A0A087X2T2_POEFO Loading...

PAK1 interacting protein 1

Negatively regulates the PAK1 kinase. PAK1 is a member of the PAK kinase family, which has been shown to play a positive role in the regulation of signaling pathways involving MAPK8 and RELA. PAK1 exists as an inactive homodimer, which is activated by binding of small GTPases such as CDC42 to an N-terminal regulatory domain. PAK1IP1 also binds to the N-terminus of PAK1, and inhibits the specific activation of PAK1 by CDC42. May be involved in ribosomal large subunit assembly.

AlphaFold DB , UniProt , Accession A0A087X2T2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 361 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.7	Very low	81.1	Confident	243 Å²	243	38.5 Å²	38.5	100%	1.197	23%	0.231	S	C	*	.				0	120	0	-93.8	-175.4	-104.8	0	0	106.6	A3	M1-A3 PolarHBondContact O-N 3.43Å
2	A	51.1	Low	82.4	Confident	57 Å²	57	41.3 Å²	41.3	47%	0.471	24%	0.235	S	C	.	.			trans	-57.1	133.2	176.8	0	0	0	0	0	109.2	V4	A2-V4 PolarHBondContact O-N 3.12Å; A2-V4 VanDerWaalsContact O-N 3.12Å
3	A	55.2	Low	83.5	Confident	57 Å²	57	43.1 Å²	43.1	47%	0.471	24%	0.24	S	C	.	.			trans	-62.8	117.4	173.6	0	0	0	0	0	107.6	M1 T23	M1-A3 PolarHBondContact O-N 3.43Å; A3-T23 PolarHBondContact N-OG1 3.41Å; A3-T23 PolarHBondContact O-OG1 3.29Å; A3-T23 VanDerWaalsContact O-OG1 3.05Å
4	V	75.8	Confident	84.4	Confident	62 Å²	62	45.9 Å²	45.9	38%	0.376	25%	0.25	S	S	.	.			trans	-91.6	111.4	175.8	-177.6	0	0	0	0	107	A2 R20 P303	A2-V4 PolarHBondContact O-N 3.12Å; A2-V4 VanDerWaalsContact O-N 3.12Å; V4-R20 HydrophobicContact CG1-CG 3.66Å; V4-P303 WeakPolarHBondContact O-CD 3.29Å
5	L	88.4	Confident	85.2	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.026	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	156.1	170.3	62.8	103.3	0	0	0	109	L7 V21 T23 W28 L252 V300	L5-L7 HydrophobicContact CD1-CD2 3.79Å; L5-L7 HydrophobicContact CD1-CG 4.45Å; L5-V21 HydrophobicContact CD1-CB 3.54Å; L5-V21 HydrophobicContact CD1-CG1 4.14Å; L5-V21 HydrophobicContact CD1-CG2 3.58Å; L5-V21 HydrophobicContact CD2-CB 4.48Å; L5-V21 HydrophobicContact CD2-CG1 4.5Å; L5-V21 HydrophobicContact CG-CB 3.8Å; L5-V21 HydrophobicContact CG-CG1 4.32Å; L5-V21 HydrophobicContact CG-CG2 4.38Å; L5-V21 PolarHBondContact O-N 2.94Å; L5-T23 HydrophobicContact CD2-CG2 4.21Å; L5-W28 HydrophobicContact CD1-CZ3 4.14Å; L5-W28 HydrophobicContact CD2-CE3 4.17Å; L5-W28 HydrophobicContact CD2-CH2 3.39Å; L5-W28 HydrophobicContact CD2-CZ2 4.49Å; L5-W28 HydrophobicContact CD2-CZ3 3.21Å; L5-W28 HydrophobicContact CG-CZ3 4.26Å; L5-L252 HydrophobicContact CD2-CD1 4.2Å; L5-V300 HydrophobicContact CD1-CG2 4.5Å
6	E	92.9	Very high	85.9	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	134	178	-57.8	-164.3	170.4	0	0	111.4	Y19 R20 M67 R70 W301	E6-Y19 CarbonylContact C-O 3.53Å; E6-Y19 VanDerWaalsContact CA-O 3.23Å; E6-Y19 WeakPolarHBondContact CA-O 3.24Å; E6-R20 HydrophobicContact CG-CB 4.29Å; E6-R20 HydrophobicContact CG-CG 4.41Å; E6-R20 IonicContact OE1-CZ 3.32Å; E6-R20 IonicContact OE1-NE 2.87Å; E6-R20 PolarHBondContact OE1-NE 3.31Å; E6-R20 IonicContact OE1-NH2 2.9Å; E6-R20 PolarHBondContact OE1-NH2 2.82Å; E6-M67 HydrophobicContact CB-CE 4.28Å; E6-M67 WeakPolarHBondContact OE2-CE 3.37Å; E6-R70 VanDerWaalsContact CD-NH2 3.28Å; E6-R70 IonicContact OE1-CZ 3.45Å; E6-R70 IonicContact OE1-NH1 2.65Å; E6-R70 PolarHBondContact OE1-NH1 2.79Å; E6-R70 VanDerWaalsContact OE1-NH1 3.08Å; E6-R70 IonicContact OE1-NH2 3.35Å; E6-R70 PolarHBondContact OE1-NH2 3.3Å; E6-R70 IonicContact OE2-CZ 3.42Å; E6-R70 IonicContact OE2-NH1 2.65Å; E6-R70 PolarHBondContact OE2-NH1 3.08Å; E6-R70 IonicContact OE2-NH2 3.22Å; E6-R70 PolarHBondContact OE2-NH2 2.77Å; E6-W301 HydrophobicContact CB-CB 4.5Å; E6-W301 HydrophobicContact CB-CE3 4.07Å; E6-W301 HydrophobicContact CG-CE3 3.93Å; E6-W301 HydrophobicContact CG-CZ3 4.28Å; E6-W301 PolarHBondContact N-O 2.73Å; E6-W301 PolarHBondContact O-N 3.32Å
7	L	95.4	Very high	86.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	124.8	175.7	-47.2	175.5	0	0	0	107.4	L5 G18 Y19 V21 A30 L261 I269 M271	L5-L7 HydrophobicContact CD1-CD2 3.79Å; L5-L7 HydrophobicContact CD1-CG 4.45Å; L7-G18 CarbonylContact O-C 3.56Å; L7-G18 WeakPolarHBondContact O-CA 3.03Å; L7-Y19 PolarHBondContact N-O 3.15Å; L7-Y19 PolarHBondContact O-N 3.46Å; L7-V21 HydrophobicContact CD1-CG2 3.68Å; L7-V21 HydrophobicContact CD2-CG2 4.18Å; L7-V21 HydrophobicContact CG-CG2 3.63Å; L7-A30 HydrophobicContact CD1-CB 4.46Å; L7-L261 HydrophobicContact CD2-CD1 3.58Å; L7-L261 HydrophobicContact CD2-CD2 3.68Å; L7-L261 HydrophobicContact CD2-CG 4.25Å; L7-I269 HydrophobicContact CD1-CG2 3.95Å; L7-M271 HydrophobicContact CD1-CE 4.49Å; L7-M271 HydrophobicContact CD1-CG 4.28Å; L7-M271 HydrophobicContact CD1-SD 3.86Å
8	I	96.9	Very high	87	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.5	173.6	-56.9	124.3	0	0	0	108.6	T16 F17 V46 A48 V53 M67 L298 A299 W301	I8-T16 HydrophobicContact CG2-CG2 3.78Å; I8-F17 VanDerWaalsContact CA-O 3.28Å; I8-F17 WeakPolarHBondContact CA-O 3.36Å; I8-V46 HydrophobicContact CB-CG2 4.34Å; I8-V46 HydrophobicContact CG2-CG2 3.73Å; I8-A48 HydrophobicContact CD1-CB 4.4Å; I8-V53 HydrophobicContact CB-CG1 4.35Å; I8-V53 HydrophobicContact CD1-CB 4.26Å; I8-V53 HydrophobicContact CD1-CG1 3.92Å; I8-V53 HydrophobicContact CD1-CG2 3.29Å; I8-V53 HydrophobicContact CG1-CG1 4.06Å; I8-V53 HydrophobicContact CG1-CG2 4.09Å; I8-V53 HydrophobicContact CG2-CG1 3.75Å; I8-M67 HydrophobicContact CD1-CE 4.43Å; I8-L298 CarbonylContact O-C 3.58Å; I8-L298 WeakPolarHBondContact O-CA 3.48Å; I8-A299 PolarHBondContact N-O 2.9Å; I8-A299 PolarHBondContact O-N 3.33Å; I8-W301 HydrophobicContact CD1-CB 3.45Å; I8-W301 VanDerWaalsContact CD1-CB 3.45Å; I8-W301 HydrophobicContact CD1-CG 4.47Å
9	A	97.3	Very high	87.4	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	140	175.7	0	0	0	0	0	111.5	T16 F17 I269 L295 C297 L298	A9-T16 CarbonylContact O-C 3.57Å; A9-T16 WeakPolarHBondContact O-CA 3.23Å; A9-F17 PolarHBondContact N-O 3.4Å; A9-F17 PolarHBondContact O-N 3.01Å; A9-I269 HydrophobicContact CB-CD1 3.61Å; A9-I269 HydrophobicContact CB-CG1 4.37Å; A9-L295 HydrophobicContact CB-CD1 4.37Å; A9-L295 HydrophobicContact CB-CD2 4.01Å; A9-C297 VanDerWaalsContact CA-O 3.3Å; A9-C297 WeakPolarHBondContact CA-O 3.41Å; A9-L298 HydrophobicContact CB-CD1 4.19Å
10	G	97.3	Very high	87.7	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	158.3	167.6	0	0	0	0	0	111.2	L295 T296 C297	G10-L295 WeakPolarHBondContact O-CA 3.03Å; G10-T296 VanDerWaalsContact C-OG1 3.24Å; G10-T296 PolarHBondContact O-N 2.87Å; G10-T296 PolarHBondContact O-OG1 2.86Å; G10-T296 VanDerWaalsContact O-OG1 3.12Å; G10-C297 PolarHBondContact N-O 2.89Å
11	S	97.5	Very high	87.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	162.1	-178.1	63.5	0	0	0	0	113.5	E13 Q14 I15 V43 R294 T296	S11-E13 PolarHBondContact O-N 3.14Å; S11-Q14 PolarHBondContact O-N 3.4Å; S11-I15 PolarHBondContact N-O 3Å; S11-I15 VanDerWaalsContact N-O 3.08Å; S11-I15 PolarHBondContact OG-N 3.09Å; S11-I15 VanDerWaalsContact OG-N 3.08Å; S11-I15 PolarHBondContact OG-O 3.18Å; S11-V43 PolarHBondContact O-N 2.9Å; S11-V43 VanDerWaalsContact O-N 3.07Å; S11-R294 WeakPolarHBondContact CA-O 3.2Å; S11-T296 PolarHBondContact N-OG1 2.87Å
12	Y	96.8	Very high	89.8	Confident	72 Å²	72	30.1 Å²	30.1	28%	0.282	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-28.6	168.6	-82.1	-69.5	0	0	0	112.3	Q14 S42 R294 T296	Y12-Q14 PolarHBondContact O-N 3.31Å; Y12-Q14 VanDerWaalsContact O-N 3.13Å; Y12-S42 VanDerWaalsContact CD1-OG 3.31Å; Y12-S42 WeakPolarHBondContact CD1-OG 3.28Å; Y12-R294 HydrophobicContact CD2-CB 3.83Å; Y12-R294 WeakPolarHBondContact CD2-O 3.43Å; Y12-R294 PolarHBondContact N-O 3.34Å; Y12-T296 HydrophobicContact CD1-CG2 3.99Å; Y12-T296 HydrophobicContact CD2-CG2 3.39Å; Y12-T296 HydrophobicContact CE1-CG2 4.03Å; Y12-T296 HydrophobicContact CE2-CG2 3.45Å; Y12-T296 VanDerWaalsContact CE2-CG2 3.45Å; Y12-T296 HydrophobicContact CG-CG2 3.68Å
13	E	96.4	Very high	91.3	Very high	64 Å²	64	28.7 Å²	28.7	30%	0.299	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	10.6	179.1	-66.4	67	-146.4	0	0	112.9	S11 I15 A293 R294	S11-E13 PolarHBondContact O-N 3.14Å; E13-I15 HydrophobicContact CB-CD1 4.38Å; E13-I15 HydrophobicContact CB-CG1 4.37Å; E13-I15 WeakPolarHBondContact O-CG1 3.34Å; E13-I15 PolarHBondContact O-N 3.22Å; E13-A293 HydrophobicContact CB-CB 4.47Å; E13-A293 HydrophobicContact CG-CB 4.39Å; E13-R294 IonicContact OE1-CZ 3.4Å; E13-R294 VanDerWaalsContact OE1-CZ 3.27Å; E13-R294 IonicContact OE1-NE 3.16Å; E13-R294 PolarHBondContact OE1-NE 3.16Å; E13-R294 IonicContact OE1-NH2 3.91Å; E13-R294 PolarHBondContact OE1-NH2 3.45Å; E13-R294 PolarHBondContact OE2-N 3.05Å
14	Q	96.3	Very high	92.2	Very high	82 Å²	82	32.4 Å²	32.4	38%	0.383	15%	0.15	S	C	.	.	S	Bend	trans	72.4	12.2	174.3	-36	177.7	-7.4	0	0	113.6	S11 Y12 T40 A41	S11-Q14 PolarHBondContact O-N 3.4Å; Y12-Q14 PolarHBondContact O-N 3.31Å; Y12-Q14 VanDerWaalsContact O-N 3.13Å; Q14-T40 VanDerWaalsContact CD-C 3.42Å; Q14-T40 VanDerWaalsContact CD-O 3.28Å; Q14-T40 PolarHBondContact NE2-O 3.09Å; Q14-T40 VanDerWaalsContact NE2-O 3.14Å; Q14-T40 PolarHBondContact OE1-O 3.47Å; Q14-A41 WeakPolarHBondContact CA-O 3.33Å; Q14-A41 WeakPolarHBondContact CB-O 2.86Å; Q14-A41 VanDerWaalsContact CG-C 3.5Å
15	I	96.1	Very high	92	Very high	31 Å²	31	32.6 Å²	32.6	16%	0.159	17%	0.165	C	C	.	.			trans	-103.7	136.6	-175.7	-50.1	177.7	0	0	0	109.7	S11 E13 F17 T35	S11-I15 PolarHBondContact N-O 3Å; S11-I15 VanDerWaalsContact N-O 3.08Å; S11-I15 PolarHBondContact OG-N 3.09Å; S11-I15 VanDerWaalsContact OG-N 3.08Å; S11-I15 PolarHBondContact OG-O 3.18Å; E13-I15 HydrophobicContact CB-CD1 4.38Å; E13-I15 HydrophobicContact CB-CG1 4.37Å; E13-I15 WeakPolarHBondContact O-CG1 3.34Å; E13-I15 PolarHBondContact O-N 3.22Å; I15-F17 HydrophobicContact CB-CE1 4.34Å; I15-F17 HydrophobicContact CB-CE2 3.85Å; I15-F17 HydrophobicContact CB-CZ 3.73Å; I15-F17 HydrophobicContact CD1-CZ 4.03Å; I15-F17 HydrophobicContact CG1-CZ 4.45Å; I15-F17 HydrophobicContact CG2-CD1 4.03Å; I15-F17 HydrophobicContact CG2-CD2 4.26Å; I15-F17 HydrophobicContact CG2-CE1 3.61Å; I15-F17 HydrophobicContact CG2-CE2 3.86Å; I15-F17 HydrophobicContact CG2-CG 4.34Å; I15-F17 HydrophobicContact CG2-CZ 3.52Å; I15-T35 HydrophobicContact CG2-CG2 3.27Å
16	T	96.3	Very high	91.1	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.5	163.4	-56.9	0	0	0	0	109.6	I8 A9 F34 T35 H36 T55	I8-T16 HydrophobicContact CG2-CG2 3.78Å; A9-T16 CarbonylContact O-C 3.57Å; A9-T16 WeakPolarHBondContact O-CA 3.23Å; T16-F34 HydrophobicContact CG2-CE2 4.46Å; T16-T35 WeakPolarHBondContact O-CA 3.32Å; T16-H36 PolarHBondContact N-O 3.34Å; T16-H36 PolarHBondContact O-N 2.9Å; T16-T55 HydrophobicContact CG2-CG2 3.77Å
17	F	96.2	Very high	90.3	Very high	15 Å²	15	43.7 Å²	43.7	7%	0.066	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	136.7	177.6	-57.3	-83.2	0	0	0	110.5	I8 A9 I15 Y19 T35 T291 A293 L295	I8-F17 VanDerWaalsContact CA-O 3.28Å; I8-F17 WeakPolarHBondContact CA-O 3.36Å; A9-F17 PolarHBondContact N-O 3.4Å; A9-F17 PolarHBondContact O-N 3.01Å; I15-F17 HydrophobicContact CB-CE1 4.34Å; I15-F17 HydrophobicContact CB-CE2 3.85Å; I15-F17 HydrophobicContact CB-CZ 3.73Å; I15-F17 HydrophobicContact CD1-CZ 4.03Å; I15-F17 HydrophobicContact CG1-CZ 4.45Å; I15-F17 HydrophobicContact CG2-CD1 4.03Å; I15-F17 HydrophobicContact CG2-CD2 4.26Å; I15-F17 HydrophobicContact CG2-CE1 3.61Å; I15-F17 HydrophobicContact CG2-CE2 3.86Å; I15-F17 HydrophobicContact CG2-CG 4.34Å; I15-F17 HydrophobicContact CG2-CZ 3.52Å; F17-Y19 HydrophobicContact CB-CD2 4.11Å; F17-Y19 HydrophobicContact CB-CE2 3.58Å; F17-Y19 HydrophobicContact CD1-CE2 4.44Å; F17-Y19 HydrophobicContact CG-CE2 4.21Å; F17-T35 HydrophobicContact CD1-CG2 4.19Å; F17-T35 HydrophobicContact CE1-CG2 4.18Å; F17-T291 HydrophobicContact CD2-CG2 4.5Å; F17-A293 HydrophobicContact CE2-CB 3.59Å; F17-A293 HydrophobicContact CZ-CB 3.64Å; F17-L295 HydrophobicContact CD2-CD2 4.27Å; F17-L295 HydrophobicContact CE2-CD2 4.38Å
