A0A077Z2M1_TRITR Loading...

Insulin receptor substrate 1

Activates phosphatidylinositol 3-kinase when bound to the regulatory p85 subunit. May mediate the control of various cellular processes by insulin-like peptides. When phosphorylated by the insulin receptor binds specifically to various cellular proteins containing SH2 domains. Involved in control of cell proliferation, cell size, and body and organ growth throughout development. Also has a role in a signaling pathway controlling the physiological response required to endure periods of low nutrient conditions. Insulin/insulin-like growth factor (IGF) signaling pathway has a role in regulating aging and is necessary in the ovary for vitellogenic maturation.

AlphaFold DB , UniProt , Accession A0A077Z2M1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 910 aa.

						>A0A077Z2M1_TRITR|A0A077Z2M1
MQRGRKRFFVLHQDSYNGSARIDCYESEKRFRYGATPKLSVPLKQCFNINKKVSLSADGKFKYCIAVYTYSDCLLLGCETEQEQEAWLQTLLGVLVNTQSTGSADDFRRPCFEHVWDVKILKNKGITEKTPKLAGFFRFCLNSCSVYFYKVNTQDEFYEFPLVYISNYGHQGNMFFLRVGRSALTGSGELWMNTEDVLDAVNIHETMKQILEENHELRQRNMPVEPRRAYAPNSMRSNSVSVSGQSGEMFNVGDSRLRAISESEKTLQKYDSFSLQACSSYPCFNSLRGHFNYLQSRSVPGVPAHDNNSQSIGCFSVGGSVAYSRSASHSPSIRRNIALTGFNMHNSAVGSRSGHSTDSVGSTSTYSEADRVSVRSGYRHNPLDLVGVELSNRSAMSADGSSDRFPGLTCSPVFLEKACMEGKELFPAGSQESMSSNVITHFAEVHSPADCLGSFRRMTLDSGCVDAASPREGTSVMPTSYSSEQISDYTPMAPSPSEKLSKGRAQGSWNMDEIRPYPHEFDGSTPPSRAYSCGSKPSSTSSFKQPSWLRKLHLPFSDERKRAHSFGNWNKFVLRKNSSSYLGSDSSDSCLRARSDSCGSDEYASTSRNGTRCQPRTRLFDSKFSSCSEDLVEIDFRTASSSFGQSQSGSLGSTDSLGRSRANSMGTNNMIFKQTWLPKVEQITEQELTPSVRLVQDLFDHERNIPSDTVADYVPMSPCVSIQIAESVAPDSPFSNQEPSRSSDYLEMTCDPSTSTDFRMSSANDQQCNKIGKLEFNFPGTKTDSASDEASLHCLKTVSSRKKTGTSRRHTTSDPCSSSVEETQMKRMKRNPNTAVQYPLSECSSSIQLLKKLGRRSWHGDCVDEVDQTVVRDDCVFNEATMLMNAGNTKAASCRTEGDYVFVCPPPPSC
					

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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	43.7	Very low	72	Confident	96 Å²	96	71.5 Å²	71.5	47%	0.473	34%	0.336	S	S	.	.				0	-161.1	0	-95.5	-164.9	-179.4	0	0	108.6	L39 D899	M1-L39 HydrophobicContact CE-CB 3.79Å; M1-L39 HydrophobicContact CE-CD2 3.72Å; M1-L39 HydrophobicContact CE-CG 4.41Å; M1-D899 PolarHBondContact N-OD2 3.4Å
2	Q	38.8	Very low	73.5	Confident	126 Å²	126	69.4 Å²	69.4	59%	0.589	33%	0.326	S	S	*	.			trans	-89	116.9	158.6	-82.9	-169.6	-12.2	0	0	108.5	R5	Q2-R5 VanDerWaalsContact OE1-NH2 3.14Å
3	R	48.3	Very low	74.5	Confident	163 Å²	163	72.5 Å²	72.5	62%	0.615	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-31.8	133.2	-178.6	-82.2	177.7	160.4	-128.4	-16.8	115.5	R5 D58 D899	R3-R5 PolarHBondContact O-N 3.12Å; R3-D58 IonicContact CZ-OD2 3.41Å; R3-D58 VanDerWaalsContact NH1-CG 3.34Å; R3-D58 IonicContact NH1-OD1 2.67Å; R3-D58 PolarHBondContact NH1-OD1 2.89Å; R3-D58 IonicContact NH1-OD2 2.72Å; R3-D58 PolarHBondContact NH1-OD2 2.88Å; R3-D58 IonicContact NH2-OD2 2.75Å; R3-D58 PolarHBondContact NH2-OD2 2.9Å; R3-D899 WeakPolarHBondContact CG-OD1 3.31Å
4	G	55.9	Low	75.3	Confident	50 Å²	50	70.6 Å²	70.6	52%	0.515	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	15.5	150.2	0	0	0	0	0	118.3
5	R	69.9	Low	75.5	Confident	129 Å²	129	69.7 Å²	69.7	49%	0.487	34%	0.338	S	S	.	.			trans	-95.5	124.2	174.7	-60.9	-173.7	-173.6	172.3	9	110.4	Q2 R3 V901	Q2-R5 VanDerWaalsContact OE1-NH2 3.14Å; R3-R5 PolarHBondContact O-N 3.12Å; R5-V901 WeakPolarHBondContact O-CG1 3.41Å
6	K	82.9	Confident	75.6	Confident	88 Å²	88	78.8 Å²	78.8	38%	0.383	37%	0.37	S	S	.	.			trans	-53.5	139.5	171.7	-176.3	149.4	-167.5	167.1	0	110.4	E79 F902 V903 C904	K6-E79 IonicContact NZ-OE1 2.92Å; K6-E79 PolarHBondContact NZ-OE1 2.87Å; K6-F902 HydrophobicContact CB-CB 3.99Å; K6-F902 HydrophobicContact CB-CD2 4.06Å; K6-F902 HydrophobicContact CB-CG 4.39Å; K6-F902 HydrophobicContact CD-CB 3.65Å; K6-F902 HydrophobicContact CD-CD2 4.45Å; K6-F902 HydrophobicContact CD-CG 4.1Å; K6-F902 HydrophobicContact CG-CB 3.64Å; K6-F902 HydrophobicContact CG-CG 4.38Å; K6-V903 WeakPolarHBondContact CE-O 3.28Å; K6-V903 PolarHBondContact NZ-O 3.42Å; K6-C904 WeakPolarHBondContact CE-SG 3.31Å; K6-C904 PolarHBondContact NZ-SG 3.33Å
7	R	87.4	Confident	75.5	Confident	31 Å²	31	80.4 Å²	80.4	12%	0.117	38%	0.382	C	S	.	.			trans	-124.7	178.1	179.1	-69.7	-69.2	-179.5	-143.5	12.4	109.2	F9 Y25 E26 V901	R7-F9 HydrophobicContact CB-CD2 4.36Å; R7-F9 HydrophobicContact CB-CE2 3.86Å; R7-F9 HydrophobicContact CB-CZ 4.19Å; R7-Y25 WeakPolarHBondContact CB-O 3.4Å; R7-Y25 WeakPolarHBondContact CD-O 3.29Å; R7-E26 IonicContact CZ-OE1 3.74Å; R7-E26 IonicContact NH1-OE1 2.72Å; R7-E26 PolarHBondContact NH1-OE1 2.82Å; R7-E26 IonicContact NH2-OE1 3.96Å; R7-E26 PolarHBondContact NH2-OE1 3.21Å; R7-V901 HydrophobicContact CB-CG1 3.7Å; R7-V901 HydrophobicContact CG-CG1 3.57Å
8	F	89.8	Confident	75.7	Confident	37 Å²	37	77.7 Å²	77.7	16%	0.162	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	119.6	169.5	-174.6	-100	0	0	0	107.8	V10 Y25 E28 F31	F8-V10 HydrophobicContact CD1-CG2 3.89Å; F8-V10 HydrophobicContact CE1-CG2 3.52Å; F8-Y25 HydrophobicContact CD1-CD2 4.47Å; F8-Y25 PolarHBondContact N-O 3.17Å; F8-Y25 PolarHBondContact O-N 3.2Å; F8-E28 HydrophobicContact CD1-CB 4.31Å; F8-E28 HydrophobicContact CD2-CB 3.68Å; F8-E28 HydrophobicContact CD2-CG 4.13Å; F8-E28 HydrophobicContact CE1-CB 4.44Å; F8-E28 HydrophobicContact CE1-CG 4.16Å; F8-E28 HydrophobicContact CE2-CB 3.84Å; F8-E28 HydrophobicContact CE2-CG 3.76Å; F8-E28 HydrophobicContact CG-CB 3.92Å; F8-E28 HydrophobicContact CG-CG 4.49Å; F8-E28 HydrophobicContact CZ-CB 4.22Å; F8-E28 HydrophobicContact CZ-CG 3.78Å; F8-F31 HydrophobicContact CD1-CB 3.94Å; F8-F31 HydrophobicContact CD1-CD1 4.3Å; F8-F31 HydrophobicContact CD1-CG 4.26Å; F8-F31 HydrophobicContact CE1-CB 4.04Å; F8-F31 AromaticContact CE1-CD1 3.53Å; F8-F31 HydrophobicContact CE1-CD1 3.53Å; F8-F31 HydrophobicContact CE1-CE1 4.2Å; F8-F31 AromaticContact CE1-CG 3.91Å; F8-F31 HydrophobicContact CE1-CG 3.91Å; F8-F31 HydrophobicContact CZ-CD1 4.34Å
9	F	91.6	Very high	76.2	Confident	7 Å²	7	76.4 Å²	76.4	3%	0.031	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	141.3	-179.7	-63.5	-93.2	0	0	0	109.7	R7 I22 D23 C24 L76 W87 V901 V903	R7-F9 HydrophobicContact CB-CD2 4.36Å; R7-F9 HydrophobicContact CB-CE2 3.86Å; R7-F9 HydrophobicContact CB-CZ 4.19Å; F9-I22 HydrophobicContact CB-CD1 4.38Å; F9-I22 HydrophobicContact CB-CG1 4.43Å; F9-I22 HydrophobicContact CD1-CD1 4.03Å; F9-I22 HydrophobicContact CD1-CG1 4.16Å; F9-D23 CarbonylContact C-O 3.57Å; F9-D23 WeakPolarHBondContact CA-O 3.29Å; F9-C24 HydrophobicContact CD1-CB 3.77Å; F9-C24 HydrophobicContact CE1-CB 3.71Å; F9-L76 HydrophobicContact CD1-CD2 3.91Å; F9-L76 HydrophobicContact CE1-CD2 3.5Å; F9-L76 HydrophobicContact CE2-CD2 4.17Å; F9-L76 HydrophobicContact CG-CD2 4.4Å; F9-L76 HydrophobicContact CZ-CD2 3.65Å; F9-W87 HydrophobicContact CB-CH2 4.46Å; F9-V901 HydrophobicContact CE2-CB 4.48Å; F9-V901 HydrophobicContact CE2-CG1 3.97Å; F9-V901 HydrophobicContact CZ-CB 4.33Å; F9-V901 HydrophobicContact CZ-CG1 4.15Å; F9-V903 HydrophobicContact CB-CG1 4.16Å; F9-V903 HydrophobicContact CD2-CB 4.17Å; F9-V903 HydrophobicContact CD2-CG1 3.96Å; F9-V903 HydrophobicContact CD2-CG2 3.79Å; F9-V903 HydrophobicContact CE2-CG2 3.97Å; F9-V903 HydrophobicContact CG-CG1 4.45Å
10	V	92.2	Very high	76.8	Confident	21 Å²	21	72.6 Å²	72.6	13%	0.127	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	129.8	175.5	-176	0	0	0	0	107.8	F8 H12 I22 D23 Y25 F31	F8-V10 HydrophobicContact CD1-CG2 3.89Å; F8-V10 HydrophobicContact CE1-CG2 3.52Å; V10-H12 WeakPolarHBondContact CG1-NE2 3.42Å; V10-I22 WeakPolarHBondContact O-CA 3.44Å; V10-D23 PolarHBondContact N-O 3.49Å; V10-D23 PolarHBondContact O-N 2.94Å; V10-Y25 HydrophobicContact CB-CE2 4.09Å; V10-Y25 HydrophobicContact CG2-CD2 3.91Å; V10-Y25 HydrophobicContact CG2-CE2 3.71Å; V10-F31 HydrophobicContact CB-CE2 4.46Å; V10-F31 HydrophobicContact CG1-CE2 4.18Å; V10-F31 HydrophobicContact CG1-CZ 4.16Å; V10-F31 HydrophobicContact CG2-CD1 4.21Å; V10-F31 HydrophobicContact CG2-CD2 3.82Å; V10-F31 HydrophobicContact CG2-CE1 4.19Å; V10-F31 HydrophobicContact CG2-CE2 3.8Å; V10-F31 HydrophobicContact CG2-CG 4.02Å; V10-F31 HydrophobicContact CG2-CZ 3.99Å
11	L	92.1	Very high	77.5	Confident	38 Å²	38	71.5 Å²	71.5	20%	0.199	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	119.2	175.2	173.3	54.7	0	0	0	108.4	L43 W87 T90 L91 V94	L11-L43 HydrophobicContact CD1-CD1 3.64Å; L11-W87 HydrophobicContact CB-CH2 4.35Å; L11-W87 HydrophobicContact CB-CZ3 3.98Å; L11-W87 HydrophobicContact CD2-CZ3 4.33Å; L11-T90 HydrophobicContact CD2-CG2 3.7Å; L11-L91 HydrophobicContact CD1-CD2 3.96Å; L11-L91 HydrophobicContact CD2-CD2 3.92Å; L11-L91 HydrophobicContact CD2-CG 4.24Å; L11-V94 HydrophobicContact CD1-CG1 4.36Å; L11-V94 HydrophobicContact CD1-CG2 4.47Å; L11-V94 HydrophobicContact CD2-CG2 4.11Å; L11-V94 HydrophobicContact CG-CG2 4.3Å
12	H	89.9	Confident	79.8	Confident	47 Å²	47	67 Å²	67	22%	0.218	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	139.1	173.3	-61.9	-87.8	0	0	0	109.7	V10 A20 R21 D23	V10-H12 WeakPolarHBondContact CG1-NE2 3.42Å; H12-A20 WeakPolarHBondContact O-CA 3.45Å; H12-A20 WeakPolarHBondContact O-CB 3.34Å; H12-R21 HydrophobicContact CB-CG 3.95Å; H12-R21 PolarHBondContact N-O 2.98Å; H12-R21 PolarHBondContact O-N 3.24Å; H12-R21 VanDerWaalsContact O-N 3.15Å; H12-D23 IonicContact CD2-OD2 2.66Å; H12-D23 IonicContact NE2-OD2 3.63Å
13	Q	86.7	Confident	82.3	Confident	110 Å²	110	61.3 Å²	61.3	51%	0.514	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-84.1	164.4	165.1	-174.6	166.5	-16.8	0	0	110.1	S15 V94	Q13-S15 PolarHBondContact O-N 3.26Å; Q13-V94 HydrophobicContact CB-CG1 4.47Å
14	D	84.5	Confident	84.3	Confident	45 Å²	45	53.6 Å²	53.6	24%	0.241	27%	0.274	C	S	.	.	S	Bend	trans	-58.7	128.2	170	-87.4	-21.7	0	0	0	109.5	S19 A20 K44 T98	D14-S19 WeakPolarHBondContact OD1-CA 3.4Å; D14-S19 WeakPolarHBondContact OD1-CB 3.44Å; D14-A20 PolarHBondContact OD1-N 2.94Å; D14-K44 VanDerWaalsContact CG-CE 3.41Å; D14-K44 WeakPolarHBondContact OD1-CE 3.36Å; D14-K44 IonicContact OD1-NZ 3.92Å; D14-K44 WeakPolarHBondContact OD2-CE 3.36Å; D14-K44 IonicContact OD2-NZ 3.64Å; D14-K44 PolarHBondContact OD2-NZ 3.21Å; D14-T98 HydrophobicContact CB-CG2 4.46Å; D14-T98 WeakPolarHBondContact OD2-CB 3.24Å; D14-T98 VanDerWaalsContact OD2-CG2 3.25Å; D14-T98 WeakPolarHBondContact OD2-CG2 3.35Å
15	S	79.5	Confident	86	Confident	58 Å²	58	52.1 Å²	52.1	41%	0.406	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-153.4	170.3	-178.2	64.8	0	0	0	0	110.5	Q13 N17 G18	Q13-S15 PolarHBondContact O-N 3.26Å; S15-N17 PolarHBondContact O-N 2.95Å; S15-N17 PolarHBondContact OG-N 3.14Å; S15-G18 PolarHBondContact N-O 3.16Å; S15-G18 VanDerWaalsContact N-O 3.15Å; S15-G18 CarbonylContact O-C 3.47Å; S15-G18 PolarHBondContact O-N 2.77Å; S15-G18 VanDerWaalsContact O-O 3.11Å; S15-G18 PolarHBondContact OG-O 3.28Å
16	Y	76.7	Confident	86.9	Confident	214 Å²	214	49 Å²	49	84%	0.839	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.4	170.6	66	-84.5	0	0	0	112.4	G18	Y16-G18 PolarHBondContact O-N 2.69Å; Y16-G18 VanDerWaalsContact O-N 3.17Å
17	N	73.8	Confident	87.2	Confident	107 Å²	107	47.1 Å²	47.1	57%	0.572	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	19.5	171.9	-65.2	-45.4	0	0	0	113.7	S15	S15-N17 PolarHBondContact O-N 2.95Å; S15-N17 PolarHBondContact OG-N 3.14Å
18	G	79.5	Confident	87.4	Confident	32 Å²	32	49.5 Å²	49.5	33%	0.33	25%	0.254	S	S	.	.	B	Isolated β-bridge	trans	106.4	168.3	174.8	0	0	0	0	0	114.3	S15 Y16	S15-G18 PolarHBondContact N-O 3.16Å; S15-G18 VanDerWaalsContact N-O 3.15Å; S15-G18 CarbonylContact O-C 3.47Å; S15-G18 PolarHBondContact O-N 2.77Å; S15-G18 VanDerWaalsContact O-O 3.11Å; S15-G18 PolarHBondContact OG-O 3.28Å; Y16-G18 PolarHBondContact O-N 2.69Å; Y16-G18 VanDerWaalsContact O-N 3.17Å
19	S	85.2	Confident	87.4	Confident	53 Å²	53	55 Å²	55	37%	0.371	28%	0.278	S	S	.	.			trans	-68.8	158.5	-174.3	57.5	0	0	0	0	113.8	D14 R21	D14-S19 WeakPolarHBondContact OD1-CA 3.4Å; D14-S19 WeakPolarHBondContact OD1-CB 3.44Å; S19-R21 WeakPolarHBondContact O-CG 3.44Å; S19-R21 PolarHBondContact O-N 2.79Å; S19-R21 PolarHBondContact O-NH1 3.18Å
20	A	88.3	Confident	87.4	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.301	C	S	.	.			trans	-58.2	133	177	0	0	0	0	0	111.3	H12 D14 P42 L43 V94 T98	H12-A20 WeakPolarHBondContact O-CA 3.45Å; H12-A20 WeakPolarHBondContact O-CB 3.34Å; D14-A20 PolarHBondContact OD1-N 2.94Å; A20-P42 CarbonylContact O-C 3.58Å; A20-P42 WeakPolarHBondContact O-CA 3.46Å; A20-L43 HydrophobicContact CB-CB 4.29Å; A20-L43 HydrophobicContact CB-CD1 4.29Å; A20-L43 PolarHBondContact O-N 3.06Å; A20-V94 HydrophobicContact CB-CG1 3.7Å; A20-T98 HydrophobicContact CB-CG2 3.29Å
21	R	90.3	Very high	87.3	Confident	50 Å²	50	63.8 Å²	63.8	19%	0.189	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	155.4	-170.7	60.6	-172	-176.4	-91.5	4.6	110.9	H12 S19 D23 V41	H12-R21 HydrophobicContact CB-CG 3.95Å; H12-R21 PolarHBondContact N-O 2.98Å; H12-R21 PolarHBondContact O-N 3.24Å; H12-R21 VanDerWaalsContact O-N 3.15Å; S19-R21 WeakPolarHBondContact O-CG 3.44Å; S19-R21 PolarHBondContact O-N 2.79Å; S19-R21 PolarHBondContact O-NH1 3.18Å; R21-D23 WeakPolarHBondContact CD-OD1 3.49Å; R21-D23 WeakPolarHBondContact CD-OD2 3.31Å; R21-D23 WeakPolarHBondContact CG-OD1 3.49Å; R21-D23 IonicContact CZ-OD2 3.97Å; R21-D23 IonicContact NE-OD1 3.84Å; R21-D23 IonicContact NE-OD2 2.66Å; R21-D23 PolarHBondContact NE-OD2 2.92Å; R21-D23 IonicContact NH2-OD2 2.85Å; R21-V41 CarbonylContact C-O 3.47Å; R21-V41 WeakPolarHBondContact CA-O 3.33Å; R21-V41 WeakPolarHBondContact CB-O 3.37Å
22	I	91.7	Very high	87.2	Confident	2 Å²	2	70.5 Å²	70.5	1%	0.01	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	117.3	167	-176.3	170.7	0	0	0	109.6	F9 V10 V41 L43 L74 L76	F9-I22 HydrophobicContact CB-CD1 4.38Å; F9-I22 HydrophobicContact CB-CG1 4.43Å; F9-I22 HydrophobicContact CD1-CD1 4.03Å; F9-I22 HydrophobicContact CD1-CG1 4.16Å; V10-I22 WeakPolarHBondContact O-CA 3.44Å; I22-V41 HydrophobicContact CG2-CB 3.88Å; I22-V41 PolarHBondContact N-O 3.33Å; I22-V41 PolarHBondContact O-N 3.36Å; I22-L43 HydrophobicContact CG2-CD2 4.5Å; I22-L74 HydrophobicContact CG2-CD2 3.99Å; I22-L76 HydrophobicContact CD1-CD1 3.74Å; I22-L76 HydrophobicContact CD1-CD2 4.02Å
23	D	91.8	Very high	87.3	Confident	5 Å²	5	77.6 Å²	77.6	3%	0.027	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	127	-175.5	-73.1	-6.5	0	0	0	109.9	F9 V10 H12 R21 Y25 P37 S40	F9-D23 CarbonylContact C-O 3.57Å; F9-D23 WeakPolarHBondContact CA-O 3.29Å; V10-D23 PolarHBondContact N-O 3.49Å; V10-D23 PolarHBondContact O-N 2.94Å; H12-D23 IonicContact CD2-OD2 2.66Å; H12-D23 IonicContact NE2-OD2 3.63Å; R21-D23 WeakPolarHBondContact CD-OD1 3.49Å; R21-D23 WeakPolarHBondContact CD-OD2 3.31Å; R21-D23 WeakPolarHBondContact CG-OD1 3.49Å; R21-D23 IonicContact CZ-OD2 3.97Å; R21-D23 IonicContact NE-OD1 3.84Å; R21-D23 IonicContact NE-OD2 2.66Å; R21-D23 PolarHBondContact NE-OD2 2.92Å; R21-D23 IonicContact NH2-OD2 2.85Å; D23-Y25 HydrophobicContact CB-CE2 3.77Å; D23-P37 HydrophobicContact CB-CB 4.05Å; D23-P37 HydrophobicContact CB-CG 4.5Å; D23-S40 WeakPolarHBondContact OD1-CA 3.44Å; D23-S40 WeakPolarHBondContact OD1-CB 3.39Å; D23-S40 PolarHBondContact OD1-OG 3.2Å
24	C	90.6	Very high	87.4	Confident	2 Å²	2	75.7 Å²	75.7	1%	0.014	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	116.4	-172.8	173.8	0	0	0	0	111.8	F9 K38 L39	F9-C24 HydrophobicContact CD1-CB 3.77Å; F9-C24 HydrophobicContact CE1-CB 3.71Å; C24-K38 PolarHBondContact O-N 3.32Å; C24-L39 HydrophobicContact CB-CB 4.17Å; C24-L39 PolarHBondContact N-O 3.12Å
25	Y	91.9	Very high	87.6	Confident	18 Å²	18	75 Å²	75	7%	0.071	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	157.7	179.5	-59.7	-90	0	0	0	112.2	R7 F8 V10 D23 S27 F31 A35 P37	R7-Y25 WeakPolarHBondContact CB-O 3.4Å; R7-Y25 WeakPolarHBondContact CD-O 3.29Å; F8-Y25 HydrophobicContact CD1-CD2 4.47Å; F8-Y25 PolarHBondContact N-O 3.17Å; F8-Y25 PolarHBondContact O-N 3.2Å; V10-Y25 HydrophobicContact CB-CE2 4.09Å; V10-Y25 HydrophobicContact CG2-CD2 3.91Å; V10-Y25 HydrophobicContact CG2-CE2 3.71Å; D23-Y25 HydrophobicContact CB-CE2 3.77Å; Y25-S27 VanDerWaalsContact C-N 3.31Å; Y25-S27 PolarHBondContact O-N 3.2Å; Y25-F31 HydrophobicContact CD1-CB 4.08Å; Y25-F31 HydrophobicContact CD2-CB 4.04Å; Y25-F31 HydrophobicContact CD2-CD2 4.15Å; Y25-F31 HydrophobicContact CD2-CG 4.4Å; Y25-F31 HydrophobicContact CE1-CB 4.41Å; Y25-F31 HydrophobicContact CE1-CD2 4.14Å; Y25-F31 HydrophobicContact CE2-CB 4.39Å; Y25-F31 AromaticContact CE2-CD2 3.65Å; Y25-F31 HydrophobicContact CE2-CD2 3.65Å; Y25-F31 HydrophobicContact CE2-CE2 4.36Å; Y25-F31 HydrophobicContact CE2-CG 4.34Å; Y25-F31 HydrophobicContact CG-CB 3.88Å; Y25-F31 AromaticContact CZ-CD2 3.64Å; Y25-A35 WeakPolarHBondContact CE1-O 3.42Å; Y25-P37 HydrophobicContact CD1-CB 4.35Å; Y25-P37 HydrophobicContact CE1-CB 3.85Å; Y25-P37 HydrophobicContact CE1-CG 4.5Å; Y25-P37 HydrophobicContact CE2-CB 4.34Å
26	E	88.7	Confident	88.1	Confident	64 Å²	64	78.2 Å²	78.2	30%	0.299	39%	0.387	S	S	.	.	S	Bend	trans	-65.7	-35.3	177.3	-176.9	127	-95.7	0	0	112.7	R7 R30 K38	R7-E26 IonicContact CZ-OE1 3.74Å; R7-E26 IonicContact NH1-OE1 2.72Å; R7-E26 PolarHBondContact NH1-OE1 2.82Å; R7-E26 IonicContact NH2-OE1 3.96Å; R7-E26 PolarHBondContact NH2-OE1 3.21Å; E26-R30 HydrophobicContact CB-CG 4.27Å; E26-K38 HydrophobicContact CB-CD 4.43Å; E26-K38 IonicContact OE1-NZ 3.18Å; E26-K38 PolarHBondContact OE1-NZ 2.94Å; E26-K38 WeakPolarHBondContact OE2-CE 3.44Å; E26-K38 IonicContact OE2-NZ 2.73Å; E26-K38 PolarHBondContact OE2-NZ 3.26Å
27	S	88.4	Confident	88.8	Confident	48 Å²	48	70.1 Å²	70.1	34%	0.336	36%	0.361	S	S	.	.			trans	-162.8	161.5	176.6	62.2	0	0	0	0	109.5	Y25 K29 R30 F31	Y25-S27 VanDerWaalsContact C-N 3.31Å; Y25-S27 PolarHBondContact O-N 3.2Å; S27-K29 PolarHBondContact O-N 3.39Å; S27-R30 WeakPolarHBondContact O-CB 3.42Å; S27-R30 PolarHBondContact O-N 2.96Å; S27-F31 PolarHBondContact O-N 3.19Å
28	E	91.8	Very high	89.6	Confident	81 Å²	81	70.5 Å²	70.5	38%	0.379	36%	0.357	S	S	.	.	H	α-helix	trans	-54.6	-39.3	175.9	-173.9	-171.8	-166.3	0	0	112.3	F8 R30 F31 R32	F8-E28 HydrophobicContact CD1-CB 4.31Å; F8-E28 HydrophobicContact CD2-CB 3.68Å; F8-E28 HydrophobicContact CD2-CG 4.13Å; F8-E28 HydrophobicContact CE1-CB 4.44Å; F8-E28 HydrophobicContact CE1-CG 4.16Å; F8-E28 HydrophobicContact CE2-CB 3.84Å; F8-E28 HydrophobicContact CE2-CG 3.76Å; F8-E28 HydrophobicContact CG-CB 3.92Å; F8-E28 HydrophobicContact CG-CG 4.49Å; F8-E28 HydrophobicContact CZ-CB 4.22Å; F8-E28 HydrophobicContact CZ-CG 3.78Å; E28-R30 PolarHBondContact O-N 2.98Å; E28-F31 WeakPolarHBondContact O-CB 3.12Å; E28-F31 PolarHBondContact O-N 3.27Å; E28-R32 VanDerWaalsContact CD-NE 3.34Å; E28-R32 VanDerWaalsContact CD-NH2 3.34Å; E28-R32 HydrophobicContact CG-CG 4.21Å; E28-R32 PolarHBondContact O-N 2.78Å; E28-R32 IonicContact OE1-CZ 3.51Å; E28-R32 IonicContact OE1-NE 2.73Å; E28-R32 PolarHBondContact OE1-NE 3.33Å; E28-R32 IonicContact OE1-NH2 3.33Å; E28-R32 PolarHBondContact OE1-NH2 3.36Å; E28-R32 IonicContact OE2-NE 3.56Å; E28-R32 IonicContact OE2-NH2 3.51Å
29	K	91.2	Very high	90	Very high	152 Å²	152	71.9 Å²	71.9	66%	0.661	36%	0.357	S	S	*	.	H	α-helix	trans	-57.2	-38.1	176.8	-65	-173.1	178.9	-175.5	0	112	S27 Y33	S27-K29 PolarHBondContact O-N 3.39Å; K29-Y33 HydrophobicContact CB-CE2 4.42Å; K29-Y33 WeakPolarHBondContact O-CD2 3.48Å; K29-Y33 PolarHBondContact O-N 3.18Å; K29-Y33 VanDerWaalsContact O-N 3.13Å
30	R	90.9	Very high	90.2	Very high	139 Å²	139	72 Å²	72	53%	0.525	36%	0.357	S	S	.	.	H	α-helix	trans	-66.4	-40.2	175.8	-75.6	-69.6	-161.7	162.5	3.6	112	E26 S27 E28 Y33 A35	E26-R30 HydrophobicContact CB-CG 4.27Å; S27-R30 WeakPolarHBondContact O-CB 3.42Å; S27-R30 PolarHBondContact O-N 2.96Å; E28-R30 PolarHBondContact O-N 2.98Å; R30-Y33 PolarHBondContact O-N 3.05Å; R30-A35 HydrophobicContact CB-CB 4.1Å; R30-A35 WeakPolarHBondContact O-CB 3.4Å; R30-A35 PolarHBondContact O-N 3.15Å
31	F	89.3	Confident	90.1	Very high	74 Å²	74	72.5 Å²	72.5	33%	0.325	36%	0.361	S	S	.	.	H	α-helix	trans	-62.7	-51.4	174	169.5	-113.2	0	0	0	111.6	F8 V10 Y25 S27 E28 Y33 G34	F8-F31 HydrophobicContact CD1-CB 3.94Å; F8-F31 HydrophobicContact CD1-CD1 4.3Å; F8-F31 HydrophobicContact CD1-CG 4.26Å; F8-F31 HydrophobicContact CE1-CB 4.04Å; F8-F31 AromaticContact CE1-CD1 3.53Å; F8-F31 HydrophobicContact CE1-CD1 3.53Å; F8-F31 HydrophobicContact CE1-CE1 4.2Å; F8-F31 AromaticContact CE1-CG 3.91Å; F8-F31 HydrophobicContact CE1-CG 3.91Å; F8-F31 HydrophobicContact CZ-CD1 4.34Å; V10-F31 HydrophobicContact CB-CE2 4.46Å; V10-F31 HydrophobicContact CG1-CE2 4.18Å; V10-F31 HydrophobicContact CG1-CZ 4.16Å; V10-F31 HydrophobicContact CG2-CD1 4.21Å; V10-F31 HydrophobicContact CG2-CD2 3.82Å; V10-F31 HydrophobicContact CG2-CE1 4.19Å; V10-F31 HydrophobicContact CG2-CE2 3.8Å; V10-F31 HydrophobicContact CG2-CG 4.02Å; V10-F31 HydrophobicContact CG2-CZ 3.99Å; Y25-F31 HydrophobicContact CD1-CB 4.08Å; Y25-F31 HydrophobicContact CD2-CB 4.04Å; Y25-F31 HydrophobicContact CD2-CD2 4.15Å; Y25-F31 HydrophobicContact CD2-CG 4.4Å; Y25-F31 HydrophobicContact CE1-CB 4.41Å; Y25-F31 HydrophobicContact CE1-CD2 4.14Å; Y25-F31 HydrophobicContact CE2-CB 4.39Å; Y25-F31 AromaticContact CE2-CD2 3.65Å; Y25-F31 HydrophobicContact CE2-CD2 3.65Å; Y25-F31 HydrophobicContact CE2-CE2 4.36Å; Y25-F31 HydrophobicContact CE2-CG 4.34Å; Y25-F31 HydrophobicContact CG-CB 3.88Å; Y25-F31 AromaticContact CZ-CD2 3.64Å; S27-F31 PolarHBondContact O-N 3.19Å; E28-F31 WeakPolarHBondContact O-CB 3.12Å; E28-F31 PolarHBondContact O-N 3.27Å; F31-Y33 PolarHBondContact O-N 2.92Å; F31-Y33 VanDerWaalsContact O-N 3.16Å; F31-G34 PolarHBondContact O-N 3.22Å
32	R	91.3	Very high	90	Very high	179 Å²	179	71.8 Å²	71.8	68%	0.675	36%	0.363	S	S	*	.	H	α-helix	trans	-60.9	-24.5	179.2	-66.1	-174.5	-173.1	-162.5	7.3	114	E28	E28-R32 VanDerWaalsContact CD-NE 3.34Å; E28-R32 VanDerWaalsContact CD-NH2 3.34Å; E28-R32 HydrophobicContact CG-CG 4.21Å; E28-R32 PolarHBondContact O-N 2.78Å; E28-R32 IonicContact OE1-CZ 3.51Å; E28-R32 IonicContact OE1-NE 2.73Å; E28-R32 PolarHBondContact OE1-NE 3.33Å; E28-R32 IonicContact OE1-NH2 3.33Å; E28-R32 PolarHBondContact OE1-NH2 3.36Å; E28-R32 IonicContact OE2-NE 3.56Å; E28-R32 IonicContact OE2-NH2 3.51Å
33	Y	91.4	Very high	89.7	Confident	197 Å²	197	71.7 Å²	71.7	77%	0.773	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	11.3	173.1	-68.9	-53	0	0	0	114.1	K29 R30 F31 A35	K29-Y33 HydrophobicContact CB-CE2 4.42Å; K29-Y33 WeakPolarHBondContact O-CD2 3.48Å; K29-Y33 PolarHBondContact O-N 3.18Å; K29-Y33 VanDerWaalsContact O-N 3.13Å; R30-Y33 PolarHBondContact O-N 3.05Å; F31-Y33 PolarHBondContact O-N 2.92Å; F31-Y33 VanDerWaalsContact O-N 3.16Å; Y33-A35 VanDerWaalsContact C-N 3.27Å; Y33-A35 PolarHBondContact O-N 3.44Å
34	G	87.7	Confident	89.1	Confident	69 Å²	69	75 Å²	75	71%	0.711	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	24.5	177.9	0	0	0	0	0	114.5	F31	F31-G34 PolarHBondContact O-N 3.22Å
35	A	90.4	Very high	88.5	Confident	30 Å²	30	79.8 Å²	79.8	25%	0.248	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-66	156.8	175.2	0	0	0	0	0	111	Y25 R30 Y33	Y25-A35 WeakPolarHBondContact CE1-O 3.42Å; R30-A35 HydrophobicContact CB-CB 4.1Å; R30-A35 WeakPolarHBondContact O-CB 3.4Å; R30-A35 PolarHBondContact O-N 3.15Å; Y33-A35 VanDerWaalsContact C-N 3.27Å; Y33-A35 PolarHBondContact O-N 3.44Å
36	T	90.2	Very high	87.8	Confident	126 Å²	126	79 Å²	79	77%	0.773	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-67.4	142.5	174.3	46.8	0	0	0	0	112
37	P	90.9	Very high	87.2	Confident	45 Å²	45	77.6 Å²	77.6	29%	0.292	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-66.8	147.5	173.1	27.9	-33.4	0	0	0	110.8	D23 Y25	D23-P37 HydrophobicContact CB-CB 4.05Å; D23-P37 HydrophobicContact CB-CG 4.5Å; Y25-P37 HydrophobicContact CD1-CB 4.35Å; Y25-P37 HydrophobicContact CE1-CB 3.85Å; Y25-P37 HydrophobicContact CE1-CG 4.5Å; Y25-P37 HydrophobicContact CE2-CB 4.34Å
38	K	89.3	Confident	86.8	Confident	115 Å²	115	76.1 Å²	76.1	50%	0.5	38%	0.377	S	S	.	.	S	Bend	trans	-81.3	-19.8	177.8	-66.9	-160.9	169.3	-169.8	0	113.5	C24 E26	C24-K38 PolarHBondContact O-N 3.32Å; E26-K38 HydrophobicContact CB-CD 4.43Å; E26-K38 IonicContact OE1-NZ 3.18Å; E26-K38 PolarHBondContact OE1-NZ 2.94Å; E26-K38 WeakPolarHBondContact OE2-CE 3.44Å; E26-K38 IonicContact OE2-NZ 2.73Å; E26-K38 PolarHBondContact OE2-NZ 3.26Å
39	L	88.2	Confident	86.4	Confident	61 Å²	61	72.8 Å²	72.8	32%	0.319	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	138.2	170	174	66.3	0	0	0	106.4	M1 C24 V41 L74	M1-L39 HydrophobicContact CE-CB 3.79Å; M1-L39 HydrophobicContact CE-CD2 3.72Å; M1-L39 HydrophobicContact CE-CG 4.41Å; C24-L39 HydrophobicContact CB-CB 4.17Å; C24-L39 PolarHBondContact N-O 3.12Å; L39-V41 HydrophobicContact CD1-CG2 4.01Å; L39-V41 HydrophobicContact CD2-CG2 3.94Å; L39-V41 HydrophobicContact CG-CG2 3.84Å; L39-L74 HydrophobicContact CD2-CD1 3.96Å; L39-L74 HydrophobicContact CD2-CD2 4.28Å
40	S	89.2	Confident	85.9	Confident	54 Å²	54	66.9 Å²	66.9	38%	0.378	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	127.5	170.4	179.2	0	0	0	0	107.1	D23	D23-S40 WeakPolarHBondContact OD1-CA 3.44Å; D23-S40 WeakPolarHBondContact OD1-CB 3.39Å; D23-S40 PolarHBondContact OD1-OG 3.2Å
41	V	88.1	Confident	85.2	Confident	12 Å²	12	63.5 Å²	63.5	7%	0.073	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	106.8	-179.9	-178.3	0	0	0	0	109.1	R21 I22 L39 L43 T69 L74	R21-V41 CarbonylContact C-O 3.47Å; R21-V41 WeakPolarHBondContact CA-O 3.33Å; R21-V41 WeakPolarHBondContact CB-O 3.37Å; I22-V41 HydrophobicContact CG2-CB 3.88Å; I22-V41 PolarHBondContact N-O 3.33Å; I22-V41 PolarHBondContact O-N 3.36Å; L39-V41 HydrophobicContact CD1-CG2 4.01Å; L39-V41 HydrophobicContact CD2-CG2 3.94Å; L39-V41 HydrophobicContact CG-CG2 3.84Å; V41-L43 PolarHBondContact O-N 3.14Å; V41-T69 HydrophobicContact CG1-CG2 3.5Å; V41-L74 HydrophobicContact CG2-CD2 4.22Å
42	P	87.1	Confident	84.4	Confident	35 Å²	35	61.5 Å²	61.5	23%	0.227	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	124.3	174.2	-21.7	33.5	0	0	0	110.9	A20 K44 Q45	A20-P42 CarbonylContact O-C 3.58Å; A20-P42 WeakPolarHBondContact O-CA 3.46Å; P42-K44 PolarHBondContact O-N 3.45Å; P42-Q45 HydrophobicContact CB-CG 4.27Å; P42-Q45 WeakPolarHBondContact O-CB 3.25Å; P42-Q45 PolarHBondContact O-N 3.29Å
43	L	85.3	Confident	83.1	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-64.2	-26.1	-178.5	-71.4	-176.3	0	0	0	112.3	L11 A20 I22 V41 Q45 C46 L91 V94 L95	L11-L43 HydrophobicContact CD1-CD1 3.64Å; A20-L43 HydrophobicContact CB-CB 4.29Å; A20-L43 HydrophobicContact CB-CD1 4.29Å; A20-L43 PolarHBondContact O-N 3.06Å; I22-L43 HydrophobicContact CG2-CD2 4.5Å; V41-L43 PolarHBondContact O-N 3.14Å; L43-Q45 PolarHBondContact O-N 3.07Å; L43-Q45 VanDerWaalsContact O-N 3.16Å; L43-C46 VanDerWaalsContact O-CB 3.3Å; L43-C46 WeakPolarHBondContact O-CB 3.42Å; L43-C46 PolarHBondContact O-N 3.24Å; L43-L91 HydrophobicContact CD2-CD2 4.34Å; L43-V94 HydrophobicContact CD1-CB 4.17Å; L43-V94 HydrophobicContact CD1-CG1 3.67Å; L43-L95 HydrophobicContact CB-CD2 3.91Å; L43-L95 HydrophobicContact CB-CG 4.48Å; L43-L95 WeakPolarHBondContact O-CD2 3.43Å
44	K	80	Confident	81.5	Confident	73 Å²	73	46.6 Å²	46.6	32%	0.317	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-61.4	-22.7	172.7	-53.1	-158.3	-177.1	-138.1	0	113.4	D14 P42 T98 T101 R109	D14-K44 VanDerWaalsContact CG-CE 3.41Å; D14-K44 WeakPolarHBondContact OD1-CE 3.36Å; D14-K44 IonicContact OD1-NZ 3.92Å; D14-K44 WeakPolarHBondContact OD2-CE 3.36Å; D14-K44 IonicContact OD2-NZ 3.64Å; D14-K44 PolarHBondContact OD2-NZ 3.21Å; P42-K44 PolarHBondContact O-N 3.45Å; K44-T98 PolarHBondContact NZ-O 3.11Å; K44-T101 PolarHBondContact NZ-OG1 2.89Å; K44-R109 PolarHBondContact O-NH1 3.26Å; K44-R109 PolarHBondContact O-NH2 3.13Å
45	Q	76.6	Confident	79.7	Confident	104 Å²	104	49.3 Å²	49.3	49%	0.486	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-90.6	-7.8	173.3	-61.5	179.4	-3.8	0	0	113.7	P42 L43 T69 Y70	P42-Q45 HydrophobicContact CB-CG 4.27Å; P42-Q45 WeakPolarHBondContact O-CB 3.25Å; P42-Q45 PolarHBondContact O-N 3.29Å; L43-Q45 PolarHBondContact O-N 3.07Å; L43-Q45 VanDerWaalsContact O-N 3.16Å; Q45-T69 WeakPolarHBondContact O-CA 3.5Å; Q45-Y70 WeakPolarHBondContact O-CD2 3.48Å
46	C	77.5	Confident	77.8	Confident	2 Å²	2	49 Å²	49	1%	0.014	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	134	170.7	-58.4	0	0	0	0	108.5	L43 V67 Y68 L95 R109	L43-C46 VanDerWaalsContact O-CB 3.3Å; L43-C46 WeakPolarHBondContact O-CB 3.42Å; L43-C46 PolarHBondContact O-N 3.24Å; C46-V67 HydrophobicContact CB-CG1 4.27Å; C46-V67 WeakPolarHBondContact SG-CG1 3.09Å; C46-Y68 WeakPolarHBondContact CA-O 3.42Å; C46-L95 HydrophobicContact CB-CD2 4.47Å; C46-R109 PolarHBondContact O-NH1 3.07Å
47	F	76.8	Confident	75.7	Confident	34 Å²	34	47.6 Å²	47.6	15%	0.149	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	-15.3	178.6	75.5	-102.6	0	0	0	113.1	Y68 T69 Y70 F112 R138	F47-Y68 PolarHBondContact N-O 3Å; F47-T69 WeakPolarHBondContact CE1-O 3.26Å; F47-Y70 HydrophobicContact CD1-CD1 4.46Å; F47-Y70 HydrophobicContact CD1-CE1 4.47Å; F47-F112 AromaticContact CD2-CD2 3.55Å; F47-F112 HydrophobicContact CD2-CD2 3.55Å; F47-F112 AromaticContact CD2-CE2 3.49Å; F47-F112 HydrophobicContact CD2-CE2 3.49Å; F47-F112 VanDerWaalsContact CD2-CE2 3.49Å; F47-F112 AromaticContact CE2-CD2 3.57Å; F47-F112 HydrophobicContact CE2-CD2 3.57Å; F47-F112 AromaticContact CE2-CE2 3.58Å; F47-F112 HydrophobicContact CE2-CE2 3.58Å; F47-R138 HydrophobicContact CZ-CG 4.28Å
48	N	79.9	Confident	73.7	Confident	17 Å²	17	49.1 Å²	49.1	9%	0.091	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	147.6	174.6	169.1	-94.2	0	0	0	110.3	N50 Y68 F112 V115	N48-N50 PolarHBondContact ND2-OD1 3.28Å; N48-N50 PolarHBondContact OD1-ND2 2.73Å; N48-N50 PolarHBondContact OD1-OD1 2.71Å; N48-Y68 HydrophobicContact CB-CD2 4.46Å; N48-Y68 PolarHBondContact O-N 3.41Å; N48-Y68 WeakPolarHBondContact OD1-CD2 3.44Å; N48-F112 PolarHBondContact ND2-O 2.75Å; N48-V115 HydrophobicContact CB-CG2 4.04Å; N48-V115 WeakPolarHBondContact OD1-CG2 3.36Å
49	I	82.8	Confident	72	Confident	10 Å²	10	47 Å²	47	5%	0.051	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	122.9	169.4	-60.7	-173	0	0	0	108.1	I65 A66 V67 L88 L91 L92 L95	I49-I65 HydrophobicContact CG2-CG2 3.47Å; I49-I65 VanDerWaalsContact CG2-CG2 3.47Å; I49-A66 CarbonylContact C-O 3.56Å; I49-A66 WeakPolarHBondContact CA-O 3.19Å; I49-V67 HydrophobicContact CD1-CG1 4.12Å; I49-V67 HydrophobicContact CD1-CG2 4.02Å; I49-V67 HydrophobicContact CG1-CB 4.36Å; I49-V67 HydrophobicContact CG1-CG1 4.09Å; I49-V67 HydrophobicContact CG1-CG2 4.13Å; I49-V67 HydrophobicContact CG2-CG2 4.14Å; I49-L88 HydrophobicContact CG2-CD1 3.84Å; I49-L91 HydrophobicContact CD1-CB 3.92Å; I49-L91 HydrophobicContact CD1-CD1 4.49Å; I49-L91 HydrophobicContact CD1-CD2 4.45Å; I49-L92 HydrophobicContact CB-CD2 4.47Å; I49-L95 HydrophobicContact CD1-CD1 3.43Å; I49-L95 VanDerWaalsContact CD1-CD1 3.43Å; I49-L95 HydrophobicContact CD1-CG 4.38Å; I49-L95 HydrophobicContact CG1-CD1 3.79Å
50	N	80.2	Confident	70.6	Confident	28 Å²	28	51.6 Å²	51.6	15%	0.15	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	147.5	-176.4	-74.7	-17.7	0	0	0	112.7	N48 K52 A66 Y68 V115	N48-N50 PolarHBondContact ND2-OD1 3.28Å; N48-N50 PolarHBondContact OD1-ND2 2.73Å; N48-N50 PolarHBondContact OD1-OD1 2.71Å; N50-K52 PolarHBondContact O-N 2.85Å; N50-A66 PolarHBondContact N-O 3.19Å; N50-A66 PolarHBondContact O-N 2.85Å; N50-Y68 HydrophobicContact CB-CE2 4.36Å; N50-V115 PolarHBondContact ND2-N 3.49Å
51	K	78.2	Confident	69.4	Low	68 Å²	68	50.1 Å²	50.1	30%	0.296	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	105.8	169.2	-160.6	173.7	-176.9	174.7	0	109.1	Q84 E85 L88	K51-Q84 VanDerWaalsContact CE-CD 3.46Å; K51-Q84 HydrophobicContact CG-CG 4.34Å; K51-Q84 VanDerWaalsContact CG-NE2 3.26Å; K51-E85 WeakPolarHBondContact CE-OE2 3.34Å; K51-E85 IonicContact NZ-OE2 2.66Å; K51-E85 PolarHBondContact NZ-OE2 2.97Å; K51-L88 HydrophobicContact CB-CD2 3.99Å; K51-L88 HydrophobicContact CD-CD2 4.17Å; K51-L88 HydrophobicContact CG-CD2 4.33Å
