A0A077Z3G5_TRITR Loading...

receptor protein-tyrosine kinase

AlphaFold DB , UniProt , Accession A0A077Z3G5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 861 aa.

						>A0A077Z3G5_TRITR|A0A077Z3G5
MNPRFRTHVRPKQEVMLGDRMKLRCEAVGKPQPYVHWYRNNELISPAKSQQRVKFNRFSMTIMRVEPGDEGLYACKVWNQIGQIWRNFTVRINDLAQWKHRMLEHGRMMAQNRNDPSEVKEFLDPEDVNFDRDWNKKGGPRLDDLPQNDGGGHAVDQQLGDWNDSNTTPAWYKQFERDNRQGFSLSSRRDFSLGAPYWSKPESEFVKVVASPAGRQQKLSCRANGEPEPQVIWYKNGVEITPEMERRLGYHIKKWSLILPDLVPSDAGTYTCKVFNKYGEISHNYTVTVVGEFSANWPQRSVVQLVCCSERVPHKPIIAPDFPKNLTVHVGENATFSCPVLSDLQPHIEWFRHKQVNGTWFDQNDYWYGDQINSDASDGSTDQDSASDPYTLVLLNVTMEQSTWYTCVVGNALGVVYKSAWLEVLPGRDAAANDSLSVAKTAQFQWKDTINVILTFLVAIIATIAFICCFIMFRFLSAQRLCRRRRMKPHPQVQCEHATTDSCNGFAPTQKLIKINRDGQYMSNGSLAPLISIVPANVPAEERSNGKDDDDDNDGDDVSDSSSEESDQEVHPMVVQKSEELSQRRTTRARYQPFSRIRSPYLFQCSDRWPAGLSSDLPSVKTSLRPISEVFELELENLHISNSKPCLADSGHSSENSSSPRESCSSDRQSSMQGSNVSVNSSHSAVSSGRGTDGSLAASKEAKKEHKPSAKRHSVPDLSDASLSSEVFTHSSQAQQHTWSGNGRDRPLGSSCNDIFSPRKVASSIAKSKLEAGGEKGKLRAIEDAMSPSQEVLDKSGKKNLNLRKKLSSSQLEEMDPKRYSEKKEDKPSTADANANGHSQVLSSAEPAYLDLLVASRESVV
					

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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	72.6	Confident	64.7	Low	96 Å²	96	80.7 Å²	80.7	47%	0.473	38%	0.38	S	S	.	.				0	113.4	0	179.2	-173.1	-179.5	0	0	109	R4 K30 N79	M1-R4 HydrophobicContact CE-CG 4.19Å; M1-K30 HydrophobicContact CB-CB 3.98Å; M1-K30 PolarHBondContact N-O 3.4Å; M1-K30 PolarHBondContact O-N 2.74Å; M1-K30 VanDerWaalsContact O-N 3.15Å; M1-K30 VanDerWaalsContact O-O 3.14Å; M1-N79 PolarHBondContact O-ND2 3.28Å
2	N	72	Confident	64.4	Low	82 Å²	82	87.5 Å²	87.5	44%	0.439	41%	0.407	S	S	.	.			trans	-53.7	143.9	171.8	-164	11.6	0	0	0	110	I81 G82	N2-I81 HydrophobicContact CB-CG2 4.16Å; N2-G82 WeakPolarHBondContact OD1-CA 3.48Å
3	P	78.2	Confident	64.7	Low	6 Å²	6	84.5 Å²	84.5	4%	0.039	39%	0.393	C	S	.	.			trans	-63.7	148.8	-179.9	-24	37.7	0	0	0	112.3	V28 P33 V77 N79 G82 I84	P3-V28 CarbonylContact C-O 3.59Å; P3-V28 WeakPolarHBondContact CA-O 3.49Å; P3-P33 HydrophobicContact CB-CB 4.06Å; P3-P33 HydrophobicContact CB-CG 4.19Å; P3-P33 HydrophobicContact CG-CB 3.79Å; P3-P33 HydrophobicContact CG-CG 4.36Å; P3-V77 HydrophobicContact CB-CG1 3.97Å; P3-N79 WeakPolarHBondContact CD-OD1 3.16Å; P3-N79 HydrophobicContact CG-CB 4.21Å; P3-G82 WeakPolarHBondContact CD-O 3.31Å; P3-I84 HydrophobicContact CB-CD1 4.04Å; P3-I84 HydrophobicContact CB-CG1 4.28Å; P3-I84 WeakPolarHBondContact O-CG2 3.26Å
4	R	73.9	Confident	65.1	Low	160 Å²	160	85.6 Å²	85.6	60%	0.604	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.2	143.9	167.3	64.9	179.5	-174.2	-173.6	1.6	109.6	M1 A27 V28	M1-R4 HydrophobicContact CE-CG 4.19Å; R4-A27 CarbonylContact O-C 3.59Å; R4-A27 WeakPolarHBondContact O-CA 3.07Å; R4-A27 VanDerWaalsContact O-CB 3.31Å; R4-A27 WeakPolarHBondContact O-CB 3.3Å; R4-V28 HydrophobicContact CG-CG2 3.72Å; R4-V28 PolarHBondContact N-O 3.23Å; R4-V28 PolarHBondContact O-N 2.74Å
5	F	79.8	Confident	65.2	Low	48 Å²	48	80.7 Å²	80.7	21%	0.211	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	143.6	171.9	-62.4	-68.7	0	0	0	110.6	C25 E26 A27 V77 I84 W85 R86	F5-C25 HydrophobicContact CE1-CB 4.13Å; F5-E26 CarbonylContact C-O 3.52Å; F5-E26 WeakPolarHBondContact CA-O 3.23Å; F5-A27 HydrophobicContact CD1-CB 4.19Å; F5-V77 HydrophobicContact CE1-CB 4.35Å; F5-V77 HydrophobicContact CE1-CG2 3.81Å; F5-I84 HydrophobicContact CD1-CD1 4.01Å; F5-I84 HydrophobicContact CD2-CD1 3.67Å; F5-I84 HydrophobicContact CD2-CG1 4.45Å; F5-I84 HydrophobicContact CE1-CD1 3.91Å; F5-I84 HydrophobicContact CE1-CG1 4.23Å; F5-I84 HydrophobicContact CE2-CB 4.2Å; F5-I84 HydrophobicContact CE2-CD1 3.56Å; F5-I84 HydrophobicContact CE2-CG1 3.84Å; F5-I84 HydrophobicContact CG-CD1 3.89Å; F5-I84 HydrophobicContact CZ-CB 4.41Å; F5-I84 HydrophobicContact CZ-CD1 3.68Å; F5-I84 HydrophobicContact CZ-CG1 3.7Å; F5-W85 WeakPolarHBondContact CE2-O 3.35Å; F5-R86 VanDerWaalsContact CB-NH2 3.3Å; F5-R86 HydrophobicContact CE1-CB 4.12Å; F5-R86 HydrophobicContact CE2-CB 3.77Å; F5-R86 HydrophobicContact CZ-CB 3.44Å; F5-R86 VanDerWaalsContact CZ-CB 3.44Å
6	R	72.3	Confident	65.2	Low	157 Å²	157	78.4 Å²	78.4	59%	0.592	37%	0.367	S	S	*	.	S	Bend	trans	-84.7	-36.7	173.2	-93	-177	162.9	174.7	0.6	112.3	E26 V28	R6-E26 HydrophobicContact CB-CB 4.32Å; R6-E26 HydrophobicContact CB-CG 4.31Å; R6-E26 WeakPolarHBondContact CD-OE1 3.03Å; R6-E26 IonicContact CZ-OE1 3.95Å; R6-E26 PolarHBondContact N-O 3.18Å; R6-E26 IonicContact NE-OE1 3.35Å; R6-E26 IonicContact NH1-OE1 2.79Å; R6-E26 PolarHBondContact NH1-OE1 3.4Å; R6-V28 HydrophobicContact CG-CG1 3.9Å; R6-V28 HydrophobicContact CG-CG2 4.23Å
7	T	51.5	Low	65.4	Low	50 Å²	50	77.9 Å²	77.9	31%	0.307	37%	0.367	S	S	.	.	S	Bend	trans	-123.1	143.1	-171.2	56.9	0	0	0	0	110.8	R86	T7-R86 VanDerWaalsContact O-CZ 3.25Å; T7-R86 PolarHBondContact O-NH1 3.46Å; T7-R86 PolarHBondContact O-NH2 2.76Å
8	H	49.5	Very low	65.6	Low	95 Å²	95	75.5 Å²	75.5	44%	0.44	37%	0.366	S	S	.	.			trans	-80.8	148.6	161.7	-62.8	-87.2	0	0	0	108.7	P201	H8-P201 VanDerWaalsContact CE1-CD 3.46Å; H8-P201 WeakPolarHBondContact CE1-CD 3.12Å
9	V	57.3	Low	65.7	Low	39 Å²	39	75.1 Å²	75.1	24%	0.236	37%	0.365	C	S	.	.			trans	-147.8	156.3	-178.2	-61.3	0	0	0	0	107.6	P11 R24 F88	V9-P11 WeakPolarHBondContact O-CD 3.49Å; V9-R24 HydrophobicContact CG1-CB 4.22Å; V9-R24 WeakPolarHBondContact CG1-O 3.21Å; V9-F88 HydrophobicContact CB-CE1 4.3Å; V9-F88 HydrophobicContact CG2-CE1 3.47Å; V9-F88 VanDerWaalsContact CG2-CE1 3.47Å; V9-F88 HydrophobicContact CG2-CZ 3.87Å
10	R	46.3	Very low	65.9	Low	63 Å²	63	75.8 Å²	75.8	24%	0.238	36%	0.364	C	S	.	.			trans	-68.1	130.3	-177.6	-50.7	-175.4	-162.6	-151.9	5.8	110.7	K12 F88 A195 Y197	R10-K12 VanDerWaalsContact C-N 3.31Å; R10-K12 WeakPolarHBondContact CB-O 3.26Å; R10-F88 WeakPolarHBondContact O-CD1 3.41Å; R10-A195 PolarHBondContact NH1-O 2.77Å; R10-A195 PolarHBondContact NH2-O 2.93Å; R10-Y197 HydrophobicContact CG-CD2 4.32Å; R10-Y197 HydrophobicContact CG-CG 4.09Å; R10-Y197 VanDerWaalsContact CZ-CD1 3.49Å
11	P	58.6	Low	66.4	Low	92 Å²	92	72.3 Å²	72.3	60%	0.597	35%	0.348	S	S	*	.	S	Bend	trans	-70.9	-26.1	169.4	-19.5	33.2	0	0	0	112.6	V9 F88 T89	V9-P11 WeakPolarHBondContact O-CD 3.49Å; P11-F88 CarbonylContact O-C 3.53Å; P11-F88 VanDerWaalsContact O-CA 3.25Å; P11-F88 WeakPolarHBondContact O-CA 3.31Å; P11-T89 PolarHBondContact O-N 2.95Å
12	K	61.3	Low	66.8	Low	162 Å²	162	70.8 Å²	70.8	70%	0.704	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	128.1	170.9	-65.7	179.6	-178.3	175.9	0	109.1	R10 T89	R10-K12 VanDerWaalsContact C-N 3.31Å; R10-K12 WeakPolarHBondContact CB-O 3.26Å; K12-T89 WeakPolarHBondContact CA-O 3.44Å
13	Q	68	Low	67.4	Low	48 Å²	48	67 Å²	67	22%	0.224	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	110.4	177.4	179.5	62.6	69	0	0	108.6	V15 M21 L23 T89 V90 R91	Q13-V15 HydrophobicContact CG-CG2 3.78Å; Q13-M21 HydrophobicContact CG-CG 4.34Å; Q13-M21 HydrophobicContact CG-SD 4.03Å; Q13-L23 HydrophobicContact CB-CD2 4.33Å; Q13-L23 HydrophobicContact CG-CD2 4.16Å; Q13-T89 PolarHBondContact N-O 3.44Å; Q13-V90 HydrophobicContact CB-CG2 4.32Å; Q13-V90 WeakPolarHBondContact O-CA 3.28Å; Q13-R91 PolarHBondContact O-N 3.08Å
14	E	70.3	Confident	67.5	Low	100 Å²	100	72.8 Å²	72.8	47%	0.467	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	140.2	170.1	-53.9	-159	-178.3	0	0	109.1	R91 N93	E14-R91 WeakPolarHBondContact CA-O 3.34Å; E14-R91 HydrophobicContact CG-CB 4.3Å; E14-N93 PolarHBondContact OE2-ND2 2.79Å
15	V	66.1	Low	67.8	Low	13 Å²	13	65.1 Å²	65.1	8%	0.079	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	144.5	-177.8	-166.5	0	0	0	0	108.9	Q13 D19 M21 V65 R91 I92 N93	Q13-V15 HydrophobicContact CG-CG2 3.78Å; V15-D19 HydrophobicContact CG1-CB 3.7Å; V15-M21 HydrophobicContact CG1-CB 4.31Å; V15-M21 HydrophobicContact CG2-CB 4.02Å; V15-M21 HydrophobicContact CG2-CG 3.97Å; V15-M21 HydrophobicContact CG2-SD 3.9Å; V15-V65 HydrophobicContact CG1-CB 4.39Å; V15-V65 HydrophobicContact CG1-CG2 4Å; V15-R91 PolarHBondContact N-O 3.36Å; V15-R91 VanDerWaalsContact N-O 3.12Å; V15-I92 WeakPolarHBondContact O-CA 3.41Å; V15-N93 PolarHBondContact O-N 2.81Å
16	M	65	Low	67.9	Low	44 Å²	44	66.1 Å²	66.1	22%	0.217	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	155.3	176.4	-51.6	-53.8	-63.1	0	0	111.5	G18 D19 N93 L95 W98	M16-G18 PolarHBondContact O-N 3.26Å; M16-D19 HydrophobicContact CB-CB 4.37Å; M16-D19 WeakPolarHBondContact CB-OD2 3.46Å; M16-D19 WeakPolarHBondContact O-CB 2.9Å; M16-D19 PolarHBondContact O-N 2.6Å; M16-N93 CarbonylContact C-O 3.5Å; M16-N93 VanDerWaalsContact CA-O 3.24Å; M16-N93 WeakPolarHBondContact CA-O 3.15Å; M16-N93 HydrophobicContact CE-CB 3.86Å; M16-N93 WeakPolarHBondContact CE-O 3.47Å; M16-N93 HydrophobicContact SD-CB 3.65Å; M16-L95 VanDerWaalsContact CE-CA 3.5Å; M16-L95 HydrophobicContact CE-CB 3.97Å; M16-L95 HydrophobicContact CE-CD1 4.13Å; M16-W98 HydrophobicContact CE-CB 4.04Å; M16-W98 HydrophobicContact CE-CG 4.42Å
17	L	68.5	Low	68.4	Low	70 Å²	70	58.7 Å²	58.7	37%	0.366	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	132.9	167	-74.8	173.1	0	0	0	110.8	D19 P67 I92 N93 D94	L17-D19 VanDerWaalsContact C-N 3.32Å; L17-D19 PolarHBondContact O-N 2.77Å; L17-P67 HydrophobicContact CD1-CG 4.47Å; L17-P67 HydrophobicContact CD2-CB 4.15Å; L17-P67 HydrophobicContact CD2-CG 3.58Å; L17-I92 HydrophobicContact CD2-CG2 3.37Å; L17-I92 HydrophobicContact CG-CG2 3.74Å; L17-N93 PolarHBondContact N-O 2.69Å; L17-D94 HydrophobicContact CD1-CB 3.88Å
18	G	68.9	Low	69.9	Low	34 Å²	34	57.9 Å²	57.9	35%	0.351	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	-21	-178	0	0	0	0	0	115.5	M16 V65	M16-G18 PolarHBondContact O-N 3.26Å; G18-V65 PolarHBondContact N-O 3.19Å
19	D	68.3	Low	71.5	Confident	67 Å²	67	53.8 Å²	53.8	36%	0.358	27%	0.266	S	S	.	.			trans	-70.5	172.4	-176	-91.5	-9.9	0	0	0	113.8	V15 M16 L17 R64 V65	V15-D19 HydrophobicContact CG1-CB 3.7Å; M16-D19 HydrophobicContact CB-CB 4.37Å; M16-D19 WeakPolarHBondContact CB-OD2 3.46Å; M16-D19 WeakPolarHBondContact O-CB 2.9Å; M16-D19 PolarHBondContact O-N 2.6Å; L17-D19 VanDerWaalsContact C-N 3.32Å; L17-D19 PolarHBondContact O-N 2.77Å; D19-R64 CarbonylContact O-C 3.45Å; D19-R64 WeakPolarHBondContact O-CA 3.15Å; D19-V65 WeakPolarHBondContact O-CB 3.33Å; D19-V65 WeakPolarHBondContact O-CG2 3.23Å; D19-V65 PolarHBondContact O-N 2.76Å
20	R	69.3	Low	72.6	Confident	89 Å²	89	59.5 Å²	59.5	34%	0.336	29%	0.288	S	S	.	.			trans	-101.6	107.2	176.1	176	174.5	157.6	-78.5	14.2	112.1	T61 I62 M63 D190	R20-T61 HydrophobicContact CG-CG2 3.87Å; R20-I62 CarbonylContact C-O 3.58Å; R20-I62 WeakPolarHBondContact CA-O 3.38Å; R20-I62 WeakPolarHBondContact CG-O 3.31Å; R20-M63 HydrophobicContact CG-SD 4.47Å; R20-D190 IonicContact CZ-OD1 2.65Å; R20-D190 IonicContact CZ-OD2 3.48Å; R20-D190 IonicContact NH1-OD1 3.22Å; R20-D190 PolarHBondContact NH1-OD1 3.45Å; R20-D190 IonicContact NH1-OD2 2.68Å; R20-D190 PolarHBondContact NH1-OD2 3.35Å; R20-D190 IonicContact NH2-OD1 3.54Å; R20-D190 IonicContact NH2-OD2 3.3Å; R20-D190 PolarHBondContact NH2-OD2 2.7Å
21	M	76.7	Confident	74.7	Confident	4 Å²	4	59.2 Å²	59.2	2%	0.02	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	144.3	173.2	-179.1	168.9	55	0	0	112.3	Q13 V15 L23 T61 I62 V65 Y73 V90	Q13-M21 HydrophobicContact CG-CG 4.34Å; Q13-M21 HydrophobicContact CG-SD 4.03Å; V15-M21 HydrophobicContact CG1-CB 4.31Å; V15-M21 HydrophobicContact CG2-CB 4.02Å; V15-M21 HydrophobicContact CG2-CG 3.97Å; V15-M21 HydrophobicContact CG2-SD 3.9Å; M21-L23 HydrophobicContact CG-CD2 4.16Å; M21-L23 HydrophobicContact CG-CG 4.39Å; M21-L23 HydrophobicContact SD-CD2 3.9Å; M21-L23 HydrophobicContact SD-CG 4.25Å; M21-T61 CarbonylContact O-C 3.41Å; M21-T61 VanDerWaalsContact O-CA 3.29Å; M21-T61 WeakPolarHBondContact O-CA 3.39Å; M21-T61 WeakPolarHBondContact O-CG2 3.27Å; M21-I62 HydrophobicContact CB-CB 4.33Å; M21-I62 HydrophobicContact CE-CB 4.44Å; M21-I62 HydrophobicContact CE-CD1 3.54Å; M21-I62 HydrophobicContact CE-CG1 3.94Å; M21-I62 PolarHBondContact N-O 3.29Å; M21-I62 PolarHBondContact O-N 2.74Å; M21-V65 HydrophobicContact CB-CG2 3.73Å; M21-Y73 HydrophobicContact CE-CE2 4.33Å; M21-V90 HydrophobicContact CE-CG1 3.9Å; M21-V90 HydrophobicContact CE-CG2 3.99Å; M21-V90 HydrophobicContact SD-CB 4.19Å; M21-V90 HydrophobicContact SD-CG1 3.58Å; M21-V90 VanDerWaalsContact SD-CG1 3.58Å; M21-V90 HydrophobicContact SD-CG2 3.45Å; M21-V90 WeakPolarHBondContact SD-CG2 3.36Å
22	K	80.9	Confident	75.9	Confident	63 Å²	63	59.1 Å²	59.1	27%	0.274	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	103.7	170.4	-178	171.2	177.7	178.2	0	113.4	R24 S59 M60 T61	K22-R24 HydrophobicContact CG-CG 4.32Å; K22-S59 WeakPolarHBondContact CE-OG 3.43Å; K22-M60 CarbonylContact C-O 3.06Å; K22-M60 WeakPolarHBondContact CA-O 3.44Å; K22-T61 HydrophobicContact CB-CG2 4.35Å
23	L	84.7	Confident	77.1	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.016	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	138.6	174.2	-54.1	-176.6	0	0	0	110.3	Q13 M21 W37 S59 M60 Y73 F88 V90	Q13-L23 HydrophobicContact CB-CD2 4.33Å; Q13-L23 HydrophobicContact CG-CD2 4.16Å; M21-L23 HydrophobicContact CG-CD2 4.16Å; M21-L23 HydrophobicContact CG-CG 4.39Å; M21-L23 HydrophobicContact SD-CD2 3.9Å; M21-L23 HydrophobicContact SD-CG 4.25Å; L23-W37 HydrophobicContact CB-CE3 4.49Å; L23-W37 HydrophobicContact CB-CH2 3.58Å; L23-W37 HydrophobicContact CB-CZ3 3.47Å; L23-W37 VanDerWaalsContact CB-CZ3 3.47Å; L23-W37 HydrophobicContact CD1-CZ3 3.99Å; L23-W37 HydrophobicContact CG-CZ3 4.39Å; L23-S59 CarbonylContact O-C 3.46Å; L23-S59 WeakPolarHBondContact O-CA 3.46Å; L23-S59 WeakPolarHBondContact O-CB 3.45Å; L23-M60 HydrophobicContact CD1-CE 4.1Å; L23-M60 PolarHBondContact N-O 2.83Å; L23-M60 PolarHBondContact O-N 2.86Å; L23-M60 VanDerWaalsContact O-N 3.13Å; L23-Y73 HydrophobicContact CD1-CD1 4.06Å; L23-Y73 HydrophobicContact CD1-CD2 4.31Å; L23-Y73 HydrophobicContact CD1-CG 3.76Å; L23-F88 HydrophobicContact CB-CE1 4.38Å; L23-F88 HydrophobicContact CB-CZ 4.37Å; L23-F88 HydrophobicContact CD1-CB 4.26Å; L23-F88 HydrophobicContact CD1-CD2 4.21Å; L23-F88 HydrophobicContact CD1-CG 4.17Å; L23-F88 HydrophobicContact CD2-CB 4.33Å; L23-F88 HydrophobicContact CD2-CD1 3.91Å; L23-F88 HydrophobicContact CD2-CE1 4.39Å; L23-F88 HydrophobicContact CD2-CG 4.15Å; L23-V90 HydrophobicContact CD1-CG2 4.34Å; L23-V90 HydrophobicContact CD2-CG2 4.26Å
24	R	80.6	Confident	78.1	Confident	127 Å²	127	56.9 Å²	56.9	48%	0.479	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132.9	-174.8	-52.9	-175.8	-167.7	-167.2	5.3	112.3	V9 K22	V9-R24 HydrophobicContact CG1-CB 4.22Å; V9-R24 WeakPolarHBondContact CG1-O 3.21Å; K22-R24 HydrophobicContact CG-CG 4.32Å
25	C	80.4	Confident	79	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.258	C	S	.	.			trans	-135.6	45.7	-179.1	-70.1	0	0	0	0	112	F5 A27 W37 F58 C75 V77 F88	F5-C25 HydrophobicContact CE1-CB 4.13Å; C25-A27 PolarHBondContact O-N 2.8Å; C25-W37 HydrophobicContact CB-CH2 4.08Å; C25-W37 HydrophobicContact CB-CZ2 4.01Å; C25-W37 WeakPolarHBondContact SG-CH2 3.49Å; C25-F58 PolarHBondContact N-O 3.32Å; C25-F58 VanDerWaalsContact O-CD1 3.28Å; C25-F58 WeakPolarHBondContact O-CD1 3.42Å; C25-C75 HydrophobicContact CB-CB 3.78Å; C25-C75 WeakPolarHBondContact CB-SG 3.08Å; C25-C75 WeakPolarHBondContact SG-CB 3.25Å; C25-C75 CovalentContact SG-SG 2.01Å; C25-C75 PolarHBondContact SG-SG 2.82Å; C25-V77 HydrophobicContact CB-CG2 4.39Å; C25-F88 WeakPolarHBondContact SG-CE2 3.39Å; C25-F88 WeakPolarHBondContact SG-CZ 3.17Å
26	E	82.1	Confident	80.1	Confident	68 Å²	68	56.5 Å²	56.5	32%	0.318	27%	0.271	S	S	.	.			trans	-61.6	133.6	-178.2	-158.6	-174.8	148.9	0	0	111.2	F5 R6 F58	F5-E26 CarbonylContact C-O 3.52Å; F5-E26 WeakPolarHBondContact CA-O 3.23Å; R6-E26 HydrophobicContact CB-CB 4.32Å; R6-E26 HydrophobicContact CB-CG 4.31Å; R6-E26 WeakPolarHBondContact CD-OE1 3.03Å; R6-E26 IonicContact CZ-OE1 3.95Å; R6-E26 PolarHBondContact N-O 3.18Å; R6-E26 IonicContact NE-OE1 3.35Å; R6-E26 IonicContact NH1-OE1 2.79Å; R6-E26 PolarHBondContact NH1-OE1 3.4Å; E26-F58 HydrophobicContact CB-CB 4.19Å; E26-F58 HydrophobicContact CG-CB 4.32Å; E26-F58 HydrophobicContact CG-CD2 3.89Å; E26-F58 HydrophobicContact CG-CG 4.34Å
27	A	81.9	Confident	81.3	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.008	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	157.6	-172.7	0	0	0	0	0	112.2	R4 F5 C25 F58 V77	R4-A27 CarbonylContact O-C 3.59Å; R4-A27 WeakPolarHBondContact O-CA 3.07Å; R4-A27 VanDerWaalsContact O-CB 3.31Å; R4-A27 WeakPolarHBondContact O-CB 3.3Å; F5-A27 HydrophobicContact CD1-CB 4.19Å; C25-A27 PolarHBondContact O-N 2.8Å; A27-F58 HydrophobicContact CB-CE1 4.04Å; A27-F58 HydrophobicContact CB-CZ 4.31Å; A27-F58 WeakPolarHBondContact O-CE2 3.16Å; A27-F58 VanDerWaalsContact O-CZ 3.26Å; A27-F58 WeakPolarHBondContact O-CZ 3.44Å; A27-V77 HydrophobicContact CB-CG1 3.66Å; A27-V77 HydrophobicContact CB-CG2 4.4Å
28	V	83.8	Confident	82.2	Confident	33 Å²	33	53.2 Å²	53.2	20%	0.2	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	146.1	172.7	-73.8	0	0	0	0	110.7	P3 R4 R6	P3-V28 CarbonylContact C-O 3.59Å; P3-V28 WeakPolarHBondContact CA-O 3.49Å; R4-V28 HydrophobicContact CG-CG2 3.72Å; R4-V28 PolarHBondContact N-O 3.23Å; R4-V28 PolarHBondContact O-N 2.74Å; R6-V28 HydrophobicContact CG-CG1 3.9Å; R6-V28 HydrophobicContact CG-CG2 4.23Å
29	G	83.1	Confident	83.2	Confident	10 Å²	10	54.6 Å²	54.6	10%	0.103	25%	0.247	C	C	.	.			trans	-160.8	171	172.7	0	0	0	0	0	109.1	P31	G29-P31 CarbonylContact C-O 3.58Å; G29-P31 CarbonylContact O-C 3.56Å
30	K	80.8	Confident	84	Confident	159 Å²	159	55.7 Å²	55.7	69%	0.691	25%	0.252	S	S	*	.	S	Bend	trans	-132.5	111.9	169	-65	-171.4	176.6	-174.4	0	107.9	M1	M1-K30 HydrophobicContact CB-CB 3.98Å; M1-K30 PolarHBondContact N-O 3.4Å; M1-K30 PolarHBondContact O-N 2.74Å; M1-K30 VanDerWaalsContact O-N 3.15Å; M1-K30 VanDerWaalsContact O-O 3.14Å
31	P	89.1	Confident	84.6	Confident	56 Å²	56	57.9 Å²	57.9	36%	0.364	27%	0.271	S	S	.	.	S	Bend	cis	-62	166.3	0.6	-22	34.3	0	0	0	114.9	G29 P33 N79 Q80	G29-P31 CarbonylContact C-O 3.58Å; G29-P31 CarbonylContact O-C 3.56Å; P31-P33 WeakPolarHBondContact O-CD 3.23Å; P31-N79 PolarHBondContact O-ND2 3.45Å; P31-Q80 HydrophobicContact CG-CG 4.04Å
32	Q	84.4	Confident	85	Confident	91 Å²	91	65 Å²	65	43%	0.425	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-53.7	121.4	175.1	169.3	58.9	56.7	0	0	110.1	F58	Q32-F58 VanDerWaalsContact NE2-CZ 3.34Å
33	P	87	Confident	85.2	Confident	4 Å²	4	65.7 Å²	65.7	3%	0.026	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-79.6	154.5	-176.4	29.4	-34	0	0	0	113.6	P3 P31 F58 V77 W78 N79	P3-P33 HydrophobicContact CB-CB 4.06Å; P3-P33 HydrophobicContact CB-CG 4.19Å; P3-P33 HydrophobicContact CG-CB 3.79Å; P3-P33 HydrophobicContact CG-CG 4.36Å; P31-P33 WeakPolarHBondContact O-CD 3.23Å; P33-F58 HydrophobicContact CG-CE1 4.49Å; P33-F58 HydrophobicContact CG-CZ 4.14Å; P33-V77 HydrophobicContact CB-CG1 3.74Å; P33-V77 HydrophobicContact CG-CG1 4.06Å; P33-W78 CarbonylContact C-O 3.58Å; P33-W78 WeakPolarHBondContact CA-O 3.21Å; P33-W78 VanDerWaalsContact CB-O 3.23Å; P33-W78 WeakPolarHBondContact CB-O 3.39Å; P33-N79 HydrophobicContact CB-CB 4.23Å
34	Y	88.3	Confident	85.2	Confident	158 Å²	158	67.3 Å²	67.3	62%	0.62	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	162.6	172.8	-58	-85.4	0	0	0	110.5	V77 W78	Y34-V77 CarbonylContact O-C 3.54Å; Y34-V77 VanDerWaalsContact O-CA 3.27Å; Y34-V77 WeakPolarHBondContact O-CA 3.4Å; Y34-W78 HydrophobicContact CD2-CZ2 4.4Å; Y34-W78 PolarHBondContact N-O 3.43Å; Y34-W78 PolarHBondContact O-N 2.8Å
35	V	89.2	Confident	84.7	Confident	27 Å²	27	63.3 Å²	63.3	16%	0.164	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	132.6	174.2	69.1	0	0	0	0	111.6	R57 F58 C75 K76 V77	V35-R57 WeakPolarHBondContact CG1-O 3.33Å; V35-F58 HydrophobicContact CB-CD1 4.26Å; V35-F58 HydrophobicContact CG1-CD1 4.34Å; V35-C75 HydrophobicContact CG2-CB 3.94Å; V35-K76 WeakPolarHBondContact CA-O 3.12Å; V35-V77 HydrophobicContact CB-CG2 4.06Å; V35-V77 HydrophobicContact CG2-CG2 3.72Å
36	H	89.1	Confident	84.1	Confident	78 Å²	78	67.9 Å²	67.9	36%	0.361	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	143.8	164.6	-75.6	-169.6	0	0	0	109.3	Y38 L43 C75 K76	H36-Y38 HydrophobicContact CB-CE2 3.81Å; H36-L43 HydrophobicContact CB-CD1 3.8Å; H36-C75 CarbonylContact O-C 3.44Å; H36-C75 WeakPolarHBondContact O-CA 3.19Å; H36-K76 HydrophobicContact CB-CB 4.45Å; H36-K76 PolarHBondContact N-O 2.69Å; H36-K76 PolarHBondContact O-N 3.02Å
37	W	90.1	Very high	83	Confident	6 Å²	6	69.6 Å²	69.6	2%	0.023	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	139.3	176.9	-70.6	87.9	0	0	0	110.6	L23 C25 I44 F55 M60 A74 C75 F88	L23-W37 HydrophobicContact CB-CE3 4.49Å; L23-W37 HydrophobicContact CB-CH2 3.58Å; L23-W37 HydrophobicContact CB-CZ3 3.47Å; L23-W37 VanDerWaalsContact CB-CZ3 3.47Å; L23-W37 HydrophobicContact CD1-CZ3 3.99Å; L23-W37 HydrophobicContact CG-CZ3 4.39Å; C25-W37 HydrophobicContact CB-CH2 4.08Å; C25-W37 HydrophobicContact CB-CZ2 4.01Å; C25-W37 WeakPolarHBondContact SG-CH2 3.49Å; W37-I44 HydrophobicContact CB-CB 4.49Å; W37-I44 HydrophobicContact CB-CD1 4.12Å; W37-I44 PolarHBondContact O-N 2.7Å; W37-F55 HydrophobicContact CB-CE1 3.87Å; W37-F55 AromaticContact CD1-CD1 3.69Å; W37-F55 AromaticContact CD1-CE1 3.61Å; W37-F55 HydrophobicContact CG-CD1 4.33Å; W37-F55 AromaticContact CG-CE1 3.84Å; W37-F55 HydrophobicContact CG-CE1 3.84Å; W37-M60 HydrophobicContact CB-SD 4.35Å; W37-M60 HydrophobicContact CD2-CB 3.78Å; W37-M60 HydrophobicContact CE3-CB 4.16Å; W37-M60 HydrophobicContact CE3-CE 4.36Å; W37-M60 HydrophobicContact CG-CB 4.1Å; W37-M60 HydrophobicContact CZ2-CB 4.31Å; W37-A74 CarbonylContact C-O 3.59Å; W37-A74 WeakPolarHBondContact CA-O 3.33Å; W37-C75 HydrophobicContact CD2-CB 4.04Å; W37-C75 HydrophobicContact CE3-CB 3.86Å; W37-C75 HydrophobicContact CH2-CB 3.97Å; W37-C75 HydrophobicContact CZ2-CB 4.12Å; W37-C75 HydrophobicContact CZ3-CB 3.83Å; W37-F88 HydrophobicContact CH2-CE2 4.09Å; W37-F88 HydrophobicContact CH2-CZ 4.27Å; W37-F88 HydrophobicContact CZ3-CD2 4.26Å; W37-F88 AromaticContact CZ3-CE2 3.71Å; W37-F88 HydrophobicContact CZ3-CE2 3.71Å; W37-F88 HydrophobicContact CZ3-CZ 4.31Å
38	Y	88.3	Confident	81.8	Confident	39 Å²	39	78.2 Å²	78.2	15%	0.153	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	151.6	-179.6	-63	-100.1	0	0	0	109.9	H36 N41 E42 L43 Y73 A74 K76 W85	H36-Y38 HydrophobicContact CB-CE2 3.81Å; Y38-N41 WeakPolarHBondContact CD1-O 3.31Å; Y38-E42 CarbonylContact C-O 3.54Å; Y38-E42 WeakPolarHBondContact CA-O 3.12Å; Y38-E42 WeakPolarHBondContact CB-O 3.21Å; Y38-L43 HydrophobicContact CD1-CB 4.19Å; Y38-L43 HydrophobicContact CD1-CD1 4.32Å; Y38-L43 HydrophobicContact CE1-CB 3.99Å; Y38-L43 HydrophobicContact CE1-CD1 3.89Å; Y38-L43 HydrophobicContact CE2-CD1 4.07Å; Y38-Y73 CarbonylContact O-C 3.56Å; Y38-Y73 WeakPolarHBondContact O-CA 3.28Å; Y38-A74 PolarHBondContact N-O 2.93Å; Y38-A74 PolarHBondContact O-N 2.81Å; Y38-K76 HydrophobicContact CD2-CB 4.41Å; Y38-K76 HydrophobicContact CE2-CB 3.72Å; Y38-K76 HydrophobicContact CE2-CD 4.39Å; Y38-W85 AromaticContact CD2-CZ3 3.94Å; Y38-W85 HydrophobicContact CD2-CZ3 3.94Å; Y38-W85 HydrophobicContact CE2-CH2 4.07Å; Y38-W85 AromaticContact CE2-CZ3 3.87Å; Y38-W85 HydrophobicContact CE2-CZ3 3.87Å
39	R	89.1	Confident	80.6	Confident	64 Å²	64	78.1 Å²	78.1	24%	0.242	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	128.4	168.6	-177.3	-173.7	176.4	-154.8	-12.3	108.3	N41 E42 I44 G68 D69 E70 L72 Y73	R39-N41 PolarHBondContact O-N 2.79Å; R39-E42 PolarHBondContact N-O 3.36Å; R39-E42 WeakPolarHBondContact O-CB 3.39Å; R39-E42 PolarHBondContact O-N 3.45Å; R39-I44 HydrophobicContact CB-CD1 3.81Å; R39-I44 HydrophobicContact CB-CG1 3.89Å; R39-G68 PolarHBondContact NH1-O 3.32Å; R39-G68 PolarHBondContact NH2-O 2.79Å; R39-D69 PolarHBondContact NE-O 2.81Å; R39-D69 PolarHBondContact NH2-O 3.4Å; R39-E70 PolarHBondContact NH2-O 3.06Å; R39-L72 CarbonylContact C-O 3.53Å; R39-L72 WeakPolarHBondContact CA-O 3.05Å; R39-Y73 HydrophobicContact CB-CD1 3.8Å; R39-Y73 HydrophobicContact CB-CE1 3.76Å; R39-Y73 HydrophobicContact CB-CG 4.44Å; R39-Y73 HydrophobicContact CG-CD1 4Å; R39-Y73 HydrophobicContact CG-CD2 4.38Å; R39-Y73 HydrophobicContact CG-CE1 3.7Å; R39-Y73 HydrophobicContact CG-CE2 4.11Å; R39-Y73 HydrophobicContact CG-CG 4.35Å
40	N	84.9	Confident	79.4	Confident	89 Å²	89	84 Å²	84	48%	0.476	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	42.6	-176.8	-58.2	-15.7	0	0	0	111.6	E42 G71 L72	N40-E42 PolarHBondContact O-N 3.27Å; N40-G71 WeakPolarHBondContact OD1-CA 3.29Å; N40-L72 PolarHBondContact N-O 3.47Å; N40-L72 PolarHBondContact OD1-N 3.37Å
41	N	81.1	Confident	78.6	Confident	136 Å²	136	85.3 Å²	85.3	73%	0.727	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	-7.2	-172.9	-56.5	-25.5	0	0	0	117.2	Y38 R39	Y38-N41 WeakPolarHBondContact CD1-O 3.31Å; R39-N41 PolarHBondContact O-N 2.79Å
42	E	85.4	Confident	78.3	Confident	153 Å²	153	84.6 Å²	84.6	72%	0.715	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	142.3	173.3	-59.2	-167.7	153.8	0	0	112.2	Y38 R39 N40 I44	Y38-E42 CarbonylContact C-O 3.54Å; Y38-E42 WeakPolarHBondContact CA-O 3.12Å; Y38-E42 WeakPolarHBondContact CB-O 3.21Å; R39-E42 PolarHBondContact N-O 3.36Å; R39-E42 WeakPolarHBondContact O-CB 3.39Å; R39-E42 PolarHBondContact O-N 3.45Å; N40-E42 PolarHBondContact O-N 3.27Å; E42-I44 PolarHBondContact O-N 2.8Å
43	L	86.3	Confident	78.2	Confident	78 Å²	78	81.4 Å²	81.4	41%	0.408	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	115.6	177.6	-179.3	72.5	0	0	0	110.8	H36 Y38 S45	H36-L43 HydrophobicContact CB-CD1 3.8Å; Y38-L43 HydrophobicContact CD1-CB 4.19Å; Y38-L43 HydrophobicContact CD1-CD1 4.32Å; Y38-L43 HydrophobicContact CE1-CB 3.99Å; Y38-L43 HydrophobicContact CE1-CD1 3.89Å; Y38-L43 HydrophobicContact CE2-CD1 4.07Å; L43-S45 VanDerWaalsContact C-N 3.32Å; L43-S45 PolarHBondContact O-N 2.74Å; L43-S45 PolarHBondContact O-OG 3.46Å
44	I	85.4	Confident	77.8	Confident	36 Å²	36	86.7 Å²	86.7	19%	0.185	44%	0.436	C	S	.	.			trans	-71.8	90.5	177.2	-45	173.8	0	0	0	108.5	W37 R39 E42 P46 F55 M60 Y73	W37-I44 HydrophobicContact CB-CB 4.49Å; W37-I44 HydrophobicContact CB-CD1 4.12Å; W37-I44 PolarHBondContact O-N 2.7Å; R39-I44 HydrophobicContact CB-CD1 3.81Å; R39-I44 HydrophobicContact CB-CG1 3.89Å; E42-I44 PolarHBondContact O-N 2.8Å; I44-P46 WeakPolarHBondContact O-CD 3.36Å; I44-F55 HydrophobicContact CB-CZ 4.21Å; I44-F55 HydrophobicContact CG2-CZ 3.82Å; I44-M60 HydrophobicContact CD1-CE 3.74Å; I44-M60 HydrophobicContact CD1-SD 3.53Å; I44-M60 VanDerWaalsContact CD1-SD 3.53Å; I44-M60 HydrophobicContact CG2-SD 4.31Å; I44-Y73 HydrophobicContact CD1-CD1 3.75Å; I44-Y73 HydrophobicContact CD1-CE1 3.8Å
45	S	68.7	Low	77.6	Confident	44 Å²	44	82.4 Å²	82.4	31%	0.308	42%	0.421	S	S	.	.			trans	-68.4	118.8	-171.6	-65.9	0	0	0	0	111	L43 A47 K48 S49	L43-S45 VanDerWaalsContact C-N 3.32Å; L43-S45 PolarHBondContact O-N 2.74Å; L43-S45 PolarHBondContact O-OG 3.46Å; S45-A47 PolarHBondContact O-N 3.5Å; S45-K48 CarbonylContact O-C 3.4Å; S45-K48 PolarHBondContact O-N 2.79Å; S45-S49 PolarHBondContact O-N 3.41Å
46	P	67.4	Low	77.1	Confident	95 Å²	95	86.4 Å²	86.4	62%	0.617	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-27.3	-179.8	-27.7	36.8	0	0	0	114.1	I44 S49 F55	I44-P46 WeakPolarHBondContact O-CD 3.36Å; P46-S49 VanDerWaalsContact O-CB 3.27Å; P46-S49 WeakPolarHBondContact O-CB 3.43Å; P46-F55 HydrophobicContact CB-CD2 4.1Å; P46-F55 HydrophobicContact CB-CE2 4.23Å; P46-F55 HydrophobicContact CG-CD2 4.24Å; P46-F55 HydrophobicContact CG-CE2 4.22Å
47	A	59.6	Low	76.7	Confident	105 Å²	105	90.9 Å²	90.9	87%	0.868	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-18	175.8	0	0	0	0	0	114.9	S45	S45-A47 PolarHBondContact O-N 3.5Å
48	K	57.8	Low	76.3	Confident	182 Å²	182	91.7 Å²	91.7	79%	0.791	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-1.1	172.1	-64.2	-174.1	175.9	-177.4	0	112.5	S45 Q50	S45-K48 CarbonylContact O-C 3.4Å; S45-K48 PolarHBondContact O-N 2.79Å; K48-Q50 PolarHBondContact O-N 2.8Å
49	S	58.2	Low	76.2	Confident	30 Å²	30	90.4 Å²	90.4	21%	0.21	46%	0.455	C	S	.	.			trans	-65.7	97	176.4	-171.3	0	0	0	0	109.9	S45 P46 V53	S45-S49 PolarHBondContact O-N 3.41Å; P46-S49 VanDerWaalsContact O-CB 3.27Å; P46-S49 WeakPolarHBondContact O-CB 3.43Å; S49-V53 WeakPolarHBondContact OG-CB 3.2Å; S49-V53 PolarHBondContact OG-O 2.84Å
50	Q	57	Low	76.1	Confident	135 Å²	135	87.4 Å²	87.4	63%	0.631	44%	0.444	S	S	*	.			trans	-49	153.8	170.6	-64.6	170.2	-21.3	0	0	110.4	K48 R52 V53	K48-Q50 PolarHBondContact O-N 2.8Å; Q50-R52 PolarHBondContact O-N 2.8Å; Q50-V53 PolarHBondContact O-N 3.17Å
51	Q	64.2	Low	76.1	Confident	186 Å²	186	83.8 Å²	83.8	87%	0.869	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-20.9	-175.8	-65.3	178.5	-12	0	0	114.8	V53	Q51-V53 VanDerWaalsContact C-N 3.32Å; Q51-V53 PolarHBondContact O-N 3.41Å
52	R	82.2	Confident	76.2	Confident	41 Å²	41	77.5 Å²	77.5	16%	0.155	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-27.8	173	-163.7	165.3	69.9	69.8	-8.2	113.6	Q50 I62 M63 R64 E66 D69	Q50-R52 PolarHBondContact O-N 2.8Å; R52-I62 HydrophobicContact CG-CG2 4.41Å; R52-M63 WeakPolarHBondContact O-CB 3.25Å; R52-M63 WeakPolarHBondContact O-CG 3.49Å; R52-M63 PolarHBondContact O-N 2.72Å; R52-R64 VanDerWaalsContact CD-O 3.26Å; R52-R64 WeakPolarHBondContact CD-O 3.39Å; R52-R64 HydrophobicContact CG-CB 4.42Å; R52-R64 WeakPolarHBondContact CG-O 3.28Å; R52-R64 PolarHBondContact NH1-O 2.79Å; R52-E66 WeakPolarHBondContact CD-OE1 3.44Å; R52-E66 IonicContact CZ-OE1 3.72Å; R52-E66 IonicContact CZ-OE2 2.72Å; R52-E66 IonicContact NE-OE1 3.6Å; R52-E66 PolarHBondContact NE-OE1 2.94Å; R52-E66 IonicContact NE-OE2 2.71Å; R52-E66 PolarHBondContact NE-OE2 2.94Å; R52-E66 VanDerWaalsContact NE-OE2 3.09Å; R52-E66 IonicContact NH2-OE2 3.9Å; R52-E66 PolarHBondContact NH2-OE2 2.84Å; R52-D69 IonicContact CZ-OD1 2.71Å; R52-D69 IonicContact CZ-OD2 2.67Å; R52-D69 VanDerWaalsContact NH1-CG 3.34Å; R52-D69 IonicContact NH1-OD1 3.49Å; R52-D69 PolarHBondContact NH1-OD1 2.86Å; R52-D69 IonicContact NH1-OD2 3.97Å; R52-D69 PolarHBondContact NH1-OD2 3.43Å; R52-D69 IonicContact NH2-OD1 3.62Å; R52-D69 PolarHBondContact NH2-OD1 2.86Å; R52-D69 IonicContact NH2-OD2 3.67Å; R52-D69 PolarHBondContact NH2-OD2 2.79Å
53	V	83	Confident	75.7	Confident	23 Å²	23	73.9 Å²	73.9	14%	0.139	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132.5	-178.5	-177.8	0	0	0	0	110.9	S49 Q50 Q51 F55 M60 T61 I62	S49-V53 WeakPolarHBondContact OG-CB 3.2Å; S49-V53 PolarHBondContact OG-O 2.84Å; Q50-V53 PolarHBondContact O-N 3.17Å; Q51-V53 VanDerWaalsContact C-N 3.32Å; Q51-V53 PolarHBondContact O-N 3.41Å; V53-F55 HydrophobicContact CG1-CE2 4.28Å; V53-F55 HydrophobicContact CG1-CZ 4.27Å; V53-M60 HydrophobicContact CG1-CG 3.77Å; V53-M60 HydrophobicContact CG1-SD 3.87Å; V53-T61 CarbonylContact C-O 3.57Å; V53-T61 WeakPolarHBondContact CA-O 3.17Å; V53-I62 HydrophobicContact CG1-CG1 4.49Å; V53-I62 HydrophobicContact CG2-CD1 4.27Å; V53-I62 HydrophobicContact CG2-CG1 4.03Å; V53-I62 HydrophobicContact CG2-CG2 4.3Å
54	K	79.6	Confident	75.2	Confident	116 Å²	116	78 Å²	78	50%	0.504	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	131.3	-173.8	-62.8	-176	179.7	179.8	0	111.5	T61 M63	K54-T61 PolarHBondContact N-O 3.31Å; K54-T61 PolarHBondContact O-N 3.32Å; K54-M63 HydrophobicContact CD-CG 4.07Å; K54-M63 HydrophobicContact CD-SD 4.09Å; K54-M63 HydrophobicContact CG-CG 4.4Å
55	F	83	Confident	74.7	Confident	67 Å²	67	76.4 Å²	76.4	29%	0.294	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	147.5	176.7	-64.3	-79.7	0	0	0	112.2	W37 I44 P46 V53 M60	W37-F55 HydrophobicContact CB-CE1 3.87Å; W37-F55 AromaticContact CD1-CD1 3.69Å; W37-F55 AromaticContact CD1-CE1 3.61Å; W37-F55 HydrophobicContact CG-CD1 4.33Å; W37-F55 AromaticContact CG-CE1 3.84Å; W37-F55 HydrophobicContact CG-CE1 3.84Å; I44-F55 HydrophobicContact CB-CZ 4.21Å; I44-F55 HydrophobicContact CG2-CZ 3.82Å; P46-F55 HydrophobicContact CB-CD2 4.1Å; P46-F55 HydrophobicContact CB-CE2 4.23Å; P46-F55 HydrophobicContact CG-CD2 4.24Å; P46-F55 HydrophobicContact CG-CE2 4.22Å; V53-F55 HydrophobicContact CG1-CE2 4.28Å; V53-F55 HydrophobicContact CG1-CZ 4.27Å; F55-M60 HydrophobicContact CD1-CB 3.93Å; F55-M60 HydrophobicContact CD1-CG 3.92Å; F55-M60 HydrophobicContact CE1-CB 3.8Å; F55-M60 HydrophobicContact CE1-CG 3.49Å; F55-M60 VanDerWaalsContact CE1-CG 3.49Å; F55-M60 HydrophobicContact CE1-SD 3.53Å; F55-M60 VanDerWaalsContact CE1-SD 3.53Å; F55-M60 HydrophobicContact CZ-CG 4.04Å; F55-M60 HydrophobicContact CZ-SD 3.76Å
56	N	79.2	Confident	75.5	Confident	111 Å²	111	78 Å²	78	59%	0.594	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.3	162.6	168.1	-168	-27.3	0	0	0	107.2	F58 S59	N56-F58 PolarHBondContact O-N 3.47Å; N56-S59 PolarHBondContact N-O 2.86Å; N56-S59 PolarHBondContact O-N 3.35Å
57	R	81	Confident	76.1	Confident	173 Å²	173	78.1 Å²	78.1	65%	0.653	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-39.2	-38.2	-166.7	-174.4	-174.9	-75.6	-162.3	-0.9	115	V35	V35-R57 WeakPolarHBondContact CG1-O 3.33Å
58	F	81.7	Confident	77.3	Confident	23 Å²	23	75.7 Å²	75.7	10%	0.101	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.8	27.1	175.8	-68.1	-64.1	0	0	0	114.7	C25 E26 A27 Q32 P33 V35 N56 V77	C25-F58 PolarHBondContact N-O 3.32Å; C25-F58 VanDerWaalsContact O-CD1 3.28Å; C25-F58 WeakPolarHBondContact O-CD1 3.42Å; E26-F58 HydrophobicContact CB-CB 4.19Å; E26-F58 HydrophobicContact CG-CB 4.32Å; E26-F58 HydrophobicContact CG-CD2 3.89Å; E26-F58 HydrophobicContact CG-CG 4.34Å; A27-F58 HydrophobicContact CB-CE1 4.04Å; A27-F58 HydrophobicContact CB-CZ 4.31Å; A27-F58 WeakPolarHBondContact O-CE2 3.16Å; A27-F58 VanDerWaalsContact O-CZ 3.26Å; A27-F58 WeakPolarHBondContact O-CZ 3.44Å; Q32-F58 VanDerWaalsContact NE2-CZ 3.34Å; P33-F58 HydrophobicContact CG-CE1 4.49Å; P33-F58 HydrophobicContact CG-CZ 4.14Å; V35-F58 HydrophobicContact CB-CD1 4.26Å; V35-F58 HydrophobicContact CG1-CD1 4.34Å; N56-F58 PolarHBondContact O-N 3.47Å; F58-V77 HydrophobicContact CE1-CG1 4.34Å
59	S	85.6	Confident	78.8	Confident	11 Å²	11	67.3 Å²	67.3	8%	0.077	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	135.3	176.9	66.4	0	0	0	0	112.9	K22 L23 N56	K22-S59 WeakPolarHBondContact CE-OG 3.43Å; L23-S59 CarbonylContact O-C 3.46Å; L23-S59 WeakPolarHBondContact O-CA 3.46Å; L23-S59 WeakPolarHBondContact O-CB 3.45Å; N56-S59 PolarHBondContact N-O 2.86Å; N56-S59 PolarHBondContact O-N 3.35Å
60	M	86.3	Confident	80.1	Confident	2 Å²	2	69.9 Å²	69.9	1%	0.01	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	139.4	165.3	-176.1	-179.8	67.7	0	0	109.5	K22 L23 W37 I44 V53 F55 Y73	K22-M60 CarbonylContact C-O 3.06Å; K22-M60 WeakPolarHBondContact CA-O 3.44Å; L23-M60 HydrophobicContact CD1-CE 4.1Å; L23-M60 PolarHBondContact N-O 2.83Å; L23-M60 PolarHBondContact O-N 2.86Å; L23-M60 VanDerWaalsContact O-N 3.13Å; W37-M60 HydrophobicContact CB-SD 4.35Å; W37-M60 HydrophobicContact CD2-CB 3.78Å; W37-M60 HydrophobicContact CE3-CB 4.16Å; W37-M60 HydrophobicContact CE3-CE 4.36Å; W37-M60 HydrophobicContact CG-CB 4.1Å; W37-M60 HydrophobicContact CZ2-CB 4.31Å; I44-M60 HydrophobicContact CD1-CE 3.74Å; I44-M60 HydrophobicContact CD1-SD 3.53Å; I44-M60 VanDerWaalsContact CD1-SD 3.53Å; I44-M60 HydrophobicContact CG2-SD 4.31Å; V53-M60 HydrophobicContact CG1-CG 3.77Å; V53-M60 HydrophobicContact CG1-SD 3.87Å; F55-M60 HydrophobicContact CD1-CB 3.93Å; F55-M60 HydrophobicContact CD1-CG 3.92Å; F55-M60 HydrophobicContact CE1-CB 3.8Å; F55-M60 HydrophobicContact CE1-CG 3.49Å; F55-M60 VanDerWaalsContact CE1-CG 3.49Å; F55-M60 HydrophobicContact CE1-SD 3.53Å; F55-M60 VanDerWaalsContact CE1-SD 3.53Å; F55-M60 HydrophobicContact CZ-CG 4.04Å; F55-M60 HydrophobicContact CZ-SD 3.76Å; M60-Y73 HydrophobicContact CE-CD1 3.56Å; M60-Y73 HydrophobicContact CE-CE1 3.53Å
61	T	85.2	Confident	81.6	Confident	13 Å²	13	64.2 Å²	64.2	8%	0.08	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	128.6	178.9	-52.9	0	0	0	0	109.3	R20 M21 K22 V53 K54 M63	R20-T61 HydrophobicContact CG-CG2 3.87Å; M21-T61 CarbonylContact O-C 3.41Å; M21-T61 VanDerWaalsContact O-CA 3.29Å; M21-T61 WeakPolarHBondContact O-CA 3.39Å; M21-T61 WeakPolarHBondContact O-CG2 3.27Å; K22-T61 HydrophobicContact CB-CG2 4.35Å; V53-T61 CarbonylContact C-O 3.57Å; V53-T61 WeakPolarHBondContact CA-O 3.17Å; K54-T61 PolarHBondContact N-O 3.31Å; K54-T61 PolarHBondContact O-N 3.32Å; T61-M63 HydrophobicContact CG2-SD 4.18Å
62	I	83.3	Confident	82.7	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.015	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	118.7	169.9	-53.9	-161.2	0	0	0	106.9	R20 M21 R52 V53 R64 V65 D69	R20-I62 CarbonylContact C-O 3.58Å; R20-I62 WeakPolarHBondContact CA-O 3.38Å; R20-I62 WeakPolarHBondContact CG-O 3.31Å; M21-I62 HydrophobicContact CB-CB 4.33Å; M21-I62 HydrophobicContact CE-CB 4.44Å; M21-I62 HydrophobicContact CE-CD1 3.54Å; M21-I62 HydrophobicContact CE-CG1 3.94Å; M21-I62 PolarHBondContact N-O 3.29Å; M21-I62 PolarHBondContact O-N 2.74Å; R52-I62 HydrophobicContact CG-CG2 4.41Å; V53-I62 HydrophobicContact CG1-CG1 4.49Å; V53-I62 HydrophobicContact CG2-CD1 4.27Å; V53-I62 HydrophobicContact CG2-CG1 4.03Å; V53-I62 HydrophobicContact CG2-CG2 4.3Å; I62-R64 WeakPolarHBondContact CG2-O 3.32Å; I62-V65 HydrophobicContact CB-CG2 4.33Å; I62-V65 HydrophobicContact CG2-CG2 4.1Å; I62-D69 HydrophobicContact CD1-CB 4.46Å
63	M	74.7	Confident	83.1	Confident	78 Å²	78	56.8 Å²	56.8	38%	0.384	29%	0.286	S	S	.	.	S	Bend	trans	-76	-29.3	-169.4	-70.1	-62.7	-50.9	0	0	114.4	R20 R52 K54 T61	R20-M63 HydrophobicContact CG-SD 4.47Å; R52-M63 WeakPolarHBondContact O-CB 3.25Å; R52-M63 WeakPolarHBondContact O-CG 3.49Å; R52-M63 PolarHBondContact O-N 2.72Å; K54-M63 HydrophobicContact CD-CG 4.07Å; K54-M63 HydrophobicContact CD-SD 4.09Å; K54-M63 HydrophobicContact CG-CG 4.4Å; T61-M63 HydrophobicContact CG2-SD 4.18Å
64	R	75.9	Confident	83.4	Confident	164 Å²	164	56.1 Å²	56.1	62%	0.619	28%	0.282	S	S	*	.	S	Bend	trans	-142.8	120.8	173.4	172	179.9	-95.7	-167.9	-6.5	106.2	D19 R52 I62	D19-R64 CarbonylContact O-C 3.45Å; D19-R64 WeakPolarHBondContact O-CA 3.15Å; R52-R64 VanDerWaalsContact CD-O 3.26Å; R52-R64 WeakPolarHBondContact CD-O 3.39Å; R52-R64 HydrophobicContact CG-CB 4.42Å; R52-R64 WeakPolarHBondContact CG-O 3.28Å; R52-R64 PolarHBondContact NH1-O 2.79Å; I62-R64 WeakPolarHBondContact CG2-O 3.32Å
65	V	75.9	Confident	83.8	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.018	26%	0.258	C	S	.	.			trans	-86.8	127.7	-178.6	166.7	0	0	0	0	110.3	V15 G18 D19 M21 I62 D69 I92	V15-V65 HydrophobicContact CG1-CB 4.39Å; V15-V65 HydrophobicContact CG1-CG2 4Å; G18-V65 PolarHBondContact N-O 3.19Å; D19-V65 WeakPolarHBondContact O-CB 3.33Å; D19-V65 WeakPolarHBondContact O-CG2 3.23Å; D19-V65 PolarHBondContact O-N 2.76Å; M21-V65 HydrophobicContact CB-CG2 3.73Å; I62-V65 HydrophobicContact CB-CG2 4.33Å; I62-V65 HydrophobicContact CG2-CG2 4.1Å; V65-D69 WeakPolarHBondContact CA-OD2 3.47Å; V65-D69 HydrophobicContact CG1-CB 4.46Å; V65-I92 HydrophobicContact CG1-CD1 3.54Å; V65-I92 HydrophobicContact CG1-CG1 3.93Å; V65-I92 HydrophobicContact CG1-CG2 4Å
66	E	85.2	Confident	84.2	Confident	78 Å²	78	49.5 Å²	49.5	36%	0.364	25%	0.253	S	S	.	.			trans	-108.1	155	178.9	-71.7	162.3	-171	0	0	109.3	R52 G68 D69 I92	R52-E66 WeakPolarHBondContact CD-OE1 3.44Å; R52-E66 IonicContact CZ-OE1 3.72Å; R52-E66 IonicContact CZ-OE2 2.72Å; R52-E66 IonicContact NE-OE1 3.6Å; R52-E66 PolarHBondContact NE-OE1 2.94Å; R52-E66 IonicContact NE-OE2 2.71Å; R52-E66 PolarHBondContact NE-OE2 2.94Å; R52-E66 VanDerWaalsContact NE-OE2 3.09Å; R52-E66 IonicContact NH2-OE2 3.9Å; R52-E66 PolarHBondContact NH2-OE2 2.84Å; E66-G68 PolarHBondContact O-N 3.3Å; E66-G68 VanDerWaalsContact O-N 3.09Å; E66-D69 PolarHBondContact N-OD2 2.92Å; E66-D69 WeakPolarHBondContact O-CB 3.3Å; E66-D69 PolarHBondContact O-N 3.24Å; E66-I92 WeakPolarHBondContact O-CD1 3.38Å