18	G	95.4	Very high	90	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120.1	168.4	0	0	0	0	0	110.3	L7 D33 F34	L7-G18 CarbonylContact O-C 3.56Å; L7-G18 WeakPolarHBondContact O-CA 3.03Å; G18-D33 PolarHBondContact O-N 2.77Å; G18-F34 PolarHBondContact N-O 2.87Å; G18-F34 PolarHBondContact O-N 2.83Å; G18-F34 VanDerWaalsContact O-N 3.15Å
19	Y	94.7	Very high	89.6	Confident	22 Å²	22	47.2 Å²	47.2	9%	0.086	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	124.3	175.8	-69.3	-88.9	0	0	0	110.7	E6 L7 F17 K31 P32 I269 V289 T291	E6-Y19 CarbonylContact C-O 3.53Å; E6-Y19 VanDerWaalsContact CA-O 3.23Å; E6-Y19 WeakPolarHBondContact CA-O 3.24Å; L7-Y19 PolarHBondContact N-O 3.15Å; L7-Y19 PolarHBondContact O-N 3.46Å; F17-Y19 HydrophobicContact CB-CD2 4.11Å; F17-Y19 HydrophobicContact CB-CE2 3.58Å; F17-Y19 HydrophobicContact CD1-CE2 4.44Å; F17-Y19 HydrophobicContact CG-CE2 4.21Å; Y19-K31 CarbonylContact C-O 3.47Å; Y19-K31 WeakPolarHBondContact CA-O 3.47Å; Y19-P32 HydrophobicContact CD1-CB 4.22Å; Y19-P32 HydrophobicContact CE1-CB 3.99Å; Y19-I269 HydrophobicContact CD2-CD1 4.24Å; Y19-I269 HydrophobicContact CE2-CD1 4.43Å; Y19-V289 HydrophobicContact CD1-CG1 4.42Å; Y19-V289 HydrophobicContact CD1-CG2 3.63Å; Y19-V289 HydrophobicContact CD2-CG1 4.32Å; Y19-V289 HydrophobicContact CE1-CG2 3.33Å; Y19-V289 HydrophobicContact CE2-CG1 4.48Å; Y19-V289 HydrophobicContact CE2-CG2 4.39Å; Y19-V289 HydrophobicContact CG-CG1 4.28Å; Y19-V289 HydrophobicContact CG-CG2 4.29Å; Y19-T291 HydrophobicContact CE2-CG2 3.65Å
20	R	92.6	Very high	89.4	Confident	77 Å²	77	48.1 Å²	48.1	29%	0.291	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	122.4	172.4	-177.6	171.4	-64.4	148	18	110.5	V4 E6 K31 D33 R70	V4-R20 HydrophobicContact CG1-CG 3.66Å; E6-R20 HydrophobicContact CG-CB 4.29Å; E6-R20 HydrophobicContact CG-CG 4.41Å; E6-R20 IonicContact OE1-CZ 3.32Å; E6-R20 IonicContact OE1-NE 2.87Å; E6-R20 PolarHBondContact OE1-NE 3.31Å; E6-R20 IonicContact OE1-NH2 2.9Å; E6-R20 PolarHBondContact OE1-NH2 2.82Å; R20-K31 PolarHBondContact N-O 3.08Å; R20-K31 PolarHBondContact O-N 2.65Å; R20-D33 HydrophobicContact CB-CB 4.13Å; R20-D33 IonicContact CZ-OD1 3.24Å; R20-D33 VanDerWaalsContact CZ-OD1 3.24Å; R20-D33 IonicContact NE-OD1 3.9Å; R20-D33 IonicContact NH1-OD1 3.67Å; R20-D33 VanDerWaalsContact NH2-CG 3.26Å; R20-D33 IonicContact NH2-OD1 2.73Å; R20-D33 PolarHBondContact NH2-OD1 3.11Å; R20-D33 IonicContact NH2-OD2 3.29Å; R20-D33 PolarHBondContact NH2-OD2 3.39Å; R20-R70 VanDerWaalsContact NH2-CZ 3.26Å; R20-R70 VanDerWaalsContact NH2-NH2 3.17Å
21	V	91.9	Very high	89.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	127.3	178.3	-178.4	0	0	0	0	109.5	L5 L7 W28 T29 A30 M271	L5-V21 HydrophobicContact CD1-CB 3.54Å; L5-V21 HydrophobicContact CD1-CG1 4.14Å; L5-V21 HydrophobicContact CD1-CG2 3.58Å; L5-V21 HydrophobicContact CD2-CB 4.48Å; L5-V21 HydrophobicContact CD2-CG1 4.5Å; L5-V21 HydrophobicContact CG-CB 3.8Å; L5-V21 HydrophobicContact CG-CG1 4.32Å; L5-V21 HydrophobicContact CG-CG2 4.38Å; L5-V21 PolarHBondContact O-N 2.94Å; L7-V21 HydrophobicContact CD1-CG2 3.68Å; L7-V21 HydrophobicContact CD2-CG2 4.18Å; L7-V21 HydrophobicContact CG-CG2 3.63Å; V21-W28 HydrophobicContact CG1-CB 4.15Å; V21-W28 HydrophobicContact CG1-CD2 4.14Å; V21-W28 HydrophobicContact CG1-CE3 3.57Å; V21-W28 HydrophobicContact CG1-CG 4.44Å; V21-W28 HydrophobicContact CG1-CZ3 4.24Å; V21-T29 WeakPolarHBondContact CA-O 3.28Å; V21-A30 HydrophobicContact CG2-CB 4.03Å; V21-M271 HydrophobicContact CG1-SD 3.91Å; V21-M271 HydrophobicContact CG2-SD 3.78Å
22	K	86.4	Confident	88.9	Confident	87 Å²	87	58.6 Å²	58.6	38%	0.378	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	129.9	169.5	-66.8	-171.2	-179.2	-165.9	0	109.1	T29	K22-T29 PolarHBondContact N-O 2.65Å; K22-T29 PolarHBondContact O-N 3.12Å; K22-T29 VanDerWaalsContact O-N 3.14Å
23	T	81.9	Confident	88.6	Confident	26 Å²	26	57.8 Å²	57.8	16%	0.16	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	92	179.2	50.7	0	0	0	0	108.2	A3 L5 W28	A3-T23 PolarHBondContact N-OG1 3.41Å; A3-T23 PolarHBondContact O-OG1 3.29Å; A3-T23 VanDerWaalsContact O-OG1 3.05Å; L5-T23 HydrophobicContact CD2-CG2 4.21Å; T23-W28 HydrophobicContact CG2-CD2 3.78Å; T23-W28 VanDerWaalsContact CG2-CE2 3.42Å; T23-W28 HydrophobicContact CG2-CE3 4.16Å; T23-W28 HydrophobicContact CG2-CG 4.39Å; T23-W28 HydrophobicContact CG2-CH2 3.8Å; T23-W28 HydrophobicContact CG2-CZ2 3.44Å; T23-W28 VanDerWaalsContact CG2-CZ2 3.44Å; T23-W28 HydrophobicContact CG2-CZ3 4.18Å
24	E	72.9	Confident	88.4	Confident	135 Å²	135	55.8 Å²	55.8	63%	0.631	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.5	89.2	177.7	-71.4	-178.9	-165.8	0	0	108.7	N26 D27	E24-N26 PolarHBondContact O-N 2.77Å; E24-D27 PolarHBondContact N-O 3.35Å; E24-D27 PolarHBondContact O-N 3.39Å
25	G	72.1	Confident	88.2	Confident	67 Å²	67	55.4 Å²	55.4	69%	0.691	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	-124.3	-175.7	0	0	0	0	0	112.2
26	N	69.7	Low	87.9	Confident	114 Å²	114	54.3 Å²	54.3	61%	0.61	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-14.6	178.1	-92.3	-1.4	0	0	0	113.8	E24	E24-N26 PolarHBondContact O-N 2.77Å
27	D	76.3	Confident	87.8	Confident	123 Å²	123	60.3 Å²	60.3	66%	0.658	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	123	-175.9	-69.2	-16.5	0	0	0	110.3	E24	E24-D27 PolarHBondContact N-O 3.35Å; E24-D27 PolarHBondContact O-N 3.39Å
28	W	89.2	Confident	87.5	Confident	8 Å²	8	61 Å²	61	3%	0.03	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	115.2	-177.8	-76.3	41.6	0	0	0	109.6	L5 V21 T23 V254 V259 M271 L286	L5-W28 HydrophobicContact CD1-CZ3 4.14Å; L5-W28 HydrophobicContact CD2-CE3 4.17Å; L5-W28 HydrophobicContact CD2-CH2 3.39Å; L5-W28 HydrophobicContact CD2-CZ2 4.49Å; L5-W28 HydrophobicContact CD2-CZ3 3.21Å; L5-W28 HydrophobicContact CG-CZ3 4.26Å; V21-W28 HydrophobicContact CG1-CB 4.15Å; V21-W28 HydrophobicContact CG1-CD2 4.14Å; V21-W28 HydrophobicContact CG1-CE3 3.57Å; V21-W28 HydrophobicContact CG1-CG 4.44Å; V21-W28 HydrophobicContact CG1-CZ3 4.24Å; T23-W28 HydrophobicContact CG2-CD2 3.78Å; T23-W28 VanDerWaalsContact CG2-CE2 3.42Å; T23-W28 HydrophobicContact CG2-CE3 4.16Å; T23-W28 HydrophobicContact CG2-CG 4.39Å; T23-W28 HydrophobicContact CG2-CH2 3.8Å; T23-W28 HydrophobicContact CG2-CZ2 3.44Å; T23-W28 VanDerWaalsContact CG2-CZ2 3.44Å; T23-W28 HydrophobicContact CG2-CZ3 4.18Å; W28-V254 HydrophobicContact CH2-CG2 4.11Å; W28-V259 HydrophobicContact CH2-CB 4.48Å; W28-V259 HydrophobicContact CH2-CG1 4.32Å; W28-V259 HydrophobicContact CH2-CG2 3.74Å; W28-V259 HydrophobicContact CZ2-CG2 4.14Å; W28-V259 HydrophobicContact CZ3-CG1 3.99Å; W28-V259 HydrophobicContact CZ3-CG2 4.25Å; W28-M271 HydrophobicContact CB-CE 4.38Å; W28-M271 HydrophobicContact CB-SD 4.35Å; W28-M271 HydrophobicContact CE3-SD 3.83Å; W28-L286 HydrophobicContact CB-CB 4.05Å; W28-L286 HydrophobicContact CD2-CB 4.38Å; W28-L286 HydrophobicContact CD2-CD1 3.96Å; W28-L286 HydrophobicContact CE3-CD1 4.37Å; W28-L286 HydrophobicContact CG-CB 3.93Å; W28-L286 HydrophobicContact CG-CD1 4.26Å; W28-L286 HydrophobicContact CZ2-CD1 4.32Å; W28-L286 PolarHBondContact N-O 2.68Å; W28-L286 VanDerWaalsContact N-O 3.16Å
29	T	88.5	Confident	87.5	Confident	66 Å²	66	61.3 Å²	61.3	41%	0.405	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	119.8	179.8	58.8	0	0	0	0	110.6	V21 K22	V21-T29 WeakPolarHBondContact CA-O 3.28Å; K22-T29 PolarHBondContact N-O 2.65Å; K22-T29 PolarHBondContact O-N 3.12Å; K22-T29 VanDerWaalsContact O-N 3.14Å
30	A	92.2	Very high	87.6	Confident	20 Å²	20	65.4 Å²	65.4	17%	0.165	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	118.1	174.8	0	0	0	0	0	109.5	L7 V21 M271 V289	L7-A30 HydrophobicContact CD1-CB 4.46Å; V21-A30 HydrophobicContact CG2-CB 4.03Å; A30-M271 HydrophobicContact CB-CE 4.28Å; A30-V289 HydrophobicContact CB-CB 3.92Å; A30-V289 HydrophobicContact CB-CG1 4.05Å; A30-V289 HydrophobicContact CB-CG2 4.39Å
31	K	92	Very high	87.8	Confident	116 Å²	116	62.8 Å²	62.8	50%	0.504	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	139.8	174.4	-65	-169.2	179.7	-169.7	0	109.8	Y19 R20 D33	Y19-K31 CarbonylContact C-O 3.47Å; Y19-K31 WeakPolarHBondContact CA-O 3.47Å; R20-K31 PolarHBondContact N-O 3.08Å; R20-K31 PolarHBondContact O-N 2.65Å; K31-D33 PolarHBondContact O-N 2.84Å
32	P	92.4	Very high	88.1	Confident	103 Å²	103	63.3 Å²	63.3	67%	0.669	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.1	130.9	175.7	25.7	-33.2	0	0	0	109.4	Y19	Y19-P32 HydrophobicContact CD1-CB 4.22Å; Y19-P32 HydrophobicContact CE1-CB 3.99Å
33	D	91.1	Very high	88.6	Confident	55 Å²	55	59.2 Å²	59.2	29%	0.294	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-50.7	175.6	-171.6	61.2	0	0	0	110.6	G18 R20 K31 R70	G18-D33 PolarHBondContact O-N 2.77Å; R20-D33 HydrophobicContact CB-CB 4.13Å; R20-D33 IonicContact CZ-OD1 3.24Å; R20-D33 VanDerWaalsContact CZ-OD1 3.24Å; R20-D33 IonicContact NE-OD1 3.9Å; R20-D33 IonicContact NH1-OD1 3.67Å; R20-D33 VanDerWaalsContact NH2-CG 3.26Å; R20-D33 IonicContact NH2-OD1 2.73Å; R20-D33 PolarHBondContact NH2-OD1 3.11Å; R20-D33 IonicContact NH2-OD2 3.29Å; R20-D33 PolarHBondContact NH2-OD2 3.39Å; K31-D33 PolarHBondContact O-N 2.84Å; D33-R70 IonicContact OD2-CZ 3.94Å; D33-R70 IonicContact OD2-NE 3.57Å; D33-R70 IonicContact OD2-NH1 2.68Å; D33-R70 PolarHBondContact OD2-NH1 3.31Å
34	F	91.9	Very high	89.3	Confident	23 Å²	23	59.6 Å²	59.6	10%	0.101	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	159.1	174.6	67.9	-91.9	0	0	0	112.5	T16 G18 H36 Y65 M67	T16-F34 HydrophobicContact CG2-CE2 4.46Å; G18-F34 PolarHBondContact N-O 2.87Å; G18-F34 PolarHBondContact O-N 2.83Å; G18-F34 VanDerWaalsContact O-N 3.15Å; F34-H36 HydrophobicContact CD2-CB 4.07Å; F34-H36 HydrophobicContact CE2-CB 4.27Å; F34-Y65 AromaticContact CD1-CE1 3.92Å; F34-Y65 HydrophobicContact CD1-CE1 3.92Å; F34-Y65 AromaticContact CD1-CZ 3.99Å; F34-Y65 HydrophobicContact CD2-CE1 4.49Å; F34-Y65 HydrophobicContact CD2-CE2 4.39Å; F34-Y65 HydrophobicContact CE1-CD1 4.22Å; F34-Y65 AromaticContact CE1-CE1 3.68Å; F34-Y65 HydrophobicContact CE1-CE1 3.68Å; F34-Y65 HydrophobicContact CE2-CD1 4.41Å; F34-Y65 HydrophobicContact CE2-CE1 4.28Å; F34-Y65 HydrophobicContact CG-CE1 4.33Å; F34-Y65 AromaticContact CG-CZ 3.98Å; F34-Y65 AromaticContact CZ-CD1 4Å; F34-Y65 HydrophobicContact CZ-CD1 4Å; F34-Y65 AromaticContact CZ-CE1 3.87Å; F34-Y65 HydrophobicContact CZ-CE1 3.87Å; F34-M67 HydrophobicContact CE1-CE 4.22Å; F34-M67 HydrophobicContact CE1-SD 4.1Å; F34-M67 HydrophobicContact CZ-SD 4.38Å
35	T	92.3	Very high	90.5	Very high	73 Å²	73	53.5 Å²	53.5	45%	0.448	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	123	170.2	-56.1	0	0	0	0	106.8	I15 T16 F17 H37	I15-T35 HydrophobicContact CG2-CG2 3.27Å; T16-T35 WeakPolarHBondContact O-CA 3.32Å; F17-T35 HydrophobicContact CD1-CG2 4.19Å; F17-T35 HydrophobicContact CE1-CG2 4.18Å; T35-H37 WeakPolarHBondContact CG2-NE2 3.48Å
36	H	90.3	Very high	91.7	Very high	8 Å²	8	51.2 Å²	51.2	4%	0.037	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	124.3	-170.9	-178.3	65.8	0	0	0	109.5	T16 F34 A38 E72	T16-H36 PolarHBondContact N-O 3.34Å; T16-H36 PolarHBondContact O-N 2.9Å; F34-H36 HydrophobicContact CD2-CB 4.07Å; F34-H36 HydrophobicContact CE2-CB 4.27Å; H36-A38 WeakPolarHBondContact CE1-CB 3.38Å; H36-A38 WeakPolarHBondContact NE2-CB 3.48Å; H36-E72 WeakPolarHBondContact CE1-CG 3.3Å; H36-E72 IonicContact CE1-OE1 3.5Å; H36-E72 PolarHBondContact CE1-OE1 3.4Å; H36-E72 IonicContact CE1-OE2 2.76Å; H36-E72 IonicContact ND1-OE1 2.68Å; H36-E72 PolarHBondContact ND1-OE1 3.32Å
37	H	93.2	Very high	93	Very high	129 Å²	129	46.2 Å²	46.2	60%	0.597	27%	0.266	S	S	*	.			trans	-114.2	39.1	-174.1	-64.5	-85.4	0	0	0	111.2	T35 H39	T35-H37 WeakPolarHBondContact CG2-NE2 3.48Å; H37-H39 VanDerWaalsContact C-N 3.34Å
38	A	91.1	Very high	93.9	Very high	28 Å²	28	41.8 Å²	41.8	23%	0.231	25%	0.246	C	C	.	.			trans	-80.2	-16.3	-178.8	0	0	0	0	0	114.1	H36 Q63	H36-A38 WeakPolarHBondContact CE1-CB 3.38Å; H36-A38 WeakPolarHBondContact NE2-CB 3.48Å; A38-Q63 HydrophobicContact CB-CB 4.28Å; A38-Q63 HydrophobicContact CB-CG 3.72Å