52	K	71.1	Confident	68.8	Low	33 Å²	33	54.9 Å²	54.9	14%	0.143	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	111	175	-173.1	166.4	-177.5	173.3	0	109.7	N50 S54 C64 A66 D199	N50-K52 PolarHBondContact O-N 2.85Å; K52-S54 PolarHBondContact O-N 2.87Å; K52-C64 PolarHBondContact N-O 3.32Å; K52-C64 CarbonylContact O-C 3.59Å; K52-C64 VanDerWaalsContact O-CB 3.25Å; K52-C64 WeakPolarHBondContact O-CB 3.44Å; K52-C64 PolarHBondContact O-N 2.82Å; K52-C64 VanDerWaalsContact O-O 3.1Å; K52-A66 HydrophobicContact CB-CB 4.43Å; K52-D199 VanDerWaalsContact CE-OD1 3.31Å; K52-D199 WeakPolarHBondContact CE-OD1 3.37Å; K52-D199 VanDerWaalsContact NZ-CG 3.29Å; K52-D199 IonicContact NZ-OD1 2.62Å; K52-D199 PolarHBondContact NZ-OD1 2.62Å; K52-D199 IonicContact NZ-OD2 2.67Å; K52-D199 PolarHBondContact NZ-OD2 2.92Å
53	V	63.6	Low	68.7	Low	54 Å²	54	55.1 Å²	55.1	33%	0.327	30%	0.299	S	S	.	.			trans	-78.8	101.2	168	172.1	0	0	0	0	107.8	L55 K62 F273	V53-L55 PolarHBondContact O-N 2.8Å; V53-K62 WeakPolarHBondContact CA-O 3.39Å; V53-K62 HydrophobicContact CG1-CG 4.44Å; V53-K62 WeakPolarHBondContact CG1-O 3.49Å; V53-F273 HydrophobicContact CB-CE1 4.49Å; V53-F273 HydrophobicContact CB-CZ 4.34Å; V53-F273 HydrophobicContact CG1-CZ 4.26Å; V53-F273 HydrophobicContact CG2-CE1 3.84Å; V53-F273 HydrophobicContact CG2-CZ 3.94Å
54	S	57.7	Low	68.6	Low	8 Å²	8	55.1 Å²	55.1	6%	0.056	30%	0.299	C	S	.	.			trans	-90.9	105.6	-172.5	-166.3	0	0	0	0	111.5	K52 S56 Y900	K52-S54 PolarHBondContact O-N 2.87Å; S54-S56 PolarHBondContact O-N 2.87Å; S54-S56 VanDerWaalsContact OG-CB 3.29Å; S54-S56 WeakPolarHBondContact OG-CB 3.33Å; S54-S56 PolarHBondContact OG-N 2.78Å; S54-S56 PolarHBondContact OG-OG 2.78Å; S54-Y900 WeakPolarHBondContact OG-CE2 3.21Å; S54-Y900 PolarHBondContact OG-OH 3.49Å; S54-Y900 VanDerWaalsContact OG-OH 3.07Å
55	L	51	Low	69	Low	126 Å²	126	51.6 Å²	51.6	66%	0.66	28%	0.284	S	S	*	.			trans	-90	44.5	158.4	-75.3	173.7	0	0	0	110.5	V53 L198	V53-L55 PolarHBondContact O-N 2.8Å; L55-L198 HydrophobicContact CB-CD1 3.47Å; L55-L198 VanDerWaalsContact CB-CD1 3.47Å; L55-L198 HydrophobicContact CD1-CD1 4.28Å
56	S	50.1	Low	69.4	Low	25 Å²	25	46.7 Å²	46.7	18%	0.175	26%	0.26	C	S	.	.			trans	-58.6	142.5	170.6	44.5	0	0	0	0	110.3	S54 D58 G59	S54-S56 PolarHBondContact O-N 2.87Å; S54-S56 VanDerWaalsContact OG-CB 3.29Å; S54-S56 WeakPolarHBondContact OG-CB 3.33Å; S54-S56 PolarHBondContact OG-N 2.78Å; S54-S56 PolarHBondContact OG-OG 2.78Å; S56-D58 PolarHBondContact O-N 2.82Å; S56-G59 PolarHBondContact O-N 2.84Å
57	A	45.8	Very low	69.9	Low	95 Å²	95	46.6 Å²	46.6	79%	0.785	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-15.8	-165.2	0	0	0	0	0	116.1	G59	A57-G59 VanDerWaalsContact C-N 3.34Å
58	D	49.3	Very low	70.2	Confident	78 Å²	78	45.4 Å²	45.4	42%	0.417	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-4.6	174.8	-77.6	-75.4	0	0	0	114.6	R3 S56 K60	R3-D58 IonicContact CZ-OD2 3.41Å; R3-D58 VanDerWaalsContact NH1-CG 3.34Å; R3-D58 IonicContact NH1-OD1 2.67Å; R3-D58 PolarHBondContact NH1-OD1 2.89Å; R3-D58 IonicContact NH1-OD2 2.72Å; R3-D58 PolarHBondContact NH1-OD2 2.88Å; R3-D58 IonicContact NH2-OD2 2.75Å; R3-D58 PolarHBondContact NH2-OD2 2.9Å; S56-D58 PolarHBondContact O-N 2.82Å; D58-K60 WeakPolarHBondContact O-CD 3.29Å; D58-K60 WeakPolarHBondContact O-CG 3.32Å; D58-K60 PolarHBondContact O-N 3.26Å
59	G	53	Low	70.3	Confident	71 Å²	71	45 Å²	45	73%	0.732	25%	0.253	S	S	*	.			trans	68.5	19.3	158.9	0	0	0	0	0	118	S56 A57	S56-G59 PolarHBondContact O-N 2.84Å; A57-G59 VanDerWaalsContact C-N 3.34Å
60	K	60.1	Low	69.9	Low	157 Å²	157	49 Å²	49	68%	0.683	27%	0.268	S	S	*	.			trans	-113.3	-16.2	-166.8	-78	155.9	-171.3	158.5	0	117.1	D58	D58-K60 WeakPolarHBondContact O-CD 3.29Å; D58-K60 WeakPolarHBondContact O-CG 3.32Å; D58-K60 PolarHBondContact O-N 3.26Å
61	F	64.1	Low	69.6	Low	22 Å²	22	50 Å²	50	10%	0.096	28%	0.277	C	S	.	.			trans	-135	87.8	-174.5	-64.1	-79	0	0	0	111.7	Y63 C64 F902	F61-Y63 PolarHBondContact O-N 3.15Å; F61-C64 VanDerWaalsContact CB-SG 3.6Å; F61-C64 PolarHBondContact O-SG 2.91Å; F61-C64 VanDerWaalsContact O-SG 3.37Å; F61-F902 HydrophobicContact CD1-CE1 4.34Å; F61-F902 HydrophobicContact CD1-CZ 4.49Å; F61-F902 AromaticContact CE1-CD1 3.69Å; F61-F902 HydrophobicContact CE1-CD1 3.69Å; F61-F902 AromaticContact CE1-CD2 3.7Å; F61-F902 HydrophobicContact CE1-CD2 3.7Å; F61-F902 AromaticContact CE1-CE1 3.57Å; F61-F902 HydrophobicContact CE1-CE1 3.57Å; F61-F902 AromaticContact CE1-CE2 3.58Å; F61-F902 HydrophobicContact CE1-CE2 3.58Å; F61-F902 AromaticContact CE1-CG 3.75Å; F61-F902 HydrophobicContact CE1-CG 3.75Å; F61-F902 AromaticContact CE1-CZ 3.52Å; F61-F902 HydrophobicContact CE1-CZ 3.52Å; F61-F902 AromaticContact CZ-CD2 3.71Å; F61-F902 HydrophobicContact CZ-CD2 3.71Å; F61-F902 HydrophobicContact CZ-CE1 4.35Å; F61-F902 AromaticContact CZ-CE2 3.51Å; F61-F902 HydrophobicContact CZ-CE2 3.51Å; F61-F902 HydrophobicContact CZ-CG 4.22Å; F61-F902 AromaticContact CZ-CZ 3.86Å; F61-F902 HydrophobicContact CZ-CZ 3.86Å
62	K	75.6	Confident	69.6	Low	113 Å²	113	50.6 Å²	50.6	49%	0.491	28%	0.284	S	S	.	.	S	Bend	trans	-61.8	-32.9	174	-177.5	-176.3	169.2	-159.9	0	111.9	V53	V53-K62 WeakPolarHBondContact CA-O 3.39Å; V53-K62 HydrophobicContact CG1-CG 4.44Å; V53-K62 WeakPolarHBondContact CG1-O 3.49Å
63	Y	83.4	Confident	70	Confident	39 Å²	39	50.8 Å²	50.8	15%	0.153	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	109.5	-168.5	-59.1	-59.3	0	0	0	110.8	F61 C78 E81 Q84	F61-Y63 PolarHBondContact O-N 3.15Å; Y63-C78 PolarHBondContact O-N 3.04Å; Y63-E81 HydrophobicContact CD1-CB 3.99Å; Y63-E81 HydrophobicContact CD1-CG 3.95Å; Y63-E81 HydrophobicContact CE1-CB 3.51Å; Y63-E81 VanDerWaalsContact CE1-CD 3.44Å; Y63-E81 HydrophobicContact CE1-CG 3.46Å; Y63-E81 VanDerWaalsContact CE1-CG 3.46Å; Y63-E81 WeakPolarHBondContact CE1-OE2 3.22Å; Y63-E81 HydrophobicContact CE2-CB 4.2Å; Y63-E81 HydrophobicContact CG-CB 4.49Å; Y63-E81 PolarHBondContact OH-OE2 3.04Å; Y63-Q84 VanDerWaalsContact CD1-OE1 3.29Å
64	C	84.4	Confident	71	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	155.7	-177.9	-50.8	0	0	0	0	113.4	K52 F61 L76 Q84 Y900	K52-C64 PolarHBondContact N-O 3.32Å; K52-C64 CarbonylContact O-C 3.59Å; K52-C64 VanDerWaalsContact O-CB 3.25Å; K52-C64 WeakPolarHBondContact O-CB 3.44Å; K52-C64 PolarHBondContact O-N 2.82Å; K52-C64 VanDerWaalsContact O-O 3.1Å; F61-C64 VanDerWaalsContact CB-SG 3.6Å; F61-C64 PolarHBondContact O-SG 2.91Å; F61-C64 VanDerWaalsContact O-SG 3.37Å; C64-L76 CarbonylContact C-O 3.57Å; C64-L76 WeakPolarHBondContact CA-O 3.31Å; C64-L76 WeakPolarHBondContact CB-O 3.42Å; C64-Q84 PolarHBondContact O-NE2 3.43Å; C64-Y900 HydrophobicContact CB-CD1 3.45Å; C64-Y900 VanDerWaalsContact CB-CD1 3.45Å; C64-Y900 HydrophobicContact CB-CE1 3.44Å; C64-Y900 VanDerWaalsContact CB-CE1 3.44Å; C64-Y900 WeakPolarHBondContact SG-CD1 3.25Å; C64-Y900 VanDerWaalsContact SG-CE1 3.51Å
65	I	87.7	Confident	72.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.6	174.8	-51.3	172.1	0	0	0	107.9	I49 V67 L76 Q84 W87 L88 L91	I49-I65 HydrophobicContact CG2-CG2 3.47Å; I49-I65 VanDerWaalsContact CG2-CG2 3.47Å; I65-V67 HydrophobicContact CG2-CG2 4.43Å; I65-L76 HydrophobicContact CB-CB 4.26Å; I65-L76 PolarHBondContact N-O 3.24Å; I65-L76 PolarHBondContact O-N 3.47Å; I65-Q84 HydrophobicContact CD1-CG 4.47Å; I65-Q84 WeakPolarHBondContact CD1-O 3.36Å; I65-Q84 HydrophobicContact CG1-CG 3.9Å; I65-W87 HydrophobicContact CD1-CB 3.47Å; I65-W87 VanDerWaalsContact CD1-CB 3.47Å; I65-L88 HydrophobicContact CD1-CB 4.29Å; I65-L88 HydrophobicContact CG2-CD1 4.3Å; I65-L91 HydrophobicContact CD1-CD1 4.48Å; I65-L91 HydrophobicContact CG2-CD1 4.39Å
66	A	86	Confident	74	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	115.3	177.6	0	0	0	0	0	109.8	I49 N50 K52 Y68 L75	I49-A66 CarbonylContact C-O 3.56Å; I49-A66 WeakPolarHBondContact CA-O 3.19Å; N50-A66 PolarHBondContact N-O 3.19Å; N50-A66 PolarHBondContact O-N 2.85Å; K52-A66 HydrophobicContact CB-CB 4.43Å; A66-Y68 HydrophobicContact CB-CD2 4.36Å; A66-Y68 HydrophobicContact CB-CE2 3.55Å; A66-L75 HydrophobicContact CB-CD2 3.66Å
67	V	87.4	Confident	75.8	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	115.1	178.2	178.8	0	0	0	0	108.3	C46 I49 I65 C73 L74 L76 L91	C46-V67 HydrophobicContact CB-CG1 4.27Å; C46-V67 WeakPolarHBondContact SG-CG1 3.09Å; I49-V67 HydrophobicContact CD1-CG1 4.12Å; I49-V67 HydrophobicContact CD1-CG2 4.02Å; I49-V67 HydrophobicContact CG1-CB 4.36Å; I49-V67 HydrophobicContact CG1-CG1 4.09Å; I49-V67 HydrophobicContact CG1-CG2 4.13Å; I49-V67 HydrophobicContact CG2-CG2 4.14Å; I65-V67 HydrophobicContact CG2-CG2 4.43Å; V67-C73 WeakPolarHBondContact O-CA 3.47Å; V67-L74 HydrophobicContact CB-CB 4.26Å; V67-L74 PolarHBondContact N-O 2.92Å; V67-L74 PolarHBondContact O-N 3.35Å; V67-L76 HydrophobicContact CG2-CD1 4.39Å; V67-L91 HydrophobicContact CG2-CD1 4.47Å
68	Y	82	Confident	77.7	Confident	9 Å²	9	38 Å²	38	4%	0.035	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	116.9	-173	-65.7	-77.9	0	0	0	112	C46 F47 N48 N50 A66 C73 V115	C46-Y68 WeakPolarHBondContact CA-O 3.42Å; F47-Y68 PolarHBondContact N-O 3Å; N48-Y68 HydrophobicContact CB-CD2 4.46Å; N48-Y68 PolarHBondContact O-N 3.41Å; N48-Y68 WeakPolarHBondContact OD1-CD2 3.44Å; N50-Y68 HydrophobicContact CB-CE2 4.36Å; A66-Y68 HydrophobicContact CB-CD2 4.36Å; A66-Y68 HydrophobicContact CB-CE2 3.55Å; Y68-C73 HydrophobicContact CD1-CB 3.86Å; Y68-C73 HydrophobicContact CE1-CB 3.85Å; Y68-C73 WeakPolarHBondContact CE1-SG 3.29Å; Y68-V115 HydrophobicContact CD1-CG1 3.88Å; Y68-V115 HydrophobicContact CD2-CB 4.02Å; Y68-V115 HydrophobicContact CD2-CG1 3.93Å; Y68-V115 HydrophobicContact CE1-CG1 3.84Å; Y68-V115 HydrophobicContact CE2-CB 3.79Å; Y68-V115 HydrophobicContact CE2-CG1 3.9Å; Y68-V115 HydrophobicContact CG-CB 4.49Å; Y68-V115 HydrophobicContact CG-CG1 3.9Å; Y68-V115 PolarHBondContact OH-O 2.94Å; Y68-V115 VanDerWaalsContact OH-O 3.13Å
69	T	82.8	Confident	79.3	Confident	9 Å²	9	39.4 Å²	39.4	6%	0.055	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	177.2	170.4	73.6	0	0	0	0	110.8	V41 Q45 F47 S71 D72 R138	V41-T69 HydrophobicContact CG1-CG2 3.5Å; Q45-T69 WeakPolarHBondContact O-CA 3.5Å; F47-T69 WeakPolarHBondContact CE1-O 3.26Å; T69-S71 PolarHBondContact O-N 3.06Å; T69-S71 PolarHBondContact OG1-N 2.86Å; T69-S71 PolarHBondContact OG1-OG 2.84Å; T69-D72 PolarHBondContact N-O 3.31Å; T69-D72 VanDerWaalsContact N-O 3.09Å; T69-D72 PolarHBondContact OG1-N 2.66Å; T69-D72 PolarHBondContact OG1-O 3.01Å; T69-R138 PolarHBondContact O-NH1 2.6Å
70	Y	74.6	Confident	80.8	Confident	94 Å²	94	39.1 Å²	39.1	37%	0.369	19%	0.191	S	C	.	.	S	Bend	trans	-66.4	-19.9	174.5	-63.6	-79.9	0	0	0	114.7	Q45 F47 Q154	Q45-Y70 WeakPolarHBondContact O-CD2 3.48Å; F47-Y70 HydrophobicContact CD1-CD1 4.46Å; F47-Y70 HydrophobicContact CD1-CE1 4.47Å; Y70-Q154 HydrophobicContact CD1-CG 4.4Å; Y70-Q154 HydrophobicContact CG-CG 4.43Å
71	S	74.5	Confident	82.1	Confident	49 Å²	49	35.1 Å²	35.1	34%	0.343	18%	0.175	S	C	.	.	S	Bend	trans	-107.5	-39.6	-178.7	59.5	0	0	0	0	113.5	T69 V151	T69-S71 PolarHBondContact O-N 3.06Å; T69-S71 PolarHBondContact OG1-N 2.86Å; T69-S71 PolarHBondContact OG1-OG 2.84Å; S71-V151 WeakPolarHBondContact O-CG1 3.43Å
72	D	76.6	Confident	83.3	Confident	81 Å²	81	41.8 Å²	41.8	43%	0.433	21%	0.206	S	C	.	.			trans	-138.1	171.1	-160.7	-70.1	-82.9	0	0	0	112.2	T69 R138	T69-D72 PolarHBondContact N-O 3.31Å; T69-D72 VanDerWaalsContact N-O 3.09Å; T69-D72 PolarHBondContact OG1-N 2.66Å; T69-D72 PolarHBondContact OG1-O 3.01Å; D72-R138 PolarHBondContact O-NH1 2.92Å; D72-R138 PolarHBondContact O-NH2 2.93Å
73	C	79.3	Confident	83.9	Confident	36 Å²	36	37.3 Å²	37.3	24%	0.243	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.1	162.7	-175.1	0	0	0	0	108.7	V67 Y68	V67-C73 WeakPolarHBondContact O-CA 3.47Å; Y68-C73 HydrophobicContact CD1-CB 3.86Å; Y68-C73 HydrophobicContact CE1-CB 3.85Å; Y68-C73 WeakPolarHBondContact CE1-SG 3.29Å
74	L	85.3	Confident	84.2	Confident	21 Å²	21	35.5 Å²	35.5	11%	0.11	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	118.4	170.1	174.2	61.9	0	0	0	108.8	I22 L39 V41 V67 L76	I22-L74 HydrophobicContact CG2-CD2 3.99Å; L39-L74 HydrophobicContact CD2-CD1 3.96Å; L39-L74 HydrophobicContact CD2-CD2 4.28Å; V41-L74 HydrophobicContact CG2-CD2 4.22Å; V67-L74 HydrophobicContact CB-CB 4.26Å; V67-L74 PolarHBondContact N-O 2.92Å; V67-L74 PolarHBondContact O-N 3.35Å; L74-L76 HydrophobicContact CD1-CD2 4.38Å; L74-L76 HydrophobicContact CD2-CD2 4.13Å; L74-L76 HydrophobicContact CG-CD2 4.01Å
75	L	85.7	Confident	84.4	Confident	15 Å²	15	37.5 Å²	37.5	8%	0.079	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	102	-176.8	-65.7	168.3	0	0	0	110.1	A66 Y900	A66-L75 HydrophobicContact CB-CD2 3.66Å; L75-Y900 HydrophobicContact CB-CD1 3.64Å; L75-Y900 HydrophobicContact CB-CE1 3.81Å; L75-Y900 HydrophobicContact CB-CG 4.2Å; L75-Y900 HydrophobicContact CD1-CD1 4.42Å; L75-Y900 HydrophobicContact CD1-CE1 3.99Å; L75-Y900 HydrophobicContact CD1-CE2 4.11Å; L75-Y900 HydrophobicContact CD2-CD1 4.45Å; L75-Y900 HydrophobicContact CD2-CE1 3.75Å; L75-Y900 HydrophobicContact CG-CD1 4.39Å; L75-Y900 HydrophobicContact CG-CE1 4.06Å
76	L	87.3	Confident	84.5	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	137	173.3	-51.3	178	0	0	0	108.8	F9 I22 C64 I65 V67 L74 L91 V903	F9-L76 HydrophobicContact CD1-CD2 3.91Å; F9-L76 HydrophobicContact CE1-CD2 3.5Å; F9-L76 HydrophobicContact CE2-CD2 4.17Å; F9-L76 HydrophobicContact CG-CD2 4.4Å; F9-L76 HydrophobicContact CZ-CD2 3.65Å; I22-L76 HydrophobicContact CD1-CD1 3.74Å; I22-L76 HydrophobicContact CD1-CD2 4.02Å; C64-L76 CarbonylContact C-O 3.57Å; C64-L76 WeakPolarHBondContact CA-O 3.31Å; C64-L76 WeakPolarHBondContact CB-O 3.42Å; I65-L76 HydrophobicContact CB-CB 4.26Å; I65-L76 PolarHBondContact N-O 3.24Å; I65-L76 PolarHBondContact O-N 3.47Å; V67-L76 HydrophobicContact CG2-CD1 4.39Å; L74-L76 HydrophobicContact CD1-CD2 4.38Å; L74-L76 HydrophobicContact CD2-CD2 4.13Å; L74-L76 HydrophobicContact CG-CD2 4.01Å; L76-L91 HydrophobicContact CD1-CD1 3.99Å; L76-V903 HydrophobicContact CB-CG2 4.01Å
77	G	86	Confident	84.7	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	137.3	172.2	0	0	0	0	0	110.3	V901 F902 V903	G77-V901 WeakPolarHBondContact CA-O 3.4Å; G77-V901 PolarHBondContact N-O 3.33Å; G77-V901 VanDerWaalsContact O-O 3.11Å; G77-F902 CarbonylContact O-C 3.57Å; G77-F902 WeakPolarHBondContact O-CA 3.42Å; G77-V903 PolarHBondContact O-N 3.2Å
78	C	85.8	Confident	84.7	Confident	4 Å²	4	41 Å²	41	3%	0.027	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	151.5	-178.6	-58.9	0	0	0	0	110.2	Y63 E83 Q84	Y63-C78 PolarHBondContact O-N 3.04Å; C78-E83 WeakPolarHBondContact CA-OE2 3.2Å; C78-E83 HydrophobicContact CB-CB 4.25Å; C78-E83 HydrophobicContact CB-CG 4.09Å; C78-Q84 HydrophobicContact CB-CB 3.93Å
79	E	83.2	Confident	85	Confident	108 Å²	108	44.7 Å²	44.7	51%	0.505	23%	0.232	S	C	.	.	S	Bend	trans	-76.8	-31	177.5	-62	-168.1	-175.6	0	0	111.2	K6 E83 F902	K6-E79 IonicContact NZ-OE1 2.92Å; K6-E79 PolarHBondContact NZ-OE1 2.87Å; E79-E83 PolarHBondContact N-OE2 3.42Å; E79-F902 HydrophobicContact CG-CD1 3.49Å; E79-F902 VanDerWaalsContact CG-CD1 3.49Å; E79-F902 HydrophobicContact CG-CE1 3.73Å; E79-F902 WeakPolarHBondContact OE1-CD1 3.35Å
80	T	85.7	Confident	85.3	Confident	64 Å²	64	47.4 Å²	47.4	39%	0.393	25%	0.249	S	C	.	.	S	Bend	trans	-134.9	161	-178.4	68.6	0	0	0	0	112.6	Q82 E83 Q84	T80-Q82 VanDerWaalsContact C-N 3.27Å; T80-Q82 PolarHBondContact O-N 3.23Å; T80-E83 PolarHBondContact O-N 3.38Å; T80-E83 WeakPolarHBondContact OG1-CB 3.27Å; T80-E83 PolarHBondContact OG1-N 3.45Å; T80-Q84 WeakPolarHBondContact O-CB 3Å; T80-Q84 PolarHBondContact O-N 3.24Å
81	E	87.7	Confident	85.9	Confident	73 Å²	73	43 Å²	43	34%	0.341	23%	0.232	S	C	.	.	H	α-helix	trans	-65.1	-32.3	172.9	-154.6	159.5	162.8	0	0	112.5	Y63 Q84 E85	Y63-E81 HydrophobicContact CD1-CB 3.99Å; Y63-E81 HydrophobicContact CD1-CG 3.95Å; Y63-E81 HydrophobicContact CE1-CB 3.51Å; Y63-E81 VanDerWaalsContact CE1-CD 3.44Å; Y63-E81 HydrophobicContact CE1-CG 3.46Å; Y63-E81 VanDerWaalsContact CE1-CG 3.46Å; Y63-E81 WeakPolarHBondContact CE1-OE2 3.22Å; Y63-E81 HydrophobicContact CE2-CB 4.2Å; Y63-E81 HydrophobicContact CG-CB 4.49Å; Y63-E81 PolarHBondContact OH-OE2 3.04Å; E81-Q84 PolarHBondContact O-N 3.39Å; E81-E85 WeakPolarHBondContact O-CB 3.34Å; E81-E85 PolarHBondContact O-N 3.01Å
82	Q	88.7	Confident	86.4	Confident	162 Å²	162	42.2 Å²	42.2	76%	0.757	22%	0.224	S	C	*	.	H	α-helix	trans	-69.7	-41.9	177.5	-67.2	171.7	-17.5	0	0	111.1	T80 E85 A86	T80-Q82 VanDerWaalsContact C-N 3.27Å; T80-Q82 PolarHBondContact O-N 3.23Å; Q82-E85 PolarHBondContact O-N 2.92Å; Q82-A86 VanDerWaalsContact O-CB 3.3Å; Q82-A86 WeakPolarHBondContact O-CB 3.35Å; Q82-A86 PolarHBondContact O-N 2.89Å
83	E	88.4	Confident	86.7	Confident	20 Å²	20	40 Å²	40	9%	0.093	22%	0.219	C	C	.	.	H	α-helix	trans	-63.5	-44.3	171.2	179.9	-177.4	-147.5	0	0	111.1	C78 E79 T80 E85 A86 W87 C904 P905	C78-E83 WeakPolarHBondContact CA-OE2 3.2Å; C78-E83 HydrophobicContact CB-CB 4.25Å; C78-E83 HydrophobicContact CB-CG 4.09Å; E79-E83 PolarHBondContact N-OE2 3.42Å; T80-E83 PolarHBondContact O-N 3.38Å; T80-E83 WeakPolarHBondContact OG1-CB 3.27Å; T80-E83 PolarHBondContact OG1-N 3.45Å; E83-E85 VanDerWaalsContact C-N 3.32Å; E83-E85 PolarHBondContact O-N 3.36Å; E83-A86 PolarHBondContact O-N 3.47Å; E83-W87 WeakPolarHBondContact O-CB 3.1Å; E83-W87 PolarHBondContact O-N 2.88Å; E83-C904 WeakPolarHBondContact OE1-CA 3.28Å; E83-P905 WeakPolarHBondContact OE1-CD 3.43Å
84	Q	89.2	Confident	86.9	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.9	-43.2	177.6	-169.9	-165.6	21.7	0	0	111.9	K51 Y63 C64 I65 C78 T80 E81 L88	K51-Q84 VanDerWaalsContact CE-CD 3.46Å; K51-Q84 HydrophobicContact CG-CG 4.34Å; K51-Q84 VanDerWaalsContact CG-NE2 3.26Å; Y63-Q84 VanDerWaalsContact CD1-OE1 3.29Å; C64-Q84 PolarHBondContact O-NE2 3.43Å; I65-Q84 HydrophobicContact CD1-CG 4.47Å; I65-Q84 WeakPolarHBondContact CD1-O 3.36Å; I65-Q84 HydrophobicContact CG1-CG 3.9Å; C78-Q84 HydrophobicContact CB-CB 3.93Å; T80-Q84 WeakPolarHBondContact O-CB 3Å; T80-Q84 PolarHBondContact O-N 3.24Å; E81-Q84 PolarHBondContact O-N 3.39Å; Q84-L88 VanDerWaalsContact O-CB 3.26Å; Q84-L88 WeakPolarHBondContact O-CB 3.44Å; Q84-L88 PolarHBondContact O-N 2.94Å
85	E	88.5	Confident	86.6	Confident	42 Å²	42	38.5 Å²	38.5	20%	0.196	21%	0.209	C	C	.	.	H	α-helix	trans	-71.5	-44.8	178.3	-162.7	58.1	-130.7	0	0	111.6	K51 E81 Q82 E83 W87 L88 Q89	K51-E85 WeakPolarHBondContact CE-OE2 3.34Å; K51-E85 IonicContact NZ-OE2 2.66Å; K51-E85 PolarHBondContact NZ-OE2 2.97Å; E81-E85 WeakPolarHBondContact O-CB 3.34Å; E81-E85 PolarHBondContact O-N 3.01Å; Q82-E85 PolarHBondContact O-N 2.92Å; E83-E85 VanDerWaalsContact C-N 3.32Å; E83-E85 PolarHBondContact O-N 3.36Å; E85-W87 PolarHBondContact O-N 3.39Å; E85-L88 PolarHBondContact O-N 3.12Å; E85-L88 VanDerWaalsContact O-N 3.17Å; E85-Q89 HydrophobicContact CG-CG 4.39Å; E85-Q89 VanDerWaalsContact O-CG 3.31Å; E85-Q89 WeakPolarHBondContact O-CG 3.23Å; E85-Q89 PolarHBondContact O-N 3.33Å; E85-Q89 PolarHBondContact OE1-NE2 2.73Å
86	A	90.2	Very high	86.1	Confident	51 Å²	51	41.3 Å²	41.3	42%	0.421	23%	0.227	S	C	.	.	H	α-helix	trans	-56.7	-48.1	176.5	0	0	0	0	0	111.5	Q82 E83 L88 Q89 T90	Q82-A86 VanDerWaalsContact O-CB 3.3Å; Q82-A86 WeakPolarHBondContact O-CB 3.35Å; Q82-A86 PolarHBondContact O-N 2.89Å; E83-A86 PolarHBondContact O-N 3.47Å; A86-L88 PolarHBondContact O-N 3.02Å; A86-Q89 PolarHBondContact O-N 3.3Å; A86-T90 PolarHBondContact O-N 3.06Å; A86-T90 PolarHBondContact O-OG1 3.17Å
87	W	90.7	Very high	85.2	Confident	7 Å²	7	44.8 Å²	44.8	3%	0.027	25%	0.246	C	C	.	.	H	α-helix	trans	-64	-39.1	176.1	-88.8	95.8	0	0	0	113.3	F9 L11 I65 E83 E85 L91 V903 C904	F9-W87 HydrophobicContact CB-CH2 4.46Å; L11-W87 HydrophobicContact CB-CH2 4.35Å; L11-W87 HydrophobicContact CB-CZ3 3.98Å; L11-W87 HydrophobicContact CD2-CZ3 4.33Å; I65-W87 HydrophobicContact CD1-CB 3.47Å; I65-W87 VanDerWaalsContact CD1-CB 3.47Å; E83-W87 WeakPolarHBondContact O-CB 3.1Å; E83-W87 PolarHBondContact O-N 2.88Å; E85-W87 PolarHBondContact O-N 3.39Å; W87-L91 HydrophobicContact CE3-CD1 4.31Å; W87-L91 HydrophobicContact CE3-CG 4.33Å; W87-L91 VanDerWaalsContact O-CB 3.26Å; W87-L91 WeakPolarHBondContact O-CB 3.45Å; W87-L91 WeakPolarHBondContact O-CD1 3.26Å; W87-L91 VanDerWaalsContact O-CG 3.24Å; W87-L91 WeakPolarHBondContact O-CG 3.25Å; W87-L91 PolarHBondContact O-N 2.87Å; W87-V903 HydrophobicContact CD2-CG1 4.03Å; W87-V903 HydrophobicContact CH2-CG1 4.02Å; W87-V903 HydrophobicContact CZ2-CG1 3.3Å; W87-C904 WeakPolarHBondContact CZ2-O 3.42Å
88	L	87.2	Confident	84	Confident	15 Å²	15	45.1 Å²	45.1	8%	0.079	25%	0.248	C	C	.	.	H	α-helix	trans	-62.4	-49.5	176.7	-179.7	62.2	0	0	0	110.8	I49 K51 I65 Q84 E85 A86 T90 L91 L92	I49-L88 HydrophobicContact CG2-CD1 3.84Å; K51-L88 HydrophobicContact CB-CD2 3.99Å; K51-L88 HydrophobicContact CD-CD2 4.17Å; K51-L88 HydrophobicContact CG-CD2 4.33Å; I65-L88 HydrophobicContact CD1-CB 4.29Å; I65-L88 HydrophobicContact CG2-CD1 4.3Å; Q84-L88 VanDerWaalsContact O-CB 3.26Å; Q84-L88 WeakPolarHBondContact O-CB 3.44Å; Q84-L88 PolarHBondContact O-N 2.94Å; E85-L88 PolarHBondContact O-N 3.12Å; E85-L88 VanDerWaalsContact O-N 3.17Å; A86-L88 PolarHBondContact O-N 3.02Å; L88-T90 PolarHBondContact O-N 2.85Å; L88-L91 PolarHBondContact O-N 3.15Å; L88-L92 HydrophobicContact CD1-CD1 3.93Å; L88-L92 HydrophobicContact CD1-CG 4.23Å; L88-L92 HydrophobicContact CG-CD1 3.95Å; L88-L92 WeakPolarHBondContact O-CB 3.3Å; L88-L92 VanDerWaalsContact O-CG 3.25Å; L88-L92 WeakPolarHBondContact O-CG 3.43Å; L88-L92 PolarHBondContact O-N 3.19Å
89	Q	87.4	Confident	82.8	Confident	88 Å²	88	48 Å²	48	41%	0.411	26%	0.261	S	S	.	.	H	α-helix	trans	-63.5	-41.5	178.4	-62.5	-60.7	-30	0	0	111.8	E85 A86 L92 G93	E85-Q89 HydrophobicContact CG-CG 4.39Å; E85-Q89 VanDerWaalsContact O-CG 3.31Å; E85-Q89 WeakPolarHBondContact O-CG 3.23Å; E85-Q89 PolarHBondContact O-N 3.33Å; E85-Q89 PolarHBondContact OE1-NE2 2.73Å; A86-Q89 PolarHBondContact O-N 3.3Å; Q89-L92 PolarHBondContact O-N 3.32Å; Q89-G93 PolarHBondContact O-N 2.87Å
90	T	89.4	Confident	81.2	Confident	66 Å²	66	47.4 Å²	47.4	41%	0.405	27%	0.268	S	S	.	.	H	α-helix	trans	-66.1	-43.3	176.3	-47.2	0	0	0	0	112.1	L11 A86 L88 G93 V94	L11-T90 HydrophobicContact CD2-CG2 3.7Å; A86-T90 PolarHBondContact O-N 3.06Å; A86-T90 PolarHBondContact O-OG1 3.17Å; L88-T90 PolarHBondContact O-N 2.85Å; T90-G93 PolarHBondContact O-N 2.87Å; T90-V94 WeakPolarHBondContact O-CG2 3.42Å; T90-V94 PolarHBondContact O-N 2.86Å
91	L	88	Confident	79.4	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.3	-41.5	177.1	-77.9	166	0	0	0	112.1	L11 L43 I49 I65 V67 L76 W87 L88 L95	L11-L91 HydrophobicContact CD1-CD2 3.96Å; L11-L91 HydrophobicContact CD2-CD2 3.92Å; L11-L91 HydrophobicContact CD2-CG 4.24Å; L43-L91 HydrophobicContact CD2-CD2 4.34Å; I49-L91 HydrophobicContact CD1-CB 3.92Å; I49-L91 HydrophobicContact CD1-CD1 4.49Å; I49-L91 HydrophobicContact CD1-CD2 4.45Å; I65-L91 HydrophobicContact CD1-CD1 4.48Å; I65-L91 HydrophobicContact CG2-CD1 4.39Å; V67-L91 HydrophobicContact CG2-CD1 4.47Å; L76-L91 HydrophobicContact CD1-CD1 3.99Å; W87-L91 HydrophobicContact CE3-CD1 4.31Å; W87-L91 HydrophobicContact CE3-CG 4.33Å; W87-L91 VanDerWaalsContact O-CB 3.26Å; W87-L91 WeakPolarHBondContact O-CB 3.45Å; W87-L91 WeakPolarHBondContact O-CD1 3.26Å; W87-L91 VanDerWaalsContact O-CG 3.24Å; W87-L91 WeakPolarHBondContact O-CG 3.25Å; W87-L91 PolarHBondContact O-N 2.87Å; L88-L91 PolarHBondContact O-N 3.15Å; L91-L95 WeakPolarHBondContact O-CB 3.48Å; L91-L95 PolarHBondContact O-N 3.2Å
92	L	84.6	Confident	77	Confident	34 Å²	34	48 Å²	48	18%	0.178	29%	0.291	C	S	.	.	H	α-helix	trans	-67.7	-41.1	175.9	-70	172.8	0	0	0	111.8	I49 L88 Q89 L95 V96	I49-L92 HydrophobicContact CB-CD2 4.47Å; L88-L92 HydrophobicContact CD1-CD1 3.93Å; L88-L92 HydrophobicContact CD1-CG 4.23Å; L88-L92 HydrophobicContact CG-CD1 3.95Å; L88-L92 WeakPolarHBondContact O-CB 3.3Å; L88-L92 VanDerWaalsContact O-CG 3.25Å; L88-L92 WeakPolarHBondContact O-CG 3.43Å; L88-L92 PolarHBondContact O-N 3.19Å; Q89-L92 PolarHBondContact O-N 3.32Å; L92-L95 WeakPolarHBondContact O-CB 3.24Å; L92-L95 PolarHBondContact O-N 3Å; L92-V96 WeakPolarHBondContact O-CG2 3.41Å; L92-V96 PolarHBondContact O-N 2.66Å
93	G	82.8	Confident	74.6	Confident	33 Å²	33	43.2 Å²	43.2	34%	0.34	28%	0.276	S	S	.	.	H	α-helix	trans	-60.2	-47.2	175.5	0	0	0	0	0	112.6	Q89 T90 L95 V96 N97	Q89-G93 PolarHBondContact O-N 2.87Å; T90-G93 PolarHBondContact O-N 2.87Å; G93-L95 VanDerWaalsContact C-N 3.35Å; G93-L95 PolarHBondContact O-N 3.36Å; G93-V96 PolarHBondContact O-N 3.26Å; G93-N97 VanDerWaalsContact O-CG 3.29Å; G93-N97 PolarHBondContact O-N 2.76Å; G93-N97 PolarHBondContact O-OD1 2.91Å
94	V	83.4	Confident	72.4	Confident	12 Å²	12	46.6 Å²	46.6	7%	0.073	31%	0.308	C	S	.	.	H	α-helix	trans	-64.1	-40	175	177.7	0	0	0	0	111.2	L11 Q13 A20 L43 T90 V96 N97 T98	L11-V94 HydrophobicContact CD1-CG1 4.36Å; L11-V94 HydrophobicContact CD1-CG2 4.47Å; L11-V94 HydrophobicContact CD2-CG2 4.11Å; L11-V94 HydrophobicContact CG-CG2 4.3Å; Q13-V94 HydrophobicContact CB-CG1 4.47Å; A20-V94 HydrophobicContact CB-CG1 3.7Å; L43-V94 HydrophobicContact CD1-CB 4.17Å; L43-V94 HydrophobicContact CD1-CG1 3.67Å; T90-V94 WeakPolarHBondContact O-CG2 3.42Å; T90-V94 PolarHBondContact O-N 2.86Å; V94-V96 PolarHBondContact O-N 2.76Å; V94-N97 PolarHBondContact O-N 3.08Å; V94-T98 HydrophobicContact CG1-CG2 4.31Å; V94-T98 WeakPolarHBondContact O-CG2 3.25Å; V94-T98 PolarHBondContact O-N 2.82Å
95	L	79.5	Confident	70.2	Confident	14 Å²	14	51.1 Å²	51.1	7%	0.073	33%	0.332	C	S	.	.	H	α-helix	trans	-60.1	-44	174.6	-90.3	175.6	0	0	0	112.9	L43 C46 I49 L91 L92 G93 T98 Q99	L43-L95 HydrophobicContact CB-CD2 3.91Å; L43-L95 HydrophobicContact CB-CG 4.48Å; L43-L95 WeakPolarHBondContact O-CD2 3.43Å; C46-L95 HydrophobicContact CB-CD2 4.47Å; I49-L95 HydrophobicContact CD1-CD1 3.43Å; I49-L95 VanDerWaalsContact CD1-CD1 3.43Å; I49-L95 HydrophobicContact CD1-CG 4.38Å; I49-L95 HydrophobicContact CG1-CD1 3.79Å; L91-L95 WeakPolarHBondContact O-CB 3.48Å; L91-L95 PolarHBondContact O-N 3.2Å; L92-L95 WeakPolarHBondContact O-CB 3.24Å; L92-L95 PolarHBondContact O-N 3Å; G93-L95 VanDerWaalsContact C-N 3.35Å; G93-L95 PolarHBondContact O-N 3.36Å; L95-T98 PolarHBondContact O-N 2.97Å; L95-T98 PolarHBondContact O-OG1 2.96Å; L95-Q99 WeakPolarHBondContact O-CG 3.46Å; L95-Q99 PolarHBondContact O-N 3.29Å; L95-Q99 PolarHBondContact O-NE2 3.12Å
96	V	73.9	Confident	68	Low	75 Å²	75	50.9 Å²	50.9	46%	0.455	33%	0.332	S	S	.	.	H	α-helix	trans	-62.1	-46.6	176.8	170	0	0	0	0	110.2	L92 G93 V94 T98 Q99 S100	L92-V96 WeakPolarHBondContact O-CG2 3.41Å; L92-V96 PolarHBondContact O-N 2.66Å; G93-V96 PolarHBondContact O-N 3.26Å; V94-V96 PolarHBondContact O-N 2.76Å; V96-T98 PolarHBondContact O-N 3.3Å; V96-Q99 PolarHBondContact O-N 2.89Å; V96-S100 PolarHBondContact O-N 3.04Å; V96-S100 VanDerWaalsContact O-N 3.07Å
97	N	67.8	Low	65.5	Low	73 Å²	73	57.3 Å²	57.3	39%	0.39	35%	0.35	S	S	.	.	H	α-helix	trans	-60.5	-30.9	177.3	-67.5	-1.3	0	0	0	112.9	G93 V94 S100	G93-N97 VanDerWaalsContact O-CG 3.29Å; G93-N97 PolarHBondContact O-N 2.76Å; G93-N97 PolarHBondContact O-OD1 2.91Å; V94-N97 PolarHBondContact O-N 3.08Å; N97-S100 PolarHBondContact O-OG 3.05Å; N97-S100 VanDerWaalsContact O-OG 3.08Å
98	T	62.9	Low	63.1	Low	6 Å²	6	66.2 Å²	66.2	4%	0.037	38%	0.384	C	S	.	.	H	α-helix	trans	-79.4	-14.5	176.5	65.8	0	0	0	0	114.9	D14 A20 K44 V94 L95 V96 T101	D14-T98 HydrophobicContact CB-CG2 4.46Å; D14-T98 WeakPolarHBondContact OD2-CB 3.24Å; D14-T98 VanDerWaalsContact OD2-CG2 3.25Å; D14-T98 WeakPolarHBondContact OD2-CG2 3.35Å; A20-T98 HydrophobicContact CB-CG2 3.29Å; K44-T98 PolarHBondContact NZ-O 3.11Å; V94-T98 HydrophobicContact CG1-CG2 4.31Å; V94-T98 WeakPolarHBondContact O-CG2 3.25Å; V94-T98 PolarHBondContact O-N 2.82Å; L95-T98 PolarHBondContact O-N 2.97Å; L95-T98 PolarHBondContact O-OG1 2.96Å; V96-T98 PolarHBondContact O-N 3.3Å; T98-T101 PolarHBondContact O-OG1 3.47Å
99	Q	58.7	Low	61.4	Low	66 Å²	66	68.1 Å²	68.1	31%	0.308	39%	0.39	S	S	.	.	H	α-helix	trans	-99.6	-24.6	180	-75.5	167.8	96.3	0	0	112.4	L95 V96	L95-Q99 WeakPolarHBondContact O-CG 3.46Å; L95-Q99 PolarHBondContact O-N 3.29Å; L95-Q99 PolarHBondContact O-NE2 3.12Å; V96-Q99 PolarHBondContact O-N 2.89Å
100	S	51.2	Low	59.7	Low	94 Å²	94	66 Å²	66	66%	0.657	38%	0.384	S	S	*	.	H	α-helix	trans	-68.8	-25.3	167.7	53.2	0	0	0	0	112.2	V96 N97 G102	V96-S100 PolarHBondContact O-N 3.04Å; V96-S100 VanDerWaalsContact O-N 3.07Å; N97-S100 PolarHBondContact O-OG 3.05Å; N97-S100 VanDerWaalsContact O-OG 3.08Å; S100-G102 VanDerWaalsContact C-N 3.29Å; S100-G102 PolarHBondContact O-N 3.28Å
101	T	47.3	Very low	58.2	Low	77 Å²	77	65.7 Å²	65.7	47%	0.472	38%	0.384	S	S	.	.	S	Bend	trans	-78.3	66.6	176.2	57.3	0	0	0	0	113.8	K44 T98	K44-T101 PolarHBondContact NZ-OG1 2.89Å; T98-T101 PolarHBondContact O-OG1 3.47Å
102	G	36.7	Very low	57.4	Low	72 Å²	72	66.3 Å²	66.3	74%	0.742	39%	0.387	S	S	*	.	S	Bend	trans	85.1	58.6	144.1	0	0	0	0	0	119.4	S100	S100-G102 VanDerWaalsContact C-N 3.29Å; S100-G102 PolarHBondContact O-N 3.28Å
103	S	38.3	Very low	56.9	Low	62 Å²	62	68 Å²	68	43%	0.434	39%	0.394	S	S	.	.			trans	-150.5	135.6	148	-175.5	0	0	0	0	112.3	D105 D106	S103-D105 PolarHBondContact O-N 2.95Å; S103-D105 PolarHBondContact OG-N 3.08Å; S103-D106 PolarHBondContact O-N 2.95Å
104	A	42	Very low	56.8	Low	92 Å²	92	69.6 Å²	69.6	76%	0.76	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.6	172.6	0	0	0	0	0	113.2
105	D	44.5	Very low	57	Low	95 Å²	95	69.2 Å²	69.2	51%	0.508	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-14.4	-179.6	-143.3	43.3	0	0	0	113.4	S103 F107 R108	S103-D105 PolarHBondContact O-N 2.95Å; S103-D105 PolarHBondContact OG-N 3.08Å; D105-F107 PolarHBondContact O-N 2.94Å; D105-R108 VanDerWaalsContact O-CB 3.27Å; D105-R108 WeakPolarHBondContact O-CB 3.34Å; D105-R108 PolarHBondContact O-N 3.37Å; D105-R108 WeakPolarHBondContact OD1-CD 3.18Å; D105-R108 IonicContact OD1-CZ 2.74Å; D105-R108 IonicContact OD1-NE 3.53Å; D105-R108 PolarHBondContact OD1-NE 3.37Å; D105-R108 IonicContact OD1-NH2 3.11Å
106	D	42.5	Very low	57.4	Low	37 Å²	37	69.2 Å²	69.2	20%	0.198	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-65.2	-24	176.6	-86.3	-53.1	0	0	0	112.5	S103 R108 R109	S103-D106 PolarHBondContact O-N 2.95Å; D106-R108 PolarHBondContact O-N 3.37Å; D106-R109 PolarHBondContact O-N 3.22Å; D106-R109 VanDerWaalsContact O-N 3.1Å; D106-R109 IonicContact OD1-CZ 3.06Å; D106-R109 IonicContact OD1-NE 3.36Å; D106-R109 PolarHBondContact OD1-NE 3.29Å; D106-R109 IonicContact OD1-NH2 2.66Å; D106-R109 PolarHBondContact OD1-NH2 3.22Å
107	F	37.3	Very low	58.1	Low	185 Å²	185	68.2 Å²	68.2	81%	0.811	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-60.4	-8.3	167.4	-70.5	-74.2	0	0	0	114.3	D105	D105-F107 PolarHBondContact O-N 2.94Å
108	R	40.3	Very low	59.2	Low	195 Å²	195	64.9 Å²	64.9	74%	0.736	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-93.7	-7.2	174.4	-58.3	-165.1	-168.1	-115.5	0.5	114.7	D105 D106 P110	D105-R108 VanDerWaalsContact O-CB 3.27Å; D105-R108 WeakPolarHBondContact O-CB 3.34Å; D105-R108 PolarHBondContact O-N 3.37Å; D105-R108 WeakPolarHBondContact OD1-CD 3.18Å; D105-R108 IonicContact OD1-CZ 2.74Å; D105-R108 IonicContact OD1-NE 3.53Å; D105-R108 PolarHBondContact OD1-NE 3.37Å; D105-R108 IonicContact OD1-NH2 3.11Å; D106-R108 PolarHBondContact O-N 3.37Å; R108-P110 WeakPolarHBondContact O-CD 3.36Å; R108-P110 VanDerWaalsContact O-N 3.14Å
109	R	49.9	Very low	60.7	Low	54 Å²	54	68.3 Å²	68.3	20%	0.204	38%	0.378	C	S	.	.	S	Bend	trans	-60	117	174	-67.3	-171.2	-166	-126.3	-4.2	108.5	K44 C46 D106 C111	K44-R109 PolarHBondContact O-NH1 3.26Å; K44-R109 PolarHBondContact O-NH2 3.13Å; C46-R109 PolarHBondContact O-NH1 3.07Å; D106-R109 PolarHBondContact O-N 3.22Å; D106-R109 VanDerWaalsContact O-N 3.1Å; D106-R109 IonicContact OD1-CZ 3.06Å; D106-R109 IonicContact OD1-NE 3.36Å; D106-R109 PolarHBondContact OD1-NE 3.29Å; D106-R109 IonicContact OD1-NH2 2.66Å; D106-R109 PolarHBondContact OD1-NH2 3.22Å; R109-C111 PolarHBondContact O-N 2.85Å
110	P	51.7	Low	62.4	Low	44 Å²	44	65.3 Å²	65.3	29%	0.286	36%	0.364	S	S	.	.			trans	-70.5	122.8	-179.4	-14	29	0	0	0	108.7	R108 F112	R108-P110 WeakPolarHBondContact O-CD 3.36Å; R108-P110 VanDerWaalsContact O-N 3.14Å; P110-F112 VanDerWaalsContact C-N 3.3Å; P110-F112 HydrophobicContact CB-CD1 4.4Å; P110-F112 HydrophobicContact CB-CE1 3.78Å; P110-F112 HydrophobicContact CB-CE2 3.95Å; P110-F112 HydrophobicContact CB-CZ 3.53Å; P110-F112 HydrophobicContact CG-CE1 4.34Å; P110-F112 HydrophobicContact CG-CE2 4.17Å; P110-F112 HydrophobicContact CG-CZ 3.69Å; P110-F112 WeakPolarHBondContact O-CD2 3.41Å; P110-F112 VanDerWaalsContact O-CE2 3.3Å; P110-F112 WeakPolarHBondContact O-CE2 3.48Å; P110-F112 PolarHBondContact O-N 2.92Å
111	C	58.2	Low	64.3	Low	60 Å²	60	62.6 Å²	62.6	41%	0.405	34%	0.342	S	S	.	.			trans	-72.2	86.1	176.2	-60.7	0	0	0	0	109.6	R109 E113 C283	R109-C111 PolarHBondContact O-N 2.85Å; C111-E113 PolarHBondContact O-N 3.04Å; C111-C283 HydrophobicContact CB-CB 4.33Å
