A0A096NQX3_PAPAN Loading...

tRNA pseudouridine synthase Pus10

Protein with different functions depending on its subcellular location: involved in miRNA processing in the nucleus and acts as a tRNA pseudouridylate synthase in the cytoplasm. In the cytoplasm, acts as a pseudouridylate synthase by catalyzing synthesis of pseudouridine(54) and pseudouridine(55) from uracil-54 and uracil-55, respectively, in the psi GC loop of a subset of tRNAs. tRNA pseudouridylate synthase activity is enhanced by the presence of 1-methyladenosine at position 53-61 of tRNAs. Does not show tRNA pseudouridylate synthase activity in the nucleus. In the nucleus, promotes primary microRNAs (pri-miRNAs) processing independently of its RNA pseudouridylate synthase activity. Binds pri-miRNAs. Modulator of TRAIL/TNFSF10-induced cell death via activation of procaspase-8 and BID cleavage. Required for the progression of the apoptotic signal through intrinsic mitochondrial cell death.

AlphaFold DB , UniProt , Accession A0A096NQX3, Species PAPAN (Papio anubis, Olive baboon), Gene PUS10, Length 529 aa.

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(Predicted Aligned Error values between residue pairs)

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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	69.3	Low	88.4	Confident	244 Å²	244	71.7 Å²	71.7	100%	1.202	36%	0.357	S	S	*	.				0	133.2	0	-161.1	166.8	-161.5	0	0	106.9
2	F	87.4	Confident	89.1	Confident	46 Å²	46	65.8 Å²	65.8	20%	0.202	33%	0.328	C	S	.	.			trans	-72.4	145.6	178.3	-162.6	-111.7	0	0	0	109.5	L4 F26 E47 L48 F51	F2-L4 HydrophobicContact CD1-CB 3.96Å; F2-L4 HydrophobicContact CD1-CG 4.3Å; F2-L4 HydrophobicContact CE1-CB 3.85Å; F2-L4 HydrophobicContact CE1-CD1 3.88Å; F2-L4 HydrophobicContact CE1-CG 3.78Å; F2-L4 PolarHBondContact O-N 2.93Å; F2-F26 HydrophobicContact CE1-CE1 4.38Å; F2-F26 HydrophobicContact CE2-CE1 4.34Å; F2-F26 HydrophobicContact CE2-CZ 4.11Å; F2-F26 AromaticContact CZ-CE1 3.81Å; F2-F26 HydrophobicContact CZ-CE1 3.81Å; F2-F26 HydrophobicContact CZ-CZ 4.04Å; F2-E47 HydrophobicContact CD2-CB 3.81Å; F2-E47 HydrophobicContact CE2-CB 3.69Å; F2-L48 HydrophobicContact CE1-CD1 4Å; F2-L48 HydrophobicContact CE2-CB 4.44Å; F2-L48 VanDerWaalsContact CZ-CA 3.5Å; F2-L48 HydrophobicContact CZ-CB 3.83Å; F2-L48 HydrophobicContact CZ-CD1 3.77Å; F2-L48 HydrophobicContact CZ-CG 4.42Å; F2-F51 HydrophobicContact CD1-CB 3.7Å; F2-F51 AromaticContact CD1-CD1 4Å; F2-F51 HydrophobicContact CD1-CD1 4Å; F2-F51 AromaticContact CD1-CD2 3.82Å; F2-F51 HydrophobicContact CD1-CD2 3.82Å; F2-F51 AromaticContact CD1-CG 3.53Å; F2-F51 HydrophobicContact CD1-CG 3.53Å; F2-F51 HydrophobicContact CE1-CB 3.71Å; F2-F51 AromaticContact CE1-CD1 3.65Å; F2-F51 HydrophobicContact CE1-CD1 3.65Å; F2-F51 HydrophobicContact CE1-CD2 4.33Å; F2-F51 HydrophobicContact CE1-CE1 4.4Å; F2-F51 AromaticContact CE1-CG 3.61Å; F2-F51 HydrophobicContact CE1-CG 3.61Å; F2-F51 HydrophobicContact CG-CB 4.37Å; F2-F51 HydrophobicContact CZ-CB 4.4Å
3	P	90.5	Very high	89.6	Confident	37 Å²	37	67.6 Å²	67.6	24%	0.24	34%	0.335	C	S	.	.	S	Bend	trans	-84.3	-6.5	-169.6	35.4	-39.3	0	0	0	114.7	F26 V31 P36	P3-F26 HydrophobicContact CG-CD1 4.13Å; P3-F26 HydrophobicContact CG-CD2 4.49Å; P3-F26 HydrophobicContact CG-CE1 3.63Å; P3-F26 HydrophobicContact CG-CE2 4.03Å; P3-F26 HydrophobicContact CG-CZ 3.57Å; P3-V31 HydrophobicContact CB-CG1 3.91Å; P3-V31 HydrophobicContact CB-CG2 4.31Å; P3-P36 HydrophobicContact CB-CB 4.17Å; P3-P36 HydrophobicContact CB-CG 3.74Å; P3-P36 HydrophobicContact CG-CB 3.86Å; P3-P36 HydrophobicContact CG-CG 4.01Å
4	L	92.7	Very high	90.1	Very high	11 Å²	11	65.6 Å²	65.6	6%	0.058	33%	0.326	C	S	.	.			trans	-96.9	144.5	-179.9	-60.3	-170.9	0	0	0	111	F2 N8 A12 I25 F26 C29 V31 L48 F51	F2-L4 HydrophobicContact CD1-CB 3.96Å; F2-L4 HydrophobicContact CD1-CG 4.3Å; F2-L4 HydrophobicContact CE1-CB 3.85Å; F2-L4 HydrophobicContact CE1-CD1 3.88Å; F2-L4 HydrophobicContact CE1-CG 3.78Å; F2-L4 PolarHBondContact O-N 2.93Å; L4-N8 WeakPolarHBondContact CA-OD1 3.23Å; L4-N8 HydrophobicContact CB-CB 4.06Å; L4-N8 HydrophobicContact CD1-CB 4.47Å; L4-N8 HydrophobicContact CD2-CB 4.16Å; L4-N8 HydrophobicContact CG-CB 4.46Å; L4-A12 HydrophobicContact CD1-CB 3.87Å; L4-I25 HydrophobicContact CD1-CG2 4.13Å; L4-F26 HydrophobicContact CD1-CD1 4.27Å; L4-F26 HydrophobicContact CD1-CE1 4.22Å; L4-F26 HydrophobicContact CD2-CD1 3.98Å; L4-F26 HydrophobicContact CD2-CE1 4.41Å; L4-F26 HydrophobicContact CG-CD1 4.12Å; L4-F26 HydrophobicContact CG-CE1 4.07Å; L4-C29 HydrophobicContact CD2-CB 3.58Å; L4-V31 HydrophobicContact CD2-CG2 3.69Å; L4-L48 HydrophobicContact CD1-CD1 4Å; L4-F51 HydrophobicContact CB-CD1 4.42Å; L4-F51 HydrophobicContact CB-CE1 3.84Å; L4-F51 HydrophobicContact CB-CZ 3.92Å; L4-F51 HydrophobicContact CD1-CE1 4.23Å
5	T	90.6	Very high	90.5	Very high	74 Å²	74	61.3 Å²	61.3	45%	0.454	30%	0.304	S	S	.	.			trans	-98.3	167.7	171.9	65.9	0	0	0	0	110.8	E7 N8 F51	T5-E7 PolarHBondContact O-N 2.84Å; T5-N8 PolarHBondContact N-OD1 2.84Å; T5-N8 WeakPolarHBondContact O-CA 3.29Å; T5-N8 WeakPolarHBondContact O-CB 3.38Å; T5-N8 PolarHBondContact O-N 3.25Å; T5-N8 PolarHBondContact OG1-OD1 3.09Å; T5-F51 WeakPolarHBondContact O-CZ 3.45Å
6	E	86.4	Confident	90.9	Very high	99 Å²	99	59.8 Å²	59.8	46%	0.463	30%	0.297	S	S	.	.	H	α-helix	trans	-56.3	-32.5	176.2	-64	-54	133	0	0	113	N8 K9	E6-N8 PolarHBondContact O-N 3.33Å; E6-K9 WeakPolarHBondContact O-CB 3.16Å; E6-K9 PolarHBondContact O-N 3.27Å; E6-K9 IonicContact OE1-NZ 2.81Å; E6-K9 WeakPolarHBondContact OE2-CD 3.35Å; E6-K9 WeakPolarHBondContact OE2-CE 3.24Å; E6-K9 IonicContact OE2-NZ 3.86Å; E6-K9 PolarHBondContact OE2-NZ 3.49Å
7	E	86.2	Confident	91.1	Very high	130 Å²	130	61.2 Å²	61.2	61%	0.607	31%	0.314	S	S	*	.	H	α-helix	trans	-60	-28	173.5	-60.7	179	174.2	0	0	112.5	T5	T5-E7 PolarHBondContact O-N 2.84Å
8	N	90.7	Very high	91.3	Very high	26 Å²	26	59.9 Å²	59.9	14%	0.139	31%	0.31	C	S	.	.	H	α-helix	trans	-82.2	-13.6	177	-54.1	144.2	0	0	0	113.3	L4 T5 E6 H10 V11 A12 C29	L4-N8 WeakPolarHBondContact CA-OD1 3.23Å; L4-N8 HydrophobicContact CB-CB 4.06Å; L4-N8 HydrophobicContact CD1-CB 4.47Å; L4-N8 HydrophobicContact CD2-CB 4.16Å; L4-N8 HydrophobicContact CG-CB 4.46Å; T5-N8 PolarHBondContact N-OD1 2.84Å; T5-N8 WeakPolarHBondContact O-CA 3.29Å; T5-N8 WeakPolarHBondContact O-CB 3.38Å; T5-N8 PolarHBondContact O-N 3.25Å; T5-N8 PolarHBondContact OG1-OD1 3.09Å; E6-N8 PolarHBondContact O-N 3.33Å; N8-H10 PolarHBondContact O-N 3.08Å; N8-V11 PolarHBondContact O-N 2.99Å; N8-A12 WeakPolarHBondContact O-CB 3.21Å; N8-A12 PolarHBondContact O-N 2.88Å; N8-C29 HydrophobicContact CB-CB 4.25Å
9	K	92.1	Very high	91.6	Very high	13 Å²	13	57.6 Å²	57.6	6%	0.057	30%	0.303	C	S	.	.	H	α-helix	trans	-62.5	-45.3	-166	-160.3	-173.4	-136.7	155.7	0	113.3	E6 V11 A12 Q13 F51 L52 E55	E6-K9 WeakPolarHBondContact O-CB 3.16Å; E6-K9 PolarHBondContact O-N 3.27Å; E6-K9 IonicContact OE1-NZ 2.81Å; E6-K9 WeakPolarHBondContact OE2-CD 3.35Å; E6-K9 WeakPolarHBondContact OE2-CE 3.24Å; E6-K9 IonicContact OE2-NZ 3.86Å; E6-K9 PolarHBondContact OE2-NZ 3.49Å; K9-V11 PolarHBondContact O-N 3.12Å; K9-A12 PolarHBondContact O-N 3.24Å; K9-Q13 VanDerWaalsContact O-CB 3.31Å; K9-Q13 WeakPolarHBondContact O-CB 3.49Å; K9-Q13 PolarHBondContact O-N 2.85Å; K9-F51 HydrophobicContact CB-CE1 4.28Å; K9-F51 HydrophobicContact CB-CZ 4.29Å; K9-F51 WeakPolarHBondContact CE-O 3.27Å; K9-F51 HydrophobicContact CG-CE1 4.11Å; K9-F51 HydrophobicContact CG-CZ 4.33Å; K9-L52 HydrophobicContact CG-CD2 3.76Å; K9-E55 WeakPolarHBondContact CD-OE2 3.39Å; K9-E55 WeakPolarHBondContact CE-OE2 3.28Å; K9-E55 VanDerWaalsContact NZ-CG 3.32Å; K9-E55 IonicContact NZ-OE2 2.65Å; K9-E55 PolarHBondContact NZ-OE2 2.95Å
10	H	92.8	Very high	91.9	Very high	106 Å²	106	54.9 Å²	54.9	49%	0.491	29%	0.288	S	S	.	.	H	α-helix	trans	-59	-46.8	176.7	-68.2	97.3	0	0	0	112	N8 Q13 L14 E166 Q170	N8-H10 PolarHBondContact O-N 3.08Å; H10-Q13 PolarHBondContact O-N 2.65Å; H10-L14 WeakPolarHBondContact O-CB 3.32Å; H10-L14 PolarHBondContact O-N 3.12Å; H10-E166 HydrophobicContact CB-CG 4.46Å; H10-Q170 PolarHBondContact ND1-OE1 3.42Å
11	V	94.1	Very high	92.2	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.018	28%	0.275	C	S	.	.	H	α-helix	trans	-63.7	-45.7	177.4	169.4	0	0	0	0	110.9	N8 K9 L14 L15 V163 E166 M167	N8-V11 PolarHBondContact O-N 2.99Å; K9-V11 PolarHBondContact O-N 3.12Å; V11-L14 PolarHBondContact O-N 2.97Å; V11-L15 HydrophobicContact CG1-CD1 3.79Å; V11-L15 HydrophobicContact CG1-CG 4.36Å; V11-L15 WeakPolarHBondContact O-CB 3.26Å; V11-L15 VanDerWaalsContact O-CG 3.3Å; V11-L15 WeakPolarHBondContact O-CG 3.49Å; V11-L15 PolarHBondContact O-N 3.27Å; V11-V163 HydrophobicContact CG1-CB 4.48Å; V11-V163 HydrophobicContact CG1-CG1 3.69Å; V11-V163 HydrophobicContact CG1-CG2 4Å; V11-V163 HydrophobicContact CG2-CG1 3.98Å; V11-E166 HydrophobicContact CG2-CG 4.49Å; V11-M167 HydrophobicContact CG2-CG 4Å; V11-M167 HydrophobicContact CG2-SD 3.73Å
12	A	96.1	Very high	93.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.2	-42.7	178.9	0	0	0	0	0	112.4	L4 N8 K9 L16 I25 L48 L52	L4-A12 HydrophobicContact CD1-CB 3.87Å; N8-A12 WeakPolarHBondContact O-CB 3.21Å; N8-A12 PolarHBondContact O-N 2.88Å; K9-A12 PolarHBondContact O-N 3.24Å; A12-L16 WeakPolarHBondContact O-CB 3.31Å; A12-L16 PolarHBondContact O-N 2.81Å; A12-I25 HydrophobicContact CB-CG2 3.71Å; A12-L48 HydrophobicContact CB-CD1 4.32Å; A12-L52 HydrophobicContact CB-CD2 4.06Å
13	Q	96.2	Very high	94	Very high	90 Å²	90	38.8 Å²	38.8	42%	0.421	21%	0.209	S	C	.	.	H	α-helix	trans	-64.4	-43.3	176.5	-174.6	57.7	65.3	0	0	112.1	K9 H10 S17 L52	K9-Q13 VanDerWaalsContact O-CB 3.31Å; K9-Q13 WeakPolarHBondContact O-CB 3.49Å; K9-Q13 PolarHBondContact O-N 2.85Å; H10-Q13 PolarHBondContact O-N 2.65Å; Q13-S17 VanDerWaalsContact O-CB 3.28Å; Q13-S17 WeakPolarHBondContact O-CB 3.38Å; Q13-S17 PolarHBondContact O-N 3.39Å; Q13-S17 PolarHBondContact O-OG 3.47Å; Q13-L52 HydrophobicContact CB-CD2 4.03Å
14	L	95.8	Very high	94.4	Very high	40 Å²	40	37 Å²	37	21%	0.209	20%	0.198	C	C	.	.	H	α-helix	trans	-65.2	-46.4	177.9	177.5	60.1	0	0	0	111.7	H10 V11 S17 T18 L162 E166	H10-L14 WeakPolarHBondContact O-CB 3.32Å; H10-L14 PolarHBondContact O-N 3.12Å; V11-L14 PolarHBondContact O-N 2.97Å; L14-S17 PolarHBondContact O-OG 2.91Å; L14-S17 VanDerWaalsContact O-OG 3.12Å; L14-T18 HydrophobicContact CD1-CG2 4.36Å; L14-T18 WeakPolarHBondContact O-CB 3.27Å; L14-T18 VanDerWaalsContact O-CG2 3.28Å; L14-T18 WeakPolarHBondContact O-CG2 3.43Å; L14-T18 PolarHBondContact O-N 3.38Å; L14-T18 PolarHBondContact O-OG1 3.03Å; L14-L162 HydrophobicContact CD2-CD1 4.03Å; L14-L162 HydrophobicContact CD2-CD2 4.19Å; L14-L162 HydrophobicContact CD2-CG 3.8Å; L14-L162 HydrophobicContact CG-CD2 4.08Å; L14-L162 HydrophobicContact CG-CG 4.26Å; L14-E166 HydrophobicContact CD2-CB 3.77Å; L14-E166 HydrophobicContact CD2-CG 3.74Å; L14-E166 WeakPolarHBondContact CD2-OE2 3.22Å
15	L	97.1	Very high	94.6	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-66.8	-43.4	177.9	-72.6	177.6	0	0	0	111.8	V11 T18 G19 T20 I25 F28 L162 V163	V11-L15 HydrophobicContact CG1-CD1 3.79Å; V11-L15 HydrophobicContact CG1-CG 4.36Å; V11-L15 WeakPolarHBondContact O-CB 3.26Å; V11-L15 VanDerWaalsContact O-CG 3.3Å; V11-L15 WeakPolarHBondContact O-CG 3.49Å; V11-L15 PolarHBondContact O-N 3.27Å; L15-T18 PolarHBondContact O-N 2.86Å; L15-T18 PolarHBondContact O-OG1 2.99Å; L15-T18 VanDerWaalsContact O-OG1 3.11Å; L15-G19 PolarHBondContact O-N 3.17Å; L15-T20 HydrophobicContact CB-CG2 4.29Å; L15-T20 WeakPolarHBondContact O-CB 3.45Å; L15-T20 PolarHBondContact O-N 3.4Å; L15-T20 PolarHBondContact O-OG1 2.88Å; L15-I25 HydrophobicContact CB-CD1 4.17Å; L15-I25 HydrophobicContact CB-CG1 3.72Å; L15-I25 HydrophobicContact CD1-CG1 4.2Å; L15-F28 HydrophobicContact CD1-CB 3.67Å; L15-F28 HydrophobicContact CD1-CD2 3.96Å; L15-F28 HydrophobicContact CD1-CG 4.02Å; L15-L162 HydrophobicContact CD2-CD2 4.38Å; L15-V163 HydrophobicContact CD1-CG2 3.83Å; L15-V163 HydrophobicContact CD2-CG2 3.88Å; L15-V163 HydrophobicContact CG-CG2 4.05Å
16	L	96.3	Very high	95	Very high	37 Å²	37	33 Å²	33	19%	0.194	17%	0.173	C	C	.	.	H	α-helix	trans	-64.5	-46.3	179.5	-174.1	63.8	0	0	0	111.8	A12 T18 G19 I25 L45 L48 L52	A12-L16 WeakPolarHBondContact O-CB 3.31Å; A12-L16 PolarHBondContact O-N 2.81Å; L16-T18 PolarHBondContact O-N 2.94Å; L16-G19 PolarHBondContact O-N 3.46Å; L16-G19 VanDerWaalsContact O-N 3.13Å; L16-I25 HydrophobicContact CB-CD1 3.79Å; L16-I25 HydrophobicContact CD1-CD1 4.21Å; L16-L45 HydrophobicContact CD1-CD1 4.12Å; L16-L48 HydrophobicContact CD1-CD2 4.01Å; L16-L48 HydrophobicContact CD2-CD2 3.98Å; L16-L48 HydrophobicContact CD2-CG 4.26Å; L16-L48 HydrophobicContact CG-CD2 4.43Å; L16-L52 HydrophobicContact CB-CD1 4.5Å; L16-L52 HydrophobicContact CD2-CD1 3.53Å
17	S	94.9	Very high	95.5	Very high	84 Å²	84	28.2 Å²	28.2	59%	0.587	15%	0.151	S	C	*	.	H	α-helix	trans	-65.6	-22.7	179.7	57.6	0	0	0	0	113.8	Q13 L14	Q13-S17 VanDerWaalsContact O-CB 3.28Å; Q13-S17 WeakPolarHBondContact O-CB 3.38Å; Q13-S17 PolarHBondContact O-N 3.39Å; Q13-S17 PolarHBondContact O-OG 3.47Å; L14-S17 PolarHBondContact O-OG 2.91Å; L14-S17 VanDerWaalsContact O-OG 3.12Å
18	T	95.1	Very high	96.1	Very high	37 Å²	37	22.1 Å²	22.1	23%	0.227	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	0.7	176.3	56.3	0	0	0	0	113.9	L14 L15 L16 N110 P268	L14-T18 HydrophobicContact CD1-CG2 4.36Å; L14-T18 WeakPolarHBondContact O-CB 3.27Å; L14-T18 VanDerWaalsContact O-CG2 3.28Å; L14-T18 WeakPolarHBondContact O-CG2 3.43Å; L14-T18 PolarHBondContact O-N 3.38Å; L14-T18 PolarHBondContact O-OG1 3.03Å; L15-T18 PolarHBondContact O-N 2.86Å; L15-T18 PolarHBondContact O-OG1 2.99Å; L15-T18 VanDerWaalsContact O-OG1 3.11Å; L16-T18 PolarHBondContact O-N 2.94Å; T18-N110 PolarHBondContact O-ND2 2.84Å; T18-P268 HydrophobicContact CG2-CB 4.02Å; T18-P268 HydrophobicContact CG2-CG 3.72Å
19	G	95.5	Very high	96.3	Very high	17 Å²	17	21.9 Å²	21.9	18%	0.175	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.3	17	174	0	0	0	0	0	115.5	L15 L16 C109 N110	L15-G19 PolarHBondContact O-N 3.17Å; L16-G19 PolarHBondContact O-N 3.46Å; L16-G19 VanDerWaalsContact O-N 3.13Å; G19-C109 WeakPolarHBondContact O-CA 3.27Å; G19-N110 PolarHBondContact O-N 3.04Å; G19-N110 PolarHBondContact O-OD1 2.83Å
20	T	97.9	Very high	96.4	Very high	3 Å²	3	22.8 Å²	22.8	2%	0.018	14%	0.136	C	C	.	.			trans	-81.9	134.4	173.6	-53.9	0	0	0	0	110.9	L15 C24 I25 N110 V111	L15-T20 HydrophobicContact CB-CG2 4.29Å; L15-T20 WeakPolarHBondContact O-CB 3.45Å; L15-T20 PolarHBondContact O-N 3.4Å; L15-T20 PolarHBondContact O-OG1 2.88Å; T20-C24 HydrophobicContact CG2-CB 3.41Å; T20-C24 VanDerWaalsContact CG2-CB 3.41Å; T20-I25 HydrophobicContact CG2-CG1 3.99Å; T20-N110 VanDerWaalsContact CA-OD1 3.25Å; T20-N110 WeakPolarHBondContact CA-OD1 3.45Å; T20-N110 PolarHBondContact N-OD1 2.89Å; T20-N110 PolarHBondContact OG1-OD1 2.91Å; T20-V111 HydrophobicContact CG2-CG2 4.03Å
21	C	97.7	Very high	96.5	Very high	2 Å²	2	18.2 Å²	18.2	1%	0.014	12%	0.115	C	C	.	.			trans	-76.8	157	-178.4	75.4	0	0	0	0	113.4	R23 C24 I25 Y41 C109 Q117	C21-R23 VanDerWaalsContact C-N 3.33Å; C21-R23 PolarHBondContact O-N 2.82Å; C21-C24 WeakPolarHBondContact O-CA 3.42Å; C21-C24 WeakPolarHBondContact O-CB 3.44Å; C21-C24 PolarHBondContact O-N 2.7Å; C21-I25 PolarHBondContact O-N 3.48Å; C21-Y41 HydrophobicContact CB-CE2 3.87Å; C21-Y41 WeakPolarHBondContact CB-OH 3.41Å; C21-C109 HydrophobicContact CB-CB 3.88Å; C21-C109 PolarHBondContact N-SG 2.88Å; C21-C109 VanDerWaalsContact N-SG 3.35Å; C21-C109 VanDerWaalsContact SG-SG 3.63Å; C21-Q117 HydrophobicContact CB-CG 4.11Å
22	P	97.6	Very high	96.4	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-53.5	-43.5	-176.2	-28.1	34.6	0	0	0	114.2	C24 I25 F26 L44 L45 L48	P22-C24 VanDerWaalsContact C-N 3.29Å; P22-C24 PolarHBondContact O-N 2.89Å; P22-I25 WeakPolarHBondContact O-CB 3.35Å; P22-I25 PolarHBondContact O-N 2.7Å; P22-I25 VanDerWaalsContact O-N 3.15Å; P22-F26 WeakPolarHBondContact O-CG 3.49Å; P22-F26 PolarHBondContact O-N 3.37Å; P22-L44 HydrophobicContact CB-CB 3.97Å; P22-L44 HydrophobicContact CG-CB 4.4Å; P22-L45 HydrophobicContact CG-CB 4.25Å; P22-L45 HydrophobicContact CG-CD1 4.05Å; P22-L48 HydrophobicContact CB-CD2 3.99Å; P22-L48 HydrophobicContact CG-CD2 3.98Å
23	R	98.1	Very high	96.2	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-64.5	-31.5	177.2	-62.6	-170.2	-172.1	112	-0.7	112.5	C21 R27 Y37 L39 L44 L116 Q117 C120 E121	C21-R23 VanDerWaalsContact C-N 3.33Å; C21-R23 PolarHBondContact O-N 2.82Å; R23-R27 WeakPolarHBondContact O-CG 3.11Å; R23-Y37 HydrophobicContact CB-CD1 4.31Å; R23-Y37 WeakPolarHBondContact CD-O 3.43Å; R23-Y37 PolarHBondContact NE-O 2.78Å; R23-Y37 WeakPolarHBondContact O-CE1 3.41Å; R23-L39 PolarHBondContact NH2-O 2.79Å; R23-L44 HydrophobicContact CG-CD1 3.62Å; R23-L116 HydrophobicContact CB-CB 3.89Å; R23-L116 HydrophobicContact CB-CD1 4.22Å; R23-L116 WeakPolarHBondContact CD-O 3.19Å; R23-L116 PolarHBondContact NH1-O 2.8Å; R23-Q117 PolarHBondContact NH1-O 2.78Å; R23-C120 PolarHBondContact NH1-SG 2.67Å; R23-E121 IonicContact CZ-OE1 2.99Å; R23-E121 IonicContact NH1-OE1 2.63Å; R23-E121 PolarHBondContact NH1-OE1 2.67Å; R23-E121 IonicContact NH2-OE1 2.74Å; R23-E121 PolarHBondContact NH2-OE1 3.02Å
24	C	98.3	Very high	96.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-74.5	-37.1	172.5	-80.3	0	0	0	0	112.2	T20 C21 P22 F26 R27 F28 C112	T20-C24 HydrophobicContact CG2-CB 3.41Å; T20-C24 VanDerWaalsContact CG2-CB 3.41Å; C21-C24 WeakPolarHBondContact O-CA 3.42Å; C21-C24 WeakPolarHBondContact O-CB 3.44Å; C21-C24 PolarHBondContact O-N 2.7Å; P22-C24 VanDerWaalsContact C-N 3.29Å; P22-C24 PolarHBondContact O-N 2.89Å; C24-F26 VanDerWaalsContact C-N 3.35Å; C24-F26 PolarHBondContact O-N 2.76Å; C24-R27 WeakPolarHBondContact O-CB 3.29Å; C24-R27 PolarHBondContact O-N 2.83Å; C24-R27 VanDerWaalsContact O-N 3.15Å; C24-F28 VanDerWaalsContact O-CD2 3.22Å; C24-F28 WeakPolarHBondContact O-CD2 3.25Å; C24-F28 PolarHBondContact O-N 3.34Å; C24-C112 VanDerWaalsContact SG-CB 3.53Å; C24-C112 PolarHBondContact SG-SG 3.32Å
25	I	98.1	Very high	96.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58	-48.2	175.5	-67.5	169.1	0	0	0	110.2	L4 A12 L15 L16 T20 C21 P22 R27 F28 C29 L48	L4-I25 HydrophobicContact CD1-CG2 4.13Å; A12-I25 HydrophobicContact CB-CG2 3.71Å; L15-I25 HydrophobicContact CB-CD1 4.17Å; L15-I25 HydrophobicContact CB-CG1 3.72Å; L15-I25 HydrophobicContact CD1-CG1 4.2Å; L16-I25 HydrophobicContact CB-CD1 3.79Å; L16-I25 HydrophobicContact CD1-CD1 4.21Å; T20-I25 HydrophobicContact CG2-CG1 3.99Å; C21-I25 PolarHBondContact O-N 3.48Å; P22-I25 WeakPolarHBondContact O-CB 3.35Å; P22-I25 PolarHBondContact O-N 2.7Å; P22-I25 VanDerWaalsContact O-N 3.15Å; I25-R27 PolarHBondContact O-N 3.29Å; I25-R27 VanDerWaalsContact O-N 3.15Å; I25-F28 PolarHBondContact O-N 3Å; I25-C29 PolarHBondContact O-N 3.13Å; I25-C29 PolarHBondContact O-SG 3.03Å; I25-C29 VanDerWaalsContact O-SG 3.36Å; I25-L48 HydrophobicContact CD1-CD2 3.63Å
26	F	97.9	Very high	96	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-52.6	-38	175.6	-66.8	-10.4	0	0	0	113.2	F2 P3 L4 P22 C24 C29 G30 V31 P36 Y37 L44	F2-F26 HydrophobicContact CE1-CE1 4.38Å; F2-F26 HydrophobicContact CE2-CE1 4.34Å; F2-F26 HydrophobicContact CE2-CZ 4.11Å; F2-F26 AromaticContact CZ-CE1 3.81Å; F2-F26 HydrophobicContact CZ-CE1 3.81Å; F2-F26 HydrophobicContact CZ-CZ 4.04Å; P3-F26 HydrophobicContact CG-CD1 4.13Å; P3-F26 HydrophobicContact CG-CD2 4.49Å; P3-F26 HydrophobicContact CG-CE1 3.63Å; P3-F26 HydrophobicContact CG-CE2 4.03Å; P3-F26 HydrophobicContact CG-CZ 3.57Å; L4-F26 HydrophobicContact CD1-CD1 4.27Å; L4-F26 HydrophobicContact CD1-CE1 4.22Å; L4-F26 HydrophobicContact CD2-CD1 3.98Å; L4-F26 HydrophobicContact CD2-CE1 4.41Å; L4-F26 HydrophobicContact CG-CD1 4.12Å; L4-F26 HydrophobicContact CG-CE1 4.07Å; P22-F26 WeakPolarHBondContact O-CG 3.49Å; P22-F26 PolarHBondContact O-N 3.37Å; C24-F26 VanDerWaalsContact C-N 3.35Å; C24-F26 PolarHBondContact O-N 2.76Å; F26-C29 CarbonylContact O-C 3.37Å; F26-C29 PolarHBondContact O-N 2.92Å; F26-G30 PolarHBondContact O-N 2.74Å; F26-V31 HydrophobicContact CB-CB 4.08Å; F26-V31 HydrophobicContact CB-CG2 4.12Å; F26-V31 HydrophobicContact CG-CG2 4.49Å; F26-V31 WeakPolarHBondContact O-CB 3.4Å; F26-V31 WeakPolarHBondContact O-CG2 3.36Å; F26-V31 PolarHBondContact O-N 3.35Å; F26-P36 HydrophobicContact CD2-CB 4.14Å; F26-P36 HydrophobicContact CE2-CB 3.75Å; F26-Y37 HydrophobicContact CB-CE1 3.73Å; F26-Y37 HydrophobicContact CB-CE2 4.42Å; F26-Y37 HydrophobicContact CD2-CD1 4.45Å; F26-Y37 HydrophobicContact CD2-CE1 4.41Å; F26-Y37 PolarHBondContact O-OH 2.87Å; F26-L44 HydrophobicContact CE2-CD1 4.48Å; F26-L44 HydrophobicContact CE2-CD2 3.62Å; F26-L44 HydrophobicContact CZ-CD2 3.82Å
27	R	98	Very high	96	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67.3	-42	176.4	-56.5	-175.3	-42.6	118.9	-2.5	113.1	R23 C24 I25 C29 G30 Y37 E156 I179 V180 A185	R23-R27 WeakPolarHBondContact O-CG 3.11Å; C24-R27 WeakPolarHBondContact O-CB 3.29Å; C24-R27 PolarHBondContact O-N 2.83Å; C24-R27 VanDerWaalsContact O-N 3.15Å; I25-R27 PolarHBondContact O-N 3.29Å; I25-R27 VanDerWaalsContact O-N 3.15Å; R27-C29 VanDerWaalsContact C-N 3.26Å; R27-G30 PolarHBondContact O-N 3.05Å; R27-Y37 HydrophobicContact CG-CE1 3.9Å; R27-Y37 PolarHBondContact N-OH 3.26Å; R27-E156 IonicContact CZ-OE1 3.18Å; R27-E156 IonicContact NH1-OE1 2.81Å; R27-E156 PolarHBondContact NH1-OE1 3.41Å; R27-E156 IonicContact NH2-OE1 3.8Å; R27-E156 PolarHBondContact NH2-OE1 2.94Å; R27-I179 HydrophobicContact CB-CG2 4.35Å; R27-I179 WeakPolarHBondContact O-CA 3.05Å; R27-V180 HydrophobicContact CB-CB 3.98Å; R27-V180 WeakPolarHBondContact CB-O 3.34Å; R27-V180 WeakPolarHBondContact CD-O 3.45Å; R27-V180 HydrophobicContact CG-CB 4.05Å; R27-V180 HydrophobicContact CG-CG1 4.33Å; R27-V180 PolarHBondContact NH1-O 3.26Å; R27-V180 PolarHBondContact O-N 3.24Å; R27-A185 HydrophobicContact CG-CB 4.14Å
28	F	97.1	Very high	96.1	Very high	2 Å²	2	31 Å²	31	1%	0.009	18%	0.177	C	C	.	.	H	α-helix	trans	-73.5	-20.1	178.5	-74.2	-73	0	0	0	112.7	L15 C24 I25 V111 A159 W160 V163 I179	L15-F28 HydrophobicContact CD1-CB 3.67Å; L15-F28 HydrophobicContact CD1-CD2 3.96Å; L15-F28 HydrophobicContact CD1-CG 4.02Å; C24-F28 VanDerWaalsContact O-CD2 3.22Å; C24-F28 WeakPolarHBondContact O-CD2 3.25Å; C24-F28 PolarHBondContact O-N 3.34Å; I25-F28 PolarHBondContact O-N 3Å; F28-V111 HydrophobicContact CE2-CG1 4.01Å; F28-V111 HydrophobicContact CE2-CG2 4.12Å; F28-V111 HydrophobicContact CZ-CG1 4.12Å; F28-A159 HydrophobicContact CE1-CB 3.87Å; F28-A159 HydrophobicContact CE2-CB 3.91Å; F28-A159 HydrophobicContact CZ-CB 3.38Å; F28-W160 HydrophobicContact CE1-CB 4.35Å; F28-V163 HydrophobicContact CB-CG2 4.18Å; F28-V163 HydrophobicContact CD1-CG2 4.11Å; F28-V163 HydrophobicContact CG-CG2 4.23Å; F28-I179 HydrophobicContact CD1-CD1 3.57Å; F28-I179 HydrophobicContact CD1-CG1 3.97Å; F28-I179 HydrophobicContact CD1-CG2 4.16Å; F28-I179 HydrophobicContact CE1-CD1 3.64Å; F28-I179 HydrophobicContact CE1-CG1 4.41Å; F28-I179 HydrophobicContact CE1-CG2 4.23Å
29	C	95.3	Very high	96.1	Very high	21 Å²	21	33 Å²	33	14%	0.142	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	7.1	170.3	-59.5	0	0	0	0	113.5	L4 N8 I25 F26 R27 V31	L4-C29 HydrophobicContact CD2-CB 3.58Å; N8-C29 HydrophobicContact CB-CB 4.25Å; I25-C29 PolarHBondContact O-N 3.13Å; I25-C29 PolarHBondContact O-SG 3.03Å; I25-C29 VanDerWaalsContact O-SG 3.36Å; F26-C29 CarbonylContact O-C 3.37Å; F26-C29 PolarHBondContact O-N 2.92Å; R27-C29 VanDerWaalsContact C-N 3.26Å; C29-V31 VanDerWaalsContact C-N 3.33Å; C29-V31 HydrophobicContact CB-CG2 4.43Å; C29-V31 PolarHBondContact O-N 2.93Å
30	G	94.1	Very high	96	Very high	32 Å²	32	35 Å²	35	33%	0.33	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	21	175.6	0	0	0	0	0	115.6	F26 R27 D32 D178	F26-G30 PolarHBondContact O-N 2.74Å; R27-G30 PolarHBondContact O-N 3.05Å; G30-D32 PolarHBondContact O-N 3.3Å; G30-D178 WeakPolarHBondContact CA-O 3.47Å
31	V	95.1	Very high	95.8	Very high	9 Å²	9	35.8 Å²	35.8	6%	0.055	20%	0.199	C	C	.	.			trans	-69.4	104.8	179.5	-179.1	0	0	0	0	109.7	P3 L4 F26 C29 F33 P36 Y37 V180	P3-V31 HydrophobicContact CB-CG1 3.91Å; P3-V31 HydrophobicContact CB-CG2 4.31Å; L4-V31 HydrophobicContact CD2-CG2 3.69Å; F26-V31 HydrophobicContact CB-CB 4.08Å; F26-V31 HydrophobicContact CB-CG2 4.12Å; F26-V31 HydrophobicContact CG-CG2 4.49Å; F26-V31 WeakPolarHBondContact O-CB 3.4Å; F26-V31 WeakPolarHBondContact O-CG2 3.36Å; F26-V31 PolarHBondContact O-N 3.35Å; C29-V31 VanDerWaalsContact C-N 3.33Å; C29-V31 HydrophobicContact CB-CG2 4.43Å; C29-V31 PolarHBondContact O-N 2.93Å; V31-F33 HydrophobicContact CG1-CB 4.5Å; V31-F33 HydrophobicContact CG1-CD2 4.49Å; V31-P36 HydrophobicContact CG1-CG 4.48Å; V31-Y37 HydrophobicContact CB-CE2 4.37Å; V31-Y37 HydrophobicContact CG1-CE2 4.13Å; V31-Y37 WeakPolarHBondContact O-CE2 3.29Å; V31-Y37 PolarHBondContact O-OH 3.23Å; V31-V180 WeakPolarHBondContact O-CG2 3.17Å
32	D	92.3	Very high	95.6	Very high	99 Å²	99	43 Å²	43	53%	0.529	23%	0.23	S	C	.	.			trans	-87.1	-20.2	-179.3	66.7	-18.2	0	0	0	113.6	G30 H34 W188	G30-D32 PolarHBondContact O-N 3.3Å; D32-H34 PolarHBondContact O-CD2 2.79Å; D32-H34 PolarHBondContact O-N 2.75Å; D32-W188 WeakPolarHBondContact O-CH2 3.42Å
33	F	92.1	Very high	95.4	Very high	142 Å²	142	48 Å²	48	62%	0.623	25%	0.253	S	S	*	.			trans	-62.1	125.2	175.2	-55.9	-69.5	0	0	0	111.8	V31 A35 P36 Y37	V31-F33 HydrophobicContact CG1-CB 4.5Å; V31-F33 HydrophobicContact CG1-CD2 4.49Å; F33-A35 PolarHBondContact O-N 3.49Å; F33-P36 WeakPolarHBondContact O-CD 3.46Å; F33-Y37 VanDerWaalsContact O-CD2 3.28Å; F33-Y37 WeakPolarHBondContact O-CD2 3.39Å; F33-Y37 WeakPolarHBondContact O-CE2 3.47Å
34	H	94.4	Very high	95.2	Very high	88 Å²	88	47.9 Å²	47.9	41%	0.407	25%	0.253	S	S	.	.	H	α-helix	trans	-71.4	-27.1	-178	-55.5	170	0	0	0	114	D32 Y37 W188	D32-H34 PolarHBondContact O-CD2 2.79Å; D32-H34 PolarHBondContact O-N 2.75Å; H34-Y37 PolarHBondContact O-N 2.85Å; H34-W188 HydrophobicContact CB-CB 4.27Å; H34-W188 HydrophobicContact CB-CG 4.45Å; H34-W188 AromaticContact CD2-CD1 3.87Å; H34-W188 AromaticContact CD2-CD2 3.24Å; H34-W188 AromaticContact CD2-CE2 3.33Å; H34-W188 AromaticContact CD2-CE3 3.6Å; H34-W188 AromaticContact CD2-CG 3.61Å; H34-W188 AromaticContact CD2-CZ2 3.77Å; H34-W188 AromaticContact CD2-CZ3 4Å; H34-W188 AromaticContact CD2-NE1 3.72Å; H34-W188 AromaticContact CE1-CD1 3.87Å; H34-W188 AromaticContact CE1-NE1 3.85Å; H34-W188 AromaticContact CG-CD2 3.93Å; H34-W188 AromaticContact CG-CG 3.86Å; H34-W188 AromaticContact NE2-CD1 3.65Å; H34-W188 AromaticContact NE2-CD2 3.68Å; H34-W188 AromaticContact NE2-CE2 3.27Å; H34-W188 VanDerWaalsContact NE2-CE2 3.27Å; H34-W188 AromaticContact NE2-CG 3.9Å; H34-W188 AromaticContact NE2-CZ2 3.69Å; H34-W188 AromaticContact NE2-NE1 3.27Å; H34-W188 PolarHBondContact NE2-NE1 2.94Å
35	A	94.6	Very high	95	Very high	71 Å²	71	49.7 Å²	49.7	59%	0.587	26%	0.262	S	S	*	.	H	α-helix	trans	-65.6	-44.3	-168.8	0	0	0	0	0	114.3	F33 Y37 K38	F33-A35 PolarHBondContact O-N 3.49Å; A35-Y37 VanDerWaalsContact C-N 3.3Å; A35-Y37 PolarHBondContact O-N 2.81Å; A35-K38 PolarHBondContact O-N 3.11Å; A35-K38 VanDerWaalsContact O-N 3.14Å
36	P	95.4	Very high	94.8	Very high	21 Å²	21	53.6 Å²	53.6	14%	0.136	28%	0.283	C	S	.	.	H	α-helix	trans	-56.1	-39.1	176.3	-26.2	34.1	0	0	0	114	P3 F26 V31 F33 K38 L39 L44	P3-P36 HydrophobicContact CB-CB 4.17Å; P3-P36 HydrophobicContact CB-CG 3.74Å; P3-P36 HydrophobicContact CG-CB 3.86Å; P3-P36 HydrophobicContact CG-CG 4.01Å; F26-P36 HydrophobicContact CD2-CB 4.14Å; F26-P36 HydrophobicContact CE2-CB 3.75Å; V31-P36 HydrophobicContact CG1-CG 4.48Å; F33-P36 WeakPolarHBondContact O-CD 3.46Å; P36-K38 PolarHBondContact O-N 2.92Å; P36-K38 VanDerWaalsContact O-N 3.17Å; P36-L39 PolarHBondContact O-N 3.21Å; P36-L44 WeakPolarHBondContact O-CD2 3.41Å
37	Y	97.1	Very high	94.6	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62	-26	-179.6	-66.9	-90.1	0	0	0	113.7	R23 F26 R27 V31 F33 H34 A35 A185 W188	R23-Y37 HydrophobicContact CB-CD1 4.31Å; R23-Y37 WeakPolarHBondContact CD-O 3.43Å; R23-Y37 PolarHBondContact NE-O 2.78Å; R23-Y37 WeakPolarHBondContact O-CE1 3.41Å; F26-Y37 HydrophobicContact CB-CE1 3.73Å; F26-Y37 HydrophobicContact CB-CE2 4.42Å; F26-Y37 HydrophobicContact CD2-CD1 4.45Å; F26-Y37 HydrophobicContact CD2-CE1 4.41Å; F26-Y37 PolarHBondContact O-OH 2.87Å; R27-Y37 HydrophobicContact CG-CE1 3.9Å; R27-Y37 PolarHBondContact N-OH 3.26Å; V31-Y37 HydrophobicContact CB-CE2 4.37Å; V31-Y37 HydrophobicContact CG1-CE2 4.13Å; V31-Y37 WeakPolarHBondContact O-CE2 3.29Å; V31-Y37 PolarHBondContact O-OH 3.23Å; F33-Y37 VanDerWaalsContact O-CD2 3.28Å; F33-Y37 WeakPolarHBondContact O-CD2 3.39Å; F33-Y37 WeakPolarHBondContact O-CE2 3.47Å; H34-Y37 PolarHBondContact O-N 2.85Å; A35-Y37 VanDerWaalsContact C-N 3.3Å; A35-Y37 PolarHBondContact O-N 2.81Å; Y37-A185 HydrophobicContact CD1-CB 4.14Å; Y37-A185 HydrophobicContact CE1-CB 3.98Å; Y37-W188 AromaticContact CD2-CE3 3.94Å; Y37-W188 HydrophobicContact CD2-CE3 3.94Å; Y37-W188 HydrophobicContact CD2-CZ3 4.13Å; Y37-W188 AromaticContact CE2-CE3 3.93Å; Y37-W188 HydrophobicContact CE2-CE3 3.93Å; Y37-W188 AromaticContact CE2-CZ3 3.63Å; Y37-W188 HydrophobicContact CE2-CZ3 3.63Å
38	K	96	Very high	94.5	Very high	103 Å²	103	57.5 Å²	57.5	45%	0.448	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-10.2	-176.8	-62.8	176.2	-179.4	-176.1	0	114	A35 P36 W188	A35-K38 PolarHBondContact O-N 3.11Å; A35-K38 VanDerWaalsContact O-N 3.14Å; P36-K38 PolarHBondContact O-N 2.92Å; P36-K38 VanDerWaalsContact O-N 3.17Å; K38-W188 WeakPolarHBondContact CE-O 3.34Å
39	L	94.9	Very high	94.3	Very high	78 Å²	78	61.3 Å²	61.3	41%	0.408	32%	0.319	S	S	.	.	S	Bend	trans	-65.6	149.7	177.7	-68.3	173.3	0	0	0	111.1	R23 P36 L44	R23-L39 PolarHBondContact NH2-O 2.79Å; P36-L39 PolarHBondContact O-N 3.21Å; L39-L44 HydrophobicContact CB-CD1 4.23Å; L39-L44 HydrophobicContact CB-CD2 3.74Å; L39-L44 HydrophobicContact CB-CG 3.71Å; L39-L44 HydrophobicContact CD1-CD2 3.81Å; L39-L44 HydrophobicContact CG-CD2 4.36Å
40	P	94.1	Very high	94.2	Very high	61 Å²	61	65.8 Å²	65.8	40%	0.396	34%	0.336	S	S	.	.			trans	-54.9	139.8	174.6	-26.4	36	0	0	0	112.1	K42 E43 L44	P40-K42 VanDerWaalsContact C-N 3.25Å; P40-K42 PolarHBondContact O-N 3.44Å; P40-K42 VanDerWaalsContact O-N 3.15Å; P40-E43 HydrophobicContact CB-CB 4.44Å; P40-E43 HydrophobicContact CB-CG 4.26Å; P40-E43 WeakPolarHBondContact CD-OE2 3.08Å; P40-E43 HydrophobicContact CG-CG 4.44Å; P40-E43 PolarHBondContact O-N 3.33Å; P40-L44 PolarHBondContact O-N 2.84Å
41	Y	94.1	Very high	94.2	Very high	19 Å²	19	65.3 Å²	65.3	8%	0.075	33%	0.325	C	S	.	.	H	α-helix	trans	-56	-38.5	-174.4	-175.3	-88.6	0	0	0	113.9	C21 L44 L45 L106 Q117 E121	C21-Y41 HydrophobicContact CB-CE2 3.87Å; C21-Y41 WeakPolarHBondContact CB-OH 3.41Å; Y41-L44 PolarHBondContact O-N 2.63Å; Y41-L45 HydrophobicContact CE1-CD2 4.4Å; Y41-L45 WeakPolarHBondContact O-CB 3.25Å; Y41-L45 PolarHBondContact O-N 2.86Å; Y41-L106 HydrophobicContact CD1-CD1 3.95Å; Y41-L106 HydrophobicContact CD1-CD2 4.24Å; Y41-L106 HydrophobicContact CE1-CD1 4.03Å; Y41-L106 HydrophobicContact CE1-CD2 3.86Å; Y41-L106 HydrophobicContact CE1-CG 4.48Å; Y41-Q117 HydrophobicContact CD2-CG 4.44Å; Y41-Q117 HydrophobicContact CE2-CB 4.3Å; Y41-Q117 HydrophobicContact CE2-CG 3.77Å; Y41-Q117 PolarHBondContact OH-NE2 2.93Å; Y41-Q117 VanDerWaalsContact OH-NE2 3.15Å; Y41-E121 WeakPolarHBondContact CB-OE1 3.34Å; Y41-E121 PolarHBondContact N-OE1 2.97Å
42	K	91.9	Very high	94.1	Very high	154 Å²	154	65.8 Å²	65.8	67%	0.67	33%	0.327	S	S	*	.	H	α-helix	trans	-65.6	-39.9	178.4	-66.6	-177.7	-180	177.3	0	112.3	P40 L45 N46	P40-K42 VanDerWaalsContact C-N 3.25Å; P40-K42 PolarHBondContact O-N 3.44Å; P40-K42 VanDerWaalsContact O-N 3.15Å; K42-L45 PolarHBondContact O-N 3.49Å; K42-N46 WeakPolarHBondContact O-CB 3.01Å; K42-N46 PolarHBondContact O-N 3.21Å; K42-N46 PolarHBondContact O-ND2 3.38Å; K42-N46 PolarHBondContact O-OD1 3.48Å
43	E	93.9	Very high	93.9	Very high	103 Å²	103	66.9 Å²	66.9	48%	0.481	33%	0.329	S	S	.	.	H	α-helix	trans	-66.4	-44.7	176	-68.6	174.1	-155.2	0	0	110.4	P40 L45 N46 E47	P40-E43 HydrophobicContact CB-CB 4.44Å; P40-E43 HydrophobicContact CB-CG 4.26Å; P40-E43 WeakPolarHBondContact CD-OE2 3.08Å; P40-E43 HydrophobicContact CG-CG 4.44Å; P40-E43 PolarHBondContact O-N 3.33Å; E43-L45 VanDerWaalsContact C-N 3.33Å; E43-L45 PolarHBondContact O-N 3.43Å; E43-N46 PolarHBondContact O-N 2.7Å; E43-E47 WeakPolarHBondContact O-CB 3.25Å; E43-E47 WeakPolarHBondContact O-CG 3.27Å; E43-E47 PolarHBondContact O-N 3.08Å
44	L	94.6	Very high	93	Very high	2 Å²	2	64.5 Å²	64.5	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-59.4	-40.5	175.7	-74.2	-179.8	0	0	0	113.6	P22 R23 F26 P36 L39 P40 Y41 L48	P22-L44 HydrophobicContact CB-CB 3.97Å; P22-L44 HydrophobicContact CG-CB 4.4Å; R23-L44 HydrophobicContact CG-CD1 3.62Å; F26-L44 HydrophobicContact CE2-CD1 4.48Å; F26-L44 HydrophobicContact CE2-CD2 3.62Å; F26-L44 HydrophobicContact CZ-CD2 3.82Å; P36-L44 WeakPolarHBondContact O-CD2 3.41Å; L39-L44 HydrophobicContact CB-CD1 4.23Å; L39-L44 HydrophobicContact CB-CD2 3.74Å; L39-L44 HydrophobicContact CB-CG 3.71Å; L39-L44 HydrophobicContact CD1-CD2 3.81Å; L39-L44 HydrophobicContact CG-CD2 4.36Å; P40-L44 PolarHBondContact O-N 2.84Å; Y41-L44 PolarHBondContact O-N 2.63Å; L44-L48 WeakPolarHBondContact O-CB 3.49Å; L44-L48 PolarHBondContact O-N 3.15Å
45	L	94.1	Very high	91.1	Very high	39 Å²	39	65.5 Å²	65.5	20%	0.204	33%	0.331	C	S	.	.	H	α-helix	trans	-67.1	-45.2	177.3	-174.9	62.7	0	0	0	111.3	L16 P22 Y41 K42 E43 L48 Q49	L16-L45 HydrophobicContact CD1-CD1 4.12Å; P22-L45 HydrophobicContact CG-CB 4.25Å; P22-L45 HydrophobicContact CG-CD1 4.05Å; Y41-L45 HydrophobicContact CE1-CD2 4.4Å; Y41-L45 WeakPolarHBondContact O-CB 3.25Å; Y41-L45 PolarHBondContact O-N 2.86Å; K42-L45 PolarHBondContact O-N 3.49Å; E43-L45 VanDerWaalsContact C-N 3.33Å; E43-L45 PolarHBondContact O-N 3.43Å; L45-L48 PolarHBondContact O-N 3.41Å; L45-Q49 WeakPolarHBondContact O-CG 3.38Å; L45-Q49 PolarHBondContact O-N 3.48Å
46	N	93.4	Very high	89	Confident	82 Å²	82	69.9 Å²	69.9	44%	0.439	34%	0.337	S	S	.	.	H	α-helix	trans	-65.3	-45.2	179.9	-67.5	-8.4	0	0	0	112.1	K42 E43 Q49 K50	K42-N46 WeakPolarHBondContact O-CB 3.01Å; K42-N46 PolarHBondContact O-N 3.21Å; K42-N46 PolarHBondContact O-ND2 3.38Å; K42-N46 PolarHBondContact O-OD1 3.48Å; E43-N46 PolarHBondContact O-N 2.7Å; N46-Q49 PolarHBondContact O-N 3.31Å; N46-K50 WeakPolarHBondContact O-CG 3.32Å; N46-K50 PolarHBondContact O-N 3.12Å
47	E	94.4	Very high	86.3	Confident	81 Å²	81	75 Å²	75	38%	0.379	36%	0.364	S	S	.	.	H	α-helix	trans	-67.9	-36.2	178.8	-67.5	-62.6	111.4	0	0	111.8	F2 E43 K50 F51	F2-E47 HydrophobicContact CD2-CB 3.81Å; F2-E47 HydrophobicContact CE2-CB 3.69Å; E43-E47 WeakPolarHBondContact O-CB 3.25Å; E43-E47 WeakPolarHBondContact O-CG 3.27Å; E43-E47 PolarHBondContact O-N 3.08Å; E47-K50 IonicContact OE1-NZ 2.7Å; E47-K50 PolarHBondContact OE1-NZ 3.31Å; E47-F51 WeakPolarHBondContact O-CB 2.98Å; E47-F51 PolarHBondContact O-N 2.7Å
48	L	94.4	Very high	83.5	Confident	0 Å²	0	83.1 Å²	83.1	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-64.5	-41.9	172.7	-179.8	65	0	0	0	112	F2 L4 A12 L16 P22 I25 L44 L45 F51 L52	F2-L48 HydrophobicContact CE1-CD1 4Å; F2-L48 HydrophobicContact CE2-CB 4.44Å; F2-L48 VanDerWaalsContact CZ-CA 3.5Å; F2-L48 HydrophobicContact CZ-CB 3.83Å; F2-L48 HydrophobicContact CZ-CD1 3.77Å; F2-L48 HydrophobicContact CZ-CG 4.42Å; L4-L48 HydrophobicContact CD1-CD1 4Å; A12-L48 HydrophobicContact CB-CD1 4.32Å; L16-L48 HydrophobicContact CD1-CD2 4.01Å; L16-L48 HydrophobicContact CD2-CD2 3.98Å; L16-L48 HydrophobicContact CD2-CG 4.26Å; L16-L48 HydrophobicContact CG-CD2 4.43Å; P22-L48 HydrophobicContact CB-CD2 3.99Å; P22-L48 HydrophobicContact CG-CD2 3.98Å; I25-L48 HydrophobicContact CD1-CD2 3.63Å; L44-L48 WeakPolarHBondContact O-CB 3.49Å; L44-L48 PolarHBondContact O-N 3.15Å; L45-L48 PolarHBondContact O-N 3.41Å; L48-F51 HydrophobicContact CD1-CD1 4.38Å; L48-F51 PolarHBondContact O-N 3.48Å; L48-L52 HydrophobicContact CD1-CD1 4.22Å; L48-L52 HydrophobicContact CD1-CG 4.36Å; L48-L52 HydrophobicContact CG-CD1 4.1Å; L48-L52 VanDerWaalsContact O-CG 3.27Å; L48-L52 WeakPolarHBondContact O-CG 3.2Å; L48-L52 PolarHBondContact O-N 3.43Å
49	Q	93.4	Very high	80.7	Confident	82 Å²	82	85.7 Å²	85.7	38%	0.383	42%	0.419	S	S	.	.	H	α-helix	trans	-61.7	-49	176.4	-77	173.8	-27.4	0	0	111.3	L45 N46 F51 L52 E53	L45-Q49 WeakPolarHBondContact O-CG 3.38Å; L45-Q49 PolarHBondContact O-N 3.48Å; N46-Q49 PolarHBondContact O-N 3.31Å; Q49-F51 VanDerWaalsContact C-N 3.35Å; Q49-F51 PolarHBondContact O-N 3.01Å; Q49-L52 PolarHBondContact O-N 2.87Å; Q49-E53 WeakPolarHBondContact O-CB 3.36Å; Q49-E53 WeakPolarHBondContact O-CG 3.26Å; Q49-E53 PolarHBondContact O-N 2.76Å
50	K	93.6	Very high	78	Confident	116 Å²	116	88.2 Å²	88.2	50%	0.504	43%	0.432	S	S	.	.	H	α-helix	trans	-55.5	-47.9	174.6	-68.6	172.3	-171.7	172.4	0	112.3	N46 E47 L52 E53 T54	N46-K50 WeakPolarHBondContact O-CG 3.32Å; N46-K50 PolarHBondContact O-N 3.12Å; E47-K50 IonicContact OE1-NZ 2.7Å; E47-K50 PolarHBondContact OE1-NZ 3.31Å; K50-L52 VanDerWaalsContact C-N 3.29Å; K50-L52 PolarHBondContact O-N 2.82Å; K50-E53 PolarHBondContact O-N 2.87Å; K50-E53 VanDerWaalsContact O-N 3.09Å; K50-T54 PolarHBondContact O-N 3.24Å; K50-T54 VanDerWaalsContact O-N 3.08Å; K50-T54 PolarHBondContact O-OG1 2.83Å
51	F	93.8	Very high	75.3	Confident	22 Å²	22	92.8 Å²	92.8	10%	0.096	45%	0.452	C	S	.	.	H	α-helix	trans	-56.3	-43.9	178.6	168.9	-104.6	0	0	0	112	F2 L4 T5 K9 E47 L48 Q49	F2-F51 HydrophobicContact CD1-CB 3.7Å; F2-F51 AromaticContact CD1-CD1 4Å; F2-F51 HydrophobicContact CD1-CD1 4Å; F2-F51 AromaticContact CD1-CD2 3.82Å; F2-F51 HydrophobicContact CD1-CD2 3.82Å; F2-F51 AromaticContact CD1-CG 3.53Å; F2-F51 HydrophobicContact CD1-CG 3.53Å; F2-F51 HydrophobicContact CE1-CB 3.71Å; F2-F51 AromaticContact CE1-CD1 3.65Å; F2-F51 HydrophobicContact CE1-CD1 3.65Å; F2-F51 HydrophobicContact CE1-CD2 4.33Å; F2-F51 HydrophobicContact CE1-CE1 4.4Å; F2-F51 AromaticContact CE1-CG 3.61Å; F2-F51 HydrophobicContact CE1-CG 3.61Å; F2-F51 HydrophobicContact CG-CB 4.37Å; F2-F51 HydrophobicContact CZ-CB 4.4Å; L4-F51 HydrophobicContact CB-CD1 4.42Å; L4-F51 HydrophobicContact CB-CE1 3.84Å; L4-F51 HydrophobicContact CB-CZ 3.92Å; L4-F51 HydrophobicContact CD1-CE1 4.23Å; T5-F51 WeakPolarHBondContact O-CZ 3.45Å; K9-F51 HydrophobicContact CB-CE1 4.28Å; K9-F51 HydrophobicContact CB-CZ 4.29Å; K9-F51 WeakPolarHBondContact CE-O 3.27Å; K9-F51 HydrophobicContact CG-CE1 4.11Å; K9-F51 HydrophobicContact CG-CZ 4.33Å; E47-F51 WeakPolarHBondContact O-CB 2.98Å; E47-F51 PolarHBondContact O-N 2.7Å; L48-F51 HydrophobicContact CD1-CD1 4.38Å; L48-F51 PolarHBondContact O-N 3.48Å; Q49-F51 VanDerWaalsContact C-N 3.35Å; Q49-F51 PolarHBondContact O-N 3.01Å
52	L	92.8	Very high	72.5	Confident	19 Å²	19	101 Å²	101	10%	0.099	49%	0.491	C	S	.	.	H	α-helix	trans	-70.5	-28.3	177.3	-66.2	172.9	0	0	0	113.3	K9 A12 Q13 L16 L48 Q49 K50	K9-L52 HydrophobicContact CG-CD2 3.76Å; A12-L52 HydrophobicContact CB-CD2 4.06Å; Q13-L52 HydrophobicContact CB-CD2 4.03Å; L16-L52 HydrophobicContact CB-CD1 4.5Å; L16-L52 HydrophobicContact CD2-CD1 3.53Å; L48-L52 HydrophobicContact CD1-CD1 4.22Å; L48-L52 HydrophobicContact CD1-CG 4.36Å; L48-L52 HydrophobicContact CG-CD1 4.1Å; L48-L52 VanDerWaalsContact O-CG 3.27Å; L48-L52 WeakPolarHBondContact O-CG 3.2Å; L48-L52 PolarHBondContact O-N 3.43Å; Q49-L52 PolarHBondContact O-N 2.87Å; K50-L52 VanDerWaalsContact C-N 3.29Å; K50-L52 PolarHBondContact O-N 2.82Å
53	E	88.8	Confident	69.6	Low	122 Å²	122	100.1 Å²	100.1	57%	0.57	50%	0.498	S	S	*	.	H	α-helix	trans	-83	-24.2	-178.1	-74.5	172.6	175.3	0	0	114.5	Q49 K50 E55 K56	Q49-E53 WeakPolarHBondContact O-CB 3.36Å; Q49-E53 WeakPolarHBondContact O-CG 3.26Å; Q49-E53 PolarHBondContact O-N 2.76Å; K50-E53 PolarHBondContact O-N 2.87Å; K50-E53 VanDerWaalsContact O-N 3.09Å; E53-E55 PolarHBondContact O-N 2.88Å; E53-K56 PolarHBondContact O-N 3.02Å
54	T	73.3	Confident	66.6	Low	92 Å²	92	103.9 Å²	103.9	56%	0.564	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-23.5	-171.2	-49.7	0	0	0	0	115.3	K50	K50-T54 PolarHBondContact O-N 3.24Å; K50-T54 VanDerWaalsContact O-N 3.08Å; K50-T54 PolarHBondContact O-OG1 2.83Å
55	E	55.1	Low	63.6	Low	108 Å²	108	111.4 Å²	111.4	51%	0.505	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.5	-14.1	179.2	-108.8	175.8	154.3	0	0	115.1	K9 E53 D57	K9-E55 WeakPolarHBondContact CD-OE2 3.39Å; K9-E55 WeakPolarHBondContact CE-OE2 3.28Å; K9-E55 VanDerWaalsContact NZ-CG 3.32Å; K9-E55 IonicContact NZ-OE2 2.65Å; K9-E55 PolarHBondContact NZ-OE2 2.95Å; E53-E55 PolarHBondContact O-N 2.88Å; E55-D57 VanDerWaalsContact C-N 3.32Å; E55-D57 PolarHBondContact O-N 2.83Å
56	K	49	Very low	60.6	Low	164 Å²	164	114.9 Å²	114.9	71%	0.713	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-25.4	-176.3	-89.4	-176.7	175.6	173.7	0	114	E53	E53-K56 PolarHBondContact O-N 3.02Å
57	D	40.3	Very low	57.7	Low	129 Å²	129	116.8 Å²	116.8	69%	0.69	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-20.1	-173.5	-74.5	-26.6	0	0	0	113.9	E55	E55-D57 VanDerWaalsContact C-N 3.32Å; E55-D57 PolarHBondContact O-N 2.83Å
58	E	38.4	Very low	54.7	Low	169 Å²	169	118.9 Å²	118.9	79%	0.79	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-18.4	-179.3	-66.5	-163.7	151.4	0	0	113.8
59	L	37	Very low	51.5	Low	158 Å²	158	129 Å²	129	83%	0.827	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	4.2	-175	-79.2	163	0	0	0	115.4
60	I	37.9	Very low	48.4	Very low	130 Å²	130	134.7 Å²	134.7	67%	0.667	69%	0.688	S	S	*	*	S	Bend	trans	-105.4	-8.1	-173.1	-63.4	179.5	0	0	0	113.3
61	L	36	Very low	45.3	Very low	157 Å²	157	137 Å²	137	82%	0.822	71%	0.705	S	S	*	*	S	Bend	trans	-95.9	21.1	-168.6	-86.4	168.7	0	0	0	117.6
62	E	35.5	Very low	42	Very low	192 Å²	192	146.9 Å²	146.9	90%	0.897	74%	0.741	S	S	*	*			trans	-132.1	73.6	168.9	-71.5	-158.1	158.3	0	0	114.2
63	V	32.5	Very low	39	Very low	136 Å²	136	152.6 Å²	152.6	82%	0.824	77%	0.771	S	S	*	*			trans	-133	124.8	155.6	-176.6	0	0	0	0	110.4
64	M	30.4	Very low	36	Very low	181 Å²	181	156.1 Å²	156.1	89%	0.892	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-70.5	128.9	-176.3	-65.9	159.6	56.8	0	0	112.7
65	N	31.2	Very low	33.8	Very low	161 Å²	161	159.2 Å²	159.2	86%	0.861	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-77.7	134	171.8	-80.4	-52.2	0	0	0	113
66	P	31.6	Very low	32.5	Very low	112 Å²	112	162.3 Å²	162.3	73%	0.727	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-92.2	162.5	152.7	1.8	18.8	0	0	0	111.7
67	P	31.6	Very low	31.4	Very low	121 Å²	121	162.4 Å²	162.4	79%	0.786	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-87.7	157.2	-154.8	33.5	-37.5	0	0	0	116.2
68	P	32	Very low	30.8	Very low	126 Å²	126	162.5 Å²	162.5	82%	0.818	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-81.3	149.3	-174.2	33.1	-36.3	0	0	0	114
69	K	27.9	Very low	30.2	Very low	212 Å²	212	160.2 Å²	160.2	92%	0.922	82%	0.82	S	S	*	*			trans	-118.1	143.9	160.8	-77.2	-176.4	177.3	176.4	0	110.5
70	K	27	Very low	29.9	Very low	202 Å²	202	159.1 Å²	159.1	88%	0.878	81%	0.814	S	S	*	*			trans	-70.3	177	-169.3	-62.7	175.7	173.4	179.3	0	114.1