39	H	96	Very high	94.1	Very high	8 Å²	8	42 Å²	42	4%	0.037	25%	0.249	C	C	.	.			trans	-91.1	143	179.3	-72.6	-61.7	0	0	0	111.4	H37 V43 T55 S57 D59 T61 Q63	H37-H39 VanDerWaalsContact C-N 3.34Å; H39-V43 HydrophobicContact CB-CG2 4.36Å; H39-T55 PolarHBondContact CE1-O 2.68Å; H39-T55 WeakPolarHBondContact NE2-CB 3.4Å; H39-T55 PolarHBondContact NE2-O 2.9Å; H39-T55 PolarHBondContact NE2-OG1 3.07Å; H39-S57 WeakPolarHBondContact CE1-CB 3.47Å; H39-S57 WeakPolarHBondContact ND1-CB 3.35Å; H39-D59 WeakPolarHBondContact CA-OD2 3.48Å; H39-D59 WeakPolarHBondContact CB-OD2 3.25Å; H39-D59 IonicContact CG-OD2 3.43Å; H39-D59 IonicContact ND1-OD1 3.08Å; H39-D59 PolarHBondContact ND1-OD1 3.29Å; H39-D59 IonicContact ND1-OD2 3.19Å; H39-D59 PolarHBondContact ND1-OD2 3.4Å; H39-T61 PolarHBondContact ND1-OG1 2.8Å; H39-Q63 WeakPolarHBondContact CE1-CG 3.47Å
40	T	95.8	Very high	94.1	Very high	108 Å²	108	43.7 Å²	43.7	66%	0.663	25%	0.252	S	S	*	.	S	Bend	trans	-101.2	2.1	175.8	61.9	0	0	0	0	112.3	Q14 D59	Q14-T40 VanDerWaalsContact CD-C 3.42Å; Q14-T40 VanDerWaalsContact CD-O 3.28Å; Q14-T40 PolarHBondContact NE2-O 3.09Å; Q14-T40 VanDerWaalsContact NE2-O 3.14Å; Q14-T40 PolarHBondContact OE1-O 3.47Å; T40-D59 PolarHBondContact N-OD2 3.05Å; T40-D59 VanDerWaalsContact OG1-CB 3.3Å; T40-D59 WeakPolarHBondContact OG1-CB 3.33Å
41	A	97.1	Very high	94.1	Very high	21 Å²	21	47.1 Å²	47.1	17%	0.174	26%	0.261	C	S	.	.	S	Bend	trans	-145.8	177	176.7	0	0	0	0	0	110.9	Q14 V43 S57 K58 D59	Q14-A41 WeakPolarHBondContact CA-O 3.33Å; Q14-A41 WeakPolarHBondContact CB-O 2.86Å; Q14-A41 VanDerWaalsContact CG-C 3.5Å; A41-V43 PolarHBondContact O-N 2.91Å; A41-S57 PolarHBondContact O-OG 2.92Å; A41-K58 HydrophobicContact CB-CB 3.75Å; A41-D59 HydrophobicContact CB-CB 3.93Å
42	S	97	Very high	94.2	Very high	12 Å²	12	42.1 Å²	42.1	8%	0.084	24%	0.24	C	C	.	.			trans	-55	129.8	-177.7	176.2	0	0	0	0	111.2	Y12 S44 S57 K58	Y12-S42 VanDerWaalsContact CD1-OG 3.31Å; Y12-S42 WeakPolarHBondContact CD1-OG 3.28Å; S42-S44 PolarHBondContact O-N 2.83Å; S42-S57 WeakPolarHBondContact O-CA 3.33Å; S42-S57 PolarHBondContact O-OG 2.96Å; S42-K58 PolarHBondContact O-N 2.87Å
43	V	98	Very high	94.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	128.7	170.3	-169.7	0	0	0	0	107.8	S11 H39 A41 T55 G56 T296	S11-V43 PolarHBondContact O-N 2.9Å; S11-V43 VanDerWaalsContact O-N 3.07Å; H39-V43 HydrophobicContact CB-CG2 4.36Å; A41-V43 PolarHBondContact O-N 2.91Å; V43-T55 HydrophobicContact CG1-CG2 4.3Å; V43-G56 WeakPolarHBondContact CG1-O 3.29Å; V43-T296 VanDerWaalsContact O-CB 3.29Å; V43-T296 WeakPolarHBondContact O-CB 3.33Å; V43-T296 PolarHBondContact O-OG1 2.79Å
44	S	97.2	Very high	94.6	Very high	34 Å²	34	34.7 Å²	34.7	24%	0.238	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-28.7	-173.3	41.2	0	0	0	0	112.8	S42 G56 S57 I83	S42-S44 PolarHBondContact O-N 2.83Å; S44-G56 PolarHBondContact N-O 3.16Å; S44-G56 PolarHBondContact OG-O 2.99Å; S44-G56 VanDerWaalsContact OG-O 3.13Å; S44-S57 WeakPolarHBondContact OG-CA 3.48Å; S44-I83 WeakPolarHBondContact CB-O 3.45Å; S44-I83 PolarHBondContact OG-O 2.93Å
45	A	97.1	Very high	94.9	Very high	8 Å²	8	33.8 Å²	33.8	7%	0.066	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	149	-178.7	0	0	0	0	0	111.1	T55 G56 L86	A45-T55 WeakPolarHBondContact O-CA 3.45Å; A45-G56 PolarHBondContact N-O 2.75Å; A45-G56 VanDerWaalsContact N-O 3.13Å; A45-G56 PolarHBondContact O-N 2.81Å; A45-L86 HydrophobicContact CB-CB 4.27Å; A45-L86 HydrophobicContact CB-CD1 4Å; A45-L86 HydrophobicContact CB-CG 3.99Å
46	V	97.8	Very high	95.2	Very high	18 Å²	18	30.3 Å²	30.3	11%	0.109	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	141.4	172	62.2	0	0	0	0	109	I8 V53 V54 T55 C297 A299	I8-V46 HydrophobicContact CB-CG2 4.34Å; I8-V46 HydrophobicContact CG2-CG2 3.73Å; V46-V53 HydrophobicContact CG2-CG1 4.27Å; V46-V54 CarbonylContact C-O 3.6Å; V46-V54 WeakPolarHBondContact CA-O 3.42Å; V46-T55 HydrophobicContact CB-CG2 4.33Å; V46-T55 HydrophobicContact CG2-CG2 3.98Å; V46-C297 HydrophobicContact CG1-CB 3.84Å; V46-A299 HydrophobicContact CB-CB 4.44Å; V46-A299 HydrophobicContact CG1-CB 3.77Å; V46-A299 HydrophobicContact CG2-CB 3.91Å
47	A	96.6	Very high	95.6	Very high	9 Å²	9	30 Å²	30	7%	0.074	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	149.1	170.2	0	0	0	0	0	110.2	V54 L86 F88	A47-V54 HydrophobicContact CB-CG2 3.81Å; A47-V54 PolarHBondContact N-O 2.81Å; A47-V54 PolarHBondContact O-N 2.88Å; A47-L86 HydrophobicContact CB-CB 3.9Å; A47-F88 HydrophobicContact CB-CD2 3.79Å; A47-F88 HydrophobicContact CB-CE2 4.07Å
48	A	94.9	Very high	95.8	Very high	30 Å²	30	29.1 Å²	29.1	25%	0.248	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	138.4	-179.8	0	0	0	0	0	110.7	I8 V53 F88 A299 V300 W301	I8-A48 HydrophobicContact CD1-CB 4.4Å; A48-V53 HydrophobicContact CB-CG2 4.27Å; A48-F88 WeakPolarHBondContact O-CD2 3.34Å; A48-A299 HydrophobicContact CB-CB 4.23Å; A48-V300 WeakPolarHBondContact CB-O 3.17Å; A48-W301 HydrophobicContact CB-CB 4.16Å
49	S	93.3	Very high	96.1	Very high	13 Å²	13	29 Å²	29	9%	0.091	16%	0.158	C	C	.	.			trans	-120.2	177.9	170.1	66.6	0	0	0	0	109.2	R51 F52 W301	S49-R51 PolarHBondContact O-N 3.44Å; S49-F52 PolarHBondContact N-O 2.94Å; S49-F52 PolarHBondContact OG-N 2.82Å; S49-F52 PolarHBondContact OG-O 2.86Å; S49-W301 PolarHBondContact O-NE1 2.84Å
50	E	88.6	Confident	96.1	Very high	101 Å²	101	33 Å²	33	47%	0.472	18%	0.177	S	C	.	.	S	Bend	trans	-56.8	-25.4	179.4	-57	-171.3	135	0	0	114.6	W301 S304	E50-W301 PolarHBondContact O-NE1 2.71Å; E50-S304 VanDerWaalsContact CG-OG 3.24Å; E50-S304 WeakPolarHBondContact CG-OG 3.12Å; E50-S304 PolarHBondContact OE1-OG 3.42Å
51	R	91.8	Very high	96.2	Very high	92 Å²	92	29 Å²	29	35%	0.347	15%	0.152	S	C	.	.	S	Bend	trans	-120.1	-36.9	-176.9	179.2	173	177.6	-169.7	-6.7	113.5	S49 D66 M67 K68	S49-R51 PolarHBondContact O-N 3.44Å; R51-D66 IonicContact CZ-OD2 3.27Å; R51-D66 VanDerWaalsContact CZ-OD2 3.3Å; R51-D66 IonicContact NE-OD1 3.97Å; R51-D66 IonicContact NE-OD2 2.86Å; R51-D66 PolarHBondContact NE-OD2 2.85Å; R51-D66 IonicContact NH2-OD2 2.76Å; R51-D66 PolarHBondContact NH2-OD2 2.92Å; R51-M67 WeakPolarHBondContact O-CB 3.48Å; R51-M67 PolarHBondContact O-N 2.87Å; R51-K68 HydrophobicContact CG-CD 4.17Å; R51-K68 HydrophobicContact CG-CG 4.19Å
52	F	94.2	Very high	96.3	Very high	12 Å²	12	28 Å²	28	5%	0.053	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	141.9	-169.7	-64.1	-78.5	0	0	0	111.6	S49 Y65 D66 H73 F88 W111	S49-F52 PolarHBondContact N-O 2.94Å; S49-F52 PolarHBondContact OG-N 2.82Å; S49-F52 PolarHBondContact OG-O 2.86Å; F52-Y65 WeakPolarHBondContact CA-O 3.29Å; F52-D66 HydrophobicContact CD1-CB 4.04Å; F52-D66 HydrophobicContact CE1-CB 3.78Å; F52-H73 HydrophobicContact CE1-CB 4.16Å; F52-H73 AromaticContact CE1-CG 3.78Å; F52-H73 AromaticContact CE1-ND1 3.9Å; F52-F88 HydrophobicContact CB-CZ 4.32Å; F52-W111 HydrophobicContact CB-CH2 4.39Å; F52-W111 HydrophobicContact CB-CZ2 3.93Å; F52-W111 HydrophobicContact CD1-CZ2 4.06Å; F52-W111 AromaticContact CD2-CZ2 3.59Å; F52-W111 HydrophobicContact CD2-CZ2 3.59Å; F52-W111 HydrophobicContact CE1-CZ2 4.44Å; F52-W111 AromaticContact CE1-NE1 3.98Å; F52-W111 AromaticContact CE2-CZ2 3.99Å; F52-W111 HydrophobicContact CE2-CZ2 3.99Å; F52-W111 AromaticContact CE2-NE1 3.92Å; F52-W111 AromaticContact CG-CZ2 3.61Å; F52-W111 HydrophobicContact CG-CZ2 3.61Å; F52-W111 HydrophobicContact CZ-CZ2 4.4Å; F52-W111 AromaticContact CZ-NE1 3.7Å
53	V	95.7	Very high	96.3	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.012	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136	164.7	170.4	0	0	0	0	107.2	I8 V46 A48 Y65 M67 W301	I8-V53 HydrophobicContact CB-CG1 4.35Å; I8-V53 HydrophobicContact CD1-CB 4.26Å; I8-V53 HydrophobicContact CD1-CG1 3.92Å; I8-V53 HydrophobicContact CD1-CG2 3.29Å; I8-V53 HydrophobicContact CG1-CG1 4.06Å; I8-V53 HydrophobicContact CG1-CG2 4.09Å; I8-V53 HydrophobicContact CG2-CG1 3.75Å; V46-V53 HydrophobicContact CG2-CG1 4.27Å; A48-V53 HydrophobicContact CB-CG2 4.27Å; V53-Y65 PolarHBondContact N-O 2.99Å; V53-Y65 PolarHBondContact O-N 2.75Å; V53-M67 HydrophobicContact CB-CG 4.3Å; V53-M67 HydrophobicContact CB-SD 4.11Å; V53-M67 HydrophobicContact CG2-CE 4Å; V53-M67 HydrophobicContact CG2-CG 3.53Å; V53-M67 HydrophobicContact CG2-SD 3.47Å; V53-M67 WeakPolarHBondContact CG2-SD 3.25Å; V53-W301 HydrophobicContact CG2-CB 4.36Å; V53-W301 HydrophobicContact CG2-CG 4.34Å
54	V	97.5	Very high	96.2	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	136.2	-179.2	-56.3	0	0	0	0	109.9	V46 A47 I62 Q63 L64 L86 F88 L94 W111	V46-V54 CarbonylContact C-O 3.6Å; V46-V54 WeakPolarHBondContact CA-O 3.42Å; A47-V54 HydrophobicContact CB-CG2 3.81Å; A47-V54 PolarHBondContact N-O 2.81Å; A47-V54 PolarHBondContact O-N 2.88Å; V54-I62 HydrophobicContact CB-CG2 4.15Å; V54-Q63 VanDerWaalsContact CA-O 3.28Å; V54-Q63 WeakPolarHBondContact CA-O 3.33Å; V54-L64 HydrophobicContact CB-CD2 4.09Å; V54-L64 HydrophobicContact CG1-CD2 3.29Å; V54-L86 HydrophobicContact CG2-CB 4.48Å; V54-L86 HydrophobicContact CG2-CD1 4.12Å; V54-F88 HydrophobicContact CB-CE2 4.5Å; V54-F88 HydrophobicContact CB-CZ 4.43Å; V54-F88 HydrophobicContact CG1-CE2 4.11Å; V54-F88 HydrophobicContact CG1-CZ 3.63Å; V54-F88 HydrophobicContact CG2-CE2 3.63Å; V54-F88 HydrophobicContact CG2-CZ 3.88Å; V54-L94 HydrophobicContact CB-CD2 4.31Å; V54-L94 HydrophobicContact CG1-CD2 4.19Å; V54-L94 HydrophobicContact CG2-CD1 3.77Å; V54-L94 HydrophobicContact CG2-CD2 3.95Å; V54-W111 HydrophobicContact CG1-CH2 3.93Å; V54-W111 HydrophobicContact CG1-CZ3 4.47Å
55	T	98.1	Very high	96.2	Very high	4 Å²	4	28.4 Å²	28.4	3%	0.025	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	136.1	-179.8	50.3	0	0	0	0	109.7	T16 H39 V43 A45 V46 I62 Q63	T16-T55 HydrophobicContact CG2-CG2 3.77Å; H39-T55 PolarHBondContact CE1-O 2.68Å; H39-T55 WeakPolarHBondContact NE2-CB 3.4Å; H39-T55 PolarHBondContact NE2-O 2.9Å; H39-T55 PolarHBondContact NE2-OG1 3.07Å; V43-T55 HydrophobicContact CG1-CG2 4.3Å; A45-T55 WeakPolarHBondContact O-CA 3.45Å; V46-T55 HydrophobicContact CB-CG2 4.33Å; V46-T55 HydrophobicContact CG2-CG2 3.98Å; T55-I62 CarbonylContact O-C 3.51Å; T55-I62 WeakPolarHBondContact O-CA 3.43Å; T55-Q63 PolarHBondContact N-O 3.03Å; T55-Q63 PolarHBondContact O-N 2.91Å
56	G	98	Very high	96	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	144.3	177.3	0	0	0	0	0	109.3	V43 S44 A45 L86	V43-G56 WeakPolarHBondContact CG1-O 3.29Å; S44-G56 PolarHBondContact N-O 3.16Å; S44-G56 PolarHBondContact OG-O 2.99Å; S44-G56 VanDerWaalsContact OG-O 3.13Å; A45-G56 PolarHBondContact N-O 2.75Å; A45-G56 VanDerWaalsContact N-O 3.13Å; A45-G56 PolarHBondContact O-N 2.81Å; G56-L86 VanDerWaalsContact N-CD1 3.25Å
57	S	98.1	Very high	95.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	168.7	-172.1	168.9	0	0	0	0	112.4	H39 A41 S42 S44 D59 E60 T61 I83	H39-S57 WeakPolarHBondContact CE1-CB 3.47Å; H39-S57 WeakPolarHBondContact ND1-CB 3.35Å; A41-S57 PolarHBondContact O-OG 2.92Å; S42-S57 WeakPolarHBondContact O-CA 3.33Å; S42-S57 PolarHBondContact O-OG 2.96Å; S44-S57 WeakPolarHBondContact OG-CA 3.48Å; S57-D59 VanDerWaalsContact CB-CG 3.48Å; S57-D59 VanDerWaalsContact CB-OD1 3.25Å; S57-D59 WeakPolarHBondContact CB-OD1 3.3Å; S57-D59 WeakPolarHBondContact CB-OD2 3.12Å; S57-D59 PolarHBondContact O-N 3Å; S57-D59 PolarHBondContact OG-N 2.91Å; S57-D59 VanDerWaalsContact OG-N 3.12Å; S57-D59 PolarHBondContact OG-OD1 2.88Å; S57-D59 PolarHBondContact OG-OD2 2.88Å; S57-E60 PolarHBondContact O-N 3.5Å; S57-T61 PolarHBondContact N-O 2.88Å; S57-I83 PolarHBondContact O-N 2.83Å
58	K	97.7	Very high	95.3	Very high	111 Å²	111	34.1 Å²	34.1	48%	0.483	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-10	167.2	-65.2	-169.3	-180	-171.1	0	113.7	A41 S42 E60 T82	A41-K58 HydrophobicContact CB-CB 3.75Å; S42-K58 PolarHBondContact O-N 2.87Å; K58-E60 PolarHBondContact O-N 2.98Å; K58-T82 HydrophobicContact CB-CG2 4.3Å; K58-T82 HydrophobicContact CG-CG2 3.63Å