67	P	79.4	Confident	84.7	Confident	96 Å²	96	44.2 Å²	44.2	62%	0.623	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-56.2	-34.5	179.8	-17.4	26.9	0	0	0	111.9	L17 D69 E70	L17-P67 HydrophobicContact CD1-CG 4.47Å; L17-P67 HydrophobicContact CD2-CB 4.15Å; L17-P67 HydrophobicContact CD2-CG 3.58Å; P67-D69 PolarHBondContact O-N 3.43Å; P67-D69 VanDerWaalsContact O-N 3.1Å; P67-E70 PolarHBondContact O-N 3.17Å
68	G	85.3	Confident	85	Confident	54 Å²	54	40.6 Å²	40.6	56%	0.557	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-70.3	12	173.2	0	0	0	0	0	115.8	R39 E66	R39-G68 PolarHBondContact NH1-O 3.32Å; R39-G68 PolarHBondContact NH2-O 2.79Å; E66-G68 PolarHBondContact O-N 3.3Å; E66-G68 VanDerWaalsContact O-N 3.09Å
69	D	88.5	Confident	85.2	Confident	6 Å²	6	39.9 Å²	39.9	3%	0.032	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-97.4	-9.4	168.5	-66.8	-37.8	0	0	0	113.6	R39 R52 I62 V65 E66 P67 Y73 I92	R39-D69 PolarHBondContact NE-O 2.81Å; R39-D69 PolarHBondContact NH2-O 3.4Å; R52-D69 IonicContact CZ-OD1 2.71Å; R52-D69 IonicContact CZ-OD2 2.67Å; R52-D69 VanDerWaalsContact NH1-CG 3.34Å; R52-D69 IonicContact NH1-OD1 3.49Å; R52-D69 PolarHBondContact NH1-OD1 2.86Å; R52-D69 IonicContact NH1-OD2 3.97Å; R52-D69 PolarHBondContact NH1-OD2 3.43Å; R52-D69 IonicContact NH2-OD1 3.62Å; R52-D69 PolarHBondContact NH2-OD1 2.86Å; R52-D69 IonicContact NH2-OD2 3.67Å; R52-D69 PolarHBondContact NH2-OD2 2.79Å; I62-D69 HydrophobicContact CD1-CB 4.46Å; V65-D69 WeakPolarHBondContact CA-OD2 3.47Å; V65-D69 HydrophobicContact CG1-CB 4.46Å; E66-D69 PolarHBondContact N-OD2 2.92Å; E66-D69 WeakPolarHBondContact O-CB 3.3Å; E66-D69 PolarHBondContact O-N 3.24Å; P67-D69 PolarHBondContact O-N 3.43Å; P67-D69 VanDerWaalsContact O-N 3.1Å; D69-Y73 VanDerWaalsContact O-CE2 3.28Å; D69-Y73 WeakPolarHBondContact O-CE2 3.44Å; D69-Y73 PolarHBondContact O-OH 3.43Å; D69-I92 HydrophobicContact CB-CD1 3.74Å
70	E	86.4	Confident	85.5	Confident	84 Å²	84	47 Å²	47	39%	0.393	24%	0.241	S	C	.	.			trans	-60.7	144.5	-178.7	175.5	131.8	178.6	0	0	111.9	R39 P67 V90 R91 I92	R39-E70 PolarHBondContact NH2-O 3.06Å; P67-E70 PolarHBondContact O-N 3.17Å; E70-V90 WeakPolarHBondContact CG-O 3.27Å; E70-R91 WeakPolarHBondContact OE2-CA 3.39Å; E70-I92 HydrophobicContact CB-CD1 3.93Å; E70-I92 HydrophobicContact CB-CG1 4.12Å; E70-I92 PolarHBondContact OE2-N 2.72Å
71	G	88	Confident	85.3	Confident	17 Å²	17	51.1 Å²	51.1	18%	0.175	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149	-166.1	172.2	0	0	0	0	0	115.8	N40 V90	N40-G71 WeakPolarHBondContact OD1-CA 3.29Å; G71-V90 PolarHBondContact N-O 3.04Å; G71-V90 VanDerWaalsContact N-O 3.15Å; G71-V90 PolarHBondContact O-N 3.34Å
72	L	88.3	Confident	85.1	Confident	68 Å²	68	51.7 Å²	51.7	36%	0.356	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	104.6	179.9	-176	68.8	0	0	0	110.2	R39 N40 N87	R39-L72 CarbonylContact C-O 3.53Å; R39-L72 WeakPolarHBondContact CA-O 3.05Å; N40-L72 PolarHBondContact N-O 3.47Å; N40-L72 PolarHBondContact OD1-N 3.37Å; L72-N87 HydrophobicContact CD1-CB 4.23Å
73	Y	89.7	Confident	85.2	Confident	3 Å²	3	56.6 Å²	56.6	1%	0.012	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	152.3	170.5	-67.9	-99.2	0	0	0	110.8	M21 L23 Y38 R39 I44 M60 D69 N87 F88 V90	M21-Y73 HydrophobicContact CE-CE2 4.33Å; L23-Y73 HydrophobicContact CD1-CD1 4.06Å; L23-Y73 HydrophobicContact CD1-CD2 4.31Å; L23-Y73 HydrophobicContact CD1-CG 3.76Å; Y38-Y73 CarbonylContact O-C 3.56Å; Y38-Y73 WeakPolarHBondContact O-CA 3.28Å; R39-Y73 HydrophobicContact CB-CD1 3.8Å; R39-Y73 HydrophobicContact CB-CE1 3.76Å; R39-Y73 HydrophobicContact CB-CG 4.44Å; R39-Y73 HydrophobicContact CG-CD1 4Å; R39-Y73 HydrophobicContact CG-CD2 4.38Å; R39-Y73 HydrophobicContact CG-CE1 3.7Å; R39-Y73 HydrophobicContact CG-CE2 4.11Å; R39-Y73 HydrophobicContact CG-CG 4.35Å; I44-Y73 HydrophobicContact CD1-CD1 3.75Å; I44-Y73 HydrophobicContact CD1-CE1 3.8Å; M60-Y73 HydrophobicContact CE-CD1 3.56Å; M60-Y73 HydrophobicContact CE-CE1 3.53Å; D69-Y73 VanDerWaalsContact O-CE2 3.28Å; D69-Y73 WeakPolarHBondContact O-CE2 3.44Å; D69-Y73 PolarHBondContact O-OH 3.43Å; Y73-N87 CarbonylContact O-C 3.55Å; Y73-N87 WeakPolarHBondContact O-CA 3.23Å; Y73-F88 PolarHBondContact N-O 3.16Å; Y73-F88 PolarHBondContact O-N 3.07Å; Y73-V90 HydrophobicContact CD2-CB 3.85Å; Y73-V90 HydrophobicContact CD2-CG2 3.36Å; Y73-V90 HydrophobicContact CE2-CB 3.76Å; Y73-V90 HydrophobicContact CE2-CG1 4.31Å; Y73-V90 HydrophobicContact CE2-CG2 3.6Å; Y73-V90 HydrophobicContact CG-CG2 4.32Å
74	A	88.5	Confident	85.6	Confident	8 Å²	8	54.5 Å²	54.5	7%	0.066	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	151.5	169.9	0	0	0	0	0	111.2	W37 Y38 W85 R86 N87	W37-A74 CarbonylContact C-O 3.59Å; W37-A74 WeakPolarHBondContact CA-O 3.33Å; Y38-A74 PolarHBondContact N-O 2.93Å; Y38-A74 PolarHBondContact O-N 2.81Å; A74-W85 HydrophobicContact CB-CE3 4.42Å; A74-R86 CarbonylContact C-O 3.53Å; A74-R86 VanDerWaalsContact CA-O 3.31Å; A74-R86 WeakPolarHBondContact CA-O 3.39Å; A74-N87 WeakPolarHBondContact CB-OD1 3.18Å
75	C	89.8	Confident	86	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	127.9	168.6	67.3	0	0	0	0	109.8	C25 V35 H36 W37 W85 R86	C25-C75 HydrophobicContact CB-CB 3.78Å; C25-C75 WeakPolarHBondContact CB-SG 3.08Å; C25-C75 WeakPolarHBondContact SG-CB 3.25Å; C25-C75 CovalentContact SG-SG 2.01Å; C25-C75 PolarHBondContact SG-SG 2.82Å; V35-C75 HydrophobicContact CG2-CB 3.94Å; H36-C75 CarbonylContact O-C 3.44Å; H36-C75 WeakPolarHBondContact O-CA 3.19Å; W37-C75 HydrophobicContact CD2-CB 4.04Å; W37-C75 HydrophobicContact CE3-CB 3.86Å; W37-C75 HydrophobicContact CH2-CB 3.97Å; W37-C75 HydrophobicContact CZ2-CB 4.12Å; W37-C75 HydrophobicContact CZ3-CB 3.83Å; C75-W85 WeakPolarHBondContact O-CA 3.3Å; C75-R86 PolarHBondContact N-O 2.78Å; C75-R86 PolarHBondContact O-N 3.24Å
76	K	89.7	Confident	86.3	Confident	44 Å²	44	54 Å²	54	19%	0.191	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	110	173.5	-175.6	-174.8	-173.3	177	0	108.1	V35 H36 Y38 W85	V35-K76 WeakPolarHBondContact CA-O 3.12Å; H36-K76 HydrophobicContact CB-CB 4.45Å; H36-K76 PolarHBondContact N-O 2.69Å; H36-K76 PolarHBondContact O-N 3.02Å; Y38-K76 HydrophobicContact CD2-CB 4.41Å; Y38-K76 HydrophobicContact CE2-CB 3.72Å; Y38-K76 HydrophobicContact CE2-CD 4.39Å; K76-W85 HydrophobicContact CB-CD2 4.04Å; K76-W85 HydrophobicContact CB-CE3 3.86Å; K76-W85 HydrophobicContact CB-CH2 4.11Å; K76-W85 HydrophobicContact CB-CZ2 4.27Å; K76-W85 HydrophobicContact CB-CZ3 3.89Å; K76-W85 HydrophobicContact CD-CH2 3.82Å; K76-W85 HydrophobicContact CD-CZ2 3.53Å; K76-W85 HydrophobicContact CD-CZ3 4.46Å; K76-W85 HydrophobicContact CG-CD2 4.03Å; K76-W85 HydrophobicContact CG-CE3 4.31Å; K76-W85 HydrophobicContact CG-CH2 4.15Å; K76-W85 HydrophobicContact CG-CZ2 3.84Å; K76-W85 HydrophobicContact CG-CZ3 4.36Å
77	V	89.5	Confident	86.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	129.4	176	174.6	0	0	0	0	109	P3 F5 C25 A27 P33 Y34 V35 F58 Q83 I84	P3-V77 HydrophobicContact CB-CG1 3.97Å; F5-V77 HydrophobicContact CE1-CB 4.35Å; F5-V77 HydrophobicContact CE1-CG2 3.81Å; C25-V77 HydrophobicContact CB-CG2 4.39Å; A27-V77 HydrophobicContact CB-CG1 3.66Å; A27-V77 HydrophobicContact CB-CG2 4.4Å; P33-V77 HydrophobicContact CB-CG1 3.74Å; P33-V77 HydrophobicContact CG-CG1 4.06Å; Y34-V77 CarbonylContact O-C 3.54Å; Y34-V77 VanDerWaalsContact O-CA 3.27Å; Y34-V77 WeakPolarHBondContact O-CA 3.4Å; V35-V77 HydrophobicContact CB-CG2 4.06Å; V35-V77 HydrophobicContact CG2-CG2 3.72Å; F58-V77 HydrophobicContact CE1-CG1 4.34Å; V77-Q83 CarbonylContact O-C 3.51Å; V77-Q83 WeakPolarHBondContact O-CA 3.01Å; V77-I84 HydrophobicContact CB-CD1 4.26Å; V77-I84 HydrophobicContact CB-CG1 3.77Å; V77-I84 HydrophobicContact CG1-CD1 4.37Å; V77-I84 HydrophobicContact CG1-CG1 4.26Å; V77-I84 PolarHBondContact N-O 2.81Å; V77-I84 PolarHBondContact O-N 3.48Å
78	W	88.6	Confident	86.4	Confident	98 Å²	98	50 Å²	50	37%	0.371	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	155.4	-173.1	69.6	-79.5	0	0	0	114	P33 Y34 G82 Q83	P33-W78 CarbonylContact C-O 3.58Å; P33-W78 WeakPolarHBondContact CA-O 3.21Å; P33-W78 VanDerWaalsContact CB-O 3.23Å; P33-W78 WeakPolarHBondContact CB-O 3.39Å; Y34-W78 HydrophobicContact CD2-CZ2 4.4Å; Y34-W78 PolarHBondContact N-O 3.43Å; Y34-W78 PolarHBondContact O-N 2.8Å; W78-G82 WeakPolarHBondContact CA-O 3.27Å; W78-Q83 HydrophobicContact CB-CB 3.77Å
79	N	85.2	Confident	86.1	Confident	8 Å²	8	50.5 Å²	50.5	4%	0.043	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	-177.3	163.8	71.2	16.7	0	0	0	109.4	M1 P3 P31 P33 I81 G82	M1-N79 PolarHBondContact O-ND2 3.28Å; P3-N79 WeakPolarHBondContact CD-OD1 3.16Å; P3-N79 HydrophobicContact CG-CB 4.21Å; P31-N79 PolarHBondContact O-ND2 3.45Å; P33-N79 HydrophobicContact CB-CB 4.23Å; N79-I81 PolarHBondContact O-N 3.26Å; N79-I81 WeakPolarHBondContact OD1-CA 3.3Å; N79-I81 WeakPolarHBondContact OD1-CB 3.4Å; N79-I81 PolarHBondContact OD1-N 2.85Å; N79-G82 PolarHBondContact N-O 2.82Å; N79-G82 PolarHBondContact O-N 3.27Å; N79-G82 VanDerWaalsContact O-N 3.1Å; N79-G82 VanDerWaalsContact O-O 3.05Å; N79-G82 PolarHBondContact OD1-N 3.02Å
80	Q	91.2	Very high	85.9	Confident	159 Å²	159	50.2 Å²	50.2	74%	0.743	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-8	-178.9	79.7	-165.8	33.3	0	0	115.7	P31	P31-Q80 HydrophobicContact CG-CG 4.04Å
81	I	82.8	Confident	85.4	Confident	89 Å²	89	53 Å²	53	46%	0.456	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-17.1	-179.9	-48.8	-62.9	0	0	0	111.3	N2 N79	N2-I81 HydrophobicContact CB-CG2 4.16Å; N79-I81 PolarHBondContact O-N 3.26Å; N79-I81 WeakPolarHBondContact OD1-CA 3.3Å; N79-I81 WeakPolarHBondContact OD1-CB 3.4Å; N79-I81 PolarHBondContact OD1-N 2.85Å
82	G	81	Confident	84.9	Confident	25 Å²	25	53.2 Å²	53.2	26%	0.258	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	158.8	-177.8	177.4	0	0	0	0	0	114.5	N2 P3 W78 N79	N2-G82 WeakPolarHBondContact OD1-CA 3.48Å; P3-G82 WeakPolarHBondContact CD-O 3.31Å; W78-G82 WeakPolarHBondContact CA-O 3.27Å; N79-G82 PolarHBondContact N-O 2.82Å; N79-G82 PolarHBondContact O-N 3.27Å; N79-G82 VanDerWaalsContact O-N 3.1Å; N79-G82 VanDerWaalsContact O-O 3.05Å; N79-G82 PolarHBondContact OD1-N 3.02Å
83	Q	86.4	Confident	83.5	Confident	107 Å²	107	50.6 Å²	50.6	50%	0.5	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	143.9	-172.8	62.3	-175.6	3.6	0	0	110.8	V77 W78	V77-Q83 CarbonylContact O-C 3.51Å; V77-Q83 WeakPolarHBondContact O-CA 3.01Å; W78-Q83 HydrophobicContact CB-CB 3.77Å
84	I	81.5	Confident	82.3	Confident	33 Å²	33	52.9 Å²	52.9	17%	0.169	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	152.1	173.4	65.7	179.5	0	0	0	109.5	P3 F5 V77	P3-I84 HydrophobicContact CB-CD1 4.04Å; P3-I84 HydrophobicContact CB-CG1 4.28Å; P3-I84 WeakPolarHBondContact O-CG2 3.26Å; F5-I84 HydrophobicContact CD1-CD1 4.01Å; F5-I84 HydrophobicContact CD2-CD1 3.67Å; F5-I84 HydrophobicContact CD2-CG1 4.45Å; F5-I84 HydrophobicContact CE1-CD1 3.91Å; F5-I84 HydrophobicContact CE1-CG1 4.23Å; F5-I84 HydrophobicContact CE2-CB 4.2Å; F5-I84 HydrophobicContact CE2-CD1 3.56Å; F5-I84 HydrophobicContact CE2-CG1 3.84Å; F5-I84 HydrophobicContact CG-CD1 3.89Å; F5-I84 HydrophobicContact CZ-CB 4.41Å; F5-I84 HydrophobicContact CZ-CD1 3.68Å; F5-I84 HydrophobicContact CZ-CG1 3.7Å; V77-I84 HydrophobicContact CB-CD1 4.26Å; V77-I84 HydrophobicContact CB-CG1 3.77Å; V77-I84 HydrophobicContact CG1-CD1 4.37Å; V77-I84 HydrophobicContact CG1-CG1 4.26Å; V77-I84 PolarHBondContact N-O 2.81Å; V77-I84 PolarHBondContact O-N 3.48Å
85	W	85.4	Confident	80.6	Confident	123 Å²	123	56.8 Å²	56.8	47%	0.466	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	153.7	-179.6	-66.2	81.8	0	0	0	110.8	F5 Y38 A74 C75 K76	F5-W85 WeakPolarHBondContact CE2-O 3.35Å; Y38-W85 AromaticContact CD2-CZ3 3.94Å; Y38-W85 HydrophobicContact CD2-CZ3 3.94Å; Y38-W85 HydrophobicContact CE2-CH2 4.07Å; Y38-W85 AromaticContact CE2-CZ3 3.87Å; Y38-W85 HydrophobicContact CE2-CZ3 3.87Å; A74-W85 HydrophobicContact CB-CE3 4.42Å; C75-W85 WeakPolarHBondContact O-CA 3.3Å; K76-W85 HydrophobicContact CB-CD2 4.04Å; K76-W85 HydrophobicContact CB-CE3 3.86Å; K76-W85 HydrophobicContact CB-CH2 4.11Å; K76-W85 HydrophobicContact CB-CZ2 4.27Å; K76-W85 HydrophobicContact CB-CZ3 3.89Å; K76-W85 HydrophobicContact CD-CH2 3.82Å; K76-W85 HydrophobicContact CD-CZ2 3.53Å; K76-W85 HydrophobicContact CD-CZ3 4.46Å; K76-W85 HydrophobicContact CG-CD2 4.03Å; K76-W85 HydrophobicContact CG-CE3 4.31Å; K76-W85 HydrophobicContact CG-CH2 4.15Å; K76-W85 HydrophobicContact CG-CZ2 3.84Å; K76-W85 HydrophobicContact CG-CZ3 4.36Å
86	R	81.6	Confident	78.8	Confident	35 Å²	35	59.8 Å²	59.8	13%	0.132	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	132.5	170.5	163.1	-175.8	-68.9	-178.5	-5.4	109.6	F5 T7 A74 C75 F88	F5-R86 VanDerWaalsContact CB-NH2 3.3Å; F5-R86 HydrophobicContact CE1-CB 4.12Å; F5-R86 HydrophobicContact CE2-CB 3.77Å; F5-R86 HydrophobicContact CZ-CB 3.44Å; F5-R86 VanDerWaalsContact CZ-CB 3.44Å; T7-R86 VanDerWaalsContact O-CZ 3.25Å; T7-R86 PolarHBondContact O-NH1 3.46Å; T7-R86 PolarHBondContact O-NH2 2.76Å; A74-R86 CarbonylContact C-O 3.53Å; A74-R86 VanDerWaalsContact CA-O 3.31Å; A74-R86 WeakPolarHBondContact CA-O 3.39Å; C75-R86 PolarHBondContact N-O 2.78Å; C75-R86 PolarHBondContact O-N 3.24Å; R86-F88 HydrophobicContact CG-CE2 3.95Å; R86-F88 HydrophobicContact CG-CZ 3.97Å
87	N	83.6	Confident	77	Confident	86 Å²	86	62.6 Å²	62.6	46%	0.46	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	153.9	-174.7	-58.9	-2	0	0	0	111	L72 Y73 A74	L72-N87 HydrophobicContact CD1-CB 4.23Å; Y73-N87 CarbonylContact O-C 3.55Å; Y73-N87 WeakPolarHBondContact O-CA 3.23Å; A74-N87 WeakPolarHBondContact CB-OD1 3.18Å
88	F	83.5	Confident	75	Confident	4 Å²	4	65.8 Å²	65.8	2%	0.018	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	121.1	177.6	-51.5	-102.6	0	0	0	109.4	V9 R10 P11 L23 C25 W37 Y73 R86	V9-F88 HydrophobicContact CB-CE1 4.3Å; V9-F88 HydrophobicContact CG2-CE1 3.47Å; V9-F88 VanDerWaalsContact CG2-CE1 3.47Å; V9-F88 HydrophobicContact CG2-CZ 3.87Å; R10-F88 WeakPolarHBondContact O-CD1 3.41Å; P11-F88 CarbonylContact O-C 3.53Å; P11-F88 VanDerWaalsContact O-CA 3.25Å; P11-F88 WeakPolarHBondContact O-CA 3.31Å; L23-F88 HydrophobicContact CB-CE1 4.38Å; L23-F88 HydrophobicContact CB-CZ 4.37Å; L23-F88 HydrophobicContact CD1-CB 4.26Å; L23-F88 HydrophobicContact CD1-CD2 4.21Å; L23-F88 HydrophobicContact CD1-CG 4.17Å; L23-F88 HydrophobicContact CD2-CB 4.33Å; L23-F88 HydrophobicContact CD2-CD1 3.91Å; L23-F88 HydrophobicContact CD2-CE1 4.39Å; L23-F88 HydrophobicContact CD2-CG 4.15Å; C25-F88 WeakPolarHBondContact SG-CE2 3.39Å; C25-F88 WeakPolarHBondContact SG-CZ 3.17Å; W37-F88 HydrophobicContact CH2-CE2 4.09Å; W37-F88 HydrophobicContact CH2-CZ 4.27Å; W37-F88 HydrophobicContact CZ3-CD2 4.26Å; W37-F88 AromaticContact CZ3-CE2 3.71Å; W37-F88 HydrophobicContact CZ3-CE2 3.71Å; W37-F88 HydrophobicContact CZ3-CZ 4.31Å; Y73-F88 PolarHBondContact N-O 3.16Å; Y73-F88 PolarHBondContact O-N 3.07Å; R86-F88 HydrophobicContact CG-CE2 3.95Å; R86-F88 HydrophobicContact CG-CZ 3.97Å
89	T	79.5	Confident	72.8	Confident	63 Å²	63	64.3 Å²	64.3	39%	0.387	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	110.4	164.2	-52.5	0	0	0	0	108.1	P11 K12 Q13	P11-T89 PolarHBondContact O-N 2.95Å; K12-T89 WeakPolarHBondContact CA-O 3.44Å; Q13-T89 PolarHBondContact N-O 3.44Å
90	V	82.9	Confident	71.1	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	123.4	172.8	174.1	0	0	0	0	108.5	Q13 M21 L23 E70 G71 Y73 I92	Q13-V90 HydrophobicContact CB-CG2 4.32Å; Q13-V90 WeakPolarHBondContact O-CA 3.28Å; M21-V90 HydrophobicContact CE-CG1 3.9Å; M21-V90 HydrophobicContact CE-CG2 3.99Å; M21-V90 HydrophobicContact SD-CB 4.19Å; M21-V90 HydrophobicContact SD-CG1 3.58Å; M21-V90 VanDerWaalsContact SD-CG1 3.58Å; M21-V90 HydrophobicContact SD-CG2 3.45Å; M21-V90 WeakPolarHBondContact SD-CG2 3.36Å; L23-V90 HydrophobicContact CD1-CG2 4.34Å; L23-V90 HydrophobicContact CD2-CG2 4.26Å; E70-V90 WeakPolarHBondContact CG-O 3.27Å; G71-V90 PolarHBondContact N-O 3.04Å; G71-V90 VanDerWaalsContact N-O 3.15Å; G71-V90 PolarHBondContact O-N 3.34Å; Y73-V90 HydrophobicContact CD2-CB 3.85Å; Y73-V90 HydrophobicContact CD2-CG2 3.36Å; Y73-V90 HydrophobicContact CE2-CB 3.76Å; Y73-V90 HydrophobicContact CE2-CG1 4.31Å; Y73-V90 HydrophobicContact CE2-CG2 3.6Å; Y73-V90 HydrophobicContact CG-CG2 4.32Å; V90-I92 HydrophobicContact CG1-CG1 4.24Å
91	R	77	Confident	69.1	Low	143 Å²	143	66.4 Å²	66.4	54%	0.54	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	145.5	169.9	-77.5	-171.9	163.1	-174.3	-6.4	110.3	Q13 E14 V15 E70	Q13-R91 PolarHBondContact O-N 3.08Å; E14-R91 WeakPolarHBondContact CA-O 3.34Å; E14-R91 HydrophobicContact CG-CB 4.3Å; V15-R91 PolarHBondContact N-O 3.36Å; V15-R91 VanDerWaalsContact N-O 3.12Å; E70-R91 WeakPolarHBondContact OE2-CA 3.39Å
92	I	76.4	Confident	67.1	Low	22 Å²	22	66.1 Å²	66.1	11%	0.113	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	118.7	-173.6	-59.3	-179.1	0	0	0	109.8	V15 L17 V65 E66 D69 E70 V90	V15-I92 WeakPolarHBondContact O-CA 3.41Å; L17-I92 HydrophobicContact CD2-CG2 3.37Å; L17-I92 HydrophobicContact CG-CG2 3.74Å; V65-I92 HydrophobicContact CG1-CD1 3.54Å; V65-I92 HydrophobicContact CG1-CG1 3.93Å; V65-I92 HydrophobicContact CG1-CG2 4Å; E66-I92 WeakPolarHBondContact O-CD1 3.38Å; D69-I92 HydrophobicContact CB-CD1 3.74Å; E70-I92 HydrophobicContact CB-CD1 3.93Å; E70-I92 HydrophobicContact CB-CG1 4.12Å; E70-I92 PolarHBondContact OE2-N 2.72Å; V90-I92 HydrophobicContact CG1-CG1 4.24Å
93	N	59.5	Low	65.4	Low	13 Å²	13	70.4 Å²	70.4	7%	0.07	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	124.7	-178.6	-75.6	-33.6	0	0	0	110.2	E14 V15 M16 L17 R101	E14-N93 PolarHBondContact OE2-ND2 2.79Å; V15-N93 PolarHBondContact O-N 2.81Å; M16-N93 CarbonylContact C-O 3.5Å; M16-N93 VanDerWaalsContact CA-O 3.24Å; M16-N93 WeakPolarHBondContact CA-O 3.15Å; M16-N93 HydrophobicContact CE-CB 3.86Å; M16-N93 WeakPolarHBondContact CE-O 3.47Å; M16-N93 HydrophobicContact SD-CB 3.65Å; L17-N93 PolarHBondContact N-O 2.69Å; N93-R101 PolarHBondContact OD1-NH2 3.16Å
94	D	65.6	Low	63.7	Low	50 Å²	50	69.4 Å²	69.4	27%	0.267	33%	0.331	S	S	.	.			trans	-74	137.6	160.3	176.1	3.1	0	0	0	109.2	L17 A96 Q97 W98	L17-D94 HydrophobicContact CD1-CB 3.88Å; D94-A96 VanDerWaalsContact C-N 3.27Å; D94-A96 PolarHBondContact O-N 3.12Å; D94-A96 PolarHBondContact OD1-N 2.81Å; D94-Q97 HydrophobicContact CB-CB 4.09Å; D94-Q97 HydrophobicContact CB-CG 3.88Å; D94-Q97 PolarHBondContact O-N 3.38Å; D94-Q97 PolarHBondContact OD2-NE2 2.81Å; D94-W98 VanDerWaalsContact O-CB 3.31Å; D94-W98 WeakPolarHBondContact O-CB 3.49Å; D94-W98 PolarHBondContact O-N 2.88Å
95	L	51.2	Low	61.7	Low	90 Å²	90	72.7 Å²	72.7	47%	0.471	35%	0.345	S	S	.	.	H	α-helix	trans	-63.3	-32.9	177.4	-177.8	62.4	0	0	0	112	M16 K99	M16-L95 VanDerWaalsContact CE-CA 3.5Å; M16-L95 HydrophobicContact CE-CB 3.97Å; M16-L95 HydrophobicContact CE-CD1 4.13Å; L95-K99 HydrophobicContact CD1-CG 4.47Å; L95-K99 HydrophobicContact CG-CD 4.42Å; L95-K99 WeakPolarHBondContact O-CB 3.28Å; L95-K99 VanDerWaalsContact O-CG 3.23Å; L95-K99 WeakPolarHBondContact O-CG 3.21Å; L95-K99 PolarHBondContact O-N 3.19Å; L95-K99 VanDerWaalsContact O-N 3.11Å
96	A	53.4	Low	59.4	Low	63 Å²	63	68.7 Å²	68.7	52%	0.521	34%	0.342	S	S	.	.	H	α-helix	trans	-66.3	-49.4	175	0	0	0	0	0	111.1	D94 K99 H100	D94-A96 VanDerWaalsContact C-N 3.27Å; D94-A96 PolarHBondContact O-N 3.12Å; D94-A96 PolarHBondContact OD1-N 2.81Å; A96-K99 PolarHBondContact O-N 3.13Å; A96-H100 PolarHBondContact O-N 3.04Å; A96-H100 VanDerWaalsContact O-N 3.08Å
97	Q	52.1	Low	57.8	Low	103 Å²	103	74.6 Å²	74.6	48%	0.481	37%	0.365	S	S	.	.	H	α-helix	trans	-66.2	-38.8	178.7	-61.8	174.9	36.6	0	0	112.6	D94 H100 R101	D94-Q97 HydrophobicContact CB-CB 4.09Å; D94-Q97 HydrophobicContact CB-CG 3.88Å; D94-Q97 PolarHBondContact O-N 3.38Å; D94-Q97 PolarHBondContact OD2-NE2 2.81Å; Q97-H100 PolarHBondContact O-N 3.33Å; Q97-R101 WeakPolarHBondContact O-CG 3.5Å; Q97-R101 PolarHBondContact O-N 2.97Å
98	W	46.5	Very low	55.6	Low	68 Å²	68	76.4 Å²	76.4	26%	0.258	37%	0.372	S	S	.	.	H	α-helix	trans	-63.5	-46.5	177.4	-177.8	89	0	0	0	111.3	M16 D94 H100 R101 M102 Y278	M16-W98 HydrophobicContact CE-CB 4.04Å; M16-W98 HydrophobicContact CE-CG 4.42Å; D94-W98 VanDerWaalsContact O-CB 3.31Å; D94-W98 WeakPolarHBondContact O-CB 3.49Å; D94-W98 PolarHBondContact O-N 2.88Å; W98-H100 VanDerWaalsContact C-N 3.34Å; W98-H100 PolarHBondContact O-N 2.92Å; W98-R101 PolarHBondContact O-N 2.88Å; W98-M102 HydrophobicContact CD2-SD 4.47Å; W98-M102 HydrophobicContact CH2-CG 4.18Å; W98-M102 HydrophobicContact CZ2-CE 4.19Å; W98-M102 HydrophobicContact CZ2-CG 3.92Å; W98-M102 HydrophobicContact CZ2-SD 4.03Å; W98-M102 PolarHBondContact O-N 3.27Å; W98-Y278 HydrophobicContact CZ2-CD1 4.43Å
99	K	43.2	Very low	53.1	Low	66 Å²	66	82 Å²	82	29%	0.287	40%	0.399	S	S	.	.	H	α-helix	trans	-56.3	-47.1	173.6	-76.3	170.8	177.9	177.5	0	111.5	L95 A96 M102 L103	L95-K99 HydrophobicContact CD1-CG 4.47Å; L95-K99 HydrophobicContact CG-CD 4.42Å; L95-K99 WeakPolarHBondContact O-CB 3.28Å; L95-K99 VanDerWaalsContact O-CG 3.23Å; L95-K99 WeakPolarHBondContact O-CG 3.21Å; L95-K99 PolarHBondContact O-N 3.19Å; L95-K99 VanDerWaalsContact O-N 3.11Å; A96-K99 PolarHBondContact O-N 3.13Å; K99-M102 PolarHBondContact O-N 3.01Å; K99-L103 VanDerWaalsContact O-CG 3.31Å; K99-L103 WeakPolarHBondContact O-CG 3.36Å; K99-L103 PolarHBondContact O-N 2.7Å
100	H	49.3	Very low	51.2	Low	112 Å²	112	81.6 Å²	81.6	52%	0.519	40%	0.403	S	S	.	.	H	α-helix	trans	-59.2	-51.2	179.5	-172.5	65.1	0	0	0	111.8	A96 Q97 W98 M102 L103 E104	A96-H100 PolarHBondContact O-N 3.04Å; A96-H100 VanDerWaalsContact O-N 3.08Å; Q97-H100 PolarHBondContact O-N 3.33Å; W98-H100 VanDerWaalsContact C-N 3.34Å; W98-H100 PolarHBondContact O-N 2.92Å; H100-M102 VanDerWaalsContact C-N 3.33Å; H100-M102 PolarHBondContact O-N 2.9Å; H100-L103 PolarHBondContact O-N 2.77Å; H100-L103 VanDerWaalsContact O-N 3.16Å; H100-E104 IonicContact CD2-OE2 2.83Å; H100-E104 IonicContact NE2-OE1 3.96Å; H100-E104 IonicContact NE2-OE2 2.6Å; H100-E104 PolarHBondContact O-N 2.65Å
101	R	49.1	Very low	49.4	Very low	100 Å²	100	88.7 Å²	88.7	38%	0.377	44%	0.436	S	S	.	.	H	α-helix	trans	-62.4	-35.8	178.8	-66.7	-173.9	-52	-120	10.4	113.2	N93 Q97 W98 H105	N93-R101 PolarHBondContact OD1-NH2 3.16Å; Q97-R101 WeakPolarHBondContact O-CG 3.5Å; Q97-R101 PolarHBondContact O-N 2.97Å; W98-R101 PolarHBondContact O-N 2.88Å; R101-H105 VanDerWaalsContact O-CB 3.29Å; R101-H105 WeakPolarHBondContact O-CB 3.39Å; R101-H105 PolarHBondContact O-N 3.11Å
102	M	39.6	Very low	47.7	Very low	82 Å²	82	88.7 Å²	88.7	40%	0.404	45%	0.446	S	S	.	.	H	α-helix	trans	-70.3	-36.2	175.7	-107	59	-167.9	0	0	112.6	W98 K99 H100 H105 G106	W98-M102 HydrophobicContact CD2-SD 4.47Å; W98-M102 HydrophobicContact CH2-CG 4.18Å; W98-M102 HydrophobicContact CZ2-CE 4.19Å; W98-M102 HydrophobicContact CZ2-CG 3.92Å; W98-M102 HydrophobicContact CZ2-SD 4.03Å; W98-M102 PolarHBondContact O-N 3.27Å; K99-M102 PolarHBondContact O-N 3.01Å; H100-M102 VanDerWaalsContact C-N 3.33Å; H100-M102 PolarHBondContact O-N 2.9Å; M102-H105 PolarHBondContact O-N 2.87Å; M102-G106 PolarHBondContact O-N 3.23Å
103	L	46.8	Very low	46	Very low	116 Å²	116	97.4 Å²	97.4	61%	0.607	48%	0.478	S	S	*	.	H	α-helix	trans	-68.1	-40.4	173.4	-71.2	166.7	0	0	0	111.9	K99 H100 R107	K99-L103 VanDerWaalsContact O-CG 3.31Å; K99-L103 WeakPolarHBondContact O-CG 3.36Å; K99-L103 PolarHBondContact O-N 2.7Å; H100-L103 PolarHBondContact O-N 2.77Å; H100-L103 VanDerWaalsContact O-N 3.16Å; L103-R107 WeakPolarHBondContact O-CB 3.45Å; L103-R107 PolarHBondContact O-N 2.99Å
104	E	49.4	Very low	45.1	Very low	85 Å²	85	105.2 Å²	105.2	40%	0.397	52%	0.52	S	S	.	.	H	α-helix	trans	-64.2	-43.9	172.5	-70.7	-169	123.5	0	0	112	H100 G106 R107 M108	H100-E104 IonicContact CD2-OE2 2.83Å; H100-E104 IonicContact NE2-OE1 3.96Å; H100-E104 IonicContact NE2-OE2 2.6Å; H100-E104 PolarHBondContact O-N 2.65Å; E104-G106 PolarHBondContact O-N 3.13Å; E104-R107 WeakPolarHBondContact O-CB 3.32Å; E104-R107 PolarHBondContact O-N 3.01Å; E104-M108 WeakPolarHBondContact O-CG 3.31Å; E104-M108 PolarHBondContact O-N 3.22Å
105	H	39.5	Very low	44.1	Very low	102 Å²	102	106.8 Å²	106.8	47%	0.472	53%	0.528	S	S	.	.	H	α-helix	trans	-62.2	-42.4	176.9	-173.6	-86.6	0	0	0	112	R101 M102 M108 M109	R101-H105 VanDerWaalsContact O-CB 3.29Å; R101-H105 WeakPolarHBondContact O-CB 3.39Å; R101-H105 PolarHBondContact O-N 3.11Å; M102-H105 PolarHBondContact O-N 2.87Å; H105-M108 PolarHBondContact O-N 3.35Å; H105-M109 VanDerWaalsContact CE1-CE 3.47Å; H105-M109 WeakPolarHBondContact CE1-CE 3.42Å; H105-M109 WeakPolarHBondContact NE2-CE 3.34Å; H105-M109 WeakPolarHBondContact O-CG 3.48Å; H105-M109 PolarHBondContact O-N 3.01Å
106	G	37.3	Very low	43.8	Very low	40 Å²	40	107.9 Å²	107.9	41%	0.412	54%	0.54	S	S	.	.	H	α-helix	trans	-60.5	-43.5	172.1	0	0	0	0	0	112.4	M102 E104 M108 M109 A110	M102-G106 PolarHBondContact O-N 3.23Å; E104-G106 PolarHBondContact O-N 3.13Å; G106-M108 PolarHBondContact O-N 2.86Å; G106-M109 PolarHBondContact O-N 2.86Å; G106-A110 WeakPolarHBondContact O-CB 3.21Å; G106-A110 PolarHBondContact O-N 3.27Å
107	R	47.4	Very low	43.2	Very low	159 Å²	159	108.8 Å²	108.8	60%	0.6	54%	0.543	S	S	*	.	H	α-helix	trans	-63.1	-38.8	175.8	-177.7	179.7	-76	175	-5.8	112.6	L103 E104 Q111	L103-R107 WeakPolarHBondContact O-CB 3.45Å; L103-R107 PolarHBondContact O-N 2.99Å; E104-R107 WeakPolarHBondContact O-CB 3.32Å; E104-R107 PolarHBondContact O-N 3.01Å; R107-Q111 VanDerWaalsContact O-CG 3.3Å; R107-Q111 WeakPolarHBondContact O-CG 3.48Å; R107-Q111 PolarHBondContact O-N 2.97Å
108	M	38.7	Very low	42.6	Very low	123 Å²	123	109.9 Å²	109.9	61%	0.606	55%	0.548	S	S	*	.	H	α-helix	trans	-69.8	-40.7	176.7	-72.4	-179.4	-179	0	0	112.5	E104 H105 G106 A110 Q111	E104-M108 WeakPolarHBondContact O-CG 3.31Å; E104-M108 PolarHBondContact O-N 3.22Å; H105-M108 PolarHBondContact O-N 3.35Å; G106-M108 PolarHBondContact O-N 2.86Å; M108-A110 VanDerWaalsContact C-N 3.35Å; M108-Q111 PolarHBondContact O-N 3.36Å
109	M	30.9	Very low	42.2	Very low	122 Å²	122	111.2 Å²	111.2	60%	0.601	56%	0.564	S	S	*	*	H	α-helix	trans	-65.6	-39.2	176.2	-68.7	-63.7	175	0	0	111.6	H105 G106 Q111 N112	H105-M109 VanDerWaalsContact CE1-CE 3.47Å; H105-M109 WeakPolarHBondContact CE1-CE 3.42Å; H105-M109 WeakPolarHBondContact NE2-CE 3.34Å; H105-M109 WeakPolarHBondContact O-CG 3.48Å; H105-M109 PolarHBondContact O-N 3.01Å; G106-M109 PolarHBondContact O-N 2.86Å; M109-Q111 PolarHBondContact O-N 2.68Å; M109-N112 PolarHBondContact O-N 2.9Å
110	A	38.7	Very low	41.9	Very low	55 Å²	55	117.1 Å²	117.1	46%	0.455	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.5	-7.9	175	0	0	0	0	0	114.7	G106 M108 V119	G106-A110 WeakPolarHBondContact O-CB 3.21Å; G106-A110 PolarHBondContact O-N 3.27Å; M108-A110 VanDerWaalsContact C-N 3.35Å; A110-V119 HydrophobicContact CB-CG2 4.37Å
111	Q	44.9	Very low	41.5	Very low	148 Å²	148	119.3 Å²	119.3	69%	0.692	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-3.4	178.4	-80.6	174.5	-27.4	0	0	114	R107 M108 M109	R107-Q111 VanDerWaalsContact O-CG 3.3Å; R107-Q111 WeakPolarHBondContact O-CG 3.48Å; R107-Q111 PolarHBondContact O-N 2.97Å; M108-Q111 PolarHBondContact O-N 3.36Å; M109-Q111 PolarHBondContact O-N 2.68Å
112	N	42.5	Very low	40.9	Very low	143 Å²	143	123.4 Å²	123.4	77%	0.765	62%	0.621	S	S	*	*	S	Bend	trans	-112.1	6.1	-168.4	-149	16.5	0	0	0	115	M109	M109-N112 PolarHBondContact O-N 2.9Å
113	R	40.3	Very low	40.7	Very low	206 Å²	206	124.9 Å²	124.9	78%	0.777	63%	0.63	S	S	*	*	S	Bend	trans	-148.1	143.7	171.6	-85.7	-177.4	177.1	177.1	-2.3	111	D115	R113-D115 PolarHBondContact O-N 3.47Å
114	N	41.3	Very low	40	Very low	176 Å²	176	123.7 Å²	123.7	94%	0.941	62%	0.624	S	S	*	*	S	Bend	trans	-83.3	42.1	-174.2	-67.9	-13.4	0	0	0	113.9
115	D	44.6	Very low	39.4	Very low	84 Å²	84	123.1 Å²	123.1	45%	0.449	63%	0.627	S	S	.	*			trans	-126	102.4	174.3	-159.2	-28.1	0	0	0	112.1	R113 S117	R113-D115 PolarHBondContact O-N 3.47Å; D115-S117 PolarHBondContact O-N 2.93Å; D115-S117 WeakPolarHBondContact OD1-CA 3.48Å; D115-S117 WeakPolarHBondContact OD1-CB 3.09Å; D115-S117 PolarHBondContact OD1-N 3.26Å; D115-S117 PolarHBondContact OD1-OG 2.88Å
116	P	44.5	Very low	39.4	Very low	112 Å²	112	126 Å²	126	73%	0.727	64%	0.641	S	S	*	*	S	Bend	trans	-67.1	-7.5	174.9	-21.4	34.4	0	0	0	114.9
117	S	40.3	Very low	39.4	Very low	83 Å²	83	131.5 Å²	131.5	58%	0.58	66%	0.661	S	S	*	*	S	Bend	trans	-80.2	-43.3	-168.8	-43.2	0	0	0	0	113	D115 V119 K120	D115-S117 PolarHBondContact O-N 2.93Å; D115-S117 WeakPolarHBondContact OD1-CA 3.48Å; D115-S117 WeakPolarHBondContact OD1-CB 3.09Å; D115-S117 PolarHBondContact OD1-N 3.26Å; D115-S117 PolarHBondContact OD1-OG 2.88Å; S117-V119 PolarHBondContact O-N 3.18Å; S117-K120 WeakPolarHBondContact O-CB 3.36Å; S117-K120 PolarHBondContact O-N 2.95Å; S117-K120 VanDerWaalsContact O-N 3.13Å
118	E	40.3	Very low	38.9	Very low	125 Å²	125	128.4 Å²	128.4	58%	0.584	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-64.1	-21.8	-178	-68	-171.1	141	0	0	113.1	K120 E121	E118-K120 PolarHBondContact O-N 3.03Å; E118-E121 PolarHBondContact O-N 2.81Å
119	V	37	Very low	38.6	Very low	96 Å²	96	127.7 Å²	127.7	58%	0.582	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-57.4	-22.5	175.2	-174.6	0	0	0	0	111.9	A110 S117	A110-V119 HydrophobicContact CB-CG2 4.37Å; S117-V119 PolarHBondContact O-N 3.18Å
120	K	37.9	Very low	38.9	Very low	190 Å²	190	130.9 Å²	130.9	83%	0.826	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-82.1	-20.3	179.8	-140.4	174.4	-172	178.1	0	114.1	S117 E118	S117-K120 WeakPolarHBondContact O-CB 3.36Å; S117-K120 PolarHBondContact O-N 2.95Å; S117-K120 VanDerWaalsContact O-N 3.13Å; E118-K120 PolarHBondContact O-N 3.03Å
121	E	40.2	Very low	38.9	Very low	158 Å²	158	134.6 Å²	134.6	74%	0.738	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-11	-171.9	-160.5	162.3	-164	0	0	112.5	E118 L123	E118-E121 PolarHBondContact O-N 2.81Å; E121-L123 PolarHBondContact O-N 3.33Å
122	F	36.2	Very low	38.5	Very low	186 Å²	186	138.1 Å²	138.1	82%	0.816	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-3	-176.4	-135.1	-94.2	0	0	0	115.6
123	L	35.5	Very low	38.3	Very low	113 Å²	113	138.8 Å²	138.8	59%	0.592	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.6	61.7	176.3	-75	-179.9	0	0	0	110.7	E121 P125 W171	E121-L123 PolarHBondContact O-N 3.33Å; L123-P125 WeakPolarHBondContact O-CD 3.46Å; L123-W171 HydrophobicContact CD1-CH2 4.35Å; L123-W171 HydrophobicContact CD1-CZ2 3.71Å
124	D	32.2	Very low	38.1	Very low	92 Å²	92	139 Å²	139	49%	0.492	69%	0.693	S	S	.	*			trans	-68	114.2	177.8	-147.5	-18.7	0	0	0	110.6	E126 D127	D124-E126 PolarHBondContact O-N 2.65Å; D124-D127 PolarHBondContact O-N 2.93Å
125	P	37.3	Very low	37.8	Very low	72 Å²	72	138.2 Å²	138.2	47%	0.468	69%	0.689	S	S	.	*	G	3₁₀ helix	trans	-69.3	-20.3	-172.1	-19.8	34.1	0	0	0	113.3	L123 V128 W171	L123-P125 WeakPolarHBondContact O-CD 3.46Å; P125-V128 PolarHBondContact O-N 2.99Å; P125-W171 HydrophobicContact CB-CB 4.38Å; P125-W171 HydrophobicContact CG-CB 4.43Å
126	E	38.6	Very low	37.4	Very low	162 Å²	162	143 Å²	143	76%	0.757	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-79	-23.9	-177.1	-57.2	-162.2	170.6	0	0	112.7	D124 V128 N129	D124-E126 PolarHBondContact O-N 2.65Å; E126-V128 PolarHBondContact O-N 3.31Å; E126-N129 VanDerWaalsContact O-CB 3.32Å; E126-N129 WeakPolarHBondContact O-CB 3.37Å; E126-N129 PolarHBondContact O-N 2.81Å
127	D	37.8	Very low	37	Very low	156 Å²	156	147.9 Å²	147.9	83%	0.834	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-77.2	-1.3	175	-118.2	16.2	0	0	0	112.9	D124	D124-D127 PolarHBondContact O-N 2.93Å
128	V	37.6	Very low	36.8	Very low	94 Å²	94	148 Å²	148	57%	0.57	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-104.9	26.9	172.6	-155.4	0	0	0	0	111.5	P125 E126 F130	P125-V128 PolarHBondContact O-N 2.99Å; E126-V128 PolarHBondContact O-N 3.31Å; V128-F130 HydrophobicContact CG1-CD2 4.03Å; V128-F130 HydrophobicContact CG1-CE2 3.8Å; V128-F130 WeakPolarHBondContact O-CD2 3.42Å; V128-F130 PolarHBondContact O-N 2.7Å
129	N	33.1	Very low	36.4	Very low	108 Å²	108	145.6 Å²	145.6	58%	0.578	74%	0.738	S	S	*	*			trans	-68.8	87	-179.2	-168.5	-30.3	0	0	0	113.1	E126 D131	E126-N129 VanDerWaalsContact O-CB 3.32Å; E126-N129 WeakPolarHBondContact O-CB 3.37Å; E126-N129 PolarHBondContact O-N 2.81Å; N129-D131 VanDerWaalsContact C-N 3.26Å; N129-D131 WeakPolarHBondContact OD1-CB 3.44Å; N129-D131 PolarHBondContact OD1-N 3.47Å
130	F	35.7	Very low	36.4	Very low	189 Å²	189	147.4 Å²	147.4	83%	0.829	75%	0.752	S	S	*	*			trans	-80.1	-1.6	167.6	-77.5	-77.9	0	0	0	113.8	V128 R132	V128-F130 HydrophobicContact CG1-CD2 4.03Å; V128-F130 HydrophobicContact CG1-CE2 3.8Å; V128-F130 WeakPolarHBondContact O-CD2 3.42Å; V128-F130 PolarHBondContact O-N 2.7Å; F130-R132 PolarHBondContact O-N 2.84Å
131	D	38.3	Very low	36	Very low	133 Å²	133	148 Å²	148	71%	0.711	75%	0.749	S	S	*	*			trans	-87.3	-8.8	-159.3	-146.7	1.3	0	0	0	113.8	N129 D133	N129-D131 VanDerWaalsContact C-N 3.26Å; N129-D131 WeakPolarHBondContact OD1-CB 3.44Å; N129-D131 PolarHBondContact OD1-N 3.47Å; D131-D133 PolarHBondContact O-N 2.69Å
132	R	38	Very low	35.8	Very low	222 Å²	222	148.1 Å²	148.1	84%	0.838	75%	0.754	S	S	*	*	S	Bend	trans	-100.7	48.4	-170.7	-151.8	-173.5	68.2	-159.1	-3.1	115.6	F130	F130-R132 PolarHBondContact O-N 2.84Å
133	D	37.4	Very low	35.9	Very low	157 Å²	157	144.9 Å²	144.9	84%	0.84	75%	0.745	S	S	*	*	S	Bend	trans	-160.1	-16.9	160.8	-115.8	-15	0	0	0	114.3	D131 N135	D131-D133 PolarHBondContact O-N 2.69Å; D133-N135 PolarHBondContact O-N 2.75Å
134	W	36.6	Very low	36	Very low	210 Å²	210	146.2 Å²	146.2	80%	0.795	75%	0.753	S	S	*	*			trans	-74.6	-23.4	-167.5	-160.4	-114	0	0	0	115.1	K136	W134-K136 PolarHBondContact O-N 2.84Å
135	N	35.2	Very low	36.1	Very low	160 Å²	160	149.1 Å²	149.1	86%	0.856	77%	0.768	S	S	*	*	S	Bend	trans	-81.9	35.6	-166.8	-143.3	-15.7	0	0	0	114.7	D133	D133-N135 PolarHBondContact O-N 2.75Å
136	K	36	Very low	35.9	Very low	186 Å²	186	151.4 Å²	151.4	81%	0.809	78%	0.782	S	S	*	*	S	Bend	trans	-138.5	106.9	176.5	-76	-177.8	178.3	170.5	0	112	W134	W134-K136 PolarHBondContact O-N 2.84Å
137	K	36.4	Very low	35.4	Very low	214 Å²	214	152.7 Å²	152.7	93%	0.93	79%	0.788	S	S	*	*	S	Bend	trans	92.9	52.1	171.1	-53	-179.6	-179.5	179.7	0	118.6
138	G	34.5	Very low	35.3	Very low	84 Å²	84	153 Å²	153	87%	0.866	79%	0.79	S	S	*	*				55.1	112.9	117.7	0	0	0	0	0	122.5
139	G	33.7	Very low	34.9	Very low	75 Å²	75	156 Å²	156	77%	0.773	80%	0.803	S	S	*	*			trans	99.5	163.7	146.8	0	0	0	0	0	117
140	P	35.3	Very low	35	Very low	135 Å²	135	154.7 Å²	154.7	88%	0.877	82%	0.815	S	S	*	*			cis	-101.6	-175.8	-2.3	39.3	-32.2	0	0	0	113.6
141	R	30.1	Very low	34.7	Very low	203 Å²	203	149.9 Å²	149.9	77%	0.766	82%	0.819	S	S	*	*			trans	-76.8	159.3	175.4	-73.3	170.8	115.9	106.1	-0.1	112.1	D143	R141-D143 WeakPolarHBondContact CB-OD2 3.48Å; R141-D143 WeakPolarHBondContact CD-OD2 3.29Å; R141-D143 IonicContact CZ-OD2 2.83Å; R141-D143 IonicContact NE-OD2 3.59Å; R141-D143 PolarHBondContact NE-OD2 2.89Å
142	L	36.6	Very low	34.3	Very low	159 Å²	159	147 Å²	147	83%	0.832	82%	0.821	S	S	*	*			trans	-114.7	53.7	172.6	-166.5	76.5	0	0	0	110.4
143	D	37.4	Very low	34	Very low	119 Å²	119	145.9 Å²	145.9	64%	0.636	82%	0.824	S	S	*	*			trans	-97.1	4.5	178.6	-64.1	-45.3	0	0	0	112	R141	R141-D143 WeakPolarHBondContact CB-OD2 3.48Å; R141-D143 WeakPolarHBondContact CD-OD2 3.29Å; R141-D143 IonicContact CZ-OD2 2.83Å; R141-D143 IonicContact NE-OD2 3.59Å; R141-D143 PolarHBondContact NE-OD2 2.89Å
144	D	37.4	Very low	33.7	Very low	141 Å²	141	142.5 Å²	142.5	75%	0.754	82%	0.819	S	S	*	*	S	Bend	trans	-119.1	5.4	-156.5	-80.9	-48.8	0	0	0	117.6
145	L	35.3	Very low	33.4	Very low	153 Å²	153	140 Å²	140	80%	0.801	83%	0.826	S	S	*	*	S	Bend	trans	-135.3	148.9	-179	-73.5	176.4	0	0	0	114.3
146	P	32.2	Very low	33.2	Very low	120 Å²	120	138.1 Å²	138.1	78%	0.779	82%	0.816	S	S	*	*			trans	-94.1	156.6	-145.1	-8.8	28.8	0	0	0	116
147	Q	29.4	Very low	33	Very low	188 Å²	188	138.3 Å²	138.3	88%	0.879	82%	0.82	S	S	*	*			trans	-66.5	152.2	164.1	-63.9	166.1	-64.2	0	0	110.9
148	N	34.3	Very low	32.7	Very low	164 Å²	164	136.5 Å²	136.5	88%	0.877	82%	0.815	S	S	*	*			trans	-148.9	117.2	165	-157.1	28.5	0	0	0	109.9
149	D	30.3	Very low	32.7	Very low	156 Å²	156	140.5 Å²	140.5	83%	0.834	82%	0.815	S	S	*	*			trans	-81.7	153.6	178.7	-68.1	-64.5	0	0	0	111.9
150	G	34.7	Very low	32.4	Very low	80 Å²	80	139.9 Å²	139.9	83%	0.825	81%	0.809	S	S	*	*			trans	157.3	97.1	174.3	0	0	0	0	0	113.6
151	G	29.9	Very low	32.1	Very low	89 Å²	89	140.9 Å²	140.9	92%	0.918	81%	0.807	S	S	*	*			trans	-79.5	160.2	177.1	0	0	0	0	0	113.9
152	G	29.8	Very low	32	Very low	73 Å²	73	139.6 Å²	139.6	75%	0.753	80%	0.802	S	S	*	*			trans	-163.3	70.4	-175.2	0	0	0	0	0	115.8
153	H	32.4	Very low	31.7	Very low	197 Å²	197	139.9 Å²	139.9	91%	0.912	81%	0.805	S	S	*	*			trans	50.1	119.7	158.7	-71.7	-82.8	0	0	0	121.4
154	A	29.4	Very low	31.8	Very low	87 Å²	87	139.3 Å²	139.3	72%	0.719	80%	0.802	S	S	*	*			trans	-70.9	154.5	175.4	0	0	0	0	0	115.1
155	V	31.7	Very low	32.2	Very low	158 Å²	158	136.4 Å²	136.4	96%	0.958	79%	0.792	S	S	*	*			trans	-129.8	96.7	137	179.5	0	0	0	0	106.6
156	D	30.3	Very low	32.6	Very low	120 Å²	120	136 Å²	136	64%	0.642	79%	0.791	S	S	*	*			trans	-135.3	108.2	-178.1	-173.8	7.8	0	0	0	110.2
157	Q	32.3	Very low	33.2	Very low	190 Å²	190	133.9 Å²	133.9	89%	0.888	78%	0.776	S	S	*	*			trans	-165.6	61	175.6	-133.7	175.7	45.2	0	0	114.6
158	Q	30.3	Very low	33.6	Very low	175 Å²	175	127 Å²	127	82%	0.818	75%	0.746	S	S	*	*	S	Bend	trans	-162.3	16.9	135.9	-135.8	160.8	7.7	0	0	116.4	G160	Q158-G160 VanDerWaalsContact C-N 3.32Å; Q158-G160 PolarHBondContact O-N 3.23Å
159	L	33.3	Very low	34	Very low	169 Å²	169	122.1 Å²	122.1	89%	0.885	72%	0.724	S	S	*	*			trans	-93.9	58.6	172.5	-72.9	170	0	0	0	111.4
160	G	27.6	Very low	34.6	Very low	62 Å²	62	118.6 Å²	118.6	64%	0.639	72%	0.716	S	S	*	*			trans	-75.6	147.2	168.7	0	0	0	0	0	111.5	Q158	Q158-G160 VanDerWaalsContact C-N 3.32Å; Q158-G160 PolarHBondContact O-N 3.23Å
161	D	28.3	Very low	35.1	Very low	156 Å²	156	119.6 Å²	119.6	83%	0.834	70%	0.696	S	S	*	*	S	Bend	trans	54.5	87.1	169.5	-53.4	-27.3	0	0	0	116.8
162	W	29.5	Very low	35.6	Very low	175 Å²	175	118.7 Å²	118.7	66%	0.663	67%	0.665	S	S	*	*			trans	-158.7	43.8	138.6	-120.8	62.7	0	0	0	111.8	T167	W162-T167 HydrophobicContact CH2-CG2 4.44Å; W162-T167 HydrophobicContact CZ2-CG2 4.47Å
163	N	30.9	Very low	36.4	Very low	166 Å²	166	119.5 Å²	119.5	89%	0.888	65%	0.648	S	S	*	*			trans	-101.9	17.2	178.7	-161.1	31.2	0	0	0	113.1
164	D	37.6	Very low	37.1	Very low	107 Å²	107	113.7 Å²	113.7	57%	0.572	62%	0.621	S	S	*	*			trans	-80.7	140.2	176.8	-161.8	-9.3	0	0	0	110.7	N166	D164-N166 VanDerWaalsContact C-N 3.29Å; D164-N166 PolarHBondContact O-N 2.96Å
165	S	45.9	Very low	37.7	Very low	80 Å²	80	113.1 Å²	113.1	56%	0.559	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-19.2	-162.6	59.6	0	0	0	0	114.5	K173	S165-K173 PolarHBondContact O-NZ 3.19Å; S165-K173 VanDerWaalsContact O-NZ 3.12Å
166	N	44.8	Very low	38.6	Very low	145 Å²	145	110 Å²	110	78%	0.775	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-12.8	-166.8	-72.1	-33.8	0	0	0	116.2	D164	D164-N166 VanDerWaalsContact C-N 3.29Å; D164-N166 PolarHBondContact O-N 2.96Å
167	T	43.9	Very low	39.5	Very low	75 Å²	75	111 Å²	111	46%	0.46	57%	0.572	S	S	.	*	S	Bend	trans	-110.4	-4.5	-175.2	43.3	0	0	0	0	115.2	W162 P169	W162-T167 HydrophobicContact CH2-CG2 4.44Å; W162-T167 HydrophobicContact CZ2-CG2 4.47Å; T167-P169 WeakPolarHBondContact O-CD 3.4Å