112	F	71.9	Confident	66.2	Low	13 Å²	13	66 Å²	66	6%	0.057	35%	0.35	C	S	.	.			trans	-71.2	124.5	173.4	-51.1	-73.4	0	0	0	109.6	F47 N48 P110 V115 C140 N142 Y147 Y149	F47-F112 AromaticContact CD2-CD2 3.55Å; F47-F112 HydrophobicContact CD2-CD2 3.55Å; F47-F112 AromaticContact CD2-CE2 3.49Å; F47-F112 HydrophobicContact CD2-CE2 3.49Å; F47-F112 VanDerWaalsContact CD2-CE2 3.49Å; F47-F112 AromaticContact CE2-CD2 3.57Å; F47-F112 HydrophobicContact CE2-CD2 3.57Å; F47-F112 AromaticContact CE2-CE2 3.58Å; F47-F112 HydrophobicContact CE2-CE2 3.58Å; N48-F112 PolarHBondContact ND2-O 2.75Å; P110-F112 VanDerWaalsContact C-N 3.3Å; P110-F112 HydrophobicContact CB-CD1 4.4Å; P110-F112 HydrophobicContact CB-CE1 3.78Å; P110-F112 HydrophobicContact CB-CE2 3.95Å; P110-F112 HydrophobicContact CB-CZ 3.53Å; P110-F112 HydrophobicContact CG-CE1 4.34Å; P110-F112 HydrophobicContact CG-CE2 4.17Å; P110-F112 HydrophobicContact CG-CZ 3.69Å; P110-F112 WeakPolarHBondContact O-CD2 3.41Å; P110-F112 VanDerWaalsContact O-CE2 3.3Å; P110-F112 WeakPolarHBondContact O-CE2 3.48Å; P110-F112 PolarHBondContact O-N 2.92Å; F112-V115 HydrophobicContact CB-CG2 3.71Å; F112-V115 HydrophobicContact CG-CG2 4.34Å; F112-C140 HydrophobicContact CB-CB 4.11Å; F112-C140 HydrophobicContact CD1-CB 3.1Å; F112-C140 HydrophobicContact CD2-CB 4.31Å; F112-C140 HydrophobicContact CE1-CB 3.47Å; F112-C140 VanDerWaalsContact CE1-CB 3.47Å; F112-C140 HydrophobicContact CG-CB 3.59Å; F112-C140 HydrophobicContact CZ-CB 4.21Å; F112-N142 WeakPolarHBondContact CA-OD1 3.38Å; F112-N142 WeakPolarHBondContact CD1-OD1 3.24Å; F112-Y147 HydrophobicContact CD1-CD2 4.27Å; F112-Y147 AromaticContact CE1-CD2 3.73Å; F112-Y147 HydrophobicContact CE1-CD2 3.73Å; F112-Y147 HydrophobicContact CE1-CE2 4.41Å; F112-Y147 AromaticContact CE1-CG 3.97Å; F112-Y147 HydrophobicContact CE1-CG 3.97Å; F112-Y149 AromaticContact CE1-CE2 3.79Å; F112-Y149 HydrophobicContact CE1-CE2 3.79Å; F112-Y149 HydrophobicContact CE2-CE2 4.35Å; F112-Y149 HydrophobicContact CZ-CD2 4.26Å; F112-Y149 AromaticContact CZ-CE2 3.36Å; F112-Y149 HydrophobicContact CZ-CE2 3.36Å; F112-Y149 AromaticContact CZ-CZ 3.8Å
113	E	73.4	Confident	68.2	Low	69 Å²	69	68.8 Å²	68.8	32%	0.322	35%	0.348	S	S	.	.	S	Bend	trans	-77.2	-36.3	176.5	-69.3	146	-151.7	0	0	110.2	C111 L141 S143	C111-E113 PolarHBondContact O-N 3.04Å; E113-L141 PolarHBondContact N-O 3.04Å; E113-S143 WeakPolarHBondContact OE1-CB 3.47Å; E113-S143 PolarHBondContact OE1-N 3.46Å; E113-S143 PolarHBondContact OE1-OG 2.79Å; E113-S143 PolarHBondContact OE2-N 2.99Å
114	H	82.3	Confident	70.4	Confident	66 Å²	66	70.2 Å²	70.2	31%	0.306	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	143.5	179.9	-53.6	-77.9	0	0	0	111.8	W116 C140 L141 T206	H114-W116 HydrophobicContact CB-CE3 4.18Å; H114-W116 HydrophobicContact CB-CH2 3.28Å; H114-W116 HydrophobicContact CB-CZ2 3.9Å; H114-W116 HydrophobicContact CB-CZ3 3.42Å; H114-W116 VanDerWaalsContact CB-CZ3 3.42Å; H114-C140 CarbonylContact O-C 3.47Å; H114-C140 WeakPolarHBondContact O-CA 3.49Å; H114-L141 HydrophobicContact CB-CB 4.45Å; H114-L141 PolarHBondContact N-O 3.21Å; H114-L141 PolarHBondContact O-N 3.27Å; H114-T206 HydrophobicContact CB-CG2 4.35Å; H114-T206 WeakPolarHBondContact CD2-CG2 3.25Å; H114-T206 WeakPolarHBondContact NE2-CG2 3.39Å
115	V	86.5	Confident	72.4	Confident	5 Å²	5	67.5 Å²	67.5	3%	0.03	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	133	-175.1	-179.8	0	0	0	0	109.3	N48 N50 Y68 F112 R138 F139 C140	N48-V115 HydrophobicContact CB-CG2 4.04Å; N48-V115 WeakPolarHBondContact OD1-CG2 3.36Å; N50-V115 PolarHBondContact ND2-N 3.49Å; Y68-V115 HydrophobicContact CD1-CG1 3.88Å; Y68-V115 HydrophobicContact CD2-CB 4.02Å; Y68-V115 HydrophobicContact CD2-CG1 3.93Å; Y68-V115 HydrophobicContact CE1-CG1 3.84Å; Y68-V115 HydrophobicContact CE2-CB 3.79Å; Y68-V115 HydrophobicContact CE2-CG1 3.9Å; Y68-V115 HydrophobicContact CG-CB 4.49Å; Y68-V115 HydrophobicContact CG-CG1 3.9Å; Y68-V115 PolarHBondContact OH-O 2.94Å; Y68-V115 VanDerWaalsContact OH-O 3.13Å; F112-V115 HydrophobicContact CB-CG2 3.71Å; F112-V115 HydrophobicContact CG-CG2 4.34Å; V115-R138 HydrophobicContact CG1-CG 3.4Å; V115-R138 VanDerWaalsContact CG1-CG 3.4Å; V115-F139 CarbonylContact C-O 3.42Å; V115-F139 WeakPolarHBondContact CA-O 3.25Å; V115-C140 HydrophobicContact CG2-CB 4.18Å
116	W	87.9	Confident	74.3	Confident	13 Å²	13	63.2 Å²	63.2	5%	0.049	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	146	176.6	-55.6	-102.6	0	0	0	110.3	H114 V118 F139 L141 N202 I203 T206	H114-W116 HydrophobicContact CB-CE3 4.18Å; H114-W116 HydrophobicContact CB-CH2 3.28Å; H114-W116 HydrophobicContact CB-CZ2 3.9Å; H114-W116 HydrophobicContact CB-CZ3 3.42Å; H114-W116 VanDerWaalsContact CB-CZ3 3.42Å; W116-V118 HydrophobicContact CB-CG1 4.4Å; W116-F139 AromaticContact CE3-CD1 3.66Å; W116-F139 HydrophobicContact CE3-CD1 3.66Å; W116-F139 HydrophobicContact CE3-CE1 4.22Å; W116-F139 AromaticContact CZ3-CD1 3.81Å; W116-F139 HydrophobicContact CZ3-CD1 3.81Å; W116-F139 AromaticContact CZ3-CE1 3.93Å; W116-F139 HydrophobicContact CZ3-CE1 3.93Å; W116-F139 PolarHBondContact N-O 2.97Å; W116-F139 PolarHBondContact O-N 3.18Å; W116-L141 HydrophobicContact CH2-CD2 4.15Å; W116-L141 HydrophobicContact CZ3-CB 3.99Å; W116-L141 HydrophobicContact CZ3-CD2 4.27Å; W116-N202 PolarHBondContact NE1-ND2 3.43Å; W116-I203 HydrophobicContact CB-CD1 4.14Å; W116-I203 HydrophobicContact CB-CG1 4.47Å; W116-I203 HydrophobicContact CD2-CD1 4.15Å; W116-I203 HydrophobicContact CD2-CG1 3.51Å; W116-I203 HydrophobicContact CE3-CG1 4.04Å; W116-I203 HydrophobicContact CG-CD1 3.92Å; W116-I203 HydrophobicContact CG-CG1 3.75Å; W116-I203 HydrophobicContact CH2-CG1 4.22Å; W116-I203 HydrophobicContact CZ2-CB 4.37Å; W116-I203 HydrophobicContact CZ2-CG1 3.79Å; W116-I203 HydrophobicContact CZ3-CG1 4.36Å; W116-T206 HydrophobicContact CH2-CG2 3.92Å; W116-T206 HydrophobicContact CZ2-CG2 4.33Å
117	D	88.5	Confident	76.3	Confident	54 Å²	54	61.5 Å²	61.5	29%	0.289	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	126	170.7	-76.9	-47.9	0	0	0	110.6	R138	D117-R138 VanDerWaalsContact CG-NH2 3.32Å; D117-R138 IonicContact OD1-CZ 3.28Å; D117-R138 IonicContact OD1-NE 2.66Å; D117-R138 PolarHBondContact OD1-NE 2.91Å; D117-R138 IonicContact OD1-NH2 2.73Å; D117-R138 PolarHBondContact OD1-NH2 2.89Å; D117-R138 VanDerWaalsContact OD1-NH2 3.11Å; D117-R138 IonicContact OD2-CZ 3.51Å; D117-R138 IonicContact OD2-NE 3.92Å; D117-R138 IonicContact OD2-NH2 2.75Å; D117-R138 PolarHBondContact OD2-NH2 2.85Å
118	V	92.1	Very high	78.5	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.018	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	151	-174.4	-56.1	0	0	0	0	111.9	W116 I120 F137 F139 M192 T194 I203	W116-V118 HydrophobicContact CB-CG1 4.4Å; V118-I120 HydrophobicContact CG2-CG1 4.47Å; V118-F137 HydrophobicContact CG2-CB 4.36Å; V118-F137 WeakPolarHBondContact CG2-O 3.35Å; V118-F137 PolarHBondContact N-O 3.36Å; V118-F137 PolarHBondContact O-N 3.33Å; V118-F139 HydrophobicContact CG1-CB 3.95Å; V118-F139 HydrophobicContact CG2-CB 3.83Å; V118-M192 HydrophobicContact CB-CB 4.18Å; V118-M192 HydrophobicContact CB-CG 4.09Å; V118-M192 HydrophobicContact CB-SD 4.12Å; V118-M192 HydrophobicContact CG1-CG 4.38Å; V118-M192 HydrophobicContact CG1-SD 4.19Å; V118-M192 HydrophobicContact CG2-CB 4.31Å; V118-M192 HydrophobicContact CG2-CG 4.33Å; V118-M192 HydrophobicContact CG2-SD 3.85Å; V118-T194 HydrophobicContact CG1-CG2 4.46Å; V118-I203 HydrophobicContact CG1-CD1 4.29Å
119	K	93.4	Very high	80.5	Confident	78 Å²	78	58.1 Å²	58.1	34%	0.339	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	96.5	-179.6	-179.5	-170.7	174.5	-168	0	110.1	L121 G135 F136 M192 N193	K119-L121 PolarHBondContact O-N 2.88Å; K119-G135 CarbonylContact C-O 3.54Å; K119-G135 WeakPolarHBondContact CA-O 3.49Å; K119-F136 HydrophobicContact CB-CD1 4.09Å; K119-F136 HydrophobicContact CB-CE1 3.92Å; K119-F136 HydrophobicContact CB-CZ 4.46Å; K119-F136 HydrophobicContact CD-CE1 3.84Å; K119-F136 HydrophobicContact CD-CE2 4.45Å; K119-F136 HydrophobicContact CD-CZ 3.68Å; K119-F136 HydrophobicContact CG-CD1 4.26Å; K119-F136 HydrophobicContact CG-CE1 3.86Å; K119-F136 HydrophobicContact CG-CE2 4.33Å; K119-F136 HydrophobicContact CG-CZ 3.89Å; K119-M192 WeakPolarHBondContact O-CA 3.2Å; K119-N193 HydrophobicContact CB-CB 4.3Å; K119-N193 PolarHBondContact N-O 3.03Å; K119-N193 PolarHBondContact O-N 2.87Å
120	I	93.7	Very high	82.1	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.021	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	126	-179.3	-48.7	179.9	0	0	0	109.5	V118 T127 L133 G135 F137 F148 L190 M192	V118-I120 HydrophobicContact CG2-CG1 4.47Å; I120-T127 HydrophobicContact CG2-CG2 3.73Å; I120-L133 WeakPolarHBondContact CB-O 3.05Å; I120-L133 WeakPolarHBondContact CD1-O 3.35Å; I120-L133 VanDerWaalsContact CG2-O 3.25Å; I120-L133 WeakPolarHBondContact CG2-O 3.44Å; I120-G135 PolarHBondContact N-O 3.04Å; I120-G135 PolarHBondContact O-N 2.8Å; I120-F137 HydrophobicContact CB-CD2 4.36Å; I120-F137 HydrophobicContact CD1-CB 4.01Å; I120-F137 HydrophobicContact CD1-CD1 4.34Å; I120-F137 HydrophobicContact CD1-CD2 3.51Å; I120-F137 HydrophobicContact CD1-CE2 4.03Å; I120-F137 HydrophobicContact CD1-CG 3.7Å; I120-F137 HydrophobicContact CG1-CB 4.29Å; I120-F137 HydrophobicContact CG1-CD2 3.84Å; I120-F137 HydrophobicContact CG1-CG 4.27Å; I120-F148 HydrophobicContact CD1-CD1 3.57Å; I120-F148 HydrophobicContact CD1-CE1 3.8Å; I120-F148 HydrophobicContact CD1-CG 4.34Å; I120-F148 HydrophobicContact CG1-CD1 4.47Å; I120-F148 HydrophobicContact CG1-CE1 4.45Å; I120-L190 HydrophobicContact CG2-CD2 4.31Å; I120-M192 HydrophobicContact CG1-CB 4.17Å
121	L	92.1	Very high	83.7	Confident	37 Å²	37	59.5 Å²	59.5	19%	0.194	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-71.8	135.9	-174.7	-61.5	-177.6	0	0	0	111.4	K119 K124 T127 M174 W191 N193	K119-L121 PolarHBondContact O-N 2.88Å; L121-K124 HydrophobicContact CB-CD 4.21Å; L121-K124 HydrophobicContact CD1-CD 3.87Å; L121-T127 WeakPolarHBondContact O-CG2 3.29Å; L121-T127 PolarHBondContact O-OG1 2.86Å; L121-M174 HydrophobicContact CD1-SD 4.15Å; L121-W191 WeakPolarHBondContact CB-O 3.46Å; L121-W191 HydrophobicContact CD1-CB 4.12Å; L121-W191 PolarHBondContact N-O 2.75Å; L121-N193 HydrophobicContact CD2-CB 4.4Å
122	K	87.4	Confident	84.9	Confident	149 Å²	149	63.4 Å²	63.4	65%	0.648	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	146.8	173.6	-71.7	-178.2	177	-165.2	0	110.7	K124 A134	K122-K124 VanDerWaalsContact C-N 3.31Å; K122-K124 PolarHBondContact O-N 2.82Å; K122-A134 HydrophobicContact CB-CB 4.27Å; K122-A134 WeakPolarHBondContact CE-O 3.37Å; K122-A134 HydrophobicContact CG-CB 3.47Å; K122-A134 VanDerWaalsContact CG-CB 3.47Å
123	N	79.2	Confident	85.6	Confident	130 Å²	130	62.8 Å²	62.8	70%	0.695	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	38.4	172.5	-51.9	8.6	0	0	0	113.8	T127	N123-T127 PolarHBondContact N-OG1 3.11Å; N123-T127 VanDerWaalsContact N-OG1 3.15Å
124	K	83.8	Confident	86.4	Confident	91 Å²	91	60 Å²	60	40%	0.396	30%	0.3	S	S	.	.	S	Bend	trans	-130.9	124.5	172.4	-73.3	-166.4	177.8	-173.5	0	110.6	L121 K122 I126 T127 W191	L121-K124 HydrophobicContact CB-CD 4.21Å; L121-K124 HydrophobicContact CD1-CD 3.87Å; K122-K124 VanDerWaalsContact C-N 3.31Å; K122-K124 PolarHBondContact O-N 2.82Å; K124-I126 PolarHBondContact O-N 2.79Å; K124-T127 PolarHBondContact N-OG1 2.73Å; K124-T127 PolarHBondContact O-N 2.74Å; K124-T127 PolarHBondContact O-OG1 2.77Å; K124-W191 HydrophobicContact CB-CB 4.42Å; K124-W191 HydrophobicContact CD-CB 4.11Å; K124-W191 HydrophobicContact CD-CG 4.23Å
125	G	84.2	Confident	86.8	Confident	35 Å²	35	58 Å²	58	36%	0.361	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	-118.4	175.6	0	0	0	0	0	112.6	T127 E128 E189	G125-T127 PolarHBondContact O-N 3.3Å; G125-E128 WeakPolarHBondContact O-CB 3.28Å; G125-E128 PolarHBondContact O-N 3.31Å; G125-E189 CarbonylContact C-O 3.52Å; G125-E189 WeakPolarHBondContact CA-O 3.44Å
126	I	84.5	Confident	87	Confident	6 Å²	6	62 Å²	62	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-61.9	-33.1	-177.6	-52	-178.7	0	0	0	111.4	K124 E128 K129 T130 L133 V179 T185 E189 L190	K124-I126 PolarHBondContact O-N 2.79Å; I126-E128 PolarHBondContact O-N 3.45Å; I126-K129 PolarHBondContact O-N 2.96Å; I126-T130 PolarHBondContact O-N 2.66Å; I126-L133 HydrophobicContact CG2-CD1 3.89Å; I126-V179 HydrophobicContact CD1-CG2 3.53Å; I126-T185 HydrophobicContact CG2-CG2 3.99Å; I126-E189 PolarHBondContact N-O 3.33Å; I126-L190 HydrophobicContact CB-CD2 3.89Å; I126-L190 HydrophobicContact CD1-CD1 4.47Å; I126-L190 HydrophobicContact CD1-CD2 4.1Å; I126-L190 HydrophobicContact CD1-CG 3.84Å; I126-L190 HydrophobicContact CG1-CD2 4.33Å; I126-L190 HydrophobicContact CG1-CG 4.42Å
127	T	84.1	Confident	87.1	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.006	31%	0.312	C	S	.	.	H	α-helix	trans	-72.1	-11.9	-173.4	69.5	0	0	0	0	113.9	I120 L121 N123 K124 G125 T130 P131 L133 A134 L190	I120-T127 HydrophobicContact CG2-CG2 3.73Å; L121-T127 WeakPolarHBondContact O-CG2 3.29Å; L121-T127 PolarHBondContact O-OG1 2.86Å; N123-T127 PolarHBondContact N-OG1 3.11Å; N123-T127 VanDerWaalsContact N-OG1 3.15Å; K124-T127 PolarHBondContact N-OG1 2.73Å; K124-T127 PolarHBondContact O-N 2.74Å; K124-T127 PolarHBondContact O-OG1 2.77Å; G125-T127 PolarHBondContact O-N 3.3Å; T127-T130 CarbonylContact O-C 3.51Å; T127-P131 WeakPolarHBondContact O-CA 3.34Å; T127-L133 HydrophobicContact CG2-CB 4.15Å; T127-A134 HydrophobicContact CG2-CB 4Å; T127-L190 HydrophobicContact CG2-CD2 4.09Å
128	E	83.2	Confident	87.1	Confident	144 Å²	144	59.4 Å²	59.4	67%	0.673	30%	0.3	S	S	*	.	H	α-helix	trans	-66.9	-44	167.7	-175.4	-174.6	-167.8	0	0	111.4	G125 I126	G125-E128 WeakPolarHBondContact O-CB 3.28Å; G125-E128 PolarHBondContact O-N 3.31Å; I126-E128 PolarHBondContact O-N 3.45Å
129	K	82.5	Confident	87	Confident	164 Å²	164	59.2 Å²	59.2	71%	0.713	30%	0.299	S	S	*	.	H	α-helix	trans	-85	-28.4	179.8	-62.1	177.1	-175.9	173.7	0	112.5	I126	I126-K129 PolarHBondContact O-N 2.96Å
130	T	84.6	Confident	86.9	Confident	39 Å²	39	55.5 Å²	55.5	24%	0.239	28%	0.283	C	S	.	.			trans	-129	76.5	-176.8	-51.1	0	0	0	0	109.6	I126 T127 K132 L133	I126-T130 PolarHBondContact O-N 2.66Å; T127-T130 CarbonylContact O-C 3.51Å; T130-K132 HydrophobicContact CG2-CB 4.41Å; T130-K132 PolarHBondContact O-N 2.91Å; T130-L133 HydrophobicContact CG2-CB 4.39Å; T130-L133 HydrophobicContact CG2-CD1 3.88Å; T130-L133 HydrophobicContact CG2-CG 4.16Å; T130-L133 WeakPolarHBondContact O-CB 3.24Å; T130-L133 PolarHBondContact O-N 2.99Å
131	P	84.2	Confident	86.7	Confident	89 Å²	89	55.3 Å²	55.3	58%	0.578	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-64	-14.8	-178	25	-34.9	0	0	0	113.9	T127 L133 A134	T127-P131 WeakPolarHBondContact O-CA 3.34Å; P131-L133 PolarHBondContact O-N 3.47Å; P131-A134 PolarHBondContact O-N 2.88Å
132	K	84.2	Confident	86.4	Confident	141 Å²	141	54 Å²	54	61%	0.613	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-60.6	-30.6	169.6	-68	-166.1	175.5	-164.9	0	113.1	T130 A134 Y158	T130-K132 HydrophobicContact CG2-CB 4.41Å; T130-K132 PolarHBondContact O-N 2.91Å; K132-A134 PolarHBondContact O-N 3.13Å; K132-Y158 VanDerWaalsContact CB-OH 3.28Å; K132-Y158 WeakPolarHBondContact CB-OH 3.49Å
133	L	86.7	Confident	86.1	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-75.5	7.5	179	-91	164.1	0	0	0	114	I120 I126 T127 T130 P131 F137 Y158 T185 L190	I120-L133 WeakPolarHBondContact CB-O 3.05Å; I120-L133 WeakPolarHBondContact CD1-O 3.35Å; I120-L133 VanDerWaalsContact CG2-O 3.25Å; I120-L133 WeakPolarHBondContact CG2-O 3.44Å; I126-L133 HydrophobicContact CG2-CD1 3.89Å; T127-L133 HydrophobicContact CG2-CB 4.15Å; T130-L133 HydrophobicContact CG2-CB 4.39Å; T130-L133 HydrophobicContact CG2-CD1 3.88Å; T130-L133 HydrophobicContact CG2-CG 4.16Å; T130-L133 WeakPolarHBondContact O-CB 3.24Å; T130-L133 PolarHBondContact O-N 2.99Å; P131-L133 PolarHBondContact O-N 3.47Å; L133-F137 WeakPolarHBondContact O-CE2 3.39Å; L133-Y158 HydrophobicContact CD1-CD1 4.35Å; L133-Y158 HydrophobicContact CD1-CE1 4.28Å; L133-Y158 HydrophobicContact CD2-CD1 3.94Å; L133-Y158 HydrophobicContact CD2-CD2 3.41Å; L133-Y158 VanDerWaalsContact CD2-CD2 3.41Å; L133-Y158 HydrophobicContact CD2-CE1 4.19Å; L133-Y158 HydrophobicContact CD2-CE2 3.69Å; L133-Y158 HydrophobicContact CD2-CG 3.54Å; L133-Y158 HydrophobicContact CG-CD1 4.15Å; L133-Y158 HydrophobicContact CG-CD2 4.11Å; L133-Y158 HydrophobicContact CG-CE1 3.94Å; L133-Y158 HydrophobicContact CG-CE2 3.89Å; L133-Y158 HydrophobicContact CG-CG 4.22Å; L133-T185 HydrophobicContact CD1-CG2 3.77Å; L133-L190 HydrophobicContact CD1-CD2 4.42Å
134	A	89.6	Confident	86.3	Confident	12 Å²	12	44.3 Å²	44.3	10%	0.099	24%	0.236	C	C	.	.			trans	-122.3	113.6	-172.5	0	0	0	0	0	113.6	K122 T127 P131 K132	K122-A134 HydrophobicContact CB-CB 4.27Å; K122-A134 WeakPolarHBondContact CE-O 3.37Å; K122-A134 HydrophobicContact CG-CB 3.47Å; K122-A134 VanDerWaalsContact CG-CB 3.47Å; T127-A134 HydrophobicContact CG2-CB 4Å; P131-A134 PolarHBondContact O-N 2.88Å; K132-A134 PolarHBondContact O-N 3.13Å
135	G	90.1	Very high	86.6	Confident	23 Å²	23	40 Å²	40	24%	0.237	22%	0.217	C	C	.	.	S	Bend	trans	168.2	-153.9	-170.8	0	0	0	0	0	111.1	K119 I120	K119-G135 CarbonylContact C-O 3.54Å; K119-G135 WeakPolarHBondContact CA-O 3.49Å; I120-G135 PolarHBondContact N-O 3.04Å; I120-G135 PolarHBondContact O-N 2.8Å
136	F	90.4	Very high	86.9	Confident	88 Å²	88	38.4 Å²	38.4	39%	0.386	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	127.6	168.6	-68.7	-92.6	0	0	0	108.7	K119 V151 R895	K119-F136 HydrophobicContact CB-CD1 4.09Å; K119-F136 HydrophobicContact CB-CE1 3.92Å; K119-F136 HydrophobicContact CB-CZ 4.46Å; K119-F136 HydrophobicContact CD-CE1 3.84Å; K119-F136 HydrophobicContact CD-CE2 4.45Å; K119-F136 HydrophobicContact CD-CZ 3.68Å; K119-F136 HydrophobicContact CG-CD1 4.26Å; K119-F136 HydrophobicContact CG-CE1 3.86Å; K119-F136 HydrophobicContact CG-CE2 4.33Å; K119-F136 HydrophobicContact CG-CZ 3.89Å; F136-V151 HydrophobicContact CB-CB 4.44Å; F136-V151 HydrophobicContact CB-CG2 4.23Å; F136-V151 PolarHBondContact O-N 3.2Å; F136-R895 HydrophobicContact CE2-CG 4.39Å; F136-R895 VanDerWaalsContact CE2-NE 3.34Å; F136-R895 HydrophobicContact CZ-CG 4.19Å; F136-R895 VanDerWaalsContact CZ-NE 3.35Å
137	F	90.3	Very high	87.2	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.009	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	144.1	-179	-76.1	-99	0	0	0	109	V118 I120 L133 F148 Y149 K150 Y158	V118-F137 HydrophobicContact CG2-CB 4.36Å; V118-F137 WeakPolarHBondContact CG2-O 3.35Å; V118-F137 PolarHBondContact N-O 3.36Å; V118-F137 PolarHBondContact O-N 3.33Å; I120-F137 HydrophobicContact CB-CD2 4.36Å; I120-F137 HydrophobicContact CD1-CB 4.01Å; I120-F137 HydrophobicContact CD1-CD1 4.34Å; I120-F137 HydrophobicContact CD1-CD2 3.51Å; I120-F137 HydrophobicContact CD1-CE2 4.03Å; I120-F137 HydrophobicContact CD1-CG 3.7Å; I120-F137 HydrophobicContact CG1-CB 4.29Å; I120-F137 HydrophobicContact CG1-CD2 3.84Å; I120-F137 HydrophobicContact CG1-CG 4.27Å; L133-F137 WeakPolarHBondContact O-CE2 3.39Å; F137-F148 HydrophobicContact CB-CB 4.46Å; F137-F148 HydrophobicContact CB-CD1 4.34Å; F137-F148 HydrophobicContact CD1-CB 3.79Å; F137-F148 HydrophobicContact CE1-CB 4.46Å; F137-F148 HydrophobicContact CG-CB 4.43Å; F137-Y149 CarbonylContact C-O 3.56Å; F137-Y149 WeakPolarHBondContact CA-O 3.36Å; F137-K150 HydrophobicContact CD1-CB 3.92Å; F137-K150 HydrophobicContact CE1-CB 3.53Å; F137-K150 HydrophobicContact CE1-CG 4.17Å; F137-K150 HydrophobicContact CZ-CB 4.01Å; F137-K150 HydrophobicContact CZ-CD 4.48Å; F137-K150 HydrophobicContact CZ-CG 4.13Å; F137-Y158 HydrophobicContact CE1-CD2 4.06Å; F137-Y158 HydrophobicContact CE1-CE2 4.14Å; F137-Y158 HydrophobicContact CZ-CE2 4.42Å
138	R	88.5	Confident	87.5	Confident	11 Å²	11	39.1 Å²	39.1	4%	0.042	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	112.2	166.4	-166.9	152.4	-72.8	172.2	-6.7	107.4	F47 T69 D72 V115 D117 F148 Y149	F47-R138 HydrophobicContact CZ-CG 4.28Å; T69-R138 PolarHBondContact O-NH1 2.6Å; D72-R138 PolarHBondContact O-NH1 2.92Å; D72-R138 PolarHBondContact O-NH2 2.93Å; V115-R138 HydrophobicContact CG1-CG 3.4Å; V115-R138 VanDerWaalsContact CG1-CG 3.4Å; D117-R138 VanDerWaalsContact CG-NH2 3.32Å; D117-R138 IonicContact OD1-CZ 3.28Å; D117-R138 IonicContact OD1-NE 2.66Å; D117-R138 PolarHBondContact OD1-NE 2.91Å; D117-R138 IonicContact OD1-NH2 2.73Å; D117-R138 PolarHBondContact OD1-NH2 2.89Å; D117-R138 VanDerWaalsContact OD1-NH2 3.11Å; D117-R138 IonicContact OD2-CZ 3.51Å; D117-R138 IonicContact OD2-NE 3.92Å; D117-R138 IonicContact OD2-NH2 2.75Å; D117-R138 PolarHBondContact OD2-NH2 2.85Å; R138-F148 WeakPolarHBondContact O-CA 3.11Å; R138-Y149 PolarHBondContact N-O 2.66Å; R138-Y149 PolarHBondContact O-N 3.35Å
139	F	91.3	Very high	87.7	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	115.4	174.1	-175.5	-75.3	0	0	0	107.3	V115 W116 V118 L141 V146 F148 F175 M192 I203 M207	V115-F139 CarbonylContact C-O 3.42Å; V115-F139 WeakPolarHBondContact CA-O 3.25Å; W116-F139 AromaticContact CE3-CD1 3.66Å; W116-F139 HydrophobicContact CE3-CD1 3.66Å; W116-F139 HydrophobicContact CE3-CE1 4.22Å; W116-F139 AromaticContact CZ3-CD1 3.81Å; W116-F139 HydrophobicContact CZ3-CD1 3.81Å; W116-F139 AromaticContact CZ3-CE1 3.93Å; W116-F139 HydrophobicContact CZ3-CE1 3.93Å; W116-F139 PolarHBondContact N-O 2.97Å; W116-F139 PolarHBondContact O-N 3.18Å; V118-F139 HydrophobicContact CG1-CB 3.95Å; V118-F139 HydrophobicContact CG2-CB 3.83Å; F139-L141 HydrophobicContact CE1-CB 4.25Å; F139-V146 HydrophobicContact CD2-CG1 4.23Å; F139-V146 HydrophobicContact CE1-CG1 4.2Å; F139-V146 HydrophobicContact CE2-CG1 3.69Å; F139-V146 HydrophobicContact CZ-CG1 3.68Å; F139-V146 HydrophobicContact CZ-CG2 4.16Å; F139-F148 HydrophobicContact CD2-CD1 4.1Å; F139-F148 AromaticContact CD2-CE1 3.45Å; F139-F148 HydrophobicContact CD2-CE1 3.45Å; F139-F148 VanDerWaalsContact CD2-CE1 3.45Å; F139-F148 AromaticContact CD2-CZ 3.7Å; F139-F148 HydrophobicContact CD2-CZ 3.7Å; F139-F148 AromaticContact CE2-CE1 4Å; F139-F148 HydrophobicContact CE2-CE1 4Å; F139-F148 HydrophobicContact CE2-CE2 4.49Å; F139-F148 AromaticContact CE2-CZ 3.75Å; F139-F148 HydrophobicContact CE2-CZ 3.75Å; F139-F148 HydrophobicContact CG-CE1 4.49Å; F139-F175 HydrophobicContact CE2-CE1 4.27Å; F139-F175 HydrophobicContact CZ-CE1 4.35Å; F139-M192 HydrophobicContact CD2-CE 4.42Å; F139-M192 HydrophobicContact CD2-SD 3.74Å; F139-M192 HydrophobicContact CE2-CE 4.33Å; F139-M192 HydrophobicContact CE2-SD 4.08Å; F139-I203 HydrophobicContact CE1-CG2 4.12Å; F139-I203 HydrophobicContact CZ-CG2 4.15Å; F139-M207 HydrophobicContact CE1-CE 4.2Å; F139-M207 HydrophobicContact CZ-CE 3.69Å
140	C	89.5	Confident	87.9	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	140.7	177.7	-43.5	0	0	0	0	109.6	F112 H114 V115 Y147	F112-C140 HydrophobicContact CB-CB 4.11Å; F112-C140 HydrophobicContact CD1-CB 3.1Å; F112-C140 HydrophobicContact CD2-CB 4.31Å; F112-C140 HydrophobicContact CE1-CB 3.47Å; F112-C140 VanDerWaalsContact CE1-CB 3.47Å; F112-C140 HydrophobicContact CG-CB 3.59Å; F112-C140 HydrophobicContact CZ-CB 4.21Å; H114-C140 CarbonylContact O-C 3.47Å; H114-C140 WeakPolarHBondContact O-CA 3.49Å; V115-C140 HydrophobicContact CG2-CB 4.18Å; C140-Y147 PolarHBondContact N-O 3Å; C140-Y147 PolarHBondContact O-N 3.01Å
141	L	90.3	Very high	87.8	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.1	-175.2	177	59.6	0	0	0	110.1	E113 H114 W116 F139 V146 L162 T206 M207 I210	E113-L141 PolarHBondContact N-O 3.04Å; H114-L141 HydrophobicContact CB-CB 4.45Å; H114-L141 PolarHBondContact N-O 3.21Å; H114-L141 PolarHBondContact O-N 3.27Å; W116-L141 HydrophobicContact CH2-CD2 4.15Å; W116-L141 HydrophobicContact CZ3-CB 3.99Å; W116-L141 HydrophobicContact CZ3-CD2 4.27Å; F139-L141 HydrophobicContact CE1-CB 4.25Å; L141-V146 HydrophobicContact CD1-CG2 3.84Å; L141-L162 HydrophobicContact CD1-CD2 4.17Å; L141-T206 HydrophobicContact CD2-CG2 4.05Å; L141-M207 HydrophobicContact CD1-CE 4.06Å; L141-M207 HydrophobicContact CD1-SD 4.39Å; L141-M207 HydrophobicContact CD2-CE 4.19Å; L141-I210 HydrophobicContact CD2-CD1 3.76Å; L141-I210 HydrophobicContact CG-CD1 3.89Å
142	N	84.9	Confident	87.2	Confident	9 Å²	9	31 Å²	31	5%	0.048	16%	0.161	C	C	.	.			trans	-117.6	163.8	169.3	-57	19.8	0	0	0	108.5	F112 C144 S145	F112-N142 WeakPolarHBondContact CA-OD1 3.38Å; F112-N142 WeakPolarHBondContact CD1-OD1 3.24Å; N142-C144 PolarHBondContact O-N 2.8Å; N142-S145 PolarHBondContact N-O 2.83Å; N142-S145 PolarHBondContact O-N 2.99Å
143	S	82.4	Confident	86.7	Confident	44 Å²	44	26.5 Å²	26.5	31%	0.308	15%	0.145	S	C	.	.	S	Bend	trans	-55	6.3	168.9	44.8	0	0	0	0	116.7	E113 N214	E113-S143 WeakPolarHBondContact OE1-CB 3.47Å; E113-S143 PolarHBondContact OE1-N 3.46Å; E113-S143 PolarHBondContact OE1-OG 2.79Å; E113-S143 PolarHBondContact OE2-N 2.99Å; S143-N214 PolarHBondContact O-ND2 2.93Å; S143-N214 PolarHBondContact O-OD1 3.5Å
144	C	83.5	Confident	85.6	Confident	32 Å²	32	32.7 Å²	32.7	22%	0.216	17%	0.174	C	C	.	.	S	Bend	trans	-146.6	-21.1	175.2	67.4	0	0	0	0	116.4	N142 L162 L287	N142-C144 PolarHBondContact O-N 2.8Å; C144-L162 WeakPolarHBondContact O-CB 3.15Å; C144-L162 WeakPolarHBondContact O-CG 3.33Å; C144-L162 PolarHBondContact O-N 3.21Å; C144-L287 HydrophobicContact CB-CD2 3.9Å
145	S	89	Confident	84.5	Confident	1 Å²	1	39 Å²	39	1%	0.007	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	149	-174.7	-76.3	0	0	0	0	112.4	N142 Y147 E159 P161	N142-S145 PolarHBondContact N-O 2.83Å; N142-S145 PolarHBondContact O-N 2.99Å; S145-Y147 VanDerWaalsContact CB-CE2 3.46Å; S145-Y147 WeakPolarHBondContact CB-OH 3.39Å; S145-E159 WeakPolarHBondContact CB-OE1 3.11Å; S145-E159 PolarHBondContact OG-OE1 2.77Å; S145-P161 WeakPolarHBondContact OG-CA 3.43Å
146	V	91.8	Very high	84.1	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	138.2	165.1	173.8	0	0	0	0	109	F139 L141 F148 E159 F160 L162 I165 L177 M207	F139-V146 HydrophobicContact CD2-CG1 4.23Å; F139-V146 HydrophobicContact CE1-CG1 4.2Å; F139-V146 HydrophobicContact CE2-CG1 3.69Å; F139-V146 HydrophobicContact CZ-CG1 3.68Å; F139-V146 HydrophobicContact CZ-CG2 4.16Å; L141-V146 HydrophobicContact CD1-CG2 3.84Å; V146-F148 HydrophobicContact CG1-CD2 4.1Å; V146-F148 HydrophobicContact CG1-CE2 3.65Å; V146-F148 HydrophobicContact CG1-CZ 4.19Å; V146-E159 WeakPolarHBondContact O-CA 3.13Å; V146-F160 HydrophobicContact CB-CB 4.45Å; V146-F160 PolarHBondContact N-O 2.82Å; V146-F160 PolarHBondContact O-N 2.78Å; V146-L162 HydrophobicContact CG2-CD2 4.04Å; V146-I165 HydrophobicContact CG2-CD1 3.84Å; V146-L177 HydrophobicContact CG1-CD2 4.4Å; V146-M207 HydrophobicContact CG2-CE 3.63Å; V146-M207 HydrophobicContact CG2-SD 4.42Å
147	Y	90.7	Very high	83.8	Confident	22 Å²	22	41.9 Å²	41.9	9%	0.086	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	140.2	175.1	-59	-95.2	0	0	0	110.7	F112 C140 S145 Y149 F157 Y158 E159	F112-Y147 HydrophobicContact CD1-CD2 4.27Å; F112-Y147 AromaticContact CE1-CD2 3.73Å; F112-Y147 HydrophobicContact CE1-CD2 3.73Å; F112-Y147 HydrophobicContact CE1-CE2 4.41Å; F112-Y147 AromaticContact CE1-CG 3.97Å; F112-Y147 HydrophobicContact CE1-CG 3.97Å; C140-Y147 PolarHBondContact N-O 3Å; C140-Y147 PolarHBondContact O-N 3.01Å; S145-Y147 VanDerWaalsContact CB-CE2 3.46Å; S145-Y147 WeakPolarHBondContact CB-OH 3.39Å; Y147-Y149 HydrophobicContact CD1-CE2 4.46Å; Y147-Y149 HydrophobicContact CG-CE2 4.23Å; Y147-F157 HydrophobicContact CD1-CD2 4.19Å; Y147-F157 HydrophobicContact CD1-CE2 4.39Å; Y147-Y158 CarbonylContact C-O 3.59Å; Y147-Y158 WeakPolarHBondContact CA-O 3.49Å; Y147-E159 HydrophobicContact CD1-CB 3.82Å; Y147-E159 HydrophobicContact CD1-CG 3.86Å; Y147-E159 HydrophobicContact CE1-CB 3.69Å; Y147-E159 HydrophobicContact CE1-CG 3.37Å; Y147-E159 WeakPolarHBondContact CE1-OE2 3.21Å; Y147-E159 VanDerWaalsContact OH-CD 3.31Å; Y147-E159 PolarHBondContact OH-OE1 2.87Å; Y147-E159 VanDerWaalsContact OH-OE1 3.12Å
148	F	90.5	Very high	83.7	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	105.3	170.7	-65.4	-96	0	0	0	109.3	I120 F137 R138 F139 V146 F157 Y158 F160 L177 L190 M192	I120-F148 HydrophobicContact CD1-CD1 3.57Å; I120-F148 HydrophobicContact CD1-CE1 3.8Å; I120-F148 HydrophobicContact CD1-CG 4.34Å; I120-F148 HydrophobicContact CG1-CD1 4.47Å; I120-F148 HydrophobicContact CG1-CE1 4.45Å; F137-F148 HydrophobicContact CB-CB 4.46Å; F137-F148 HydrophobicContact CB-CD1 4.34Å; F137-F148 HydrophobicContact CD1-CB 3.79Å; F137-F148 HydrophobicContact CE1-CB 4.46Å; F137-F148 HydrophobicContact CG-CB 4.43Å; R138-F148 WeakPolarHBondContact O-CA 3.11Å; F139-F148 HydrophobicContact CD2-CD1 4.1Å; F139-F148 AromaticContact CD2-CE1 3.45Å; F139-F148 HydrophobicContact CD2-CE1 3.45Å; F139-F148 VanDerWaalsContact CD2-CE1 3.45Å; F139-F148 AromaticContact CD2-CZ 3.7Å; F139-F148 HydrophobicContact CD2-CZ 3.7Å; F139-F148 AromaticContact CE2-CE1 4Å; F139-F148 HydrophobicContact CE2-CE1 4Å; F139-F148 HydrophobicContact CE2-CE2 4.49Å; F139-F148 AromaticContact CE2-CZ 3.75Å; F139-F148 HydrophobicContact CE2-CZ 3.75Å; F139-F148 HydrophobicContact CG-CE1 4.49Å; V146-F148 HydrophobicContact CG1-CD2 4.1Å; V146-F148 HydrophobicContact CG1-CE2 3.65Å; V146-F148 HydrophobicContact CG1-CZ 4.19Å; F148-F157 CarbonylContact O-C 3.58Å; F148-F157 VanDerWaalsContact O-CA 3.25Å; F148-F157 WeakPolarHBondContact O-CA 3.32Å; F148-Y158 PolarHBondContact N-O 2.84Å; F148-Y158 PolarHBondContact O-N 2.86Å; F148-F160 AromaticContact CD2-CD2 3.6Å; F148-F160 HydrophobicContact CD2-CD2 3.6Å; F148-F160 AromaticContact CD2-CE2 3.57Å; F148-F160 HydrophobicContact CD2-CE2 3.57Å; F148-F160 AromaticContact CE2-CD2 3.55Å; F148-F160 HydrophobicContact CE2-CD2 3.55Å; F148-F160 AromaticContact CE2-CE2 3.67Å; F148-F160 HydrophobicContact CE2-CE2 3.67Å; F148-L177 HydrophobicContact CE2-CD2 4Å; F148-L177 HydrophobicContact CZ-CD2 3.89Å; F148-L190 HydrophobicContact CE2-CD1 3.8Å; F148-L190 HydrophobicContact CZ-CD1 3.74Å; F148-M192 HydrophobicContact CE1-CE 3.77Å; F148-M192 HydrophobicContact CE1-SD 3.97Å; F148-M192 HydrophobicContact CZ-CE 3.85Å
149	Y	87.3	Confident	83.8	Confident	42 Å²	42	46.4 Å²	46.4	17%	0.165	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.4	173.6	-73.5	-93.6	0	0	0	109.9	F112 F137 R138 Y147 V151 F157	F112-Y149 AromaticContact CE1-CE2 3.79Å; F112-Y149 HydrophobicContact CE1-CE2 3.79Å; F112-Y149 HydrophobicContact CE2-CE2 4.35Å; F112-Y149 HydrophobicContact CZ-CD2 4.26Å; F112-Y149 AromaticContact CZ-CE2 3.36Å; F112-Y149 HydrophobicContact CZ-CE2 3.36Å; F112-Y149 AromaticContact CZ-CZ 3.8Å; F137-Y149 CarbonylContact C-O 3.56Å; F137-Y149 WeakPolarHBondContact CA-O 3.36Å; R138-Y149 PolarHBondContact N-O 2.66Å; R138-Y149 PolarHBondContact O-N 3.35Å; Y147-Y149 HydrophobicContact CD1-CE2 4.46Å; Y147-Y149 HydrophobicContact CG-CE2 4.23Å; Y149-V151 PolarHBondContact O-N 2.64Å; Y149-F157 HydrophobicContact CD1-CB 3.62Å; Y149-F157 HydrophobicContact CD1-CG 4.48Å; Y149-F157 HydrophobicContact CD2-CB 4.46Å; Y149-F157 HydrophobicContact CE1-CB 3.54Å; Y149-F157 HydrophobicContact CE1-CD1 4.23Å; Y149-F157 AromaticContact CE1-CG 3.92Å; Y149-F157 HydrophobicContact CE1-CG 3.92Å; Y149-F157 HydrophobicContact CE2-CB 4.38Å; Y149-F157 HydrophobicContact CG-CB 4.08Å
150	K	86.7	Confident	83.8	Confident	61 Å²	61	46.5 Å²	46.5	27%	0.265	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	121.6	179.7	179.3	-175.3	162.8	-152.6	0	110.2	F137 N152 T153 E156	F137-K150 HydrophobicContact CD1-CB 3.92Å; F137-K150 HydrophobicContact CE1-CB 3.53Å; F137-K150 HydrophobicContact CE1-CG 4.17Å; F137-K150 HydrophobicContact CZ-CB 4.01Å; F137-K150 HydrophobicContact CZ-CD 4.48Å; F137-K150 HydrophobicContact CZ-CG 4.13Å; K150-N152 PolarHBondContact O-N 2.8Å; K150-T153 VanDerWaalsContact CB-OG1 3.28Å; K150-T153 WeakPolarHBondContact CB-OG1 3.4Å; K150-T153 WeakPolarHBondContact CD-OG1 3.42Å; K150-T153 VanDerWaalsContact CG-OG1 3.29Å; K150-T153 WeakPolarHBondContact CG-OG1 3.41Å; K150-T153 PolarHBondContact O-N 2.88Å; K150-T153 VanDerWaalsContact O-N 3.13Å; K150-T153 VanDerWaalsContact O-O 3.08Å; K150-T153 PolarHBondContact O-OG1 3.4Å; K150-E156 HydrophobicContact CB-CB 4.18Å; K150-E156 WeakPolarHBondContact CB-O 3.2Å; K150-E156 HydrophobicContact CD-CB 4.01Å; K150-E156 WeakPolarHBondContact CD-OE2 3.04Å; K150-E156 WeakPolarHBondContact CE-OE2 3.34Å; K150-E156 PolarHBondContact N-O 2.93Å; K150-E156 IonicContact NZ-OE1 3.13Å; K150-E156 PolarHBondContact NZ-OE1 2.78Å; K150-E156 IonicContact NZ-OE2 3.92Å; K150-E156 PolarHBondContact NZ-OE2 2.78Å