59	D	97.1	Very high	95.1	Very high	26 Å²	26	39 Å²	39	14%	0.139	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	9.9	172.8	62.1	32.7	0	0	0	113.2	H39 T40 A41 S57 T61	H39-D59 WeakPolarHBondContact CA-OD2 3.48Å; H39-D59 WeakPolarHBondContact CB-OD2 3.25Å; H39-D59 IonicContact CG-OD2 3.43Å; H39-D59 IonicContact ND1-OD1 3.08Å; H39-D59 PolarHBondContact ND1-OD1 3.29Å; H39-D59 IonicContact ND1-OD2 3.19Å; H39-D59 PolarHBondContact ND1-OD2 3.4Å; T40-D59 PolarHBondContact N-OD2 3.05Å; T40-D59 VanDerWaalsContact OG1-CB 3.3Å; T40-D59 WeakPolarHBondContact OG1-CB 3.33Å; A41-D59 HydrophobicContact CB-CB 3.93Å; S57-D59 VanDerWaalsContact CB-CG 3.48Å; S57-D59 VanDerWaalsContact CB-OD1 3.25Å; S57-D59 WeakPolarHBondContact CB-OD1 3.3Å; S57-D59 WeakPolarHBondContact CB-OD2 3.12Å; S57-D59 PolarHBondContact O-N 3Å; S57-D59 PolarHBondContact OG-N 2.91Å; S57-D59 VanDerWaalsContact OG-N 3.12Å; S57-D59 PolarHBondContact OG-OD1 2.88Å; S57-D59 PolarHBondContact OG-OD2 2.88Å; D59-T61 PolarHBondContact O-N 2.83Å; D59-T61 VanDerWaalsContact O-N 3.11Å; D59-T61 WeakPolarHBondContact OD1-CB 3.41Å; D59-T61 PolarHBondContact OD1-N 2.87Å; D59-T61 PolarHBondContact OD1-OG1 2.97Å
60	E	97.2	Very high	95	Very high	93 Å²	93	42.1 Å²	42.1	44%	0.435	19%	0.185	S	C	.	.	S	Bend	trans	70.4	1.6	175.6	-38.9	-178.5	165.3	0	0	113.9	S57 K58 G81	S57-E60 PolarHBondContact O-N 3.5Å; K58-E60 PolarHBondContact O-N 2.98Å; E60-G81 WeakPolarHBondContact CA-O 3.31Å; E60-G81 VanDerWaalsContact CD-N 3.3Å; E60-G81 PolarHBondContact OE1-N 2.9Å
61	T	97.4	Very high	95.2	Very high	22 Å²	22	40.6 Å²	40.6	14%	0.135	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	151.5	179.6	75.4	0	0	0	0	112.6	H39 S57 D59 Q63 L77	H39-T61 PolarHBondContact ND1-OG1 2.8Å; S57-T61 PolarHBondContact N-O 2.88Å; D59-T61 PolarHBondContact O-N 2.83Å; D59-T61 VanDerWaalsContact O-N 3.11Å; D59-T61 WeakPolarHBondContact OD1-CB 3.41Å; D59-T61 PolarHBondContact OD1-N 2.87Å; D59-T61 PolarHBondContact OD1-OG1 2.97Å; T61-Q63 PolarHBondContact OG1-NE2 2.81Å; T61-Q63 VanDerWaalsContact OG1-NE2 3.15Å; T61-L77 HydrophobicContact CG2-CD2 4.34Å; T61-L77 HydrophobicContact CG2-CG 4.47Å
62	I	98.2	Very high	95.3	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	117.9	164.7	-54.7	164.8	0	0	0	107.7	V54 T55 L64 A75 L76 I83 L86 L94 W106	V54-I62 HydrophobicContact CB-CG2 4.15Å; T55-I62 CarbonylContact O-C 3.51Å; T55-I62 WeakPolarHBondContact O-CA 3.43Å; I62-L64 HydrophobicContact CG2-CD2 4.34Å; I62-A75 CarbonylContact O-C 3.5Å; I62-A75 VanDerWaalsContact O-CA 3.3Å; I62-A75 WeakPolarHBondContact O-CA 3.25Å; I62-L76 HydrophobicContact CB-CB 4.07Å; I62-L76 HydrophobicContact CB-CD1 4.23Å; I62-L76 HydrophobicContact CB-CG 4.38Å; I62-L76 HydrophobicContact CD1-CD1 4.33Å; I62-L76 HydrophobicContact CG2-CD1 4.17Å; I62-L76 PolarHBondContact N-O 3.49Å; I62-L76 VanDerWaalsContact N-O 3.12Å; I62-L76 PolarHBondContact O-N 2.9Å; I62-I83 HydrophobicContact CD1-CD1 4.28Å; I62-I83 HydrophobicContact CG1-CD1 3.95Å; I62-I83 HydrophobicContact CG1-CG1 3.85Å; I62-I83 HydrophobicContact CG1-CG2 4.14Å; I62-L86 HydrophobicContact CD1-CD2 3.82Å; I62-L86 HydrophobicContact CG1-CD2 4.16Å; I62-L86 HydrophobicContact CG2-CD1 4.21Å; I62-L86 HydrophobicContact CG2-CD2 4.19Å; I62-L94 HydrophobicContact CG2-CD2 4.49Å; I62-W106 HydrophobicContact CD1-CZ2 4.39Å
63	Q	97.7	Very high	95.2	Very high	28 Å²	28	45.8 Å²	45.8	13%	0.131	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	139.4	178.5	-60.9	-66.1	-25.5	0	0	110.1	A38 H39 V54 T55 T61	A38-Q63 HydrophobicContact CB-CB 4.28Å; A38-Q63 HydrophobicContact CB-CG 3.72Å; H39-Q63 WeakPolarHBondContact CE1-CG 3.47Å; V54-Q63 VanDerWaalsContact CA-O 3.28Å; V54-Q63 WeakPolarHBondContact CA-O 3.33Å; T55-Q63 PolarHBondContact N-O 3.03Å; T55-Q63 PolarHBondContact O-N 2.91Å; T61-Q63 PolarHBondContact OG1-NE2 2.81Å; T61-Q63 VanDerWaalsContact OG1-NE2 3.15Å
64	L	97.1	Very high	95.2	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	127.7	-175.9	-51.8	176.4	0	0	0	110	V54 I62 H73 G74 L76 W111	V54-L64 HydrophobicContact CB-CD2 4.09Å; V54-L64 HydrophobicContact CG1-CD2 3.29Å; I62-L64 HydrophobicContact CG2-CD2 4.34Å; L64-H73 HydrophobicContact CB-CB 3.96Å; L64-H73 PolarHBondContact O-N 2.86Å; L64-G74 VanDerWaalsContact CB-O 3.29Å; L64-G74 WeakPolarHBondContact CB-O 3.29Å; L64-G74 WeakPolarHBondContact CG-O 3.4Å; L64-G74 PolarHBondContact N-O 2.86Å; L64-L76 HydrophobicContact CD1-CD2 3.93Å; L64-L76 HydrophobicContact CD1-CG 4.07Å; L64-L76 HydrophobicContact CD2-CD1 3.99Å; L64-L76 HydrophobicContact CD2-CG 4.18Å; L64-L76 HydrophobicContact CG-CG 4.25Å; L64-W111 HydrophobicContact CD1-CB 4.1Å; L64-W111 HydrophobicContact CD1-CD2 3.41Å; L64-W111 VanDerWaalsContact CD1-CD2 3.41Å; L64-W111 HydrophobicContact CD1-CE3 3.77Å; L64-W111 HydrophobicContact CD1-CG 3.57Å; L64-W111 HydrophobicContact CD1-CZ2 4.28Å; L64-W111 HydrophobicContact CD1-CZ3 4.34Å; L64-W111 HydrophobicContact CD2-CD2 4.27Å; L64-W111 HydrophobicContact CD2-CE3 3.92Å; L64-W111 HydrophobicContact CD2-CH2 3.77Å; L64-W111 HydrophobicContact CD2-CZ2 4.14Å; L64-W111 HydrophobicContact CD2-CZ3 3.67Å; L64-W111 HydrophobicContact CG-CD2 4.47Å
65	Y	95.6	Very high	95.1	Very high	23 Å²	23	49.2 Å²	49.2	9%	0.09	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	124.6	177.5	-170.1	-93	0	0	0	110.8	F34 F52 V53 M67 R70 E72	F34-Y65 AromaticContact CD1-CE1 3.92Å; F34-Y65 HydrophobicContact CD1-CE1 3.92Å; F34-Y65 AromaticContact CD1-CZ 3.99Å; F34-Y65 HydrophobicContact CD2-CE1 4.49Å; F34-Y65 HydrophobicContact CD2-CE2 4.39Å; F34-Y65 HydrophobicContact CE1-CD1 4.22Å; F34-Y65 AromaticContact CE1-CE1 3.68Å; F34-Y65 HydrophobicContact CE1-CE1 3.68Å; F34-Y65 HydrophobicContact CE2-CD1 4.41Å; F34-Y65 HydrophobicContact CE2-CE1 4.28Å; F34-Y65 HydrophobicContact CG-CE1 4.33Å; F34-Y65 AromaticContact CG-CZ 3.98Å; F34-Y65 AromaticContact CZ-CD1 4Å; F34-Y65 HydrophobicContact CZ-CD1 4Å; F34-Y65 AromaticContact CZ-CE1 3.87Å; F34-Y65 HydrophobicContact CZ-CE1 3.87Å; F52-Y65 WeakPolarHBondContact CA-O 3.29Å; V53-Y65 PolarHBondContact N-O 2.99Å; V53-Y65 PolarHBondContact O-N 2.75Å; Y65-M67 HydrophobicContact CD1-CG 4.49Å; Y65-M67 HydrophobicContact CD1-SD 3.48Å; Y65-M67 WeakPolarHBondContact CD1-SD 3.39Å; Y65-M67 HydrophobicContact CE1-SD 3.7Å; Y65-M67 PolarHBondContact O-N 2.98Å; Y65-R70 PolarHBondContact OH-O 2.97Å; Y65-E72 HydrophobicContact CD2-CG 4.44Å
66	D	93.7	Very high	95.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	108.2	178.9	-170.9	-31.3	0	0	0	109.9	R51 F52 K68 K69 R70 T71	R51-D66 IonicContact CZ-OD2 3.27Å; R51-D66 VanDerWaalsContact CZ-OD2 3.3Å; R51-D66 IonicContact NE-OD1 3.97Å; R51-D66 IonicContact NE-OD2 2.86Å; R51-D66 PolarHBondContact NE-OD2 2.85Å; R51-D66 IonicContact NH2-OD2 2.76Å; R51-D66 PolarHBondContact NH2-OD2 2.92Å; F52-D66 HydrophobicContact CD1-CB 4.04Å; F52-D66 HydrophobicContact CE1-CB 3.78Å; D66-K68 VanDerWaalsContact C-N 3.28Å; D66-K68 PolarHBondContact O-N 2.79Å; D66-K68 WeakPolarHBondContact OD1-CB 3.43Å; D66-K68 PolarHBondContact OD1-N 2.81Å; D66-K69 HydrophobicContact CB-CB 4.17Å; D66-K69 PolarHBondContact O-N 3.06Å; D66-K69 PolarHBondContact OD1-N 3.08Å; D66-K69 VanDerWaalsContact OD1-N 3.11Å; D66-R70 WeakPolarHBondContact O-CA 3.28Å; D66-R70 PolarHBondContact O-N 2.84Å; D66-T71 PolarHBondContact N-O 3.39Å; D66-T71 PolarHBondContact O-N 3.04Å
67	M	91.2	Very high	94.9	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.01	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-21.6	-177.6	-60.1	-63.3	-79.9	0	0	113.2	E6 I8 F34 R51 V53 Y65 R70 W301	E6-M67 HydrophobicContact CB-CE 4.28Å; E6-M67 WeakPolarHBondContact OE2-CE 3.37Å; I8-M67 HydrophobicContact CD1-CE 4.43Å; F34-M67 HydrophobicContact CE1-CE 4.22Å; F34-M67 HydrophobicContact CE1-SD 4.1Å; F34-M67 HydrophobicContact CZ-SD 4.38Å; R51-M67 WeakPolarHBondContact O-CB 3.48Å; R51-M67 PolarHBondContact O-N 2.87Å; V53-M67 HydrophobicContact CB-CG 4.3Å; V53-M67 HydrophobicContact CB-SD 4.11Å; V53-M67 HydrophobicContact CG2-CE 4Å; V53-M67 HydrophobicContact CG2-CG 3.53Å; V53-M67 HydrophobicContact CG2-SD 3.47Å; V53-M67 WeakPolarHBondContact CG2-SD 3.25Å; Y65-M67 HydrophobicContact CD1-CG 4.49Å; Y65-M67 HydrophobicContact CD1-SD 3.48Å; Y65-M67 WeakPolarHBondContact CD1-SD 3.39Å; Y65-M67 HydrophobicContact CE1-SD 3.7Å; Y65-M67 PolarHBondContact O-N 2.98Å; M67-R70 PolarHBondContact O-NE 2.84Å; M67-R70 VanDerWaalsContact O-NE 3.12Å; M67-W301 HydrophobicContact CB-CD2 4.12Å; M67-W301 VanDerWaalsContact CB-CE2 3.48Å; M67-W301 HydrophobicContact CB-CH2 3.98Å; M67-W301 HydrophobicContact CB-CZ2 3.42Å; M67-W301 VanDerWaalsContact CB-CZ2 3.42Å; M67-W301 HydrophobicContact CE-CB 4.13Å; M67-W301 HydrophobicContact CE-CD2 3.58Å; M67-W301 HydrophobicContact CE-CE3 3.66Å; M67-W301 HydrophobicContact CE-CG 3.79Å; M67-W301 HydrophobicContact CE-CZ3 4.28Å; M67-W301 HydrophobicContact CG-CD2 4.03Å; M67-W301 HydrophobicContact CG-CG 4.16Å; M67-W301 HydrophobicContact CG-CZ2 4.2Å
68	K	89.3	Confident	94.8	Very high	152 Å²	152	59.9 Å²	59.9	66%	0.661	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-40.8	175.3	-68.6	-171.7	177.2	-174	0	111	R51 D66	R51-K68 HydrophobicContact CG-CD 4.17Å; R51-K68 HydrophobicContact CG-CG 4.19Å; D66-K68 VanDerWaalsContact C-N 3.28Å; D66-K68 PolarHBondContact O-N 2.79Å; D66-K68 WeakPolarHBondContact OD1-CB 3.43Å; D66-K68 PolarHBondContact OD1-N 2.81Å
69	K	90.5	Very high	94.7	Very high	134 Å²	134	55 Å²	55	58%	0.583	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-18.8	179.9	-66.2	-174.2	177.1	-172.9	0	113.7	D66 T71	D66-K69 HydrophobicContact CB-CB 4.17Å; D66-K69 PolarHBondContact O-N 3.06Å; D66-K69 PolarHBondContact OD1-N 3.08Å; D66-K69 VanDerWaalsContact OD1-N 3.11Å; K69-T71 VanDerWaalsContact C-N 3.3Å
70	R	90.7	Very high	94.7	Very high	78 Å²	78	61.4 Å²	61.4	29%	0.294	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	42.7	-172.5	-56.2	-66.9	176.7	177.7	-8.9	112.2	E6 R20 D33 Y65 D66 M67	E6-R70 VanDerWaalsContact CD-NH2 3.28Å; E6-R70 IonicContact OE1-CZ 3.45Å; E6-R70 IonicContact OE1-NH1 2.65Å; E6-R70 PolarHBondContact OE1-NH1 2.79Å; E6-R70 VanDerWaalsContact OE1-NH1 3.08Å; E6-R70 IonicContact OE1-NH2 3.35Å; E6-R70 PolarHBondContact OE1-NH2 3.3Å; E6-R70 IonicContact OE2-CZ 3.42Å; E6-R70 IonicContact OE2-NH1 2.65Å; E6-R70 PolarHBondContact OE2-NH1 3.08Å; E6-R70 IonicContact OE2-NH2 3.22Å; E6-R70 PolarHBondContact OE2-NH2 2.77Å; R20-R70 VanDerWaalsContact NH2-CZ 3.26Å; R20-R70 VanDerWaalsContact NH2-NH2 3.17Å; D33-R70 IonicContact OD2-CZ 3.94Å; D33-R70 IonicContact OD2-NE 3.57Å; D33-R70 IonicContact OD2-NH1 2.68Å; D33-R70 PolarHBondContact OD2-NH1 3.31Å; Y65-R70 PolarHBondContact OH-O 2.97Å; D66-R70 WeakPolarHBondContact O-CA 3.28Å; D66-R70 PolarHBondContact O-N 2.84Å; M67-R70 PolarHBondContact O-NE 2.84Å; M67-R70 VanDerWaalsContact O-NE 3.12Å
71	T	92.6	Very high	94.6	Very high	69 Å²	69	57.4 Å²	57.4	42%	0.423	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	152.7	-178.3	61	0	0	0	0	111.1	D66 K69 H73	D66-T71 PolarHBondContact N-O 3.39Å; D66-T71 PolarHBondContact O-N 3.04Å; K69-T71 VanDerWaalsContact C-N 3.3Å; T71-H73 PolarHBondContact O-N 3.21Å
72	E	92.9	Very high	94.6	Very high	126 Å²	126	57.1 Å²	57.1	59%	0.589	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.4	131.5	168.1	-48.7	-175.9	168.1	0	0	109.2	H36 Y65	H36-E72 WeakPolarHBondContact CE1-CG 3.3Å; H36-E72 IonicContact CE1-OE1 3.5Å; H36-E72 PolarHBondContact CE1-OE1 3.4Å; H36-E72 IonicContact CE1-OE2 2.76Å; H36-E72 IonicContact ND1-OE1 2.68Å; H36-E72 PolarHBondContact ND1-OE1 3.32Å; Y65-E72 HydrophobicContact CD2-CG 4.44Å
73	H	93.8	Very high	94.6	Very high	87 Å²	87	57 Å²	57	40%	0.403	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-33.8	-179.8	-167.4	73.2	0	0	0	111.9	F52 L64 T71 W111	F52-H73 HydrophobicContact CE1-CB 4.16Å; F52-H73 AromaticContact CE1-CG 3.78Å; F52-H73 AromaticContact CE1-ND1 3.9Å; L64-H73 HydrophobicContact CB-CB 3.96Å; L64-H73 PolarHBondContact O-N 2.86Å; T71-H73 PolarHBondContact O-N 3.21Å; H73-W111 AromaticContact CD2-CD1 3.34Å; H73-W111 AromaticContact CD2-NE1 3.4Å; H73-W111 PolarHBondContact CD2-NE1 3.31Å; H73-W111 AromaticContact NE2-CD1 3.25Å; H73-W111 VanDerWaalsContact NE2-CD1 3.25Å; H73-W111 AromaticContact NE2-NE1 3.51Å