71	I	28.4	Very low	29.3	Very low	165 Å²	165	160.2 Å²	160.2	85%	0.846	82%	0.821	S	S	*	*			trans	101.8	132.5	161.2	-59.2	162.5	0	0	0	112.2
72	R	26.1	Very low	28.9	Very low	229 Å²	229	157.7 Å²	157.7	86%	0.864	81%	0.809	S	S	*	*			cis	-169.1	158.6	-14.6	177.7	178.9	-169.4	178.3	2.4	107.5
73	L	28	Very low	28.6	Very low	138 Å²	138	155.9 Å²	155.9	72%	0.723	81%	0.805	S	S	*	*			trans	-56.2	148.7	173.6	-75	79	0	0	0	112.6
74	Q	27.5	Very low	28.4	Very low	197 Å²	197	153.1 Å²	153.1	92%	0.921	79%	0.791	S	S	*	*				-152	131.4	127.1	-128.7	161.1	-12.2	0	0	111.8
75	E	27	Very low	28.3	Very low	156 Å²	156	152.7 Å²	152.7	73%	0.729	79%	0.787	S	S	*	*			trans	-79.3	159.6	171.1	-62.6	146.1	145.3	0	0	110
76	L	26.7	Very low	28.1	Very low	173 Å²	173	153.1 Å²	153.1	91%	0.906	79%	0.789	S	S	*	*			trans	-164.3	120.6	136.3	-107	155.1	0	0	0	111
77	E	26.3	Very low	27.9	Very low	166 Å²	166	151.6 Å²	151.6	78%	0.776	79%	0.794	S	S	*	*			trans	-56.3	168.7	154.9	-55.5	158.6	146	0	0	109
78	D	26.7	Very low	27.5	Very low	132 Å²	132	155.4 Å²	155.4	71%	0.706	80%	0.801	S	S	*	*			cis	-164.8	169.1	12.7	-141.2	-14.8	0	0	0	107.9
79	S	26.8	Very low	27.1	Very low	120 Å²	120	152.9 Å²	152.9	84%	0.839	80%	0.798	S	S	*	*			trans	166.4	127.8	138.1	-77.6	0	0	0	0	113
80	I	30.3	Very low	27	Very low	136 Å²	136	155 Å²	155	70%	0.697	80%	0.8	S	S	*	*			trans	-105	141.1	177.7	-67.3	163.4	0	0	0	109.3
81	D	26.4	Very low	26.8	Very low	152 Å²	152	153 Å²	153	81%	0.813	80%	0.797	S	S	*	*			trans	-175.7	151.6	143.2	-98.4	-24.5	0	0	0	108.7
82	N	27.4	Very low	26.6	Very low	105 Å²	105	151 Å²	151	56%	0.561	80%	0.798	S	S	*	*			cis	174.5	130.4	-35.2	-119	-42.3	0	0	0	104.1
83	L	28.2	Very low	26.6	Very low	154 Å²	154	146 Å²	146	81%	0.806	79%	0.793	S	S	*	*			trans	65.1	152.8	147.7	-59.6	166.6	0	0	0	118.8
84	S	27.9	Very low	26.3	Very low	78 Å²	78	144.3 Å²	144.3	55%	0.545	79%	0.792	S	S	.	*			cis	-174.7	172	-16.4	57.1	0	0	0	0	111.6
85	Q	28.2	Very low	26.2	Very low	171 Å²	171	144.3 Å²	144.3	80%	0.799	79%	0.792	S	S	*	*			trans	72.3	123.9	157.5	-66.5	166.7	16.1	0	0	117.3
86	N	28.1	Very low	26.2	Very low	170 Å²	170	145 Å²	145	91%	0.909	80%	0.801	S	S	*	*				82.1	126.8	53.4	-77.6	5	0	0	0	114.5
87	G	26.2	Very low	26.3	Very low	80 Å²	80	140.5 Å²	140.5	83%	0.825	80%	0.797	S	S	*	*			trans	-173.8	118.5	170.2	0	0	0	0	0	111.4
88	E	25	Very low	26.3	Very low	202 Å²	202	137.7 Å²	137.7	94%	0.944	80%	0.795	S	S	*	*			trans	-99.5	150.2	-170.2	-61.6	176.8	121.7	0	0	114.4
89	G	23.3	Very low	27	Very low	72 Å²	72	139.9 Å²	139.9	74%	0.742	81%	0.805	S	S	*	*				90.6	121.3	126.9	0	0	0	0	0	120.4
90	R	25.4	Very low	27.3	Very low	258 Å²	258	138 Å²	138	97%	0.974	80%	0.797	S	S	*	*				-172	159.3	116.2	-102	169.8	-175.3	-165.9	1.3	113.1
91	I	23.3	Very low	27.7	Very low	158 Å²	158	135.8 Å²	135.8	81%	0.81	79%	0.794	S	S	*	*			trans	-110.2	143.5	-169.2	-65.3	164	0	0	0	110.5	V93	I91-V93 HydrophobicContact CG2-CG2 4.03Å
92	S	24.4	Very low	28	Very low	123 Å²	123	138.1 Å²	138.1	86%	0.86	80%	0.796	S	S	*	*			trans	-153.3	151.1	158.9	58.5	0	0	0	0	112.8
93	V	24.6	Very low	28.3	Very low	125 Å²	125	140.4 Å²	140.4	76%	0.758	81%	0.809	S	S	*	*			trans	-143	141.3	-154.5	165.5	0	0	0	0	109.2	I91	I91-V93 HydrophobicContact CG2-CG2 4.03Å
94	S	23.2	Very low	29	Very low	102 Å²	102	136.8 Å²	136.8	71%	0.713	80%	0.796	S	S	*	*			cis	-171.4	159.5	-15.6	53.2	0	0	0	0	108.8
95	Q	25.7	Very low	30	Very low	198 Å²	198	140.8 Å²	140.8	93%	0.925	81%	0.811	S	S	*	*			trans	-152.4	146.1	164.1	-117.8	172	6.7	0	0	113.8
96	D	25.6	Very low	31.7	Very low	169 Å²	169	135.9 Å²	135.9	90%	0.904	79%	0.79	S	S	*	*			trans	-77.1	169.3	-168.6	-67.5	-65	0	0	0	115.5
97	G	28.8	Very low	34.7	Very low	80 Å²	80	134.2 Å²	134.2	83%	0.825	78%	0.781	S	S	*	*			trans	137.6	29.6	144.5	0	0	0	0	0	120
98	S	27.9	Very low	38	Very low	107 Å²	107	131.3 Å²	131.3	75%	0.748	75%	0.748	S	S	*	*			trans	-149.8	118.7	164.9	-172.4	0	0	0	0	112.8	A100	S98-A100 PolarHBondContact O-N 2.74Å
99	I	40	Very low	41.5	Very low	178 Å²	178	121.8 Å²	121.8	91%	0.913	70%	0.703	S	S	*	*			trans	-82.9	66	173.8	-55.3	171.2	0	0	0	109	S101	I99-S101 PolarHBondContact O-N 3.05Å
100	A	33.9	Very low	45	Very low	80 Å²	80	118.3 Å²	118.3	66%	0.661	67%	0.668	S	S	*	*			trans	-76.6	104.3	164.8	0	0	0	0	0	108.5	S98 K102	S98-A100 PolarHBondContact O-N 2.74Å; A100-K102 PolarHBondContact O-N 3.41Å
101	S	37.3	Very low	48.5	Very low	90 Å²	90	106.1 Å²	106.1	63%	0.629	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-56.5	137.7	169.2	-171.5	0	0	0	0	109.4	I99 N103	I99-S101 PolarHBondContact O-N 3.05Å; S101-N103 PolarHBondContact O-N 3.49Å
102	K	34.1	Very low	52	Low	201 Å²	201	98.6 Å²	98.6	87%	0.874	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-58	121.2	-173.4	-70.8	176.8	177.1	176	0	110.8	A100 S104	A100-K102 PolarHBondContact O-N 3.41Å; K102-S104 PolarHBondContact O-N 3.19Å; K102-S104 VanDerWaalsContact O-N 3.14Å
103	N	34.1	Very low	55.5	Low	153 Å²	153	92.8 Å²	92.8	82%	0.818	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-49.3	118.8	176.6	-77	-7.2	0	0	0	111.4	S101	S101-N103 PolarHBondContact O-N 3.49Å
104	S	42.4	Very low	59	Low	77 Å²	77	86.8 Å²	86.8	54%	0.538	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-87.6	137.2	152	70.5	0	0	0	0	107.9	K102 L106	K102-S104 PolarHBondContact O-N 3.19Å; K102-S104 VanDerWaalsContact O-N 3.14Å; S104-L106 PolarHBondContact O-N 2.99Å
105	N	48.7	Very low	62.6	Low	163 Å²	163	82 Å²	82	87%	0.872	47%	0.472	S	S	*	.			trans	-74.9	63.8	179	-74.3	-12.2	0	0	0	110.8
106	L	64.8	Low	66	Low	67 Å²	67	72.5 Å²	72.5	35%	0.351	43%	0.428	S	S	.	.			trans	-113.1	124.1	176.8	-66.4	-178.3	0	0	0	109.5	Y41 S104 V108	Y41-L106 HydrophobicContact CD1-CD1 3.95Å; Y41-L106 HydrophobicContact CD1-CD2 4.24Å; Y41-L106 HydrophobicContact CE1-CD1 4.03Å; Y41-L106 HydrophobicContact CE1-CD2 3.86Å; Y41-L106 HydrophobicContact CE1-CG 4.48Å; S104-L106 PolarHBondContact O-N 2.99Å; L106-V108 PolarHBondContact O-N 3.36Å
107	N	89.1	Confident	69.4	Low	136 Å²	136	65 Å²	65	73%	0.727	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-62.8	132.6	173.6	-70.2	-15.7	0	0	0	109.7	C109 Q117	N107-C109 PolarHBondContact O-N 3.18Å; N107-Q117 PolarHBondContact O-NE2 3.1Å
108	V	96.5	Very high	72.6	Confident	19 Å²	19	65.4 Å²	65.4	12%	0.115	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-71	130.5	178.2	-175.6	0	0	0	0	109.8	L106 N110 P272 A274 V275	L106-V108 PolarHBondContact O-N 3.36Å; V108-N110 PolarHBondContact O-N 3.37Å; V108-N110 VanDerWaalsContact O-N 3.16Å; V108-P272 HydrophobicContact CB-CG 3.76Å; V108-P272 HydrophobicContact CG1-CG 3.41Å; V108-P272 VanDerWaalsContact CG1-CG 3.41Å; V108-A274 WeakPolarHBondContact CG1-O 3.31Å; V108-V275 HydrophobicContact CB-CG1 4.43Å; V108-V275 HydrophobicContact CG1-CG1 3.91Å; V108-V275 HydrophobicContact CG2-CG1 3.74Å
109	C	98	Very high	76	Confident	1 Å²	1	61 Å²	61	1%	0.007	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-59.2	117.6	179.5	-176.8	0	0	0	0	111.2	G19 C21 N107 V111 C112 L113 Q117	G19-C109 WeakPolarHBondContact O-CA 3.27Å; C21-C109 HydrophobicContact CB-CB 3.88Å; C21-C109 PolarHBondContact N-SG 2.88Å; C21-C109 VanDerWaalsContact N-SG 3.35Å; C21-C109 VanDerWaalsContact SG-SG 3.63Å; N107-C109 PolarHBondContact O-N 3.18Å; C109-V111 PolarHBondContact O-N 3.17Å; C109-V111 VanDerWaalsContact O-N 3.12Å; C109-C112 VanDerWaalsContact CB-SG 3.53Å; C109-C112 PolarHBondContact O-N 2.88Å; C109-C112 PolarHBondContact SG-N 3.36Å; C109-L113 WeakPolarHBondContact O-CA 3.29Å; C109-L113 PolarHBondContact O-N 2.94Å; C109-Q117 HydrophobicContact CB-CG 4.46Å
110	N	97.4	Very high	78.7	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-25.9	177.4	63.5	-16.1	0	0	0	114.4	T18 G19 T20 V108 R155 P269	T18-N110 PolarHBondContact O-ND2 2.84Å; G19-N110 PolarHBondContact O-N 3.04Å; G19-N110 PolarHBondContact O-OD1 2.83Å; T20-N110 VanDerWaalsContact CA-OD1 3.25Å; T20-N110 WeakPolarHBondContact CA-OD1 3.45Å; T20-N110 PolarHBondContact N-OD1 2.89Å; T20-N110 PolarHBondContact OG1-OD1 2.91Å; V108-N110 PolarHBondContact O-N 3.37Å; V108-N110 VanDerWaalsContact O-N 3.16Å; N110-R155 WeakPolarHBondContact O-CD 3.4Å; N110-R155 PolarHBondContact O-NH1 2.93Å; N110-P269 HydrophobicContact CB-CB 4.48Å; N110-P269 HydrophobicContact CB-CG 4.24Å; N110-P269 VanDerWaalsContact CB-O 3.27Å; N110-P269 WeakPolarHBondContact CB-O 3.4Å; N110-P269 PolarHBondContact ND2-O 3.2Å
111	V	98.1	Very high	81.7	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.012	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-53.8	177.6	-176.9	0	0	0	0	113	T20 F28 C109 E156 A159 P269	T20-V111 HydrophobicContact CG2-CG2 4.03Å; F28-V111 HydrophobicContact CE2-CG1 4.01Å; F28-V111 HydrophobicContact CE2-CG2 4.12Å; F28-V111 HydrophobicContact CZ-CG1 4.12Å; C109-V111 PolarHBondContact O-N 3.17Å; C109-V111 VanDerWaalsContact O-N 3.12Å; V111-E156 HydrophobicContact CG1-CB 4.49Å; V111-A159 HydrophobicContact CG2-CB 3.65Å; V111-P269 HydrophobicContact CG2-CG 4.26Å
112	C	98.2	Very high	84.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105	-0.9	-168.9	76.8	0	0	0	0	115.4	C24 C109 G114 I115 L116 L182	C24-C112 VanDerWaalsContact SG-CB 3.53Å; C24-C112 PolarHBondContact SG-SG 3.32Å; C109-C112 VanDerWaalsContact CB-SG 3.53Å; C109-C112 PolarHBondContact O-N 2.88Å; C109-C112 PolarHBondContact SG-N 3.36Å; C112-G114 VanDerWaalsContact C-N 3.29Å; C112-G114 PolarHBondContact O-N 3.01Å; C112-I115 HydrophobicContact CB-CB 4.28Å; C112-I115 VanDerWaalsContact O-CB 3.31Å; C112-I115 WeakPolarHBondContact O-CB 3.31Å; C112-I115 WeakPolarHBondContact O-CG1 3.48Å; C112-I115 PolarHBondContact O-N 2.89Å; C112-L116 PolarHBondContact SG-N 2.79Å; C112-L116 VanDerWaalsContact SG-N 3.45Å; C112-L182 HydrophobicContact CB-CD1 3.85Å; C112-L182 HydrophobicContact CB-CD2 4.28Å
113	L	97.7	Very high	87.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	44.1	174.3	-44	-179.6	0	0	0	112.9	C109 L152 H216 P272 V275 C276	C109-L113 WeakPolarHBondContact O-CA 3.29Å; C109-L113 PolarHBondContact O-N 2.94Å; L113-L152 HydrophobicContact CB-CD2 4.19Å; L113-L152 HydrophobicContact CD1-CD2 3.35Å; L113-L152 HydrophobicContact CG-CD2 3.48Å; L113-L152 VanDerWaalsContact CG-CD2 3.48Å; L113-H216 HydrophobicContact CD1-CB 3.92Å; L113-P272 HydrophobicContact CD2-CB 4.22Å; L113-P272 HydrophobicContact CD2-CG 3.62Å; L113-V275 CarbonylContact O-C 3.15Å; L113-C276 PolarHBondContact O-N 2.99Å; L113-C276 PolarHBondContact O-SG 3.32Å; L113-C276 VanDerWaalsContact O-SG 3.4Å
114	G	97.4	Very high	90.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	-12.2	-179.8	0	0	0	0	0	116.5	C112 L116 Q117 E118	C112-G114 VanDerWaalsContact C-N 3.29Å; C112-G114 PolarHBondContact O-N 3.01Å; G114-L116 VanDerWaalsContact C-N 3.32Å; G114-L116 PolarHBondContact O-N 2.91Å; G114-Q117 WeakPolarHBondContact O-CA 3.15Å; G114-Q117 PolarHBondContact O-N 3.1Å; G114-E118 PolarHBondContact O-N 2.88Å
115	I	98.5	Very high	93.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-39.3	-175.5	-66.4	-65	0	0	0	113.2	C112 F119 C120 F148 L152 L182 Y186 F214 C276	C112-I115 HydrophobicContact CB-CB 4.28Å; C112-I115 VanDerWaalsContact O-CB 3.31Å; C112-I115 WeakPolarHBondContact O-CB 3.31Å; C112-I115 WeakPolarHBondContact O-CG1 3.48Å; C112-I115 PolarHBondContact O-N 2.89Å; I115-F119 HydrophobicContact CD1-CD2 4.27Å; I115-C120 PolarHBondContact O-N 2.8Å; I115-F148 HydrophobicContact CD1-CD1 3.9Å; I115-F148 HydrophobicContact CD1-CE1 3.96Å; I115-F148 HydrophobicContact CG1-CD1 4.24Å; I115-F148 HydrophobicContact CG1-CE1 4.3Å; I115-F148 HydrophobicContact CG2-CD1 4.25Å; I115-F148 HydrophobicContact CG2-CE1 3.53Å; I115-F148 HydrophobicContact CG2-CE2 4.49Å; I115-F148 HydrophobicContact CG2-CZ 3.68Å; I115-L152 HydrophobicContact CG1-CD1 4.28Å; I115-L182 HydrophobicContact CG2-CD1 4.04Å; I115-L182 HydrophobicContact CG2-CD2 4.4Å; I115-L182 HydrophobicContact CG2-CG 4.29Å; I115-Y186 HydrophobicContact CG2-CD2 3.55Å; I115-Y186 HydrophobicContact CG2-CE2 3.91Å; I115-Y186 HydrophobicContact CG2-CG 4.24Å; I115-Y186 WeakPolarHBondContact O-CD2 3.3Å; I115-Y186 WeakPolarHBondContact O-CE2 3.32Å; I115-F214 HydrophobicContact CD1-CB 3.99Å; I115-F214 HydrophobicContact CD1-CD1 3.64Å; I115-F214 HydrophobicContact CD1-CD2 3.59Å; I115-F214 HydrophobicContact CD1-CE1 3.91Å; I115-F214 HydrophobicContact CD1-CE2 3.85Å; I115-F214 HydrophobicContact CD1-CG 3.46Å; I115-F214 VanDerWaalsContact CD1-CG 3.46Å; I115-F214 HydrophobicContact CD1-CZ 4.01Å; I115-C276 HydrophobicContact CD1-CB 4.12Å
116	L	98.3	Very high	95.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	24.9	173.3	-62.9	178	0	0	0	113	R23 C112 G114 C120 L182 A185 Y186 I189	R23-L116 HydrophobicContact CB-CB 3.89Å; R23-L116 HydrophobicContact CB-CD1 4.22Å; R23-L116 WeakPolarHBondContact CD-O 3.19Å; R23-L116 PolarHBondContact NH1-O 2.8Å; C112-L116 PolarHBondContact SG-N 2.79Å; C112-L116 VanDerWaalsContact SG-N 3.45Å; G114-L116 VanDerWaalsContact C-N 3.32Å; G114-L116 PolarHBondContact O-N 2.91Å; L116-C120 VanDerWaalsContact C-SG 3.55Å; L116-C120 HydrophobicContact CD2-CB 4.43Å; L116-L182 HydrophobicContact CD1-CD1 3.54Å; L116-L182 HydrophobicContact CD2-CD1 4.34Å; L116-L182 HydrophobicContact CG-CD1 3.61Å; L116-A185 HydrophobicContact CD1-CB 4.34Å; L116-Y186 HydrophobicContact CD2-CD2 4.16Å; L116-I189 HydrophobicContact CD2-CD1 3.84Å
117	Q	97.2	Very high	97.3	Very high	11 Å²	11	36.4 Å²	36.4	5%	0.051	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-103.1	172.5	-56.7	180	-87.4	0	0	107.9	C21 R23 Y41 N107 C109 G114 C120 E121	C21-Q117 HydrophobicContact CB-CG 4.11Å; R23-Q117 PolarHBondContact NH1-O 2.78Å; Y41-Q117 HydrophobicContact CD2-CG 4.44Å; Y41-Q117 HydrophobicContact CE2-CB 4.3Å; Y41-Q117 HydrophobicContact CE2-CG 3.77Å; Y41-Q117 PolarHBondContact OH-NE2 2.93Å; Y41-Q117 VanDerWaalsContact OH-NE2 3.15Å; N107-Q117 PolarHBondContact O-NE2 3.1Å; C109-Q117 HydrophobicContact CB-CG 4.46Å; G114-Q117 WeakPolarHBondContact O-CA 3.15Å; G114-Q117 PolarHBondContact O-N 3.1Å; Q117-C120 PolarHBondContact O-SG 2.94Å; Q117-E121 WeakPolarHBondContact O-CG 3.25Å
118	E	95.6	Very high	97.7	Very high	88 Å²	88	29.9 Å²	29.9	41%	0.411	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-73.4	-33.1	-178.9	56.8	174.8	-147.6	0	0	114	G114 C120 E121 F124	G114-E118 PolarHBondContact O-N 2.88Å; E118-C120 VanDerWaalsContact C-N 3.26Å; E118-C120 PolarHBondContact O-N 2.86Å; E118-E121 PolarHBondContact O-N 3.39Å; E118-E121 VanDerWaalsContact O-N 3.11Å; E118-F124 WeakPolarHBondContact O-CB 3.47Å
119	F	97.9	Very high	97.8	Very high	14 Å²	14	29 Å²	29	6%	0.061	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-75.1	-9.8	-174.1	-63.8	-56.3	0	0	0	114.8	I115 F124 Y186 F214 V275 C276 V278	I115-F119 HydrophobicContact CD1-CD2 4.27Å; F119-F124 HydrophobicContact CB-CD1 4.27Å; F119-F124 HydrophobicContact CB-CE1 4.49Å; F119-F124 HydrophobicContact CD1-CD1 4.25Å; F119-F124 AromaticContact CD1-CD2 3.7Å; F119-F124 HydrophobicContact CD1-CD2 3.7Å; F119-F124 HydrophobicContact CD1-CE1 4.34Å; F119-F124 AromaticContact CD1-CE2 3.86Å; F119-F124 HydrophobicContact CD1-CE2 3.86Å; F119-F124 AromaticContact CD1-CG 3.9Å; F119-F124 HydrophobicContact CD1-CG 3.9Å; F119-F124 HydrophobicContact CD1-CZ 4.15Å; F119-F124 HydrophobicContact CE1-CD2 4.19Å; F119-F124 HydrophobicContact CE1-CE2 4.25Å; F119-F124 WeakPolarHBondContact O-CD1 3.45Å; F119-Y186 HydrophobicContact CB-CE2 4.3Å; F119-Y186 VanDerWaalsContact O-CE2 3.29Å; F119-Y186 WeakPolarHBondContact O-CE2 3.38Å; F119-Y186 PolarHBondContact O-OH 3.32Å; F119-Y186 VanDerWaalsContact O-OH 3.07Å; F119-F214 HydrophobicContact CB-CE1 3.93Å; F119-F214 HydrophobicContact CB-CZ 3.83Å; F119-F214 AromaticContact CD1-CE1 3.59Å; F119-F214 HydrophobicContact CD1-CE1 3.59Å; F119-F214 HydrophobicContact CD1-CZ 4.15Å; F119-F214 HydrophobicContact CD2-CD1 4.39Å; F119-F214 AromaticContact CD2-CE1 3.83Å; F119-F214 HydrophobicContact CD2-CE1 3.83Å; F119-F214 HydrophobicContact CE1-CE1 4.05Å; F119-F214 HydrophobicContact CE2-CE1 4.26Å; F119-F214 HydrophobicContact CG-CD1 4.46Å; F119-F214 AromaticContact CG-CE1 3.49Å; F119-F214 HydrophobicContact CG-CE1 3.49Å; F119-F214 VanDerWaalsContact CG-CE1 3.49Å; F119-F214 AromaticContact CG-CZ 3.93Å; F119-F214 HydrophobicContact CG-CZ 3.93Å; F119-F214 HydrophobicContact CZ-CE1 4.37Å; F119-V275 HydrophobicContact CE2-CB 4.08Å; F119-V275 HydrophobicContact CE2-CG2 4.1Å; F119-V275 HydrophobicContact CZ-CG2 4.18Å; F119-C276 HydrophobicContact CD2-CB 4.38Å; F119-C276 HydrophobicContact CE2-CB 3.9Å; F119-C276 WeakPolarHBondContact CE2-O 3.06Å; F119-C276 WeakPolarHBondContact CZ-O 3.26Å; F119-V278 HydrophobicContact CD1-CG2 4.32Å; F119-V278 HydrophobicContact CE1-CG2 3.84Å; F119-V278 HydrophobicContact CZ-CG2 4.48Å
120	C	97.7	Very high	97.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-101.7	7.5	170.3	67.4	0	0	0	0	113.2	R23 I115 L116 Q117 E118 Y186 I189 T190	R23-C120 PolarHBondContact NH1-SG 2.67Å; I115-C120 PolarHBondContact O-N 2.8Å; L116-C120 VanDerWaalsContact C-SG 3.55Å; L116-C120 HydrophobicContact CD2-CB 4.43Å; Q117-C120 PolarHBondContact O-SG 2.94Å; E118-C120 VanDerWaalsContact C-N 3.26Å; E118-C120 PolarHBondContact O-N 2.86Å; C120-Y186 HydrophobicContact CB-CD2 3.89Å; C120-Y186 HydrophobicContact CB-CE2 3.98Å; C120-I189 HydrophobicContact CB-CB 4.28Å; C120-I189 HydrophobicContact CB-CD1 3.96Å; C120-I189 HydrophobicContact CB-CG2 4.04Å; C120-I189 WeakPolarHBondContact O-CG2 3.24Å; C120-T190 HydrophobicContact CB-CG2 4.16Å
121	E	97.3	Very high	97.8	Very high	64 Å²	64	38.9 Å²	38.9	30%	0.299	18%	0.179	S	C	.	.	S	Bend	trans	-101.5	160.9	-176.1	-69.9	-173.6	169.7	0	0	113.4	R23 Y41 Q117 E118 D123 F124 V125	R23-E121 IonicContact CZ-OE1 2.99Å; R23-E121 IonicContact NH1-OE1 2.63Å; R23-E121 PolarHBondContact NH1-OE1 2.67Å; R23-E121 IonicContact NH2-OE1 2.74Å; R23-E121 PolarHBondContact NH2-OE1 3.02Å; Y41-E121 WeakPolarHBondContact CB-OE1 3.34Å; Y41-E121 PolarHBondContact N-OE1 2.97Å; Q117-E121 WeakPolarHBondContact O-CG 3.25Å; E118-E121 PolarHBondContact O-N 3.39Å; E118-E121 VanDerWaalsContact O-N 3.11Å; E121-D123 VanDerWaalsContact C-N 3.29Å; E121-D123 PolarHBondContact O-N 3.29Å; E121-F124 PolarHBondContact O-N 3.13Å; E121-V125 PolarHBondContact O-N 2.81Å; E121-V125 VanDerWaalsContact O-N 3.13Å
122	K	97.5	Very high	97.8	Very high	85 Å²	85	38.9 Å²	38.9	37%	0.37	18%	0.179	S	C	.	.	H	α-helix	trans	-56.6	-39.1	-169.2	-172.3	163.5	-175.1	164.9	0	113.1	F124 V125 K126 L193 E196 E197	K122-F124 VanDerWaalsContact C-N 3.28Å; K122-F124 PolarHBondContact O-N 2.88Å; K122-V125 PolarHBondContact O-N 3.16Å; K122-K126 WeakPolarHBondContact O-CB 3.31Å; K122-K126 PolarHBondContact O-N 2.87Å; K122-L193 HydrophobicContact CB-CD2 4.28Å; K122-L193 HydrophobicContact CD-CD2 4.44Å; K122-L193 HydrophobicContact CG-CD2 4.41Å; K122-E196 IonicContact NZ-OE1 2.9Å; K122-E196 PolarHBondContact NZ-OE1 3.1Å; K122-E196 IonicContact NZ-OE2 2.85Å; K122-E197 WeakPolarHBondContact CE-OE2 3.32Å
123	D	97.5	Very high	97.8	Very high	124 Å²	124	44.3 Å²	44.3	66%	0.663	20%	0.204	S	C	*	.	H	α-helix	trans	-64.3	-29.9	179.2	-74	-10	0	0	0	113.6	E121 K127	E121-D123 VanDerWaalsContact C-N 3.29Å; E121-D123 PolarHBondContact O-N 3.29Å; D123-K127 WeakPolarHBondContact O-CD 3.38Å; D123-K127 WeakPolarHBondContact O-CE 3.31Å; D123-K127 VanDerWaalsContact O-CG 3.31Å; D123-K127 WeakPolarHBondContact O-CG 3.46Å
124	F	98	Very high	97.8	Very high	19 Å²	19	48.5 Å²	48.5	8%	0.083	24%	0.239	C	C	.	.	H	α-helix	trans	-78.4	-48.8	173.1	175.9	-105.3	0	0	0	111.1	E118 F119 E121 K122 K126 K127 V128 V212 F214 V278	E118-F124 WeakPolarHBondContact O-CB 3.47Å; F119-F124 HydrophobicContact CB-CD1 4.27Å; F119-F124 HydrophobicContact CB-CE1 4.49Å; F119-F124 HydrophobicContact CD1-CD1 4.25Å; F119-F124 AromaticContact CD1-CD2 3.7Å; F119-F124 HydrophobicContact CD1-CD2 3.7Å; F119-F124 HydrophobicContact CD1-CE1 4.34Å; F119-F124 AromaticContact CD1-CE2 3.86Å; F119-F124 HydrophobicContact CD1-CE2 3.86Å; F119-F124 AromaticContact CD1-CG 3.9Å; F119-F124 HydrophobicContact CD1-CG 3.9Å; F119-F124 HydrophobicContact CD1-CZ 4.15Å; F119-F124 HydrophobicContact CE1-CD2 4.19Å; F119-F124 HydrophobicContact CE1-CE2 4.25Å; F119-F124 WeakPolarHBondContact O-CD1 3.45Å; E121-F124 PolarHBondContact O-N 3.13Å; K122-F124 VanDerWaalsContact C-N 3.28Å; K122-F124 PolarHBondContact O-N 2.88Å; F124-K126 VanDerWaalsContact C-N 3.26Å; F124-K126 PolarHBondContact O-N 2.93Å; F124-K127 WeakPolarHBondContact O-CB 3.45Å; F124-K127 PolarHBondContact O-N 3.43Å; F124-V128 HydrophobicContact CD1-CG2 4.26Å; F124-V128 HydrophobicContact CE1-CG2 3.68Å; F124-V128 HydrophobicContact CE2-CG2 4.05Å; F124-V128 HydrophobicContact CZ-CG2 3.56Å; F124-V128 PolarHBondContact O-N 3.02Å; F124-V128 VanDerWaalsContact O-N 3.11Å; F124-V212 HydrophobicContact CZ-CG1 4.14Å; F124-F214 AromaticContact CE1-CZ 3.9Å; F124-F214 HydrophobicContact CE1-CZ 3.9Å; F124-F214 HydrophobicContact CZ-CE1 4.23Å; F124-F214 AromaticContact CZ-CZ 3.89Å; F124-F214 HydrophobicContact CZ-CZ 3.89Å; F124-V278 HydrophobicContact CE2-CG2 3.66Å; F124-V278 HydrophobicContact CZ-CG2 3.96Å
125	V	98.4	Very high	97.8	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.006	26%	0.255	C	S	.	.	H	α-helix	trans	-56.9	-43.1	179.1	177.6	0	0	0	0	110.7	E121 K122 K127 V128 C129 T190 L193 F194	E121-V125 PolarHBondContact O-N 2.81Å; E121-V125 VanDerWaalsContact O-N 3.13Å; K122-V125 PolarHBondContact O-N 3.16Å; V125-K127 VanDerWaalsContact C-N 3.34Å; V125-K127 PolarHBondContact O-N 3.11Å; V125-V128 WeakPolarHBondContact O-CA 3.32Å; V125-V128 WeakPolarHBondContact O-CB 3.18Å; V125-V128 PolarHBondContact O-N 3.49Å; V125-C129 PolarHBondContact O-N 2.8Å; V125-C129 PolarHBondContact O-SG 2.87Å; V125-T190 HydrophobicContact CG2-CG2 3.98Å; V125-L193 HydrophobicContact CB-CB 4.14Å; V125-L193 HydrophobicContact CG1-CB 3.82Å; V125-L193 HydrophobicContact CG2-CB 4.09Å; V125-L193 HydrophobicContact CG2-CD1 3.99Å; V125-F194 HydrophobicContact CG1-CD1 3.76Å; V125-F194 HydrophobicContact CG1-CD2 4.15Å; V125-F194 HydrophobicContact CG1-CE1 3.86Å; V125-F194 HydrophobicContact CG1-CE2 4.24Å; V125-F194 HydrophobicContact CG1-CG 3.89Å; V125-F194 HydrophobicContact CG1-CZ 4.1Å
126	K	98.4	Very high	97.8	Very high	81 Å²	81	52.9 Å²	52.9	35%	0.352	28%	0.277	S	S	.	.	H	α-helix	trans	-56.9	-41	174.9	-176.2	173.1	-171.3	88.7	0	113.3	K122 F124 V128 C129 Q130 E197	K122-K126 WeakPolarHBondContact O-CB 3.31Å; K122-K126 PolarHBondContact O-N 2.87Å; F124-K126 VanDerWaalsContact C-N 3.26Å; F124-K126 PolarHBondContact O-N 2.93Å; K126-V128 VanDerWaalsContact C-N 3.34Å; K126-C129 PolarHBondContact O-N 2.85Å; K126-Q130 WeakPolarHBondContact O-CB 3.42Å; K126-Q130 VanDerWaalsContact O-CG 3.26Å; K126-Q130 WeakPolarHBondContact O-CG 3.05Å; K126-Q130 PolarHBondContact O-N 3.38Å; K126-E197 WeakPolarHBondContact CG-OE1 3.33Å; K126-E197 IonicContact NZ-OE1 2.82Å; K126-E197 PolarHBondContact NZ-OE1 3.23Å
127	K	98.1	Very high	97.8	Very high	119 Å²	119	53.9 Å²	53.9	52%	0.517	28%	0.282	S	S	.	.	H	α-helix	trans	-66.5	-35.5	175.5	-68.8	165.5	-172	170.8	0	112.2	D123 F124 V125 K131	D123-K127 WeakPolarHBondContact O-CD 3.38Å; D123-K127 WeakPolarHBondContact O-CE 3.31Å; D123-K127 VanDerWaalsContact O-CG 3.31Å; D123-K127 WeakPolarHBondContact O-CG 3.46Å; F124-K127 WeakPolarHBondContact O-CB 3.45Å; F124-K127 PolarHBondContact O-N 3.43Å; V125-K127 VanDerWaalsContact C-N 3.34Å; V125-K127 PolarHBondContact O-N 3.11Å; K127-K131 PolarHBondContact O-N 3.48Å
128	V	98.4	Very high	97.8	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65	-50.3	172.6	179.3	0	0	0	0	109.7	F124 V125 K126 Q130 K131 V132 F194 V210 V212 I281	F124-V128 HydrophobicContact CD1-CG2 4.26Å; F124-V128 HydrophobicContact CE1-CG2 3.68Å; F124-V128 HydrophobicContact CE2-CG2 4.05Å; F124-V128 HydrophobicContact CZ-CG2 3.56Å; F124-V128 PolarHBondContact O-N 3.02Å; F124-V128 VanDerWaalsContact O-N 3.11Å; V125-V128 WeakPolarHBondContact O-CA 3.32Å; V125-V128 WeakPolarHBondContact O-CB 3.18Å; V125-V128 PolarHBondContact O-N 3.49Å; K126-V128 VanDerWaalsContact C-N 3.34Å; V128-Q130 PolarHBondContact O-N 2.87Å; V128-K131 WeakPolarHBondContact O-CB 3.45Å; V128-K131 PolarHBondContact O-N 2.78Å; V128-K131 VanDerWaalsContact O-N 3.08Å; V128-V132 HydrophobicContact CG1-CG2 4.47Å; V128-V132 WeakPolarHBondContact O-CG2 3.41Å; V128-V132 PolarHBondContact O-N 3.18Å; V128-F194 HydrophobicContact CB-CE1 3.99Å; V128-F194 HydrophobicContact CB-CZ 4.23Å; V128-F194 HydrophobicContact CG1-CE1 3.6Å; V128-F194 HydrophobicContact CG1-CZ 3.86Å; V128-V210 HydrophobicContact CG1-CG1 3.95Å; V128-V212 HydrophobicContact CG1-CG2 4.05Å; V128-V212 HydrophobicContact CG2-CG2 4.17Å; V128-I281 HydrophobicContact CG1-CG2 3.8Å; V128-I281 HydrophobicContact CG2-CD1 4.03Å; V128-I281 HydrophobicContact CG2-CG1 4.48Å
129	C	98.5	Very high	98	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-56.8	-46.5	178.2	-64.6	0	0	0	0	112.4	V125 K126 K131 V132 E133 E197 L198	V125-C129 PolarHBondContact O-N 2.8Å; V125-C129 PolarHBondContact O-SG 2.87Å; K126-C129 PolarHBondContact O-N 2.85Å; C129-K131 PolarHBondContact O-N 3.15Å; C129-V132 CarbonylContact O-C 3.52Å; C129-V132 WeakPolarHBondContact O-CA 3.27Å; C129-V132 WeakPolarHBondContact O-CB 3.24Å; C129-V132 PolarHBondContact O-N 3.3Å; C129-E133 WeakPolarHBondContact O-CG 3.47Å; C129-E133 PolarHBondContact O-N 3.38Å; C129-E197 HydrophobicContact CB-CB 4.34Å; C129-E197 HydrophobicContact CB-CG 3.82Å; C129-L198 HydrophobicContact CB-CD2 3.76Å; C129-L198 HydrophobicContact CB-CG 4.2Å
130	Q	98.2	Very high	98	Very high	99 Å²	99	58 Å²	58	46%	0.463	31%	0.307	S	S	.	.	H	α-helix	trans	-57.4	-35.7	175.8	-75.6	172.2	-19.9	0	0	113.1	K126 V128 A134	K126-Q130 WeakPolarHBondContact O-CB 3.42Å; K126-Q130 VanDerWaalsContact O-CG 3.26Å; K126-Q130 WeakPolarHBondContact O-CG 3.05Å; K126-Q130 PolarHBondContact O-N 3.38Å; V128-Q130 PolarHBondContact O-N 2.87Å; Q130-A134 WeakPolarHBondContact O-CB 3.34Å; Q130-A134 PolarHBondContact O-N 2.7Å; Q130-A134 VanDerWaalsContact O-N 3.16Å
131	K	97.9	Very high	98	Very high	110 Å²	110	58.8 Å²	58.8	48%	0.478	31%	0.312	S	S	.	.	H	α-helix	trans	-71.1	-39.4	174.9	-162.7	-173.5	-178.3	-172.1	0	111.6	K127 V128 C129 A134 S135 I281	K127-K131 PolarHBondContact O-N 3.48Å; V128-K131 WeakPolarHBondContact O-CB 3.45Å; V128-K131 PolarHBondContact O-N 2.78Å; V128-K131 VanDerWaalsContact O-N 3.08Å; C129-K131 PolarHBondContact O-N 3.15Å; K131-A134 PolarHBondContact O-N 3.1Å; K131-S135 PolarHBondContact O-N 2.93Å; K131-S135 PolarHBondContact O-OG 3.31Å; K131-I281 HydrophobicContact CB-CG2 4.45Å; K131-I281 HydrophobicContact CD-CB 3.81Å; K131-I281 HydrophobicContact CD-CG2 3.82Å; K131-I281 WeakPolarHBondContact CE-O 3.17Å; K131-I281 PolarHBondContact NZ-O 3.18Å
132	V	97.8	Very high	98.1	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-64.3	-45.5	176.8	172.6	0	0	0	0	111.4	V128 C129 A134 S135 F139 L198 F208 V210 C283	V128-V132 HydrophobicContact CG1-CG2 4.47Å; V128-V132 WeakPolarHBondContact O-CG2 3.41Å; V128-V132 PolarHBondContact O-N 3.18Å; C129-V132 CarbonylContact O-C 3.52Å; C129-V132 WeakPolarHBondContact O-CA 3.27Å; C129-V132 WeakPolarHBondContact O-CB 3.24Å; C129-V132 PolarHBondContact O-N 3.3Å; V132-A134 VanDerWaalsContact C-N 3.34Å; V132-A134 PolarHBondContact O-N 2.61Å; V132-S135 WeakPolarHBondContact O-CB 3.15Å; V132-S135 PolarHBondContact O-N 3.38Å; V132-F139 HydrophobicContact CG1-CE1 4.3Å; V132-F139 HydrophobicContact CG1-CZ 4.19Å; V132-L198 HydrophobicContact CG1-CD2 4.42Å; V132-F208 HydrophobicContact CG1-CE1 3.79Å; V132-F208 HydrophobicContact CG1-CZ 3.79Å; V132-V210 HydrophobicContact CG1-CG2 4.11Å; V132-V210 HydrophobicContact CG2-CB 4.45Å; V132-V210 HydrophobicContact CG2-CG1 3.74Å; V132-V210 HydrophobicContact CG2-CG2 3.81Å; V132-C283 HydrophobicContact CG1-CB 4.48Å; V132-C283 HydrophobicContact CG2-CB 4.21Å
133	E	97.8	Very high	98.1	Very high	114 Å²	114	53.4 Å²	53.4	53%	0.533	29%	0.291	S	S	.	.	H	α-helix	trans	-60.6	-43.3	175.5	-68.6	173.8	138.4	0	0	111.5	C129 S135 G136 L198	C129-E133 WeakPolarHBondContact O-CG 3.47Å; C129-E133 PolarHBondContact O-N 3.38Å; E133-S135 PolarHBondContact O-N 3.17Å; E133-G136 PolarHBondContact O-N 2.94Å; E133-G136 VanDerWaalsContact O-N 3.1Å; E133-L198 HydrophobicContact CG-CD2 4.13Å
134	A	98	Very high	98.2	Very high	88 Å²	88	47.6 Å²	47.6	73%	0.727	26%	0.26	S	S	*	.	H	α-helix	trans	-64.8	-20.1	178.1	0	0	0	0	0	113.9	Q130 K131 V132 G136	Q130-A134 WeakPolarHBondContact O-CB 3.34Å; Q130-A134 PolarHBondContact O-N 2.7Å; Q130-A134 VanDerWaalsContact O-N 3.16Å; K131-A134 PolarHBondContact O-N 3.1Å; V132-A134 VanDerWaalsContact C-N 3.34Å; V132-A134 PolarHBondContact O-N 2.61Å; A134-G136 VanDerWaalsContact C-N 3.32Å
135	S	97.3	Very high	98.2	Very high	47 Å²	47	48.1 Å²	48.1	33%	0.329	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-19.7	173.7	-64.9	0	0	0	0	113.4	K131 V132 E133 F137 C283 H364	K131-S135 PolarHBondContact O-N 2.93Å; K131-S135 PolarHBondContact O-OG 3.31Å; V132-S135 WeakPolarHBondContact O-CB 3.15Å; V132-S135 PolarHBondContact O-N 3.38Å; E133-S135 PolarHBondContact O-N 3.17Å; S135-F137 PolarHBondContact O-N 2.83Å; S135-C283 VanDerWaalsContact CB-SG 3.59Å; S135-C283 PolarHBondContact OG-SG 3.16Å; S135-H364 PolarHBondContact O-CD2 2.84Å
136	G	97.6	Very high	98.1	Very high	46 Å²	46	48.2 Å²	48.2	47%	0.474	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	31.3	170.9	0	0	0	0	0	115.8	E133 A134	E133-G136 PolarHBondContact O-N 2.94Å; E133-G136 VanDerWaalsContact O-N 3.1Å; A134-G136 VanDerWaalsContact C-N 3.32Å
137	F	98.6	Very high	98.1	Very high	21 Å²	21	47.3 Å²	47.3	9%	0.092	27%	0.271	C	S	.	.			trans	-78.5	143.4	170.3	-74.6	-85.7	0	0	0	112	S135 F139 F208 C283 H285 N362 H364	S135-F137 PolarHBondContact O-N 2.83Å; F137-F139 HydrophobicContact CB-CD1 4.03Å; F137-F139 HydrophobicContact CB-CE1 4.44Å; F137-F139 WeakPolarHBondContact O-CD1 3.5Å; F137-F139 WeakPolarHBondContact O-CE1 3.3Å; F137-F208 HydrophobicContact CB-CD2 4.27Å; F137-F208 HydrophobicContact CB-CE2 3.54Å; F137-F208 HydrophobicContact CB-CZ 4Å; F137-F208 HydrophobicContact CD1-CE2 4.11Å; F137-F208 AromaticContact CD2-CE2 3.76Å; F137-F208 HydrophobicContact CD2-CE2 3.76Å; F137-F208 HydrophobicContact CD2-CZ 4.26Å; F137-F208 HydrophobicContact CE2-CE2 4.49Å; F137-F208 HydrophobicContact CG-CD2 4.36Å; F137-F208 AromaticContact CG-CE2 3.54Å; F137-F208 HydrophobicContact CG-CE2 3.54Å; F137-F208 HydrophobicContact CG-CZ 4.28Å; F137-C283 WeakPolarHBondContact CE2-O 3.47Å; F137-H285 HydrophobicContact CD1-CB 3.84Å; F137-H285 HydrophobicContact CE1-CB 3.98Å; F137-N362 VanDerWaalsContact CE1-OD1 3.25Å; F137-N362 WeakPolarHBondContact CE1-OD1 3.4Å; F137-N362 WeakPolarHBondContact CZ-OD1 3.4Å; F137-H364 HydrophobicContact CD1-CB 4.22Å; F137-H364 AromaticContact CD1-CD2 3.93Å; F137-H364 AromaticContact CD1-CG 3.93Å; F137-H364 HydrophobicContact CE1-CB 4.44Å; F137-H364 AromaticContact CE1-CD2 3.71Å; F137-H364 AromaticContact CE1-CE1 3.75Å; F137-H364 AromaticContact CE1-CG 3.73Å; F137-H364 AromaticContact CE1-ND1 3.77Å; F137-H364 AromaticContact CE1-NE2 3.76Å; F137-H364 AromaticContact CE2-CD2 3.83Å; F137-H364 AromaticContact CE2-NE2 3.66Å; F137-H364 AromaticContact CZ-CD2 3.65Å; F137-H364 AromaticContact CZ-CE1 3.59Å; F137-H364 AromaticContact CZ-NE2 3.32Å; F137-H364 VanDerWaalsContact CZ-NE2 3.32Å; F137-H364 WeakPolarHBondContact CZ-NE2 3.36Å
138	E	98.4	Very high	98	Very high	64 Å²	64	42.4 Å²	42.4	30%	0.299	25%	0.249	S	C	.	.			trans	-82.3	129.6	160.6	-73.3	176.9	178.8	0	0	110.8	H285 H364 R365 V366 H367	E138-H285 PolarHBondContact O-CD2 2.65Å; E138-H364 PolarHBondContact N-O 2.81Å; E138-R365 WeakPolarHBondContact OE2-CA 3.46Å; E138-R365 WeakPolarHBondContact OE2-CG 3.3Å; E138-V366 HydrophobicContact CB-CG2 3.94Å; E138-V366 PolarHBondContact OE2-N 3.22Å; E138-H367 IonicContact OE2-CD2 3.22Å; E138-H367 IonicContact OE2-CG 2.67Å; E138-H367 PolarHBondContact OE2-N 3.05Å
139	F	98.3	Very high	97.9	Very high	40 Å²	40	42.6 Å²	42.6	18%	0.175	25%	0.25	C	S	.	.			trans	-158	154.5	175.6	55.8	-88.5	0	0	0	111.3	V132 F137 V200 F208	V132-F139 HydrophobicContact CG1-CE1 4.3Å; V132-F139 HydrophobicContact CG1-CZ 4.19Å; F137-F139 HydrophobicContact CB-CD1 4.03Å; F137-F139 HydrophobicContact CB-CE1 4.44Å; F137-F139 WeakPolarHBondContact O-CD1 3.5Å; F137-F139 WeakPolarHBondContact O-CE1 3.3Å; F139-V200 HydrophobicContact CD2-CG1 4.4Å; F139-V200 HydrophobicContact CD2-CG2 4.05Å; F139-V200 HydrophobicContact CE2-CG1 4.41Å; F139-V200 HydrophobicContact CE2-CG2 3.75Å; F139-F208 HydrophobicContact CB-CB 3.67Å; F139-F208 HydrophobicContact CB-CD1 3.68Å; F139-F208 HydrophobicContact CB-CD2 4.24Å; F139-F208 HydrophobicContact CB-CE1 4.37Å; F139-F208 HydrophobicContact CB-CG 3.6Å; F139-F208 AromaticContact CD1-CD1 3.6Å; F139-F208 HydrophobicContact CD1-CD1 3.6Å; F139-F208 HydrophobicContact CD1-CD2 4.23Å; F139-F208 AromaticContact CD1-CE1 3.37Å; F139-F208 HydrophobicContact CD1-CE1 3.37Å; F139-F208 HydrophobicContact CD1-CE2 4.05Å; F139-F208 HydrophobicContact CD1-CG 4.02Å; F139-F208 AromaticContact CD1-CZ 3.6Å; F139-F208 HydrophobicContact CD1-CZ 3.6Å; F139-F208 AromaticContact CD2-CD1 3.69Å; F139-F208 HydrophobicContact CD2-CD1 3.69Å; F139-F208 AromaticContact CD2-CE1 3.94Å; F139-F208 HydrophobicContact CD2-CE1 3.94Å; F139-F208 HydrophobicContact CD2-CG 4.49Å; F139-F208 HydrophobicContact CE1-CD1 4.13Å; F139-F208 AromaticContact CE1-CE1 3.48Å; F139-F208 HydrophobicContact CE1-CE1 3.48Å; F139-F208 VanDerWaalsContact CE1-CE1 3.48Å; F139-F208 AromaticContact CE1-CZ 3.72Å; F139-F208 HydrophobicContact CE1-CZ 3.72Å; F139-F208 HydrophobicContact CE2-CD1 4.22Å; F139-F208 HydrophobicContact CE2-CE1 4.03Å; F139-F208 HydrophobicContact CG-CB 4.34Å; F139-F208 AromaticContact CG-CD1 3.36Å; F139-F208 HydrophobicContact CG-CD1 3.36Å; F139-F208 HydrophobicContact CG-CD2 4.42Å; F139-F208 AromaticContact CG-CE1 3.62Å; F139-F208 HydrophobicContact CG-CE1 3.62Å; F139-F208 AromaticContact CG-CG 3.8Å; F139-F208 HydrophobicContact CG-CG 3.8Å; F139-F208 HydrophobicContact CG-CZ 4.26Å; F139-F208 HydrophobicContact CZ-CD1 4.42Å; F139-F208 AromaticContact CZ-CE1 3.82Å; F139-F208 HydrophobicContact CZ-CE1 3.82Å; F139-F208 HydrophobicContact CZ-CZ 4.44Å
140	T	98.1	Very high	97.8	Very high	95 Å²	95	44.4 Å²	44.4	58%	0.583	26%	0.262	S	S	*	.	S	Bend	trans	-118.7	-8.8	179.2	52.8	0	0	0	0	114.2	P201	T140-P201 WeakPolarHBondContact O-CD 3.26Å
141	S	98.6	Very high	97.6	Very high	16 Å²	16	40 Å²	40	11%	0.112	24%	0.242	C	C	.	.	S	Bend	trans	-157.3	162.7	172.1	64.8	0	0	0	0	108.3	P201 S206	S141-P201 VanDerWaalsContact CA-O 3.28Å; S141-P201 WeakPolarHBondContact CA-O 3.23Å; S141-P201 WeakPolarHBondContact CB-O 3.42Å; S141-S206 PolarHBondContact O-OG 3.04Å; S141-S206 WeakPolarHBondContact OG-CB 3.18Å; S141-S206 PolarHBondContact OG-OG 2.85Å
142	L	98.5	Very high	97.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-129.3	149.8	173.6	71	150.1	0	0	0	113.4	L198 V200 P201 I202 D203 F208 V210	L142-L198 HydrophobicContact CD1-CD1 4.06Å; L142-L198 HydrophobicContact CD2-CD1 4.03Å; L142-V200 HydrophobicContact CD2-CG2 3.51Å; L142-P201 PolarHBondContact N-O 2.65Å; L142-I202 HydrophobicContact CD1-CD1 4.06Å; L142-I202 HydrophobicContact CD2-CD1 3.61Å; L142-I202 HydrophobicContact CG-CD1 3.64Å; L142-I202 CarbonylContact O-C 3.52Å; L142-I202 WeakPolarHBondContact O-CA 3.47Å; L142-D203 PolarHBondContact O-N 2.86Å; L142-F208 CarbonylContact C-O 3.45Å; L142-F208 WeakPolarHBondContact CA-O 3.33Å; L142-F208 HydrophobicContact CB-CD1 3.98Å; L142-V210 HydrophobicContact CB-CG2 4.48Å; L142-V210 HydrophobicContact CD1-CB 3.99Å; L142-V210 HydrophobicContact CD1-CG2 3.66Å
143	V	98.4	Very high	97.5	Very high	36 Å²	36	35.1 Å²	35.1	22%	0.218	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	121.6	160.4	63.6	0	0	0	0	108.6	D203 F208 E209 V210	V143-D203 WeakPolarHBondContact CB-O 3.33Å; V143-F208 PolarHBondContact N-O 2.89Å; V143-E209 HydrophobicContact CG1-CB 3.78Å; V143-E209 HydrophobicContact CG1-CG 4.07Å; V143-E209 WeakPolarHBondContact O-CA 3.44Å; V143-V210 PolarHBondContact O-N 2.86Å
144	F	98.3	Very high	97.5	Very high	3 Å²	3	29.7 Å²	29.7	1%	0.013	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	125.7	176.9	177.9	-121.7	0	0	0	111.4	V146 Y186 K187 F194 V210 V212	F144-V146 HydrophobicContact CE1-CB 4.1Å; F144-V146 HydrophobicContact CE1-CG1 4.29Å; F144-V146 HydrophobicContact CZ-CB 3.92Å; F144-V146 HydrophobicContact CZ-CG2 4.43Å; F144-Y186 HydrophobicContact CE1-CD1 4.09Å; F144-Y186 AromaticContact CE1-CE1 3.62Å; F144-Y186 HydrophobicContact CE1-CE1 3.62Å; F144-Y186 AromaticContact CZ-CE1 3.8Å; F144-Y186 HydrophobicContact CZ-CE1 3.8Å; F144-K187 HydrophobicContact CD1-CG 4.35Å; F144-K187 WeakPolarHBondContact O-CE 3.39Å; F144-K187 PolarHBondContact O-NZ 3.2Å; F144-F194 HydrophobicContact CD1-CD2 4.31Å; F144-F194 AromaticContact CD1-CE2 3.94Å; F144-F194 HydrophobicContact CD1-CE2 3.94Å; F144-F194 HydrophobicContact CD2-CD2 4.24Å; F144-F194 AromaticContact CD2-CE2 3.61Å; F144-F194 HydrophobicContact CD2-CE2 3.61Å; F144-F194 AromaticContact CD2-CZ 3.84Å; F144-F194 HydrophobicContact CD2-CZ 3.84Å; F144-F194 AromaticContact CE1-CE2 3.84Å; F144-F194 HydrophobicContact CE1-CE2 3.84Å; F144-F194 AromaticContact CE2-CE2 3.52Å; F144-F194 HydrophobicContact CE2-CE2 3.52Å; F144-F194 AromaticContact CE2-CZ 3.57Å; F144-F194 HydrophobicContact CE2-CZ 3.57Å; F144-F194 HydrophobicContact CG-CD2 4.14Å; F144-F194 AromaticContact CG-CE2 3.84Å; F144-F194 HydrophobicContact CG-CE2 3.84Å; F144-F194 AromaticContact CZ-CE2 3.64Å; F144-F194 HydrophobicContact CZ-CE2 3.64Å; F144-F194 HydrophobicContact CZ-CZ 4.02Å; F144-V210 HydrophobicContact CD2-CB 4.47Å; F144-V210 HydrophobicContact CD2-CG1 4.39Å; F144-V210 WeakPolarHBondContact CD2-O 3.32Å; F144-V212 HydrophobicContact CE2-CB 4.4Å; F144-V212 HydrophobicContact CE2-CG2 3.93Å; F144-V212 HydrophobicContact CZ-CG2 4.41Å
145	S	97.8	Very high	97.5	Very high	30 Å²	30	26.1 Å²	26.1	21%	0.21	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	137.1	-177.7	-158.6	0	0	0	0	110.2	E209 V210 S211 V212	S145-E209 WeakPolarHBondContact CB-OE1 3.33Å; S145-E209 PolarHBondContact OG-OE1 2.92Å; S145-V210 PolarHBondContact N-O 2.82Å; S145-S211 WeakPolarHBondContact O-CA 3.41Å; S145-V212 PolarHBondContact O-N 2.97Å
146	V	97.5	Very high	97.5	Very high	3 Å²	3	25.2 Å²	25.2	2%	0.018	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	132.9	-179.5	66.6	0	0	0	0	111.3	F144 F148 K183 Y186 V212 F214	F144-V146 HydrophobicContact CE1-CB 4.1Å; F144-V146 HydrophobicContact CE1-CG1 4.29Å; F144-V146 HydrophobicContact CZ-CB 3.92Å; F144-V146 HydrophobicContact CZ-CG2 4.43Å; V146-F148 HydrophobicContact CB-CE1 4.45Å; V146-F148 HydrophobicContact CG1-CE1 4.23Å; V146-F148 HydrophobicContact CG1-CZ 3.97Å; V146-F148 HydrophobicContact CG2-CD1 3.91Å; V146-F148 HydrophobicContact CG2-CE1 3.38Å; V146-F148 HydrophobicContact CG2-CZ 3.99Å; V146-K183 HydrophobicContact CG1-CD 3.99Å; V146-K183 HydrophobicContact CG1-CG 3.87Å; V146-K183 WeakPolarHBondContact O-CE 3.28Å; V146-K183 PolarHBondContact O-NZ 3.4Å; V146-Y186 HydrophobicContact CB-CE1 4.27Å; V146-Y186 HydrophobicContact CG1-CD1 4.07Å; V146-Y186 HydrophobicContact CG1-CE1 4.23Å; V146-Y186 HydrophobicContact CG2-CD1 4.43Å; V146-Y186 HydrophobicContact CG2-CE1 3.89Å; V146-V212 WeakPolarHBondContact CA-O 3.33Å; V146-F214 HydrophobicContact CG2-CD2 3.89Å; V146-F214 HydrophobicContact CG2-CE2 3.75Å
147	S	97.3	Very high	97.4	Very high	62 Å²	62	23.4 Å²	23.4	43%	0.434	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128.7	177.3	-72.2	0	0	0	0	109.1	V212 F214	S147-V212 PolarHBondContact N-O 3.13Å; S147-F214 PolarHBondContact O-N 3.28Å
148	F	97.2	Very high	97.4	Very high	16 Å²	16	22.4 Å²	22.4	7%	0.07	13%	0.129	C	C	.	.			trans	-109.6	158.3	-179.6	-60.5	-41.4	0	0	0	111.2	I115 V146 L152 L182 K183 Y186 F214	I115-F148 HydrophobicContact CD1-CD1 3.9Å; I115-F148 HydrophobicContact CD1-CE1 3.96Å; I115-F148 HydrophobicContact CG1-CD1 4.24Å; I115-F148 HydrophobicContact CG1-CE1 4.3Å; I115-F148 HydrophobicContact CG2-CD1 4.25Å; I115-F148 HydrophobicContact CG2-CE1 3.53Å; I115-F148 HydrophobicContact CG2-CE2 4.49Å; I115-F148 HydrophobicContact CG2-CZ 3.68Å; V146-F148 HydrophobicContact CB-CE1 4.45Å; V146-F148 HydrophobicContact CG1-CE1 4.23Å; V146-F148 HydrophobicContact CG1-CZ 3.97Å; V146-F148 HydrophobicContact CG2-CD1 3.91Å; V146-F148 HydrophobicContact CG2-CE1 3.38Å; V146-F148 HydrophobicContact CG2-CZ 3.99Å; F148-L152 HydrophobicContact CB-CD1 3.87Å; F148-L152 HydrophobicContact CG-CD1 4.29Å; F148-L182 HydrophobicContact CD2-CD2 3.99Å; F148-L182 HydrophobicContact CD2-CG 4.22Å; F148-L182 HydrophobicContact CE2-CB 4.38Å; F148-L182 HydrophobicContact CE2-CD2 4.04Å; F148-L182 HydrophobicContact CE2-CG 3.78Å; F148-L182 HydrophobicContact CZ-CG 4.36Å; F148-K183 HydrophobicContact CE2-CB 3.77Å; F148-K183 HydrophobicContact CE2-CG 4.39Å; F148-Y186 HydrophobicContact CE1-CD1 4.44Å; F148-Y186 HydrophobicContact CZ-CD1 4.04Å; F148-Y186 HydrophobicContact CZ-CD2 4.48Å; F148-Y186 AromaticContact CZ-CG 3.99Å; F148-Y186 HydrophobicContact CZ-CG 3.99Å; F148-F214 AromaticContact CD1-CD2 3.84Å; F148-F214 HydrophobicContact CD1-CD2 3.84Å; F148-F214 HydrophobicContact CE1-CD2 4.01Å; F148-F214 HydrophobicContact CE1-CE2 4.24Å
149	P	96.6	Very high	97.3	Very high	4 Å²	4	19.4 Å²	19.4	3%	0.026	12%	0.115	C	C	.	.			trans	-54.5	127.1	175.6	-21.1	30.1	0	0	0	110.6	Q151 L152 F214 H216	P149-Q151 HydrophobicContact CB-CG 4.08Å; P149-Q151 VanDerWaalsContact CB-OE1 3.23Å; P149-Q151 PolarHBondContact O-N 3.24Å; P149-Q151 VanDerWaalsContact O-N 3.1Å; P149-L152 HydrophobicContact CB-CG 4.31Å; P149-L152 HydrophobicContact CG-CG 4.38Å; P149-L152 WeakPolarHBondContact O-CB 3.49Å; P149-L152 WeakPolarHBondContact O-CG 3.44Å; P149-L152 PolarHBondContact O-N 2.97Å; P149-F214 WeakPolarHBondContact CD-O 3.06Å; P149-F214 HydrophobicContact CG-CB 4.47Å; P149-H216 HydrophobicContact CB-CB 4.35Å; P149-H216 HydrophobicContact CG-CB 4Å
150	P	95.1	Very high	97.3	Very high	38 Å²	38	19.3 Å²	19.3	25%	0.247	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-32.6	-177.6	-28.9	36	0	0	0	114	L152 S153 F244 V249	P150-L152 PolarHBondContact O-N 2.73Å; P150-S153 PolarHBondContact O-N 2.99Å; P150-F244 WeakPolarHBondContact CB-O 3.38Å; P150-F244 WeakPolarHBondContact CG-O 3.11Å; P150-V249 HydrophobicContact CB-CG2 4.07Å
151	Q	95	Very high	97.2	Very high	7 Å²	7	15 Å²	15	3%	0.033	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-18.3	176.5	63.4	-93	42.9	0	0	115.2	P149 S153 V154 R155 H216 T219 D222	P149-Q151 HydrophobicContact CB-CG 4.08Å; P149-Q151 VanDerWaalsContact CB-OE1 3.23Å; P149-Q151 PolarHBondContact O-N 3.24Å; P149-Q151 VanDerWaalsContact O-N 3.1Å; Q151-S153 PolarHBondContact O-N 2.87Å; Q151-S153 VanDerWaalsContact O-N 3.16Å; Q151-V154 VanDerWaalsContact O-CB 3.32Å; Q151-V154 WeakPolarHBondContact O-CB 3.44Å; Q151-V154 PolarHBondContact O-N 3.25Å; Q151-R155 PolarHBondContact O-N 2.9Å; Q151-H216 PolarHBondContact NE2-O 3.26Å; Q151-T219 VanDerWaalsContact CG-O 3.25Å; Q151-T219 WeakPolarHBondContact CG-O 3.21Å; Q151-T219 PolarHBondContact NE2-O 3.4Å; Q151-T219 PolarHBondContact NE2-OG1 3.05Å; Q151-D222 HydrophobicContact CB-CB 3.75Å; Q151-D222 HydrophobicContact CG-CB 4.45Å