151	V	81.8	Confident	83.8	Confident	32 Å²	32	47.7 Å²	47.7	19%	0.194	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	135.5	-174.2	-171	0	0	0	0	110.4	S71 F136 Y149	S71-V151 WeakPolarHBondContact O-CG1 3.43Å; F136-V151 HydrophobicContact CB-CB 4.44Å; F136-V151 HydrophobicContact CB-CG2 4.23Å; F136-V151 PolarHBondContact O-N 3.2Å; Y149-V151 PolarHBondContact O-N 2.64Å
152	N	72.3	Confident	83.8	Confident	132 Å²	132	47.9 Å²	47.9	71%	0.706	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.2	16.3	-171.2	-44.7	-89.5	0	0	0	116	K150	K150-N152 PolarHBondContact O-N 2.8Å
153	T	72.9	Confident	83.9	Confident	45 Å²	45	51.2 Å²	51.2	28%	0.276	26%	0.262	S	S	.	.			trans	-139.7	123.6	171.1	40	0	0	0	0	110.4	K150	K150-T153 VanDerWaalsContact CB-OG1 3.28Å; K150-T153 WeakPolarHBondContact CB-OG1 3.4Å; K150-T153 WeakPolarHBondContact CD-OG1 3.42Å; K150-T153 VanDerWaalsContact CG-OG1 3.29Å; K150-T153 WeakPolarHBondContact CG-OG1 3.41Å; K150-T153 PolarHBondContact O-N 2.88Å; K150-T153 VanDerWaalsContact O-N 3.13Å; K150-T153 VanDerWaalsContact O-O 3.08Å; K150-T153 PolarHBondContact O-OG1 3.4Å
154	Q	63.1	Low	84.3	Confident	131 Å²	131	51.8 Å²	51.8	61%	0.612	26%	0.258	S	S	*	.	S	Bend	trans	-74.3	-35.1	-172.6	-67.5	175.2	-68.9	0	0	112.7	Y70	Y70-Q154 HydrophobicContact CD1-CG 4.4Å; Y70-Q154 HydrophobicContact CG-CG 4.43Å
155	D	68	Low	84.6	Confident	145 Å²	145	51.3 Å²	51.3	78%	0.775	25%	0.254	S	S	*	.	S	Bend	trans	-104	-10.1	-171.5	-44.8	-68.7	0	0	0	115.2	F157	D155-F157 PolarHBondContact O-N 3.01Å
156	E	80.6	Confident	84.7	Confident	70 Å²	70	54.7 Å²	54.7	33%	0.327	28%	0.277	S	S	.	.			trans	-86.9	87.9	178.5	-77.4	-165.3	-157	0	0	111.3	K150	K150-E156 HydrophobicContact CB-CB 4.18Å; K150-E156 WeakPolarHBondContact CB-O 3.2Å; K150-E156 HydrophobicContact CD-CB 4.01Å; K150-E156 WeakPolarHBondContact CD-OE2 3.04Å; K150-E156 WeakPolarHBondContact CE-OE2 3.34Å; K150-E156 PolarHBondContact N-O 2.93Å; K150-E156 IonicContact NZ-OE1 3.13Å; K150-E156 PolarHBondContact NZ-OE1 2.78Å; K150-E156 IonicContact NZ-OE2 3.92Å; K150-E156 PolarHBondContact NZ-OE2 2.78Å
157	F	85.1	Confident	84.7	Confident	101 Å²	101	58 Å²	58	44%	0.443	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	159.9	172.1	77.7	-85.6	0	0	0	113.3	Y147 F148 Y149 D155 E159	Y147-F157 HydrophobicContact CD1-CD2 4.19Å; Y147-F157 HydrophobicContact CD1-CE2 4.39Å; F148-F157 CarbonylContact O-C 3.58Å; F148-F157 VanDerWaalsContact O-CA 3.25Å; F148-F157 WeakPolarHBondContact O-CA 3.32Å; Y149-F157 HydrophobicContact CD1-CB 3.62Å; Y149-F157 HydrophobicContact CD1-CG 4.48Å; Y149-F157 HydrophobicContact CD2-CB 4.46Å; Y149-F157 HydrophobicContact CE1-CB 3.54Å; Y149-F157 HydrophobicContact CE1-CD1 4.23Å; Y149-F157 AromaticContact CE1-CG 3.92Å; Y149-F157 HydrophobicContact CE1-CG 3.92Å; Y149-F157 HydrophobicContact CE2-CB 4.38Å; Y149-F157 HydrophobicContact CG-CB 4.08Å; D155-F157 PolarHBondContact O-N 3.01Å; F157-E159 HydrophobicContact CE2-CB 4.46Å
158	Y	88.2	Confident	84.9	Confident	51 Å²	51	59.1 Å²	59.1	20%	0.2	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	118.6	174.3	-64.5	-90.9	0	0	0	110.7	K132 L133 F137 Y147 F148	K132-Y158 VanDerWaalsContact CB-OH 3.28Å; K132-Y158 WeakPolarHBondContact CB-OH 3.49Å; L133-Y158 HydrophobicContact CD1-CD1 4.35Å; L133-Y158 HydrophobicContact CD1-CE1 4.28Å; L133-Y158 HydrophobicContact CD2-CD1 3.94Å; L133-Y158 HydrophobicContact CD2-CD2 3.41Å; L133-Y158 VanDerWaalsContact CD2-CD2 3.41Å; L133-Y158 HydrophobicContact CD2-CE1 4.19Å; L133-Y158 HydrophobicContact CD2-CE2 3.69Å; L133-Y158 HydrophobicContact CD2-CG 3.54Å; L133-Y158 HydrophobicContact CG-CD1 4.15Å; L133-Y158 HydrophobicContact CG-CD2 4.11Å; L133-Y158 HydrophobicContact CG-CE1 3.94Å; L133-Y158 HydrophobicContact CG-CE2 3.89Å; L133-Y158 HydrophobicContact CG-CG 4.22Å; F137-Y158 HydrophobicContact CE1-CD2 4.06Å; F137-Y158 HydrophobicContact CE1-CE2 4.14Å; F137-Y158 HydrophobicContact CZ-CE2 4.42Å; Y147-Y158 CarbonylContact C-O 3.59Å; Y147-Y158 WeakPolarHBondContact CA-O 3.49Å; F148-Y158 PolarHBondContact N-O 2.84Å; F148-Y158 PolarHBondContact O-N 2.86Å
159	E	89.9	Confident	85.1	Confident	56 Å²	56	59.4 Å²	59.4	26%	0.262	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	134.5	173.9	-174.1	179	169.9	0	0	111.7	S145 V146 Y147 F157 P161 H290	S145-E159 WeakPolarHBondContact CB-OE1 3.11Å; S145-E159 PolarHBondContact OG-OE1 2.77Å; V146-E159 WeakPolarHBondContact O-CA 3.13Å; Y147-E159 HydrophobicContact CD1-CB 3.82Å; Y147-E159 HydrophobicContact CD1-CG 3.86Å; Y147-E159 HydrophobicContact CE1-CB 3.69Å; Y147-E159 HydrophobicContact CE1-CG 3.37Å; Y147-E159 WeakPolarHBondContact CE1-OE2 3.21Å; Y147-E159 VanDerWaalsContact OH-CD 3.31Å; Y147-E159 PolarHBondContact OH-OE1 2.87Å; Y147-E159 VanDerWaalsContact OH-OE1 3.12Å; F157-E159 HydrophobicContact CE2-CB 4.46Å; E159-P161 HydrophobicContact CG-CG 4.42Å; E159-H290 IonicContact OE1-CE1 2.72Å
160	F	90.7	Very high	85.4	Confident	3 Å²	3	60.8 Å²	60.8	1%	0.013	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	97.3	169.6	-61.4	-86.9	0	0	0	109	V146 F148 L162 V179 A183 T185 L190	V146-F160 HydrophobicContact CB-CB 4.45Å; V146-F160 PolarHBondContact N-O 2.82Å; V146-F160 PolarHBondContact O-N 2.78Å; F148-F160 AromaticContact CD2-CD2 3.6Å; F148-F160 HydrophobicContact CD2-CD2 3.6Å; F148-F160 AromaticContact CD2-CE2 3.57Å; F148-F160 HydrophobicContact CD2-CE2 3.57Å; F148-F160 AromaticContact CE2-CD2 3.55Å; F148-F160 HydrophobicContact CE2-CD2 3.55Å; F148-F160 AromaticContact CE2-CE2 3.67Å; F148-F160 HydrophobicContact CE2-CE2 3.67Å; F160-L162 PolarHBondContact O-N 2.96Å; F160-V179 HydrophobicContact CD1-CG1 3.77Å; F160-V179 HydrophobicContact CE1-CG1 4.15Å; F160-V179 HydrophobicContact CG-CG1 4.44Å; F160-A183 HydrophobicContact CD1-CB 4.35Å; F160-T185 HydrophobicContact CE1-CG2 3.75Å; F160-T185 HydrophobicContact CZ-CG2 3.78Å; F160-L190 HydrophobicContact CE2-CD1 3.99Å; F160-L190 HydrophobicContact CZ-CD1 3.97Å
161	P	90.2	Very high	85.7	Confident	24 Å²	24	63.4 Å²	63.4	16%	0.156	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	140.3	173.3	-27.5	36.6	0	0	0	111.5	S145 E159 V163 Y164	S145-P161 WeakPolarHBondContact OG-CA 3.43Å; E159-P161 HydrophobicContact CG-CG 4.42Å; P161-V163 HydrophobicContact CB-CG2 4.21Å; P161-V163 PolarHBondContact O-N 2.92Å; P161-Y164 HydrophobicContact CB-CD2 4.31Å; P161-Y164 HydrophobicContact CB-CE2 4.43Å; P161-Y164 HydrophobicContact CG-CD2 4.14Å; P161-Y164 HydrophobicContact CG-CE2 4.03Å; P161-Y164 PolarHBondContact O-N 2.97Å
162	L	89.5	Confident	86.2	Confident	4 Å²	4	63.8 Å²	63.8	2%	0.021	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-56.6	-24.9	-177.1	-67.8	178.9	0	0	0	112.4	L141 C144 V146 F160 Y164 I165 M207 I210 L211	L141-L162 HydrophobicContact CD1-CD2 4.17Å; C144-L162 WeakPolarHBondContact O-CB 3.15Å; C144-L162 WeakPolarHBondContact O-CG 3.33Å; C144-L162 PolarHBondContact O-N 3.21Å; V146-L162 HydrophobicContact CG2-CD2 4.04Å; F160-L162 PolarHBondContact O-N 2.96Å; L162-Y164 PolarHBondContact O-N 2.96Å; L162-I165 HydrophobicContact CD2-CD1 3.55Å; L162-I165 PolarHBondContact O-N 3.27Å; L162-M207 HydrophobicContact CD2-SD 3.89Å; L162-I210 HydrophobicContact CD1-CG2 3.75Å; L162-L211 HydrophobicContact CB-CD2 3.85Å; L162-L211 HydrophobicContact CD1-CD2 4.16Å; L162-L211 HydrophobicContact CD2-CD2 4.12Å; L162-L211 HydrophobicContact CG-CD2 4.25Å
163	V	87.6	Confident	87.1	Confident	79 Å²	79	60.3 Å²	60.3	48%	0.479	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-59.9	-27	173.3	-145.3	0	0	0	0	113.9	P161	P161-V163 HydrophobicContact CB-CG2 4.21Å; P161-V163 PolarHBondContact O-N 2.92Å
164	Y	90.4	Very high	88.1	Confident	56 Å²	56	60.3 Å²	60.3	22%	0.22	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-98.4	-5.6	-177.1	-56	-23.1	0	0	0	113	P161 L162 V179 G180 A183	P161-Y164 HydrophobicContact CB-CD2 4.31Å; P161-Y164 HydrophobicContact CB-CE2 4.43Å; P161-Y164 HydrophobicContact CG-CD2 4.14Å; P161-Y164 HydrophobicContact CG-CE2 4.03Å; P161-Y164 PolarHBondContact O-N 2.97Å; L162-Y164 PolarHBondContact O-N 2.96Å; Y164-V179 CarbonylContact O-C 3.59Å; Y164-V179 WeakPolarHBondContact O-CA 3.46Å; Y164-G180 PolarHBondContact O-N 3.41Å; Y164-A183 HydrophobicContact CD2-CB 4.47Å
165	I	91.5	Very high	89.7	Confident	23 Å²	23	54 Å²	54	12%	0.118	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	127.4	171.6	-59.1	169.8	0	0	0	108	V146 L162 Y168 L177 M207	V146-I165 HydrophobicContact CG2-CD1 3.84Å; L162-I165 HydrophobicContact CD2-CD1 3.55Å; L162-I165 PolarHBondContact O-N 3.27Å; I165-Y168 HydrophobicContact CG2-CD1 4.17Å; I165-L177 HydrophobicContact CB-CD1 4.44Å; I165-L177 HydrophobicContact CD1-CD1 3.94Å; I165-L177 HydrophobicContact CG1-CD1 3.99Å; I165-L177 HydrophobicContact CG2-CD1 3.61Å; I165-M207 HydrophobicContact CD1-SD 4.14Å
166	S	90.3	Very high	90.9	Very high	71 Å²	71	49 Å²	49	50%	0.497	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	-23.5	-176.4	65.6	0	0	0	0	113.7	R178	S166-R178 PolarHBondContact N-O 2.88Å; S166-R178 PolarHBondContact OG-O 3.12Å
167	N	92.2	Very high	91.6	Very high	69 Å²	69	45.6 Å²	45.6	37%	0.369	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	158.8	168.1	-164.6	21.1	0	0	0	109.3	R178	N167-R178 HydrophobicContact CB-CB 3.97Å; N167-R178 PolarHBondContact N-O 3.47Å; N167-R178 WeakPolarHBondContact O-CB 3.35Å; N167-R178 PolarHBondContact O-N 2.92Å
168	Y	94.3	Very high	92	Very high	47 Å²	47	46.5 Å²	46.5	18%	0.184	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	159	176.1	60	-80.6	0	0	0	109.5	I165 F175 F176 H204 M207 K208 L211	I165-Y168 HydrophobicContact CG2-CD1 4.17Å; Y168-F175 HydrophobicContact CD2-CZ 4.42Å; Y168-F176 VanDerWaalsContact CA-O 3.31Å; Y168-F176 WeakPolarHBondContact CA-O 3.3Å; Y168-H204 AromaticContact CD2-ND1 3.54Å; Y168-H204 AromaticContact CE2-CE1 3.78Å; Y168-H204 AromaticContact CE2-ND1 3.57Å; Y168-M207 HydrophobicContact CD1-CG 4.19Å; Y168-M207 HydrophobicContact CD2-CB 4.02Å; Y168-M207 HydrophobicContact CD2-CG 3.5Å; Y168-M207 VanDerWaalsContact CD2-CG 3.5Å; Y168-M207 HydrophobicContact CE1-CG 4.34Å; Y168-M207 HydrophobicContact CE2-CB 4Å; Y168-M207 HydrophobicContact CE2-CG 3.65Å; Y168-M207 HydrophobicContact CG-CG 3.82Å; Y168-K208 HydrophobicContact CE2-CB 4.22Å; Y168-K208 VanDerWaalsContact OH-CA 3.32Å; Y168-K208 WeakPolarHBondContact OH-CA 3.39Å; Y168-K208 WeakPolarHBondContact OH-CB 3.45Å; Y168-L211 HydrophobicContact CD1-CD1 3.88Å; Y168-L211 HydrophobicContact CE1-CD1 3.29Å
169	G	94.7	Very high	92.2	Very high	6 Å²	6	44.1 Å²	44.1	6%	0.062	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.1	175.4	-179.3	0	0	0	0	0	113.4	F175 F176	G169-F175 WeakPolarHBondContact O-CA 3.37Å; G169-F175 WeakPolarHBondContact O-CD2 3.45Å; G169-F176 VanDerWaalsContact C-CE1 3.47Å; G169-F176 PolarHBondContact N-O 3.45Å; G169-F176 VanDerWaalsContact O-CD1 3.29Å; G169-F176 WeakPolarHBondContact O-CD1 3.46Å; G169-F176 PolarHBondContact O-N 3.33Å
170	H	94.2	Very high	92.3	Very high	71 Å²	71	42.3 Å²	42.3	33%	0.329	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	156.8	177.3	67.2	-92.1	0	0	0	111.5	M174 F175 A200 H204	H170-M174 CarbonylContact C-O 3.47Å; H170-M174 VanDerWaalsContact CA-O 3.31Å; H170-M174 WeakPolarHBondContact CA-O 3.09Å; H170-F175 HydrophobicContact CB-CD2 4.41Å; H170-A200 HydrophobicContact CB-CB 4.06Å; H170-A200 WeakPolarHBondContact CB-O 3.44Å; H170-H204 AromaticContact CE1-CD2 3.8Å; H170-H204 WeakPolarHBondContact ND1-CB 3.42Å; H170-H204 AromaticContact ND1-CD2 3.54Å; H170-H204 AromaticContact ND1-CG 3.49Å
171	Q	93.1	Very high	92.3	Very high	115 Å²	115	52.8 Å²	52.8	54%	0.537	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	96.7	175.7	-173.5	-180	8.9	0	0	108.9	M174	Q171-M174 PolarHBondContact N-O 2.62Å; Q171-M174 PolarHBondContact O-N 3.46Å
172	G	91.8	Very high	92.1	Very high	40 Å²	40	55.8 Å²	55.8	41%	0.412	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	-134.3	-169	0	0	0	0	0	110.9	M174	G172-M174 PolarHBondContact O-N 3.13Å
173	N	92.1	Very high	91.9	Very high	59 Å²	59	55.9 Å²	55.9	32%	0.316	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	20.5	173.9	70.3	-25.1	0	0	0	113.6	N193 T194 V197	N173-N193 PolarHBondContact ND2-ND2 3.43Å; N173-N193 WeakPolarHBondContact O-CA 3.2Å; N173-T194 PolarHBondContact O-N 3.29Å; N173-T194 PolarHBondContact O-OG1 3.37Å; N173-T194 VanDerWaalsContact O-OG1 3.12Å; N173-V197 HydrophobicContact CB-CG2 4.12Å
174	M	93.5	Very high	91.6	Very high	45 Å²	45	60.2 Å²	60.2	22%	0.222	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	134.5	170.5	-64.6	179.9	-70.2	0	0	110.2	L121 H170 Q171 G172 W191 M192	L121-M174 HydrophobicContact CD1-SD 4.15Å; H170-M174 CarbonylContact C-O 3.47Å; H170-M174 VanDerWaalsContact CA-O 3.31Å; H170-M174 WeakPolarHBondContact CA-O 3.09Å; Q171-M174 PolarHBondContact N-O 2.62Å; Q171-M174 PolarHBondContact O-N 3.46Å; G172-M174 PolarHBondContact O-N 3.13Å; M174-W191 HydrophobicContact SD-CE3 4.49Å; M174-M192 CarbonylContact C-O 3.58Å; M174-M192 VanDerWaalsContact CA-O 3.28Å; M174-M192 WeakPolarHBondContact CA-O 3.36Å
175	F	95.1	Very high	91.3	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	144.3	165	-176.7	-99.8	0	0	0	109.2	F139 Y168 G169 H170 L177 M192 I203 H204	F139-F175 HydrophobicContact CE2-CE1 4.27Å; F139-F175 HydrophobicContact CZ-CE1 4.35Å; Y168-F175 HydrophobicContact CD2-CZ 4.42Å; G169-F175 WeakPolarHBondContact O-CA 3.37Å; G169-F175 WeakPolarHBondContact O-CD2 3.45Å; H170-F175 HydrophobicContact CB-CD2 4.41Å; F175-L177 HydrophobicContact CE1-CB 4.23Å; F175-M192 HydrophobicContact CB-CG 4Å; F175-M192 HydrophobicContact CD1-CE 3.86Å; F175-M192 HydrophobicContact CD1-CG 4.35Å; F175-M192 HydrophobicContact CD1-SD 3.87Å; F175-M192 HydrophobicContact CE1-CE 4.47Å; F175-M192 PolarHBondContact N-O 3.33Å; F175-M192 PolarHBondContact O-N 2.67Å; F175-I203 HydrophobicContact CD1-CG2 4Å; F175-I203 HydrophobicContact CD2-CB 4.23Å; F175-I203 HydrophobicContact CD2-CG2 3.85Å; F175-I203 HydrophobicContact CE1-CG2 3.81Å; F175-I203 HydrophobicContact CE2-CB 4.34Å; F175-I203 HydrophobicContact CE2-CG2 3.66Å; F175-I203 HydrophobicContact CG-CG2 4.02Å; F175-I203 HydrophobicContact CZ-CG2 3.64Å; F175-H204 HydrophobicContact CE2-CB 4.19Å
176	F	94.4	Very high	91	Very high	38 Å²	38	59.4 Å²	59.4	17%	0.167	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	141.8	175.5	72.7	-96.4	0	0	0	111.6	Y168 G169 L190 W191	Y168-F176 VanDerWaalsContact CA-O 3.31Å; Y168-F176 WeakPolarHBondContact CA-O 3.3Å; G169-F176 VanDerWaalsContact C-CE1 3.47Å; G169-F176 PolarHBondContact N-O 3.45Å; G169-F176 VanDerWaalsContact O-CD1 3.29Å; G169-F176 WeakPolarHBondContact O-CD1 3.46Å; G169-F176 PolarHBondContact O-N 3.33Å; F176-L190 CarbonylContact C-O 3.59Å; F176-L190 VanDerWaalsContact CA-O 3.29Å; F176-L190 WeakPolarHBondContact CA-O 3.49Å; F176-W191 HydrophobicContact CB-CD2 3.83Å; F176-W191 HydrophobicContact CB-CE3 3.95Å; F176-W191 HydrophobicContact CB-CG 4.37Å; F176-W191 HydrophobicContact CB-CH2 4.22Å; F176-W191 HydrophobicContact CB-CZ2 4.11Å; F176-W191 HydrophobicContact CB-CZ3 4.15Å; F176-W191 HydrophobicContact CD1-CH2 4.08Å; F176-W191 HydrophobicContact CD1-CZ3 4.26Å; F176-W191 HydrophobicContact CG-CH2 4.29Å; F176-W191 HydrophobicContact CG-CZ2 4.31Å
177	L	94.6	Very high	91	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	115	-179	-174.9	66.1	0	0	0	109.7	V146 F148 I165 F175 E189 L190 M192	V146-L177 HydrophobicContact CG1-CD2 4.4Å; F148-L177 HydrophobicContact CE2-CD2 4Å; F148-L177 HydrophobicContact CZ-CD2 3.89Å; I165-L177 HydrophobicContact CB-CD1 4.44Å; I165-L177 HydrophobicContact CD1-CD1 3.94Å; I165-L177 HydrophobicContact CG1-CD1 3.99Å; I165-L177 HydrophobicContact CG2-CD1 3.61Å; F175-L177 HydrophobicContact CE1-CB 4.23Å; L177-E189 CarbonylContact O-C 3.58Å; L177-E189 WeakPolarHBondContact O-CA 3.38Å; L177-L190 HydrophobicContact CB-CB 4.42Å; L177-L190 PolarHBondContact N-O 2.87Å; L177-L190 PolarHBondContact O-N 3.32Å; L177-M192 HydrophobicContact CB-CE 4.23Å
178	R	94.1	Very high	91	Very high	119 Å²	119	56.8 Å²	56.8	45%	0.449	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	109.8	-177	-173.9	-178.9	172.4	116.6	-9.6	110.9	S166 N167 G188 E189	S166-R178 PolarHBondContact N-O 2.88Å; S166-R178 PolarHBondContact OG-O 3.12Å; N167-R178 HydrophobicContact CB-CB 3.97Å; N167-R178 PolarHBondContact N-O 3.47Å; N167-R178 WeakPolarHBondContact O-CB 3.35Å; N167-R178 PolarHBondContact O-N 2.92Å; R178-G188 CarbonylContact C-O 3.6Å; R178-G188 WeakPolarHBondContact CA-O 3.41Å; R178-E189 HydrophobicContact CB-CG 3.78Å; R178-E189 WeakPolarHBondContact CD-OE1 3.48Å; R178-E189 HydrophobicContact CG-CG 3.64Å; R178-E189 IonicContact CZ-OE1 3.87Å; R178-E189 IonicContact NE-OE1 3.47Å; R178-E189 IonicContact NH1-OE1 2.69Å; R178-E189 PolarHBondContact NH1-OE1 3.25Å
179	V	93.1	Very high	90.9	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.012	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	143.2	179.2	-50.8	0	0	0	0	111.8	I126 F160 Y164 A183 G186 S187 G188	I126-V179 HydrophobicContact CD1-CG2 3.53Å; F160-V179 HydrophobicContact CD1-CG1 3.77Å; F160-V179 HydrophobicContact CE1-CG1 4.15Å; F160-V179 HydrophobicContact CG-CG1 4.44Å; Y164-V179 CarbonylContact O-C 3.59Å; Y164-V179 WeakPolarHBondContact O-CA 3.46Å; V179-A183 HydrophobicContact CB-CB 3.81Å; V179-A183 HydrophobicContact CG2-CB 3.65Å; V179-G186 WeakPolarHBondContact CG2-O 3.42Å; V179-S187 WeakPolarHBondContact O-CA 3.39Å; V179-G188 PolarHBondContact N-O 3.48Å; V179-G188 PolarHBondContact O-N 3Å
180	G	91.1	Very high	90.8	Very high	18 Å²	18	56.6 Å²	56.6	19%	0.186	31%	0.305	C	S	.	.			trans	-75.5	178.1	177.7	0	0	0	0	0	113.3	Y164 S182 A183 S187	Y164-G180 PolarHBondContact O-N 3.41Å; G180-S182 PolarHBondContact O-N 2.72Å; G180-S182 VanDerWaalsContact O-N 3.15Å; G180-A183 PolarHBondContact O-N 2.75Å; G180-S187 WeakPolarHBondContact O-CA 3.44Å
181	R	90.1	Very high	90.8	Very high	223 Å²	223	55.5 Å²	55.5	84%	0.842	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-18.7	-177	-65.1	178.7	-176.1	164.3	1.2	113.9
182	S	87.2	Confident	90.9	Very high	86 Å²	86	50 Å²	50	60%	0.601	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-10.1	-179.3	-44.3	0	0	0	0	114.3	G180	G180-S182 PolarHBondContact O-N 2.72Å; G180-S182 VanDerWaalsContact O-N 3.15Å
183	A	85.7	Confident	91	Very high	7 Å²	7	50.2 Å²	50.2	6%	0.058	26%	0.264	C	S	.	.	S	Bend	trans	-69.7	148.3	175.5	0	0	0	0	0	111.4	F160 Y164 V179 G180 T185 G186	F160-A183 HydrophobicContact CD1-CB 4.35Å; Y164-A183 HydrophobicContact CD2-CB 4.47Å; V179-A183 HydrophobicContact CB-CB 3.81Å; V179-A183 HydrophobicContact CG2-CB 3.65Å; G180-A183 PolarHBondContact O-N 2.75Å; A183-T185 PolarHBondContact O-N 3.3Å; A183-T185 VanDerWaalsContact O-N 3.15Å; A183-G186 WeakPolarHBondContact O-CA 3.26Å; A183-G186 PolarHBondContact O-N 3.09Å
184	L	79.9	Confident	91	Very high	169 Å²	169	47.7 Å²	47.7	89%	0.885	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.6	-178.8	-64.4	173.1	0	0	0	113.5	G186	L184-G186 VanDerWaalsContact C-N 3.26Å; L184-G186 PolarHBondContact O-N 2.77Å
185	T	84.8	Confident	90.6	Very high	35 Å²	35	49.2 Å²	49.2	22%	0.215	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-6.9	173.4	53.3	0	0	0	0	114.2	I126 L133 F160 A183	I126-T185 HydrophobicContact CG2-CG2 3.99Å; L133-T185 HydrophobicContact CD1-CG2 3.77Å; F160-T185 HydrophobicContact CE1-CG2 3.75Å; F160-T185 HydrophobicContact CZ-CG2 3.78Å; A183-T185 PolarHBondContact O-N 3.3Å; A183-T185 VanDerWaalsContact O-N 3.15Å
186	G	85.1	Confident	90.1	Very high	28 Å²	28	52 Å²	52	29%	0.289	27%	0.272	S	S	.	.			trans	68.2	176.1	-156.5	0	0	0	0	0	112.5	V179 A183 L184	V179-G186 WeakPolarHBondContact CG2-O 3.42Å; A183-G186 WeakPolarHBondContact O-CA 3.26Å; A183-G186 PolarHBondContact O-N 3.09Å; L184-G186 VanDerWaalsContact C-N 3.26Å; L184-G186 PolarHBondContact O-N 2.77Å
187	S	90.7	Very high	89.8	Confident	63 Å²	63	53.6 Å²	53.6	44%	0.441	29%	0.285	S	S	.	.	S	Bend	trans	-71.5	136.5	-178.7	56.5	0	0	0	0	113.1	V179 G180	V179-S187 WeakPolarHBondContact O-CA 3.39Å; G180-S187 WeakPolarHBondContact O-CA 3.44Å
188	G	90.7	Very high	89.4	Confident	22 Å²	22	57.9 Å²	57.9	23%	0.227	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.5	-167.8	173.9	0	0	0	0	0	111.9	R178 V179	R178-G188 CarbonylContact C-O 3.6Å; R178-G188 WeakPolarHBondContact CA-O 3.41Å; V179-G188 PolarHBondContact N-O 3.48Å; V179-G188 PolarHBondContact O-N 3Å
189	E	92.7	Very high	89.1	Confident	49 Å²	49	53 Å²	53	23%	0.229	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134.8	-179.6	-69	172.1	-175.8	0	0	111.1	G125 I126 L177 R178 W191	G125-E189 CarbonylContact C-O 3.52Å; G125-E189 WeakPolarHBondContact CA-O 3.44Å; I126-E189 PolarHBondContact N-O 3.33Å; L177-E189 CarbonylContact O-C 3.58Å; L177-E189 WeakPolarHBondContact O-CA 3.38Å; R178-E189 HydrophobicContact CB-CG 3.78Å; R178-E189 WeakPolarHBondContact CD-OE1 3.48Å; R178-E189 HydrophobicContact CG-CG 3.64Å; R178-E189 IonicContact CZ-OE1 3.87Å; R178-E189 IonicContact NE-OE1 3.47Å; R178-E189 IonicContact NH1-OE1 2.69Å; R178-E189 PolarHBondContact NH1-OE1 3.25Å; E189-W191 PolarHBondContact OE2-NE1 3.33Å
190	L	93.5	Very high	89.1	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	128.1	164.1	-65.9	170.3	0	0	0	107.8	I120 I126 T127 L133 F148 F160 F176 L177 M192	I120-L190 HydrophobicContact CG2-CD2 4.31Å; I126-L190 HydrophobicContact CB-CD2 3.89Å; I126-L190 HydrophobicContact CD1-CD1 4.47Å; I126-L190 HydrophobicContact CD1-CD2 4.1Å; I126-L190 HydrophobicContact CD1-CG 3.84Å; I126-L190 HydrophobicContact CG1-CD2 4.33Å; I126-L190 HydrophobicContact CG1-CG 4.42Å; T127-L190 HydrophobicContact CG2-CD2 4.09Å; L133-L190 HydrophobicContact CD1-CD2 4.42Å; F148-L190 HydrophobicContact CE2-CD1 3.8Å; F148-L190 HydrophobicContact CZ-CD1 3.74Å; F160-L190 HydrophobicContact CE2-CD1 3.99Å; F160-L190 HydrophobicContact CZ-CD1 3.97Å; F176-L190 CarbonylContact C-O 3.59Å; F176-L190 VanDerWaalsContact CA-O 3.29Å; F176-L190 WeakPolarHBondContact CA-O 3.49Å; L177-L190 HydrophobicContact CB-CB 4.42Å; L177-L190 PolarHBondContact N-O 2.87Å; L177-L190 PolarHBondContact O-N 3.32Å; L190-M192 HydrophobicContact CB-CE 4.24Å
191	W	93.8	Very high	89.1	Confident	48 Å²	48	54.4 Å²	54.4	18%	0.182	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	125.7	174.1	-74.1	77.5	0	0	0	108.2	L121 K124 M174 F176 E189	L121-W191 WeakPolarHBondContact CB-O 3.46Å; L121-W191 HydrophobicContact CD1-CB 4.12Å; L121-W191 PolarHBondContact N-O 2.75Å; K124-W191 HydrophobicContact CB-CB 4.42Å; K124-W191 HydrophobicContact CD-CB 4.11Å; K124-W191 HydrophobicContact CD-CG 4.23Å; M174-W191 HydrophobicContact SD-CE3 4.49Å; F176-W191 HydrophobicContact CB-CD2 3.83Å; F176-W191 HydrophobicContact CB-CE3 3.95Å; F176-W191 HydrophobicContact CB-CG 4.37Å; F176-W191 HydrophobicContact CB-CH2 4.22Å; F176-W191 HydrophobicContact CB-CZ2 4.11Å; F176-W191 HydrophobicContact CB-CZ3 4.15Å; F176-W191 HydrophobicContact CD1-CH2 4.08Å; F176-W191 HydrophobicContact CD1-CZ3 4.26Å; F176-W191 HydrophobicContact CG-CH2 4.29Å; F176-W191 HydrophobicContact CG-CZ2 4.31Å; E189-W191 PolarHBondContact OE2-NE1 3.33Å
192	M	94.6	Very high	89.1	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.7	-176.4	70.2	-156.7	76	0	0	111.6	V118 K119 I120 F139 F148 M174 F175 L177 L190	V118-M192 HydrophobicContact CB-CB 4.18Å; V118-M192 HydrophobicContact CB-CG 4.09Å; V118-M192 HydrophobicContact CB-SD 4.12Å; V118-M192 HydrophobicContact CG1-CG 4.38Å; V118-M192 HydrophobicContact CG1-SD 4.19Å; V118-M192 HydrophobicContact CG2-CB 4.31Å; V118-M192 HydrophobicContact CG2-CG 4.33Å; V118-M192 HydrophobicContact CG2-SD 3.85Å; K119-M192 WeakPolarHBondContact O-CA 3.2Å; I120-M192 HydrophobicContact CG1-CB 4.17Å; F139-M192 HydrophobicContact CD2-CE 4.42Å; F139-M192 HydrophobicContact CD2-SD 3.74Å; F139-M192 HydrophobicContact CE2-CE 4.33Å; F139-M192 HydrophobicContact CE2-SD 4.08Å; F148-M192 HydrophobicContact CE1-CE 3.77Å; F148-M192 HydrophobicContact CE1-SD 3.97Å; F148-M192 HydrophobicContact CZ-CE 3.85Å; M174-M192 CarbonylContact C-O 3.58Å; M174-M192 VanDerWaalsContact CA-O 3.28Å; M174-M192 WeakPolarHBondContact CA-O 3.36Å; F175-M192 HydrophobicContact CB-CG 4Å; F175-M192 HydrophobicContact CD1-CE 3.86Å; F175-M192 HydrophobicContact CD1-CG 4.35Å; F175-M192 HydrophobicContact CD1-SD 3.87Å; F175-M192 HydrophobicContact CE1-CE 4.47Å; F175-M192 PolarHBondContact N-O 3.33Å; F175-M192 PolarHBondContact O-N 2.67Å; L177-M192 HydrophobicContact CB-CE 4.23Å; L190-M192 HydrophobicContact CB-CE 4.24Å
193	N	93.7	Very high	89.3	Confident	44 Å²	44	43.1 Å²	43.1	24%	0.235	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	128.4	177	-159.8	109.8	0	0	0	108.7	K119 L121 N173	K119-N193 HydrophobicContact CB-CB 4.3Å; K119-N193 PolarHBondContact N-O 3.03Å; K119-N193 PolarHBondContact O-N 2.87Å; L121-N193 HydrophobicContact CD2-CB 4.4Å; N173-N193 PolarHBondContact ND2-ND2 3.43Å; N173-N193 WeakPolarHBondContact O-CA 3.2Å
194	T	92.3	Very high	89.7	Confident	6 Å²	6	44.7 Å²	44.7	4%	0.037	25%	0.251	C	S	.	.			trans	-84.8	177.5	169.6	54.2	0	0	0	0	110.5	V118 N173 D196 D199 A200 I203	V118-T194 HydrophobicContact CG1-CG2 4.46Å; N173-T194 PolarHBondContact O-N 3.29Å; N173-T194 PolarHBondContact O-OG1 3.37Å; N173-T194 VanDerWaalsContact O-OG1 3.12Å; T194-D196 PolarHBondContact OG1-O 3.48Å; T194-D199 HydrophobicContact CG2-CB 4.18Å; T194-A200 HydrophobicContact CG2-CB 3.97Å; T194-I203 HydrophobicContact CG2-CD1 3.79Å
195	E	85.9	Confident	90.2	Very high	77 Å²	77	40.6 Å²	40.6	36%	0.36	23%	0.227	S	C	.	.	S	Bend	trans	-68.8	-68.5	166.8	-60.9	-174.6	119.9	0	0	109.3	E897 G898	E195-E897 VanDerWaalsContact OE1-CA 3.27Å; E195-E897 WeakPolarHBondContact OE1-CA 3.44Å; E195-G898 PolarHBondContact OE1-N 3.31Å
196	D	83.9	Confident	90.5	Very high	57 Å²	57	39.6 Å²	39.6	31%	0.305	22%	0.221	S	C	.	.	S	Bend	trans	-101.3	158.2	179.6	-83.7	-47.3	0	0	0	113.1	T194 L198 D199	T194-D196 PolarHBondContact OG1-O 3.48Å; D196-L198 PolarHBondContact O-N 3.01Å; D196-D199 PolarHBondContact O-N 2.85Å
197	V	88.2	Confident	90.8	Very high	73 Å²	73	38.2 Å²	38.2	44%	0.442	21%	0.207	S	C	.	.	H	α-helix	trans	-57.8	-35.5	169.8	179.4	0	0	0	0	111	N173 D199 A200 V201	N173-V197 HydrophobicContact CB-CG2 4.12Å; V197-D199 VanDerWaalsContact C-N 3.33Å; V197-D199 PolarHBondContact O-N 3.09Å; V197-A200 PolarHBondContact O-N 3.42Å; V197-A200 VanDerWaalsContact O-N 3.14Å; V197-V201 HydrophobicContact CG1-CG2 4.47Å; V197-V201 WeakPolarHBondContact O-CG2 3.3Å; V197-V201 PolarHBondContact O-N 2.92Å
198	L	86.9	Confident	90.8	Very high	90 Å²	90	38.3 Å²	38.3	47%	0.471	20%	0.2	S	C	.	.	H	α-helix	trans	-65	-34.8	-179.6	-61.2	-179.2	0	0	0	112.5	L55 D196 V201 N202	L55-L198 HydrophobicContact CB-CD1 3.47Å; L55-L198 VanDerWaalsContact CB-CD1 3.47Å; L55-L198 HydrophobicContact CD1-CD1 4.28Å; D196-L198 PolarHBondContact O-N 3.01Å; L198-V201 PolarHBondContact O-N 3.42Å; L198-N202 WeakPolarHBondContact O-CB 3.34Å; L198-N202 PolarHBondContact O-N 2.67Å
199	D	87.9	Confident	90.7	Very high	16 Å²	16	41.2 Å²	41.2	9%	0.086	21%	0.207	C	C	.	.	H	α-helix	trans	-67.3	-35.8	173.4	-82.6	-36.2	0	0	0	111.5	K52 T194 D196 V197 N202 I203	K52-D199 VanDerWaalsContact CE-OD1 3.31Å; K52-D199 WeakPolarHBondContact CE-OD1 3.37Å; K52-D199 VanDerWaalsContact NZ-CG 3.29Å; K52-D199 IonicContact NZ-OD1 2.62Å; K52-D199 PolarHBondContact NZ-OD1 2.62Å; K52-D199 IonicContact NZ-OD2 2.67Å; K52-D199 PolarHBondContact NZ-OD2 2.92Å; T194-D199 HydrophobicContact CG2-CB 4.18Å; D196-D199 PolarHBondContact O-N 2.85Å; V197-D199 VanDerWaalsContact C-N 3.33Å; V197-D199 PolarHBondContact O-N 3.09Å; D199-N202 PolarHBondContact O-N 3.31Å; D199-I203 WeakPolarHBondContact O-CD1 3.45Å; D199-I203 WeakPolarHBondContact O-CG1 3.35Å; D199-I203 PolarHBondContact O-N 3.29Å
200	A	91.9	Very high	90.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-68.9	-36.4	176.7	0	0	0	0	0	112.7	H170 T194 V197 H204	H170-A200 HydrophobicContact CB-CB 4.06Å; H170-A200 WeakPolarHBondContact CB-O 3.44Å; T194-A200 HydrophobicContact CG2-CB 3.97Å; V197-A200 PolarHBondContact O-N 3.42Å; V197-A200 VanDerWaalsContact O-N 3.14Å; A200-H204 PolarHBondContact O-N 3.38Å
201	V	91.6	Very high	90.1	Very high	50 Å²	50	40.9 Å²	40.9	30%	0.303	21%	0.207	S	C	.	.	H	α-helix	trans	-67.9	-44.5	171.9	176.2	0	0	0	0	110.7	V197 L198 H204 E205	V197-V201 HydrophobicContact CG1-CG2 4.47Å; V197-V201 WeakPolarHBondContact O-CG2 3.3Å; V197-V201 PolarHBondContact O-N 2.92Å; L198-V201 PolarHBondContact O-N 3.42Å; V201-H204 WeakPolarHBondContact O-CB 3.24Å; V201-H204 PolarHBondContact O-N 3.03Å; V201-H204 VanDerWaalsContact O-N 3.12Å; V201-E205 PolarHBondContact O-N 2.96Å
202	N	89.9	Confident	89.7	Confident	72 Å²	72	43.7 Å²	43.7	39%	0.385	22%	0.222	S	C	.	.	H	α-helix	trans	-57.7	-52.8	178	-174.5	24.3	0	0	0	111.3	W116 L198 D199 H204 E205 T206	W116-N202 PolarHBondContact NE1-ND2 3.43Å; L198-N202 WeakPolarHBondContact O-CB 3.34Å; L198-N202 PolarHBondContact O-N 2.67Å; D199-N202 PolarHBondContact O-N 3.31Å; N202-H204 PolarHBondContact O-N 3.1Å; N202-H204 VanDerWaalsContact O-N 3.17Å; N202-E205 PolarHBondContact O-N 2.88Å; N202-T206 WeakPolarHBondContact O-CB 3.3Å; N202-T206 PolarHBondContact O-N 3.4Å; N202-T206 PolarHBondContact O-OG1 3.49Å; N202-T206 PolarHBondContact OD1-OG1 3.25Å
203	I	92.3	Very high	89.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-54.7	-37.8	175.5	-64.5	161.1	0	0	0	111.4	W116 V118 F139 F175 T194 D199 M207	W116-I203 HydrophobicContact CB-CD1 4.14Å; W116-I203 HydrophobicContact CB-CG1 4.47Å; W116-I203 HydrophobicContact CD2-CD1 4.15Å; W116-I203 HydrophobicContact CD2-CG1 3.51Å; W116-I203 HydrophobicContact CE3-CG1 4.04Å; W116-I203 HydrophobicContact CG-CD1 3.92Å; W116-I203 HydrophobicContact CG-CG1 3.75Å; W116-I203 HydrophobicContact CH2-CG1 4.22Å; W116-I203 HydrophobicContact CZ2-CB 4.37Å; W116-I203 HydrophobicContact CZ2-CG1 3.79Å; W116-I203 HydrophobicContact CZ3-CG1 4.36Å; V118-I203 HydrophobicContact CG1-CD1 4.29Å; F139-I203 HydrophobicContact CE1-CG2 4.12Å; F139-I203 HydrophobicContact CZ-CG2 4.15Å; F175-I203 HydrophobicContact CD1-CG2 4Å; F175-I203 HydrophobicContact CD2-CB 4.23Å; F175-I203 HydrophobicContact CD2-CG2 3.85Å; F175-I203 HydrophobicContact CE1-CG2 3.81Å; F175-I203 HydrophobicContact CE2-CB 4.34Å; F175-I203 HydrophobicContact CE2-CG2 3.66Å; F175-I203 HydrophobicContact CG-CG2 4.02Å; F175-I203 HydrophobicContact CZ-CG2 3.64Å; T194-I203 HydrophobicContact CG2-CD1 3.79Å; D199-I203 WeakPolarHBondContact O-CD1 3.45Å; D199-I203 WeakPolarHBondContact O-CG1 3.35Å; D199-I203 PolarHBondContact O-N 3.29Å; I203-M207 WeakPolarHBondContact O-CB 3.31Å; I203-M207 PolarHBondContact O-N 3.07Å
204	H	92.6	Very high	88.4	Confident	39 Å²	39	46.9 Å²	46.9	18%	0.181	24%	0.236	C	C	.	.	H	α-helix	trans	-66.8	-49.1	178.5	180	61.7	0	0	0	113.2	Y168 H170 F175 A200 V201 N202 K208	Y168-H204 AromaticContact CD2-ND1 3.54Å; Y168-H204 AromaticContact CE2-CE1 3.78Å; Y168-H204 AromaticContact CE2-ND1 3.57Å; H170-H204 AromaticContact CE1-CD2 3.8Å; H170-H204 WeakPolarHBondContact ND1-CB 3.42Å; H170-H204 AromaticContact ND1-CD2 3.54Å; H170-H204 AromaticContact ND1-CG 3.49Å; F175-H204 HydrophobicContact CE2-CB 4.19Å; A200-H204 PolarHBondContact O-N 3.38Å; V201-H204 WeakPolarHBondContact O-CB 3.24Å; V201-H204 PolarHBondContact O-N 3.03Å; V201-H204 VanDerWaalsContact O-N 3.12Å; N202-H204 PolarHBondContact O-N 3.1Å; N202-H204 VanDerWaalsContact O-N 3.17Å; H204-K208 WeakPolarHBondContact O-CB 3.35Å; H204-K208 PolarHBondContact O-N 3.19Å
205	E	92	Very high	87.7	Confident	83 Å²	83	51 Å²	51	39%	0.388	26%	0.255	S	S	.	.	H	α-helix	trans	-70.8	-38.4	-179.4	-63.6	-58.9	148.6	0	0	111.9	V201 N202 K208 Q209	V201-E205 PolarHBondContact O-N 2.96Å; N202-E205 PolarHBondContact O-N 2.88Å; E205-K208 WeakPolarHBondContact O-CB 3.26Å; E205-K208 PolarHBondContact O-N 3.3Å; E205-K208 IonicContact OE2-NZ 3.66Å; E205-K208 PolarHBondContact OE2-NZ 3.41Å; E205-Q209 PolarHBondContact O-N 2.93Å