74	G	94.4	Very high	94.6	Very high	33 Å²	33	57.5 Å²	57.5	34%	0.34	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	151.9	-172.6	179	0	0	0	0	0	112.2	L64	L64-G74 VanDerWaalsContact CB-O 3.29Å; L64-G74 WeakPolarHBondContact CB-O 3.29Å; L64-G74 WeakPolarHBondContact CG-O 3.4Å; L64-G74 PolarHBondContact N-O 2.86Å
75	A	96.1	Very high	94.6	Very high	41 Å²	41	57.8 Å²	57.8	34%	0.339	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	146.6	178.8	0	0	0	0	0	110.7	I62 L77	I62-A75 CarbonylContact O-C 3.5Å; I62-A75 VanDerWaalsContact O-CA 3.3Å; I62-A75 WeakPolarHBondContact O-CA 3.25Å; A75-L77 HydrophobicContact CB-CD1 4.04Å
76	L	97.2	Very high	94.7	Very high	10 Å²	10	57.3 Å²	57.3	5%	0.052	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	122.4	170	-47.7	173.5	0	0	0	108.6	I62 L64 L94 W106 W111	I62-L76 HydrophobicContact CB-CB 4.07Å; I62-L76 HydrophobicContact CB-CD1 4.23Å; I62-L76 HydrophobicContact CB-CG 4.38Å; I62-L76 HydrophobicContact CD1-CD1 4.33Å; I62-L76 HydrophobicContact CG2-CD1 4.17Å; I62-L76 PolarHBondContact N-O 3.49Å; I62-L76 VanDerWaalsContact N-O 3.12Å; I62-L76 PolarHBondContact O-N 2.9Å; L64-L76 HydrophobicContact CD1-CD2 3.93Å; L64-L76 HydrophobicContact CD1-CG 4.07Å; L64-L76 HydrophobicContact CD2-CD1 3.99Å; L64-L76 HydrophobicContact CD2-CG 4.18Å; L64-L76 HydrophobicContact CG-CG 4.25Å; L76-L94 HydrophobicContact CD1-CD2 4.27Å; L76-W106 HydrophobicContact CB-CE3 4.35Å; L76-W106 HydrophobicContact CB-CH2 3.68Å; L76-W106 HydrophobicContact CB-CZ2 4.09Å; L76-W106 HydrophobicContact CB-CZ3 3.83Å; L76-W106 HydrophobicContact CD1-CD2 3.68Å; L76-W106 HydrophobicContact CD1-CE3 3.79Å; L76-W106 HydrophobicContact CD1-CG 4.05Å; L76-W106 HydrophobicContact CD1-CH2 4.38Å; L76-W106 HydrophobicContact CD1-CZ2 4.33Å; L76-W106 HydrophobicContact CD1-CZ3 4.14Å; L76-W106 HydrophobicContact CD2-CE3 3.92Å; L76-W106 HydrophobicContact CD2-CZ3 3.87Å; L76-W106 HydrophobicContact CG-CE3 4.25Å; L76-W106 HydrophobicContact CG-CH2 4.44Å; L76-W106 HydrophobicContact CG-CZ3 4.17Å; L76-W111 HydrophobicContact CD1-CE3 4.03Å; L76-W111 HydrophobicContact CD1-CZ3 4.32Å; L76-W111 HydrophobicContact CD2-CB 3.96Å; L76-W111 HydrophobicContact CD2-CE3 4.35Å; L76-W111 WeakPolarHBondContact CD2-O 3.49Å
77	L	95.3	Very high	94.9	Very high	133 Å²	133	59 Å²	59	70%	0.696	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.3	107.3	179.1	-58.1	97.1	0	0	0	108.4	T61 A75	T61-L77 HydrophobicContact CG2-CD2 4.34Å; T61-L77 HydrophobicContact CG2-CG 4.47Å; A75-L77 HydrophobicContact CB-CD1 4.04Å
78	H	95.2	Very high	95.1	Very high	84 Å²	84	60.2 Å²	60.2	39%	0.389	31%	0.305	S	S	.	.			trans	-157.6	-30.4	178.4	-166.5	84.2	0	0	0	113.8	C104 W106 T116	H78-C104 PolarHBondContact CD2-SG 3.23Å; H78-W106 HydrophobicContact CB-CH2 3.5Å; H78-W106 HydrophobicContact CB-CZ2 3.89Å; H78-T116 PolarHBondContact NE2-OG1 3.3Å
79	H	95.9	Very high	95.3	Very high	9 Å²	9	56.9 Å²	56.9	4%	0.042	29%	0.289	C	S	.	.			trans	-77.5	149.4	177.1	-77.5	-74.3	0	0	0	111.4	I83 S96 D100 L102 C104	H79-I83 HydrophobicContact CB-CD1 3.5Å; H79-I83 VanDerWaalsContact CB-CD1 3.5Å; H79-I83 VanDerWaalsContact CD2-CD1 3.43Å; H79-I83 WeakPolarHBondContact CD2-CD1 3.2Å; H79-S96 PolarHBondContact NE2-OG 3.4Å; H79-D100 WeakPolarHBondContact CA-OD2 3.23Å; H79-D100 WeakPolarHBondContact CB-OD2 3.16Å; H79-D100 IonicContact CE1-OD1 3.77Å; H79-D100 IonicContact CE1-OD2 2.91Å; H79-D100 IonicContact CG-OD2 3.98Å; H79-D100 IonicContact ND1-OD1 3.69Å; H79-D100 PolarHBondContact ND1-OD1 3.37Å; H79-D100 IonicContact ND1-OD2 2.75Å; H79-D100 PolarHBondContact ND1-OD2 3.5Å; H79-L102 PolarHBondContact CE1-O 2.88Å; H79-C104 PolarHBondContact CE1-SG 3.07Å; H79-C104 PolarHBondContact NE2-SG 3.47Å; H79-C104 VanDerWaalsContact NE2-SG 3.44Å
80	E	95.9	Very high	95.1	Very high	160 Å²	160	53.1 Å²	53.1	75%	0.748	29%	0.288	S	S	*	.	S	Bend	trans	-111.7	83.2	172.8	-68.7	-178	176.9	0	0	109.2	D100	E80-D100 HydrophobicContact CB-CB 4.28Å; E80-D100 PolarHBondContact N-OD2 2.86Å; E80-D100 WeakPolarHBondContact O-CB 3.42Å
81	G	95.9	Very high	95	Very high	10 Å²	10	52.8 Å²	52.8	10%	0.103	30%	0.298	C	S	.	.	S	Bend	trans	130.8	-179.8	-178.1	0	0	0	0	0	112.8	E60 I83	E60-G81 WeakPolarHBondContact CA-O 3.31Å; E60-G81 VanDerWaalsContact CD-N 3.3Å; E60-G81 PolarHBondContact OE1-N 2.9Å; G81-I83 PolarHBondContact O-N 2.82Å
82	T	97.6	Very high	94.8	Very high	15 Å²	15	51.5 Å²	51.5	9%	0.092	29%	0.292	C	S	.	.			trans	-57.5	134.3	-173.7	-54.9	0	0	0	0	111.7	K58 T84 G98 E99	K58-T82 HydrophobicContact CB-CG2 4.3Å; K58-T82 HydrophobicContact CG-CG2 3.63Å; T82-T84 HydrophobicContact CG2-CG2 4.5Å; T82-T84 PolarHBondContact O-N 2.93Å; T82-G98 CarbonylContact O-C 3.59Å; T82-G98 VanDerWaalsContact O-CA 3.24Å; T82-G98 WeakPolarHBondContact O-CA 3.21Å; T82-E99 WeakPolarHBondContact CB-OE2 3.31Å; T82-E99 PolarHBondContact N-OE2 2.85Å; T82-E99 PolarHBondContact O-N 2.94Å; T82-E99 VanDerWaalsContact OG1-CD 3.29Å; T82-E99 PolarHBondContact OG1-OE2 2.77Å
83	I	98.4	Very high	94.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	109.9	168.4	-51.6	-57.9	0	0	0	108.8	S44 S57 I62 H79 G81 L86	S44-I83 WeakPolarHBondContact CB-O 3.45Å; S44-I83 PolarHBondContact OG-O 2.93Å; S57-I83 PolarHBondContact O-N 2.83Å; I62-I83 HydrophobicContact CD1-CD1 4.28Å; I62-I83 HydrophobicContact CG1-CD1 3.95Å; I62-I83 HydrophobicContact CG1-CG1 3.85Å; I62-I83 HydrophobicContact CG1-CG2 4.14Å; H79-I83 HydrophobicContact CB-CD1 3.5Å; H79-I83 VanDerWaalsContact CB-CD1 3.5Å; H79-I83 VanDerWaalsContact CD2-CD1 3.43Å; H79-I83 WeakPolarHBondContact CD2-CD1 3.2Å; G81-I83 PolarHBondContact O-N 2.82Å; I83-L86 HydrophobicContact CG2-CD1 4.25Å; I83-L86 HydrophobicContact CG2-CD2 3.93Å; I83-L86 HydrophobicContact CG2-CG 3.9Å
84	T	97.6	Very high	95	Very high	37 Å²	37	44.3 Å²	44.3	23%	0.227	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-28.7	-173.1	55.7	0	0	0	0	113	T82 G97 E99 V124	T82-T84 HydrophobicContact CG2-CG2 4.5Å; T82-T84 PolarHBondContact O-N 2.93Å; T84-G97 PolarHBondContact N-O 2.96Å; T84-G97 PolarHBondContact OG1-O 2.92Å; T84-E99 HydrophobicContact CG2-CG 3.87Å; T84-V124 VanDerWaalsContact CB-O 3.31Å; T84-V124 WeakPolarHBondContact CB-O 3.35Å; T84-V124 WeakPolarHBondContact CG2-O 3.38Å; T84-V124 PolarHBondContact OG1-O 2.55Å
85	C	97	Very high	95.2	Very high	11 Å²	11	43.1 Å²	43.1	7%	0.074	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	145.5	179.7	56.7	0	0	0	0	112.6	S96 G97 L127	C85-S96 WeakPolarHBondContact O-CA 3.35Å; C85-G97 PolarHBondContact N-O 3.17Å; C85-G97 PolarHBondContact O-N 2.83Å; C85-L127 HydrophobicContact CB-CB 4.29Å; C85-L127 VanDerWaalsContact SG-CB 3.57Å
86	L	98.1	Very high	95.3	Very high	12 Å²	12	41.2 Å²	41.2	6%	0.063	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	135.5	175.8	-69.3	171.7	0	0	0	108.5	A45 A47 V54 G56 I62 I83 L94 L95 S96	A45-L86 HydrophobicContact CB-CB 4.27Å; A45-L86 HydrophobicContact CB-CD1 4Å; A45-L86 HydrophobicContact CB-CG 3.99Å; A47-L86 HydrophobicContact CB-CB 3.9Å; V54-L86 HydrophobicContact CG2-CB 4.48Å; V54-L86 HydrophobicContact CG2-CD1 4.12Å; G56-L86 VanDerWaalsContact N-CD1 3.25Å; I62-L86 HydrophobicContact CD1-CD2 3.82Å; I62-L86 HydrophobicContact CG1-CD2 4.16Å; I62-L86 HydrophobicContact CG2-CD1 4.21Å; I62-L86 HydrophobicContact CG2-CD2 4.19Å; I83-L86 HydrophobicContact CG2-CD1 4.25Å; I83-L86 HydrophobicContact CG2-CD2 3.93Å; I83-L86 HydrophobicContact CG2-CG 3.9Å; L86-L94 HydrophobicContact CB-CD1 4.46Å; L86-L94 HydrophobicContact CD2-CD1 4.36Å; L86-L94 HydrophobicContact CD2-CD2 4.39Å; L86-L95 WeakPolarHBondContact CA-O 3.37Å; L86-S96 VanDerWaalsContact CD2-CB 3.49Å
87	E	97.1	Very high	95.3	Very high	37 Å²	37	40.7 Å²	40.7	17%	0.173	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	131.9	177.3	-167.5	175.9	-164.3	0	0	111.7	L95 S128 V129	E87-L95 PolarHBondContact N-O 3.45Å; E87-L95 PolarHBondContact O-N 2.68Å; E87-S128 VanDerWaalsContact OE2-C 3.27Å; E87-S128 WeakPolarHBondContact OE2-CA 3.35Å; E87-V129 VanDerWaalsContact CD-N 3.3Å; E87-V129 HydrophobicContact CG-CG2 4.38Å; E87-V129 PolarHBondContact OE1-N 2.9Å; E87-V129 PolarHBondContact OE2-N 2.73Å
88	F	95.8	Very high	95.4	Very high	27 Å²	27	34.4 Å²	34.4	12%	0.118	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	141.9	173.6	-78.7	-74.9	0	0	0	111.5	A47 A48 F52 V54 H93 L94 T108 W111	A47-F88 HydrophobicContact CB-CD2 3.79Å; A47-F88 HydrophobicContact CB-CE2 4.07Å; A48-F88 WeakPolarHBondContact O-CD2 3.34Å; F52-F88 HydrophobicContact CB-CZ 4.32Å; V54-F88 HydrophobicContact CB-CE2 4.5Å; V54-F88 HydrophobicContact CB-CZ 4.43Å; V54-F88 HydrophobicContact CG1-CE2 4.11Å; V54-F88 HydrophobicContact CG1-CZ 3.63Å; V54-F88 HydrophobicContact CG2-CE2 3.63Å; V54-F88 HydrophobicContact CG2-CZ 3.88Å; F88-H93 WeakPolarHBondContact CA-O 3.46Å; F88-L94 HydrophobicContact CD1-CB 3.98Å; F88-L94 HydrophobicContact CD1-CD1 4.1Å; F88-L94 HydrophobicContact CD2-CD1 4.28Å; F88-L94 HydrophobicContact CE1-CB 3.83Å; F88-L94 HydrophobicContact CE1-CD1 4.09Å; F88-L94 HydrophobicContact CE1-CG 4.43Å; F88-L94 HydrophobicContact CE2-CD1 4.28Å; F88-L94 HydrophobicContact CG-CD1 4.21Å; F88-L94 HydrophobicContact CZ-CD1 4.19Å; F88-T108 HydrophobicContact CD1-CG2 4.17Å; F88-T108 HydrophobicContact CE1-CG2 3.83Å; F88-W111 AromaticContact CE1-CH2 3.94Å; F88-W111 HydrophobicContact CE1-CH2 3.94Å; F88-W111 HydrophobicContact CZ-CH2 4.07Å
89	Y	92.4	Very high	95.5	Very high	82 Å²	82	34.1 Å²	34.1	32%	0.322	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	101.2	157.9	178	-110.7	0	0	0	109.2	S91 S92 H93 V129 S132	Y89-S91 PolarHBondContact O-N 2.8Å; Y89-S92 PolarHBondContact O-N 3.27Å; Y89-S92 PolarHBondContact O-OG 3.35Å; Y89-H93 PolarHBondContact N-O 3.42Å; Y89-H93 PolarHBondContact O-N 3.41Å; Y89-V129 HydrophobicContact CD2-CG1 3.95Å; Y89-V129 HydrophobicContact CG-CG1 4.34Å; Y89-S132 PolarHBondContact OH-O 2.99Å
90	G	87.5	Confident	95.6	Very high	55 Å²	55	35.7 Å²	35.7	57%	0.567	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.6	-133.4	-175.1	0	0	0	0	0	111.8
91	S	88	Confident	95.6	Very high	70 Å²	70	28 Å²	28	49%	0.49	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	6.5	176.6	59.6	0	0	0	0	113.5	Y89 T108	Y89-S91 PolarHBondContact O-N 2.8Å; S91-T108 WeakPolarHBondContact O-CB 3.38Å; S91-T108 PolarHBondContact O-OG1 3.04Å
92	S	89.6	Confident	95.7	Very high	43 Å²	43	29.2 Å²	29.2	30%	0.301	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-38	-170.3	58.4	0	0	0	0	114.6	Y89 T108	Y89-S92 PolarHBondContact O-N 3.27Å; Y89-S92 PolarHBondContact O-OG 3.35Å; S92-T108 VanDerWaalsContact C-OG1 3.23Å; S92-T108 WeakPolarHBondContact CA-OG1 3.36Å; S92-T108 PolarHBondContact O-N 2.86Å; S92-T108 VanDerWaalsContact O-N 3.08Å; S92-T108 PolarHBondContact O-OG1 2.6Å
93	H	93.5	Very high	95.7	Very high	62 Å²	62	28.8 Å²	28.8	29%	0.287	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	141	-173.7	-59.1	-56.8	0	0	0	111.9	F88 Y89 L95 V105 W106 M114	F88-H93 WeakPolarHBondContact CA-O 3.46Å; Y89-H93 PolarHBondContact N-O 3.42Å; Y89-H93 PolarHBondContact O-N 3.41Å; H93-L95 HydrophobicContact CB-CD1 4.39Å; H93-V105 HydrophobicContact CB-CG1 4.5Å; H93-W106 WeakPolarHBondContact CA-O 3.28Å; H93-M114 WeakPolarHBondContact CE1-CE 3.21Å; H93-M114 WeakPolarHBondContact ND1-CE 3.24Å
94	L	97.1	Very high	95.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	135.1	164.5	171.7	69.3	0	0	0	107.5	V54 I62 L76 L86 F88 W106 W111	V54-L94 HydrophobicContact CB-CD2 4.31Å; V54-L94 HydrophobicContact CG1-CD2 4.19Å; V54-L94 HydrophobicContact CG2-CD1 3.77Å; V54-L94 HydrophobicContact CG2-CD2 3.95Å; I62-L94 HydrophobicContact CG2-CD2 4.49Å; L76-L94 HydrophobicContact CD1-CD2 4.27Å; L86-L94 HydrophobicContact CB-CD1 4.46Å; L86-L94 HydrophobicContact CD2-CD1 4.36Å; L86-L94 HydrophobicContact CD2-CD2 4.39Å; F88-L94 HydrophobicContact CD1-CB 3.98Å; F88-L94 HydrophobicContact CD1-CD1 4.1Å; F88-L94 HydrophobicContact CD2-CD1 4.28Å; F88-L94 HydrophobicContact CE1-CB 3.83Å; F88-L94 HydrophobicContact CE1-CD1 4.09Å; F88-L94 HydrophobicContact CE1-CG 4.43Å; F88-L94 HydrophobicContact CE2-CD1 4.28Å; F88-L94 HydrophobicContact CG-CD1 4.21Å; F88-L94 HydrophobicContact CZ-CD1 4.19Å; L94-W106 HydrophobicContact CB-CB 4.19Å; L94-W106 PolarHBondContact N-O 2.79Å; L94-W106 VanDerWaalsContact N-O 3.14Å; L94-W106 PolarHBondContact O-N 2.94Å; L94-W111 HydrophobicContact CB-CZ3 4.1Å; L94-W111 HydrophobicContact CD2-CH2 4.42Å; L94-W111 HydrophobicContact CD2-CZ3 3.77Å