152	L	97	Very high	97	Very high	6 Å²	6	15 Å²	15	3%	0.031	9%	0.085	C	C	.	.	H	α-helix	trans	-57.3	-32.9	175.1	-70.3	-164	0	0	0	111.6	L113 I115 F148 P149 P150 V154 R155 E156 L182	L113-L152 HydrophobicContact CB-CD2 4.19Å; L113-L152 HydrophobicContact CD1-CD2 3.35Å; L113-L152 HydrophobicContact CG-CD2 3.48Å; L113-L152 VanDerWaalsContact CG-CD2 3.48Å; I115-L152 HydrophobicContact CG1-CD1 4.28Å; F148-L152 HydrophobicContact CB-CD1 3.87Å; F148-L152 HydrophobicContact CG-CD1 4.29Å; P149-L152 HydrophobicContact CB-CG 4.31Å; P149-L152 HydrophobicContact CG-CG 4.38Å; P149-L152 WeakPolarHBondContact O-CB 3.49Å; P149-L152 WeakPolarHBondContact O-CG 3.44Å; P149-L152 PolarHBondContact O-N 2.97Å; P150-L152 PolarHBondContact O-N 2.73Å; L152-V154 PolarHBondContact O-N 2.9Å; L152-R155 PolarHBondContact O-N 3.3Å; L152-E156 VanDerWaalsContact O-CB 3.27Å; L152-E156 WeakPolarHBondContact O-CB 3.37Å; L152-E156 PolarHBondContact O-N 2.95Å; L152-L182 HydrophobicContact CD1-CD2 3.44Å; L152-L182 VanDerWaalsContact CD1-CD2 3.44Å
153	S	96.7	Very high	96.9	Very high	2 Å²	2	15.1 Å²	15.1	1%	0.014	9%	0.086	C	C	.	.	H	α-helix	trans	-63.4	-27.8	176.4	-70.3	0	0	0	0	113.2	P150 Q151 H157 M250 L253	P150-S153 PolarHBondContact O-N 2.99Å; Q151-S153 PolarHBondContact O-N 2.87Å; Q151-S153 VanDerWaalsContact O-N 3.16Å; S153-H157 WeakPolarHBondContact O-CB 3.37Å; S153-H157 PolarHBondContact O-N 3.06Å; S153-M250 PolarHBondContact OG-SD 2.85Å; S153-M250 VanDerWaalsContact OG-SD 3.4Å; S153-L253 VanDerWaalsContact C-CD1 3.45Å; S153-L253 WeakPolarHBondContact O-CD1 3.36Å
154	V	97.3	Very high	96.7	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-70.5	-47.8	174.7	-176.1	0	0	0	0	110.1	Q151 L152 E156 H157 A158 C223 F225 L226 V249 L253 F261 F265	Q151-V154 VanDerWaalsContact O-CB 3.32Å; Q151-V154 WeakPolarHBondContact O-CB 3.44Å; Q151-V154 PolarHBondContact O-N 3.25Å; L152-V154 PolarHBondContact O-N 2.9Å; V154-E156 PolarHBondContact O-N 3.18Å; V154-H157 WeakPolarHBondContact O-CB 3.49Å; V154-H157 PolarHBondContact O-N 2.89Å; V154-A158 PolarHBondContact O-N 2.95Å; V154-C223 HydrophobicContact CG2-CB 4.06Å; V154-F225 HydrophobicContact CG1-CE1 3.87Å; V154-F225 HydrophobicContact CG1-CZ 4.25Å; V154-L226 HydrophobicContact CG2-CD1 4.03Å; V154-V249 HydrophobicContact CG2-CG1 4.01Å; V154-L253 HydrophobicContact CG2-CD1 4.46Å; V154-F261 HydrophobicContact CG1-CE2 3.85Å; V154-F261 HydrophobicContact CG1-CZ 3.98Å; V154-F265 HydrophobicContact CG1-CB 4.4Å; V154-F265 HydrophobicContact CG1-CD1 3.85Å; V154-F265 HydrophobicContact CG1-CD2 3.52Å; V154-F265 HydrophobicContact CG1-CE1 3.97Å; V154-F265 HydrophobicContact CG1-CE2 3.67Å; V154-F265 HydrophobicContact CG1-CG 3.62Å; V154-F265 HydrophobicContact CG1-CZ 3.89Å
155	R	97.8	Very high	96.4	Very high	13 Å²	13	22.6 Å²	22.6	5%	0.049	12%	0.117	C	C	.	.	H	α-helix	trans	-64	-40	178.1	-68.6	171.2	169.5	-87.4	-15.5	112.5	N110 Q151 L152 A158 A159 D222 F265 P269 N270	N110-R155 WeakPolarHBondContact O-CD 3.4Å; N110-R155 PolarHBondContact O-NH1 2.93Å; Q151-R155 PolarHBondContact O-N 2.9Å; L152-R155 PolarHBondContact O-N 3.3Å; R155-A158 PolarHBondContact O-N 2.85Å; R155-A159 WeakPolarHBondContact O-CB 3.22Å; R155-A159 PolarHBondContact O-N 2.7Å; R155-D222 IonicContact CZ-OD2 3.87Å; R155-D222 IonicContact NE-OD2 2.72Å; R155-D222 PolarHBondContact NE-OD2 2.91Å; R155-D222 IonicContact NH2-OD1 3.85Å; R155-D222 IonicContact NH2-OD2 3.7Å; R155-D222 PolarHBondContact NH2-OD2 3Å; R155-F265 HydrophobicContact CG-CE1 4.27Å; R155-F265 HydrophobicContact CG-CZ 3.83Å; R155-P269 HydrophobicContact CB-CB 4.23Å; R155-P269 HydrophobicContact CG-CB 4.13Å; R155-N270 PolarHBondContact NH1-O 2.74Å
156	E	97.1	Very high	96.2	Very high	28 Å²	28	22.6 Å²	22.6	13%	0.131	11%	0.114	C	C	.	.	H	α-helix	trans	-65	-37.2	173.9	-177.2	157.6	-115	0	0	112.2	R27 V111 L152 V154 W160	R27-E156 IonicContact CZ-OE1 3.18Å; R27-E156 IonicContact NH1-OE1 2.81Å; R27-E156 PolarHBondContact NH1-OE1 3.41Å; R27-E156 IonicContact NH2-OE1 3.8Å; R27-E156 PolarHBondContact NH2-OE1 2.94Å; V111-E156 HydrophobicContact CG1-CB 4.49Å; L152-E156 VanDerWaalsContact O-CB 3.27Å; L152-E156 WeakPolarHBondContact O-CB 3.37Å; L152-E156 PolarHBondContact O-N 2.95Å; V154-E156 PolarHBondContact O-N 3.18Å; E156-W160 WeakPolarHBondContact O-CB 2.95Å; E156-W160 PolarHBondContact O-N 3.37Å
157	H	96.9	Very high	95.9	Very high	8 Å²	8	23.7 Å²	23.7	4%	0.037	12%	0.119	C	C	.	.	H	α-helix	trans	-68.5	-42.3	173.3	-170.4	89.5	0	0	0	112.3	S153 V154 W160 L161 R176 L253 F261	S153-H157 WeakPolarHBondContact O-CB 3.37Å; S153-H157 PolarHBondContact O-N 3.06Å; V154-H157 WeakPolarHBondContact O-CB 3.49Å; V154-H157 PolarHBondContact O-N 2.89Å; H157-W160 AromaticContact CE1-CE3 3.88Å; H157-W160 AromaticContact CE1-CZ3 3.62Å; H157-W160 AromaticContact ND1-CE3 3.9Å; H157-W160 PolarHBondContact O-N 3.23Å; H157-L161 WeakPolarHBondContact O-CG 3.33Å; H157-L161 PolarHBondContact O-N 3.27Å; H157-R176 PolarHBondContact ND1-NH1 3.01Å; H157-L253 HydrophobicContact CB-CD1 4.31Å; H157-L253 HydrophobicContact CB-CD2 4.09Å; H157-L253 PolarHBondContact CE1-O 3.42Å; H157-F261 HydrophobicContact CB-CE2 4.3Å; H157-F261 HydrophobicContact CB-CZ 4.27Å; H157-F261 AromaticContact CD2-CD1 3.98Å; H157-F261 AromaticContact CD2-CD2 3.64Å; H157-F261 AromaticContact CD2-CE1 3.92Å; H157-F261 AromaticContact CD2-CE2 3.56Å; H157-F261 AromaticContact CD2-CG 3.86Å; H157-F261 AromaticContact CD2-CZ 3.72Å
158	A	97.6	Very high	95.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-60.2	-46.8	174.7	0	0	0	0	0	111.9	V154 R155 W160 L161 L162 F261 F265 P266 C267 P269	V154-A158 PolarHBondContact O-N 2.95Å; R155-A158 PolarHBondContact O-N 2.85Å; A158-W160 PolarHBondContact O-N 2.95Å; A158-L161 PolarHBondContact O-N 2.81Å; A158-L162 PolarHBondContact O-N 3.43Å; A158-F261 HydrophobicContact CB-CE1 3.82Å; A158-F261 HydrophobicContact CB-CZ 3.93Å; A158-F265 HydrophobicContact CB-CD1 3.82Å; A158-F265 HydrophobicContact CB-CE1 3.87Å; A158-P266 WeakPolarHBondContact CB-O 3.33Å; A158-C267 PolarHBondContact O-SG 3.3Å; A158-P269 HydrophobicContact CB-CB 4.5Å; A158-P269 HydrophobicContact CB-CG 4.47Å
159	A	97.3	Very high	95.3	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-64.4	-38.5	175.9	0	0	0	0	0	112.5	F28 V111 R155 L161 L162 V163	F28-A159 HydrophobicContact CE1-CB 3.87Å; F28-A159 HydrophobicContact CE2-CB 3.91Å; F28-A159 HydrophobicContact CZ-CB 3.38Å; V111-A159 HydrophobicContact CG2-CB 3.65Å; R155-A159 WeakPolarHBondContact O-CB 3.22Å; R155-A159 PolarHBondContact O-N 2.7Å; A159-L161 PolarHBondContact O-N 2.67Å; A159-L162 PolarHBondContact O-N 2.93Å; A159-V163 VanDerWaalsContact O-CG2 3.29Å; A159-V163 WeakPolarHBondContact O-CG2 3.34Å; A159-V163 PolarHBondContact O-N 3.28Å
160	W	96.8	Very high	95	Very high	37 Å²	37	31 Å²	31	14%	0.14	16%	0.157	C	C	.	.	H	α-helix	trans	-60.6	-43.5	172.1	167.5	68.1	0	0	0	112.4	F28 E156 H157 A158 L162 V163 K164 R176 I179	F28-W160 HydrophobicContact CE1-CB 4.35Å; E156-W160 WeakPolarHBondContact O-CB 2.95Å; E156-W160 PolarHBondContact O-N 3.37Å; H157-W160 AromaticContact CE1-CE3 3.88Å; H157-W160 AromaticContact CE1-CZ3 3.62Å; H157-W160 AromaticContact ND1-CE3 3.9Å; H157-W160 PolarHBondContact O-N 3.23Å; A158-W160 PolarHBondContact O-N 2.95Å; W160-L162 VanDerWaalsContact C-N 3.34Å; W160-L162 PolarHBondContact O-N 3.18Å; W160-V163 PolarHBondContact O-N 3.32Å; W160-K164 HydrophobicContact CH2-CD 4.1Å; W160-K164 HydrophobicContact CZ2-CD 3.87Å; W160-K164 WeakPolarHBondContact O-CB 3.15Å; W160-K164 PolarHBondContact O-N 3.12Å; W160-R176 HydrophobicContact CZ2-CB 4.33Å; W160-I179 HydrophobicContact CB-CD1 3.76Å; W160-I179 VanDerWaalsContact CD1-CD1 3.41Å; W160-I179 HydrophobicContact CG-CD1 3.88Å
161	L	96	Very high	94.7	Very high	5 Å²	5	34.8 Å²	34.8	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-60.7	-43	176.4	-72.9	178.3	0	0	0	112.1	H157 A158 A159 K164 Q165 E258 F261 L262	H157-L161 WeakPolarHBondContact O-CG 3.33Å; H157-L161 PolarHBondContact O-N 3.27Å; A158-L161 PolarHBondContact O-N 2.81Å; A159-L161 PolarHBondContact O-N 2.67Å; L161-K164 HydrophobicContact CD2-CD 4.39Å; L161-K164 PolarHBondContact O-N 2.96Å; L161-Q165 WeakPolarHBondContact O-CB 3.31Å; L161-Q165 PolarHBondContact O-N 3.38Å; L161-E258 HydrophobicContact CD1-CG 4.1Å; L161-E258 VanDerWaalsContact CD2-CD 3.46Å; L161-E258 HydrophobicContact CD2-CG 3.64Å; L161-E258 WeakPolarHBondContact CD2-OE2 3.39Å; L161-F261 HydrophobicContact CD1-CD1 3.58Å; L161-F261 HydrophobicContact CD1-CE1 4Å; L161-F261 HydrophobicContact CD1-CG 4.32Å; L161-L262 HydrophobicContact CD1-CD2 4.09Å; L161-L262 HydrophobicContact CD1-CG 4.3Å
162	L	95.4	Very high	94.4	Very high	16 Å²	16	37.5 Å²	37.5	8%	0.084	20%	0.198	C	C	.	.	H	α-helix	trans	-60.3	-48	175.8	-175.6	70	0	0	0	111.9	L14 L15 A158 A159 W160 Q165 E166 P268	L14-L162 HydrophobicContact CD2-CD1 4.03Å; L14-L162 HydrophobicContact CD2-CD2 4.19Å; L14-L162 HydrophobicContact CD2-CG 3.8Å; L14-L162 HydrophobicContact CG-CD2 4.08Å; L14-L162 HydrophobicContact CG-CG 4.26Å; L15-L162 HydrophobicContact CD2-CD2 4.38Å; A158-L162 PolarHBondContact O-N 3.43Å; A159-L162 PolarHBondContact O-N 2.93Å; W160-L162 VanDerWaalsContact C-N 3.34Å; W160-L162 PolarHBondContact O-N 3.18Å; L162-Q165 PolarHBondContact O-N 3.13Å; L162-E166 PolarHBondContact O-N 3.32Å; L162-P268 HydrophobicContact CD2-CB 3.88Å
163	V	95.4	Very high	93.9	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.012	24%	0.235	C	C	.	.	H	α-helix	trans	-66.9	-42.8	179.9	178.4	0	0	0	0	111	V11 L15 F28 A159 W160 Q165 E166 M167 L174	V11-V163 HydrophobicContact CG1-CB 4.48Å; V11-V163 HydrophobicContact CG1-CG1 3.69Å; V11-V163 HydrophobicContact CG1-CG2 4Å; V11-V163 HydrophobicContact CG2-CG1 3.98Å; L15-V163 HydrophobicContact CD1-CG2 3.83Å; L15-V163 HydrophobicContact CD2-CG2 3.88Å; L15-V163 HydrophobicContact CG-CG2 4.05Å; F28-V163 HydrophobicContact CB-CG2 4.18Å; F28-V163 HydrophobicContact CD1-CG2 4.11Å; F28-V163 HydrophobicContact CG-CG2 4.23Å; A159-V163 VanDerWaalsContact O-CG2 3.29Å; A159-V163 WeakPolarHBondContact O-CG2 3.34Å; A159-V163 PolarHBondContact O-N 3.28Å; W160-V163 PolarHBondContact O-N 3.32Å; V163-Q165 VanDerWaalsContact C-N 3.28Å; V163-Q165 PolarHBondContact O-N 2.92Å; V163-E166 PolarHBondContact O-N 3.49Å; V163-E166 VanDerWaalsContact O-N 3.14Å; V163-M167 HydrophobicContact CG1-CG 4.06Å; V163-M167 WeakPolarHBondContact O-CB 3.13Å; V163-M167 WeakPolarHBondContact O-CG 3.45Å; V163-M167 PolarHBondContact O-N 3.35Å; V163-L174 HydrophobicContact CB-CD2 4.26Å; V163-L174 HydrophobicContact CG1-CD2 3.43Å; V163-L174 VanDerWaalsContact CG1-CD2 3.43Å
164	K	94.3	Very high	93.3	Very high	74 Å²	74	43.9 Å²	43.9	32%	0.322	24%	0.241	S	C	.	.	H	α-helix	trans	-56.1	-42.2	173.6	176.4	-166.8	171.3	-166.4	0	111.5	W160 L161 G168 E258	W160-K164 HydrophobicContact CH2-CD 4.1Å; W160-K164 HydrophobicContact CZ2-CD 3.87Å; W160-K164 WeakPolarHBondContact O-CB 3.15Å; W160-K164 PolarHBondContact O-N 3.12Å; L161-K164 HydrophobicContact CD2-CD 4.39Å; L161-K164 PolarHBondContact O-N 2.96Å; K164-G168 PolarHBondContact O-N 2.86Å; K164-E258 IonicContact NZ-OE1 2.62Å; K164-E258 IonicContact NZ-OE2 2.92Å; K164-E258 PolarHBondContact NZ-OE2 3.26Å
165	Q	92.9	Very high	92.8	Very high	123 Å²	123	45.5 Å²	45.5	58%	0.575	26%	0.257	S	S	*	.	H	α-helix	trans	-65.3	-43	175.7	-173.6	-177.2	3.9	0	0	111.9	L161 L162 V163 G168 K169	L161-Q165 WeakPolarHBondContact O-CB 3.31Å; L161-Q165 PolarHBondContact O-N 3.38Å; L162-Q165 PolarHBondContact O-N 3.13Å; V163-Q165 VanDerWaalsContact C-N 3.28Å; V163-Q165 PolarHBondContact O-N 2.92Å; Q165-G168 PolarHBondContact O-N 3.03Å; Q165-K169 PolarHBondContact O-N 2.88Å
166	E	93.7	Very high	92.2	Very high	29 Å²	29	47.8 Å²	47.8	14%	0.136	27%	0.266	C	S	.	.	H	α-helix	trans	-69.1	-40.9	-179.6	-163	59.3	-141.4	0	0	112.8	H10 V11 L14 L162 V163 G168 K169 Q170	H10-E166 HydrophobicContact CB-CG 4.46Å; V11-E166 HydrophobicContact CG2-CG 4.49Å; L14-E166 HydrophobicContact CD2-CB 3.77Å; L14-E166 HydrophobicContact CD2-CG 3.74Å; L14-E166 WeakPolarHBondContact CD2-OE2 3.22Å; L162-E166 PolarHBondContact O-N 3.32Å; V163-E166 PolarHBondContact O-N 3.49Å; V163-E166 VanDerWaalsContact O-N 3.14Å; E166-G168 VanDerWaalsContact C-N 3.3Å; E166-G168 PolarHBondContact O-N 3.27Å; E166-K169 WeakPolarHBondContact O-CB 3.44Å; E166-K169 PolarHBondContact O-N 2.85Å; E166-K169 IonicContact OE1-NZ 3.61Å; E166-K169 PolarHBondContact OE1-NZ 2.75Å; E166-K169 WeakPolarHBondContact OE2-CE 3.39Å; E166-K169 IonicContact OE2-NZ 3.66Å; E166-K169 PolarHBondContact OE2-NZ 2.54Å; E166-Q170 PolarHBondContact O-NE2 3.23Å
167	M	90.8	Very high	91.8	Very high	26 Å²	26	54 Å²	54	13%	0.128	30%	0.3	C	S	.	.	H	α-helix	trans	-62.2	-39.5	172.6	-68.2	-70.5	-83.1	0	0	110.9	V11 V163 K169 Q170 S171 L172 L174	V11-M167 HydrophobicContact CG2-CG 4Å; V11-M167 HydrophobicContact CG2-SD 3.73Å; V163-M167 HydrophobicContact CG1-CG 4.06Å; V163-M167 WeakPolarHBondContact O-CB 3.13Å; V163-M167 WeakPolarHBondContact O-CG 3.45Å; V163-M167 PolarHBondContact O-N 3.35Å; M167-K169 VanDerWaalsContact C-N 3.3Å; M167-K169 PolarHBondContact O-N 2.82Å; M167-Q170 CarbonylContact O-C 3.49Å; M167-Q170 WeakPolarHBondContact O-CA 3.45Å; M167-Q170 WeakPolarHBondContact O-CB 3.43Å; M167-Q170 PolarHBondContact O-N 2.8Å; M167-S171 PolarHBondContact O-N 2.93Å; M167-L172 CarbonylContact C-O 3.27Å; M167-L172 VanDerWaalsContact C-O 3.27Å; M167-L172 HydrophobicContact CB-CB 4.21Å; M167-L172 HydrophobicContact CE-CB 3.66Å; M167-L172 HydrophobicContact CE-CD1 3.87Å; M167-L172 HydrophobicContact CE-CG 4.41Å; M167-L172 PolarHBondContact O-N 2.86Å; M167-L172 HydrophobicContact SD-CB 4.19Å; M167-L172 HydrophobicContact SD-CD1 4.02Å; M167-L174 HydrophobicContact CE-CB 4.46Å; M167-L174 HydrophobicContact CG-CB 4.26Å
168	G	90.9	Very high	91.5	Very high	46 Å²	46	57.7 Å²	57.7	47%	0.474	32%	0.32	S	S	.	.	H	α-helix	trans	-59.8	-33.8	175.4	0	0	0	0	0	114.2	K164 Q165 E166 Q170 S171	K164-G168 PolarHBondContact O-N 2.86Å; Q165-G168 PolarHBondContact O-N 3.03Å; E166-G168 VanDerWaalsContact C-N 3.3Å; E166-G168 PolarHBondContact O-N 3.27Å; G168-Q170 VanDerWaalsContact C-N 3.26Å; G168-Q170 PolarHBondContact O-N 3Å; G168-S171 PolarHBondContact O-N 2.88Å
169	K	91.8	Very high	91.4	Very high	136 Å²	136	58.5 Å²	58.5	59%	0.591	32%	0.324	S	S	*	.	H	α-helix	trans	-65.3	-31	173	-62.3	173.9	-170.5	167.6	0	112.5	Q165 E166 M167 S171	Q165-K169 PolarHBondContact O-N 2.88Å; E166-K169 WeakPolarHBondContact O-CB 3.44Å; E166-K169 PolarHBondContact O-N 2.85Å; E166-K169 IonicContact OE1-NZ 3.61Å; E166-K169 PolarHBondContact OE1-NZ 2.75Å; E166-K169 WeakPolarHBondContact OE2-CE 3.39Å; E166-K169 IonicContact OE2-NZ 3.66Å; E166-K169 PolarHBondContact OE2-NZ 2.54Å; M167-K169 VanDerWaalsContact C-N 3.3Å; M167-K169 PolarHBondContact O-N 2.82Å; K169-S171 VanDerWaalsContact C-N 3.28Å
170	Q	88.6	Confident	91.4	Very high	55 Å²	55	59.1 Å²	59.1	26%	0.257	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	5.9	178.4	-66.6	162.7	86.1	0	0	112.3	H10 E166 M167 G168 L172	H10-Q170 PolarHBondContact ND1-OE1 3.42Å; E166-Q170 PolarHBondContact O-NE2 3.23Å; M167-Q170 CarbonylContact O-C 3.49Å; M167-Q170 WeakPolarHBondContact O-CA 3.45Å; M167-Q170 WeakPolarHBondContact O-CB 3.43Å; M167-Q170 PolarHBondContact O-N 2.8Å; G168-Q170 VanDerWaalsContact C-N 3.26Å; G168-Q170 PolarHBondContact O-N 3Å; Q170-L172 HydrophobicContact CB-CD1 4.16Å; Q170-L172 HydrophobicContact CB-CG 4.14Å; Q170-L172 PolarHBondContact O-N 2.85Å
171	S	89.6	Confident	91.4	Very high	116 Å²	116	62.6 Å²	62.6	81%	0.811	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	22.2	-172.4	-53.5	0	0	0	0	114.6	M167 G168 K169	M167-S171 PolarHBondContact O-N 2.93Å; G168-S171 PolarHBondContact O-N 2.88Å; K169-S171 VanDerWaalsContact C-N 3.28Å
172	L	88.5	Confident	91.4	Very high	64 Å²	64	62.5 Å²	62.5	34%	0.335	35%	0.346	S	S	.	.			trans	-96.5	145	175.6	-61.3	175.2	0	0	0	110.7	M167 Q170	M167-L172 CarbonylContact C-O 3.27Å; M167-L172 VanDerWaalsContact C-O 3.27Å; M167-L172 HydrophobicContact CB-CB 4.21Å; M167-L172 HydrophobicContact CE-CB 3.66Å; M167-L172 HydrophobicContact CE-CD1 3.87Å; M167-L172 HydrophobicContact CE-CG 4.41Å; M167-L172 PolarHBondContact O-N 2.86Å; M167-L172 HydrophobicContact SD-CB 4.19Å; M167-L172 HydrophobicContact SD-CD1 4.02Å; Q170-L172 HydrophobicContact CB-CD1 4.16Å; Q170-L172 HydrophobicContact CB-CG 4.14Å; Q170-L172 PolarHBondContact O-N 2.85Å
173	S	85.8	Confident	91.5	Very high	114 Å²	114	64.7 Å²	64.7	80%	0.797	35%	0.354	S	S	*	.			trans	-101.9	132.5	174.8	58	0	0	0	0	111
174	L	85.9	Confident	91.6	Very high	29 Å²	29	68.7 Å²	68.7	15%	0.152	37%	0.373	C	S	.	.			trans	-122.1	114.7	170.1	-171.9	71.5	0	0	0	110.2	V163 M167 D178	V163-L174 HydrophobicContact CB-CD2 4.26Å; V163-L174 HydrophobicContact CG1-CD2 3.43Å; V163-L174 VanDerWaalsContact CG1-CD2 3.43Å; M167-L174 HydrophobicContact CE-CB 4.46Å; M167-L174 HydrophobicContact CG-CB 4.26Å; L174-D178 HydrophobicContact CD1-CB 3.63Å; L174-D178 HydrophobicContact CG-CB 4.47Å
175	G	86.8	Confident	91.8	Very high	33 Å²	33	65.1 Å²	65.1	34%	0.34	36%	0.357	S	S	.	.			trans	-70.5	163.8	168.8	0	0	0	0	0	111.7	D177 D178	G175-D177 VanDerWaalsContact C-N 3.35Å; G175-D178 VanDerWaalsContact CA-OD2 3.29Å; G175-D178 WeakPolarHBondContact CA-OD2 3.29Å; G175-D178 PolarHBondContact N-OD2 3Å
176	R	85	Confident	92	Very high	61 Å²	61	59.3 Å²	59.3	23%	0.23	33%	0.33	C	S	.	.	S	Bend	trans	-77.3	-26.6	176.9	-169.8	167.8	179.4	-174.1	-6	112.4	H157 W160 D178 N254	H157-R176 PolarHBondContact ND1-NH1 3.01Å; W160-R176 HydrophobicContact CZ2-CB 4.33Å; R176-D178 VanDerWaalsContact C-N 3.3Å; R176-N254 PolarHBondContact NH1-OD1 3.41Å
177	D	88.6	Confident	92.2	Very high	159 Å²	159	59.9 Å²	59.9	85%	0.85	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-12.5	179.5	-55.7	-54.1	0	0	0	112.7	G175 I179	G175-D177 VanDerWaalsContact C-N 3.35Å; D177-I179 PolarHBondContact O-N 3.4Å
178	D	90.4	Very high	92.6	Very high	85 Å²	85	60.4 Å²	60.4	46%	0.455	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-11.6	173.4	-55.1	-26.7	0	0	0	112.5	G30 L174 G175 R176	G30-D178 WeakPolarHBondContact CA-O 3.47Å; L174-D178 HydrophobicContact CD1-CB 3.63Å; L174-D178 HydrophobicContact CG-CB 4.47Å; G175-D178 VanDerWaalsContact CA-OD2 3.29Å; G175-D178 WeakPolarHBondContact CA-OD2 3.29Å; G175-D178 PolarHBondContact N-OD2 3Å; R176-D178 VanDerWaalsContact C-N 3.3Å
179	I	94.6	Very high	92.9	Very high	17 Å²	17	58.6 Å²	58.6	9%	0.087	31%	0.312	C	S	.	.	S	Bend	trans	-88.7	117.2	177.7	-61.7	168.2	0	0	0	110	R27 F28 W160 D177 Q181	R27-I179 HydrophobicContact CB-CG2 4.35Å; R27-I179 WeakPolarHBondContact O-CA 3.05Å; F28-I179 HydrophobicContact CD1-CD1 3.57Å; F28-I179 HydrophobicContact CD1-CG1 3.97Å; F28-I179 HydrophobicContact CD1-CG2 4.16Å; F28-I179 HydrophobicContact CE1-CD1 3.64Å; F28-I179 HydrophobicContact CE1-CG1 4.41Å; F28-I179 HydrophobicContact CE1-CG2 4.23Å; W160-I179 HydrophobicContact CB-CD1 3.76Å; W160-I179 VanDerWaalsContact CD1-CD1 3.41Å; W160-I179 HydrophobicContact CG-CD1 3.88Å; D177-I179 PolarHBondContact O-N 3.4Å; I179-Q181 PolarHBondContact O-N 2.86Å
180	V	97.4	Very high	93.3	Very high	15 Å²	15	52.1 Å²	52.1	9%	0.091	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-55.8	125.5	172.7	177	0	0	0	0	110.3	R27 V31 A185 W188	R27-V180 HydrophobicContact CB-CB 3.98Å; R27-V180 WeakPolarHBondContact CB-O 3.34Å; R27-V180 WeakPolarHBondContact CD-O 3.45Å; R27-V180 HydrophobicContact CG-CB 4.05Å; R27-V180 HydrophobicContact CG-CG1 4.33Å; R27-V180 PolarHBondContact NH1-O 3.26Å; R27-V180 PolarHBondContact O-N 3.24Å; V31-V180 WeakPolarHBondContact O-CG2 3.17Å; V180-A185 HydrophobicContact CG1-CB 4.01Å; V180-W188 HydrophobicContact CB-CH2 4.42Å; V180-W188 HydrophobicContact CG1-CE3 4.38Å; V180-W188 HydrophobicContact CG1-CH2 3.44Å; V180-W188 VanDerWaalsContact CG1-CH2 3.44Å; V180-W188 HydrophobicContact CG1-CZ2 4.19Å; V180-W188 HydrophobicContact CG1-CZ3 3.56Å; V180-W188 HydrophobicContact CG2-CH2 4.05Å; V180-W188 HydrophobicContact CG2-CZ3 4.37Å
181	Q	96.6	Very high	93.7	Very high	109 Å²	109	51.9 Å²	51.9	51%	0.509	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-67.3	143.7	-173.9	-60.5	-170.8	27.6	0	0	112.1	I179 K183 E184 A185	I179-Q181 PolarHBondContact O-N 2.86Å; Q181-K183 VanDerWaalsContact C-N 3.25Å; Q181-K183 PolarHBondContact O-N 3.38Å; Q181-E184 HydrophobicContact CB-CB 4.05Å; Q181-E184 WeakPolarHBondContact O-CB 3.41Å; Q181-E184 PolarHBondContact O-N 2.65Å; Q181-A185 PolarHBondContact O-N 3.27Å
182	L	97.6	Very high	94.1	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.021	26%	0.26	C	S	.	.	H	α-helix	trans	-56.5	-40.9	-178.8	177.2	61.3	0	0	0	112.2	C112 I115 L116 F148 L152 E184 Y186	C112-L182 HydrophobicContact CB-CD1 3.85Å; C112-L182 HydrophobicContact CB-CD2 4.28Å; I115-L182 HydrophobicContact CG2-CD1 4.04Å; I115-L182 HydrophobicContact CG2-CD2 4.4Å; I115-L182 HydrophobicContact CG2-CG 4.29Å; L116-L182 HydrophobicContact CD1-CD1 3.54Å; L116-L182 HydrophobicContact CD2-CD1 4.34Å; L116-L182 HydrophobicContact CG-CD1 3.61Å; F148-L182 HydrophobicContact CD2-CD2 3.99Å; F148-L182 HydrophobicContact CD2-CG 4.22Å; F148-L182 HydrophobicContact CE2-CB 4.38Å; F148-L182 HydrophobicContact CE2-CD2 4.04Å; F148-L182 HydrophobicContact CE2-CG 3.78Å; F148-L182 HydrophobicContact CZ-CG 4.36Å; L152-L182 HydrophobicContact CD1-CD2 3.44Å; L152-L182 VanDerWaalsContact CD1-CD2 3.44Å; L182-E184 VanDerWaalsContact C-N 3.28Å; L182-E184 PolarHBondContact O-N 3.42Å; L182-Y186 WeakPolarHBondContact O-CB 3.5Å; L182-Y186 PolarHBondContact O-N 3.13Å
183	K	96.8	Very high	94.6	Very high	61 Å²	61	47.2 Å²	47.2	27%	0.265	25%	0.252	S	S	.	.	H	α-helix	trans	-69.3	-27.1	179.2	-176.6	161.6	176.7	164	0	112.7	V146 F148 Q181 K187	V146-K183 HydrophobicContact CG1-CD 3.99Å; V146-K183 HydrophobicContact CG1-CG 3.87Å; V146-K183 WeakPolarHBondContact O-CE 3.28Å; V146-K183 PolarHBondContact O-NZ 3.4Å; F148-K183 HydrophobicContact CE2-CB 3.77Å; F148-K183 HydrophobicContact CE2-CG 4.39Å; Q181-K183 VanDerWaalsContact C-N 3.25Å; Q181-K183 PolarHBondContact O-N 3.38Å; K183-K187 HydrophobicContact CG-CD 4.34Å; K183-K187 WeakPolarHBondContact O-CB 3.35Å; K183-K187 WeakPolarHBondContact O-CD 3.36Å; K183-K187 WeakPolarHBondContact O-CG 3.46Å; K183-K187 PolarHBondContact O-N 2.92Å
184	E	96.9	Very high	95.2	Very high	86 Å²	86	41.8 Å²	41.8	40%	0.402	21%	0.214	S	C	.	.	H	α-helix	trans	-79.3	-54.1	-179.8	177.6	167.5	-147.5	0	0	110.7	Q181 L182 Y186 K187 W188	Q181-E184 HydrophobicContact CB-CB 4.05Å; Q181-E184 WeakPolarHBondContact O-CB 3.41Å; Q181-E184 PolarHBondContact O-N 2.65Å; L182-E184 VanDerWaalsContact C-N 3.28Å; L182-E184 PolarHBondContact O-N 3.42Å; E184-Y186 VanDerWaalsContact C-N 3.28Å; E184-Y186 PolarHBondContact O-N 3.33Å; E184-K187 CarbonylContact O-C 3.58Å; E184-K187 WeakPolarHBondContact O-CA 3.34Å; E184-K187 WeakPolarHBondContact O-CB 3.43Å; E184-K187 PolarHBondContact O-N 3.19Å; E184-W188 HydrophobicContact CG-CD2 4.29Å; E184-W188 VanDerWaalsContact CG-CE2 3.43Å; E184-W188 HydrophobicContact CG-CH2 4.37Å; E184-W188 HydrophobicContact CG-CZ2 3.49Å; E184-W188 VanDerWaalsContact CG-CZ2 3.49Å; E184-W188 PolarHBondContact O-N 3.11Å
185	A	98.3	Very high	95.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-55.8	-42	173.1	0	0	0	0	0	112.2	R27 Y37 L116 V180 Q181 K187 W188 I189	R27-A185 HydrophobicContact CG-CB 4.14Å; Y37-A185 HydrophobicContact CD1-CB 4.14Å; Y37-A185 HydrophobicContact CE1-CB 3.98Å; L116-A185 HydrophobicContact CD1-CB 4.34Å; V180-A185 HydrophobicContact CG1-CB 4.01Å; Q181-A185 PolarHBondContact O-N 3.27Å; A185-K187 VanDerWaalsContact C-N 3.32Å; A185-K187 PolarHBondContact O-N 3.42Å; A185-W188 HydrophobicContact CB-CE3 4.39Å; A185-W188 PolarHBondContact O-N 3.37Å; A185-I189 WeakPolarHBondContact O-CD1 3.43Å; A185-I189 VanDerWaalsContact O-CG1 3.32Å; A185-I189 WeakPolarHBondContact O-CG1 3.38Å; A185-I189 PolarHBondContact O-N 3.48Å
186	Y	98.6	Very high	96.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.2	-40.9	175.1	-176.4	-99	0	0	0	112.2	I115 L116 F119 C120 F144 V146 F148 L182 E184 I189 T190 F214	I115-Y186 HydrophobicContact CG2-CD2 3.55Å; I115-Y186 HydrophobicContact CG2-CE2 3.91Å; I115-Y186 HydrophobicContact CG2-CG 4.24Å; I115-Y186 WeakPolarHBondContact O-CD2 3.3Å; I115-Y186 WeakPolarHBondContact O-CE2 3.32Å; L116-Y186 HydrophobicContact CD2-CD2 4.16Å; F119-Y186 HydrophobicContact CB-CE2 4.3Å; F119-Y186 VanDerWaalsContact O-CE2 3.29Å; F119-Y186 WeakPolarHBondContact O-CE2 3.38Å; F119-Y186 PolarHBondContact O-OH 3.32Å; F119-Y186 VanDerWaalsContact O-OH 3.07Å; C120-Y186 HydrophobicContact CB-CD2 3.89Å; C120-Y186 HydrophobicContact CB-CE2 3.98Å; F144-Y186 HydrophobicContact CE1-CD1 4.09Å; F144-Y186 AromaticContact CE1-CE1 3.62Å; F144-Y186 HydrophobicContact CE1-CE1 3.62Å; F144-Y186 AromaticContact CZ-CE1 3.8Å; F144-Y186 HydrophobicContact CZ-CE1 3.8Å; V146-Y186 HydrophobicContact CB-CE1 4.27Å; V146-Y186 HydrophobicContact CG1-CD1 4.07Å; V146-Y186 HydrophobicContact CG1-CE1 4.23Å; V146-Y186 HydrophobicContact CG2-CD1 4.43Å; V146-Y186 HydrophobicContact CG2-CE1 3.89Å; F148-Y186 HydrophobicContact CE1-CD1 4.44Å; F148-Y186 HydrophobicContact CZ-CD1 4.04Å; F148-Y186 HydrophobicContact CZ-CD2 4.48Å; F148-Y186 AromaticContact CZ-CG 3.99Å; F148-Y186 HydrophobicContact CZ-CG 3.99Å; L182-Y186 WeakPolarHBondContact O-CB 3.5Å; L182-Y186 PolarHBondContact O-N 3.13Å; E184-Y186 VanDerWaalsContact C-N 3.28Å; E184-Y186 PolarHBondContact O-N 3.33Å; Y186-I189 PolarHBondContact O-N 2.83Å; Y186-T190 HydrophobicContact CD1-CG2 4.35Å; Y186-T190 HydrophobicContact CD2-CG2 4.43Å; Y186-T190 HydrophobicContact CE1-CG2 4.06Å; Y186-T190 HydrophobicContact CE2-CG2 4.14Å; Y186-T190 WeakPolarHBondContact O-CB 2.95Å; Y186-T190 WeakPolarHBondContact O-CG2 3.38Å; Y186-T190 PolarHBondContact O-N 2.69Å; Y186-T190 PolarHBondContact O-OG1 3.44Å; Y186-F214 WeakPolarHBondContact OH-CZ 3.47Å
187	K	97.8	Very high	97	Very high	42 Å²	42	45.8 Å²	45.8	18%	0.183	23%	0.23	C	C	.	.	H	α-helix	trans	-69.4	-39.5	175.9	-81	176.4	158.6	-91.2	0	112.6	F144 K183 E184 A185 I189 T190 H191	F144-K187 HydrophobicContact CD1-CG 4.35Å; F144-K187 WeakPolarHBondContact O-CE 3.39Å; F144-K187 PolarHBondContact O-NZ 3.2Å; K183-K187 HydrophobicContact CG-CD 4.34Å; K183-K187 WeakPolarHBondContact O-CB 3.35Å; K183-K187 WeakPolarHBondContact O-CD 3.36Å; K183-K187 WeakPolarHBondContact O-CG 3.46Å; K183-K187 PolarHBondContact O-N 2.92Å; E184-K187 CarbonylContact O-C 3.58Å; E184-K187 WeakPolarHBondContact O-CA 3.34Å; E184-K187 WeakPolarHBondContact O-CB 3.43Å; E184-K187 PolarHBondContact O-N 3.19Å; A185-K187 VanDerWaalsContact C-N 3.32Å; A185-K187 PolarHBondContact O-N 3.42Å; K187-I189 PolarHBondContact O-N 2.81Å; K187-T190 PolarHBondContact O-N 3.25Å; K187-H191 VanDerWaalsContact CG-NE2 3.3Å; K187-H191 WeakPolarHBondContact CG-NE2 3.23Å; K187-H191 PolarHBondContact NZ-NE2 3.17Å; K187-H191 WeakPolarHBondContact O-CB 3.13Å; K187-H191 PolarHBondContact O-N 2.91Å
188	W	98.1	Very high	97.4	Very high	37 Å²	37	39.3 Å²	39.3	14%	0.14	20%	0.195	C	C	.	.	H	α-helix	trans	-57	-34.9	175.7	-62.8	-17	0	0	0	112.9	D32 H34 Y37 K38 V180 E184 A185 P192	D32-W188 WeakPolarHBondContact O-CH2 3.42Å; H34-W188 HydrophobicContact CB-CB 4.27Å; H34-W188 HydrophobicContact CB-CG 4.45Å; H34-W188 AromaticContact CD2-CD1 3.87Å; H34-W188 AromaticContact CD2-CD2 3.24Å; H34-W188 AromaticContact CD2-CE2 3.33Å; H34-W188 AromaticContact CD2-CE3 3.6Å; H34-W188 AromaticContact CD2-CG 3.61Å; H34-W188 AromaticContact CD2-CZ2 3.77Å; H34-W188 AromaticContact CD2-CZ3 4Å; H34-W188 AromaticContact CD2-NE1 3.72Å; H34-W188 AromaticContact CE1-CD1 3.87Å; H34-W188 AromaticContact CE1-NE1 3.85Å; H34-W188 AromaticContact CG-CD2 3.93Å; H34-W188 AromaticContact CG-CG 3.86Å; H34-W188 AromaticContact NE2-CD1 3.65Å; H34-W188 AromaticContact NE2-CD2 3.68Å; H34-W188 AromaticContact NE2-CE2 3.27Å; H34-W188 VanDerWaalsContact NE2-CE2 3.27Å; H34-W188 AromaticContact NE2-CG 3.9Å; H34-W188 AromaticContact NE2-CZ2 3.69Å; H34-W188 AromaticContact NE2-NE1 3.27Å; H34-W188 PolarHBondContact NE2-NE1 2.94Å; Y37-W188 AromaticContact CD2-CE3 3.94Å; Y37-W188 HydrophobicContact CD2-CE3 3.94Å; Y37-W188 HydrophobicContact CD2-CZ3 4.13Å; Y37-W188 AromaticContact CE2-CE3 3.93Å; Y37-W188 HydrophobicContact CE2-CE3 3.93Å; Y37-W188 AromaticContact CE2-CZ3 3.63Å; Y37-W188 HydrophobicContact CE2-CZ3 3.63Å; K38-W188 WeakPolarHBondContact CE-O 3.34Å; V180-W188 HydrophobicContact CB-CH2 4.42Å; V180-W188 HydrophobicContact CG1-CE3 4.38Å; V180-W188 HydrophobicContact CG1-CH2 3.44Å; V180-W188 VanDerWaalsContact CG1-CH2 3.44Å; V180-W188 HydrophobicContact CG1-CZ2 4.19Å; V180-W188 HydrophobicContact CG1-CZ3 3.56Å; V180-W188 HydrophobicContact CG2-CH2 4.05Å; V180-W188 HydrophobicContact CG2-CZ3 4.37Å; E184-W188 HydrophobicContact CG-CD2 4.29Å; E184-W188 VanDerWaalsContact CG-CE2 3.43Å; E184-W188 HydrophobicContact CG-CH2 4.37Å; E184-W188 HydrophobicContact CG-CZ2 3.49Å; E184-W188 VanDerWaalsContact CG-CZ2 3.49Å; E184-W188 PolarHBondContact O-N 3.11Å; A185-W188 HydrophobicContact CB-CE3 4.39Å; A185-W188 PolarHBondContact O-N 3.37Å; W188-P192 WeakPolarHBondContact O-CD 3.37Å
189	I	98.4	Very high	97.8	Very high	8 Å²	8	38.5 Å²	38.5	4%	0.041	21%	0.206	C	C	.	.	H	α-helix	trans	-81.2	-50.1	177.1	-53.5	160.1	0	0	0	111	L116 C120 A185 Y186 K187 P192 L193	L116-I189 HydrophobicContact CD2-CD1 3.84Å; C120-I189 HydrophobicContact CB-CB 4.28Å; C120-I189 HydrophobicContact CB-CD1 3.96Å; C120-I189 HydrophobicContact CB-CG2 4.04Å; C120-I189 WeakPolarHBondContact O-CG2 3.24Å; A185-I189 WeakPolarHBondContact O-CD1 3.43Å; A185-I189 VanDerWaalsContact O-CG1 3.32Å; A185-I189 WeakPolarHBondContact O-CG1 3.38Å; A185-I189 PolarHBondContact O-N 3.48Å; Y186-I189 PolarHBondContact O-N 2.83Å; K187-I189 PolarHBondContact O-N 2.81Å; I189-P192 WeakPolarHBondContact O-CD 3.46Å; I189-P192 VanDerWaalsContact O-CG 3.29Å; I189-P192 WeakPolarHBondContact O-CG 3.26Å; I189-L193 HydrophobicContact CG2-CD1 4.44Å
190	T	98.4	Very high	98	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-81.3	-32.3	-169.4	53.9	0	0	0	0	114.6	C120 V125 Y186 K187 L193 F194	C120-T190 HydrophobicContact CB-CG2 4.16Å; V125-T190 HydrophobicContact CG2-CG2 3.98Å; Y186-T190 HydrophobicContact CD1-CG2 4.35Å; Y186-T190 HydrophobicContact CD2-CG2 4.43Å; Y186-T190 HydrophobicContact CE1-CG2 4.06Å; Y186-T190 HydrophobicContact CE2-CG2 4.14Å; Y186-T190 WeakPolarHBondContact O-CB 2.95Å; Y186-T190 WeakPolarHBondContact O-CG2 3.38Å; Y186-T190 PolarHBondContact O-N 2.69Å; Y186-T190 PolarHBondContact O-OG1 3.44Å; K187-T190 PolarHBondContact O-N 3.25Å; T190-L193 WeakPolarHBondContact O-CB 3.3Å; T190-L193 PolarHBondContact O-N 3.08Å; T190-L193 VanDerWaalsContact O-N 3.1Å; T190-F194 VanDerWaalsContact O-CD2 3.26Å; T190-F194 WeakPolarHBondContact O-CD2 3.42Å; T190-F194 PolarHBondContact O-N 3.1Å
191	H	98.3	Very high	98	Very high	49 Å²	49	41.7 Å²	41.7	23%	0.227	23%	0.228	C	C	.	.	H	α-helix	trans	-52.5	-50.5	178	-77.5	-170.6	0	0	0	114.2	K187 L193 F194 S195 I202	K187-H191 VanDerWaalsContact CG-NE2 3.3Å; K187-H191 WeakPolarHBondContact CG-NE2 3.23Å; K187-H191 PolarHBondContact NZ-NE2 3.17Å; K187-H191 WeakPolarHBondContact O-CB 3.13Å; K187-H191 PolarHBondContact O-N 2.91Å; H191-L193 VanDerWaalsContact C-N 3.31Å; H191-L193 PolarHBondContact O-N 3.09Å; H191-F194 PolarHBondContact O-N 3.4Å; H191-S195 WeakPolarHBondContact O-CB 3.43Å; H191-S195 PolarHBondContact O-N 3.43Å; H191-I202 HydrophobicContact CB-CG1 3.92Å
192	P	98.2	Very high	98.1	Very high	51 Å²	51	38.7 Å²	38.7	33%	0.331	22%	0.215	S	C	.	.	H	α-helix	trans	-66	-32.8	177.1	26.7	-35.9	0	0	0	112.6	W188 I189 S195 E196	W188-P192 WeakPolarHBondContact O-CD 3.37Å; I189-P192 WeakPolarHBondContact O-CD 3.46Å; I189-P192 VanDerWaalsContact O-CG 3.29Å; I189-P192 WeakPolarHBondContact O-CG 3.26Å; P192-S195 PolarHBondContact O-N 3.16Å; P192-E196 WeakPolarHBondContact O-CB 3.2Å; P192-E196 PolarHBondContact O-N 3.47Å
193	L	98.4	Very high	98.1	Very high	31 Å²	31	41.9 Å²	41.9	16%	0.162	23%	0.232	C	C	.	.	H	α-helix	trans	-67.2	-43.1	177.1	-62.8	173.8	0	0	0	111.6	K122 V125 I189 T190 H191 S195 E196 E197	K122-L193 HydrophobicContact CB-CD2 4.28Å; K122-L193 HydrophobicContact CD-CD2 4.44Å; K122-L193 HydrophobicContact CG-CD2 4.41Å; V125-L193 HydrophobicContact CB-CB 4.14Å; V125-L193 HydrophobicContact CG1-CB 3.82Å; V125-L193 HydrophobicContact CG2-CB 4.09Å; V125-L193 HydrophobicContact CG2-CD1 3.99Å; I189-L193 HydrophobicContact CG2-CD1 4.44Å; T190-L193 WeakPolarHBondContact O-CB 3.3Å; T190-L193 PolarHBondContact O-N 3.08Å; T190-L193 VanDerWaalsContact O-N 3.1Å; H191-L193 VanDerWaalsContact C-N 3.31Å; H191-L193 PolarHBondContact O-N 3.09Å; L193-S195 VanDerWaalsContact C-N 3.31Å; L193-S195 PolarHBondContact O-N 2.97Å; L193-E196 PolarHBondContact O-N 2.9Å; L193-E197 WeakPolarHBondContact O-CB 3.42Å; L193-E197 PolarHBondContact O-N 3.1Å
194	F	98.4	Very high	98	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-40.6	172.4	-82.8	-65.8	0	0	0	111.9	V125 V128 F144 T190 H191 L198 I202 V210	V125-F194 HydrophobicContact CG1-CD1 3.76Å; V125-F194 HydrophobicContact CG1-CD2 4.15Å; V125-F194 HydrophobicContact CG1-CE1 3.86Å; V125-F194 HydrophobicContact CG1-CE2 4.24Å; V125-F194 HydrophobicContact CG1-CG 3.89Å; V125-F194 HydrophobicContact CG1-CZ 4.1Å; V128-F194 HydrophobicContact CB-CE1 3.99Å; V128-F194 HydrophobicContact CB-CZ 4.23Å; V128-F194 HydrophobicContact CG1-CE1 3.6Å; V128-F194 HydrophobicContact CG1-CZ 3.86Å; F144-F194 HydrophobicContact CD1-CD2 4.31Å; F144-F194 AromaticContact CD1-CE2 3.94Å; F144-F194 HydrophobicContact CD1-CE2 3.94Å; F144-F194 HydrophobicContact CD2-CD2 4.24Å; F144-F194 AromaticContact CD2-CE2 3.61Å; F144-F194 HydrophobicContact CD2-CE2 3.61Å; F144-F194 AromaticContact CD2-CZ 3.84Å; F144-F194 HydrophobicContact CD2-CZ 3.84Å; F144-F194 AromaticContact CE1-CE2 3.84Å; F144-F194 HydrophobicContact CE1-CE2 3.84Å; F144-F194 AromaticContact CE2-CE2 3.52Å; F144-F194 HydrophobicContact CE2-CE2 3.52Å; F144-F194 AromaticContact CE2-CZ 3.57Å; F144-F194 HydrophobicContact CE2-CZ 3.57Å; F144-F194 HydrophobicContact CG-CD2 4.14Å; F144-F194 AromaticContact CG-CE2 3.84Å; F144-F194 HydrophobicContact CG-CE2 3.84Å; F144-F194 AromaticContact CZ-CE2 3.64Å; F144-F194 HydrophobicContact CZ-CE2 3.64Å; F144-F194 HydrophobicContact CZ-CZ 4.02Å; T190-F194 VanDerWaalsContact O-CD2 3.26Å; T190-F194 WeakPolarHBondContact O-CD2 3.42Å; T190-F194 PolarHBondContact O-N 3.1Å; H191-F194 PolarHBondContact O-N 3.4Å; F194-L198 HydrophobicContact CD1-CD1 4.35Å; F194-L198 WeakPolarHBondContact O-CB 3.19Å; F194-L198 PolarHBondContact O-N 3.46Å; F194-I202 HydrophobicContact CB-CD1 3.96Å; F194-V210 HydrophobicContact CE1-CG1 4.49Å
195	S	98.2	Very high	97.9	Very high	40 Å²	40	47 Å²	47	28%	0.28	27%	0.273	S	S	.	.	H	α-helix	trans	-71.5	-35.7	-178.8	-164.9	0	0	0	0	112.9	H191 P192 L193 G199 V200	H191-S195 WeakPolarHBondContact O-CB 3.43Å; H191-S195 PolarHBondContact O-N 3.43Å; P192-S195 PolarHBondContact O-N 3.16Å; L193-S195 VanDerWaalsContact C-N 3.31Å; L193-S195 PolarHBondContact O-N 2.97Å; S195-G199 WeakPolarHBondContact O-CA 3.45Å; S195-G199 PolarHBondContact O-N 3.19Å; S195-G199 VanDerWaalsContact O-N 3.11Å; S195-V200 VanDerWaalsContact CA-O 3.24Å; S195-V200 WeakPolarHBondContact CA-O 3.41Å; S195-V200 WeakPolarHBondContact CB-O 3.1Å; S195-V200 PolarHBondContact OG-O 3.26Å
196	E	98.2	Very high	97.9	Very high	122 Å²	122	48 Å²	48	57%	0.57	28%	0.28	S	S	*	.	H	α-helix	trans	-67.5	-48.4	173	-172.2	-167.4	151.9	0	0	111.6	K122 P192 L193	K122-E196 IonicContact NZ-OE1 2.9Å; K122-E196 PolarHBondContact NZ-OE1 3.1Å; K122-E196 IonicContact NZ-OE2 2.85Å; P192-E196 WeakPolarHBondContact O-CB 3.2Å; P192-E196 PolarHBondContact O-N 3.47Å; L193-E196 PolarHBondContact O-N 2.9Å
197	E	98.2	Very high	97.8	Very high	46 Å²	46	52.7 Å²	52.7	22%	0.215	31%	0.305	C	S	.	.	H	α-helix	trans	-76.9	-34.8	-172.8	-161.4	80.9	-157.7	0	0	112.6	K122 K126 C129 L193	K122-E197 WeakPolarHBondContact CE-OE2 3.32Å; K126-E197 WeakPolarHBondContact CG-OE1 3.33Å; K126-E197 IonicContact NZ-OE1 2.82Å; K126-E197 PolarHBondContact NZ-OE1 3.23Å; C129-E197 HydrophobicContact CB-CB 4.34Å; C129-E197 HydrophobicContact CB-CG 3.82Å; L193-E197 WeakPolarHBondContact O-CB 3.42Å; L193-E197 PolarHBondContact O-N 3.1Å
198	L	97.8	Very high	97.9	Very high	23 Å²	23	50.7 Å²	50.7	12%	0.12	30%	0.296	C	S	.	.	H	α-helix	trans	-92.9	-6.4	176.9	-61.8	173.1	0	0	0	114	C129 V132 E133 L142 F194 V200	C129-L198 HydrophobicContact CB-CD2 3.76Å; C129-L198 HydrophobicContact CB-CG 4.2Å; V132-L198 HydrophobicContact CG1-CD2 4.42Å; E133-L198 HydrophobicContact CG-CD2 4.13Å; L142-L198 HydrophobicContact CD1-CD1 4.06Å; L142-L198 HydrophobicContact CD2-CD1 4.03Å; F194-L198 HydrophobicContact CD1-CD1 4.35Å; F194-L198 WeakPolarHBondContact O-CB 3.19Å; F194-L198 PolarHBondContact O-N 3.46Å; L198-V200 HydrophobicContact CB-CG2 3.85Å; L198-V200 PolarHBondContact O-N 3.38Å
199	G	98.2	Very high	97.9	Very high	67 Å²	67	52.9 Å²	52.9	69%	0.691	31%	0.308	S	S	*	.	S	Bend	trans	66.5	14.1	179.5	0	0	0	0	0	116	S195	S195-G199 WeakPolarHBondContact O-CA 3.45Å; S195-G199 PolarHBondContact O-N 3.19Å; S195-G199 VanDerWaalsContact O-N 3.11Å
200	V	98.2	Very high	97.9	Very high	21 Å²	21	52.5 Å²	52.5	13%	0.127	31%	0.306	C	S	.	.	S	Bend	trans	-126.7	152.2	-176.8	-69.1	0	0	0	0	112.2	F139 L142 S195 L198	F139-V200 HydrophobicContact CD2-CG1 4.4Å; F139-V200 HydrophobicContact CD2-CG2 4.05Å; F139-V200 HydrophobicContact CE2-CG1 4.41Å; F139-V200 HydrophobicContact CE2-CG2 3.75Å; L142-V200 HydrophobicContact CD2-CG2 3.51Å; S195-V200 VanDerWaalsContact CA-O 3.24Å; S195-V200 WeakPolarHBondContact CA-O 3.41Å; S195-V200 WeakPolarHBondContact CB-O 3.1Å; S195-V200 PolarHBondContact OG-O 3.26Å; L198-V200 HydrophobicContact CB-CG2 3.85Å; L198-V200 PolarHBondContact O-N 3.38Å
201	P	98.3	Very high	97.9	Very high	78 Å²	78	53.5 Å²	53.5	51%	0.506	31%	0.313	S	S	.	.			trans	-70.9	153.7	177.2	28.6	-35.9	0	0	0	113.4	T140 S141 L142	T140-P201 WeakPolarHBondContact O-CD 3.26Å; S141-P201 VanDerWaalsContact CA-O 3.28Å; S141-P201 WeakPolarHBondContact CA-O 3.23Å; S141-P201 WeakPolarHBondContact CB-O 3.42Å; L142-P201 PolarHBondContact N-O 2.65Å
202	I	98	Very high	97.9	Very high	47 Å²	47	51.2 Å²	51.2	24%	0.241	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-81.9	121.7	164.9	-52.9	-58.2	0	0	0	109	L142 H191 F194	L142-I202 HydrophobicContact CD1-CD1 4.06Å; L142-I202 HydrophobicContact CD2-CD1 3.61Å; L142-I202 HydrophobicContact CG-CD1 3.64Å; L142-I202 CarbonylContact O-C 3.52Å; L142-I202 WeakPolarHBondContact O-CA 3.47Å; H191-I202 HydrophobicContact CB-CG1 3.92Å; F194-I202 HydrophobicContact CB-CD1 3.96Å
203	D	97.7	Very high	97.9	Very high	70 Å²	70	50.2 Å²	50.2	37%	0.374	30%	0.295	S	S	.	.			trans	-129.2	125.5	175.4	-176.5	-1.3	0	0	0	110.1	L142 V143 K205 S206	L142-D203 PolarHBondContact O-N 2.86Å; V143-D203 WeakPolarHBondContact CB-O 3.33Å; D203-K205 PolarHBondContact O-N 3.24Å; D203-K205 PolarHBondContact OD1-N 2.96Å; D203-S206 PolarHBondContact O-N 3.46Å; D203-S206 VanDerWaalsContact O-N 3.14Å
204	G	95.2	Very high	97.9	Very high	70 Å²	70	49 Å²	49	72%	0.722	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-7.5	175.9	0	0	0	0	0	114.6
205	K	95.6	Very high	97.8	Very high	185 Å²	185	50.1 Å²	50.1	80%	0.804	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	4.9	173.1	-62.1	-177.9	-179.5	178.8	0	113.6	D203	D203-K205 PolarHBondContact O-N 3.24Å; D203-K205 PolarHBondContact OD1-N 2.96Å
206	S	97.7	Very high	97.7	Very high	21 Å²	21	48.5 Å²	48.5	15%	0.147	29%	0.286	C	S	.	.			trans	-58.5	142.8	176.7	-176.1	0	0	0	0	110.9	S141 D203 F208	S141-S206 PolarHBondContact O-OG 3.04Å; S141-S206 WeakPolarHBondContact OG-CB 3.18Å; S141-S206 PolarHBondContact OG-OG 2.85Å; D203-S206 PolarHBondContact O-N 3.46Å; D203-S206 VanDerWaalsContact O-N 3.14Å; S206-F208 VanDerWaalsContact C-N 3.28Å; S206-F208 PolarHBondContact OG-N 2.9Å
207	L	97.3	Very high	97.6	Very high	98 Å²	98	46.9 Å²	46.9	51%	0.513	29%	0.286	S	S	.	.	S	Bend	trans	-74	-21.4	168.1	-64	179	0	0	0	111.7	G286	L207-G286 PolarHBondContact O-N 3.23Å
208	F	98.6	Very high	97.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	112.2	179.9	-171.6	-116.4	0	0	0	111.1	V132 F137 F139 L142 V143 S206 V210 C283 A284 H285	V132-F208 HydrophobicContact CG1-CE1 3.79Å; V132-F208 HydrophobicContact CG1-CZ 3.79Å; F137-F208 HydrophobicContact CB-CD2 4.27Å; F137-F208 HydrophobicContact CB-CE2 3.54Å; F137-F208 HydrophobicContact CB-CZ 4Å; F137-F208 HydrophobicContact CD1-CE2 4.11Å; F137-F208 AromaticContact CD2-CE2 3.76Å; F137-F208 HydrophobicContact CD2-CE2 3.76Å; F137-F208 HydrophobicContact CD2-CZ 4.26Å; F137-F208 HydrophobicContact CE2-CE2 4.49Å; F137-F208 HydrophobicContact CG-CD2 4.36Å; F137-F208 AromaticContact CG-CE2 3.54Å; F137-F208 HydrophobicContact CG-CE2 3.54Å; F137-F208 HydrophobicContact CG-CZ 4.28Å; F139-F208 HydrophobicContact CB-CB 3.67Å; F139-F208 HydrophobicContact CB-CD1 3.68Å; F139-F208 HydrophobicContact CB-CD2 4.24Å; F139-F208 HydrophobicContact CB-CE1 4.37Å; F139-F208 HydrophobicContact CB-CG 3.6Å; F139-F208 AromaticContact CD1-CD1 3.6Å; F139-F208 HydrophobicContact CD1-CD1 3.6Å; F139-F208 HydrophobicContact CD1-CD2 4.23Å; F139-F208 AromaticContact CD1-CE1 3.37Å; F139-F208 HydrophobicContact CD1-CE1 3.37Å; F139-F208 HydrophobicContact CD1-CE2 4.05Å; F139-F208 HydrophobicContact CD1-CG 4.02Å; F139-F208 AromaticContact CD1-CZ 3.6Å; F139-F208 HydrophobicContact CD1-CZ 3.6Å; F139-F208 AromaticContact CD2-CD1 3.69Å; F139-F208 HydrophobicContact CD2-CD1 3.69Å; F139-F208 AromaticContact CD2-CE1 3.94Å; F139-F208 HydrophobicContact CD2-CE1 3.94Å; F139-F208 HydrophobicContact CD2-CG 4.49Å; F139-F208 HydrophobicContact CE1-CD1 4.13Å; F139-F208 AromaticContact CE1-CE1 3.48Å; F139-F208 HydrophobicContact CE1-CE1 3.48Å; F139-F208 VanDerWaalsContact CE1-CE1 3.48Å; F139-F208 AromaticContact CE1-CZ 3.72Å; F139-F208 HydrophobicContact CE1-CZ 3.72Å; F139-F208 HydrophobicContact CE2-CD1 4.22Å; F139-F208 HydrophobicContact CE2-CE1 4.03Å; F139-F208 HydrophobicContact CG-CB 4.34Å; F139-F208 AromaticContact CG-CD1 3.36Å; F139-F208 HydrophobicContact CG-CD1 3.36Å; F139-F208 HydrophobicContact CG-CD2 4.42Å; F139-F208 AromaticContact CG-CE1 3.62Å; F139-F208 HydrophobicContact CG-CE1 3.62Å; F139-F208 AromaticContact CG-CG 3.8Å; F139-F208 HydrophobicContact CG-CG 3.8Å; F139-F208 HydrophobicContact CG-CZ 4.26Å; F139-F208 HydrophobicContact CZ-CD1 4.42Å; F139-F208 AromaticContact CZ-CE1 3.82Å; F139-F208 HydrophobicContact CZ-CE1 3.82Å; F139-F208 HydrophobicContact CZ-CZ 4.44Å; L142-F208 CarbonylContact C-O 3.45Å; L142-F208 WeakPolarHBondContact CA-O 3.33Å; L142-F208 HydrophobicContact CB-CD1 3.98Å; V143-F208 PolarHBondContact N-O 2.89Å; S206-F208 VanDerWaalsContact C-N 3.28Å; S206-F208 PolarHBondContact OG-N 2.9Å; F208-V210 HydrophobicContact CD1-CG2 4.32Å; F208-V210 HydrophobicContact CE1-CG2 3.77Å; F208-V210 HydrophobicContact CZ-CG2 4.38Å; F208-C283 HydrophobicContact CE1-CB 4.44Å; F208-C283 HydrophobicContact CE2-CB 3.94Å; F208-C283 HydrophobicContact CZ-CB 3.62Å; F208-A284 WeakPolarHBondContact CD2-O 3.18Å; F208-H285 HydrophobicContact CD2-CB 4.24Å