168	T	39.2	Very low	40.4	Very low	42 Å²	42	106.3 Å²	106.3	26%	0.258	55%	0.553	S	S	.	*	S	Bend	trans	-92.4	113.3	173.3	22.3	0	0	0	0	110.9	K173	T168-K173 PolarHBondContact O-NZ 2.82Å; T168-K173 WeakPolarHBondContact OG1-CE 3.38Å; T168-K173 PolarHBondContact OG1-NZ 3.27Å
169	P	42	Very low	41.1	Very low	62 Å²	62	102.9 Å²	102.9	40%	0.403	54%	0.541	S	S	.	.			trans	-57.4	144.2	-178.4	-25.9	35.2	0	0	0	113.2	T167 W171 Y172 K173	T167-P169 WeakPolarHBondContact O-CD 3.4Å; P169-W171 VanDerWaalsContact C-N 3.25Å; P169-W171 HydrophobicContact CB-CG 4.25Å; P169-W171 PolarHBondContact O-N 2.92Å; P169-Y172 WeakPolarHBondContact O-CB 3.14Å; P169-Y172 PolarHBondContact O-N 2.86Å; P169-K173 PolarHBondContact O-N 3.3Å
170	A	42.8	Very low	42	Very low	82 Å²	82	105.1 Å²	105.1	68%	0.678	54%	0.537	S	S	*	.	H	α-helix	trans	-58.2	-37.3	-179.9	0	0	0	0	0	112.6	Y172 K173 Q174	A170-Y172 VanDerWaalsContact C-N 3.28Å; A170-Y172 PolarHBondContact O-N 2.88Å; A170-K173 PolarHBondContact O-N 3.09Å; A170-Q174 WeakPolarHBondContact O-CB 3.37Å; A170-Q174 PolarHBondContact O-N 2.89Å
171	W	44.3	Very low	42.7	Very low	102 Å²	102	109.9 Å²	109.9	39%	0.386	54%	0.543	S	S	.	.	H	α-helix	trans	-64.1	-30.2	175.7	73.9	-104.7	0	0	0	112.7	L123 P125 P169 Q174 F175	L123-W171 HydrophobicContact CD1-CH2 4.35Å; L123-W171 HydrophobicContact CD1-CZ2 3.71Å; P125-W171 HydrophobicContact CB-CB 4.38Å; P125-W171 HydrophobicContact CG-CB 4.43Å; P169-W171 VanDerWaalsContact C-N 3.25Å; P169-W171 HydrophobicContact CB-CG 4.25Å; P169-W171 PolarHBondContact O-N 2.92Å; W171-Q174 WeakPolarHBondContact O-CB 3.33Å; W171-Q174 PolarHBondContact O-N 2.96Å; W171-F175 VanDerWaalsContact O-CB 3.32Å; W171-F175 WeakPolarHBondContact O-CB 3.49Å; W171-F175 PolarHBondContact O-N 2.89Å
172	Y	40.9	Very low	43.1	Very low	69 Å²	69	106.5 Å²	106.5	27%	0.271	55%	0.545	S	S	.	.	H	α-helix	trans	-72.3	-45	177.2	-173.1	-86.8	0	0	0	110.7	P169 A170 Q174 F175 E176	P169-Y172 WeakPolarHBondContact O-CB 3.14Å; P169-Y172 PolarHBondContact O-N 2.86Å; A170-Y172 VanDerWaalsContact C-N 3.28Å; A170-Y172 PolarHBondContact O-N 2.88Å; Y172-Q174 PolarHBondContact O-N 2.62Å; Y172-F175 PolarHBondContact O-N 2.85Å; Y172-E176 HydrophobicContact CD1-CG 4.39Å; Y172-E176 HydrophobicContact CE1-CG 3.83Å; Y172-E176 WeakPolarHBondContact CE1-OE1 3.36Å; Y172-E176 VanDerWaalsContact CZ-OE1 3.24Å; Y172-E176 PolarHBondContact O-N 2.82Å; Y172-E176 PolarHBondContact OH-OE1 2.87Å
173	K	46.7	Very low	43.5	Very low	90 Å²	90	106.8 Å²	106.8	39%	0.391	55%	0.551	S	S	.	*	H	α-helix	trans	-64.1	-17	171.2	-72.2	171.2	175.7	149.7	0	113.4	S165 T168 P169 A170 R177	S165-K173 PolarHBondContact O-NZ 3.19Å; S165-K173 VanDerWaalsContact O-NZ 3.12Å; T168-K173 PolarHBondContact O-NZ 2.82Å; T168-K173 WeakPolarHBondContact OG1-CE 3.38Å; T168-K173 PolarHBondContact OG1-NZ 3.27Å; P169-K173 PolarHBondContact O-N 3.3Å; A170-K173 PolarHBondContact O-N 3.09Å; K173-R177 PolarHBondContact O-NE 2.8Å; K173-R177 PolarHBondContact O-NH2 2.87Å
174	Q	47.5	Very low	43.9	Very low	75 Å²	75	103.2 Å²	103.2	35%	0.35	54%	0.539	S	S	.	.	H	α-helix	trans	-84.1	-53.6	171.6	-175.9	57.9	47.6	0	0	110.3	A170 W171 Y172 E176 R177 D178	A170-Q174 WeakPolarHBondContact O-CB 3.37Å; A170-Q174 PolarHBondContact O-N 2.89Å; W171-Q174 WeakPolarHBondContact O-CB 3.33Å; W171-Q174 PolarHBondContact O-N 2.96Å; Y172-Q174 PolarHBondContact O-N 2.62Å; Q174-E176 VanDerWaalsContact C-N 3.3Å; Q174-E176 PolarHBondContact O-N 2.85Å; Q174-R177 WeakPolarHBondContact O-CA 3.43Å; Q174-R177 WeakPolarHBondContact O-CB 3.46Å; Q174-R177 PolarHBondContact O-N 2.74Å; Q174-R177 VanDerWaalsContact OE1-CZ 3.3Å; Q174-D178 WeakPolarHBondContact CG-OD2 3.36Å; Q174-D178 VanDerWaalsContact NE2-CG 3.27Å; Q174-D178 PolarHBondContact NE2-OD1 2.86Å; Q174-D178 PolarHBondContact NE2-OD2 3.08Å; Q174-D178 PolarHBondContact O-N 3.22Å
175	F	42.1	Very low	43.9	Very low	76 Å²	76	105.5 Å²	105.5	33%	0.333	55%	0.551	S	S	.	*	H	α-helix	trans	-53.6	-39.4	177.5	175.8	-91.2	0	0	0	113.7	W171 Y172 R177 D178 N179	W171-F175 VanDerWaalsContact O-CB 3.32Å; W171-F175 WeakPolarHBondContact O-CB 3.49Å; W171-F175 PolarHBondContact O-N 2.89Å; Y172-F175 PolarHBondContact O-N 2.85Å; F175-R177 VanDerWaalsContact C-N 3.33Å; F175-D178 PolarHBondContact O-N 2.96Å; F175-N179 WeakPolarHBondContact CD2-ND2 3.36Å; F175-N179 VanDerWaalsContact CE2-ND2 3.29Å; F175-N179 WeakPolarHBondContact CE2-ND2 2.99Å; F175-N179 WeakPolarHBondContact CZ-ND2 3.49Å; F175-N179 WeakPolarHBondContact O-CB 3.46Å; F175-N179 PolarHBondContact O-N 3.34Å; F175-N179 PolarHBondContact O-ND2 3.02Å
176	E	49.8	Very low	43.4	Very low	92 Å²	92	106.1 Å²	106.1	43%	0.43	56%	0.555	S	S	.	*	H	α-helix	trans	-70.7	-25.4	174.2	-71.7	-166	158.7	0	0	114	Y172 Q174 R180	Y172-E176 HydrophobicContact CD1-CG 4.39Å; Y172-E176 HydrophobicContact CE1-CG 3.83Å; Y172-E176 WeakPolarHBondContact CE1-OE1 3.36Å; Y172-E176 VanDerWaalsContact CZ-OE1 3.24Å; Y172-E176 PolarHBondContact O-N 2.82Å; Y172-E176 PolarHBondContact OH-OE1 2.87Å; Q174-E176 VanDerWaalsContact C-N 3.3Å; Q174-E176 PolarHBondContact O-N 2.85Å; E176-R180 WeakPolarHBondContact O-CG 3.31Å
177	R	50.7	Low	42.8	Very low	140 Å²	140	104.5 Å²	104.5	53%	0.528	56%	0.555	S	S	.	*	H	α-helix	trans	-72.7	-44	174.1	-135.7	178.7	-54.4	129.4	17.1	110.3	K173 Q174 F175 R180	K173-R177 PolarHBondContact O-NE 2.8Å; K173-R177 PolarHBondContact O-NH2 2.87Å; Q174-R177 WeakPolarHBondContact O-CA 3.43Å; Q174-R177 WeakPolarHBondContact O-CB 3.46Å; Q174-R177 PolarHBondContact O-N 2.74Å; Q174-R177 VanDerWaalsContact OE1-CZ 3.3Å; F175-R177 VanDerWaalsContact C-N 3.33Å; R177-R180 PolarHBondContact O-N 3.2Å
178	D	51.1	Low	42.7	Very low	92 Å²	92	112.4 Å²	112.4	49%	0.492	58%	0.576	S	S	.	*	H	α-helix	trans	-73.2	-33.9	-176.2	-56.4	-32.4	0	0	0	111.8	Q174 F175 R180	Q174-D178 WeakPolarHBondContact CG-OD2 3.36Å; Q174-D178 VanDerWaalsContact NE2-CG 3.27Å; Q174-D178 PolarHBondContact NE2-OD1 2.86Å; Q174-D178 PolarHBondContact NE2-OD2 3.08Å; Q174-D178 PolarHBondContact O-N 3.22Å; F175-D178 PolarHBondContact O-N 2.96Å; D178-R180 VanDerWaalsContact C-N 3.32Å; D178-R180 PolarHBondContact O-N 2.98Å
179	N	44.9	Very low	42.9	Very low	104 Å²	104	121.6 Å²	121.6	56%	0.556	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-5.9	174.8	-77	-88.9	0	0	0	114.7	F175 Q181	F175-N179 WeakPolarHBondContact CD2-ND2 3.36Å; F175-N179 VanDerWaalsContact CE2-ND2 3.29Å; F175-N179 WeakPolarHBondContact CE2-ND2 2.99Å; F175-N179 WeakPolarHBondContact CZ-ND2 3.49Å; F175-N179 WeakPolarHBondContact O-CB 3.46Å; F175-N179 PolarHBondContact O-N 3.34Å; F175-N179 PolarHBondContact O-ND2 3.02Å; N179-Q181 PolarHBondContact O-N 2.88Å
180	R	51.8	Low	42.7	Very low	216 Å²	216	122.7 Å²	122.7	82%	0.815	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-10.5	171.6	-83.2	-179.4	-174.8	-144.4	3.1	113.3	E176 R177 D178	E176-R180 WeakPolarHBondContact O-CG 3.31Å; R177-R180 PolarHBondContact O-N 3.2Å; D178-R180 VanDerWaalsContact C-N 3.32Å; D178-R180 PolarHBondContact O-N 2.98Å
181	Q	43.1	Very low	42.8	Very low	162 Å²	162	126.2 Å²	126.2	76%	0.757	61%	0.609	S	S	*	*	S	Bend	trans	-98.2	118.3	174.4	-59.6	-168.4	8.5	0	0	110.1	N179 F183	N179-Q181 PolarHBondContact O-N 2.88Å; Q181-F183 PolarHBondContact O-N 3.23Å; Q181-F183 VanDerWaalsContact O-N 3.07Å
182	G	36.3	Very low	43.2	Very low	85 Å²	85	125.5 Å²	125.5	88%	0.876	62%	0.62	S	S	*	*			trans	-68.3	102.9	-165.7	0	0	0	0	0	114.8
183	F	38.1	Very low	44.3	Very low	180 Å²	180	127.1 Å²	127.1	79%	0.789	63%	0.632	S	S	*	*			trans	-83.6	118	178.7	-159.5	-90.1	0	0	0	112.3	Q181 L185	Q181-F183 PolarHBondContact O-N 3.23Å; Q181-F183 VanDerWaalsContact O-N 3.07Å; F183-L185 PolarHBondContact O-N 2.88Å
184	S	39.2	Very low	45.3	Very low	91 Å²	91	123.5 Å²	123.5	64%	0.636	62%	0.62	S	S	*	*			trans	-77.1	111.2	-175.7	78.1	0	0	0	0	113.3	S186	S184-S186 PolarHBondContact O-N 3.23Å
185	L	37.7	Very low	46.5	Very low	156 Å²	156	121.2 Å²	121.2	82%	0.817	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	81	176.5	-74.5	161.1	0	0	0	111.8	F183	F183-L185 PolarHBondContact O-N 2.88Å
186	S	34.2	Very low	48.6	Very low	93 Å²	93	117.8 Å²	117.8	65%	0.65	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.2	-19.6	-178	67.6	0	0	0	0	117.9	S184	S184-S186 PolarHBondContact O-N 3.23Å
187	S	32.9	Very low	50.3	Low	110 Å²	110	117.5 Å²	117.5	77%	0.769	60%	0.595	S	S	*	*			trans	-155.7	88.5	-177.7	-85.1	0	0	0	0	116.4
188	R	42.3	Very low	52.1	Low	241 Å²	241	112.2 Å²	112.2	91%	0.909	58%	0.575	S	S	*	*	S	Bend	trans	-152.6	169	141.7	-106.1	163.3	-162.5	-152.1	3.2	109
189	R	42.8	Very low	53.8	Low	236 Å²	236	109.6 Å²	109.6	89%	0.891	56%	0.564	S	S	*	*			trans	-70.3	144.2	-156.2	-64.2	174.4	-175	149.3	2.6	113.4	F191	R189-F191 VanDerWaalsContact C-N 3.26Å; R189-F191 PolarHBondContact O-N 2.56Å
190	D	37.5	Very low	55.4	Low	85 Å²	85	109.5 Å²	109.5	46%	0.455	56%	0.559	S	S	.	*			trans	-69.1	61.7	-170.7	-166.5	19.1	0	0	0	114.4	R20	R20-D190 IonicContact CZ-OD1 2.65Å; R20-D190 IonicContact CZ-OD2 3.48Å; R20-D190 IonicContact NH1-OD1 3.22Å; R20-D190 PolarHBondContact NH1-OD1 3.45Å; R20-D190 IonicContact NH1-OD2 2.68Å; R20-D190 PolarHBondContact NH1-OD2 3.35Å; R20-D190 IonicContact NH2-OD1 3.54Å; R20-D190 IonicContact NH2-OD2 3.3Å; R20-D190 PolarHBondContact NH2-OD2 2.7Å
191	F	44.6	Very low	56.5	Low	155 Å²	155	100.7 Å²	100.7	68%	0.68	53%	0.53	S	S	*	.			trans	-105.7	103.8	165.8	-94	-95.4	0	0	0	109.1	R189 L193 E226	R189-F191 VanDerWaalsContact C-N 3.26Å; R189-F191 PolarHBondContact O-N 2.56Å; F191-L193 PolarHBondContact O-N 2.84Å; F191-E226 HydrophobicContact CB-CG 4.34Å; F191-E226 HydrophobicContact CD1-CG 4.28Å; F191-E226 WeakPolarHBondContact CD1-OE2 3.42Å
192	S	52.9	Low	58.1	Low	88 Å²	88	97.1 Å²	97.1	62%	0.615	51%	0.513	S	S	*	.			trans	-72	96.8	177.3	56.4	0	0	0	0	110.3
193	L	64.4	Low	59.8	Low	102 Å²	102	98.5 Å²	98.5	53%	0.534	51%	0.509	S	S	.	.			trans	-44.7	136.8	166	-73.6	158.3	0	0	0	110.6	F191 E226 Y278	F191-L193 PolarHBondContact O-N 2.84Å; L193-E226 WeakPolarHBondContact CA-O 3.44Å; L193-E226 HydrophobicContact CD2-CG 4.02Å; L193-E226 HydrophobicContact CG-CG 4.41Å; L193-Y278 HydrophobicContact CB-CE2 3.69Å; L193-Y278 HydrophobicContact CD2-CE2 3.79Å; L193-Y278 HydrophobicContact CG-CE2 4.29Å
194	G	67.6	Low	61.7	Low	14 Å²	14	94.2 Å²	94.2	14%	0.144	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.8	172.1	-179.8	0	0	0	0	0	114.5	E226 N276 Y278	G194-E226 PolarHBondContact N-O 2.8Å; G194-E226 PolarHBondContact O-N 2.74Å; G194-N276 PolarHBondContact O-ND2 2.79Å; G194-Y278 VanDerWaalsContact C-CB 3.45Å
195	A	73.6	Confident	63.6	Low	27 Å²	27	90.8 Å²	90.8	22%	0.223	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.6	162	-175.3	0	0	0	0	0	113.1	R10 N276 Y278	R10-A195 PolarHBondContact NH1-O 2.77Å; R10-A195 PolarHBondContact NH2-O 2.93Å; A195-N276 WeakPolarHBondContact CA-OD1 3.34Å; A195-Y278 WeakPolarHBondContact CB-O 3.38Å; A195-Y278 VanDerWaalsContact N-CB 3.29Å
196	P	85.4	Confident	65.6	Low	4 Å²	4	87.8 Å²	87.8	3%	0.026	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	161.1	168.9	27.3	-35.1	0	0	0	112.9	N224 P229 V274 G279 I281	P196-N224 CarbonylContact C-O 3.51Å; P196-N224 VanDerWaalsContact CA-O 3.27Å; P196-N224 WeakPolarHBondContact CA-O 3.2Å; P196-P229 HydrophobicContact CB-CB 3.96Å; P196-P229 HydrophobicContact CB-CG 4.05Å; P196-V274 HydrophobicContact CB-CB 4.48Å; P196-V274 HydrophobicContact CB-CG1 3.65Å; P196-V274 HydrophobicContact CG-CG1 4.2Å; P196-V274 WeakPolarHBondContact CG-O 3.15Å; P196-G279 WeakPolarHBondContact CD-O 3.39Å; P196-I281 HydrophobicContact CB-CD1 3.88Å; P196-I281 HydrophobicContact CB-CG1 4.04Å; P196-I281 HydrophobicContact CG-CD1 4.29Å; P196-I281 HydrophobicContact CG-CG1 3.95Å; P196-I281 HydrophobicContact CG-CG2 4.35Å
197	Y	85.4	Confident	68	Low	86 Å²	86	90 Å²	90	34%	0.337	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	149.2	169.8	66.5	-73.5	0	0	0	110.2	R10 A223 N224	R10-Y197 HydrophobicContact CG-CD2 4.32Å; R10-Y197 HydrophobicContact CG-CG 4.09Å; R10-Y197 VanDerWaalsContact CZ-CD1 3.49Å; Y197-A223 CarbonylContact O-C 3.59Å; Y197-A223 VanDerWaalsContact O-CA 3.27Å; Y197-A223 WeakPolarHBondContact O-CA 3.41Å; Y197-A223 WeakPolarHBondContact O-CB 3.22Å; Y197-N224 HydrophobicContact CD1-CB 4.09Å; Y197-N224 WeakPolarHBondContact CD1-O 3.49Å; Y197-N224 HydrophobicContact CE1-CB 3.49Å; Y197-N224 VanDerWaalsContact CE1-CB 3.49Å; Y197-N224 HydrophobicContact CE2-CB 4.1Å; Y197-N224 PolarHBondContact N-O 3.17Å; Y197-N224 PolarHBondContact O-N 2.89Å
198	W	88.7	Confident	70.4	Confident	29 Å²	29	89 Å²	89	11%	0.11	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	137.1	176.6	-56.4	128.6	0	0	0	111.8	K200 F205 C221 A223 V274 I281 H283	W198-K200 VanDerWaalsContact C-N 3.27Å; W198-K200 CarbonylContact C-O 3.56Å; W198-K200 WeakPolarHBondContact CB-O 3.15Å; W198-K200 PolarHBondContact O-N 3.1Å; W198-F205 HydrophobicContact CB-CE2 3.87Å; W198-F205 HydrophobicContact CB-CZ 4.16Å; W198-F205 AromaticContact CD2-CE2 3.73Å; W198-F205 HydrophobicContact CD2-CE2 3.73Å; W198-F205 HydrophobicContact CD2-CZ 4.25Å; W198-F205 HydrophobicContact CE3-CE2 4.03Å; W198-F205 HydrophobicContact CE3-CZ 4.13Å; W198-F205 AromaticContact CG-CE2 3.65Å; W198-F205 HydrophobicContact CG-CE2 3.65Å; W198-F205 HydrophobicContact CG-CZ 4.28Å; W198-C221 HydrophobicContact CH2-CB 4.33Å; W198-C221 HydrophobicContact CZ3-CB 3.81Å; W198-C221 WeakPolarHBondContact CZ3-O 2.98Å; W198-A223 HydrophobicContact CE3-CB 3.98Å; W198-A223 HydrophobicContact CZ3-CB 4.2Å; W198-V274 HydrophobicContact CH2-CG2 4.02Å; W198-V274 HydrophobicContact CZ3-CB 4.42Å; W198-V274 HydrophobicContact CZ3-CG2 3.7Å; W198-I281 HydrophobicContact CD2-CD1 3.59Å; W198-I281 HydrophobicContact CD2-CG1 4.39Å; W198-I281 HydrophobicContact CE3-CD1 3.7Å; W198-I281 HydrophobicContact CE3-CG1 4.43Å; W198-I281 HydrophobicContact CG-CD1 4.17Å; W198-I281 HydrophobicContact CH2-CB 4.44Å; W198-I281 HydrophobicContact CH2-CD1 3.92Å; W198-I281 HydrophobicContact CH2-CG1 3.73Å; W198-I281 HydrophobicContact CZ2-CB 3.95Å; W198-I281 HydrophobicContact CZ2-CD1 3.82Å; W198-I281 HydrophobicContact CZ2-CG1 3.67Å; W198-I281 HydrophobicContact CZ3-CD1 3.86Å; W198-I281 HydrophobicContact CZ3-CG1 4.12Å; W198-H283 HydrophobicContact CH2-CB 3.97Å; W198-H283 HydrophobicContact CZ2-CB 3.63Å
199	S	86.3	Confident	72.4	Confident	37 Å²	37	78.2 Å²	78.2	26%	0.259	40%	0.401	S	S	.	.	S	Bend	trans	-72.9	-22.8	178.1	66.9	0	0	0	0	113.2	R222 N224	S199-R222 VanDerWaalsContact CB-O 3.26Å; S199-R222 WeakPolarHBondContact CB-O 3.4Å; S199-R222 PolarHBondContact N-O 2.99Å; S199-R222 WeakPolarHBondContact OG-CB 3.38Å; S199-R222 WeakPolarHBondContact OG-CG 3.43Å; S199-R222 PolarHBondContact OG-O 3.29Å; S199-N224 WeakPolarHBondContact CB-OD1 3.39Å
200	K	77.8	Confident	74.3	Confident	103 Å²	103	70.2 Å²	70.2	45%	0.448	39%	0.385	S	S	.	.	S	Bend	trans	-114.6	159.6	171.5	-86.3	170.6	164.6	-98.2	0	108.7	W198 E204 F205	W198-K200 VanDerWaalsContact C-N 3.27Å; W198-K200 CarbonylContact C-O 3.56Å; W198-K200 WeakPolarHBondContact CB-O 3.15Å; W198-K200 PolarHBondContact O-N 3.1Å; K200-E204 HydrophobicContact CB-CB 4.36Å; K200-E204 IonicContact NZ-OE2 3.21Å; K200-E204 PolarHBondContact NZ-OE2 3.49Å; K200-F205 HydrophobicContact CB-CZ 4.37Å
201	P	76.8	Confident	76.3	Confident	30 Å²	30	66.4 Å²	66.4	20%	0.195	37%	0.365	C	S	.	.			trans	-64.9	147.4	170.4	32.3	-34.4	0	0	0	109.1	H8 S203 E204	H8-P201 VanDerWaalsContact CE1-CD 3.46Å; H8-P201 WeakPolarHBondContact CE1-CD 3.12Å; P201-S203 PolarHBondContact O-N 2.98Å; P201-S203 VanDerWaalsContact O-N 3.12Å; P201-E204 WeakPolarHBondContact CD-OE1 3.35Å; P201-E204 HydrophobicContact CG-CB 4.1Å; P201-E204 HydrophobicContact CG-CG 3.75Å; P201-E204 WeakPolarHBondContact CG-OE1 3.32Å; P201-E204 WeakPolarHBondContact O-CB 3.49Å; P201-E204 PolarHBondContact O-N 3.41Å
202	E	74.9	Confident	77.5	Confident	88 Å²	88	60.8 Å²	60.8	41%	0.411	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-63.6	-24.9	-175.2	-159.6	178.9	153.8	0	0	113.1	E204 F205 H283	E202-E204 PolarHBondContact O-N 2.98Å; E202-F205 HydrophobicContact CB-CD2 4.44Å; E202-F205 HydrophobicContact CG-CD2 3.98Å; E202-F205 PolarHBondContact O-N 2.95Å; E202-F205 VanDerWaalsContact O-N 3.09Å; E202-H283 WeakPolarHBondContact CG-ND1 3.37Å; E202-H283 IonicContact OE1-CE1 3.76Å; E202-H283 IonicContact OE1-CG 2.79Å; E202-H283 IonicContact OE1-ND1 2.73Å; E202-H283 PolarHBondContact OE1-ND1 2.89Å
203	S	73.8	Confident	78.3	Confident	113 Å²	113	57.2 Å²	57.2	79%	0.79	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-67.6	-8.2	172.1	58.9	0	0	0	0	115.1	P201	P201-S203 PolarHBondContact O-N 2.98Å; P201-S203 VanDerWaalsContact O-N 3.12Å
204	E	76.3	Confident	78.3	Confident	91 Å²	91	54.1 Å²	54.1	43%	0.425	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-92.9	-6.6	170.2	-82.7	179	-130	0	0	113.1	K200 P201 E202	K200-E204 HydrophobicContact CB-CB 4.36Å; K200-E204 IonicContact NZ-OE2 3.21Å; K200-E204 PolarHBondContact NZ-OE2 3.49Å; P201-E204 WeakPolarHBondContact CD-OE1 3.35Å; P201-E204 HydrophobicContact CG-CB 4.1Å; P201-E204 HydrophobicContact CG-CG 3.75Å; P201-E204 WeakPolarHBondContact CG-OE1 3.32Å; P201-E204 WeakPolarHBondContact O-CB 3.49Å; P201-E204 PolarHBondContact O-N 3.41Å; E202-E204 PolarHBondContact O-N 2.98Å
205	F	79.8	Confident	78.7	Confident	19 Å²	19	60.3 Å²	60.3	8%	0.083	33%	0.332	C	S	.	.	S	Bend	trans	-85.7	130.9	169.4	-57.2	-57	0	0	0	109.9	W198 K200 E202 K207 S220 H283 Y285	W198-F205 HydrophobicContact CB-CE2 3.87Å; W198-F205 HydrophobicContact CB-CZ 4.16Å; W198-F205 AromaticContact CD2-CE2 3.73Å; W198-F205 HydrophobicContact CD2-CE2 3.73Å; W198-F205 HydrophobicContact CD2-CZ 4.25Å; W198-F205 HydrophobicContact CE3-CE2 4.03Å; W198-F205 HydrophobicContact CE3-CZ 4.13Å; W198-F205 AromaticContact CG-CE2 3.65Å; W198-F205 HydrophobicContact CG-CE2 3.65Å; W198-F205 HydrophobicContact CG-CZ 4.28Å; K200-F205 HydrophobicContact CB-CZ 4.37Å; E202-F205 HydrophobicContact CB-CD2 4.44Å; E202-F205 HydrophobicContact CG-CD2 3.98Å; E202-F205 PolarHBondContact O-N 2.95Å; E202-F205 VanDerWaalsContact O-N 3.09Å; F205-K207 PolarHBondContact O-N 3.38Å; F205-S220 WeakPolarHBondContact CD1-O 3.46Å; F205-S220 WeakPolarHBondContact CE1-O 3.49Å; F205-H283 VanDerWaalsContact CB-NE2 3.28Å; F205-H283 WeakPolarHBondContact CB-NE2 3.49Å; F205-Y285 HydrophobicContact CB-CE1 4.47Å
206	V	80.2	Confident	79.1	Confident	92 Å²	92	65.2 Å²	65.2	56%	0.558	35%	0.35	S	S	*	.			trans	-77.7	106.2	-179.4	177.1	0	0	0	0	108.8	V208 V209 Y285	V206-V208 WeakPolarHBondContact CG1-O 3.35Å; V206-V208 PolarHBondContact O-N 3.17Å; V206-V209 HydrophobicContact CB-CG2 4.34Å; V206-V209 HydrophobicContact CG1-CG2 3.99Å; V206-V209 WeakPolarHBondContact O-CG2 3.42Å; V206-Y285 WeakPolarHBondContact O-CD1 2.98Å
207	K	84.8	Confident	79.3	Confident	139 Å²	139	67.4 Å²	67.4	60%	0.604	36%	0.36	S	S	*	.	S	Bend	trans	-64.7	-33.9	-178.2	-70	-170	175	-170.2	0	114.2	F205 T286	F205-K207 PolarHBondContact O-N 3.38Å; K207-T286 PolarHBondContact O-N 3.15Å
208	V	82.7	Confident	79.6	Confident	91 Å²	91	69 Å²	69	55%	0.552	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.5	116.7	-178.8	-176.2	0	0	0	0	108.9	V206 T286	V206-V208 WeakPolarHBondContact CG1-O 3.35Å; V206-V208 PolarHBondContact O-N 3.17Å; V208-T286 CarbonylContact C-O 3.56Å; V208-T286 WeakPolarHBondContact CA-O 3.09Å
209	V	85.3	Confident	79.8	Confident	13 Å²	13	67.8 Å²	67.8	8%	0.079	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	88.1	-171.1	-178.4	0	0	0	0	108.5	V206 Q217 L219 Y285 T286 V287 T288	V206-V209 HydrophobicContact CB-CG2 4.34Å; V206-V209 HydrophobicContact CG1-CG2 3.99Å; V206-V209 WeakPolarHBondContact O-CG2 3.42Å; V209-Q217 VanDerWaalsContact CG1-CD 3.49Å; V209-Q217 HydrophobicContact CG1-CG 3.71Å; V209-Q217 VanDerWaalsContact CG1-NE2 3.33Å; V209-L219 HydrophobicContact CB-CD2 4.41Å; V209-L219 HydrophobicContact CG1-CD2 4.23Å; V209-L219 HydrophobicContact CG2-CD2 4.01Å; V209-Y285 HydrophobicContact CG2-CD1 4.04Å; V209-T286 PolarHBondContact N-O 3.21Å; V209-V287 HydrophobicContact CB-CG2 4.34Å; V209-V287 WeakPolarHBondContact O-CA 3.15Å; V209-T288 PolarHBondContact O-N 3.03Å
210	A	82.2	Confident	80	Confident	68 Å²	68	68.3 Å²	68.3	56%	0.562	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	124.3	172.6	0	0	0	0	0	109.7	T288 V290	A210-T288 WeakPolarHBondContact CA-O 3.38Å; A210-T288 WeakPolarHBondContact CA-OG1 3.33Å; A210-V290 HydrophobicContact CB-CG2 4.32Å
211	S	79.7	Confident	80.6	Confident	5 Å²	5	63.4 Å²	63.4	4%	0.035	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	134.8	-175.8	-54.8	0	0	0	0	110	Q217 T288 V289 V290	S211-Q217 PolarHBondContact OG-OE1 3.05Å; S211-T288 PolarHBondContact N-O 2.82Å; S211-V289 CarbonylContact O-C 3.5Å; S211-V289 WeakPolarHBondContact O-CA 3.21Å; S211-V290 PolarHBondContact O-N 2.9Å
212	P	69.2	Low	81.2	Confident	38 Å²	38	68.9 Å²	68.9	25%	0.247	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	150	172.3	-25	34.5	0	0	0	112.8	R215 V290 E292	P212-R215 HydrophobicContact CB-CG 4.09Å; P212-V290 CarbonylContact C-O 3.54Å; P212-V290 VanDerWaalsContact CA-O 3.24Å; P212-V290 WeakPolarHBondContact CA-O 3.21Å; P212-E292 HydrophobicContact CB-CB 4.44Å; P212-E292 HydrophobicContact CB-CG 4.27Å; P212-E292 VanDerWaalsContact CB-OE1 3.27Å; P212-E292 WeakPolarHBondContact CB-OE1 3.4Å; P212-E292 WeakPolarHBondContact CG-OE1 3.28Å
213	A	69	Low	81.8	Confident	12 Å²	12	64.8 Å²	64.8	10%	0.099	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	156.6	168.3	0	0	0	0	0	111.6	R215 L262 V289 V290 L341	A213-R215 PolarHBondContact O-N 3.45Å; A213-L262 CarbonylContact C-O 3.5Å; A213-L262 WeakPolarHBondContact CA-O 3.15Å; A213-V289 HydrophobicContact CB-CG1 4.01Å; A213-V290 PolarHBondContact N-O 2.81Å; A213-L341 HydrophobicContact CB-CD1 4.45Å
214	G	65.4	Low	82.3	Confident	38 Å²	38	62.4 Å²	62.4	39%	0.392	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	-18.6	-176.9	0	0	0	0	0	115.4	D261 L262	G214-D261 WeakPolarHBondContact CA-OD1 3.33Å; G214-L262 PolarHBondContact N-O 3.14Å
215	R	75	Confident	82.3	Confident	144 Å²	144	58.9 Å²	58.9	54%	0.543	31%	0.312	S	S	.	.	S	Bend	trans	-85.1	144.8	-178.5	-58.2	-167.7	-170.3	-150.1	3.4	111.7	P212 A213 L262 E292	P212-R215 HydrophobicContact CB-CG 4.09Å; A213-R215 PolarHBondContact O-N 3.45Å; R215-L262 WeakPolarHBondContact O-CB 3.35Å; R215-L262 VanDerWaalsContact O-CG 3.26Å; R215-L262 WeakPolarHBondContact O-CG 3.28Å; R215-L262 PolarHBondContact O-N 2.84Å; R215-E292 IonicContact CZ-OE1 2.84Å; R215-E292 VanDerWaalsContact CZ-OE1 3.3Å; R215-E292 IonicContact NE-OE1 3.14Å; R215-E292 PolarHBondContact NE-OE1 2.82Å; R215-E292 IonicContact NH2-OE1 2.69Å; R215-E292 PolarHBondContact NH2-OE1 2.79Å
216	Q	83	Confident	82.1	Confident	129 Å²	129	61 Å²	61	60%	0.603	32%	0.322	S	S	*	.			trans	-77.5	121.4	171.7	175.6	-168.1	-121.4	0	0	110.7	I258 L259	Q216-I258 HydrophobicContact CG-CG2 3.64Å; Q216-I258 VanDerWaalsContact OE1-CG2 3.26Å; Q216-L259 CarbonylContact C-O 3.54Å; Q216-L259 VanDerWaalsContact CA-O 3.31Å; Q216-L259 WeakPolarHBondContact CA-O 3.39Å
217	Q	88.9	Confident	82.3	Confident	50 Å²	50	58.6 Å²	58.6	23%	0.234	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	147.8	173.5	-178	51	29.7	0	0	112.3	V209 S211 L219 L259 L262	V209-Q217 VanDerWaalsContact CG1-CD 3.49Å; V209-Q217 HydrophobicContact CG1-CG 3.71Å; V209-Q217 VanDerWaalsContact CG1-NE2 3.33Å; S211-Q217 PolarHBondContact OG-OE1 3.05Å; Q217-L219 HydrophobicContact CG-CD2 4.42Å; Q217-L259 PolarHBondContact N-O 3.24Å; Q217-L259 PolarHBondContact O-N 2.03Å; Q217-L262 HydrophobicContact CB-CD1 3.61Å; Q217-L262 HydrophobicContact CB-CG 4.28Å
218	K	92.1	Very high	82.3	Confident	121 Å²	121	58.3 Å²	58.3	53%	0.526	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	119.8	178.6	-178.6	179.9	178.4	-176.1	0	111.7	S256 L257 I258	K218-S256 VanDerWaalsContact CE-CB 3.43Å; K218-S256 WeakPolarHBondContact CE-OG 3.5Å; K218-L257 WeakPolarHBondContact CA-O 3.32Å; K218-I258 HydrophobicContact CD-CG1 4.44Å; K218-I258 HydrophobicContact CG-CG1 4.15Å
219	L	93.1	Very high	82.4	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	148.6	171.2	-50.6	-177.9	0	0	0	109.3	V209 Q217 W233 S256 L257 Y270 Y285 V287	V209-L219 HydrophobicContact CB-CD2 4.41Å; V209-L219 HydrophobicContact CG1-CD2 4.23Å; V209-L219 HydrophobicContact CG2-CD2 4.01Å; Q217-L219 HydrophobicContact CG-CD2 4.42Å; L219-W233 HydrophobicContact CB-CH2 3.59Å; L219-W233 HydrophobicContact CB-CZ3 3.65Å; L219-W233 HydrophobicContact CD1-CZ3 4Å; L219-W233 HydrophobicContact CG-CZ3 4.49Å; L219-S256 WeakPolarHBondContact O-CA 3.35Å; L219-S256 WeakPolarHBondContact O-CB 3.34Å; L219-L257 HydrophobicContact CD1-CD2 4.42Å; L219-L257 PolarHBondContact N-O 2.99Å; L219-L257 PolarHBondContact O-N 3.09Å; L219-Y270 HydrophobicContact CD1-CD1 4.33Å; L219-Y270 HydrophobicContact CD1-CD2 4.3Å; L219-Y270 HydrophobicContact CD1-CG 3.82Å; L219-Y285 HydrophobicContact CB-CD2 4.3Å; L219-Y285 HydrophobicContact CB-CE2 4.32Å; L219-Y285 HydrophobicContact CB-CG 4.42Å; L219-Y285 HydrophobicContact CD1-CD2 4.16Å; L219-Y285 HydrophobicContact CD1-CG 4.05Å; L219-Y285 HydrophobicContact CD2-CD1 3.92Å; L219-Y285 HydrophobicContact CD2-CG 4.05Å; L219-Y285 HydrophobicContact CG-CG 4.4Å; L219-V287 HydrophobicContact CD1-CG2 4.01Å; L219-V287 HydrophobicContact CD2-CG2 4.04Å
220	S	90.8	Very high	82.6	Confident	49 Å²	49	59.7 Å²	59.7	34%	0.343	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	106.9	-177.2	-169.2	0	0	0	0	115.2	F205 W255 S256 Y285	F205-S220 WeakPolarHBondContact CD1-O 3.46Å; F205-S220 WeakPolarHBondContact CE1-O 3.49Å; S220-W255 CarbonylContact C-O 3.56Å; S220-W255 VanDerWaalsContact CA-O 3.24Å; S220-W255 WeakPolarHBondContact CA-O 3.46Å; S220-W255 PolarHBondContact OG-O 3.31Å; S220-S256 PolarHBondContact OG-OG 3.12Å; S220-Y285 VanDerWaalsContact C-OH 3.23Å; S220-Y285 PolarHBondContact O-OH 2.77Å
221	C	89.2	Confident	83	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.29	C	S	.	.			trans	-106.8	48.2	-174.9	56.6	0	0	0	0	112.4	W198 A223 W233 W255 C272	W198-C221 HydrophobicContact CH2-CB 4.33Å; W198-C221 HydrophobicContact CZ3-CB 3.81Å; W198-C221 WeakPolarHBondContact CZ3-O 2.98Å; C221-A223 PolarHBondContact O-N 3.33Å; C221-A223 VanDerWaalsContact O-N 3.13Å; C221-W233 HydrophobicContact CB-CH2 4.38Å; C221-W233 HydrophobicContact CB-CZ2 4.49Å; C221-W233 WeakPolarHBondContact SG-CZ2 3.45Å; C221-W255 PolarHBondContact N-O 2.62Å; C221-C272 HydrophobicContact CB-CB 3.48Å; C221-C272 VanDerWaalsContact CB-CB 3.48Å; C221-C272 WeakPolarHBondContact CB-SG 3.3Å; C221-C272 WeakPolarHBondContact SG-CB 3.47Å; C221-C272 CovalentContact SG-SG 2.01Å; C221-C272 PolarHBondContact SG-SG 3.01Å
222	R	89.7	Confident	83.5	Confident	144 Å²	144	59.6 Å²	59.6	54%	0.543	30%	0.299	S	S	.	.			trans	-58.6	122.4	-172.9	-175.6	-177	-177.6	171.1	3.1	112.3	S199 W255	S199-R222 VanDerWaalsContact CB-O 3.26Å; S199-R222 WeakPolarHBondContact CB-O 3.4Å; S199-R222 PolarHBondContact N-O 2.99Å; S199-R222 WeakPolarHBondContact OG-CB 3.38Å; S199-R222 WeakPolarHBondContact OG-CG 3.43Å; S199-R222 PolarHBondContact OG-O 3.29Å; R222-W255 HydrophobicContact CB-CB 3.95Å; R222-W255 HydrophobicContact CB-CG 4.06Å; R222-W255 HydrophobicContact CG-CB 4.25Å; R222-W255 HydrophobicContact CG-CD2 4.34Å; R222-W255 HydrophobicContact CG-CG 3.86Å
223	A	86.9	Confident	84.7	Confident	2 Å²	2	57.9 Å²	57.9	2%	0.017	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	172.2	179.1	0	0	0	0	0	112.6	Y197 W198 C221 W255 V274 I281	Y197-A223 CarbonylContact O-C 3.59Å; Y197-A223 VanDerWaalsContact O-CA 3.27Å; Y197-A223 WeakPolarHBondContact O-CA 3.41Å; Y197-A223 WeakPolarHBondContact O-CB 3.22Å; W198-A223 HydrophobicContact CE3-CB 3.98Å; W198-A223 HydrophobicContact CZ3-CB 4.2Å; C221-A223 PolarHBondContact O-N 3.33Å; C221-A223 VanDerWaalsContact O-N 3.13Å; A223-W255 HydrophobicContact CB-CE3 4.26Å; A223-W255 HydrophobicContact CB-CH2 4.2Å; A223-W255 HydrophobicContact CB-CZ3 3.82Å; A223-V274 HydrophobicContact CB-CB 4.35Å; A223-V274 HydrophobicContact CB-CG1 3.71Å; A223-V274 HydrophobicContact CB-CG2 4.14Å; A223-I281 HydrophobicContact CB-CD1 4.3Å
224	N	84.4	Confident	85.9	Confident	64 Å²	64	59.5 Å²	59.5	34%	0.342	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	156.2	174.8	-76.7	93.4	0	0	0	108.8	P196 Y197 S199	P196-N224 CarbonylContact C-O 3.51Å; P196-N224 VanDerWaalsContact CA-O 3.27Å; P196-N224 WeakPolarHBondContact CA-O 3.2Å; Y197-N224 HydrophobicContact CD1-CB 4.09Å; Y197-N224 WeakPolarHBondContact CD1-O 3.49Å; Y197-N224 HydrophobicContact CE1-CB 3.49Å; Y197-N224 VanDerWaalsContact CE1-CB 3.49Å; Y197-N224 HydrophobicContact CE2-CB 4.1Å; Y197-N224 PolarHBondContact N-O 3.17Å; Y197-N224 PolarHBondContact O-N 2.89Å; S199-N224 WeakPolarHBondContact CB-OD1 3.39Å
225	G	77.5	Confident	87.2	Confident	17 Å²	17	58.9 Å²	58.9	18%	0.175	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	170	179	0	0	0	0	0	110	P227	G225-P227 CarbonylContact C-O 3.52Å; G225-P227 CarbonylContact O-C 3.58Å
226	E	74.7	Confident	88.1	Confident	62 Å²	62	56.9 Å²	56.9	29%	0.29	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	109	177.3	-171.8	59.9	-107.8	0	0	109.2	F191 L193 G194 N276 Y278	F191-E226 HydrophobicContact CB-CG 4.34Å; F191-E226 HydrophobicContact CD1-CG 4.28Å; F191-E226 WeakPolarHBondContact CD1-OE2 3.42Å; L193-E226 WeakPolarHBondContact CA-O 3.44Å; L193-E226 HydrophobicContact CD2-CG 4.02Å; L193-E226 HydrophobicContact CG-CG 4.41Å; G194-E226 PolarHBondContact N-O 2.8Å; G194-E226 PolarHBondContact O-N 2.74Å; E226-N276 PolarHBondContact N-ND2 2.82Å; E226-Y278 WeakPolarHBondContact O-CD2 3.48Å
227	P	84.6	Confident	88.4	Confident	43 Å²	43	53.5 Å²	53.5	28%	0.279	28%	0.278	S	S	.	.	S	Bend	cis	-59.5	164.3	0.7	-22.1	33.6	0	0	0	114.1	G225 P229 N276 K277	G225-P227 CarbonylContact C-O 3.52Å; G225-P227 CarbonylContact O-C 3.58Å; P227-P229 WeakPolarHBondContact O-CD 3.02Å; P227-N276 PolarHBondContact O-ND2 3.39Å; P227-K277 HydrophobicContact CG-CD 4.28Å; P227-K277 HydrophobicContact CG-CG 4.43Å
228	E	84.5	Confident	88.5	Confident	132 Å²	132	55.5 Å²	55.5	62%	0.617	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-53	122.1	176.3	-172.4	175.2	-143.2	0	0	110	K254	E228-K254 IonicContact OE1-NZ 2.69Å; E228-K254 PolarHBondContact OE1-NZ 3.17Å; E228-K254 IonicContact OE2-NZ 2.62Å; E228-K254 PolarHBondContact OE2-NZ 2.91Å
229	P	86.2	Confident	88.6	Confident	4 Å²	4	53.5 Å²	53.5	3%	0.026	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-77.6	150	-172.8	24.6	-26.5	0	0	0	112.6	P196 P227 W255 V274 F275 N276	P196-P229 HydrophobicContact CB-CB 3.96Å; P196-P229 HydrophobicContact CB-CG 4.05Å; P227-P229 WeakPolarHBondContact O-CD 3.02Å; P229-W255 HydrophobicContact CG-CH2 3.95Å; P229-W255 WeakPolarHBondContact O-CH2 3.33Å; P229-V274 HydrophobicContact CB-CG1 3.68Å; P229-V274 HydrophobicContact CG-CG1 3.98Å; P229-F275 CarbonylContact C-O 3.57Å; P229-F275 VanDerWaalsContact CA-O 3.24Å; P229-F275 WeakPolarHBondContact CA-O 3.25Å; P229-F275 WeakPolarHBondContact CB-O 3.43Å; P229-N276 HydrophobicContact CB-CB 4.11Å
230	Q	88	Confident	88.5	Confident	130 Å²	130	53.8 Å²	53.8	61%	0.607	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	166.1	170.8	-63	-175.5	8.2	0	0	110.3	V274 F275	Q230-V274 WeakPolarHBondContact O-CA 3.46Å; Q230-V274 WeakPolarHBondContact O-CG1 3.14Å; Q230-F275 HydrophobicContact CB-CD1 4.35Å; Q230-F275 HydrophobicContact CB-CE1 3.77Å; Q230-F275 HydrophobicContact CB-CE2 4.04Å; Q230-F275 HydrophobicContact CB-CZ 3.61Å; Q230-F275 HydrophobicContact CG-CZ 4.43Å; Q230-F275 PolarHBondContact N-O 3.03Å; Q230-F275 PolarHBondContact O-N 3.44Å; Q230-F275 VanDerWaalsContact OE1-CZ 3.27Å
231	V	91.1	Very high	88.4	Confident	27 Å²	27	54 Å²	54	16%	0.164	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	131	-177.3	52.3	0	0	0	0	110.8	K254 W255 C272 K273 V274	V231-K254 HydrophobicContact CG1-CG 4.27Å; V231-K254 VanDerWaalsContact CG1-O 3.32Å; V231-K254 WeakPolarHBondContact CG1-O 3.39Å; V231-W255 HydrophobicContact CB-CE3 4.26Å; V231-W255 HydrophobicContact CB-CZ3 3.86Å; V231-W255 HydrophobicContact CG1-CE3 4.13Å; V231-W255 HydrophobicContact CG1-CZ3 3.99Å; V231-W255 HydrophobicContact CG2-CZ3 4.5Å; V231-C272 WeakPolarHBondContact CG2-SG 3.14Å; V231-K273 WeakPolarHBondContact CA-O 3.03Å; V231-V274 HydrophobicContact CB-CG2 4.15Å; V231-V274 HydrophobicContact CG2-CG2 3.99Å
232	I	90.9	Very high	88.3	Confident	44 Å²	44	58 Å²	58	23%	0.226	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	145.1	175	-67.2	167	0	0	0	108	Y234 E239 K273 F275	I232-Y234 HydrophobicContact CB-CE2 4.17Å; I232-Y234 HydrophobicContact CG2-CD2 4.21Å; I232-Y234 HydrophobicContact CG2-CE1 4.38Å; I232-Y234 HydrophobicContact CG2-CE2 3.51Å; I232-Y234 WeakPolarHBondContact CG2-OH 3.15Å; I232-E239 HydrophobicContact CG2-CG 3.53Å; I232-K273 PolarHBondContact N-O 2.71Å; I232-K273 PolarHBondContact O-N 2.98Å; I232-F275 HydrophobicContact CD1-CE1 3.62Å; I232-F275 HydrophobicContact CD1-CZ 4.03Å; I232-F275 HydrophobicContact CG1-CE1 3.93Å
233	W	94.4	Very high	88	Confident	1 Å²	1	57.3 Å²	57.3	0%	0.004	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	139.8	175.4	-69.5	84.3	0	0	0	110.4	L219 C221 I240 I252 L257 T271 C272 Y285	L219-W233 HydrophobicContact CB-CH2 3.59Å; L219-W233 HydrophobicContact CB-CZ3 3.65Å; L219-W233 HydrophobicContact CD1-CZ3 4Å; L219-W233 HydrophobicContact CG-CZ3 4.49Å; C221-W233 HydrophobicContact CB-CH2 4.38Å; C221-W233 HydrophobicContact CB-CZ2 4.49Å; C221-W233 WeakPolarHBondContact SG-CZ2 3.45Å; W233-I240 HydrophobicContact CB-CB 4.49Å; W233-I240 HydrophobicContact CB-CD1 4.02Å; W233-I240 HydrophobicContact CB-CG1 4.45Å; W233-I240 PolarHBondContact O-N 2.94Å; W233-I252 HydrophobicContact CB-CD1 4.22Å; W233-I252 HydrophobicContact CG-CD1 4.43Å; W233-L257 HydrophobicContact CB-CD2 4.5Å; W233-L257 HydrophobicContact CD2-CB 3.62Å; W233-L257 HydrophobicContact CD2-CD2 4.21Å; W233-L257 HydrophobicContact CD2-CG 4.5Å; W233-L257 HydrophobicContact CE3-CB 3.71Å; W233-L257 HydrophobicContact CE3-CD2 3.86Å; W233-L257 HydrophobicContact CE3-CG 4.46Å; W233-L257 HydrophobicContact CG-CB 4.19Å; W233-L257 HydrophobicContact CH2-CB 4.01Å; W233-L257 HydrophobicContact CZ2-CB 3.91Å; W233-L257 VanDerWaalsContact CZ2-N 3.33Å; W233-L257 HydrophobicContact CZ3-CB 3.91Å; W233-L257 HydrophobicContact CZ3-CD2 4.43Å; W233-T271 CarbonylContact C-O 3.54Å; W233-T271 WeakPolarHBondContact CA-O 3.27Å; W233-C272 HydrophobicContact CD2-CB 4.02Å; W233-C272 HydrophobicContact CE3-CB 3.81Å; W233-C272 HydrophobicContact CH2-CB 3.83Å; W233-C272 HydrophobicContact CZ2-CB 4.02Å; W233-C272 HydrophobicContact CZ3-CB 3.72Å; W233-Y285 HydrophobicContact CH2-CE2 4.12Å; W233-Y285 HydrophobicContact CZ3-CD2 4.12Å; W233-Y285 HydrophobicContact CZ3-CE2 4.05Å
234	Y	93.9	Very high	87.7	Confident	46 Å²	46	58.9 Å²	58.9	18%	0.18	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	145.3	174.4	-59	-96.9	0	0	0	109.7	I232 G237 V238 E239 Y270 T271 K273	I232-Y234 HydrophobicContact CB-CE2 4.17Å; I232-Y234 HydrophobicContact CG2-CD2 4.21Å; I232-Y234 HydrophobicContact CG2-CE1 4.38Å; I232-Y234 HydrophobicContact CG2-CE2 3.51Å; I232-Y234 WeakPolarHBondContact CG2-OH 3.15Å; Y234-G237 WeakPolarHBondContact CD1-O 3.5Å; Y234-V238 CarbonylContact C-O 3.58Å; Y234-V238 WeakPolarHBondContact CA-O 3.38Å; Y234-V238 WeakPolarHBondContact CB-O 3.46Å; Y234-E239 VanDerWaalsContact CD1-CA 3.48Å; Y234-E239 HydrophobicContact CD1-CB 3.85Å; Y234-E239 HydrophobicContact CD1-CG 4.35Å; Y234-E239 HydrophobicContact CE1-CB 3.61Å; Y234-E239 HydrophobicContact CE1-CG 3.91Å; Y234-E239 WeakPolarHBondContact CE1-OE2 3.05Å; Y234-E239 PolarHBondContact OH-OE2 2.92Å; Y234-Y270 CarbonylContact O-C 3.6Å; Y234-Y270 WeakPolarHBondContact O-CA 3.32Å; Y234-T271 PolarHBondContact N-O 3.19Å; Y234-T271 PolarHBondContact O-N 2.89Å; Y234-K273 HydrophobicContact CD2-CB 4.37Å; Y234-K273 HydrophobicContact CE2-CB 3.84Å; Y234-K273 HydrophobicContact CE2-CD 4.21Å
235	K	93.2	Very high	87.8	Confident	26 Å²	26	58 Å²	58	11%	0.113	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	121.3	166.6	-178.3	-177.3	-177.9	-178	0	108	G237 V238 I240 Y250 S265 D266 Y270	K235-G237 PolarHBondContact O-N 3.02Å; K235-G237 VanDerWaalsContact O-N 3.15Å; K235-V238 PolarHBondContact N-O 2.77Å; K235-V238 PolarHBondContact O-N 2.8Å; K235-I240 HydrophobicContact CB-CD1 4.14Å; K235-I240 HydrophobicContact CB-CG1 4.11Å; K235-Y250 HydrophobicContact CD-CE2 4.39Å; K235-Y250 PolarHBondContact NZ-OH 3.09Å; K235-S265 WeakPolarHBondContact CE-O 3.24Å; K235-S265 PolarHBondContact NZ-O 2.89Å; K235-D266 IonicContact NZ-OD1 3.09Å; K235-Y270 HydrophobicContact CB-CD1 4.14Å; K235-Y270 HydrophobicContact CB-CE1 3.89Å; K235-Y270 HydrophobicContact CD-CE1 3.96Å; K235-Y270 WeakPolarHBondContact CD-OH 3.19Å; K235-Y270 VanDerWaalsContact CE-OH 3.24Å; K235-Y270 WeakPolarHBondContact CE-OH 3.35Å; K235-Y270 HydrophobicContact CG-CD1 4.34Å; K235-Y270 HydrophobicContact CG-CE1 3.8Å; K235-Y270 HydrophobicContact CG-CE2 4.3Å
236	N	92.2	Very high	87.9	Confident	101 Å²	101	65.9 Å²	65.9	54%	0.54	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	35.4	-178.1	-59.7	-21.7	0	0	0	113.6	V238 G268 T269	N236-V238 VanDerWaalsContact C-N 3.31Å; N236-V238 PolarHBondContact O-N 3.15Å; N236-G268 VanDerWaalsContact OD1-CA 3.29Å; N236-G268 WeakPolarHBondContact OD1-CA 3.26Å; N236-T269 PolarHBondContact N-O 3.5Å; N236-T269 PolarHBondContact OD1-N 2.97Å
237	G	91	Very high	88.1	Confident	59 Å²	59	71.5 Å²	71.5	61%	0.608	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	-12.3	-177.8	0	0	0	0	0	115.6	Y234 K235	Y234-G237 WeakPolarHBondContact CD1-O 3.5Å; K235-G237 PolarHBondContact O-N 3.02Å; K235-G237 VanDerWaalsContact O-N 3.15Å
238	V	91.1	Very high	88	Confident	91 Å²	91	70.3 Å²	70.3	55%	0.552	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	136.2	174.9	-176.8	0	0	0	0	109.9	Y234 K235 N236 M244	Y234-V238 CarbonylContact C-O 3.58Å; Y234-V238 WeakPolarHBondContact CA-O 3.38Å; Y234-V238 WeakPolarHBondContact CB-O 3.46Å; K235-V238 PolarHBondContact N-O 2.77Å; K235-V238 PolarHBondContact O-N 2.8Å; N236-V238 VanDerWaalsContact C-N 3.31Å; N236-V238 PolarHBondContact O-N 3.15Å; V238-M244 HydrophobicContact CG1-SD 4.33Å
239	E	92.8	Very high	87.8	Confident	80 Å²	80	65.3 Å²	65.3	37%	0.374	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	133.3	-179.5	-167	159.3	135.9	0	0	111.6	I232 Y234 T241	I232-E239 HydrophobicContact CG2-CG 3.53Å; Y234-E239 VanDerWaalsContact CD1-CA 3.48Å; Y234-E239 HydrophobicContact CD1-CB 3.85Å; Y234-E239 HydrophobicContact CD1-CG 4.35Å; Y234-E239 HydrophobicContact CE1-CB 3.61Å; Y234-E239 HydrophobicContact CE1-CG 3.91Å; Y234-E239 WeakPolarHBondContact CE1-OE2 3.05Å; Y234-E239 PolarHBondContact OH-OE2 2.92Å; E239-T241 VanDerWaalsContact C-N 3.34Å; E239-T241 PolarHBondContact O-N 2.85Å
240	I	90.7	Very high	88	Confident	7 Å²	7	65.2 Å²	65.2	4%	0.036	34%	0.335	C	S	.	.			trans	-78.7	88.5	175.1	-55.8	-179.5	0	0	0	107.8	W233 K235 M244 E245 Y250 I252 L257 Y270	W233-I240 HydrophobicContact CB-CB 4.49Å; W233-I240 HydrophobicContact CB-CD1 4.02Å; W233-I240 HydrophobicContact CB-CG1 4.45Å; W233-I240 PolarHBondContact O-N 2.94Å; K235-I240 HydrophobicContact CB-CD1 4.14Å; K235-I240 HydrophobicContact CB-CG1 4.11Å; I240-M244 HydrophobicContact CG1-CE 4.43Å; I240-M244 HydrophobicContact CG2-CB 4.18Å; I240-E245 HydrophobicContact CG2-CG 4.08Å; I240-Y250 HydrophobicContact CD1-CD2 4.28Å; I240-Y250 HydrophobicContact CD1-CE2 4.39Å; I240-Y250 HydrophobicContact CG2-CD2 4Å; I240-I252 HydrophobicContact CB-CD1 4.43Å; I240-I252 HydrophobicContact CG2-CD1 4.23Å; I240-L257 HydrophobicContact CD1-CD1 4.25Å; I240-L257 HydrophobicContact CD1-CD2 3.59Å; I240-Y270 HydrophobicContact CD1-CD1 3.99Å; I240-Y270 HydrophobicContact CD1-CE1 4.04Å