95	L	97.3	Very high	95.5	Very high	8 Å²	8	27.9 Å²	27.9	4%	0.042	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	138.2	168.1	-69.1	75.7	0	0	0	109.1	L86 E87 H93 C104 V105 L127 V129 A136 L150	L86-L95 WeakPolarHBondContact CA-O 3.37Å; E87-L95 PolarHBondContact N-O 3.45Å; E87-L95 PolarHBondContact O-N 2.68Å; H93-L95 HydrophobicContact CB-CD1 4.39Å; L95-C104 WeakPolarHBondContact CA-O 3.3Å; L95-V105 HydrophobicContact CG-CG1 4.47Å; L95-V105 HydrophobicContact CG-CG2 4.28Å; L95-L127 HydrophobicContact CB-CD2 3.29Å; L95-L127 HydrophobicContact CD2-CD2 3.89Å; L95-L127 HydrophobicContact CG-CD2 4.24Å; L95-V129 HydrophobicContact CD1-CG2 3.96Å; L95-V129 HydrophobicContact CD2-CG2 3.84Å; L95-V129 HydrophobicContact CG-CG2 4.38Å; L95-A136 HydrophobicContact CD2-CB 4.42Å; L95-L150 HydrophobicContact CD2-CD1 4.41Å; L95-L150 HydrophobicContact CD2-CD2 4.07Å
96	S	98.1	Very high	95.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.4	175.7	63.2	0	0	0	0	111	H79 C85 L86 L103 C104 W106	H79-S96 PolarHBondContact NE2-OG 3.4Å; C85-S96 WeakPolarHBondContact O-CA 3.35Å; L86-S96 VanDerWaalsContact CD2-CB 3.49Å; S96-L103 CarbonylContact O-C 3.56Å; S96-L103 VanDerWaalsContact O-CA 3.26Å; S96-L103 WeakPolarHBondContact O-CA 3.39Å; S96-C104 PolarHBondContact N-O 3.06Å; S96-C104 PolarHBondContact O-N 3.38Å; S96-C104 WeakPolarHBondContact OG-CB 3.46Å; S96-W106 PolarHBondContact OG-NE1 3Å
97	G	97.8	Very high	95.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	147.5	170.4	0	0	0	0	0	111.3	T84 C85 L102	T84-G97 PolarHBondContact N-O 2.96Å; T84-G97 PolarHBondContact OG1-O 2.92Å; C85-G97 PolarHBondContact N-O 3.17Å; C85-G97 PolarHBondContact O-N 2.83Å; G97-L102 WeakPolarHBondContact CA-O 3.14Å
98	G	97.5	Very high	95.1	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	173.4	-175.5	0	0	0	0	0	114.7	T82 D100 G101 L102 V124	T82-G98 CarbonylContact O-C 3.59Å; T82-G98 VanDerWaalsContact O-CA 3.24Å; T82-G98 WeakPolarHBondContact O-CA 3.21Å; G98-D100 PolarHBondContact O-N 3.35Å; G98-G101 PolarHBondContact O-N 2.76Å; G98-L102 PolarHBondContact N-O 2.83Å; G98-V124 WeakPolarHBondContact O-CB 3.4Å; G98-V124 PolarHBondContact O-N 3.34Å
99	E	97.8	Very high	94.9	Very high	78 Å²	78	34.8 Å²	34.8	36%	0.364	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-19.1	172.5	-75	178.7	161.1	0	0	113.2	T82 T84 G101 H123	T82-E99 WeakPolarHBondContact CB-OE2 3.31Å; T82-E99 PolarHBondContact N-OE2 2.85Å; T82-E99 PolarHBondContact O-N 2.94Å; T82-E99 VanDerWaalsContact OG1-CD 3.29Å; T82-E99 PolarHBondContact OG1-OE2 2.77Å; T84-E99 HydrophobicContact CG2-CG 3.87Å; E99-G101 PolarHBondContact O-N 3.08Å; E99-G101 VanDerWaalsContact O-N 3.11Å; E99-H123 HydrophobicContact CB-CB 4.33Å; E99-H123 HydrophobicContact CG-CB 4.16Å; E99-H123 PolarHBondContact O-ND1 3.13Å
100	D	97.6	Very high	94.9	Very high	42 Å²	42	37.8 Å²	37.8	23%	0.225	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-10.3	168.2	53.3	16.3	0	0	0	114.3	H79 E80 G98 L102	H79-D100 WeakPolarHBondContact CA-OD2 3.23Å; H79-D100 WeakPolarHBondContact CB-OD2 3.16Å; H79-D100 IonicContact CE1-OD1 3.77Å; H79-D100 IonicContact CE1-OD2 2.91Å; H79-D100 IonicContact CG-OD2 3.98Å; H79-D100 IonicContact ND1-OD1 3.69Å; H79-D100 PolarHBondContact ND1-OD1 3.37Å; H79-D100 IonicContact ND1-OD2 2.75Å; H79-D100 PolarHBondContact ND1-OD2 3.5Å; E80-D100 HydrophobicContact CB-CB 4.28Å; E80-D100 PolarHBondContact N-OD2 2.86Å; E80-D100 WeakPolarHBondContact O-CB 3.42Å; G98-D100 PolarHBondContact O-N 3.35Å; D100-L102 HydrophobicContact CB-CD1 4.33Å; D100-L102 HydrophobicContact CB-CG 4.05Å; D100-L102 PolarHBondContact O-N 3.48Å; D100-L102 WeakPolarHBondContact OD1-CB 3.48Å; D100-L102 PolarHBondContact OD1-N 2.77Å; D100-L102 WeakPolarHBondContact OD2-CD1 3.25Å
101	G	96.8	Very high	95.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	77.9	9.7	-176	0	0	0	0	0	113.4	G98 E99 A119 H120 G122	G98-G101 PolarHBondContact O-N 2.76Å; E99-G101 PolarHBondContact O-N 3.08Å; E99-G101 VanDerWaalsContact O-N 3.11Å; G101-A119 PolarHBondContact O-N 3.42Å; G101-H120 PolarHBondContact O-N 3.15Å; G101-G122 WeakPolarHBondContact CA-O 3.48Å
102	L	97.2	Very high	95.6	Very high	34 Å²	34	38 Å²	38	18%	0.178	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	148.6	177.8	-55.2	-178.4	0	0	0	111.2	H79 G97 G98 D100 T116 I117 K118 V124	H79-L102 PolarHBondContact CE1-O 2.88Å; G97-L102 WeakPolarHBondContact CA-O 3.14Å; G98-L102 PolarHBondContact N-O 2.83Å; D100-L102 HydrophobicContact CB-CD1 4.33Å; D100-L102 HydrophobicContact CB-CG 4.05Å; D100-L102 PolarHBondContact O-N 3.48Å; D100-L102 WeakPolarHBondContact OD1-CB 3.48Å; D100-L102 PolarHBondContact OD1-N 2.77Å; D100-L102 WeakPolarHBondContact OD2-CD1 3.25Å; L102-T116 HydrophobicContact CB-CG2 4.33Å; L102-T116 HydrophobicContact CD1-CG2 3.85Å; L102-T116 HydrophobicContact CD2-CG2 4.29Å; L102-T116 HydrophobicContact CG-CG2 4.39Å; L102-I117 CarbonylContact C-O 3.53Å; L102-I117 WeakPolarHBondContact CA-O 3.44Å; L102-K118 HydrophobicContact CD2-CB 4.4Å; L102-K118 HydrophobicContact CD2-CG 3.78Å; L102-V124 WeakPolarHBondContact O-CG2 3.33Å
103	L	96.9	Very high	95.9	Very high	6 Å²	6	38 Å²	38	3%	0.031	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	131.3	158.4	-69.5	173.6	0	0	0	108.6	S96 I117 A119 V124 L127	S96-L103 CarbonylContact O-C 3.56Å; S96-L103 VanDerWaalsContact O-CA 3.26Å; S96-L103 WeakPolarHBondContact O-CA 3.39Å; L103-I117 HydrophobicContact CB-CB 4.26Å; L103-I117 PolarHBondContact N-O 3.35Å; L103-I117 PolarHBondContact O-N 3.4Å; L103-A119 HydrophobicContact CB-CB 4.09Å; L103-A119 HydrophobicContact CD1-CB 3.56Å; L103-A119 HydrophobicContact CG-CB 3.48Å; L103-A119 VanDerWaalsContact CG-CB 3.48Å; L103-V124 HydrophobicContact CD2-CG1 3.86Å; L103-V124 HydrophobicContact CD2-CG2 4.3Å; L103-V124 HydrophobicContact CG-CG2 4.44Å; L103-L127 HydrophobicContact CD1-CD1 3.9Å; L103-L127 HydrophobicContact CD2-CB 4.5Å; L103-L127 HydrophobicContact CD2-CD1 3.9Å; L103-L127 HydrophobicContact CD2-CD2 4.34Å; L103-L127 HydrophobicContact CD2-CG 4.49Å
104	C	96.2	Very high	95.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	140.2	176	-59.3	0	0	0	0	110.1	H78 H79 L95 S96 W106 T115	H78-C104 PolarHBondContact CD2-SG 3.23Å; H79-C104 PolarHBondContact CE1-SG 3.07Å; H79-C104 PolarHBondContact NE2-SG 3.47Å; H79-C104 VanDerWaalsContact NE2-SG 3.44Å; L95-C104 WeakPolarHBondContact CA-O 3.3Å; S96-C104 PolarHBondContact N-O 3.06Å; S96-C104 PolarHBondContact O-N 3.38Å; S96-C104 WeakPolarHBondContact OG-CB 3.46Å; C104-W106 HydrophobicContact CB-CZ2 3.95Å; C104-T115 WeakPolarHBondContact CA-O 3.43Å
105	V	95.7	Very high	95.6	Very high	18 Å²	18	42.3 Å²	42.3	11%	0.109	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	119.7	175.5	-170.8	0	0	0	0	108.6	H93 L95 M114 T115	H93-V105 HydrophobicContact CB-CG1 4.5Å; L95-V105 HydrophobicContact CG-CG1 4.47Å; L95-V105 HydrophobicContact CG-CG2 4.28Å; V105-M114 HydrophobicContact CG1-CE 3.65Å; V105-M114 PolarHBondContact O-N 3.48Å; V105-T115 PolarHBondContact N-O 3.41Å; V105-T115 PolarHBondContact O-N 3.12Å
106	W	96.6	Very high	95.5	Very high	10 Å²	10	44.9 Å²	44.9	4%	0.038	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	141.6	-174.5	-52.5	89.3	0	0	0	111	I62 L76 H78 H93 L94 S96 C104 E112 C113	I62-W106 HydrophobicContact CD1-CZ2 4.39Å; L76-W106 HydrophobicContact CB-CE3 4.35Å; L76-W106 HydrophobicContact CB-CH2 3.68Å; L76-W106 HydrophobicContact CB-CZ2 4.09Å; L76-W106 HydrophobicContact CB-CZ3 3.83Å; L76-W106 HydrophobicContact CD1-CD2 3.68Å; L76-W106 HydrophobicContact CD1-CE3 3.79Å; L76-W106 HydrophobicContact CD1-CG 4.05Å; L76-W106 HydrophobicContact CD1-CH2 4.38Å; L76-W106 HydrophobicContact CD1-CZ2 4.33Å; L76-W106 HydrophobicContact CD1-CZ3 4.14Å; L76-W106 HydrophobicContact CD2-CE3 3.92Å; L76-W106 HydrophobicContact CD2-CZ3 3.87Å; L76-W106 HydrophobicContact CG-CE3 4.25Å; L76-W106 HydrophobicContact CG-CH2 4.44Å; L76-W106 HydrophobicContact CG-CZ3 4.17Å; H78-W106 HydrophobicContact CB-CH2 3.5Å; H78-W106 HydrophobicContact CB-CZ2 3.89Å; H93-W106 WeakPolarHBondContact CA-O 3.28Å; L94-W106 HydrophobicContact CB-CB 4.19Å; L94-W106 PolarHBondContact N-O 2.79Å; L94-W106 VanDerWaalsContact N-O 3.14Å; L94-W106 PolarHBondContact O-N 2.94Å; S96-W106 PolarHBondContact OG-NE1 3Å; C104-W106 HydrophobicContact CB-CZ2 3.95Å; W106-E112 WeakPolarHBondContact CA-O 3.4Å; W106-C113 HydrophobicContact CD2-CB 4.34Å; W106-C113 HydrophobicContact CE3-CB 3.74Å; W106-C113 HydrophobicContact CH2-CB 4.03Å; W106-C113 HydrophobicContact CZ3-CB 3.57Å
107	S	94.8	Very high	95.3	Very high	21 Å²	21	45.7 Å²	45.7	15%	0.147	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	125	168.2	-175.9	0	0	0	0	110	K109 W111 E112	S107-K109 PolarHBondContact O-N 2.83Å; S107-W111 WeakPolarHBondContact O-CA 3.36Å; S107-W111 PolarHBondContact O-N 2.89Å; S107-E112 PolarHBondContact N-O 3.23Å
108	T	93.8	Very high	95.1	Very high	11 Å²	11	54.3 Å²	54.3	7%	0.067	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-12.2	176.2	58.9	0	0	0	0	113.6	F88 S91 S92 W111	F88-T108 HydrophobicContact CD1-CG2 4.17Å; F88-T108 HydrophobicContact CE1-CG2 3.83Å; S91-T108 WeakPolarHBondContact O-CB 3.38Å; S91-T108 PolarHBondContact O-OG1 3.04Å; S92-T108 VanDerWaalsContact C-OG1 3.23Å; S92-T108 WeakPolarHBondContact CA-OG1 3.36Å; S92-T108 PolarHBondContact O-N 2.86Å; S92-T108 VanDerWaalsContact O-N 3.08Å; S92-T108 PolarHBondContact O-OG1 2.6Å; T108-W111 HydrophobicContact CG2-CH2 4.15Å; T108-W111 HydrophobicContact CG2-CZ3 4.45Å
109	K	91.6	Very high	95	Very high	190 Å²	190	54.3 Å²	54.3	83%	0.826	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-42.6	178.8	-69.3	-173.6	178.9	-178.6	0	112	S107	S107-K109 PolarHBondContact O-N 2.83Å
110	K	92.3	Very high	94.9	Very high	145 Å²	145	51.2 Å²	51.2	63%	0.63	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	-11	-175.8	-66.5	-171.6	176.8	-174.3	0	114	E112	K110-E112 HydrophobicContact CB-CB 4.49Å; K110-E112 HydrophobicContact CB-CG 3.93Å; K110-E112 WeakPolarHBondContact CD-OE2 3.06Å; K110-E112 PolarHBondContact O-N 3.12Å
111	W	95.8	Very high	94.8	Very high	22 Å²	22	58.8 Å²	58.8	8%	0.083	28%	0.282	C	S	.	.			trans	58.6	30	-174.3	-67.2	113	0	0	0	114.2	F52 V54 L64 H73 L76 F88 L94 S107 T108	F52-W111 HydrophobicContact CB-CH2 4.39Å; F52-W111 HydrophobicContact CB-CZ2 3.93Å; F52-W111 HydrophobicContact CD1-CZ2 4.06Å; F52-W111 AromaticContact CD2-CZ2 3.59Å; F52-W111 HydrophobicContact CD2-CZ2 3.59Å; F52-W111 HydrophobicContact CE1-CZ2 4.44Å; F52-W111 AromaticContact CE1-NE1 3.98Å; F52-W111 AromaticContact CE2-CZ2 3.99Å; F52-W111 HydrophobicContact CE2-CZ2 3.99Å; F52-W111 AromaticContact CE2-NE1 3.92Å; F52-W111 AromaticContact CG-CZ2 3.61Å; F52-W111 HydrophobicContact CG-CZ2 3.61Å; F52-W111 HydrophobicContact CZ-CZ2 4.4Å; F52-W111 AromaticContact CZ-NE1 3.7Å; V54-W111 HydrophobicContact CG1-CH2 3.93Å; V54-W111 HydrophobicContact CG1-CZ3 4.47Å; L64-W111 HydrophobicContact CD1-CB 4.1Å; L64-W111 HydrophobicContact CD1-CD2 3.41Å; L64-W111 VanDerWaalsContact CD1-CD2 3.41Å; L64-W111 HydrophobicContact CD1-CE3 3.77Å; L64-W111 HydrophobicContact CD1-CG 3.57Å; L64-W111 HydrophobicContact CD1-CZ2 4.28Å; L64-W111 HydrophobicContact CD1-CZ3 4.34Å; L64-W111 HydrophobicContact CD2-CD2 4.27Å; L64-W111 HydrophobicContact CD2-CE3 3.92Å; L64-W111 HydrophobicContact CD2-CH2 3.77Å; L64-W111 HydrophobicContact CD2-CZ2 4.14Å; L64-W111 HydrophobicContact CD2-CZ3 3.67Å; L64-W111 HydrophobicContact CG-CD2 4.47Å; H73-W111 AromaticContact CD2-CD1 3.34Å; H73-W111 AromaticContact CD2-NE1 3.4Å; H73-W111 PolarHBondContact CD2-NE1 3.31Å; H73-W111 AromaticContact NE2-CD1 3.25Å; H73-W111 VanDerWaalsContact NE2-CD1 3.25Å; H73-W111 AromaticContact NE2-NE1 3.51Å; L76-W111 HydrophobicContact CD1-CE3 4.03Å; L76-W111 HydrophobicContact CD1-CZ3 4.32Å; L76-W111 HydrophobicContact CD2-CB 3.96Å; L76-W111 HydrophobicContact CD2-CE3 4.35Å; L76-W111 WeakPolarHBondContact CD2-O 3.49Å; F88-W111 AromaticContact CE1-CH2 3.94Å; F88-W111 HydrophobicContact CE1-CH2 3.94Å; F88-W111 HydrophobicContact CZ-CH2 4.07Å; L94-W111 HydrophobicContact CB-CZ3 4.1Å; L94-W111 HydrophobicContact CD2-CH2 4.42Å; L94-W111 HydrophobicContact CD2-CZ3 3.77Å; S107-W111 WeakPolarHBondContact O-CA 3.36Å; S107-W111 PolarHBondContact O-N 2.89Å; T108-W111 HydrophobicContact CG2-CH2 4.15Å; T108-W111 HydrophobicContact CG2-CZ3 4.45Å