209	E	98.6	Very high	97.3	Very high	83 Å²	83	48.3 Å²	48.3	39%	0.388	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	130.8	177	-177.3	170.6	-161.4	0	0	110.2	V143 S145 C283 A284	V143-E209 HydrophobicContact CG1-CB 3.78Å; V143-E209 HydrophobicContact CG1-CG 4.07Å; V143-E209 WeakPolarHBondContact O-CA 3.44Å; S145-E209 WeakPolarHBondContact CB-OE1 3.33Å; S145-E209 PolarHBondContact OG-OE1 2.92Å; E209-C283 CarbonylContact O-C 3.6Å; E209-C283 WeakPolarHBondContact O-CA 3.25Å; E209-C283 WeakPolarHBondContact O-CB 3.49Å; E209-A284 PolarHBondContact N-O 3.24Å; E209-A284 PolarHBondContact O-N 3.1Å
210	V	98.6	Very high	97	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	119.6	163.9	176.8	0	0	0	0	107.5	V128 V132 L142 V143 F144 S145 F194 F208 C283	V128-V210 HydrophobicContact CG1-CG1 3.95Å; V132-V210 HydrophobicContact CG1-CG2 4.11Å; V132-V210 HydrophobicContact CG2-CB 4.45Å; V132-V210 HydrophobicContact CG2-CG1 3.74Å; V132-V210 HydrophobicContact CG2-CG2 3.81Å; L142-V210 HydrophobicContact CB-CG2 4.48Å; L142-V210 HydrophobicContact CD1-CB 3.99Å; L142-V210 HydrophobicContact CD1-CG2 3.66Å; V143-V210 PolarHBondContact O-N 2.86Å; F144-V210 HydrophobicContact CD2-CB 4.47Å; F144-V210 HydrophobicContact CD2-CG1 4.39Å; F144-V210 WeakPolarHBondContact CD2-O 3.32Å; S145-V210 PolarHBondContact N-O 2.82Å; F194-V210 HydrophobicContact CE1-CG1 4.49Å; F208-V210 HydrophobicContact CD1-CG2 4.32Å; F208-V210 HydrophobicContact CE1-CG2 3.77Å; F208-V210 HydrophobicContact CZ-CG2 4.38Å; V210-C283 HydrophobicContact CG2-CB 4.16Å
211	S	98.3	Very high	96.7	Very high	21 Å²	21	54.5 Å²	54.5	15%	0.147	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	140.7	-177	89.7	0	0	0	0	111.6	S145 I281 E282	S145-S211 WeakPolarHBondContact O-CA 3.41Å; S211-I281 WeakPolarHBondContact O-CA 3.49Å; S211-E282 PolarHBondContact N-O 3.48Å; S211-E282 PolarHBondContact O-N 3.25Å
212	V	98.4	Very high	96.3	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	126.2	171.4	179.2	0	0	0	0	109.4	F124 V128 F144 S145 V146 S147 F214 V278 E280 I281	F124-V212 HydrophobicContact CZ-CG1 4.14Å; V128-V212 HydrophobicContact CG1-CG2 4.05Å; V128-V212 HydrophobicContact CG2-CG2 4.17Å; F144-V212 HydrophobicContact CE2-CB 4.4Å; F144-V212 HydrophobicContact CE2-CG2 3.93Å; F144-V212 HydrophobicContact CZ-CG2 4.41Å; S145-V212 PolarHBondContact O-N 2.97Å; V146-V212 WeakPolarHBondContact CA-O 3.33Å; S147-V212 PolarHBondContact N-O 3.13Å; V212-F214 HydrophobicContact CB-CE2 4.39Å; V212-F214 HydrophobicContact CG1-CD2 4.01Å; V212-F214 HydrophobicContact CG1-CE1 4.36Å; V212-F214 HydrophobicContact CG1-CE2 3.48Å; V212-F214 VanDerWaalsContact CG1-CE2 3.48Å; V212-F214 HydrophobicContact CG1-CZ 3.68Å; V212-V278 HydrophobicContact CG1-CG1 4.33Å; V212-E280 WeakPolarHBondContact CA-O 3.4Å; V212-I281 HydrophobicContact CG2-CG1 4.35Å; V212-I281 HydrophobicContact CG2-CG2 4.47Å
213	V	97.9	Very high	96	Very high	30 Å²	30	50.1 Å²	50.1	18%	0.182	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123.7	178.3	-173.4	0	0	0	0	109.5	L279 E280	V213-L279 HydrophobicContact CB-CB 4.3Å; V213-L279 HydrophobicContact CG1-CB 4.2Å; V213-L279 HydrophobicContact CG1-CD2 3.87Å; V213-L279 WeakPolarHBondContact O-CB 3.47Å; V213-L279 PolarHBondContact O-N 3.35Å; V213-E280 HydrophobicContact CB-CB 4.03Å; V213-E280 HydrophobicContact CG2-CB 4.06Å; V213-E280 WeakPolarHBondContact CG2-OE2 3.36Å; V213-E280 PolarHBondContact N-O 3.24Å; V213-E280 PolarHBondContact O-N 3.43Å
214	F	98.1	Very high	95.7	Very high	5 Å²	5	50.7 Å²	50.7	2%	0.022	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	137.7	175	-67.5	-82.4	0	0	0	111.2	I115 F119 F124 V146 S147 F148 P149 Y186 V212 C276 T277 V278	I115-F214 HydrophobicContact CD1-CB 3.99Å; I115-F214 HydrophobicContact CD1-CD1 3.64Å; I115-F214 HydrophobicContact CD1-CD2 3.59Å; I115-F214 HydrophobicContact CD1-CE1 3.91Å; I115-F214 HydrophobicContact CD1-CE2 3.85Å; I115-F214 HydrophobicContact CD1-CG 3.46Å; I115-F214 VanDerWaalsContact CD1-CG 3.46Å; I115-F214 HydrophobicContact CD1-CZ 4.01Å; F119-F214 HydrophobicContact CB-CE1 3.93Å; F119-F214 HydrophobicContact CB-CZ 3.83Å; F119-F214 AromaticContact CD1-CE1 3.59Å; F119-F214 HydrophobicContact CD1-CE1 3.59Å; F119-F214 HydrophobicContact CD1-CZ 4.15Å; F119-F214 HydrophobicContact CD2-CD1 4.39Å; F119-F214 AromaticContact CD2-CE1 3.83Å; F119-F214 HydrophobicContact CD2-CE1 3.83Å; F119-F214 HydrophobicContact CE1-CE1 4.05Å; F119-F214 HydrophobicContact CE2-CE1 4.26Å; F119-F214 HydrophobicContact CG-CD1 4.46Å; F119-F214 AromaticContact CG-CE1 3.49Å; F119-F214 HydrophobicContact CG-CE1 3.49Å; F119-F214 VanDerWaalsContact CG-CE1 3.49Å; F119-F214 AromaticContact CG-CZ 3.93Å; F119-F214 HydrophobicContact CG-CZ 3.93Å; F119-F214 HydrophobicContact CZ-CE1 4.37Å; F124-F214 AromaticContact CE1-CZ 3.9Å; F124-F214 HydrophobicContact CE1-CZ 3.9Å; F124-F214 HydrophobicContact CZ-CE1 4.23Å; F124-F214 AromaticContact CZ-CZ 3.89Å; F124-F214 HydrophobicContact CZ-CZ 3.89Å; V146-F214 HydrophobicContact CG2-CD2 3.89Å; V146-F214 HydrophobicContact CG2-CE2 3.75Å; S147-F214 PolarHBondContact O-N 3.28Å; F148-F214 AromaticContact CD1-CD2 3.84Å; F148-F214 HydrophobicContact CD1-CD2 3.84Å; F148-F214 HydrophobicContact CE1-CD2 4.01Å; F148-F214 HydrophobicContact CE1-CE2 4.24Å; P149-F214 WeakPolarHBondContact CD-O 3.06Å; P149-F214 HydrophobicContact CG-CB 4.47Å; Y186-F214 WeakPolarHBondContact OH-CZ 3.47Å; V212-F214 HydrophobicContact CB-CE2 4.39Å; V212-F214 HydrophobicContact CG1-CD2 4.01Å; V212-F214 HydrophobicContact CG1-CE1 4.36Å; V212-F214 HydrophobicContact CG1-CE2 3.48Å; V212-F214 VanDerWaalsContact CG1-CE2 3.48Å; V212-F214 HydrophobicContact CG1-CZ 3.68Å; F214-C276 HydrophobicContact CB-CB 4.28Å; F214-C276 HydrophobicContact CD1-CB 3.99Å; F214-T277 WeakPolarHBondContact CA-O 3.46Å; F214-V278 HydrophobicContact CD1-CG2 4.11Å; F214-V278 HydrophobicContact CE1-CG2 3.71Å
215	A	96.8	Very high	95.6	Very high	24 Å²	24	48.8 Å²	48.8	20%	0.198	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	163.3	170.7	0	0	0	0	0	110.1	C276 T277 L279	A215-C276 CarbonylContact O-C 3.49Å; A215-C276 WeakPolarHBondContact O-CA 3.29Å; A215-T277 PolarHBondContact N-O 3.3Å; A215-T277 PolarHBondContact O-N 3.04Å; A215-T277 PolarHBondContact O-OG1 3.18Å; A215-L279 HydrophobicContact CB-CB 4.32Å; A215-L279 HydrophobicContact CB-CD1 4.37Å
216	H	97.2	Very high	95.4	Very high	6 Å²	6	40 Å²	40	3%	0.028	21%	0.214	C	C	.	.			trans	-145.7	89.3	170.6	-168.2	-83.4	0	0	0	110	L113 P149 Q151 E218 T219 V220 A274 V275	L113-H216 HydrophobicContact CD1-CB 3.92Å; P149-H216 HydrophobicContact CB-CB 4.35Å; P149-H216 HydrophobicContact CG-CB 4Å; Q151-H216 PolarHBondContact NE2-O 3.26Å; H216-E218 VanDerWaalsContact C-N 3.33Å; H216-E218 IonicContact CE1-OE2 2.7Å; H216-E218 PolarHBondContact O-N 2.95Å; H216-T219 WeakPolarHBondContact ND1-CG2 3.46Å; H216-T219 PolarHBondContact ND1-N 2.7Å; H216-T219 PolarHBondContact ND1-OG1 2.94Å; H216-T219 PolarHBondContact O-N 2.96Å; H216-T219 PolarHBondContact O-OG1 2.79Å; H216-V220 PolarHBondContact O-N 2.81Å; H216-A274 PolarHBondContact NE2-O 2.86Å; H216-V275 PolarHBondContact CD2-O 3.19Å
217	P	95	Very high	95.1	Very high	89 Å²	89	40.3 Å²	40.3	58%	0.578	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-58.5	-38.9	-172	-27.6	36.2	0	0	0	114.2	T219 V220	P217-T219 PolarHBondContact O-N 3.09Å; P217-T219 VanDerWaalsContact O-N 3.08Å; P217-V220 WeakPolarHBondContact O-CG1 3.39Å; P217-V220 PolarHBondContact O-N 2.85Å
218	E	95.2	Very high	94.7	Very high	93 Å²	93	39.8 Å²	39.8	44%	0.435	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-59.1	-22.6	-179.6	169.4	-179.5	-163.7	0	0	113.5	H216 K273 A274	H216-E218 VanDerWaalsContact C-N 3.33Å; H216-E218 IonicContact CE1-OE2 2.7Å; H216-E218 PolarHBondContact O-N 2.95Å; E218-K273 WeakPolarHBondContact OE1-CB 3.15Å; E218-K273 WeakPolarHBondContact OE1-CG 3.49Å; E218-K273 PolarHBondContact OE1-N 2.88Å; E218-K273 PolarHBondContact OE2-N 2.83Å; E218-A274 PolarHBondContact OE2-N 3.11Å; E218-A274 VanDerWaalsContact OE2-N 3.07Å
219	T	94.6	Very high	94.3	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.031	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-123.9	16.4	-175.7	61.9	0	0	0	0	113	Q151 H216 P217 E221 D222	Q151-T219 VanDerWaalsContact CG-O 3.25Å; Q151-T219 WeakPolarHBondContact CG-O 3.21Å; Q151-T219 PolarHBondContact NE2-O 3.4Å; Q151-T219 PolarHBondContact NE2-OG1 3.05Å; H216-T219 WeakPolarHBondContact ND1-CG2 3.46Å; H216-T219 PolarHBondContact ND1-N 2.7Å; H216-T219 PolarHBondContact ND1-OG1 2.94Å; H216-T219 PolarHBondContact O-N 2.96Å; H216-T219 PolarHBondContact O-OG1 2.79Å; P217-T219 PolarHBondContact O-N 3.09Å; P217-T219 VanDerWaalsContact O-N 3.08Å; T219-E221 PolarHBondContact O-N 3.06Å; T219-E221 VanDerWaalsContact O-N 3.1Å; T219-D222 WeakPolarHBondContact CB-OD2 3.2Å; T219-D222 VanDerWaalsContact O-CB 3.3Å; T219-D222 WeakPolarHBondContact O-CB 3.17Å; T219-D222 PolarHBondContact O-N 2.79Å; T219-D222 VanDerWaalsContact O-N 3.09Å
220	V	91.9	Very high	93.9	Very high	76 Å²	76	39.2 Å²	39.2	46%	0.461	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-58	-27.1	180	71.8	0	0	0	0	112.2	H216 P217	H216-V220 PolarHBondContact O-N 2.81Å; P217-V220 WeakPolarHBondContact O-CG1 3.39Å; P217-V220 PolarHBondContact O-N 2.85Å
221	E	91.3	Very high	93.4	Very high	142 Å²	142	43.4 Å²	43.4	66%	0.664	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-83.5	-12.5	-178.9	-50.5	-161.4	146.9	0	0	114.8	T219 C223 H224	T219-E221 PolarHBondContact O-N 3.06Å; T219-E221 VanDerWaalsContact O-N 3.1Å; E221-C223 PolarHBondContact O-N 3.01Å; E221-H224 WeakPolarHBondContact CA-ND1 3.49Å; E221-H224 WeakPolarHBondContact CB-ND1 3.36Å; E221-H224 WeakPolarHBondContact O-CB 3.25Å; E221-H224 PolarHBondContact O-N 2.91Å
222	D	91.2	Very high	93.1	Very high	30 Å²	30	45.5 Å²	45.5	16%	0.16	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-55.1	-21.4	-179.5	-77.3	13.8	0	0	0	112.6	Q151 R155 T219 F225 F265	Q151-D222 HydrophobicContact CB-CB 3.75Å; Q151-D222 HydrophobicContact CG-CB 4.45Å; R155-D222 IonicContact CZ-OD2 3.87Å; R155-D222 IonicContact NE-OD2 2.72Å; R155-D222 PolarHBondContact NE-OD2 2.91Å; R155-D222 IonicContact NH2-OD1 3.85Å; R155-D222 IonicContact NH2-OD2 3.7Å; R155-D222 PolarHBondContact NH2-OD2 3Å; T219-D222 WeakPolarHBondContact CB-OD2 3.2Å; T219-D222 VanDerWaalsContact O-CB 3.3Å; T219-D222 WeakPolarHBondContact O-CB 3.17Å; T219-D222 PolarHBondContact O-N 2.79Å; T219-D222 VanDerWaalsContact O-N 3.09Å; D222-F225 VanDerWaalsContact O-CD1 3.29Å; D222-F225 WeakPolarHBondContact O-CD1 3.42Å; D222-F225 WeakPolarHBondContact O-CE1 3.35Å; D222-F265 HydrophobicContact CB-CE2 3.78Å
223	C	90.4	Very high	92.6	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.02	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-102.4	-6.1	175.7	61.7	0	0	0	0	115.7	V154 E221 F225 L226 F244 V249	V154-C223 HydrophobicContact CG2-CB 4.06Å; E221-C223 PolarHBondContact O-N 3.01Å; C223-F225 VanDerWaalsContact C-N 3.34Å; C223-F225 PolarHBondContact O-N 2.8Å; C223-L226 HydrophobicContact CB-CD1 4.43Å; C223-L226 WeakPolarHBondContact O-CB 3.27Å; C223-L226 PolarHBondContact O-N 3.33Å; C223-F244 HydrophobicContact CB-CD1 4.22Å; C223-F244 WeakPolarHBondContact O-CE1 3.4Å; C223-V249 HydrophobicContact CB-CG1 4.46Å; C223-V249 HydrophobicContact CB-CG2 3.97Å
224	H	91.8	Very high	92.1	Very high	83 Å²	83	45.3 Å²	45.3	38%	0.384	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-37.8	-176.1	-75.7	147.2	0	0	0	112.8	E221 L226 A227 F244	E221-H224 WeakPolarHBondContact CA-ND1 3.49Å; E221-H224 WeakPolarHBondContact CB-ND1 3.36Å; E221-H224 WeakPolarHBondContact O-CB 3.25Å; E221-H224 PolarHBondContact O-N 2.91Å; H224-L226 PolarHBondContact O-N 2.89Å; H224-L226 VanDerWaalsContact O-N 3.15Å; H224-A227 WeakPolarHBondContact O-CB 3.39Å; H224-A227 PolarHBondContact O-N 3.11Å; H224-F244 AromaticContact CD2-CE2 3.52Å; H224-F244 AromaticContact CD2-CZ 3.59Å
225	F	92.6	Very high	91.2	Very high	29 Å²	29	52.7 Å²	52.7	13%	0.127	30%	0.295	C	S	.	.	H	α-helix	trans	-59.4	-28.9	-179.7	81.7	-88.5	0	0	0	113	V154 D222 C223 A227 A228 I229 I256 F261 Q264 F265	V154-F225 HydrophobicContact CG1-CE1 3.87Å; V154-F225 HydrophobicContact CG1-CZ 4.25Å; D222-F225 VanDerWaalsContact O-CD1 3.29Å; D222-F225 WeakPolarHBondContact O-CD1 3.42Å; D222-F225 WeakPolarHBondContact O-CE1 3.35Å; C223-F225 VanDerWaalsContact C-N 3.34Å; C223-F225 PolarHBondContact O-N 2.8Å; F225-A227 PolarHBondContact O-N 3.13Å; F225-A228 PolarHBondContact O-N 2.93Å; F225-A228 VanDerWaalsContact O-N 3.14Å; F225-I229 HydrophobicContact CD2-CD1 3.75Å; F225-I229 HydrophobicContact CE2-CD1 4.17Å; F225-I229 PolarHBondContact O-N 3.07Å; F225-I256 HydrophobicContact CE2-CD1 3.73Å; F225-F261 HydrophobicContact CE2-CD2 4.36Å; F225-F261 AromaticContact CZ-CD2 3.91Å; F225-F261 HydrophobicContact CZ-CD2 3.91Å; F225-F261 AromaticContact CZ-CE2 3.95Å; F225-F261 HydrophobicContact CZ-CE2 3.95Å; F225-Q264 HydrophobicContact CB-CB 4.48Å; F225-Q264 HydrophobicContact CD2-CB 3.49Å; F225-Q264 VanDerWaalsContact CD2-CB 3.49Å; F225-Q264 HydrophobicContact CD2-CG 3.98Å; F225-Q264 HydrophobicContact CE2-CB 3.77Å; F225-Q264 HydrophobicContact CE2-CG 4.47Å; F225-Q264 HydrophobicContact CG-CB 4.01Å; F225-Q264 HydrophobicContact CZ-CB 4.49Å; F225-F265 HydrophobicContact CE1-CB 4.08Å; F225-F265 HydrophobicContact CE1-CD2 4.11Å; F225-F265 HydrophobicContact CE1-CG 4.4Å; F225-F265 HydrophobicContact CZ-CB 4.02Å
226	L	92.3	Very high	90.2	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-64.7	-26.9	177.2	-64.3	172.9	0	0	0	112.8	V154 C223 H224 A228 I229 C230 F234 V249 A252 L253 I256	V154-L226 HydrophobicContact CG2-CD1 4.03Å; C223-L226 HydrophobicContact CB-CD1 4.43Å; C223-L226 WeakPolarHBondContact O-CB 3.27Å; C223-L226 PolarHBondContact O-N 3.33Å; H224-L226 PolarHBondContact O-N 2.89Å; H224-L226 VanDerWaalsContact O-N 3.15Å; L226-A228 VanDerWaalsContact C-N 3.35Å; L226-I229 PolarHBondContact O-N 2.79Å; L226-C230 WeakPolarHBondContact O-CA 3.23Å; L226-C230 PolarHBondContact O-N 3.14Å; L226-F234 HydrophobicContact CB-CE2 3.8Å; L226-F234 HydrophobicContact CB-CZ 3.75Å; L226-F234 WeakPolarHBondContact O-CE2 3.42Å; L226-V249 HydrophobicContact CD1-CG1 3.83Å; L226-A252 HydrophobicContact CB-CB 4.08Å; L226-A252 HydrophobicContact CD1-CB 4.3Å; L226-A252 HydrophobicContact CD2-CB 4.35Å; L226-A252 HydrophobicContact CG-CB 4.49Å; L226-L253 HydrophobicContact CD1-CD2 4.06Å; L226-L253 HydrophobicContact CD1-CG 4.04Å; L226-L253 HydrophobicContact CD2-CD2 4.04Å; L226-I256 HydrophobicContact CD2-CD1 3.85Å
227	A	90.5	Very high	88.8	Confident	29 Å²	29	59.3 Å²	59.3	24%	0.24	34%	0.341	C	S	.	.	H	α-helix	trans	-72.9	-28.2	175.9	0	0	0	0	0	112.7	H224 F225 P231 F234 F244	H224-A227 WeakPolarHBondContact O-CB 3.39Å; H224-A227 PolarHBondContact O-N 3.11Å; F225-A227 PolarHBondContact O-N 3.13Å; A227-P231 VanDerWaalsContact O-CA 3.32Å; A227-P231 WeakPolarHBondContact O-CA 3.33Å; A227-P231 WeakPolarHBondContact O-CB 3.41Å; A227-F234 HydrophobicContact CB-CD2 3.95Å; A227-F234 HydrophobicContact CB-CE2 4.43Å; A227-F234 HydrophobicContact CB-CG 4.24Å; A227-F244 HydrophobicContact CB-CE1 3.84Å; A227-F244 HydrophobicContact CB-CZ 3.65Å
228	A	89.1	Confident	87	Confident	87 Å²	87	64.6 Å²	64.6	72%	0.719	35%	0.354	S	S	*	.	H	α-helix	trans	-73.5	-35.7	173.2	0	0	0	0	0	112.1	F225 L226	F225-A228 PolarHBondContact O-N 2.93Å; F225-A228 VanDerWaalsContact O-N 3.14Å; L226-A228 VanDerWaalsContact C-N 3.35Å
229	I	90.5	Very high	85.2	Confident	60 Å²	60	68.3 Å²	68.3	31%	0.308	38%	0.377	S	S	.	.	H	α-helix	trans	-88	-36.3	-176.5	-58.7	174.2	0	0	0	112.5	F225 L226 P231 I256 Q264	F225-I229 HydrophobicContact CD2-CD1 3.75Å; F225-I229 HydrophobicContact CE2-CD1 4.17Å; F225-I229 PolarHBondContact O-N 3.07Å; L226-I229 PolarHBondContact O-N 2.79Å; I229-P231 VanDerWaalsContact C-CD 3.45Å; I229-I256 HydrophobicContact CB-CD1 4.48Å; I229-I256 HydrophobicContact CD1-CD1 3.59Å; I229-I256 HydrophobicContact CD1-CG1 4.49Å; I229-I256 HydrophobicContact CG2-CD1 4.1Å; I229-I256 HydrophobicContact CG2-CG1 4.06Å; I229-Q264 HydrophobicContact CD1-CG 4.1Å
230	C	90.3	Very high	83.6	Confident	10 Å²	10	74.5 Å²	74.5	7%	0.068	40%	0.404	C	S	.	.			trans	-129.5	59.3	-176.8	-69.8	0	0	0	0	111.6	L226 D232 C233 F234 A252	L226-C230 WeakPolarHBondContact O-CA 3.23Å; L226-C230 PolarHBondContact O-N 3.14Å; C230-D232 PolarHBondContact O-N 2.8Å; C230-D232 VanDerWaalsContact O-N 3.09Å; C230-C233 HydrophobicContact CB-CB 4.5Å; C230-C233 WeakPolarHBondContact O-CB 3.43Å; C230-C233 PolarHBondContact O-N 3.48Å; C230-F234 WeakPolarHBondContact O-CD2 3.5Å; C230-A252 HydrophobicContact CB-CB 3.92Å
231	P	89.1	Confident	82.1	Confident	88 Å²	88	80.9 Å²	80.9	57%	0.571	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-59.8	-25.8	-175.1	23.4	-34.4	0	0	0	113.4	A227 I229 C233 F234	A227-P231 VanDerWaalsContact O-CA 3.32Å; A227-P231 WeakPolarHBondContact O-CA 3.33Å; A227-P231 WeakPolarHBondContact O-CB 3.41Å; I229-P231 VanDerWaalsContact C-CD 3.45Å; P231-C233 PolarHBondContact O-N 2.94Å; P231-F234 PolarHBondContact O-N 2.86Å
232	D	90.2	Very high	81.3	Confident	66 Å²	66	77.2 Å²	77.2	35%	0.353	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-67	-16.9	178.3	85.2	-75.1	0	0	0	114.1	C230 K255	C230-D232 PolarHBondContact O-N 2.8Å; C230-D232 VanDerWaalsContact O-N 3.09Å; D232-K255 IonicContact OD1-NZ 3.78Å; D232-K255 PolarHBondContact OD1-NZ 3.04Å; D232-K255 IonicContact OD2-NZ 3.11Å; D232-K255 PolarHBondContact OD2-NZ 3.01Å
233	C	88.1	Confident	80.8	Confident	13 Å²	13	78 Å²	78	9%	0.088	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-82.4	-23.2	176.9	-69.8	0	0	0	0	113.7	C230 P231 K251 A252	C230-C233 HydrophobicContact CB-CB 4.5Å; C230-C233 WeakPolarHBondContact O-CB 3.43Å; C230-C233 PolarHBondContact O-N 3.48Å; P231-C233 PolarHBondContact O-N 2.94Å; C233-K251 HydrophobicContact CB-CD 4.43Å; C233-A252 HydrophobicContact CB-CB 4.14Å
234	F	87.5	Confident	80.6	Confident	14 Å²	14	79.4 Å²	79.4	6%	0.061	43%	0.43	C	S	.	.			trans	-110.5	43.9	-169	-60.6	-81.3	0	0	0	112.9	L226 A227 C230 P231 V243 F244 A248 V249 A252	L226-F234 HydrophobicContact CB-CE2 3.8Å; L226-F234 HydrophobicContact CB-CZ 3.75Å; L226-F234 WeakPolarHBondContact O-CE2 3.42Å; A227-F234 HydrophobicContact CB-CD2 3.95Å; A227-F234 HydrophobicContact CB-CE2 4.43Å; A227-F234 HydrophobicContact CB-CG 4.24Å; C230-F234 WeakPolarHBondContact O-CD2 3.5Å; P231-F234 PolarHBondContact O-N 2.86Å; F234-V243 HydrophobicContact CB-CB 4.28Å; F234-V243 HydrophobicContact CB-CG2 4.16Å; F234-F244 AromaticContact CD1-CD1 3.67Å; F234-F244 HydrophobicContact CD1-CD1 3.67Å; F234-F244 AromaticContact CD1-CE1 3.81Å; F234-F244 HydrophobicContact CD1-CE1 3.81Å; F234-F244 HydrophobicContact CD1-CG 4.32Å; F234-F244 AromaticContact CE1-CD1 3.42Å; F234-F244 HydrophobicContact CE1-CD1 3.42Å; F234-F244 VanDerWaalsContact CE1-CD1 3.42Å; F234-F244 AromaticContact CE1-CE1 3.75Å; F234-F244 HydrophobicContact CE1-CE1 3.75Å; F234-F244 HydrophobicContact CE1-CG 4.33Å; F234-F244 HydrophobicContact CG-CE1 4.32Å; F234-F244 HydrophobicContact CZ-CD1 4.19Å; F234-F244 HydrophobicContact CZ-CE1 4.21Å; F234-A248 HydrophobicContact CD1-CB 3.95Å; F234-A248 HydrophobicContact CE1-CB 3.9Å; F234-V249 HydrophobicContact CE1-CG2 4.09Å; F234-V249 HydrophobicContact CZ-CG2 4.48Å; F234-A252 HydrophobicContact CE2-CB 3.67Å; F234-A252 HydrophobicContact CZ-CB 3.74Å
235	K	80.8	Confident	80.5	Confident	160 Å²	160	77.6 Å²	77.6	70%	0.696	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-70.2	132.5	179.4	-62.9	-173.1	-178	-174.1	0	111.1	A237	K235-A237 PolarHBondContact O-N 3.21Å
236	P	74.9	Confident	80.4	Confident	117 Å²	117	80 Å²	80	76%	0.76	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-58.2	127	172.6	-24.2	34	0	0	0	111.7	V243	P236-V243 HydrophobicContact CB-CG1 4.46Å; P236-V243 HydrophobicContact CG-CG1 4.29Å
237	A	68.2	Low	80.4	Confident	52 Å²	52	87.1 Å²	87.1	43%	0.43	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-97.1	144	168.1	0	0	0	0	0	109.2	K235 N239 K240	K235-A237 PolarHBondContact O-N 3.21Å; A237-N239 PolarHBondContact O-N 2.86Å; A237-K240 HydrophobicContact CB-CB 4.48Å; A237-K240 HydrophobicContact CB-CD 4.11Å; A237-K240 HydrophobicContact CB-CG 4.17Å; A237-K240 PolarHBondContact O-N 2.64Å
238	K	57.6	Low	80.4	Confident	200 Å²	200	86.2 Å²	86.2	87%	0.87	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	133.6	168.3	-67.2	-173.8	177.6	-175.9	0	108.6
239	N	56.6	Low	80.7	Confident	170 Å²	170	82.1 Å²	82.1	91%	0.909	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	22.7	176	-46.8	-4.6	0	0	0	116.7	A237	A237-N239 PolarHBondContact O-N 2.86Å
240	K	60.1	Low	80.8	Confident	135 Å²	135	81.6 Å²	81.6	59%	0.587	42%	0.424	S	S	*	.			trans	-111	129.9	168.7	-69.1	-165.2	177.4	-174.3	0	112.2	A237 S242 T245	A237-K240 HydrophobicContact CB-CB 4.48Å; A237-K240 HydrophobicContact CB-CD 4.11Å; A237-K240 HydrophobicContact CB-CG 4.17Å; A237-K240 PolarHBondContact O-N 2.64Å; K240-S242 VanDerWaalsContact C-N 3.33Å; K240-S242 PolarHBondContact O-N 3Å; K240-T245 HydrophobicContact CD-CG2 4.2Å
241	Q	60.7	Low	81	Confident	211 Å²	211	86 Å²	86	99%	0.986	44%	0.441	S	S	*	.	S	Bend	trans	-70.2	-25.2	177.8	-68.5	178.5	-6.6	0	0	113.5
242	S	75.3	Confident	81.3	Confident	64 Å²	64	81.8 Å²	81.8	45%	0.448	41%	0.414	S	S	.	.			trans	-137.5	143.6	176.6	178.9	0	0	0	0	112	K240 F244	K240-S242 VanDerWaalsContact C-N 3.33Å; K240-S242 PolarHBondContact O-N 3Å; S242-F244 PolarHBondContact OG-N 3.06Å
243	V	81.3	Confident	81.5	Confident	48 Å²	48	78.8 Å²	78.8	29%	0.291	40%	0.398	S	S	.	.	S	Bend	trans	-79.7	-21.8	172.8	-63.6	0	0	0	0	112.6	F234 P236 T245	F234-V243 HydrophobicContact CB-CB 4.28Å; F234-V243 HydrophobicContact CB-CG2 4.16Å; P236-V243 HydrophobicContact CB-CG1 4.46Å; P236-V243 HydrophobicContact CG-CG1 4.29Å; V243-T245 PolarHBondContact O-N 3.36Å
244	F	86	Confident	81.8	Confident	31 Å²	31	83.3 Å²	83.3	14%	0.136	42%	0.422	C	S	.	.			trans	-81.1	53.9	-176.2	-65.1	-82.5	0	0	0	112.5	P150 C223 H224 A227 F234 S242	P150-F244 WeakPolarHBondContact CB-O 3.38Å; P150-F244 WeakPolarHBondContact CG-O 3.11Å; C223-F244 HydrophobicContact CB-CD1 4.22Å; C223-F244 WeakPolarHBondContact O-CE1 3.4Å; H224-F244 AromaticContact CD2-CE2 3.52Å; H224-F244 AromaticContact CD2-CZ 3.59Å; A227-F244 HydrophobicContact CB-CE1 3.84Å; A227-F244 HydrophobicContact CB-CZ 3.65Å; F234-F244 AromaticContact CD1-CD1 3.67Å; F234-F244 HydrophobicContact CD1-CD1 3.67Å; F234-F244 AromaticContact CD1-CE1 3.81Å; F234-F244 HydrophobicContact CD1-CE1 3.81Å; F234-F244 HydrophobicContact CD1-CG 4.32Å; F234-F244 AromaticContact CE1-CD1 3.42Å; F234-F244 HydrophobicContact CE1-CD1 3.42Å; F234-F244 VanDerWaalsContact CE1-CD1 3.42Å; F234-F244 AromaticContact CE1-CE1 3.75Å; F234-F244 HydrophobicContact CE1-CE1 3.75Å; F234-F244 HydrophobicContact CE1-CG 4.33Å; F234-F244 HydrophobicContact CG-CE1 4.32Å; F234-F244 HydrophobicContact CZ-CD1 4.19Å; F234-F244 HydrophobicContact CZ-CE1 4.21Å; S242-F244 PolarHBondContact OG-N 3.06Å
245	T	89.9	Confident	82.1	Confident	45 Å²	45	87.7 Å²	87.7	28%	0.276	44%	0.441	S	S	.	.			trans	-67.9	149.2	171.7	67.5	0	0	0	0	110.7	K240 V243 M247 A248 V249	K240-T245 HydrophobicContact CD-CG2 4.2Å; V243-T245 PolarHBondContact O-N 3.36Å; T245-M247 PolarHBondContact O-N 3.09Å; T245-M247 VanDerWaalsContact O-N 3.08Å; T245-A248 WeakPolarHBondContact O-CA 3.34Å; T245-A248 WeakPolarHBondContact O-CB 3.49Å; T245-A248 PolarHBondContact O-N 3.13Å; T245-A248 WeakPolarHBondContact OG1-CB 3.35Å; T245-A248 PolarHBondContact OG1-N 3.02Å; T245-V249 PolarHBondContact O-N 3.19Å
246	R	90.4	Very high	82.8	Confident	79 Å²	79	80.8 Å²	80.8	30%	0.298	41%	0.411	S	S	.	.	H	α-helix	trans	-49.9	-38.2	176.1	-175.3	-178.2	176.7	-132	-2.3	112.5	V249 M250	R246-V249 PolarHBondContact O-N 3Å; R246-M250 HydrophobicContact CG-CG 4.47Å; R246-M250 WeakPolarHBondContact O-CB 3.4Å; R246-M250 VanDerWaalsContact O-CG 3.28Å; R246-M250 WeakPolarHBondContact O-CG 3.34Å; R246-M250 PolarHBondContact O-N 3.21Å
247	M	90.7	Very high	83.8	Confident	151 Å²	151	81 Å²	81	74%	0.744	40%	0.4	S	S	*	.	H	α-helix	trans	-67	-40.4	177.1	-171.1	60.8	72.7	0	0	112.9	T245 K251	T245-M247 PolarHBondContact O-N 3.09Å; T245-M247 VanDerWaalsContact O-N 3.08Å; M247-K251 WeakPolarHBondContact O-CB 3.45Å; M247-K251 PolarHBondContact O-N 3.08Å
248	A	91.9	Very high	85.1	Confident	10 Å²	10	82.5 Å²	82.5	8%	0.083	40%	0.398	C	S	.	.	H	α-helix	trans	-66.7	-42.4	175.4	0	0	0	0	0	111.8	F234 T245 K251 A252	F234-A248 HydrophobicContact CD1-CB 3.95Å; F234-A248 HydrophobicContact CE1-CB 3.9Å; T245-A248 WeakPolarHBondContact O-CA 3.34Å; T245-A248 WeakPolarHBondContact O-CB 3.49Å; T245-A248 PolarHBondContact O-N 3.13Å; T245-A248 WeakPolarHBondContact OG1-CB 3.35Å; T245-A248 PolarHBondContact OG1-N 3.02Å; A248-K251 PolarHBondContact O-N 2.92Å; A248-A252 PolarHBondContact O-N 3.11Å
249	V	94.7	Very high	86.9	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-61.1	-49.8	174.8	174.4	0	0	0	0	110.9	P150 V154 C223 L226 F234 T245 R246 K251 A252 L253	P150-V249 HydrophobicContact CB-CG2 4.07Å; V154-V249 HydrophobicContact CG2-CG1 4.01Å; C223-V249 HydrophobicContact CB-CG1 4.46Å; C223-V249 HydrophobicContact CB-CG2 3.97Å; L226-V249 HydrophobicContact CD1-CG1 3.83Å; F234-V249 HydrophobicContact CE1-CG2 4.09Å; F234-V249 HydrophobicContact CZ-CG2 4.48Å; T245-V249 PolarHBondContact O-N 3.19Å; R246-V249 PolarHBondContact O-N 3Å; V249-K251 VanDerWaalsContact C-N 3.32Å; V249-K251 PolarHBondContact O-N 2.64Å; V249-A252 PolarHBondContact O-N 2.81Å; V249-A252 VanDerWaalsContact O-N 3.15Å; V249-L253 HydrophobicContact CG1-CD1 3.77Å; V249-L253 HydrophobicContact CG1-CG 4.36Å; V249-L253 WeakPolarHBondContact O-CG 3.37Å; V249-L253 PolarHBondContact O-N 3.22Å
250	M	92.9	Very high	88.7	Confident	49 Å²	49	71.6 Å²	71.6	24%	0.241	35%	0.346	C	S	.	.	H	α-helix	trans	-58.2	-41.4	175.4	-76	-67.4	-66.5	0	0	112.5	S153 R246 A252 L253 N254	S153-M250 PolarHBondContact OG-SD 2.85Å; S153-M250 VanDerWaalsContact OG-SD 3.4Å; R246-M250 HydrophobicContact CG-CG 4.47Å; R246-M250 WeakPolarHBondContact O-CB 3.4Å; R246-M250 VanDerWaalsContact O-CG 3.28Å; R246-M250 WeakPolarHBondContact O-CG 3.34Å; R246-M250 PolarHBondContact O-N 3.21Å; M250-A252 PolarHBondContact O-N 3.28Å; M250-L253 PolarHBondContact O-N 2.9Å; M250-N254 VanDerWaalsContact O-CG 3.31Å; M250-N254 PolarHBondContact O-N 2.84Å; M250-N254 PolarHBondContact O-OD1 3.22Å
251	K	93.5	Very high	90.4	Very high	102 Å²	102	65.1 Å²	65.1	44%	0.443	32%	0.318	S	S	.	.	H	α-helix	trans	-63.1	-39.2	176.1	-172	-171.3	173.9	-167.7	0	112.3	C233 M247 A248 V249	C233-K251 HydrophobicContact CB-CD 4.43Å; M247-K251 WeakPolarHBondContact O-CB 3.45Å; M247-K251 PolarHBondContact O-N 3.08Å; A248-K251 PolarHBondContact O-N 2.92Å; V249-K251 VanDerWaalsContact C-N 3.32Å; V249-K251 PolarHBondContact O-N 2.64Å
252	A	95.3	Very high	92.1	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-69	-42.4	175.2	0	0	0	0	0	112.1	L226 C230 C233 F234 A248 V249 M250 N254 K255 I256	L226-A252 HydrophobicContact CB-CB 4.08Å; L226-A252 HydrophobicContact CD1-CB 4.3Å; L226-A252 HydrophobicContact CD2-CB 4.35Å; L226-A252 HydrophobicContact CG-CB 4.49Å; C230-A252 HydrophobicContact CB-CB 3.92Å; C233-A252 HydrophobicContact CB-CB 4.14Å; F234-A252 HydrophobicContact CE2-CB 3.67Å; F234-A252 HydrophobicContact CZ-CB 3.74Å; A248-A252 PolarHBondContact O-N 3.11Å; V249-A252 PolarHBondContact O-N 2.81Å; V249-A252 VanDerWaalsContact O-N 3.15Å; M250-A252 PolarHBondContact O-N 3.28Å; A252-N254 PolarHBondContact O-N 2.75Å; A252-K255 PolarHBondContact O-N 3.09Å; A252-I256 PolarHBondContact O-N 3.04Å
253	L	95.3	Very high	93.1	Very high	3 Å²	3	62 Å²	62	2%	0.016	30%	0.297	C	S	.	.	H	α-helix	trans	-64.6	-20.7	176.2	-68.7	167.8	0	0	0	113.9	S153 V154 H157 L226 V249 M250 F261	S153-L253 VanDerWaalsContact C-CD1 3.45Å; S153-L253 WeakPolarHBondContact O-CD1 3.36Å; V154-L253 HydrophobicContact CG2-CD1 4.46Å; H157-L253 HydrophobicContact CB-CD1 4.31Å; H157-L253 HydrophobicContact CB-CD2 4.09Å; H157-L253 PolarHBondContact CE1-O 3.42Å; L226-L253 HydrophobicContact CD1-CD2 4.06Å; L226-L253 HydrophobicContact CD1-CG 4.04Å; L226-L253 HydrophobicContact CD2-CD2 4.04Å; V249-L253 HydrophobicContact CG1-CD1 3.77Å; V249-L253 HydrophobicContact CG1-CG 4.36Å; V249-L253 WeakPolarHBondContact O-CG 3.37Å; V249-L253 PolarHBondContact O-N 3.22Å; M250-L253 PolarHBondContact O-N 2.9Å; L253-F261 HydrophobicContact CD2-CD2 3.9Å; L253-F261 HydrophobicContact CD2-CE2 3.59Å
254	N	93.8	Very high	93.7	Very high	109 Å²	109	65.3 Å²	65.3	58%	0.583	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-6.7	172.8	-69.5	3.6	0	0	0	113.4	R176 M250 A252	R176-N254 PolarHBondContact NH1-OD1 3.41Å; M250-N254 VanDerWaalsContact O-CG 3.31Å; M250-N254 PolarHBondContact O-N 2.84Å; M250-N254 PolarHBondContact O-OD1 3.22Å; A252-N254 PolarHBondContact O-N 2.75Å
255	K	94.2	Very high	94.2	Very high	105 Å²	105	64.6 Å²	64.6	46%	0.457	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-32.3	179.4	-75.9	-173.5	170.3	-157.5	0	113.8	D232 A252	D232-K255 IonicContact OD1-NZ 3.78Å; D232-K255 PolarHBondContact OD1-NZ 3.04Å; D232-K255 IonicContact OD2-NZ 3.11Å; D232-K255 PolarHBondContact OD2-NZ 3.01Å; A252-K255 PolarHBondContact O-N 3.09Å
256	I	95.6	Very high	94.5	Very high	16 Å²	16	65 Å²	65	8%	0.082	31%	0.31	C	S	.	.	S	Bend	trans	-61.1	140.9	-179.5	-169.6	162.8	0	0	0	110.4	F225 L226 I229 A252 D260 F261	F225-I256 HydrophobicContact CE2-CD1 3.73Å; L226-I256 HydrophobicContact CD2-CD1 3.85Å; I229-I256 HydrophobicContact CB-CD1 4.48Å; I229-I256 HydrophobicContact CD1-CD1 3.59Å; I229-I256 HydrophobicContact CD1-CG1 4.49Å; I229-I256 HydrophobicContact CG2-CD1 4.1Å; I229-I256 HydrophobicContact CG2-CG1 4.06Å; A252-I256 PolarHBondContact O-N 3.04Å; I256-D260 HydrophobicContact CG1-CB 4.27Å; I256-F261 HydrophobicContact CD1-CB 4Å; I256-F261 HydrophobicContact CD1-CD2 4.4Å; I256-F261 HydrophobicContact CG1-CB 4.24Å; I256-F261 HydrophobicContact CG2-CB 4.38Å; I256-F261 HydrophobicContact CG2-CD2 4.4Å
257	K	95.6	Very high	94.7	Very high	120 Å²	120	63.1 Å²	63.1	52%	0.522	31%	0.308	S	S	.	.			trans	-73.7	143.7	170.9	-62.1	-174.4	-179	175.8	0	110.3	E259 D260 F261	K257-E259 VanDerWaalsContact C-N 3.26Å; K257-E259 HydrophobicContact CB-CG 3.77Å; K257-E259 HydrophobicContact CD-CG 3.97Å; K257-E259 WeakPolarHBondContact CD-OE1 3.48Å; K257-E259 IonicContact NZ-OE1 2.89Å; K257-E259 PolarHBondContact NZ-OE1 3.24Å; K257-E259 PolarHBondContact O-N 3.08Å; K257-D260 HydrophobicContact CB-CB 4.38Å; K257-D260 PolarHBondContact O-N 3.32Å; K257-F261 PolarHBondContact O-N 3.26Å
258	E	95.1	Very high	94.9	Very high	85 Å²	85	58 Å²	58	40%	0.397	29%	0.286	S	S	.	.	H	α-helix	trans	-53.1	-43.9	176.4	-170.2	166.7	137.2	0	0	112.2	L161 K164 D260 F261 L262	L161-E258 HydrophobicContact CD1-CG 4.1Å; L161-E258 VanDerWaalsContact CD2-CD 3.46Å; L161-E258 HydrophobicContact CD2-CG 3.64Å; L161-E258 WeakPolarHBondContact CD2-OE2 3.39Å; K164-E258 IonicContact NZ-OE1 2.62Å; K164-E258 IonicContact NZ-OE2 2.92Å; K164-E258 PolarHBondContact NZ-OE2 3.26Å; E258-D260 VanDerWaalsContact C-N 3.33Å; E258-D260 PolarHBondContact O-N 3.46Å; E258-F261 PolarHBondContact O-N 2.79Å; E258-L262 HydrophobicContact CG-CD1 4.07Å; E258-L262 WeakPolarHBondContact O-CB 3.26Å; E258-L262 VanDerWaalsContact O-CG 3.28Å; E258-L262 WeakPolarHBondContact O-CG 3.1Å; E258-L262 PolarHBondContact O-N 3.03Å
259	E	95.2	Very high	95	Very high	95 Å²	95	57.6 Å²	57.6	44%	0.444	28%	0.282	S	S	.	.	H	α-helix	trans	-59.4	-36.8	175	51.5	159.7	159.1	0	0	114.1	K257 K263	K257-E259 VanDerWaalsContact C-N 3.26Å; K257-E259 HydrophobicContact CB-CG 3.77Å; K257-E259 HydrophobicContact CD-CG 3.97Å; K257-E259 WeakPolarHBondContact CD-OE1 3.48Å; K257-E259 IonicContact NZ-OE1 2.89Å; K257-E259 PolarHBondContact NZ-OE1 3.24Å; K257-E259 PolarHBondContact O-N 3.08Å; E259-K263 VanDerWaalsContact O-CD 3.28Å; E259-K263 WeakPolarHBondContact O-CD 2.94Å; E259-K263 WeakPolarHBondContact O-CE 3.39Å; E259-K263 WeakPolarHBondContact O-CG 3.45Å; E259-K263 PolarHBondContact O-N 2.93Å; E259-K263 IonicContact OE2-NZ 3.8Å; E259-K263 PolarHBondContact OE2-NZ 2.65Å
260	D	94.8	Very high	95	Very high	45 Å²	45	62.7 Å²	62.7	24%	0.241	31%	0.31	C	S	.	.	H	α-helix	trans	-84.9	-27.3	-177.2	-64.6	-34.1	0	0	0	111.9	I256 K257 E258 K263 Q264	I256-D260 HydrophobicContact CG1-CB 4.27Å; K257-D260 HydrophobicContact CB-CB 4.38Å; K257-D260 PolarHBondContact O-N 3.32Å; E258-D260 VanDerWaalsContact C-N 3.33Å; E258-D260 PolarHBondContact O-N 3.46Å; D260-K263 IonicContact OD1-NZ 3.5Å; D260-K263 PolarHBondContact OD1-NZ 2.86Å; D260-Q264 VanDerWaalsContact O-CG 3.24Å; D260-Q264 WeakPolarHBondContact O-CG 3.45Å
261	F	96.9	Very high	95	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64.7	-51.5	167.9	-177.7	-85.7	0	0	0	110.9	V154 H157 A158 L161 F225 L253 I256 K257 E258 K263 Q264 F265	V154-F261 HydrophobicContact CG1-CE2 3.85Å; V154-F261 HydrophobicContact CG1-CZ 3.98Å; H157-F261 HydrophobicContact CB-CE2 4.3Å; H157-F261 HydrophobicContact CB-CZ 4.27Å; H157-F261 AromaticContact CD2-CD1 3.98Å; H157-F261 AromaticContact CD2-CD2 3.64Å; H157-F261 AromaticContact CD2-CE1 3.92Å; H157-F261 AromaticContact CD2-CE2 3.56Å; H157-F261 AromaticContact CD2-CG 3.86Å; H157-F261 AromaticContact CD2-CZ 3.72Å; A158-F261 HydrophobicContact CB-CE1 3.82Å; A158-F261 HydrophobicContact CB-CZ 3.93Å; L161-F261 HydrophobicContact CD1-CD1 3.58Å; L161-F261 HydrophobicContact CD1-CE1 4Å; L161-F261 HydrophobicContact CD1-CG 4.32Å; F225-F261 HydrophobicContact CE2-CD2 4.36Å; F225-F261 AromaticContact CZ-CD2 3.91Å; F225-F261 HydrophobicContact CZ-CD2 3.91Å; F225-F261 AromaticContact CZ-CE2 3.95Å; F225-F261 HydrophobicContact CZ-CE2 3.95Å; L253-F261 HydrophobicContact CD2-CD2 3.9Å; L253-F261 HydrophobicContact CD2-CE2 3.59Å; I256-F261 HydrophobicContact CD1-CB 4Å; I256-F261 HydrophobicContact CD1-CD2 4.4Å; I256-F261 HydrophobicContact CG1-CB 4.24Å; I256-F261 HydrophobicContact CG2-CB 4.38Å; I256-F261 HydrophobicContact CG2-CD2 4.4Å; K257-F261 PolarHBondContact O-N 3.26Å; E258-F261 PolarHBondContact O-N 2.79Å; F261-K263 VanDerWaalsContact C-N 3.26Å; F261-K263 PolarHBondContact O-N 2.8Å; F261-Q264 PolarHBondContact O-N 3.45Å; F261-F265 HydrophobicContact CE1-CB 4.03Å; F261-F265 HydrophobicContact CE1-CD1 4.09Å; F261-F265 HydrophobicContact CE1-CG 4.46Å; F261-F265 HydrophobicContact CE2-CB 4.29Å; F261-F265 HydrophobicContact CZ-CB 3.89Å; F261-F265 AromaticContact CZ-CD1 3.75Å; F261-F265 HydrophobicContact CZ-CD1 3.75Å; F261-F265 HydrophobicContact CZ-CG 4.04Å; F261-F265 PolarHBondContact O-N 2.92Å
262	L	95.7	Very high	95	Very high	82 Å²	82	59.1 Å²	59.1	43%	0.429	30%	0.302	S	S	.	.	H	α-helix	trans	-66.4	-23.8	-177	-67.4	171.4	0	0	0	113.7	L161 E258 Q264 C267	L161-L262 HydrophobicContact CD1-CD2 4.09Å; L161-L262 HydrophobicContact CD1-CG 4.3Å; E258-L262 HydrophobicContact CG-CD1 4.07Å; E258-L262 WeakPolarHBondContact O-CB 3.26Å; E258-L262 VanDerWaalsContact O-CG 3.28Å; E258-L262 WeakPolarHBondContact O-CG 3.1Å; E258-L262 PolarHBondContact O-N 3.03Å; L262-Q264 VanDerWaalsContact C-N 3.29Å; L262-C267 HydrophobicContact CD2-CB 3.45Å; L262-C267 VanDerWaalsContact CD2-CB 3.45Å
263	K	95.4	Very high	94.9	Very high	128 Å²	128	68.4 Å²	68.4	56%	0.557	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-21.8	171	-73.1	162.6	-152.9	159.7	0	113.4	E259 D260 F261	E259-K263 VanDerWaalsContact O-CD 3.28Å; E259-K263 WeakPolarHBondContact O-CD 2.94Å; E259-K263 WeakPolarHBondContact O-CE 3.39Å; E259-K263 WeakPolarHBondContact O-CG 3.45Å; E259-K263 PolarHBondContact O-N 2.93Å; E259-K263 IonicContact OE2-NZ 3.8Å; E259-K263 PolarHBondContact OE2-NZ 2.65Å; D260-K263 IonicContact OD1-NZ 3.5Å; D260-K263 PolarHBondContact OD1-NZ 2.86Å; F261-K263 VanDerWaalsContact C-N 3.26Å; F261-K263 PolarHBondContact O-N 2.8Å
264	Q	95.7	Very high	94.9	Very high	117 Å²	117	70.6 Å²	70.6	55%	0.547	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-26.6	-166.9	-62.8	-71.9	-21.1	0	0	113.5	F225 I229 D260 F261 L262	F225-Q264 HydrophobicContact CB-CB 4.48Å; F225-Q264 HydrophobicContact CD2-CB 3.49Å; F225-Q264 VanDerWaalsContact CD2-CB 3.49Å; F225-Q264 HydrophobicContact CD2-CG 3.98Å; F225-Q264 HydrophobicContact CE2-CB 3.77Å; F225-Q264 HydrophobicContact CE2-CG 4.47Å; F225-Q264 HydrophobicContact CG-CB 4.01Å; F225-Q264 HydrophobicContact CZ-CB 4.49Å; I229-Q264 HydrophobicContact CD1-CG 4.1Å; D260-Q264 VanDerWaalsContact O-CG 3.24Å; D260-Q264 WeakPolarHBondContact O-CG 3.45Å; F261-Q264 PolarHBondContact O-N 3.45Å; L262-Q264 VanDerWaalsContact C-N 3.29Å
265	F	96.5	Very high	95	Very high	15 Å²	15	67.5 Å²	67.5	7%	0.066	35%	0.346	C	S	.	.	S	Bend	trans	-130.6	134.9	-175.9	-164.1	-92.9	0	0	0	112.5	V154 R155 A158 D222 F225 F261 P269	V154-F265 HydrophobicContact CG1-CB 4.4Å; V154-F265 HydrophobicContact CG1-CD1 3.85Å; V154-F265 HydrophobicContact CG1-CD2 3.52Å; V154-F265 HydrophobicContact CG1-CE1 3.97Å; V154-F265 HydrophobicContact CG1-CE2 3.67Å; V154-F265 HydrophobicContact CG1-CG 3.62Å; V154-F265 HydrophobicContact CG1-CZ 3.89Å; R155-F265 HydrophobicContact CG-CE1 4.27Å; R155-F265 HydrophobicContact CG-CZ 3.83Å; A158-F265 HydrophobicContact CB-CD1 3.82Å; A158-F265 HydrophobicContact CB-CE1 3.87Å; D222-F265 HydrophobicContact CB-CE2 3.78Å; F225-F265 HydrophobicContact CE1-CB 4.08Å; F225-F265 HydrophobicContact CE1-CD2 4.11Å; F225-F265 HydrophobicContact CE1-CG 4.4Å; F225-F265 HydrophobicContact CZ-CB 4.02Å; F261-F265 HydrophobicContact CE1-CB 4.03Å; F261-F265 HydrophobicContact CE1-CD1 4.09Å; F261-F265 HydrophobicContact CE1-CG 4.46Å; F261-F265 HydrophobicContact CE2-CB 4.29Å; F261-F265 HydrophobicContact CZ-CB 3.89Å; F261-F265 AromaticContact CZ-CD1 3.75Å; F261-F265 HydrophobicContact CZ-CD1 3.75Å; F261-F265 HydrophobicContact CZ-CG 4.04Å; F261-F265 PolarHBondContact O-N 2.92Å; F265-P269 HydrophobicContact CE1-CB 4.13Å
266	P	95	Very high	95.2	Very high	55 Å²	55	62.6 Å²	62.6	36%	0.357	33%	0.325	S	S	.	.			trans	-59	136.4	179	-25.3	34.9	0	0	0	114	A158 P268	A158-P266 WeakPolarHBondContact CB-O 3.33Å; P266-P268 CarbonylContact C-O 3.58Å; P266-P268 WeakPolarHBondContact CB-O 3.08Å; P266-P268 CarbonylContact O-C 3.45Å
267	C	95.6	Very high	95.3	Very high	39 Å²	39	65.1 Å²	65.1	26%	0.264	34%	0.341	S	S	.	.	S	Bend	trans	-134	106.6	173.7	-174.2	0	0	0	0	108.2	A158 L262	A158-C267 PolarHBondContact O-SG 3.3Å; L262-C267 HydrophobicContact CD2-CB 3.45Å; L262-C267 VanDerWaalsContact CD2-CB 3.45Å
268	P	93.9	Very high	95.4	Very high	42 Å²	42	61.9 Å²	61.9	27%	0.273	33%	0.331	S	S	.	.	S	Bend	cis	-58.9	156.7	1.1	26.7	-37.9	0	0	0	114.4	T18 L162 P266	T18-P268 HydrophobicContact CG2-CB 4.02Å; T18-P268 HydrophobicContact CG2-CG 3.72Å; L162-P268 HydrophobicContact CD2-CB 3.88Å; P266-P268 CarbonylContact C-O 3.58Å; P266-P268 WeakPolarHBondContact CB-O 3.08Å; P266-P268 CarbonylContact O-C 3.45Å
269	P	95	Very high	95.4	Very high	2 Å²	2	62.8 Å²	62.8	1%	0.013	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-62.3	141.5	166.4	26	-31.1	0	0	0	110.3	N110 V111 R155 A158 F265	N110-P269 HydrophobicContact CB-CB 4.48Å; N110-P269 HydrophobicContact CB-CG 4.24Å; N110-P269 VanDerWaalsContact CB-O 3.27Å; N110-P269 WeakPolarHBondContact CB-O 3.4Å; N110-P269 PolarHBondContact ND2-O 3.2Å; V111-P269 HydrophobicContact CG2-CG 4.26Å; R155-P269 HydrophobicContact CB-CB 4.23Å; R155-P269 HydrophobicContact CG-CB 4.13Å; A158-P269 HydrophobicContact CB-CB 4.5Å; A158-P269 HydrophobicContact CB-CG 4.47Å; F265-P269 HydrophobicContact CE1-CB 4.13Å
270	N	93.8	Very high	95.4	Very high	107 Å²	107	62.2 Å²	62.2	57%	0.572	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-71.8	141.7	176.5	-67.1	-30	0	0	0	111.3	R155	R155-N270 PolarHBondContact NH1-O 2.74Å
271	S	92.3	Very high	95.5	Very high	60 Å²	60	61.4 Å²	61.4	42%	0.42	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-66.3	130.5	170.6	-62.5	0	0	0	0	110.1
272	P	94	Very high	95.5	Very high	17 Å²	17	66.9 Å²	66.9	11%	0.11	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-75.1	172.8	177	38.5	-42.5	0	0	0	111	V108 L113 A274	V108-P272 HydrophobicContact CB-CG 3.76Å; V108-P272 HydrophobicContact CG1-CG 3.41Å; V108-P272 VanDerWaalsContact CG1-CG 3.41Å; L113-P272 HydrophobicContact CD2-CB 4.22Å; L113-P272 HydrophobicContact CD2-CG 3.62Å; P272-A274 WeakPolarHBondContact CG-O 3.49Å
273	K	93.3	Very high	95.6	Very high	195 Å²	195	63.7 Å²	63.7	85%	0.848	34%	0.341	S	S	*	.	S	Bend	trans	-82.2	-34.7	170.6	-64.1	171.2	-175.1	172.2	0	112.4	E218	E218-K273 WeakPolarHBondContact OE1-CB 3.15Å; E218-K273 WeakPolarHBondContact OE1-CG 3.49Å; E218-K273 PolarHBondContact OE1-N 2.88Å; E218-K273 PolarHBondContact OE2-N 2.83Å
274	A	95.3	Very high	95.8	Very high	48 Å²	48	59.6 Å²	59.6	40%	0.397	33%	0.331	S	S	.	.	S	Bend	trans	-114	162.7	-178	0	0	0	0	0	112.4	V108 H216 E218 P272	V108-A274 WeakPolarHBondContact CG1-O 3.31Å; H216-A274 PolarHBondContact NE2-O 2.86Å; E218-A274 PolarHBondContact OE2-N 3.11Å; E218-A274 VanDerWaalsContact OE2-N 3.07Å; P272-A274 WeakPolarHBondContact CG-O 3.49Å
275	V	97.1	Very high	95.9	Very high	44 Å²	44	55 Å²	55	27%	0.267	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-84	170.8	164.3	-65.6	0	0	0	0	110.4	V108 L113 F119 H216	V108-V275 HydrophobicContact CB-CG1 4.43Å; V108-V275 HydrophobicContact CG1-CG1 3.91Å; V108-V275 HydrophobicContact CG2-CG1 3.74Å; L113-V275 CarbonylContact O-C 3.15Å; F119-V275 HydrophobicContact CE2-CB 4.08Å; F119-V275 HydrophobicContact CE2-CG2 4.1Å; F119-V275 HydrophobicContact CZ-CG2 4.18Å; H216-V275 PolarHBondContact CD2-O 3.19Å
276	C	97.7	Very high	95.9	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.02	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-52	143.7	169.5	-76.8	0	0	0	0	111.8	L113 I115 F119 F214 A215	L113-C276 PolarHBondContact O-N 2.99Å; L113-C276 PolarHBondContact O-SG 3.32Å; L113-C276 VanDerWaalsContact O-SG 3.4Å; I115-C276 HydrophobicContact CD1-CB 4.12Å; F119-C276 HydrophobicContact CD2-CB 4.38Å; F119-C276 HydrophobicContact CE2-CB 3.9Å; F119-C276 WeakPolarHBondContact CE2-O 3.06Å; F119-C276 WeakPolarHBondContact CZ-O 3.26Å; F214-C276 HydrophobicContact CB-CB 4.28Å; F214-C276 HydrophobicContact CD1-CB 3.99Å; A215-C276 CarbonylContact O-C 3.49Å; A215-C276 WeakPolarHBondContact O-CA 3.29Å
277	T	97.5	Very high	96.1	Very high	69 Å²	69	54.1 Å²	54.1	42%	0.423	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	138.9	166.3	56.4	0	0	0	0	109.2	F214 A215 L279	F214-T277 WeakPolarHBondContact CA-O 3.46Å; A215-T277 PolarHBondContact N-O 3.3Å; A215-T277 PolarHBondContact O-N 3.04Å; A215-T277 PolarHBondContact O-OG1 3.18Å; T277-L279 PolarHBondContact O-N 3.25Å
278	V	97.5	Very high	96.2	Very high	52 Å²	52	53.2 Å²	53.2	32%	0.315	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	114	168.1	-176.2	0	0	0	0	107.1	F119 F124 V212 F214 I281	F119-V278 HydrophobicContact CD1-CG2 4.32Å; F119-V278 HydrophobicContact CE1-CG2 3.84Å; F119-V278 HydrophobicContact CZ-CG2 4.48Å; F124-V278 HydrophobicContact CE2-CG2 3.66Å; F124-V278 HydrophobicContact CZ-CG2 3.96Å; V212-V278 HydrophobicContact CG1-CG1 4.33Å; F214-V278 HydrophobicContact CD1-CG2 4.11Å; F214-V278 HydrophobicContact CE1-CG2 3.71Å; V278-I281 HydrophobicContact CG1-CD1 3.94Å; V278-I281 HydrophobicContact CG1-CG1 3.58Å