241	T	89.1	Confident	88	Confident	53 Å²	53	63 Å²	63	33%	0.325	32%	0.324	S	S	.	.			trans	-68.4	161.2	177.7	65.8	0	0	0	0	111.4	E239 E243 M244 E245	E239-T241 VanDerWaalsContact C-N 3.34Å; E239-T241 PolarHBondContact O-N 2.85Å; T241-E243 PolarHBondContact O-N 2.88Å; T241-E243 PolarHBondContact OG1-N 2.81Å; T241-M244 WeakPolarHBondContact O-CA 3.21Å; T241-M244 WeakPolarHBondContact O-CB 3.43Å; T241-M244 PolarHBondContact O-N 3Å; T241-M244 PolarHBondContact OG1-N 2.65Å; T241-E245 PolarHBondContact O-N 3.22Å
242	P	87.6	Confident	87.9	Confident	86 Å²	86	64 Å²	64	56%	0.558	33%	0.328	S	S	*	.	H	α-helix	trans	-59.4	-15.4	171.2	-25.9	35.8	0	0	0	114.3	R246	P242-R246 WeakPolarHBondContact O-CG 3.24Å; P242-R246 PolarHBondContact O-N 2.87Å; P242-R246 PolarHBondContact O-NH1 2.88Å
243	E	82.6	Confident	87.7	Confident	128 Å²	128	68.4 Å²	68.4	60%	0.598	35%	0.345	S	S	*	.	H	α-helix	trans	-79.3	-43.1	170.7	-174.2	-179.3	174	0	0	111.7	T241 E245 R246 R247	T241-E243 PolarHBondContact O-N 2.88Å; T241-E243 PolarHBondContact OG1-N 2.81Å; E243-E245 VanDerWaalsContact C-N 3.31Å; E243-E245 PolarHBondContact O-N 2.8Å; E243-R246 PolarHBondContact O-N 2.86Å; E243-R247 WeakPolarHBondContact O-CB 3.42Å; E243-R247 PolarHBondContact O-N 2.92Å
244	M	81.7	Confident	87.3	Confident	35 Å²	35	72.7 Å²	72.7	17%	0.172	36%	0.364	C	S	.	.	H	α-helix	trans	-62.8	-36.9	171.3	-71.8	178.1	59.3	0	0	112	V238 I240 T241 R246 R247 L248	V238-M244 HydrophobicContact CG1-SD 4.33Å; I240-M244 HydrophobicContact CG1-CE 4.43Å; I240-M244 HydrophobicContact CG2-CB 4.18Å; T241-M244 WeakPolarHBondContact O-CA 3.21Å; T241-M244 WeakPolarHBondContact O-CB 3.43Å; T241-M244 PolarHBondContact O-N 3Å; T241-M244 PolarHBondContact OG1-N 2.65Å; M244-R246 PolarHBondContact O-N 2.98Å; M244-R247 PolarHBondContact O-N 3.2Å; M244-L248 HydrophobicContact CE-CD1 4.3Å; M244-L248 WeakPolarHBondContact O-CB 3.23Å; M244-L248 PolarHBondContact O-N 2.79Å
245	E	86.2	Confident	87.1	Confident	46 Å²	46	72 Å²	72	22%	0.215	36%	0.361	C	S	.	.	H	α-helix	trans	-57.6	-45.6	171.2	-72.8	-167.3	-96.4	0	0	112.1	I240 T241 E243 G249 Y250 I252	I240-E245 HydrophobicContact CG2-CG 4.08Å; T241-E245 PolarHBondContact O-N 3.22Å; E243-E245 VanDerWaalsContact C-N 3.31Å; E243-E245 PolarHBondContact O-N 2.8Å; E245-G249 CarbonylContact O-C 3.15Å; E245-G249 WeakPolarHBondContact O-CA 3.19Å; E245-G249 PolarHBondContact O-N 2.85Å; E245-G249 VanDerWaalsContact O-N 3.08Å; E245-Y250 PolarHBondContact O-N 3.28Å; E245-Y250 VanDerWaalsContact O-N 3.13Å; E245-I252 HydrophobicContact CG-CD1 4.23Å; E245-I252 HydrophobicContact CG-CG1 4.31Å; E245-I252 WeakPolarHBondContact OE2-CB 3.32Å; E245-I252 PolarHBondContact OE2-N 2.8Å
246	R	79.4	Confident	87	Confident	183 Å²	183	71.2 Å²	71.2	69%	0.691	36%	0.359	S	S	*	.	H	α-helix	trans	-66.8	-46.2	176.1	-69.9	-173.5	-53.8	-90.6	7.2	112.4	P242 E243 M244	P242-R246 WeakPolarHBondContact O-CG 3.24Å; P242-R246 PolarHBondContact O-N 2.87Å; P242-R246 PolarHBondContact O-NH1 2.88Å; E243-R246 PolarHBondContact O-N 2.86Å; M244-R246 PolarHBondContact O-N 2.98Å
247	R	79.3	Confident	87.1	Confident	179 Å²	179	66.4 Å²	66.4	68%	0.675	33%	0.334	S	S	*	.	H	α-helix	trans	-71.5	-31	-173.3	-168.1	178.1	70.5	81.2	-7.5	113.4	E243 M244	E243-R247 WeakPolarHBondContact O-CB 3.42Å; E243-R247 PolarHBondContact O-N 2.92Å; M244-R247 PolarHBondContact O-N 3.2Å
248	L	81.8	Confident	87.1	Confident	18 Å²	18	64.2 Å²	64.2	9%	0.094	31%	0.308	C	S	.	.	H	α-helix	trans	-108.4	4.2	-177.4	-55.3	174.4	0	0	0	112.9	M244 Y250 R311	M244-L248 HydrophobicContact CE-CD1 4.3Å; M244-L248 WeakPolarHBondContact O-CB 3.23Å; M244-L248 PolarHBondContact O-N 2.79Å; L248-Y250 HydrophobicContact CB-CD1 3.75Å; L248-Y250 HydrophobicContact CB-CD2 4.22Å; L248-Y250 HydrophobicContact CB-CE1 3.6Å; L248-Y250 HydrophobicContact CB-CE2 4.1Å; L248-Y250 HydrophobicContact CB-CG 4.06Å; L248-Y250 HydrophobicContact CD1-CD2 4.3Å; L248-Y250 HydrophobicContact CD1-CE1 4.35Å; L248-Y250 HydrophobicContact CD1-CE2 3.62Å; L248-Y250 VanDerWaalsContact O-CD1 3.25Å; L248-Y250 WeakPolarHBondContact O-CD1 3.35Å; L248-Y250 PolarHBondContact O-N 3.01Å; L248-Y250 VanDerWaalsContact O-N 3.14Å; L248-R311 PolarHBondContact O-NE 3.35Å
249	G	80.7	Confident	87.1	Confident	28 Å²	28	59.9 Å²	59.9	29%	0.289	28%	0.282	S	S	.	.			trans	67.5	5.7	-177.2	0	0	0	0	0	115.1	E245 H251 P260	E245-G249 CarbonylContact O-C 3.15Å; E245-G249 WeakPolarHBondContact O-CA 3.19Å; E245-G249 PolarHBondContact O-N 2.85Å; E245-G249 VanDerWaalsContact O-N 3.08Å; G249-H251 PolarHBondContact O-CE1 2.86Å; G249-H251 PolarHBondContact O-ND1 3.37Å; G249-P260 WeakPolarHBondContact O-CD 3.35Å; G249-P260 WeakPolarHBondContact O-CG 3.37Å
250	Y	89.9	Confident	86.6	Confident	1 Å²	1	57.5 Å²	57.5	0%	0.004	27%	0.273	C	S	.	.			trans	-64	153.9	-178.2	-59	-10.7	0	0	0	111.7	K235 I240 E245 L248 L257 I258 L259 D266 Y270	K235-Y250 HydrophobicContact CD-CE2 4.39Å; K235-Y250 PolarHBondContact NZ-OH 3.09Å; I240-Y250 HydrophobicContact CD1-CD2 4.28Å; I240-Y250 HydrophobicContact CD1-CE2 4.39Å; I240-Y250 HydrophobicContact CG2-CD2 4Å; E245-Y250 PolarHBondContact O-N 3.28Å; E245-Y250 VanDerWaalsContact O-N 3.13Å; L248-Y250 HydrophobicContact CB-CD1 3.75Å; L248-Y250 HydrophobicContact CB-CD2 4.22Å; L248-Y250 HydrophobicContact CB-CE1 3.6Å; L248-Y250 HydrophobicContact CB-CE2 4.1Å; L248-Y250 HydrophobicContact CB-CG 4.06Å; L248-Y250 HydrophobicContact CD1-CD2 4.3Å; L248-Y250 HydrophobicContact CD1-CE1 4.35Å; L248-Y250 HydrophobicContact CD1-CE2 3.62Å; L248-Y250 VanDerWaalsContact O-CD1 3.25Å; L248-Y250 WeakPolarHBondContact O-CD1 3.35Å; L248-Y250 PolarHBondContact O-N 3.01Å; L248-Y250 VanDerWaalsContact O-N 3.14Å; Y250-L257 HydrophobicContact CD2-CD1 4.46Å; Y250-I258 WeakPolarHBondContact CA-O 3.4Å; Y250-L259 HydrophobicContact CD1-CD2 3.56Å; Y250-L259 HydrophobicContact CD2-CD2 3.92Å; Y250-L259 HydrophobicContact CE1-CD2 3.52Å; Y250-L259 HydrophobicContact CE2-CD2 3.88Å; Y250-L259 HydrophobicContact CG-CD2 3.76Å; Y250-D266 WeakPolarHBondContact CE1-OD1 3.26Å; Y250-D266 PolarHBondContact OH-OD1 2.82Å; Y250-Y270 HydrophobicContact CE2-CE1 4.32Å; Y250-Y270 PolarHBondContact OH-OH 3.25Å; Y250-Y270 VanDerWaalsContact OH-OH 3.11Å
251	H	87.7	Confident	85.8	Confident	85 Å²	85	59.4 Å²	59.4	39%	0.394	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	115.6	175.8	-50.3	-32.4	0	0	0	112.8	G249 I258	G249-H251 PolarHBondContact O-CE1 2.86Å; G249-H251 PolarHBondContact O-ND1 3.37Å; H251-I258 HydrophobicContact CB-CB 4.24Å; H251-I258 PolarHBondContact N-O 2.92Å; H251-I258 PolarHBondContact O-N 2.84Å
252	I	90.1	Very high	85.3	Confident	48 Å²	48	56.9 Å²	56.9	25%	0.246	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	110.2	172.6	-63	174.8	0	0	0	109.5	W233 I240 E245 L257	W233-I252 HydrophobicContact CB-CD1 4.22Å; W233-I252 HydrophobicContact CG-CD1 4.43Å; I240-I252 HydrophobicContact CB-CD1 4.43Å; I240-I252 HydrophobicContact CG2-CD1 4.23Å; E245-I252 HydrophobicContact CG-CD1 4.23Å; E245-I252 HydrophobicContact CG-CG1 4.31Å; E245-I252 WeakPolarHBondContact OE2-CB 3.32Å; E245-I252 PolarHBondContact OE2-N 2.8Å; I252-L257 HydrophobicContact CG1-CD1 3.75Å
253	K	87.1	Confident	84.8	Confident	135 Å²	135	52.9 Å²	52.9	59%	0.587	24%	0.242	S	C	*	.			trans	-110.1	66	176.9	-64.8	-174.9	-175.9	170.8	0	109.9	W255 S256 I258	K253-W255 PolarHBondContact O-N 2.87Å; K253-S256 PolarHBondContact N-O 3.06Å; K253-S256 PolarHBondContact O-N 2.94Å; K253-I258 HydrophobicContact CD-CD1 3.82Å; K253-I258 HydrophobicContact CG-CD1 4.46Å
254	K	84.9	Confident	84.6	Confident	92 Å²	92	49.4 Å²	49.4	40%	0.4	23%	0.23	S	C	.	.	S	Bend	trans	55.3	-100.5	-174	-166.3	174.2	-166.6	170.5	0	110.5	E228 V231 S256	E228-K254 IonicContact OE1-NZ 2.69Å; E228-K254 PolarHBondContact OE1-NZ 3.17Å; E228-K254 IonicContact OE2-NZ 2.62Å; E228-K254 PolarHBondContact OE2-NZ 2.91Å; V231-K254 HydrophobicContact CG1-CG 4.27Å; V231-K254 VanDerWaalsContact CG1-O 3.32Å; V231-K254 WeakPolarHBondContact CG1-O 3.39Å; K254-S256 PolarHBondContact O-N 2.85Å
255	W	89.2	Confident	84.6	Confident	31 Å²	31	50.1 Å²	50.1	12%	0.117	24%	0.238	C	C	.	.	S	Bend	trans	-72.3	8.6	-178.4	-55.8	120.8	0	0	0	115.5	S220 C221 R222 A223 P229 V231 K253 V274	S220-W255 CarbonylContact C-O 3.56Å; S220-W255 VanDerWaalsContact CA-O 3.24Å; S220-W255 WeakPolarHBondContact CA-O 3.46Å; S220-W255 PolarHBondContact OG-O 3.31Å; C221-W255 PolarHBondContact N-O 2.62Å; R222-W255 HydrophobicContact CB-CB 3.95Å; R222-W255 HydrophobicContact CB-CG 4.06Å; R222-W255 HydrophobicContact CG-CB 4.25Å; R222-W255 HydrophobicContact CG-CD2 4.34Å; R222-W255 HydrophobicContact CG-CG 3.86Å; A223-W255 HydrophobicContact CB-CE3 4.26Å; A223-W255 HydrophobicContact CB-CH2 4.2Å; A223-W255 HydrophobicContact CB-CZ3 3.82Å; P229-W255 HydrophobicContact CG-CH2 3.95Å; P229-W255 WeakPolarHBondContact O-CH2 3.33Å; V231-W255 HydrophobicContact CB-CE3 4.26Å; V231-W255 HydrophobicContact CB-CZ3 3.86Å; V231-W255 HydrophobicContact CG1-CE3 4.13Å; V231-W255 HydrophobicContact CG1-CZ3 3.99Å; V231-W255 HydrophobicContact CG2-CZ3 4.5Å; K253-W255 PolarHBondContact O-N 2.87Å; W255-V274 HydrophobicContact CE3-CG2 4.46Å; W255-V274 HydrophobicContact CH2-CG1 4.21Å; W255-V274 HydrophobicContact CZ3-CG1 3.85Å; W255-V274 HydrophobicContact CZ3-CG2 3.86Å
256	S	92.5	Very high	84.7	Confident	10 Å²	10	48 Å²	48	7%	0.07	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	136.2	-177.4	-58	0	0	0	0	112.1	K218 L219 S220 K253 K254	K218-S256 VanDerWaalsContact CE-CB 3.43Å; K218-S256 WeakPolarHBondContact CE-OG 3.5Å; L219-S256 WeakPolarHBondContact O-CA 3.35Å; L219-S256 WeakPolarHBondContact O-CB 3.34Å; S220-S256 PolarHBondContact OG-OG 3.12Å; K253-S256 PolarHBondContact N-O 3.06Å; K253-S256 PolarHBondContact O-N 2.94Å; K254-S256 PolarHBondContact O-N 2.85Å
257	L	93.6	Very high	85.2	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	132.2	163.3	175.9	65.5	0	0	0	107.9	K218 L219 W233 I240 Y250 I252 L259 Y270	K218-L257 WeakPolarHBondContact CA-O 3.32Å; L219-L257 HydrophobicContact CD1-CD2 4.42Å; L219-L257 PolarHBondContact N-O 2.99Å; L219-L257 PolarHBondContact O-N 3.09Å; W233-L257 HydrophobicContact CB-CD2 4.5Å; W233-L257 HydrophobicContact CD2-CB 3.62Å; W233-L257 HydrophobicContact CD2-CD2 4.21Å; W233-L257 HydrophobicContact CD2-CG 4.5Å; W233-L257 HydrophobicContact CE3-CB 3.71Å; W233-L257 HydrophobicContact CE3-CD2 3.86Å; W233-L257 HydrophobicContact CE3-CG 4.46Å; W233-L257 HydrophobicContact CG-CB 4.19Å; W233-L257 HydrophobicContact CH2-CB 4.01Å; W233-L257 HydrophobicContact CZ2-CB 3.91Å; W233-L257 VanDerWaalsContact CZ2-N 3.33Å; W233-L257 HydrophobicContact CZ3-CB 3.91Å; W233-L257 HydrophobicContact CZ3-CD2 4.43Å; I240-L257 HydrophobicContact CD1-CD1 4.25Å; I240-L257 HydrophobicContact CD1-CD2 3.59Å; Y250-L257 HydrophobicContact CD2-CD1 4.46Å; I252-L257 HydrophobicContact CG1-CD1 3.75Å; L257-L259 HydrophobicContact CD1-CD2 4.39Å; L257-L259 HydrophobicContact CD2-CD2 3.97Å; L257-L259 HydrophobicContact CG-CD2 3.99Å; L257-L259 HydrophobicContact CG-CG 4.47Å; L257-Y270 HydrophobicContact CD2-CD1 3.44Å; L257-Y270 VanDerWaalsContact CD2-CD1 3.44Å; L257-Y270 HydrophobicContact CD2-CE1 3.79Å; L257-Y270 HydrophobicContact CD2-CG 4.42Å
258	I	91.5	Very high	85.7	Confident	13 Å²	13	33.3 Å²	33.3	7%	0.067	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.2	173.7	-57	173.4	0	0	0	107.7	Q216 K218 Y250 H251 K253 P260	Q216-I258 HydrophobicContact CG-CG2 3.64Å; Q216-I258 VanDerWaalsContact OE1-CG2 3.26Å; K218-I258 HydrophobicContact CD-CG1 4.44Å; K218-I258 HydrophobicContact CG-CG1 4.15Å; Y250-I258 WeakPolarHBondContact CA-O 3.4Å; H251-I258 HydrophobicContact CB-CB 4.24Å; H251-I258 PolarHBondContact N-O 2.92Å; H251-I258 PolarHBondContact O-N 2.84Å; K253-I258 HydrophobicContact CD-CD1 3.82Å; K253-I258 HydrophobicContact CG-CD1 4.46Å; I258-P260 WeakPolarHBondContact O-CD 3.26Å
259	L	90.2	Very high	86.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	92.1	173.2	-52.8	175.2	0	0	0	106.1	Q216 Q217 Y250 L257 L262 Y270	Q216-L259 CarbonylContact C-O 3.54Å; Q216-L259 VanDerWaalsContact CA-O 3.31Å; Q216-L259 WeakPolarHBondContact CA-O 3.39Å; Q217-L259 PolarHBondContact N-O 3.24Å; Q217-L259 PolarHBondContact O-N 2.03Å; Y250-L259 HydrophobicContact CD1-CD2 3.56Å; Y250-L259 HydrophobicContact CD2-CD2 3.92Å; Y250-L259 HydrophobicContact CE1-CD2 3.52Å; Y250-L259 HydrophobicContact CE2-CD2 3.88Å; Y250-L259 HydrophobicContact CG-CD2 3.76Å; L257-L259 HydrophobicContact CD1-CD2 4.39Å; L257-L259 HydrophobicContact CD2-CD2 3.97Å; L257-L259 HydrophobicContact CG-CD2 3.99Å; L257-L259 HydrophobicContact CG-CG 4.47Å; L259-L262 HydrophobicContact CB-CD2 3.74Å; L259-L262 HydrophobicContact CD1-CD2 3.97Å; L259-Y270 HydrophobicContact CD1-CE1 4.13Å; L259-Y270 HydrophobicContact CD1-CE2 4.12Å; L259-Y270 HydrophobicContact CD2-CE1 3.87Å
260	P	82.9	Confident	87.1	Confident	29 Å²	29	33.6 Å²	33.6	19%	0.188	18%	0.183	C	C	.	.			trans	-70.2	150.3	173	31.9	-33.1	0	0	0	109.7	G249 I258 R311	G249-P260 WeakPolarHBondContact O-CD 3.35Å; G249-P260 WeakPolarHBondContact O-CG 3.37Å; I258-P260 WeakPolarHBondContact O-CD 3.26Å; P260-R311 PolarHBondContact O-NH1 3.43Å; P260-R311 PolarHBondContact O-NH2 2.83Å
261	D	74.3	Confident	87.3	Confident	47 Å²	47	34.7 Å²	34.7	25%	0.251	19%	0.19	S	C	.	.	S	Bend	trans	48.7	71.5	169.2	-171.2	32	0	0	0	113.5	G214 V263 R311	G214-D261 WeakPolarHBondContact CA-OD1 3.33Å; D261-V263 PolarHBondContact O-N 3.24Å; D261-R311 PolarHBondContact O-NH1 2.98Å; D261-R311 PolarHBondContact O-NH2 3.11Å
262	L	78.9	Confident	87.6	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.172	C	C	.	.			trans	-67.5	125.6	-173	-80.8	173.7	0	0	0	112.8	A213 G214 R215 Q217 L259 D266 V289	A213-L262 CarbonylContact C-O 3.5Å; A213-L262 WeakPolarHBondContact CA-O 3.15Å; G214-L262 PolarHBondContact N-O 3.14Å; R215-L262 WeakPolarHBondContact O-CB 3.35Å; R215-L262 VanDerWaalsContact O-CG 3.26Å; R215-L262 WeakPolarHBondContact O-CG 3.28Å; R215-L262 PolarHBondContact O-N 2.84Å; Q217-L262 HydrophobicContact CB-CD1 3.61Å; Q217-L262 HydrophobicContact CB-CG 4.28Å; L259-L262 HydrophobicContact CB-CD2 3.74Å; L259-L262 HydrophobicContact CD1-CD2 3.97Å; L262-D266 HydrophobicContact CD2-CB 3.61Å; L262-V289 HydrophobicContact CB-CG1 4.05Å; L262-V289 HydrophobicContact CB-CG2 4.11Å; L262-V289 HydrophobicContact CD1-CG2 4.22Å; L262-V289 HydrophobicContact CD2-CG2 3.95Å; L262-V289 HydrophobicContact CG-CG2 4.34Å
263	V	77.3	Confident	87.8	Confident	3 Å²	3	31 Å²	31	2%	0.018	17%	0.171	C	C	.	.			trans	-105.8	156.9	167.3	-62.4	0	0	0	0	110.9	D261 S265 D266 V289 R311	D261-V263 PolarHBondContact O-N 3.24Å; V263-S265 WeakPolarHBondContact CG2-OG 3.49Å; V263-S265 PolarHBondContact O-N 2.86Å; V263-S265 VanDerWaalsContact O-N 3.11Å; V263-D266 WeakPolarHBondContact CG2-OD2 3.35Å; V263-D266 PolarHBondContact N-OD2 3.45Å; V263-D266 WeakPolarHBondContact O-CA 3.44Å; V263-D266 VanDerWaalsContact O-CB 3.27Å; V263-D266 WeakPolarHBondContact O-CB 3.14Å; V263-D266 PolarHBondContact O-N 2.86Å; V263-V289 WeakPolarHBondContact O-CG2 3.49Å; V263-R311 HydrophobicContact CG1-CG 4.21Å; V263-R311 HydrophobicContact CG2-CG 3.56Å
264	P	78.5	Confident	88	Confident	55 Å²	55	24.5 Å²	24.5	36%	0.357	14%	0.143	S	C	.	.	G	3₁₀ helix	trans	-45.1	-37.7	174.7	-31.9	35.1	0	0	0	116	D266 A267 C308	P264-D266 PolarHBondContact O-N 3.47Å; P264-A267 WeakPolarHBondContact O-CB 3.4Å; P264-A267 PolarHBondContact O-N 2.8Å; P264-C308 WeakPolarHBondContact CD-O 3.27Å; P264-C308 WeakPolarHBondContact CG-O 3.15Å
265	S	81.3	Confident	88.2	Confident	49 Å²	49	22.7 Å²	22.7	34%	0.343	14%	0.135	S	C	.	.	G	3₁₀ helix	trans	-71	-7.2	175.4	64.5	0	0	0	0	114.8	K235 V263 A267 S309	K235-S265 WeakPolarHBondContact CE-O 3.24Å; K235-S265 PolarHBondContact NZ-O 2.89Å; V263-S265 WeakPolarHBondContact CG2-OG 3.49Å; V263-S265 PolarHBondContact O-N 2.86Å; V263-S265 VanDerWaalsContact O-N 3.11Å; S265-A267 VanDerWaalsContact C-N 3.28Å; S265-S309 WeakPolarHBondContact CB-O 3.31Å; S265-S309 PolarHBondContact N-O 2.83Å; S265-S309 PolarHBondContact OG-O 2.83Å
266	D	88.4	Confident	87.8	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.005	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-79.1	-7.4	165.2	-62.2	-48.3	0	0	0	113.2	K235 Y250 L262 V263 P264 Y270 V289 R311	K235-D266 IonicContact NZ-OD1 3.09Å; Y250-D266 WeakPolarHBondContact CE1-OD1 3.26Å; Y250-D266 PolarHBondContact OH-OD1 2.82Å; L262-D266 HydrophobicContact CD2-CB 3.61Å; V263-D266 WeakPolarHBondContact CG2-OD2 3.35Å; V263-D266 PolarHBondContact N-OD2 3.45Å; V263-D266 WeakPolarHBondContact O-CA 3.44Å; V263-D266 VanDerWaalsContact O-CB 3.27Å; V263-D266 WeakPolarHBondContact O-CB 3.14Å; V263-D266 PolarHBondContact O-N 2.86Å; P264-D266 PolarHBondContact O-N 3.47Å; D266-Y270 VanDerWaalsContact O-CE2 3.24Å; D266-Y270 WeakPolarHBondContact O-CE2 3.31Å; D266-Y270 PolarHBondContact O-OH 3.24Å; D266-V289 HydrophobicContact CB-CG2 4.15Å; D266-R311 IonicContact OD1-NE 3.08Å; D266-R311 IonicContact OD1-NH2 2.89Å; D266-R311 IonicContact OD2-CZ 3.99Å; D266-R311 VanDerWaalsContact OD2-CZ 3.31Å; D266-R311 IonicContact OD2-NE 2.93Å; D266-R311 PolarHBondContact OD2-NE 3.01Å; D266-R311 IonicContact OD2-NH2 3.85Å; D266-R311 PolarHBondContact OD2-NH2 2.9Å
267	A	88.4	Confident	87.2	Confident	38 Å²	38	28.6 Å²	28.6	31%	0.314	16%	0.162	S	C	.	.			trans	-64.1	146.1	168.8	0	0	0	0	0	110.9	P264 S265 V287 V289	P264-A267 WeakPolarHBondContact O-CB 3.4Å; P264-A267 PolarHBondContact O-N 2.8Å; S265-A267 VanDerWaalsContact C-N 3.28Å; A267-V287 WeakPolarHBondContact CA-O 3.37Å; A267-V289 HydrophobicContact CB-CG2 4.43Å
268	G	91.7	Very high	86.5	Confident	17 Å²	17	32 Å²	32	18%	0.175	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.4	-172.3	-179.3	0	0	0	0	0	114.1	N236 V287	N236-G268 VanDerWaalsContact OD1-CA 3.29Å; N236-G268 WeakPolarHBondContact OD1-CA 3.26Å; G268-V287 PolarHBondContact N-O 3.12Å; G268-V287 PolarHBondContact O-N 2.83Å
269	T	95.2	Very high	85.8	Confident	51 Å²	51	32.7 Å²	32.7	31%	0.313	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	115.1	177.3	-60	0	0	0	0	110.4	N236 N284 Y285	N236-T269 PolarHBondContact N-O 3.5Å; N236-T269 PolarHBondContact OD1-N 2.97Å; T269-N284 HydrophobicContact CG2-CB 4Å; T269-Y285 CarbonylContact C-O 3.59Å; T269-Y285 WeakPolarHBondContact CA-O 3.49Å
270	Y	95.3	Very high	85.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	114.2	175.7	-70.2	-98.5	0	0	0	110.4	L219 Y234 K235 I240 Y250 L257 L259 D266 Y285 V287	L219-Y270 HydrophobicContact CD1-CD1 4.33Å; L219-Y270 HydrophobicContact CD1-CD2 4.3Å; L219-Y270 HydrophobicContact CD1-CG 3.82Å; Y234-Y270 CarbonylContact O-C 3.6Å; Y234-Y270 WeakPolarHBondContact O-CA 3.32Å; K235-Y270 HydrophobicContact CB-CD1 4.14Å; K235-Y270 HydrophobicContact CB-CE1 3.89Å; K235-Y270 HydrophobicContact CD-CE1 3.96Å; K235-Y270 WeakPolarHBondContact CD-OH 3.19Å; K235-Y270 VanDerWaalsContact CE-OH 3.24Å; K235-Y270 WeakPolarHBondContact CE-OH 3.35Å; K235-Y270 HydrophobicContact CG-CD1 4.34Å; K235-Y270 HydrophobicContact CG-CE1 3.8Å; K235-Y270 HydrophobicContact CG-CE2 4.3Å; I240-Y270 HydrophobicContact CD1-CD1 3.99Å; I240-Y270 HydrophobicContact CD1-CE1 4.04Å; Y250-Y270 HydrophobicContact CE2-CE1 4.32Å; Y250-Y270 PolarHBondContact OH-OH 3.25Å; Y250-Y270 VanDerWaalsContact OH-OH 3.11Å; L257-Y270 HydrophobicContact CD2-CD1 3.44Å; L257-Y270 VanDerWaalsContact CD2-CD1 3.44Å; L257-Y270 HydrophobicContact CD2-CE1 3.79Å; L257-Y270 HydrophobicContact CD2-CG 4.42Å; L259-Y270 HydrophobicContact CD1-CE1 4.13Å; L259-Y270 HydrophobicContact CD1-CE2 4.12Å; L259-Y270 HydrophobicContact CD2-CE1 3.87Å; D266-Y270 VanDerWaalsContact O-CE2 3.24Å; D266-Y270 WeakPolarHBondContact O-CE2 3.31Å; D266-Y270 PolarHBondContact O-OH 3.24Å; Y270-Y285 PolarHBondContact N-O 2.84Å; Y270-Y285 PolarHBondContact O-N 2.86Å; Y270-V287 HydrophobicContact CD2-CB 3.94Å; Y270-V287 HydrophobicContact CD2-CG2 3.52Å; Y270-V287 HydrophobicContact CE2-CB 3.91Å; Y270-V287 HydrophobicContact CE2-CG2 3.85Å; Y270-V287 HydrophobicContact CG-CG2 4.42Å
271	T	95.2	Very high	85.9	Confident	25 Å²	25	38.1 Å²	38.1	15%	0.153	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	121.7	177.4	-59.5	0	0	0	0	109.7	W233 Y234 H283 N284	W233-T271 CarbonylContact C-O 3.54Å; W233-T271 WeakPolarHBondContact CA-O 3.27Å; Y234-T271 PolarHBondContact N-O 3.19Å; Y234-T271 PolarHBondContact O-N 2.89Å; T271-H283 WeakPolarHBondContact CA-O 3.46Å; T271-N284 VanDerWaalsContact CG2-OD1 3.32Å; T271-N284 WeakPolarHBondContact CG2-OD1 3.35Å; T271-N284 PolarHBondContact OG1-OD1 3.36Å
272	C	94.1	Very high	86.8	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	116.9	162.9	168.6	0	0	0	0	109	C221 V231 W233 S282 H283	C221-C272 HydrophobicContact CB-CB 3.48Å; C221-C272 VanDerWaalsContact CB-CB 3.48Å; C221-C272 WeakPolarHBondContact CB-SG 3.3Å; C221-C272 WeakPolarHBondContact SG-CB 3.47Å; C221-C272 CovalentContact SG-SG 2.01Å; C221-C272 PolarHBondContact SG-SG 3.01Å; V231-C272 WeakPolarHBondContact CG2-SG 3.14Å; W233-C272 HydrophobicContact CD2-CB 4.02Å; W233-C272 HydrophobicContact CE3-CB 3.81Å; W233-C272 HydrophobicContact CH2-CB 3.83Å; W233-C272 HydrophobicContact CZ2-CB 4.02Å; W233-C272 HydrophobicContact CZ3-CB 3.72Å; C272-S282 CarbonylContact O-C 3.57Å; C272-S282 VanDerWaalsContact O-CA 3.26Å; C272-S282 WeakPolarHBondContact O-CA 3.44Å; C272-H283 PolarHBondContact N-O 3.29Å; C272-H283 PolarHBondContact O-N 3.22Å
273	K	93.2	Very high	87.4	Confident	54 Å²	54	39.1 Å²	39.1	24%	0.235	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122.8	173.4	178.3	169.1	168.2	151.3	0	109.1	V231 I232 Y234 E280	V231-K273 WeakPolarHBondContact CA-O 3.03Å; I232-K273 PolarHBondContact N-O 2.71Å; I232-K273 PolarHBondContact O-N 2.98Å; Y234-K273 HydrophobicContact CD2-CB 4.37Å; Y234-K273 HydrophobicContact CE2-CB 3.84Å; Y234-K273 HydrophobicContact CE2-CD 4.21Å; K273-E280 VanDerWaalsContact CE-OE1 3.23Å; K273-E280 WeakPolarHBondContact CE-OE1 3.37Å; K273-E280 WeakPolarHBondContact CE-OE2 3.2Å; K273-E280 IonicContact NZ-OE1 3.9Å; K273-E280 PolarHBondContact NZ-OE1 2.6Å; K273-E280 IonicContact NZ-OE2 3.87Å; K273-E280 PolarHBondContact NZ-OE2 3.08Å
274	V	92	Very high	88.3	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.9	178.3	178.5	0	0	0	0	108.8	P196 W198 A223 P229 Q230 V231 W255 E280 I281	P196-V274 HydrophobicContact CB-CB 4.48Å; P196-V274 HydrophobicContact CB-CG1 3.65Å; P196-V274 HydrophobicContact CG-CG1 4.2Å; P196-V274 WeakPolarHBondContact CG-O 3.15Å; W198-V274 HydrophobicContact CH2-CG2 4.02Å; W198-V274 HydrophobicContact CZ3-CB 4.42Å; W198-V274 HydrophobicContact CZ3-CG2 3.7Å; A223-V274 HydrophobicContact CB-CB 4.35Å; A223-V274 HydrophobicContact CB-CG1 3.71Å; A223-V274 HydrophobicContact CB-CG2 4.14Å; P229-V274 HydrophobicContact CB-CG1 3.68Å; P229-V274 HydrophobicContact CG-CG1 3.98Å; Q230-V274 WeakPolarHBondContact O-CA 3.46Å; Q230-V274 WeakPolarHBondContact O-CG1 3.14Å; V231-V274 HydrophobicContact CB-CG2 4.15Å; V231-V274 HydrophobicContact CG2-CG2 3.99Å; W255-V274 HydrophobicContact CE3-CG2 4.46Å; W255-V274 HydrophobicContact CH2-CG1 4.21Å; W255-V274 HydrophobicContact CZ3-CG1 3.85Å; W255-V274 HydrophobicContact CZ3-CG2 3.86Å; V274-E280 CarbonylContact O-C 3.42Å; V274-E280 VanDerWaalsContact O-CA 3.25Å; V274-E280 WeakPolarHBondContact O-CA 3.26Å; V274-I281 HydrophobicContact CB-CD1 4.42Å; V274-I281 HydrophobicContact CB-CG1 3.85Å; V274-I281 HydrophobicContact CG1-CG1 4.43Å; V274-I281 PolarHBondContact N-O 2.86Å; V274-I281 PolarHBondContact O-N 3.01Å
275	F	88.7	Confident	89	Confident	54 Å²	54	40.6 Å²	40.6	24%	0.237	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	153.8	-175.5	65.2	-79.3	0	0	0	113	P229 Q230 I232 G279 E280	P229-F275 CarbonylContact C-O 3.57Å; P229-F275 VanDerWaalsContact CA-O 3.24Å; P229-F275 WeakPolarHBondContact CA-O 3.25Å; P229-F275 WeakPolarHBondContact CB-O 3.43Å; Q230-F275 HydrophobicContact CB-CD1 4.35Å; Q230-F275 HydrophobicContact CB-CE1 3.77Å; Q230-F275 HydrophobicContact CB-CE2 4.04Å; Q230-F275 HydrophobicContact CB-CZ 3.61Å; Q230-F275 HydrophobicContact CG-CZ 4.43Å; Q230-F275 PolarHBondContact N-O 3.03Å; Q230-F275 PolarHBondContact O-N 3.44Å; Q230-F275 VanDerWaalsContact OE1-CZ 3.27Å; I232-F275 HydrophobicContact CD1-CE1 3.62Å; I232-F275 HydrophobicContact CD1-CZ 4.03Å; I232-F275 HydrophobicContact CG1-CE1 3.93Å; F275-G279 WeakPolarHBondContact CA-O 3.46Å; F275-E280 HydrophobicContact CB-CB 3.89Å
276	N	81.8	Confident	89.6	Confident	20 Å²	20	41 Å²	41	11%	0.107	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	-179.6	158.5	72.5	10.3	0	0	0	109.1	G194 A195 E226 P227 P229 Y278 G279	G194-N276 PolarHBondContact O-ND2 2.79Å; A195-N276 WeakPolarHBondContact CA-OD1 3.34Å; E226-N276 PolarHBondContact N-ND2 2.82Å; P227-N276 PolarHBondContact O-ND2 3.39Å; P229-N276 HydrophobicContact CB-CB 4.11Å; N276-Y278 PolarHBondContact O-N 2.01Å; N276-Y278 PolarHBondContact OD1-N 2.76Å; N276-G279 PolarHBondContact N-O 2.79Å; N276-G279 PolarHBondContact O-N 2.82Å
277	K	78.5	Confident	89.8	Confident	145 Å²	145	41 Å²	41	63%	0.63	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-1.9	-178.2	71.6	-178.5	-175.4	-178.9	0	116.5	P227	P227-K277 HydrophobicContact CG-CD 4.28Å; P227-K277 HydrophobicContact CG-CG 4.43Å
278	Y	78.5	Confident	89.8	Confident	72 Å²	72	41.7 Å²	41.7	28%	0.282	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114	0.8	177.3	-63.5	-65.3	0	0	0	113.8	W98 L193 G194 A195 E226 N276	W98-Y278 HydrophobicContact CZ2-CD1 4.43Å; L193-Y278 HydrophobicContact CB-CE2 3.69Å; L193-Y278 HydrophobicContact CD2-CE2 3.79Å; L193-Y278 HydrophobicContact CG-CE2 4.29Å; G194-Y278 VanDerWaalsContact C-CB 3.45Å; A195-Y278 WeakPolarHBondContact CB-O 3.38Å; A195-Y278 VanDerWaalsContact N-CB 3.29Å; E226-Y278 WeakPolarHBondContact O-CD2 3.48Å; N276-Y278 PolarHBondContact O-N 2.01Å; N276-Y278 PolarHBondContact OD1-N 2.76Å
279	G	78.5	Confident	89.3	Confident	26 Å²	26	41.9 Å²	41.9	27%	0.268	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	147.2	-174.3	173.5	0	0	0	0	0	113.9	P196 F275 N276	P196-G279 WeakPolarHBondContact CD-O 3.39Å; F275-G279 WeakPolarHBondContact CA-O 3.46Å; N276-G279 PolarHBondContact N-O 2.79Å; N276-G279 PolarHBondContact O-N 2.82Å
280	E	86.5	Confident	88.1	Confident	106 Å²	106	42.5 Å²	42.5	50%	0.495	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	158.3	-178	59.8	179	-106.7	0	0	112.5	K273 V274 F275	K273-E280 VanDerWaalsContact CE-OE1 3.23Å; K273-E280 WeakPolarHBondContact CE-OE1 3.37Å; K273-E280 WeakPolarHBondContact CE-OE2 3.2Å; K273-E280 IonicContact NZ-OE1 3.9Å; K273-E280 PolarHBondContact NZ-OE1 2.6Å; K273-E280 IonicContact NZ-OE2 3.87Å; K273-E280 PolarHBondContact NZ-OE2 3.08Å; V274-E280 CarbonylContact O-C 3.42Å; V274-E280 VanDerWaalsContact O-CA 3.25Å; V274-E280 WeakPolarHBondContact O-CA 3.26Å; F275-E280 HydrophobicContact CB-CB 3.89Å
281	I	87.7	Confident	86.2	Confident	38 Å²	38	44 Å²	44	20%	0.195	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	148.1	169.5	61.7	-176.8	0	0	0	108.5	P196 W198 A223 V274	P196-I281 HydrophobicContact CB-CD1 3.88Å; P196-I281 HydrophobicContact CB-CG1 4.04Å; P196-I281 HydrophobicContact CG-CD1 4.29Å; P196-I281 HydrophobicContact CG-CG1 3.95Å; P196-I281 HydrophobicContact CG-CG2 4.35Å; W198-I281 HydrophobicContact CD2-CD1 3.59Å; W198-I281 HydrophobicContact CD2-CG1 4.39Å; W198-I281 HydrophobicContact CE3-CD1 3.7Å; W198-I281 HydrophobicContact CE3-CG1 4.43Å; W198-I281 HydrophobicContact CG-CD1 4.17Å; W198-I281 HydrophobicContact CH2-CB 4.44Å; W198-I281 HydrophobicContact CH2-CD1 3.92Å; W198-I281 HydrophobicContact CH2-CG1 3.73Å; W198-I281 HydrophobicContact CZ2-CB 3.95Å; W198-I281 HydrophobicContact CZ2-CD1 3.82Å; W198-I281 HydrophobicContact CZ2-CG1 3.67Å; W198-I281 HydrophobicContact CZ3-CD1 3.86Å; W198-I281 HydrophobicContact CZ3-CG1 4.12Å; A223-I281 HydrophobicContact CB-CD1 4.3Å; V274-I281 HydrophobicContact CB-CD1 4.42Å; V274-I281 HydrophobicContact CB-CG1 3.85Å; V274-I281 HydrophobicContact CG1-CG1 4.43Å; V274-I281 PolarHBondContact N-O 2.86Å; V274-I281 PolarHBondContact O-N 3.01Å
282	S	93.1	Very high	84	Confident	63 Å²	63	47.8 Å²	47.8	44%	0.441	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	149.1	177.9	54.4	0	0	0	0	111.6	C272	C272-S282 CarbonylContact O-C 3.57Å; C272-S282 VanDerWaalsContact O-CA 3.26Å; C272-S282 WeakPolarHBondContact O-CA 3.44Å
283	H	92.6	Very high	81.7	Confident	5 Å²	5	50.6 Å²	50.6	2%	0.023	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	135.7	174.4	-172.5	80.6	0	0	0	110.4	W198 E202 F205 T271 C272 Y285	W198-H283 HydrophobicContact CH2-CB 3.97Å; W198-H283 HydrophobicContact CZ2-CB 3.63Å; E202-H283 WeakPolarHBondContact CG-ND1 3.37Å; E202-H283 IonicContact OE1-CE1 3.76Å; E202-H283 IonicContact OE1-CG 2.79Å; E202-H283 IonicContact OE1-ND1 2.73Å; E202-H283 PolarHBondContact OE1-ND1 2.89Å; F205-H283 VanDerWaalsContact CB-NE2 3.28Å; F205-H283 WeakPolarHBondContact CB-NE2 3.49Å; T271-H283 WeakPolarHBondContact CA-O 3.46Å; C272-H283 PolarHBondContact N-O 3.29Å; C272-H283 PolarHBondContact O-N 3.22Å; H283-Y285 AromaticContact CD2-CE2 3.75Å; H283-Y285 AromaticContact CD2-CZ 3.77Å
284	N	94.3	Very high	79.2	Confident	80 Å²	80	52.8 Å²	52.8	43%	0.428	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.7	-173	-62	7.4	0	0	0	110.3	T269 T271	T269-N284 HydrophobicContact CG2-CB 4Å; T271-N284 VanDerWaalsContact CG2-OD1 3.32Å; T271-N284 WeakPolarHBondContact CG2-OD1 3.35Å; T271-N284 PolarHBondContact OG1-OD1 3.36Å
285	Y	94.5	Very high	76.8	Confident	8 Å²	8	57.3 Å²	57.3	3%	0.031	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	122.7	170.3	-61.7	-92.8	0	0	0	109	F205 V206 V209 L219 S220 W233 T269 Y270 H283	F205-Y285 HydrophobicContact CB-CE1 4.47Å; V206-Y285 WeakPolarHBondContact O-CD1 2.98Å; V209-Y285 HydrophobicContact CG2-CD1 4.04Å; L219-Y285 HydrophobicContact CB-CD2 4.3Å; L219-Y285 HydrophobicContact CB-CE2 4.32Å; L219-Y285 HydrophobicContact CB-CG 4.42Å; L219-Y285 HydrophobicContact CD1-CD2 4.16Å; L219-Y285 HydrophobicContact CD1-CG 4.05Å; L219-Y285 HydrophobicContact CD2-CD1 3.92Å; L219-Y285 HydrophobicContact CD2-CG 4.05Å; L219-Y285 HydrophobicContact CG-CG 4.4Å; S220-Y285 VanDerWaalsContact C-OH 3.23Å; S220-Y285 PolarHBondContact O-OH 2.77Å; W233-Y285 HydrophobicContact CH2-CE2 4.12Å; W233-Y285 HydrophobicContact CZ3-CD2 4.12Å; W233-Y285 HydrophobicContact CZ3-CE2 4.05Å; T269-Y285 CarbonylContact C-O 3.59Å; T269-Y285 WeakPolarHBondContact CA-O 3.49Å; Y270-Y285 PolarHBondContact N-O 2.84Å; Y270-Y285 PolarHBondContact O-N 2.86Å; H283-Y285 AromaticContact CD2-CE2 3.75Å; H283-Y285 AromaticContact CD2-CZ 3.77Å
286	T	94.1	Very high	74.4	Confident	57 Å²	57	62 Å²	62	35%	0.35	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	105.7	165.7	-56.1	0	0	0	0	108.1	K207 V208 V209 T288	K207-T286 PolarHBondContact O-N 3.15Å; V208-T286 CarbonylContact C-O 3.56Å; V208-T286 WeakPolarHBondContact CA-O 3.09Å; V209-T286 PolarHBondContact N-O 3.21Å; T286-T288 HydrophobicContact CG2-CG2 4.39Å
287	V	91.8	Very high	72.2	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.006	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	126.1	174.8	177.1	0	0	0	0	108.5	V209 L219 A267 G268 Y270 V289	V209-V287 HydrophobicContact CB-CG2 4.34Å; V209-V287 WeakPolarHBondContact O-CA 3.15Å; L219-V287 HydrophobicContact CD1-CG2 4.01Å; L219-V287 HydrophobicContact CD2-CG2 4.04Å; A267-V287 WeakPolarHBondContact CA-O 3.37Å; G268-V287 PolarHBondContact N-O 3.12Å; G268-V287 PolarHBondContact O-N 2.83Å; Y270-V287 HydrophobicContact CD2-CB 3.94Å; Y270-V287 HydrophobicContact CD2-CG2 3.52Å; Y270-V287 HydrophobicContact CE2-CB 3.91Å; Y270-V287 HydrophobicContact CE2-CG2 3.85Å; Y270-V287 HydrophobicContact CG-CG2 4.42Å; V287-V289 HydrophobicContact CG1-CG2 4.31Å
288	T	87.9	Confident	70.2	Confident	54 Å²	54	60.5 Å²	60.5	33%	0.331	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	111.1	173	52.5	0	0	0	0	108.9	V209 A210 S211 T286 V290	V209-T288 PolarHBondContact O-N 3.03Å; A210-T288 WeakPolarHBondContact CA-O 3.38Å; A210-T288 WeakPolarHBondContact CA-OG1 3.33Å; S211-T288 PolarHBondContact N-O 2.82Å; T286-T288 HydrophobicContact CG2-CG2 4.39Å; T288-V290 PolarHBondContact O-N 2.86Å
289	V	81.2	Confident	68.4	Low	20 Å²	20	65.9 Å²	65.9	12%	0.121	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	110.7	175.2	-175.9	0	0	0	0	108.1	S211 A213 L262 V263 D266 A267 V287	S211-V289 CarbonylContact O-C 3.5Å; S211-V289 WeakPolarHBondContact O-CA 3.21Å; A213-V289 HydrophobicContact CB-CG1 4.01Å; L262-V289 HydrophobicContact CB-CG1 4.05Å; L262-V289 HydrophobicContact CB-CG2 4.11Å; L262-V289 HydrophobicContact CD1-CG2 4.22Å; L262-V289 HydrophobicContact CD2-CG2 3.95Å; L262-V289 HydrophobicContact CG-CG2 4.34Å; V263-V289 WeakPolarHBondContact O-CG2 3.49Å; D266-V289 HydrophobicContact CB-CG2 4.15Å; A267-V289 HydrophobicContact CB-CG2 4.43Å; V287-V289 HydrophobicContact CG1-CG2 4.31Å
290	V	70.1	Confident	66.9	Low	65 Å²	65	76.7 Å²	76.7	39%	0.394	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	113.3	177.8	-176.4	0	0	0	0	107	A210 S211 P212 A213 T288 E292	A210-V290 HydrophobicContact CB-CG2 4.32Å; S211-V290 PolarHBondContact O-N 2.9Å; P212-V290 CarbonylContact C-O 3.54Å; P212-V290 VanDerWaalsContact CA-O 3.24Å; P212-V290 WeakPolarHBondContact CA-O 3.21Å; A213-V290 PolarHBondContact N-O 2.81Å; T288-V290 PolarHBondContact O-N 2.86Å; V290-E292 PolarHBondContact O-N 2.86Å
291	G	55.1	Low	64.8	Low	32 Å²	32	75.1 Å²	75.1	33%	0.33	42%	0.415	S	S	.	.			trans	-57.2	129.5	166.5	0	0	0	0	0	108.8	F293 S294	G291-F293 PolarHBondContact O-N 2.9Å; G291-S294 PolarHBondContact O-N 2.72Å; G291-S294 VanDerWaalsContact O-N 3.17Å
292	E	49.8	Very low	62.6	Low	104 Å²	104	77.6 Å²	77.6	49%	0.486	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	21.3	-167.8	-156.8	151.6	-132.8	0	0	114	P212 R215 V290	P212-E292 HydrophobicContact CB-CB 4.44Å; P212-E292 HydrophobicContact CB-CG 4.27Å; P212-E292 VanDerWaalsContact CB-OE1 3.27Å; P212-E292 WeakPolarHBondContact CB-OE1 3.4Å; P212-E292 WeakPolarHBondContact CG-OE1 3.28Å; R215-E292 IonicContact CZ-OE1 2.84Å; R215-E292 VanDerWaalsContact CZ-OE1 3.3Å; R215-E292 IonicContact NE-OE1 3.14Å; R215-E292 PolarHBondContact NE-OE1 2.82Å; R215-E292 IonicContact NH2-OE1 2.69Å; R215-E292 PolarHBondContact NH2-OE1 2.79Å; V290-E292 PolarHBondContact O-N 2.86Å
293	F	46.6	Very low	59.9	Low	59 Å²	59	80.7 Å²	80.7	26%	0.259	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-14.3	-177.7	-53.7	-55	0	0	0	113.4	G291 A295 W297 A319 P339	G291-F293 PolarHBondContact O-N 2.9Å; F293-A295 PolarHBondContact O-N 2.67Å; F293-W297 HydrophobicContact CB-CG 4.48Å; F293-A319 HydrophobicContact CD1-CB 3.83Å; F293-A319 HydrophobicContact CE1-CB 3.23Å; F293-A319 HydrophobicContact CE2-CB 4.43Å; F293-A319 HydrophobicContact CZ-CB 3.58Å; F293-P339 HydrophobicContact CE1-CB 3.86Å; F293-P339 HydrophobicContact CE1-CG 4.34Å; F293-P339 HydrophobicContact CZ-CB 4.21Å
294	S	39.3	Very low	57.6	Low	99 Å²	99	87.6 Å²	87.6	69%	0.692	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	14.6	-164.4	-147.6	0	0	0	0	116.6	G291	G291-S294 PolarHBondContact O-N 2.72Å; G291-S294 VanDerWaalsContact O-N 3.17Å
295	A	42.8	Very low	55.4	Low	95 Å²	95	88.4 Å²	88.4	79%	0.785	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-23.3	-176.5	0	0	0	0	0	114.8	F293	F293-A295 PolarHBondContact O-N 2.67Å
296	N	38.8	Very low	52.9	Low	154 Å²	154	93 Å²	93	82%	0.824	51%	0.513	S	S	*	.	S	Bend	trans	-143.4	18.2	-175.2	-101.2	-25.7	0	0	0	113
297	W	35.5	Very low	50.6	Low	58 Å²	58	93.5 Å²	93.5	22%	0.22	52%	0.518	C	S	.	.			trans	-84.5	127.5	-174.2	-104.8	60.2	0	0	0	112.5	F293 Q299 V302 P320 D321	F293-W297 HydrophobicContact CB-CG 4.48Å; W297-Q299 PolarHBondContact O-N 2.93Å; W297-V302 HydrophobicContact CE3-CG2 3.94Å; W297-V302 HydrophobicContact CZ3-CG2 4.38Å; W297-P320 HydrophobicContact CH2-CB 3.55Å; W297-P320 HydrophobicContact CH2-CG 3.49Å; W297-P320 VanDerWaalsContact CH2-CG 3.49Å; W297-P320 HydrophobicContact CZ2-CB 3.52Å; W297-P320 HydrophobicContact CZ2-CG 3.56Å; W297-D321 PolarHBondContact NE1-OD2 2.65Å; W297-D321 VanDerWaalsContact NE1-OD2 3.08Å
298	P	35.6	Very low	48.7	Very low	75 Å²	75	94.5 Å²	94.5	49%	0.487	53%	0.525	S	S	.	.			trans	-67.8	118.2	171.6	28.3	-32.3	0	0	0	109.2	R300 S301	P298-R300 PolarHBondContact O-N 3.18Å; P298-S301 PolarHBondContact O-N 3.42Å
299	Q	41.5	Very low	47.1	Very low	185 Å²	185	93 Å²	93	86%	0.864	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-57.9	-15.1	-172.5	-68.5	-170.7	-69.8	0	0	115.1	W297 S301	W297-Q299 PolarHBondContact O-N 2.93Å; Q299-S301 VanDerWaalsContact C-N 3.31Å; Q299-S301 PolarHBondContact O-N 3.34Å
300	R	45.6	Very low	46	Very low	253 Å²	253	97.2 Å²	97.2	96%	0.955	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-79.5	-4.6	-177.8	-68.4	-177.6	173	173	-3.3	114.9	P298	P298-R300 PolarHBondContact O-N 3.18Å
301	S	43.2	Very low	45.6	Very low	72 Å²	72	96.6 Å²	96.6	50%	0.503	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-114.2	6.6	-174.6	-56.9	0	0	0	0	114.2	P298 Q299 V303	P298-S301 PolarHBondContact O-N 3.42Å; Q299-S301 VanDerWaalsContact C-N 3.31Å; Q299-S301 PolarHBondContact O-N 3.34Å; S301-V303 VanDerWaalsContact C-N 3.31Å; S301-V303 PolarHBondContact O-N 3.1Å
302	V	42	Very low	45.7	Very low	91 Å²	91	98.5 Å²	98.5	55%	0.552	53%	0.53	S	S	*	.			trans	-84.1	74.2	180	-169.6	0	0	0	0	110.4	W297 Q304	W297-V302 HydrophobicContact CE3-CG2 3.94Å; W297-V302 HydrophobicContact CZ3-CG2 4.38Å; V302-Q304 PolarHBondContact O-N 2.82Å; V302-Q304 VanDerWaalsContact O-N 3.09Å
303	V	36.9	Very low	46.1	Very low	127 Å²	127	97.2 Å²	97.2	77%	0.77	53%	0.531	S	S	*	.			trans	-65.7	104.5	153.1	177.4	0	0	0	0	105.9	S301 L305	S301-V303 VanDerWaalsContact C-N 3.31Å; S301-V303 PolarHBondContact O-N 3.1Å; V303-L305 VanDerWaalsContact C-N 3.3Å; V303-L305 PolarHBondContact O-N 3.44Å
304	Q	43.3	Very low	46.6	Very low	151 Å²	151	95.3 Å²	95.3	71%	0.706	52%	0.523	S	S	*	.			trans	-70.4	88.2	-177.8	-173.9	173.4	-60.6	0	0	109.5	V302 V306	V302-Q304 PolarHBondContact O-N 2.82Å; V302-Q304 VanDerWaalsContact O-N 3.09Å; Q304-V306 PolarHBondContact O-N 3.18Å
305	L	47.6	Very low	47.6	Very low	96 Å²	96	96.6 Å²	96.6	50%	0.503	52%	0.516	S	S	.	.			trans	-51.4	109.4	177.4	-83	160.4	0	0	0	109.9	V303 C307 C308 S309	V303-L305 VanDerWaalsContact C-N 3.3Å; V303-L305 PolarHBondContact O-N 3.44Å; L305-C307 PolarHBondContact O-N 2.87Å; L305-C308 HydrophobicContact CB-CB 4.15Å; L305-C308 VanDerWaalsContact CB-SG 3.56Å; L305-C308 WeakPolarHBondContact O-CA 3.47Å; L305-C308 WeakPolarHBondContact O-CB 3.36Å; L305-C308 PolarHBondContact O-N 3.2Å; L305-S309 PolarHBondContact O-N 2.89Å
306	V	43.5	Very low	48.9	Very low	105 Å²	105	92.1 Å²	92.1	64%	0.636	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-57.2	-40.5	-175	-179.1	0	0	0	0	110.6	Q304 C308 S309 E310	Q304-V306 PolarHBondContact O-N 3.18Å; V306-C308 PolarHBondContact O-N 2.9Å; V306-S309 WeakPolarHBondContact O-CB 3.48Å; V306-S309 PolarHBondContact O-N 2.76Å; V306-S309 PolarHBondContact O-OG 3.01Å; V306-E310 PolarHBondContact O-N 2.99Å
307	C	44.4	Very low	50.4	Low	67 Å²	67	87 Å²	87	45%	0.453	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-56.3	-31.6	174.6	-48.4	0	0	0	0	113.7	L305 S309	L305-C307 PolarHBondContact O-N 2.87Å; C307-S309 VanDerWaalsContact C-N 3.3Å
308	C	51.8	Low	52.2	Low	23 Å²	23	84.7 Å²	84.7	16%	0.155	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-82	-7.4	177	-56.6	0	0	0	0	113.1	P264 L305 V306 I317 L341	P264-C308 WeakPolarHBondContact CD-O 3.27Å; P264-C308 WeakPolarHBondContact CG-O 3.15Å; L305-C308 HydrophobicContact CB-CB 4.15Å; L305-C308 VanDerWaalsContact CB-SG 3.56Å; L305-C308 WeakPolarHBondContact O-CA 3.47Å; L305-C308 WeakPolarHBondContact O-CB 3.36Å; L305-C308 PolarHBondContact O-N 3.2Å; V306-C308 PolarHBondContact O-N 2.9Å; C308-I317 WeakPolarHBondContact SG-CD1 3.36Å; C308-L341 HydrophobicContact CB-CD2 3.7Å