112	E	94.3	Very high	94.7	Very high	109 Å²	109	59.6 Å²	59.6	51%	0.509	29%	0.29	S	S	.	.			trans	-90	141.3	173.9	-67.2	167.8	177.5	0	0	110.3	W106 S107 K110 M114	W106-E112 WeakPolarHBondContact CA-O 3.4Å; S107-E112 PolarHBondContact N-O 3.23Å; K110-E112 HydrophobicContact CB-CB 4.49Å; K110-E112 HydrophobicContact CB-CG 3.93Å; K110-E112 WeakPolarHBondContact CD-OE2 3.06Å; K110-E112 PolarHBondContact O-N 3.12Å; E112-M114 PolarHBondContact O-N 3.28Å
113	C	95.4	Very high	94.7	Very high	42 Å²	42	62 Å²	62	28%	0.284	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	111.9	169.7	-172.3	0	0	0	0	108.7	W106 T116	W106-C113 HydrophobicContact CD2-CB 4.34Å; W106-C113 HydrophobicContact CE3-CB 3.74Å; W106-C113 HydrophobicContact CH2-CB 4.03Å; W106-C113 HydrophobicContact CZ3-CB 3.57Å; C113-T116 PolarHBondContact SG-OG1 2.94Å
114	M	93	Very high	94.8	Very high	92 Å²	92	61.8 Å²	61.8	45%	0.453	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-40.1	-179.5	-58.8	-168.4	-56.5	0	0	111.5	H93 V105 E112	H93-M114 WeakPolarHBondContact CE1-CE 3.21Å; H93-M114 WeakPolarHBondContact ND1-CE 3.24Å; V105-M114 HydrophobicContact CG1-CE 3.65Å; V105-M114 PolarHBondContact O-N 3.48Å; E112-M114 PolarHBondContact O-N 3.28Å
115	T	91.8	Very high	94.8	Very high	61 Å²	61	63.2 Å²	63.2	37%	0.374	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	133.3	-175.2	-55.1	0	0	0	0	110.2	C104 V105 I117	C104-T115 WeakPolarHBondContact CA-O 3.43Å; V105-T115 PolarHBondContact N-O 3.41Å; V105-T115 PolarHBondContact O-N 3.12Å; T115-I117 HydrophobicContact CG2-CD1 4.38Å; T115-I117 HydrophobicContact CG2-CG1 3.79Å
116	T	94.4	Very high	94.9	Very high	61 Å²	61	62.6 Å²	62.6	37%	0.374	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	126.2	169.2	-52.9	0	0	0	0	109.1	H78 L102 C113	H78-T116 PolarHBondContact NE2-OG1 3.3Å; L102-T116 HydrophobicContact CB-CG2 4.33Å; L102-T116 HydrophobicContact CD1-CG2 3.85Å; L102-T116 HydrophobicContact CD2-CG2 4.29Å; L102-T116 HydrophobicContact CG-CG2 4.39Å; C113-T116 PolarHBondContact SG-OG1 2.94Å
117	I	94.3	Very high	95	Very high	17 Å²	17	62.2 Å²	62.2	9%	0.087	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	122.5	-174.8	-55.1	176.4	0	0	0	108.1	L102 L103 T115 A119 W148	L102-I117 CarbonylContact C-O 3.53Å; L102-I117 WeakPolarHBondContact CA-O 3.44Å; L103-I117 HydrophobicContact CB-CB 4.26Å; L103-I117 PolarHBondContact N-O 3.35Å; L103-I117 PolarHBondContact O-N 3.4Å; T115-I117 HydrophobicContact CG2-CD1 4.38Å; T115-I117 HydrophobicContact CG2-CG1 3.79Å; I117-A119 HydrophobicContact CG2-CB 4.45Å; I117-A119 PolarHBondContact O-N 3.23Å; I117-W148 HydrophobicContact CD1-CE3 4.49Å; I117-W148 HydrophobicContact CG2-CD2 4.37Å; I117-W148 HydrophobicContact CG2-CE3 3.74Å; I117-W148 HydrophobicContact CG2-CH2 3.46Å; I117-W148 VanDerWaalsContact CG2-CH2 3.46Å; I117-W148 HydrophobicContact CG2-CZ2 4.12Å; I117-W148 HydrophobicContact CG2-CZ3 3.23Å
118	K	94.3	Very high	95.1	Very high	181 Å²	181	61.4 Å²	61.4	79%	0.787	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	81	169.3	-69.3	-174.9	178.7	-176.9	0	109.5	L102	L102-K118 HydrophobicContact CD2-CB 4.4Å; L102-K118 HydrophobicContact CD2-CG 3.78Å
119	A	94.1	Very high	95.3	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.297	C	S	.	.			trans	-76.4	-45.2	-166	0	0	0	0	0	111.8	G101 L103 I117 V124 R146 W148	G101-A119 PolarHBondContact O-N 3.42Å; L103-A119 HydrophobicContact CB-CB 4.09Å; L103-A119 HydrophobicContact CD1-CB 3.56Å; L103-A119 HydrophobicContact CG-CB 3.48Å; L103-A119 VanDerWaalsContact CG-CB 3.48Å; I117-A119 HydrophobicContact CG2-CB 4.45Å; I117-A119 PolarHBondContact O-N 3.23Å; A119-V124 HydrophobicContact CB-CG2 4.38Å; A119-R146 WeakPolarHBondContact O-CD 3.39Å; A119-R146 PolarHBondContact O-NE 3.02Å; A119-R146 PolarHBondContact O-NH1 3.17Å; A119-W148 VanDerWaalsContact CA-CZ2 3.45Å; A119-W148 HydrophobicContact CB-CH2 4.21Å; A119-W148 HydrophobicContact CB-CZ2 3.59Å
120	H	96.4	Very high	95.5	Very high	14 Å²	14	53.4 Å²	53.4	7%	0.065	26%	0.263	C	S	.	.			trans	-132.7	156	-175.9	-70.7	-88.2	0	0	0	111.1	G101 G122 S138 D142 T144	G101-H120 PolarHBondContact O-N 3.15Å; H120-G122 VanDerWaalsContact C-N 3.29Å; H120-G122 WeakPolarHBondContact CB-O 3.46Å; H120-S138 WeakPolarHBondContact NE2-CB 3.16Å; H120-S138 PolarHBondContact NE2-OG 3.3Å; H120-D142 WeakPolarHBondContact CA-OD2 3.06Å; H120-D142 IonicContact CE1-OD1 2.9Å; H120-D142 IonicContact CG-OD1 3.3Å; H120-D142 IonicContact CG-OD2 3.81Å; H120-D142 VanDerWaalsContact ND1-CG 3.35Å; H120-D142 IonicContact ND1-OD1 2.82Å; H120-D142 PolarHBondContact ND1-OD1 3.21Å; H120-D142 IonicContact ND1-OD2 3.8Å; H120-D142 PolarHBondContact ND1-OD2 2.99Å; H120-T144 PolarHBondContact CE1-O 3.38Å; H120-T144 PolarHBondContact CE1-OG1 2.76Å; H120-T144 PolarHBondContact ND1-OG1 3.13Å
121	K	95.4	Very high	95.6	Very high	200 Å²	200	49.4 Å²	49.4	87%	0.87	25%	0.252	S	S	*	.	S	Bend	trans	-77.7	-18.7	172.8	-72.3	-174.2	177.7	-178.1	0	112.9	D142	K121-D142 HydrophobicContact CB-CB 4.15Å; K121-D142 PolarHBondContact N-OD2 2.94Å
122	G	95.3	Very high	95.5	Very high	18 Å²	18	50.7 Å²	50.7	19%	0.186	26%	0.264	C	S	.	.	S	Bend	trans	-122.8	-166.1	170.3	0	0	0	0	0	109.5	G101 H120	G101-G122 WeakPolarHBondContact CA-O 3.48Å; H120-G122 VanDerWaalsContact C-N 3.29Å; H120-G122 WeakPolarHBondContact CB-O 3.46Å
123	H	97.1	Very high	95.3	Very high	85 Å²	85	46.2 Å²	46.2	39%	0.394	25%	0.247	S	C	.	.			trans	-56.7	136.1	-177.5	-44.7	-30.8	0	0	0	111.9	E99 G140 T141	E99-H123 HydrophobicContact CB-CB 4.33Å; E99-H123 HydrophobicContact CG-CB 4.16Å; E99-H123 PolarHBondContact O-ND1 3.13Å; H123-G140 CarbonylContact O-C 3.56Å; H123-G140 WeakPolarHBondContact O-CA 3.32Å; H123-T141 HydrophobicContact CB-CG2 4.03Å; H123-T141 PolarHBondContact N-OG1 2.8Å; H123-T141 PolarHBondContact O-N 3.26Å
124	V	98	Very high	95.2	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	128.9	162	-173.3	0	0	0	0	106.9	T84 G98 L102 L103 A119	T84-V124 VanDerWaalsContact CB-O 3.31Å; T84-V124 WeakPolarHBondContact CB-O 3.35Å; T84-V124 WeakPolarHBondContact CG2-O 3.38Å; T84-V124 PolarHBondContact OG1-O 2.55Å; G98-V124 WeakPolarHBondContact O-CB 3.4Å; G98-V124 PolarHBondContact O-N 3.34Å; L102-V124 WeakPolarHBondContact O-CG2 3.33Å; L103-V124 HydrophobicContact CD2-CG1 3.86Å; L103-V124 HydrophobicContact CD2-CG2 4.3Å; L103-V124 HydrophobicContact CG-CG2 4.44Å; A119-V124 HydrophobicContact CB-CG2 4.38Å
125	T	97.5	Very high	95.2	Very high	31 Å²	31	47.8 Å²	47.8	19%	0.19	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-33.4	-179.9	50.5	0	0	0	0	112.3	V139 T141 A165	T125-V139 PolarHBondContact N-O 2.99Å; T125-V139 WeakPolarHBondContact OG1-CG2 3.47Å; T125-V139 PolarHBondContact OG1-O 3.15Å; T125-V139 VanDerWaalsContact OG1-O 3.09Å; T125-T141 HydrophobicContact CG2-CG2 3.86Å; T125-A165 PolarHBondContact OG1-O 2.6Å
126	S	97.8	Very high	95.4	Very high	5 Å²	5	44.9 Å²	44.9	4%	0.035	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	153.3	176.3	-177.2	0	0	0	0	111.2	S138 V139 H166 V168	S126-S138 WeakPolarHBondContact O-CA 3.38Å; S126-V139 PolarHBondContact N-O 2.75Å; S126-V139 PolarHBondContact O-N 3.34Å; S126-H166 WeakPolarHBondContact CB-O 3.18Å; S126-V168 PolarHBondContact OG-N 2.93Å; S126-V168 VanDerWaalsContact OG-N 3.11Å; S126-V168 PolarHBondContact OG-O 3.27Å
127	L	97.8	Very high	95.6	Very high	2 Å²	2	42 Å²	42	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	146.7	173.7	179.6	77.1	0	0	0	108.6	C85 L95 L103 A136 L137	C85-L127 HydrophobicContact CB-CB 4.29Å; C85-L127 VanDerWaalsContact SG-CB 3.57Å; L95-L127 HydrophobicContact CB-CD2 3.29Å; L95-L127 HydrophobicContact CD2-CD2 3.89Å; L95-L127 HydrophobicContact CG-CD2 4.24Å; L103-L127 HydrophobicContact CD1-CD1 3.9Å; L103-L127 HydrophobicContact CD2-CB 4.5Å; L103-L127 HydrophobicContact CD2-CD1 3.9Å; L103-L127 HydrophobicContact CD2-CD2 4.34Å; L103-L127 HydrophobicContact CD2-CG 4.49Å; L127-A136 HydrophobicContact CD1-CB 4.17Å; L127-L137 CarbonylContact C-O 3.6Å; L127-L137 WeakPolarHBondContact CA-O 3.47Å; L127-L137 WeakPolarHBondContact CD1-O 3.44Å
128	S	97.4	Very high	95.7	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.021	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	127.1	165.7	-166.5	0	0	0	0	111.3	E87 A136 L137 V168 W170	E87-S128 VanDerWaalsContact OE2-C 3.27Å; E87-S128 WeakPolarHBondContact OE2-CA 3.35Å; S128-A136 CarbonylContact O-C 3.57Å; S128-A136 WeakPolarHBondContact O-CA 3.06Å; S128-L137 PolarHBondContact N-O 2.83Å; S128-L137 PolarHBondContact O-N 2.87Å; S128-V168 WeakPolarHBondContact CB-O 3.45Å; S128-W170 VanDerWaalsContact O-CD1 3.29Å; S128-W170 PolarHBondContact O-NE1 3.1Å; S128-W170 PolarHBondContact OG-N 3.43Å
129	V	96.9	Very high	95.9	Very high	11 Å²	11	32.6 Å²	32.6	7%	0.067	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	132.3	175.2	-178	0	0	0	0	109.9	E87 Y89 L95 L150 W170	E87-V129 VanDerWaalsContact CD-N 3.3Å; E87-V129 HydrophobicContact CG-CG2 4.38Å; E87-V129 PolarHBondContact OE1-N 2.9Å; E87-V129 PolarHBondContact OE2-N 2.73Å; Y89-V129 HydrophobicContact CD2-CG1 3.95Å; Y89-V129 HydrophobicContact CG-CG1 4.34Å; L95-V129 HydrophobicContact CD1-CG2 3.96Å; L95-V129 HydrophobicContact CD2-CG2 3.84Å; L95-V129 HydrophobicContact CG-CG2 4.38Å; V129-L150 HydrophobicContact CG1-CD1 4.11Å; V129-W170 VanDerWaalsContact C-CD1 3.46Å
130	H	96.3	Very high	96	Very high	22 Å²	22	32.6 Å²	32.6	10%	0.102	17%	0.172	C	C	.	.			trans	-67.9	142.3	176.1	-178.3	-82.7	0	0	0	109.9	S132 G133 L135 W170 G174	H130-S132 PolarHBondContact CE1-OG 2.85Å; H130-S132 WeakPolarHBondContact ND1-CB 3.5Å; H130-S132 PolarHBondContact ND1-N 2.86Å; H130-S132 PolarHBondContact ND1-OG 3.44Å; H130-S132 PolarHBondContact O-N 3.08Å; H130-G133 PolarHBondContact O-N 3.17Å; H130-L135 HydrophobicContact CB-CB 3.84Å; H130-L135 VanDerWaalsContact CB-O 3.24Å; H130-L135 WeakPolarHBondContact CB-O 3.1Å; H130-L135 PolarHBondContact N-O 2.8Å; H130-W170 HydrophobicContact CB-CD2 4.25Å; H130-W170 HydrophobicContact CB-CG 4.4Å; H130-W170 HydrophobicContact CB-CZ2 4.35Å; H130-W170 AromaticContact CD2-CD2 3.84Å; H130-W170 AromaticContact CD2-CE2 3.98Å; H130-W170 AromaticContact CD2-CE3 3.67Å; H130-W170 AromaticContact CD2-CH2 3.88Å; H130-W170 AromaticContact CD2-CZ3 3.71Å; H130-G174 WeakPolarHBondContact NE2-CA 3.32Å; H130-G174 PolarHBondContact NE2-O 3.14Å
131	P	93.9	Very high	96	Very high	61 Å²	61	34.1 Å²	34.1	40%	0.396	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-32.6	-178.5	-27.8	33	0	0	0	114.8	G133 P172	P131-G133 PolarHBondContact O-N 3.35Å; P131-P172 WeakPolarHBondContact CG-O 3.18Å
132	S	93.6	Very high	96.1	Very high	50 Å²	50	26.3 Å²	26.3	35%	0.35	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-15.1	174.3	77.3	0	0	0	0	115.3	Y89 H130 K134	Y89-S132 PolarHBondContact OH-O 2.99Å; H130-S132 PolarHBondContact CE1-OG 2.85Å; H130-S132 WeakPolarHBondContact ND1-CB 3.5Å; H130-S132 PolarHBondContact ND1-N 2.86Å; H130-S132 PolarHBondContact ND1-OG 3.44Å; H130-S132 PolarHBondContact O-N 3.08Å; S132-K134 PolarHBondContact O-N 3Å; S132-K134 PolarHBondContact OG-N 3.45Å