279	L	95.2	Very high	96.4	Very high	104 Å²	104	51.8 Å²	51.8	55%	0.545	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-53.9	177.7	-172.3	80.3	0	0	0	109.6	V213 A215 T277	V213-L279 HydrophobicContact CB-CB 4.3Å; V213-L279 HydrophobicContact CG1-CB 4.2Å; V213-L279 HydrophobicContact CG1-CD2 3.87Å; V213-L279 WeakPolarHBondContact O-CB 3.47Å; V213-L279 PolarHBondContact O-N 3.35Å; A215-L279 HydrophobicContact CB-CB 4.32Å; A215-L279 HydrophobicContact CB-CD1 4.37Å; T277-L279 PolarHBondContact O-N 3.25Å
280	E	94.9	Very high	96.5	Very high	83 Å²	83	51.7 Å²	51.7	39%	0.388	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	144.4	-174.2	-71.6	147.9	-170.6	0	0	109.9	V212 V213 E282	V212-E280 WeakPolarHBondContact CA-O 3.4Å; V213-E280 HydrophobicContact CB-CB 4.03Å; V213-E280 HydrophobicContact CG2-CB 4.06Å; V213-E280 WeakPolarHBondContact CG2-OE2 3.36Å; V213-E280 PolarHBondContact N-O 3.24Å; V213-E280 PolarHBondContact O-N 3.43Å; E280-E282 HydrophobicContact CB-CG 4.38Å
281	I	97.5	Very high	96.7	Very high	27 Å²	27	46.6 Å²	46.6	14%	0.138	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	115.9	163.1	-61.6	167.8	0	0	0	104.2	V128 K131 S211 V212 V278	V128-I281 HydrophobicContact CG1-CG2 3.8Å; V128-I281 HydrophobicContact CG2-CD1 4.03Å; V128-I281 HydrophobicContact CG2-CG1 4.48Å; K131-I281 HydrophobicContact CB-CG2 4.45Å; K131-I281 HydrophobicContact CD-CB 3.81Å; K131-I281 HydrophobicContact CD-CG2 3.82Å; K131-I281 WeakPolarHBondContact CE-O 3.17Å; K131-I281 PolarHBondContact NZ-O 3.18Å; S211-I281 WeakPolarHBondContact O-CA 3.49Å; V212-I281 HydrophobicContact CG2-CG1 4.35Å; V212-I281 HydrophobicContact CG2-CG2 4.47Å; V278-I281 HydrophobicContact CG1-CD1 3.94Å; V278-I281 HydrophobicContact CG1-CG1 3.58Å
282	E	97.1	Very high	96.9	Very high	115 Å²	115	43.7 Å²	43.7	54%	0.537	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	159.2	-178.3	-56.8	-175.6	149.4	0	0	110.1	S211 E280	S211-E282 PolarHBondContact N-O 3.48Å; S211-E282 PolarHBondContact O-N 3.25Å; E280-E282 HydrophobicContact CB-CG 4.38Å
283	C	97.9	Very high	97.1	Very high	16 Å²	16	43.9 Å²	43.9	11%	0.108	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	143.8	166.2	58.8	0	0	0	0	109.7	V132 S135 F137 F208 E209 V210	V132-C283 HydrophobicContact CG1-CB 4.48Å; V132-C283 HydrophobicContact CG2-CB 4.21Å; S135-C283 VanDerWaalsContact CB-SG 3.59Å; S135-C283 PolarHBondContact OG-SG 3.16Å; F137-C283 WeakPolarHBondContact CE2-O 3.47Å; F208-C283 HydrophobicContact CE1-CB 4.44Å; F208-C283 HydrophobicContact CE2-CB 3.94Å; F208-C283 HydrophobicContact CZ-CB 3.62Å; E209-C283 CarbonylContact O-C 3.6Å; E209-C283 WeakPolarHBondContact O-CA 3.25Å; E209-C283 WeakPolarHBondContact O-CB 3.49Å; V210-C283 HydrophobicContact CG2-CB 4.16Å
284	A	98.3	Very high	97.4	Very high	42 Å²	42	34.6 Å²	34.6	35%	0.347	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	149	-178.7	0	0	0	0	0	110.2	F208 E209 N362	F208-A284 WeakPolarHBondContact CD2-O 3.18Å; E209-A284 PolarHBondContact N-O 3.24Å; E209-A284 PolarHBondContact O-N 3.1Å; A284-N362 VanDerWaalsContact CA-OD1 3.29Å; A284-N362 WeakPolarHBondContact CA-OD1 3.33Å; A284-N362 WeakPolarHBondContact CB-OD1 3.41Å
285	H	98.6	Very high	97.5	Very high	19 Å²	19	32.4 Å²	32.4	9%	0.088	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	127.7	172.5	-161.1	-67.2	0	0	0	110.4	F137 E138 F208 N362 P363	F137-H285 HydrophobicContact CD1-CB 3.84Å; F137-H285 HydrophobicContact CE1-CB 3.98Å; E138-H285 PolarHBondContact O-CD2 2.65Å; F208-H285 HydrophobicContact CD2-CB 4.24Å; H285-N362 PolarHBondContact N-OD1 2.92Å; H285-N362 WeakPolarHBondContact O-CA 3.29Å; H285-P363 HydrophobicContact CB-CG 4.38Å; H285-P363 WeakPolarHBondContact CB-O 3.44Å
286	G	97.4	Very high	97.6	Very high	27 Å²	27	30.3 Å²	30.3	28%	0.278	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-57.7	150.5	172.7	0	0	0	0	0	111.2	L207 V288	L207-G286 PolarHBondContact O-N 3.23Å; G286-V288 PolarHBondContact O-N 3.34Å
287	A	97.8	Very high	97.7	Very high	26 Å²	26	34.8 Å²	34.8	22%	0.215	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-62.4	138.9	-171.3	0	0	0	0	0	112.7	F289 E359 L360	A287-F289 HydrophobicContact CB-CE2 4.45Å; A287-F289 HydrophobicContact CB-CZ 4.19Å; A287-F289 VanDerWaalsContact O-CE2 3.29Å; A287-F289 WeakPolarHBondContact O-CE2 3.29Å; A287-E359 HydrophobicContact CB-CG 3.53Å; A287-L360 WeakPolarHBondContact CA-O 3.43Å; A287-L360 WeakPolarHBondContact CB-O 3.46Å
288	V	97.8	Very high	97.7	Very high	19 Å²	19	32.7 Å²	32.7	12%	0.115	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	156.9	170.8	-57	0	0	0	0	109.4	G286 F330 L360 P363 V366	G286-V288 PolarHBondContact O-N 3.34Å; V288-F330 HydrophobicContact CG2-CD1 3.72Å; V288-F330 HydrophobicContact CG2-CE1 3.82Å; V288-L360 HydrophobicContact CG2-CB 4.13Å; V288-L360 HydrophobicContact CG2-CD1 4.29Å; V288-L360 PolarHBondContact N-O 2.81Å; V288-L360 PolarHBondContact O-N 3.32Å; V288-P363 HydrophobicContact CB-CG 4.46Å; V288-P363 HydrophobicContact CG1-CG 4.05Å; V288-P363 HydrophobicContact CG2-CB 4.16Å; V288-P363 HydrophobicContact CG2-CG 3.81Å; V288-V366 HydrophobicContact CG1-CB 4.3Å; V288-V366 HydrophobicContact CG1-CG1 3.76Å; V288-V366 HydrophobicContact CG2-CG1 4.46Å
289	F	97.6	Very high	97.8	Very high	12 Å²	12	33.5 Å²	33.5	5%	0.053	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	133	-171.5	-54.2	-94.6	0	0	0	111.1	A287 I358 E359 L394 V395 R397 I400	A287-F289 HydrophobicContact CB-CE2 4.45Å; A287-F289 HydrophobicContact CB-CZ 4.19Å; A287-F289 VanDerWaalsContact O-CE2 3.29Å; A287-F289 WeakPolarHBondContact O-CE2 3.29Å; F289-I358 WeakPolarHBondContact CA-O 3.29Å; F289-E359 HydrophobicContact CD1-CB 3.62Å; F289-E359 HydrophobicContact CD1-CG 3.9Å; F289-E359 HydrophobicContact CE1-CB 3.41Å; F289-E359 VanDerWaalsContact CE1-CB 3.41Å; F289-E359 VanDerWaalsContact CE1-CD 3.49Å; F289-E359 HydrophobicContact CE1-CG 3.27Å; F289-E359 VanDerWaalsContact CE1-OE1 3.3Å; F289-E359 WeakPolarHBondContact CE1-OE1 3.39Å; F289-E359 HydrophobicContact CZ-CB 4.41Å; F289-E359 HydrophobicContact CZ-CG 3.8Å; F289-E359 VanDerWaalsContact CZ-OE1 3.23Å; F289-E359 WeakPolarHBondContact CZ-OE1 3.33Å; F289-L394 WeakPolarHBondContact O-CA 3.47Å; F289-V395 HydrophobicContact CB-CG2 3.71Å; F289-V395 PolarHBondContact O-N 3.27Å; F289-R397 HydrophobicContact CD2-CB 4.41Å; F289-R397 HydrophobicContact CE2-CB 3.71Å; F289-R397 HydrophobicContact CZ-CB 3.92Å; F289-R397 HydrophobicContact CZ-CG 4.27Å; F289-I400 HydrophobicContact CB-CD1 4.29Å; F289-I400 HydrophobicContact CD1-CD1 3.12Å; F289-I400 HydrophobicContact CD1-CG1 4.37Å; F289-I400 HydrophobicContact CD2-CD1 4.31Å; F289-I400 HydrophobicContact CE1-CD1 3.29Å; F289-I400 HydrophobicContact CG-CD1 3.66Å; F289-I400 HydrophobicContact CZ-CD1 4.06Å
290	V	98.1	Very high	97.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	128.4	170.2	178.4	0	0	0	0	107.9	L326 F330 A357 I358 L360 L392 Q393 L394	V290-L326 HydrophobicContact CB-CD2 3.65Å; V290-L326 HydrophobicContact CG1-CD2 3.9Å; V290-L326 HydrophobicContact CG2-CD2 3.88Å; V290-F330 HydrophobicContact CG2-CE1 4.2Å; V290-F330 HydrophobicContact CG2-CE2 3.81Å; V290-F330 HydrophobicContact CG2-CZ 3.43Å; V290-F330 VanDerWaalsContact CG2-CZ 3.43Å; V290-A357 CarbonylContact O-C 3.29Å; V290-A357 VanDerWaalsContact O-CA 3.27Å; V290-A357 WeakPolarHBondContact O-CA 3.2Å; V290-I358 PolarHBondContact N-O 3.47Å; V290-I358 PolarHBondContact O-N 2.94Å; V290-L360 HydrophobicContact CG2-CD1 4.05Å; V290-L392 HydrophobicContact CG1-CD1 3.35Å; V290-L392 HydrophobicContact CG1-CD2 4.41Å; V290-L392 HydrophobicContact CG1-CG 3.73Å; V290-Q393 CarbonylContact C-O 3.58Å; V290-Q393 WeakPolarHBondContact CA-O 3.5Å; V290-L394 HydrophobicContact CG2-CD2 3.94Å
291	A	97.6	Very high	98.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	159	175.2	0	0	0	0	0	111.2	F356 A357 L392 Q393 V395 W523 P524	A291-F356 VanDerWaalsContact CA-O 3.25Å; A291-F356 WeakPolarHBondContact CA-O 3.21Å; A291-F356 WeakPolarHBondContact CB-O 3.43Å; A291-A357 HydrophobicContact CB-CB 4.11Å; A291-L392 CarbonylContact O-C 3.5Å; A291-L392 VanDerWaalsContact O-CA 3.3Å; A291-L392 WeakPolarHBondContact O-CA 3.5Å; A291-Q393 PolarHBondContact N-O 2.92Å; A291-Q393 PolarHBondContact O-N 2.97Å; A291-V395 HydrophobicContact CB-CB 4.43Å; A291-V395 HydrophobicContact CB-CG1 3.74Å; A291-V395 HydrophobicContact CB-CG2 3.77Å; A291-W523 HydrophobicContact CB-CH2 3.45Å; A291-W523 VanDerWaalsContact CB-CH2 3.45Å; A291-W523 HydrophobicContact CB-CZ2 4.08Å; A291-W523 HydrophobicContact CB-CZ3 4.04Å; A291-P524 HydrophobicContact CB-CB 4.23Å; A291-P524 HydrophobicContact CB-CG 4.36Å
292	G	97.7	Very high	98.1	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.1	-163	175.6	0	0	0	0	0	110.7	P355 F356 R390	G292-P355 WeakPolarHBondContact O-CA 3.17Å; G292-F356 VanDerWaalsContact C-CE1 3.41Å; G292-F356 PolarHBondContact N-O 2.98Å; G292-F356 WeakPolarHBondContact O-CD1 3.4Å; G292-F356 PolarHBondContact O-N 2.87Å; G292-R390 WeakPolarHBondContact CA-O 3.2Å
293	R	98	Very high	98.1	Very high	20 Å²	20	23.1 Å²	23.1	8%	0.075	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	133.1	173	-42.1	178	90.7	94	-2.1	109.8	N352 R354 V389 R390 D391 V521 W523 P524	R293-N352 VanDerWaalsContact CB-O 3.26Å; R293-N352 WeakPolarHBondContact CB-O 3.38Å; R293-N352 WeakPolarHBondContact CD-O 3.44Å; R293-R354 CarbonylContact C-O 3.54Å; R293-R354 VanDerWaalsContact CA-O 3.26Å; R293-R354 WeakPolarHBondContact CA-O 3.45Å; R293-V389 WeakPolarHBondContact O-CA 3.02Å; R293-R390 HydrophobicContact CB-CG 3.83Å; R293-R390 HydrophobicContact CG-CG 4.37Å; R293-R390 PolarHBondContact N-O 3.16Å; R293-R390 PolarHBondContact O-N 3.32Å; R293-D391 WeakPolarHBondContact CD-OD2 3.42Å; R293-D391 HydrophobicContact CG-CB 4.3Å; R293-D391 WeakPolarHBondContact CG-OD2 3.4Å; R293-V521 PolarHBondContact NH1-O 3.05Å; R293-V521 PolarHBondContact NH2-O 2.75Å; R293-W523 PolarHBondContact NH1-O 2.95Å; R293-W523 VanDerWaalsContact NH1-O 3.11Å; R293-P524 HydrophobicContact CG-CG 4.27Å; R293-P524 PolarHBondContact NH1-O 3.26Å; R293-P524 VanDerWaalsContact NH1-O 3.13Å
294	Y	98.6	Very high	98.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	138.5	177.8	76.6	-99.5	0	0	0	111.8	K296 Q303 V318 F337 E343 G353 R354 F356 Q388	Y294-K296 HydrophobicContact CD2-CB 4.22Å; Y294-K296 HydrophobicContact CE2-CB 4.09Å; Y294-Q303 PolarHBondContact OH-NE2 3.36Å; Y294-V318 HydrophobicContact CD1-CG1 3.96Å; Y294-V318 HydrophobicContact CD2-CG1 3.55Å; Y294-V318 HydrophobicContact CE1-CG1 4.11Å; Y294-V318 HydrophobicContact CE2-CG1 3.75Å; Y294-V318 HydrophobicContact CE2-CG2 4.27Å; Y294-V318 HydrophobicContact CG-CG1 3.68Å; Y294-F337 HydrophobicContact CE1-CZ 4.3Å; Y294-E343 VanDerWaalsContact CE2-OE1 3.32Å; Y294-E343 WeakPolarHBondContact CE2-OE1 3.26Å; Y294-E343 PolarHBondContact OH-OE1 3.32Å; Y294-E343 PolarHBondContact OH-OE2 2.8Å; Y294-G353 CarbonylContact O-C 3.56Å; Y294-G353 WeakPolarHBondContact O-CA 3.41Å; Y294-R354 HydrophobicContact CD1-CB 4.26Å; Y294-R354 HydrophobicContact CE1-CB 3.8Å; Y294-R354 HydrophobicContact CE1-CG 4.11Å; Y294-R354 HydrophobicContact CE2-CB 4.4Å; Y294-R354 PolarHBondContact N-O 3.49Å; Y294-R354 PolarHBondContact O-N 3.42Å; Y294-R354 WeakPolarHBondContact OH-CD 3.39Å; Y294-R354 PolarHBondContact OH-NE 3.01Å; Y294-F356 HydrophobicContact CD1-CB 4.19Å; Y294-F356 AromaticContact CD1-CD1 3.92Å; Y294-F356 HydrophobicContact CD1-CD1 3.92Å; Y294-F356 HydrophobicContact CD1-CG 4.34Å; Y294-Q388 CarbonylContact C-O 3.24Å; Y294-Q388 VanDerWaalsContact CA-O 3.31Å; Y294-Q388 WeakPolarHBondContact CA-O 3.41Å
295	N	98.8	Very high	98.1	Very high	2 Å²	2	24 Å²	24	1%	0.011	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	153.4	155.1	-68.9	117.2	0	0	0	110.3	Y297 T349 L350 G351 I387 Q388 R390	N295-Y297 HydrophobicContact CB-CD2 4.47Å; N295-Y297 HydrophobicContact CB-CE1 4.17Å; N295-Y297 HydrophobicContact CB-CE2 3.59Å; N295-Y297 VanDerWaalsContact CB-CZ 3.43Å; N295-Y297 VanDerWaalsContact CB-OH 3.29Å; N295-Y297 WeakPolarHBondContact CB-OH 3.35Å; N295-Y297 PolarHBondContact OD1-OH 2.82Å; N295-T349 CarbonylContact C-O 3.53Å; N295-T349 WeakPolarHBondContact CA-O 3.44Å; N295-T349 WeakPolarHBondContact CB-O 3.15Å; N295-T349 PolarHBondContact ND2-O 3.35Å; N295-L350 WeakPolarHBondContact ND2-CA 3.4Å; N295-L350 PolarHBondContact ND2-O 2.74Å; N295-L350 VanDerWaalsContact ND2-O 3.1Å; N295-G351 PolarHBondContact ND2-O 3.11Å; N295-G351 PolarHBondContact OD1-O 2.92Å; N295-I387 WeakPolarHBondContact O-CA 3.3Å; N295-I387 VanDerWaalsContact O-CB 3.3Å; N295-I387 WeakPolarHBondContact O-CB 3.25Å; N295-Q388 HydrophobicContact CB-CB 4.5Å; N295-Q388 PolarHBondContact N-O 2.91Å; N295-Q388 PolarHBondContact O-N 3.39Å; N295-R390 VanDerWaalsContact OD1-CZ 3.22Å; N295-R390 PolarHBondContact OD1-NH1 3.08Å; N295-R390 PolarHBondContact OD1-NH2 3.13Å
296	K	98.8	Very high	97.9	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	115.6	176.1	178.8	-165.9	173.3	-149.8	0	108.1	Y294 S298 L301 V318 E343 D344 V345 V347 R348 T349	Y294-K296 HydrophobicContact CD2-CB 4.22Å; Y294-K296 HydrophobicContact CE2-CB 4.09Å; K296-S298 VanDerWaalsContact CE-O 3.27Å; K296-S298 WeakPolarHBondContact CE-O 3.49Å; K296-L301 WeakPolarHBondContact CE-O 3.49Å; K296-L301 PolarHBondContact NZ-O 2.91Å; K296-V318 HydrophobicContact CB-CG2 4.45Å; K296-V318 HydrophobicContact CD-CG2 4Å; K296-V318 HydrophobicContact CG-CG2 4.09Å; K296-E343 HydrophobicContact CD-CG 4.23Å; K296-D344 PolarHBondContact NZ-O 2.74Å; K296-V345 PolarHBondContact NZ-O 3.17Å; K296-V347 WeakPolarHBondContact CD-O 3.23Å; K296-V347 WeakPolarHBondContact CE-O 3.3Å; K296-V347 PolarHBondContact NZ-O 3.24Å; K296-R348 CarbonylContact O-C 3.57Å; K296-R348 VanDerWaalsContact O-CA 3.24Å; K296-R348 WeakPolarHBondContact O-CA 3.4Å; K296-R348 WeakPolarHBondContact O-CB 3.29Å; K296-T349 PolarHBondContact N-O 2.63Å; K296-T349 PolarHBondContact O-N 2.82Å
297	Y	98.6	Very high	97.7	Very high	98 Å²	98	30.4 Å²	30.4	38%	0.384	15%	0.151	S	C	.	.			trans	-101.2	-23.5	-176.4	-54	-80.4	0	0	0	112.6	N295 R348 L350 K386 Q388	N295-Y297 HydrophobicContact CB-CD2 4.47Å; N295-Y297 HydrophobicContact CB-CE1 4.17Å; N295-Y297 HydrophobicContact CB-CE2 3.59Å; N295-Y297 VanDerWaalsContact CB-CZ 3.43Å; N295-Y297 VanDerWaalsContact CB-OH 3.29Å; N295-Y297 WeakPolarHBondContact CB-OH 3.35Å; N295-Y297 PolarHBondContact OD1-OH 2.82Å; Y297-R348 VanDerWaalsContact O-CD 3.26Å; Y297-R348 WeakPolarHBondContact O-CD 3.38Å; Y297-R348 WeakPolarHBondContact O-CG 3.35Å; Y297-L350 HydrophobicContact CD1-CD2 4.11Å; Y297-L350 HydrophobicContact CE1-CD2 4.26Å; Y297-K386 PolarHBondContact N-O 3.19Å; Y297-Q388 HydrophobicContact CE2-CB 3.84Å; Y297-Q388 HydrophobicContact CE2-CG 3.58Å
298	S	98.4	Very high	97.3	Very high	25 Å²	25	32.4 Å²	32.4	18%	0.175	16%	0.157	C	C	.	.			trans	-74.2	134.4	176.5	-179.1	0	0	0	0	112.5	K296 N300 K386	K296-S298 VanDerWaalsContact CE-O 3.27Å; K296-S298 WeakPolarHBondContact CE-O 3.49Å; S298-N300 VanDerWaalsContact C-N 3.31Å; S298-N300 PolarHBondContact OG-N 3.2Å; S298-K386 PolarHBondContact N-O 3.02Å
299	R	98.4	Very high	96.9	Very high	68 Å²	68	39.1 Å²	39.1	26%	0.257	19%	0.192	S	C	.	.	S	Bend	trans	-89.5	10.7	164.4	-60.4	-162.1	-179.7	-66.5	-3.6	113.2	V345 D346 R348 E513 L514 D515	R299-V345 CarbonylContact C-O 3.54Å; R299-V345 VanDerWaalsContact C-O 3.24Å; R299-D346 WeakPolarHBondContact CD-O 3.39Å; R299-D346 VanDerWaalsContact CG-O 3.24Å; R299-D346 WeakPolarHBondContact CG-O 3.46Å; R299-D346 PolarHBondContact NH1-O 3.32Å; R299-D346 WeakPolarHBondContact O-CA 3.32Å; R299-R348 HydrophobicContact CG-CG 4.08Å; R299-R348 VanDerWaalsContact NH2-CZ 3.33Å; R299-R348 VanDerWaalsContact NH2-NE 3.19Å; R299-E513 IonicContact CZ-OE2 3.65Å; R299-E513 IonicContact NE-OE2 3.27Å; R299-E513 PolarHBondContact NE-OE2 2.72Å; R299-E513 IonicContact NH2-OE2 3.63Å; R299-E513 PolarHBondContact NH2-OE2 3.36Å; R299-L514 PolarHBondContact NH1-O 2.97Å; R299-D515 IonicContact CZ-OD1 3.37Å; R299-D515 VanDerWaalsContact CZ-OD1 3.28Å; R299-D515 IonicContact NH1-OD1 2.65Å; R299-D515 PolarHBondContact NH1-OD1 3.5Å; R299-D515 IonicContact NH2-OD1 3.86Å; R299-D515 PolarHBondContact NH2-OD1 2.81Å; R299-D515 IonicContact NH2-OD2 2.69Å; R299-D515 PolarHBondContact NH2-OD2 3.14Å
300	N	98	Very high	96.6	Very high	102 Å²	102	41.9 Å²	41.9	55%	0.545	22%	0.224	S	C	.	.	S	Bend	trans	-136.9	52.7	177.4	-167.2	33.7	0	0	0	110.7	S298 L314	S298-N300 VanDerWaalsContact C-N 3.31Å; S298-N300 PolarHBondContact OG-N 3.2Å; N300-L314 VanDerWaalsContact OD1-CD2 3.27Å; N300-L314 WeakPolarHBondContact OD1-CD2 3.49Å
301	L	98.4	Very high	96.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.251	C	S	.	.			trans	-144.1	123.6	178	-174.6	74.2	0	0	0	109	K296 V318 L321 K386 I387	K296-L301 WeakPolarHBondContact CE-O 3.49Å; K296-L301 PolarHBondContact NZ-O 2.91Å; L301-V318 HydrophobicContact CD2-CG2 3.71Å; L301-V318 HydrophobicContact CG-CG2 4.36Å; L301-L321 HydrophobicContact CD1-CD1 4.21Å; L301-L321 HydrophobicContact CD2-CD1 3.78Å; L301-K386 HydrophobicContact CD1-CD 4.25Å; L301-K386 HydrophobicContact CD2-CB 4.13Å; L301-I387 HydrophobicContact CD2-CG2 3.75Å
302	P	98.1	Very high	96.3	Very high	1 Å²	1	53 Å²	53	1%	0.006	27%	0.271	C	S	.	.			trans	-75.2	153.7	171.4	34.1	-35.2	0	0	0	110.3	T304 W306 L314 S316 S317 V318 V345	P302-T304 VanDerWaalsContact C-N 3.34Å; P302-T304 WeakPolarHBondContact CB-O 3.21Å; P302-W306 HydrophobicContact CB-CB 4.1Å; P302-W306 HydrophobicContact CG-CB 4.06Å; P302-L314 HydrophobicContact CG-CB 4.32Å; P302-S316 WeakPolarHBondContact CG-O 3.31Å; P302-S317 CarbonylContact O-C 3.58Å; P302-S317 WeakPolarHBondContact O-CA 3.41Å; P302-S317 WeakPolarHBondContact O-CB 3.47Å; P302-V318 PolarHBondContact O-N 2.86Å; P302-V345 HydrophobicContact CB-CG2 4.12Å
303	Q	98.2	Very high	96.2	Very high	8 Å²	8	57 Å²	57	4%	0.037	29%	0.289	C	S	.	.	S	Bend	trans	-66.2	-37.8	176.4	-179.1	-163.6	55.7	0	0	112	Y294 V318 E319 F337 S339 G341 R342	Y294-Q303 PolarHBondContact OH-NE2 3.36Å; Q303-V318 HydrophobicContact CG-CB 4.48Å; Q303-V318 WeakPolarHBondContact O-CB 3.11Å; Q303-V318 PolarHBondContact O-N 2.83Å; Q303-E319 WeakPolarHBondContact O-CB 3.37Å; Q303-E319 PolarHBondContact O-N 3Å; Q303-F337 HydrophobicContact CG-CE1 4.32Å; Q303-S339 PolarHBondContact NE2-OG 3.1Å; Q303-G341 PolarHBondContact NE2-O 3.14Å; Q303-G341 VanDerWaalsContact NE2-O 3.13Å; Q303-R342 HydrophobicContact CB-CG 4.29Å; Q303-R342 VanDerWaalsContact OE1-CD 3.23Å; Q303-R342 VanDerWaalsContact OE1-NH1 3.07Å
304	T	97.9	Very high	96	Very high	37 Å²	37	57.6 Å²	57.6	23%	0.227	29%	0.293	C	S	.	.	S	Bend	trans	-130	159.6	179.3	67.1	0	0	0	0	108.9	P302 W306 E319 F337 R342	P302-T304 VanDerWaalsContact C-N 3.34Å; P302-T304 WeakPolarHBondContact CB-O 3.21Å; T304-W306 PolarHBondContact O-N 2.86Å; T304-E319 VanDerWaalsContact CB-OE2 3.23Å; T304-E319 WeakPolarHBondContact CB-OE2 3.47Å; T304-E319 HydrophobicContact CG2-CB 4.47Å; T304-E319 WeakPolarHBondContact CG2-OE2 3.5Å; T304-F337 HydrophobicContact CG2-CD1 4.31Å; T304-R342 VanDerWaalsContact CG2-NH1 3.31Å; T304-R342 PolarHBondContact OG1-NH1 3.14Å; T304-R342 PolarHBondContact OG1-NH2 3.3Å
305	P	97.4	Very high	95.9	Very high	39 Å²	39	64.2 Å²	64.2	25%	0.253	32%	0.324	S	S	.	.			trans	-52.3	122.5	-173.3	-27.5	33.6	0	0	0	112.7	I307 S317 E319 E320	P305-I307 HydrophobicContact CB-CD1 4.39Å; P305-I307 PolarHBondContact O-N 3.11Å; P305-S317 WeakPolarHBondContact CD-OG 3.37Å; P305-E319 VanDerWaalsContact CD-CD 3.46Å; P305-E319 WeakPolarHBondContact CD-OE1 3.39Å; P305-E320 HydrophobicContact CG-CG 4Å
306	W	94.6	Very high	95.8	Very high	93 Å²	93	65.1 Å²	65.1	35%	0.352	33%	0.33	S	S	.	.			trans	-96.4	92.3	179.5	-169.8	10	0	0	0	110.7	P302 T304 I308 K313 L314 V345	P302-W306 HydrophobicContact CB-CB 4.1Å; P302-W306 HydrophobicContact CG-CB 4.06Å; T304-W306 PolarHBondContact O-N 2.86Å; W306-I308 HydrophobicContact CZ2-CD1 4.43Å; W306-K313 HydrophobicContact CD2-CB 4.06Å; W306-K313 HydrophobicContact CE3-CB 4.3Å; W306-K313 HydrophobicContact CG-CB 4.28Å; W306-K313 PolarHBondContact O-N 2.98Å; W306-L314 HydrophobicContact CE3-CD1 3.83Å; W306-L314 HydrophobicContact CE3-CG 4.01Å; W306-L314 HydrophobicContact CZ3-CD1 3.98Å; W306-L314 HydrophobicContact CZ3-CG 4.28Å; W306-V345 HydrophobicContact CE3-CG2 4.22Å; W306-V345 HydrophobicContact CZ3-CG2 4.21Å
307	I	92.4	Very high	95.8	Very high	89 Å²	89	65.1 Å²	65.1	46%	0.456	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134	178.8	-57.3	172.7	0	0	0	108.5	P305 E311 R312	P305-I307 HydrophobicContact CB-CD1 4.39Å; P305-I307 PolarHBondContact O-N 3.11Å; I307-E311 WeakPolarHBondContact CA-O 3.08Å; I307-R312 HydrophobicContact CG1-CB 4.45Å
308	I	89.6	Confident	95.8	Very high	68 Å²	68	60.4 Å²	60.4	35%	0.349	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	127.8	172.1	-54.1	-179.6	0	0	0	106.8	W306 G310 E311 K313	W306-I308 HydrophobicContact CZ2-CD1 4.43Å; I308-G310 PolarHBondContact O-N 3.05Å; I308-E311 PolarHBondContact N-O 2.81Å; I308-E311 WeakPolarHBondContact O-CB 3.42Å; I308-E311 PolarHBondContact O-N 3.04Å; I308-K313 HydrophobicContact CB-CG 4.23Å; I308-K313 HydrophobicContact CD1-CG 4.02Å; I308-K313 HydrophobicContact CG1-CG 3.96Å
309	D	90.1	Very high	95.8	Very high	159 Å²	159	60.8 Å²	60.8	85%	0.85	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	35.4	179.6	-52.6	-36.4	0	0	0	114	E311	D309-E311 PolarHBondContact O-N 3.34Å
310	G	92.1	Very high	95.8	Very high	71 Å²	71	58.7 Å²	58.7	73%	0.732	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	-15	-176.2	0	0	0	0	0	114.6	I308	I308-G310 PolarHBondContact O-N 3.05Å
311	E	93.4	Very high	95.8	Very high	121 Å²	121	55.1 Å²	55.1	57%	0.565	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	125.9	177.8	-63.5	-174.7	164.5	0	0	112.1	I307 I308 D309 K313	I307-E311 WeakPolarHBondContact CA-O 3.08Å; I308-E311 PolarHBondContact N-O 2.81Å; I308-E311 WeakPolarHBondContact O-CB 3.42Å; I308-E311 PolarHBondContact O-N 3.04Å; D309-E311 PolarHBondContact O-N 3.34Å; E311-K313 PolarHBondContact O-N 2.98Å; E311-K313 IonicContact OE2-NZ 3.73Å; E311-K313 PolarHBondContact OE2-NZ 3.03Å
312	R	95.1	Very high	95.8	Very high	111 Å²	111	55.1 Å²	55.1	42%	0.419	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	120.3	170	-178.5	175.5	-67.3	-115.8	9.3	109.8	I307 L314 E320	I307-R312 HydrophobicContact CG1-CB 4.45Å; R312-L314 VanDerWaalsContact CD-O 3.25Å; R312-L314 WeakPolarHBondContact CD-O 3.34Å; R312-L314 WeakPolarHBondContact CG-O 3.47Å; R312-E320 IonicContact CZ-OE1 2.7Å; R312-E320 IonicContact CZ-OE2 3.33Å; R312-E320 VanDerWaalsContact NH1-CD 3.27Å; R312-E320 IonicContact NH1-OE1 2.69Å; R312-E320 PolarHBondContact NH1-OE1 2.59Å; R312-E320 IonicContact NH1-OE2 2.74Å; R312-E320 PolarHBondContact NH1-OE2 3.48Å; R312-E320 IonicContact NH2-OE1 3.71Å; R312-E320 PolarHBondContact NH2-OE1 2.98Å
313	K	95.4	Very high	95.8	Very high	85 Å²	85	55 Å²	55	37%	0.37	29%	0.285	S	S	.	.	S	Bend	trans	-88.7	-23.7	-177.4	-59.5	-56.2	179.1	-177.3	0	114	W306 I308 E311	W306-K313 HydrophobicContact CD2-CB 4.06Å; W306-K313 HydrophobicContact CE3-CB 4.3Å; W306-K313 HydrophobicContact CG-CB 4.28Å; W306-K313 PolarHBondContact O-N 2.98Å; I308-K313 HydrophobicContact CB-CG 4.23Å; I308-K313 HydrophobicContact CD1-CG 4.02Å; I308-K313 HydrophobicContact CG1-CG 3.96Å; E311-K313 PolarHBondContact O-N 2.98Å; E311-K313 IonicContact OE2-NZ 3.73Å; E311-K313 PolarHBondContact OE2-NZ 3.03Å
314	L	94.9	Very high	95.7	Very high	32 Å²	32	58.9 Å²	58.9	17%	0.168	31%	0.305	C	S	.	.	S	Bend	trans	-139.5	144.5	169	-73.4	179.6	0	0	0	110.9	N300 P302 W306 R312 S316 V345	N300-L314 VanDerWaalsContact OD1-CD2 3.27Å; N300-L314 WeakPolarHBondContact OD1-CD2 3.49Å; P302-L314 HydrophobicContact CG-CB 4.32Å; W306-L314 HydrophobicContact CE3-CD1 3.83Å; W306-L314 HydrophobicContact CE3-CG 4.01Å; W306-L314 HydrophobicContact CZ3-CD1 3.98Å; W306-L314 HydrophobicContact CZ3-CG 4.28Å; R312-L314 VanDerWaalsContact CD-O 3.25Å; R312-L314 WeakPolarHBondContact CD-O 3.34Å; R312-L314 WeakPolarHBondContact CG-O 3.47Å; L314-S316 PolarHBondContact O-N 2.9Å; L314-V345 HydrophobicContact CD1-CB 4.49Å; L314-V345 HydrophobicContact CD1-CG1 3.42Å; L314-V345 VanDerWaalsContact CD1-CG1 3.42Å; L314-V345 HydrophobicContact CD1-CG2 4.24Å
315	E	95.9	Very high	95.6	Very high	140 Å²	140	58.8 Å²	58.8	65%	0.654	30%	0.302	S	S	*	.	S	Bend	trans	-62.8	129.2	176.7	-175.2	-155.7	-145.2	0	0	111.3	K386	E315-K386 IonicContact OE2-NZ 2.65Å; E315-K386 PolarHBondContact OE2-NZ 3.17Å
316	S	97.1	Very high	95.6	Very high	20 Å²	20	56.9 Å²	56.9	14%	0.14	29%	0.29	C	S	.	.			trans	56.1	-169.6	175.4	-163.1	0	0	0	0	114.1	P302 L314 E320 L321	P302-S316 WeakPolarHBondContact CG-O 3.31Å; L314-S316 PolarHBondContact O-N 2.9Å; S316-E320 VanDerWaalsContact CA-OE2 3.25Å; S316-E320 WeakPolarHBondContact CA-OE2 3.37Å; S316-L321 WeakPolarHBondContact OG-CG 3.45Å
317	S	98.6	Very high	95.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.283	C	S	.	.			trans	-162.4	166.5	177.5	56.5	0	0	0	0	110.4	P302 P305 E319 E320 L321	P302-S317 CarbonylContact O-C 3.58Å; P302-S317 WeakPolarHBondContact O-CA 3.41Å; P302-S317 WeakPolarHBondContact O-CB 3.47Å; P305-S317 WeakPolarHBondContact CD-OG 3.37Å; S317-E319 PolarHBondContact O-N 3.25Å; S317-E320 WeakPolarHBondContact CB-OE2 3.22Å; S317-E320 PolarHBondContact N-OE2 3.48Å; S317-E320 PolarHBondContact O-N 3.36Å; S317-E320 VanDerWaalsContact OG-CG 3.31Å; S317-E320 WeakPolarHBondContact OG-CG 3.16Å; S317-E320 PolarHBondContact OG-N 2.93Å; S317-E320 PolarHBondContact OG-OE2 3.04Å; S317-L321 VanDerWaalsContact O-CG 3.26Å; S317-L321 WeakPolarHBondContact O-CG 3.41Å; S317-L321 PolarHBondContact O-N 3.33Å; S317-L321 VanDerWaalsContact O-N 3.15Å
318	V	98.6	Very high	95.9	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-57.7	-42.8	172.4	176.6	0	0	0	0	110.6	Y294 K296 L301 P302 Q303 I322 I387	Y294-V318 HydrophobicContact CD1-CG1 3.96Å; Y294-V318 HydrophobicContact CD2-CG1 3.55Å; Y294-V318 HydrophobicContact CE1-CG1 4.11Å; Y294-V318 HydrophobicContact CE2-CG1 3.75Å; Y294-V318 HydrophobicContact CE2-CG2 4.27Å; Y294-V318 HydrophobicContact CG-CG1 3.68Å; K296-V318 HydrophobicContact CB-CG2 4.45Å; K296-V318 HydrophobicContact CD-CG2 4Å; K296-V318 HydrophobicContact CG-CG2 4.09Å; L301-V318 HydrophobicContact CD2-CG2 3.71Å; L301-V318 HydrophobicContact CG-CG2 4.36Å; P302-V318 PolarHBondContact O-N 2.86Å; Q303-V318 HydrophobicContact CG-CB 4.48Å; Q303-V318 WeakPolarHBondContact O-CB 3.11Å; Q303-V318 PolarHBondContact O-N 2.83Å; V318-I322 HydrophobicContact CG1-CD1 3.95Å; V318-I322 VanDerWaalsContact O-CG1 3.31Å; V318-I322 WeakPolarHBondContact O-CG1 3.35Å; V318-I322 PolarHBondContact O-N 3.06Å; V318-I387 HydrophobicContact CB-CG2 4.43Å; V318-I387 HydrophobicContact CG1-CG2 4.27Å; V318-I387 HydrophobicContact CG2-CG2 3.98Å
319	E	98.5	Very high	96.3	Very high	32 Å²	32	52 Å²	52	15%	0.15	28%	0.283	C	S	.	.	H	α-helix	trans	-50	-64	173.8	173.7	177.1	128.7	0	0	111.9	Q303 T304 P305 S317 L321 I322 S323 F335 F337	Q303-E319 WeakPolarHBondContact O-CB 3.37Å; Q303-E319 PolarHBondContact O-N 3Å; T304-E319 VanDerWaalsContact CB-OE2 3.23Å; T304-E319 WeakPolarHBondContact CB-OE2 3.47Å; T304-E319 HydrophobicContact CG2-CB 4.47Å; T304-E319 WeakPolarHBondContact CG2-OE2 3.5Å; P305-E319 VanDerWaalsContact CD-CD 3.46Å; P305-E319 WeakPolarHBondContact CD-OE1 3.39Å; S317-E319 PolarHBondContact O-N 3.25Å; E319-L321 PolarHBondContact O-N 2.9Å; E319-I322 PolarHBondContact O-N 2.98Å; E319-I322 VanDerWaalsContact O-N 3.1Å; E319-S323 WeakPolarHBondContact O-CB 3.34Å; E319-S323 PolarHBondContact O-N 2.71Å; E319-S323 PolarHBondContact O-OG 3.25Å; E319-F335 HydrophobicContact CG-CE2 3.64Å; E319-F335 HydrophobicContact CG-CZ 4.09Å; E319-F337 HydrophobicContact CB-CB 4.38Å; E319-F337 HydrophobicContact CB-CD1 4.29Å; E319-F337 HydrophobicContact CB-CD2 4.22Å; E319-F337 HydrophobicContact CB-CG 4.05Å; E319-F337 HydrophobicContact CG-CB 3.62Å; E319-F337 HydrophobicContact CG-CD1 4.4Å; E319-F337 HydrophobicContact CG-CD2 4.21Å; E319-F337 HydrophobicContact CG-CG 3.84Å
320	E	98.2	Very high	96.6	Very high	25 Å²	25	44.4 Å²	44.4	12%	0.117	24%	0.243	C	C	.	.	H	α-helix	trans	-60.5	-43.4	-175.6	-69.4	163	119	0	0	112.8	P305 R312 S316 S317 I322 S323 D324	P305-E320 HydrophobicContact CG-CG 4Å; R312-E320 IonicContact CZ-OE1 2.7Å; R312-E320 IonicContact CZ-OE2 3.33Å; R312-E320 VanDerWaalsContact NH1-CD 3.27Å; R312-E320 IonicContact NH1-OE1 2.69Å; R312-E320 PolarHBondContact NH1-OE1 2.59Å; R312-E320 IonicContact NH1-OE2 2.74Å; R312-E320 PolarHBondContact NH1-OE2 3.48Å; R312-E320 IonicContact NH2-OE1 3.71Å; R312-E320 PolarHBondContact NH2-OE1 2.98Å; S316-E320 VanDerWaalsContact CA-OE2 3.25Å; S316-E320 WeakPolarHBondContact CA-OE2 3.37Å; S317-E320 WeakPolarHBondContact CB-OE2 3.22Å; S317-E320 PolarHBondContact N-OE2 3.48Å; S317-E320 PolarHBondContact O-N 3.36Å; S317-E320 VanDerWaalsContact OG-CG 3.31Å; S317-E320 WeakPolarHBondContact OG-CG 3.16Å; S317-E320 PolarHBondContact OG-N 2.93Å; S317-E320 PolarHBondContact OG-OE2 3.04Å; E320-I322 PolarHBondContact O-N 2.86Å; E320-I322 VanDerWaalsContact O-N 3.08Å; E320-S323 PolarHBondContact O-N 2.73Å; E320-D324 WeakPolarHBondContact O-CB 3.36Å; E320-D324 PolarHBondContact O-N 2.69Å; E320-D324 VanDerWaalsContact O-N 3.12Å
321	L	98.5	Very high	96.9	Very high	26 Å²	26	47.2 Å²	47.2	14%	0.136	24%	0.235	C	C	.	.	H	α-helix	trans	-58.1	-26.9	178.7	-70.9	173.3	0	0	0	112.8	L301 S316 S317 E319 H325 K386 I387	L301-L321 HydrophobicContact CD1-CD1 4.21Å; L301-L321 HydrophobicContact CD2-CD1 3.78Å; S316-L321 WeakPolarHBondContact OG-CG 3.45Å; S317-L321 VanDerWaalsContact O-CG 3.26Å; S317-L321 WeakPolarHBondContact O-CG 3.41Å; S317-L321 PolarHBondContact O-N 3.33Å; S317-L321 VanDerWaalsContact O-N 3.15Å; E319-L321 PolarHBondContact O-N 2.9Å; L321-H325 PolarHBondContact O-CE1 2.71Å; L321-H325 PolarHBondContact O-ND1 2.87Å; L321-K386 HydrophobicContact CD1-CB 4.04Å; L321-K386 HydrophobicContact CD1-CD 4.34Å; L321-I387 HydrophobicContact CB-CD1 4.33Å; L321-I387 HydrophobicContact CB-CG1 3.82Å; L321-I387 HydrophobicContact CD1-CG1 3.81Å; L321-I387 HydrophobicContact CD1-CG2 4.1Å; L321-I387 HydrophobicContact CG-CG1 4.46Å
322	I	98.4	Very high	97.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-90.2	-60.1	174.6	-57.7	170.3	0	0	0	109.5	V318 E319 E320 D324 H325 L326 F337 F356 I358 I380 I387 V389	V318-I322 HydrophobicContact CG1-CD1 3.95Å; V318-I322 VanDerWaalsContact O-CG1 3.31Å; V318-I322 WeakPolarHBondContact O-CG1 3.35Å; V318-I322 PolarHBondContact O-N 3.06Å; E319-I322 PolarHBondContact O-N 2.98Å; E319-I322 VanDerWaalsContact O-N 3.1Å; E320-I322 PolarHBondContact O-N 2.86Å; E320-I322 VanDerWaalsContact O-N 3.08Å; I322-D324 PolarHBondContact O-N 3.14Å; I322-H325 PolarHBondContact O-N 3.06Å; I322-L326 HydrophobicContact CG2-CD1 4.07Å; I322-L326 WeakPolarHBondContact O-CD1 3.35Å; I322-F337 HydrophobicContact CD1-CE2 4.42Å; I322-F356 HydrophobicContact CD1-CD1 4.45Å; I322-F356 HydrophobicContact CD1-CE1 4.15Å; I322-F356 HydrophobicContact CD1-CE2 4.35Å; I322-F356 HydrophobicContact CD1-CZ 4.11Å; I322-F356 HydrophobicContact CG2-CE2 3.8Å; I322-F356 HydrophobicContact CG2-CZ 3.9Å; I322-I358 HydrophobicContact CB-CD1 4.23Å; I322-I358 HydrophobicContact CG2-CD1 3.52Å; I322-I380 HydrophobicContact CG1-CG2 4.38Å; I322-I380 HydrophobicContact CG2-CD1 4.28Å; I322-I387 HydrophobicContact CG1-CD1 4.26Å; I322-V389 HydrophobicContact CD1-CG2 3.85Å; I322-V389 HydrophobicContact CG1-CG2 3.83Å
323	S	97.3	Very high	97.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.4	-31.3	-164.3	60.5	0	0	0	0	115.4	E319 E320 H325 L326 L327 F335	E319-S323 WeakPolarHBondContact O-CB 3.34Å; E319-S323 PolarHBondContact O-N 2.71Å; E319-S323 PolarHBondContact O-OG 3.25Å; E320-S323 PolarHBondContact O-N 2.73Å; S323-H325 PolarHBondContact O-N 3.48Å; S323-L326 PolarHBondContact O-N 2.98Å; S323-L327 PolarHBondContact O-N 3.3Å; S323-F335 WeakPolarHBondContact OG-CE1 3.34Å; S323-F335 WeakPolarHBondContact OG-CE2 3.33Å; S323-F335 WeakPolarHBondContact OG-CZ 3.33Å
324	D	95.1	Very high	97.4	Very high	89 Å²	89	41.6 Å²	41.6	48%	0.476	22%	0.223	S	C	.	.	H	α-helix	trans	-58.8	-33.1	179.9	-70.2	-11.9	0	0	0	111.5	E320 I322	E320-D324 WeakPolarHBondContact O-CB 3.36Å; E320-D324 PolarHBondContact O-N 2.69Å; E320-D324 VanDerWaalsContact O-N 3.12Å; I322-D324 PolarHBondContact O-N 3.14Å
325	H	97.3	Very high	97.5	Very high	34 Å²	34	42 Å²	42	16%	0.157	22%	0.224	C	C	.	.	H	α-helix	trans	-72.3	-34.7	176.1	-58.7	84.8	0	0	0	112.5	L321 I322 S323 V329 L376 I380 S383	L321-H325 PolarHBondContact O-CE1 2.71Å; L321-H325 PolarHBondContact O-ND1 2.87Å; I322-H325 PolarHBondContact O-N 3.06Å; S323-H325 PolarHBondContact O-N 3.48Å; H325-V329 VanDerWaalsContact O-CG2 3.29Å; H325-V329 WeakPolarHBondContact O-CG2 3.28Å; H325-V329 PolarHBondContact O-N 3.38Å; H325-L376 HydrophobicContact CB-CD1 4.26Å; H325-I380 HydrophobicContact CB-CG1 3.83Å; H325-S383 PolarHBondContact CE1-OG 3.39Å; H325-S383 VanDerWaalsContact NE2-CB 3.32Å; H325-S383 WeakPolarHBondContact NE2-CB 3.5Å; H325-S383 PolarHBondContact NE2-OG 3.33Å
326	L	97.5	Very high	97.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-73.8	-45.8	-179	-78.4	72.3	0	0	0	110.7	V290 I322 S323 A328 V329 F330 I358 L360 L376 I380	V290-L326 HydrophobicContact CB-CD2 3.65Å; V290-L326 HydrophobicContact CG1-CD2 3.9Å; V290-L326 HydrophobicContact CG2-CD2 3.88Å; I322-L326 HydrophobicContact CG2-CD1 4.07Å; I322-L326 WeakPolarHBondContact O-CD1 3.35Å; S323-L326 PolarHBondContact O-N 2.98Å; L326-A328 VanDerWaalsContact C-N 3.3Å; L326-A328 PolarHBondContact O-N 2.92Å; L326-V329 PolarHBondContact O-N 3.33Å; L326-F330 HydrophobicContact CB-CD2 4.38Å; L326-F330 WeakPolarHBondContact O-CD2 3.24Å; L326-F330 PolarHBondContact O-N 3.31Å; L326-I358 HydrophobicContact CD1-CD1 4.43Å; L326-I358 HydrophobicContact CD2-CB 4.07Å; L326-I358 HydrophobicContact CD2-CD1 3.79Å; L326-I358 HydrophobicContact CD2-CG1 4.5Å; L326-I358 HydrophobicContact CD2-CG2 4.17Å; L326-L360 HydrophobicContact CB-CD1 4.31Å; L326-L360 HydrophobicContact CB-CD2 3.97Å; L326-L360 HydrophobicContact CD2-CD1 4.24Å; L326-L376 HydrophobicContact CG-CD2 4.21Å; L326-I380 HydrophobicContact CD1-CD1 3.74Å
327	L	96.4	Very high	97.6	Very high	40 Å²	40	40 Å²	40	21%	0.209	21%	0.214	C	C	.	.	H	α-helix	trans	-49.8	-50.7	178.5	-80.9	-176.1	0	0	0	112.1	S323 V329 K331 A332 F335 L360	S323-L327 PolarHBondContact O-N 3.3Å; L327-V329 VanDerWaalsContact C-N 3.32Å; L327-V329 PolarHBondContact O-N 3.02Å; L327-K331 WeakPolarHBondContact O-CA 3.42Å; L327-K331 PolarHBondContact O-N 3.13Å; L327-A332 HydrophobicContact CD2-CB 4Å; L327-A332 PolarHBondContact O-N 3.48Å; L327-F335 HydrophobicContact CD1-CD1 3.69Å; L327-F335 HydrophobicContact CD1-CE1 3.99Å; L327-F335 HydrophobicContact CD2-CB 4.21Å; L327-F335 HydrophobicContact CD2-CD1 3.93Å; L327-F335 HydrophobicContact CG-CD1 3.73Å; L327-F335 HydrophobicContact CG-CE1 4.43Å; L327-L360 HydrophobicContact CD2-CD2 4.25Å
328	A	95.3	Very high	97.4	Very high	73 Å²	73	42.2 Å²	42.2	60%	0.603	23%	0.23	S	C	*	.	H	α-helix	trans	-66.5	-31.4	-178.4	0	0	0	0	0	113.4	L326	L326-A328 VanDerWaalsContact C-N 3.3Å; L326-A328 PolarHBondContact O-N 2.92Å
329	V	97.8	Very high	97.2	Very high	33 Å²	33	43 Å²	43	20%	0.2	24%	0.235	C	C	.	.	H	α-helix	trans	-84.4	-40.3	-176.4	167.6	0	0	0	0	112	H325 L326 L327 K331 R365 F368 L376	H325-V329 VanDerWaalsContact O-CG2 3.29Å; H325-V329 WeakPolarHBondContact O-CG2 3.28Å; H325-V329 PolarHBondContact O-N 3.38Å; L326-V329 PolarHBondContact O-N 3.33Å; L327-V329 VanDerWaalsContact C-N 3.32Å; L327-V329 PolarHBondContact O-N 3.02Å; V329-K331 VanDerWaalsContact C-N 3.33Å; V329-R365 WeakPolarHBondContact O-CD 3.49Å; V329-F368 HydrophobicContact CG1-CE1 3.49Å; V329-F368 VanDerWaalsContact CG1-CE1 3.49Å; V329-F368 HydrophobicContact CG1-CZ 3.87Å; V329-L376 HydrophobicContact CB-CD1 4.48Å; V329-L376 HydrophobicContact CG1-CD2 4.24Å; V329-L376 HydrophobicContact CG2-CD1 4.05Å
330	F	98.4	Very high	96.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-83	-9.9	176.1	-76.5	-103	0	0	0	113.3	V288 V290 L326 A332 L360 P363 H364 R365 F368 I373 L376 L394	V288-F330 HydrophobicContact CG2-CD1 3.72Å; V288-F330 HydrophobicContact CG2-CE1 3.82Å; V290-F330 HydrophobicContact CG2-CE1 4.2Å; V290-F330 HydrophobicContact CG2-CE2 3.81Å; V290-F330 HydrophobicContact CG2-CZ 3.43Å; V290-F330 VanDerWaalsContact CG2-CZ 3.43Å; L326-F330 HydrophobicContact CB-CD2 4.38Å; L326-F330 WeakPolarHBondContact O-CD2 3.24Å; L326-F330 PolarHBondContact O-N 3.31Å; F330-A332 VanDerWaalsContact C-N 3.25Å; F330-A332 HydrophobicContact CB-CB 4.44Å; F330-A332 PolarHBondContact O-N 2.99Å; F330-L360 HydrophobicContact CB-CD1 3.98Å; F330-L360 HydrophobicContact CD1-CD1 3.66Å; F330-L360 HydrophobicContact CD2-CD1 3.6Å; F330-L360 HydrophobicContact CE1-CD1 3.97Å; F330-L360 HydrophobicContact CE2-CD1 3.93Å; F330-L360 HydrophobicContact CG-CD1 3.47Å; F330-L360 VanDerWaalsContact CG-CD1 3.47Å; F330-L360 HydrophobicContact CZ-CD1 4.11Å; F330-P363 HydrophobicContact CB-CB 4.33Å; F330-H364 PolarHBondContact O-N 3.21Å; F330-R365 WeakPolarHBondContact CD1-O 3.39Å; F330-R365 PolarHBondContact O-N 3.32Å; F330-F368 HydrophobicContact CD1-CD2 4.32Å; F330-F368 AromaticContact CD1-CE2 3.42Å; F330-F368 HydrophobicContact CD1-CE2 3.42Å; F330-F368 VanDerWaalsContact CD1-CE2 3.42Å; F330-F368 AromaticContact CD1-CZ 3.91Å; F330-F368 HydrophobicContact CD1-CZ 3.91Å; F330-F368 HydrophobicContact CD2-CE2 4.25Å; F330-F368 AromaticContact CD2-CZ 3.99Å; F330-F368 HydrophobicContact CD2-CZ 3.99Å; F330-F368 AromaticContact CE1-CD2 3.68Å; F330-F368 HydrophobicContact CE1-CD2 3.68Å; F330-F368 AromaticContact CE1-CE2 3.21Å; F330-F368 HydrophobicContact CE1-CE2 3.21Å; F330-F368 AromaticContact CE1-CZ 3.93Å; F330-F368 HydrophobicContact CE1-CZ 3.93Å; F330-F368 HydrophobicContact CE2-CE2 4.08Å; F330-F368 HydrophobicContact CE2-CZ 4.01Å; F330-F368 AromaticContact CG-CE2 3.94Å; F330-F368 HydrophobicContact CG-CE2 3.94Å; F330-F368 AromaticContact CG-CZ 3.93Å; F330-F368 HydrophobicContact CG-CZ 3.93Å; F330-F368 AromaticContact CZ-CD2 3.84Å; F330-F368 HydrophobicContact CZ-CD2 3.84Å; F330-F368 AromaticContact CZ-CE2 3.56Å; F330-F368 HydrophobicContact CZ-CE2 3.56Å; F330-F368 AromaticContact CZ-CZ 3.97Å; F330-F368 HydrophobicContact CZ-CZ 3.97Å; F330-I373 HydrophobicContact CZ-CD1 4.26Å; F330-L376 HydrophobicContact CE2-CD2 3.97Å; F330-L394 HydrophobicContact CE1-CD2 3.84Å; F330-L394 HydrophobicContact CZ-CD2 3.88Å
331	K	98.2	Very high	96.5	Very high	131 Å²	131	40.7 Å²	40.7	57%	0.57	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	49.6	-173.1	-58.4	174.9	-177.8	174.2	0	110.8	L327 V329 H364	L327-K331 WeakPolarHBondContact O-CA 3.42Å; L327-K331 PolarHBondContact O-N 3.13Å; V329-K331 VanDerWaalsContact C-N 3.33Å; K331-H364 HydrophobicContact CB-CB 3.86Å; K331-H364 HydrophobicContact CD-CB 4.27Å; K331-H364 PolarHBondContact O-N 3.42Å; K331-H364 PolarHBondContact O-ND1 3.04Å
332	A	98.3	Very high	96.3	Very high	16 Å²	16	45.5 Å²	45.5	13%	0.132	24%	0.244	C	C	.	.			trans	-93.2	151.5	178.2	0	0	0	0	0	110.3	L327 F330 L360 V361 P363	L327-A332 HydrophobicContact CD2-CB 4Å; L327-A332 PolarHBondContact O-N 3.48Å; F330-A332 VanDerWaalsContact C-N 3.25Å; F330-A332 HydrophobicContact CB-CB 4.44Å; F330-A332 PolarHBondContact O-N 2.99Å; A332-L360 HydrophobicContact CB-CB 4Å; A332-L360 HydrophobicContact CB-CD2 4.1Å; A332-V361 WeakPolarHBondContact CB-O 3.49Å; A332-P363 HydrophobicContact CB-CB 4.35Å
333	E	97.3	Very high	96.2	Very high	129 Å²	129	46 Å²	46	60%	0.603	25%	0.246	S	C	*	.	S	Bend	trans	-76.9	-36	-179.4	-68.4	175.5	-174.7	0	0	112.5	V361 N362	E333-V361 PolarHBondContact N-O 2.81Å; E333-N362 HydrophobicContact CG-CB 4.09Å; E333-N362 PolarHBondContact OE1-ND2 2.74Å
334	S	97.9	Very high	96.2	Very high	54 Å²	54	48.3 Å²	48.3	38%	0.378	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	172.2	-178.4	59.1	0	0	0	0	110.6	V361	S334-V361 PolarHBondContact O-N 3.45Å; S334-V361 WeakPolarHBondContact OG-CB 3.41Å
335	F	98	Very high	96.3	Very high	40 Å²	40	45.9 Å²	45.9	18%	0.175	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	156.4	176.3	70.2	-92.6	0	0	0	112.1	E319 S323 L327 F337 I358 E359 L360	E319-F335 HydrophobicContact CG-CE2 3.64Å; E319-F335 HydrophobicContact CG-CZ 4.09Å; S323-F335 WeakPolarHBondContact OG-CE1 3.34Å; S323-F335 WeakPolarHBondContact OG-CE2 3.33Å; S323-F335 WeakPolarHBondContact OG-CZ 3.33Å; L327-F335 HydrophobicContact CD1-CD1 3.69Å; L327-F335 HydrophobicContact CD1-CE1 3.99Å; L327-F335 HydrophobicContact CD2-CB 4.21Å; L327-F335 HydrophobicContact CD2-CD1 3.93Å; L327-F335 HydrophobicContact CG-CD1 3.73Å; L327-F335 HydrophobicContact CG-CE1 4.43Å; F335-F337 HydrophobicContact CD2-CB 4.34Å; F335-F337 HydrophobicContact CE2-CB 4.24Å; F335-I358 HydrophobicContact CB-CG2 3.75Å; F335-I358 HydrophobicContact CD2-CG2 4.26Å; F335-I358 HydrophobicContact CG-CG2 4.25Å; F335-E359 CarbonylContact C-O 3.56Å; F335-E359 WeakPolarHBondContact CA-O 3.38Å; F335-E359 WeakPolarHBondContact CB-O 3.14Å; F335-L360 HydrophobicContact CB-CD2 4.17Å
336	N	97	Very high	96.4	Very high	87 Å²	87	47.7 Å²	47.7	47%	0.465	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	118.2	164.2	-56.5	-57	0	0	0	109.4	I358 E359	N336-I358 WeakPolarHBondContact O-CA 3.05Å; N336-E359 HydrophobicContact CB-CB 4.08Å; N336-E359 PolarHBondContact N-O 2.81Å; N336-E359 PolarHBondContact ND2-OE2 3.42Å; N336-E359 PolarHBondContact O-N 2.9Å
337	F	96.9	Very high	96.4	Very high	30 Å²	30	47.9 Å²	47.9	13%	0.132	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	139.3	174.6	178.7	-86.7	0	0	0	111	Y294 Q303 T304 E319 I322 F335 F356 I358	Y294-F337 HydrophobicContact CE1-CZ 4.3Å; Q303-F337 HydrophobicContact CG-CE1 4.32Å; T304-F337 HydrophobicContact CG2-CD1 4.31Å; E319-F337 HydrophobicContact CB-CB 4.38Å; E319-F337 HydrophobicContact CB-CD1 4.29Å; E319-F337 HydrophobicContact CB-CD2 4.22Å; E319-F337 HydrophobicContact CB-CG 4.05Å; E319-F337 HydrophobicContact CG-CB 3.62Å; E319-F337 HydrophobicContact CG-CD1 4.4Å; E319-F337 HydrophobicContact CG-CD2 4.21Å; E319-F337 HydrophobicContact CG-CG 3.84Å; I322-F337 HydrophobicContact CD1-CE2 4.42Å; F335-F337 HydrophobicContact CD2-CB 4.34Å; F335-F337 HydrophobicContact CE2-CB 4.24Å; F337-F356 HydrophobicContact CD2-CD2 4.46Å; F337-F356 HydrophobicContact CE2-CB 3.85Å; F337-F356 AromaticContact CE2-CD2 3.87Å; F337-F356 HydrophobicContact CE2-CD2 3.87Å; F337-F356 HydrophobicContact CE2-CG 4.02Å; F337-F356 HydrophobicContact CZ-CB 3.82Å; F337-F356 HydrophobicContact CZ-CG 4.41Å; F337-I358 HydrophobicContact CD2-CD1 4.2Å; F337-I358 HydrophobicContact CD2-CG1 3.82Å
338	S	94.9	Very high	96.5	Very high	48 Å²	48	49.4 Å²	49.4	34%	0.336	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	146.9	176.1	-170.5	0	0	0	0	110	F356 A357	S338-F356 CarbonylContact O-C 3.58Å; S338-F356 VanDerWaalsContact O-CA 3.23Å; S338-F356 WeakPolarHBondContact O-CA 3.33Å; S338-F356 WeakPolarHBondContact O-CB 3.44Å; S338-A357 PolarHBondContact N-O 3.45Å; S338-A357 PolarHBondContact O-N 3.49Å; S338-A357 VanDerWaalsContact O-O 3.1Å