309	S	55.3	Low	53.9	Low	22 Å²	22	81.2 Å²	81.2	15%	0.154	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-35.2	178.9	70.1	0	0	0	0	112.4	S265 L305 V306 C307	S265-S309 WeakPolarHBondContact CB-O 3.31Å; S265-S309 PolarHBondContact N-O 2.83Å; S265-S309 PolarHBondContact OG-O 2.83Å; L305-S309 PolarHBondContact O-N 2.89Å; V306-S309 WeakPolarHBondContact O-CB 3.48Å; V306-S309 PolarHBondContact O-N 2.76Å; V306-S309 PolarHBondContact O-OG 3.01Å; C307-S309 VanDerWaalsContact C-N 3.3Å
310	E	58.1	Low	55.1	Low	109 Å²	109	76 Å²	76	51%	0.509	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	158.8	-178.8	-58.2	-156.4	141.8	0	0	112.3	V306 V312	V306-E310 PolarHBondContact O-N 2.99Å; E310-V312 HydrophobicContact CB-CG2 3.91Å; E310-V312 PolarHBondContact O-N 3.33Å
311	R	61.4	Low	56.5	Low	52 Å²	52	67 Å²	67	20%	0.196	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	64	175.2	-64.2	179.9	172.2	-92.3	4.5	110.9	L248 P260 D261 V263 D266 D343	L248-R311 PolarHBondContact O-NE 3.35Å; P260-R311 PolarHBondContact O-NH1 3.43Å; P260-R311 PolarHBondContact O-NH2 2.83Å; D261-R311 PolarHBondContact O-NH1 2.98Å; D261-R311 PolarHBondContact O-NH2 3.11Å; V263-R311 HydrophobicContact CG1-CG 4.21Å; V263-R311 HydrophobicContact CG2-CG 3.56Å; D266-R311 IonicContact OD1-NE 3.08Å; D266-R311 IonicContact OD1-NH2 2.89Å; D266-R311 IonicContact OD2-CZ 3.99Å; D266-R311 VanDerWaalsContact OD2-CZ 3.31Å; D266-R311 IonicContact OD2-NE 2.93Å; D266-R311 PolarHBondContact OD2-NE 3.01Å; D266-R311 IonicContact OD2-NH2 3.85Å; D266-R311 PolarHBondContact OD2-NH2 2.9Å; R311-D343 WeakPolarHBondContact CA-OD2 3.47Å
312	V	55.9	Low	58.2	Low	71 Å²	71	66 Å²	66	43%	0.43	36%	0.36	S	S	.	.			trans	-113.6	106.3	-179.3	178.4	0	0	0	0	107.6	E310 H314 D343	E310-V312 HydrophobicContact CB-CG2 3.91Å; E310-V312 PolarHBondContact O-N 3.33Å; V312-H314 PolarHBondContact O-CD2 2.77Å; V312-H314 PolarHBondContact O-N 3.48Å; V312-H314 VanDerWaalsContact O-N 3.1Å; V312-D343 PolarHBondContact N-OD2 3.39Å
313	P	58.2	Low	60.4	Low	77 Å²	77	62.1 Å²	62.1	50%	0.5	34%	0.337	S	S	.	.			trans	-50.5	120	-178.2	-31	37.1	0	0	0	112	L344 L413	P313-L344 HydrophobicContact CB-CD1 4.38Å; P313-L344 HydrophobicContact CB-CD2 4.49Å; P313-L344 HydrophobicContact CB-CG 4.29Å; P313-L413 HydrophobicContact CB-CD1 3.57Å; P313-L413 WeakPolarHBondContact O-CD1 3.34Å
314	H	57.2	Low	62.6	Low	19 Å²	19	60.6 Å²	60.6	9%	0.088	32%	0.32	C	S	.	.			trans	-127.8	159.5	-174.9	63.4	74.5	0	0	0	111.6	V312 L341 D343 N411	V312-H314 PolarHBondContact O-CD2 2.77Å; V312-H314 PolarHBondContact O-N 3.48Å; V312-H314 VanDerWaalsContact O-N 3.1Å; H314-L341 PolarHBondContact CE1-O 3.49Å; H314-D343 IonicContact CD2-OD1 3Å; H314-D343 IonicContact NE2-OD1 2.69Å; H314-N411 PolarHBondContact O-ND2 2.79Å
315	K	60.8	Low	64.8	Low	126 Å²	126	58.5 Å²	58.5	55%	0.548	31%	0.314	S	S	.	.	S	Bend	trans	-57.8	149.1	167.7	68.9	-179.3	-179.1	-179	0	109.8	V416	K315-V416 HydrophobicContact CD-CG1 4.14Å; K315-V416 HydrophobicContact CG-CG1 4.34Å
316	P	70.1	Confident	66.8	Low	1 Å²	1	56 Å²	56	1%	0.006	30%	0.301	C	S	.	.			trans	-60.2	151.9	-172.3	-18.7	31.2	0	0	0	112	V340 P346 V409 N411 G414 V416	P316-V340 HydrophobicContact CB-CG1 3.85Å; P316-P346 HydrophobicContact CG-CB 4.36Å; P316-V409 HydrophobicContact CB-CB 4.37Å; P316-V409 HydrophobicContact CB-CG1 3.59Å; P316-V409 HydrophobicContact CG-CG1 3.98Å; P316-N411 HydrophobicContact CG-CB 3.89Å; P316-G414 WeakPolarHBondContact CD-O 3.45Å; P316-V416 HydrophobicContact CB-CG2 4.01Å; P316-V416 VanDerWaalsContact O-CG1 3.26Å; P316-V416 WeakPolarHBondContact O-CG1 3.27Å; P316-V416 WeakPolarHBondContact O-CG2 3.4Å
317	I	69.8	Low	69	Low	47 Å²	47	55 Å²	55	24%	0.241	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	108.6	-179.5	-63.1	173.4	0	0	0	108.7	C308 V340 L341	C308-I317 WeakPolarHBondContact SG-CD1 3.36Å; I317-V340 WeakPolarHBondContact O-CA 3.4Å; I317-L341 HydrophobicContact CB-CB 4.46Å; I317-L341 PolarHBondContact N-O 3.16Å; I317-L341 PolarHBondContact O-N 2.89Å
318	I	74.9	Confident	71.1	Confident	9 Å²	9	52.5 Å²	52.5	5%	0.046	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	129	173.2	-58.5	162.5	0	0	0	108.7	F322 C338 V340 V409 V416 K418	I318-F322 WeakPolarHBondContact CG2-O 3.21Å; I318-C338 WeakPolarHBondContact CG2-SG 3.39Å; I318-V340 HydrophobicContact CG1-CG2 4.35Å; I318-V409 HydrophobicContact CD1-CB 4.45Å; I318-V409 HydrophobicContact CD1-CG2 3.93Å; I318-V409 HydrophobicContact CG1-CB 4.41Å; I318-V409 HydrophobicContact CG1-CG2 3.92Å; I318-V416 HydrophobicContact CD1-CB 4.43Å; I318-V416 HydrophobicContact CD1-CG2 3.81Å; I318-V416 HydrophobicContact CG1-CG2 3.85Å; I318-K418 HydrophobicContact CB-CD 4.12Å; I318-K418 HydrophobicContact CD1-CB 4.25Å; I318-K418 HydrophobicContact CD1-CG 4.14Å; I318-K418 HydrophobicContact CG2-CD 3.83Å; I318-K418 HydrophobicContact CG2-CG 4.43Å; I318-K418 PolarHBondContact O-NZ 2.82Å; I318-K418 VanDerWaalsContact O-NZ 3.17Å
319	A	70.8	Confident	72.8	Confident	2 Å²	2	53.1 Å²	53.1	2%	0.017	28%	0.278	C	S	.	.			trans	-43.5	131.6	177.8	0	0	0	0	0	112.3	F293 D321 F322 P339 K418	F293-A319 HydrophobicContact CD1-CB 3.83Å; F293-A319 HydrophobicContact CE1-CB 3.23Å; F293-A319 HydrophobicContact CE2-CB 4.43Å; F293-A319 HydrophobicContact CZ-CB 3.58Å; A319-D321 PolarHBondContact O-N 2.73Å; A319-F322 HydrophobicContact CB-CB 4.16Å; A319-F322 HydrophobicContact CB-CD2 3.64Å; A319-F322 HydrophobicContact CB-CE2 4.44Å; A319-F322 HydrophobicContact CB-CG 4.25Å; A319-F322 PolarHBondContact O-N 2.96Å; A319-P339 HydrophobicContact CB-CB 4.39Å; A319-P339 PolarHBondContact N-O 2.68Å; A319-K418 PolarHBondContact O-NZ 2.83Å
320	P	67.1	Low	74.5	Confident	77 Å²	77	55.1 Å²	55.1	50%	0.5	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-44.2	-168.4	-29.6	35.5	0	0	0	115	W297 F322 K418	W297-P320 HydrophobicContact CH2-CB 3.55Å; W297-P320 HydrophobicContact CH2-CG 3.49Å; W297-P320 VanDerWaalsContact CH2-CG 3.49Å; W297-P320 HydrophobicContact CZ2-CB 3.52Å; W297-P320 HydrophobicContact CZ2-CG 3.56Å; P320-F322 VanDerWaalsContact C-N 3.32Å; P320-F322 PolarHBondContact O-N 3.25Å; P320-K418 PolarHBondContact O-NZ 3Å
321	D	74.3	Confident	75.8	Confident	62 Å²	62	51.6 Å²	51.6	33%	0.332	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	6.8	179.4	-45.7	-37.7	0	0	0	115.5	W297 A319 K324	W297-D321 PolarHBondContact NE1-OD2 2.65Å; W297-D321 VanDerWaalsContact NE1-OD2 3.08Å; A319-D321 PolarHBondContact O-N 2.73Å; D321-K324 WeakPolarHBondContact O-CE 3.16Å; D321-K324 WeakPolarHBondContact O-CG 3Å
322	F	79	Confident	77.1	Confident	51 Å²	51	53.3 Å²	53.3	22%	0.224	29%	0.293	C	S	.	.			trans	-124.1	149.9	-173.2	-67.6	-99.1	0	0	0	112.5	I318 A319 P320 K324 S337 P339 K418	I318-F322 WeakPolarHBondContact CG2-O 3.21Å; A319-F322 HydrophobicContact CB-CB 4.16Å; A319-F322 HydrophobicContact CB-CD2 3.64Å; A319-F322 HydrophobicContact CB-CE2 4.44Å; A319-F322 HydrophobicContact CB-CG 4.25Å; A319-F322 PolarHBondContact O-N 2.96Å; P320-F322 VanDerWaalsContact C-N 3.32Å; P320-F322 PolarHBondContact O-N 3.25Å; F322-K324 HydrophobicContact CD1-CG 4.46Å; F322-S337 WeakPolarHBondContact CD1-O 3.06Å; F322-P339 HydrophobicContact CD1-CG 4.35Å; F322-P339 HydrophobicContact CG-CG 4.37Å; F322-K418 WeakPolarHBondContact O-CD 3.35Å
323	P	87.7	Confident	78.7	Confident	11 Å²	11	54.3 Å²	54.3	7%	0.071	30%	0.296	C	S	.	.	S	Bend	cis	-66.3	156.4	-9.4	28.4	-31.2	0	0	0	111.5	F336 S337 W350 A420	P323-F336 HydrophobicContact CB-CD1 4.14Å; P323-S337 WeakPolarHBondContact CA-O 3.2Å; P323-W350 HydrophobicContact CB-CH2 4.35Å; P323-W350 HydrophobicContact CB-CZ3 4.35Å; P323-A420 HydrophobicContact CB-CB 3.85Å; P323-A420 HydrophobicContact CG-CB 3.78Å
324	K	83.8	Confident	80.1	Confident	94 Å²	94	50.8 Å²	50.8	41%	0.409	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-95.6	143.9	-179.6	-68.2	-172.7	-177	-151.8	0	110.3	D321 F322 F336 A420	D321-K324 WeakPolarHBondContact O-CE 3.16Å; D321-K324 WeakPolarHBondContact O-CG 3Å; F322-K324 HydrophobicContact CD1-CG 4.46Å; K324-F336 WeakPolarHBondContact O-CD1 3.45Å; K324-F336 VanDerWaalsContact O-CE1 3.22Å; K324-F336 WeakPolarHBondContact O-CE1 3.33Å; K324-A420 WeakPolarHBondContact O-CB 3.48Å
325	N	90	Very high	81.7	Confident	107 Å²	107	53.1 Å²	53.1	57%	0.572	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-59.1	140.9	167.1	-66.8	-7.8	0	0	0	109.4	A420 W421	N325-A420 WeakPolarHBondContact OD1-CA 3.42Å; N325-W421 WeakPolarHBondContact CA-O 3.32Å; N325-W421 PolarHBondContact OD1-N 3.49Å
326	L	89.2	Confident	83	Confident	44 Å²	44	47.2 Å²	47.2	23%	0.23	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	138.3	-177.6	-63.1	176.5	0	0	0	110.1	V328 A334 T335 F336 W421 L422 E423	L326-V328 HydrophobicContact CB-CG2 4.29Å; L326-A334 HydrophobicContact CD1-CB 4.34Å; L326-T335 WeakPolarHBondContact CD1-O 3.47Å; L326-F336 HydrophobicContact CB-CE1 4.37Å; L326-F336 HydrophobicContact CD1-CD1 3.67Å; L326-F336 HydrophobicContact CD1-CD2 4.26Å; L326-F336 HydrophobicContact CD1-CE1 3.7Å; L326-F336 HydrophobicContact CD1-CE2 4.29Å; L326-F336 HydrophobicContact CD1-CG 3.97Å; L326-F336 HydrophobicContact CD1-CZ 4.04Å; L326-F336 HydrophobicContact CG-CD1 4.09Å; L326-F336 HydrophobicContact CG-CE1 3.83Å; L326-F336 HydrophobicContact CG-CZ 4.39Å; L326-W421 PolarHBondContact N-O 3.45Å; L326-L422 HydrophobicContact CB-CD1 3.91Å; L326-E423 PolarHBondContact O-N 2.83Å
327	T	89.7	Confident	83.7	Confident	83 Å²	83	48.9 Å²	48.9	51%	0.509	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	122.3	170.4	-55.6	0	0	0	0	108.3	E423 L425	T327-E423 WeakPolarHBondContact CA-O 3.28Å; T327-E423 WeakPolarHBondContact CB-OE2 3.35Å; T327-E423 HydrophobicContact CG2-CB 4.2Å; T327-E423 HydrophobicContact CG2-CG 4.05Å; T327-E423 WeakPolarHBondContact CG2-OE2 3.32Å; T327-E423 PolarHBondContact OG1-OE2 2.94Å; T327-L425 HydrophobicContact CG2-CD1 3.5Å; T327-L425 VanDerWaalsContact CG2-CD1 3.5Å; T327-L425 HydrophobicContact CG2-CD2 4.34Å; T327-L425 HydrophobicContact CG2-CG 3.65Å
328	V	88.3	Confident	84.1	Confident	15 Å²	15	46.7 Å²	46.7	9%	0.091	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	143.3	-167.2	179.5	0	0	0	0	109.4	L326 E332 A334 L422 E423 V424 L425	L326-V328 HydrophobicContact CB-CG2 4.29Å; V328-E332 HydrophobicContact CG1-CB 3.53Å; V328-A334 HydrophobicContact CG2-CB 3.98Å; V328-L422 HydrophobicContact CB-CD1 4.4Å; V328-L422 HydrophobicContact CG2-CD1 4.07Å; V328-E423 PolarHBondContact N-O 3.43Å; V328-V424 CarbonylContact O-C 3.59Å; V328-V424 WeakPolarHBondContact O-CA 3.35Å; V328-L425 PolarHBondContact O-N 2.69Å
329	H	88.2	Confident	84.2	Confident	37 Å²	37	47.8 Å²	47.8	17%	0.171	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	154.2	174.8	-68.7	-79.2	0	0	0	112.4	G331 E332 L425 P426 R428	H329-G331 PolarHBondContact O-N 2.9Å; H329-E332 HydrophobicContact CB-CG 4.22Å; H329-E332 WeakPolarHBondContact CB-OE2 3.49Å; H329-E332 IonicContact CD2-OE1 3.68Å; H329-E332 IonicContact CD2-OE2 3.31Å; H329-E332 IonicContact CG-OE2 2.77Å; H329-E332 PolarHBondContact N-OE2 3.06Å; H329-E332 WeakPolarHBondContact O-CB 3.47Å; H329-E332 PolarHBondContact O-N 2.88Å; H329-L425 CarbonylContact C-O 3.58Å; H329-L425 VanDerWaalsContact CA-O 3.32Å; H329-L425 WeakPolarHBondContact CA-O 3.46Å; H329-P426 PolarHBondContact ND1-O 2.88Å; H329-R428 PolarHBondContact NE2-NE 2.94Å; H329-R428 PolarHBondContact NE2-NH2 3.41Å
330	V	90	Very high	84.2	Confident	63 Å²	63	49 Å²	49	38%	0.382	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	125.3	169.6	175.3	0	0	0	0	110.8	V397 M399 V424 L425	V330-V397 CarbonylContact C-O 3.6Å; V330-V397 VanDerWaalsContact CA-O 3.31Å; V330-V397 WeakPolarHBondContact CA-O 3.01Å; V330-M399 HydrophobicContact CG2-CG 3.69Å; V330-M399 HydrophobicContact CG2-SD 3.39Å; V330-M399 WeakPolarHBondContact CG2-SD 3.46Å; V330-V424 HydrophobicContact CG2-CG1 3.8Å; V330-L425 PolarHBondContact N-O 2.92Å
331	G	86.4	Confident	84	Confident	36 Å²	36	46.8 Å²	46.8	37%	0.371	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.7	-10.2	-178.9	0	0	0	0	0	115.5	H329 N396 V397	H329-G331 PolarHBondContact O-N 2.9Å; G331-N396 WeakPolarHBondContact CA-OD1 3Å; G331-V397 PolarHBondContact N-O 2.94Å
332	E	88.2	Confident	83.5	Confident	87 Å²	87	44.7 Å²	44.7	41%	0.407	25%	0.252	S	S	.	.	S	Bend	trans	-79.6	165.4	168.3	-67.2	175.6	160.1	0	0	110.5	V328 H329 V397	V328-E332 HydrophobicContact CG1-CB 3.53Å; H329-E332 HydrophobicContact CB-CG 4.22Å; H329-E332 WeakPolarHBondContact CB-OE2 3.49Å; H329-E332 IonicContact CD2-OE1 3.68Å; H329-E332 IonicContact CD2-OE2 3.31Å; H329-E332 IonicContact CG-OE2 2.77Å; H329-E332 PolarHBondContact N-OE2 3.06Å; H329-E332 WeakPolarHBondContact O-CB 3.47Å; H329-E332 PolarHBondContact O-N 2.88Å; E332-V397 WeakPolarHBondContact O-CB 3.3Å; E332-V397 WeakPolarHBondContact O-CG2 2.99Å; E332-V397 PolarHBondContact O-N 3.42Å
333	N	90.1	Very high	82.4	Confident	93 Å²	93	43.8 Å²	43.8	50%	0.497	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-95.6	133.2	175.6	-63.8	-14.9	0	0	0	110	L394 L395 N396	N333-L394 CarbonylContact C-O 3.41Å; N333-L394 VanDerWaalsContact CA-O 3.29Å; N333-L394 WeakPolarHBondContact CA-O 3.44Å; N333-L395 WeakPolarHBondContact ND2-CD2 3.46Å; N333-L395 WeakPolarHBondContact OD1-CA 3.45Å; N333-N396 PolarHBondContact OD1-N 3.13Å
334	A	87.6	Confident	81.1	Confident	2 Å²	2	45.9 Å²	45.9	2%	0.017	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	145.3	169.4	0	0	0	0	0	110.5	L326 V328 L394 V397 L422	L326-A334 HydrophobicContact CD1-CB 4.34Å; V328-A334 HydrophobicContact CG2-CB 3.98Å; A334-L394 HydrophobicContact CB-CB 4.28Å; A334-L394 HydrophobicContact CB-CD1 4.43Å; A334-L394 PolarHBondContact N-O 3.43Å; A334-L394 PolarHBondContact O-N 3.21Å; A334-V397 HydrophobicContact CB-CG2 3.91Å; A334-L422 HydrophobicContact CB-CD1 3.77Å; A334-L422 HydrophobicContact CB-CD2 4.18Å
335	T	89.6	Confident	80.3	Confident	69 Å²	69	49.3 Å²	49.3	42%	0.423	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	104.2	179.5	-59.1	0	0	0	0	110.5	L326 T391 L392 V393	L326-T335 WeakPolarHBondContact CD1-O 3.47Å; T335-T391 HydrophobicContact CG2-CG2 3.49Å; T335-T391 VanDerWaalsContact CG2-CG2 3.49Å; T335-L392 CarbonylContact C-O 3.57Å; T335-L392 WeakPolarHBondContact CA-O 3.31Å; T335-V393 HydrophobicContact CG2-CG2 4.11Å
336	F	88.2	Confident	79.4	Confident	2 Å²	2	45 Å²	45	1%	0.009	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	142.4	170	-67.4	-76.4	0	0	0	109.9	P323 K324 L326 W350 T391 L392 L394 Y405 A420 L422	P323-F336 HydrophobicContact CB-CD1 4.14Å; K324-F336 WeakPolarHBondContact O-CD1 3.45Å; K324-F336 VanDerWaalsContact O-CE1 3.22Å; K324-F336 WeakPolarHBondContact O-CE1 3.33Å; L326-F336 HydrophobicContact CB-CE1 4.37Å; L326-F336 HydrophobicContact CD1-CD1 3.67Å; L326-F336 HydrophobicContact CD1-CD2 4.26Å; L326-F336 HydrophobicContact CD1-CE1 3.7Å; L326-F336 HydrophobicContact CD1-CE2 4.29Å; L326-F336 HydrophobicContact CD1-CG 3.97Å; L326-F336 HydrophobicContact CD1-CZ 4.04Å; L326-F336 HydrophobicContact CG-CD1 4.09Å; L326-F336 HydrophobicContact CG-CE1 3.83Å; L326-F336 HydrophobicContact CG-CZ 4.39Å; F336-W350 HydrophobicContact CB-CH2 3.63Å; F336-W350 HydrophobicContact CB-CZ3 3.74Å; F336-W350 HydrophobicContact CG-CZ3 4.4Å; F336-T391 CarbonylContact O-C 3.58Å; F336-T391 WeakPolarHBondContact O-CA 3.47Å; F336-L392 HydrophobicContact CB-CB 4.39Å; F336-L392 HydrophobicContact CD2-CD2 4.31Å; F336-L392 PolarHBondContact N-O 2.81Å; F336-L392 PolarHBondContact O-N 2.88Å; F336-L394 HydrophobicContact CD2-CD1 4.48Å; F336-L394 HydrophobicContact CE2-CD1 4.21Å; F336-Y405 HydrophobicContact CD2-CG 4.2Å; F336-Y405 HydrophobicContact CE2-CD1 4.27Å; F336-Y405 AromaticContact CE2-CD2 3.54Å; F336-Y405 HydrophobicContact CE2-CD2 3.54Å; F336-Y405 HydrophobicContact CE2-CE2 4.2Å; F336-Y405 AromaticContact CE2-CG 3.59Å; F336-Y405 HydrophobicContact CE2-CG 3.59Å; F336-Y405 AromaticContact CZ-CD2 3.83Å; F336-Y405 HydrophobicContact CZ-CD2 3.83Å; F336-Y405 HydrophobicContact CZ-CG 4.15Å; F336-A420 HydrophobicContact CD1-CB 4.14Å; F336-A420 HydrophobicContact CE1-CB 3.71Å; F336-L422 HydrophobicContact CE2-CB 4.26Å; F336-L422 HydrophobicContact CZ-CB 3.89Å; F336-L422 HydrophobicContact CZ-CD1 4.47Å
337	S	85	Confident	78.8	Confident	36 Å²	36	48.6 Å²	48.6	25%	0.252	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	143.9	168.7	-175.6	0	0	0	0	109.2	F322 P323 Y390	F322-S337 WeakPolarHBondContact CD1-O 3.06Å; P323-S337 WeakPolarHBondContact CA-O 3.2Å; S337-Y390 CarbonylContact C-O 3.57Å; S337-Y390 WeakPolarHBondContact CA-O 3.31Å
338	C	78.4	Confident	78.3	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.253	C	S	.	.			trans	-137.8	76.6	178.3	179	0	0	0	0	109.4	I318 I348 W350 Y390 C407	I318-C338 WeakPolarHBondContact CG2-SG 3.39Å; C338-I348 HydrophobicContact CB-CD1 4.2Å; C338-W350 HydrophobicContact CB-CH2 3.55Å; C338-W350 HydrophobicContact CB-CZ2 3.64Å; C338-Y390 PolarHBondContact N-O 3.47Å; C338-Y390 WeakPolarHBondContact O-CD1 3.28Å; C338-C407 HydrophobicContact CB-CB 3.53Å; C338-C407 WeakPolarHBondContact CB-SG 3.37Å; C338-C407 WeakPolarHBondContact SG-CB 3.22Å; C338-C407 CovalentContact SG-SG 2.03Å; C338-C407 PolarHBondContact SG-SG 2.8Å
339	P	77.1	Confident	78	Confident	33 Å²	33	47.1 Å²	47.1	21%	0.214	26%	0.258	C	S	.	.			trans	-69.7	141.4	-179.8	-15.6	30.4	0	0	0	111.5	F293 A319 F322	F293-P339 HydrophobicContact CE1-CB 3.86Å; F293-P339 HydrophobicContact CE1-CG 4.34Å; F293-P339 HydrophobicContact CZ-CB 4.21Å; A319-P339 HydrophobicContact CB-CB 4.39Å; A319-P339 PolarHBondContact N-O 2.68Å; F322-P339 HydrophobicContact CD1-CG 4.35Å; F322-P339 HydrophobicContact CG-CG 4.37Å
340	V	70.1	Confident	77.8	Confident	28 Å²	28	45.5 Å²	45.5	17%	0.17	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	135.7	-171.5	174	0	0	0	0	110.7	P316 I317 I318 P346 Y390 V409	P316-V340 HydrophobicContact CB-CG1 3.85Å; I317-V340 WeakPolarHBondContact O-CA 3.4Å; I318-V340 HydrophobicContact CG1-CG2 4.35Å; V340-P346 HydrophobicContact CG1-CB 4.47Å; V340-P346 HydrophobicContact CG1-CG 4.17Å; V340-Y390 HydrophobicContact CB-CD1 4.16Å; V340-Y390 HydrophobicContact CB-CE1 3.71Å; V340-Y390 HydrophobicContact CG2-CD1 3.81Å; V340-Y390 HydrophobicContact CG2-CE1 3.68Å; V340-V409 HydrophobicContact CB-CG1 4.36Å; V340-V409 HydrophobicContact CG1-CG1 3.78Å; V340-V409 HydrophobicContact CG2-CB 4.3Å; V340-V409 HydrophobicContact CG2-CG1 3.66Å; V340-V409 HydrophobicContact CG2-CG2 3.78Å
341	L	64.3	Low	77.4	Confident	30 Å²	30	42.6 Å²	42.6	16%	0.157	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.3	163.1	-175.2	70	0	0	0	109.5	A213 C308 H314 I317	A213-L341 HydrophobicContact CB-CD1 4.45Å; C308-L341 HydrophobicContact CB-CD2 3.7Å; H314-L341 PolarHBondContact CE1-O 3.49Å; I317-L341 HydrophobicContact CB-CB 4.46Å; I317-L341 PolarHBondContact N-O 3.16Å; I317-L341 PolarHBondContact O-N 2.89Å
342	S	63.6	Low	77.5	Confident	18 Å²	18	44 Å²	44	13%	0.126	23%	0.226	C	C	.	.			trans	-169	110.2	-178.5	-178.2	0	0	0	0	112.4	L344 N411	S342-L344 WeakPolarHBondContact CB-O 3.47Å; S342-L344 PolarHBondContact O-N 3.04Å; S342-L344 VanDerWaalsContact O-N 3.08Å; S342-L344 PolarHBondContact OG-O 3.05Å; S342-N411 PolarHBondContact OG-ND2 3.17Å
343	D	54.5	Low	77.3	Confident	31 Å²	31	40 Å²	40	17%	0.166	21%	0.208	C	C	.	.	S	Bend	trans	-55.9	-20.9	174.4	-68.5	29.5	0	0	0	114.4	R311 V312 H314	R311-D343 WeakPolarHBondContact CA-OD2 3.47Å; V312-D343 PolarHBondContact N-OD2 3.39Å; H314-D343 IonicContact CD2-OD1 3Å; H314-D343 IonicContact NE2-OD1 2.69Å
344	L	60.9	Low	77	Confident	55 Å²	55	39.8 Å²	39.8	29%	0.288	20%	0.202	S	C	.	.	S	Bend	trans	-106.5	136.4	172.6	-59.5	-179.1	0	0	0	109.3	P313 S342 P346 N411 A412 L413	P313-L344 HydrophobicContact CB-CD1 4.38Å; P313-L344 HydrophobicContact CB-CD2 4.49Å; P313-L344 HydrophobicContact CB-CG 4.29Å; S342-L344 WeakPolarHBondContact CB-O 3.47Å; S342-L344 PolarHBondContact O-N 3.04Å; S342-L344 VanDerWaalsContact O-N 3.08Å; S342-L344 PolarHBondContact OG-O 3.05Å; L344-P346 WeakPolarHBondContact O-CD 3.49Å; L344-N411 HydrophobicContact CB-CB 4.16Å; L344-A412 HydrophobicContact CD1-CB 4.21Å; L344-L413 HydrophobicContact CD1-CD1 3.58Å; L344-L413 HydrophobicContact CD1-CG 3.7Å; L344-L413 HydrophobicContact CG-CD1 4.48Å
345	Q	66.3	Low	76.7	Confident	167 Å²	167	45 Å²	45	78%	0.78	23%	0.227	S	C	*	.			trans	-46	109.8	174.9	175.3	62.7	69.4	0	0	111
346	P	72.3	Confident	76.4	Confident	17 Å²	17	44.4 Å²	44.4	11%	0.11	22%	0.222	C	C	.	.			trans	-85.9	161.3	178.4	36.4	-35	0	0	0	110.6	P316 V340 L344 Y390 V409 G410 N411	P316-P346 HydrophobicContact CG-CB 4.36Å; V340-P346 HydrophobicContact CG1-CB 4.47Å; V340-P346 HydrophobicContact CG1-CG 4.17Å; L344-P346 WeakPolarHBondContact O-CD 3.49Å; P346-Y390 VanDerWaalsContact CG-OH 3.26Å; P346-Y390 WeakPolarHBondContact CG-OH 3.19Å; P346-V409 HydrophobicContact CB-CG1 4Å; P346-G410 CarbonylContact C-O 3.59Å; P346-G410 VanDerWaalsContact CA-O 3.25Å; P346-G410 WeakPolarHBondContact CA-O 3.09Å; P346-N411 HydrophobicContact CB-CB 4.49Å
347	H	75.7	Confident	76.2	Confident	119 Å²	119	52.2 Å²	52.2	55%	0.551	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	138.8	165.8	-170.7	-100	0	0	0	108	E349 V409 G410	H347-E349 VanDerWaalsContact CE1-CG 3.42Å; H347-E349 WeakPolarHBondContact CE1-CG 3.34Å; H347-E349 IonicContact CE1-OE1 3.47Å; H347-E349 WeakPolarHBondContact ND1-CG 3.24Å; H347-V409 CarbonylContact O-C 3.46Å; H347-V409 WeakPolarHBondContact O-CA 3.21Å; H347-G410 PolarHBondContact N-O 3.03Å; H347-G410 PolarHBondContact O-N 2.91Å
348	I	80.1	Confident	75.9	Confident	24 Å²	24	53.2 Å²	53.2	12%	0.123	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135	177.4	179.4	168.2	0	0	0	110.3	C338 W350 P389 Y390 C407 V408 V409	C338-I348 HydrophobicContact CB-CD1 4.2Å; I348-W350 HydrophobicContact CD1-CZ2 4.48Å; I348-P389 HydrophobicContact CG2-CB 3.73Å; I348-P389 HydrophobicContact CG2-CG 4.32Å; I348-P389 WeakPolarHBondContact CG2-O 3.24Å; I348-Y390 HydrophobicContact CD1-CD1 3.91Å; I348-Y390 HydrophobicContact CG2-CD1 4.18Å; I348-Y390 HydrophobicContact CG2-CE1 4.18Å; I348-C407 HydrophobicContact CD1-CB 3.97Å; I348-C407 HydrophobicContact CG1-CB 4.42Å; I348-V408 CarbonylContact C-O 3.52Å; I348-V408 WeakPolarHBondContact CA-O 3.36Å; I348-V409 HydrophobicContact CB-CG2 4.26Å; I348-V409 HydrophobicContact CD1-CG2 3.91Å; I348-V409 HydrophobicContact CG1-CG2 3.93Å
349	E	80.5	Confident	75.7	Confident	42 Å²	42	56.6 Å²	56.6	20%	0.196	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	134.6	177.7	-57.2	-177.1	113.3	0	0	107.9	H347 Q371 V408 I513 Y521	H347-E349 VanDerWaalsContact CE1-CG 3.42Å; H347-E349 WeakPolarHBondContact CE1-CG 3.34Å; H347-E349 IonicContact CE1-OE1 3.47Å; H347-E349 WeakPolarHBondContact ND1-CG 3.24Å; E349-Q371 PolarHBondContact OE1-NE2 2.79Å; E349-V408 PolarHBondContact N-O 2.01Å; E349-V408 PolarHBondContact O-N 3.19Å; E349-I513 HydrophobicContact CB-CD1 4.13Å; E349-I513 HydrophobicContact CG-CD1 4.4Å; E349-I513 WeakPolarHBondContact OE2-CD1 3.17Å; E349-Y521 PolarHBondContact OE2-OH 3.44Å
350	W	84.7	Confident	75.4	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.015	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	143.1	173.5	-69.3	87.4	0	0	0	110	P323 F336 C338 I348 Q371 I372 P389 L392 T406 C407	P323-W350 HydrophobicContact CB-CH2 4.35Å; P323-W350 HydrophobicContact CB-CZ3 4.35Å; F336-W350 HydrophobicContact CB-CH2 3.63Å; F336-W350 HydrophobicContact CB-CZ3 3.74Å; F336-W350 HydrophobicContact CG-CZ3 4.4Å; C338-W350 HydrophobicContact CB-CH2 3.55Å; C338-W350 HydrophobicContact CB-CZ2 3.64Å; I348-W350 HydrophobicContact CD1-CZ2 4.48Å; W350-Q371 CarbonylContact O-C 3.53Å; W350-Q371 WeakPolarHBondContact O-CA 3.26Å; W350-I372 HydrophobicContact CB-CB 4.33Å; W350-I372 PolarHBondContact O-N 2.99Å; W350-P389 PolarHBondContact NE1-O 2.8Å; W350-L392 HydrophobicContact CB-CD2 4.09Å; W350-L392 HydrophobicContact CD2-CB 3.61Å; W350-L392 HydrophobicContact CD2-CD2 3.86Å; W350-L392 HydrophobicContact CD2-CG 4.33Å; W350-L392 HydrophobicContact CE3-CB 4.02Å; W350-L392 HydrophobicContact CE3-CD2 3.74Å; W350-L392 HydrophobicContact CG-CB 3.99Å; W350-L392 HydrophobicContact CG-CD2 4.03Å; W350-L392 HydrophobicContact CG-CG 4.45Å; W350-L392 HydrophobicContact CH2-CB 4.26Å; W350-L392 HydrophobicContact CZ2-CB 3.9Å; W350-L392 HydrophobicContact CZ3-CB 4.32Å; W350-L392 HydrophobicContact CZ3-CD2 4.43Å; W350-T406 CarbonylContact C-O 3.51Å; W350-T406 WeakPolarHBondContact CA-O 3.27Å; W350-C407 HydrophobicContact CD2-CB 4.11Å; W350-C407 HydrophobicContact CE3-CB 3.92Å; W350-C407 HydrophobicContact CH2-CB 3.96Å; W350-C407 HydrophobicContact CZ2-CB 4.12Å; W350-C407 HydrophobicContact CZ3-CB 3.85Å
351	F	82.7	Confident	75.7	Confident	2 Å²	2	59 Å²	59	1%	0.009	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	123.7	-178.7	-177	-93	0	0	0	109.9	H353 W367 G369 D370 Y405 T406 I513 I515	F351-H353 AromaticContact CD1-CD2 3.76Å; F351-H353 AromaticContact CD1-NE2 3.67Å; F351-H353 AromaticContact CE1-CE1 4Å; F351-H353 AromaticContact CE1-NE2 3.99Å; F351-W367 HydrophobicContact CE1-CB 4.06Å; F351-W367 HydrophobicContact CZ-CB 4.39Å; F351-G369 VanDerWaalsContact CZ-CA 3.44Å; F351-D370 CarbonylContact C-O 3.57Å; F351-D370 WeakPolarHBondContact CA-O 3.34Å; F351-Y405 WeakPolarHBondContact O-CA 3.49Å; F351-T406 PolarHBondContact N-O 2.98Å; F351-T406 PolarHBondContact O-N 3.38Å; F351-I513 HydrophobicContact CD2-CB 4.39Å; F351-I515 HydrophobicContact CB-CD1 4.27Å; F351-I515 HydrophobicContact CD1-CD1 3.98Å; F351-I515 HydrophobicContact CD2-CD1 4.49Å; F351-I515 HydrophobicContact CE1-CD1 4.41Å; F351-I515 HydrophobicContact CG-CD1 4.01Å
352	R	87.6	Confident	76.3	Confident	65 Å²	65	59 Å²	59	25%	0.245	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	122.9	177.2	173.7	-174.5	63.6	178.2	-4.9	109.5	G369 D370 I372 T403 Y405	R352-G369 CarbonylContact O-C 3.56Å; R352-G369 WeakPolarHBondContact O-CA 3.17Å; R352-D370 IonicContact CZ-OD2 2.65Å; R352-D370 PolarHBondContact N-O 3.13Å; R352-D370 IonicContact NE-OD2 3.58Å; R352-D370 PolarHBondContact NE-OD2 3.14Å; R352-D370 IonicContact NH2-OD2 3.9Å; R352-D370 PolarHBondContact NH2-OD2 2.76Å; R352-D370 PolarHBondContact O-N 2.84Å; R352-I372 HydrophobicContact CB-CD1 3.5Å; R352-I372 HydrophobicContact CB-CG1 4.14Å; R352-I372 HydrophobicContact CG-CD1 4.34Å; R352-T403 HydrophobicContact CG-CG2 3.55Å; R352-Y405 HydrophobicContact CB-CD1 4.04Å; R352-Y405 HydrophobicContact CB-CE1 3.81Å; R352-Y405 WeakPolarHBondContact CD-OH 3.43Å; R352-Y405 HydrophobicContact CG-CD1 4.29Å; R352-Y405 HydrophobicContact CG-CE1 3.72Å
353	H	84.2	Confident	77	Confident	3 Å²	3	67.5 Å²	67.5	1%	0.014	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	150.6	-178.9	-66.1	-112.3	0	0	0	111.9	F351 W360 W367 Y368 T403 W404 T406	F351-H353 AromaticContact CD1-CD2 3.76Å; F351-H353 AromaticContact CD1-NE2 3.67Å; F351-H353 AromaticContact CE1-CE1 4Å; F351-H353 AromaticContact CE1-NE2 3.99Å; H353-W360 HydrophobicContact CB-CE3 3.93Å; H353-W360 HydrophobicContact CB-CZ3 3.7Å; H353-W367 AromaticContact CE1-CD2 3.37Å; H353-W367 AromaticContact CE1-CE2 3.92Å; H353-W367 AromaticContact CE1-CE3 3.49Å; H353-W367 VanDerWaalsContact CE1-CE3 3.49Å; H353-W367 AromaticContact CE1-CG 3.6Å; H353-W367 AromaticContact ND1-CD2 3.41Å; H353-W367 AromaticContact ND1-CE3 3.05Å; H353-W367 AromaticContact ND1-CG 3.79Å; H353-W367 AromaticContact ND1-CZ3 3.69Å; H353-Y368 CarbonylContact C-O 3.48Å; H353-Y368 WeakPolarHBondContact CA-O 3.43Å; H353-T403 WeakPolarHBondContact O-CG2 3.47Å; H353-T403 PolarHBondContact O-OG1 2.84Å; H353-W404 HydrophobicContact CB-CB 3.92Å; H353-W404 PolarHBondContact CD2-O 2.94Å; H353-W404 VanDerWaalsContact CD2-O 3.27Å; H353-W404 PolarHBondContact N-O 2.79Å; H353-T406 PolarHBondContact NE2-OG1 2.75Å
354	K	84.4	Confident	77.9	Confident	88 Å²	88	70.9 Å²	70.9	38%	0.383	36%	0.361	S	S	.	.			trans	-132.5	152.1	176.4	-76.4	175.4	165.8	169.7	0	109.9	Y368 D370	K354-Y368 PolarHBondContact N-O 2.75Å; K354-Y368 WeakPolarHBondContact O-CB 3.38Å; K354-D370 WeakPolarHBondContact CE-OD1 3.29Å; K354-D370 WeakPolarHBondContact CE-OD2 3.4Å; K354-D370 IonicContact NZ-OD1 3.5Å; K354-D370 PolarHBondContact NZ-OD1 2.93Å; K354-D370 IonicContact NZ-OD2 3.75Å; K354-D370 PolarHBondContact NZ-OD2 2.99Å
355	Q	81	Confident	78.2	Confident	113 Å²	113	71.3 Å²	71.3	53%	0.528	36%	0.363	S	S	.	.			trans	-91.4	140.9	161.3	-67.2	-178.7	8.7	0	0	109.9	T359 W360	Q355-T359 CarbonylContact C-O 3.54Å; Q355-T359 VanDerWaalsContact CA-O 3.31Å; Q355-T359 WeakPolarHBondContact CA-O 3.01Å; Q355-W360 HydrophobicContact CG-CD2 3.66Å; Q355-W360 HydrophobicContact CG-CE3 3.83Å; Q355-W360 HydrophobicContact CG-CG 4.28Å; Q355-W360 HydrophobicContact CG-CH2 3.99Å; Q355-W360 HydrophobicContact CG-CZ2 3.83Å; Q355-W360 HydrophobicContact CG-CZ3 3.98Å; Q355-W360 VanDerWaalsContact NE2-CE2 3.32Å
356	V	82.4	Confident	78.1	Confident	55 Å²	55	66.1 Å²	66.1	33%	0.333	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-127.7	124.6	169.1	-177.7	0	0	0	0	106.9	G358 T359 Y368	V356-G358 PolarHBondContact O-N 2.93Å; V356-T359 PolarHBondContact N-O 2.92Å; V356-T359 PolarHBondContact O-N 3.11Å; V356-T359 PolarHBondContact O-OG1 2.52Å; V356-Y368 HydrophobicContact CB-CD2 3.66Å; V356-Y368 HydrophobicContact CB-CE2 3.62Å; V356-Y368 HydrophobicContact CB-CG 4.16Å; V356-Y368 HydrophobicContact CG1-CE2 4.39Å; V356-Y368 HydrophobicContact CG2-CD1 3.97Å; V356-Y368 HydrophobicContact CG2-CD2 3.67Å; V356-Y368 HydrophobicContact CG2-CE1 4.32Å; V356-Y368 HydrophobicContact CG2-CE2 4.04Å; V356-Y368 HydrophobicContact CG2-CG 3.63Å
357	N	84.5	Confident	77.8	Confident	166 Å²	166	68.3 Å²	68.3	89%	0.888	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	25.7	-175.4	-55	-26.1	0	0	0	114.6	T359	N357-T359 VanDerWaalsContact C-N 3.34Å
358	G	77.6	Confident	78	Confident	57 Å²	57	65.9 Å²	65.9	59%	0.588	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	-3.6	-176.6	0	0	0	0	0	115.5	V356	V356-G358 PolarHBondContact O-N 2.93Å
359	T	76	Confident	78.1	Confident	71 Å²	71	65.1 Å²	65.1	44%	0.436	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-96.4	149	170.2	70.8	0	0	0	0	111	Q355 V356 N357 F361	Q355-T359 CarbonylContact C-O 3.54Å; Q355-T359 VanDerWaalsContact CA-O 3.31Å; Q355-T359 WeakPolarHBondContact CA-O 3.01Å; V356-T359 PolarHBondContact N-O 2.92Å; V356-T359 PolarHBondContact O-N 3.11Å; V356-T359 PolarHBondContact O-OG1 2.52Å; N357-T359 VanDerWaalsContact C-N 3.34Å; T359-F361 PolarHBondContact OG1-O 3.04Å
360	W	71.1	Confident	78.2	Confident	53 Å²	53	64.3 Å²	64.3	20%	0.201	32%	0.324	C	S	.	.	S	Bend	trans	-86.9	-8.6	169.4	-66.9	102.5	0	0	0	112.9	H353 Q355 W367 Y368 T403 W421	H353-W360 HydrophobicContact CB-CE3 3.93Å; H353-W360 HydrophobicContact CB-CZ3 3.7Å; Q355-W360 HydrophobicContact CG-CD2 3.66Å; Q355-W360 HydrophobicContact CG-CE3 3.83Å; Q355-W360 HydrophobicContact CG-CG 4.28Å; Q355-W360 HydrophobicContact CG-CH2 3.99Å; Q355-W360 HydrophobicContact CG-CZ2 3.83Å; Q355-W360 HydrophobicContact CG-CZ3 3.98Å; Q355-W360 VanDerWaalsContact NE2-CE2 3.32Å; W360-W367 HydrophobicContact CB-CE3 3.84Å; W360-W367 HydrophobicContact CB-CZ3 3.74Å; W360-W367 HydrophobicContact CG-CZ3 4.16Å; W360-W367 CarbonylContact O-C 3.53Å; W360-W367 WeakPolarHBondContact O-CA 3.27Å; W360-Y368 PolarHBondContact O-N 2.92Å; W360-T403 WeakPolarHBondContact CH2-OG1 3.48Å; W360-T403 WeakPolarHBondContact CZ3-OG1 3.24Å; W360-W421 HydrophobicContact CH2-CH2 4.13Å; W360-W421 AromaticContact CH2-CZ3 3.9Å; W360-W421 HydrophobicContact CH2-CZ3 3.9Å; W360-W421 HydrophobicContact CZ2-CH2 4.17Å; W360-W421 HydrophobicContact CZ2-CZ3 4.01Å
361	F	74.9	Confident	78	Confident	58 Å²	58	66 Å²	66	25%	0.254	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-129.5	147.5	-168.4	-54.4	-89.7	0	0	0	112.4	T359 Y366 W367 Y368	T359-F361 PolarHBondContact OG1-O 3.04Å; F361-Y366 CarbonylContact C-O 3.51Å; F361-Y366 VanDerWaalsContact CA-O 3.28Å; F361-Y366 WeakPolarHBondContact CA-O 3.33Å; F361-W367 HydrophobicContact CD1-CD2 4.01Å; F361-W367 HydrophobicContact CD1-CE3 4.27Å; F361-W367 HydrophobicContact CD1-CG 4.24Å; F361-W367 AromaticContact CE1-CD2 3.42Å; F361-W367 HydrophobicContact CE1-CD2 3.42Å; F361-W367 VanDerWaalsContact CE1-CD2 3.42Å; F361-W367 AromaticContact CE1-CE2 3.34Å; F361-W367 AromaticContact CE1-CE3 3.74Å; F361-W367 HydrophobicContact CE1-CE3 3.74Å; F361-W367 AromaticContact CE1-CG 3.99Å; F361-W367 HydrophobicContact CE1-CG 3.99Å; F361-W367 AromaticContact CE1-CH2 3.97Å; F361-W367 HydrophobicContact CE1-CH2 3.97Å; F361-W367 AromaticContact CE1-CZ2 3.64Å; F361-W367 HydrophobicContact CE1-CZ2 3.64Å; F361-W367 HydrophobicContact CE1-CZ3 4.01Å; F361-W367 AromaticContact CE1-NE1 3.74Å; F361-W367 HydrophobicContact CE2-CE3 4.44Å; F361-W367 HydrophobicContact CE2-CH2 4.29Å; F361-W367 HydrophobicContact CE2-CZ3 4.15Å; F361-W367 AromaticContact CZ-CD2 3.93Å; F361-W367 HydrophobicContact CZ-CD2 3.93Å; F361-W367 AromaticContact CZ-CE2 3.74Å; F361-W367 AromaticContact CZ-CE3 3.82Å; F361-W367 HydrophobicContact CZ-CE3 3.82Å; F361-W367 AromaticContact CZ-CH2 3.46Å; F361-W367 HydrophobicContact CZ-CH2 3.46Å; F361-W367 VanDerWaalsContact CZ-CH2 3.46Å; F361-W367 AromaticContact CZ-CZ2 3.52Å; F361-W367 HydrophobicContact CZ-CZ2 3.52Å; F361-W367 AromaticContact CZ-CZ3 3.61Å; F361-W367 HydrophobicContact CZ-CZ3 3.61Å; F361-Y368 WeakPolarHBondContact O-CE2 3.19Å
362	D	77.3	Confident	77.9	Confident	30 Å²	30	67 Å²	67	16%	0.16	34%	0.337	C	S	.	.			trans	-77.7	178.2	166.9	90.1	10.2	0	0	0	112.3	N364 D365 Y366 Y368 K514	D362-N364 PolarHBondContact O-N 2.91Å; D362-N364 WeakPolarHBondContact OD1-CA 3.46Å; D362-N364 PolarHBondContact OD1-N 3.44Å; D362-N364 PolarHBondContact OD1-ND2 2.8Å; D362-N364 PolarHBondContact OD2-ND2 2.95Å; D362-D365 PolarHBondContact O-N 2.82Å; D362-Y366 PolarHBondContact N-O 2.81Å; D362-Y368 HydrophobicContact CB-CE1 3.7Å; D362-Y368 HydrophobicContact CB-CE2 4.44Å; D362-K514 IonicContact OD2-NZ 2.7Å; D362-K514 PolarHBondContact OD2-NZ 2.99Å; D362-K514 VanDerWaalsContact OD2-NZ 3.14Å
363	Q	79.4	Confident	76.7	Confident	197 Å²	197	68.6 Å²	68.6	92%	0.921	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-0.9	-176.6	-66.7	177.2	-19	0	0	114.9
364	N	73	Confident	75.5	Confident	103 Å²	103	70 Å²	70	55%	0.551	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.4	27.9	-179.2	-24.7	-104.7	0	0	0	111	D362 Y366	D362-N364 PolarHBondContact O-N 2.91Å; D362-N364 WeakPolarHBondContact OD1-CA 3.46Å; D362-N364 PolarHBondContact OD1-N 3.44Å; D362-N364 PolarHBondContact OD1-ND2 2.8Å; D362-N364 PolarHBondContact OD2-ND2 2.95Å; N364-Y366 HydrophobicContact CB-CD2 3.8Å; N364-Y366 HydrophobicContact CB-CE2 3.76Å; N364-Y366 PolarHBondContact O-N 2.81Å; N364-Y366 VanDerWaalsContact O-N 3.12Å
365	D	67	Low	73.9	Confident	63 Å²	63	71 Å²	71	34%	0.337	37%	0.371	S	S	.	.	S	Bend	trans	57.9	20	-179.7	-90	6.8	0	0	0	115.5	D362 R517	D362-D365 PolarHBondContact O-N 2.82Å; D365-R517 HydrophobicContact CB-CB 4.25Å; D365-R517 WeakPolarHBondContact OD2-CD 3.42Å; D365-R517 IonicContact OD2-CZ 3.51Å; D365-R517 IonicContact OD2-NE 2.81Å; D365-R517 IonicContact OD2-NH1 3.49Å; D365-R517 PolarHBondContact OD2-NH1 2.82Å
366	Y	63.5	Low	71.9	Confident	59 Å²	59	68.8 Å²	68.8	23%	0.231	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-80.8	130.8	169.5	-65.2	-70.9	0	0	0	111.8	F361 D362 N364 K514 I515 N516	F361-Y366 CarbonylContact C-O 3.51Å; F361-Y366 VanDerWaalsContact CA-O 3.28Å; F361-Y366 WeakPolarHBondContact CA-O 3.33Å; D362-Y366 PolarHBondContact N-O 2.81Å; N364-Y366 HydrophobicContact CB-CD2 3.8Å; N364-Y366 HydrophobicContact CB-CE2 3.76Å; N364-Y366 PolarHBondContact O-N 2.81Å; N364-Y366 VanDerWaalsContact O-N 3.12Å; Y366-K514 HydrophobicContact CD1-CB 3.69Å; Y366-K514 HydrophobicContact CD1-CD 4.1Å; Y366-K514 HydrophobicContact CD1-CG 4.33Å; Y366-K514 HydrophobicContact CD2-CD 4.05Å; Y366-K514 HydrophobicContact CE1-CB 4Å; Y366-K514 HydrophobicContact CE1-CD 4.28Å; Y366-K514 HydrophobicContact CE2-CD 4.28Å; Y366-K514 HydrophobicContact CG-CB 4.28Å; Y366-K514 HydrophobicContact CG-CD 3.98Å; Y366-K514 HydrophobicContact CG-CG 4.44Å; Y366-I515 WeakPolarHBondContact CA-O 3.36Å; Y366-N516 HydrophobicContact CD1-CB 4.18Å; Y366-N516 HydrophobicContact CE1-CB 3.85Å
367	W	66.3	Low	69.8	Low	62 Å²	62	68.9 Å²	68.9	24%	0.235	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-60.9	135.4	174.2	-66	93.7	0	0	0	112.6	F351 H353 W360 F361 I515	F351-W367 HydrophobicContact CE1-CB 4.06Å; F351-W367 HydrophobicContact CZ-CB 4.39Å; H353-W367 AromaticContact CE1-CD2 3.37Å; H353-W367 AromaticContact CE1-CE2 3.92Å; H353-W367 AromaticContact CE1-CE3 3.49Å; H353-W367 VanDerWaalsContact CE1-CE3 3.49Å; H353-W367 AromaticContact CE1-CG 3.6Å; H353-W367 AromaticContact ND1-CD2 3.41Å; H353-W367 AromaticContact ND1-CE3 3.05Å; H353-W367 AromaticContact ND1-CG 3.79Å; H353-W367 AromaticContact ND1-CZ3 3.69Å; W360-W367 HydrophobicContact CB-CE3 3.84Å; W360-W367 HydrophobicContact CB-CZ3 3.74Å; W360-W367 HydrophobicContact CG-CZ3 4.16Å; W360-W367 CarbonylContact O-C 3.53Å; W360-W367 WeakPolarHBondContact O-CA 3.27Å; F361-W367 HydrophobicContact CD1-CD2 4.01Å; F361-W367 HydrophobicContact CD1-CE3 4.27Å; F361-W367 HydrophobicContact CD1-CG 4.24Å; F361-W367 AromaticContact CE1-CD2 3.42Å; F361-W367 HydrophobicContact CE1-CD2 3.42Å; F361-W367 VanDerWaalsContact CE1-CD2 3.42Å; F361-W367 AromaticContact CE1-CE2 3.34Å; F361-W367 AromaticContact CE1-CE3 3.74Å; F361-W367 HydrophobicContact CE1-CE3 3.74Å; F361-W367 AromaticContact CE1-CG 3.99Å; F361-W367 HydrophobicContact CE1-CG 3.99Å; F361-W367 AromaticContact CE1-CH2 3.97Å; F361-W367 HydrophobicContact CE1-CH2 3.97Å; F361-W367 AromaticContact CE1-CZ2 3.64Å; F361-W367 HydrophobicContact CE1-CZ2 3.64Å; F361-W367 HydrophobicContact CE1-CZ3 4.01Å; F361-W367 AromaticContact CE1-NE1 3.74Å; F361-W367 HydrophobicContact CE2-CE3 4.44Å; F361-W367 HydrophobicContact CE2-CH2 4.29Å; F361-W367 HydrophobicContact CE2-CZ3 4.15Å; F361-W367 AromaticContact CZ-CD2 3.93Å; F361-W367 HydrophobicContact CZ-CD2 3.93Å; F361-W367 AromaticContact CZ-CE2 3.74Å; F361-W367 AromaticContact CZ-CE3 3.82Å; F361-W367 HydrophobicContact CZ-CE3 3.82Å; F361-W367 AromaticContact CZ-CH2 3.46Å; F361-W367 HydrophobicContact CZ-CH2 3.46Å; F361-W367 VanDerWaalsContact CZ-CH2 3.46Å; F361-W367 AromaticContact CZ-CZ2 3.52Å; F361-W367 HydrophobicContact CZ-CZ2 3.52Å; F361-W367 AromaticContact CZ-CZ3 3.61Å; F361-W367 HydrophobicContact CZ-CZ3 3.61Å; W367-I515 PolarHBondContact N-O 3.34Å
368	Y	80.1	Confident	67.5	Low	69 Å²	69	69.3 Å²	69.3	27%	0.271	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-78.1	136.4	167	-70.8	-55.6	0	0	0	110.8	H353 K354 V356 W360 F361 D362	H353-Y368 CarbonylContact C-O 3.48Å; H353-Y368 WeakPolarHBondContact CA-O 3.43Å; K354-Y368 PolarHBondContact N-O 2.75Å; K354-Y368 WeakPolarHBondContact O-CB 3.38Å; V356-Y368 HydrophobicContact CB-CD2 3.66Å; V356-Y368 HydrophobicContact CB-CE2 3.62Å; V356-Y368 HydrophobicContact CB-CG 4.16Å; V356-Y368 HydrophobicContact CG1-CE2 4.39Å; V356-Y368 HydrophobicContact CG2-CD1 3.97Å; V356-Y368 HydrophobicContact CG2-CD2 3.67Å; V356-Y368 HydrophobicContact CG2-CE1 4.32Å; V356-Y368 HydrophobicContact CG2-CE2 4.04Å; V356-Y368 HydrophobicContact CG2-CG 3.63Å; W360-Y368 PolarHBondContact O-N 2.92Å; F361-Y368 WeakPolarHBondContact O-CE2 3.19Å; D362-Y368 HydrophobicContact CB-CE1 3.7Å; D362-Y368 HydrophobicContact CB-CE2 4.44Å
369	G	82.5	Confident	65.4	Low	7 Å²	7	70.2 Å²	70.2	7%	0.072	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169	-176.1	179.6	0	0	0	0	0	113.6	F351 R352 L512	F351-G369 VanDerWaalsContact CZ-CA 3.44Å; R352-G369 CarbonylContact O-C 3.56Å; R352-G369 WeakPolarHBondContact O-CA 3.17Å; G369-L512 WeakPolarHBondContact O-CD1 3.48Å