206	T	90.5	Very high	87.1	Confident	14 Å²	14	52 Å²	52	9%	0.086	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-45.1	174.3	-51.6	0	0	0	0	111.9	H114 W116 L141 N202 K208 Q209 I210	H114-T206 HydrophobicContact CB-CG2 4.35Å; H114-T206 WeakPolarHBondContact CD2-CG2 3.25Å; H114-T206 WeakPolarHBondContact NE2-CG2 3.39Å; W116-T206 HydrophobicContact CH2-CG2 3.92Å; W116-T206 HydrophobicContact CZ2-CG2 4.33Å; L141-T206 HydrophobicContact CD2-CG2 4.05Å; N202-T206 WeakPolarHBondContact O-CB 3.3Å; N202-T206 PolarHBondContact O-N 3.4Å; N202-T206 PolarHBondContact O-OG1 3.49Å; N202-T206 PolarHBondContact OD1-OG1 3.25Å; T206-K208 VanDerWaalsContact C-N 3.26Å; T206-K208 PolarHBondContact O-N 3.34Å; T206-Q209 PolarHBondContact O-N 3.05Å; T206-I210 HydrophobicContact CG2-CD1 4.08Å; T206-I210 PolarHBondContact O-N 3.47Å; T206-I210 VanDerWaalsContact O-N 3.08Å
207	M	91.3	Very high	86.3	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.6	-39.5	174.5	180	68.2	60.7	0	0	111.6	F139 L141 V146 L162 I165 Y168 I203 L211	F139-M207 HydrophobicContact CE1-CE 4.2Å; F139-M207 HydrophobicContact CZ-CE 3.69Å; L141-M207 HydrophobicContact CD1-CE 4.06Å; L141-M207 HydrophobicContact CD1-SD 4.39Å; L141-M207 HydrophobicContact CD2-CE 4.19Å; V146-M207 HydrophobicContact CG2-CE 3.63Å; V146-M207 HydrophobicContact CG2-SD 4.42Å; L162-M207 HydrophobicContact CD2-SD 3.89Å; I165-M207 HydrophobicContact CD1-SD 4.14Å; Y168-M207 HydrophobicContact CD1-CG 4.19Å; Y168-M207 HydrophobicContact CD2-CB 4.02Å; Y168-M207 HydrophobicContact CD2-CG 3.5Å; Y168-M207 VanDerWaalsContact CD2-CG 3.5Å; Y168-M207 HydrophobicContact CE1-CG 4.34Å; Y168-M207 HydrophobicContact CE2-CB 4Å; Y168-M207 HydrophobicContact CE2-CG 3.65Å; Y168-M207 HydrophobicContact CG-CG 3.82Å; I203-M207 WeakPolarHBondContact O-CB 3.31Å; I203-M207 PolarHBondContact O-N 3.07Å; M207-L211 HydrophobicContact CG-CD1 3.84Å; M207-L211 VanDerWaalsContact O-CB 3.29Å; M207-L211 WeakPolarHBondContact O-CB 3.11Å; M207-L211 WeakPolarHBondContact O-CD1 3.35Å; M207-L211 VanDerWaalsContact O-CG 3.26Å; M207-L211 WeakPolarHBondContact O-CG 3.41Å; M207-L211 PolarHBondContact O-N 2.97Å; M207-L211 HydrophobicContact SD-CD1 3.93Å; M207-L211 HydrophobicContact SD-CG 4.34Å
208	K	90.7	Very high	85.2	Confident	64 Å²	64	53.2 Å²	53.2	28%	0.278	26%	0.256	S	S	.	.	H	α-helix	trans	-65.1	-51	178.3	-180	-175.6	125.7	-146.9	0	111.7	Y168 H204 E205 T206 I210 L211 E212	Y168-K208 HydrophobicContact CE2-CB 4.22Å; Y168-K208 VanDerWaalsContact OH-CA 3.32Å; Y168-K208 WeakPolarHBondContact OH-CA 3.39Å; Y168-K208 WeakPolarHBondContact OH-CB 3.45Å; H204-K208 WeakPolarHBondContact O-CB 3.35Å; H204-K208 PolarHBondContact O-N 3.19Å; E205-K208 WeakPolarHBondContact O-CB 3.26Å; E205-K208 PolarHBondContact O-N 3.3Å; E205-K208 IonicContact OE2-NZ 3.66Å; E205-K208 PolarHBondContact OE2-NZ 3.41Å; T206-K208 VanDerWaalsContact C-N 3.26Å; T206-K208 PolarHBondContact O-N 3.34Å; K208-I210 PolarHBondContact O-N 2.78Å; K208-L211 PolarHBondContact O-N 3.35Å; K208-E212 HydrophobicContact CG-CG 4.45Å; K208-E212 WeakPolarHBondContact CG-OE1 3.18Å; K208-E212 WeakPolarHBondContact O-CB 3.49Å; K208-E212 WeakPolarHBondContact O-CG 3.4Å; K208-E212 PolarHBondContact O-N 3.29Å
209	Q	88.7	Confident	84.2	Confident	83 Å²	83	54.6 Å²	54.6	39%	0.388	26%	0.26	S	S	.	.	H	α-helix	trans	-55	-53	176.7	179.1	179.9	-14.5	0	0	111.2	E205 T206 L211 E212 E213	E205-Q209 PolarHBondContact O-N 2.93Å; T206-Q209 PolarHBondContact O-N 3.05Å; Q209-L211 VanDerWaalsContact C-N 3.28Å; Q209-L211 PolarHBondContact O-N 3.46Å; Q209-E212 PolarHBondContact O-N 2.92Å; Q209-E212 VanDerWaalsContact O-N 3.12Å; Q209-E213 HydrophobicContact CG-CG 4.47Å; Q209-E213 VanDerWaalsContact CG-OE1 3.25Å; Q209-E213 WeakPolarHBondContact CG-OE1 3.42Å; Q209-E213 PolarHBondContact NE2-OE1 3.23Å; Q209-E213 WeakPolarHBondContact O-CG 3.42Å; Q209-E213 PolarHBondContact O-N 3.06Å
210	I	87.7	Confident	83.1	Confident	8 Å²	8	62 Å²	62	4%	0.041	29%	0.287	C	S	.	.	H	α-helix	trans	-62.8	-34.3	-177.7	-71.8	171.7	0	0	0	111.9	L141 L162 T206 K208 N214	L141-I210 HydrophobicContact CD2-CD1 3.76Å; L141-I210 HydrophobicContact CG-CD1 3.89Å; L162-I210 HydrophobicContact CD1-CG2 3.75Å; T206-I210 HydrophobicContact CG2-CD1 4.08Å; T206-I210 PolarHBondContact O-N 3.47Å; T206-I210 VanDerWaalsContact O-N 3.08Å; K208-I210 PolarHBondContact O-N 2.78Å; I210-N214 VanDerWaalsContact O-CB 3.26Å; I210-N214 WeakPolarHBondContact O-CB 3.42Å; I210-N214 PolarHBondContact O-N 2.78Å; I210-N214 PolarHBondContact O-ND2 2.91Å
211	L	85.7	Confident	81.4	Confident	34 Å²	34	68.1 Å²	68.1	18%	0.178	32%	0.32	C	S	.	.	H	α-helix	trans	-73.6	-34.6	174.9	-77.5	171.4	0	0	0	113.3	L162 Y168 M207 K208 Q209 H215	L162-L211 HydrophobicContact CB-CD2 3.85Å; L162-L211 HydrophobicContact CD1-CD2 4.16Å; L162-L211 HydrophobicContact CD2-CD2 4.12Å; L162-L211 HydrophobicContact CG-CD2 4.25Å; Y168-L211 HydrophobicContact CD1-CD1 3.88Å; Y168-L211 HydrophobicContact CE1-CD1 3.29Å; M207-L211 HydrophobicContact CG-CD1 3.84Å; M207-L211 VanDerWaalsContact O-CB 3.29Å; M207-L211 WeakPolarHBondContact O-CB 3.11Å; M207-L211 WeakPolarHBondContact O-CD1 3.35Å; M207-L211 VanDerWaalsContact O-CG 3.26Å; M207-L211 WeakPolarHBondContact O-CG 3.41Å; M207-L211 PolarHBondContact O-N 2.97Å; M207-L211 HydrophobicContact SD-CD1 3.93Å; M207-L211 HydrophobicContact SD-CG 4.34Å; K208-L211 PolarHBondContact O-N 3.35Å; Q209-L211 VanDerWaalsContact C-N 3.28Å; Q209-L211 PolarHBondContact O-N 3.46Å; L211-H215 VanDerWaalsContact O-CB 3.3Å; L211-H215 WeakPolarHBondContact O-CB 3.27Å; L211-H215 PolarHBondContact O-N 3.43Å
212	E	85.2	Confident	79.4	Confident	108 Å²	108	72 Å²	72	51%	0.505	34%	0.336	S	S	.	.	H	α-helix	trans	-67.7	-46.6	174.5	-74.3	170.8	175.1	0	0	110.4	K208 Q209 N214 H215 E216	K208-E212 HydrophobicContact CG-CG 4.45Å; K208-E212 WeakPolarHBondContact CG-OE1 3.18Å; K208-E212 WeakPolarHBondContact O-CB 3.49Å; K208-E212 WeakPolarHBondContact O-CG 3.4Å; K208-E212 PolarHBondContact O-N 3.29Å; Q209-E212 PolarHBondContact O-N 2.92Å; Q209-E212 VanDerWaalsContact O-N 3.12Å; E212-N214 PolarHBondContact O-N 3.48Å; E212-H215 WeakPolarHBondContact O-CB 3.39Å; E212-H215 PolarHBondContact O-N 2.78Å; E212-H215 VanDerWaalsContact O-N 3.11Å; E212-E216 PolarHBondContact O-N 2.91Å
213	E	81.7	Confident	77.4	Confident	96 Å²	96	73.9 Å²	73.9	45%	0.449	35%	0.352	S	S	.	.	H	α-helix	trans	-60	-44	172.4	-69.9	175.7	-164.2	0	0	112.1	Q209 H215 E216 L217	Q209-E213 HydrophobicContact CG-CG 4.47Å; Q209-E213 VanDerWaalsContact CG-OE1 3.25Å; Q209-E213 WeakPolarHBondContact CG-OE1 3.42Å; Q209-E213 PolarHBondContact NE2-OE1 3.23Å; Q209-E213 WeakPolarHBondContact O-CG 3.42Å; Q209-E213 PolarHBondContact O-N 3.06Å; E213-H215 VanDerWaalsContact C-N 3.28Å; E213-H215 PolarHBondContact O-N 2.89Å; E213-E216 PolarHBondContact O-N 3.1Å; E213-L217 WeakPolarHBondContact O-CG 3.32Å; E213-L217 PolarHBondContact O-N 3.08Å
214	N	79.2	Confident	75.4	Confident	15 Å²	15	80.4 Å²	80.4	8%	0.08	39%	0.392	C	S	.	.	H	α-helix	trans	-60.1	-37.4	173.4	-98.9	-100.7	0	0	0	112.8	S143 I210 E212 R218	S143-N214 PolarHBondContact O-ND2 2.93Å; S143-N214 PolarHBondContact O-OD1 3.5Å; I210-N214 VanDerWaalsContact O-CB 3.26Å; I210-N214 WeakPolarHBondContact O-CB 3.42Å; I210-N214 PolarHBondContact O-N 2.78Å; I210-N214 PolarHBondContact O-ND2 2.91Å; E212-N214 PolarHBondContact O-N 3.48Å; N214-R218 WeakPolarHBondContact O-CB 3.19Å; N214-R218 VanDerWaalsContact O-CG 3.24Å; N214-R218 WeakPolarHBondContact O-CG 3.43Å; N214-R218 PolarHBondContact O-N 2.81Å
215	H	77.6	Confident	73.3	Confident	91 Å²	91	86.1 Å²	86.1	42%	0.421	42%	0.418	S	S	.	.	H	α-helix	trans	-69.9	-40.7	179	178.5	-121.9	0	0	0	110.9	L211 E212 E213 R218 Q219	L211-H215 VanDerWaalsContact O-CB 3.3Å; L211-H215 WeakPolarHBondContact O-CB 3.27Å; L211-H215 PolarHBondContact O-N 3.43Å; E212-H215 WeakPolarHBondContact O-CB 3.39Å; E212-H215 PolarHBondContact O-N 2.78Å; E212-H215 VanDerWaalsContact O-N 3.11Å; E213-H215 VanDerWaalsContact C-N 3.28Å; E213-H215 PolarHBondContact O-N 2.89Å; H215-R218 PolarHBondContact O-N 3.49Å; H215-Q219 PolarHBondContact CE1-NE2 3.39Å; H215-Q219 PolarHBondContact NE2-NE2 2.88Å; H215-Q219 WeakPolarHBondContact O-CG 3.48Å; H215-Q219 PolarHBondContact O-N 3.17Å
216	E	72.9	Confident	70.8	Confident	99 Å²	99	87.2 Å²	87.2	46%	0.463	43%	0.433	S	S	.	.	H	α-helix	trans	-62.6	-46.9	170.8	-72.2	-160.9	-163.6	0	0	112.5	E212 E213 R218 Q219 R220	E212-E216 PolarHBondContact O-N 2.91Å; E213-E216 PolarHBondContact O-N 3.1Å; E216-R218 PolarHBondContact O-N 3.43Å; E216-Q219 PolarHBondContact O-N 3.38Å; E216-R220 WeakPolarHBondContact O-CG 3.39Å; E216-R220 PolarHBondContact O-N 2.93Å; E216-R220 IonicContact OE2-CZ 3.71Å; E216-R220 IonicContact OE2-NE 2.73Å; E216-R220 IonicContact OE2-NH2 3.16Å; E216-R220 PolarHBondContact OE2-NH2 3.44Å
217	L	68	Low	68.4	Low	64 Å²	64	98 Å²	98	34%	0.335	47%	0.472	S	S	.	.	H	α-helix	trans	-58.7	-35.6	175.6	-71.7	172	0	0	0	111.6	E213 N221	E213-L217 WeakPolarHBondContact O-CG 3.32Å; E213-L217 PolarHBondContact O-N 3.08Å; L217-N221 VanDerWaalsContact O-CB 3.24Å; L217-N221 WeakPolarHBondContact O-CB 3.17Å; L217-N221 PolarHBondContact O-N 2.99Å; L217-N221 PolarHBondContact O-ND2 2.91Å
218	R	64.9	Low	66	Low	92 Å²	92	106.7 Å²	106.7	35%	0.347	51%	0.505	S	S	.	.	H	α-helix	trans	-70.6	-31.9	173	-75.8	172	-171.2	170.7	9.4	113.5	N214 H215 E216 M222	N214-R218 WeakPolarHBondContact O-CB 3.19Å; N214-R218 VanDerWaalsContact O-CG 3.24Å; N214-R218 WeakPolarHBondContact O-CG 3.43Å; N214-R218 PolarHBondContact O-N 2.81Å; H215-R218 PolarHBondContact O-N 3.49Å; E216-R218 PolarHBondContact O-N 3.43Å; R218-M222 WeakPolarHBondContact O-CB 3.15Å; R218-M222 PolarHBondContact O-N 2.77Å
219	Q	66.7	Low	63.3	Low	118 Å²	118	108.4 Å²	108.4	55%	0.551	53%	0.531	S	S	*	.	H	α-helix	trans	-72.6	-44.7	173.4	-71.5	-175.3	17.8	0	0	111.7	H215 E216 N221 M222	H215-Q219 PolarHBondContact CE1-NE2 3.39Å; H215-Q219 PolarHBondContact NE2-NE2 2.88Å; H215-Q219 WeakPolarHBondContact O-CG 3.48Å; H215-Q219 PolarHBondContact O-N 3.17Å; E216-Q219 PolarHBondContact O-N 3.38Å; Q219-N221 VanDerWaalsContact C-N 3.33Å; Q219-N221 PolarHBondContact O-N 3.07Å; Q219-M222 WeakPolarHBondContact O-CB 3.34Å; Q219-M222 PolarHBondContact O-N 2.85Å
220	R	63	Low	61.3	Low	173 Å²	173	112.8 Å²	112.8	65%	0.653	55%	0.545	S	S	*	.	H	α-helix	trans	-63.9	-37.2	177.3	-62.5	176	-154.5	170.2	5.1	112.2	E216	E216-R220 WeakPolarHBondContact O-CG 3.39Å; E216-R220 PolarHBondContact O-N 2.93Å; E216-R220 IonicContact OE2-CZ 3.71Å; E216-R220 IonicContact OE2-NE 2.73Å; E216-R220 IonicContact OE2-NH2 3.16Å; E216-R220 PolarHBondContact OE2-NH2 3.44Å
221	N	58.1	Low	59.1	Low	127 Å²	127	116.3 Å²	116.3	68%	0.679	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	4	176.4	-65.1	-58.8	0	0	0	113.9	L217 Q219 P223	L217-N221 VanDerWaalsContact O-CB 3.24Å; L217-N221 WeakPolarHBondContact O-CB 3.17Å; L217-N221 PolarHBondContact O-N 2.99Å; L217-N221 PolarHBondContact O-ND2 2.91Å; Q219-N221 VanDerWaalsContact C-N 3.33Å; Q219-N221 PolarHBondContact O-N 3.07Å; N221-P223 WeakPolarHBondContact O-CD 3.47Å
222	M	48.8	Very low	56.8	Low	133 Å²	133	120.7 Å²	120.7	66%	0.655	61%	0.606	S	S	*	*	S	Bend	trans	-68	127.9	170.5	-172.9	169.4	-176.9	0	0	107.7	R218 Q219 V224	R218-M222 WeakPolarHBondContact O-CB 3.15Å; R218-M222 PolarHBondContact O-N 2.77Å; Q219-M222 WeakPolarHBondContact O-CB 3.34Å; Q219-M222 PolarHBondContact O-N 2.85Å; M222-V224 PolarHBondContact O-N 2.86Å
223	P	46.9	Very low	54.5	Low	111 Å²	111	123.1 Å²	123.1	72%	0.721	62%	0.622	S	S	*	*			trans	-56.7	119.9	171.7	-23.2	33.7	0	0	0	108.7	N221 E225	N221-P223 WeakPolarHBondContact O-CD 3.47Å; P223-E225 PolarHBondContact O-N 3.1Å
224	V	50.8	Low	52.6	Low	136 Å²	136	124 Å²	124	82%	0.824	64%	0.639	S	S	*	*			trans	-69	83.5	165.7	-178.5	0	0	0	0	106.1	M222 P226	M222-V224 PolarHBondContact O-N 2.86Å; V224-P226 VanDerWaalsContact O-CD 3.24Å; V224-P226 WeakPolarHBondContact O-CD 3.16Å; V224-P226 VanDerWaalsContact O-N 3.1Å
225	E	48.1	Very low	50.7	Low	159 Å²	159	131.6 Å²	131.6	74%	0.743	68%	0.676	S	S	*	*			trans	-54.9	119.1	166.9	-174.6	-179.8	-147.1	0	0	106	P223 R227	P223-E225 PolarHBondContact O-N 3.1Å; E225-R227 PolarHBondContact O-N 3.03Å
226	P	40	Very low	49	Very low	106 Å²	106	138.4 Å²	138.4	69%	0.688	70%	0.698	S	S	*	*			trans	-60.5	113.5	-178.9	-22.3	33.4	0	0	0	107.4	V224 R228	V224-P226 VanDerWaalsContact O-CD 3.24Å; V224-P226 WeakPolarHBondContact O-CD 3.16Å; V224-P226 VanDerWaalsContact O-N 3.1Å; P226-R228 VanDerWaalsContact C-N 3.34Å; P226-R228 PolarHBondContact O-N 3.25Å
227	R	39.5	Very low	47.4	Very low	240 Å²	240	138.4 Å²	138.4	91%	0.906	71%	0.709	S	S	*	*			trans	-51.6	103.9	173.6	-77.5	-174.5	-178.7	169.9	1.7	106.7	E225 A229	E225-R227 PolarHBondContact O-N 3.03Å; R227-A229 PolarHBondContact O-N 3Å
228	R	41.6	Very low	46.2	Very low	183 Å²	183	143 Å²	143	69%	0.691	73%	0.734	S	S	*	*			trans	-58.8	111.9	178.8	-76.9	-176.6	179.9	162.7	2.1	106.7	P226 Y230	P226-R228 VanDerWaalsContact C-N 3.34Å; P226-R228 PolarHBondContact O-N 3.25Å; R228-Y230 HydrophobicContact CB-CD2 3.69Å; R228-Y230 HydrophobicContact CB-CE2 3.4Å; R228-Y230 HydrophobicContact CB-CG 4.5Å; R228-Y230 VanDerWaalsContact CD-OH 3.23Å; R228-Y230 WeakPolarHBondContact CD-OH 2.98Å; R228-Y230 HydrophobicContact CG-CE2 4.22Å; R228-Y230 PolarHBondContact NH1-OH 3.05Å; R228-Y230 WeakPolarHBondContact O-CD2 3.49Å; R228-Y230 PolarHBondContact O-N 3.25Å
229	A	33.8	Very low	45	Very low	100 Å²	100	143.9 Å²	143.9	83%	0.826	76%	0.755	S	S	*	*			trans	-70.2	75.9	174.2	0	0	0	0	0	108.1	R227 A231	R227-A229 PolarHBondContact O-N 3Å; A229-A231 PolarHBondContact O-N 3.35Å; A229-A231 VanDerWaalsContact O-N 3.08Å
230	Y	46.1	Very low	43.9	Very low	175 Å²	175	144.9 Å²	144.9	69%	0.686	77%	0.768	S	S	*	*			trans	-63.6	111.5	174.7	-79.1	-72.2	0	0	0	107.9	R228	R228-Y230 HydrophobicContact CB-CD2 3.69Å; R228-Y230 HydrophobicContact CB-CE2 3.4Å; R228-Y230 HydrophobicContact CB-CG 4.5Å; R228-Y230 VanDerWaalsContact CD-OH 3.23Å; R228-Y230 WeakPolarHBondContact CD-OH 2.98Å; R228-Y230 HydrophobicContact CG-CE2 4.22Å; R228-Y230 PolarHBondContact NH1-OH 3.05Å; R228-Y230 WeakPolarHBondContact O-CD2 3.49Å; R228-Y230 PolarHBondContact O-N 3.25Å
231	A	42.6	Very low	42.7	Very low	83 Å²	83	142.1 Å²	142.1	69%	0.686	78%	0.776	S	S	*	*			trans	-62.9	148.4	-166.3	0	0	0	0	0	112.4	A229 N233	A229-A231 PolarHBondContact O-N 3.35Å; A229-A231 VanDerWaalsContact O-N 3.08Å; A231-N233 VanDerWaalsContact C-N 3.27Å; A231-N233 PolarHBondContact O-N 2.88Å
232	P	36.5	Very low	42.1	Very low	126 Å²	126	142.3 Å²	142.3	82%	0.818	78%	0.781	S	S	*	*	S	Bend	trans	-75.3	77.3	176.4	32.6	-35.5	0	0	0	110.6
233	N	38.1	Very low	41.6	Very low	158 Å²	158	142 Å²	142	85%	0.845	79%	0.792	S	S	*	*			trans	-166.1	97.1	166.4	-101.4	-35.2	0	0	0	112.8	A231	A231-N233 VanDerWaalsContact C-N 3.27Å; A231-N233 PolarHBondContact O-N 2.88Å
234	S	41.4	Very low	41	Very low	114 Å²	114	139.7 Å²	139.7	80%	0.797	79%	0.788	S	S	*	*			trans	-165.2	98.4	142.8	-166.3	0	0	0	0	110.1
235	M	39.1	Very low	40.6	Very low	176 Å²	176	142.3 Å²	142.3	87%	0.867	79%	0.792	S	S	*	*			trans	-92.9	158.3	162.8	-60.4	-165.6	90.7	0	0	109.3
236	R	41	Very low	39.9	Very low	233 Å²	233	139.8 Å²	139.8	88%	0.879	79%	0.791	S	S	*	*			trans	78.8	130.3	-173.5	-46.5	166.3	176.3	-168.7	-2.8	111.6
237	S	40.4	Very low	39.6	Very low	100 Å²	100	138.2 Å²	138.2	70%	0.699	80%	0.795	S	S	*	*			cis	-150.5	142.8	20.8	-58	0	0	0	0	112.8
238	N	42.8	Very low	39.6	Very low	159 Å²	159	136 Å²	136	85%	0.85	80%	0.795	S	S	*	*			trans	50.2	144.8	138.4	-54.5	-4	0	0	0	120.8
239	S	38.7	Very low	39.1	Very low	112 Å²	112	134.2 Å²	134.2	78%	0.783	80%	0.796	S	S	*	*			cis	-144.2	146.9	6.9	47.5	0	0	0	0	112.3
240	V	43.9	Very low	39.2	Very low	138 Å²	138	137.9 Å²	137.9	84%	0.836	79%	0.794	S	S	*	*			trans	-126.5	121.1	161.7	173.6	0	0	0	0	107.2	V242	V240-V242 HydrophobicContact CG1-CG2 4.44Å
241	S	37.5	Very low	38.5	Very low	116 Å²	116	136.8 Å²	136.8	81%	0.811	80%	0.8	S	S	*	*			trans	-100.3	77.5	-178.5	57.6	0	0	0	0	111.1
242	V	46	Very low	38.3	Very low	131 Å²	131	139.5 Å²	139.5	79%	0.794	81%	0.808	S	S	*	*			trans	-131.2	109.5	163.2	-177	0	0	0	0	107.8	V240	V240-V242 HydrophobicContact CG1-CG2 4.44Å
243	S	38.2	Very low	38.3	Very low	125 Å²	125	137 Å²	137	87%	0.874	80%	0.804	S	S	*	*			trans	-90.7	131.2	-179.6	-53.6	0	0	0	0	110.5
244	G	35.5	Very low	38	Very low	63 Å²	63	137 Å²	137	65%	0.649	81%	0.805	S	S	*	*			trans	129.9	104.3	157.7	0	0	0	0	0	116.3
245	Q	42.2	Very low	37.8	Very low	191 Å²	191	136.5 Å²	136.5	89%	0.893	80%	0.801	S	S	*	*			trans	64.6	143.2	143.7	-57.7	174.2	52	0	0	119.2
246	S	33	Very low	37.7	Very low	106 Å²	106	139.7 Å²	139.7	74%	0.741	80%	0.803	S	S	*	*			cis	176	126.4	-43.4	40.2	0	0	0	0	107.8
247	G	34.4	Very low	37.2	Very low	74 Å²	74	136.5 Å²	136.5	76%	0.763	80%	0.803	S	S	*	*			trans	80.9	156.1	177.7	0	0	0	0	0	114.5
248	E	37.8	Very low	36.7	Very low	194 Å²	194	143.7 Å²	143.7	91%	0.907	81%	0.814	S	S	*	*			cis	-139.3	174.3	-4.9	-73.8	-161	101.4	0	0	112.8
249	M	32.6	Very low	36.4	Very low	144 Å²	144	140.2 Å²	140.2	71%	0.709	81%	0.807	S	S	*	*			trans	-73.3	-171.5	-165	-70.7	154.8	41.5	0	0	116.7
250	F	36.2	Very low	36.4	Very low	178 Å²	178	141.9 Å²	141.9	78%	0.781	81%	0.806	S	S	*	*			trans	83.8	109.1	170.7	-51.9	-76.4	0	0	0	114.8
251	N	31.4	Very low	35.8	Very low	151 Å²	151	140 Å²	140	81%	0.807	80%	0.799	S	S	*	*			cis	85.1	152.4	25.5	-153.7	6.9	0	0	0	114.5
252	V	37.6	Very low	35.6	Very low	141 Å²	141	142.9 Å²	142.9	86%	0.855	80%	0.8	S	S	*	*			trans	75	136.6	-166.1	-169.3	0	0	0	0	112.8
253	G	35.5	Very low	35.2	Very low	72 Å²	72	143 Å²	143	74%	0.742	81%	0.807	S	S	*	*			cis	-166.1	175	-0.4	0	0	0	0	0	113.7
254	D	33.5	Very low	34.8	Very low	160 Å²	160	145.4 Å²	145.4	86%	0.856	80%	0.804	S	S	*	*			trans	-86.4	178.9	-170.1	-154.9	-16.8	0	0	0	113.6
255	S	37.2	Very low	34.7	Very low	102 Å²	102	151.7 Å²	151.7	71%	0.713	81%	0.813	S	S	*	*			trans	105.7	97.6	161.8	-47	0	0	0	0	117.6
256	R	35.8	Very low	34.3	Very low	243 Å²	243	149.3 Å²	149.3	92%	0.917	81%	0.812	S	S	*	*				178.5	122.6	102	-100.3	174.8	158.9	140.2	-4.9	113.8
257	L	31.1	Very low	34.4	Very low	167 Å²	167	151.3 Å²	151.3	87%	0.874	81%	0.814	S	S	*	*			trans	-100.2	158.7	156	-75	169.3	0	0	0	109.8
258	R	30.5	Very low	34.2	Very low	251 Å²	251	156.6 Å²	156.6	95%	0.947	82%	0.818	S	S	*	*			trans	72.5	109.7	169.7	-59	-178.4	174.5	-177.4	-2.4	118.5
259	A	35.8	Very low	33.9	Very low	85 Å²	85	156.3 Å²	156.3	70%	0.702	81%	0.814	S	S	*	*			trans	-147.7	122.9	140.2	0	0	0	0	0	106
260	I	38.4	Very low	33.8	Very low	148 Å²	148	158.5 Å²	158.5	76%	0.759	82%	0.816	S	S	*	*				58.9	96.6	99.3	-58.1	164.2	0	0	0	109.9
261	S	32.2	Very low	33.5	Very low	99 Å²	99	157.3 Å²	157.3	69%	0.692	82%	0.818	S	S	*	*				72.3	160.4	66.5	78.7	0	0	0	0	114.4
262	E	32.9	Very low	33.4	Very low	176 Å²	176	154.7 Å²	154.7	82%	0.822	81%	0.811	S	S	*	*			trans	80.1	101.3	-179.7	-56.1	-176.5	-158.3	0	0	118
263	S	36.6	Very low	33.2	Very low	134 Å²	134	155.3 Å²	155.3	94%	0.937	80%	0.803	S	S	*	*			trans	-165.7	45	144.3	15.9	0	0	0	0	110.9
264	E	31.8	Very low	32.9	Very low	175 Å²	175	155.7 Å²	155.7	82%	0.818	79%	0.794	S	S	*	*			trans	-99	107.1	176.9	-173.9	-178.2	177.5	0	0	110.3
265	K	33.2	Very low	32.9	Very low	194 Å²	194	154.6 Å²	154.6	84%	0.843	79%	0.787	S	S	*	*			trans	-170	159.5	162.6	-98.2	132.9	-163.2	172	0	109.9
266	T	33	Very low	32.6	Very low	141 Å²	141	155.5 Å²	155.5	87%	0.865	78%	0.781	S	S	*	*	S	Bend	trans	60.7	66.9	176.4	63.6	0	0	0	0	118
267	L	35.1	Very low	32.2	Very low	148 Å²	148	147.7 Å²	147.7	78%	0.775	77%	0.768	S	S	*	*			trans	-150.6	13	142.3	-119.7	171.3	0	0	0	116.1	K269	L267-K269 VanDerWaalsContact C-N 3.29Å; L267-K269 PolarHBondContact O-N 2.83Å
268	Q	29.7	Very low	32.3	Very low	185 Å²	185	143.3 Å²	143.3	86%	0.864	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	76.7	172.4	-72.2	178.7	-20.5	0	0	111.9
269	K	31.5	Very low	32.4	Very low	189 Å²	189	136.6 Å²	136.6	82%	0.822	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.8	15.2	165.7	-137.6	-177.4	177.5	177.5	0	117.6	L267	L267-K269 VanDerWaalsContact C-N 3.29Å; L267-K269 PolarHBondContact O-N 2.83Å
270	Y	31.7	Very low	32.1	Very low	189 Å²	189	137.8 Å²	137.8	74%	0.741	75%	0.745	S	S	*	*			trans	-135	9.2	175.8	-85.2	-75.8	0	0	0	115.4	S272	Y270-S272 PolarHBondContact O-N 2.54Å
271	D	29.1	Very low	32.1	Very low	154 Å²	154	135.7 Å²	135.7	82%	0.824	73%	0.728	S	S	*	*			trans	-73	66.1	170.7	-64.2	-59.3	0	0	0	111.9
272	S	29.8	Very low	32.2	Very low	96 Å²	96	135.6 Å²	135.6	67%	0.671	73%	0.725	S	S	*	*			trans	-149.3	24	171.4	81.5	0	0	0	0	113.2	Y270	Y270-S272 PolarHBondContact O-N 2.54Å
273	F	32.1	Very low	32.3	Very low	154 Å²	154	129.6 Å²	129.6	68%	0.675	70%	0.702	S	S	*	*			trans	-96.2	106	163.2	-101.7	-93.8	0	0	0	108.5	V53 L275	V53-F273 HydrophobicContact CB-CE1 4.49Å; V53-F273 HydrophobicContact CB-CZ 4.34Å; V53-F273 HydrophobicContact CG1-CZ 4.26Å; V53-F273 HydrophobicContact CG2-CE1 3.84Å; V53-F273 HydrophobicContact CG2-CZ 3.94Å; F273-L275 PolarHBondContact O-N 2.99Å
274	S	29.1	Very low	31.9	Very low	80 Å²	80	131.1 Å²	131.1	56%	0.559	69%	0.692	S	S	*	*			trans	-70.1	92.1	179.6	58.1	0	0	0	0	110.8	Q276	S274-Q276 PolarHBondContact O-N 2.97Å
275	L	33.6	Very low	31.9	Very low	136 Å²	136	129.1 Å²	129.1	71%	0.712	69%	0.687	S	S	*	*			trans	-66.8	76.4	155.4	-83.7	169	0	0	0	108.4	F273 A277	F273-L275 PolarHBondContact O-N 2.99Å; L275-A277 PolarHBondContact O-N 3.34Å
276	Q	30.8	Very low	32.3	Very low	122 Å²	122	123 Å²	123	57%	0.57	67%	0.669	S	S	*	*			trans	-69.8	85.8	167.6	-177.6	167.7	-37.7	0	0	107.2	S274 C278	S274-Q276 PolarHBondContact O-N 2.97Å; Q276-C278 PolarHBondContact O-N 3.16Å; Q276-C278 VanDerWaalsContact O-N 3.09Å
277	A	28.1	Very low	32.6	Very low	78 Å²	78	118.9 Å²	118.9	65%	0.645	64%	0.641	S	S	*	*			trans	-58.7	114.9	-176.4	0	0	0	0	0	110	L275 S279	L275-A277 PolarHBondContact O-N 3.34Å; A277-S279 PolarHBondContact O-N 2.97Å
278	C	33.8	Very low	32.6	Very low	75 Å²	75	121.6 Å²	121.6	51%	0.507	64%	0.641	S	S	.	*			trans	-75.6	64.5	176.1	-62.4	0	0	0	0	111.1	Q276 S280 Y281	Q276-C278 PolarHBondContact O-N 3.16Å; Q276-C278 VanDerWaalsContact O-N 3.09Å; C278-S280 PolarHBondContact O-N 3.22Å; C278-Y281 HydrophobicContact CB-CD2 3.49Å; C278-Y281 VanDerWaalsContact CB-CD2 3.49Å; C278-Y281 HydrophobicContact CB-CE2 3.3Å; C278-Y281 HydrophobicContact CB-CG 4.46Å
279	S	31.4	Very low	33	Very low	111 Å²	111	114.9 Å²	114.9	78%	0.776	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-9.7	178	52	0	0	0	0	114	A277	A277-S279 PolarHBondContact O-N 2.97Å
280	S	31	Very low	33.5	Very low	110 Å²	110	110 Å²	110	77%	0.769	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	1.6	-175.2	-44.3	0	0	0	0	114.7	C278	C278-S280 PolarHBondContact O-N 3.22Å
281	Y	37.7	Very low	33.8	Very low	104 Å²	104	106.6 Å²	106.6	41%	0.408	59%	0.591	S	S	.	*			trans	-90	136.3	-179.2	-65.7	-41.6	0	0	0	113.3	C278 C283	C278-Y281 HydrophobicContact CB-CD2 3.49Å; C278-Y281 VanDerWaalsContact CB-CD2 3.49Å; C278-Y281 HydrophobicContact CB-CE2 3.3Å; C278-Y281 HydrophobicContact CB-CG 4.46Å; Y281-C283 PolarHBondContact O-N 2.81Å
282	P	33.7	Very low	34.3	Very low	96 Å²	96	104 Å²	104	62%	0.623	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-63.3	-4.1	-174.8	-25.7	35	0	0	0	117.5	F284 N285	P282-F284 PolarHBondContact O-N 3.44Å; P282-F284 VanDerWaalsContact O-N 3.08Å; P282-N285 PolarHBondContact O-N 3.25Å
283	C	35.3	Very low	34.7	Very low	51 Å²	51	106.1 Å²	106.1	35%	0.345	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-63.6	-21.2	-166.1	-158.9	0	0	0	0	114.1	C111 Y281 N285 S286	C111-C283 HydrophobicContact CB-CB 4.33Å; Y281-C283 PolarHBondContact O-N 2.81Å; C283-N285 PolarHBondContact O-N 2.91Å; C283-N285 VanDerWaalsContact O-N 3.1Å; C283-S286 WeakPolarHBondContact O-CB 3.49Å; C283-S286 PolarHBondContact O-N 2.72Å
284	F	29	Very low	35.1	Very low	165 Å²	165	102.9 Å²	102.9	72%	0.724	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-55.8	-28.8	-179.1	-139.1	-89.2	0	0	0	113.8	P282 S286	P282-F284 PolarHBondContact O-N 3.44Å; P282-F284 VanDerWaalsContact O-N 3.08Å; F284-S286 VanDerWaalsContact C-N 3.33Å; F284-S286 PolarHBondContact O-N 2.73Å
285	N	32	Very low	35.8	Very low	133 Å²	133	106.1 Å²	106.1	71%	0.711	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-71.1	-23.3	179.7	-76.8	-44.8	0	0	0	114	P282 C283 L287 R288	P282-N285 PolarHBondContact O-N 3.25Å; C283-N285 PolarHBondContact O-N 2.91Å; C283-N285 VanDerWaalsContact O-N 3.1Å; N285-L287 VanDerWaalsContact C-N 3.35Å; N285-L287 PolarHBondContact O-N 2.91Å; N285-R288 PolarHBondContact O-N 2.88Å
286	S	40	Very low	36.1	Very low	67 Å²	67	103.7 Å²	103.7	47%	0.469	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66	-34.7	-175.7	-172.4	0	0	0	0	113.1	C283 F284 R288 G289 H290	C283-S286 WeakPolarHBondContact O-CB 3.49Å; C283-S286 PolarHBondContact O-N 2.72Å; F284-S286 VanDerWaalsContact C-N 3.33Å; F284-S286 PolarHBondContact O-N 2.73Å; S286-R288 PolarHBondContact O-N 3.49Å; S286-R288 VanDerWaalsContact O-N 3.1Å; S286-G289 PolarHBondContact O-N 3.37Å; S286-H290 PolarHBondContact O-N 3.39Å
287	L	39.2	Very low	36.3	Very low	53 Å²	53	106.5 Å²	106.5	28%	0.277	57%	0.566	S	S	.	*	H	α-helix	trans	-52.9	-34.8	177.1	-77.7	164.9	0	0	0	112.8	C144 N285 G289 F291	C144-L287 HydrophobicContact CB-CD2 3.9Å; N285-L287 VanDerWaalsContact C-N 3.35Å; N285-L287 PolarHBondContact O-N 2.91Å; L287-G289 VanDerWaalsContact C-N 3.32Å; L287-G289 PolarHBondContact O-N 2.72Å; L287-F291 PolarHBondContact O-N 3.03Å
288	R	36.4	Very low	36.6	Very low	206 Å²	206	107.3 Å²	107.3	78%	0.777	57%	0.567	S	S	*	*	H	α-helix	trans	-74.1	-22.4	-179.7	-147.8	177.2	-166.3	-162.3	4.2	112.9	N285 S286 N292	N285-R288 PolarHBondContact O-N 2.88Å; S286-R288 PolarHBondContact O-N 3.49Å; S286-R288 VanDerWaalsContact O-N 3.1Å; R288-N292 PolarHBondContact O-ND2 3Å
289	G	38.3	Very low	36.9	Very low	43 Å²	43	110.1 Å²	110.1	44%	0.443	58%	0.582	S	S	.	*	H	α-helix	trans	-76.8	-54.4	173	0	0	0	0	0	112.3	S286 L287 F291 N292 Y293	S286-G289 PolarHBondContact O-N 3.37Å; L287-G289 VanDerWaalsContact C-N 3.32Å; L287-G289 PolarHBondContact O-N 2.72Å; G289-F291 PolarHBondContact O-N 3.26Å; G289-N292 PolarHBondContact O-N 3.49Å; G289-Y293 PolarHBondContact O-N 3.15Å; G289-Y293 VanDerWaalsContact O-N 3.07Å
290	H	41.1	Very low	37	Very low	86 Å²	86	110.6 Å²	110.6	40%	0.398	58%	0.582	S	S	.	*	H	α-helix	trans	-60.6	-39.1	-174.8	-92.5	-150.3	0	0	0	113.7	E159 S286 N292 Y293 L294	E159-H290 IonicContact OE1-CE1 2.72Å; S286-H290 PolarHBondContact O-N 3.39Å; H290-N292 PolarHBondContact O-N 3.47Å; H290-Y293 PolarHBondContact O-N 3.03Å; H290-L294 WeakPolarHBondContact O-CG 3.25Å; H290-L294 PolarHBondContact O-N 3.32Å; H290-L294 VanDerWaalsContact O-N 3.13Å
291	F	37.8	Very low	37.3	Very low	119 Å²	119	108.8 Å²	108.8	52%	0.522	58%	0.58	S	S	.	*	H	α-helix	trans	-63.1	-40	176.9	-95.5	-87.3	0	0	0	113.1	L287 G289 Q295	L287-F291 PolarHBondContact O-N 3.03Å; G289-F291 PolarHBondContact O-N 3.26Å; F291-Q295 PolarHBondContact O-N 2.9Å
292	N	39.7	Very low	37.4	Very low	98 Å²	98	110.4 Å²	110.4	52%	0.524	60%	0.601	S	S	.	*	H	α-helix	trans	-70.6	-37.9	177.5	-76	-63.3	0	0	0	112	R288 G289 H290 L294 Q295 S296	R288-N292 PolarHBondContact O-ND2 3Å; G289-N292 PolarHBondContact O-N 3.49Å; H290-N292 PolarHBondContact O-N 3.47Å; N292-L294 VanDerWaalsContact C-N 3.3Å; N292-L294 PolarHBondContact O-N 2.66Å; N292-Q295 PolarHBondContact O-N 2.99Å; N292-S296 PolarHBondContact O-N 2.92Å; N292-S296 PolarHBondContact O-OG 2.89Å
293	Y	37.8	Very low	37.3	Very low	141 Å²	141	111.8 Å²	111.8	55%	0.553	61%	0.61	S	S	*	*	H	α-helix	trans	-68.2	-26.5	178.2	-166	-94.4	0	0	0	113.4	G289 H290 S296	G289-Y293 PolarHBondContact O-N 3.15Å; G289-Y293 VanDerWaalsContact O-N 3.07Å; H290-Y293 PolarHBondContact O-N 3.03Å; Y293-S296 PolarHBondContact O-OG 3.34Å
294	L	42.1	Very low	37.6	Very low	86 Å²	86	114.2 Å²	114.2	45%	0.45	63%	0.634	S	S	.	*	H	α-helix	trans	-82	-28.8	174.7	-69.6	174.3	0	0	0	113.2	H290 N292	H290-L294 WeakPolarHBondContact O-CG 3.25Å; H290-L294 PolarHBondContact O-N 3.32Å; H290-L294 VanDerWaalsContact O-N 3.13Å; N292-L294 VanDerWaalsContact C-N 3.3Å; N292-L294 PolarHBondContact O-N 2.66Å
295	Q	43.1	Very low	38.1	Very low	149 Å²	149	114.9 Å²	114.9	70%	0.696	64%	0.639	S	S	*	*	H	α-helix	trans	-71.8	-31.5	173.9	-80.7	-171.4	-28.3	0	0	113.2	F291 N292 R297	F291-Q295 PolarHBondContact O-N 2.9Å; N292-Q295 PolarHBondContact O-N 2.99Å; Q295-R297 VanDerWaalsContact C-N 3.3Å; Q295-R297 PolarHBondContact O-N 2.88Å
296	S	40.7	Very low	38.2	Very low	84 Å²	84	114.2 Å²	114.2	59%	0.587	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-2	-175.8	56.1	0	0	0	0	115.6	N292 Y293 S298	N292-S296 PolarHBondContact O-N 2.92Å; N292-S296 PolarHBondContact O-OG 2.89Å; Y293-S296 PolarHBondContact O-OG 3.34Å; S296-S298 VanDerWaalsContact C-N 3.35Å; S296-S298 PolarHBondContact O-N 3.04Å
297	R	33.3	Very low	38	Very low	182 Å²	182	118.3 Å²	118.3	69%	0.687	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	11.5	178.1	-83.1	-172.8	172.8	-118.5	0.3	115.4	Q295 V299	Q295-R297 VanDerWaalsContact C-N 3.3Å; Q295-R297 PolarHBondContact O-N 2.88Å; R297-V299 PolarHBondContact O-N 3.28Å
298	S	36	Very low	37.7	Very low	95 Å²	95	122.7 Å²	122.7	66%	0.664	68%	0.676	S	S	*	*	S	Bend	trans	-72.5	111.1	167.2	56.3	0	0	0	0	110.9	S296	S296-S298 VanDerWaalsContact C-N 3.35Å; S296-S298 PolarHBondContact O-N 3.04Å
299	V	39.2	Very low	37.5	Very low	134 Å²	134	117 Å²	117	81%	0.812	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-54	124.7	-173.9	179.4	0	0	0	0	113.1	R297	R297-V299 PolarHBondContact O-N 3.28Å
300	P	33.3	Very low	37.4	Very low	121 Å²	121	123.9 Å²	123.9	79%	0.786	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-70.7	128.7	167.3	-16.2	31	0	0	0	111.4
301	G	37.1	Very low	36.9	Very low	71 Å²	71	124.6 Å²	124.6	73%	0.732	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-76.6	139.9	175.1	0	0	0	0	0	112.7
302	V	40.4	Very low	36.7	Very low	139 Å²	139	127.1 Å²	127.1	84%	0.842	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-52.7	131.9	-178.6	178.5	0	0	0	0	112.8
303	P	32	Very low	36.4	Very low	124 Å²	124	125.9 Å²	125.9	81%	0.805	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-78.9	136.4	167.3	32.6	-32.7	0	0	0	111.1
304	A	41.5	Very low	36	Very low	102 Å²	102	124.8 Å²	124.8	84%	0.843	74%	0.742	S	S	*	*			trans	-111	141.9	169.3	0	0	0	0	0	109.7
305	H	38.3	Very low	35.5	Very low	180 Å²	180	131 Å²	131	83%	0.833	77%	0.766	S	S	*	*			trans	-74.8	160.5	-168.6	-122.3	-61.8	0	0	0	114
306	D	34	Very low	34.9	Very low	119 Å²	119	129.2 Å²	129.2	64%	0.636	77%	0.769	S	S	*	*			trans	-59.2	146.3	176.7	-34.1	-102.6	0	0	0	112.9
307	N	36.2	Very low	34.6	Very low	153 Å²	153	132.3 Å²	132.3	82%	0.818	79%	0.785	S	S	*	*				-174.3	145	94.4	-102.9	-71.7	0	0	0	116.3
308	N	33.4	Very low	34.4	Very low	145 Å²	145	127.4 Å²	127.4	78%	0.775	79%	0.79	S	S	*	*			trans	77.2	143	152.1	-145.5	-2	0	0	0	121.1
309	S	31.7	Very low	34.2	Very low	87 Å²	87	126.3 Å²	126.3	61%	0.608	79%	0.794	S	S	*	*			trans	-59.9	161.1	173.2	65	0	0	0	0	113.1
310	Q	37.8	Very low	34	Very low	186 Å²	186	125.9 Å²	125.9	87%	0.869	80%	0.797	S	S	*	*			cis	-146.1	-178.4	49.8	-69.7	-179.3	0.8	0	0	114.6
311	S	29.4	Very low	34	Very low	102 Å²	102	125.9 Å²	125.9	71%	0.713	80%	0.795	S	S	*	*			trans	-88.9	156.7	-168.6	51.1	0	0	0	0	115
312	I	34.4	Very low	33.8	Very low	172 Å²	172	126.4 Å²	126.4	88%	0.882	79%	0.792	S	S	*	*				168.8	147.2	123.7	-87.2	157.1	0	0	0	109.9
313	G	32.7	Very low	33.4	Very low	72 Å²	72	129.7 Å²	129.7	74%	0.742	79%	0.791	S	S	*	*			trans	98.3	97.1	156	0	0	0	0	0	116.4
314	C	29.1	Very low	33.2	Very low	117 Å²	117	128.9 Å²	128.9	79%	0.791	79%	0.788	S	S	*	*			trans	-72.1	147.8	168.3	-49.5	0	0	0	0	111.4
315	F	33	Very low	32.9	Very low	218 Å²	218	135 Å²	135	96%	0.956	79%	0.789	S	S	*	*				-160.6	150.3	122	-93.3	-61.5	0	0	0	109.8
316	S	29.1	Very low	32.5	Very low	110 Å²	110	131.8 Å²	131.8	77%	0.769	79%	0.786	S	S	*	*			trans	-116.1	131.1	-168.6	-175.4	0	0	0	0	112.2
317	V	34.6	Very low	32.5	Very low	150 Å²	150	131.1 Å²	131.1	91%	0.909	80%	0.798	S	S	*	*			trans	-134.9	99.3	165.6	-178.7	0	0	0	0	107.8
318	G	30	Very low	32.4	Very low	78 Å²	78	127.9 Å²	127.9	80%	0.804	79%	0.787	S	S	*	*			trans	-84.8	123.6	-178.4	0	0	0	0	0	112.7
319	G	31.9	Very low	32.4	Very low	73 Å²	73	129.5 Å²	129.5	75%	0.753	79%	0.789	S	S	*	*			trans	-117.8	100.3	170.3	0	0	0	0	0	111.1
320	S	33.2	Very low	32.5	Very low	124 Å²	124	129.9 Å²	129.9	87%	0.867	79%	0.792	S	S	*	*			trans	-87.1	112.8	179.4	-169.5	0	0	0	0	111.1
321	V	34.4	Very low	32.7	Very low	122 Å²	122	126.2 Å²	126.2	74%	0.739	78%	0.784	S	S	*	*			trans	-98.4	85.8	178.1	-175.8	0	0	0	0	109.7	Y323	V321-Y323 HydrophobicContact CG1-CD2 4.23Å; V321-Y323 PolarHBondContact O-N 2.78Å
322	A	32.3	Very low	32.9	Very low	81 Å²	81	125.9 Å²	125.9	67%	0.669	78%	0.782	S	S	*	*			trans	-74.6	110.5	173.5	0	0	0	0	0	110.7	S324	A322-S324 VanDerWaalsContact C-N 3.29Å; A322-S324 PolarHBondContact O-N 3.24Å