339	S	94	Very high	96.7	Very high	15 Å²	15	46 Å²	46	11%	0.105	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	153.7	179.7	60.3	0	0	0	0	111.7	Q303 G341 P355	Q303-S339 PolarHBondContact NE2-OG 3.1Å; S339-G341 VanDerWaalsContact C-N 3.32Å; S339-G341 PolarHBondContact O-N 3.18Å; S339-G341 PolarHBondContact OG-O 2.89Å; S339-P355 WeakPolarHBondContact CA-O 3.43Å; S339-P355 WeakPolarHBondContact CB-O 3.49Å
340	S	92.5	Very high	96.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.233	C	C	.	.	S	Bend	trans	-75.3	85.8	176.2	-165.5	0	0	0	0	110.2	R354 P355 M403 E407	S340-R354 WeakPolarHBondContact O-CD 3.06Å; S340-R354 PolarHBondContact O-NH1 2.69Å; S340-P355 PolarHBondContact N-O 3.31Å; S340-M403 WeakPolarHBondContact CB-O 3.49Å; S340-M403 PolarHBondContact OG-O 3.19Å; S340-E407 PolarHBondContact OG-N 2.85Å
341	G	90.3	Very high	96.6	Very high	10 Å²	10	48 Å²	48	10%	0.103	25%	0.252	C	S	.	.	S	Bend	trans	77.5	-170.1	-172.5	0	0	0	0	0	115.1	Q303 S339 R354 E407	Q303-G341 PolarHBondContact NE2-O 3.14Å; Q303-G341 VanDerWaalsContact NE2-O 3.13Å; S339-G341 VanDerWaalsContact C-N 3.32Å; S339-G341 PolarHBondContact O-N 3.18Å; S339-G341 PolarHBondContact OG-O 2.89Å; G341-R354 VanDerWaalsContact O-CD 3.29Å; G341-R354 WeakPolarHBondContact O-CD 3.37Å; G341-E407 VanDerWaalsContact CA-CD 3.5Å; G341-E407 PolarHBondContact N-OE2 3.4Å
342	R	94.2	Very high	96.5	Very high	126 Å²	126	47.4 Å²	47.4	48%	0.475	26%	0.255	S	S	.	.			trans	-150.6	153.5	-174.2	174.3	172.5	-169.8	123.5	-9.6	112.5	Q303 T304	Q303-R342 HydrophobicContact CB-CG 4.29Å; Q303-R342 VanDerWaalsContact OE1-CD 3.23Å; Q303-R342 VanDerWaalsContact OE1-NH1 3.07Å; T304-R342 VanDerWaalsContact CG2-NH1 3.31Å; T304-R342 PolarHBondContact OG1-NH1 3.14Å; T304-R342 PolarHBondContact OG1-NH2 3.3Å
343	E	96.2	Very high	96.5	Very high	10 Å²	10	46.8 Å²	46.8	5%	0.047	25%	0.25	C	S	.	.			trans	-114	161.6	167.7	67.6	-74.8	161.6	0	0	113.1	Y294 K296 V347 T349 R354 V516	Y294-E343 VanDerWaalsContact CE2-OE1 3.32Å; Y294-E343 WeakPolarHBondContact CE2-OE1 3.26Å; Y294-E343 PolarHBondContact OH-OE1 3.32Å; Y294-E343 PolarHBondContact OH-OE2 2.8Å; K296-E343 HydrophobicContact CD-CG 4.23Å; E343-V347 HydrophobicContact CB-CB 3.91Å; E343-V347 HydrophobicContact CB-CG1 3.68Å; E343-V347 HydrophobicContact CG-CB 4.2Å; E343-V347 HydrophobicContact CG-CG1 4.12Å; E343-T349 VanDerWaalsContact CD-OG1 3.24Å; E343-T349 PolarHBondContact OE2-OG1 2.86Å; E343-R354 IonicContact OE2-CZ 3.5Å; E343-R354 IonicContact OE2-NE 2.79Å; E343-R354 PolarHBondContact OE2-NE 2.88Å; E343-R354 IonicContact OE2-NH2 3.71Å; E343-R354 PolarHBondContact OE2-NH2 3.11Å; E343-V516 HydrophobicContact CB-CG2 4.32Å
344	D	97.1	Very high	96.5	Very high	50 Å²	50	41 Å²	41	27%	0.267	22%	0.223	S	C	.	.			trans	-70.2	166.9	174.7	-68.8	-41.8	0	0	0	111.5	K296 D346 V347 R447 K487	K296-D344 PolarHBondContact NZ-O 2.74Å; D344-D346 VanDerWaalsContact C-N 3.27Å; D344-D346 WeakPolarHBondContact CB-OD1 3.39Å; D344-D346 PolarHBondContact O-N 2.77Å; D344-V347 HydrophobicContact CB-CG2 3.93Å; D344-V347 PolarHBondContact O-N 3.26Å; D344-R447 IonicContact OD1-CZ 2.67Å; D344-R447 IonicContact OD1-NH1 3.93Å; D344-R447 PolarHBondContact OD1-NH1 3.25Å; D344-R447 IonicContact OD1-NH2 2.81Å; D344-R447 IonicContact OD2-CZ 3.68Å; D344-R447 IonicContact OD2-NH1 3.24Å; D344-R447 PolarHBondContact OD2-NH1 3.47Å; D344-R447 IonicContact OD2-NH2 2.59Å; D344-R447 PolarHBondContact OD2-NH2 2.93Å; D344-K487 WeakPolarHBondContact OD2-CE 3.48Å; D344-K487 IonicContact OD2-NZ 3.04Å; D344-K487 PolarHBondContact OD2-NZ 3.49Å
345	V	97.6	Very high	96.4	Very high	37 Å²	37	38.4 Å²	38.4	22%	0.224	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-39.9	-179.1	174.2	0	0	0	0	112.7	K296 R299 P302 W306 L314	K296-V345 PolarHBondContact NZ-O 3.17Å; R299-V345 CarbonylContact C-O 3.54Å; R299-V345 VanDerWaalsContact C-O 3.24Å; P302-V345 HydrophobicContact CB-CG2 4.12Å; W306-V345 HydrophobicContact CE3-CG2 4.22Å; W306-V345 HydrophobicContact CZ3-CG2 4.21Å; L314-V345 HydrophobicContact CD1-CB 4.49Å; L314-V345 HydrophobicContact CD1-CG1 3.42Å; L314-V345 VanDerWaalsContact CD1-CG1 3.42Å; L314-V345 HydrophobicContact CD1-CG2 4.24Å
346	D	98	Very high	96.3	Very high	72 Å²	72	36.5 Å²	36.5	39%	0.385	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-5.9	-176.1	57.9	-13.5	0	0	0	114.5	R299 D344 K487	R299-D346 WeakPolarHBondContact CD-O 3.39Å; R299-D346 VanDerWaalsContact CG-O 3.24Å; R299-D346 WeakPolarHBondContact CG-O 3.46Å; R299-D346 PolarHBondContact NH1-O 3.32Å; R299-D346 WeakPolarHBondContact O-CA 3.32Å; D344-D346 VanDerWaalsContact C-N 3.27Å; D344-D346 WeakPolarHBondContact CB-OD1 3.39Å; D344-D346 PolarHBondContact O-N 2.77Å; D346-K487 IonicContact OD1-NZ 3.95Å; D346-K487 PolarHBondContact OD1-NZ 3.24Å; D346-K487 IonicContact OD2-NZ 3.96Å; D346-K487 PolarHBondContact OD2-NZ 2.79Å
347	V	98.6	Very high	96.3	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.024	18%	0.175	C	C	.	.			trans	-95.2	133.2	-177.4	175.3	0	0	0	0	110.8	K296 E343 D344 L514 V516	K296-V347 WeakPolarHBondContact CD-O 3.23Å; K296-V347 WeakPolarHBondContact CE-O 3.3Å; K296-V347 PolarHBondContact NZ-O 3.24Å; E343-V347 HydrophobicContact CB-CB 3.91Å; E343-V347 HydrophobicContact CB-CG1 3.68Å; E343-V347 HydrophobicContact CG-CB 4.2Å; E343-V347 HydrophobicContact CG-CG1 4.12Å; D344-V347 HydrophobicContact CB-CG2 3.93Å; D344-V347 PolarHBondContact O-N 3.26Å; V347-L514 WeakPolarHBondContact CA-O 2.84Å; V347-L514 HydrophobicContact CG1-CG 4.26Å; V347-L514 HydrophobicContact CG2-CB 4.06Å; V347-L514 HydrophobicContact CG2-CD2 3.83Å; V347-L514 HydrophobicContact CG2-CG 4Å; V347-V516 HydrophobicContact CG1-CG2 3.9Å
348	R	98.8	Very high	96.4	Very high	73 Å²	73	31 Å²	31	28%	0.275	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	162.2	171.5	-59.2	-177	-65.4	-162.2	-1.6	111	K296 Y297 R299 L350 E513 L514 D515 V516	K296-R348 CarbonylContact O-C 3.57Å; K296-R348 VanDerWaalsContact O-CA 3.24Å; K296-R348 WeakPolarHBondContact O-CA 3.4Å; K296-R348 WeakPolarHBondContact O-CB 3.29Å; Y297-R348 VanDerWaalsContact O-CD 3.26Å; Y297-R348 WeakPolarHBondContact O-CD 3.38Å; Y297-R348 WeakPolarHBondContact O-CG 3.35Å; R299-R348 HydrophobicContact CG-CG 4.08Å; R299-R348 VanDerWaalsContact NH2-CZ 3.33Å; R299-R348 VanDerWaalsContact NH2-NE 3.19Å; R348-L350 HydrophobicContact CB-CD2 4.02Å; R348-L350 HydrophobicContact CB-CG 4.26Å; R348-E513 IonicContact NH2-OE2 2.64Å; R348-L514 PolarHBondContact N-O 3.43Å; R348-D515 VanDerWaalsContact CB-OD1 3.25Å; R348-D515 WeakPolarHBondContact CB-OD1 3.48Å; R348-D515 IonicContact CZ-OD1 3.57Å; R348-D515 IonicContact CZ-OD2 3.49Å; R348-D515 IonicContact NE-OD1 2.82Å; R348-D515 PolarHBondContact NE-OD1 3.07Å; R348-D515 IonicContact NE-OD2 3.48Å; R348-D515 PolarHBondContact NE-OD2 2.7Å; R348-D515 IonicContact NH2-OD1 2.7Å; R348-D515 IonicContact NH2-OD2 3.84Å; R348-D515 PolarHBondContact NH2-OD2 3.28Å; R348-V516 PolarHBondContact O-N 3.45Å
349	T	98.6	Very high	96.5	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.006	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	108.2	171.6	-58.9	0	0	0	0	108.5	N295 K296 E343 R354 V516	N295-T349 CarbonylContact C-O 3.53Å; N295-T349 WeakPolarHBondContact CA-O 3.44Å; N295-T349 WeakPolarHBondContact CB-O 3.15Å; N295-T349 PolarHBondContact ND2-O 3.35Å; K296-T349 PolarHBondContact N-O 2.63Å; K296-T349 PolarHBondContact O-N 2.82Å; E343-T349 VanDerWaalsContact CD-OG1 3.24Å; E343-T349 PolarHBondContact OE2-OG1 2.86Å; T349-R354 HydrophobicContact CG2-CB 4.04Å; T349-V516 HydrophobicContact CG2-CB 4.25Å; T349-V516 HydrophobicContact CG2-CG1 4.47Å
350	L	98.2	Very high	96.7	Very high	35 Å²	35	29.6 Å²	29.6	18%	0.183	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	-163.6	-170.3	-53.5	-176.8	0	0	0	110.1	N295 Y297 R348 N352 G353 D515 V516	N295-L350 WeakPolarHBondContact ND2-CA 3.4Å; N295-L350 PolarHBondContact ND2-O 2.74Å; N295-L350 VanDerWaalsContact ND2-O 3.1Å; Y297-L350 HydrophobicContact CD1-CD2 4.11Å; Y297-L350 HydrophobicContact CE1-CD2 4.26Å; R348-L350 HydrophobicContact CB-CD2 4.02Å; R348-L350 HydrophobicContact CB-CG 4.26Å; L350-N352 PolarHBondContact O-N 2.95Å; L350-G353 PolarHBondContact O-N 3.28Å; L350-D515 HydrophobicContact CD1-CB 3.93Å; L350-D515 HydrophobicContact CG-CB 4.36Å; L350-V516 PolarHBondContact N-O 3.35Å
351	G	96.7	Very high	97	Very high	40 Å²	40	31.7 Å²	31.7	41%	0.412	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	51.7	-138	-176	0	0	0	0	0	112.4	N295 G353 R390	N295-G351 PolarHBondContact ND2-O 3.11Å; N295-G351 PolarHBondContact OD1-O 2.92Å; G351-G353 PolarHBondContact O-N 3.24Å; G351-G353 VanDerWaalsContact O-N 3.11Å; G351-R390 PolarHBondContact O-NH1 3.29Å
352	N	96	Very high	97.4	Very high	118 Å²	118	32.3 Å²	32.3	63%	0.631	17%	0.169	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	-3.2	179	-61.8	0.3	0	0	0	113.7	R293 L350 R390	R293-N352 VanDerWaalsContact CB-O 3.26Å; R293-N352 WeakPolarHBondContact CB-O 3.38Å; R293-N352 WeakPolarHBondContact CD-O 3.44Å; L350-N352 PolarHBondContact O-N 2.95Å; N352-R390 WeakPolarHBondContact O-CD 3.45Å; N352-R390 PolarHBondContact O-NH1 2.95Å
353	G	97.4	Very high	97.6	Very high	3 Å²	3	26.3 Å²	26.3	3%	0.031	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	78.3	177.4	177.5	0	0	0	0	0	114.5	Y294 L350 G351	Y294-G353 CarbonylContact O-C 3.56Å; Y294-G353 WeakPolarHBondContact O-CA 3.41Å; L350-G353 PolarHBondContact O-N 3.28Å; G351-G353 PolarHBondContact O-N 3.24Å; G351-G353 VanDerWaalsContact O-N 3.11Å
354	R	96.7	Very high	97.7	Very high	8 Å²	8	28.2 Å²	28.2	3%	0.03	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	133.1	177.4	-177.7	-173.8	-57.2	-69.3	-5.1	110.9	R293 Y294 S340 G341 E343 T349 V519	R293-R354 CarbonylContact C-O 3.54Å; R293-R354 VanDerWaalsContact CA-O 3.26Å; R293-R354 WeakPolarHBondContact CA-O 3.45Å; Y294-R354 HydrophobicContact CD1-CB 4.26Å; Y294-R354 HydrophobicContact CE1-CB 3.8Å; Y294-R354 HydrophobicContact CE1-CG 4.11Å; Y294-R354 HydrophobicContact CE2-CB 4.4Å; Y294-R354 PolarHBondContact N-O 3.49Å; Y294-R354 PolarHBondContact O-N 3.42Å; Y294-R354 WeakPolarHBondContact OH-CD 3.39Å; Y294-R354 PolarHBondContact OH-NE 3.01Å; S340-R354 WeakPolarHBondContact O-CD 3.06Å; S340-R354 PolarHBondContact O-NH1 2.69Å; G341-R354 VanDerWaalsContact O-CD 3.29Å; G341-R354 WeakPolarHBondContact O-CD 3.37Å; E343-R354 IonicContact OE2-CZ 3.5Å; E343-R354 IonicContact OE2-NE 2.79Å; E343-R354 PolarHBondContact OE2-NE 2.88Å; E343-R354 IonicContact OE2-NH2 3.71Å; E343-R354 PolarHBondContact OE2-NH2 3.11Å; T349-R354 HydrophobicContact CG2-CB 4.04Å; R354-V519 HydrophobicContact CB-CG2 4.27Å; R354-V519 HydrophobicContact CG-CG2 4.38Å
355	P	96.3	Very high	97.8	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	136.4	169.6	-25.2	34.8	0	0	0	113.4	G292 S339 S340 M403 V521 W523	G292-P355 WeakPolarHBondContact O-CA 3.17Å; S339-P355 WeakPolarHBondContact CA-O 3.43Å; S339-P355 WeakPolarHBondContact CB-O 3.49Å; S340-P355 PolarHBondContact N-O 3.31Å; P355-M403 HydrophobicContact CB-SD 4.49Å; P355-V521 HydrophobicContact CG-CB 4.11Å; P355-V521 HydrophobicContact CG-CG1 4.26Å; P355-W523 HydrophobicContact CB-CE3 4.49Å; P355-W523 WeakPolarHBondContact CB-O 3.43Å; P355-W523 WeakPolarHBondContact CG-O 3.47Å
356	F	96.8	Very high	97.8	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	161.3	170.5	75.5	-85.8	0	0	0	111.5	A291 G292 Y294 I322 F337 S338 I358 V389 L392	A291-F356 VanDerWaalsContact CA-O 3.25Å; A291-F356 WeakPolarHBondContact CA-O 3.21Å; A291-F356 WeakPolarHBondContact CB-O 3.43Å; G292-F356 VanDerWaalsContact C-CE1 3.41Å; G292-F356 PolarHBondContact N-O 2.98Å; G292-F356 WeakPolarHBondContact O-CD1 3.4Å; G292-F356 PolarHBondContact O-N 2.87Å; Y294-F356 HydrophobicContact CD1-CB 4.19Å; Y294-F356 AromaticContact CD1-CD1 3.92Å; Y294-F356 HydrophobicContact CD1-CD1 3.92Å; Y294-F356 HydrophobicContact CD1-CG 4.34Å; I322-F356 HydrophobicContact CD1-CD1 4.45Å; I322-F356 HydrophobicContact CD1-CE1 4.15Å; I322-F356 HydrophobicContact CD1-CE2 4.35Å; I322-F356 HydrophobicContact CD1-CZ 4.11Å; I322-F356 HydrophobicContact CG2-CE2 3.8Å; I322-F356 HydrophobicContact CG2-CZ 3.9Å; F337-F356 HydrophobicContact CD2-CD2 4.46Å; F337-F356 HydrophobicContact CE2-CB 3.85Å; F337-F356 AromaticContact CE2-CD2 3.87Å; F337-F356 HydrophobicContact CE2-CD2 3.87Å; F337-F356 HydrophobicContact CE2-CG 4.02Å; F337-F356 HydrophobicContact CZ-CB 3.82Å; F337-F356 HydrophobicContact CZ-CG 4.41Å; S338-F356 CarbonylContact O-C 3.58Å; S338-F356 VanDerWaalsContact O-CA 3.23Å; S338-F356 WeakPolarHBondContact O-CA 3.33Å; S338-F356 WeakPolarHBondContact O-CB 3.44Å; F356-I358 HydrophobicContact CD2-CD1 4.23Å; F356-I358 HydrophobicContact CD2-CG1 4.06Å; F356-I358 HydrophobicContact CE2-CD1 3.9Å; F356-I358 HydrophobicContact CE2-CG1 4.14Å; F356-V389 HydrophobicContact CE1-CG1 3.88Å; F356-V389 HydrophobicContact CE1-CG2 4.29Å; F356-V389 HydrophobicContact CZ-CG1 3.85Å; F356-V389 HydrophobicContact CZ-CG2 4.36Å; F356-L392 HydrophobicContact CZ-CD1 3.99Å
357	A	97.3	Very high	97.7	Very high	2 Å²	2	28.9 Å²	28.9	2%	0.017	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	150.2	164.6	0	0	0	0	0	110.8	V290 A291 S338 I400 M403 W523	V290-A357 CarbonylContact O-C 3.29Å; V290-A357 VanDerWaalsContact O-CA 3.27Å; V290-A357 WeakPolarHBondContact O-CA 3.2Å; A291-A357 HydrophobicContact CB-CB 4.11Å; S338-A357 PolarHBondContact N-O 3.45Å; S338-A357 PolarHBondContact O-N 3.49Å; S338-A357 VanDerWaalsContact O-O 3.1Å; A357-I400 HydrophobicContact CB-CG1 4.43Å; A357-M403 HydrophobicContact CB-CE 3.44Å; A357-M403 VanDerWaalsContact CB-CE 3.44Å; A357-M403 HydrophobicContact CB-SD 4.35Å; A357-W523 HydrophobicContact CB-CH2 4.21Å
358	I	97.8	Very high	97.7	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	115.3	176.1	-63.5	171.1	0	0	0	107.1	F289 V290 I322 L326 F335 N336 F337 F356 L360	F289-I358 WeakPolarHBondContact CA-O 3.29Å; V290-I358 PolarHBondContact N-O 3.47Å; V290-I358 PolarHBondContact O-N 2.94Å; I322-I358 HydrophobicContact CB-CD1 4.23Å; I322-I358 HydrophobicContact CG2-CD1 3.52Å; L326-I358 HydrophobicContact CD1-CD1 4.43Å; L326-I358 HydrophobicContact CD2-CB 4.07Å; L326-I358 HydrophobicContact CD2-CD1 3.79Å; L326-I358 HydrophobicContact CD2-CG1 4.5Å; L326-I358 HydrophobicContact CD2-CG2 4.17Å; F335-I358 HydrophobicContact CB-CG2 3.75Å; F335-I358 HydrophobicContact CD2-CG2 4.26Å; F335-I358 HydrophobicContact CG-CG2 4.25Å; N336-I358 WeakPolarHBondContact O-CA 3.05Å; F337-I358 HydrophobicContact CD2-CD1 4.2Å; F337-I358 HydrophobicContact CD2-CG1 3.82Å; F356-I358 HydrophobicContact CD2-CD1 4.23Å; F356-I358 HydrophobicContact CD2-CG1 4.06Å; F356-I358 HydrophobicContact CE2-CD1 3.9Å; F356-I358 HydrophobicContact CE2-CG1 4.14Å; I358-L360 HydrophobicContact CG2-CD2 4.1Å; I358-L360 HydrophobicContact CG2-CG 4.16Å
359	E	97.9	Very high	97.6	Very high	33 Å²	33	30.4 Å²	30.4	15%	0.154	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	125.8	165.4	-176.9	167.9	-131	0	0	108.4	A287 F289 F335 N336 R397	A287-E359 HydrophobicContact CB-CG 3.53Å; F289-E359 HydrophobicContact CD1-CB 3.62Å; F289-E359 HydrophobicContact CD1-CG 3.9Å; F289-E359 HydrophobicContact CE1-CB 3.41Å; F289-E359 VanDerWaalsContact CE1-CB 3.41Å; F289-E359 VanDerWaalsContact CE1-CD 3.49Å; F289-E359 HydrophobicContact CE1-CG 3.27Å; F289-E359 VanDerWaalsContact CE1-OE1 3.3Å; F289-E359 WeakPolarHBondContact CE1-OE1 3.39Å; F289-E359 HydrophobicContact CZ-CB 4.41Å; F289-E359 HydrophobicContact CZ-CG 3.8Å; F289-E359 VanDerWaalsContact CZ-OE1 3.23Å; F289-E359 WeakPolarHBondContact CZ-OE1 3.33Å; F335-E359 CarbonylContact C-O 3.56Å; F335-E359 WeakPolarHBondContact CA-O 3.38Å; F335-E359 WeakPolarHBondContact CB-O 3.14Å; N336-E359 HydrophobicContact CB-CB 4.08Å; N336-E359 PolarHBondContact N-O 2.81Å; N336-E359 PolarHBondContact ND2-OE2 3.42Å; N336-E359 PolarHBondContact O-N 2.9Å; E359-R397 IonicContact OE1-CZ 2.73Å; E359-R397 IonicContact OE1-NE 3.2Å; E359-R397 IonicContact OE1-NH2 3.06Å; E359-R397 PolarHBondContact OE1-NH2 3.48Å
360	L	98.5	Very high	97.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	117.8	177.8	-68.6	159.8	0	0	0	108.7	A287 V288 V290 L326 L327 F330 A332 F335 I358	A287-L360 WeakPolarHBondContact CA-O 3.43Å; A287-L360 WeakPolarHBondContact CB-O 3.46Å; V288-L360 HydrophobicContact CG2-CB 4.13Å; V288-L360 HydrophobicContact CG2-CD1 4.29Å; V288-L360 PolarHBondContact N-O 2.81Å; V288-L360 PolarHBondContact O-N 3.32Å; V290-L360 HydrophobicContact CG2-CD1 4.05Å; L326-L360 HydrophobicContact CB-CD1 4.31Å; L326-L360 HydrophobicContact CB-CD2 3.97Å; L326-L360 HydrophobicContact CD2-CD1 4.24Å; L327-L360 HydrophobicContact CD2-CD2 4.25Å; F330-L360 HydrophobicContact CB-CD1 3.98Å; F330-L360 HydrophobicContact CD1-CD1 3.66Å; F330-L360 HydrophobicContact CD2-CD1 3.6Å; F330-L360 HydrophobicContact CE1-CD1 3.97Å; F330-L360 HydrophobicContact CE2-CD1 3.93Å; F330-L360 HydrophobicContact CG-CD1 3.47Å; F330-L360 VanDerWaalsContact CG-CD1 3.47Å; F330-L360 HydrophobicContact CZ-CD1 4.11Å; A332-L360 HydrophobicContact CB-CB 4Å; A332-L360 HydrophobicContact CB-CD2 4.1Å; F335-L360 HydrophobicContact CB-CD2 4.17Å; I358-L360 HydrophobicContact CG2-CD2 4.1Å; I358-L360 HydrophobicContact CG2-CG 4.16Å
361	V	98.3	Very high	97.4	Very high	44 Å²	44	38.9 Å²	38.9	27%	0.267	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	131.7	-170.5	-176.2	0	0	0	0	110.5	A332 E333 S334	A332-V361 WeakPolarHBondContact CB-O 3.49Å; E333-V361 PolarHBondContact N-O 2.81Å; S334-V361 PolarHBondContact O-N 3.45Å; S334-V361 WeakPolarHBondContact OG-CB 3.41Å
362	N	98.3	Very high	97.5	Very high	22 Å²	22	39.9 Å²	39.9	12%	0.118	21%	0.21	C	C	.	.	S	Bend	trans	48.8	53.6	-176.5	-151	23	0	0	0	114.6	F137 A284 H285 E333 H364	F137-N362 VanDerWaalsContact CE1-OD1 3.25Å; F137-N362 WeakPolarHBondContact CE1-OD1 3.4Å; F137-N362 WeakPolarHBondContact CZ-OD1 3.4Å; A284-N362 VanDerWaalsContact CA-OD1 3.29Å; A284-N362 WeakPolarHBondContact CA-OD1 3.33Å; A284-N362 WeakPolarHBondContact CB-OD1 3.41Å; H285-N362 PolarHBondContact N-OD1 2.92Å; H285-N362 WeakPolarHBondContact O-CA 3.29Å; E333-N362 HydrophobicContact CG-CB 4.09Å; E333-N362 PolarHBondContact OE1-ND2 2.74Å; N362-H364 PolarHBondContact O-N 3.4Å; N362-H364 PolarHBondContact O-ND1 3.27Å
363	P	98.6	Very high	97.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.182	C	C	.	.			trans	-69.8	127.9	-179.8	31.1	-35.4	0	0	0	111	H285 V288 F330 A332 V366	H285-P363 HydrophobicContact CB-CG 4.38Å; H285-P363 WeakPolarHBondContact CB-O 3.44Å; V288-P363 HydrophobicContact CB-CG 4.46Å; V288-P363 HydrophobicContact CG1-CG 4.05Å; V288-P363 HydrophobicContact CG2-CB 4.16Å; V288-P363 HydrophobicContact CG2-CG 3.81Å; F330-P363 HydrophobicContact CB-CB 4.33Å; A332-P363 HydrophobicContact CB-CB 4.35Å; P363-V366 HydrophobicContact CB-CG1 3.89Å; P363-V366 HydrophobicContact CG-CG1 3.6Å
364	H	98.6	Very high	97.6	Very high	50 Å²	50	38 Å²	38	23%	0.231	20%	0.196	C	C	.	.	S	Bend	trans	-83.9	-16.2	173.4	-61	62.3	0	0	0	112.4	S135 F137 E138 F330 K331 N362	S135-H364 PolarHBondContact O-CD2 2.84Å; F137-H364 HydrophobicContact CD1-CB 4.22Å; F137-H364 AromaticContact CD1-CD2 3.93Å; F137-H364 AromaticContact CD1-CG 3.93Å; F137-H364 HydrophobicContact CE1-CB 4.44Å; F137-H364 AromaticContact CE1-CD2 3.71Å; F137-H364 AromaticContact CE1-CE1 3.75Å; F137-H364 AromaticContact CE1-CG 3.73Å; F137-H364 AromaticContact CE1-ND1 3.77Å; F137-H364 AromaticContact CE1-NE2 3.76Å; F137-H364 AromaticContact CE2-CD2 3.83Å; F137-H364 AromaticContact CE2-NE2 3.66Å; F137-H364 AromaticContact CZ-CD2 3.65Å; F137-H364 AromaticContact CZ-CE1 3.59Å; F137-H364 AromaticContact CZ-NE2 3.32Å; F137-H364 VanDerWaalsContact CZ-NE2 3.32Å; F137-H364 WeakPolarHBondContact CZ-NE2 3.36Å; E138-H364 PolarHBondContact N-O 2.81Å; F330-H364 PolarHBondContact O-N 3.21Å; K331-H364 HydrophobicContact CB-CB 3.86Å; K331-H364 HydrophobicContact CD-CB 4.27Å; K331-H364 PolarHBondContact O-N 3.42Å; K331-H364 PolarHBondContact O-ND1 3.04Å; N362-H364 PolarHBondContact O-N 3.4Å; N362-H364 PolarHBondContact O-ND1 3.27Å
365	R	98.4	Very high	97.6	Very high	64 Å²	64	42.8 Å²	42.8	24%	0.242	22%	0.218	C	C	.	.			trans	-121.3	125.3	173.3	-174.5	-178.9	-178	-158.3	-10	110	E138 V329 F330 H367 F368 E372	E138-R365 WeakPolarHBondContact OE2-CA 3.46Å; E138-R365 WeakPolarHBondContact OE2-CG 3.3Å; V329-R365 WeakPolarHBondContact O-CD 3.49Å; F330-R365 WeakPolarHBondContact CD1-O 3.39Å; F330-R365 PolarHBondContact O-N 3.32Å; R365-H367 PolarHBondContact NH2-O 2.89Å; R365-F368 HydrophobicContact CB-CZ 4.34Å; R365-F368 HydrophobicContact CG-CE1 4.38Å; R365-F368 HydrophobicContact CG-CE2 3.97Å; R365-F368 HydrophobicContact CG-CZ 3.65Å; R365-E372 IonicContact CZ-OE1 3.35Å; R365-E372 IonicContact NH1-OE1 2.67Å; R365-E372 IonicContact NH2-OE1 2.82Å; R365-E372 PolarHBondContact NH2-OE1 3.45Å; R365-E372 IonicContact NH2-OE2 3.96Å
366	V	97.9	Very high	97.7	Very high	18 Å²	18	43.1 Å²	43.1	11%	0.109	22%	0.22	C	C	.	.			trans	-134.2	-13.2	-176.6	-61.5	0	0	0	0	113.9	E138 V288 P363	E138-V366 HydrophobicContact CB-CG2 3.94Å; E138-V366 PolarHBondContact OE2-N 3.22Å; V288-V366 HydrophobicContact CG1-CB 4.3Å; V288-V366 HydrophobicContact CG1-CG1 3.76Å; V288-V366 HydrophobicContact CG2-CG1 4.46Å; P363-V366 HydrophobicContact CB-CG1 3.89Å; P363-V366 HydrophobicContact CG-CG1 3.6Å
367	H	97.1	Very high	97.8	Very high	91 Å²	91	44.3 Å²	44.3	42%	0.421	23%	0.226	S	C	.	.			trans	-91.5	113.6	177.4	-61.8	-46	0	0	0	111.5	E138 R365	E138-H367 IonicContact OE2-CD2 3.22Å; E138-H367 IonicContact OE2-CG 2.67Å; E138-H367 PolarHBondContact OE2-N 3.05Å; R365-H367 PolarHBondContact NH2-O 2.89Å
368	F	97.6	Very high	97.9	Very high	29 Å²	29	48.3 Å²	48.3	13%	0.127	24%	0.244	C	C	.	.			trans	-136.7	134.9	177.9	-62	-90.1	0	0	0	110	V329 F330 R365 E372 I373 L394	V329-F368 HydrophobicContact CG1-CE1 3.49Å; V329-F368 VanDerWaalsContact CG1-CE1 3.49Å; V329-F368 HydrophobicContact CG1-CZ 3.87Å; F330-F368 HydrophobicContact CD1-CD2 4.32Å; F330-F368 AromaticContact CD1-CE2 3.42Å; F330-F368 HydrophobicContact CD1-CE2 3.42Å; F330-F368 VanDerWaalsContact CD1-CE2 3.42Å; F330-F368 AromaticContact CD1-CZ 3.91Å; F330-F368 HydrophobicContact CD1-CZ 3.91Å; F330-F368 HydrophobicContact CD2-CE2 4.25Å; F330-F368 AromaticContact CD2-CZ 3.99Å; F330-F368 HydrophobicContact CD2-CZ 3.99Å; F330-F368 AromaticContact CE1-CD2 3.68Å; F330-F368 HydrophobicContact CE1-CD2 3.68Å; F330-F368 AromaticContact CE1-CE2 3.21Å; F330-F368 HydrophobicContact CE1-CE2 3.21Å; F330-F368 AromaticContact CE1-CZ 3.93Å; F330-F368 HydrophobicContact CE1-CZ 3.93Å; F330-F368 HydrophobicContact CE2-CE2 4.08Å; F330-F368 HydrophobicContact CE2-CZ 4.01Å; F330-F368 AromaticContact CG-CE2 3.94Å; F330-F368 HydrophobicContact CG-CE2 3.94Å; F330-F368 AromaticContact CG-CZ 3.93Å; F330-F368 HydrophobicContact CG-CZ 3.93Å; F330-F368 AromaticContact CZ-CD2 3.84Å; F330-F368 HydrophobicContact CZ-CD2 3.84Å; F330-F368 AromaticContact CZ-CE2 3.56Å; F330-F368 HydrophobicContact CZ-CE2 3.56Å; F330-F368 AromaticContact CZ-CZ 3.97Å; F330-F368 HydrophobicContact CZ-CZ 3.97Å; R365-F368 HydrophobicContact CB-CZ 4.34Å; R365-F368 HydrophobicContact CG-CE1 4.38Å; R365-F368 HydrophobicContact CG-CE2 3.97Å; R365-F368 HydrophobicContact CG-CZ 3.65Å; F368-E372 HydrophobicContact CD1-CB 4.29Å; F368-I373 HydrophobicContact CB-CD1 3.64Å; F368-I373 HydrophobicContact CB-CG1 3.93Å; F368-I373 HydrophobicContact CD1-CD1 4.19Å; F368-I373 HydrophobicContact CD2-CD1 4.48Å; F368-I373 HydrophobicContact CG-CD1 3.86Å; F368-L394 HydrophobicContact CB-CD1 4.22Å; F368-L394 HydrophobicContact CD2-CD1 4.44Å
369	T	97.6	Very high	97.9	Very high	80 Å²	80	53.2 Å²	53.2	49%	0.491	27%	0.266	S	S	.	.			trans	-76.4	158.9	165.6	61.7	0	0	0	0	110.6	Q371 E372 I373	T369-Q371 PolarHBondContact O-N 3.15Å; T369-E372 WeakPolarHBondContact CB-OE2 3.32Å; T369-E372 PolarHBondContact N-OE2 3.39Å; T369-E372 PolarHBondContact O-N 3.2Å; T369-E372 VanDerWaalsContact O-N 3.1Å; T369-E372 WeakPolarHBondContact OG1-CG 3.03Å; T369-E372 PolarHBondContact OG1-N 3.04Å; T369-E372 PolarHBondContact OG1-OE2 3.04Å; T369-I373 PolarHBondContact O-N 3.33Å; T369-I373 VanDerWaalsContact O-N 3.16Å
370	S	95	Very high	97.9	Very high	111 Å²	111	51.7 Å²	51.7	78%	0.776	26%	0.258	S	S	*	.	H	α-helix	trans	-57	-31.7	174.2	-45.8	0	0	0	0	112.5	K374	S370-K374 WeakPolarHBondContact O-CB 3.35Å; S370-K374 PolarHBondContact O-N 3.05Å
371	Q	97	Very high	97.9	Very high	104 Å²	104	52.5 Å²	52.5	49%	0.486	26%	0.263	S	S	.	.	H	α-helix	trans	-67	-42.8	176.6	179.2	56.5	32	0	0	111.9	T369 I373 K374 E375	T369-Q371 PolarHBondContact O-N 3.15Å; Q371-I373 VanDerWaalsContact C-N 3.35Å; Q371-I373 PolarHBondContact O-N 3Å; Q371-K374 WeakPolarHBondContact O-CB 3.2Å; Q371-K374 PolarHBondContact O-N 3.27Å; Q371-E375 WeakPolarHBondContact CG-OE1 3.41Å; Q371-E375 PolarHBondContact NE2-OE1 2.99Å; Q371-E375 WeakPolarHBondContact O-CG 3.47Å; Q371-E375 PolarHBondContact O-N 3.03Å
372	E	97.9	Very high	97.9	Very high	61 Å²	61	56.9 Å²	56.9	29%	0.285	28%	0.284	S	S	.	.	H	α-helix	trans	-67.5	-34.3	177	-70.1	166.9	105.4	0	0	112.5	R365 F368 T369 E375 L376	R365-E372 IonicContact CZ-OE1 3.35Å; R365-E372 IonicContact NH1-OE1 2.67Å; R365-E372 IonicContact NH2-OE1 2.82Å; R365-E372 PolarHBondContact NH2-OE1 3.45Å; R365-E372 IonicContact NH2-OE2 3.96Å; F368-E372 HydrophobicContact CD1-CB 4.29Å; T369-E372 WeakPolarHBondContact CB-OE2 3.32Å; T369-E372 PolarHBondContact N-OE2 3.39Å; T369-E372 PolarHBondContact O-N 3.2Å; T369-E372 VanDerWaalsContact O-N 3.1Å; T369-E372 WeakPolarHBondContact OG1-CG 3.03Å; T369-E372 PolarHBondContact OG1-N 3.04Å; T369-E372 PolarHBondContact OG1-OE2 3.04Å; E372-E375 PolarHBondContact O-N 2.97Å; E372-L376 WeakPolarHBondContact O-CB 3.37Å; E372-L376 PolarHBondContact O-N 3.21Å
373	I	98.1	Very high	97.9	Very high	6 Å²	6	58.6 Å²	58.6	3%	0.031	30%	0.298	C	S	.	.	H	α-helix	trans	-68.6	-38.8	172.4	-57.8	-62	0	0	0	110.8	F330 F368 T369 Q371 E375 L376 Q377 L392 L394	F330-I373 HydrophobicContact CZ-CD1 4.26Å; F368-I373 HydrophobicContact CB-CD1 3.64Å; F368-I373 HydrophobicContact CB-CG1 3.93Å; F368-I373 HydrophobicContact CD1-CD1 4.19Å; F368-I373 HydrophobicContact CD2-CD1 4.48Å; F368-I373 HydrophobicContact CG-CD1 3.86Å; T369-I373 PolarHBondContact O-N 3.33Å; T369-I373 VanDerWaalsContact O-N 3.16Å; Q371-I373 VanDerWaalsContact C-N 3.35Å; Q371-I373 PolarHBondContact O-N 3Å; I373-E375 VanDerWaalsContact C-N 3.35Å; I373-E375 PolarHBondContact O-N 2.88Å; I373-L376 WeakPolarHBondContact O-CB 3.15Å; I373-L376 PolarHBondContact O-N 3.28Å; I373-Q377 PolarHBondContact O-N 3.03Å; I373-L392 HydrophobicContact CG2-CB 4.08Å; I373-L392 HydrophobicContact CG2-CD2 4.05Å; I373-L392 HydrophobicContact CG2-CG 3.86Å; I373-L392 WeakPolarHBondContact CG2-O 3.43Å; I373-L394 HydrophobicContact CD1-CD1 4.48Å; I373-L394 HydrophobicContact CD1-CG 4.24Å
374	K	97.4	Very high	97.7	Very high	76 Å²	76	59.3 Å²	59.3	33%	0.33	30%	0.303	S	S	.	.	H	α-helix	trans	-62.1	-41	173	-170.4	170.6	-173.7	165	0	111.6	S370 Q371 Q377 Q378 D529	S370-K374 WeakPolarHBondContact O-CB 3.35Å; S370-K374 PolarHBondContact O-N 3.05Å; Q371-K374 WeakPolarHBondContact O-CB 3.2Å; Q371-K374 PolarHBondContact O-N 3.27Å; K374-Q377 WeakPolarHBondContact O-CB 3.18Å; K374-Q377 PolarHBondContact O-N 2.97Å; K374-Q378 WeakPolarHBondContact O-CG 3.32Å; K374-Q378 PolarHBondContact O-N 3.17Å; K374-D529 WeakPolarHBondContact CE-OXT 3.31Å; K374-D529 PolarHBondContact NZ-O 3.47Å; K374-D529 PolarHBondContact NZ-OXT 3.41Å
375	E	98	Very high	97.7	Very high	107 Å²	107	63.6 Å²	63.6	50%	0.5	33%	0.328	S	S	.	.	H	α-helix	trans	-65.1	-37.8	173.1	-74.5	168.1	-160.4	0	0	112.5	Q371 E372 I373 Q378 K379	Q371-E375 WeakPolarHBondContact CG-OE1 3.41Å; Q371-E375 PolarHBondContact NE2-OE1 2.99Å; Q371-E375 WeakPolarHBondContact O-CG 3.47Å; Q371-E375 PolarHBondContact O-N 3.03Å; E372-E375 PolarHBondContact O-N 2.97Å; I373-E375 VanDerWaalsContact C-N 3.35Å; I373-E375 PolarHBondContact O-N 2.88Å; E375-Q378 PolarHBondContact O-N 2.96Å; E375-K379 WeakPolarHBondContact O-CB 3.41Å; E375-K379 PolarHBondContact O-N 3.42Å
376	L	98.1	Very high	97.7	Very high	7 Å²	7	63 Å²	63	4%	0.037	33%	0.327	C	S	.	.	H	α-helix	trans	-64.3	-40.4	173.2	-177.1	55.6	0	0	0	112	H325 L326 V329 F330 E372 I373 K379 I380 L392	H325-L376 HydrophobicContact CB-CD1 4.26Å; L326-L376 HydrophobicContact CG-CD2 4.21Å; V329-L376 HydrophobicContact CB-CD1 4.48Å; V329-L376 HydrophobicContact CG1-CD2 4.24Å; V329-L376 HydrophobicContact CG2-CD1 4.05Å; F330-L376 HydrophobicContact CE2-CD2 3.97Å; E372-L376 WeakPolarHBondContact O-CB 3.37Å; E372-L376 PolarHBondContact O-N 3.21Å; I373-L376 WeakPolarHBondContact O-CB 3.15Å; I373-L376 PolarHBondContact O-N 3.28Å; L376-K379 HydrophobicContact CD1-CD 4.38Å; L376-K379 WeakPolarHBondContact O-CB 3.48Å; L376-K379 PolarHBondContact O-N 3.29Å; L376-I380 HydrophobicContact CD1-CD1 4.47Å; L376-I380 HydrophobicContact CG-CD1 4.28Å; L376-I380 WeakPolarHBondContact O-CD1 3.46Å; L376-I380 WeakPolarHBondContact O-CG1 3.44Å; L376-I380 PolarHBondContact O-N 3.27Å; L376-L392 HydrophobicContact CB-CD2 4.32Å; L376-L392 HydrophobicContact CD2-CD2 4.49Å; L376-L392 HydrophobicContact CG-CD2 4.17Å
377	Q	98.6	Very high	97.7	Very high	26 Å²	26	62.2 Å²	62.2	12%	0.121	32%	0.322	C	S	.	.	H	α-helix	trans	-59.2	-47.7	171.6	-174.5	179.9	-79.7	0	0	111.1	I373 K374 K379 I380 N381 V389 R390 D391 L392	I373-Q377 PolarHBondContact O-N 3.03Å; K374-Q377 WeakPolarHBondContact O-CB 3.18Å; K374-Q377 PolarHBondContact O-N 2.97Å; Q377-K379 VanDerWaalsContact C-N 3.31Å; Q377-K379 PolarHBondContact O-N 3.45Å; Q377-I380 PolarHBondContact O-N 3.33Å; Q377-N381 WeakPolarHBondContact O-CB 3.47Å; Q377-N381 VanDerWaalsContact O-CG 3.26Å; Q377-N381 PolarHBondContact O-N 3.25Å; Q377-V389 HydrophobicContact CG-CB 4.42Å; Q377-V389 HydrophobicContact CG-CG1 4.28Å; Q377-V389 VanDerWaalsContact CG-O 3.29Å; Q377-V389 WeakPolarHBondContact CG-O 3.07Å; Q377-R390 VanDerWaalsContact OE1-CA 3.25Å; Q377-D391 VanDerWaalsContact OE1-N 3.13Å; Q377-L392 HydrophobicContact CB-CB 3.89Å; Q377-L392 HydrophobicContact CB-CD2 3.84Å; Q377-L392 HydrophobicContact CG-CB 4.12Å; Q377-L392 VanDerWaalsContact OE1-CB 3.28Å
378	Q	98.3	Very high	97.8	Very high	86 Å²	86	60.5 Å²	60.5	40%	0.402	32%	0.315	S	S	.	.	H	α-helix	trans	-63.6	-35.3	176.8	-65.9	-59.6	-23.2	0	0	112.2	K374 E375 N381 N382	K374-Q378 WeakPolarHBondContact O-CG 3.32Å; K374-Q378 PolarHBondContact O-N 3.17Å; E375-Q378 PolarHBondContact O-N 2.96Å; Q378-N381 PolarHBondContact O-N 3.14Å; Q378-N382 VanDerWaalsContact O-CB 3.29Å; Q378-N382 WeakPolarHBondContact O-CB 3.44Å; Q378-N382 PolarHBondContact O-N 3.03Å; Q378-N382 PolarHBondContact O-ND2 2.98Å
379	K	98.3	Very high	97.9	Very high	103 Å²	103	59.3 Å²	59.3	45%	0.448	31%	0.31	S	S	.	.	H	α-helix	trans	-62.4	-43.3	174.6	-172.9	-174.4	-179.7	-172.5	0	112.1	E375 L376 Q377 S383	E375-K379 WeakPolarHBondContact O-CB 3.41Å; E375-K379 PolarHBondContact O-N 3.42Å; L376-K379 HydrophobicContact CD1-CD 4.38Å; L376-K379 WeakPolarHBondContact O-CB 3.48Å; L376-K379 PolarHBondContact O-N 3.29Å; Q377-K379 VanDerWaalsContact C-N 3.31Å; Q377-K379 PolarHBondContact O-N 3.45Å; K379-S383 PolarHBondContact O-N 3.01Å; K379-S383 PolarHBondContact O-OG 3.48Å
380	I	98.3	Very high	97.9	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-66.3	-41.8	175.5	-64.6	157.5	0	0	0	110.5	I322 H325 L326 L376 Q377 N382 S383 I387 V389 L392	I322-I380 HydrophobicContact CG1-CG2 4.38Å; I322-I380 HydrophobicContact CG2-CD1 4.28Å; H325-I380 HydrophobicContact CB-CG1 3.83Å; L326-I380 HydrophobicContact CD1-CD1 3.74Å; L376-I380 HydrophobicContact CD1-CD1 4.47Å; L376-I380 HydrophobicContact CG-CD1 4.28Å; L376-I380 WeakPolarHBondContact O-CD1 3.46Å; L376-I380 WeakPolarHBondContact O-CG1 3.44Å; L376-I380 PolarHBondContact O-N 3.27Å; Q377-I380 PolarHBondContact O-N 3.33Å; I380-N382 VanDerWaalsContact C-N 3.34Å; I380-N382 PolarHBondContact O-N 3.31Å; I380-S383 PolarHBondContact O-N 2.77Å; I380-S383 PolarHBondContact O-OG 3.28Å; I380-I387 HydrophobicContact CG2-CD1 3.84Å; I380-V389 HydrophobicContact CG2-CB 4.45Å; I380-V389 HydrophobicContact CG2-CG2 3.87Å; I380-L392 HydrophobicContact CD1-CD2 4.16Å
381	N	98.4	Very high	98	Very high	18 Å²	18	54.3 Å²	54.3	10%	0.096	27%	0.266	C	S	.	.	H	α-helix	trans	-67.3	-33.5	179.3	-73.2	-6	0	0	0	113	Q377 Q378 Q388 V389	Q377-N381 WeakPolarHBondContact O-CB 3.47Å; Q377-N381 VanDerWaalsContact O-CG 3.26Å; Q377-N381 PolarHBondContact O-N 3.25Å; Q378-N381 PolarHBondContact O-N 3.14Å; N381-Q388 VanDerWaalsContact CB-OE1 3.26Å; N381-Q388 VanDerWaalsContact CG-OE1 3.29Å; N381-Q388 PolarHBondContact O-NE2 3.31Å; N381-Q388 WeakPolarHBondContact OD1-CA 3.45Å; N381-V389 PolarHBondContact ND2-O 3.3Å; N381-V389 PolarHBondContact OD1-N 3.08Å; N381-V389 PolarHBondContact OD1-O 3.07Å
382	N	98.4	Very high	98.1	Very high	135 Å²	135	49.6 Å²	49.6	72%	0.722	24%	0.244	S	C	*	.	H	α-helix	trans	-81.7	-14.3	178.1	-71.6	-36.9	0	0	0	113.5	Q378 I380	Q378-N382 VanDerWaalsContact O-CB 3.29Å; Q378-N382 WeakPolarHBondContact O-CB 3.44Å; Q378-N382 PolarHBondContact O-N 3.03Å; Q378-N382 PolarHBondContact O-ND2 2.98Å; I380-N382 VanDerWaalsContact C-N 3.34Å; I380-N382 PolarHBondContact O-N 3.31Å
383	S	97.6	Very high	98.1	Very high	59 Å²	59	48.3 Å²	48.3	41%	0.413	24%	0.238	S	C	.	.	H	α-helix	trans	-92.1	-11.9	-179	66.5	0	0	0	0	114.2	H325 K379 I380	H325-S383 PolarHBondContact CE1-OG 3.39Å; H325-S383 VanDerWaalsContact NE2-CB 3.32Å; H325-S383 WeakPolarHBondContact NE2-CB 3.5Å; H325-S383 PolarHBondContact NE2-OG 3.33Å; K379-S383 PolarHBondContact O-N 3.01Å; K379-S383 PolarHBondContact O-OG 3.48Å; I380-S383 PolarHBondContact O-N 2.77Å; I380-S383 PolarHBondContact O-OG 3.28Å
384	S	96.2	Very high	98	Very high	15 Å²	15	51.3 Å²	51.3	11%	0.105	25%	0.254	C	S	.	.			trans	-149.2	137.2	178.9	-162.9	0	0	0	0	113.7	K386 I387 Q388	S384-K386 WeakPolarHBondContact OG-CB 3.45Å; S384-K386 PolarHBondContact OG-N 3.09Å; S384-K386 VanDerWaalsContact OG-N 3.12Å; S384-I387 VanDerWaalsContact O-O 3.07Å; S384-Q388 PolarHBondContact O-NE2 3.33Å; S384-Q388 VanDerWaalsContact O-NE2 3.17Å
385	N	97.6	Very high	97.9	Very high	140 Å²	140	48.9 Å²	48.9	75%	0.749	25%	0.245	S	C	*	.	S	Bend	trans	-90.8	-6.9	164	66.5	-8.8	0	0	0	113
386	K	98.4	Very high	97.6	Very high	52 Å²	52	47.7 Å²	47.7	23%	0.226	25%	0.245	C	C	.	.	S	Bend	trans	-76	-28.1	-179.1	-59.1	-180	-178.8	173.7	0	111.6	Y297 S298 L301 E315 L321 S384	Y297-K386 PolarHBondContact N-O 3.19Å; S298-K386 PolarHBondContact N-O 3.02Å; L301-K386 HydrophobicContact CD1-CD 4.25Å; L301-K386 HydrophobicContact CD2-CB 4.13Å; E315-K386 IonicContact OE2-NZ 2.65Å; E315-K386 PolarHBondContact OE2-NZ 3.17Å; L321-K386 HydrophobicContact CD1-CB 4.04Å; L321-K386 HydrophobicContact CD1-CD 4.34Å; S384-K386 WeakPolarHBondContact OG-CB 3.45Å; S384-K386 PolarHBondContact OG-N 3.09Å; S384-K386 VanDerWaalsContact OG-N 3.12Å
387	I	98.7	Very high	97.1	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	164.8	180	60.9	85.3	0	0	0	110.6	N295 L301 V318 L321 I322 I380 S384 V389	N295-I387 WeakPolarHBondContact O-CA 3.3Å; N295-I387 VanDerWaalsContact O-CB 3.3Å; N295-I387 WeakPolarHBondContact O-CB 3.25Å; L301-I387 HydrophobicContact CD2-CG2 3.75Å; V318-I387 HydrophobicContact CB-CG2 4.43Å; V318-I387 HydrophobicContact CG1-CG2 4.27Å; V318-I387 HydrophobicContact CG2-CG2 3.98Å; L321-I387 HydrophobicContact CB-CD1 4.33Å; L321-I387 HydrophobicContact CB-CG1 3.82Å; L321-I387 HydrophobicContact CD1-CG1 3.81Å; L321-I387 HydrophobicContact CD1-CG2 4.1Å; L321-I387 HydrophobicContact CG-CG1 4.46Å; I322-I387 HydrophobicContact CG1-CD1 4.26Å; I380-I387 HydrophobicContact CG2-CD1 3.84Å; S384-I387 VanDerWaalsContact O-O 3.07Å; I387-V389 HydrophobicContact CD1-CG2 4.3Å
388	Q	98.6	Very high	96.2	Very high	56 Å²	56	60.1 Å²	60.1	26%	0.262	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	156.5	162.2	-70.7	-70.2	-79.1	0	0	107.9	Y294 N295 Y297 N381 S384	Y294-Q388 CarbonylContact C-O 3.24Å; Y294-Q388 VanDerWaalsContact CA-O 3.31Å; Y294-Q388 WeakPolarHBondContact CA-O 3.41Å; N295-Q388 HydrophobicContact CB-CB 4.5Å; N295-Q388 PolarHBondContact N-O 2.91Å; N295-Q388 PolarHBondContact O-N 3.39Å; Y297-Q388 HydrophobicContact CE2-CB 3.84Å; Y297-Q388 HydrophobicContact CE2-CG 3.58Å; N381-Q388 VanDerWaalsContact CB-OE1 3.26Å; N381-Q388 VanDerWaalsContact CG-OE1 3.29Å; N381-Q388 PolarHBondContact O-NE2 3.31Å; N381-Q388 WeakPolarHBondContact OD1-CA 3.45Å; S384-Q388 PolarHBondContact O-NE2 3.33Å; S384-Q388 VanDerWaalsContact O-NE2 3.17Å
389	V	98.6	Very high	95.2	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.024	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	141.1	179.2	176.2	0	0	0	0	110	R293 I322 F356 Q377 I380 N381 I387 L392	R293-V389 WeakPolarHBondContact O-CA 3.02Å; I322-V389 HydrophobicContact CD1-CG2 3.85Å; I322-V389 HydrophobicContact CG1-CG2 3.83Å; F356-V389 HydrophobicContact CE1-CG1 3.88Å; F356-V389 HydrophobicContact CE1-CG2 4.29Å; F356-V389 HydrophobicContact CZ-CG1 3.85Å; F356-V389 HydrophobicContact CZ-CG2 4.36Å; Q377-V389 HydrophobicContact CG-CB 4.42Å; Q377-V389 HydrophobicContact CG-CG1 4.28Å; Q377-V389 VanDerWaalsContact CG-O 3.29Å; Q377-V389 WeakPolarHBondContact CG-O 3.07Å; I380-V389 HydrophobicContact CG2-CB 4.45Å; I380-V389 HydrophobicContact CG2-CG2 3.87Å; N381-V389 PolarHBondContact ND2-O 3.3Å; N381-V389 PolarHBondContact OD1-N 3.08Å; N381-V389 PolarHBondContact OD1-O 3.07Å; I387-V389 HydrophobicContact CD1-CG2 4.3Å; V389-L392 HydrophobicContact CG1-CB 4.39Å; V389-L392 HydrophobicContact CG1-CD1 3.97Å
390	R	98.3	Very high	94.2	Very high	69 Å²	69	53.5 Å²	53.5	26%	0.26	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	173.7	170.2	67.5	170.4	61.9	61.1	11	110.9	G292 R293 N295 G351 N352 Q377 L392	G292-R390 WeakPolarHBondContact CA-O 3.2Å; R293-R390 HydrophobicContact CB-CG 3.83Å; R293-R390 HydrophobicContact CG-CG 4.37Å; R293-R390 PolarHBondContact N-O 3.16Å; R293-R390 PolarHBondContact O-N 3.32Å; N295-R390 VanDerWaalsContact OD1-CZ 3.22Å; N295-R390 PolarHBondContact OD1-NH1 3.08Å; N295-R390 PolarHBondContact OD1-NH2 3.13Å; G351-R390 PolarHBondContact O-NH1 3.29Å; N352-R390 WeakPolarHBondContact O-CD 3.45Å; N352-R390 PolarHBondContact O-NH1 2.95Å; Q377-R390 VanDerWaalsContact OE1-CA 3.25Å; R390-L392 PolarHBondContact O-N 3.35Å; R390-L392 VanDerWaalsContact O-N 3.13Å
391	D	97.7	Very high	93.2	Very high	16 Å²	16	55.6 Å²	55.6	9%	0.086	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	55	27.1	174.8	-50.2	-46.3	0	0	0	113.7	R293 Q377 Q393 A526 L527	R293-D391 WeakPolarHBondContact CD-OD2 3.42Å; R293-D391 HydrophobicContact CG-CB 4.3Å; R293-D391 WeakPolarHBondContact CG-OD2 3.4Å; Q377-D391 VanDerWaalsContact OE1-N 3.13Å; D391-Q393 PolarHBondContact O-N 3.08Å; D391-Q393 PolarHBondContact O-NE2 3.1Å; D391-A526 WeakPolarHBondContact OD1-CA 3.43Å; D391-L527 HydrophobicContact CB-CG 4.48Å; D391-L527 PolarHBondContact OD1-N 3.2Å
392	L	98.2	Very high	92.1	Very high	5 Å²	5	59.2 Å²	59.2	3%	0.026	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	121.5	-175.2	-162.4	71.1	0	0	0	110.2	V290 A291 F356 I373 L376 Q377 I380 V389 R390 L527	V290-L392 HydrophobicContact CG1-CD1 3.35Å; V290-L392 HydrophobicContact CG1-CD2 4.41Å; V290-L392 HydrophobicContact CG1-CG 3.73Å; A291-L392 CarbonylContact O-C 3.5Å; A291-L392 VanDerWaalsContact O-CA 3.3Å; A291-L392 WeakPolarHBondContact O-CA 3.5Å; F356-L392 HydrophobicContact CZ-CD1 3.99Å; I373-L392 HydrophobicContact CG2-CB 4.08Å; I373-L392 HydrophobicContact CG2-CD2 4.05Å; I373-L392 HydrophobicContact CG2-CG 3.86Å; I373-L392 WeakPolarHBondContact CG2-O 3.43Å; L376-L392 HydrophobicContact CB-CD2 4.32Å; L376-L392 HydrophobicContact CD2-CD2 4.49Å; L376-L392 HydrophobicContact CG-CD2 4.17Å; Q377-L392 HydrophobicContact CB-CB 3.89Å; Q377-L392 HydrophobicContact CB-CD2 3.84Å; Q377-L392 HydrophobicContact CG-CB 4.12Å; Q377-L392 VanDerWaalsContact OE1-CB 3.28Å; I380-L392 HydrophobicContact CD1-CD2 4.16Å; V389-L392 HydrophobicContact CG1-CB 4.39Å; V389-L392 HydrophobicContact CG1-CD1 3.97Å; R390-L392 PolarHBondContact O-N 3.35Å; R390-L392 VanDerWaalsContact O-N 3.13Å; L392-L527 WeakPolarHBondContact O-CD1 3.47Å
393	Q	97.4	Very high	91.2	Very high	34 Å²	34	52.9 Å²	52.9	16%	0.159	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	154.1	-175.1	63.3	-159.9	-93.7	0	0	112	V290 A291 D391 V395 P525 L527	V290-Q393 CarbonylContact C-O 3.58Å; V290-Q393 WeakPolarHBondContact CA-O 3.5Å; A291-Q393 PolarHBondContact N-O 2.92Å; A291-Q393 PolarHBondContact O-N 2.97Å; D391-Q393 PolarHBondContact O-N 3.08Å; D391-Q393 PolarHBondContact O-NE2 3.1Å; Q393-V395 HydrophobicContact CG-CG1 3.91Å; Q393-P525 PolarHBondContact NE2-O 2.92Å; Q393-L527 HydrophobicContact CB-CD1 4.37Å
394	L	97.1	Very high	90.2	Very high	70 Å²	70	56.9 Å²	56.9	37%	0.366	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	135.2	167.5	-73.8	169.2	0	0	0	109.9	F289 V290 F330 F368 I373	F289-L394 WeakPolarHBondContact O-CA 3.47Å; V290-L394 HydrophobicContact CG2-CD2 3.94Å; F330-L394 HydrophobicContact CE1-CD2 3.84Å; F330-L394 HydrophobicContact CZ-CD2 3.88Å; F368-L394 HydrophobicContact CB-CD1 4.22Å; F368-L394 HydrophobicContact CD2-CD1 4.44Å; I373-L394 HydrophobicContact CD1-CD1 4.48Å; I373-L394 HydrophobicContact CD1-CG 4.24Å
395	V	95.5	Very high	89.4	Confident	24 Å²	24	60 Å²	60	15%	0.145	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	166.2	177.5	-58.1	0	0	0	0	111	F289 A291 Q393 A399 W523	F289-V395 HydrophobicContact CB-CG2 3.71Å; F289-V395 PolarHBondContact O-N 3.27Å; A291-V395 HydrophobicContact CB-CB 4.43Å; A291-V395 HydrophobicContact CB-CG1 3.74Å; A291-V395 HydrophobicContact CB-CG2 3.77Å; Q393-V395 HydrophobicContact CG-CG1 3.91Å; V395-A399 HydrophobicContact CB-CB 4.15Å; V395-W523 HydrophobicContact CB-CZ2 4.38Å; V395-W523 HydrophobicContact CG1-CZ2 4.17Å; V395-W523 HydrophobicContact CG2-CH2 4.41Å; V395-W523 HydrophobicContact CG2-CZ2 4.19Å
396	T	91.8	Very high	88.4	Confident	82 Å²	82	53.4 Å²	53.4	50%	0.503	26%	0.263	S	S	.	.			trans	-93.5	168.3	173.7	76.2	0	0	0	0	111.6	E398 A399	T396-E398 WeakPolarHBondContact CB-OE2 3.37Å; T396-E398 PolarHBondContact O-N 2.9Å; T396-E398 PolarHBondContact OG1-OE2 3.15Å; T396-A399 WeakPolarHBondContact O-CB 3.28Å; T396-A399 PolarHBondContact O-N 3.47Å
397	R	87.7	Confident	87.5	Confident	154 Å²	154	55.1 Å²	55.1	58%	0.581	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-34.7	178	175.4	168.7	-93.8	-141.6	-3.2	112.6	F289 E359 A399 I400	F289-R397 HydrophobicContact CD2-CB 4.41Å; F289-R397 HydrophobicContact CE2-CB 3.71Å; F289-R397 HydrophobicContact CZ-CB 3.92Å; F289-R397 HydrophobicContact CZ-CG 4.27Å; E359-R397 IonicContact OE1-CZ 2.73Å; E359-R397 IonicContact OE1-NE 3.2Å; E359-R397 IonicContact OE1-NH2 3.06Å; E359-R397 PolarHBondContact OE1-NH2 3.48Å; R397-A399 VanDerWaalsContact C-N 3.33Å; R397-A399 PolarHBondContact O-N 3.35Å; R397-I400 WeakPolarHBondContact O-CB 3.49Å; R397-I400 PolarHBondContact O-N 3.45Å
398	E	80.2	Confident	86.6	Confident	140 Å²	140	62.5 Å²	62.5	65%	0.654	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-64.3	-40	-178.5	-60.1	67.2	-141.9	0	0	110.9	T396 I400 G401	T396-E398 WeakPolarHBondContact CB-OE2 3.37Å; T396-E398 PolarHBondContact O-N 2.9Å; T396-E398 PolarHBondContact OG1-OE2 3.15Å; E398-I400 PolarHBondContact O-N 2.9Å; E398-G401 PolarHBondContact O-N 2.9Å