370	D	82.7	Confident	63.4	Low	25 Å²	25	71.4 Å²	71.4	13%	0.134	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	150.1	175.1	-34.2	-63.1	0	0	0	110.9	F351 R352 K354	F351-D370 CarbonylContact C-O 3.57Å; F351-D370 WeakPolarHBondContact CA-O 3.34Å; R352-D370 IonicContact CZ-OD2 2.65Å; R352-D370 PolarHBondContact N-O 3.13Å; R352-D370 IonicContact NE-OD2 3.58Å; R352-D370 PolarHBondContact NE-OD2 3.14Å; R352-D370 IonicContact NH2-OD2 3.9Å; R352-D370 PolarHBondContact NH2-OD2 2.76Å; R352-D370 PolarHBondContact O-N 2.84Å; K354-D370 WeakPolarHBondContact CE-OD1 3.29Å; K354-D370 WeakPolarHBondContact CE-OD2 3.4Å; K354-D370 IonicContact NZ-OD1 3.5Å; K354-D370 PolarHBondContact NZ-OD1 2.93Å; K354-D370 IonicContact NZ-OD2 3.75Å; K354-D370 PolarHBondContact NZ-OD2 2.99Å
371	Q	79.8	Confident	61.4	Low	41 Å²	41	75.4 Å²	75.4	19%	0.192	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	136.2	161.5	-178.9	171.3	15.2	0	0	110.2	E349 W350 I513	E349-Q371 PolarHBondContact OE1-NE2 2.79Å; W350-Q371 CarbonylContact O-C 3.53Å; W350-Q371 WeakPolarHBondContact O-CA 3.26Å; Q371-I513 HydrophobicContact CB-CD1 4.07Å; Q371-I513 HydrophobicContact CG-CD1 3.9Å
372	I	79.7	Confident	59.6	Low	21 Å²	21	80.7 Å²	80.7	11%	0.108	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	132.9	171.5	-61.1	-176.7	0	0	0	108.8	W350 R352 A376 L392 Y405	W350-I372 HydrophobicContact CB-CB 4.33Å; W350-I372 PolarHBondContact O-N 2.99Å; R352-I372 HydrophobicContact CB-CD1 3.5Å; R352-I372 HydrophobicContact CB-CG1 4.14Å; R352-I372 HydrophobicContact CG-CD1 4.34Å; I372-A376 HydrophobicContact CG2-CB 4.11Å; I372-L392 HydrophobicContact CG2-CD1 3.69Å; I372-Y405 HydrophobicContact CD1-CD1 4.35Å; I372-Y405 HydrophobicContact CD1-CE1 3.89Å
373	N	64	Low	57.5	Low	100 Å²	100	88.2 Å²	88.2	54%	0.535	49%	0.493	S	S	.	.			trans	-84.1	144.2	169.4	-63.6	-1.9	0	0	0	109.5	D375 A376	N373-D375 PolarHBondContact O-N 2.73Å; N373-A376 WeakPolarHBondContact O-CB 3.22Å; N373-A376 PolarHBondContact O-N 3.08Å; N373-A376 VanDerWaalsContact O-N 3.09Å
374	S	57.8	Low	55.3	Low	33 Å²	33	86.7 Å²	86.7	23%	0.231	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-30.2	171.2	48.2	0	0	0	0	112.6	A376	S374-A376 PolarHBondContact O-N 3.21Å
375	D	51.2	Low	53.3	Low	108 Å²	108	87.4 Å²	87.4	58%	0.578	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	11.7	178.6	-55.2	-36.8	0	0	0	114.2	N373 S377 S387	N373-D375 PolarHBondContact O-N 2.73Å; D375-S377 PolarHBondContact O-N 2.99Å; D375-S387 WeakPolarHBondContact OD1-CB 3.38Å; D375-S387 PolarHBondContact OD1-OG 2.91Å
376	A	39.7	Very low	52	Low	67 Å²	67	89.4 Å²	89.4	55%	0.554	53%	0.53	S	S	*	.			trans	-75.6	36	-176.4	0	0	0	0	0	114.8	I372 N373 S374	I372-A376 HydrophobicContact CG2-CB 4.11Å; N373-A376 WeakPolarHBondContact O-CB 3.22Å; N373-A376 PolarHBondContact O-N 3.08Å; N373-A376 VanDerWaalsContact O-N 3.09Å; S374-A376 PolarHBondContact O-N 3.21Å
377	S	38.4	Very low	51.8	Low	57 Å²	57	89.1 Å²	89.1	40%	0.399	54%	0.536	S	S	.	.			trans	-88.2	96.8	162.7	59.3	0	0	0	0	109.6	D375 G379	D375-S377 PolarHBondContact O-N 2.99Å; S377-G379 PolarHBondContact O-N 2.72Å
378	D	36.4	Very low	52	Low	174 Å²	174	89.8 Å²	89.8	93%	0.93	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	120.4	-177	-158.6	2.5	0	0	0	111.5
379	G	32	Very low	51.6	Low	77 Å²	77	89.1 Å²	89.1	79%	0.794	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.4	11.1	159.8	0	0	0	0	0	120.7	S377	S377-G379 PolarHBondContact O-N 2.72Å
380	S	34	Very low	51.6	Low	95 Å²	95	91.5 Å²	91.5	66%	0.664	56%	0.556	S	S	*	*			trans	-119.1	113.7	174.3	65.6	0	0	0	0	114.5
381	T	29.9	Very low	51.6	Low	137 Å²	137	91.9 Å²	91.9	84%	0.84	56%	0.559	S	S	*	*			trans	-76.9	118	172.6	48.5	0	0	0	0	112.4
382	D	37.5	Very low	52	Low	169 Å²	169	90 Å²	90	90%	0.904	55%	0.55	S	S	*	*			trans	-153.7	124.1	140.4	-104.5	-31.1	0	0	0	109.7
383	Q	31.8	Very low	52.5	Low	189 Å²	189	91.9 Å²	91.9	88%	0.883	56%	0.563	S	S	*	*			trans	-100.1	110.1	-177.8	-68.4	178.1	-32.9	0	0	110.1
384	D	33.2	Very low	53.6	Low	165 Å²	165	87.8 Å²	87.8	88%	0.882	54%	0.541	S	S	*	.	S	Bend	trans	166.3	22.3	148.1	-95.4	-11.9	0	0	0	114
385	S	32.8	Very low	55.1	Low	117 Å²	117	90.4 Å²	90.4	82%	0.818	55%	0.552	S	S	*	*			trans	-125.5	111.1	165.9	-64.6	0	0	0	0	109.9	S387	S385-S387 PolarHBondContact O-N 2.74Å
386	A	39.3	Very low	56.7	Low	105 Å²	105	90.5 Å²	90.5	87%	0.868	55%	0.552	S	S	*	*			trans	-62.3	127.1	172.6	0	0	0	0	0	109
387	S	58	Low	59	Low	53 Å²	53	87.3 Å²	87.3	37%	0.371	53%	0.526	S	S	.	.			trans	-62.1	145.6	174.2	64.3	0	0	0	0	109.5	D375 S385 P389	D375-S387 WeakPolarHBondContact OD1-CB 3.38Å; D375-S387 PolarHBondContact OD1-OG 2.91Å; S385-S387 PolarHBondContact O-N 2.74Å; S387-P389 VanDerWaalsContact O-CD 3.28Å; S387-P389 WeakPolarHBondContact O-CD 3.14Å
388	D	70.8	Confident	61.6	Low	77 Å²	77	87.3 Å²	87.3	41%	0.412	52%	0.524	S	S	.	.			trans	-77.7	111.3	171.2	169.7	32.2	0	0	0	108.5	Y390 T391	D388-Y390 PolarHBondContact O-N 3.13Å; D388-Y390 VanDerWaalsContact O-N 3.17Å; D388-Y390 WeakPolarHBondContact OD1-CB 3.34Å; D388-Y390 VanDerWaalsContact OD1-CD2 3.3Å; D388-Y390 WeakPolarHBondContact OD1-CD2 3.17Å; D388-Y390 PolarHBondContact OD1-N 2.95Å; D388-Y390 VanDerWaalsContact OD1-N 3.15Å; D388-T391 PolarHBondContact O-N 3.08Å; D388-T391 VanDerWaalsContact O-O 3.13Å; D388-T391 VanDerWaalsContact OD2-CB 3.32Å; D388-T391 WeakPolarHBondContact OD2-CB 3.18Å; D388-T391 PolarHBondContact OD2-N 2.86Å; D388-T391 PolarHBondContact OD2-OG1 2.76Å
389	P	73.2	Confident	64	Low	55 Å²	55	83.8 Å²	83.8	36%	0.357	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-17.9	-176.9	31.7	-37.7	0	0	0	112.2	I348 W350 S387 T391	I348-P389 HydrophobicContact CG2-CB 3.73Å; I348-P389 HydrophobicContact CG2-CG 4.32Å; I348-P389 WeakPolarHBondContact CG2-O 3.24Å; W350-P389 PolarHBondContact NE1-O 2.8Å; S387-P389 VanDerWaalsContact O-CD 3.28Å; S387-P389 WeakPolarHBondContact O-CD 3.14Å; P389-T391 PolarHBondContact O-N 3.4Å
390	Y	80.6	Confident	66.6	Low	56 Å²	56	88.7 Å²	88.7	22%	0.22	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-0.5	172.1	-54.7	-68.7	0	0	0	113.5	S337 C338 V340 P346 I348 D388	S337-Y390 CarbonylContact C-O 3.57Å; S337-Y390 WeakPolarHBondContact CA-O 3.31Å; C338-Y390 PolarHBondContact N-O 3.47Å; C338-Y390 WeakPolarHBondContact O-CD1 3.28Å; V340-Y390 HydrophobicContact CB-CD1 4.16Å; V340-Y390 HydrophobicContact CB-CE1 3.71Å; V340-Y390 HydrophobicContact CG2-CD1 3.81Å; V340-Y390 HydrophobicContact CG2-CE1 3.68Å; P346-Y390 VanDerWaalsContact CG-OH 3.26Å; P346-Y390 WeakPolarHBondContact CG-OH 3.19Å; I348-Y390 HydrophobicContact CD1-CD1 3.91Å; I348-Y390 HydrophobicContact CG2-CD1 4.18Å; I348-Y390 HydrophobicContact CG2-CE1 4.18Å; D388-Y390 PolarHBondContact O-N 3.13Å; D388-Y390 VanDerWaalsContact O-N 3.17Å; D388-Y390 WeakPolarHBondContact OD1-CB 3.34Å; D388-Y390 VanDerWaalsContact OD1-CD2 3.3Å; D388-Y390 WeakPolarHBondContact OD1-CD2 3.17Å; D388-Y390 PolarHBondContact OD1-N 2.95Å; D388-Y390 VanDerWaalsContact OD1-N 3.15Å
391	T	84.5	Confident	69.2	Low	34 Å²	34	85.9 Å²	85.9	21%	0.209	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	117.4	-179.9	-64.2	0	0	0	0	111.2	T335 F336 D388 P389 V393	T335-T391 HydrophobicContact CG2-CG2 3.49Å; T335-T391 VanDerWaalsContact CG2-CG2 3.49Å; F336-T391 CarbonylContact O-C 3.58Å; F336-T391 WeakPolarHBondContact O-CA 3.47Å; D388-T391 PolarHBondContact O-N 3.08Å; D388-T391 VanDerWaalsContact O-O 3.13Å; D388-T391 VanDerWaalsContact OD2-CB 3.32Å; D388-T391 WeakPolarHBondContact OD2-CB 3.18Å; D388-T391 PolarHBondContact OD2-N 2.86Å; D388-T391 PolarHBondContact OD2-OG1 2.76Å; P389-T391 PolarHBondContact O-N 3.4Å; T391-V393 HydrophobicContact CG2-CG2 4.17Å
392	L	88	Confident	72	Confident	1 Å²	1	81.2 Å²	81.2	1%	0.005	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	115.8	173.2	169.7	63.9	0	0	0	109.7	T335 F336 W350 I372 L394 Y405	T335-L392 CarbonylContact C-O 3.57Å; T335-L392 WeakPolarHBondContact CA-O 3.31Å; F336-L392 HydrophobicContact CB-CB 4.39Å; F336-L392 HydrophobicContact CD2-CD2 4.31Å; F336-L392 PolarHBondContact N-O 2.81Å; F336-L392 PolarHBondContact O-N 2.88Å; W350-L392 HydrophobicContact CB-CD2 4.09Å; W350-L392 HydrophobicContact CD2-CB 3.61Å; W350-L392 HydrophobicContact CD2-CD2 3.86Å; W350-L392 HydrophobicContact CD2-CG 4.33Å; W350-L392 HydrophobicContact CE3-CB 4.02Å; W350-L392 HydrophobicContact CE3-CD2 3.74Å; W350-L392 HydrophobicContact CG-CB 3.99Å; W350-L392 HydrophobicContact CG-CD2 4.03Å; W350-L392 HydrophobicContact CG-CG 4.45Å; W350-L392 HydrophobicContact CH2-CB 4.26Å; W350-L392 HydrophobicContact CZ2-CB 3.9Å; W350-L392 HydrophobicContact CZ3-CB 4.32Å; W350-L392 HydrophobicContact CZ3-CD2 4.43Å; I372-L392 HydrophobicContact CG2-CD1 3.69Å; L392-L394 HydrophobicContact CD1-CD2 4.11Å; L392-L394 HydrophobicContact CD2-CD2 4.4Å; L392-L394 HydrophobicContact CG-CD2 4.26Å; L392-L394 HydrophobicContact CG-CG 4.35Å; L392-Y405 HydrophobicContact CD2-CD1 3.81Å; L392-Y405 HydrophobicContact CD2-CE1 4.42Å
393	V	88.5	Confident	74.5	Confident	61 Å²	61	73.6 Å²	73.6	37%	0.37	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	125.4	174	-174.9	0	0	0	0	109.6	T335 T391 L395	T335-V393 HydrophobicContact CG2-CG2 4.11Å; T391-V393 HydrophobicContact CG2-CG2 4.17Å; V393-L395 HydrophobicContact CG1-CD2 3.7Å; V393-L395 HydrophobicContact CG1-CG 4.34Å
394	L	88.6	Confident	77	Confident	14 Å²	14	68.7 Å²	68.7	7%	0.073	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	111.7	172.2	-57.7	171.4	0	0	0	107.7	N333 A334 F336 L392 V397 Y405 L422	N333-L394 CarbonylContact C-O 3.41Å; N333-L394 VanDerWaalsContact CA-O 3.29Å; N333-L394 WeakPolarHBondContact CA-O 3.44Å; A334-L394 HydrophobicContact CB-CB 4.28Å; A334-L394 HydrophobicContact CB-CD1 4.43Å; A334-L394 PolarHBondContact N-O 3.43Å; A334-L394 PolarHBondContact O-N 3.21Å; F336-L394 HydrophobicContact CD2-CD1 4.48Å; F336-L394 HydrophobicContact CE2-CD1 4.21Å; L392-L394 HydrophobicContact CD1-CD2 4.11Å; L392-L394 HydrophobicContact CD2-CD2 4.4Å; L392-L394 HydrophobicContact CG-CD2 4.26Å; L392-L394 HydrophobicContact CG-CG 4.35Å; L394-V397 HydrophobicContact CB-CG2 3.95Å; L394-V397 WeakPolarHBondContact O-CG2 3.33Å; L394-Y405 HydrophobicContact CD1-CD1 4.32Å; L394-Y405 HydrophobicContact CD1-CE1 3.65Å; L394-Y405 HydrophobicContact CD1-CE2 4.24Å; L394-Y405 HydrophobicContact CD2-CE1 4.25Å; L394-L422 HydrophobicContact CD1-CD2 3.77Å
395	L	88.3	Confident	79.7	Confident	88 Å²	88	60.9 Å²	60.9	46%	0.461	35%	0.345	S	S	.	.			trans	-84.6	142	-178.3	-59	176.9	0	0	0	111.3	N333 V393 V397	N333-L395 WeakPolarHBondContact ND2-CD2 3.46Å; N333-L395 WeakPolarHBondContact OD1-CA 3.45Å; V393-L395 HydrophobicContact CG1-CD2 3.7Å; V393-L395 HydrophobicContact CG1-CG 4.34Å; L395-V397 PolarHBondContact O-N 2.89Å
396	N	86.2	Confident	82.2	Confident	109 Å²	109	55.3 Å²	55.3	58%	0.583	31%	0.307	S	S	*	.	S	Bend	trans	50.2	59.3	170.2	-174.9	60.6	0	0	0	113.2	G331 N333	G331-N396 WeakPolarHBondContact CA-OD1 3Å; N333-N396 PolarHBondContact OD1-N 3.13Å
397	V	87.9	Confident	84.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.265	C	S	.	.			trans	-65.3	139.2	-165	176	0	0	0	0	112.9	V330 G331 E332 A334 L394 L395 Q401 L422 V424	V330-V397 CarbonylContact C-O 3.6Å; V330-V397 VanDerWaalsContact CA-O 3.31Å; V330-V397 WeakPolarHBondContact CA-O 3.01Å; G331-V397 PolarHBondContact N-O 2.94Å; E332-V397 WeakPolarHBondContact O-CB 3.3Å; E332-V397 WeakPolarHBondContact O-CG2 2.99Å; E332-V397 PolarHBondContact O-N 3.42Å; A334-V397 HydrophobicContact CB-CG2 3.91Å; L394-V397 HydrophobicContact CB-CG2 3.95Å; L394-V397 WeakPolarHBondContact O-CG2 3.33Å; L395-V397 PolarHBondContact O-N 2.89Å; V397-Q401 VanDerWaalsContact CA-OE1 3.32Å; V397-Q401 HydrophobicContact CG1-CB 4.17Å; V397-L422 HydrophobicContact CG1-CD2 4.06Å; V397-V424 HydrophobicContact CG1-CB 4.42Å; V397-V424 HydrophobicContact CG1-CG1 4Å; V397-V424 HydrophobicContact CG1-CG2 3.48Å; V397-V424 VanDerWaalsContact CG1-CG2 3.48Å
398	T	91.6	Very high	85.7	Confident	57 Å²	57	48 Å²	48	35%	0.35	25%	0.249	S	C	.	.			trans	-109.8	159.4	178.4	69.7	0	0	0	0	112.1	E400 Q401	T398-E400 PolarHBondContact O-N 2.88Å; T398-E400 VanDerWaalsContact O-N 3.13Å; T398-Q401 WeakPolarHBondContact O-CB 2.99Å; T398-Q401 PolarHBondContact O-N 2.92Å; T398-Q401 PolarHBondContact OG1-OE1 2.83Å
399	M	87.9	Confident	86.2	Confident	100 Å²	100	44.4 Å²	44.4	49%	0.493	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-54.5	-33.1	178.3	-63.9	-61.6	-59.7	0	0	113	V330 Q401 S402 V424	V330-M399 HydrophobicContact CG2-CG 3.69Å; V330-M399 HydrophobicContact CG2-SD 3.39Å; V330-M399 WeakPolarHBondContact CG2-SD 3.46Å; M399-Q401 PolarHBondContact O-N 2.89Å; M399-S402 WeakPolarHBondContact O-CB 3.46Å; M399-S402 PolarHBondContact O-N 2.85Å; M399-V424 WeakPolarHBondContact CE-O 3.4Å; M399-V424 HydrophobicContact SD-CB 4.39Å; M399-V424 HydrophobicContact SD-CG1 3.99Å
400	E	86.5	Confident	86.2	Confident	181 Å²	181	42.6 Å²	42.6	85%	0.846	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-68.1	-15.1	-179.9	-61.2	178.7	-173.5	0	0	113.6	T398 S402	T398-E400 PolarHBondContact O-N 2.88Å; T398-E400 VanDerWaalsContact O-N 3.13Å; E400-S402 VanDerWaalsContact C-N 3.34Å
401	Q	87.1	Confident	85.7	Confident	35 Å²	35	41 Å²	41	16%	0.164	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-88.1	1.1	177.8	-70.3	170.4	-66.2	0	0	113.3	V397 T398 M399 T403 Y405 L422	V397-Q401 VanDerWaalsContact CA-OE1 3.32Å; V397-Q401 HydrophobicContact CG1-CB 4.17Å; T398-Q401 WeakPolarHBondContact O-CB 2.99Å; T398-Q401 PolarHBondContact O-N 2.92Å; T398-Q401 PolarHBondContact OG1-OE1 2.83Å; M399-Q401 PolarHBondContact O-N 2.89Å; Q401-T403 PolarHBondContact O-N 2.87Å; Q401-Y405 WeakPolarHBondContact O-CE2 3.25Å; Q401-Y405 PolarHBondContact O-OH 2.85Å; Q401-L422 HydrophobicContact CB-CD2 4.48Å
402	S	90.1	Very high	84.9	Confident	39 Å²	39	44.1 Å²	44.1	27%	0.273	25%	0.246	S	C	.	.			trans	-74.5	101.1	177	-164.4	0	0	0	0	111.3	M399 E400 L422 V424	M399-S402 WeakPolarHBondContact O-CB 3.46Å; M399-S402 PolarHBondContact O-N 2.85Å; E400-S402 VanDerWaalsContact C-N 3.34Å; S402-L422 CarbonylContact C-O 3.58Å; S402-L422 WeakPolarHBondContact CA-O 3.49Å; S402-L422 WeakPolarHBondContact CB-O 3.25Å; S402-L422 PolarHBondContact OG-O 2.93Å; S402-V424 PolarHBondContact OG-N 2.92Å
403	T	89.2	Confident	84	Confident	9 Å²	9	48.5 Å²	48.5	6%	0.055	27%	0.269	C	S	.	.	S	Bend	trans	-165.9	179.3	-174	-172.6	0	0	0	0	111	R352 H353 W360 Q401 Y405 W421 L422	R352-T403 HydrophobicContact CG-CG2 3.55Å; H353-T403 WeakPolarHBondContact O-CG2 3.47Å; H353-T403 PolarHBondContact O-OG1 2.84Å; W360-T403 WeakPolarHBondContact CH2-OG1 3.48Å; W360-T403 WeakPolarHBondContact CZ3-OG1 3.24Å; Q401-T403 PolarHBondContact O-N 2.87Å; T403-Y405 HydrophobicContact CG2-CD2 4.25Å; T403-Y405 HydrophobicContact CG2-CE2 3.6Å; T403-Y405 WeakPolarHBondContact O-CD2 3.33Å; T403-W421 VanDerWaalsContact C-CE3 3.48Å; T403-L422 PolarHBondContact N-O 3.09Å; T403-L422 PolarHBondContact O-N 2.79Å
404	W	85	Confident	82.8	Confident	86 Å²	86	46.8 Å²	46.8	33%	0.326	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	137.3	168.1	-66	104.8	0	0	0	111.6	H353 A420 W421	H353-W404 HydrophobicContact CB-CB 3.92Å; H353-W404 PolarHBondContact CD2-O 2.94Å; H353-W404 VanDerWaalsContact CD2-O 3.27Å; H353-W404 PolarHBondContact N-O 2.79Å; W404-A420 CarbonylContact C-O 3.53Å; W404-A420 WeakPolarHBondContact CA-O 3.48Å; W404-A420 VanDerWaalsContact CE3-C 3.44Å; W404-W421 HydrophobicContact CB-CE3 4.46Å; W404-W421 AromaticContact CD1-CE3 3.66Å; W404-W421 AromaticContact CD1-CZ3 3.56Å; W404-W421 AromaticContact CD2-CE3 3.72Å; W404-W421 HydrophobicContact CD2-CE3 3.72Å; W404-W421 HydrophobicContact CD2-CZ3 4.41Å; W404-W421 AromaticContact CE2-CE3 3.64Å; W404-W421 HydrophobicContact CE3-CB 4.16Å; W404-W421 HydrophobicContact CE3-CE3 4.43Å; W404-W421 AromaticContact CG-CE3 3.71Å; W404-W421 HydrophobicContact CG-CE3 3.71Å; W404-W421 HydrophobicContact CG-CZ3 4.03Å; W404-W421 HydrophobicContact CH2-CB 4.42Å; W404-W421 HydrophobicContact CZ2-CE3 4.28Å; W404-W421 HydrophobicContact CZ3-CB 4.09Å; W404-W421 AromaticContact NE1-CE3 3.6Å; W404-W421 AromaticContact NE1-CZ3 3.63Å
405	Y	89.3	Confident	81.6	Confident	1 Å²	1	48.5 Å²	48.5	0%	0.004	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	126.8	168.2	-68.7	-99	0	0	0	108.8	F336 F351 R352 I372 L392 L394 Q401 T403 S419 A420 L422	F336-Y405 HydrophobicContact CD2-CG 4.2Å; F336-Y405 HydrophobicContact CE2-CD1 4.27Å; F336-Y405 AromaticContact CE2-CD2 3.54Å; F336-Y405 HydrophobicContact CE2-CD2 3.54Å; F336-Y405 HydrophobicContact CE2-CE2 4.2Å; F336-Y405 AromaticContact CE2-CG 3.59Å; F336-Y405 HydrophobicContact CE2-CG 3.59Å; F336-Y405 AromaticContact CZ-CD2 3.83Å; F336-Y405 HydrophobicContact CZ-CD2 3.83Å; F336-Y405 HydrophobicContact CZ-CG 4.15Å; F351-Y405 WeakPolarHBondContact O-CA 3.49Å; R352-Y405 HydrophobicContact CB-CD1 4.04Å; R352-Y405 HydrophobicContact CB-CE1 3.81Å; R352-Y405 WeakPolarHBondContact CD-OH 3.43Å; R352-Y405 HydrophobicContact CG-CD1 4.29Å; R352-Y405 HydrophobicContact CG-CE1 3.72Å; I372-Y405 HydrophobicContact CD1-CD1 4.35Å; I372-Y405 HydrophobicContact CD1-CE1 3.89Å; L392-Y405 HydrophobicContact CD2-CD1 3.81Å; L392-Y405 HydrophobicContact CD2-CE1 4.42Å; L394-Y405 HydrophobicContact CD1-CD1 4.32Å; L394-Y405 HydrophobicContact CD1-CE1 3.65Å; L394-Y405 HydrophobicContact CD1-CE2 4.24Å; L394-Y405 HydrophobicContact CD2-CE1 4.25Å; Q401-Y405 WeakPolarHBondContact O-CE2 3.25Å; Q401-Y405 PolarHBondContact O-OH 2.85Å; T403-Y405 HydrophobicContact CG2-CD2 4.25Å; T403-Y405 HydrophobicContact CG2-CE2 3.6Å; T403-Y405 WeakPolarHBondContact O-CD2 3.33Å; Y405-S419 CarbonylContact O-C 3.55Å; Y405-S419 WeakPolarHBondContact O-CA 3.43Å; Y405-A420 PolarHBondContact N-O 2.73Å; Y405-A420 PolarHBondContact O-N 2.71Å; Y405-L422 HydrophobicContact CD2-CB 3.96Å; Y405-L422 HydrophobicContact CE2-CB 3.68Å; Y405-L422 HydrophobicContact CE2-CD2 3.89Å; Y405-L422 HydrophobicContact CE2-CG 4.46Å
406	T	86.5	Confident	81	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	131.8	179.8	-59.7	0	0	0	0	109.8	W350 F351 H353 V408 Y417 K418 S419 I515	W350-T406 CarbonylContact C-O 3.51Å; W350-T406 WeakPolarHBondContact CA-O 3.27Å; F351-T406 PolarHBondContact N-O 2.98Å; F351-T406 PolarHBondContact O-N 3.38Å; H353-T406 PolarHBondContact NE2-OG1 2.75Å; T406-V408 HydrophobicContact CG2-CG2 3.93Å; T406-Y417 HydrophobicContact CG2-CD2 4.25Å; T406-Y417 HydrophobicContact CG2-CG 4.49Å; T406-K418 CarbonylContact C-O 3.45Å; T406-K418 WeakPolarHBondContact CA-O 3.5Å; T406-K418 WeakPolarHBondContact CG2-O 3.32Å; T406-S419 PolarHBondContact OG1-OG 3.33Å; T406-I515 HydrophobicContact CG2-CD1 4.37Å
407	C	85.2	Confident	80.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	130.7	157.9	55	0	0	0	0	108.9	C338 I348 W350 Y417 K418	C338-C407 HydrophobicContact CB-CB 3.53Å; C338-C407 WeakPolarHBondContact CB-SG 3.37Å; C338-C407 WeakPolarHBondContact SG-CB 3.22Å; C338-C407 CovalentContact SG-SG 2.03Å; C338-C407 PolarHBondContact SG-SG 2.8Å; I348-C407 HydrophobicContact CD1-CB 3.97Å; I348-C407 HydrophobicContact CG1-CB 4.42Å; W350-C407 HydrophobicContact CD2-CB 4.11Å; W350-C407 HydrophobicContact CE3-CB 3.92Å; W350-C407 HydrophobicContact CH2-CB 3.96Å; W350-C407 HydrophobicContact CZ2-CB 4.12Å; W350-C407 HydrophobicContact CZ3-CB 3.85Å; C407-Y417 CarbonylContact O-C 3.56Å; C407-Y417 WeakPolarHBondContact O-CA 3.21Å; C407-Y417 WeakPolarHBondContact O-CB 3.38Å; C407-K418 PolarHBondContact N-O 3.15Å; C407-K418 PolarHBondContact O-N 2.8Å
408	V	85.1	Confident	80.4	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.03	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.9	173.7	-176.2	0	0	0	0	107.2	I348 E349 T406 V415 I515 Y521	I348-V408 CarbonylContact C-O 3.52Å; I348-V408 WeakPolarHBondContact CA-O 3.36Å; E349-V408 PolarHBondContact N-O 2.01Å; E349-V408 PolarHBondContact O-N 3.19Å; T406-V408 HydrophobicContact CG2-CG2 3.93Å; V408-V415 HydrophobicContact CG1-CG1 3.57Å; V408-I515 HydrophobicContact CG2-CD1 3.66Å; V408-I515 HydrophobicContact CG2-CG1 4.46Å; V408-Y521 HydrophobicContact CG1-CD2 4.45Å; V408-Y521 HydrophobicContact CG1-CE2 3.97Å
409	V	79.8	Confident	80.2	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	117.2	-169.8	-174.3	0	0	0	0	109.5	P316 I318 V340 P346 H347 I348 V415 V416	P316-V409 HydrophobicContact CB-CB 4.37Å; P316-V409 HydrophobicContact CB-CG1 3.59Å; P316-V409 HydrophobicContact CG-CG1 3.98Å; I318-V409 HydrophobicContact CD1-CB 4.45Å; I318-V409 HydrophobicContact CD1-CG2 3.93Å; I318-V409 HydrophobicContact CG1-CB 4.41Å; I318-V409 HydrophobicContact CG1-CG2 3.92Å; V340-V409 HydrophobicContact CB-CG1 4.36Å; V340-V409 HydrophobicContact CG1-CG1 3.78Å; V340-V409 HydrophobicContact CG2-CB 4.3Å; V340-V409 HydrophobicContact CG2-CG1 3.66Å; V340-V409 HydrophobicContact CG2-CG2 3.78Å; P346-V409 HydrophobicContact CB-CG1 4Å; H347-V409 CarbonylContact O-C 3.46Å; H347-V409 WeakPolarHBondContact O-CA 3.21Å; I348-V409 HydrophobicContact CB-CG2 4.26Å; I348-V409 HydrophobicContact CD1-CG2 3.91Å; I348-V409 HydrophobicContact CG1-CG2 3.93Å; V409-V415 CarbonylContact O-C 3.57Å; V409-V415 WeakPolarHBondContact O-CA 3.34Å; V409-V416 HydrophobicContact CB-CG2 4.12Å; V409-V416 PolarHBondContact N-O 2.82Å; V409-V416 PolarHBondContact O-N 2.97Å
410	G	73.2	Confident	80.1	Confident	18 Å²	18	42.1 Å²	42.1	19%	0.186	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	144.4	-177.6	0	0	0	0	0	113.4	P346 H347 G414	P346-G410 CarbonylContact C-O 3.59Å; P346-G410 VanDerWaalsContact CA-O 3.25Å; P346-G410 WeakPolarHBondContact CA-O 3.09Å; H347-G410 PolarHBondContact N-O 3.03Å; H347-G410 PolarHBondContact O-N 2.91Å; G410-G414 WeakPolarHBondContact CA-O 3.11Å
411	N	72	Confident	80.3	Confident	21 Å²	21	37.2 Å²	37.2	11%	0.112	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	-175.3	161.6	74.7	17.4	0	0	0	109.4	H314 P316 S342 L344 P346 L413 G414	H314-N411 PolarHBondContact O-ND2 2.79Å; P316-N411 HydrophobicContact CG-CB 3.89Å; S342-N411 PolarHBondContact OG-ND2 3.17Å; L344-N411 HydrophobicContact CB-CB 4.16Å; P346-N411 HydrophobicContact CB-CB 4.49Å; N411-L413 PolarHBondContact O-N 2.69Å; N411-L413 WeakPolarHBondContact OD1-CA 3.29Å; N411-L413 WeakPolarHBondContact OD1-CB 3.39Å; N411-L413 PolarHBondContact OD1-N 3.5Å; N411-G414 PolarHBondContact N-O 2.76Å; N411-G414 PolarHBondContact O-N 3.15Å; N411-G414 PolarHBondContact OD1-N 3Å
412	A	67.8	Low	80.6	Confident	100 Å²	100	35.5 Å²	35.5	83%	0.826	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-5.5	-177.5	0	0	0	0	0	115.5	L344	L344-A412 HydrophobicContact CD1-CB 4.21Å
413	L	67.8	Low	80.6	Confident	93 Å²	93	37.7 Å²	37.7	49%	0.487	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-5.3	-179.3	-60	170.2	0	0	0	113.5	P313 L344 N411	P313-L413 HydrophobicContact CB-CD1 3.57Å; P313-L413 WeakPolarHBondContact O-CD1 3.34Å; L344-L413 HydrophobicContact CD1-CD1 3.58Å; L344-L413 HydrophobicContact CD1-CG 3.7Å; L344-L413 HydrophobicContact CG-CD1 4.48Å; N411-L413 PolarHBondContact O-N 2.69Å; N411-L413 WeakPolarHBondContact OD1-CA 3.29Å; N411-L413 WeakPolarHBondContact OD1-CB 3.39Å; N411-L413 PolarHBondContact OD1-N 3.5Å
414	G	63.7	Low	80.7	Confident	26 Å²	26	37.6 Å²	37.6	27%	0.268	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	152.5	177.2	175.7	0	0	0	0	0	114.3	P316 G410 N411	P316-G414 WeakPolarHBondContact CD-O 3.45Å; G410-G414 WeakPolarHBondContact CA-O 3.11Å; N411-G414 PolarHBondContact N-O 2.76Å; N411-G414 PolarHBondContact O-N 3.15Å; N411-G414 PolarHBondContact OD1-N 3Å
415	V	64.1	Low	80.9	Confident	49 Å²	49	36.4 Å²	36.4	30%	0.297	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	143.9	178.4	-175.2	0	0	0	0	109.2	V408 V409 Y521	V408-V415 HydrophobicContact CG1-CG1 3.57Å; V409-V415 CarbonylContact O-C 3.57Å; V409-V415 WeakPolarHBondContact O-CA 3.34Å; V415-Y521 HydrophobicContact CG1-CG 4.36Å; V415-Y521 HydrophobicContact CG2-CD1 4.02Å; V415-Y521 HydrophobicContact CG2-CG 4.28Å
416	V	74.5	Confident	80.8	Confident	30 Å²	30	39.4 Å²	39.4	18%	0.182	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	158.7	167.9	-64.2	0	0	0	0	109.3	K315 P316 I318 V409	K315-V416 HydrophobicContact CD-CG1 4.14Å; K315-V416 HydrophobicContact CG-CG1 4.34Å; P316-V416 HydrophobicContact CB-CG2 4.01Å; P316-V416 VanDerWaalsContact O-CG1 3.26Å; P316-V416 WeakPolarHBondContact O-CG1 3.27Å; P316-V416 WeakPolarHBondContact O-CG2 3.4Å; I318-V416 HydrophobicContact CD1-CB 4.43Å; I318-V416 HydrophobicContact CD1-CG2 3.81Å; I318-V416 HydrophobicContact CG1-CG2 3.85Å; V409-V416 HydrophobicContact CB-CG2 4.12Å; V409-V416 PolarHBondContact N-O 2.82Å; V409-V416 PolarHBondContact O-N 2.97Å
417	Y	83.4	Confident	80.2	Confident	79 Å²	79	40.6 Å²	40.6	31%	0.31	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	155.7	178.6	59.5	-84.8	0	0	0	111	T406 C407 I515 G519	T406-Y417 HydrophobicContact CG2-CD2 4.25Å; T406-Y417 HydrophobicContact CG2-CG 4.49Å; C407-Y417 CarbonylContact O-C 3.56Å; C407-Y417 WeakPolarHBondContact O-CA 3.21Å; C407-Y417 WeakPolarHBondContact O-CB 3.38Å; Y417-I515 HydrophobicContact CE2-CG2 4.44Å; Y417-G519 VanDerWaalsContact OH-CA 3.24Å; Y417-G519 WeakPolarHBondContact OH-CA 3.27Å
418	K	79.4	Confident	79.1	Confident	64 Å²	64	48.8 Å²	48.8	28%	0.278	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	148.5	171.6	-74.7	-172.8	-178.7	174.8	0	112.2	I318 A319 P320 F322 T406 C407	I318-K418 HydrophobicContact CB-CD 4.12Å; I318-K418 HydrophobicContact CD1-CB 4.25Å; I318-K418 HydrophobicContact CD1-CG 4.14Å; I318-K418 HydrophobicContact CG2-CD 3.83Å; I318-K418 HydrophobicContact CG2-CG 4.43Å; I318-K418 PolarHBondContact O-NZ 2.82Å; I318-K418 VanDerWaalsContact O-NZ 3.17Å; A319-K418 PolarHBondContact O-NZ 2.83Å; P320-K418 PolarHBondContact O-NZ 3Å; F322-K418 WeakPolarHBondContact O-CD 3.35Å; T406-K418 CarbonylContact C-O 3.45Å; T406-K418 WeakPolarHBondContact CA-O 3.5Å; T406-K418 WeakPolarHBondContact CG2-O 3.32Å; C407-K418 PolarHBondContact N-O 3.15Å; C407-K418 PolarHBondContact O-N 2.8Å
419	S	86.3	Confident	78	Confident	48 Å²	48	54.7 Å²	54.7	34%	0.336	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	145	-173.3	-49.7	0	0	0	0	112.1	Y405 T406	Y405-S419 CarbonylContact O-C 3.55Å; Y405-S419 WeakPolarHBondContact O-CA 3.43Å; T406-S419 PolarHBondContact OG1-OG 3.33Å
420	A	86.7	Confident	76.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	152.4	169.7	0	0	0	0	0	110.7	P323 K324 N325 F336 W404 Y405	P323-A420 HydrophobicContact CB-CB 3.85Å; P323-A420 HydrophobicContact CG-CB 3.78Å; K324-A420 WeakPolarHBondContact O-CB 3.48Å; N325-A420 WeakPolarHBondContact OD1-CA 3.42Å; F336-A420 HydrophobicContact CD1-CB 4.14Å; F336-A420 HydrophobicContact CE1-CB 3.71Å; W404-A420 CarbonylContact C-O 3.53Å; W404-A420 WeakPolarHBondContact CA-O 3.48Å; W404-A420 VanDerWaalsContact CE3-C 3.44Å; Y405-A420 PolarHBondContact N-O 2.73Å; Y405-A420 PolarHBondContact O-N 2.71Å
421	W	90.7	Very high	76	Confident	77 Å²	77	58.4 Å²	58.4	29%	0.292	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	136.4	178.1	-173.3	-97.4	0	0	0	111.3	N325 L326 W360 T403 W404	N325-W421 WeakPolarHBondContact CA-O 3.32Å; N325-W421 PolarHBondContact OD1-N 3.49Å; L326-W421 PolarHBondContact N-O 3.45Å; W360-W421 HydrophobicContact CH2-CH2 4.13Å; W360-W421 AromaticContact CH2-CZ3 3.9Å; W360-W421 HydrophobicContact CH2-CZ3 3.9Å; W360-W421 HydrophobicContact CZ2-CH2 4.17Å; W360-W421 HydrophobicContact CZ2-CZ3 4.01Å; T403-W421 VanDerWaalsContact C-CE3 3.48Å; W404-W421 HydrophobicContact CB-CE3 4.46Å; W404-W421 AromaticContact CD1-CE3 3.66Å; W404-W421 AromaticContact CD1-CZ3 3.56Å; W404-W421 AromaticContact CD2-CE3 3.72Å; W404-W421 HydrophobicContact CD2-CE3 3.72Å; W404-W421 HydrophobicContact CD2-CZ3 4.41Å; W404-W421 AromaticContact CE2-CE3 3.64Å; W404-W421 HydrophobicContact CE3-CB 4.16Å; W404-W421 HydrophobicContact CE3-CE3 4.43Å; W404-W421 AromaticContact CG-CE3 3.71Å; W404-W421 HydrophobicContact CG-CE3 3.71Å; W404-W421 HydrophobicContact CG-CZ3 4.03Å; W404-W421 HydrophobicContact CH2-CB 4.42Å; W404-W421 HydrophobicContact CZ2-CE3 4.28Å; W404-W421 HydrophobicContact CZ3-CB 4.09Å; W404-W421 AromaticContact NE1-CE3 3.6Å; W404-W421 AromaticContact NE1-CZ3 3.63Å
422	L	92.3	Very high	75.2	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	114.9	163.1	-174.6	56	0	0	0	109.1	L326 V328 A334 F336 L394 V397 Q401 S402 T403 Y405 V424	L326-L422 HydrophobicContact CB-CD1 3.91Å; V328-L422 HydrophobicContact CB-CD1 4.4Å; V328-L422 HydrophobicContact CG2-CD1 4.07Å; A334-L422 HydrophobicContact CB-CD1 3.77Å; A334-L422 HydrophobicContact CB-CD2 4.18Å; F336-L422 HydrophobicContact CE2-CB 4.26Å; F336-L422 HydrophobicContact CZ-CB 3.89Å; F336-L422 HydrophobicContact CZ-CD1 4.47Å; L394-L422 HydrophobicContact CD1-CD2 3.77Å; V397-L422 HydrophobicContact CG1-CD2 4.06Å; Q401-L422 HydrophobicContact CB-CD2 4.48Å; S402-L422 CarbonylContact C-O 3.58Å; S402-L422 WeakPolarHBondContact CA-O 3.49Å; S402-L422 WeakPolarHBondContact CB-O 3.25Å; S402-L422 PolarHBondContact OG-O 2.93Å; T403-L422 PolarHBondContact N-O 3.09Å; T403-L422 PolarHBondContact O-N 2.79Å; Y405-L422 HydrophobicContact CD2-CB 3.96Å; Y405-L422 HydrophobicContact CE2-CB 3.68Å; Y405-L422 HydrophobicContact CE2-CD2 3.89Å; Y405-L422 HydrophobicContact CE2-CG 4.46Å; L422-V424 HydrophobicContact CD2-CG2 4.19Å; L422-V424 HydrophobicContact CG-CG2 3.93Å
423	E	91.1	Very high	74.7	Confident	84 Å²	84	60 Å²	60	39%	0.393	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	122.3	167	-178	179.4	-142.6	0	0	109	L326 T327 V328 L425	L326-E423 PolarHBondContact O-N 2.83Å; T327-E423 WeakPolarHBondContact CA-O 3.28Å; T327-E423 WeakPolarHBondContact CB-OE2 3.35Å; T327-E423 HydrophobicContact CG2-CB 4.2Å; T327-E423 HydrophobicContact CG2-CG 4.05Å; T327-E423 WeakPolarHBondContact CG2-OE2 3.32Å; T327-E423 PolarHBondContact OG1-OE2 2.94Å; V328-E423 PolarHBondContact N-O 3.43Å; E423-L425 HydrophobicContact CG-CD2 4.05Å
424	V	90.8	Very high	74.3	Confident	7 Å²	7	60.4 Å²	60.4	4%	0.042	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	115.3	176.3	-171.4	0	0	0	0	109.1	V328 V330 V397 M399 S402 L422	V328-V424 CarbonylContact O-C 3.59Å; V328-V424 WeakPolarHBondContact O-CA 3.35Å; V330-V424 HydrophobicContact CG2-CG1 3.8Å; V397-V424 HydrophobicContact CG1-CB 4.42Å; V397-V424 HydrophobicContact CG1-CG1 4Å; V397-V424 HydrophobicContact CG1-CG2 3.48Å; V397-V424 VanDerWaalsContact CG1-CG2 3.48Å; M399-V424 WeakPolarHBondContact CE-O 3.4Å; M399-V424 HydrophobicContact SD-CB 4.39Å; M399-V424 HydrophobicContact SD-CG1 3.99Å; S402-V424 PolarHBondContact OG-N 2.92Å; L422-V424 HydrophobicContact CD2-CG2 4.19Å; L422-V424 HydrophobicContact CG-CG2 3.93Å
425	L	88.2	Confident	74.1	Confident	61 Å²	61	62.8 Å²	62.8	32%	0.319	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	145.3	178.3	-62.5	-176.7	0	0	0	110.8	T327 V328 H329 V330 E423	T327-L425 HydrophobicContact CG2-CD1 3.5Å; T327-L425 VanDerWaalsContact CG2-CD1 3.5Å; T327-L425 HydrophobicContact CG2-CD2 4.34Å; T327-L425 HydrophobicContact CG2-CG 3.65Å; V328-L425 PolarHBondContact O-N 2.69Å; H329-L425 CarbonylContact C-O 3.58Å; H329-L425 VanDerWaalsContact CA-O 3.32Å; H329-L425 WeakPolarHBondContact CA-O 3.46Å; V330-L425 PolarHBondContact N-O 2.92Å; E423-L425 HydrophobicContact CG-CD2 4.05Å
426	P	87.9	Confident	73.9	Confident	65 Å²	65	64.3 Å²	64.3	42%	0.422	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-55.9	148	171.9	24.3	-33.8	0	0	0	111.2	H329 A430	H329-P426 PolarHBondContact ND1-O 2.88Å; P426-A430 HydrophobicContact CB-CB 4.28Å
427	G	73.3	Confident	73.3	Confident	25 Å²	25	65.1 Å²	65.1	26%	0.258	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-57.3	147.7	176.1	0	0	0	0	0	111.5	D429 A430 A431	G427-D429 PolarHBondContact O-N 3.19Å; G427-D429 VanDerWaalsContact O-N 3.11Å; G427-A430 WeakPolarHBondContact O-CA 3.35Å; G427-A430 WeakPolarHBondContact O-CB 3.28Å; G427-A430 PolarHBondContact O-N 2.71Å; G427-A431 PolarHBondContact O-N 3.03Å
428	R	63.4	Low	72.4	Confident	172 Å²	172	65.9 Å²	65.9	65%	0.649	37%	0.374	S	S	*	.	H	α-helix	trans	-58.3	-32	-170	-64.5	-178.4	-177.2	162.4	7.4	113.3	H329 A432	H329-R428 PolarHBondContact NE2-NE 2.94Å; H329-R428 PolarHBondContact NE2-NH2 3.41Å; R428-A432 PolarHBondContact O-N 3.48Å
429	D	62.3	Low	71.6	Confident	130 Å²	130	65.3 Å²	65.3	70%	0.695	38%	0.381	S	S	*	.	H	α-helix	trans	-72.1	-28.5	175.9	-56	-53.4	0	0	0	113.3	G427 N433	G427-D429 PolarHBondContact O-N 3.19Å; G427-D429 VanDerWaalsContact O-N 3.11Å; D429-N433 WeakPolarHBondContact O-CB 3.33Å; D429-N433 PolarHBondContact O-N 3.49Å; D429-N433 PolarHBondContact O-ND2 3.12Å
430	A	56.9	Low	70.8	Confident	45 Å²	45	69.2 Å²	69.2	37%	0.372	39%	0.392	S	S	.	.	H	α-helix	trans	-69.9	-46.6	173.3	0	0	0	0	0	110.3	P426 G427 A432 N433 D434	P426-A430 HydrophobicContact CB-CB 4.28Å; G427-A430 WeakPolarHBondContact O-CA 3.35Å; G427-A430 WeakPolarHBondContact O-CB 3.28Å; G427-A430 PolarHBondContact O-N 2.71Å; A430-A432 VanDerWaalsContact C-N 3.29Å; A430-A432 PolarHBondContact O-N 2.68Å; A430-N433 PolarHBondContact O-N 2.86Å; A430-N433 VanDerWaalsContact O-N 3.13Å; A430-D434 PolarHBondContact O-N 3Å
431	A	52.5	Low	69.8	Low	50 Å²	50	73 Å²	73	41%	0.413	42%	0.415	S	S	.	.	H	α-helix	trans	-61.3	-35.3	174.9	0	0	0	0	0	112.7	G427 S435	G427-A431 PolarHBondContact O-N 3.03Å; A431-S435 VanDerWaalsContact O-CB 3.28Å; A431-S435 WeakPolarHBondContact O-CB 3.5Å; A431-S435 PolarHBondContact O-N 3.04Å; A431-S435 PolarHBondContact O-OG 3.2Å
432	A	55.8	Low	68.5	Low	52 Å²	52	72 Å²	72	43%	0.43	42%	0.423	S	S	.	.	H	α-helix	trans	-67.7	-41.8	172.8	0	0	0	0	0	112.4	R428 A430 S435 L436	R428-A432 PolarHBondContact O-N 3.48Å; A430-A432 VanDerWaalsContact C-N 3.29Å; A430-A432 PolarHBondContact O-N 2.68Å; A432-S435 PolarHBondContact O-OG 2.88Å; A432-L436 WeakPolarHBondContact O-CB 3.35Å; A432-L436 PolarHBondContact O-N 2.96Å
433	N	57.2	Low	67	Low	104 Å²	104	76.8 Å²	76.8	56%	0.556	45%	0.446	S	S	*	.	H	α-helix	trans	-71.5	-35	177.8	-78.9	-58.1	0	0	0	112.9	D429 A430 L436 S437	D429-N433 WeakPolarHBondContact O-CB 3.33Å; D429-N433 PolarHBondContact O-N 3.49Å; D429-N433 PolarHBondContact O-ND2 3.12Å; A430-N433 PolarHBondContact O-N 2.86Å; A430-N433 VanDerWaalsContact O-N 3.13Å; N433-L436 CarbonylContact O-C 3.51Å; N433-L436 PolarHBondContact O-N 3.42Å; N433-S437 VanDerWaalsContact O-CB 3.31Å; N433-S437 WeakPolarHBondContact O-CB 3.26Å; N433-S437 PolarHBondContact O-N 3.1Å
434	D	59.1	Low	65.6	Low	101 Å²	101	79 Å²	79	54%	0.54	45%	0.454	S	S	.	.	H	α-helix	trans	-79.2	-37.3	176.6	-87	-29	0	0	0	113.3	A430 L436 S437 V438	A430-D434 PolarHBondContact O-N 3Å; D434-L436 PolarHBondContact O-N 3.03Å; D434-S437 WeakPolarHBondContact CA-OG 3.42Å; D434-S437 PolarHBondContact O-N 2.85Å; D434-S437 VanDerWaalsContact O-N 3.16Å; D434-S437 PolarHBondContact O-OG 2.79Å; D434-S437 VanDerWaalsContact O-OG 3.12Å; D434-S437 PolarHBondContact OD1-OG 2.75Å; D434-V438 VanDerWaalsContact O-CB 3.27Å; D434-V438 WeakPolarHBondContact O-CB 3.4Å; D434-V438 VanDerWaalsContact O-CG2 3.28Å; D434-V438 WeakPolarHBondContact O-CG2 3.49Å; D434-V438 PolarHBondContact O-N 2.83Å
435	S	59.4	Low	64.4	Low	76 Å²	76	83.9 Å²	83.9	53%	0.531	48%	0.477	S	S	.	.	H	α-helix	trans	-62	-33.5	167.9	56.1	0	0	0	0	111.2	A431 A432 A439	A431-S435 VanDerWaalsContact O-CB 3.28Å; A431-S435 WeakPolarHBondContact O-CB 3.5Å; A431-S435 PolarHBondContact O-N 3.04Å; A431-S435 PolarHBondContact O-OG 3.2Å; A432-S435 PolarHBondContact O-OG 2.88Å; S435-A439 WeakPolarHBondContact O-CB 3.47Å; S435-A439 PolarHBondContact O-N 2.97Å
436	L	60.2	Low	63.5	Low	81 Å²	81	87.1 Å²	87.1	42%	0.424	49%	0.485	S	S	.	.	H	α-helix	trans	-73.2	-34.5	171.5	-174.1	62.8	0	0	0	113.4	A432 N433 D434 K440	A432-L436 WeakPolarHBondContact O-CB 3.35Å; A432-L436 PolarHBondContact O-N 2.96Å; N433-L436 CarbonylContact O-C 3.51Å; N433-L436 PolarHBondContact O-N 3.42Å; D434-L436 PolarHBondContact O-N 3.03Å; L436-K440 HydrophobicContact CD1-CD 4.44Å; L436-K440 HydrophobicContact CG-CD 4.2Å; L436-K440 VanDerWaalsContact O-CB 3.27Å; L436-K440 WeakPolarHBondContact O-CB 3.46Å; L436-K440 WeakPolarHBondContact O-CD 3.14Å; L436-K440 WeakPolarHBondContact O-CG 3.13Å; L436-K440 PolarHBondContact O-N 3Å
437	S	61.6	Low	62.9	Low	46 Å²	46	88.6 Å²	88.6	32%	0.322	48%	0.484	S	S	.	.	H	α-helix	trans	-72.5	-45	178.2	83.8	0	0	0	0	110.7	N433 D434 K440 T441	N433-S437 VanDerWaalsContact O-CB 3.31Å; N433-S437 WeakPolarHBondContact O-CB 3.26Å; N433-S437 PolarHBondContact O-N 3.1Å; D434-S437 WeakPolarHBondContact CA-OG 3.42Å; D434-S437 PolarHBondContact O-N 2.85Å; D434-S437 VanDerWaalsContact O-N 3.16Å; D434-S437 PolarHBondContact O-OG 2.79Å; D434-S437 VanDerWaalsContact O-OG 3.12Å; D434-S437 PolarHBondContact OD1-OG 2.75Å; S437-K440 PolarHBondContact O-N 3.09Å; S437-T441 VanDerWaalsContact O-CB 3.3Å; S437-T441 WeakPolarHBondContact O-CB 3.48Å; S437-T441 PolarHBondContact O-N 2.82Å; S437-T441 PolarHBondContact O-OG1 2.79Å
438	V	64.6	Low	63.1	Low	95 Å²	95	90.5 Å²	90.5	58%	0.576	49%	0.489	S	S	*	.	H	α-helix	trans	-65.7	-43.6	173.1	174.3	0	0	0	0	110.5	D434 K440 T441 A442	D434-V438 VanDerWaalsContact O-CB 3.27Å; D434-V438 WeakPolarHBondContact O-CB 3.4Å; D434-V438 VanDerWaalsContact O-CG2 3.28Å; D434-V438 WeakPolarHBondContact O-CG2 3.49Å; D434-V438 PolarHBondContact O-N 2.83Å; V438-K440 PolarHBondContact O-N 2.69Å; V438-T441 PolarHBondContact O-N 3.03Å; V438-A442 VanDerWaalsContact O-CB 3.26Å; V438-A442 WeakPolarHBondContact O-CB 3.35Å; V438-A442 PolarHBondContact O-N 3.48Å
439	A	64.3	Low	63.8	Low	52 Å²	52	85.5 Å²	85.5	43%	0.43	48%	0.478	S	S	.	.	H	α-helix	trans	-62.3	-41.7	174.8	0	0	0	0	0	112.1	S435 Q443	S435-A439 WeakPolarHBondContact O-CB 3.47Å; S435-A439 PolarHBondContact O-N 2.97Å; A439-Q443 WeakPolarHBondContact O-CB 3.47Å; A439-Q443 WeakPolarHBondContact O-CG 3.41Å; A439-Q443 PolarHBondContact O-N 3.27Å
440	K	68	Low	64.8	Low	130 Å²	130	83.5 Å²	83.5	57%	0.565	47%	0.466	S	S	*	.	H	α-helix	trans	-64.5	-41.5	173.7	-78	167.4	-178.2	168.1	0	112.2	L436 S437 V438 Q443 F444	L436-K440 HydrophobicContact CD1-CD 4.44Å; L436-K440 HydrophobicContact CG-CD 4.2Å; L436-K440 VanDerWaalsContact O-CB 3.27Å; L436-K440 WeakPolarHBondContact O-CB 3.46Å; L436-K440 WeakPolarHBondContact O-CD 3.14Å; L436-K440 WeakPolarHBondContact O-CG 3.13Å; L436-K440 PolarHBondContact O-N 3Å; S437-K440 PolarHBondContact O-N 3.09Å; V438-K440 PolarHBondContact O-N 2.69Å; K440-Q443 CarbonylContact O-C 3.55Å; K440-Q443 WeakPolarHBondContact O-CA 3.49Å; K440-Q443 WeakPolarHBondContact O-CB 3.44Å; K440-Q443 PolarHBondContact O-N 2.72Å; K440-F444 PolarHBondContact O-N 2.79Å
441	T	67.3	Low	65.9	Low	80 Å²	80	85.6 Å²	85.6	49%	0.491	47%	0.471	S	S	.	.	H	α-helix	trans	-70.2	-43.1	-179.1	-56.4	0	0	0	0	110.8	S437 V438 Q443 F444 Q445	S437-T441 VanDerWaalsContact O-CB 3.3Å; S437-T441 WeakPolarHBondContact O-CB 3.48Å; S437-T441 PolarHBondContact O-N 2.82Å; S437-T441 PolarHBondContact O-OG1 2.79Å; V438-T441 PolarHBondContact O-N 3.03Å; T441-Q443 VanDerWaalsContact C-N 3.33Å; T441-Q443 PolarHBondContact O-N 2.89Å; T441-F444 WeakPolarHBondContact O-CB 3.45Å; T441-F444 PolarHBondContact O-N 2.88Å; T441-Q445 HydrophobicContact CG2-CG 4.26Å; T441-Q445 WeakPolarHBondContact O-CB 3.1Å; T441-Q445 VanDerWaalsContact O-CG 3.3Å; T441-Q445 WeakPolarHBondContact O-CG 3.45Å; T441-Q445 PolarHBondContact O-N 2.94Å
442	A	62.7	Low	67.4	Low	56 Å²	56	86.8 Å²	86.8	46%	0.463	47%	0.473	S	S	.	.	H	α-helix	trans	-60.8	-41.3	169.1	0	0	0	0	0	111.5	V438 F444 Q445 W446	V438-A442 VanDerWaalsContact O-CB 3.26Å; V438-A442 WeakPolarHBondContact O-CB 3.35Å; V438-A442 PolarHBondContact O-N 3.48Å; A442-F444 PolarHBondContact O-N 3.4Å; A442-Q445 PolarHBondContact O-N 2.84Å; A442-W446 PolarHBondContact O-N 3.34Å