323	Y	32.6	Very low	33	Very low	209 Å²	209	125.2 Å²	125.2	82%	0.82	78%	0.779	S	S	*	*			trans	-85.6	62.3	-177.5	-130.4	-80.5	0	0	0	112.8	V321	V321-Y323 HydrophobicContact CG1-CD2 4.23Å; V321-Y323 PolarHBondContact O-N 2.78Å
324	S	28.5	Very low	33	Very low	106 Å²	106	132.1 Å²	132.1	74%	0.741	78%	0.783	S	S	*	*			trans	-93	104.3	175.7	-56.4	0	0	0	0	110.8	A322	A322-S324 VanDerWaalsContact C-N 3.29Å; A322-S324 PolarHBondContact O-N 3.24Å
325	R	34	Very low	33.3	Very low	232 Å²	232	137.1 Å²	137.1	88%	0.875	79%	0.785	S	S	*	*			trans	-136.3	96.3	168.9	-78.3	-164.6	171.1	-124.7	-3.7	112.5
326	S	30.4	Very low	33.3	Very low	111 Å²	111	134.3 Å²	134.3	78%	0.776	78%	0.78	S	S	*	*			trans	-59.3	144.4	167	-43.7	0	0	0	0	111.4
327	A	34.6	Very low	33.6	Very low	106 Å²	106	136.1 Å²	136.1	88%	0.876	78%	0.779	S	S	*	*			trans	-119.5	66	172.9	0	0	0	0	0	110.2
328	S	32.4	Very low	33.6	Very low	84 Å²	84	132.9 Å²	132.9	59%	0.587	77%	0.768	S	S	*	*			trans	-113.1	78.3	-173.8	56	0	0	0	0	111.3
329	H	35.3	Very low	33.8	Very low	179 Å²	179	137 Å²	137	83%	0.829	77%	0.771	S	S	*	*			trans	-139.7	82.9	179.1	-71.6	-56.4	0	0	0	112.6
330	S	33.8	Very low	34	Very low	96 Å²	96	139.8 Å²	139.8	67%	0.671	77%	0.774	S	S	*	*			trans	-65.7	136	157.3	-45.3	0	0	0	0	109.2	S332	S330-S332 VanDerWaalsContact C-N 3.33Å; S330-S332 PolarHBondContact O-N 3.27Å
331	P	40.6	Very low	34	Very low	108 Å²	108	136.9 Å²	136.9	70%	0.701	76%	0.763	S	S	*	*			trans	-77	81.6	176.3	31.7	-34.2	0	0	0	110.6	I333	P331-I333 PolarHBondContact O-N 3.07Å
332	S	34.1	Very low	33.9	Very low	95 Å²	95	141 Å²	141	66%	0.664	77%	0.771	S	S	*	*			trans	-58.7	121	168.5	-59.2	0	0	0	0	109.8	S330 R334	S330-S332 VanDerWaalsContact C-N 3.33Å; S330-S332 PolarHBondContact O-N 3.27Å; S332-R334 PolarHBondContact O-N 3.13Å
333	I	35.5	Very low	33.9	Very low	159 Å²	159	144.5 Å²	144.5	82%	0.815	78%	0.779	S	S	*	*			trans	-71.6	75.1	172.3	-56.7	173.9	0	0	0	108.8	P331 R335	P331-I333 PolarHBondContact O-N 3.07Å; I333-R335 PolarHBondContact O-N 3.24Å
334	R	32.9	Very low	34.1	Very low	217 Å²	217	141.5 Å²	141.5	82%	0.819	77%	0.774	S	S	*	*			trans	-78	103.8	166.2	-73.9	-166.6	176.8	-135.4	-1.2	108.2	S332 N336	S332-R334 PolarHBondContact O-N 3.13Å; R334-N336 PolarHBondContact O-N 3.49Å; R334-N336 VanDerWaalsContact O-N 3.14Å
335	R	36.6	Very low	34.3	Very low	222 Å²	222	144.3 Å²	144.3	84%	0.838	78%	0.775	S	S	*	*			trans	-58.9	113.9	159.9	-67.1	-177.7	176.4	102	-1.9	107.3	I333 I337	I333-R335 PolarHBondContact O-N 3.24Å; R335-I337 VanDerWaalsContact C-N 3.35Å; R335-I337 PolarHBondContact O-N 3.16Å
336	N	32.4	Very low	34.4	Very low	159 Å²	159	140.5 Å²	140.5	85%	0.85	77%	0.772	S	S	*	*			trans	-70.1	92.4	173	-86.7	-24.1	0	0	0	109.3	R334 A338	R334-N336 PolarHBondContact O-N 3.49Å; R334-N336 VanDerWaalsContact O-N 3.14Å; N336-A338 PolarHBondContact O-N 2.9Å
337	I	35.7	Very low	34.6	Very low	148 Å²	148	140.3 Å²	140.3	76%	0.759	77%	0.771	S	S	*	*			trans	-77.8	96.9	158.5	-61.6	178.8	0	0	0	106.2	R335 L339	R335-I337 VanDerWaalsContact C-N 3.35Å; R335-I337 PolarHBondContact O-N 3.16Å; I337-L339 PolarHBondContact O-N 2.97Å
338	A	34.7	Very low	34.6	Very low	82 Å²	82	139.5 Å²	139.5	68%	0.678	76%	0.764	S	S	*	*			trans	-71.7	107.2	172.5	0	0	0	0	0	109.1	N336 T340	N336-A338 PolarHBondContact O-N 2.9Å; A338-T340 VanDerWaalsContact C-N 3.28Å; A338-T340 PolarHBondContact O-N 3.47Å
339	L	33.7	Very low	34.8	Very low	165 Å²	165	142.9 Å²	142.9	86%	0.864	78%	0.781	S	S	*	*			trans	-76.8	79.5	171.8	-78.5	171.4	0	0	0	110.6	I337	I337-L339 PolarHBondContact O-N 2.97Å
340	T	37.4	Very low	34.7	Very low	131 Å²	131	137.7 Å²	137.7	80%	0.804	78%	0.775	S	S	*	*			trans	-105.4	85.5	153.6	53.2	0	0	0	0	107.7	A338	A338-T340 VanDerWaalsContact C-N 3.28Å; A338-T340 PolarHBondContact O-N 3.47Å
341	G	31.5	Very low	34.8	Very low	62 Å²	62	138.3 Å²	138.3	64%	0.639	78%	0.78	S	S	*	*			trans	-73.9	138.3	179.7	0	0	0	0	0	111.8
342	F	33	Very low	34.6	Very low	209 Å²	209	144.8 Å²	144.8	92%	0.917	79%	0.791	S	S	*	*			trans	-131.9	135.8	144.3	-97.1	-76.4	0	0	0	109
343	N	32.4	Very low	34.9	Very low	155 Å²	155	145.5 Å²	145.5	83%	0.829	80%	0.796	S	S	*	*			trans	-88.6	140.7	-169.4	-164.6	5.9	0	0	0	110.3
344	M	36.3	Very low	35	Very low	146 Å²	146	140.8 Å²	140.8	72%	0.719	79%	0.786	S	S	*	*			trans	-129.7	108.8	-178.9	-81.2	-70.4	155.9	0	0	111.3
345	H	34.1	Very low	35.3	Very low	164 Å²	164	139.3 Å²	139.3	76%	0.759	79%	0.788	S	S	*	*			trans	39.2	117.3	159.4	-61	-79.9	0	0	0	119.6
346	N	34.4	Very low	35.4	Very low	152 Å²	152	133.2 Å²	133.2	81%	0.813	78%	0.779	S	S	*	*				-152	151.5	97.9	-123.3	-31.6	0	0	0	114.1
347	S	34.6	Very low	35.8	Very low	108 Å²	108	130.6 Å²	130.6	76%	0.755	77%	0.769	S	S	*	*			trans	16.4	128.4	159.9	-55.2	0	0	0	0	119.4
348	A	34.9	Very low	35.9	Very low	89 Å²	89	130.8 Å²	130.8	74%	0.736	77%	0.772	S	S	*	*			cis	-175.9	150.7	46.2	0	0	0	0	0	113.7
349	V	36.4	Very low	36.2	Very low	154 Å²	154	131.6 Å²	131.6	93%	0.933	77%	0.773	S	S	*	*			trans	53.4	122.1	153.1	-176.8	0	0	0	0	119.6
350	G	34.4	Very low	36.7	Very low	70 Å²	70	130.7 Å²	130.7	72%	0.722	77%	0.773	S	S	*	*			trans	176.8	22	172.4	0	0	0	0	0	124.3
351	S	35.2	Very low	36.7	Very low	110 Å²	110	127.5 Å²	127.5	77%	0.769	77%	0.767	S	S	*	*			trans	53.9	119.4	158	-60.9	0	0	0	0	123.2
352	R	35.9	Very low	37	Very low	244 Å²	244	130.2 Å²	130.2	92%	0.921	78%	0.776	S	S	*	*			trans	65.3	156.8	147	-67.4	179.7	171.2	-159.1	-3.9	118.6
353	S	40.1	Very low	37.2	Very low	110 Å²	110	126.8 Å²	126.8	77%	0.769	77%	0.772	S	S	*	*			cis	177.3	150.8	-28.2	53.6	0	0	0	0	107.3
354	G	37.6	Very low	37.5	Very low	59 Å²	59	124.5 Å²	124.5	61%	0.608	77%	0.769	S	S	*	*			cis	164.6	-178.6	3	0	0	0	0	0	109.4
355	H	41	Very low	37.3	Very low	186 Å²	186	123.5 Å²	123.5	86%	0.861	77%	0.771	S	S	*	*			trans	69.5	160.8	173.3	-53.3	-74.6	0	0	0	116
356	S	37.6	Very low	37.4	Very low	94 Å²	94	125.7 Å²	125.7	66%	0.657	77%	0.774	S	S	*	*			cis	-178.4	162.4	-18.2	-96.7	0	0	0	0	108.4
357	T	41.6	Very low	37.4	Very low	105 Å²	105	123.3 Å²	123.3	64%	0.644	77%	0.769	S	S	*	*			cis	-169.6	145.2	-18.5	24.5	0	0	0	0	109.6
358	D	37.5	Very low	37.5	Very low	151 Å²	151	127 Å²	127	81%	0.807	78%	0.775	S	S	*	*			trans	62	174.2	155	-42.6	-31.1	0	0	0	118.4
359	S	41.1	Very low	37.7	Very low	100 Å²	100	127 Å²	127	70%	0.699	77%	0.774	S	S	*	*			cis	-162.3	154.8	15.3	61.3	0	0	0	0	114.6
360	V	43.4	Very low	37.7	Very low	145 Å²	145	126.4 Å²	126.4	88%	0.879	77%	0.766	S	S	*	*			trans	36.5	154.5	150.7	-54.1	0	0	0	0	123.5
361	G	37.9	Very low	37.7	Very low	64 Å²	64	133 Å²	133	66%	0.66	77%	0.769	S	S	*	*			cis	151.4	146.9	-10.4	0	0	0	0	0	115.4
362	S	38.3	Very low	37.5	Very low	120 Å²	120	134.2 Å²	134.2	84%	0.839	77%	0.771	S	S	*	*			trans	65	160.4	164.2	-48	0	0	0	0	117.2
363	T	37.4	Very low	37.4	Very low	137 Å²	137	127.7 Å²	127.7	84%	0.84	76%	0.763	S	S	*	*			cis	-157.7	179.7	3.4	-9.5	0	0	0	0	107.2
364	S	37.6	Very low	37.1	Very low	107 Å²	107	127.8 Å²	127.8	75%	0.748	76%	0.759	S	S	*	*			cis	-156	-159.8	6.9	56.3	0	0	0	0	110.5
365	T	31.6	Very low	36.9	Very low	124 Å²	124	136.3 Å²	136.3	76%	0.761	77%	0.773	S	S	*	*			trans	-141.5	163.7	175.4	49.8	0	0	0	0	112
366	Y	37.3	Very low	36.6	Very low	210 Å²	210	133.2 Å²	133.2	82%	0.824	77%	0.772	S	S	*	*			trans	163.4	119	153.2	-104.3	-85.6	0	0	0	106.3
367	S	33.5	Very low	36.5	Very low	103 Å²	103	131.8 Å²	131.8	72%	0.72	77%	0.771	S	S	*	*				64.1	118	61.1	-55.6	0	0	0	0	111.8
368	E	36.9	Very low	36.2	Very low	186 Å²	186	137.3 Å²	137.3	87%	0.869	78%	0.782	S	S	*	*				-175.7	-174.7	66	-157.5	163.9	122.1	0	0	112.7
369	A	38.6	Very low	36.1	Very low	87 Å²	87	140 Å²	140	72%	0.719	78%	0.781	S	S	*	*			trans	80.7	97.8	151.9	0	0	0	0	0	123.8
370	D	38	Very low	35.9	Very low	142 Å²	142	143.5 Å²	143.5	76%	0.759	79%	0.786	S	S	*	*				79.8	176.7	124	-121.4	-35.4	0	0	0	124.6
371	R	34.1	Very low	35.4	Very low	209 Å²	209	143 Å²	143	79%	0.789	78%	0.779	S	S	*	*			trans	-103	143.3	-151.2	-72.2	174.9	175.8	91.7	-8	117.1
372	V	30.9	Very low	35.5	Very low	136 Å²	136	146.1 Å²	146.1	82%	0.824	79%	0.787	S	S	*	*			trans	50.7	117.4	137.2	-178.3	0	0	0	0	119.2
373	S	32.7	Very low	35.2	Very low	107 Å²	107	147.5 Å²	147.5	75%	0.748	78%	0.784	S	S	*	*				165.9	169.4	113.2	-164.3	0	0	0	0	114.8
374	V	35.1	Very low	35	Very low	111 Å²	111	147.6 Å²	147.6	67%	0.673	78%	0.78	S	S	*	*			trans	75.6	100.7	157.7	-166.6	0	0	0	0	122.2
375	R	33.2	Very low	34.8	Very low	239 Å²	239	149.4 Å²	149.4	90%	0.902	78%	0.78	S	S	*	*			trans	58.5	166.2	138.6	-57.1	176.8	175	168.2	-3	119
376	S	34.9	Very low	34.9	Very low	121 Å²	121	150.1 Å²	150.1	85%	0.846	78%	0.784	S	S	*	*			cis	-156.8	156	12.5	-160	0	0	0	0	113
377	G	35.2	Very low	34.6	Very low	63 Å²	63	143.1 Å²	143.1	65%	0.649	78%	0.775	S	S	*	*			trans	152.5	113	161.3	0	0	0	0	0	118.7
378	Y	36.1	Very low	34.7	Very low	222 Å²	222	145.3 Å²	145.3	87%	0.871	78%	0.784	S	S	*	*			trans	12.5	125.8	157.2	-52	-89.6	0	0	0	120.9
379	R	34.9	Very low	34.3	Very low	207 Å²	207	143.7 Å²	143.7	78%	0.781	78%	0.777	S	S	*	*				71.7	140.3	52.8	-70.9	-177.4	169.8	-139.6	9	114.5
380	H	35.9	Very low	34.1	Very low	173 Å²	173	145.9 Å²	145.9	80%	0.801	78%	0.775	S	S	*	*			cis	-152.6	178	17.7	-115.2	-57.2	0	0	0	113.7
381	N	33	Very low	33.7	Very low	136 Å²	136	143.6 Å²	143.6	73%	0.727	77%	0.771	S	S	*	*			trans	-125.1	164.8	176.2	-124.5	16.7	0	0	0	110.1
382	P	40	Very low	33.5	Very low	128 Å²	128	139.9 Å²	139.9	83%	0.831	77%	0.766	S	S	*	*				-157.4	-162.2	107.2	41.8	-20.8	0	0	0	116.8
383	L	32	Very low	33.4	Very low	149 Å²	149	144 Å²	144	78%	0.78	77%	0.767	S	S	*	*			trans	-127	175.5	-165.9	-72.8	162.9	0	0	0	115.2
384	D	33	Very low	33.3	Very low	140 Å²	140	144.3 Å²	144.3	75%	0.749	77%	0.769	S	S	*	*				118.1	146.5	129.3	-89	-45.3	0	0	0	125.3
385	L	34.5	Very low	33.1	Very low	145 Å²	145	142.6 Å²	142.6	76%	0.759	77%	0.767	S	S	*	*			trans	77.1	120.3	152.7	-103.8	64.2	0	0	0	125.9
386	V	34.1	Very low	33	Very low	138 Å²	138	139 Å²	139	84%	0.836	76%	0.762	S	S	*	*				38.4	142	127.1	178.6	0	0	0	0	120.7
387	G	31	Very low	32.8	Very low	63 Å²	63	138.5 Å²	138.5	65%	0.649	76%	0.759	S	S	*	*			cis	157.1	-174.8	0	0	0	0	0	0	112.4
388	V	35.3	Very low	32.8	Very low	149 Å²	149	139.8 Å²	139.8	90%	0.903	76%	0.764	S	S	*	*			trans	71.3	152.3	172.2	-175.1	0	0	0	0	116.2
389	E	28.6	Very low	32.5	Very low	152 Å²	152	137.3 Å²	137.3	71%	0.71	77%	0.766	S	S	*	*			cis	-167.6	-170.5	-44.9	-155.2	-136.3	134.5	0	0	108.9
390	L	33.9	Very low	32.5	Very low	133 Å²	133	131.3 Å²	131.3	70%	0.696	77%	0.768	S	S	*	*			trans	72.6	118.9	170.5	-56.3	174.8	0	0	0	116.6
391	S	29.7	Very low	32.4	Very low	94 Å²	94	128.8 Å²	128.8	66%	0.657	77%	0.77	S	S	*	*				76.5	139.2	73	-73.9	0	0	0	0	114.1
392	N	28.9	Very low	32.5	Very low	131 Å²	131	127 Å²	127	70%	0.701	77%	0.768	S	S	*	*			cis	-157.5	-174.4	8.2	-137	-42	0	0	0	113.4
393	R	29.9	Very low	32.2	Very low	222 Å²	222	127.4 Å²	127.4	84%	0.838	76%	0.763	S	S	*	*			trans	-25.9	163	161.6	-65.6	158.6	171.5	-137.5	-2	117.2
394	S	29.6	Very low	32.2	Very low	114 Å²	114	131.9 Å²	131.9	80%	0.797	77%	0.77	S	S	*	*			cis	-175.8	175.7	15.9	20.4	0	0	0	0	108.8
395	A	30.4	Very low	32.2	Very low	75 Å²	75	134.9 Å²	134.9	62%	0.62	78%	0.776	S	S	*	*			cis	-178.6	-164.8	-23.8	0	0	0	0	0	108.1
396	M	32.8	Very low	32.2	Very low	163 Å²	163	133.2 Å²	133.2	80%	0.803	77%	0.774	S	S	*	*			trans	75.5	111.5	172.8	-50.9	-66.3	97	0	0	115
397	S	30.2	Very low	32.1	Very low	112 Å²	112	130.6 Å²	130.6	78%	0.783	78%	0.775	S	S	*	*				73.4	141	92.8	79.1	0	0	0	0	114.9
398	A	35	Very low	32.1	Very low	90 Å²	90	135.3 Å²	135.3	74%	0.744	78%	0.784	S	S	*	*			cis	-149.1	-165.4	17.2	0	0	0	0	0	113.6
399	D	30.1	Very low	31.9	Very low	170 Å²	170	134.8 Å²	134.8	91%	0.909	78%	0.782	S	S	*	*			trans	-57.3	158.9	-165.7	-53.7	-79.7	0	0	0	119
400	G	34.7	Very low	32.1	Very low	81 Å²	81	133.4 Å²	133.4	84%	0.835	79%	0.788	S	S	*	*			trans	-178	102.3	169	0	0	0	0	0	112.2
401	S	34.2	Very low	31.9	Very low	120 Å²	120	132.2 Å²	132.2	84%	0.839	79%	0.79	S	S	*	*			trans	-96.1	143.3	-173.9	57	0	0	0	0	114.1
402	S	34.2	Very low	32.3	Very low	98 Å²	98	134 Å²	134	69%	0.685	80%	0.799	S	S	*	*				-166.2	160.5	128	-146.2	0	0	0	0	114.5
403	D	33.7	Very low	32.4	Very low	136 Å²	136	133.8 Å²	133.8	73%	0.727	80%	0.803	S	S	*	*			trans	55.7	109.9	154.5	-59.1	-54.9	0	0	0	122.1
404	R	33	Very low	32.5	Very low	244 Å²	244	132.9 Å²	132.9	92%	0.921	81%	0.805	S	S	*	*			trans	-126.6	129.3	149	-74.9	-171.6	179.7	-169.8	1.9	109.9
405	F	33.4	Very low	32.5	Very low	202 Å²	202	134.5 Å²	134.5	89%	0.886	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-76.8	133.6	169	-77.6	-99	0	0	0	111.9
406	P	33.9	Very low	32.5	Very low	111 Å²	111	140 Å²	140	72%	0.721	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-94.6	150.2	155.2	35.2	-29.4	0	0	0	111.3
407	G	31.5	Very low	32.2	Very low	82 Å²	82	142 Å²	142	85%	0.845	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-79.4	145.1	179.6	0	0	0	0	0	113.6
408	L	32.1	Very low	32.4	Very low	163 Å²	163	140.9 Å²	140.9	85%	0.853	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-90.8	135.3	-179.8	-66.7	170.8	0	0	0	112.4
409	T	30.3	Very low	32.1	Very low	138 Å²	138	142.5 Å²	142.5	85%	0.847	82%	0.823	S	S	*	*			trans	-127.9	114.1	161.2	54.3	0	0	0	0	108.2
410	C	32.8	Very low	32.3	Very low	123 Å²	123	142.1 Å²	142.1	83%	0.831	82%	0.818	S	S	*	*			trans	-91.5	127.2	-177.9	-64.5	0	0	0	0	111.9
411	S	29.8	Very low	32	Very low	108 Å²	108	146.3 Å²	146.3	76%	0.755	82%	0.816	S	S	*	*			trans	-114.2	136.6	154.7	-60.4	0	0	0	0	107.8	V413	S411-V413 PolarHBondContact O-N 2.78Å
412	P	38.5	Very low	31.8	Very low	130 Å²	130	143.8 Å²	143.8	84%	0.844	81%	0.808	S	S	*	*			trans	-81.4	116.1	175.4	31.5	-31	0	0	0	110.4
413	V	30.3	Very low	31.8	Very low	128 Å²	128	148.7 Å²	148.7	78%	0.776	82%	0.817	S	S	*	*			trans	-121.9	134	160.4	178.7	0	0	0	0	106.1	S411	S411-V413 PolarHBondContact O-N 2.78Å
414	F	32.9	Very low	31.6	Very low	203 Å²	203	148.9 Å²	148.9	89%	0.89	81%	0.814	S	S	*	*			trans	-117.6	149.4	174.8	-110.8	-87.3	0	0	0	112.4
415	L	29.5	Very low	31.6	Very low	148 Å²	148	145.5 Å²	145.5	78%	0.775	81%	0.813	S	S	*	*			trans	-72.2	159.7	-175.6	-108.5	67.1	0	0	0	111.5
416	E	30.6	Very low	31.4	Very low	189 Å²	189	144.1 Å²	144.1	88%	0.883	81%	0.807	S	S	*	*				-154.6	150.6	66.9	-85.2	-171.4	121	0	0	115.9
417	K	26.5	Very low	31.6	Very low	207 Å²	207	144.1 Å²	144.1	90%	0.9	81%	0.807	S	S	*	*			trans	-166.9	131.5	150	-118.7	176.4	-177.2	179.6	0	112.2
418	A	33.2	Very low	31.5	Very low	88 Å²	88	145.2 Å²	145.2	73%	0.727	81%	0.808	S	S	*	*			trans	-154.3	119.5	166.2	0	0	0	0	0	106.9
419	C	29.4	Very low	31.5	Very low	123 Å²	123	140.6 Å²	140.6	83%	0.831	80%	0.8	S	S	*	*				75.5	128.2	80	-69.3	0	0	0	0	112.2
420	M	32.9	Very low	31.5	Very low	162 Å²	162	139.7 Å²	139.7	80%	0.798	80%	0.799	S	S	*	*			cis	-146	-179.4	16.2	-71.4	-157.5	70.1	0	0	114.7
421	E	28.3	Very low	31.4	Very low	170 Å²	170	141.4 Å²	141.4	79%	0.794	80%	0.795	S	S	*	*			trans	-63.5	166.8	173.6	-57.2	140.7	106.7	0	0	114.3
422	G	31.7	Very low	31.4	Very low	66 Å²	66	143.7 Å²	143.7	68%	0.68	79%	0.794	S	S	*	*			cis	152.1	-169.3	-3.1	0	0	0	0	0	112.9
423	K	34.1	Very low	31	Very low	202 Å²	202	143.1 Å²	143.1	88%	0.878	79%	0.793	S	S	*	*			trans	73.9	149.7	174.4	-64.6	176	-177.8	175.3	0	117.6
424	E	28.8	Very low	30.8	Very low	140 Å²	140	145.6 Å²	145.6	65%	0.654	80%	0.798	S	S	*	*			cis	169.6	128.6	-29.1	-110.7	-76.9	171.2	0	0	107.3
425	L	32.8	Very low	30.7	Very low	173 Å²	173	141.6 Å²	141.6	91%	0.906	80%	0.795	S	S	*	*			trans	173	155.7	148.5	-96.6	156.5	0	0	0	113.1
426	F	29.1	Very low	30.7	Very low	172 Å²	172	139.7 Å²	139.7	75%	0.754	80%	0.795	S	S	*	*			trans	-138.3	-171.8	-158.1	-99.2	-76.1	0	0	0	110.4
427	P	37.5	Very low	30.9	Very low	111 Å²	111	138.9 Å²	138.9	72%	0.721	80%	0.796	S	S	*	*			cis	-141.3	-173.9	-19	30.9	-7.6	0	0	0	116.7
428	A	30.4	Very low	30.9	Very low	105 Å²	105	135 Å²	135	87%	0.868	79%	0.79	S	S	*	*			trans	106.8	132.9	130.5	0	0	0	0	0	123.5
429	G	31.5	Very low	30.8	Very low	67 Å²	67	138.2 Å²	138.2	69%	0.691	79%	0.793	S	S	*	*			trans	114.7	103	162	0	0	0	0	0	115.2
430	S	30.8	Very low	30.6	Very low	118 Å²	118	137.6 Å²	137.6	83%	0.825	79%	0.786	S	S	*	*				68.1	133.8	72.4	74.2	0	0	0	0	114.4
431	Q	31.8	Very low	30.6	Very low	160 Å²	160	138.4 Å²	138.4	75%	0.748	79%	0.787	S	S	*	*			cis	-165.8	140.3	22.8	-167.3	175.3	-17.8	0	0	114.6
432	E	28.9	Very low	30.4	Very low	156 Å²	156	139.9 Å²	139.9	73%	0.729	79%	0.791	S	S	*	*			trans	41.2	147.7	148.3	-59.3	173	141.3	0	0	127.8
433	S	29.6	Very low	30.4	Very low	118 Å²	118	141.7 Å²	141.7	83%	0.825	80%	0.8	S	S	*	*			trans	83.1	155.5	142.4	76.4	0	0	0	0	121.9
434	M	27.4	Very low	30.1	Very low	179 Å²	179	140.5 Å²	140.5	88%	0.882	80%	0.797	S	S	*	*			cis	-167.5	165.6	-47.8	-136.2	-167.4	-174.3	0	0	112.4
435	S	29	Very low	30.1	Very low	119 Å²	119	140.5 Å²	140.5	83%	0.832	81%	0.807	S	S	*	*			trans	81.2	151.4	159.2	76.7	0	0	0	0	120.9
436	S	30.4	Very low	30.2	Very low	109 Å²	109	140.4 Å²	140.4	76%	0.762	80%	0.801	S	S	*	*			trans	-118.2	171.4	-164.7	-30.2	0	0	0	0	113.3
437	N	34.9	Very low	30.4	Very low	171 Å²	171	137 Å²	137	91%	0.914	80%	0.799	S	S	*	*			trans	-159.4	151.1	153	-95.8	-52.3	0	0	0	111.5
438	V	26.9	Very low	30.3	Very low	127 Å²	127	137.4 Å²	137.4	77%	0.77	80%	0.801	S	S	*	*			trans	-124.4	143	-175.8	173.4	0	0	0	0	110.6
439	I	30.5	Very low	30.5	Very low	155 Å²	155	136.4 Å²	136.4	80%	0.795	79%	0.793	S	S	*	*			trans	-135.2	130.8	166.3	-60.4	-178.5	0	0	0	109.2
440	T	25.9	Very low	30.6	Very low	110 Å²	110	139.5 Å²	139.5	68%	0.675	79%	0.794	S	S	*	*			trans	-94	151.5	176.7	49.9	0	0	0	0	111.7
441	H	31.8	Very low	30.7	Very low	179 Å²	179	138.8 Å²	138.8	83%	0.829	79%	0.788	S	S	*	*			trans	-142.2	135.4	161.7	-99.8	-83.1	0	0	0	111.5
442	F	24.7	Very low	30.8	Very low	201 Å²	201	138.5 Å²	138.5	88%	0.882	79%	0.791	S	S	*	*			trans	-81.8	154	171	-80.2	-111.1	0	0	0	110.7
443	A	32	Very low	31.1	Very low	103 Å²	103	134.6 Å²	134.6	85%	0.851	79%	0.792	S	S	*	*			trans	-137.7	146.2	161.4	0	0	0	0	0	109.5
444	E	28.5	Very low	31.3	Very low	178 Å²	178	134.8 Å²	134.8	83%	0.832	79%	0.794	S	S	*	*			trans	-117.7	136.5	-162.9	-174.3	171.2	-158.9	0	0	110.6
445	V	28.4	Very low	31.3	Very low	140 Å²	140	134.8 Å²	134.8	85%	0.848	79%	0.789	S	S	*	*			trans	-108	115.6	-173	-178.9	0	0	0	0	111.2
446	H	34	Very low	31.6	Very low	170 Å²	170	140.8 Å²	140.8	79%	0.787	79%	0.793	S	S	*	*			trans	-81.5	134.7	170.7	-90.7	-105.4	0	0	0	112.1
447	S	32.6	Very low	31.5	Very low	102 Å²	102	144.8 Å²	144.8	71%	0.713	79%	0.792	S	S	*	*			trans	-87.3	165.1	166.8	-178.3	0	0	0	0	110.9
448	P	36.5	Very low	31.1	Very low	118 Å²	118	143.6 Å²	143.6	77%	0.766	78%	0.783	S	S	*	*				-140.6	151.4	109.7	37.5	-25.8	0	0	0	116.1
449	A	33.9	Very low	31.5	Very low	85 Å²	85	144.5 Å²	144.5	70%	0.702	79%	0.788	S	S	*	*			trans	19.8	139.5	144.8	0	0	0	0	0	120.3
450	D	33.9	Very low	31.5	Very low	131 Å²	131	145.3 Å²	145.3	70%	0.701	79%	0.793	S	S	*	*			cis	-155.9	-168.1	13.7	-139.2	26.4	0	0	0	109.5
451	C	33.7	Very low	31.9	Very low	103 Å²	103	147.6 Å²	147.6	70%	0.696	80%	0.801	S	S	*	*			cis	-153.8	160.9	21.3	-157.1	0	0	0	0	115.9
452	L	33.6	Very low	32	Very low	155 Å²	155	144.2 Å²	144.2	81%	0.812	80%	0.798	S	S	*	*			trans	-38.3	148.9	159.5	-54.4	161.4	0	0	0	114.7
453	G	34.5	Very low	32.4	Very low	74 Å²	74	137.8 Å²	137.8	76%	0.763	79%	0.788	S	S	*	*			cis	-170.5	-168.4	2.2	0	0	0	0	0	109.9
454	S	34.8	Very low	32.5	Very low	122 Å²	122	138.8 Å²	138.8	85%	0.853	79%	0.787	S	S	*	*			cis	-154.3	151.6	8.6	-174.5	0	0	0	0	111.2
455	F	27.3	Very low	33	Very low	179 Å²	179	136.5 Å²	136.5	79%	0.785	79%	0.786	S	S	*	*			trans	-102.4	151.5	-176.7	-99.4	-99.8	0	0	0	113.6
456	R	34.3	Very low	33.2	Very low	244 Å²	244	137.3 Å²	137.3	92%	0.921	79%	0.785	S	S	*	*			trans	-179.7	117	145.4	-92.6	140.9	-160.8	-97.5	5.3	108.1
457	R	28.4	Very low	33.3	Very low	193 Å²	193	133.8 Å²	133.8	73%	0.728	79%	0.786	S	S	*	*			cis	95.4	103.3	18.1	-161.6	176.9	-176.5	154	2.7	115.6
458	M	26.4	Very low	33.7	Very low	147 Å²	147	134 Å²	134	72%	0.724	79%	0.793	S	S	*	*			trans	54.1	125.4	149.1	-60.5	163.7	175.6	0	0	120.3
459	T	35.2	Very low	33.7	Very low	145 Å²	145	133.8 Å²	133.8	89%	0.89	80%	0.795	S	S	*	*				-171.8	163	102.5	34.1	0	0	0	0	111.7
460	L	30.4	Very low	34.2	Very low	172 Å²	172	134.8 Å²	134.8	90%	0.901	79%	0.794	S	S	*	*			trans	-112.8	129.2	163.6	-74.6	167.6	0	0	0	108
461	D	34.8	Very low	34.5	Very low	158 Å²	158	138.2 Å²	138.2	85%	0.845	80%	0.797	S	S	*	*			trans	-164.8	178.7	141	-139.1	-46.9	0	0	0	111.2
462	S	33.8	Very low	34.7	Very low	109 Å²	109	140.3 Å²	140.3	76%	0.762	80%	0.797	S	S	*	*			trans	-71.2	168.9	-168.4	49.4	0	0	0	0	117.9
463	G	33.3	Very low	35	Very low	65 Å²	65	136.1 Å²	136.1	67%	0.67	79%	0.791	S	S	*	*			trans	107.8	101.8	169.6	0	0	0	0	0	113.3
464	C	34.8	Very low	35.3	Very low	124 Å²	124	139.7 Å²	139.7	84%	0.838	80%	0.798	S	S	*	*				84.9	144.7	62.5	-70.6	0	0	0	0	115.4
465	V	38	Very low	35.4	Very low	131 Å²	131	139.2 Å²	139.2	79%	0.794	79%	0.794	S	S	*	*			trans	64.4	111.9	170.1	-62.9	0	0	0	0	120.7
466	D	33.2	Very low	36.2	Very low	157 Å²	157	137.5 Å²	137.5	84%	0.84	80%	0.799	S	S	*	*			trans	4.6	147.1	137.9	-51	-76.7	0	0	0	119.2
467	A	36.4	Very low	36.3	Very low	96 Å²	96	134 Å²	134	79%	0.793	80%	0.795	S	S	*	*			cis	-173.2	153.9	49.1	0	0	0	0	0	113.1
468	A	39.5	Very low	36.8	Very low	106 Å²	106	130.1 Å²	130.1	88%	0.876	80%	0.795	S	S	*	*			trans	162.9	117.6	138.4	0	0	0	0	0	111.8
469	S	37.1	Very low	37.2	Very low	114 Å²	114	129.1 Å²	129.1	80%	0.797	80%	0.797	S	S	*	*			trans	-128.7	150.7	164.5	174.3	0	0	0	0	108.7
470	P	46	Very low	37.3	Very low	105 Å²	105	127.6 Å²	127.6	68%	0.682	79%	0.792	S	S	*	*			trans	-143	126.3	143.4	33.8	-17.2	0	0	0	115.2
471	R	38.8	Very low	37.7	Very low	204 Å²	204	130 Å²	130	77%	0.77	79%	0.791	S	S	*	*				67.7	160.6	127.9	-66	171.2	168.3	-123.8	-10.7	118
472	E	38.8	Very low	38	Very low	147 Å²	147	127.5 Å²	127.5	69%	0.687	79%	0.786	S	S	*	*			cis	-155.5	155.7	-3.1	-128.9	152.2	-157.6	0	0	111.6
473	G	39.2	Very low	38.1	Very low	67 Å²	67	127.6 Å²	127.6	69%	0.691	79%	0.786	S	S	*	*			trans	78.6	151.9	164.4	0	0	0	0	0	117.1
474	T	41.1	Very low	38.4	Very low	148 Å²	148	132.8 Å²	132.8	91%	0.908	79%	0.793	S	S	*	*			cis	-154.4	150.5	-10.3	-28.6	0	0	0	0	109.3
475	S	35.9	Very low	38.6	Very low	112 Å²	112	135 Å²	135	78%	0.783	79%	0.791	S	S	*	*			trans	-106.4	137.2	-175.4	48.8	0	0	0	0	113.7
476	V	43.9	Very low	38.6	Very low	144 Å²	144	135.3 Å²	135.3	87%	0.873	79%	0.787	S	S	*	*			trans	-142	125.7	159.2	-175.5	0	0	0	0	110.5
477	M	36.8	Very low	38.6	Very low	171 Å²	171	133.3 Å²	133.3	84%	0.842	79%	0.785	S	S	*	*			trans	-120.4	153.2	162.9	-94.2	-78.8	-174.8	0	0	105.3
478	P	39.2	Very low	38.7	Very low	111 Å²	111	136 Å²	136	72%	0.721	79%	0.786	S	S	*	*				-156.9	166	79.8	41.1	-20.1	0	0	0	119.5
479	T	34.6	Very low	38.3	Very low	126 Å²	126	140.8 Å²	140.8	77%	0.773	78%	0.783	S	S	*	*			trans	-22.1	149.3	156.5	59.1	0	0	0	0	120.6
480	S	38.8	Very low	38.6	Very low	113 Å²	113	140.7 Å²	140.7	79%	0.79	78%	0.778	S	S	*	*				-165.8	143.5	123.2	47.1	0	0	0	0	113.3
481	Y	36.8	Very low	38.2	Very low	222 Å²	222	140.9 Å²	140.9	87%	0.871	78%	0.779	S	S	*	*			trans	24.2	148.8	152	-91	-112.9	0	0	0	122.1
482	S	41.3	Very low	38.3	Very low	106 Å²	106	139.9 Å²	139.9	74%	0.741	79%	0.785	S	S	*	*			cis	-137.2	164.1	20.8	-66.1	0	0	0	0	113.8
483	S	36.4	Very low	38.3	Very low	111 Å²	111	137 Å²	137	78%	0.776	79%	0.787	S	S	*	*			trans	-101.5	149	166	-52.4	0	0	0	0	111.7
484	E	40.4	Very low	38.6	Very low	174 Å²	174	139.5 Å²	139.5	81%	0.813	79%	0.791	S	S	*	*			trans	-161.7	119.3	139.9	-105.9	160	-157.3	0	0	106
485	Q	39.2	Very low	38.3	Very low	171 Å²	171	137.8 Å²	137.8	80%	0.799	79%	0.785	S	S	*	*				59.2	129.5	97.9	-66.2	-169.5	-0.3	0	0	113.5
486	I	36.6	Very low	38.7	Very low	137 Å²	137	137.7 Å²	137.7	70%	0.703	78%	0.782	S	S	*	*			cis	-140.7	154	17.9	-124.1	154.7	0	0	0	111.5
487	S	34.7	Very low	38.3	Very low	114 Å²	114	135.9 Å²	135.9	80%	0.797	78%	0.776	S	S	*	*			trans	-122	110.6	169.2	59.2	0	0	0	0	109.2
488	D	38.2	Very low	38.4	Very low	154 Å²	154	134.7 Å²	134.7	82%	0.824	77%	0.768	S	S	*	*			trans	-118.2	134.9	167.4	-93	-52.9	0	0	0	110.6
489	Y	31.4	Very low	38.4	Very low	205 Å²	205	136.7 Å²	136.7	80%	0.804	77%	0.765	S	S	*	*			trans	-119.5	143.5	-171.3	178.5	-84.4	0	0	0	108.4
490	T	42.9	Very low	38.4	Very low	113 Å²	113	138.3 Å²	138.3	69%	0.693	77%	0.768	S	S	*	*			trans	155.4	126.7	146	-71.2	0	0	0	0	110.3
491	P	37.4	Very low	38.3	Very low	109 Å²	109	137 Å²	137	71%	0.708	76%	0.759	S	S	*	*			trans	-86.1	154.8	170.8	35.2	-34.1	0	0	0	112.1
492	M	40.8	Very low	38.4	Very low	182 Å²	182	136.2 Å²	136.2	90%	0.897	76%	0.76	S	S	*	*			trans	-132.8	141.3	170	-76.4	-168.6	68	0	0	113.2
493	A	39.6	Very low	38.1	Very low	87 Å²	87	135.1 Å²	135.1	72%	0.719	77%	0.766	S	S	*	*			trans	-95.5	168.3	173	0	0	0	0	0	110.8
494	P	43.9	Very low	38	Very low	120 Å²	120	141.9 Å²	141.9	78%	0.779	77%	0.774	S	S	*	*			trans	-97.6	162.4	-156.2	37.5	-37.3	0	0	0	115.9
495	S	36	Very low	37.8	Very low	112 Å²	112	138.6 Å²	138.6	78%	0.783	78%	0.777	S	S	*	*			trans	146.3	163.9	149	58	0	0	0	0	111.6
496	P	43.1	Very low	37.7	Very low	109 Å²	109	140 Å²	140	71%	0.708	78%	0.784	S	S	*	*			cis	-135.2	172.3	-48.3	39	-24.7	0	0	0	114.2
497	S	37.1	Very low	37.6	Very low	107 Å²	107	136.7 Å²	136.7	75%	0.748	78%	0.783	S	S	*	*			trans	53.1	110.5	147.4	-60.1	0	0	0	0	121.6
498	E	38.8	Very low	37.6	Very low	145 Å²	145	136.9 Å²	136.9	68%	0.678	79%	0.785	S	S	*	*				172.1	139.7	92.8	-85.3	-135.8	120.7	0	0	116
499	K	37.6	Very low	37.6	Very low	153 Å²	153	140.6 Å²	140.6	67%	0.665	79%	0.787	S	S	*	*			trans	63.4	122.8	141.8	-72.3	172.3	-176.9	143.2	0	123.8
500	L	35.2	Very low	37.9	Very low	161 Å²	161	138.3 Å²	138.3	84%	0.843	79%	0.789	S	S	*	*			trans	70.7	141	149	-83.4	79.2	0	0	0	118.9
501	S	37.7	Very low	37.6	Very low	85 Å²	85	140.4 Å²	140.4	59%	0.594	79%	0.793	S	S	*	*			cis	-161.9	162.1	-14.5	74	0	0	0	0	113.5
502	K	38.7	Very low	37.6	Very low	206 Å²	206	143 Å²	143	90%	0.896	80%	0.801	S	S	*	*			trans	62.8	99.3	157.7	-64.8	173.9	-178.5	175.7	0	118.9
503	G	35	Very low	37.4	Very low	83 Å²	83	141.2 Å²	141.2	86%	0.856	79%	0.79	S	S	*	*			trans	-172	114.2	157.1	0	0	0	0	0	109.4
504	R	33.8	Very low	37.3	Very low	252 Å²	252	145 Å²	145	95%	0.951	80%	0.797	S	S	*	*			trans	-130.2	113	-164	-179.7	-170.6	-177.8	-169.4	2.2	112.6
505	A	36.3	Very low	37.1	Very low	106 Å²	106	147.4 Å²	147.4	88%	0.876	79%	0.79	S	S	*	*			trans	-153.9	122.8	155.7	0	0	0	0	0	109.8
506	Q	36.5	Very low	37.1	Very low	200 Å²	200	147.9 Å²	147.9	94%	0.935	79%	0.79	S	S	*	*			trans	-129.9	133.8	171.6	-150.5	-178.4	5.7	0	0	106.3
507	G	35.1	Very low	36.7	Very low	67 Å²	67	152.3 Å²	152.3	69%	0.691	80%	0.795	S	S	*	*			trans	-136	78.9	-171.9	0	0	0	0	0	111.8
508	S	35.4	Very low	36.8	Very low	119 Å²	119	152.9 Å²	152.9	83%	0.832	80%	0.796	S	S	*	*			trans	-81	129.5	166.6	-172.6	0	0	0	0	109	N510	S508-N510 PolarHBondContact O-N 2.97Å
509	W	37.2	Very low	36.7	Very low	231 Å²	231	154.9 Å²	154.9	88%	0.875	81%	0.805	S	S	*	*			trans	-82.2	93.8	177.5	-70.9	94.5	0	0	0	110.3
510	N	37.8	Very low	36.6	Very low	157 Å²	157	155.3 Å²	155.3	84%	0.84	81%	0.809	S	S	*	*			trans	-97.6	128.9	163.3	-147.1	13.3	0	0	0	107.9	S508	S508-N510 PolarHBondContact O-N 2.97Å
511	M	36	Very low	36.6	Very low	157 Å²	157	156.7 Å²	156.7	77%	0.773	81%	0.809	S	S	*	*			trans	-110.4	94.7	-174.4	-91.7	-78.1	-167.5	0	0	110.3
512	D	37.5	Very low	36.6	Very low	165 Å²	165	159.8 Å²	159.8	88%	0.882	82%	0.818	S	S	*	*			trans	-167.2	154.2	156.5	-102.4	-37.2	0	0	0	110.1
513	E	36.4	Very low	36.4	Very low	144 Å²	144	153.1 Å²	153.1	67%	0.673	81%	0.809	S	S	*	*			trans	63.8	124	-165.9	-154.9	156.8	-138.9	0	0	112.2	R515	E513-R515 IonicContact OE1-CZ 3.74Å; E513-R515 IonicContact OE1-NE 3.42Å; E513-R515 PolarHBondContact OE1-NE 3.41Å; E513-R515 IonicContact OE1-NH2 3.12Å; E513-R515 PolarHBondContact OE1-NH2 3.37Å; E513-R515 VanDerWaalsContact OE1-NH2 3.12Å
514	I	37.7	Very low	36.6	Very low	166 Å²	166	155 Å²	155	85%	0.851	81%	0.809	S	S	*	*				-139.6	156.6	67.2	-77.4	162.1	0	0	0	112.7
515	R	39.8	Very low	37.2	Very low	170 Å²	170	149.8 Å²	149.8	64%	0.642	81%	0.805	S	S	*	*			trans	-77.2	156.6	-173.7	-56.1	172.7	-158.2	-178.6	5.1	113.8	E513	E513-R515 IonicContact OE1-CZ 3.74Å; E513-R515 IonicContact OE1-NE 3.42Å; E513-R515 PolarHBondContact OE1-NE 3.41Å; E513-R515 IonicContact OE1-NH2 3.12Å; E513-R515 PolarHBondContact OE1-NH2 3.37Å; E513-R515 VanDerWaalsContact OE1-NH2 3.12Å
516	P	35.7	Very low	37.9	Very low	122 Å²	122	149.9 Å²	149.9	79%	0.792	80%	0.797	S	S	*	*			trans	-75.3	149.9	167	33.1	-35.5	0	0	0	112.2
517	Y	34.9	Very low	38.2	Very low	203 Å²	203	146.6 Å²	146.6	80%	0.796	79%	0.793	S	S	*	*			trans	-140	146	163.4	-91.6	-86.9	0	0	0	110.3
518	P	38.9	Very low	38.4	Very low	118 Å²	118	149.3 Å²	149.3	77%	0.766	80%	0.801	S	S	*	*			trans	-100	162.2	-174.3	38.7	-35	0	0	0	113.9
519	H	37.2	Very low	38.5	Very low	188 Å²	188	155.6 Å²	155.6	87%	0.87	81%	0.806	S	S	*	*			trans	-148.1	152.4	150	-154.7	-80.2	0	0	0	110.4
520	E	36.4	Very low	38.7	Very low	161 Å²	161	148.5 Å²	148.5	75%	0.752	80%	0.797	S	S	*	*			trans	-103.3	156.1	-178	-57.3	-176.8	129.7	0	0	112.4
521	F	34.6	Very low	38.7	Very low	191 Å²	191	152 Å²	152	84%	0.838	80%	0.8	S	S	*	*			trans	56	157.2	163.4	-90.4	-111.6	0	0	0	118
522	D	37.2	Very low	39	Very low	149 Å²	149	150.4 Å²	150.4	80%	0.797	80%	0.804	S	S	*	*			cis	-127.6	173.9	6.6	-162.2	-0.5	0	0	0	111.3
523	G	35.2	Very low	38.9	Very low	67 Å²	67	148.9 Å²	148.9	69%	0.691	81%	0.805	S	S	*	*			trans	-94	155.4	-156.3	0	0	0	0	0	118.6
524	S	38.8	Very low	38.8	Very low	123 Å²	123	145.4 Å²	145.4	86%	0.86	81%	0.808	S	S	*	*			trans	-153.4	150.4	147.3	49.2	0	0	0	0	109.9
525	T	46.3	Very low	39	Very low	141 Å²	141	143.5 Å²	143.5	87%	0.865	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-90.8	133.9	-163.5	27.5	0	0	0	0	114.9
526	P	51.1	Low	38.9	Very low	109 Å²	109	145.1 Å²	145.1	71%	0.708	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-81.7	151.6	156.2	33.7	-32.1	0	0	0	111.1
527	P	42.9	Very low	39.1	Very low	131 Å²	131	144.4 Å²	144.4	85%	0.851	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-87.5	124.2	-168	32	-35.3	0	0	0	115.2
528	S	39.7	Very low	39.3	Very low	124 Å²	124	139.9 Å²	139.9	87%	0.867	81%	0.814	S	S	*	*			trans	-86.3	110.6	172.1	-60.7	0	0	0	0	112.1	A530	S528-A530 PolarHBondContact O-N 3.19Å
529	R	37.1	Very low	39.2	Very low	251 Å²	251	139.8 Å²	139.8	95%	0.947	82%	0.816	S	S	*	*			trans	-89	86.7	-178.2	-162	172.8	-170.6	171.3	3.8	113.9
530	A	40.7	Very low	39	Very low	81 Å²	81	137.2 Å²	137.2	67%	0.669	81%	0.814	S	S	*	*			trans	37.5	117.7	147.5	0	0	0	0	0	120.6	S528	S528-A530 PolarHBondContact O-N 3.19Å
531	Y	38.7	Very low	38.9	Very low	230 Å²	230	135 Å²	135	90%	0.902	82%	0.817	S	S	*	*			trans	-101	137.4	137.1	-78.7	-87.6	0	0	0	108.5
532	S	42	Very low	38.9	Very low	124 Å²	124	130.4 Å²	130.4	87%	0.867	81%	0.808	S	S	*	*			trans	-81.2	144.4	-177.2	-59.8	0	0	0	0	112.7
533	C	34.8	Very low	38.7	Very low	133 Å²	133	132 Å²	132	90%	0.899	81%	0.808	S	S	*	*			trans	-124.4	135.4	-179.7	-62.5	0	0	0	0	112.1
534	G	34.6	Very low	38.8	Very low	71 Å²	71	138.3 Å²	138.3	73%	0.732	82%	0.817	S	S	*	*			trans	-175	138.5	168.6	0	0	0	0	0	109.3
535	S	42.1	Very low	38.8	Very low	126 Å²	126	139.6 Å²	139.6	88%	0.881	81%	0.809	S	S	*	*			cis	-145.2	156.3	6.9	-64.9	0	0	0	0	112.4
536	K	38.3	Very low	38.4	Very low	204 Å²	204	138.5 Å²	138.5	89%	0.887	80%	0.804	S	S	*	*			trans	-90.1	176.8	162.5	-89.5	-179.7	177.9	178.3	0	108.9
537	P	40.3	Very low	37.5	Very low	107 Å²	107	136.8 Å²	136.8	70%	0.695	80%	0.795	S	S	*	*			cis	-147	-173.7	24.5	39	-15.9	0	0	0	118.3
538	S	37.7	Very low	37.3	Very low	108 Å²	108	142.7 Å²	142.7	76%	0.755	80%	0.801	S	S	*	*			trans	63.2	153.1	154.2	37.9	0	0	0	0	119.6
539	S	37.4	Very low	37	Very low	116 Å²	116	143 Å²	143	81%	0.811	79%	0.792	S	S	*	*			cis	-155.7	169.9	-5.6	37.7	0	0	0	0	111.6
540	T	32.4	Very low	36.7	Very low	134 Å²	134	141.6 Å²	141.6	82%	0.822	79%	0.786	S	S	*	*			trans	-73.2	142.9	-176.9	46.2	0	0	0	0	116.3
541	S	35.8	Very low	36.2	Very low	115 Å²	115	146.7 Å²	146.7	80%	0.804	79%	0.793	S	S	*	*				-178.9	113.8	125.8	55.2	0	0	0	0	116.3
542	S	33	Very low	35.9	Very low	94 Å²	94	142.7 Å²	142.7	66%	0.657	79%	0.787	S	S	*	*			trans	46.8	159.6	140.7	-149	0	0	0	0	125.1
543	F	34.1	Very low	35.3	Very low	183 Å²	183	144.8 Å²	144.8	80%	0.803	78%	0.783	S	S	*	*			trans	72.2	130.7	166.1	-63.4	-65.5	0	0	0	117.6
544	K	36.9	Very low	35.2	Very low	200 Å²	200	145.1 Å²	145.1	87%	0.87	78%	0.775	S	S	*	*			cis	-139.5	162.1	2.8	-98.5	166.7	-173.5	176.1	0	111.5
545	Q	39	Very low	35.2	Very low	149 Å²	149	146.7 Å²	146.7	70%	0.696	77%	0.772	S	S	*	*			trans	-100.7	169.1	171	-124.1	-178.3	7.3	0	0	110.5