399	A	76.9	Confident	85.9	Confident	18 Å²	18	65.8 Å²	65.8	15%	0.149	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-60.4	-28.3	-179.2	0	0	0	0	0	113	V395 T396 R397 G401 H402 W523	V395-A399 HydrophobicContact CB-CB 4.15Å; T396-A399 WeakPolarHBondContact O-CB 3.28Å; T396-A399 PolarHBondContact O-N 3.47Å; R397-A399 VanDerWaalsContact C-N 3.33Å; R397-A399 PolarHBondContact O-N 3.35Å; A399-G401 PolarHBondContact O-N 3.12Å; A399-H402 WeakPolarHBondContact O-CB 3.38Å; A399-H402 PolarHBondContact O-CD2 3.47Å; A399-H402 VanDerWaalsContact O-CD2 3.24Å; A399-H402 PolarHBondContact O-N 2.9Å; A399-W523 HydrophobicContact CB-CZ2 3.73Å; A399-W523 VanDerWaalsContact O-CE2 3.24Å; A399-W523 WeakPolarHBondContact O-CZ2 3.15Å; A399-W523 PolarHBondContact O-NE1 3.48Å
400	I	76.7	Confident	85.4	Confident	32 Å²	32	68.5 Å²	68.5	16%	0.164	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-64.9	-24.4	178.7	-56.1	168.5	0	0	0	111.7	F289 A357 R397 E398 H402 M403	F289-I400 HydrophobicContact CB-CD1 4.29Å; F289-I400 HydrophobicContact CD1-CD1 3.12Å; F289-I400 HydrophobicContact CD1-CG1 4.37Å; F289-I400 HydrophobicContact CD2-CD1 4.31Å; F289-I400 HydrophobicContact CE1-CD1 3.29Å; F289-I400 HydrophobicContact CG-CD1 3.66Å; F289-I400 HydrophobicContact CZ-CD1 4.06Å; A357-I400 HydrophobicContact CB-CG1 4.43Å; R397-I400 WeakPolarHBondContact O-CB 3.49Å; R397-I400 PolarHBondContact O-N 3.45Å; E398-I400 PolarHBondContact O-N 2.9Å; I400-H402 PolarHBondContact O-N 3.36Å; I400-M403 HydrophobicContact CG2-CE 3.81Å; I400-M403 PolarHBondContact O-N 3.21Å; I400-M403 VanDerWaalsContact O-N 3.1Å
401	G	77.3	Confident	85.2	Confident	44 Å²	44	66.8 Å²	66.8	45%	0.454	33%	0.33	S	S	.	.	H	α-helix	trans	-54.3	-38	175.5	0	0	0	0	0	112.7	E398 A399 M403 K404	E398-G401 PolarHBondContact O-N 2.9Å; A399-G401 PolarHBondContact O-N 3.12Å; G401-M403 VanDerWaalsContact C-N 3.25Å; G401-M403 PolarHBondContact O-N 2.67Å; G401-K404 PolarHBondContact O-N 2.74Å; G401-K404 VanDerWaalsContact O-N 3.16Å
402	H	76.2	Confident	85.1	Confident	94 Å²	94	66.4 Å²	66.4	44%	0.435	33%	0.328	S	S	.	.	H	α-helix	trans	-63.3	-25.2	180	-59	-57.5	0	0	0	113.7	A399 I400 K404 E405 G406 W523	A399-H402 WeakPolarHBondContact O-CB 3.38Å; A399-H402 PolarHBondContact O-CD2 3.47Å; A399-H402 VanDerWaalsContact O-CD2 3.24Å; A399-H402 PolarHBondContact O-N 2.9Å; I400-H402 PolarHBondContact O-N 3.36Å; H402-K404 VanDerWaalsContact C-N 3.34Å; H402-K404 PolarHBondContact O-N 3.46Å; H402-E405 IonicContact ND1-OE2 3.2Å; H402-G406 PolarHBondContact O-N 2.99Å; H402-W523 HydrophobicContact CB-CB 4.03Å; H402-W523 HydrophobicContact CB-CD2 4.25Å; H402-W523 HydrophobicContact CB-CG 3.79Å; H402-W523 AromaticContact CD2-CD1 3.74Å; H402-W523 AromaticContact CD2-NE1 3.93Å
403	M	78.2	Confident	85.1	Confident	3 Å²	3	66.6 Å²	66.6	2%	0.015	33%	0.329	C	S	.	.	H	α-helix	trans	-66.8	-34.7	175.6	-74.2	-156.6	-70.6	0	0	113.1	S340 P355 A357 I400 G401 G406 E407 W523	S340-M403 WeakPolarHBondContact CB-O 3.49Å; S340-M403 PolarHBondContact OG-O 3.19Å; P355-M403 HydrophobicContact CB-SD 4.49Å; A357-M403 HydrophobicContact CB-CE 3.44Å; A357-M403 VanDerWaalsContact CB-CE 3.44Å; A357-M403 HydrophobicContact CB-SD 4.35Å; I400-M403 HydrophobicContact CG2-CE 3.81Å; I400-M403 PolarHBondContact O-N 3.21Å; I400-M403 VanDerWaalsContact O-N 3.1Å; G401-M403 VanDerWaalsContact C-N 3.25Å; G401-M403 PolarHBondContact O-N 2.67Å; M403-G406 PolarHBondContact O-N 3.04Å; M403-E407 PolarHBondContact O-N 2.97Å; M403-W523 HydrophobicContact CE-CZ3 4.27Å; M403-W523 HydrophobicContact CG-CE3 3.43Å; M403-W523 VanDerWaalsContact CG-CE3 3.43Å; M403-W523 HydrophobicContact CG-CH2 4.13Å; M403-W523 HydrophobicContact CG-CZ3 3.21Å; M403-W523 HydrophobicContact SD-CE3 4.33Å; M403-W523 HydrophobicContact SD-CH2 4.44Å; M403-W523 HydrophobicContact SD-CZ3 3.62Å
404	K	77.4	Confident	85.2	Confident	142 Å²	142	66.3 Å²	66.3	62%	0.617	33%	0.327	S	S	*	.	H	α-helix	trans	-73.7	-46.6	-178.6	-70.3	-175.5	175.7	179.1	0	111.3	G401 H402 G406 E407 E408	G401-K404 PolarHBondContact O-N 2.74Å; G401-K404 VanDerWaalsContact O-N 3.16Å; H402-K404 VanDerWaalsContact C-N 3.34Å; H402-K404 PolarHBondContact O-N 3.46Å; K404-G406 PolarHBondContact O-N 3.34Å; K404-E407 PolarHBondContact O-N 3.38Å; K404-E408 PolarHBondContact O-N 3.25Å; K404-E408 VanDerWaalsContact O-N 3.11Å
405	E	79.9	Confident	85.3	Confident	81 Å²	81	63.9 Å²	63.9	38%	0.379	32%	0.316	S	S	.	.	H	α-helix	trans	-53.6	-45.2	168.2	-172.3	-158.5	139.6	0	0	110.4	H402 E407 E408 E409 K410	H402-E405 IonicContact ND1-OE2 3.2Å; E405-E407 VanDerWaalsContact C-N 3.31Å; E405-E407 PolarHBondContact O-N 3.03Å; E405-E408 PolarHBondContact O-N 3.06Å; E405-E409 PolarHBondContact O-N 2.88Å; E405-K410 IonicContact OE1-NZ 2.84Å; E405-K410 PolarHBondContact OE1-NZ 2.67Å
406	G	75.4	Confident	85.4	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-55.6	-39	173.7	0	0	0	0	0	114.6	H402 M403 K404 K412 V521	H402-G406 PolarHBondContact O-N 2.99Å; M403-G406 PolarHBondContact O-N 3.04Å; K404-G406 PolarHBondContact O-N 3.34Å; G406-K412 PolarHBondContact O-NZ 3.27Å; G406-V521 WeakPolarHBondContact O-CG2 3.48Å
407	E	79.3	Confident	85.8	Confident	88 Å²	88	60 Å²	60	41%	0.411	29%	0.291	S	S	.	.	H	α-helix	trans	-71.3	-48.1	-179.4	-179.1	171.8	174.9	0	0	111	S340 G341 M403 K404 E405 K412 A482	S340-E407 PolarHBondContact OG-N 2.85Å; G341-E407 VanDerWaalsContact CA-CD 3.5Å; G341-E407 PolarHBondContact N-OE2 3.4Å; M403-E407 PolarHBondContact O-N 2.97Å; K404-E407 PolarHBondContact O-N 3.38Å; E405-E407 VanDerWaalsContact C-N 3.31Å; E405-E407 PolarHBondContact O-N 3.03Å; E407-K412 PolarHBondContact O-NZ 3.15Å; E407-A482 WeakPolarHBondContact O-CB 3.49Å
408	E	79.6	Confident	86.3	Confident	156 Å²	156	52.7 Å²	52.7	73%	0.729	26%	0.263	S	S	*	.	H	α-helix	trans	-79	-36.5	-170	-66.7	-175	179.6	0	0	114.1	K404 E405 A482	K404-E408 PolarHBondContact O-N 3.25Å; K404-E408 VanDerWaalsContact O-N 3.11Å; E405-E408 PolarHBondContact O-N 3.06Å; E408-A482 WeakPolarHBondContact O-CB 3.42Å
409	E	84.3	Confident	87.2	Confident	124 Å²	124	50.2 Å²	50.2	58%	0.579	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-45.6	-171.5	-59.2	-170.9	165.8	0	0	113.7	E405	E405-E409 PolarHBondContact O-N 2.88Å
410	K	89	Confident	88.2	Confident	61 Å²	61	49.3 Å²	49.3	27%	0.265	24%	0.241	S	C	.	.	S	Bend	trans	-72.6	153.7	-163.8	-51.2	-59.3	-178.7	-149.9	0	112.1	E405 K412 D520 V521	E405-K410 IonicContact OE1-NZ 2.84Å; E405-K410 PolarHBondContact OE1-NZ 2.67Å; K410-K412 WeakPolarHBondContact O-CD 3.38Å; K410-K412 WeakPolarHBondContact O-CE 3.34Å; K410-K412 PolarHBondContact O-NZ 3.48Å; K410-D520 WeakPolarHBondContact CB-O 3.44Å; K410-D520 WeakPolarHBondContact CG-O 3.12Å; K410-V521 HydrophobicContact CB-CG2 3.94Å; K410-V521 HydrophobicContact CG-CG2 3.95Å
411	T	94.1	Very high	89.3	Confident	33 Å²	33	50.6 Å²	50.6	20%	0.202	25%	0.248	C	C	.	.			trans	-76.2	160.9	-179.8	44	0	0	0	0	111.7	K479 T480 D520	T411-K479 VanDerWaalsContact CB-CE 3.42Å; T411-K479 WeakPolarHBondContact OG1-CE 3.27Å; T411-K479 PolarHBondContact OG1-NZ 2.95Å; T411-T480 WeakPolarHBondContact CA-O 3.46Å; T411-T480 WeakPolarHBondContact CB-O 3.37Å; T411-D520 WeakPolarHBondContact O-CB 3.45Å; T411-D520 PolarHBondContact O-N 3.27Å; T411-D520 VanDerWaalsContact O-N 3.14Å; T411-D520 PolarHBondContact OG1-OD2 3.48Å
412	K	95.9	Very high	90.2	Very high	8 Å²	8	53.4 Å²	53.4	4%	0.035	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	141.6	175.3	-72.8	90.1	-162.5	172.9	0	108.9	G406 E407 K410 Y414 T480 S518 V519	G406-K412 PolarHBondContact O-NZ 3.27Å; E407-K412 PolarHBondContact O-NZ 3.15Å; K410-K412 WeakPolarHBondContact O-CD 3.38Å; K410-K412 WeakPolarHBondContact O-CE 3.34Å; K410-K412 PolarHBondContact O-NZ 3.48Å; K412-Y414 HydrophobicContact CB-CD2 4.49Å; K412-Y414 HydrophobicContact CB-CE2 3.56Å; K412-T480 PolarHBondContact N-O 3.46Å; K412-T480 VanDerWaalsContact N-O 3.13Å; K412-T480 PolarHBondContact O-N 2.7Å; K412-S518 WeakPolarHBondContact CA-O 3.28Å; K412-V519 HydrophobicContact CG-CG1 4.4Å; K412-V519 HydrophobicContact CG-CG2 4.34Å
413	T	98.1	Very high	91.3	Very high	10 Å²	10	51.8 Å²	51.8	6%	0.061	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	139.7	176.6	-49.5	0	0	0	0	109.5	R477 L478 E517 S518	T413-R477 HydrophobicContact CG2-CG 4.27Å; T413-L478 CarbonylContact C-O 3.6Å; T413-L478 WeakPolarHBondContact CA-O 3.35Å; T413-E517 HydrophobicContact CG2-CB 4.19Å; T413-E517 PolarHBondContact O-N 3.36Å; T413-S518 WeakPolarHBondContact CB-OG 3.49Å; T413-S518 PolarHBondContact N-O 3.02Å; T413-S518 PolarHBondContact O-N 2.62Å; T413-S518 PolarHBondContact OG1-OG 2.98Å
414	Y	98.6	Very high	92.3	Very high	28 Å²	28	52 Å²	52	11%	0.11	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	158.4	-177	-57	-95.2	0	0	0	111.2	K412 R477 L478 T480 I486 L514 D515 V516	K412-Y414 HydrophobicContact CB-CD2 4.49Å; K412-Y414 HydrophobicContact CB-CE2 3.56Å; Y414-R477 CarbonylContact O-C 3.56Å; Y414-R477 VanDerWaalsContact O-CA 3.27Å; Y414-R477 WeakPolarHBondContact O-CA 3.44Å; Y414-L478 PolarHBondContact N-O 3.42Å; Y414-L478 PolarHBondContact O-N 3.05Å; Y414-T480 HydrophobicContact CD2-CG2 4.42Å; Y414-I486 HydrophobicContact CD1-CG1 3.83Å; Y414-I486 HydrophobicContact CD2-CD1 3.69Å; Y414-I486 HydrophobicContact CD2-CG1 3.78Å; Y414-I486 HydrophobicContact CE1-CG1 3.81Å; Y414-I486 HydrophobicContact CE2-CD1 3.66Å; Y414-I486 HydrophobicContact CE2-CG1 3.8Å; Y414-I486 HydrophobicContact CG-CD1 4.21Å; Y414-I486 HydrophobicContact CG-CG1 3.8Å; Y414-L514 HydrophobicContact CD1-CD1 4.05Å; Y414-L514 HydrophobicContact CG-CD1 4.41Å; Y414-D515 CarbonylContact C-O 3.52Å; Y414-D515 WeakPolarHBondContact CA-O 3.42Å; Y414-D515 WeakPolarHBondContact CB-O 3.18Å; Y414-V516 HydrophobicContact CD1-CG2 4.03Å; Y414-V516 HydrophobicContact CE1-CG2 3.82Å
415	S	98.6	Very high	93.3	Very high	19 Å²	19	49.4 Å²	49.4	13%	0.133	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	124.8	167.4	-174.7	0	0	0	0	108.4	L514 D515 E517	S415-L514 WeakPolarHBondContact O-CA 3.22Å; S415-D515 PolarHBondContact N-O 2.65Å; S415-D515 PolarHBondContact O-N 3.26Å; S415-E517 WeakPolarHBondContact CB-OE1 3.17Å
416	A	98.8	Very high	94.1	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.008	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	133.3	-178.5	0	0	0	0	0	110.5	I418 R475 L476 I511 E513 L514	A416-I418 HydrophobicContact CB-CG1 4.2Å; A416-R475 CarbonylContact O-C 3.46Å; A416-R475 VanDerWaalsContact O-CA 3.25Å; A416-R475 WeakPolarHBondContact O-CA 3.2Å; A416-L476 PolarHBondContact N-O 3.11Å; A416-L476 PolarHBondContact O-N 3.1Å; A416-I511 HydrophobicContact CB-CD1 3.72Å; A416-I511 HydrophobicContact CB-CG1 4.2Å; A416-E513 CarbonylContact C-O 3.52Å; A416-E513 VanDerWaalsContact CA-O 3.31Å; A416-E513 WeakPolarHBondContact CA-O 3.4Å; A416-L514 HydrophobicContact CB-CD1 4.24Å
417	L	98.8	Very high	95.2	Very high	23 Å²	23	58.3 Å²	58.3	12%	0.12	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	116.4	164.4	-177.9	62.8	0	0	0	108	H473 R475 L512 E513	L417-H473 HydrophobicContact CD1-CB 4.38Å; L417-R475 HydrophobicContact CD1-CG 4.02Å; L417-L512 HydrophobicContact CB-CB 4.47Å; L417-L512 HydrophobicContact CD2-CB 4.17Å; L417-L512 HydrophobicContact CD2-CD1 4.23Å; L417-L512 HydrophobicContact CG-CB 4.27Å; L417-L512 HydrophobicContact CG-CD1 4.4Å; L417-L512 PolarHBondContact O-N 3.3Å; L417-E513 HydrophobicContact CB-CB 3.9Å; L417-E513 HydrophobicContact CD2-CG 4.47Å; L417-E513 PolarHBondContact N-O 2.72Å
418	I	98.9	Very high	96.1	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	134.3	-175.5	-59.8	-177.5	0	0	0	109	A416 H473 F474 L476 V490 I501 A509 D510	A416-I418 HydrophobicContact CB-CG1 4.2Å; I418-H473 VanDerWaalsContact O-CA 3.31Å; I418-H473 WeakPolarHBondContact O-CA 3.27Å; I418-F474 HydrophobicContact CB-CD1 4.16Å; I418-F474 HydrophobicContact CB-CE1 3.81Å; I418-F474 HydrophobicContact CB-CE2 4.49Å; I418-F474 HydrophobicContact CB-CZ 4Å; I418-F474 HydrophobicContact CD1-CE1 4.5Å; I418-F474 HydrophobicContact CD1-CE2 4.02Å; I418-F474 HydrophobicContact CD1-CZ 3.82Å; I418-F474 HydrophobicContact CG1-CZ 4.46Å; I418-F474 HydrophobicContact CG2-CD1 4.29Å; I418-F474 HydrophobicContact CG2-CE1 3.57Å; I418-F474 HydrophobicContact CG2-CZ 3.89Å; I418-F474 PolarHBondContact N-O 3.35Å; I418-F474 PolarHBondContact O-N 2.99Å; I418-F474 VanDerWaalsContact O-N 3.13Å; I418-L476 HydrophobicContact CD1-CB 3.59Å; I418-L476 HydrophobicContact CD1-CD2 3.68Å; I418-L476 HydrophobicContact CD1-CG 4.28Å; I418-L476 HydrophobicContact CG1-CB 4.37Å; I418-V490 HydrophobicContact CB-CG1 4.47Å; I418-V490 HydrophobicContact CD1-CB 4.48Å; I418-V490 HydrophobicContact CD1-CG1 3.92Å; I418-V490 HydrophobicContact CD1-CG2 3.7Å; I418-V490 HydrophobicContact CG1-CG1 3.95Å; I418-V490 HydrophobicContact CG1-CG2 4.15Å; I418-V490 HydrophobicContact CG2-CG1 3.86Å; I418-I501 HydrophobicContact CD1-CG1 4.35Å; I418-I501 HydrophobicContact CD1-CG2 4.37Å; I418-A509 HydrophobicContact CG2-CB 4.13Å; I418-D510 WeakPolarHBondContact CA-O 3.22Å
419	W	98.8	Very high	97	Very high	88 Å²	88	49.9 Å²	49.9	33%	0.333	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	147.4	168.4	170.3	80.1	0	0	0	110.7	D421 H472 H473 A509 D510 L512	W419-D421 HydrophobicContact CH2-CB 3.67Å; W419-D421 HydrophobicContact CZ2-CB 4.19Å; W419-D421 HydrophobicContact CZ3-CB 4.25Å; W419-H472 CarbonylContact C-O 3.54Å; W419-H472 VanDerWaalsContact CA-O 3.28Å; W419-H472 WeakPolarHBondContact CA-O 3.18Å; W419-H473 AromaticContact CD1-NE2 3.55Å; W419-A509 VanDerWaalsContact O-CA 3.27Å; W419-A509 WeakPolarHBondContact O-CA 3.33Å; W419-D510 HydrophobicContact CE3-CB 4.08Å; W419-D510 PolarHBondContact N-O 3.28Å; W419-D510 PolarHBondContact O-N 3.19Å; W419-L512 HydrophobicContact CB-CD1 4.06Å; W419-L512 HydrophobicContact CB-CD2 4.07Å; W419-L512 HydrophobicContact CB-CG 3.98Å
420	T	98.8	Very high	97.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	141.5	172.8	58.2	0	0	0	0	112.7	K422 I424 H472 F474 M505 V507 T508	T420-K422 PolarHBondContact OG1-O 3.38Å; T420-I424 HydrophobicContact CG2-CG2 4.46Å; T420-H472 PolarHBondContact N-O 2.91Å; T420-H472 PolarHBondContact O-ND1 2.92Å; T420-F474 HydrophobicContact CG2-CE1 4.03Å; T420-M505 HydrophobicContact CG2-CE 4.09Å; T420-V507 HydrophobicContact CG2-CG2 3.85Å; T420-T508 WeakPolarHBondContact CA-O 3.5Å
421	D	98.5	Very high	98	Very high	59 Å²	59	48.6 Å²	48.6	32%	0.316	24%	0.236	S	C	.	.	S	Bend	trans	-66.1	-38.1	177.8	65.4	-17.9	0	0	0	113.7	W419 H472 V507 T508	W419-D421 HydrophobicContact CH2-CB 3.67Å; W419-D421 HydrophobicContact CZ2-CB 4.19Å; W419-D421 HydrophobicContact CZ3-CB 4.25Å; D421-H472 PolarHBondContact O-CE1 2.96Å; D421-V507 WeakPolarHBondContact OD1-CB 3.45Å; D421-T508 VanDerWaalsContact CG-N 3.26Å; D421-T508 PolarHBondContact N-O 2.7Å; D421-T508 PolarHBondContact OD1-N 2.81Å; D421-T508 WeakPolarHBondContact OD2-CB 3.44Å; D421-T508 PolarHBondContact OD2-N 2.75Å; D421-T508 PolarHBondContact OD2-OG1 2.9Å
422	K	98.1	Very high	98.2	Very high	103 Å²	103	47 Å²	47	45%	0.448	23%	0.226	S	C	.	.	S	Bend	trans	-92.1	148	175.1	-63.7	171.8	-159.3	167.5	0	110.3	T420 I424 N506 V507	T420-K422 PolarHBondContact OG1-O 3.38Å; K422-I424 PolarHBondContact O-N 3.27Å; K422-N506 PolarHBondContact NZ-O 2.93Å; K422-V507 HydrophobicContact CB-CG1 4.27Å; K422-V507 HydrophobicContact CD-CG1 4.31Å
423	A	98.5	Very high	98.3	Very high	60 Å²	60	48.7 Å²	48.7	50%	0.496	24%	0.235	S	C	.	.			trans	-63.4	130	169.8	0	0	0	0	0	110.2	E471	A423-E471 CarbonylContact C-O 3.45Å; A423-E471 WeakPolarHBondContact CA-O 3.38Å; A423-E471 HydrophobicContact CB-CB 4.32Å
424	I	98.5	Very high	98.3	Very high	6 Å²	6	54.5 Å²	54.5	3%	0.031	27%	0.266	C	S	.	.			trans	-115.1	155.2	178.4	56.5	162.2	0	0	0	110.8	T420 K422 I429 Y468 E471 F474 M505	T420-I424 HydrophobicContact CG2-CG2 4.46Å; K422-I424 PolarHBondContact O-N 3.27Å; I424-I429 HydrophobicContact CD1-CG2 3.99Å; I424-Y468 HydrophobicContact CG1-CE2 4.34Å; I424-Y468 PolarHBondContact O-OH 3.26Å; I424-E471 VanDerWaalsContact CG1-O 3.27Å; I424-E471 WeakPolarHBondContact CG1-O 3.33Å; I424-E471 PolarHBondContact N-O 3.04Å; I424-F474 HydrophobicContact CD1-CB 4.46Å; I424-F474 HydrophobicContact CD1-CD1 3.73Å; I424-F474 HydrophobicContact CD1-CE1 4.41Å; I424-F474 HydrophobicContact CD1-CG 4.43Å; I424-M505 HydrophobicContact CD1-CE 4.49Å; I424-M505 HydrophobicContact CG2-CE 3.98Å
425	Q	98.3	Very high	98.3	Very high	89 Å²	89	55 Å²	55	42%	0.416	27%	0.27	S	S	.	.			trans	-114.4	160.6	168.9	-61.8	-67.2	-53.7	0	0	109.2	K427 D428	Q425-K427 HydrophobicContact CB-CG 4.26Å; Q425-K427 PolarHBondContact O-N 2.76Å; Q425-K427 VanDerWaalsContact O-N 3.11Å; Q425-D428 WeakPolarHBondContact CB-OD2 3.45Å; Q425-D428 PolarHBondContact N-OD2 3.16Å; Q425-D428 WeakPolarHBondContact O-CB 3.4Å; Q425-D428 PolarHBondContact O-N 3.41Å
426	K	97.4	Very high	98.3	Very high	126 Å²	126	59.8 Å²	59.8	55%	0.548	29%	0.289	S	S	.	.	H	α-helix	trans	-49.8	-43.2	-178.3	-172.9	-169.4	173.5	-153.1	0	113.6	D428 I429 E430 Y468	K426-D428 PolarHBondContact O-N 3.24Å; K426-I429 WeakPolarHBondContact O-CG1 3.48Å; K426-I429 PolarHBondContact O-N 2.93Å; K426-E430 WeakPolarHBondContact CE-OE1 3.47Å; K426-E430 IonicContact NZ-OE1 2.64Å; K426-E430 PolarHBondContact NZ-OE1 2.98Å; K426-E430 WeakPolarHBondContact O-CG 3.48Å; K426-E430 PolarHBondContact O-N 2.89Å; K426-Y468 HydrophobicContact CB-CD2 4.2Å; K426-Y468 HydrophobicContact CB-CG 4.07Å; K426-Y468 HydrophobicContact CG-CG 4.43Å
427	K	97.6	Very high	98.2	Very high	142 Å²	142	64.3 Å²	64.3	62%	0.617	31%	0.313	S	S	*	.	H	α-helix	trans	-59.8	-27	177.9	70.3	-175.6	-177.6	175.5	0	113.9	Q425 I429 E430	Q425-K427 HydrophobicContact CB-CG 4.26Å; Q425-K427 PolarHBondContact O-N 2.76Å; Q425-K427 VanDerWaalsContact O-N 3.11Å; K427-I429 VanDerWaalsContact C-N 3.25Å; K427-I429 PolarHBondContact O-N 3.3Å; K427-E430 PolarHBondContact O-N 3.15Å
428	D	98.1	Very high	98.2	Very high	66 Å²	66	64.7 Å²	64.7	35%	0.353	32%	0.315	S	S	.	.	H	α-helix	trans	-78.2	-14.3	-173.6	-53.1	-35.7	0	0	0	111.8	Q425 K426 F431	Q425-D428 WeakPolarHBondContact CB-OD2 3.45Å; Q425-D428 PolarHBondContact N-OD2 3.16Å; Q425-D428 WeakPolarHBondContact O-CB 3.4Å; Q425-D428 PolarHBondContact O-N 3.41Å; K426-D428 PolarHBondContact O-N 3.24Å; D428-F431 WeakPolarHBondContact O-CD1 3.21Å; D428-F431 VanDerWaalsContact O-CE1 3.24Å; D428-F431 WeakPolarHBondContact O-CE1 3.28Å
429	I	98.4	Very high	98.2	Very high	1 Å²	1	72.7 Å²	72.7	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-107.9	-8.4	172.8	60.3	176	0	0	0	113.3	I424 K426 K427 F431 L432 T466 Y468 F474 M505	I424-I429 HydrophobicContact CD1-CG2 3.99Å; K426-I429 WeakPolarHBondContact O-CG1 3.48Å; K426-I429 PolarHBondContact O-N 2.93Å; K427-I429 VanDerWaalsContact C-N 3.25Å; K427-I429 PolarHBondContact O-N 3.3Å; I429-F431 VanDerWaalsContact C-N 3.3Å; I429-F431 PolarHBondContact O-N 2.9Å; I429-L432 HydrophobicContact CB-CD1 4.48Å; I429-L432 WeakPolarHBondContact O-CB 3.38Å; I429-L432 PolarHBondContact O-N 3.37Å; I429-T466 HydrophobicContact CB-CG2 4.25Å; I429-T466 PolarHBondContact O-OG1 3.14Å; I429-Y468 HydrophobicContact CD1-CD2 4.27Å; I429-F474 HydrophobicContact CD1-CB 3.57Å; I429-F474 HydrophobicContact CD1-CD2 3.97Å; I429-F474 HydrophobicContact CD1-CG 3.86Å; I429-F474 HydrophobicContact CG2-CD1 4.11Å; I429-F474 HydrophobicContact CG2-CD2 4.24Å; I429-F474 HydrophobicContact CG2-CE1 4.14Å; I429-F474 HydrophobicContact CG2-CE2 4.26Å; I429-F474 HydrophobicContact CG2-CG 4.16Å; I429-F474 HydrophobicContact CG2-CZ 4.21Å; I429-M505 HydrophobicContact CG2-CE 3.45Å; I429-M505 VanDerWaalsContact CG2-CE 3.45Å; I429-M505 HydrophobicContact CG2-SD 4.06Å
430	E	97.3	Very high	98.2	Very high	82 Å²	82	68.6 Å²	68.6	38%	0.383	33%	0.334	S	S	.	.	H	α-helix	trans	-62.4	-34.9	-175.7	-85.3	170	177.5	0	0	112.4	K426 K427 L432 N433	K426-E430 WeakPolarHBondContact CE-OE1 3.47Å; K426-E430 IonicContact NZ-OE1 2.64Å; K426-E430 PolarHBondContact NZ-OE1 2.98Å; K426-E430 WeakPolarHBondContact O-CG 3.48Å; K426-E430 PolarHBondContact O-N 2.89Å; K427-E430 PolarHBondContact O-N 3.15Å; E430-L432 PolarHBondContact O-N 3.5Å; E430-N433 WeakPolarHBondContact CA-ND2 3.36Å; E430-N433 WeakPolarHBondContact O-CB 3.43Å; E430-N433 PolarHBondContact O-N 3.28Å; E430-N433 VanDerWaalsContact O-N 3.15Å; E430-N433 PolarHBondContact O-ND2 3.23Å
431	F	98.4	Very high	98.2	Very high	76 Å²	76	73.1 Å²	73.1	33%	0.333	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-62.5	-23.9	178.4	82.8	-84.4	0	0	0	114.3	D428 I429 N433 D434 I435 L504 M505	D428-F431 WeakPolarHBondContact O-CD1 3.21Å; D428-F431 VanDerWaalsContact O-CE1 3.24Å; D428-F431 WeakPolarHBondContact O-CE1 3.28Å; I429-F431 VanDerWaalsContact C-N 3.3Å; I429-F431 PolarHBondContact O-N 2.9Å; F431-N433 PolarHBondContact O-N 2.81Å; F431-D434 PolarHBondContact O-N 3.32Å; F431-I435 HydrophobicContact CD2-CD1 4.05Å; F431-I435 HydrophobicContact CE2-CD1 3.95Å; F431-L504 HydrophobicContact CE2-CB 4.43Å; F431-L504 HydrophobicContact CZ-CB 4.28Å; F431-L504 WeakPolarHBondContact CZ-O 3.49Å; F431-M505 HydrophobicContact CE1-CG 4.05Å; F431-M505 HydrophobicContact CZ-CG 4.02Å
432	L	98.4	Very high	98.2	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-65	-27.5	178.8	-67.1	174.7	0	0	0	111.6	I429 E430 D434 I435 M464 T466 F474 I501 L504 M505	I429-L432 HydrophobicContact CB-CD1 4.48Å; I429-L432 WeakPolarHBondContact O-CB 3.38Å; I429-L432 PolarHBondContact O-N 3.37Å; E430-L432 PolarHBondContact O-N 3.5Å; L432-D434 VanDerWaalsContact C-N 3.27Å; L432-D434 PolarHBondContact O-N 3.13Å; L432-I435 HydrophobicContact CD2-CD1 4.1Å; L432-I435 PolarHBondContact O-N 3.31Å; L432-M464 HydrophobicContact CD2-CE 4.21Å; L432-T466 HydrophobicContact CB-CG2 3.78Å; L432-T466 HydrophobicContact CD1-CG2 3.93Å; L432-T466 HydrophobicContact CG-CG2 4.47Å; L432-F474 HydrophobicContact CD1-CE2 4.13Å; L432-F474 HydrophobicContact CD1-CZ 4.3Å; L432-I501 HydrophobicContact CD1-CD1 4.45Å; L432-I501 HydrophobicContact CD2-CD1 4.45Å; L432-L504 HydrophobicContact CD2-CB 4.38Å; L432-L504 HydrophobicContact CD2-CD1 4.2Å; L432-M505 HydrophobicContact CD1-CG 4.39Å; L432-M505 HydrophobicContact CD1-SD 3.97Å
433	N	98	Very high	98.2	Very high	43 Å²	43	70 Å²	70	23%	0.23	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-66.2	-30.2	178.5	-58.2	-80.4	0	0	0	112.1	E430 F431 K436 E465 T466	E430-N433 WeakPolarHBondContact CA-ND2 3.36Å; E430-N433 WeakPolarHBondContact O-CB 3.43Å; E430-N433 PolarHBondContact O-N 3.28Å; E430-N433 VanDerWaalsContact O-N 3.15Å; E430-N433 PolarHBondContact O-ND2 3.23Å; F431-N433 PolarHBondContact O-N 2.81Å; N433-K436 WeakPolarHBondContact O-CE 3.48Å; N433-K436 PolarHBondContact O-NZ 3.28Å; N433-E465 VanDerWaalsContact OD1-CA 3.28Å; N433-E465 WeakPolarHBondContact OD1-CA 3.32Å; N433-T466 PolarHBondContact ND2-OG1 3.02Å; N433-T466 PolarHBondContact OD1-N 3.5Å; N433-T466 PolarHBondContact OD1-OG1 3.28Å
434	D	97.9	Very high	98.1	Very high	133 Å²	133	67.2 Å²	67.2	71%	0.711	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-18.3	-177	-61.1	-41.6	0	0	0	112.8	F431 L432 K436	F431-D434 PolarHBondContact O-N 3.32Å; L432-D434 VanDerWaalsContact C-N 3.27Å; L432-D434 PolarHBondContact O-N 3.13Å; D434-K436 PolarHBondContact O-N 3.18Å
435	I	98.2	Very high	98.1	Very high	37 Å²	37	66.9 Å²	66.9	19%	0.19	32%	0.317	C	S	.	.			trans	-73.8	114.8	179.1	-57	177.5	0	0	0	109.8	F431 L432 L438 M464 L504	F431-I435 HydrophobicContact CD2-CD1 4.05Å; F431-I435 HydrophobicContact CE2-CD1 3.95Å; L432-I435 HydrophobicContact CD2-CD1 4.1Å; L432-I435 PolarHBondContact O-N 3.31Å; I435-L438 HydrophobicContact CG2-CB 3.75Å; I435-L438 HydrophobicContact CG2-CD1 4.05Å; I435-L438 HydrophobicContact CG2-CD2 4.25Å; I435-L438 HydrophobicContact CG2-CG 4.23Å; I435-M464 HydrophobicContact CB-CE 3.76Å; I435-M464 HydrophobicContact CD1-CE 4.12Å; I435-M464 HydrophobicContact CG1-CE 4.48Å; I435-M464 HydrophobicContact CG2-CE 3.91Å; I435-L504 HydrophobicContact CD1-CD2 4.5Å
436	K	97.9	Very high	98.1	Very high	121 Å²	121	66.3 Å²	66.3	53%	0.526	32%	0.316	S	S	.	.			trans	-115.6	150	173.5	-50.5	-55.2	178.4	-162.1	0	111.2	N433 D434 L438 H462	N433-K436 WeakPolarHBondContact O-CE 3.48Å; N433-K436 PolarHBondContact O-NZ 3.28Å; D434-K436 PolarHBondContact O-N 3.18Å; K436-L438 PolarHBondContact O-N 2.88Å; K436-L438 VanDerWaalsContact O-N 3.13Å; K436-H462 WeakPolarHBondContact CA-O 3.32Å
437	D	98.1	Very high	98	Very high	96 Å²	96	64.8 Å²	64.8	51%	0.513	31%	0.307	S	S	.	.	S	Bend	trans	45.2	42.7	178.3	-67	-53.2	0	0	0	114.7	K439 V460 I461 H462	D437-K439 PolarHBondContact O-N 2.87Å; D437-K439 VanDerWaalsContact O-N 3.08Å; D437-V460 HydrophobicContact CB-CG1 4.01Å; D437-I461 CarbonylContact C-O 3.56Å; D437-I461 VanDerWaalsContact CA-O 3.26Å; D437-I461 WeakPolarHBondContact CA-O 3.49Å; D437-I461 PolarHBondContact N-O 3.08Å; D437-H462 PolarHBondContact N-O 3.37Å; D437-H462 IonicContact OD1-CE1 2.65Å; D437-H462 IonicContact OD1-CG 3.1Å; D437-H462 IonicContact OD1-ND1 2.86Å; D437-H462 PolarHBondContact OD1-ND1 3.26Å
438	L	98.6	Very high	97.8	Very high	30 Å²	30	59.1 Å²	59.1	16%	0.157	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	112.3	178.9	-177.6	66.8	0	0	0	110.2	I435 K436 I440 V460 I461 M464 F489 P499 L504	I435-L438 HydrophobicContact CG2-CB 3.75Å; I435-L438 HydrophobicContact CG2-CD1 4.05Å; I435-L438 HydrophobicContact CG2-CD2 4.25Å; I435-L438 HydrophobicContact CG2-CG 4.23Å; K436-L438 PolarHBondContact O-N 2.88Å; K436-L438 VanDerWaalsContact O-N 3.13Å; L438-I440 HydrophobicContact CD2-CG2 4.11Å; L438-I440 HydrophobicContact CG-CG2 4.02Å; L438-V460 WeakPolarHBondContact O-CA 3.27Å; L438-I461 HydrophobicContact CB-CB 4.19Å; L438-I461 PolarHBondContact N-O 2.96Å; L438-I461 PolarHBondContact O-N 3.35Å; L438-M464 HydrophobicContact CD2-CE 4.41Å; L438-F489 HydrophobicContact CD2-CE2 3.95Å; L438-F489 HydrophobicContact CD2-CZ 4.02Å; L438-P499 HydrophobicContact CD1-CG 3.87Å; L438-P499 HydrophobicContact CD2-CG 4.13Å; L438-P499 HydrophobicContact CG-CG 4.16Å; L438-L504 HydrophobicContact CD2-CD1 3.98Å
439	K	98.6	Very high	97.6	Very high	169 Å²	169	59 Å²	59	74%	0.735	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	127.3	171.7	-65.5	178	-177	176	0	109.6	D437 R459 V460 P499	D437-K439 PolarHBondContact O-N 2.87Å; D437-K439 VanDerWaalsContact O-N 3.08Å; K439-R459 WeakPolarHBondContact CA-O 3.39Å; K439-V460 HydrophobicContact CG-CG2 4.35Å; K439-P499 WeakPolarHBondContact O-CD 3.39Å
440	I	98.7	Very high	97.2	Very high	2 Å²	2	65.5 Å²	65.5	1%	0.01	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	139.8	174.6	71.4	176.5	0	0	0	110.4	L438 A458 R459 I461 T484 F489 T497 K498 P499	L438-I440 HydrophobicContact CD2-CG2 4.11Å; L438-I440 HydrophobicContact CG-CG2 4.02Å; I440-A458 CarbonylContact O-C 3.46Å; I440-A458 WeakPolarHBondContact O-CA 3.42Å; I440-R459 HydrophobicContact CD1-CB 4.27Å; I440-R459 HydrophobicContact CG1-CB 3.78Å; I440-R459 PolarHBondContact N-O 2.8Å; I440-R459 PolarHBondContact O-N 3.48Å; I440-I461 HydrophobicContact CD1-CD1 4.1Å; I440-I461 HydrophobicContact CD1-CG1 4.4Å; I440-I461 HydrophobicContact CG2-CG1 4.39Å; I440-T484 HydrophobicContact CD1-CG2 4.07Å; I440-F489 HydrophobicContact CD1-CB 4.27Å; I440-F489 HydrophobicContact CD1-CD2 3.75Å; I440-F489 HydrophobicContact CD1-CG 4.23Å; I440-F489 HydrophobicContact CG2-CD2 4.09Å; I440-F489 HydrophobicContact CG2-CE2 3.94Å; I440-T497 HydrophobicContact CD1-CG2 4.12Å; I440-K498 CarbonylContact C-O 3.58Å; I440-K498 WeakPolarHBondContact CA-O 3.37Å; I440-P499 HydrophobicContact CG2-CG 4.1Å
441	D	98.6	Very high	96.7	Very high	94 Å²	94	69.7 Å²	69.7	50%	0.503	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	115.4	168.3	-79.4	-40.7	0	0	0	109.3	V456 T497 K498	D441-V456 HydrophobicContact CB-CG1 4.05Å; D441-T497 WeakPolarHBondContact O-CA 3.31Å; D441-K498 PolarHBondContact N-O 3.21Å; D441-K498 PolarHBondContact O-N 3.4Å
442	Q	98.4	Very high	96.3	Very high	2 Å²	2	73 Å²	73	1%	0.009	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	110	-171.9	-170.9	-175.5	-109.4	0	0	109.5	R457 Y485 T497	Q442-R457 PolarHBondContact N-O 2.98Å; Q442-R457 PolarHBondContact O-N 3.23Å; Q442-Y485 PolarHBondContact OE1-O 3.12Å; Q442-T497 HydrophobicContact CB-CG2 4.19Å; Q442-T497 HydrophobicContact CG-CG2 4.03Å
443	K	98.2	Very high	96.1	Very high	95 Å²	95	77.7 Å²	77.7	41%	0.413	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	148.3	169.5	-70.8	176.5	-179.3	-172.6	0	109.7	P445 A455 V456 R496	K443-P445 VanDerWaalsContact O-CD 3.31Å; K443-P445 WeakPolarHBondContact O-CD 3.14Å; K443-A455 CarbonylContact C-O 3.58Å; K443-A455 WeakPolarHBondContact CA-O 3.42Å; K443-V456 HydrophobicContact CG-CG2 3.81Å; K443-R496 HydrophobicContact CB-CB 4.17Å; K443-R496 WeakPolarHBondContact CB-O 3.34Å; K443-R496 HydrophobicContact CD-CB 4.32Å; K443-R496 PolarHBondContact N-O 2.91Å
444	T	97.5	Very high	96	Very high	1 Å²	1	81.5 Å²	81.5	1%	0.006	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-47.4	116.1	171.5	-60.4	0	0	0	0	109.3	V448 L449 R452 P453 A455 R457 R496	T444-V448 HydrophobicContact CG2-CG2 3.77Å; T444-L449 HydrophobicContact CG2-CD2 3.85Å; T444-R452 HydrophobicContact CG2-CB 3.76Å; T444-P453 PolarHBondContact OG1-O 3.36Å; T444-A455 PolarHBondContact N-O 3.37Å; T444-A455 PolarHBondContact OG1-N 3.05Å; T444-A455 VanDerWaalsContact OG1-N 3.14Å; T444-A455 PolarHBondContact OG1-O 2.97Å; T444-R457 PolarHBondContact OG1-NH1 2.82Å; T444-R496 VanDerWaalsContact O-CZ 3.28Å; T444-R496 PolarHBondContact O-NH1 2.98Å; T444-R496 PolarHBondContact O-NH2 3.37Å
445	P	98.1	Very high	96	Very high	0 Å²	0	76.9 Å²	76.9	0%	0	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-55	145.5	-170.7	-33.2	37.3	0	0	0	114.6	K443 R447 V448 L449 Y485 E488	K443-P445 VanDerWaalsContact O-CD 3.31Å; K443-P445 WeakPolarHBondContact O-CD 3.14Å; P445-R447 VanDerWaalsContact C-N 3.27Å; P445-R447 HydrophobicContact CB-CG 4.29Å; P445-R447 PolarHBondContact O-N 2.96Å; P445-V448 HydrophobicContact CB-CG2 4.1Å; P445-V448 HydrophobicContact CG-CG2 4.33Å; P445-V448 WeakPolarHBondContact O-CG2 3.35Å; P445-V448 PolarHBondContact O-N 3.39Å; P445-L449 PolarHBondContact O-N 3.02Å; P445-Y485 VanDerWaalsContact CD-CD2 3.42Å; P445-Y485 VanDerWaalsContact CD-CE2 3.43Å; P445-Y485 HydrophobicContact CG-CD1 3.99Å; P445-Y485 HydrophobicContact CG-CD2 3.42Å; P445-Y485 VanDerWaalsContact CG-CD2 3.42Å; P445-Y485 HydrophobicContact CG-CE1 4.35Å; P445-Y485 HydrophobicContact CG-CE2 3.86Å; P445-Y485 HydrophobicContact CG-CG 3.52Å; P445-E488 HydrophobicContact CB-CG 3.73Å; P445-E488 WeakPolarHBondContact CB-OE1 3.32Å; P445-E488 HydrophobicContact CG-CB 4.42Å; P445-E488 HydrophobicContact CG-CG 3.78Å
446	L	97.4	Very high	95.9	Very high	76 Å²	76	79.3 Å²	79.3	40%	0.398	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-50.3	-47.7	-179.5	-70.2	178.2	0	0	0	112.2	V448 L449 D493 F494	L446-V448 PolarHBondContact O-N 3.06Å; L446-V448 VanDerWaalsContact O-N 3.11Å; L446-L449 HydrophobicContact CD2-CD1 3.82Å; L446-L449 PolarHBondContact O-N 3.24Å; L446-D493 WeakPolarHBondContact CD1-OD1 3.3Å; L446-D493 WeakPolarHBondContact CG-OD1 3.49Å; L446-D493 PolarHBondContact N-OD2 3.21Å; L446-F494 HydrophobicContact CD1-CD2 3.7Å; L446-F494 HydrophobicContact CD1-CE2 4.07Å
447	R	95.6	Very high	95.9	Very high	95 Å²	95	77.1 Å²	77.1	36%	0.358	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-61.2	-19.9	-178.9	70.9	-177.3	179	103.7	-10.9	115.1	D344 P445 H450 E488	D344-R447 IonicContact OD1-CZ 2.67Å; D344-R447 IonicContact OD1-NH1 3.93Å; D344-R447 PolarHBondContact OD1-NH1 3.25Å; D344-R447 IonicContact OD1-NH2 2.81Å; D344-R447 IonicContact OD2-CZ 3.68Å; D344-R447 IonicContact OD2-NH1 3.24Å; D344-R447 PolarHBondContact OD2-NH1 3.47Å; D344-R447 IonicContact OD2-NH2 2.59Å; D344-R447 PolarHBondContact OD2-NH2 2.93Å; P445-R447 VanDerWaalsContact C-N 3.27Å; P445-R447 HydrophobicContact CB-CG 4.29Å; P445-R447 PolarHBondContact O-N 2.96Å; R447-H450 PolarHBondContact O-CE1 3.35Å; R447-H450 PolarHBondContact O-ND1 3.15Å; R447-H450 VanDerWaalsContact O-ND1 3.13Å; R447-E488 WeakPolarHBondContact CD-OE1 3.29Å; R447-E488 IonicContact CZ-OE1 3.72Å; R447-E488 IonicContact NE-OE1 2.7Å; R447-E488 PolarHBondContact NE-OE1 3.18Å; R447-E488 IonicContact NE-OE2 3.73Å; R447-E488 IonicContact NH2-OE1 2.67Å; R447-E488 IonicContact NH2-OE2 3.87Å
448	V	94.5	Very high	95.8	Very high	22 Å²	22	75.6 Å²	75.6	13%	0.133	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-110.8	0.2	178.3	-51.6	0	0	0	0	114.3	T444 P445 L446 H450 R451 R452	T444-V448 HydrophobicContact CG2-CG2 3.77Å; P445-V448 HydrophobicContact CB-CG2 4.1Å; P445-V448 HydrophobicContact CG-CG2 4.33Å; P445-V448 WeakPolarHBondContact O-CG2 3.35Å; P445-V448 PolarHBondContact O-N 3.39Å; L446-V448 PolarHBondContact O-N 3.06Å; L446-V448 VanDerWaalsContact O-N 3.11Å; V448-H450 PolarHBondContact O-N 3.15Å; V448-H450 VanDerWaalsContact O-N 3.17Å; V448-R451 PolarHBondContact O-N 3.41Å; V448-R452 HydrophobicContact CG2-CB 4.46Å; V448-R452 HydrophobicContact CG2-CG 4.41Å; V448-R452 PolarHBondContact O-N 3.5Å
449	L	92.8	Very high	95.8	Very high	63 Å²	63	76.7 Å²	76.7	33%	0.33	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-29.6	179.4	-76	178.4	0	0	0	113.4	T444 P445 L446 R451 L454	T444-L449 HydrophobicContact CG2-CD2 3.85Å; P445-L449 PolarHBondContact O-N 3.02Å; L446-L449 HydrophobicContact CD2-CD1 3.82Å; L446-L449 PolarHBondContact O-N 3.24Å; L449-R451 PolarHBondContact O-N 2.95Å; L449-L454 HydrophobicContact CD2-CB 4.18Å; L449-L454 HydrophobicContact CD2-CD1 3.92Å
450	H	89.8	Confident	95.8	Very high	138 Å²	138	69.7 Å²	69.7	64%	0.639	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-10.2	175.5	71.6	-83.5	0	0	0	114	R447 V448	R447-H450 PolarHBondContact O-CE1 3.35Å; R447-H450 PolarHBondContact O-ND1 3.15Å; R447-H450 VanDerWaalsContact O-ND1 3.13Å; V448-H450 PolarHBondContact O-N 3.15Å; V448-H450 VanDerWaalsContact O-N 3.17Å
451	R	87.1	Confident	95.8	Very high	170 Å²	170	69.6 Å²	69.6	64%	0.642	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.1	-15.6	179.2	-50	-169.9	-172.1	-167.9	0.1	114.4	V448 L449	V448-R451 PolarHBondContact O-N 3.41Å; L449-R451 PolarHBondContact O-N 2.95Å
452	R	89.6	Confident	95.8	Very high	147 Å²	147	67.7 Å²	67.7	56%	0.555	33%	0.333	S	S	*	.	S	Bend	trans	-135.2	137	-171.6	-64.1	-64.5	-164.3	169.6	4.9	110.2	T444 V448	T444-R452 HydrophobicContact CG2-CB 3.76Å; V448-R452 HydrophobicContact CG2-CB 4.46Å; V448-R452 HydrophobicContact CG2-CG 4.41Å; V448-R452 PolarHBondContact O-N 3.5Å
453	P	94.1	Very high	95.8	Very high	98 Å²	98	69 Å²	69	64%	0.636	34%	0.342	S	S	*	.			trans	-61.8	147.1	178.1	26.7	-34.7	0	0	0	111.5	T444 A455	T444-P453 PolarHBondContact OG1-O 3.36Å; P453-A455 PolarHBondContact O-N 3.31Å
454	L	96.7	Very high	95.8	Very high	123 Å²	123	64.5 Å²	64.5	64%	0.644	32%	0.323	S	S	*	.			trans	-66.1	114.3	175.1	178.1	63.9	0	0	0	109.8	L449	L449-L454 HydrophobicContact CD2-CB 4.18Å; L449-L454 HydrophobicContact CD2-CD1 3.92Å
455	A	96.8	Very high	95.9	Very high	36 Å²	36	68.3 Å²	68.3	30%	0.298	34%	0.34	S	S	.	.			trans	-142.6	150.6	174	0	0	0	0	0	109.4	K443 T444 P453	K443-A455 CarbonylContact C-O 3.58Å; K443-A455 WeakPolarHBondContact CA-O 3.42Å; T444-A455 PolarHBondContact N-O 3.37Å; T444-A455 PolarHBondContact OG1-N 3.05Å; T444-A455 VanDerWaalsContact OG1-N 3.14Å; T444-A455 PolarHBondContact OG1-O 2.97Å; P453-A455 PolarHBondContact O-N 3.31Å
456	V	97.4	Very high	95.9	Very high	87 Å²	87	69.5 Å²	69.5	53%	0.527	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	135.7	162.4	-176.1	0	0	0	0	107.3	D441 K443	D441-V456 HydrophobicContact CB-CG1 4.05Å; K443-V456 HydrophobicContact CG-CG2 3.81Å
457	R	96.8	Very high	96	Very high	75 Å²	75	71.5 Å²	71.5	28%	0.283	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	124.4	172.6	-62.9	-178.3	-172.9	76.3	3.5	109.2	Q442 T444	Q442-R457 PolarHBondContact N-O 2.98Å; Q442-R457 PolarHBondContact O-N 3.23Å; T444-R457 PolarHBondContact OG1-NH1 2.82Å
458	A	97.7	Very high	96.1	Very high	64 Å²	64	70.6 Å²	70.6	53%	0.529	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	134.3	165.4	0	0	0	0	0	109.1	I440	I440-A458 CarbonylContact O-C 3.46Å; I440-A458 WeakPolarHBondContact O-CA 3.42Å
459	R	97.9	Very high	96.3	Very high	53 Å²	53	72.7 Å²	72.7	20%	0.2	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	164.2	177.1	-69.5	-66.2	175.8	-113.6	27.4	109.9	K439 I440 A482 G483 T484	K439-R459 WeakPolarHBondContact CA-O 3.39Å; I440-R459 HydrophobicContact CD1-CB 4.27Å; I440-R459 HydrophobicContact CG1-CB 3.78Å; I440-R459 PolarHBondContact N-O 2.8Å; I440-R459 PolarHBondContact O-N 3.48Å; R459-A482 PolarHBondContact NE-O 3.36Å; R459-G483 PolarHBondContact NE-O 3.34Å; R459-T484 HydrophobicContact CB-CG2 4.21Å; R459-T484 HydrophobicContact CG-CG2 4.49Å
460	V	98.4	Very high	96.6	Very high	22 Å²	22	72.7 Å²	72.7	13%	0.133	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128.3	-179	-179	0	0	0	0	109.7	D437 L438 K439 T480 Q481	D437-V460 HydrophobicContact CB-CG1 4.01Å; L438-V460 WeakPolarHBondContact O-CA 3.27Å; K439-V460 HydrophobicContact CG-CG2 4.35Å; V460-T480 WeakPolarHBondContact O-CA 3.43Å; V460-Q481 HydrophobicContact CB-CB 4.37Å; V460-Q481 PolarHBondContact O-N 3.07Å
461	I	98.7	Very high	97	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	105.4	163.7	-44.9	-61	0	0	0	106.2	D437 L438 I440 M464 L478 T480 T484 F489	D437-I461 CarbonylContact C-O 3.56Å; D437-I461 VanDerWaalsContact CA-O 3.26Å; D437-I461 WeakPolarHBondContact CA-O 3.49Å; D437-I461 PolarHBondContact N-O 3.08Å; L438-I461 HydrophobicContact CB-CB 4.19Å; L438-I461 PolarHBondContact N-O 2.96Å; L438-I461 PolarHBondContact O-N 3.35Å; I440-I461 HydrophobicContact CD1-CD1 4.1Å; I440-I461 HydrophobicContact CD1-CG1 4.4Å; I440-I461 HydrophobicContact CG2-CG1 4.39Å; I461-M464 HydrophobicContact CG2-CG 3.74Å; I461-M464 HydrophobicContact CG2-SD 4.2Å; I461-L478 HydrophobicContact CD1-CD1 4.44Å; I461-L478 HydrophobicContact CG2-CB 4.31Å; I461-L478 HydrophobicContact CG2-CD1 4.24Å; I461-T480 HydrophobicContact CD1-CG2 3.52Å; I461-T480 HydrophobicContact CG2-CG2 4.36Å; I461-T484 HydrophobicContact CD1-CG2 3.82Å; I461-F489 HydrophobicContact CD1-CD1 4.1Å; I461-F489 HydrophobicContact CD1-CD2 4.42Å; I461-F489 HydrophobicContact CD1-CE1 4.22Å; I461-F489 HydrophobicContact CD1-CG 4.21Å; I461-F489 HydrophobicContact CD1-CZ 4.46Å; I461-F489 HydrophobicContact CG1-CD1 4.38Å; I461-F489 HydrophobicContact CG1-CD2 4.34Å; I461-F489 HydrophobicContact CG1-CE1 4.05Å; I461-F489 HydrophobicContact CG1-CE2 4.01Å; I461-F489 HydrophobicContact CG1-CZ 3.86Å
462	H	98.4	Very high	97.5	Very high	54 Å²	54	66.1 Å²	66.1	25%	0.25	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	-42.8	-173.6	-65.6	-64.5	0	0	0	111.9	K436 D437 K479	K436-H462 WeakPolarHBondContact CA-O 3.32Å; D437-H462 PolarHBondContact N-O 3.37Å; D437-H462 IonicContact OD1-CE1 2.65Å; D437-H462 IonicContact OD1-CG 3.1Å; D437-H462 IonicContact OD1-ND1 2.86Å; D437-H462 PolarHBondContact OD1-ND1 3.26Å; H462-K479 HydrophobicContact CB-CG 4.48Å; H462-K479 PolarHBondContact N-O 3.29Å
463	S	98.6	Very high	98	Very high	30 Å²	30	61.4 Å²	61.4	21%	0.21	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	154.5	176.6	61.6	0	0	0	0	111.6	L478 K479	S463-L478 VanDerWaalsContact O-CA 3.3Å; S463-L478 WeakPolarHBondContact O-CA 3.47Å; S463-K479 PolarHBondContact N-O 3.19Å; S463-K479 PolarHBondContact O-N 2.95Å
464	M	98.7	Very high	98.2	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	147.4	169.8	-73	-178.5	-64.7	0	0	109.1	L432 I435 L438 I461 L476 R477 L478 F489 I501	L432-M464 HydrophobicContact CD2-CE 4.21Å; I435-M464 HydrophobicContact CB-CE 3.76Å; I435-M464 HydrophobicContact CD1-CE 4.12Å; I435-M464 HydrophobicContact CG1-CE 4.48Å; I435-M464 HydrophobicContact CG2-CE 3.91Å; L438-M464 HydrophobicContact CD2-CE 4.41Å; I461-M464 HydrophobicContact CG2-CG 3.74Å; I461-M464 HydrophobicContact CG2-SD 4.2Å; M464-L476 HydrophobicContact CB-CD1 3.9Å; M464-L476 HydrophobicContact CG-CD1 4.05Å; M464-L476 HydrophobicContact SD-CD1 4.19Å; M464-L476 HydrophobicContact SD-CD2 4.31Å; M464-R477 CarbonylContact C-O 3.56Å; M464-R477 WeakPolarHBondContact CA-O 3.22Å; M464-L478 HydrophobicContact CG-CB 4.03Å; M464-F489 HydrophobicContact SD-CE1 3.93Å; M464-F489 HydrophobicContact SD-CZ 3.92Å; M464-I501 HydrophobicContact SD-CD1 4.1Å
465	E	98.6	Very high	98.3	Very high	81 Å²	81	55.8 Å²	55.8	38%	0.379	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	125	176.7	-73.7	168.2	-157.4	0	0	108.2	N433 R477	N433-E465 VanDerWaalsContact OD1-CA 3.28Å; N433-E465 WeakPolarHBondContact OD1-CA 3.32Å; E465-R477 HydrophobicContact CB-CB 4.18Å; E465-R477 VanDerWaalsContact CD-NH1 3.26Å; E465-R477 PolarHBondContact N-O 2.97Å; E465-R477 PolarHBondContact O-N 2.81Å; E465-R477 IonicContact OE1-NH1 2.7Å; E465-R477 PolarHBondContact OE1-NH1 3.4Å; E465-R477 VanDerWaalsContact OE1-NH1 3.1Å; E465-R477 WeakPolarHBondContact OE2-CD 3.33Å; E465-R477 IonicContact OE2-CZ 3.5Å; E465-R477 IonicContact OE2-NH1 3.28Å; E465-R477 PolarHBondContact OE2-NH1 2.93Å
466	T	98.6	Very high	98.4	Very high	24 Å²	24	54.1 Å²	54.1	15%	0.147	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	138.6	-174.1	61.1	0	0	0	0	113	I429 L432 N433 F474 R475 L476	I429-T466 HydrophobicContact CB-CG2 4.25Å; I429-T466 PolarHBondContact O-OG1 3.14Å; L432-T466 HydrophobicContact CB-CG2 3.78Å; L432-T466 HydrophobicContact CD1-CG2 3.93Å; L432-T466 HydrophobicContact CG-CG2 4.47Å; N433-T466 PolarHBondContact ND2-OG1 3.02Å; N433-T466 PolarHBondContact OD1-N 3.5Å; N433-T466 PolarHBondContact OD1-OG1 3.28Å; T466-F474 HydrophobicContact CG2-CD2 4.31Å; T466-F474 HydrophobicContact CG2-CE2 4.25Å; T466-R475 WeakPolarHBondContact CA-O 3.19Å; T466-L476 HydrophobicContact CG2-CD1 3.85Å
467	Q	98.6	Very high	98.5	Very high	119 Å²	119	55 Å²	55	56%	0.556	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.8	107.8	172	-61.2	175.7	0.2	0	0	109	F474 R475	Q467-F474 CarbonylContact O-C 3.6Å; Q467-F474 WeakPolarHBondContact O-CA 3.35Å; Q467-F474 WeakPolarHBondContact O-CB 3.36Å; Q467-R475 HydrophobicContact CB-CB 4.29Å; Q467-R475 PolarHBondContact N-O 3.04Å; Q467-R475 PolarHBondContact O-N 3.23Å
468	Y	98.7	Very high	98.5	Very high	75 Å²	75	51.5 Å²	51.5	29%	0.294	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	138.2	174.9	-178.1	-95.5	0	0	0	110.9	I424 K426 I429 D470 E471	I424-Y468 HydrophobicContact CG1-CE2 4.34Å; I424-Y468 PolarHBondContact O-OH 3.26Å; K426-Y468 HydrophobicContact CB-CD2 4.2Å; K426-Y468 HydrophobicContact CB-CG 4.07Å; K426-Y468 HydrophobicContact CG-CG 4.43Å; I429-Y468 HydrophobicContact CD1-CD2 4.27Å; Y468-D470 VanDerWaalsContact CE2-O 3.23Å; Y468-D470 WeakPolarHBondContact CE2-O 3.25Å; Y468-D470 VanDerWaalsContact CZ-C 3.41Å; Y468-D470 VanDerWaalsContact OH-C 3.25Å; Y468-D470 PolarHBondContact OH-O 3.3Å; Y468-E471 PolarHBondContact OH-N 3.29Å
469	V	98.5	Very high	98.6	Very high	67 Å²	67	51.8 Å²	51.8	41%	0.406	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	-59.4	176.6	177.7	0	0	0	0	109.8	H473 R475	V469-H473 HydrophobicContact CB-CB 4.11Å; V469-H473 WeakPolarHBondContact CB-O 3.2Å; V469-H473 HydrophobicContact CG1-CB 4.39Å; V469-H473 PolarHBondContact N-O 3.24Å; V469-R475 HydrophobicContact CG2-CG 4.46Å