443	Q	60.4	Low	69	Low	100 Å²	100	88.7 Å²	88.7	47%	0.467	48%	0.475	S	S	.	.	H	α-helix	trans	-65	-8.9	172.4	-90.4	-83.2	-17	0	0	114.9	A439 K440 T441 W446 K447	A439-Q443 WeakPolarHBondContact O-CB 3.47Å; A439-Q443 WeakPolarHBondContact O-CG 3.41Å; A439-Q443 PolarHBondContact O-N 3.27Å; K440-Q443 CarbonylContact O-C 3.55Å; K440-Q443 WeakPolarHBondContact O-CA 3.49Å; K440-Q443 WeakPolarHBondContact O-CB 3.44Å; K440-Q443 PolarHBondContact O-N 2.72Å; T441-Q443 VanDerWaalsContact C-N 3.33Å; T441-Q443 PolarHBondContact O-N 2.89Å; Q443-W446 VanDerWaalsContact C-NE1 3.35Å; Q443-W446 VanDerWaalsContact CA-CD1 3.4Å; Q443-W446 PolarHBondContact O-NE1 2.9Å; Q443-K447 WeakPolarHBondContact O-CD 3.34Å; Q443-K447 WeakPolarHBondContact O-CE 3.19Å; Q443-K447 PolarHBondContact O-NZ 2.95Å
444	F	62.5	Low	70.5	Confident	131 Å²	131	88.4 Å²	88.4	58%	0.575	47%	0.473	S	S	*	.	H	α-helix	trans	-101.8	-53.5	171.6	-157.7	-95.1	0	0	0	110.1	K440 T441 A442 W446 K447 D448	K440-F444 PolarHBondContact O-N 2.79Å; T441-F444 WeakPolarHBondContact O-CB 3.45Å; T441-F444 PolarHBondContact O-N 2.88Å; A442-F444 PolarHBondContact O-N 3.4Å; F444-W446 VanDerWaalsContact C-N 3.34Å; F444-W446 PolarHBondContact O-N 3.36Å; F444-K447 WeakPolarHBondContact O-CB 3.38Å; F444-K447 PolarHBondContact O-N 3.34Å; F444-D448 VanDerWaalsContact CD1-OD2 3.23Å; F444-D448 WeakPolarHBondContact CD1-OD2 3.33Å; F444-D448 WeakPolarHBondContact CE1-OD2 3.42Å; F444-D448 PolarHBondContact O-N 3.11Å; F444-D448 VanDerWaalsContact O-N 3.07Å
445	Q	63.8	Low	71.9	Confident	110 Å²	110	87.9 Å²	87.9	51%	0.514	47%	0.473	S	S	.	.	H	α-helix	trans	-53.2	-41.3	179.1	-73.6	-69.8	-29.3	0	0	113.6	T441 A442 K447 D448 T449	T441-Q445 HydrophobicContact CG2-CG 4.26Å; T441-Q445 WeakPolarHBondContact O-CB 3.1Å; T441-Q445 VanDerWaalsContact O-CG 3.3Å; T441-Q445 WeakPolarHBondContact O-CG 3.45Å; T441-Q445 PolarHBondContact O-N 2.94Å; A442-Q445 PolarHBondContact O-N 2.84Å; Q445-K447 VanDerWaalsContact C-N 3.33Å; Q445-K447 PolarHBondContact O-N 2.99Å; Q445-D448 PolarHBondContact O-N 3.45Å; Q445-T449 WeakPolarHBondContact O-CB 3.26Å; Q445-T449 PolarHBondContact O-N 3.41Å; Q445-T449 PolarHBondContact O-OG1 2.84Å
446	W	70.1	Confident	73.4	Confident	129 Å²	129	90.7 Å²	90.7	49%	0.489	48%	0.476	S	S	.	.	H	α-helix	trans	-65.1	-33.7	175.9	78.2	-50.6	0	0	0	113.2	A442 Q443 F444 I450	A442-W446 PolarHBondContact O-N 3.34Å; Q443-W446 VanDerWaalsContact C-NE1 3.35Å; Q443-W446 VanDerWaalsContact CA-CD1 3.4Å; Q443-W446 PolarHBondContact O-NE1 2.9Å; F444-W446 VanDerWaalsContact C-N 3.34Å; F444-W446 PolarHBondContact O-N 3.36Å; W446-I450 HydrophobicContact CD2-CD1 4.45Å; W446-I450 HydrophobicContact CE3-CD1 3.8Å; W446-I450 HydrophobicContact CZ3-CD1 4.31Å; W446-I450 VanDerWaalsContact O-CB 3.32Å; W446-I450 WeakPolarHBondContact O-CB 3.42Å; W446-I450 WeakPolarHBondContact O-CD1 3.49Å; W446-I450 WeakPolarHBondContact O-CG1 3.38Å; W446-I450 PolarHBondContact O-N 3.08Å
447	K	75.1	Confident	75	Confident	95 Å²	95	91 Å²	91	41%	0.413	48%	0.478	S	S	.	.	H	α-helix	trans	-71.9	-44.3	177.9	-72.3	166.7	-170.5	136.9	0	110.6	Q443 F444 Q445 T449 I450 N451	Q443-K447 WeakPolarHBondContact O-CD 3.34Å; Q443-K447 WeakPolarHBondContact O-CE 3.19Å; Q443-K447 PolarHBondContact O-NZ 2.95Å; F444-K447 WeakPolarHBondContact O-CB 3.38Å; F444-K447 PolarHBondContact O-N 3.34Å; Q445-K447 VanDerWaalsContact C-N 3.33Å; Q445-K447 PolarHBondContact O-N 2.99Å; K447-T449 VanDerWaalsContact C-N 3.34Å; K447-I450 PolarHBondContact O-N 3.2Å; K447-N451 WeakPolarHBondContact O-CB 3.21Å; K447-N451 PolarHBondContact O-N 2.89Å; K447-N451 PolarHBondContact O-ND2 3.35Å
448	D	77.2	Confident	76.5	Confident	65 Å²	65	93 Å²	93	35%	0.348	49%	0.488	S	S	.	.	H	α-helix	trans	-65.6	-39.4	174.9	-69.9	-20.3	0	0	0	111.5	F444 Q445 N451 V452	F444-D448 VanDerWaalsContact CD1-OD2 3.23Å; F444-D448 WeakPolarHBondContact CD1-OD2 3.33Å; F444-D448 WeakPolarHBondContact CE1-OD2 3.42Å; F444-D448 PolarHBondContact O-N 3.11Å; F444-D448 VanDerWaalsContact O-N 3.07Å; Q445-D448 PolarHBondContact O-N 3.45Å; D448-N451 PolarHBondContact O-N 3Å; D448-V452 WeakPolarHBondContact O-CB 3.24Å; D448-V452 VanDerWaalsContact O-CG2 3.27Å; D448-V452 WeakPolarHBondContact O-CG2 3.35Å; D448-V452 PolarHBondContact O-N 3.36Å
449	T	78.5	Confident	77.7	Confident	68 Å²	68	90.7 Å²	90.7	42%	0.417	48%	0.479	S	S	.	.	H	α-helix	trans	-63.5	-41.6	173.8	-56.8	0	0	0	0	111.5	Q445 K447 V452 I453	Q445-T449 WeakPolarHBondContact O-CB 3.26Å; Q445-T449 PolarHBondContact O-N 3.41Å; Q445-T449 PolarHBondContact O-OG1 2.84Å; K447-T449 VanDerWaalsContact C-N 3.34Å; T449-V452 PolarHBondContact O-N 3.35Å; T449-I453 HydrophobicContact CG2-CD1 3.85Å; T449-I453 HydrophobicContact CG2-CG1 4.43Å; T449-I453 WeakPolarHBondContact O-CB 3.39Å; T449-I453 VanDerWaalsContact O-CG1 3.23Å; T449-I453 WeakPolarHBondContact O-CG1 3.34Å; T449-I453 PolarHBondContact O-N 2.99Å
450	I	83.6	Confident	79.1	Confident	87 Å²	87	92.1 Å²	92.1	45%	0.446	48%	0.478	S	S	.	.	H	α-helix	trans	-64.5	-41.2	173.8	-74	164.2	0	0	0	111	W446 K447 I453 L454	W446-I450 HydrophobicContact CD2-CD1 4.45Å; W446-I450 HydrophobicContact CE3-CD1 3.8Å; W446-I450 HydrophobicContact CZ3-CD1 4.31Å; W446-I450 VanDerWaalsContact O-CB 3.32Å; W446-I450 WeakPolarHBondContact O-CB 3.42Å; W446-I450 WeakPolarHBondContact O-CD1 3.49Å; W446-I450 WeakPolarHBondContact O-CG1 3.38Å; W446-I450 PolarHBondContact O-N 3.08Å; K447-I450 PolarHBondContact O-N 3.2Å; I450-I453 PolarHBondContact O-N 3.37Å; I450-L454 WeakPolarHBondContact O-CB 3.44Å; I450-L454 PolarHBondContact O-N 2.91Å
451	N	81	Confident	80.2	Confident	89 Å²	89	91.4 Å²	91.4	48%	0.476	48%	0.479	S	S	.	.	H	α-helix	trans	-65	-41.2	175.6	-70.6	-29.8	0	0	0	112	K447 D448 L454 T455	K447-N451 WeakPolarHBondContact O-CB 3.21Å; K447-N451 PolarHBondContact O-N 2.89Å; K447-N451 PolarHBondContact O-ND2 3.35Å; D448-N451 PolarHBondContact O-N 3Å; N451-L454 PolarHBondContact O-N 3.16Å; N451-T455 WeakPolarHBondContact O-CB 3.04Å; N451-T455 WeakPolarHBondContact O-CG2 3.41Å; N451-T455 PolarHBondContact O-N 2.97Å; N451-T455 PolarHBondContact O-OG1 3.41Å
452	V	84	Confident	81.4	Confident	75 Å²	75	90.2 Å²	90.2	46%	0.455	48%	0.478	S	S	.	.	H	α-helix	trans	-63.7	-48.4	173.6	168.4	0	0	0	0	110.5	D448 T449 L454 T455 F456	D448-V452 WeakPolarHBondContact O-CB 3.24Å; D448-V452 VanDerWaalsContact O-CG2 3.27Å; D448-V452 WeakPolarHBondContact O-CG2 3.35Å; D448-V452 PolarHBondContact O-N 3.36Å; T449-V452 PolarHBondContact O-N 3.35Å; V452-L454 VanDerWaalsContact C-N 3.33Å; V452-L454 PolarHBondContact O-N 3.42Å; V452-T455 WeakPolarHBondContact CA-OG1 3.43Å; V452-T455 PolarHBondContact O-N 2.95Å; V452-T455 PolarHBondContact O-OG1 3.01Å; V452-F456 HydrophobicContact CG1-CD2 3.69Å; V452-F456 HydrophobicContact CG1-CE2 3.76Å; V452-F456 WeakPolarHBondContact O-CB 3.48Å; V452-F456 VanDerWaalsContact O-CD2 3.3Å; V452-F456 WeakPolarHBondContact O-CD2 3.35Å; V452-F456 PolarHBondContact O-N 3.48Å
453	I	88.2	Confident	82.8	Confident	92 Å²	92	91.2 Å²	91.2	47%	0.472	48%	0.479	S	S	.	.	H	α-helix	trans	-60.2	-43	175.4	-70.8	167	0	0	0	110.8	T449 I450 F456 L457	T449-I453 HydrophobicContact CG2-CD1 3.85Å; T449-I453 HydrophobicContact CG2-CG1 4.43Å; T449-I453 WeakPolarHBondContact O-CB 3.39Å; T449-I453 VanDerWaalsContact O-CG1 3.23Å; T449-I453 WeakPolarHBondContact O-CG1 3.34Å; T449-I453 PolarHBondContact O-N 2.99Å; I450-I453 PolarHBondContact O-N 3.37Å; I453-F456 PolarHBondContact O-N 2.84Å; I453-L457 HydrophobicContact CG2-CD1 3.86Å; I453-L457 HydrophobicContact CG2-CG 4.29Å; I453-L457 WeakPolarHBondContact O-CB 3.37Å; I453-L457 VanDerWaalsContact O-CG 3.28Å; I453-L457 WeakPolarHBondContact O-CG 3.45Å; I453-L457 PolarHBondContact O-N 3.38Å
454	L	89.2	Confident	84.3	Confident	99 Å²	99	91 Å²	91	52%	0.518	48%	0.479	S	S	.	.	H	α-helix	trans	-66.4	-41.2	179.2	-173.9	64	0	0	0	111.8	I450 N451 V452 L457 V458	I450-L454 WeakPolarHBondContact O-CB 3.44Å; I450-L454 PolarHBondContact O-N 2.91Å; N451-L454 PolarHBondContact O-N 3.16Å; V452-L454 VanDerWaalsContact C-N 3.33Å; V452-L454 PolarHBondContact O-N 3.42Å; L454-L457 PolarHBondContact O-N 2.98Å; L454-V458 WeakPolarHBondContact O-CB 3.45Å; L454-V458 VanDerWaalsContact O-CG2 3.3Å; L454-V458 WeakPolarHBondContact O-CG2 3.45Å; L454-V458 PolarHBondContact O-N 3.5Å
455	T	88.6	Confident	85.7	Confident	89 Å²	89	87 Å²	87	55%	0.546	47%	0.47	S	S	.	.	H	α-helix	trans	-67.6	-37.8	174.3	50.6	0	0	0	0	112	N451 V452 V458 A459	N451-T455 WeakPolarHBondContact O-CB 3.04Å; N451-T455 WeakPolarHBondContact O-CG2 3.41Å; N451-T455 PolarHBondContact O-N 2.97Å; N451-T455 PolarHBondContact O-OG1 3.41Å; V452-T455 WeakPolarHBondContact CA-OG1 3.43Å; V452-T455 PolarHBondContact O-N 2.95Å; V452-T455 PolarHBondContact O-OG1 3.01Å; T455-V458 PolarHBondContact O-N 3.49Å; T455-A459 VanDerWaalsContact O-CB 3.25Å; T455-A459 WeakPolarHBondContact O-CB 3.25Å; T455-A459 PolarHBondContact O-N 3.26Å
456	F	90.5	Very high	86.9	Confident	136 Å²	136	89 Å²	89	60%	0.596	48%	0.478	S	S	*	.	H	α-helix	trans	-63.5	-42	170.1	-89.3	-70.2	0	0	0	112.1	V452 I453 A459 I460	V452-F456 HydrophobicContact CG1-CD2 3.69Å; V452-F456 HydrophobicContact CG1-CE2 3.76Å; V452-F456 WeakPolarHBondContact O-CB 3.48Å; V452-F456 VanDerWaalsContact O-CD2 3.3Å; V452-F456 WeakPolarHBondContact O-CD2 3.35Å; V452-F456 PolarHBondContact O-N 3.48Å; I453-F456 PolarHBondContact O-N 2.84Å; F456-A459 CarbonylContact O-C 3.42Å; F456-A459 PolarHBondContact O-N 3.49Å; F456-I460 WeakPolarHBondContact O-CB 3.12Å; F456-I460 WeakPolarHBondContact O-CD1 3.23Å; F456-I460 WeakPolarHBondContact O-CG1 3.14Å; F456-I460 PolarHBondContact O-N 3.18Å
457	L	93.2	Very high	87.8	Confident	86 Å²	86	87.3 Å²	87.3	45%	0.45	48%	0.478	S	S	.	.	H	α-helix	trans	-65.6	-42.1	176.2	-74.9	171.9	0	0	0	111.8	I453 L454 A459 I460 I461	I453-L457 HydrophobicContact CG2-CD1 3.86Å; I453-L457 HydrophobicContact CG2-CG 4.29Å; I453-L457 WeakPolarHBondContact O-CB 3.37Å; I453-L457 VanDerWaalsContact O-CG 3.28Å; I453-L457 WeakPolarHBondContact O-CG 3.45Å; I453-L457 PolarHBondContact O-N 3.38Å; L454-L457 PolarHBondContact O-N 2.98Å; L457-A459 VanDerWaalsContact C-N 3.35Å; L457-I460 PolarHBondContact O-N 3.39Å; L457-I461 WeakPolarHBondContact O-CB 3.38Å; L457-I461 WeakPolarHBondContact O-CD1 3.45Å; L457-I461 VanDerWaalsContact O-CG1 3.23Å; L457-I461 WeakPolarHBondContact O-CG1 3.29Å; L457-I461 PolarHBondContact O-N 3.13Å
458	V	92.8	Very high	88.4	Confident	88 Å²	88	86 Å²	86	53%	0.533	48%	0.48	S	S	.	.	H	α-helix	trans	-63.9	-40.2	173.3	169.6	0	0	0	0	110.8	L454 T455 I461 A462	L454-V458 WeakPolarHBondContact O-CB 3.45Å; L454-V458 VanDerWaalsContact O-CG2 3.3Å; L454-V458 WeakPolarHBondContact O-CG2 3.45Å; L454-V458 PolarHBondContact O-N 3.5Å; T455-V458 PolarHBondContact O-N 3.49Å; V458-I461 PolarHBondContact O-N 3.2Å; V458-A462 WeakPolarHBondContact O-CB 3.38Å; V458-A462 PolarHBondContact O-N 3.05Å
459	A	91.3	Very high	88.8	Confident	47 Å²	47	87.1 Å²	87.1	39%	0.388	49%	0.491	S	S	.	.	H	α-helix	trans	-67.5	-36.1	174.3	0	0	0	0	0	112.5	T455 F456 L457 T463	T455-A459 VanDerWaalsContact O-CB 3.25Å; T455-A459 WeakPolarHBondContact O-CB 3.25Å; T455-A459 PolarHBondContact O-N 3.26Å; F456-A459 CarbonylContact O-C 3.42Å; F456-A459 PolarHBondContact O-N 3.49Å; L457-A459 VanDerWaalsContact C-N 3.35Å; A459-T463 VanDerWaalsContact O-CB 3.31Å; A459-T463 WeakPolarHBondContact O-CB 3.44Å; A459-T463 VanDerWaalsContact O-CG2 3.29Å; A459-T463 WeakPolarHBondContact O-CG2 3.24Å; A459-T463 PolarHBondContact O-N 3.18Å; A459-T463 PolarHBondContact O-OG1 3.02Å
460	I	92.7	Very high	89.1	Confident	83 Å²	83	88.6 Å²	88.6	43%	0.426	49%	0.492	S	S	.	.	H	α-helix	trans	-68.4	-44.8	174.3	-73.2	162.9	0	0	0	110.1	F456 L457 T463 I464	F456-I460 WeakPolarHBondContact O-CB 3.12Å; F456-I460 WeakPolarHBondContact O-CD1 3.23Å; F456-I460 WeakPolarHBondContact O-CG1 3.14Å; F456-I460 PolarHBondContact O-N 3.18Å; L457-I460 PolarHBondContact O-N 3.39Å; I460-T463 WeakPolarHBondContact CA-OG1 3.23Å; I460-T463 PolarHBondContact O-N 3.2Å; I460-T463 PolarHBondContact O-OG1 3.02Å; I460-I464 HydrophobicContact CG2-CD1 3.65Å; I460-I464 HydrophobicContact CG2-CG1 4.38Å; I460-I464 VanDerWaalsContact O-CB 3.28Å; I460-I464 WeakPolarHBondContact O-CB 3.41Å; I460-I464 WeakPolarHBondContact O-CG1 3.31Å; I460-I464 PolarHBondContact O-N 2.86Å
461	I	92.4	Very high	89	Confident	114 Å²	114	89.3 Å²	89.3	59%	0.585	50%	0.496	S	S	*	.	H	α-helix	trans	-64.2	-42.9	175.4	-68.8	163.1	0	0	0	110.5	L457 V458 I464 A465	L457-I461 WeakPolarHBondContact O-CB 3.38Å; L457-I461 WeakPolarHBondContact O-CD1 3.45Å; L457-I461 VanDerWaalsContact O-CG1 3.23Å; L457-I461 WeakPolarHBondContact O-CG1 3.29Å; L457-I461 PolarHBondContact O-N 3.13Å; V458-I461 PolarHBondContact O-N 3.2Å; I461-I464 PolarHBondContact O-N 2.63Å; I461-A465 WeakPolarHBondContact O-CB 3.43Å; I461-A465 PolarHBondContact O-N 2.6Å
462	A	92	Very high	88.8	Confident	56 Å²	56	91 Å²	91	46%	0.463	50%	0.502	S	S	.	.	H	α-helix	trans	-67.2	-39.1	177.2	0	0	0	0	0	112.5	V458 F466	V458-A462 WeakPolarHBondContact O-CB 3.38Å; V458-A462 PolarHBondContact O-N 3.05Å; A462-F466 VanDerWaalsContact O-CB 3.25Å; A462-F466 WeakPolarHBondContact O-CB 3.31Å; A462-F466 PolarHBondContact O-N 3.03Å
463	T	92.5	Very high	88.3	Confident	77 Å²	77	93.7 Å²	93.7	47%	0.472	51%	0.508	S	S	.	.	H	α-helix	trans	-74.1	-35.7	175.6	50.7	0	0	0	0	112.2	A459 I460 F466 I467	A459-T463 VanDerWaalsContact O-CB 3.31Å; A459-T463 WeakPolarHBondContact O-CB 3.44Å; A459-T463 VanDerWaalsContact O-CG2 3.29Å; A459-T463 WeakPolarHBondContact O-CG2 3.24Å; A459-T463 PolarHBondContact O-N 3.18Å; A459-T463 PolarHBondContact O-OG1 3.02Å; I460-T463 WeakPolarHBondContact CA-OG1 3.23Å; I460-T463 PolarHBondContact O-N 3.2Å; I460-T463 PolarHBondContact O-OG1 3.02Å; T463-F466 PolarHBondContact O-N 2.87Å; T463-I467 WeakPolarHBondContact O-CB 3.47Å; T463-I467 WeakPolarHBondContact O-CD1 3.4Å; T463-I467 WeakPolarHBondContact O-CG1 3.37Å; T463-I467 PolarHBondContact O-N 3.44Å
464	I	91.9	Very high	87.3	Confident	94 Å²	94	95.4 Å²	95.4	48%	0.482	51%	0.509	S	S	.	.	H	α-helix	trans	-62.9	-46.4	169.3	-71.4	168.2	0	0	0	109.9	I460 I461 F466 I467 C468	I460-I464 HydrophobicContact CG2-CD1 3.65Å; I460-I464 HydrophobicContact CG2-CG1 4.38Å; I460-I464 VanDerWaalsContact O-CB 3.28Å; I460-I464 WeakPolarHBondContact O-CB 3.41Å; I460-I464 WeakPolarHBondContact O-CG1 3.31Å; I460-I464 PolarHBondContact O-N 2.86Å; I461-I464 PolarHBondContact O-N 2.63Å; I464-F466 PolarHBondContact O-N 3.33Å; I464-I467 CarbonylContact O-C 3.51Å; I464-I467 PolarHBondContact O-N 3.26Å; I464-C468 WeakPolarHBondContact O-CB 3.49Å; I464-C468 PolarHBondContact O-N 3.49Å; I464-C468 PolarHBondContact O-SG 3.24Å
465	A	90.2	Very high	86.1	Confident	47 Å²	47	99.2 Å²	99.2	39%	0.388	52%	0.521	S	S	.	.	H	α-helix	trans	-61.2	-43	175.7	0	0	0	0	0	111.5	I461 C468 C469	I461-A465 WeakPolarHBondContact O-CB 3.43Å; I461-A465 PolarHBondContact O-N 2.6Å; A465-C468 PolarHBondContact O-N 3.37Å; A465-C469 WeakPolarHBondContact O-CB 3.3Å; A465-C469 PolarHBondContact O-N 3.46Å; A465-C469 PolarHBondContact O-SG 3.33Å
466	F	90.4	Very high	84.6	Confident	153 Å²	153	101.1 Å²	101.1	67%	0.671	53%	0.527	S	S	*	.	H	α-helix	trans	-67.4	-36.5	175.8	-159.9	-85.3	0	0	0	112	A462 T463 I464 F470	A462-F466 VanDerWaalsContact O-CB 3.25Å; A462-F466 WeakPolarHBondContact O-CB 3.31Å; A462-F466 PolarHBondContact O-N 3.03Å; T463-F466 PolarHBondContact O-N 2.87Å; I464-F466 PolarHBondContact O-N 3.33Å; F466-F470 HydrophobicContact CE1-CD2 4.49Å; F466-F470 WeakPolarHBondContact O-CA 3.39Å; F466-F470 WeakPolarHBondContact O-CB 3.37Å; F466-F470 PolarHBondContact O-N 3.07Å
467	I	89.1	Confident	83	Confident	94 Å²	94	95.7 Å²	95.7	48%	0.482	51%	0.507	S	S	.	.	H	α-helix	trans	-68.2	-39.4	173.2	-74	163.7	0	0	0	110.4	T463 I464 F470 I471	T463-I467 WeakPolarHBondContact O-CB 3.47Å; T463-I467 WeakPolarHBondContact O-CD1 3.4Å; T463-I467 WeakPolarHBondContact O-CG1 3.37Å; T463-I467 PolarHBondContact O-N 3.44Å; I464-I467 CarbonylContact O-C 3.51Å; I464-I467 PolarHBondContact O-N 3.26Å; I467-F470 CarbonylContact O-C 3.52Å; I467-F470 PolarHBondContact O-N 2.8Å; I467-I471 HydrophobicContact CG2-CD1 3.63Å; I467-I471 HydrophobicContact CG2-CG1 4.25Å; I467-I471 VanDerWaalsContact O-CB 3.23Å; I467-I471 WeakPolarHBondContact O-CB 3.29Å; I467-I471 WeakPolarHBondContact O-CG1 3.49Å; I467-I471 PolarHBondContact O-N 3.22Å
468	C	87.1	Confident	81.1	Confident	68 Å²	68	95.2 Å²	95.2	46%	0.459	52%	0.515	S	S	.	.	H	α-helix	trans	-66.3	-45.5	173.5	-71.2	0	0	0	0	111.1	I464 A465 F470 I471 M472	I464-C468 WeakPolarHBondContact O-CB 3.49Å; I464-C468 PolarHBondContact O-N 3.49Å; I464-C468 PolarHBondContact O-SG 3.24Å; A465-C468 PolarHBondContact O-N 3.37Å; C468-F470 VanDerWaalsContact C-N 3.32Å; C468-F470 PolarHBondContact O-N 3.04Å; C468-I471 PolarHBondContact O-N 3.41Å; C468-M472 WeakPolarHBondContact O-CB 3.16Å; C468-M472 VanDerWaalsContact O-CG 3.26Å; C468-M472 WeakPolarHBondContact O-CG 3.32Å; C468-M472 PolarHBondContact O-N 2.69Å
469	C	85.9	Confident	79	Confident	87 Å²	87	99 Å²	99	59%	0.588	53%	0.527	S	S	*	.	H	α-helix	trans	-62.8	-36.7	173.1	-71.2	0	0	0	0	112.1	A465 F473	A465-C469 WeakPolarHBondContact O-CB 3.3Å; A465-C469 PolarHBondContact O-N 3.46Å; A465-C469 PolarHBondContact O-SG 3.33Å; C469-F473 WeakPolarHBondContact O-CB 3.44Å; C469-F473 PolarHBondContact O-N 3.49Å
470	F	84.1	Confident	76.8	Confident	99 Å²	99	106.3 Å²	106.3	43%	0.434	54%	0.544	S	S	.	.	H	α-helix	trans	-77.9	-31.7	177.4	-168.8	-93.9	0	0	0	112	F466 I467 C468 R474	F466-F470 HydrophobicContact CE1-CD2 4.49Å; F466-F470 WeakPolarHBondContact O-CA 3.39Å; F466-F470 WeakPolarHBondContact O-CB 3.37Å; F466-F470 PolarHBondContact O-N 3.07Å; I467-F470 CarbonylContact O-C 3.52Å; I467-F470 PolarHBondContact O-N 2.8Å; C468-F470 VanDerWaalsContact C-N 3.32Å; C468-F470 PolarHBondContact O-N 3.04Å; F470-R474 HydrophobicContact CD1-CG 3.73Å; F470-R474 HydrophobicContact CE1-CG 3.65Å; F470-R474 HydrophobicContact CG-CG 4.32Å; F470-R474 HydrophobicContact CZ-CG 4.18Å; F470-R474 VanDerWaalsContact CZ-NE 3.27Å; F470-R474 WeakPolarHBondContact O-CA 3.32Å; F470-R474 WeakPolarHBondContact O-CB 3.4Å; F470-R474 WeakPolarHBondContact O-CG 3.36Å; F470-R474 PolarHBondContact O-N 2.89Å
471	I	82.1	Confident	74.2	Confident	102 Å²	102	109.6 Å²	109.6	52%	0.523	56%	0.562	S	S	.	*	H	α-helix	trans	-68.4	-45.4	170.2	-75.1	168.8	0	0	0	109.3	I467 C468 R474 F475	I467-I471 HydrophobicContact CG2-CD1 3.63Å; I467-I471 HydrophobicContact CG2-CG1 4.25Å; I467-I471 VanDerWaalsContact O-CB 3.23Å; I467-I471 WeakPolarHBondContact O-CB 3.29Å; I467-I471 WeakPolarHBondContact O-CG1 3.49Å; I467-I471 PolarHBondContact O-N 3.22Å; C468-I471 PolarHBondContact O-N 3.41Å; I471-R474 CarbonylContact O-C 3.49Å; I471-R474 PolarHBondContact O-N 3.02Å; I471-F475 WeakPolarHBondContact O-CB 3.04Å; I471-F475 PolarHBondContact O-N 3.49Å
472	M	76.8	Confident	71.5	Confident	124 Å²	124	109.7 Å²	109.7	61%	0.611	57%	0.571	S	S	*	*	H	α-helix	trans	-61.2	-48.8	173.2	-73.1	-66.2	-72.5	0	0	111.2	C468 R474 F475 L476	C468-M472 WeakPolarHBondContact O-CB 3.16Å; C468-M472 VanDerWaalsContact O-CG 3.26Å; C468-M472 WeakPolarHBondContact O-CG 3.32Å; C468-M472 PolarHBondContact O-N 2.69Å; M472-R474 VanDerWaalsContact C-N 3.29Å; M472-R474 PolarHBondContact O-N 3.31Å; M472-F475 WeakPolarHBondContact O-CB 3.49Å; M472-F475 PolarHBondContact O-N 2.89Å; M472-F475 VanDerWaalsContact O-N 3.08Å; M472-L476 VanDerWaalsContact O-CG 3.31Å; M472-L476 WeakPolarHBondContact O-CG 3.38Å; M472-L476 PolarHBondContact O-N 3.41Å
473	F	73.9	Confident	68.9	Low	133 Å²	133	116.9 Å²	116.9	58%	0.583	59%	0.586	S	S	*	*	H	α-helix	trans	-63.6	-33.4	176.3	-171.4	-93.3	0	0	0	111.9	C469 L476 S477	C469-F473 WeakPolarHBondContact O-CB 3.44Å; C469-F473 PolarHBondContact O-N 3.49Å; F473-L476 CarbonylContact O-C 3.53Å; F473-L476 PolarHBondContact O-N 3.01Å; F473-S477 WeakPolarHBondContact CD1-OG 3.44Å; F473-S477 WeakPolarHBondContact O-CA 3.34Å; F473-S477 WeakPolarHBondContact O-CB 3.43Å; F473-S477 PolarHBondContact O-N 2.85Å; F473-S477 PolarHBondContact O-OG 3.28Å
474	R	67.2	Low	66.4	Low	128 Å²	128	122.4 Å²	122.4	48%	0.483	60%	0.599	S	S	.	*	H	α-helix	trans	-80	-19.8	172.3	-69.5	-74.2	179.9	164.9	-2.7	112.9	F470 I471 M472 L476 A478	F470-R474 HydrophobicContact CD1-CG 3.73Å; F470-R474 HydrophobicContact CE1-CG 3.65Å; F470-R474 HydrophobicContact CG-CG 4.32Å; F470-R474 HydrophobicContact CZ-CG 4.18Å; F470-R474 VanDerWaalsContact CZ-NE 3.27Å; F470-R474 WeakPolarHBondContact O-CA 3.32Å; F470-R474 WeakPolarHBondContact O-CB 3.4Å; F470-R474 WeakPolarHBondContact O-CG 3.36Å; F470-R474 PolarHBondContact O-N 2.89Å; I471-R474 CarbonylContact O-C 3.49Å; I471-R474 PolarHBondContact O-N 3.02Å; M472-R474 VanDerWaalsContact C-N 3.29Å; M472-R474 PolarHBondContact O-N 3.31Å; R474-L476 VanDerWaalsContact C-N 3.34Å; R474-A478 WeakPolarHBondContact O-CA 3.2Å; R474-A478 WeakPolarHBondContact O-CB 3.1Å; R474-A478 PolarHBondContact O-N 2.9Å
475	F	63.3	Low	63.7	Low	178 Å²	178	128.1 Å²	128.1	78%	0.781	61%	0.614	S	S	*	*	H	α-helix	trans	-70.8	-38.9	166.4	-142.3	-101	0	0	0	109.4	I471 M472	I471-F475 WeakPolarHBondContact O-CB 3.04Å; I471-F475 PolarHBondContact O-N 3.49Å; M472-F475 WeakPolarHBondContact O-CB 3.49Å; M472-F475 PolarHBondContact O-N 2.89Å; M472-F475 VanDerWaalsContact O-N 3.08Å
476	L	56.3	Low	61.1	Low	129 Å²	129	135.8 Å²	135.8	68%	0.675	63%	0.633	S	S	*	*	H	α-helix	trans	-75.2	-24.2	173.8	-63.6	167.5	0	0	0	113.9	M472 F473 R474	M472-L476 VanDerWaalsContact O-CG 3.31Å; M472-L476 WeakPolarHBondContact O-CG 3.38Å; M472-L476 PolarHBondContact O-N 3.41Å; F473-L476 CarbonylContact O-C 3.53Å; F473-L476 PolarHBondContact O-N 3.01Å; R474-L476 VanDerWaalsContact C-N 3.34Å
477	S	57.6	Low	58.5	Low	23 Å²	23	136.7 Å²	136.7	16%	0.161	64%	0.641	C	S	.	*	H	α-helix	trans	-121.1	-6.4	-174.9	68	0	0	0	0	116.2	F473 Q479 R480	F473-S477 WeakPolarHBondContact CD1-OG 3.44Å; F473-S477 WeakPolarHBondContact O-CA 3.34Å; F473-S477 WeakPolarHBondContact O-CB 3.43Å; F473-S477 PolarHBondContact O-N 2.85Å; F473-S477 PolarHBondContact O-OG 3.28Å; S477-Q479 PolarHBondContact O-N 2.86Å; S477-R480 WeakPolarHBondContact O-CA 3.43Å; S477-R480 VanDerWaalsContact O-CB 3.31Å; S477-R480 WeakPolarHBondContact O-CB 3.41Å; S477-R480 PolarHBondContact O-N 3.32Å
478	A	52.8	Low	55.8	Low	75 Å²	75	141.6 Å²	141.6	62%	0.62	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	0.2	167	0	0	0	0	0	112.9	R474 R480	R474-A478 WeakPolarHBondContact O-CA 3.2Å; R474-A478 WeakPolarHBondContact O-CB 3.1Å; R474-A478 PolarHBondContact O-N 2.9Å; A478-R480 PolarHBondContact O-N 3.21Å
479	Q	49.3	Very low	53.6	Low	168 Å²	168	143 Å²	143	79%	0.785	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-13.4	147.9	-71.1	-166.2	-13.5	0	0	112.4	S477	S477-Q479 PolarHBondContact O-N 2.86Å
480	R	45.9	Very low	51.1	Low	200 Å²	200	147.5 Å²	147.5	76%	0.755	68%	0.68	S	S	*	*	S	Bend	trans	-122.8	79.7	-179.6	-54.1	-175.4	-173.6	178	2.7	111.8	S477 A478	S477-R480 WeakPolarHBondContact O-CA 3.43Å; S477-R480 VanDerWaalsContact O-CB 3.31Å; S477-R480 WeakPolarHBondContact O-CB 3.41Å; S477-R480 PolarHBondContact O-N 3.32Å; A478-R480 PolarHBondContact O-N 3.21Å
481	L	38.2	Very low	49	Very low	153 Å²	153	147.8 Å²	147.8	80%	0.801	69%	0.692	S	S	*	*			trans	49.1	107.5	150.6	-76.5	72.3	0	0	0	119.4
482	C	34	Very low	46.7	Very low	115 Å²	115	152.1 Å²	152.1	78%	0.777	71%	0.709	S	S	*	*				7.3	125.9	120.5	-58	0	0	0	0	119
483	R	38.4	Very low	44.4	Very low	207 Å²	207	152.5 Å²	152.5	78%	0.781	72%	0.718	S	S	*	*				177.5	128.4	110.7	-95.8	163.8	-177.5	-162.4	2.1	114.8
484	R	40	Very low	42.4	Very low	193 Å²	193	154.7 Å²	154.7	73%	0.728	73%	0.731	S	S	*	*			trans	68	118	140.2	-63.9	174.6	-179.1	-169.6	-1.9	118
485	R	35.5	Very low	40.5	Very low	214 Å²	214	154.1 Å²	154.1	81%	0.808	75%	0.745	S	S	*	*				73.6	139.2	79.8	-73.4	-179.8	-176.2	-170.6	1	112.9
486	R	34.9	Very low	39.1	Very low	208 Å²	208	154.7 Å²	154.7	79%	0.785	75%	0.75	S	S	*	*			cis	-171.5	173.6	-2.5	-125.5	-175.2	-177.5	-173.3	-0.3	110.6
487	M	36.5	Very low	38	Very low	172 Å²	172	157.3 Å²	157.3	85%	0.847	76%	0.758	S	S	*	*			trans	100.8	162.1	156.3	-52.3	-142.9	172.9	0	0	121.2
488	K	31.9	Very low	36.7	Very low	197 Å²	197	160.5 Å²	160.5	86%	0.857	79%	0.786	S	S	*	*			trans	-169.8	-174.8	-160.8	-99.7	-166.9	175.6	-170	0	107.4
489	P	40.9	Very low	35.8	Very low	99 Å²	99	162.5 Å²	162.5	64%	0.643	79%	0.791	S	S	*	*			cis	-140.5	175.1	-49.6	41.9	-25.2	0	0	0	115.5
490	H	34.4	Very low	35	Very low	180 Å²	180	160.2 Å²	160.2	83%	0.833	79%	0.788	S	S	*	*			trans	59.8	177.4	148.1	-93.6	-51.9	0	0	0	120.9
491	P	38.7	Very low	34.4	Very low	106 Å²	106	157.8 Å²	157.8	69%	0.688	79%	0.79	S	S	*	*			cis	-134.2	-167.8	-21.5	31.2	-8.6	0	0	0	115.1
492	Q	34.7	Very low	34	Very low	192 Å²	192	155.1 Å²	155.1	90%	0.897	78%	0.784	S	S	*	*			trans	124.6	169.4	149.2	-64.9	-140.2	-57.2	0	0	118.3
493	V	29	Very low	33.8	Very low	132 Å²	132	155 Å²	155	80%	0.8	78%	0.784	S	S	*	*			trans	-138.6	147.4	-148.9	172.3	0	0	0	0	110.6
494	Q	31.1	Very low	33.5	Very low	180 Å²	180	152.9 Å²	152.9	84%	0.841	79%	0.788	S	S	*	*			trans	-156.1	152.5	159.2	-123	165.6	-18.3	0	0	112.2
495	C	27.6	Very low	32.9	Very low	115 Å²	115	147.1 Å²	147.1	78%	0.777	79%	0.789	S	S	*	*			trans	-142.3	147	174.4	-65	0	0	0	0	108.8
496	E	33.5	Very low	32.7	Very low	191 Å²	191	147.4 Å²	147.4	89%	0.893	80%	0.796	S	S	*	*			trans	-137.7	174.7	176.5	-88.5	-177.2	119.8	0	0	112.4
497	H	33.3	Very low	32.3	Very low	184 Å²	184	141.8 Å²	141.8	85%	0.852	79%	0.794	S	S	*	*			trans	-122.9	155.1	-145	-97.1	-105.9	0	0	0	116.8
498	A	30.7	Very low	31.9	Very low	89 Å²	89	139.2 Å²	139.2	74%	0.736	79%	0.79	S	S	*	*			trans	67.7	171.8	149.9	0	0	0	0	0	117.4
499	T	32.8	Very low	31.7	Very low	117 Å²	117	136.8 Å²	136.8	72%	0.718	79%	0.792	S	S	*	*			cis	-143.7	133.1	15.2	49.1	0	0	0	0	115.3
500	T	32.3	Very low	31.1	Very low	121 Å²	121	139 Å²	139	74%	0.742	79%	0.794	S	S	*	*				49.8	168.1	129	74.1	0	0	0	0	125.8
501	D	33.4	Very low	30.9	Very low	148 Å²	148	138.6 Å²	138.6	79%	0.791	79%	0.79	S	S	*	*			trans	94.8	144.3	161.3	-64.1	25.7	0	0	0	118.5
502	S	30.4	Very low	30.6	Very low	97 Å²	97	139 Å²	139	68%	0.678	79%	0.785	S	S	*	*			cis	-174.1	152.3	-27.1	-173.4	0	0	0	0	110
503	C	30.8	Very low	31	Very low	114 Å²	114	130.7 Å²	130.7	77%	0.77	75%	0.747	S	S	*	*			trans	159.8	105.8	139.2	-89.4	0	0	0	0	117.1
504	N	31	Very low	31.8	Very low	161 Å²	161	128.2 Å²	128.2	86%	0.861	73%	0.725	S	S	*	*			trans	28.4	138.4	134.2	-54.5	-15.6	0	0	0	123.8
505	G	28.6	Very low	32.7	Very low	72 Å²	72	119.9 Å²	119.9	74%	0.742	69%	0.687	S	S	*	*			trans	-174.7	67.8	164.3	0	0	0	0	0	119.8
506	F	29.3	Very low	33.6	Very low	221 Å²	221	115.5 Å²	115.5	97%	0.969	66%	0.655	S	S	*	*			trans	56.2	155.2	159.1	-84.8	-92.1	0	0	0	121.9
507	A	27	Very low	34.1	Very low	90 Å²	90	114.1 Å²	114.1	74%	0.744	64%	0.642	S	S	*	*			trans	-154	147.6	174.3	0	0	0	0	0	112.6
508	P	28.8	Very low	34.8	Very low	117 Å²	117	111.2 Å²	111.2	76%	0.76	63%	0.633	S	S	*	*			trans	-99.5	151	160.1	36.2	-29.4	0	0	0	111.6
509	T	26.9	Very low	35.4	Very low	147 Å²	147	108.3 Å²	108.3	90%	0.902	61%	0.611	S	S	*	*			trans	-81.9	127.7	-179.6	46	0	0	0	0	112.5
510	Q	28.9	Very low	35.5	Very low	146 Å²	146	109.2 Å²	109.2	68%	0.682	61%	0.607	S	S	*	*			trans	-119.6	155	169.7	-70.4	-177.7	-20.7	0	0	110.4
511	K	30.9	Very low	35.6	Very low	170 Å²	170	106.3 Å²	106.3	74%	0.739	58%	0.583	S	S	*	*			trans	-71.7	130.9	179.5	-75.3	-178	175.5	-179.6	0	110.1
512	L	31.9	Very low	35.5	Very low	114 Å²	114	106.2 Å²	106.2	60%	0.597	58%	0.58	S	S	*	*			trans	-88.9	114.1	172.8	-141	79	0	0	0	109.8	G369	G369-L512 WeakPolarHBondContact O-CD1 3.48Å
513	I	43.2	Very low	35.8	Very low	18 Å²	18	106 Å²	106	9%	0.092	58%	0.578	C	S	.	*			trans	-78.7	144.1	161.8	-73	173.8	0	0	0	108.2	E349 F351 Q371 I515 Y521	E349-I513 HydrophobicContact CB-CD1 4.13Å; E349-I513 HydrophobicContact CG-CD1 4.4Å; E349-I513 WeakPolarHBondContact OE2-CD1 3.17Å; F351-I513 HydrophobicContact CD2-CB 4.39Å; Q371-I513 HydrophobicContact CB-CD1 4.07Å; Q371-I513 HydrophobicContact CG-CD1 3.9Å; I513-I515 HydrophobicContact CG2-CG1 4.26Å; I513-Y521 HydrophobicContact CG2-CE2 3.57Å; I513-Y521 WeakPolarHBondContact CG2-OH 3.47Å
514	K	46	Very low	35.9	Very low	80 Å²	80	108.2 Å²	108.2	35%	0.348	58%	0.582	S	S	.	*			trans	-118.1	128.1	176.5	-72.9	-162.7	170.4	-135.6	0	110.4	D362 Y366	D362-K514 IonicContact OD2-NZ 2.7Å; D362-K514 PolarHBondContact OD2-NZ 2.99Å; D362-K514 VanDerWaalsContact OD2-NZ 3.14Å; Y366-K514 HydrophobicContact CD1-CB 3.69Å; Y366-K514 HydrophobicContact CD1-CD 4.1Å; Y366-K514 HydrophobicContact CD1-CG 4.33Å; Y366-K514 HydrophobicContact CD2-CD 4.05Å; Y366-K514 HydrophobicContact CE1-CB 4Å; Y366-K514 HydrophobicContact CE1-CD 4.28Å; Y366-K514 HydrophobicContact CE2-CD 4.28Å; Y366-K514 HydrophobicContact CG-CB 4.28Å; Y366-K514 HydrophobicContact CG-CD 3.98Å; Y366-K514 HydrophobicContact CG-CG 4.44Å
515	I	50.2	Low	35.8	Very low	6 Å²	6	103.8 Å²	103.8	3%	0.031	58%	0.575	C	S	.	*	B	Isolated β-bridge	trans	-118.8	115.7	176.2	-53.1	173.4	0	0	0	106.9	F351 Y366 W367 T406 V408 Y417 I513	F351-I515 HydrophobicContact CB-CD1 4.27Å; F351-I515 HydrophobicContact CD1-CD1 3.98Å; F351-I515 HydrophobicContact CD2-CD1 4.49Å; F351-I515 HydrophobicContact CE1-CD1 4.41Å; F351-I515 HydrophobicContact CG-CD1 4.01Å; Y366-I515 WeakPolarHBondContact CA-O 3.36Å; W367-I515 PolarHBondContact N-O 3.34Å; T406-I515 HydrophobicContact CG2-CD1 4.37Å; V408-I515 HydrophobicContact CG2-CD1 3.66Å; V408-I515 HydrophobicContact CG2-CG1 4.46Å; Y417-I515 HydrophobicContact CE2-CG2 4.44Å; I513-I515 HydrophobicContact CG2-CG1 4.26Å
516	N	44.9	Very low	35.7	Very low	22 Å²	22	105.7 Å²	105.7	12%	0.118	58%	0.577	C	S	.	*	B	Isolated β-bridge	trans	-78.7	151	172.3	-176.3	21.9	0	0	0	110.1	Y366 D518 G519	Y366-N516 HydrophobicContact CD1-CB 4.18Å; Y366-N516 HydrophobicContact CE1-CB 3.85Å; N516-D518 PolarHBondContact ND2-OD2 3.25Å; N516-D518 PolarHBondContact O-N 3.24Å; N516-G519 PolarHBondContact O-N 3.37Å
517	R	45.7	Very low	35.6	Very low	162 Å²	162	103.8 Å²	103.8	61%	0.611	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.6	-36.3	171.6	-172	175.4	-178.3	175.9	-1.3	113.4	D365 G519	D365-R517 HydrophobicContact CB-CB 4.25Å; D365-R517 WeakPolarHBondContact OD2-CD 3.42Å; D365-R517 IonicContact OD2-CZ 3.51Å; D365-R517 IonicContact OD2-NE 2.81Å; D365-R517 IonicContact OD2-NH1 3.49Å; D365-R517 PolarHBondContact OD2-NH1 2.82Å; R517-G519 PolarHBondContact O-N 2.96Å
518	D	47.3	Very low	35.7	Very low	124 Å²	124	104 Å²	104	66%	0.663	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	5.2	178	-44.9	-55.5	0	0	0	113.7	N516 Q520	N516-D518 PolarHBondContact ND2-OD2 3.25Å; N516-D518 PolarHBondContact O-N 3.24Å; D518-Q520 PolarHBondContact O-N 2.84Å
519	G	42.5	Very low	35.8	Very low	27 Å²	27	104.3 Å²	104.3	28%	0.278	58%	0.58	S	S	.	*			trans	73.6	4.2	175.6	0	0	0	0	0	116.3	Y417 N516 R517	Y417-G519 VanDerWaalsContact OH-CA 3.24Å; Y417-G519 WeakPolarHBondContact OH-CA 3.27Å; N516-G519 PolarHBondContact O-N 3.37Å; R517-G519 PolarHBondContact O-N 2.96Å
520	Q	34.6	Very low	35.9	Very low	136 Å²	136	105 Å²	105	64%	0.636	58%	0.577	S	S	*	*			trans	-69.9	128.7	170.1	-65.4	-169.4	1.4	0	0	110.9	D518	D518-Q520 PolarHBondContact O-N 2.84Å
521	Y	35.1	Very low	35.9	Very low	61 Å²	61	105.6 Å²	105.6	24%	0.239	58%	0.583	C	S	.	*	B	Isolated β-bridge	trans	-108.3	125.9	179.1	-162.9	-110.9	0	0	0	110	E349 V408 V415 I513	E349-Y521 PolarHBondContact OE2-OH 3.44Å; V408-Y521 HydrophobicContact CG1-CD2 4.45Å; V408-Y521 HydrophobicContact CG1-CE2 3.97Å; V415-Y521 HydrophobicContact CG1-CG 4.36Å; V415-Y521 HydrophobicContact CG2-CD1 4.02Å; V415-Y521 HydrophobicContact CG2-CG 4.28Å; I513-Y521 HydrophobicContact CG2-CE2 3.57Å; I513-Y521 WeakPolarHBondContact CG2-OH 3.47Å
522	M	31.4	Very low	35.6	Very low	146 Å²	146	102.7 Å²	102.7	72%	0.719	58%	0.584	S	S	*	*			trans	-114.1	101.5	171.9	-74.3	-163.6	174.2	0	0	110.2	N524	M522-N524 PolarHBondContact O-N 3.26Å
523	S	35.8	Very low	35.5	Very low	91 Å²	91	104.9 Å²	104.9	64%	0.636	60%	0.595	S	S	*	*			trans	-75	114.7	173.1	52.1	0	0	0	0	110.5	G525	S523-G525 PolarHBondContact O-N 2.8Å
524	N	34.3	Very low	34.7	Very low	161 Å²	161	110 Å²	110	86%	0.861	63%	0.627	S	S	*	*			trans	-63.4	109.4	163.6	-79.6	-42.8	0	0	0	108	M522	M522-N524 PolarHBondContact O-N 3.26Å
525	G	28.8	Very low	34	Very low	69 Å²	69	112.1 Å²	112.1	71%	0.711	65%	0.649	S	S	*	*			trans	-68.6	139.9	-148.5	0	0	0	0	0	116.7	S523	S523-G525 PolarHBondContact O-N 2.8Å
526	S	26.6	Very low	33.2	Very low	111 Å²	111	115.9 Å²	115.9	78%	0.776	68%	0.681	S	S	*	*			trans	-160.4	88.1	152.3	-166.6	0	0	0	0	111.3
527	L	27.6	Very low	32.9	Very low	181 Å²	181	121.5 Å²	121.5	95%	0.948	71%	0.711	S	S	*	*			trans	-178	133.9	147.4	-100	167.3	0	0	0	108.2
528	A	28.1	Very low	32.5	Very low	95 Å²	95	119.5 Å²	119.5	79%	0.785	72%	0.716	S	S	*	*			trans	-114.5	156.7	-170.9	0	0	0	0	0	112.5
529	P	30.8	Very low	32	Very low	124 Å²	124	118.9 Å²	118.9	81%	0.805	72%	0.719	S	S	*	*			trans	-98.8	159.9	-160.1	38	-37.1	0	0	0	116
530	L	29.3	Very low	31.6	Very low	162 Å²	162	122.1 Å²	122.1	85%	0.848	74%	0.743	S	S	*	*			trans	-149.2	131.1	168.1	-77.7	176.4	0	0	0	106.8
531	I	28.1	Very low	31.7	Very low	157 Å²	157	124.1 Å²	124.1	81%	0.805	75%	0.753	S	S	*	*			cis	-142	151.6	3.5	-85.1	148.6	0	0	0	108.3
532	S	26	Very low	31.6	Very low	109 Å²	109	127.9 Å²	127.9	76%	0.762	77%	0.772	S	S	*	*			trans	-118.6	169.5	168.8	-166.4	0	0	0	0	112.2
533	I	28.5	Very low	31.8	Very low	160 Å²	160	130.2 Å²	130.2	82%	0.821	77%	0.773	S	S	*	*			trans	-89.2	150.9	-163.5	-62.3	166	0	0	0	112.1
534	V	27.4	Very low	31.9	Very low	127 Å²	127	130.2 Å²	130.2	77%	0.77	77%	0.773	S	S	*	*			trans	-97.9	131.4	179.4	176.6	0	0	0	0	111.3
535	P	30.9	Very low	32	Very low	123 Å²	123	130.7 Å²	130.7	80%	0.799	78%	0.776	S	S	*	*				-134.4	161.2	123.6	32.2	-18.4	0	0	0	113.7
536	A	34.3	Very low	32.5	Very low	85 Å²	85	130.8 Å²	130.8	70%	0.702	78%	0.776	S	S	*	*			trans	-133.8	157.5	174.9	0	0	0	0	0	108
537	N	37.7	Very low	33.2	Very low	141 Å²	141	134.1 Å²	134.1	75%	0.754	78%	0.777	S	S	*	*			cis	-154.7	141.3	22.7	-120.3	0.2	0	0	0	107.8
538	V	37	Very low	33.9	Very low	120 Å²	120	130.2 Å²	130.2	73%	0.727	76%	0.757	S	S	*	*				73.5	137.1	83.6	160.8	0	0	0	0	115
539	P	37.3	Very low	34.8	Very low	110 Å²	110	131.6 Å²	131.6	71%	0.714	75%	0.751	S	S	*	*			cis	-148.1	-179.3	-23.6	42.9	-23.4	0	0	0	117.8
540	A	33.7	Very low	35.7	Very low	95 Å²	95	132.4 Å²	132.4	79%	0.785	75%	0.749	S	S	*	*			trans	59.4	160.7	148.2	0	0	0	0	0	121.2
541	E	36.6	Very low	36.5	Very low	179 Å²	179	131.6 Å²	131.6	84%	0.836	75%	0.745	S	S	*	*			cis	-154.5	154.6	11.5	-159.2	163.6	-137	0	0	114.4
542	E	34.6	Very low	37.6	Very low	140 Å²	140	130.9 Å²	130.9	65%	0.654	74%	0.743	S	S	*	*			trans	44.3	131.6	160.2	-83	-155.8	176.3	0	0	129.1
543	R	34.6	Very low	38.5	Very low	195 Å²	195	131.8 Å²	131.8	74%	0.736	74%	0.739	S	S	*	*			trans	82.5	103	132.2	-83.8	-168.9	168.6	104.6	7.2	126.8
544	S	37.3	Very low	39.3	Very low	91 Å²	91	131.3 Å²	131.3	64%	0.636	74%	0.738	S	S	*	*				83.7	121	113.6	69.8	0	0	0	0	126.8
545	N	37	Very low	40	Very low	171 Å²	171	128.5 Å²	128.5	91%	0.914	74%	0.736	S	S	*	*			trans	89.3	133.6	132.5	-67.5	12.2	0	0	0	124.8
546	G	38.9	Very low	40.6	Very low	70 Å²	70	130.7 Å²	130.7	72%	0.722	74%	0.74	S	S	*	*			trans	124.1	119.2	168.7	0	0	0	0	0	112.1
547	K	41.2	Very low	41.1	Very low	182 Å²	182	133.4 Å²	133.4	79%	0.791	74%	0.743	S	S	*	*			cis	72.6	131.7	47.5	-64.3	-145.8	111.3	-130.7	0	112.5
548	D	43.8	Very low	41.3	Very low	98 Å²	98	131.9 Å²	131.9	52%	0.524	74%	0.739	S	S	.	*			cis	-166.5	169.6	17.8	-108.7	-7.7	0	0	0	113.8
549	D	46.4	Very low	41.3	Very low	125 Å²	125	131.1 Å²	131.1	67%	0.668	74%	0.739	S	S	*	*			trans	54.2	157	153.9	-42.1	-13.8	0	0	0	122.1
550	D	48.5	Very low	41.3	Very low	140 Å²	140	132.8 Å²	132.8	75%	0.749	74%	0.742	S	S	*	*			cis	-172.9	177.1	-34.8	-89.9	-19.9	0	0	0	112.2
551	D	47.7	Very low	41.4	Very low	145 Å²	145	132.4 Å²	132.4	78%	0.775	73%	0.733	S	S	*	*			trans	84.2	111.5	153.6	-67.4	-3.7	0	0	0	128.3
552	D	49.5	Very low	41.3	Very low	142 Å²	142	129.2 Å²	129.2	76%	0.759	73%	0.73	S	S	*	*				79.5	111.4	115.8	-79.7	15.1	0	0	0	130.7
553	N	45.2	Very low	41.2	Very low	129 Å²	129	126.7 Å²	126.7	69%	0.69	73%	0.728	S	S	*	*				107.1	126.1	108.4	-136.4	53	0	0	0	127.7
554	D	45.5	Very low	41.3	Very low	149 Å²	149	125.6 Å²	125.6	80%	0.797	73%	0.732	S	S	*	*			trans	51.5	140.4	144.9	-73.3	-19.7	0	0	0	128.6
555	G	42.5	Very low	41.1	Very low	69 Å²	69	129 Å²	129	71%	0.711	74%	0.737	S	S	*	*			trans	146.8	95.2	135.7	0	0	0	0	0	122.2
556	D	44.1	Very low	40.8	Very low	168 Å²	168	125.2 Å²	125.2	90%	0.898	72%	0.724	S	S	*	*			trans	32.6	152.6	137.7	-59.3	-8.1	0	0	0	124.3
557	D	43.2	Very low	40.5	Very low	143 Å²	143	129.1 Å²	129.1	77%	0.765	73%	0.729	S	S	*	*			cis	-176	175.4	-16.8	-176.5	22.9	0	0	0	110.1
558	V	41.9	Very low	40	Very low	108 Å²	108	129 Å²	129	66%	0.655	73%	0.731	S	S	*	*			trans	85.1	101.2	158.1	-168.2	0	0	0	0	122
559	S	38.2	Very low	39.3	Very low	105 Å²	105	131.8 Å²	131.8	73%	0.734	74%	0.741	S	S	*	*			trans	12.3	161.5	134.9	77.2	0	0	0	0	123.2
560	D	37.3	Very low	38.6	Very low	145 Å²	145	131.1 Å²	131.1	78%	0.775	74%	0.741	S	S	*	*			cis	-169.3	169.7	23.2	-160.2	5.8	0	0	0	114.4
561	S	36.2	Very low	37.8	Very low	87 Å²	87	132.8 Å²	132.8	61%	0.608	74%	0.744	S	S	*	*			trans	80	117.5	142.2	72.2	0	0	0	0	124.6
562	S	34.6	Very low	37.4	Very low	111 Å²	111	130.7 Å²	130.7	78%	0.776	74%	0.738	S	S	*	*			trans	59.3	149.5	137.3	57.8	0	0	0	0	122.8
563	S	32.5	Very low	36.4	Very low	87 Å²	87	132.6 Å²	132.6	61%	0.608	75%	0.745	S	S	*	*			cis	-171.5	154.7	-17.1	55.2	0	0	0	0	111.1
564	E	35.3	Very low	35.6	Very low	172 Å²	172	132.4 Å²	132.4	80%	0.804	75%	0.748	S	S	*	*			trans	61.1	151.6	149	-68.9	157.8	150.4	0	0	119.4
565	E	34.1	Very low	34.8	Very low	163 Å²	163	131 Å²	131	76%	0.762	75%	0.745	S	S	*	*			cis	-158.9	172	-5.5	-141.7	-172.9	128.6	0	0	111.6
566	S	30.9	Very low	34.2	Very low	91 Å²	91	136.7 Å²	136.7	64%	0.636	75%	0.753	S	S	*	*			trans	71.6	105.6	148.5	66.7	0	0	0	0	123.6
567	D	31.1	Very low	33.5	Very low	153 Å²	153	136.1 Å²	136.1	82%	0.818	74%	0.742	S	S	*	*				64.8	153.2	111.1	-63.1	-6.4	0	0	0	126.7
568	Q	31.2	Very low	33	Very low	178 Å²	178	135.1 Å²	135.1	83%	0.832	75%	0.747	S	S	*	*			trans	74.5	151.4	162.4	-68	-178.4	-43.8	0	0	120.4
569	E	29.5	Very low	32.5	Very low	157 Å²	157	136.5 Å²	136.5	73%	0.734	75%	0.746	S	S	*	*			cis	-169.4	173	-33.1	-156.8	-176	139.2	0	0	109.2
570	V	31.6	Very low	32.2	Very low	112 Å²	112	140.8 Å²	140.8	68%	0.679	75%	0.754	S	S	*	*			trans	77.8	102.4	160.1	-171.2	0	0	0	0	121
571	H	32	Very low	31.8	Very low	175 Å²	175	141.3 Å²	141.3	81%	0.81	76%	0.756	S	S	*	*				43.5	167.4	111.4	-73.6	-56.7	0	0	0	123
572	P	38.3	Very low	31.6	Very low	100 Å²	100	142.4 Å²	142.4	65%	0.649	76%	0.764	S	S	*	*				-139.1	165.9	-88.6	35.7	-12	0	0	0	117.8
573	M	28.8	Very low	31.5	Very low	182 Å²	182	145.4 Å²	145.4	90%	0.897	77%	0.765	S	S	*	*			trans	-166.4	135.7	161.2	-107.8	164.9	-78.1	0	0	108.2
574	V	29.2	Very low	31.2	Very low	125 Å²	125	152.9 Å²	152.9	76%	0.758	78%	0.78	S	S	*	*			cis	87.2	130.6	31.4	-167.7	0	0	0	0	113.9
575	V	28.2	Very low	31	Very low	121 Å²	121	156.9 Å²	156.9	73%	0.733	79%	0.788	S	S	*	*			trans	76.6	141.2	-179.3	-157.6	0	0	0	0	113.7
576	Q	29.9	Very low	30.7	Very low	188 Å²	188	155.5 Å²	155.5	88%	0.879	79%	0.791	S	S	*	*			cis	-134.7	-178.4	10.2	-148.4	136.2	10.6	0	0	115.1
577	K	28.9	Very low	30.8	Very low	156 Å²	156	158.3 Å²	158.3	68%	0.678	80%	0.804	S	S	*	*			trans	-99.8	148.7	-174.7	-168.1	-166.5	-157	-170.7	0	111.6	E579	K577-E579 HydrophobicContact CD-CG 4.1Å; K577-E579 WeakPolarHBondContact CE-OE1 3.08Å; K577-E579 HydrophobicContact CG-CG 4.35Å; K577-E579 IonicContact NZ-OE1 3.76Å; K577-E579 PolarHBondContact NZ-OE1 3.44Å