546	P	37	Very low	34.5	Very low	118 Å²	118	150.2 Å²	150.2	77%	0.766	77%	0.772	S	S	*	*				-124.9	162.9	53.5	33.4	-17	0	0	0	114.4
547	S	32.6	Very low	34.1	Very low	74 Å²	74	144.9 Å²	144.9	52%	0.517	76%	0.76	S	S	.	*			cis	93.4	66.2	17.8	89.4	0	0	0	0	118.2
548	W	38.4	Very low	33.5	Very low	255 Å²	255	147 Å²	147	97%	0.966	77%	0.766	S	S	*	*				-122.7	137.9	128.1	60.8	-82.6	0	0	0	108.3
549	L	34.2	Very low	33	Very low	130 Å²	130	147.1 Å²	147.1	68%	0.681	76%	0.755	S	S	*	*			trans	-163.2	153.5	-155.4	-142.6	168	0	0	0	110.7
550	R	31.5	Very low	32.5	Very low	221 Å²	221	151 Å²	151	83%	0.834	75%	0.751	S	S	*	*			trans	92.4	155.1	162.9	-49.7	175.1	-166.8	-137.1	4.7	117.3
551	K	30.4	Very low	32.3	Very low	188 Å²	188	153.2 Å²	153.2	82%	0.817	75%	0.75	S	S	*	*			trans	81.2	133	164.6	-61.8	-167.9	178.7	-177.2	0	116.2
552	L	30.7	Very low	31.9	Very low	147 Å²	147	158.7 Å²	158.7	77%	0.77	75%	0.753	S	S	*	*			cis	-143.1	146	-18.8	-89.7	166.9	0	0	0	105.7
553	H	29.4	Very low	31.7	Very low	167 Å²	167	158 Å²	158	77%	0.773	75%	0.753	S	S	*	*				59.9	138	80.6	-128.1	-102.4	0	0	0	115.5
554	L	33.5	Very low	31.6	Very low	141 Å²	141	157.7 Å²	157.7	74%	0.738	75%	0.753	S	S	*	*			trans	-66.4	178.2	-178.3	-50.8	93.5	0	0	0	111.5
555	P	35.2	Very low	31.2	Very low	104 Å²	104	152.7 Å²	152.7	68%	0.675	74%	0.744	S	S	*	*			cis	-156.9	-158.1	20.9	49.1	-27.2	0	0	0	117.6
556	F	27.4	Very low	30.9	Very low	199 Å²	199	156.1 Å²	156.1	87%	0.873	76%	0.757	S	S	*	*			trans	54.7	165.3	163.2	-83.3	-112.8	0	0	0	117.4
557	S	28.1	Very low	30.7	Very low	92 Å²	92	154 Å²	154	64%	0.643	76%	0.757	S	S	*	*			cis	164.5	125	-32.5	-178.6	0	0	0	0	106.4
558	D	28.4	Very low	30.7	Very low	152 Å²	152	156.3 Å²	156.3	81%	0.813	76%	0.763	S	S	*	*			trans	62.2	167.8	158.5	-131.5	-27.7	0	0	0	122.3
559	E	27.7	Very low	30.4	Very low	111 Å²	111	153.4 Å²	153.4	52%	0.519	75%	0.752	S	S	.	*			trans	62.8	96.1	162.4	-69.7	-140.3	105	0	0	122.6
560	R	26.1	Very low	30.4	Very low	196 Å²	196	152.9 Å²	152.9	74%	0.74	75%	0.75	S	S	*	*				56.7	140.2	111.7	-73.2	161.9	150.1	-172	1.9	121.4
561	K	29.2	Very low	30.3	Very low	181 Å²	181	148.7 Å²	148.7	79%	0.787	74%	0.738	S	S	*	*			trans	93.5	157.8	160.4	-53.7	141.3	-167.1	156.4	0	115.6
562	R	26.7	Very low	30.3	Very low	230 Å²	230	146.7 Å²	146.7	87%	0.868	73%	0.73	S	S	*	*			cis	-174.4	136.7	-38.3	-166.5	177.5	-158.3	157.5	5.6	109.3
563	A	29.4	Very low	30.1	Very low	80 Å²	80	144.4 Å²	144.4	66%	0.661	72%	0.721	S	S	*	*			trans	62.1	169.5	172.1	0	0	0	0	0	114.4
564	H	30.9	Very low	30.1	Very low	176 Å²	176	141.4 Å²	141.4	82%	0.815	71%	0.71	S	S	*	*			cis	-128.7	145	8.8	-68.8	-107	0	0	0	109.1
565	S	29.9	Very low	29.7	Very low	95 Å²	95	144.2 Å²	144.2	66%	0.664	71%	0.711	S	S	*	*			cis	86.5	87	44	177.4	0	0	0	0	115.9
566	F	32.3	Very low	29.3	Very low	221 Å²	221	147 Å²	147	97%	0.969	71%	0.713	S	S	*	*			trans	-152.2	148.1	137.9	-73.8	-73.2	0	0	0	105.9
567	G	31.7	Very low	29.1	Very low	75 Å²	75	143.6 Å²	143.6	77%	0.773	70%	0.704	S	S	*	*			cis	144.5	146.5	7.1	0	0	0	0	0	107.9
568	N	33.7	Very low	29	Very low	121 Å²	121	144.8 Å²	144.8	65%	0.647	71%	0.712	S	S	*	*			cis	-162.1	165	-1.9	-168.9	9.8	0	0	0	111.3
569	W	31.7	Very low	28.9	Very low	195 Å²	195	142 Å²	142	74%	0.739	70%	0.704	S	S	*	*			trans	72.7	160.9	164.2	-69.7	-37.4	0	0	0	117.7
570	N	33.9	Very low	28.8	Very low	119 Å²	119	140.7 Å²	140.7	64%	0.636	71%	0.707	S	S	*	*			cis	-123.6	-115.3	4.3	-137.7	-29.7	0	0	0	115.2
571	K	30	Very low	28.9	Very low	132 Å²	132	141.1 Å²	141.1	57%	0.574	71%	0.711	S	S	*	*			trans	-153	174.6	-156.9	-64.3	-179.6	-164.5	87.6	0	109.7
572	F	30.8	Very low	29.3	Very low	147 Å²	147	140.2 Å²	140.2	65%	0.645	71%	0.714	S	S	*	*			cis	-142.1	139.6	21.6	-99.6	-78.6	0	0	0	116.6	K802 K803	F572-K802 CarbonylContact C-O 3.14Å; F572-K802 CarbonylContact O-C 3.55Å; F572-K803 PolarHBondContact O-N 3.38Å; F572-K803 VanDerWaalsContact O-N 3.16Å
573	V	26.2	Very low	29.4	Very low	98 Å²	98	132.5 Å²	132.5	59%	0.594	71%	0.705	S	S	*	*			trans	-58.1	154.9	168.3	-177.1	0	0	0	0	112.7
574	L	29.8	Very low	29.7	Very low	104 Å²	104	133.5 Å²	133.5	55%	0.545	71%	0.708	S	S	.	*			trans	175.8	170.1	130.7	-92.5	165.5	0	0	0	119.4	R801 K802	L574-R801 PolarHBondContact O-NH1 3.2Å; L574-K802 PolarHBondContact O-NZ 3.46Å
575	R	25.4	Very low	29.8	Very low	200 Å²	200	132 Å²	132	76%	0.755	71%	0.706	S	S	*	*			trans	-50.9	-155.5	179	-80.9	175.4	-176.1	-174.4	1.1	116.6	R801	R575-R801 PolarHBondContact O-NH1 2.94Å
576	K	25.6	Very low	30.1	Very low	162 Å²	162	132.3 Å²	132.3	70%	0.704	71%	0.707	S	S	*	*				-169.9	142.8	-59.7	177.6	-178.1	176.8	-170.1	0	108.3
577	N	24	Very low	30.1	Very low	129 Å²	129	126.2 Å²	126.2	69%	0.69	69%	0.692	S	S	*	*			trans	59.6	163	168.2	-73.9	26.9	0	0	0	119.6
578	S	25.4	Very low	30.2	Very low	116 Å²	116	129.6 Å²	129.6	81%	0.811	69%	0.693	S	S	*	*			trans	64.5	153.5	147.8	40.7	0	0	0	0	120.2
579	S	25.9	Very low	30.3	Very low	94 Å²	94	128.8 Å²	128.8	66%	0.657	70%	0.697	S	S	*	*			cis	-174.2	151.2	-19.2	179.5	0	0	0	0	110.7
580	S	25.6	Very low	30.1	Very low	83 Å²	83	124.8 Å²	124.8	58%	0.58	70%	0.697	S	S	*	*			trans	58.8	173.7	145.8	56.5	0	0	0	0	121.8
581	Y	29.7	Very low	30.2	Very low	206 Å²	206	127.1 Å²	127.1	81%	0.808	71%	0.708	S	S	*	*			trans	77.6	122.7	176.1	-52.8	-72.3	0	0	0	115.3
582	L	35.9	Very low	30.2	Very low	162 Å²	162	132.3 Å²	132.3	85%	0.848	73%	0.725	S	S	*	*			cis	-120.9	159.3	-1.4	-66.9	162.6	0	0	0	108.4
583	G	29	Very low	30.4	Very low	67 Å²	67	129.3 Å²	129.3	69%	0.691	73%	0.727	S	S	*	*			cis	91.6	116.2	40.9	0	0	0	0	0	108
584	S	36.7	Very low	30.6	Very low	102 Å²	102	136.2 Å²	136.2	71%	0.713	74%	0.742	S	S	*	*			cis	-146.7	161	22.4	-82	0	0	0	0	114
585	D	33.7	Very low	30.9	Very low	145 Å²	145	135 Å²	135	78%	0.775	74%	0.742	S	S	*	*				22.3	144.9	123.9	-34.2	-48.5	0	0	0	118.5
586	S	34.8	Very low	31.4	Very low	100 Å²	100	132.5 Å²	132.5	70%	0.699	74%	0.744	S	S	*	*			cis	-159.8	131	10.3	42.1	0	0	0	0	108.2
587	S	33	Very low	32.2	Very low	93 Å²	93	129.6 Å²	129.6	65%	0.65	74%	0.744	S	S	*	*				71	140.4	98.5	95.5	0	0	0	0	116
588	D	34.7	Very low	32.7	Very low	146 Å²	146	129.7 Å²	129.7	78%	0.781	75%	0.753	S	S	*	*			trans	65.8	154	160.3	-53.9	-54.8	0	0	0	118.8
589	S	34.1	Very low	33.3	Very low	105 Å²	105	127.1 Å²	127.1	73%	0.734	75%	0.746	S	S	*	*			cis	-156.3	-177.2	-29.8	60.5	0	0	0	0	110.6
590	C	28.4	Very low	34.1	Very low	110 Å²	110	127.8 Å²	127.8	74%	0.743	75%	0.75	S	S	*	*			trans	-38.3	165	179.1	-52.6	0	0	0	0	119.4
591	L	35.1	Very low	34.8	Very low	168 Å²	168	130.2 Å²	130.2	88%	0.88	76%	0.756	S	S	*	*			trans	116.5	124.8	146.5	-57.1	-176.7	0	0	0	119
592	R	30.1	Very low	35.3	Very low	242 Å²	242	126.4 Å²	126.4	91%	0.913	75%	0.746	S	S	*	*			trans	-38.8	164.6	150.9	-75.1	172.9	169.6	145.2	-4.7	114.7
593	A	35.1	Very low	35.4	Very low	83 Å²	83	127.8 Å²	127.8	69%	0.686	74%	0.741	S	S	*	*			cis	179.6	-178.4	-14.6	0	0	0	0	0	108.4
594	R	31.8	Very low	35.8	Very low	243 Å²	243	128.6 Å²	128.6	92%	0.917	74%	0.741	S	S	*	*			trans	69.7	157.3	170	-71.9	-177.2	167.8	133.5	-5.4	115.7
595	S	35.4	Very low	35.7	Very low	79 Å²	79	128.6 Å²	128.6	55%	0.552	74%	0.741	S	S	*	*			cis	-165.5	166.7	-26.7	51.8	0	0	0	0	109.5
596	D	36.8	Very low	35.7	Very low	147 Å²	147	127.3 Å²	127.3	79%	0.786	74%	0.739	S	S	*	*			trans	66.4	169.2	163.9	-37.2	-50.7	0	0	0	114.6
597	S	41.4	Very low	35.6	Very low	102 Å²	102	127.6 Å²	127.6	71%	0.713	74%	0.741	S	S	*	*			cis	-159.9	152.2	9.1	-162.4	0	0	0	0	112.4
598	C	33.6	Very low	35.7	Very low	130 Å²	130	133.7 Å²	133.7	88%	0.878	75%	0.75	S	S	*	*			trans	72.7	112.3	132.2	50	0	0	0	0	121.5
599	G	39.8	Very low	35.7	Very low	63 Å²	63	134.5 Å²	134.5	65%	0.649	75%	0.754	S	S	*	*			trans	149.4	102.2	150.3	0	0	0	0	0	112.5
600	S	42	Very low	35.9	Very low	107 Å²	107	133.4 Å²	133.4	75%	0.748	76%	0.759	S	S	*	*				69.6	134.3	68.9	-70.4	0	0	0	0	112.4
601	D	40.4	Very low	36.3	Very low	134 Å²	134	134.9 Å²	134.9	72%	0.717	77%	0.765	S	S	*	*			cis	177.5	178.1	2.1	-96.6	-43.2	0	0	0	103.4
602	E	39.2	Very low	36.3	Very low	126 Å²	126	137.6 Å²	137.6	59%	0.589	76%	0.764	S	S	*	*			cis	-166.8	163.9	10.5	-128.7	170.8	172.4	0	0	110.2
603	Y	38.8	Very low	36.5	Very low	191 Å²	191	131.1 Å²	131.1	75%	0.749	75%	0.754	S	S	*	*			trans	52.7	132.2	156.7	-57.8	-42.8	0	0	0	122.7
604	A	37.4	Very low	36.5	Very low	84 Å²	84	135.3 Å²	135.3	69%	0.694	76%	0.76	S	S	*	*				79.2	148.7	61	0	0	0	0	0	114.1
605	S	34.4	Very low	36.8	Very low	102 Å²	102	128.4 Å²	128.4	71%	0.713	75%	0.746	S	S	*	*			cis	-166.9	164.7	-6.5	-118.2	0	0	0	0	113
606	T	34	Very low	36.8	Very low	119 Å²	119	135.4 Å²	135.4	73%	0.73	76%	0.761	S	S	*	*			trans	54.6	109.8	150.5	53.3	0	0	0	0	124.5
607	S	31.9	Very low	36.7	Very low	105 Å²	105	133.6 Å²	133.6	73%	0.734	76%	0.755	S	S	*	*				84.8	160.1	120	83.8	0	0	0	0	124.3
608	R	35.8	Very low	36.4	Very low	221 Å²	221	139.3 Å²	139.3	83%	0.834	76%	0.761	S	S	*	*			trans	89.6	100.4	158.7	-71.1	-179.1	173.4	-165	-1.7	121.8
609	N	34.6	Very low	36.3	Very low	163 Å²	163	139.6 Å²	139.6	87%	0.872	75%	0.753	S	S	*	*				53.2	120.7	122.8	-58.8	5.8	0	0	0	121.9
610	G	37.6	Very low	35.9	Very low	82 Å²	82	145.5 Å²	145.5	85%	0.845	76%	0.761	S	S	*	*			trans	-159.1	103.8	160.5	0	0	0	0	0	113.3
611	T	37.5	Very low	35.3	Very low	141 Å²	141	147.2 Å²	147.2	87%	0.865	76%	0.762	S	S	*	*			trans	-65.3	160.9	177.5	53	0	0	0	0	113
612	R	35.7	Very low	34.8	Very low	226 Å²	226	144.9 Å²	144.9	85%	0.853	76%	0.756	S	S	*	*				178.9	143.1	64.6	-170.7	174.8	-162.7	-147.5	4.5	114.8
613	C	34.2	Very low	34.3	Very low	106 Å²	106	147.4 Å²	147.4	72%	0.716	77%	0.765	S	S	*	*			trans	60.6	133.4	168.4	-66.3	0	0	0	0	119.2
614	Q	33.4	Very low	33.8	Very low	171 Å²	171	147.3 Å²	147.3	80%	0.799	77%	0.769	S	S	*	*			cis	78.8	147.6	22.9	-64.4	-81.6	-14.5	0	0	115.9
615	P	38.9	Very low	33.3	Very low	98 Å²	98	148.8 Å²	148.8	64%	0.636	77%	0.774	S	S	*	*			cis	-141	167.6	11.6	41.1	-22.3	0	0	0	120.2
616	R	35	Very low	33.1	Very low	225 Å²	225	149 Å²	149	85%	0.849	78%	0.776	S	S	*	*			trans	69.4	147.3	153.9	-72	170.9	176.3	166.1	-2.1	119
617	T	35.8	Very low	32.8	Very low	110 Å²	110	149.8 Å²	149.8	68%	0.675	78%	0.784	S	S	*	*			cis	-155.1	150.2	-1.4	1.3	0	0	0	0	112.2
618	R	35	Very low	32.7	Very low	221 Å²	221	149.5 Å²	149.5	83%	0.834	78%	0.783	S	S	*	*			trans	18.7	151.6	142.3	-57.5	172	-173	-178.9	0.5	120.3
619	L	31.7	Very low	32.5	Very low	136 Å²	136	148 Å²	148	71%	0.712	79%	0.785	S	S	*	*			cis	-173.1	-178.8	-7.7	-99.9	170.3	0	0	0	105.4
620	F	31.6	Very low	32.5	Very low	188 Å²	188	148.1 Å²	148.1	83%	0.825	79%	0.786	S	S	*	*			cis	-141	-114.5	5	-145.9	-44.5	0	0	0	111.4
621	D	29.1	Very low	32.2	Very low	143 Å²	143	152.6 Å²	152.6	77%	0.765	79%	0.789	S	S	*	*			trans	-157.4	169.5	-174.5	-157.7	-24.8	0	0	0	111.5
622	S	29.5	Very low	32.1	Very low	84 Å²	84	152.5 Å²	152.5	59%	0.587	79%	0.788	S	S	*	*			trans	85.2	111.4	160.6	-73.8	0	0	0	0	124
623	K	29.3	Very low	31.9	Very low	179 Å²	179	150.4 Å²	150.4	78%	0.778	79%	0.788	S	S	*	*				75.5	142	126.9	-61.7	176.6	-175.3	173.3	0	124.1
624	F	27.5	Very low	31.8	Very low	190 Å²	190	152.7 Å²	152.7	83%	0.833	79%	0.791	S	S	*	*			trans	89.6	147.7	144.9	-88	-61.6	0	0	0	123.7
625	S	26.9	Very low	31.7	Very low	115 Å²	115	149.4 Å²	149.4	80%	0.804	78%	0.779	S	S	*	*			trans	81.5	151.8	154.3	58.8	0	0	0	0	122.5
626	S	29.2	Very low	31.5	Very low	107 Å²	107	154.2 Å²	154.2	75%	0.748	79%	0.791	S	S	*	*			trans	-76.2	161.5	-178.2	47.2	0	0	0	0	115.2
627	C	29.5	Very low	31.2	Very low	134 Å²	134	153.1 Å²	153.1	91%	0.905	79%	0.787	S	S	*	*			trans	-137.7	166.3	158.4	-80.9	0	0	0	0	111.2
628	S	28.6	Very low	31	Very low	100 Å²	100	154.7 Å²	154.7	70%	0.699	80%	0.796	S	S	*	*			trans	-135.9	163.3	-176.6	-53.4	0	0	0	0	110.9
629	E	32.9	Very low	31	Very low	189 Å²	189	149.1 Å²	149.1	88%	0.883	80%	0.797	S	S	*	*			trans	67.5	144.4	154.8	-68.4	164.3	155.2	0	0	120
630	D	32.7	Very low	31.1	Very low	166 Å²	166	147.7 Å²	147.7	89%	0.888	80%	0.799	S	S	*	*			trans	-144.6	132.5	168.8	-100.5	-43.5	0	0	0	107.9
631	L	32.6	Very low	31.2	Very low	175 Å²	175	143.9 Å²	143.9	92%	0.916	80%	0.795	S	S	*	*			trans	-147.2	152.2	169.5	-90.1	177.8	0	0	0	109.3
632	V	34.4	Very low	31.6	Very low	139 Å²	139	142.5 Å²	142.5	84%	0.842	80%	0.797	S	S	*	*			trans	-134.6	136.9	178.9	-177.8	0	0	0	0	110
633	E	31.1	Very low	31.7	Very low	182 Å²	182	148.3 Å²	148.3	85%	0.85	81%	0.812	S	S	*	*			trans	-119.6	157.1	-178.8	-177.9	176.1	-141.8	0	0	110.6
634	I	34.1	Very low	32	Very low	154 Å²	154	143.5 Å²	143.5	79%	0.79	81%	0.813	S	S	*	*			trans	-135.5	132.1	172.6	-58.8	-178.6	0	0	0	109.5
635	D	30.5	Very low	32.3	Very low	102 Å²	102	142.7 Å²	142.7	55%	0.545	81%	0.812	S	S	.	*			trans	-108.6	144.7	-172.9	162.2	36.2	0	0	0	112.4	R637	D635-R637 PolarHBondContact OD1-N 3.29Å; D635-R637 IonicContact OD2-NE 3.84Å
636	F	34	Very low	32.8	Very low	200 Å²	200	142.3 Å²	142.3	88%	0.877	81%	0.809	S	S	*	*			trans	-151	71.7	156.4	-85.6	-59.3	0	0	0	115.4
637	R	29.3	Very low	33.1	Very low	202 Å²	202	145.1 Å²	145.1	76%	0.762	81%	0.811	S	S	*	*			trans	28.5	128.8	132.1	-72.4	-173.3	173.2	-145.8	-3.2	123.6	D635	D635-R637 PolarHBondContact OD1-N 3.29Å; D635-R637 IonicContact OD2-NE 3.84Å
638	T	31.2	Very low	33.4	Very low	142 Å²	142	144.3 Å²	144.3	87%	0.871	81%	0.806	S	S	*	*			trans	72.8	114.4	143	27	0	0	0	0	123.6
639	A	35.3	Very low	33.9	Very low	104 Å²	104	143.4 Å²	143.4	86%	0.86	81%	0.813	S	S	*	*				-158.7	165.2	125.1	0	0	0	0	0	109.4
640	S	33	Very low	34	Very low	106 Å²	106	139.8 Å²	139.8	74%	0.741	81%	0.808	S	S	*	*			trans	-141.7	148.9	-160.8	58.9	0	0	0	0	117.8
641	S	34.2	Very low	34.1	Very low	108 Å²	108	140 Å²	140	76%	0.755	81%	0.808	S	S	*	*			trans	66	139.7	156.9	67.1	0	0	0	0	118
642	S	37	Very low	34.2	Very low	114 Å²	114	134.8 Å²	134.8	80%	0.797	80%	0.797	S	S	*	*				-161.2	176.3	56.4	-69.1	0	0	0	0	115
643	F	33.3	Very low	34.2	Very low	207 Å²	207	133.7 Å²	133.7	91%	0.908	80%	0.796	S	S	*	*			trans	-85	160.1	-171.7	-83.9	-116.7	0	0	0	116.1
644	G	34.6	Very low	34.4	Very low	77 Å²	77	130.4 Å²	130.4	79%	0.794	79%	0.788	S	S	*	*			trans	-168.4	134.5	158.7	0	0	0	0	0	111.8
645	Q	34.7	Very low	34.5	Very low	173 Å²	173	130 Å²	130	81%	0.808	79%	0.788	S	S	*	*			trans	-130	166.9	-172.8	-93.7	-166	-1.3	0	0	113.7
646	S	36.8	Very low	34.8	Very low	107 Å²	107	129.3 Å²	129.3	75%	0.748	79%	0.791	S	S	*	*			trans	81.7	152.8	151.2	80.4	0	0	0	0	118.7
647	Q	36.4	Very low	34.9	Very low	167 Å²	167	128.2 Å²	128.2	78%	0.78	79%	0.793	S	S	*	*			cis	-167.1	148.3	-30	-107	-148.5	38.8	0	0	109.8
648	S	35.9	Very low	35.3	Very low	116 Å²	116	121.8 Å²	121.8	81%	0.811	79%	0.79	S	S	*	*			trans	64	151	151.4	75.7	0	0	0	0	120.8
649	G	37.4	Very low	35.6	Very low	81 Å²	81	126.6 Å²	126.6	84%	0.835	79%	0.792	S	S	*	*			trans	148.5	125.8	169.9	0	0	0	0	0	113
650	S	34.8	Very low	35.7	Very low	113 Å²	113	126 Å²	126	79%	0.79	78%	0.782	S	S	*	*			trans	-144.8	168.7	-174.6	-174.4	0	0	0	0	112.4
651	L	36.4	Very low	35.9	Very low	170 Å²	170	132.8 Å²	132.8	89%	0.89	79%	0.791	S	S	*	*			trans	107.6	139.8	159.9	-56.6	173.2	0	0	0	118.9
652	G	34.3	Very low	36.1	Very low	66 Å²	66	131.1 Å²	131.1	68%	0.68	78%	0.784	S	S	*	*			trans	93.4	125.9	165.9	0	0	0	0	0	114.6
653	S	34.2	Very low	36.1	Very low	116 Å²	116	133.4 Å²	133.4	81%	0.811	79%	0.787	S	S	*	*			cis	67	132.9	44.6	-54.6	0	0	0	0	112.9
654	T	35.7	Very low	36.4	Very low	113 Å²	113	127.5 Å²	127.5	69%	0.693	77%	0.772	S	S	*	*			cis	-168.5	154.3	4.5	10.3	0	0	0	0	109.2
655	D	34.9	Very low	36.6	Very low	146 Å²	146	132.8 Å²	132.8	78%	0.781	78%	0.778	S	S	*	*			trans	59.4	165.2	150.4	-62.9	-30.1	0	0	0	120.3
656	S	37.1	Very low	36.8	Very low	88 Å²	88	127.4 Å²	127.4	62%	0.615	77%	0.769	S	S	*	*			cis	-168	174.8	-35.6	62.1	0	0	0	0	110.1
657	L	37.2	Very low	36.8	Very low	176 Å²	176	128.5 Å²	128.5	92%	0.921	77%	0.771	S	S	*	*			trans	72.4	145.5	160.4	-60.8	167.9	0	0	0	121.2
658	G	37.8	Very low	36.9	Very low	68 Å²	68	126.8 Å²	126.8	70%	0.701	77%	0.768	S	S	*	*			trans	127.5	96.4	167.9	0	0	0	0	0	113.2
659	R	36.5	Very low	36.9	Very low	242 Å²	242	127.6 Å²	127.6	91%	0.913	76%	0.763	S	S	*	*				55.4	134.3	71.9	-67.2	-165.7	169.9	-159.6	-1.6	114.3
660	S	37.7	Very low	36.8	Very low	93 Å²	93	130.8 Å²	130.8	65%	0.65	76%	0.758	S	S	*	*			cis	-175.8	170.8	-3.3	-96.8	0	0	0	0	110.9
661	R	36.8	Very low	36.7	Very low	248 Å²	248	131.9 Å²	131.9	94%	0.936	75%	0.753	S	S	*	*			trans	73.9	159	160.8	-68.6	161.1	173	179.5	-4.3	117.6
662	A	38.6	Very low	36.5	Very low	73 Å²	73	133.7 Å²	133.7	60%	0.603	75%	0.754	S	S	*	*			cis	-175.6	160.4	-30	0	0	0	0	0	110.7
663	N	36.1	Very low	36.6	Very low	161 Å²	161	139.9 Å²	139.9	86%	0.861	76%	0.763	S	S	*	*			trans	70.1	155.2	152.5	-69.4	2.6	0	0	0	117.7
664	S	41.1	Very low	36.5	Very low	84 Å²	84	142.5 Å²	142.5	59%	0.587	76%	0.762	S	S	*	*			cis	-164.6	159.6	-3	153.7	0	0	0	0	112.2
665	M	38.7	Very low	36.4	Very low	188 Å²	188	143.5 Å²	143.5	93%	0.926	77%	0.768	S	S	*	*			trans	66.1	142.5	164.5	-71.9	152	-176.2	0	0	119
666	G	38	Very low	36.1	Very low	59 Å²	59	147.3 Å²	147.3	61%	0.608	77%	0.772	S	S	*	*			cis	161.7	154.3	-12.8	0	0	0	0	0	114.8
667	T	38.3	Very low	36	Very low	131 Å²	131	150.4 Å²	150.4	80%	0.804	78%	0.78	S	S	*	*			trans	63.3	145	161.5	56.1	0	0	0	0	118.6
668	N	36.9	Very low	35.8	Very low	131 Å²	131	147.5 Å²	147.5	70%	0.701	77%	0.772	S	S	*	*			cis	-159.3	154.5	2.5	-105.6	-16.9	0	0	0	111.7
669	N	37	Very low	35.5	Very low	133 Å²	133	153.8 Å²	153.8	71%	0.711	78%	0.78	S	S	*	*			trans	60.8	151.4	152.9	-70.2	-8.5	0	0	0	120.5
670	M	35.6	Very low	35.5	Very low	147 Å²	147	149.2 Å²	149.2	72%	0.724	78%	0.779	S	S	*	*			cis	-151.7	131.7	-8.5	-128.4	176.6	-178	0	0	113.2
671	I	31.5	Very low	35.4	Very low	136 Å²	136	152.5 Å²	152.5	70%	0.697	78%	0.784	S	S	*	*			trans	30.2	116.1	143.3	-53.2	169.6	0	0	0	119.1
672	F	33	Very low	35.2	Very low	209 Å²	209	150 Å²	150	92%	0.917	78%	0.782	S	S	*	*			trans	-134.1	162.3	142	-121.9	-94.2	0	0	0	110.6
673	K	36.4	Very low	35.1	Very low	196 Å²	196	153.4 Å²	153.4	85%	0.852	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-80.5	156.4	-161	-71.8	-178.4	176.5	178	0	115.4
674	Q	32.2	Very low	35.3	Very low	171 Å²	171	151.2 Å²	151.2	80%	0.799	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-67.9	134.6	-169.8	-62.1	155.3	-78.2	0	0	114.7
675	T	32.3	Very low	35.4	Very low	133 Å²	133	155.6 Å²	155.6	82%	0.816	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-93.3	135	152	9.5	0	0	0	0	109.5
676	W	30.4	Very low	35.5	Very low	227 Å²	227	155 Å²	155	86%	0.86	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-87.2	117.7	170.2	-75.7	81.2	0	0	0	109.8
677	L	33.2	Very low	35.6	Very low	153 Å²	153	160.3 Å²	160.3	80%	0.801	80%	0.797	S	S	*	*			trans	-110.5	131.3	163.5	-77.8	166.5	0	0	0	107.9
678	P	34.3	Very low	35.8	Very low	114 Å²	114	158.2 Å²	158.2	74%	0.74	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-67	144.3	171	29.4	-33.2	0	0	0	109.9	V680	P678-V680 PolarHBondContact O-N 2.85Å
679	K	30	Very low	36.9	Very low	200 Å²	200	156 Å²	156	87%	0.87	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-61.3	130.4	168.1	-85.4	-179.6	168.4	-175.5	0	109.1
680	V	36.5	Very low	37.8	Very low	146 Å²	146	154.4 Å²	154.4	89%	0.885	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-81.4	117.6	155.3	179.1	0	0	0	0	106.5	P678	P678-V680 PolarHBondContact O-N 2.85Å
681	E	37.6	Very low	38.5	Very low	163 Å²	163	151.1 Å²	151.1	76%	0.762	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-85.1	150.5	176	-164.6	147.6	-132.3	0	0	109.6	I683	E681-I683 PolarHBondContact O-N 2.92Å
682	Q	32.7	Very low	39.9	Very low	194 Å²	194	147.4 Å²	147.4	91%	0.907	74%	0.744	S	S	*	*			trans	-73.2	111.3	-179.4	-73.6	-178.8	-73.9	0	0	110.1
683	I	36.4	Very low	41	Very low	145 Å²	145	143.5 Å²	143.5	74%	0.744	72%	0.723	S	S	*	*			trans	-91.6	124.7	167.5	-61.6	175	0	0	0	107.9	E681	E681-I683 PolarHBondContact O-N 2.92Å
684	T	40.4	Very low	42	Very low	115 Å²	115	139.6 Å²	139.6	71%	0.706	71%	0.711	S	S	*	*			trans	-78.5	165.2	176.9	36.9	0	0	0	0	112.1	Q686	T684-Q686 PolarHBondContact O-N 3.22Å
685	E	41.3	Very low	43.4	Very low	176 Å²	176	135.2 Å²	135.2	82%	0.822	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	32.1	-158.5	-55.8	177.2	131.9	0	0	116.6
686	Q	41.8	Very low	44.6	Very low	176 Å²	176	133.6 Å²	133.6	82%	0.822	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.8	-8.9	-171.3	-68.7	-170.3	-28.4	0	0	116.4	T684	T684-Q686 PolarHBondContact O-N 3.22Å
687	E	40.5	Very low	45.8	Very low	170 Å²	170	127.5 Å²	127.5	79%	0.794	66%	0.663	S	S	*	*			trans	-123	64.1	178.5	-67.6	-162.8	122.3	0	0	113.7
688	L	41.4	Very low	47	Very low	87 Å²	87	125.7 Å²	125.7	46%	0.455	65%	0.654	S	S	.	*			trans	-118.6	127.7	167.5	-72.2	176.8	0	0	0	111.2	V692 R693	L688-V692 HydrophobicContact CD2-CG1 4.18Å; L688-R693 HydrophobicContact CB-CG 4.43Å
689	T	60.6	Low	47.7	Very low	84 Å²	84	125.3 Å²	125.3	52%	0.515	64%	0.64	S	S	.	*			trans	-65.6	148.6	177	45.5	0	0	0	0	111.2	S691 V692 R693	T689-S691 PolarHBondContact O-N 3.22Å; T689-S691 VanDerWaalsContact O-N 3.11Å; T689-V692 PolarHBondContact O-N 3.11Å; T689-V692 WeakPolarHBondContact OG1-CG2 3.08Å; T689-R693 PolarHBondContact O-N 3.32Å
690	P	55.1	Low	48.5	Very low	101 Å²	101	119 Å²	119	66%	0.656	62%	0.616	S	S	*	*	H	α-helix	trans	-61.5	-25.7	-172.6	22.1	-33.4	0	0	0	114	L694	P690-L694 PolarHBondContact O-N 3.17Å; P690-L694 VanDerWaalsContact O-N 3.08Å
691	S	52	Low	49	Very low	77 Å²	77	119.1 Å²	119.1	54%	0.538	61%	0.607	S	S	.	*	H	α-helix	trans	-68.8	-30.1	173.3	49	0	0	0	0	113.8	T689 V695	T689-S691 PolarHBondContact O-N 3.22Å; T689-S691 VanDerWaalsContact O-N 3.11Å; S691-V695 WeakPolarHBondContact O-CG2 3.41Å; S691-V695 PolarHBondContact O-N 3.4Å
692	V	60.3	Low	49.4	Very low	59 Å²	59	118.4 Å²	118.4	36%	0.358	60%	0.603	S	S	.	*	H	α-helix	trans	-77.7	-39.7	175.6	-179.5	0	0	0	0	110.4	L688 T689 V695 Q696	L688-V692 HydrophobicContact CD2-CG1 4.18Å; T689-V692 PolarHBondContact O-N 3.11Å; T689-V692 WeakPolarHBondContact OG1-CG2 3.08Å; V692-V695 PolarHBondContact O-N 3.43Å; V692-Q696 WeakPolarHBondContact O-CB 2.94Å; V692-Q696 PolarHBondContact O-N 3.08Å
693	R	55.6	Low	49.7	Very low	127 Å²	127	117.1 Å²	117.1	48%	0.479	59%	0.59	S	S	.	*	H	α-helix	trans	-57.3	-51.9	172.7	-77.4	-174	171.2	155.9	0.2	111.4	L688 T689 V695 Q696 D697	L688-R693 HydrophobicContact CB-CG 4.43Å; T689-R693 PolarHBondContact O-N 3.32Å; R693-V695 VanDerWaalsContact C-N 3.29Å; R693-V695 PolarHBondContact O-N 3.19Å; R693-Q696 CarbonylContact O-C 3.57Å; R693-Q696 WeakPolarHBondContact O-CA 3.49Å; R693-Q696 PolarHBondContact O-N 2.93Å; R693-D697 WeakPolarHBondContact O-CB 3.42Å; R693-D697 PolarHBondContact O-N 3.3Å; R693-D697 VanDerWaalsContact O-OD2 3.1Å
694	L	56.7	Low	49.7	Very low	113 Å²	113	116.3 Å²	116.3	59%	0.592	59%	0.587	S	S	*	*	H	α-helix	trans	-55.2	-38.6	177.5	-79.9	168.3	0	0	0	114.2	P690 L698	P690-L694 PolarHBondContact O-N 3.17Å; P690-L694 VanDerWaalsContact O-N 3.08Å; L694-L698 WeakPolarHBondContact O-CB 3.49Å; L694-L698 WeakPolarHBondContact O-CD1 3.5Å; L694-L698 VanDerWaalsContact O-CG 3.23Å; L694-L698 WeakPolarHBondContact O-CG 3.46Å; L694-L698 PolarHBondContact O-N 3.28Å
695	V	62	Low	49.7	Very low	80 Å²	80	116.9 Å²	116.9	49%	0.485	59%	0.585	S	S	.	*	H	α-helix	trans	-70.5	-35.9	176.4	170.4	0	0	0	0	111.6	S691 V692 R693 F699	S691-V695 WeakPolarHBondContact O-CG2 3.41Å; S691-V695 PolarHBondContact O-N 3.4Å; V692-V695 PolarHBondContact O-N 3.43Å; R693-V695 VanDerWaalsContact C-N 3.29Å; R693-V695 PolarHBondContact O-N 3.19Å; V695-F699 HydrophobicContact CG1-CD2 3.9Å; V695-F699 HydrophobicContact CG1-CE2 3.93Å; V695-F699 VanDerWaalsContact O-CD2 3.28Å; V695-F699 WeakPolarHBondContact O-CD2 3.18Å; V695-F699 PolarHBondContact O-N 3.2Å; V695-F699 VanDerWaalsContact O-N 3.07Å
696	Q	57.7	Low	49.3	Very low	98 Å²	98	114.1 Å²	114.1	46%	0.458	58%	0.582	S	S	.	*	H	α-helix	trans	-74.9	-42.5	179.6	-162.2	158	-6.3	0	0	111.6	V692 R693 L698 F699 D700	V692-Q696 WeakPolarHBondContact O-CB 2.94Å; V692-Q696 PolarHBondContact O-N 3.08Å; R693-Q696 CarbonylContact O-C 3.57Å; R693-Q696 WeakPolarHBondContact O-CA 3.49Å; R693-Q696 PolarHBondContact O-N 2.93Å; Q696-L698 VanDerWaalsContact C-N 3.33Å; Q696-L698 PolarHBondContact O-N 3.3Å; Q696-F699 PolarHBondContact O-N 3.08Å; Q696-D700 PolarHBondContact O-N 2.95Å
697	D	55.3	Low	48.8	Very low	99 Å²	99	111.2 Å²	111.2	53%	0.529	58%	0.581	S	S	.	*	H	α-helix	trans	-56.9	-44.6	171	-61.8	-34.3	0	0	0	110.7	R693 D700 H701	R693-D697 WeakPolarHBondContact O-CB 3.42Å; R693-D697 PolarHBondContact O-N 3.3Å; R693-D697 VanDerWaalsContact O-OD2 3.1Å; D697-D700 PolarHBondContact O-N 3.37Å; D697-H701 VanDerWaalsContact O-CB 3.28Å; D697-H701 WeakPolarHBondContact O-CB 3.28Å; D697-H701 PolarHBondContact O-N 3.01Å
698	L	58.6	Low	48.3	Very low	116 Å²	116	110.5 Å²	110.5	61%	0.607	58%	0.583	S	S	*	*	H	α-helix	trans	-61.4	-47.1	174.1	-78.6	167.3	0	0	0	112.5	L694 Q696 D700 H701 E702	L694-L698 WeakPolarHBondContact O-CB 3.49Å; L694-L698 WeakPolarHBondContact O-CD1 3.5Å; L694-L698 VanDerWaalsContact O-CG 3.23Å; L694-L698 WeakPolarHBondContact O-CG 3.46Å; L694-L698 PolarHBondContact O-N 3.28Å; Q696-L698 VanDerWaalsContact C-N 3.33Å; Q696-L698 PolarHBondContact O-N 3.3Å; L698-D700 VanDerWaalsContact C-N 3.3Å; L698-D700 PolarHBondContact O-N 3.03Å; L698-H701 PolarHBondContact O-N 3.16Å; L698-E702 PolarHBondContact O-N 3.37Å
699	F	48.8	Very low	48.1	Very low	106 Å²	106	112.6 Å²	112.6	47%	0.465	60%	0.6	S	S	.	*	H	α-helix	trans	-65.2	-30.8	179.4	-91.7	-57.8	0	0	0	113.8	V695 Q696 R703	V695-F699 HydrophobicContact CG1-CD2 3.9Å; V695-F699 HydrophobicContact CG1-CE2 3.93Å; V695-F699 VanDerWaalsContact O-CD2 3.28Å; V695-F699 WeakPolarHBondContact O-CD2 3.18Å; V695-F699 PolarHBondContact O-N 3.2Å; V695-F699 VanDerWaalsContact O-N 3.07Å; Q696-F699 PolarHBondContact O-N 3.08Å; F699-R703 VanDerWaalsContact O-CD 3.25Å; F699-R703 WeakPolarHBondContact O-CD 3.41Å; F699-R703 WeakPolarHBondContact O-CG 3.37Å
700	D	48.3	Very low	46.7	Very low	67 Å²	67	115.1 Å²	115.1	36%	0.358	62%	0.615	S	S	.	*	H	α-helix	trans	-88.3	-19.8	177.1	-67.1	-28.1	0	0	0	111.9	Q696 D697 L698 R703 N704	Q696-D700 PolarHBondContact O-N 2.95Å; D697-D700 PolarHBondContact O-N 3.37Å; L698-D700 VanDerWaalsContact C-N 3.3Å; L698-D700 PolarHBondContact O-N 3.03Å; D700-R703 PolarHBondContact O-N 3.46Å; D700-R703 IonicContact OD1-CZ 2.89Å; D700-R703 IonicContact OD1-NH1 3.92Å; D700-R703 PolarHBondContact OD1-NH1 3.26Å; D700-N704 PolarHBondContact O-ND2 3.36Å
701	H	46.6	Very low	45.4	Very low	149 Å²	149	114.9 Å²	114.9	69%	0.69	62%	0.621	S	S	*	*	H	α-helix	trans	-73.3	-35.9	168.6	-151.6	-29.8	0	0	0	112.6	D697 L698 R703	D697-H701 VanDerWaalsContact O-CB 3.28Å; D697-H701 WeakPolarHBondContact O-CB 3.28Å; D697-H701 PolarHBondContact O-N 3.01Å; L698-H701 PolarHBondContact O-N 3.16Å; H701-R703 PolarHBondContact O-N 3.33Å
702	E	44.6	Very low	44.5	Very low	147 Å²	147	117.8 Å²	117.8	69%	0.687	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	-20.3	172.2	-75.2	-169.2	148.5	0	0	113.5	L698	L698-E702 PolarHBondContact O-N 3.37Å
703	R	40.3	Very low	42.9	Very low	168 Å²	168	125.2 Å²	125.2	63%	0.634	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-9.7	-175.3	-76.1	172.2	-175.4	152.8	3.4	115.5	F699 D700 H701	F699-R703 VanDerWaalsContact O-CD 3.25Å; F699-R703 WeakPolarHBondContact O-CD 3.41Å; F699-R703 WeakPolarHBondContact O-CG 3.37Å; D700-R703 PolarHBondContact O-N 3.46Å; D700-R703 IonicContact OD1-CZ 2.89Å; D700-R703 IonicContact OD1-NH1 3.92Å; D700-R703 PolarHBondContact OD1-NH1 3.26Å; H701-R703 PolarHBondContact O-N 3.33Å
704	N	36.4	Very low	41.8	Very low	128 Å²	128	125 Å²	125	68%	0.684	67%	0.666	S	S	*	*			trans	-110.3	23.7	-172.7	-78	-68.3	0	0	0	113.6	D700 P706	D700-N704 PolarHBondContact O-ND2 3.36Å; N704-P706 WeakPolarHBondContact O-CD 3.44Å
705	I	39.5	Very low	40.6	Very low	127 Å²	127	124.1 Å²	124.1	65%	0.651	67%	0.667	S	S	*	*			trans	-92.6	113.5	172.7	-55.7	178.3	0	0	0	108.6
706	P	33.9	Very low	39.2	Very low	118 Å²	118	128.4 Å²	128.4	77%	0.766	68%	0.684	S	S	*	*			trans	-76.3	129.8	176.6	-11.5	28.9	0	0	0	110.8	N704 D708	N704-P706 WeakPolarHBondContact O-CD 3.44Å; P706-D708 PolarHBondContact O-N 3.15Å
707	S	30.2	Very low	38.2	Very low	115 Å²	115	128.9 Å²	128.9	80%	0.804	70%	0.698	S	S	*	*			trans	-93.7	69.8	-179.8	-58.6	0	0	0	0	112.3
708	D	30.8	Very low	37.2	Very low	155 Å²	155	129.7 Å²	129.7	83%	0.829	71%	0.709	S	S	*	*			trans	-163.3	95.1	170.3	-95.8	-39	0	0	0	112.6	P706	P706-D708 PolarHBondContact O-N 3.15Å
709	T	37.1	Very low	35.8	Very low	131 Å²	131	130 Å²	130	80%	0.804	72%	0.719	S	S	*	*			trans	-171.5	163.2	146.9	23.8	0	0	0	0	111.5
710	V	31	Very low	35.1	Very low	137 Å²	137	131.4 Å²	131.4	83%	0.83	74%	0.736	S	S	*	*			trans	-107	129.1	-178.5	174.6	0	0	0	0	111.1
711	A	28.7	Very low	34.4	Very low	95 Å²	95	133 Å²	133	79%	0.785	75%	0.752	S	S	*	*			trans	51.7	67.8	160.1	0	0	0	0	0	117.9
712	D	32.5	Very low	33.8	Very low	139 Å²	139	133 Å²	133	74%	0.743	76%	0.756	S	S	*	*			trans	-76.6	123.9	169	-86.5	-53	0	0	0	113.1
713	Y	26.2	Very low	33.2	Very low	214 Å²	214	134.6 Å²	134.6	84%	0.839	76%	0.764	S	S	*	*			trans	-91.6	109.1	179.4	-175	-84.6	0	0	0	109.7	P715	Y713-P715 VanDerWaalsContact O-CD 3.31Å; Y713-P715 WeakPolarHBondContact O-CD 3.39Å
714	V	33.3	Very low	33.1	Very low	123 Å²	123	134.1 Å²	134.1	75%	0.745	77%	0.772	S	S	*	*			trans	-99.5	108.6	-176.5	-177.2	0	0	0	0	110.9
715	P	29.9	Very low	32.9	Very low	95 Å²	95	132.5 Å²	132.5	62%	0.617	78%	0.777	S	S	*	*			trans	-82	132.3	177.8	32.4	-33.6	0	0	0	111.5	Y713	Y713-P715 VanDerWaalsContact O-CD 3.31Å; Y713-P715 WeakPolarHBondContact O-CD 3.39Å
716	M	32.7	Very low	32.8	Very low	169 Å²	169	135 Å²	135	83%	0.833	79%	0.786	S	S	*	*			trans	-115.7	142.1	163	-68.3	-135.4	-75.6	0	0	110.5
717	S	37	Very low	32.9	Very low	109 Å²	109	134.9 Å²	134.9	76%	0.762	79%	0.787	S	S	*	*			trans	-127	168	-160.1	-59.7	0	0	0	0	111.1
718	P	33.8	Very low	33.3	Very low	116 Å²	116	136.3 Å²	136.3	75%	0.753	79%	0.791	S	S	*	*			cis	-125.4	170.3	-26.3	36.2	-21.7	0	0	0	112.5	V720	P718-V720 PolarHBondContact O-N 2.66Å
719	C	30.3	Very low	33.8	Very low	122 Å²	122	133 Å²	133	82%	0.824	79%	0.785	S	S	*	*			trans	-61.4	130.2	173.1	-62.6	0	0	0	0	113.1	S721	C719-S721 PolarHBondContact O-N 3.42Å
720	V	34.1	Very low	33.9	Very low	136 Å²	136	132 Å²	132	82%	0.824	78%	0.781	S	S	*	*			trans	-83.7	97.2	167.3	178.9	0	0	0	0	109.2	P718 I722	P718-V720 PolarHBondContact O-N 2.66Å; V720-I722 PolarHBondContact O-N 3.02Å; V720-I722 VanDerWaalsContact O-N 3.16Å
721	S	32.7	Very low	34.2	Very low	99 Å²	99	133.1 Å²	133.1	69%	0.692	78%	0.782	S	S	*	*			trans	-69.9	105	178.8	-58.6	0	0	0	0	112.2	C719 Q723	C719-S721 PolarHBondContact O-N 3.42Å; S721-Q723 PolarHBondContact O-N 3.17Å; S721-Q723 VanDerWaalsContact O-N 3.16Å
722	I	35.5	Very low	34.6	Very low	151 Å²	151	133.8 Å²	133.8	77%	0.774	78%	0.781	S	S	*	*			trans	-75.4	99	164.1	-60.3	178.7	0	0	0	107.9	V720 I724	V720-I722 PolarHBondContact O-N 3.02Å; V720-I722 VanDerWaalsContact O-N 3.16Å; I722-I724 PolarHBondContact O-N 3.24Å
723	Q	32.2	Very low	35	Very low	180 Å²	180	132.2 Å²	132.2	84%	0.841	78%	0.778	S	S	*	*			trans	-76.2	105.2	171.5	-71.6	-175	-41	0	0	110.2	S721	S721-Q723 PolarHBondContact O-N 3.17Å; S721-Q723 VanDerWaalsContact O-N 3.16Å
724	I	36.5	Very low	35.5	Very low	157 Å²	157	131 Å²	131	81%	0.805	78%	0.778	S	S	*	*			trans	-82.4	110.8	154.5	-61.8	178.6	0	0	0	106	I722	I722-I724 PolarHBondContact O-N 3.24Å
725	A	32.6	Very low	35.6	Very low	95 Å²	95	129.2 Å²	129.2	79%	0.785	77%	0.771	S	S	*	*			trans	-86.4	116.8	-178.9	0	0	0	0	0	110.5
726	E	36.9	Very low	35.9	Very low	180 Å²	180	131.2 Å²	131.2	84%	0.841	78%	0.776	S	S	*	*			trans	-127.8	87.8	169	-165.4	160.9	-133.4	0	0	108.8	V728	E726-V728 PolarHBondContact O-N 2.77Å
727	S	36.3	Very low	36	Very low	114 Å²	114	132.1 Å²	132.1	80%	0.797	78%	0.778	S	S	*	*			trans	-83.7	104.1	-176.5	55.5	0	0	0	0	111.1	A729	S727-A729 PolarHBondContact O-N 3.06Å
728	V	38.8	Very low	35.9	Very low	145 Å²	145	135.5 Å²	135.5	88%	0.879	78%	0.782	S	S	*	*			trans	-69.9	117.6	170	179.9	0	0	0	0	109.4	E726	E726-V728 PolarHBondContact O-N 2.77Å
729	A	41.7	Very low	36.2	Very low	86 Å²	86	134.5 Å²	134.5	71%	0.711	78%	0.775	S	S	*	*			trans	-110.9	144.7	171.3	0	0	0	0	0	110.1	S727	S727-A729 PolarHBondContact O-N 3.06Å
730	P	38.7	Very low	36.4	Very low	109 Å²	109	133.8 Å²	133.8	71%	0.708	77%	0.772	S	S	*	*			trans	-90.2	162.3	-171.1	36	-37	0	0	0	114.8
731	D	38.8	Very low	36.4	Very low	161 Å²	161	138.3 Å²	138.3	86%	0.861	77%	0.774	S	S	*	*			trans	60.4	114.3	153.3	-57.3	-28.9	0	0	0	121.1
732	S	35.8	Very low	36.6	Very low	110 Å²	110	139 Å²	139	77%	0.769	78%	0.779	S	S	*	*			trans	-71.1	162.6	164.9	70.4	0	0	0	0	112.4
733	P	41.4	Very low	36.6	Very low	105 Å²	105	136.5 Å²	136.5	68%	0.682	78%	0.775	S	S	*	*				-149.6	177.2	86.7	29.6	-7.3	0	0	0	117.1