470	D	98.4	Very high	98.6	Very high	63 Å²	63	49.2 Å²	49.2	34%	0.337	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	-174.9	178.3	64.4	61.9	0	0	0	110.7	Y468 H472 H473	Y468-D470 VanDerWaalsContact CE2-O 3.23Å; Y468-D470 WeakPolarHBondContact CE2-O 3.25Å; Y468-D470 VanDerWaalsContact CZ-C 3.41Å; Y468-D470 VanDerWaalsContact OH-C 3.25Å; Y468-D470 PolarHBondContact OH-O 3.3Å; D470-H472 PolarHBondContact O-N 3.09Å; D470-H472 VanDerWaalsContact O-N 3.09Å; D470-H472 PolarHBondContact OD1-N 3.22Å; D470-H473 VanDerWaalsContact CG-ND1 3.26Å; D470-H473 PolarHBondContact N-O 3.15Å; D470-H473 VanDerWaalsContact N-O 3.08Å; D470-H473 PolarHBondContact O-N 3.48Å; D470-H473 VanDerWaalsContact O-O 3.05Å; D470-H473 IonicContact OD1-CE1 3.86Å; D470-H473 IonicContact OD1-CG 3.61Å; D470-H473 PolarHBondContact OD1-N 2.82Å; D470-H473 VanDerWaalsContact OD1-N 3.12Å; D470-H473 IonicContact OD1-ND1 2.84Å; D470-H473 PolarHBondContact OD1-ND1 3.48Å; D470-H473 IonicContact OD2-CE1 3.99Å; D470-H473 IonicContact OD2-CG 3.65Å; D470-H473 IonicContact OD2-ND1 2.93Å; D470-H473 PolarHBondContact OD2-ND1 2.63Å
471	E	98.4	Very high	98.5	Very high	106 Å²	106	51 Å²	51	50%	0.495	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-19	-174.8	-61.9	-168.9	151.5	0	0	114	A423 I424 Y468	A423-E471 CarbonylContact C-O 3.45Å; A423-E471 WeakPolarHBondContact CA-O 3.38Å; A423-E471 HydrophobicContact CB-CB 4.32Å; I424-E471 VanDerWaalsContact CG1-O 3.27Å; I424-E471 WeakPolarHBondContact CG1-O 3.33Å; I424-E471 PolarHBondContact N-O 3.04Å; Y468-E471 PolarHBondContact OH-N 3.29Å
472	H	98.7	Very high	98.2	Very high	64 Å²	64	51.2 Å²	51.2	30%	0.296	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.5	2.4	178.4	-75.1	-81.9	0	0	0	113.6	W419 T420 D421 D470	W419-H472 CarbonylContact C-O 3.54Å; W419-H472 VanDerWaalsContact CA-O 3.28Å; W419-H472 WeakPolarHBondContact CA-O 3.18Å; T420-H472 PolarHBondContact N-O 2.91Å; T420-H472 PolarHBondContact O-ND1 2.92Å; D421-H472 PolarHBondContact O-CE1 2.96Å; D470-H472 PolarHBondContact O-N 3.09Å; D470-H472 VanDerWaalsContact O-N 3.09Å; D470-H472 PolarHBondContact OD1-N 3.22Å
473	H	98.8	Very high	98	Very high	47 Å²	47	50.9 Å²	50.9	22%	0.218	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	142.3	-175.5	-53.2	98.2	0	0	0	114.1	L417 I418 W419 V469 D470	L417-H473 HydrophobicContact CD1-CB 4.38Å; I418-H473 VanDerWaalsContact O-CA 3.31Å; I418-H473 WeakPolarHBondContact O-CA 3.27Å; W419-H473 AromaticContact CD1-NE2 3.55Å; V469-H473 HydrophobicContact CB-CB 4.11Å; V469-H473 WeakPolarHBondContact CB-O 3.2Å; V469-H473 HydrophobicContact CG1-CB 4.39Å; V469-H473 PolarHBondContact N-O 3.24Å; D470-H473 VanDerWaalsContact CG-ND1 3.26Å; D470-H473 PolarHBondContact N-O 3.15Å; D470-H473 VanDerWaalsContact N-O 3.08Å; D470-H473 PolarHBondContact O-N 3.48Å; D470-H473 VanDerWaalsContact O-O 3.05Å; D470-H473 IonicContact OD1-CE1 3.86Å; D470-H473 IonicContact OD1-CG 3.61Å; D470-H473 PolarHBondContact OD1-N 2.82Å; D470-H473 VanDerWaalsContact OD1-N 3.12Å; D470-H473 IonicContact OD1-ND1 2.84Å; D470-H473 PolarHBondContact OD1-ND1 3.48Å; D470-H473 IonicContact OD2-CE1 3.99Å; D470-H473 IonicContact OD2-CG 3.65Å; D470-H473 IonicContact OD2-ND1 2.93Å; D470-H473 PolarHBondContact OD2-ND1 2.63Å
474	F	98.8	Very high	97.9	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	156.2	165.6	69.7	-76.9	0	0	0	110.8	I418 T420 I424 I429 L432 T466 Q467 L476 I501 M505	I418-F474 HydrophobicContact CB-CD1 4.16Å; I418-F474 HydrophobicContact CB-CE1 3.81Å; I418-F474 HydrophobicContact CB-CE2 4.49Å; I418-F474 HydrophobicContact CB-CZ 4Å; I418-F474 HydrophobicContact CD1-CE1 4.5Å; I418-F474 HydrophobicContact CD1-CE2 4.02Å; I418-F474 HydrophobicContact CD1-CZ 3.82Å; I418-F474 HydrophobicContact CG1-CZ 4.46Å; I418-F474 HydrophobicContact CG2-CD1 4.29Å; I418-F474 HydrophobicContact CG2-CE1 3.57Å; I418-F474 HydrophobicContact CG2-CZ 3.89Å; I418-F474 PolarHBondContact N-O 3.35Å; I418-F474 PolarHBondContact O-N 2.99Å; I418-F474 VanDerWaalsContact O-N 3.13Å; T420-F474 HydrophobicContact CG2-CE1 4.03Å; I424-F474 HydrophobicContact CD1-CB 4.46Å; I424-F474 HydrophobicContact CD1-CD1 3.73Å; I424-F474 HydrophobicContact CD1-CE1 4.41Å; I424-F474 HydrophobicContact CD1-CG 4.43Å; I429-F474 HydrophobicContact CD1-CB 3.57Å; I429-F474 HydrophobicContact CD1-CD2 3.97Å; I429-F474 HydrophobicContact CD1-CG 3.86Å; I429-F474 HydrophobicContact CG2-CD1 4.11Å; I429-F474 HydrophobicContact CG2-CD2 4.24Å; I429-F474 HydrophobicContact CG2-CE1 4.14Å; I429-F474 HydrophobicContact CG2-CE2 4.26Å; I429-F474 HydrophobicContact CG2-CG 4.16Å; I429-F474 HydrophobicContact CG2-CZ 4.21Å; L432-F474 HydrophobicContact CD1-CE2 4.13Å; L432-F474 HydrophobicContact CD1-CZ 4.3Å; T466-F474 HydrophobicContact CG2-CD2 4.31Å; T466-F474 HydrophobicContact CG2-CE2 4.25Å; Q467-F474 CarbonylContact O-C 3.6Å; Q467-F474 WeakPolarHBondContact O-CA 3.35Å; Q467-F474 WeakPolarHBondContact O-CB 3.36Å; F474-L476 HydrophobicContact CD2-CB 4.47Å; F474-L476 HydrophobicContact CE2-CB 4.06Å; F474-L476 HydrophobicContact CE2-CD1 4.43Å; F474-I501 HydrophobicContact CZ-CG2 4.09Å; F474-M505 HydrophobicContact CE1-CE 3.94Å; F474-M505 HydrophobicContact CE1-SD 3.89Å; F474-M505 HydrophobicContact CZ-CE 4.29Å; F474-M505 HydrophobicContact CZ-SD 3.67Å
475	R	98.8	Very high	97.9	Very high	104 Å²	104	52.5 Å²	52.5	39%	0.392	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	136.1	166	-71.9	-170.8	175.6	90.5	5.3	110.5	A416 L417 T466 Q467 V469	A416-R475 CarbonylContact O-C 3.46Å; A416-R475 VanDerWaalsContact O-CA 3.25Å; A416-R475 WeakPolarHBondContact O-CA 3.2Å; L417-R475 HydrophobicContact CD1-CG 4.02Å; T466-R475 WeakPolarHBondContact CA-O 3.19Å; Q467-R475 HydrophobicContact CB-CB 4.29Å; Q467-R475 PolarHBondContact N-O 3.04Å; Q467-R475 PolarHBondContact O-N 3.23Å; V469-R475 HydrophobicContact CG2-CG 4.46Å
476	L	98.8	Very high	97.9	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	111.1	172.2	-177.9	70.7	0	0	0	108.7	A416 I418 M464 T466 F474 L478 I501	A416-L476 PolarHBondContact N-O 3.11Å; A416-L476 PolarHBondContact O-N 3.1Å; I418-L476 HydrophobicContact CD1-CB 3.59Å; I418-L476 HydrophobicContact CD1-CD2 3.68Å; I418-L476 HydrophobicContact CD1-CG 4.28Å; I418-L476 HydrophobicContact CG1-CB 4.37Å; M464-L476 HydrophobicContact CB-CD1 3.9Å; M464-L476 HydrophobicContact CG-CD1 4.05Å; M464-L476 HydrophobicContact SD-CD1 4.19Å; M464-L476 HydrophobicContact SD-CD2 4.31Å; T466-L476 HydrophobicContact CG2-CD1 3.85Å; F474-L476 HydrophobicContact CD2-CB 4.47Å; F474-L476 HydrophobicContact CE2-CB 4.06Å; F474-L476 HydrophobicContact CE2-CD1 4.43Å; L476-L478 HydrophobicContact CD2-CD1 4.42Å; L476-L478 HydrophobicContact CD2-CD2 4.29Å; L476-L478 HydrophobicContact CG-CD2 4.23Å; L476-I501 HydrophobicContact CD2-CD1 3.68Å; L476-I501 HydrophobicContact CD2-CG1 4.11Å
477	R	98.7	Very high	97.9	Very high	107 Å²	107	49 Å²	49	40%	0.404	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	132.3	165.6	178.3	174.5	-178.2	-106.1	-0.1	108	T413 Y414 M464 E465	T413-R477 HydrophobicContact CG2-CG 4.27Å; Y414-R477 CarbonylContact O-C 3.56Å; Y414-R477 VanDerWaalsContact O-CA 3.27Å; Y414-R477 WeakPolarHBondContact O-CA 3.44Å; M464-R477 CarbonylContact C-O 3.56Å; M464-R477 WeakPolarHBondContact CA-O 3.22Å; E465-R477 HydrophobicContact CB-CB 4.18Å; E465-R477 VanDerWaalsContact CD-NH1 3.26Å; E465-R477 PolarHBondContact N-O 2.97Å; E465-R477 PolarHBondContact O-N 2.81Å; E465-R477 IonicContact OE1-NH1 2.7Å; E465-R477 PolarHBondContact OE1-NH1 3.4Å; E465-R477 VanDerWaalsContact OE1-NH1 3.1Å; E465-R477 WeakPolarHBondContact OE2-CD 3.33Å; E465-R477 IonicContact OE2-CZ 3.5Å; E465-R477 IonicContact OE2-NH1 3.28Å; E465-R477 PolarHBondContact OE2-NH1 2.93Å
478	L	98.4	Very high	97.9	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	143.1	-175.5	68.1	164.3	0	0	0	113	T413 Y414 I461 S463 M464 L476 T480 I486 F489	T413-L478 CarbonylContact C-O 3.6Å; T413-L478 WeakPolarHBondContact CA-O 3.35Å; Y414-L478 PolarHBondContact N-O 3.42Å; Y414-L478 PolarHBondContact O-N 3.05Å; I461-L478 HydrophobicContact CD1-CD1 4.44Å; I461-L478 HydrophobicContact CG2-CB 4.31Å; I461-L478 HydrophobicContact CG2-CD1 4.24Å; S463-L478 VanDerWaalsContact O-CA 3.3Å; S463-L478 WeakPolarHBondContact O-CA 3.47Å; M464-L478 HydrophobicContact CG-CB 4.03Å; L476-L478 HydrophobicContact CD2-CD1 4.42Å; L476-L478 HydrophobicContact CD2-CD2 4.29Å; L476-L478 HydrophobicContact CG-CD2 4.23Å; L478-T480 HydrophobicContact CD1-CG2 3.89Å; L478-T480 HydrophobicContact CG-CG2 4.17Å; L478-I486 HydrophobicContact CD1-CD1 4.28Å; L478-I486 HydrophobicContact CD1-CG2 4.21Å; L478-I486 HydrophobicContact CD2-CG2 4.17Å; L478-F489 HydrophobicContact CD1-CD1 3.94Å; L478-F489 HydrophobicContact CD1-CE1 4.04Å
479	K	98.6	Very high	97.9	Very high	69 Å²	69	39.9 Å²	39.9	30%	0.3	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127.5	174.3	-175.6	167	-175.4	155.1	0	109.7	T411 H462 S463 D520	T411-K479 VanDerWaalsContact CB-CE 3.42Å; T411-K479 WeakPolarHBondContact OG1-CE 3.27Å; T411-K479 PolarHBondContact OG1-NZ 2.95Å; H462-K479 HydrophobicContact CB-CG 4.48Å; H462-K479 PolarHBondContact N-O 3.29Å; S463-K479 PolarHBondContact N-O 3.19Å; S463-K479 PolarHBondContact O-N 2.95Å; K479-D520 WeakPolarHBondContact CE-OD2 3.4Å; K479-D520 IonicContact NZ-OD2 3.2Å; K479-D520 PolarHBondContact NZ-OD2 3.02Å
480	T	98.2	Very high	97.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	157.8	-173.2	76.7	0	0	0	0	113.3	T411 K412 Y414 V460 I461 L478 T484 I486	T411-T480 WeakPolarHBondContact CA-O 3.46Å; T411-T480 WeakPolarHBondContact CB-O 3.37Å; K412-T480 PolarHBondContact N-O 3.46Å; K412-T480 VanDerWaalsContact N-O 3.13Å; K412-T480 PolarHBondContact O-N 2.7Å; Y414-T480 HydrophobicContact CD2-CG2 4.42Å; V460-T480 WeakPolarHBondContact O-CA 3.43Å; I461-T480 HydrophobicContact CD1-CG2 3.52Å; I461-T480 HydrophobicContact CG2-CG2 4.36Å; L478-T480 HydrophobicContact CD1-CG2 3.89Å; L478-T480 HydrophobicContact CG-CG2 4.17Å; T480-T484 HydrophobicContact CG2-CG2 4.39Å; T480-I486 HydrophobicContact CG2-CD1 3.61Å
481	Q	97.1	Very high	97.9	Very high	60 Å²	60	36.6 Å²	36.6	28%	0.28	17%	0.172	S	C	.	.			trans	-55.7	151.4	162.2	-168.8	-175.1	116	0	0	110.8	V460 T484	V460-Q481 HydrophobicContact CB-CB 4.37Å; V460-Q481 PolarHBondContact O-N 3.07Å; Q481-T484 WeakPolarHBondContact O-CB 3.49Å; Q481-T484 PolarHBondContact O-OG1 3.49Å
482	A	92.6	Very high	97.9	Very high	4 Å²	4	31.6 Å²	31.6	3%	0.033	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	142.8	171.3	0	0	0	0	0	113.8	E407 E408 R459 T484	E407-A482 WeakPolarHBondContact O-CB 3.49Å; E408-A482 WeakPolarHBondContact O-CB 3.42Å; R459-A482 PolarHBondContact NE-O 3.36Å; A482-T484 VanDerWaalsContact C-N 3.27Å; A482-T484 PolarHBondContact O-N 2.74Å
483	G	93.5	Very high	97.9	Very high	46 Å²	46	28.7 Å²	28.7	47%	0.474	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	29.6	177.1	0	0	0	0	0	114.6	R459	R459-G483 PolarHBondContact NE-O 3.34Å
484	T	97.4	Very high	97.8	Very high	8 Å²	8	35.2 Å²	35.2	5%	0.049	16%	0.163	C	C	.	.			trans	-83.9	136.5	167.5	-53.4	0	0	0	0	109.1	I440 R459 I461 T480 Q481 A482 I486	I440-T484 HydrophobicContact CD1-CG2 4.07Å; R459-T484 HydrophobicContact CB-CG2 4.21Å; R459-T484 HydrophobicContact CG-CG2 4.49Å; I461-T484 HydrophobicContact CD1-CG2 3.82Å; T480-T484 HydrophobicContact CG2-CG2 4.39Å; Q481-T484 WeakPolarHBondContact O-CB 3.49Å; Q481-T484 PolarHBondContact O-OG1 3.49Å; A482-T484 VanDerWaalsContact C-N 3.27Å; A482-T484 PolarHBondContact O-N 2.74Å; T484-I486 HydrophobicContact CG2-CD1 4.15Å
485	Y	97.8	Very high	97.8	Very high	58 Å²	58	36.9 Å²	36.9	23%	0.227	18%	0.181	C	C	.	.			trans	-98.6	95.9	-177.7	-73	-73.7	0	0	0	109.1	Q442 P445 K487 E488 F489	Q442-Y485 PolarHBondContact OE1-O 3.12Å; P445-Y485 VanDerWaalsContact CD-CD2 3.42Å; P445-Y485 VanDerWaalsContact CD-CE2 3.43Å; P445-Y485 HydrophobicContact CG-CD1 3.99Å; P445-Y485 HydrophobicContact CG-CD2 3.42Å; P445-Y485 VanDerWaalsContact CG-CD2 3.42Å; P445-Y485 HydrophobicContact CG-CE1 4.35Å; P445-Y485 HydrophobicContact CG-CE2 3.86Å; P445-Y485 HydrophobicContact CG-CG 3.52Å; Y485-K487 PolarHBondContact O-N 3.41Å; Y485-E488 WeakPolarHBondContact CB-OE2 3.44Å; Y485-E488 PolarHBondContact O-N 2.76Å; Y485-F489 PolarHBondContact O-N 3.01Å
486	I	98.6	Very high	97.8	Very high	6 Å²	6	33.9 Å²	33.9	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-62.6	-40.6	-167	-51.1	-54.5	0	0	0	112.9	Y414 L478 T480 T484 E488 F489 V490 L514	Y414-I486 HydrophobicContact CD1-CG1 3.83Å; Y414-I486 HydrophobicContact CD2-CD1 3.69Å; Y414-I486 HydrophobicContact CD2-CG1 3.78Å; Y414-I486 HydrophobicContact CE1-CG1 3.81Å; Y414-I486 HydrophobicContact CE2-CD1 3.66Å; Y414-I486 HydrophobicContact CE2-CG1 3.8Å; Y414-I486 HydrophobicContact CG-CD1 4.21Å; Y414-I486 HydrophobicContact CG-CG1 3.8Å; L478-I486 HydrophobicContact CD1-CD1 4.28Å; L478-I486 HydrophobicContact CD1-CG2 4.21Å; L478-I486 HydrophobicContact CD2-CG2 4.17Å; T480-I486 HydrophobicContact CG2-CD1 3.61Å; T484-I486 HydrophobicContact CG2-CD1 4.15Å; I486-E488 VanDerWaalsContact C-N 3.34Å; I486-E488 PolarHBondContact O-N 3.09Å; I486-F489 PolarHBondContact O-N 2.89Å; I486-V490 PolarHBondContact O-N 3.01Å; I486-V490 VanDerWaalsContact O-N 3.13Å; I486-L514 HydrophobicContact CB-CD1 4.2Å; I486-L514 HydrophobicContact CB-CD2 4.01Å; I486-L514 HydrophobicContact CG2-CD1 3.74Å; I486-L514 HydrophobicContact CG2-CD2 4.35Å
487	K	98.6	Very high	97.8	Very high	25 Å²	25	33.9 Å²	33.9	11%	0.109	17%	0.169	C	C	.	.	H	α-helix	trans	-57.9	-50.6	178.1	-58.2	-175.9	178.4	172.9	0	110.1	D344 D346 Y485 F489 V490 H491 I511 L514	D344-K487 WeakPolarHBondContact OD2-CE 3.48Å; D344-K487 IonicContact OD2-NZ 3.04Å; D344-K487 PolarHBondContact OD2-NZ 3.49Å; D346-K487 IonicContact OD1-NZ 3.95Å; D346-K487 PolarHBondContact OD1-NZ 3.24Å; D346-K487 IonicContact OD2-NZ 3.96Å; D346-K487 PolarHBondContact OD2-NZ 2.79Å; Y485-K487 PolarHBondContact O-N 3.41Å; K487-F489 VanDerWaalsContact C-N 3.28Å; K487-F489 PolarHBondContact O-N 2.93Å; K487-V490 WeakPolarHBondContact O-CA 3.44Å; K487-V490 WeakPolarHBondContact O-CB 3.47Å; K487-V490 PolarHBondContact O-N 2.99Å; K487-H491 PolarHBondContact O-CD2 2.85Å; K487-H491 PolarHBondContact O-N 3.33Å; K487-I511 HydrophobicContact CB-CG2 3.84Å; K487-I511 HydrophobicContact CD-CG2 4.46Å; K487-I511 HydrophobicContact CG-CD1 4.27Å; K487-I511 HydrophobicContact CG-CG2 3.87Å; K487-L514 HydrophobicContact CG-CD2 3.99Å
488	E	98.6	Very high	97.7	Very high	3 Å²	3	35.3 Å²	35.3	1%	0.014	18%	0.179	C	C	.	.	H	α-helix	trans	-69.4	-18.8	180	-68.9	80.5	179.3	0	0	114.5	P445 R447 Y485 I486 G492 D493 T497	P445-E488 HydrophobicContact CB-CG 3.73Å; P445-E488 WeakPolarHBondContact CB-OE1 3.32Å; P445-E488 HydrophobicContact CG-CB 4.42Å; P445-E488 HydrophobicContact CG-CG 3.78Å; R447-E488 WeakPolarHBondContact CD-OE1 3.29Å; R447-E488 IonicContact CZ-OE1 3.72Å; R447-E488 IonicContact NE-OE1 2.7Å; R447-E488 PolarHBondContact NE-OE1 3.18Å; R447-E488 IonicContact NE-OE2 3.73Å; R447-E488 IonicContact NH2-OE1 2.67Å; R447-E488 IonicContact NH2-OE2 3.87Å; Y485-E488 WeakPolarHBondContact CB-OE2 3.44Å; Y485-E488 PolarHBondContact O-N 2.76Å; I486-E488 VanDerWaalsContact C-N 3.34Å; I486-E488 PolarHBondContact O-N 3.09Å; E488-G492 CarbonylContact O-C 3.58Å; E488-G492 WeakPolarHBondContact O-CA 3.28Å; E488-G492 PolarHBondContact O-N 3.47Å; E488-G492 VanDerWaalsContact O-N 3.1Å; E488-D493 HydrophobicContact CB-CB 4.06Å; E488-D493 HydrophobicContact CG-CB 3.79Å; E488-T497 WeakPolarHBondContact O-CB 3.42Å; E488-T497 PolarHBondContact O-OG1 2.96Å; E488-T497 VanDerWaalsContact O-OG1 3.09Å
489	F	98.8	Very high	97.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-76.4	-27.6	166.2	172.9	-112.5	0	0	0	112.6	L438 I440 I461 M464 L478 Y485 I486 K487 N500 I501 L504	L438-F489 HydrophobicContact CD2-CE2 3.95Å; L438-F489 HydrophobicContact CD2-CZ 4.02Å; I440-F489 HydrophobicContact CD1-CB 4.27Å; I440-F489 HydrophobicContact CD1-CD2 3.75Å; I440-F489 HydrophobicContact CD1-CG 4.23Å; I440-F489 HydrophobicContact CG2-CD2 4.09Å; I440-F489 HydrophobicContact CG2-CE2 3.94Å; I461-F489 HydrophobicContact CD1-CD1 4.1Å; I461-F489 HydrophobicContact CD1-CD2 4.42Å; I461-F489 HydrophobicContact CD1-CE1 4.22Å; I461-F489 HydrophobicContact CD1-CG 4.21Å; I461-F489 HydrophobicContact CD1-CZ 4.46Å; I461-F489 HydrophobicContact CG1-CD1 4.38Å; I461-F489 HydrophobicContact CG1-CD2 4.34Å; I461-F489 HydrophobicContact CG1-CE1 4.05Å; I461-F489 HydrophobicContact CG1-CE2 4.01Å; I461-F489 HydrophobicContact CG1-CZ 3.86Å; M464-F489 HydrophobicContact SD-CE1 3.93Å; M464-F489 HydrophobicContact SD-CZ 3.92Å; L478-F489 HydrophobicContact CD1-CD1 3.94Å; L478-F489 HydrophobicContact CD1-CE1 4.04Å; Y485-F489 PolarHBondContact O-N 3.01Å; I486-F489 PolarHBondContact O-N 2.89Å; K487-F489 VanDerWaalsContact C-N 3.28Å; K487-F489 PolarHBondContact O-N 2.93Å; F489-N500 CarbonylContact O-C 3.52Å; F489-N500 WeakPolarHBondContact O-CA 3.4Å; F489-N500 WeakPolarHBondContact O-CB 3.38Å; F489-I501 HydrophobicContact CD1-CG1 4.32Å; F489-I501 HydrophobicContact CE1-CD1 3.69Å; F489-I501 HydrophobicContact CE1-CG1 3.93Å; F489-I501 HydrophobicContact CZ-CD1 3.81Å; F489-I501 HydrophobicContact CZ-CG1 4.24Å; F489-I501 PolarHBondContact O-N 3.05Å; F489-L504 HydrophobicContact CZ-CD1 4.48Å
490	V	98.8	Very high	97.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-76.5	-65.2	173	177	0	0	0	0	110.9	I418 I486 K487 G492 I501 A509 I511	I418-V490 HydrophobicContact CB-CG1 4.47Å; I418-V490 HydrophobicContact CD1-CB 4.48Å; I418-V490 HydrophobicContact CD1-CG1 3.92Å; I418-V490 HydrophobicContact CD1-CG2 3.7Å; I418-V490 HydrophobicContact CG1-CG1 3.95Å; I418-V490 HydrophobicContact CG1-CG2 4.15Å; I418-V490 HydrophobicContact CG2-CG1 3.86Å; I486-V490 PolarHBondContact O-N 3.01Å; I486-V490 VanDerWaalsContact O-N 3.13Å; K487-V490 WeakPolarHBondContact O-CA 3.44Å; K487-V490 WeakPolarHBondContact O-CB 3.47Å; K487-V490 PolarHBondContact O-N 2.99Å; V490-G492 VanDerWaalsContact C-N 3.31Å; V490-G492 PolarHBondContact O-N 3.31Å; V490-I501 HydrophobicContact CG2-CG1 4.28Å; V490-A509 HydrophobicContact CG1-CB 4.19Å; V490-I511 HydrophobicContact CB-CB 4.24Å; V490-I511 HydrophobicContact CG1-CB 4.14Å; V490-I511 HydrophobicContact CG2-CB 4.47Å; V490-I511 HydrophobicContact CG2-CD1 4.16Å
491	H	98.6	Very high	97.7	Very high	61 Å²	61	34.6 Å²	34.6	28%	0.282	18%	0.18	S	C	.	.	S	Bend	trans	-83.5	-3.2	-172.9	71.5	82.1	0	0	0	114.4	K487 D493 A509	K487-H491 PolarHBondContact O-CD2 2.85Å; K487-H491 PolarHBondContact O-N 3.33Å; H491-D493 WeakPolarHBondContact CE1-CA 3.44Å; H491-D493 PolarHBondContact CE1-N 3.37Å; H491-D493 PolarHBondContact ND1-N 3.01Å; H491-D493 VanDerWaalsContact ND1-N 3.17Å; H491-D493 WeakPolarHBondContact NE2-CA 3.44Å; H491-D493 VanDerWaalsContact NE2-CB 3.32Å; H491-D493 WeakPolarHBondContact NE2-CB 3.28Å; H491-D493 IonicContact NE2-OD1 3.62Å; H491-D493 PolarHBondContact NE2-OD1 3.49Å; H491-D493 VanDerWaalsContact NE2-OD1 3.11Å; H491-D493 PolarHBondContact O-N 2.93Å; H491-D493 VanDerWaalsContact O-N 3.08Å; H491-A509 VanDerWaalsContact CA-O 3.29Å; H491-A509 WeakPolarHBondContact CA-O 3.18Å; H491-A509 WeakPolarHBondContact CB-O 3.44Å
492	G	98.3	Very high	97.8	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.01	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	-3.2	174	0	0	0	0	0	116.6	E488 V490 F494 G495 R496 T497 N500	E488-G492 CarbonylContact O-C 3.58Å; E488-G492 WeakPolarHBondContact O-CA 3.28Å; E488-G492 PolarHBondContact O-N 3.47Å; E488-G492 VanDerWaalsContact O-N 3.1Å; V490-G492 VanDerWaalsContact C-N 3.31Å; V490-G492 PolarHBondContact O-N 3.31Å; G492-F494 PolarHBondContact O-N 3.19Å; G492-G495 CarbonylContact O-C 3.54Å; G492-G495 WeakPolarHBondContact O-CA 3.47Å; G492-G495 PolarHBondContact O-N 2.86Å; G492-R496 PolarHBondContact O-N 3.4Å; G492-T497 PolarHBondContact O-N 3Å; G492-T497 VanDerWaalsContact O-N 3.09Å; G492-N500 VanDerWaalsContact CA-CG 3.47Å; G492-N500 WeakPolarHBondContact CA-ND2 3.48Å
493	D	98.3	Very high	98	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.016	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	48	52.7	-179.1	-168	33.6	0	0	0	112.6	L446 E488 H491 G495 R496	L446-D493 WeakPolarHBondContact CD1-OD1 3.3Å; L446-D493 WeakPolarHBondContact CG-OD1 3.49Å; L446-D493 PolarHBondContact N-OD2 3.21Å; E488-D493 HydrophobicContact CB-CB 4.06Å; E488-D493 HydrophobicContact CG-CB 3.79Å; H491-D493 WeakPolarHBondContact CE1-CA 3.44Å; H491-D493 PolarHBondContact CE1-N 3.37Å; H491-D493 PolarHBondContact ND1-N 3.01Å; H491-D493 VanDerWaalsContact ND1-N 3.17Å; H491-D493 WeakPolarHBondContact NE2-CA 3.44Å; H491-D493 VanDerWaalsContact NE2-CB 3.32Å; H491-D493 WeakPolarHBondContact NE2-CB 3.28Å; H491-D493 IonicContact NE2-OD1 3.62Å; H491-D493 PolarHBondContact NE2-OD1 3.49Å; H491-D493 VanDerWaalsContact NE2-OD1 3.11Å; H491-D493 PolarHBondContact O-N 2.93Å; H491-D493 VanDerWaalsContact O-N 3.08Å; D493-G495 VanDerWaalsContact C-N 3.25Å; D493-G495 PolarHBondContact O-N 2.96Å; D493-R496 HydrophobicContact CB-CB 4.11Å; D493-R496 WeakPolarHBondContact O-CB 3.45Å; D493-R496 WeakPolarHBondContact O-CD 3.34Å; D493-R496 WeakPolarHBondContact O-CG 3.29Å; D493-R496 PolarHBondContact O-N 2.88Å; D493-R496 VanDerWaalsContact O-N 3.08Å; D493-R496 IonicContact OD2-CZ 2.61Å; D493-R496 IonicContact OD2-NE 2.75Å; D493-R496 IonicContact OD2-NH1 3.88Å; D493-R496 PolarHBondContact OD2-NH1 3.01Å
494	F	97.8	Very high	98.3	Very high	183 Å²	183	35.4 Å²	35.4	80%	0.803	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	37.3	-173.7	-52	-82	0	0	0	113.5	L446 G492	L446-F494 HydrophobicContact CD1-CD2 3.7Å; L446-F494 HydrophobicContact CD1-CE2 4.07Å; G492-F494 PolarHBondContact O-N 3.19Å
495	G	97.5	Very high	98.3	Very high	35 Å²	35	36.2 Å²	36.2	36%	0.361	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	16.2	-178.6	0	0	0	0	0	114.5	G492 D493 K498	G492-G495 CarbonylContact O-C 3.54Å; G492-G495 WeakPolarHBondContact O-CA 3.47Å; G492-G495 PolarHBondContact O-N 2.86Å; D493-G495 VanDerWaalsContact C-N 3.25Å; D493-G495 PolarHBondContact O-N 2.96Å; G495-K498 WeakPolarHBondContact O-CE 3.34Å
496	R	98.4	Very high	98.3	Very high	42 Å²	42	39.6 Å²	39.6	16%	0.158	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-13.1	174.1	-63.1	173.1	81.1	-95.3	3	113.3	K443 T444 G492 D493	K443-R496 HydrophobicContact CB-CB 4.17Å; K443-R496 WeakPolarHBondContact CB-O 3.34Å; K443-R496 HydrophobicContact CD-CB 4.32Å; K443-R496 PolarHBondContact N-O 2.91Å; T444-R496 VanDerWaalsContact O-CZ 3.28Å; T444-R496 PolarHBondContact O-NH1 2.98Å; T444-R496 PolarHBondContact O-NH2 3.37Å; G492-R496 PolarHBondContact O-N 3.4Å; D493-R496 HydrophobicContact CB-CB 4.11Å; D493-R496 WeakPolarHBondContact O-CB 3.45Å; D493-R496 WeakPolarHBondContact O-CD 3.34Å; D493-R496 WeakPolarHBondContact O-CG 3.29Å; D493-R496 PolarHBondContact O-N 2.88Å; D493-R496 VanDerWaalsContact O-N 3.08Å; D493-R496 IonicContact OD2-CZ 2.61Å; D493-R496 IonicContact OD2-NE 2.75Å; D493-R496 IonicContact OD2-NH1 3.88Å; D493-R496 PolarHBondContact OD2-NH1 3.01Å
497	T	98.7	Very high	98.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.2	166.7	-52.4	0	0	0	0	109.6	I440 D441 Q442 E488 G492 N500	I440-T497 HydrophobicContact CD1-CG2 4.12Å; D441-T497 WeakPolarHBondContact O-CA 3.31Å; Q442-T497 HydrophobicContact CB-CG2 4.19Å; Q442-T497 HydrophobicContact CG-CG2 4.03Å; E488-T497 WeakPolarHBondContact O-CB 3.42Å; E488-T497 PolarHBondContact O-OG1 2.96Å; E488-T497 VanDerWaalsContact O-OG1 3.09Å; G492-T497 PolarHBondContact O-N 3Å; G492-T497 VanDerWaalsContact O-N 3.09Å; T497-N500 PolarHBondContact O-ND2 3.5Å
498	K	98	Very high	98.2	Very high	137 Å²	137	43.1 Å²	43.1	60%	0.596	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-142.8	134.9	-179.2	-63.3	-168.9	-178.5	-169.3	0	112.8	I440 D441 G495	I440-K498 CarbonylContact C-O 3.58Å; I440-K498 WeakPolarHBondContact CA-O 3.37Å; D441-K498 PolarHBondContact N-O 3.21Å; D441-K498 PolarHBondContact O-N 3.4Å; G495-K498 WeakPolarHBondContact O-CE 3.34Å
499	P	98.2	Very high	98.2	Very high	40 Å²	40	43.2 Å²	43.2	26%	0.26	23%	0.233	S	C	.	.	S	Bend	cis	-62.3	166.4	-19.3	27	-33.6	0	0	0	112.3	L438 K439 I440 L504	L438-P499 HydrophobicContact CD1-CG 3.87Å; L438-P499 HydrophobicContact CD2-CG 4.13Å; L438-P499 HydrophobicContact CG-CG 4.16Å; K439-P499 WeakPolarHBondContact O-CD 3.39Å; I440-P499 HydrophobicContact CG2-CG 4.1Å; P499-L504 HydrophobicContact CB-CD2 4.08Å; P499-L504 HydrophobicContact CB-CG 4.22Å
500	N	98.8	Very high	98.2	Very high	15 Å²	15	46.7 Å²	46.7	8%	0.08	25%	0.251	C	S	.	.			trans	-141.6	163.7	176.4	61.3	66.1	0	0	0	109.6	F489 G492 T497 G502 S503 L504	F489-N500 CarbonylContact O-C 3.52Å; F489-N500 WeakPolarHBondContact O-CA 3.4Å; F489-N500 WeakPolarHBondContact O-CB 3.38Å; G492-N500 VanDerWaalsContact CA-CG 3.47Å; G492-N500 WeakPolarHBondContact CA-ND2 3.48Å; T497-N500 PolarHBondContact O-ND2 3.5Å; N500-G502 PolarHBondContact O-N 3.02Å; N500-G502 PolarHBondContact OD1-N 3.31Å; N500-S503 PolarHBondContact N-OG 3.26Å; N500-S503 PolarHBondContact O-N 2.95Å; N500-S503 VanDerWaalsContact O-N 3.09Å; N500-S503 PolarHBondContact O-OG 2.85Å; N500-S503 WeakPolarHBondContact OD1-CB 3.32Å; N500-S503 PolarHBondContact OD1-N 3.43Å; N500-S503 PolarHBondContact OD1-OG 2.71Å; N500-L504 WeakPolarHBondContact O-CG 3.43Å; N500-L504 PolarHBondContact O-N 3.27Å
501	I	98.6	Very high	98.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-54.9	-47.4	-175.1	-63.9	-62.6	0	0	0	112.3	I418 L432 M464 F474 L476 F489 V490 S503 L504 M505 A509	I418-I501 HydrophobicContact CD1-CG1 4.35Å; I418-I501 HydrophobicContact CD1-CG2 4.37Å; L432-I501 HydrophobicContact CD1-CD1 4.45Å; L432-I501 HydrophobicContact CD2-CD1 4.45Å; M464-I501 HydrophobicContact SD-CD1 4.1Å; F474-I501 HydrophobicContact CZ-CG2 4.09Å; L476-I501 HydrophobicContact CD2-CD1 3.68Å; L476-I501 HydrophobicContact CD2-CG1 4.11Å; F489-I501 HydrophobicContact CD1-CG1 4.32Å; F489-I501 HydrophobicContact CE1-CD1 3.69Å; F489-I501 HydrophobicContact CE1-CG1 3.93Å; F489-I501 HydrophobicContact CZ-CD1 3.81Å; F489-I501 HydrophobicContact CZ-CG1 4.24Å; F489-I501 PolarHBondContact O-N 3.05Å; V490-I501 HydrophobicContact CG2-CG1 4.28Å; I501-S503 VanDerWaalsContact C-N 3.33Å; I501-S503 PolarHBondContact O-N 3.47Å; I501-L504 HydrophobicContact CD1-CD1 4.49Å; I501-L504 PolarHBondContact O-N 2.83Å; I501-L504 VanDerWaalsContact O-N 3.12Å; I501-M505 HydrophobicContact CG2-SD 3.72Å; I501-M505 PolarHBondContact O-N 3.33Å; I501-A509 HydrophobicContact CG2-CB 4.11Å
502	G	97.9	Very high	98.2	Very high	8 Å²	8	49.4 Å²	49.4	8%	0.082	27%	0.267	C	S	.	.	H	α-helix	trans	-56.6	-44.4	177.1	0	0	0	0	0	113.1	N500 L504 N506 V507	N500-G502 PolarHBondContact O-N 3.02Å; N500-G502 PolarHBondContact OD1-N 3.31Å; G502-L504 PolarHBondContact O-N 3.46Å; G502-N506 WeakPolarHBondContact O-CA 3.24Å; G502-N506 PolarHBondContact O-N 3.43Å; G502-V507 CarbonylContact C-O 3.45Å; G502-V507 VanDerWaalsContact C-O 3.29Å; G502-V507 WeakPolarHBondContact CA-O 3.46Å; G502-V507 PolarHBondContact O-N 2.74Å; G502-V507 VanDerWaalsContact O-O 3.08Å
503	S	97.7	Very high	98.2	Very high	69 Å²	69	52.7 Å²	52.7	48%	0.483	28%	0.282	S	S	.	.	H	α-helix	trans	-70	-27.8	176.9	68.2	0	0	0	0	114.5	N500 I501	N500-S503 PolarHBondContact N-OG 3.26Å; N500-S503 PolarHBondContact O-N 2.95Å; N500-S503 VanDerWaalsContact O-N 3.09Å; N500-S503 PolarHBondContact O-OG 2.85Å; N500-S503 WeakPolarHBondContact OD1-CB 3.32Å; N500-S503 PolarHBondContact OD1-N 3.43Å; N500-S503 PolarHBondContact OD1-OG 2.71Å; I501-S503 VanDerWaalsContact C-N 3.33Å; I501-S503 PolarHBondContact O-N 3.47Å
504	L	98.4	Very high	98.2	Very high	49 Å²	49	53.1 Å²	53.1	26%	0.257	28%	0.284	S	S	.	.	H	α-helix	trans	-75.9	-39.5	176.6	-70.9	168.9	0	0	0	111.4	F431 L432 I435 L438 F489 P499 N500 I501 G502	F431-L504 HydrophobicContact CE2-CB 4.43Å; F431-L504 HydrophobicContact CZ-CB 4.28Å; F431-L504 WeakPolarHBondContact CZ-O 3.49Å; L432-L504 HydrophobicContact CD2-CB 4.38Å; L432-L504 HydrophobicContact CD2-CD1 4.2Å; I435-L504 HydrophobicContact CD1-CD2 4.5Å; L438-L504 HydrophobicContact CD2-CD1 3.98Å; F489-L504 HydrophobicContact CZ-CD1 4.48Å; P499-L504 HydrophobicContact CB-CD2 4.08Å; P499-L504 HydrophobicContact CB-CG 4.22Å; N500-L504 WeakPolarHBondContact O-CG 3.43Å; N500-L504 PolarHBondContact O-N 3.27Å; I501-L504 HydrophobicContact CD1-CD1 4.49Å; I501-L504 PolarHBondContact O-N 2.83Å; I501-L504 VanDerWaalsContact O-N 3.12Å; G502-L504 PolarHBondContact O-N 3.46Å
505	M	98	Very high	98.3	Very high	25 Å²	25	44.9 Å²	44.9	12%	0.123	25%	0.249	C	C	.	.	H	α-helix	trans	-92.2	-7.5	-178.5	-69.4	175.3	60.6	0	0	114	T420 I424 I429 F431 L432 F474 I501 V507	T420-M505 HydrophobicContact CG2-CE 4.09Å; I424-M505 HydrophobicContact CD1-CE 4.49Å; I424-M505 HydrophobicContact CG2-CE 3.98Å; I429-M505 HydrophobicContact CG2-CE 3.45Å; I429-M505 VanDerWaalsContact CG2-CE 3.45Å; I429-M505 HydrophobicContact CG2-SD 4.06Å; F431-M505 HydrophobicContact CE1-CG 4.05Å; F431-M505 HydrophobicContact CZ-CG 4.02Å; L432-M505 HydrophobicContact CD1-CG 4.39Å; L432-M505 HydrophobicContact CD1-SD 3.97Å; F474-M505 HydrophobicContact CE1-CE 3.94Å; F474-M505 HydrophobicContact CE1-SD 3.89Å; F474-M505 HydrophobicContact CZ-CE 4.29Å; F474-M505 HydrophobicContact CZ-SD 3.67Å; I501-M505 HydrophobicContact CG2-SD 3.72Å; I501-M505 PolarHBondContact O-N 3.33Å; M505-V507 VanDerWaalsContact C-N 3.35Å; M505-V507 HydrophobicContact CB-CG1 4.26Å; M505-V507 HydrophobicContact CB-CG2 3.81Å; M505-V507 HydrophobicContact CE-CG2 4.41Å
506	N	97.5	Very high	98.3	Very high	130 Å²	130	43.3 Å²	43.3	70%	0.695	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	42.6	-172.5	-166.9	24.4	0	0	0	113.3	K422 G502	K422-N506 PolarHBondContact NZ-O 2.93Å; G502-N506 WeakPolarHBondContact O-CA 3.24Å; G502-N506 PolarHBondContact O-N 3.43Å
507	V	97.9	Very high	98.3	Very high	20 Å²	20	44.1 Å²	44.1	12%	0.121	24%	0.238	C	C	.	.	S	Bend	trans	-130	163.8	178.5	-56.2	0	0	0	0	109.9	T420 D421 K422 G502 M505 A509	T420-V507 HydrophobicContact CG2-CG2 3.85Å; D421-V507 WeakPolarHBondContact OD1-CB 3.45Å; K422-V507 HydrophobicContact CB-CG1 4.27Å; K422-V507 HydrophobicContact CD-CG1 4.31Å; G502-V507 CarbonylContact C-O 3.45Å; G502-V507 VanDerWaalsContact C-O 3.29Å; G502-V507 WeakPolarHBondContact CA-O 3.46Å; G502-V507 PolarHBondContact O-N 2.74Å; G502-V507 VanDerWaalsContact O-O 3.08Å; M505-V507 VanDerWaalsContact C-N 3.35Å; M505-V507 HydrophobicContact CB-CG1 4.26Å; M505-V507 HydrophobicContact CB-CG2 3.81Å; M505-V507 HydrophobicContact CE-CG2 4.41Å; V507-A509 HydrophobicContact CG2-CB 4.23Å
508	T	98.4	Very high	98.1	Very high	84 Å²	84	45.7 Å²	45.7	52%	0.515	25%	0.249	S	C	.	.			trans	-81.5	124.2	156.1	-45	0	0	0	0	107.2	T420 D421	T420-T508 WeakPolarHBondContact CA-O 3.5Å; D421-T508 VanDerWaalsContact CG-N 3.26Å; D421-T508 PolarHBondContact N-O 2.7Å; D421-T508 PolarHBondContact OD1-N 2.81Å; D421-T508 WeakPolarHBondContact OD2-CB 3.44Å; D421-T508 PolarHBondContact OD2-N 2.75Å; D421-T508 PolarHBondContact OD2-OG1 2.9Å
509	A	98.5	Very high	97.9	Very high	5 Å²	5	39.6 Å²	39.6	4%	0.041	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	145.5	177.2	0	0	0	0	0	110.1	I418 W419 V490 H491 I501 V507	I418-A509 HydrophobicContact CG2-CB 4.13Å; W419-A509 VanDerWaalsContact O-CA 3.27Å; W419-A509 WeakPolarHBondContact O-CA 3.33Å; V490-A509 HydrophobicContact CG1-CB 4.19Å; H491-A509 VanDerWaalsContact CA-O 3.29Å; H491-A509 WeakPolarHBondContact CA-O 3.18Å; H491-A509 WeakPolarHBondContact CB-O 3.44Å; I501-A509 HydrophobicContact CG2-CB 4.11Å; V507-A509 HydrophobicContact CG2-CB 4.23Å
510	D	98.6	Very high	97.6	Very high	73 Å²	73	39.6 Å²	39.6	39%	0.39	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	163.6	169.7	-156.1	1.9	0	0	0	111.1	I418 W419	I418-D510 WeakPolarHBondContact CA-O 3.22Å; W419-D510 HydrophobicContact CE3-CB 4.08Å; W419-D510 PolarHBondContact N-O 3.28Å; W419-D510 PolarHBondContact O-N 3.19Å
511	I	98.6	Very high	97.1	Very high	24 Å²	24	39.2 Å²	39.2	12%	0.123	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	113.7	-174.5	-170	167.7	0	0	0	111	A416 K487 V490 E513 L514	A416-I511 HydrophobicContact CB-CD1 3.72Å; A416-I511 HydrophobicContact CB-CG1 4.2Å; K487-I511 HydrophobicContact CB-CG2 3.84Å; K487-I511 HydrophobicContact CD-CG2 4.46Å; K487-I511 HydrophobicContact CG-CD1 4.27Å; K487-I511 HydrophobicContact CG-CG2 3.87Å; V490-I511 HydrophobicContact CB-CB 4.24Å; V490-I511 HydrophobicContact CG1-CB 4.14Å; V490-I511 HydrophobicContact CG2-CB 4.47Å; V490-I511 HydrophobicContact CG2-CD1 4.16Å; I511-E513 WeakPolarHBondContact CG1-O 3.29Å; I511-L514 HydrophobicContact CD1-CB 3.83Å; I511-L514 HydrophobicContact CD1-CD1 4.14Å; I511-L514 HydrophobicContact CD1-CD2 4.26Å; I511-L514 HydrophobicContact CD1-CG 4.3Å; I511-L514 HydrophobicContact CG1-CB 4.47Å
512	L	98.3	Very high	96.6	Very high	94 Å²	94	46.7 Å²	46.7	49%	0.492	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-40.2	-178.4	-56.7	-173.8	0	0	0	112	L417 W419	L417-L512 HydrophobicContact CB-CB 4.47Å; L417-L512 HydrophobicContact CD2-CB 4.17Å; L417-L512 HydrophobicContact CD2-CD1 4.23Å; L417-L512 HydrophobicContact CG-CB 4.27Å; L417-L512 HydrophobicContact CG-CD1 4.4Å; L417-L512 PolarHBondContact O-N 3.3Å; W419-L512 HydrophobicContact CB-CD1 4.06Å; W419-L512 HydrophobicContact CB-CD2 4.07Å; W419-L512 HydrophobicContact CB-CG 3.98Å
513	E	98.6	Very high	96.2	Very high	70 Å²	70	47.4 Å²	47.4	33%	0.327	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	147.1	179.3	-70	-170.7	-138.3	0	0	110.3	R299 R348 A416 L417 I511	R299-E513 IonicContact CZ-OE2 3.65Å; R299-E513 IonicContact NE-OE2 3.27Å; R299-E513 PolarHBondContact NE-OE2 2.72Å; R299-E513 IonicContact NH2-OE2 3.63Å; R299-E513 PolarHBondContact NH2-OE2 3.36Å; R348-E513 IonicContact NH2-OE2 2.64Å; A416-E513 CarbonylContact C-O 3.52Å; A416-E513 VanDerWaalsContact CA-O 3.31Å; A416-E513 WeakPolarHBondContact CA-O 3.4Å; L417-E513 HydrophobicContact CB-CB 3.9Å; L417-E513 HydrophobicContact CD2-CG 4.47Å; L417-E513 PolarHBondContact N-O 2.72Å; I511-E513 WeakPolarHBondContact CG1-O 3.29Å
514	L	98.8	Very high	96	Very high	12 Å²	12	44.1 Å²	44.1	6%	0.063	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	133.4	175.3	176.2	62.2	0	0	0	110.3	R299 V347 R348 Y414 S415 A416 I486 K487 I511	R299-L514 PolarHBondContact NH1-O 2.97Å; V347-L514 WeakPolarHBondContact CA-O 2.84Å; V347-L514 HydrophobicContact CG1-CG 4.26Å; V347-L514 HydrophobicContact CG2-CB 4.06Å; V347-L514 HydrophobicContact CG2-CD2 3.83Å; V347-L514 HydrophobicContact CG2-CG 4Å; R348-L514 PolarHBondContact N-O 3.43Å; Y414-L514 HydrophobicContact CD1-CD1 4.05Å; Y414-L514 HydrophobicContact CG-CD1 4.41Å; S415-L514 WeakPolarHBondContact O-CA 3.22Å; A416-L514 HydrophobicContact CB-CD1 4.24Å; I486-L514 HydrophobicContact CB-CD1 4.2Å; I486-L514 HydrophobicContact CB-CD2 4.01Å; I486-L514 HydrophobicContact CG2-CD1 3.74Å; I486-L514 HydrophobicContact CG2-CD2 4.35Å; K487-L514 HydrophobicContact CG-CD2 3.99Å; I511-L514 HydrophobicContact CD1-CB 3.83Å; I511-L514 HydrophobicContact CD1-CD1 4.14Å; I511-L514 HydrophobicContact CD1-CD2 4.26Å; I511-L514 HydrophobicContact CD1-CG 4.3Å; I511-L514 HydrophobicContact CG1-CB 4.47Å
515	D	98.8	Very high	95.7	Very high	11 Å²	11	45.2 Å²	45.2	6%	0.059	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	142.2	176.9	-58.3	-38.2	0	0	0	110.1	R299 R348 L350 Y414 S415	R299-D515 IonicContact CZ-OD1 3.37Å; R299-D515 VanDerWaalsContact CZ-OD1 3.28Å; R299-D515 IonicContact NH1-OD1 2.65Å; R299-D515 PolarHBondContact NH1-OD1 3.5Å; R299-D515 IonicContact NH2-OD1 3.86Å; R299-D515 PolarHBondContact NH2-OD1 2.81Å; R299-D515 IonicContact NH2-OD2 2.69Å; R299-D515 PolarHBondContact NH2-OD2 3.14Å; R348-D515 VanDerWaalsContact CB-OD1 3.25Å; R348-D515 WeakPolarHBondContact CB-OD1 3.48Å; R348-D515 IonicContact CZ-OD1 3.57Å; R348-D515 IonicContact CZ-OD2 3.49Å; R348-D515 IonicContact NE-OD1 2.82Å; R348-D515 PolarHBondContact NE-OD1 3.07Å; R348-D515 IonicContact NE-OD2 3.48Å; R348-D515 PolarHBondContact NE-OD2 2.7Å; R348-D515 IonicContact NH2-OD1 2.7Å; R348-D515 IonicContact NH2-OD2 3.84Å; R348-D515 PolarHBondContact NH2-OD2 3.28Å; L350-D515 HydrophobicContact CD1-CB 3.93Å; L350-D515 HydrophobicContact CG-CB 4.36Å; Y414-D515 CarbonylContact C-O 3.52Å; Y414-D515 WeakPolarHBondContact CA-O 3.42Å; Y414-D515 WeakPolarHBondContact CB-O 3.18Å; S415-D515 PolarHBondContact N-O 2.65Å; S415-D515 PolarHBondContact O-N 3.26Å
516	V	98.4	Very high	95.6	Very high	2 Å²	2	48 Å²	48	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	116.7	164.1	-174.3	0	0	0	0	107.3	E343 V347 R348 T349 L350 Y414 V519	E343-V516 HydrophobicContact CB-CG2 4.32Å; V347-V516 HydrophobicContact CG1-CG2 3.9Å; R348-V516 PolarHBondContact O-N 3.45Å; T349-V516 HydrophobicContact CG2-CB 4.25Å; T349-V516 HydrophobicContact CG2-CG1 4.47Å; L350-V516 PolarHBondContact N-O 3.35Å; Y414-V516 HydrophobicContact CD1-CG2 4.03Å; Y414-V516 HydrophobicContact CE1-CG2 3.82Å; V516-V519 HydrophobicContact CG1-CG2 3.74Å
517	E	97.4	Very high	95.4	Very high	59 Å²	59	45.7 Å²	45.7	28%	0.276	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-36	178.7	-64.6	-65.3	172.3	0	0	111.8	T413 S415	T413-E517 HydrophobicContact CG2-CB 4.19Å; T413-E517 PolarHBondContact O-N 3.36Å; S415-E517 WeakPolarHBondContact CB-OE1 3.17Å
518	S	95.8	Very high	94.9	Very high	33 Å²	33	52.6 Å²	52.6	23%	0.231	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	147.6	175.8	76.3	0	0	0	0	112.9	K412 T413 D520	K412-S518 WeakPolarHBondContact CA-O 3.28Å; T413-S518 WeakPolarHBondContact CB-OG 3.49Å; T413-S518 PolarHBondContact N-O 3.02Å; T413-S518 PolarHBondContact O-N 2.62Å; T413-S518 PolarHBondContact OG1-OG 2.98Å; S518-D520 VanDerWaalsContact CB-OD1 3.23Å; S518-D520 WeakPolarHBondContact CB-OD1 3.28Å; S518-D520 PolarHBondContact OG-OD1 3.42Å
519	V	93	Very high	93.1	Very high	8 Å²	8	58 Å²	58	5%	0.048	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	104.4	166.9	179.6	0	0	0	0	106.1	R354 K412 V516 V521	R354-V519 HydrophobicContact CB-CG2 4.27Å; R354-V519 HydrophobicContact CG-CG2 4.38Å; K412-V519 HydrophobicContact CG-CG1 4.4Å; K412-V519 HydrophobicContact CG-CG2 4.34Å; V516-V519 HydrophobicContact CG1-CG2 3.74Å; V519-V521 HydrophobicContact CG1-CB 4.5Å; V519-V521 HydrophobicContact CG1-CG2 3.81Å; V519-V521 PolarHBondContact O-N 3.32Å
520	D	91.1	Very high	92.8	Very high	41 Å²	41	60.6 Å²	60.6	22%	0.219	34%	0.336	C	S	.	.			trans	-81.9	58	-162.3	-58.9	-3.7	0	0	0	111.8	K410 T411 K479 S518	K410-D520 WeakPolarHBondContact CB-O 3.44Å; K410-D520 WeakPolarHBondContact CG-O 3.12Å; T411-D520 WeakPolarHBondContact O-CB 3.45Å; T411-D520 PolarHBondContact O-N 3.27Å; T411-D520 VanDerWaalsContact O-N 3.14Å; T411-D520 PolarHBondContact OG1-OD2 3.48Å; K479-D520 WeakPolarHBondContact CE-OD2 3.4Å; K479-D520 IonicContact NZ-OD2 3.2Å; K479-D520 PolarHBondContact NZ-OD2 3.02Å; S518-D520 VanDerWaalsContact CB-OD1 3.23Å; S518-D520 WeakPolarHBondContact CB-OD1 3.28Å; S518-D520 PolarHBondContact OG-OD1 3.42Å
521	V	87.8	Confident	92.5	Very high	6 Å²	6	59.9 Å²	59.9	4%	0.036	33%	0.333	C	S	.	.			trans	-118.9	115.1	-175.4	178.9	0	0	0	0	108.2	R293 P355 G406 K410 V519 W523	R293-V521 PolarHBondContact NH1-O 3.05Å; R293-V521 PolarHBondContact NH2-O 2.75Å; P355-V521 HydrophobicContact CG-CB 4.11Å; P355-V521 HydrophobicContact CG-CG1 4.26Å; G406-V521 WeakPolarHBondContact O-CG2 3.48Å; K410-V521 HydrophobicContact CB-CG2 3.94Å; K410-V521 HydrophobicContact CG-CG2 3.95Å; V519-V521 HydrophobicContact CG1-CB 4.5Å; V519-V521 HydrophobicContact CG1-CG2 3.81Å; V519-V521 PolarHBondContact O-N 3.32Å; V521-W523 HydrophobicContact CG1-CB 4.28Å; V521-W523 PolarHBondContact O-N 3.23Å
522	D	88.8	Confident	92.2	Very high	158 Å²	158	61.9 Å²	61.9	85%	0.845	35%	0.345	S	S	*	.			trans	-79.4	38.7	-176.6	-54.2	-45.7	0	0	0	112.9
523	W	90.8	Very high	91.8	Very high	22 Å²	22	60.1 Å²	60.1	8%	0.083	34%	0.336	C	S	.	.			trans	-149.3	142.6	177.3	-170.8	93.5	0	0	0	110.4	A291 R293 P355 A357 V395 A399 H402 M403 V521	A291-W523 HydrophobicContact CB-CH2 3.45Å; A291-W523 VanDerWaalsContact CB-CH2 3.45Å; A291-W523 HydrophobicContact CB-CZ2 4.08Å; A291-W523 HydrophobicContact CB-CZ3 4.04Å; R293-W523 PolarHBondContact NH1-O 2.95Å; R293-W523 VanDerWaalsContact NH1-O 3.11Å; P355-W523 HydrophobicContact CB-CE3 4.49Å; P355-W523 WeakPolarHBondContact CB-O 3.43Å; P355-W523 WeakPolarHBondContact CG-O 3.47Å; A357-W523 HydrophobicContact CB-CH2 4.21Å; V395-W523 HydrophobicContact CB-CZ2 4.38Å; V395-W523 HydrophobicContact CG1-CZ2 4.17Å; V395-W523 HydrophobicContact CG2-CH2 4.41Å; V395-W523 HydrophobicContact CG2-CZ2 4.19Å; A399-W523 HydrophobicContact CB-CZ2 3.73Å; A399-W523 VanDerWaalsContact O-CE2 3.24Å; A399-W523 WeakPolarHBondContact O-CZ2 3.15Å; A399-W523 PolarHBondContact O-NE1 3.48Å; H402-W523 HydrophobicContact CB-CB 4.03Å; H402-W523 HydrophobicContact CB-CD2 4.25Å; H402-W523 HydrophobicContact CB-CG 3.79Å; H402-W523 AromaticContact CD2-CD1 3.74Å; H402-W523 AromaticContact CD2-NE1 3.93Å; M403-W523 HydrophobicContact CE-CZ3 4.27Å; M403-W523 HydrophobicContact CG-CE3 3.43Å; M403-W523 VanDerWaalsContact CG-CE3 3.43Å; M403-W523 HydrophobicContact CG-CH2 4.13Å; M403-W523 HydrophobicContact CG-CZ3 3.21Å; M403-W523 HydrophobicContact SD-CE3 4.33Å; M403-W523 HydrophobicContact SD-CH2 4.44Å; M403-W523 HydrophobicContact SD-CZ3 3.62Å; V521-W523 HydrophobicContact CG1-CB 4.28Å; V521-W523 PolarHBondContact O-N 3.23Å
524	P	92.5	Very high	91.4	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.006	34%	0.337	C	S	.	.	S	Bend	cis	-65	162.8	-9.3	31.2	-36.5	0	0	0	110.9	A291 R293 A526	A291-P524 HydrophobicContact CB-CB 4.23Å; A291-P524 HydrophobicContact CB-CG 4.36Å; R293-P524 HydrophobicContact CG-CG 4.27Å; R293-P524 PolarHBondContact NH1-O 3.26Å; R293-P524 VanDerWaalsContact NH1-O 3.13Å; P524-A526 PolarHBondContact O-N 2.89Å
525	P	93.1	Very high	90.9	Very high	71 Å²	71	62.6 Å²	62.6	46%	0.461	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-52.9	134.7	173.3	-24.6	34	0	0	0	111	Q393	Q393-P525 PolarHBondContact NE2-O 2.92Å
526	A	94.4	Very high	90.3	Very high	83 Å²	83	66.3 Å²	66.3	69%	0.686	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-64.6	143	171.4	0	0	0	0	0	109.9	D391 P524	D391-A526 WeakPolarHBondContact OD1-CA 3.43Å; P524-A526 PolarHBondContact O-N 2.89Å
527	L	94	Very high	89.7	Confident	82 Å²	82	71.2 Å²	71.2	43%	0.429	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-103.3	150.4	175.6	-58.3	-178.4	0	0	0	110.4	D391 L392 Q393	D391-L527 HydrophobicContact CB-CG 4.48Å; D391-L527 PolarHBondContact OD1-N 3.2Å; L392-L527 WeakPolarHBondContact O-CD1 3.47Å; Q393-L527 HydrophobicContact CB-CD1 4.37Å
528	D	87.3	Confident	89	Confident	165 Å²	165	72.3 Å²	72.3	88%	0.882	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-70.4	144	167.4	-61.3	-47.1	0	0	0	110.3
529	D	60.2	Low	88.4	Confident	197 Å²	197	75.8 Å²	75.8	100%	1.053	43%	0.432	S	S	*	.			trans	-65.2	0	-167.9	-92.2	-36.1	0	0	0	117	K374	K374-D529 WeakPolarHBondContact CE-OXT 3.31Å; K374-D529 PolarHBondContact NZ-O 3.47Å; K374-D529 PolarHBondContact NZ-OXT 3.41Å

Retrieved 529 of 529 residues in 3019.8 ms (Link to these results)

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