578	S	33	Very low	30.5	Very low	122 Å²	122	162 Å²	162	85%	0.853	81%	0.807	S	S	*	*			trans	-134.1	151.6	151.6	56.7	0	0	0	0	109.9
579	E	31.3	Very low	30.6	Very low	136 Å²	136	158.8 Å²	158.8	64%	0.636	81%	0.81	S	S	*	*			trans	-128.7	148.5	-178.4	-60.6	175.6	144.4	0	0	108.5	K577	K577-E579 HydrophobicContact CD-CG 4.1Å; K577-E579 WeakPolarHBondContact CE-OE1 3.08Å; K577-E579 HydrophobicContact CG-CG 4.35Å; K577-E579 IonicContact NZ-OE1 3.76Å; K577-E579 PolarHBondContact NZ-OE1 3.44Å
580	E	32.7	Very low	30.4	Very low	196 Å²	196	161.5 Å²	161.5	92%	0.916	81%	0.814	S	S	*	*			trans	-154.6	162.9	140.7	-124.5	178.3	174.3	0	0	112.5
581	L	28.1	Very low	30.3	Very low	156 Å²	156	167.6 Å²	167.6	82%	0.817	83%	0.826	S	S	*	*			trans	-111.7	147.8	-163.8	-65.3	83.6	0	0	0	112.8
582	S	32.4	Very low	30.1	Very low	109 Å²	109	167.5 Å²	167.5	76%	0.762	83%	0.826	S	S	*	*			trans	-146.7	99.9	149.8	-157.8	0	0	0	0	116.1
583	Q	32	Very low	29.6	Very low	174 Å²	174	168.4 Å²	168.4	81%	0.813	83%	0.832	S	S	*	*			trans	52.8	95.7	132.1	-53	-172.2	22.4	0	0	121.6
584	R	27.4	Very low	29.7	Very low	244 Å²	244	169.7 Å²	169.7	92%	0.921	83%	0.833	S	S	*	*				27.2	127.2	126.5	-63.2	-179.8	173.6	-163.6	-1.2	119.7
585	R	30.9	Very low	29.6	Very low	257 Å²	257	168.1 Å²	168.1	97%	0.97	83%	0.827	S	S	*	*				-153.2	144.8	119.1	-115.9	170.9	-172.8	179.2	3.3	113
586	T	27	Very low	29.4	Very low	134 Å²	134	173.5 Å²	173.5	82%	0.822	84%	0.835	S	S	*	*			trans	-100.6	137.2	-174.5	50.4	0	0	0	0	112.6
587	T	33	Very low	29.3	Very low	149 Å²	149	172.1 Å²	172.1	91%	0.914	83%	0.832	S	S	*	*			trans	-134.5	154.9	152.4	45.3	0	0	0	0	110.7
588	R	26.1	Very low	29.2	Very low	232 Å²	232	176 Å²	176	88%	0.875	84%	0.842	S	S	*	*			trans	-125.8	94.4	-163	-178	-168	-165.5	-179.9	7.9	110
589	A	32.3	Very low	29	Very low	109 Å²	109	174.9 Å²	174.9	90%	0.901	83%	0.834	S	S	*	*			trans	-104.5	127.5	174.6	0	0	0	0	0	110.6
590	R	26	Very low	29	Very low	214 Å²	214	173.8 Å²	173.8	81%	0.808	84%	0.839	S	S	*	*			trans	-121.7	112.1	-178	171.3	-153.5	-79.6	171.1	-8.9	108.5
591	Y	28.5	Very low	28.7	Very low	241 Å²	241	174.6 Å²	174.6	95%	0.945	84%	0.835	S	S	*	*			trans	-141.2	159.5	164	-105.5	-78.4	0	0	0	112.7
592	Q	28.6	Very low	28.6	Very low	173 Å²	173	174 Å²	174	81%	0.808	83%	0.832	S	S	*	*			trans	-96.8	161.1	-164	-92.2	-174.1	-21.1	0	0	114.1
593	P	28	Very low	28.4	Very low	118 Å²	118	177.6 Å²	177.6	77%	0.766	83%	0.834	S	S	*	*			trans	-78.2	147.8	-173.2	32.2	-36.5	0	0	0	113.1
594	F	30.7	Very low	28.1	Very low	209 Å²	209	177.6 Å²	177.6	92%	0.917	83%	0.834	S	S	*	*			trans	-123.9	156.5	163.7	-98	-88.6	0	0	0	111.5
595	S	25.7	Very low	27.9	Very low	92 Å²	92	172 Å²	172	64%	0.643	83%	0.831	S	S	*	*			trans	-131.5	157.3	-167.9	67.5	0	0	0	0	112.1
596	R	25.1	Very low	27.9	Very low	235 Å²	235	165.3 Å²	165.3	89%	0.887	82%	0.824	S	S	*	*			trans	72.7	142.9	-173	-46.8	168.5	-176.4	-171.8	-1.2	109.8
597	I	28.2	Very low	28	Very low	158 Å²	158	166 Å²	166	81%	0.81	82%	0.823	S	S	*	*				-142.5	123.6	52.2	-74.6	152.1	0	0	0	108.1
598	R	26.4	Very low	27.8	Very low	237 Å²	237	170.2 Å²	170.2	89%	0.894	82%	0.822	S	S	*	*				64.6	111.4	89	-124.8	-175.2	-167.6	-175.8	2.4	114.9
599	S	27.6	Very low	27.8	Very low	99 Å²	99	169.4 Å²	169.4	69%	0.692	82%	0.819	S	S	*	*			trans	-73.2	159.8	164.3	154.9	0	0	0	0	111.4
600	P	32.9	Very low	27.8	Very low	114 Å²	114	170.2 Å²	170.2	74%	0.74	82%	0.815	S	S	*	*			trans	-125.6	152.2	137.7	36.8	-28	0	0	0	113.6
601	Y	25.1	Very low	27.8	Very low	212 Å²	212	164.2 Å²	164.2	83%	0.831	81%	0.811	S	S	*	*			trans	-118.8	161.7	151	-100.1	-96.8	0	0	0	106.1
602	L	27	Very low	27.7	Very low	143 Å²	143	155.9 Å²	155.9	75%	0.749	80%	0.798	S	S	*	*			trans	72.3	134.3	179.5	-48.7	160.8	0	0	0	113.4
603	F	28.5	Very low	27.8	Very low	185 Å²	185	156.2 Å²	156.2	81%	0.811	81%	0.805	S	S	*	*				-155	-174.3	55.2	-109.6	-79.5	0	0	0	114.7
604	Q	24.7	Very low	27.8	Very low	174 Å²	174	155.6 Å²	155.6	81%	0.813	80%	0.803	S	S	*	*			trans	-88.9	177.7	-166.4	-71.7	166	-68.3	0	0	116.7
605	C	23.8	Very low	27.9	Very low	126 Å²	126	150.5 Å²	150.5	85%	0.851	79%	0.793	S	S	*	*			trans	-57.3	162.8	-173.4	-45.5	0	0	0	0	118.3
606	S	30.7	Very low	28.1	Very low	117 Å²	117	152.7 Å²	152.7	82%	0.818	80%	0.798	S	S	*	*			trans	-151.7	139	140.6	60.7	0	0	0	0	111.4
607	D	28.3	Very low	28.3	Very low	149 Å²	149	148.7 Å²	148.7	80%	0.797	79%	0.793	S	S	*	*			trans	-78.1	158.2	-178.1	-43.9	-95.2	0	0	0	113.5
608	R	29.2	Very low	28.4	Very low	238 Å²	238	146.6 Å²	146.6	90%	0.898	79%	0.79	S	S	*	*				-176.6	142.1	112.7	-172.1	153.4	-73.1	-135.8	-4.5	114.1
609	W	26.7	Very low	28.4	Very low	215 Å²	215	140.9 Å²	140.9	81%	0.814	79%	0.786	S	S	*	*			trans	-65.1	170.8	172	-82.3	65.1	0	0	0	113.6
610	P	31.4	Very low	28.5	Very low	125 Å²	125	142.5 Å²	142.5	81%	0.812	79%	0.792	S	S	*	*			cis	-146.7	-173.2	38.3	43.6	-21.8	0	0	0	118.8
611	A	26.6	Very low	28.2	Very low	89 Å²	89	146.5 Å²	146.5	74%	0.736	80%	0.797	S	S	*	*			trans	-91	168.1	-172.1	0	0	0	0	0	115.2
612	G	27.4	Very low	28.4	Very low	65 Å²	65	142.4 Å²	142.4	67%	0.67	80%	0.795	S	S	*	*			trans	139.4	96.4	151.8	0	0	0	0	0	116.7
613	L	30.3	Very low	28.3	Very low	181 Å²	181	140.7 Å²	140.7	95%	0.948	80%	0.795	S	S	*	*				177.4	163	109.5	-111.5	77.6	0	0	0	110.6
614	S	27.3	Very low	28.4	Very low	105 Å²	105	140.4 Å²	140.4	73%	0.734	80%	0.801	S	S	*	*			trans	-120.5	-169.1	-178.4	58.8	0	0	0	0	111.8
615	S	32.5	Very low	28.5	Very low	102 Å²	102	142.8 Å²	142.8	71%	0.713	80%	0.802	S	S	*	*			trans	77.2	142	175.2	78.2	0	0	0	0	116.2
616	D	30.5	Very low	28.6	Very low	138 Å²	138	142.8 Å²	142.8	74%	0.738	80%	0.801	S	S	*	*			cis	-164.9	157	-18.7	-116.6	-48.6	0	0	0	113.1
617	L	29.9	Very low	28.7	Very low	151 Å²	151	145.1 Å²	145.1	79%	0.791	80%	0.802	S	S	*	*			trans	62.1	170.1	156.9	-61.7	165.1	0	0	0	118.4
618	P	30.3	Very low	28.6	Very low	114 Å²	114	142.1 Å²	142.1	74%	0.74	79%	0.793	S	S	*	*				-131.8	-179.1	-59.7	39.7	-25	0	0	0	113.7
619	S	24.9	Very low	28.7	Very low	116 Å²	116	139 Å²	139	81%	0.811	79%	0.789	S	S	*	*			trans	-66	148.6	-175.3	-43.2	0	0	0	0	116.3
620	V	31.2	Very low	28.8	Very low	134 Å²	134	134.7 Å²	134.7	81%	0.812	79%	0.786	S	S	*	*			trans	-117.7	132.8	154.7	177	0	0	0	0	108.8
621	K	25.4	Very low	28.6	Very low	197 Å²	197	136.9 Å²	136.9	86%	0.857	78%	0.783	S	S	*	*			trans	-105.4	120.9	174.9	-72.9	-176.1	177.2	-178	0	110.8
622	T	30.3	Very low	28.7	Very low	127 Å²	127	140.9 Å²	140.9	78%	0.779	79%	0.786	S	S	*	*			trans	-154.6	103.7	159.6	15.2	0	0	0	0	106.9
623	S	24.5	Very low	28.8	Very low	107 Å²	107	144.6 Å²	144.6	75%	0.748	79%	0.79	S	S	*	*				67.9	70.6	58.9	-172.3	0	0	0	0	113.6
624	L	30.3	Very low	28.9	Very low	178 Å²	178	144.9 Å²	144.9	93%	0.932	79%	0.786	S	S	*	*			trans	-124.3	158.2	148.9	-74.5	177.8	0	0	0	109.2
625	R	27.1	Very low	29.1	Very low	225 Å²	225	147 Å²	147	85%	0.849	79%	0.789	S	S	*	*			trans	-95.9	158.1	-158.2	-63.4	-179.3	-177.2	-177.1	0.5	112.8
626	P	26.4	Very low	29.2	Very low	126 Å²	126	149.6 Å²	149.6	82%	0.818	79%	0.79	S	S	*	*			trans	-64.9	155.6	161.8	31.5	-36.3	0	0	0	110.8
627	I	31.4	Very low	29.3	Very low	166 Å²	166	150.4 Å²	150.4	85%	0.851	79%	0.794	S	S	*	*			trans	-130.6	136.3	164.5	-63.7	179.2	0	0	0	106.7
628	S	27.7	Very low	29.3	Very low	86 Å²	86	149.9 Å²	149.9	60%	0.601	79%	0.791	S	S	*	*			trans	-120.6	167.7	-179.5	46.5	0	0	0	0	110.2
629	E	31.1	Very low	29.3	Very low	172 Å²	172	152.1 Å²	152.1	80%	0.804	79%	0.791	S	S	*	*			trans	67.3	157.9	173.6	-58.2	140.8	-168.6	0	0	113.5
630	V	29.1	Very low	29.4	Very low	124 Å²	124	153.3 Å²	153.3	75%	0.752	79%	0.787	S	S	*	*			cis	-134.5	135.3	9.6	-177.8	0	0	0	0	105.7
631	F	27.7	Very low	29.5	Very low	172 Å²	172	152.3 Å²	152.3	75%	0.754	79%	0.786	S	S	*	*				46	148.4	89.3	-76.9	-89.5	0	0	0	114.9	L633	F631-L633 HydrophobicContact CE1-CD1 4.48Å
632	E	28.6	Very low	29.7	Very low	173 Å²	173	151 Å²	151	81%	0.808	79%	0.789	S	S	*	*			cis	-129.5	167.8	10.1	-67.2	-174.9	133.9	0	0	110.2
633	L	29.2	Very low	30	Very low	142 Å²	142	150.8 Å²	150.8	74%	0.743	79%	0.792	S	S	*	*			cis	74.3	108.4	37.7	-89.2	179.3	0	0	0	116.7	F631	F631-L633 HydrophobicContact CE1-CD1 4.48Å
634	E	31.7	Very low	30.3	Very low	188 Å²	188	155.2 Å²	155.2	88%	0.879	80%	0.798	S	S	*	*			trans	-156.1	145.2	144.7	-143.6	-178.2	-171.6	0	0	110.3
635	L	31.3	Very low	30.7	Very low	149 Å²	149	152.4 Å²	152.4	78%	0.78	79%	0.79	S	S	*	*			trans	-146.9	140.2	179.2	-129.3	174	0	0	0	108.9
636	E	33.8	Very low	30.8	Very low	157 Å²	157	148 Å²	148	73%	0.734	79%	0.792	S	S	*	*			trans	64.3	125.3	176.4	-50	-157.3	132	0	0	118.3
637	N	33.1	Very low	30.9	Very low	155 Å²	155	150.2 Å²	150.2	83%	0.829	80%	0.797	S	S	*	*			trans	-154	130.6	130.4	-114.6	-68.6	0	0	0	110.3
638	L	30.4	Very low	30.8	Very low	139 Å²	139	146.9 Å²	146.9	73%	0.728	79%	0.793	S	S	*	*			trans	-75.8	162.1	168.8	-74.9	76.6	0	0	0	109.4
639	H	30.4	Very low	30.9	Very low	162 Å²	162	149.9 Å²	149.9	75%	0.75	80%	0.803	S	S	*	*				-169.1	125.1	121.9	-106.1	67.6	0	0	0	113.5
640	I	27.7	Very low	30.9	Very low	140 Å²	140	146.8 Å²	146.8	72%	0.718	80%	0.8	S	S	*	*			trans	40.5	113.3	136.2	-52.4	-174.1	0	0	0	116.9
641	S	33	Very low	31	Very low	113 Å²	113	143.9 Å²	143.9	79%	0.79	80%	0.795	S	S	*	*				-167.5	145.9	79.2	31.2	0	0	0	0	114.6
642	N	29.4	Very low	31.2	Very low	171 Å²	171	144.6 Å²	144.6	91%	0.914	80%	0.8	S	S	*	*			trans	-85.6	138.9	164.6	-82.6	-72.1	0	0	0	111
643	S	35.4	Very low	31.4	Very low	121 Å²	121	140.7 Å²	140.7	85%	0.846	79%	0.793	S	S	*	*			trans	-149.2	158.9	150.9	60.4	0	0	0	0	110.8
644	K	31.6	Very low	31.5	Very low	200 Å²	200	138.5 Å²	138.5	87%	0.87	79%	0.789	S	S	*	*			trans	-114	160.9	-164.6	-94.9	-179.1	176.4	176.9	0	113
645	P	39.6	Very low	31.5	Very low	119 Å²	119	137 Å²	137	77%	0.773	78%	0.782	S	S	*	*			trans	-83	160.9	-167.3	34.1	-37.8	0	0	0	114.5
646	C	29.3	Very low	31.5	Very low	133 Å²	133	135.6 Å²	135.6	90%	0.899	78%	0.775	S	S	*	*			trans	-130.5	163	166.6	-81.7	0	0	0	0	111
647	L	28.6	Very low	31.4	Very low	173 Å²	173	133.2 Å²	133.2	91%	0.906	78%	0.776	S	S	*	*			trans	-108.5	159.7	-169.7	-74.5	141.9	0	0	0	113.2
648	A	29.4	Very low	31.5	Very low	95 Å²	95	130.4 Å²	130.4	79%	0.785	77%	0.768	S	S	*	*			trans	66.3	166.3	161.1	0	0	0	0	0	116.3
649	D	28.5	Very low	31.6	Very low	150 Å²	150	129.1 Å²	129.1	80%	0.802	77%	0.771	S	S	*	*			cis	-142.2	-174.3	1.5	-151.5	-27.7	0	0	0	111.2
650	S	30.5	Very low	32.2	Very low	106 Å²	106	126.8 Å²	126.8	74%	0.741	77%	0.77	S	S	*	*			trans	-72.5	163.8	-169.4	50.3	0	0	0	0	118.2
651	G	31.8	Very low	32.2	Very low	63 Å²	63	130.1 Å²	130.1	65%	0.649	77%	0.774	S	S	*	*			trans	161.7	104.8	170	0	0	0	0	0	110.3
652	H	32.5	Very low	32.2	Very low	187 Å²	187	131.6 Å²	131.6	87%	0.866	77%	0.768	S	S	*	*				53.3	130.7	86.6	-76.8	-80.3	0	0	0	114.3
653	S	31.7	Very low	32.2	Very low	92 Å²	92	128.7 Å²	128.7	64%	0.643	76%	0.762	S	S	*	*			cis	-169.5	164.1	2.9	50.7	0	0	0	0	112.7
654	S	31.7	Very low	32	Very low	95 Å²	95	128.6 Å²	128.6	66%	0.664	76%	0.76	S	S	*	*			trans	27.1	146.6	137.1	73.4	0	0	0	0	120.7
655	E	31.3	Very low	32.1	Very low	156 Å²	156	124.3 Å²	124.3	73%	0.729	75%	0.754	S	S	*	*			cis	-177.4	-178.8	26.7	-144.5	170.3	-129.5	0	0	112.5
656	N	32.6	Very low	32	Very low	121 Å²	121	123.3 Å²	123.3	65%	0.647	75%	0.751	S	S	*	*			trans	69.1	117.4	155.8	-68.7	-49.2	0	0	0	118.8
657	S	31	Very low	32.3	Very low	106 Å²	106	123 Å²	123	74%	0.741	74%	0.74	S	S	*	*				88.4	153.1	72.6	97	0	0	0	0	112.5
658	S	35	Very low	32.7	Very low	96 Å²	96	124.6 Å²	124.6	67%	0.671	73%	0.734	S	S	*	*			cis	-157.3	152.3	2.8	65	0	0	0	0	112.9
659	S	32.6	Very low	33	Very low	113 Å²	113	128.5 Å²	128.5	79%	0.79	74%	0.736	S	S	*	*				69.5	162.3	129.4	-65.2	0	0	0	0	123.9
660	P	42.7	Very low	33.3	Very low	112 Å²	112	126.3 Å²	126.3	73%	0.727	73%	0.732	S	S	*	*			trans	-133.3	175.5	-152.5	42.2	-25.6	0	0	0	117.2
661	R	29	Very low	33.5	Very low	210 Å²	210	125.7 Å²	125.7	79%	0.792	73%	0.728	S	S	*	*			trans	162.3	146	130.8	-94.2	177.3	165	-180	1.3	117.9
662	E	31.3	Very low	33.7	Very low	144 Å²	144	130 Å²	130	67%	0.673	73%	0.733	S	S	*	*			trans	56.9	111.1	134.1	-65.2	164.2	173.2	0	0	125
663	S	31.1	Very low	33.8	Very low	111 Å²	111	129.8 Å²	129.8	78%	0.776	73%	0.733	S	S	*	*				55.8	123.6	127.3	69.1	0	0	0	0	125.3
664	C	30.8	Very low	33.9	Very low	119 Å²	119	129.1 Å²	129.1	80%	0.804	74%	0.74	S	S	*	*			trans	-165.8	133.4	130.4	-100.7	0	0	0	0	108.7
665	S	33.7	Very low	34.1	Very low	109 Å²	109	130.4 Å²	130.4	76%	0.762	75%	0.749	S	S	*	*				61.1	141.4	83.2	87.7	0	0	0	0	115
666	S	37.8	Very low	34.1	Very low	99 Å²	99	130.4 Å²	130.4	69%	0.692	75%	0.754	S	S	*	*			cis	-131.2	-150.6	2.6	58	0	0	0	0	110.7
667	D	35.5	Very low	34.2	Very low	125 Å²	125	131.1 Å²	131.1	67%	0.668	76%	0.763	S	S	*	*			cis	-153.9	-139	9.4	-147.9	-88.1	0	0	0	113.8
668	R	35.9	Very low	34.1	Very low	208 Å²	208	131.5 Å²	131.5	79%	0.785	77%	0.765	S	S	*	*			trans	-115.1	-179.8	-166.8	-63.4	162	169.6	154.9	-6.2	111.8
669	Q	36.4	Very low	34.2	Very low	176 Å²	176	133.1 Å²	133.1	82%	0.822	77%	0.771	S	S	*	*			cis	-161.5	-175.2	2.5	-134.3	171.4	16.3	0	0	106.8
670	S	35.4	Very low	34	Very low	104 Å²	104	134.8 Å²	134.8	73%	0.727	77%	0.771	S	S	*	*			cis	-162.5	-178.3	-5.8	80	0	0	0	0	106.5
671	S	33	Very low	33.6	Very low	94 Å²	94	134.8 Å²	134.8	66%	0.657	77%	0.773	S	S	*	*			cis	-164.8	-178.3	-10.4	-158.8	0	0	0	0	109.1
672	M	36.7	Very low	33.7	Very low	154 Å²	154	129 Å²	129	76%	0.759	77%	0.765	S	S	*	*			trans	59.6	113	162.8	-59.4	-172.8	176.7	0	0	118.4
673	Q	35.7	Very low	34	Very low	182 Å²	182	130.6 Å²	130.6	85%	0.85	77%	0.772	S	S	*	*				66.3	131.9	63.8	-61.5	166.4	-33.6	0	0	112.6
674	G	33.4	Very low	34	Very low	78 Å²	78	130.1 Å²	130.1	80%	0.804	77%	0.769	S	S	*	*			cis	-173.7	-171.9	-0.8	0	0	0	0	0	107.7
675	S	35.8	Very low	34.1	Very low	121 Å²	121	129 Å²	129	85%	0.846	77%	0.768	S	S	*	*			cis	-160.6	179.2	1.3	56.4	0	0	0	0	110.6
676	N	31.7	Very low	34	Very low	157 Å²	157	129.9 Å²	129.9	84%	0.84	77%	0.769	S	S	*	*			trans	-64.2	162.4	-168.9	-48.5	-38.5	0	0	0	116.7
677	V	34.3	Very low	33.7	Very low	136 Å²	136	130.4 Å²	130.4	82%	0.824	77%	0.772	S	S	*	*				-167.9	149.9	114.2	147.9	0	0	0	0	109.8
678	S	29.1	Very low	33.6	Very low	113 Å²	113	129.9 Å²	129.9	79%	0.79	78%	0.778	S	S	*	*			trans	-138.2	144	176.1	54.4	0	0	0	0	111.6
679	V	35.9	Very low	33.5	Very low	131 Å²	131	123.4 Å²	123.4	79%	0.794	78%	0.776	S	S	*	*			trans	-146.7	151.9	172	-169.1	0	0	0	0	110.7
680	N	29.1	Very low	33.3	Very low	148 Å²	148	127.1 Å²	127.1	79%	0.791	78%	0.783	S	S	*	*			trans	-65.3	177.5	172.9	-60.1	-45.7	0	0	0	111.8
681	S	34.2	Very low	33.3	Very low	112 Å²	112	125.2 Å²	125.2	78%	0.783	78%	0.779	S	S	*	*			cis	-164.2	173.1	42.3	-58.4	0	0	0	0	114.8
682	S	32.1	Very low	33.3	Very low	89 Å²	89	126.5 Å²	126.5	62%	0.622	78%	0.783	S	S	*	*			trans	-66.3	159	169.3	45.3	0	0	0	0	114.1
683	H	37	Very low	33.1	Very low	177 Å²	177	126.9 Å²	126.9	82%	0.819	79%	0.789	S	S	*	*				-170.4	-173.5	105.2	-101.8	-69.4	0	0	0	113.3
684	S	31.3	Very low	33.1	Very low	101 Å²	101	122.1 Å²	122.1	71%	0.706	79%	0.788	S	S	*	*			trans	-131.3	-172.8	-154.3	54	0	0	0	0	113.1
685	A	33.3	Very low	32.9	Very low	95 Å²	95	123.5 Å²	123.5	79%	0.785	79%	0.785	S	S	*	*			trans	76.3	158.5	172	0	0	0	0	0	116.7
686	V	31.1	Very low	32.8	Very low	128 Å²	128	125.5 Å²	125.5	78%	0.776	79%	0.786	S	S	*	*			cis	-177.9	151.5	-43.3	126.9	0	0	0	0	107.1
687	S	32	Very low	32.8	Very low	109 Å²	109	122.3 Å²	122.3	76%	0.762	78%	0.781	S	S	*	*			trans	65.1	170.8	169.3	84.9	0	0	0	0	115.7
688	S	31.7	Very low	32.9	Very low	114 Å²	114	120.5 Å²	120.5	80%	0.797	78%	0.781	S	S	*	*			cis	-163.5	161.4	-40.8	54.5	0	0	0	0	110.9
689	G	34	Very low	33.1	Very low	72 Å²	72	120.2 Å²	120.2	74%	0.742	78%	0.779	S	S	*	*			trans	74.9	178.9	179.8	0	0	0	0	0	114
690	R	32.6	Very low	33.2	Very low	255 Å²	255	122.7 Å²	122.7	96%	0.962	78%	0.779	S	S	*	*			cis	168.7	148.3	-24	-115.3	-173.5	179.5	-169.3	1.6	104.6
691	G	34.6	Very low	33.6	Very low	63 Å²	63	123.7 Å²	123.7	65%	0.649	78%	0.779	S	S	*	*			trans	89.5	128.4	-178.8	0	0	0	0	0	112
692	T	33.8	Very low	33.8	Very low	122 Å²	122	122.4 Å²	122.4	75%	0.748	78%	0.775	S	S	*	*			cis	113.7	118.3	27.6	46.5	0	0	0	0	109.2
693	D	32.3	Very low	34.1	Very low	162 Å²	162	126.9 Å²	126.9	87%	0.866	78%	0.783	S	S	*	*			trans	63.6	141.4	149.8	-46.1	-33.9	0	0	0	119.8
694	G	34.9	Very low	34.1	Very low	82 Å²	82	125.9 Å²	125.9	85%	0.845	78%	0.776	S	S	*	*			trans	152.8	80.6	-178.5	0	0	0	0	0	112.7
695	S	31.2	Very low	34.3	Very low	106 Å²	106	127.5 Å²	127.5	74%	0.741	77%	0.773	S	S	*	*			trans	-94.2	175.6	171.2	-171	0	0	0	0	111
696	L	32.1	Very low	34.5	Very low	164 Å²	164	130 Å²	130	86%	0.859	77%	0.768	S	S	*	*			trans	70.8	162.4	175.4	-57.7	111.5	0	0	0	117.1
697	A	32.6	Very low	34.7	Very low	90 Å²	90	132.3 Å²	132.3	74%	0.744	77%	0.767	S	S	*	*			cis	-175.5	131	-41.4	0	0	0	0	0	110.3
698	A	35.6	Very low	35.2	Very low	98 Å²	98	132 Å²	132	81%	0.81	76%	0.763	S	S	*	*			trans	-174.6	124.6	152.9	0	0	0	0	0	107.8
699	S	32.9	Very low	35.3	Very low	107 Å²	107	132.6 Å²	132.6	75%	0.748	77%	0.767	S	S	*	*			cis	96.7	106.6	22.4	-163.1	0	0	0	0	115.3
700	K	39.3	Very low	35.4	Very low	182 Å²	182	133.8 Å²	133.8	79%	0.791	77%	0.77	S	S	*	*			trans	-172.6	110.6	145.5	-99.8	156.6	-176	-179.4	0	106.2
701	E	37.5	Very low	35.4	Very low	169 Å²	169	130.9 Å²	130.9	79%	0.79	76%	0.764	S	S	*	*				65.1	132.1	84.1	-67.2	-178.2	115.5	0	0	112.2
702	A	38.7	Very low	35.3	Very low	85 Å²	85	138.3 Å²	138.3	70%	0.702	77%	0.773	S	S	*	*			cis	-158	179.9	10.7	0	0	0	0	0	109.2
703	K	37.2	Very low	35.5	Very low	183 Å²	183	140.3 Å²	140.3	80%	0.796	77%	0.773	S	S	*	*			cis	-163.5	140.6	5.7	-126.1	163.9	-172.6	175.4	0	109.3
704	K	36.7	Very low	35.7	Very low	156 Å²	156	137.2 Å²	137.2	68%	0.678	76%	0.764	S	S	*	*			trans	50.9	154	146.2	-63	177.6	158.1	-77.3	0	121.5
705	E	36.1	Very low	35.6	Very low	135 Å²	135	139.7 Å²	139.7	63%	0.631	76%	0.763	S	S	*	*			cis	-173.5	163.8	-18.1	-97.8	158.6	178.5	0	0	105.2
706	H	37.9	Very low	36.1	Very low	148 Å²	148	139.8 Å²	139.8	69%	0.685	76%	0.761	S	S	*	*			cis	-144.7	175.2	3.6	-119.9	31.3	0	0	0	106.8
707	K	34.2	Very low	36.2	Very low	176 Å²	176	138 Å²	138	77%	0.765	75%	0.752	S	S	*	*			cis	76.6	150.8	29.4	-81.5	-166.1	174.7	-175.2	0	116.5
708	P	42.6	Very low	36.3	Very low	104 Å²	104	140.9 Å²	140.9	68%	0.675	75%	0.754	S	S	*	*			cis	-147.8	173.9	-32.3	41	-24.2	0	0	0	116.1
709	S	34.6	Very low	36.2	Very low	125 Å²	125	139.9 Å²	139.9	87%	0.874	74%	0.742	S	S	*	*			trans	-177.5	157.8	132	-86.5	0	0	0	0	113.7
710	A	35.4	Very low	36.3	Very low	98 Å²	98	141.9 Å²	141.9	81%	0.81	74%	0.744	S	S	*	*			trans	-164.8	165.5	-174.1	0	0	0	0	0	114.7
711	K	34.2	Very low	36	Very low	194 Å²	194	137 Å²	137	84%	0.843	74%	0.737	S	S	*	*			trans	-162.1	122.1	155.5	-97.8	153	-175.5	178.8	0	107.7
712	R	31.9	Very low	35.6	Very low	219 Å²	219	133.8 Å²	133.8	83%	0.826	73%	0.733	S	S	*	*				58.7	131.4	85.2	-63	-171.3	-179	-162.8	1.6	112.8
713	H	38	Very low	35.3	Very low	163 Å²	163	137.5 Å²	137.5	76%	0.755	74%	0.741	S	S	*	*			cis	-145.4	174.2	27.7	-94.1	-99.9	0	0	0	110.8
714	S	35.5	Very low	34.9	Very low	97 Å²	97	133 Å²	133	68%	0.678	73%	0.732	S	S	*	*			cis	-167	-154.9	-28.8	54.6	0	0	0	0	110.5
715	V	33.7	Very low	34.5	Very low	135 Å²	135	129.7 Å²	129.7	82%	0.818	73%	0.729	S	S	*	*			trans	-151.9	-164.1	-171.4	-119.9	0	0	0	0	109
716	P	41.7	Very low	34.2	Very low	107 Å²	107	132.2 Å²	132.2	70%	0.695	74%	0.741	S	S	*	*			cis	-122.5	-136.4	-5	27.5	0.4	0	0	0	111.3
717	D	33.8	Very low	33.9	Very low	128 Å²	128	130.7 Å²	130.7	68%	0.684	74%	0.741	S	S	*	*			cis	-167.7	175.1	0.1	-140.4	-29.8	0	0	0	114.4
718	L	35.5	Very low	33.6	Very low	149 Å²	149	131 Å²	131	78%	0.78	74%	0.743	S	S	*	*			trans	64.9	164.4	154.3	-61.9	164.5	0	0	0	122.2
719	S	33.8	Very low	33	Very low	78 Å²	78	131.2 Å²	131.2	55%	0.545	74%	0.743	S	S	.	*				-166.5	170.6	-70.7	60.2	0	0	0	0	112
720	D	33.6	Very low	33	Very low	149 Å²	149	133.5 Å²	133.5	80%	0.797	74%	0.739	S	S	*	*			trans	64.4	170	156	-54.4	-47.1	0	0	0	121
721	A	33.1	Very low	32.8	Very low	78 Å²	78	133.4 Å²	133.4	65%	0.645	73%	0.732	S	S	*	*				-162.8	146.7	-50.6	0	0	0	0	0	112.2
722	S	30.1	Very low	32.6	Very low	102 Å²	102	129.1 Å²	129.1	71%	0.713	73%	0.727	S	S	*	*			trans	65.9	139	149.1	75.6	0	0	0	0	123.1
723	L	31.3	Very low	32.7	Very low	164 Å²	164	127.4 Å²	127.4	86%	0.859	73%	0.728	S	S	*	*			trans	58.6	161.5	146.6	-60.6	163.5	0	0	0	119.6
724	S	28.6	Very low	32.3	Very low	89 Å²	89	123.9 Å²	123.9	62%	0.622	73%	0.727	S	S	*	*			cis	-160.1	167.1	-34.6	57.2	0	0	0	0	110.3
725	S	28.8	Very low	32.1	Very low	86 Å²	86	128.5 Å²	128.5	60%	0.601	74%	0.738	S	S	*	*			trans	48.2	117.8	151.1	55.7	0	0	0	0	122
726	E	31	Very low	31.8	Very low	188 Å²	188	130.3 Å²	130.3	88%	0.879	74%	0.738	S	S	*	*			trans	70.5	158.8	134.8	-62.1	178.7	176.1	0	0	117.8
727	V	29.9	Very low	31.4	Very low	116 Å²	116	134.2 Å²	134.2	70%	0.703	75%	0.747	S	S	*	*			cis	-152.6	177.1	-13.3	119.7	0	0	0	0	108.7
728	F	27.9	Very low	31	Very low	181 Å²	181	133.8 Å²	133.8	79%	0.794	75%	0.749	S	S	*	*			trans	-23.4	153.2	170.1	-66.7	-116	0	0	0	117.1
729	T	30.6	Very low	30.7	Very low	110 Å²	110	138.4 Å²	138.4	68%	0.675	76%	0.756	S	S	*	*			cis	-172.5	152.8	39.4	-16.6	0	0	0	0	114.1
730	H	34.3	Very low	30.4	Very low	172 Å²	172	139.9 Å²	139.9	80%	0.796	77%	0.766	S	S	*	*			trans	69.2	147.1	142.7	-90.1	-137	0	0	0	126.5
731	S	31.9	Very low	30.3	Very low	96 Å²	96	136 Å²	136	67%	0.671	76%	0.761	S	S	*	*			trans	58.9	108.7	149.7	52	0	0	0	0	123.8
732	S	30.7	Very low	30.2	Very low	105 Å²	105	140.6 Å²	140.6	73%	0.734	78%	0.775	S	S	*	*				27.6	143.5	114.7	71.2	0	0	0	0	120.3
733	Q	33.2	Very low	30.3	Very low	182 Å²	182	138.8 Å²	138.8	85%	0.85	77%	0.772	S	S	*	*			cis	-153.5	140.1	38.7	-85.1	-177.2	-19.5	0	0	109.4
734	A	29.7	Very low	30.3	Very low	89 Å²	89	142.1 Å²	142.1	74%	0.736	77%	0.773	S	S	*	*				94	167.9	82.1	0	0	0	0	0	115.7
735	Q	31	Very low	30.6	Very low	194 Å²	194	144.7 Å²	144.7	91%	0.907	78%	0.78	S	S	*	*			trans	74.5	131.8	177.2	-64.1	-171.5	-81.5	0	0	119.9
736	Q	28	Very low	30.8	Very low	174 Å²	174	151.2 Å²	151.2	81%	0.813	79%	0.791	S	S	*	*			trans	-88	166	176.5	-52.1	130	-47.8	0	0	110.2
737	H	32.9	Very low	31.3	Very low	189 Å²	189	147.2 Å²	147.2	88%	0.875	78%	0.781	S	S	*	*				-154	147.3	126.2	-108.8	-78.2	0	0	0	110.3
738	T	26.1	Very low	31.5	Very low	118 Å²	118	150 Å²	150	72%	0.724	79%	0.792	S	S	*	*			trans	-107.8	156.5	175.3	50.2	0	0	0	0	110.3
739	W	28.1	Very low	31.7	Very low	247 Å²	247	145 Å²	145	94%	0.936	79%	0.79	S	S	*	*			trans	-172.2	176.5	135.1	-114.2	54.6	0	0	0	111.8
740	S	27.1	Very low	31.9	Very low	109 Å²	109	145.3 Å²	145.3	76%	0.762	80%	0.797	S	S	*	*			trans	-140.1	153.3	-163.8	57.7	0	0	0	0	115.3
741	G	32.6	Very low	31.6	Very low	66 Å²	66	142.4 Å²	142.4	68%	0.68	80%	0.797	S	S	*	*			trans	169.8	133.4	162.4	0	0	0	0	0	110
742	N	29.5	Very low	31.5	Very low	176 Å²	176	143 Å²	143	94%	0.941	80%	0.8	S	S	*	*			cis	103.1	114.9	33.6	-88.2	-18.3	0	0	0	113.2
743	G	33.8	Very low	31.5	Very low	63 Å²	63	144 Å²	144	65%	0.649	80%	0.796	S	S	*	*			trans	151.1	107.9	-178.8	0	0	0	0	0	107.3
744	R	29.9	Very low	31.3	Very low	235 Å²	235	141 Å²	141	89%	0.887	79%	0.787	S	S	*	*				65.6	133.3	62.7	-58.5	-173.3	-163.9	-177.8	7.3	111.5
745	D	35.4	Very low	31.2	Very low	142 Å²	142	142.8 Å²	142.8	76%	0.759	78%	0.782	S	S	*	*			cis	-122	164.2	15.5	-70.3	-68	0	0	0	113.2
746	R	34	Very low	31.2	Very low	223 Å²	223	141.6 Å²	141.6	84%	0.842	77%	0.774	S	S	*	*			cis	96.2	153.3	29.5	-102.6	-160.4	-179	-143.3	0.3	114.8
747	P	41.2	Very low	31.3	Very low	104 Å²	104	139.1 Å²	139.1	68%	0.675	78%	0.776	S	S	*	*				-133	-163.6	-114.1	44.1	-26.6	0	0	0	113.8
748	L	33.3	Very low	31.2	Very low	176 Å²	176	134.9 Å²	134.9	92%	0.921	77%	0.766	S	S	*	*			trans	-175.7	145.9	140.4	-103.8	162.9	0	0	0	113.9
749	G	32.1	Very low	31.2	Very low	74 Å²	74	140.1 Å²	140.1	76%	0.763	77%	0.772	S	S	*	*			trans	71	140.2	166.8	0	0	0	0	0	117.1
750	S	35.5	Very low	31.1	Very low	117 Å²	117	137.8 Å²	137.8	82%	0.818	77%	0.769	S	S	*	*			cis	-152.1	118.6	-14.6	47.2	0	0	0	0	106.6
751	S	27.7	Very low	31.2	Very low	112 Å²	112	139.1 Å²	139.1	78%	0.783	77%	0.772	S	S	*	*				75.9	84.2	72.2	-175.1	0	0	0	0	113.9
752	C	30	Very low	31.1	Very low	109 Å²	109	140.4 Å²	140.4	74%	0.736	78%	0.776	S	S	*	*			trans	-171.2	133.7	138.6	-97.1	0	0	0	0	106.3
753	N	30.1	Very low	31.2	Very low	124 Å²	124	136.7 Å²	136.7	66%	0.663	76%	0.764	S	S	*	*				64.4	125.7	71.1	-67.6	41.7	0	0	0	110
754	D	29.4	Very low	31	Very low	121 Å²	121	138.4 Å²	138.4	65%	0.647	77%	0.766	S	S	*	*			cis	-161.4	142.4	18	-103.9	-20.4	0	0	0	110.3
755	I	28.5	Very low	31.1	Very low	126 Å²	126	134.9 Å²	134.9	65%	0.646	76%	0.763	S	S	*	*				107.6	120.7	100.3	-82.7	174.4	0	0	0	115.1
756	F	29.3	Very low	31	Very low	169 Å²	169	131.3 Å²	131.3	74%	0.741	75%	0.753	S	S	*	*			trans	44.3	130.8	145.9	-70.5	-118.2	0	0	0	121.9	P758	F756-P758 HydrophobicContact CB-CG 4.28Å; F756-P758 WeakPolarHBondContact O-CD 3.15Å
757	S	31	Very low	31	Very low	122 Å²	122	130.4 Å²	130.4	85%	0.853	76%	0.755	S	S	*	*			trans	-71.5	131.3	131.4	-48.3	0	0	0	0	110.4
758	P	30	Very low	30.7	Very low	100 Å²	100	130.4 Å²	130.4	65%	0.649	76%	0.758	S	S	*	*			trans	-126	134.6	133.7	6.2	15.8	0	0	0	110.8	F756	F756-P758 HydrophobicContact CB-CG 4.28Å; F756-P758 WeakPolarHBondContact O-CD 3.15Å
759	R	26	Very low	30.6	Very low	227 Å²	227	129.2 Å²	129.2	86%	0.857	75%	0.745	S	S	*	*				69.9	134.3	60.3	-96.8	-177.3	168.8	-176.6	-1.6	114.3
760	K	27.3	Very low	30.7	Very low	199 Å²	199	133.4 Å²	133.4	87%	0.865	75%	0.749	S	S	*	*			trans	82.2	149.4	173.2	-52.7	164.1	-177.8	178.5	0	112.5
761	V	29.5	Very low	30.4	Very low	136 Å²	136	134.3 Å²	134.3	82%	0.824	74%	0.741	S	S	*	*			cis	-123	119.7	16.6	176.6	0	0	0	0	113.4
762	A	28.8	Very low	30.6	Very low	94 Å²	94	134.1 Å²	134.1	78%	0.777	75%	0.746	S	S	*	*			trans	57.8	160.1	149.9	0	0	0	0	0	119.9
763	S	31.6	Very low	30.7	Very low	98 Å²	98	133.1 Å²	133.1	69%	0.685	75%	0.754	S	S	*	*			cis	-139.7	141.4	-4.9	97.4	0	0	0	0	108.9
764	S	29.6	Very low	30.6	Very low	99 Å²	99	131 Å²	131	69%	0.692	76%	0.762	S	S	*	*				61.2	134.7	96.6	-58.5	0	0	0	0	113.7
765	I	32.8	Very low	30.9	Very low	161 Å²	161	134.1 Å²	134.1	83%	0.826	77%	0.772	S	S	*	*			cis	-166.3	162.3	12.6	-111.6	158.8	0	0	0	106.8
766	A	34.1	Very low	31	Very low	67 Å²	67	137.9 Å²	137.9	55%	0.554	78%	0.784	S	S	*	*			cis	-176.5	163	-33.7	0	0	0	0	0	109.6
767	K	33.9	Very low	31.2	Very low	203 Å²	203	133.3 Å²	133.3	88%	0.883	78%	0.784	S	S	*	*			trans	66.8	158.5	160.6	-62.3	163.9	-176.3	176.8	0	116.5
768	S	33.8	Very low	31.4	Very low	105 Å²	105	137.4 Å²	137.4	73%	0.734	79%	0.787	S	S	*	*			cis	-163.6	128.1	-19.4	41.8	0	0	0	0	106.8
769	K	32.6	Very low	31.5	Very low	150 Å²	150	140 Å²	140	65%	0.652	80%	0.795	S	S	*	*				58.5	95.3	73.4	-164.3	-178.3	-168.3	-87.9	0	115.4	E771	K769-E771 WeakPolarHBondContact CE-OE1 3.46Å; K769-E771 IonicContact NZ-OE1 3.33Å; K769-E771 PolarHBondContact NZ-OE1 3.12Å; K769-E771 IonicContact NZ-OE2 3.96Å; K769-E771 PolarHBondContact NZ-OE2 2.83Å
770	L	32.9	Very low	31.8	Very low	162 Å²	162	140.2 Å²	140.2	85%	0.848	80%	0.795	S	S	*	*			trans	-169.5	111.7	150	-100.2	148.7	0	0	0	104.4
771	E	29.4	Very low	32	Very low	137 Å²	137	135.1 Å²	135.1	64%	0.64	79%	0.79	S	S	*	*			cis	77.9	131.9	47.7	-67.4	-173.8	156.9	0	0	116.1	K769	K769-E771 WeakPolarHBondContact CE-OE1 3.46Å; K769-E771 IonicContact NZ-OE1 3.33Å; K769-E771 PolarHBondContact NZ-OE1 3.12Å; K769-E771 IonicContact NZ-OE2 3.96Å; K769-E771 PolarHBondContact NZ-OE2 2.83Å
772	A	32.2	Very low	32.1	Very low	108 Å²	108	136.9 Å²	136.9	89%	0.893	79%	0.793	S	S	*	*			trans	90.3	128.9	161.3	0	0	0	0	0	120.8
773	G	32.1	Very low	32.2	Very low	87 Å²	87	140.6 Å²	140.6	90%	0.897	80%	0.795	S	S	*	*			trans	85.6	133.8	158.9	0	0	0	0	0	117.8
774	G	29	Very low	32.1	Very low	81 Å²	81	143.5 Å²	143.5	84%	0.835	80%	0.803	S	S	*	*			cis	132.6	64.1	-27.1	0	0	0	0	0	119.3
775	E	34.9	Very low	32.2	Very low	186 Å²	186	143.1 Å²	143.1	87%	0.869	81%	0.805	S	S	*	*			trans	-152.5	141.6	156.3	-89.4	-174	133.7	0	0	107.8
776	K	29.9	Very low	32.1	Very low	205 Å²	205	144.9 Å²	144.9	89%	0.891	81%	0.812	S	S	*	*			cis	71.6	96.5	44.1	-79.8	-169.3	175.1	179	0	115.8
777	G	34.2	Very low	32	Very low	72 Å²	72	146.8 Å²	146.8	74%	0.742	82%	0.822	S	S	*	*			trans	166	141.5	156.2	0	0	0	0	0	116
778	K	35.8	Very low	32.1	Very low	208 Å²	208	142.7 Å²	142.7	90%	0.904	82%	0.816	S	S	*	*			trans	56.3	108.2	161.7	-59.8	170.8	-175.9	172.9	0	116
779	L	32.1	Very low	32.1	Very low	156 Å²	156	143.2 Å²	143.2	82%	0.817	82%	0.82	S	S	*	*			cis	77.9	111.9	28.7	-134.5	176	0	0	0	114.2
780	R	32	Very low	31.8	Very low	230 Å²	230	144.4 Å²	144.4	87%	0.868	83%	0.827	S	S	*	*			trans	101.5	116.7	166.3	-58.4	-163.8	172.4	179.4	-2.8	119.6
781	A	30.7	Very low	31.6	Very low	93 Å²	93	145.1 Å²	145.1	77%	0.769	83%	0.827	S	S	*	*			trans	56.9	119.4	135.9	0	0	0	0	0	121.1
782	I	32.4	Very low	31.8	Very low	172 Å²	172	144.6 Å²	144.6	88%	0.882	83%	0.832	S	S	*	*				-150.4	153.4	111.7	-96	151.9	0	0	0	107.2
783	E	31.1	Very low	31.8	Very low	172 Å²	172	145.9 Å²	145.9	80%	0.804	82%	0.824	S	S	*	*			trans	-98.4	164.1	-175.7	-71.1	161.5	118.5	0	0	112.7
784	D	29.2	Very low	32	Very low	160 Å²	160	147.8 Å²	147.8	86%	0.856	81%	0.813	S	S	*	*			trans	68.9	165.6	156.5	-68.7	-22.1	0	0	0	122.7
785	A	31.1	Very low	32.2	Very low	90 Å²	90	151.8 Å²	151.8	74%	0.744	81%	0.808	S	S	*	*			trans	66.5	89.4	167	0	0	0	0	0	119.7
786	M	31.5	Very low	32	Very low	198 Å²	198	149.1 Å²	149.1	98%	0.975	81%	0.809	S	S	*	*			trans	-128.7	58.6	151.5	-96.8	-164.4	167.5	0	0	113.5
787	S	32	Very low	32.2	Very low	108 Å²	108	142.6 Å²	142.6	76%	0.755	80%	0.8	S	S	*	*			trans	-170.4	158.9	155.6	-90.3	0	0	0	0	107.6
788	P	35.2	Very low	31.9	Very low	117 Å²	117	148.9 Å²	148.9	76%	0.76	81%	0.807	S	S	*	*			cis	-123	-163.2	3.3	42.5	-28.4	0	0	0	112
789	S	32.7	Very low	31.8	Very low	116 Å²	116	148.4 Å²	148.4	81%	0.811	81%	0.805	S	S	*	*				-177.4	154.8	124.2	-78.3	0	0	0	0	112.6
790	Q	27.7	Very low	31.8	Very low	174 Å²	174	148.3 Å²	148.3	81%	0.813	81%	0.805	S	S	*	*			trans	-122.3	164.1	175.1	-89.5	-175.1	-98.3	0	0	110.7
791	E	29.3	Very low	31.7	Very low	178 Å²	178	144.2 Å²	144.2	83%	0.832	80%	0.8	S	S	*	*			trans	64.7	142.8	159.7	-70.8	-179.8	142.7	0	0	119.4
792	V	33.3	Very low	31.6	Very low	125 Å²	125	146.3 Å²	146.3	76%	0.758	80%	0.798	S	S	*	*				178.4	119.6	121	150.1	0	0	0	0	110.1
793	L	32.4	Very low	31.5	Very low	136 Å²	136	146.4 Å²	146.4	71%	0.712	80%	0.799	S	S	*	*			trans	63.5	157	164.5	-64.5	167.1	0	0	0	118.4
794	D	34.5	Very low	31.4	Very low	127 Å²	127	148.7 Å²	148.7	68%	0.679	80%	0.801	S	S	*	*			cis	-131.6	-176.1	8.3	-150.7	-7.8	0	0	0	114.4
795	K	33.1	Very low	31.3	Very low	165 Å²	165	149.3 Å²	149.3	72%	0.717	80%	0.796	S	S	*	*			trans	-104.2	135.1	-154.5	-44.5	136.8	-163.3	109.1	0	115.2
796	S	32.5	Very low	31.3	Very low	130 Å²	130	154 Å²	154	91%	0.909	80%	0.799	S	S	*	*			trans	168	137.9	140.3	-175.1	0	0	0	0	108.5
797	G	32.8	Very low	31.3	Very low	67 Å²	67	152 Å²	152	69%	0.691	79%	0.791	S	S	*	*			cis	-161.2	164.9	-1.9	0	0	0	0	0	109.5
798	K	29.3	Very low	31.1	Very low	205 Å²	205	151.4 Å²	151.4	89%	0.891	79%	0.788	S	S	*	*			trans	-92.8	161.1	-172.5	-70.5	175.4	178	175.5	0	113.1
799	K	33.1	Very low	30.7	Very low	197 Å²	197	151.5 Å²	151.5	86%	0.857	79%	0.791	S	S	*	*			trans	90.4	139.9	-176.3	-56.6	167.8	-175.9	177.4	0	112.4
800	N	32.5	Very low	30.7	Very low	155 Å²	155	150.4 Å²	150.4	83%	0.829	78%	0.783	S	S	*	*			cis	-132.3	156.4	8.9	-110	-17.9	0	0	0	113.5
801	L	28.4	Very low	31	Very low	143 Å²	143	150.7 Å²	150.7	75%	0.749	79%	0.785	S	S	*	*			trans	-111.1	155.8	164.4	-168.6	75.1	0	0	0	108.1
802	N	29.1	Very low	31	Very low	138 Å²	138	149.1 Å²	149.1	74%	0.738	78%	0.781	S	S	*	*			trans	74.4	139.9	-172.9	-42.7	-60.6	0	0	0	112.4
803	L	30.7	Very low	31	Very low	173 Å²	173	151.5 Å²	151.5	91%	0.906	78%	0.784	S	S	*	*			cis	-130.6	164.1	37.1	-94	106.8	0	0	0	116.3
804	R	29.3	Very low	30.9	Very low	221 Å²	221	152.2 Å²	152.2	83%	0.834	78%	0.784	S	S	*	*			trans	-93.1	154	170.5	-85.4	175.2	163.2	179.5	-4.8	112
805	K	26.7	Very low	30.7	Very low	173 Å²	173	153.8 Å²	153.8	75%	0.752	79%	0.789	S	S	*	*			trans	51.2	108.1	147.5	-67.8	-176.4	175.5	-169.8	0	119.1
806	K	31.8	Very low	30.7	Very low	189 Å²	189	152.3 Å²	152.3	82%	0.822	79%	0.789	S	S	*	*			trans	-159.7	128.5	134.3	-101.9	153.6	-178.8	-170.5	0	106.4
807	L	30	Very low	30.8	Very low	154 Å²	154	150.9 Å²	150.9	81%	0.806	78%	0.777	S	S	*	*				53.9	128.9	83.6	-70.9	159	0	0	0	111.8
808	S	27.8	Very low	30.8	Very low	97 Å²	97	156.3 Å²	156.3	68%	0.678	78%	0.781	S	S	*	*			cis	178.8	151	-15.2	35.3	0	0	0	0	107.6
809	S	28.8	Very low	30.9	Very low	119 Å²	119	156.2 Å²	156.2	83%	0.832	78%	0.775	S	S	*	*			trans	-0.6	125.9	164.6	-172.2	0	0	0	0	119.9
810	S	32.7	Very low	30.9	Very low	92 Å²	92	156.3 Å²	156.3	64%	0.643	77%	0.771	S	S	*	*				179.9	130.7	125.5	55.8	0	0	0	0	113.6
811	Q	32.9	Very low	30.8	Very low	181 Å²	181	152.5 Å²	152.5	85%	0.846	76%	0.757	S	S	*	*			trans	61.6	162.1	153.1	-66.8	171.8	-79.7	0	0	118.3
812	L	28.6	Very low	31	Very low	145 Å²	145	153.5 Å²	153.5	76%	0.759	76%	0.758	S	S	*	*			cis	169.8	165.8	-38.8	-113.1	167.2	0	0	0	105.6
813	E	33.2	Very low	31.3	Very low	174 Å²	174	156.3 Å²	156.3	81%	0.813	76%	0.763	S	S	*	*			trans	66.6	148.1	174.3	-65.1	166.6	-162	0	0	116.9
814	E	31.7	Very low	31.5	Very low	152 Å²	152	156 Å²	156	71%	0.71	76%	0.755	S	S	*	*			cis	-165.3	169.4	-35.8	-141.3	-168.9	150.1	0	0	110.1
815	M	30.4	Very low	31.6	Very low	160 Å²	160	152.7 Å²	152.7	79%	0.788	75%	0.749	S	S	*	*			trans	62.1	160.1	159.8	-67.5	179.2	-78	0	0	119.5
816	D	31.5	Very low	32.1	Very low	134 Å²	134	152.5 Å²	152.5	72%	0.717	76%	0.756	S	S	*	*			cis	-162.1	144.4	-34.8	-173.4	51	0	0	0	107.3
817	P	36	Very low	32.2	Very low	100 Å²	100	152.8 Å²	152.8	65%	0.649	76%	0.757	S	S	*	*			trans	-109.7	140.5	-170	37.1	-28.7	0	0	0	115.5
818	K	32.6	Very low	32.5	Very low	181 Å²	181	151.4 Å²	151.4	79%	0.787	76%	0.758	S	S	*	*			trans	-169.9	149.6	162	-108.2	136.8	-163.2	157.8	0	116.4
819	R	31.2	Very low	32.8	Very low	203 Å²	203	152.8 Å²	152.8	77%	0.766	77%	0.767	S	S	*	*			trans	66.8	152	165.4	-59.7	-178.4	-177.1	-168.4	2.2	116.1
820	Y	33.2	Very low	33	Very low	198 Å²	198	153.8 Å²	153.8	78%	0.776	77%	0.768	S	S	*	*			cis	-131.5	178.6	20.2	-113.4	-77.7	0	0	0	114.4
821	S	31.1	Very low	33.1	Very low	75 Å²	75	154.2 Å²	154.2	52%	0.524	78%	0.778	S	S	.	*			trans	-111.9	170.5	-166.6	56.1	0	0	0	0	115.3
822	E	32.8	Very low	33	Very low	165 Å²	165	153 Å²	153	77%	0.771	78%	0.777	S	S	*	*			trans	61.6	124.4	153.1	-67	154.4	96.4	0	0	121.3
823	K	35.1	Very low	33.4	Very low	196 Å²	196	150.8 Å²	150.8	85%	0.852	78%	0.78	S	S	*	*				-165.5	130.2	95.6	-105.3	170	-176	174.1	0	115.6
824	K	34.4	Very low	33.4	Very low	168 Å²	168	149.9 Å²	149.9	73%	0.73	78%	0.781	S	S	*	*			trans	23.7	126.3	147.1	-72.6	-173.4	163.2	-91.8	0	121.8
825	E	32	Very low	33.7	Very low	151 Å²	151	146.3 Å²	146.3	71%	0.706	78%	0.777	S	S	*	*				39.6	122.8	119.4	-54.7	167.7	116	0	0	119.8
826	D	35.5	Very low	34	Very low	169 Å²	169	145.8 Å²	145.8	90%	0.904	78%	0.777	S	S	*	*				-157.5	169.7	112.3	-134	-37.2	0	0	0	112.8
827	K	35.2	Very low	34.2	Very low	194 Å²	194	142.9 Å²	142.9	84%	0.843	78%	0.779	S	S	*	*			trans	-93.3	163.3	-172.6	-101.6	-179.9	178.1	170.2	0	114.7
828	P	35.8	Very low	34.3	Very low	126 Å²	126	145.4 Å²	145.4	82%	0.818	78%	0.782	S	S	*	*			trans	-84.8	162.6	-165.3	34.8	-37.8	0	0	0	114.7
829	S	35	Very low	34.4	Very low	125 Å²	125	141.9 Å²	141.9	87%	0.874	78%	0.78	S	S	*	*			trans	-136	154	167	60.9	0	0	0	0	112
830	T	31.5	Very low	34.6	Very low	140 Å²	140	138.5 Å²	138.5	86%	0.859	77%	0.773	S	S	*	*			trans	-102.1	143.2	-174.4	49.2	0	0	0	0	112.2
831	A	35.8	Very low	34.6	Very low	102 Å²	102	135.3 Å²	135.3	84%	0.843	77%	0.774	S	S	*	*			trans	-155.8	133.3	159.7	0	0	0	0	0	112.3
832	D	30.4	Very low	34.7	Very low	155 Å²	155	137.8 Å²	137.8	83%	0.829	78%	0.78	S	S	*	*			trans	-86.4	149.3	-177.8	-55.4	-97.7	0	0	0	114.8
833	A	37.8	Very low	34.7	Very low	99 Å²	99	134.7 Å²	134.7	82%	0.818	78%	0.777	S	S	*	*			trans	-175.5	99.8	142.7	0	0	0	0	0	108.4
834	N	33.1	Very low	34.6	Very low	155 Å²	155	130.3 Å²	130.3	83%	0.829	77%	0.771	S	S	*	*			cis	83.2	149	44.9	-158.3	7.3	0	0	0	113.9
835	A	38.1	Very low	34.6	Very low	76 Å²	76	127 Å²	127	63%	0.628	78%	0.775	S	S	*	*			trans	72.6	143.7	-176.9	0	0	0	0	0	117.3
836	N	35.6	Very low	34.7	Very low	149 Å²	149	128.4 Å²	128.4	80%	0.797	78%	0.781	S	S	*	*			cis	-165.3	155	-19.3	-104.7	-28.4	0	0	0	108.8
837	G	36.4	Very low	34.9	Very low	73 Å²	73	126.6 Å²	126.6	75%	0.753	78%	0.779	S	S	*	*			trans	172.4	10.9	176.9	0	0	0	0	0	123
838	H	37.2	Very low	34.8	Very low	154 Å²	154	121.4 Å²	121.4	71%	0.713	77%	0.773	S	S	*	*			trans	25.4	118.9	155.7	-90.2	-113.5	0	0	0	122.8
839	S	35.2	Very low	34.7	Very low	107 Å²	107	125.6 Å²	125.6	75%	0.748	77%	0.773	S	S	*	*				169	96.4	109.3	-174.3	0	0	0	0	109.9
840	Q	34.6	Very low	34.4	Very low	132 Å²	132	126.4 Å²	126.4	62%	0.617	77%	0.767	S	S	*	*				54.2	133.3	89.6	-64.8	-162	-7	0	0	114.6
841	V	33.4	Very low	34.5	Very low	130 Å²	130	125.7 Å²	125.7	79%	0.788	76%	0.758	S	S	*	*				-140.9	121.6	54.3	169	0	0	0	0	109.6
842	L	32.9	Very low	34.2	Very low	127 Å²	127	127.6 Å²	127.6	67%	0.665	75%	0.753	S	S	*	*				62	140.6	87.6	-69.2	162.8	0	0	0	114.9
843	S	32.9	Very low	34.1	Very low	101 Å²	101	127.2 Å²	127.2	71%	0.706	75%	0.751	S	S	*	*			cis	-158.7	-158.2	-7.9	57.5	0	0	0	0	107.5
844	S	33.6	Very low	33.8	Very low	104 Å²	104	128.8 Å²	128.8	73%	0.727	75%	0.75	S	S	*	*			cis	-178.9	159.7	0.1	26.6	0	0	0	0	106.3
845	A	34.8	Very low	33.6	Very low	98 Å²	98	125.8 Å²	125.8	81%	0.81	75%	0.746	S	S	*	*			cis	-170.9	173.5	-15.9	0	0	0	0	0	108.4
846	E	34.1	Very low	33.4	Very low	180 Å²	180	127.9 Å²	127.9	84%	0.841	76%	0.756	S	S	*	*			trans	-88.2	-172.1	173.6	-62.6	173.4	113.1	0	0	112.7
847	P	39.3	Very low	33.2	Very low	131 Å²	131	131.7 Å²	131.7	85%	0.851	76%	0.76	S	S	*	*				-146	170.4	97.9	40.7	-26.6	0	0	0	116
848	A	33.2	Very low	33.2	Very low	86 Å²	86	136.9 Å²	136.9	71%	0.711	77%	0.765	S	S	*	*			trans	-125.9	153.5	175.2	0	0	0	0	0	112.7
849	Y	33.1	Very low	32.8	Very low	213 Å²	213	134.3 Å²	134.3	84%	0.835	76%	0.764	S	S	*	*			trans	-154.7	123.7	163	-103.7	-90.9	0	0	0	106.2
850	L	29.7	Very low	32.7	Very low	143 Å²	143	135.8 Å²	135.8	75%	0.749	77%	0.768	S	S	*	*				59.5	105.4	69.8	-84.1	171.7	0	0	0	114.3
851	D	34	Very low	32.7	Very low	125 Å²	125	139.6 Å²	139.6	67%	0.668	80%	0.8	S	S	*	*				-179.8	153.5	98.3	-95.3	-16.9	0	0	0	114.7
852	L	29.9	Very low	32.7	Very low	141 Å²	141	140.1 Å²	140.1	74%	0.738	80%	0.8	S	S	*	*			trans	30.7	158.1	147.8	-76.3	91.1	0	0	0	123.3
853	L	26.8	Very low	32.7	Very low	147 Å²	147	140.8 Å²	140.8	77%	0.77	81%	0.808	S	S	*	*			cis	179.6	179.8	-33.1	-124.2	178.2	0	0	0	107.8
854	V	32.4	Very low	32.7	Very low	132 Å²	132	143 Å²	143	80%	0.8	81%	0.813	S	S	*	*			trans	76.8	95.6	165	-160.7	0	0	0	0	119
855	A	29.4	Very low	32.6	Very low	92 Å²	92	145.3 Å²	145.3	76%	0.76	82%	0.818	S	S	*	*			trans	-26	156	152.3	0	0	0	0	0	121.3
856	S	33.2	Very low	32.5	Very low	120 Å²	120	148.3 Å²	148.3	84%	0.839	82%	0.819	S	S	*	*				-140.5	159.3	118.6	66.5	0	0	0	0	111.2
857	R	30.3	Very low	32.4	Very low	230 Å²	230	146.1 Å²	146.1	87%	0.868	82%	0.817	S	S	*	*			trans	-96.4	164.8	175.4	-81.4	172.7	158.3	177.7	-8.6	110.6
858	E	36.3	Very low	31.9	Very low	182 Å²	182	147.2 Å²	147.2	85%	0.85	82%	0.815	S	S	*	*			trans	142.8	113.7	139.5	-78.8	161	-156.3	0	0	108.3
859	S	30.8	Very low	31.8	Very low	99 Å²	99	151.9 Å²	151.9	69%	0.692	82%	0.823	S	S	*	*			cis	97.1	111.6	34.3	74.6	0	0	0	0	113.8
860	V	31.7	Very low	31.7	Very low	138 Å²	138	146.8 Å²	146.8	84%	0.836	82%	0.822	S	S	*	*			trans	64	98.3	163.8	-170.2	0	0	0	0	116.6
861	V	35.6	Very low	31.9	Very low	213 Å²	213	147.2 Å²	147.2	100%	1.291	83%	0.829	S	S	*	*				-132.8	0	97.2	178.1	0	0	0	0	107.4

Retrieved 861 of 861 residues in 480.6 ms (Link to these results)

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