734	F	36.4	Very low	37.1	Very low	190 Å²	190	134 Å²	134	83%	0.833	77%	0.767	S	S	*	*			trans	109.8	111.4	157.4	-75.2	-78.9	0	0	0	121.4
735	S	36.3	Very low	37.2	Very low	85 Å²	85	135.8 Å²	135.8	59%	0.594	77%	0.765	S	S	*	*			trans	80.8	102.2	132.8	-83.8	0	0	0	0	123.7
736	N	35.6	Very low	37.5	Very low	137 Å²	137	138 Å²	138	73%	0.733	76%	0.763	S	S	*	*				113.3	134.4	111.4	-68.1	-0.8	0	0	0	120.1
737	Q	35.4	Very low	37.6	Very low	187 Å²	187	136.2 Å²	136.2	87%	0.874	76%	0.755	S	S	*	*			trans	78.4	82.8	152.2	-72.8	174.4	-14.1	0	0	121.1
738	E	33.7	Very low	37.6	Very low	181 Å²	181	137.5 Å²	137.5	85%	0.846	75%	0.75	S	S	*	*				-31.9	175.2	124.5	-105.9	-162.4	158.8	0	0	117
739	P	39.9	Very low	37.4	Very low	94 Å²	94	136.1 Å²	136.1	61%	0.61	74%	0.742	S	S	*	*			cis	-141.9	-174.3	-7.6	34.3	-13	0	0	0	116.2
740	S	36	Very low	37.1	Very low	107 Å²	107	137.6 Å²	137.6	75%	0.748	75%	0.746	S	S	*	*			trans	71.8	159	142.5	69.8	0	0	0	0	121
741	R	34.3	Very low	36.8	Very low	232 Å²	232	139.6 Å²	139.6	88%	0.875	75%	0.751	S	S	*	*			cis	-169.5	177.3	-37.7	-150.3	170.5	-170.7	163.7	2.2	108
742	S	36	Very low	37.1	Very low	113 Å²	113	137.1 Å²	137.1	79%	0.79	74%	0.743	S	S	*	*			trans	68.4	137.6	-175.3	70.3	0	0	0	0	114.3
743	S	35.9	Very low	37.1	Very low	99 Å²	99	136.6 Å²	136.6	69%	0.692	74%	0.74	S	S	*	*			cis	79.6	114	19.2	-158.7	0	0	0	0	115.1
744	D	41.5	Very low	36.9	Very low	127 Å²	127	137.8 Å²	137.8	68%	0.679	75%	0.745	S	S	*	*				176.7	145.3	111.7	-92	4.4	0	0	0	116.5
745	Y	38.5	Very low	36.7	Very low	194 Å²	194	133.5 Å²	133.5	76%	0.761	74%	0.739	S	S	*	*			trans	72.5	125.5	144.3	-77.7	-53.4	0	0	0	127.3
746	L	39.7	Very low	36.8	Very low	141 Å²	141	135.8 Å²	135.8	74%	0.738	75%	0.749	S	S	*	*			trans	71.3	161.7	137.5	-76.9	151.3	0	0	0	121.6
747	E	38.5	Very low	36.6	Very low	144 Å²	144	136.3 Å²	136.3	67%	0.673	75%	0.752	S	S	*	*				-169.6	160.2	-73.4	-161.1	179.2	179.7	0	0	108.8
748	M	37.5	Very low	36.6	Very low	141 Å²	141	137.5 Å²	137.5	70%	0.695	76%	0.755	S	S	*	*			trans	64.1	151	160.7	-88.2	180	-89.8	0	0	118.6
749	T	34.4	Very low	36.3	Very low	115 Å²	115	139.7 Å²	139.7	71%	0.706	76%	0.755	S	S	*	*			cis	-165.7	172.7	-30.3	12.5	0	0	0	0	109.1
750	C	35.8	Very low	36.3	Very low	117 Å²	117	144.3 Å²	144.3	79%	0.791	77%	0.771	S	S	*	*			trans	87.2	136.9	159.8	-60.9	0	0	0	0	120.3
751	D	31.9	Very low	36.1	Very low	152 Å²	152	144.6 Å²	144.6	81%	0.813	77%	0.773	S	S	*	*			trans	-87	-166.1	174	-32.9	-106.4	0	0	0	111.3
752	P	45.1	Very low	36.3	Very low	109 Å²	109	138.9 Å²	138.9	71%	0.708	77%	0.768	S	S	*	*			cis	-137.3	179.6	-11.7	36.2	-16.6	0	0	0	116
753	S	35.9	Very low	36.3	Very low	99 Å²	99	137.4 Å²	137.4	69%	0.692	76%	0.763	S	S	*	*			trans	84.2	142.4	140.2	71.5	0	0	0	0	123.6
754	T	36.7	Very low	36.5	Very low	129 Å²	129	139.3 Å²	139.3	79%	0.791	77%	0.766	S	S	*	*			trans	69	113.9	153.3	44.1	0	0	0	0	123.1
755	S	32.6	Very low	36.4	Very low	100 Å²	100	138.8 Å²	138.8	70%	0.699	76%	0.763	S	S	*	*				63.3	117.1	129	-163.4	0	0	0	0	121.3
756	T	37.4	Very low	36.4	Very low	133 Å²	133	136.8 Å²	136.8	82%	0.816	76%	0.761	S	S	*	*				-173.3	155.2	112.1	18.1	0	0	0	0	112.6
757	D	32	Very low	36.3	Very low	148 Å²	148	138 Å²	138	79%	0.791	76%	0.762	S	S	*	*			trans	-74.6	152.5	174.4	-61.1	-87.1	0	0	0	113.5
758	F	34.4	Very low	36.2	Very low	213 Å²	213	136 Å²	136	93%	0.934	76%	0.763	S	S	*	*			trans	-137.8	145.1	152.8	-103.6	-83.9	0	0	0	111.6
759	R	28.9	Very low	36.2	Very low	227 Å²	227	135.9 Å²	135.9	86%	0.857	77%	0.765	S	S	*	*			trans	-145.9	121	-162.7	-177.9	-172.3	-174.8	-167.1	3.6	112.5
760	M	39.7	Very low	36.4	Very low	190 Å²	190	139.2 Å²	139.2	94%	0.936	77%	0.77	S	S	*	*			trans	-141.9	125.2	165.8	-62.3	179.2	74.5	0	0	107.4
761	S	32.4	Very low	36.5	Very low	113 Å²	113	141.6 Å²	141.6	79%	0.79	77%	0.773	S	S	*	*			cis	101.7	72.4	10.5	-159.8	0	0	0	0	117
762	S	36.6	Very low	36.7	Very low	112 Å²	112	137.9 Å²	137.9	78%	0.783	77%	0.771	S	S	*	*			trans	-149.5	124.8	144.4	42.5	0	0	0	0	107.4
763	A	37.6	Very low	36	Very low	83 Å²	83	141.7 Å²	141.7	69%	0.686	78%	0.776	S	S	*	*				77.9	113.7	57.9	0	0	0	0	0	110.4
764	N	38.3	Very low	35.8	Very low	138 Å²	138	144.3 Å²	144.3	74%	0.738	78%	0.782	S	S	*	*			cis	-121.6	-136.4	11.4	-65.9	-19.3	0	0	0	111.2
765	D	40.3	Very low	35.4	Very low	117 Å²	117	145.9 Å²	145.9	63%	0.626	78%	0.78	S	S	*	*			cis	-156.3	-173.9	-1.1	-134.9	-49	0	0	0	114.9
766	Q	37.7	Very low	35.4	Very low	152 Å²	152	149.8 Å²	149.8	71%	0.71	79%	0.785	S	S	*	*			trans	-66.2	160	-173	-69.1	159.8	82.8	0	0	114.7
767	Q	38.3	Very low	35.2	Very low	166 Å²	166	150.3 Å²	150.3	78%	0.776	78%	0.782	S	S	*	*			cis	-154.3	165.1	12.2	-136.9	168.3	21	0	0	114.1
768	C	36.6	Very low	35	Very low	103 Å²	103	152.3 Å²	152.3	70%	0.696	79%	0.785	S	S	*	*			trans	-29.6	162.7	167	-69.6	0	0	0	0	119.8
769	N	37.7	Very low	35.2	Very low	137 Å²	137	148 Å²	148	73%	0.733	78%	0.778	S	S	*	*			cis	-170.8	176.9	0.1	-116.8	-26.9	0	0	0	113.4
770	K	37.5	Very low	35.2	Very low	186 Å²	186	140.7 Å²	140.7	81%	0.809	77%	0.773	S	S	*	*			trans	81.2	121	170	-61.3	174.5	-178.3	174.9	0	115.7
771	I	38.6	Very low	35.1	Very low	166 Å²	166	138.3 Å²	138.3	85%	0.851	77%	0.77	S	S	*	*			cis	85.9	125.6	45.2	-62.9	163.3	0	0	0	111.6
772	G	35.8	Very low	35.1	Very low	74 Å²	74	142.1 Å²	142.1	76%	0.763	77%	0.772	S	S	*	*			cis	-167.8	-170.9	7.2	0	0	0	0	0	117.1
773	K	31.9	Very low	35.1	Very low	190 Å²	190	143.2 Å²	143.2	83%	0.826	77%	0.774	S	S	*	*			trans	-76.2	162.3	-174.9	-60	179.6	174.5	-172.9	0	113.5
774	L	30.9	Very low	34.9	Very low	153 Å²	153	146.1 Å²	146.1	80%	0.801	78%	0.778	S	S	*	*			trans	-156	125.2	142.7	-110.5	160.4	0	0	0	111.6	F776	L774-F776 HydrophobicContact CD2-CD2 3.62Å; L774-F776 HydrophobicContact CD2-CE2 3.65Å
775	E	27.4	Very low	34.8	Very low	163 Å²	163	145 Å²	145	76%	0.762	78%	0.781	S	S	*	*			trans	-105.1	129.5	163.7	-63.6	168.6	95.9	0	0	108.2
776	F	32.9	Very low	34.6	Very low	182 Å²	182	144.1 Å²	144.1	80%	0.798	79%	0.79	S	S	*	*			trans	-153.7	127.7	150.2	-81.3	-79.1	0	0	0	107.1	L774	L774-F776 HydrophobicContact CD2-CD2 3.62Å; L774-F776 HydrophobicContact CD2-CE2 3.65Å
777	N	32.7	Very low	34.4	Very low	143 Å²	143	141.1 Å²	141.1	77%	0.765	79%	0.786	S	S	*	*				75.7	142.1	62.7	-96.6	-41	0	0	0	115.8
778	F	28.9	Very low	34.4	Very low	191 Å²	191	140.1 Å²	140.1	84%	0.838	79%	0.786	S	S	*	*			trans	-66.2	158.8	-172.3	-72.4	-101.1	0	0	0	114.7
779	P	38.6	Very low	34.3	Very low	122 Å²	122	143.7 Å²	143.7	79%	0.792	79%	0.792	S	S	*	*			trans	-104	110.5	138.4	33.4	-24.7	0	0	0	110.6
780	G	29.4	Very low	34.3	Very low	73 Å²	73	141.1 Å²	141.1	75%	0.753	79%	0.79	S	S	*	*			trans	-102.9	121.2	161.9	0	0	0	0	0	109.3
781	T	36.5	Very low	34.3	Very low	141 Å²	141	136.8 Å²	136.8	87%	0.865	78%	0.783	S	S	*	*			trans	-94	118.4	-178.6	39.3	0	0	0	0	112
782	K	32.1	Very low	34.2	Very low	192 Å²	192	135.9 Å²	135.9	84%	0.835	78%	0.779	S	S	*	*			trans	-120.5	133.2	158.8	-78.5	-172.3	174.5	-173	0	108.5
783	T	37.7	Very low	34.2	Very low	135 Å²	135	139.2 Å²	139.2	83%	0.828	77%	0.774	S	S	*	*			trans	-147.3	130.9	164.2	46.1	0	0	0	0	107.8
784	D	33.1	Very low	34.3	Very low	145 Å²	145	135.2 Å²	135.2	78%	0.775	77%	0.769	S	S	*	*			trans	-90.3	-166	-171.2	-54.8	-84.1	0	0	0	113.1
785	S	35.7	Very low	34.5	Very low	115 Å²	115	133.1 Å²	133.1	80%	0.804	76%	0.758	S	S	*	*			trans	70.4	120.4	-172.2	64.5	0	0	0	0	114.3
786	A	35.7	Very low	34.7	Very low	98 Å²	98	133.7 Å²	133.7	81%	0.81	76%	0.758	S	S	*	*				76.1	136.1	60.1	0	0	0	0	0	112
787	S	35.3	Very low	34.6	Very low	89 Å²	89	130.8 Å²	130.8	62%	0.622	76%	0.755	S	S	*	*			cis	-151.6	-177.4	2.3	45	0	0	0	0	111.1
788	D	36.6	Very low	34.7	Very low	145 Å²	145	130.1 Å²	130.1	78%	0.775	76%	0.757	S	S	*	*			trans	68.9	162.6	157.6	-46.7	-45.4	0	0	0	118.6
789	E	35.1	Very low	34.9	Very low	178 Å²	178	125.6 Å²	125.6	83%	0.832	75%	0.749	S	S	*	*				-153.9	169.3	-58	-145.1	-149	171.7	0	0	108.2
790	A	37.4	Very low	34.7	Very low	82 Å²	82	124.5 Å²	124.5	68%	0.678	74%	0.743	S	S	*	*			trans	63.5	152.1	164.2	0	0	0	0	0	117.8
791	S	38	Very low	35	Very low	96 Å²	96	127 Å²	127	67%	0.671	73%	0.73	S	S	*	*			cis	-158.2	155.5	-13.3	-115.4	0	0	0	0	111.7
792	L	36.1	Very low	35.1	Very low	146 Å²	146	125.4 Å²	125.4	76%	0.764	71%	0.711	S	S	*	*			trans	32.4	132.2	136.6	-52.5	169.4	0	0	0	118.6
793	H	36.9	Very low	35.4	Very low	144 Å²	144	123.3 Å²	123.3	67%	0.667	70%	0.702	S	S	*	*			cis	-158	-161.9	16	-140.5	-179.3	0	0	0	109
794	C	33.1	Very low	35.3	Very low	106 Å²	106	122.5 Å²	122.5	72%	0.716	70%	0.697	S	S	*	*			cis	-150.9	-167.8	20.9	-150.6	0	0	0	0	114.5
795	L	34.9	Very low	35.4	Very low	110 Å²	110	118.7 Å²	118.7	58%	0.576	69%	0.693	S	S	*	*			trans	-85.9	145.6	-171.6	-65	173.7	0	0	0	112.5
796	K	31.2	Very low	35.5	Very low	175 Å²	175	120.2 Å²	120.2	76%	0.761	70%	0.697	S	S	*	*				67.4	145.8	60.6	-65	-173.1	-167.5	167	0	112.5
797	T	30.7	Very low	35.4	Very low	120 Å²	120	120.5 Å²	120.5	74%	0.736	69%	0.693	S	S	*	*			cis	-170.2	166.3	9.2	6.2	0	0	0	0	113.1
798	V	34.8	Very low	35.3	Very low	130 Å²	130	125.7 Å²	125.7	79%	0.788	70%	0.699	S	S	*	*			trans	67.7	133.8	148.7	167.7	0	0	0	0	118.4
799	S	33.9	Very low	35.2	Very low	96 Å²	96	127 Å²	127	67%	0.671	69%	0.693	S	S	*	*			cis	109.7	143.9	9.1	-173.7	0	0	0	0	116.3
800	S	35	Very low	35.3	Very low	98 Å²	98	125.6 Å²	125.6	69%	0.685	69%	0.686	S	S	*	*			trans	79	147.7	160.7	-64.6	0	0	0	0	118.6
801	R	35.9	Very low	35	Very low	127 Å²	127	126.8 Å²	126.8	48%	0.479	69%	0.685	S	S	.	*			cis	-173.5	149.3	-5.4	-114.2	-178.8	176.8	-160.8	5.3	112.6	L574 R575	L574-R801 PolarHBondContact O-NH1 3.2Å; R575-R801 PolarHBondContact O-NH1 2.94Å
802	K	37.2	Very low	34.8	Very low	106 Å²	106	128.4 Å²	128.4	46%	0.461	69%	0.691	S	S	.	*			trans	65.1	168.1	140.3	-72.5	-170.6	-179.9	178.9	0	119.4	F572 L574	F572-K802 CarbonylContact C-O 3.14Å; F572-K802 CarbonylContact O-C 3.55Å; L574-K802 PolarHBondContact O-NZ 3.46Å
803	K	38.1	Very low	34.8	Very low	148 Å²	148	126.4 Å²	126.4	64%	0.643	69%	0.689	S	S	*	*			cis	-152.5	144.5	-20.3	-127.4	-165	161.8	-156.2	0	114	F572	F572-K803 PolarHBondContact O-N 3.38Å; F572-K803 VanDerWaalsContact O-N 3.16Å
804	T	37.3	Very low	34.5	Very low	118 Å²	118	126.7 Å²	126.7	72%	0.724	70%	0.696	S	S	*	*			trans	19	138.4	140.8	59	0	0	0	0	124.3
805	G	35.5	Very low	34.9	Very low	66 Å²	66	126.9 Å²	126.9	68%	0.68	70%	0.696	S	S	*	*			trans	152.4	154.9	141.3	0	0	0	0	0	112
806	T	37	Very low	34.5	Very low	146 Å²	146	127.6 Å²	127.6	90%	0.896	71%	0.708	S	S	*	*			cis	-179.3	150.7	-12.2	16.9	0	0	0	0	106.3
807	S	32.8	Very low	34.5	Very low	104 Å²	104	125.4 Å²	125.4	73%	0.727	72%	0.715	S	S	*	*			cis	-171.5	-176.3	-7.9	-170.3	0	0	0	0	108.5
808	R	33.7	Very low	34.7	Very low	198 Å²	198	125.1 Å²	125.1	75%	0.747	72%	0.718	S	S	*	*			trans	75.9	150.6	169.6	-62.4	-175.6	168.8	167.2	-1.8	116.2
809	R	34.7	Very low	34.6	Very low	173 Å²	173	124.4 Å²	124.4	65%	0.653	72%	0.719	S	S	*	*			cis	-162.3	157.5	-3.7	-118.5	175.8	172	165.6	-2	111.3
810	H	37.4	Very low	34.6	Very low	149 Å²	149	126.2 Å²	126.2	69%	0.69	73%	0.726	S	S	*	*			trans	33.9	153.1	143.9	-57	-39.5	0	0	0	122.4
811	T	31.3	Very low	34.7	Very low	106 Å²	106	130.1 Å²	130.1	65%	0.65	73%	0.733	S	S	*	*			cis	-175.1	156.4	-12.6	28.1	0	0	0	0	107.3
812	T	32.7	Very low	34.7	Very low	130 Å²	130	132.1 Å²	132.1	80%	0.798	75%	0.748	S	S	*	*			trans	59.3	150.8	154.9	47	0	0	0	0	118.3
813	S	36.4	Very low	34.7	Very low	104 Å²	104	132.5 Å²	132.5	73%	0.727	76%	0.759	S	S	*	*			cis	-164.1	162.9	-8.1	42.3	0	0	0	0	108.9
814	D	31.6	Very low	34.8	Very low	150 Å²	150	134.2 Å²	134.2	80%	0.802	77%	0.77	S	S	*	*			trans	-73.6	-177.2	170.2	-33	-98.2	0	0	0	111.8
815	P	40.1	Very low	34.6	Very low	111 Å²	111	136.7 Å²	136.7	72%	0.721	78%	0.775	S	S	*	*			cis	-137	176.2	-13.8	32.4	-11.4	0	0	0	116.1
816	C	28.2	Very low	34.7	Very low	124 Å²	124	141.8 Å²	141.8	84%	0.838	78%	0.779	S	S	*	*			trans	67.9	160.4	145.5	-78	0	0	0	0	124.4
817	S	30.7	Very low	34.5	Very low	129 Å²	129	145.8 Å²	145.8	90%	0.902	78%	0.777	S	S	*	*			trans	91.6	160.1	162.3	79.1	0	0	0	0	119.8
818	S	34.7	Very low	34.6	Very low	114 Å²	114	150.2 Å²	150.2	80%	0.797	79%	0.789	S	S	*	*			trans	-133.5	145.7	-148.4	55.1	0	0	0	0	115
819	S	31.8	Very low	34.6	Very low	116 Å²	116	150.4 Å²	150.4	81%	0.811	80%	0.795	S	S	*	*			trans	-179	131.5	147.5	36	0	0	0	0	109.8
820	V	34	Very low	34.3	Very low	133 Å²	133	153.8 Å²	153.8	81%	0.806	81%	0.808	S	S	*	*				78.6	111.6	76.3	176	0	0	0	0	114.9
821	E	37.5	Very low	34	Very low	181 Å²	181	152.8 Å²	152.8	85%	0.846	81%	0.808	S	S	*	*			trans	171.8	119.6	142.5	-95.8	-178.5	158.8	0	0	105.1
822	E	35.5	Very low	34.1	Very low	169 Å²	169	153.9 Å²	153.9	79%	0.79	82%	0.816	S	S	*	*				61.2	121.2	60.6	-159.1	159.5	-168.1	0	0	111.7
823	T	38.4	Very low	34	Very low	114 Å²	114	154.5 Å²	154.5	70%	0.699	82%	0.815	S	S	*	*				-169.2	160.8	73.2	-39.7	0	0	0	0	113.1
824	Q	39.1	Very low	33.8	Very low	184 Å²	184	155.7 Å²	155.7	86%	0.86	82%	0.818	S	S	*	*			trans	108.8	113	152.7	-56.3	-159	21.4	0	0	120.1
825	M	34.5	Very low	33.6	Very low	169 Å²	169	153.3 Å²	153.3	83%	0.833	82%	0.819	S	S	*	*			trans	-57.6	173.8	166.2	-57.1	-177.9	174.1	0	0	112.8
826	K	36.7	Very low	33.3	Very low	174 Å²	174	153.4 Å²	153.4	76%	0.757	82%	0.817	S	S	*	*				-172.3	137.7	50.4	-142.5	160	-167.6	167.6	0	114.9
827	R	32	Very low	33.4	Very low	230 Å²	230	156.4 Å²	156.4	87%	0.868	82%	0.819	S	S	*	*			trans	34.3	116.3	152.3	-70.8	179.7	167.5	176.6	-4.5	119.6
828	M	35.8	Very low	33.4	Very low	196 Å²	196	159.7 Å²	159.7	97%	0.966	81%	0.813	S	S	*	*				-161.3	143.7	102.1	-112.2	-176.5	175.9	0	0	112.3
829	K	32.6	Very low	33.3	Very low	203 Å²	203	159.3 Å²	159.3	88%	0.883	81%	0.808	S	S	*	*			trans	-109.7	138.8	172.6	-81	-174.3	173.1	-175.8	0	109.7
830	R	30.3	Very low	33.3	Very low	243 Å²	243	162 Å²	162	92%	0.917	81%	0.812	S	S	*	*			trans	-172.3	141.8	135.2	-108.1	162.1	179.4	166.3	-0.4	113.9
831	N	30.8	Very low	33.2	Very low	129 Å²	129	159.9 Å²	159.9	69%	0.69	80%	0.803	S	S	*	*			trans	46.5	106.5	162.4	-66.8	12.9	0	0	0	121.1
832	P	33.4	Very low	33	Very low	128 Å²	128	159.8 Å²	159.8	83%	0.831	80%	0.803	S	S	*	*			trans	-94.8	88.2	143.3	34.5	-23.9	0	0	0	109.5
833	N	30.2	Very low	33	Very low	143 Å²	143	156 Å²	156	77%	0.765	79%	0.794	S	S	*	*			trans	-136	64.9	179.6	-117.7	11.4	0	0	0	110.8
834	T	31.3	Very low	32.9	Very low	130 Å²	130	153.6 Å²	153.6	80%	0.798	78%	0.782	S	S	*	*			trans	-146	61.7	-179.5	-15.4	0	0	0	0	110.8	V836	T834-V836 PolarHBondContact O-N 3.43Å
835	A	29	Very low	32.8	Very low	99 Å²	99	148.5 Å²	148.5	82%	0.818	77%	0.767	S	S	*	*			trans	-67.3	114.1	171.6	0	0	0	0	0	109.7	Q837	A835-Q837 PolarHBondContact O-N 2.94Å; A835-Q837 VanDerWaalsContact O-N 3.17Å
836	V	33.2	Very low	32.9	Very low	114 Å²	114	144.5 Å²	144.5	69%	0.691	76%	0.755	S	S	*	*			trans	-72.4	107.8	177.3	177.7	0	0	0	0	108.9	T834 Y838	T834-V836 PolarHBondContact O-N 3.43Å; V836-Y838 HydrophobicContact CG1-CE2 4.36Å; V836-Y838 PolarHBondContact O-N 3.07Å
837	Q	30.7	Very low	33.2	Very low	186 Å²	186	140.5 Å²	140.5	87%	0.869	74%	0.741	S	S	*	*			trans	-69.7	117.8	175.3	-67.6	-179.6	-61.2	0	0	110.4	A835	A835-Q837 PolarHBondContact O-N 2.94Å; A835-Q837 VanDerWaalsContact O-N 3.17Å
838	Y	30.4	Very low	33.6	Very low	198 Å²	198	135.8 Å²	135.8	78%	0.776	73%	0.729	S	S	*	*			trans	-85.7	138.2	160.1	-75.4	-89.9	0	0	0	109.5	V836 L840	V836-Y838 HydrophobicContact CG1-CE2 4.36Å; V836-Y838 PolarHBondContact O-N 3.07Å; Y838-L840 PolarHBondContact O-N 3.2Å
839	P	32.3	Very low	33.7	Very low	107 Å²	107	132.3 Å²	132.3	70%	0.695	71%	0.713	S	S	*	*			trans	-75.5	110.6	-173.9	29.4	-34.6	0	0	0	111.9	S841	P839-S841 PolarHBondContact O-N 3.25Å
840	L	31.6	Very low	34	Very low	173 Å²	173	129 Å²	129	91%	0.906	71%	0.705	S	S	*	*			trans	-76	61.2	169.2	-70.8	172.4	0	0	0	111.1	Y838	Y838-L840 PolarHBondContact O-N 3.2Å
841	S	31.2	Very low	34.5	Very low	87 Å²	87	125.2 Å²	125.2	61%	0.608	70%	0.695	S	S	*	*			trans	-115.3	13.9	-168.4	62.6	0	0	0	0	116.4	P839	P839-S841 PolarHBondContact O-N 3.25Å
842	E	34.5	Very low	35	Very low	180 Å²	180	127.5 Å²	127.5	84%	0.841	70%	0.699	S	S	*	*	S	Bend	trans	-124.4	-15.3	175	-82.8	178.2	-172.6	0	0	115.2	S844	E842-S844 PolarHBondContact O-N 3.03Å
843	C	34.7	Very low	35.3	Very low	88 Å²	88	128.9 Å²	128.9	60%	0.595	70%	0.698	S	S	*	*	S	Bend	trans	-84.8	-3	-176.9	-61	0	0	0	0	115.2
844	S	36.5	Very low	35.5	Very low	64 Å²	64	125.3 Å²	125.3	45%	0.448	70%	0.695	S	S	.	*	H	α-helix	trans	-71.4	-36.3	-171.4	53.5	0	0	0	0	113.9	E842 I847 Q848	E842-S844 PolarHBondContact O-N 3.03Å; S844-I847 PolarHBondContact O-N 3.44Å; S844-Q848 WeakPolarHBondContact O-CG 3.44Å; S844-Q848 PolarHBondContact O-N 2.86Å
845	S	36.2	Very low	35.5	Very low	78 Å²	78	130.2 Å²	130.2	55%	0.545	70%	0.699	S	S	.	*	H	α-helix	trans	-65.6	-42.3	-174.2	-58.7	0	0	0	0	113.6	Q848 L849	S845-Q848 PolarHBondContact O-N 3.31Å; S845-L849 PolarHBondContact O-N 3.13Å
846	S	37.1	Very low	35.8	Very low	84 Å²	84	137.6 Å²	137.6	59%	0.587	71%	0.705	S	S	*	*	H	α-helix	trans	-69.2	-36.7	179.9	-56	0	0	0	0	112.3	L849 L850	S846-L849 PolarHBondContact O-N 3.06Å; S846-L850 PolarHBondContact O-N 3.29Å
847	I	42.9	Very low	35.7	Very low	91 Å²	91	137 Å²	137	47%	0.467	71%	0.707	S	S	.	*	H	α-helix	trans	-71.8	-33.1	176.9	-61.6	174.7	0	0	0	110.8	S844 L849 L850 K851	S844-I847 PolarHBondContact O-N 3.44Å; I847-L849 VanDerWaalsContact C-N 3.34Å; I847-L850 PolarHBondContact O-N 3.48Å; I847-K851 HydrophobicContact CG2-CD 4.2Å; I847-K851 HydrophobicContact CG2-CG 4.47Å; I847-K851 WeakPolarHBondContact O-CB 3.23Å; I847-K851 WeakPolarHBondContact O-CG 3.47Å; I847-K851 PolarHBondContact O-N 3.34Å
848	Q	40.2	Very low	35.8	Very low	131 Å²	131	140.4 Å²	140.4	61%	0.612	71%	0.712	S	S	*	*	H	α-helix	trans	-68	-29	173.5	-76.8	-176.8	9.3	0	0	113.6	S844 S845 K852	S844-Q848 WeakPolarHBondContact O-CG 3.44Å; S844-Q848 PolarHBondContact O-N 2.86Å; S845-Q848 PolarHBondContact O-N 3.31Å; Q848-K852 PolarHBondContact O-N 3.19Å
849	L	37.4	Very low	35.7	Very low	122 Å²	122	139.6 Å²	139.6	64%	0.639	72%	0.715	S	S	*	*	H	α-helix	trans	-68.7	-47.3	172.7	-88.8	161.6	0	0	0	111.8	S845 S846 I847 K851 K852	S845-L849 PolarHBondContact O-N 3.13Å; S846-L849 PolarHBondContact O-N 3.06Å; I847-L849 VanDerWaalsContact C-N 3.34Å; L849-K851 PolarHBondContact O-N 2.79Å; L849-K852 WeakPolarHBondContact O-CB 3.28Å; L849-K852 PolarHBondContact O-N 2.77Å
850	L	39.4	Very low	35.7	Very low	135 Å²	135	137.3 Å²	137.3	71%	0.707	71%	0.71	S	S	*	*	H	α-helix	trans	-62.7	-41.2	175.6	-74.7	163.8	0	0	0	112	S846 I847 K852 L853	S846-L850 PolarHBondContact O-N 3.29Å; I847-L850 PolarHBondContact O-N 3.48Å; L850-K852 PolarHBondContact O-N 2.97Å; L850-K852 VanDerWaalsContact O-N 3.13Å; L850-L853 PolarHBondContact O-N 3.48Å
851	K	41.3	Very low	35.7	Very low	162 Å²	162	135.5 Å²	135.5	70%	0.704	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-6.2	173.8	-72.8	-174.8	176.2	-174.8	0	114.6	I847 L849	I847-K851 HydrophobicContact CG2-CD 4.2Å; I847-K851 HydrophobicContact CG2-CG 4.47Å; I847-K851 WeakPolarHBondContact O-CB 3.23Å; I847-K851 WeakPolarHBondContact O-CG 3.47Å; I847-K851 PolarHBondContact O-N 3.34Å; L849-K851 PolarHBondContact O-N 2.79Å
852	K	41.2	Very low	35.5	Very low	178 Å²	178	137 Å²	137	77%	0.774	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-12.5	176.7	-118.8	176.4	-179.8	176.5	0	114.7	Q848 L849 L850	Q848-K852 PolarHBondContact O-N 3.19Å; L849-K852 WeakPolarHBondContact O-CB 3.28Å; L849-K852 PolarHBondContact O-N 2.77Å; L850-K852 PolarHBondContact O-N 2.97Å; L850-K852 VanDerWaalsContact O-N 3.13Å
853	L	39.9	Very low	35.5	Very low	157 Å²	157	134.9 Å²	134.9	82%	0.822	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-15.9	-177.4	-65.8	172.4	0	0	0	113.7	L850 R855	L850-L853 PolarHBondContact O-N 3.48Å; L853-R855 PolarHBondContact O-N 3.47Å
854	G	34.4	Very low	35.2	Very low	67 Å²	67	137.9 Å²	137.9	69%	0.691	72%	0.72	S	S	*	*			trans	-96.4	37.2	-175	0	0	0	0	0	116.7
855	R	31.6	Very low	34.9	Very low	234 Å²	234	144.1 Å²	144.1	88%	0.883	74%	0.742	S	S	*	*			trans	-115.4	78.6	175.7	-82.5	-163.3	174.8	-149.5	-1.3	113.1	L853	L853-R855 PolarHBondContact O-N 3.47Å
856	R	34.7	Very low	34.6	Very low	253 Å²	253	146 Å²	146	96%	0.955	75%	0.75	S	S	*	*			trans	-133.6	152.3	148.3	-71.4	-166.7	-178.9	-119.5	0.5	108.8
857	S	30.7	Very low	34.3	Very low	102 Å²	102	149.4 Å²	149.4	71%	0.713	76%	0.762	S	S	*	*			trans	-99.1	139.7	-157.6	50	0	0	0	0	114.1
858	W	32.7	Very low	33.6	Very low	258 Å²	258	153 Å²	153	98%	0.977	78%	0.776	S	S	*	*			trans	-126.3	148.4	145.6	-77.4	92.9	0	0	0	108.3
859	H	28.5	Very low	33.1	Very low	181 Å²	181	153.3 Å²	153.3	84%	0.838	79%	0.787	S	S	*	*			trans	-148.8	148.9	-171.4	-132.7	-74.8	0	0	0	107.9
860	G	32.3	Very low	32.6	Very low	58 Å²	58	153.8 Å²	153.8	60%	0.598	80%	0.795	S	S	*	*			trans	127.9	70.8	-166.5	0	0	0	0	0	108.9
861	D	33.1	Very low	32.2	Very low	135 Å²	135	154 Å²	154	72%	0.722	80%	0.802	S	S	*	*				79.9	98.3	92.4	-63.7	-29.1	0	0	0	110.1
862	C	27.3	Very low	31.5	Very low	119 Å²	119	155.5 Å²	155.5	80%	0.804	80%	0.803	S	S	*	*				73.3	131.4	92.2	-68.2	0	0	0	0	112.1
863	V	32.8	Very low	31.1	Very low	136 Å²	136	154.5 Å²	154.5	82%	0.824	81%	0.806	S	S	*	*			cis	-140.9	147.5	31.5	176.2	0	0	0	0	111.4
864	D	28.1	Very low	30.5	Very low	151 Å²	151	153.6 Å²	153.6	81%	0.807	80%	0.802	S	S	*	*			trans	-77.7	132.3	166.8	-61.5	-84.3	0	0	0	112
865	E	30.6	Very low	30.3	Very low	194 Å²	194	156.8 Å²	156.8	91%	0.907	81%	0.812	S	S	*	*			trans	-132.5	123.2	152.7	-168.8	158	-139.3	0	0	109.2
866	V	29.6	Very low	30.1	Very low	118 Å²	118	151.6 Å²	151.6	72%	0.715	81%	0.806	S	S	*	*			trans	-108.7	119.3	-175.9	174.7	0	0	0	0	108.4
867	D	32.1	Very low	29.9	Very low	156 Å²	156	148.9 Å²	148.9	83%	0.834	80%	0.802	S	S	*	*			trans	-132.4	148.5	161.8	-152.2	-8.6	0	0	0	111.3
868	Q	27.4	Very low	29.8	Very low	166 Å²	166	151 Å²	151	78%	0.776	81%	0.805	S	S	*	*			trans	-110.9	103.2	-165	-67.2	-177.5	-3.8	0	0	111.7
869	T	29.8	Very low	29.9	Very low	137 Å²	137	147.8 Å²	147.8	84%	0.84	80%	0.801	S	S	*	*			trans	-122.4	116	164.3	49.5	0	0	0	0	110.6
870	V	26.8	Very low	29.9	Very low	132 Å²	132	143.2 Å²	143.2	80%	0.8	80%	0.795	S	S	*	*			trans	-104.4	114.1	177.1	176.6	0	0	0	0	108.5
871	V	31.2	Very low	29.8	Very low	140 Å²	140	146.3 Å²	146.3	85%	0.848	80%	0.802	S	S	*	*			trans	-131.3	117	162.5	-176.4	0	0	0	0	107.6
872	R	27.6	Very low	29.8	Very low	193 Å²	193	148.4 Å²	148.4	73%	0.728	81%	0.81	S	S	*	*			trans	-92.6	157.7	164.2	-77	-177.3	162.1	134.3	-5.2	108.4
873	D	31.7	Very low	29.9	Very low	157 Å²	157	150.4 Å²	150.4	84%	0.84	81%	0.812	S	S	*	*				-167.7	145.2	102.1	-89.7	-20.8	0	0	0	112.1
874	D	26.7	Very low	29.9	Very low	139 Å²	139	152.1 Å²	152.1	74%	0.743	81%	0.812	S	S	*	*			trans	-88	148.8	-179.9	-63.4	-74.3	0	0	0	111
875	C	30.1	Very low	30.1	Very low	134 Å²	134	151.6 Å²	151.6	91%	0.905	81%	0.81	S	S	*	*			trans	-125.4	100	168.2	-89.6	0	0	0	0	111.1
876	V	27.4	Very low	30.1	Very low	125 Å²	125	147.3 Å²	147.3	76%	0.758	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-96.9	122	168.7	174.9	0	0	0	0	108.8
877	F	31.4	Very low	30.1	Very low	196 Å²	196	145 Å²	145	86%	0.86	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-94.1	121	170.5	-118.4	-88.1	0	0	0	111
878	N	29.2	Very low	29.9	Very low	145 Å²	145	145.1 Å²	145.1	78%	0.775	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-101.8	141.8	158.1	-81.9	-61.1	0	0	0	107.7
879	E	33.7	Very low	30.2	Very low	191 Å²	191	143.8 Å²	143.8	89%	0.893	81%	0.811	S	S	*	*			trans	-141.5	140.6	144.3	-158.4	169.4	-148.4	0	0	110.7
880	A	28.9	Very low	30.2	Very low	86 Å²	86	146.7 Å²	146.7	71%	0.711	81%	0.812	S	S	*	*			trans	-138.9	146.5	171.4	0	0	0	0	0	107.4
881	T	31.2	Very low	30.2	Very low	122 Å²	122	145.6 Å²	145.6	75%	0.748	82%	0.817	S	S	*	*			trans	178.5	123	141.7	-78.7	0	0	0	0	110
882	M	32.7	Very low	30.1	Very low	180 Å²	180	142.8 Å²	142.8	89%	0.887	81%	0.808	S	S	*	*				180	125.4	123.2	-97.2	-57.4	162.8	0	0	110.5
883	L	28.4	Very low	30	Very low	161 Å²	161	139.1 Å²	139.1	84%	0.843	81%	0.813	S	S	*	*			trans	-106.2	137.6	176.2	-83.5	164.5	0	0	0	110.2
884	M	34	Very low	29.9	Very low	171 Å²	171	136.8 Å²	136.8	84%	0.842	81%	0.807	S	S	*	*			trans	-148.9	111.7	152.7	-92.6	-54.4	171.6	0	0	113.7
885	N	32	Very low	29.9	Very low	140 Å²	140	138 Å²	138	75%	0.749	80%	0.802	S	S	*	*			trans	43	107.9	144.1	-68.7	-28.2	0	0	0	123
886	A	30.3	Very low	30.2	Very low	105 Å²	105	136.3 Å²	136.3	87%	0.868	79%	0.787	S	S	*	*				52.6	121.8	116	0	0	0	0	0	121.3
887	G	29.9	Very low	30.3	Very low	68 Å²	68	137.9 Å²	137.9	70%	0.701	79%	0.786	S	S	*	*			trans	-161.4	19.8	179.3	0	0	0	0	0	119.6	T889	G887-T889 PolarHBondContact O-N 2.89Å
888	N	27.6	Very low	30.3	Very low	160 Å²	160	129.8 Å²	129.8	86%	0.856	76%	0.758	S	S	*	*			trans	19.5	86.9	165.5	-177.7	27.8	0	0	0	118.8
889	T	33.6	Very low	30.7	Very low	137 Å²	137	124.8 Å²	124.8	84%	0.84	73%	0.731	S	S	*	*			trans	-131.9	142.5	163.2	47.5	0	0	0	0	112.8	G887	G887-T889 PolarHBondContact O-N 2.89Å
890	K	30.6	Very low	30.8	Very low	199 Å²	199	116.4 Å²	116.4	87%	0.865	69%	0.692	S	S	*	*			trans	-67.2	144.7	-168.5	-62.8	166.8	-178.5	170.5	0	113	A892	K890-A892 PolarHBondContact O-N 3.27Å
891	A	26.3	Very low	31.2	Very low	109 Å²	109	112.6 Å²	112.6	90%	0.901	66%	0.659	S	S	*	*			trans	-59.1	121.4	166.7	0	0	0	0	0	111
892	A	28.5	Very low	31.3	Very low	80 Å²	80	109.6 Å²	109.6	66%	0.661	64%	0.636	S	S	*	*			trans	-108.3	124.2	171.2	0	0	0	0	0	108.8	K890 C894	K890-A892 PolarHBondContact O-N 3.27Å; A892-C894 PolarHBondContact O-N 3.16Å
893	S	26.5	Very low	31.8	Very low	117 Å²	117	101 Å²	101	82%	0.818	59%	0.594	S	S	*	*			trans	-75.8	90.3	176.3	-179.7	0	0	0	0	109.6	R895	S893-R895 PolarHBondContact O-N 3.16Å
894	C	29.3	Very low	32.2	Very low	108 Å²	108	95.6 Å²	95.6	73%	0.73	57%	0.569	S	S	*	*			trans	-69.8	107.8	172.8	-62.9	0	0	0	0	109.5	A892	A892-C894 PolarHBondContact O-N 3.16Å
895	R	27.2	Very low	32.4	Very low	165 Å²	165	91.1 Å²	91.1	62%	0.623	55%	0.553	S	S	*	*			trans	-86.9	124.9	155.5	-68.6	177.7	-177.4	160	4.4	107.2	F136 S893	F136-R895 HydrophobicContact CE2-CG 4.39Å; F136-R895 VanDerWaalsContact CE2-NE 3.34Å; F136-R895 HydrophobicContact CZ-CG 4.19Å; F136-R895 VanDerWaalsContact CZ-NE 3.35Å; S893-R895 PolarHBondContact O-N 3.16Å
896	T	35.9	Very low	32.7	Very low	97 Å²	97	88.1 Å²	88.1	60%	0.595	54%	0.541	S	S	*	.			trans	-104.8	100.4	178.2	29.6	0	0	0	0	109
897	E	29.5	Very low	33	Very low	158 Å²	158	88.6 Å²	88.6	74%	0.738	54%	0.535	S	S	*	.			trans	-74.2	150.9	161.9	-68.2	162.6	172.8	0	0	108.5	E195 D899	E195-E897 VanDerWaalsContact OE1-CA 3.27Å; E195-E897 WeakPolarHBondContact OE1-CA 3.44Å; E897-D899 PolarHBondContact O-N 3.42Å
898	G	32.2	Very low	33.2	Very low	27 Å²	27	90.7 Å²	90.7	28%	0.278	54%	0.536	S	S	.	.			trans	-64.4	119.9	-164.4	0	0	0	0	0	116.9	E195	E195-G898 PolarHBondContact OE1-N 3.31Å
899	D	36.5	Very low	33.7	Very low	39 Å²	39	88.9 Å²	88.9	21%	0.209	54%	0.536	C	S	.	.			trans	-110.7	121.2	173.3	-77.7	-49.4	0	0	0	112.4	M1 R3 E897	M1-D899 PolarHBondContact N-OD2 3.4Å; R3-D899 WeakPolarHBondContact CG-OD1 3.31Å; E897-D899 PolarHBondContact O-N 3.42Å
900	Y	36.4	Very low	33.4	Very low	16 Å²	16	90.9 Å²	90.9	6%	0.063	55%	0.553	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.3	148.3	179.4	-57.8	-93.4	0	0	0	113.2	S54 C64 L75	S54-Y900 WeakPolarHBondContact OG-CE2 3.21Å; S54-Y900 PolarHBondContact OG-OH 3.49Å; S54-Y900 VanDerWaalsContact OG-OH 3.07Å; C64-Y900 HydrophobicContact CB-CD1 3.45Å; C64-Y900 VanDerWaalsContact CB-CD1 3.45Å; C64-Y900 HydrophobicContact CB-CE1 3.44Å; C64-Y900 VanDerWaalsContact CB-CE1 3.44Å; C64-Y900 WeakPolarHBondContact SG-CD1 3.25Å; C64-Y900 VanDerWaalsContact SG-CE1 3.51Å; L75-Y900 HydrophobicContact CB-CD1 3.64Å; L75-Y900 HydrophobicContact CB-CE1 3.81Å; L75-Y900 HydrophobicContact CB-CG 4.2Å; L75-Y900 HydrophobicContact CD1-CD1 4.42Å; L75-Y900 HydrophobicContact CD1-CE1 3.99Å; L75-Y900 HydrophobicContact CD1-CE2 4.11Å; L75-Y900 HydrophobicContact CD2-CD1 4.45Å; L75-Y900 HydrophobicContact CD2-CE1 3.75Å; L75-Y900 HydrophobicContact CG-CD1 4.39Å; L75-Y900 HydrophobicContact CG-CE1 4.06Å
901	V	36.5	Very low	33.6	Very low	5 Å²	5	85.5 Å²	85.5	3%	0.03	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	130.6	-178.7	174	0	0	0	0	113.9	R5 R7 F9 G77	R5-V901 WeakPolarHBondContact O-CG1 3.41Å; R7-V901 HydrophobicContact CB-CG1 3.7Å; R7-V901 HydrophobicContact CG-CG1 3.57Å; F9-V901 HydrophobicContact CE2-CB 4.48Å; F9-V901 HydrophobicContact CE2-CG1 3.97Å; F9-V901 HydrophobicContact CZ-CB 4.33Å; F9-V901 HydrophobicContact CZ-CG1 4.15Å; G77-V901 WeakPolarHBondContact CA-O 3.4Å; G77-V901 PolarHBondContact N-O 3.33Å; G77-V901 VanDerWaalsContact O-O 3.11Å
902	F	34	Very low	33.9	Very low	60 Å²	60	84.2 Å²	84.2	26%	0.263	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-44.4	131.9	170.6	-67.8	-75.4	0	0	0	115.2	K6 F61 G77 E79	K6-F902 HydrophobicContact CB-CB 3.99Å; K6-F902 HydrophobicContact CB-CD2 4.06Å; K6-F902 HydrophobicContact CB-CG 4.39Å; K6-F902 HydrophobicContact CD-CB 3.65Å; K6-F902 HydrophobicContact CD-CD2 4.45Å; K6-F902 HydrophobicContact CD-CG 4.1Å; K6-F902 HydrophobicContact CG-CB 3.64Å; K6-F902 HydrophobicContact CG-CG 4.38Å; F61-F902 HydrophobicContact CD1-CE1 4.34Å; F61-F902 HydrophobicContact CD1-CZ 4.49Å; F61-F902 AromaticContact CE1-CD1 3.69Å; F61-F902 HydrophobicContact CE1-CD1 3.69Å; F61-F902 AromaticContact CE1-CD2 3.7Å; F61-F902 HydrophobicContact CE1-CD2 3.7Å; F61-F902 AromaticContact CE1-CE1 3.57Å; F61-F902 HydrophobicContact CE1-CE1 3.57Å; F61-F902 AromaticContact CE1-CE2 3.58Å; F61-F902 HydrophobicContact CE1-CE2 3.58Å; F61-F902 AromaticContact CE1-CG 3.75Å; F61-F902 HydrophobicContact CE1-CG 3.75Å; F61-F902 AromaticContact CE1-CZ 3.52Å; F61-F902 HydrophobicContact CE1-CZ 3.52Å; F61-F902 AromaticContact CZ-CD2 3.71Å; F61-F902 HydrophobicContact CZ-CD2 3.71Å; F61-F902 HydrophobicContact CZ-CE1 4.35Å; F61-F902 AromaticContact CZ-CE2 3.51Å; F61-F902 HydrophobicContact CZ-CE2 3.51Å; F61-F902 HydrophobicContact CZ-CG 4.22Å; F61-F902 AromaticContact CZ-CZ 3.86Å; F61-F902 HydrophobicContact CZ-CZ 3.86Å; G77-F902 CarbonylContact O-C 3.57Å; G77-F902 WeakPolarHBondContact O-CA 3.42Å; E79-F902 HydrophobicContact CG-CD1 3.49Å; E79-F902 VanDerWaalsContact CG-CD1 3.49Å; E79-F902 HydrophobicContact CG-CE1 3.73Å; E79-F902 WeakPolarHBondContact OE1-CD1 3.35Å
903	V	42.8	Very low	34.2	Very low	0 Å²	0	84.4 Å²	84.4	0%	0	51%	0.511	C	S	.	.			trans	-99	177.4	166.8	-163.2	0	0	0	0	110.5	K6 F9 L76 G77 W87	K6-V903 WeakPolarHBondContact CE-O 3.28Å; K6-V903 PolarHBondContact NZ-O 3.42Å; F9-V903 HydrophobicContact CB-CG1 4.16Å; F9-V903 HydrophobicContact CD2-CB 4.17Å; F9-V903 HydrophobicContact CD2-CG1 3.96Å; F9-V903 HydrophobicContact CD2-CG2 3.79Å; F9-V903 HydrophobicContact CE2-CG2 3.97Å; F9-V903 HydrophobicContact CG-CG1 4.45Å; L76-V903 HydrophobicContact CB-CG2 4.01Å; G77-V903 PolarHBondContact O-N 3.2Å; W87-V903 HydrophobicContact CD2-CG1 4.03Å; W87-V903 HydrophobicContact CH2-CG1 4.02Å; W87-V903 HydrophobicContact CZ2-CG1 3.3Å
904	C	37.1	Very low	34.7	Very low	47 Å²	47	82.5 Å²	82.5	32%	0.318	49%	0.493	S	S	.	.			trans	-137.3	141.5	153.8	-70.3	0	0	0	0	106.4	K6 E83 W87	K6-C904 WeakPolarHBondContact CE-SG 3.31Å; K6-C904 PolarHBondContact NZ-SG 3.33Å; E83-C904 WeakPolarHBondContact OE1-CA 3.28Å; W87-C904 WeakPolarHBondContact CZ2-O 3.42Å
905	P	38.5	Very low	35	Very low	77 Å²	77	80.9 Å²	80.9	50%	0.5	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-63.6	152.3	179.3	28.8	-35.9	0	0	0	112.3	E83	E83-P905 WeakPolarHBondContact OE1-CD 3.43Å
906	P	37.8	Very low	35.6	Very low	77 Å²	77	75.3 Å²	75.3	50%	0.5	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-59.6	149.3	161.8	30.1	-34.9	0	0	0	109.1
907	P	36.3	Very low	35.5	Very low	114 Å²	114	73.8 Å²	73.8	74%	0.74	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-59.3	149.8	166.2	28.9	-34.4	0	0	0	109.1	S909	P907-S909 PolarHBondContact O-N 2.95Å
908	P	35	Very low	36	Very low	113 Å²	113	67.3 Å²	67.3	73%	0.734	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-56.7	132.5	169.6	26.4	-33.8	0	0	0	108.8	C910	P908-C910 PolarHBondContact O-N 3.38Å; P908-C910 VanDerWaalsContact O-N 3.16Å
909	S	37.2	Very low	36.3	Very low	122 Å²	122	70.7 Å²	70.7	85%	0.853	45%	0.451	S	S	*	.			trans	-64.9	112.1	169.9	49.8	0	0	0	0	108.6	P907	P907-S909 PolarHBondContact O-N 2.95Å
910	C	27.8	Very low	36.3	Very low	178 Å²	178	73.5 Å²	73.5	100%	1.203	47%	0.473	S	S	*	.			trans	-78.4	0	167.9	-58.5	0	0	0	0	110.5	P908	P908-C910 PolarHBondContact O-N 3.38Å; P908-C910 VanDerWaalsContact O-N 3.16Å

Retrieved 910 of 910 residues in 533 ms (Link to these results)

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