133	G	90.8	Very high	96.1	Very high	14 Å²	14	30 Å²	30	14%	0.144	16%	0.161	C	C	.	.	S	Bend	trans	73.2	0.3	-175.7	0	0	0	0	0	115.9	H130 P131 L150	H130-G133 PolarHBondContact O-N 3.17Å; P131-G133 PolarHBondContact O-N 3.35Å; G133-L150 WeakPolarHBondContact O-CD1 3.4Å
134	K	92.2	Very high	96.1	Very high	123 Å²	123	26.8 Å²	26.8	54%	0.535	15%	0.147	S	C	.	.	S	Bend	trans	-92.5	-21.7	-175.1	-61	177.1	-178.4	175.6	0	112.9	S132 L150 I151	S132-K134 PolarHBondContact O-N 3Å; S132-K134 PolarHBondContact OG-N 3.45Å; K134-L150 PolarHBondContact O-N 2.77Å; K134-I151 HydrophobicContact CB-CD1 4.16Å; K134-I151 HydrophobicContact CB-CG1 4.34Å; K134-I151 HydrophobicContact CD-CD1 4.12Å; K134-I151 HydrophobicContact CG-CD1 3.96Å; K134-I151 HydrophobicContact CG-CG1 4.3Å
135	L	94.4	Very high	96	Very high	44 Å²	44	26.9 Å²	26.9	23%	0.23	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	150.4	-176.8	-62.8	174.7	0	0	0	110.6	H130 T147 W148	H130-L135 HydrophobicContact CB-CB 3.84Å; H130-L135 VanDerWaalsContact CB-O 3.24Å; H130-L135 WeakPolarHBondContact CB-O 3.1Å; H130-L135 PolarHBondContact N-O 2.8Å; L135-T147 HydrophobicContact CD2-CG2 4.21Å; L135-W148 CarbonylContact C-O 3.54Å; L135-W148 VanDerWaalsContact CA-O 3.24Å; L135-W148 WeakPolarHBondContact CA-O 3.34Å
136	A	96.4	Very high	95.9	Very high	1 Å²	1	27 Å²	27	1%	0.008	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	153.6	164	0	0	0	0	0	110.2	L95 L127 S128 T147 W148 L150	L95-A136 HydrophobicContact CD2-CB 4.42Å; L127-A136 HydrophobicContact CD1-CB 4.17Å; S128-A136 CarbonylContact O-C 3.57Å; S128-A136 WeakPolarHBondContact O-CA 3.06Å; A136-T147 CarbonylContact O-C 3.55Å; A136-T147 WeakPolarHBondContact O-CA 3.17Å; A136-W148 HydrophobicContact CB-CB 4.37Å; A136-W148 PolarHBondContact N-O 3.05Å; A136-W148 PolarHBondContact O-N 2.92Å; A136-L150 HydrophobicContact CB-CD1 4.07Å; A136-L150 HydrophobicContact CB-CD2 4.04Å; A136-L150 HydrophobicContact CB-CG 4.18Å
137	L	97.4	Very high	95.8	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	138.2	170.6	-67.9	174.6	0	0	0	109.6	L127 S128 L145 R146 T147 V168 W170 Y177	L127-L137 CarbonylContact C-O 3.6Å; L127-L137 WeakPolarHBondContact CA-O 3.47Å; L127-L137 WeakPolarHBondContact CD1-O 3.44Å; S128-L137 PolarHBondContact N-O 2.83Å; S128-L137 PolarHBondContact O-N 2.87Å; L137-L145 HydrophobicContact CB-CD1 4.35Å; L137-L145 HydrophobicContact CD2-CD1 4.28Å; L137-R146 CarbonylContact C-O 3.59Å; L137-R146 VanDerWaalsContact CA-O 3.32Å; L137-R146 WeakPolarHBondContact CA-O 3.49Å; L137-T147 HydrophobicContact CD2-CG2 4.03Å; L137-T147 WeakPolarHBondContact CD2-OG1 3.34Å; L137-V168 HydrophobicContact CB-CG1 4.26Å; L137-V168 HydrophobicContact CB-CG2 3.73Å; L137-V168 HydrophobicContact CD1-CG2 3.8Å; L137-V168 HydrophobicContact CG-CG2 4.42Å; L137-W170 HydrophobicContact CD1-CD2 4.04Å; L137-W170 HydrophobicContact CD1-CH2 4.08Å; L137-W170 HydrophobicContact CD1-CZ2 3.4Å; L137-W170 VanDerWaalsContact CD1-CZ2 3.4Å; L137-W170 HydrophobicContact CD2-CZ2 4.04Å; L137-W170 HydrophobicContact CG-CH2 4.47Å; L137-W170 HydrophobicContact CG-CZ2 3.46Å; L137-W170 VanDerWaalsContact CG-CZ2 3.46Å; L137-Y177 HydrophobicContact CD1-CD1 3.89Å; L137-Y177 HydrophobicContact CD1-CD2 3.57Å; L137-Y177 HydrophobicContact CD1-CE1 4.38Å; L137-Y177 HydrophobicContact CD1-CE2 4.1Å; L137-Y177 HydrophobicContact CD1-CG 3.45Å; L137-Y177 VanDerWaalsContact CD1-CG 3.45Å
138	S	97.8	Very high	95.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	149.2	169.4	68.2	0	0	0	0	111.3	H120 S126 R146 W148	H120-S138 WeakPolarHBondContact NE2-CB 3.16Å; H120-S138 PolarHBondContact NE2-OG 3.3Å; S126-S138 WeakPolarHBondContact O-CA 3.38Å; S138-R146 PolarHBondContact N-O 2.8Å; S138-R146 PolarHBondContact O-N 3.42Å; S138-W148 PolarHBondContact OG-NE1 3.25Å
139	V	97.8	Very high	95.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	153.2	172.3	-72.2	0	0	0	0	109.5	T125 S126 L145 A165 V168 V179	T125-V139 PolarHBondContact N-O 2.99Å; T125-V139 WeakPolarHBondContact OG1-CG2 3.47Å; T125-V139 PolarHBondContact OG1-O 3.15Å; T125-V139 VanDerWaalsContact OG1-O 3.09Å; S126-V139 PolarHBondContact N-O 2.75Å; S126-V139 PolarHBondContact O-N 3.34Å; V139-L145 HydrophobicContact CG1-CB 4.19Å; V139-L145 HydrophobicContact CG1-CD1 3.49Å; V139-L145 VanDerWaalsContact CG1-CD1 3.49Å; V139-L145 HydrophobicContact CG1-CG 4.46Å; V139-A165 HydrophobicContact CB-CB 3.74Å; V139-A165 HydrophobicContact CG1-CB 3.74Å; V139-A165 HydrophobicContact CG2-CB 4.07Å; V139-V168 HydrophobicContact CG1-CB 4.09Å; V139-V168 HydrophobicContact CG1-CG1 4.42Å; V139-V168 HydrophobicContact CG2-CB 4Å; V139-V168 HydrophobicContact CG2-CG1 3.92Å; V139-V179 HydrophobicContact CG1-CG1 4.41Å
140	G	96.4	Very high	95.1	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	175	-179.4	0	0	0	0	0	114.1	H123 D142 K143	H123-G140 CarbonylContact O-C 3.56Å; H123-G140 WeakPolarHBondContact O-CA 3.32Å; G140-D142 PolarHBondContact O-N 3.03Å; G140-K143 PolarHBondContact O-N 2.92Å; G140-K143 VanDerWaalsContact O-N 3.16Å
141	T	96.8	Very high	94.7	Very high	46 Å²	46	37.1 Å²	37.1	28%	0.282	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-6.3	179.3	60.1	0	0	0	0	113.4	H123 T125 K143 N164	H123-T141 HydrophobicContact CB-CG2 4.03Å; H123-T141 PolarHBondContact N-OG1 2.8Å; H123-T141 PolarHBondContact O-N 3.26Å; T125-T141 HydrophobicContact CG2-CG2 3.86Å; T141-K143 PolarHBondContact O-N 3.35Å; T141-N164 PolarHBondContact O-OD1 3.27Å
142	D	95.7	Very high	94.4	Very high	35 Å²	35	38.4 Å²	38.4	19%	0.187	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	6.6	169.3	75.5	-4.7	0	0	0	113.6	H120 K121 G140 T144 R146	H120-D142 WeakPolarHBondContact CA-OD2 3.06Å; H120-D142 IonicContact CE1-OD1 2.9Å; H120-D142 IonicContact CG-OD1 3.3Å; H120-D142 IonicContact CG-OD2 3.81Å; H120-D142 VanDerWaalsContact ND1-CG 3.35Å; H120-D142 IonicContact ND1-OD1 2.82Å; H120-D142 PolarHBondContact ND1-OD1 3.21Å; H120-D142 IonicContact ND1-OD2 3.8Å; H120-D142 PolarHBondContact ND1-OD2 2.99Å; K121-D142 HydrophobicContact CB-CB 4.15Å; K121-D142 PolarHBondContact N-OD2 2.94Å; G140-D142 PolarHBondContact O-N 3.03Å; D142-T144 VanDerWaalsContact CG-OG1 3.23Å; D142-T144 PolarHBondContact O-N 2.96Å; D142-T144 WeakPolarHBondContact OD1-CB 3.27Å; D142-T144 PolarHBondContact OD1-N 2.88Å; D142-T144 VanDerWaalsContact OD1-N 3.12Å; D142-T144 PolarHBondContact OD1-OG1 3.34Å; D142-T144 PolarHBondContact OD2-OG1 3.43Å; D142-R146 IonicContact OD2-CZ 3.94Å; D142-R146 IonicContact OD2-NE 3.28Å; D142-R146 IonicContact OD2-NH2 3.44Å; D142-R146 PolarHBondContact OD2-NH2 3.43Å
143	K	96.2	Very high	93.9	Very high	97 Å²	97	37.5 Å²	37.5	42%	0.422	20%	0.199	S	C	.	.	S	Bend	trans	62.1	27.8	177.4	-53.9	169.9	178	-173.8	0	112.7	G140 T141 N160 I161 Q163 N164	G140-K143 PolarHBondContact O-N 2.92Å; G140-K143 VanDerWaalsContact O-N 3.16Å; T141-K143 PolarHBondContact O-N 3.35Å; K143-N160 PolarHBondContact O-OD1 2.99Å; K143-I161 WeakPolarHBondContact O-CG1 3.46Å; K143-I161 PolarHBondContact O-N 3.15Å; K143-Q163 WeakPolarHBondContact CA-O 3.49Å; K143-N164 WeakPolarHBondContact CE-OD1 3.3Å; K143-N164 WeakPolarHBondContact CG-OD1 3.42Å
144	T	96.6	Very high	93.8	Very high	16 Å²	16	45.4 Å²	45.4	10%	0.098	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	141.4	175.8	70.3	0	0	0	0	112	H120 D142 R146 I158 K159	H120-T144 PolarHBondContact CE1-O 3.38Å; H120-T144 PolarHBondContact CE1-OG1 2.76Å; H120-T144 PolarHBondContact ND1-OG1 3.13Å; D142-T144 VanDerWaalsContact CG-OG1 3.23Å; D142-T144 PolarHBondContact O-N 2.96Å; D142-T144 WeakPolarHBondContact OD1-CB 3.27Å; D142-T144 PolarHBondContact OD1-N 2.88Å; D142-T144 VanDerWaalsContact OD1-N 3.12Å; D142-T144 PolarHBondContact OD1-OG1 3.34Å; D142-T144 PolarHBondContact OD2-OG1 3.43Å; T144-R146 PolarHBondContact OG1-NE 3.1Å; T144-I158 HydrophobicContact CG2-CG2 4.25Å; T144-K159 CarbonylContact C-O 3.59Å; T144-K159 VanDerWaalsContact CA-O 3.29Å; T144-K159 WeakPolarHBondContact CA-O 3.22Å
145	L	96.5	Very high	93.8	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	127.4	160.6	171.4	70.1	0	0	0	107.2	L137 V139 K159 I161 V168 Y177 V179	L137-L145 HydrophobicContact CB-CD1 4.35Å; L137-L145 HydrophobicContact CD2-CD1 4.28Å; V139-L145 HydrophobicContact CG1-CB 4.19Å; V139-L145 HydrophobicContact CG1-CD1 3.49Å; V139-L145 VanDerWaalsContact CG1-CD1 3.49Å; V139-L145 HydrophobicContact CG1-CG 4.46Å; L145-K159 HydrophobicContact CB-CB 4.47Å; L145-K159 PolarHBondContact N-O 2.81Å; L145-K159 PolarHBondContact O-N 3.21Å; L145-I161 HydrophobicContact CB-CG2 4.01Å; L145-V168 HydrophobicContact CD1-CG2 4.08Å; L145-Y177 HydrophobicContact CD2-CE2 3.71Å; L145-V179 HydrophobicContact CD1-CG2 4.33Å; L145-V179 HydrophobicContact CD2-CG2 4.15Å
146	R	96.3	Very high	93.7	Very high	35 Å²	35	43.5 Å²	43.5	13%	0.132	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	137.3	-178.8	-59.5	-171.8	-176.3	-156.6	13	110.8	A119 L137 S138 D142 T144 W148 F157 I158	A119-R146 WeakPolarHBondContact O-CD 3.39Å; A119-R146 PolarHBondContact O-NE 3.02Å; A119-R146 PolarHBondContact O-NH1 3.17Å; L137-R146 CarbonylContact C-O 3.59Å; L137-R146 VanDerWaalsContact CA-O 3.32Å; L137-R146 WeakPolarHBondContact CA-O 3.49Å; S138-R146 PolarHBondContact N-O 2.8Å; S138-R146 PolarHBondContact O-N 3.42Å; D142-R146 IonicContact OD2-CZ 3.94Å; D142-R146 IonicContact OD2-NE 3.28Å; D142-R146 IonicContact OD2-NH2 3.44Å; D142-R146 PolarHBondContact OD2-NH2 3.43Å; T144-R146 PolarHBondContact OG1-NE 3.1Å; R146-W148 HydrophobicContact CB-CZ2 4.02Å; R146-F157 WeakPolarHBondContact CA-O 3.38Å; R146-I158 HydrophobicContact CG-CB 4.47Å; R146-I158 HydrophobicContact CG-CG1 4.04Å; R146-I158 HydrophobicContact CG-CG2 4.14Å
147	T	95.6	Very high	93.5	Very high	22 Å²	22	48.9 Å²	48.9	14%	0.135	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	130.3	171.9	-48.7	0	0	0	0	109	L135 A136 L137 A156 F157	L135-T147 HydrophobicContact CD2-CG2 4.21Å; A136-T147 CarbonylContact O-C 3.55Å; A136-T147 WeakPolarHBondContact O-CA 3.17Å; L137-T147 HydrophobicContact CD2-CG2 4.03Å; L137-T147 WeakPolarHBondContact CD2-OG1 3.34Å; T147-A156 HydrophobicContact CG2-CB 4.4Å; T147-A156 PolarHBondContact O-N 3.32Å; T147-F157 PolarHBondContact N-O 3.27Å; T147-F157 PolarHBondContact O-N 3.47Å
148	W	95.3	Very high	93.4	Very high	12 Å²	12	52.7 Å²	52.7	5%	0.045	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	134.9	-178.8	-57.9	96.1	0	0	0	109.9	I117 A119 L135 A136 S138 R146	I117-W148 HydrophobicContact CD1-CE3 4.49Å; I117-W148 HydrophobicContact CG2-CD2 4.37Å; I117-W148 HydrophobicContact CG2-CE3 3.74Å; I117-W148 HydrophobicContact CG2-CH2 3.46Å; I117-W148 VanDerWaalsContact CG2-CH2 3.46Å; I117-W148 HydrophobicContact CG2-CZ2 4.12Å; I117-W148 HydrophobicContact CG2-CZ3 3.23Å; A119-W148 VanDerWaalsContact CA-CZ2 3.45Å; A119-W148 HydrophobicContact CB-CH2 4.21Å; A119-W148 HydrophobicContact CB-CZ2 3.59Å; L135-W148 CarbonylContact C-O 3.54Å; L135-W148 VanDerWaalsContact CA-O 3.24Å; L135-W148 WeakPolarHBondContact CA-O 3.34Å; A136-W148 HydrophobicContact CB-CB 4.37Å; A136-W148 PolarHBondContact N-O 3.05Å; A136-W148 PolarHBondContact O-N 2.92Å; S138-W148 PolarHBondContact OG-NE1 3.25Å; R146-W148 HydrophobicContact CB-CZ2 4.02Å
149	N	92.9	Very high	93.2	Very high	43 Å²	43	55.8 Å²	55.8	23%	0.23	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	111.6	166.5	-179.4	-28.9	0	0	0	108.2	I151 N152 G153 R154 A156	N149-I151 VanDerWaalsContact C-N 3.29Å; N149-I151 PolarHBondContact O-N 2.91Å; N149-I151 VanDerWaalsContact OD1-CB 3.28Å; N149-I151 WeakPolarHBondContact OD1-CB 3.43Å; N149-I151 PolarHBondContact OD1-N 3.11Å; N149-N152 WeakPolarHBondContact CB-OD1 3.33Å; N149-N152 PolarHBondContact O-OD1 2.85Å; N149-N152 PolarHBondContact OD1-N 2.78Å; N149-G153 VanDerWaalsContact O-CA 3.32Å; N149-G153 WeakPolarHBondContact O-CA 3.35Å; N149-G153 PolarHBondContact O-N 3.42Å; N149-R154 PolarHBondContact N-O 2.72Å; N149-R154 PolarHBondContact O-N 3.21Å; N149-A156 HydrophobicContact CB-CB 4.49Å
150	L	89.4	Confident	93	Very high	49 Å²	49	60.8 Å²	60.8	26%	0.257	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-13.4	-176.7	-63	-179.3	0	0	0	113.1	L95 V129 G133 K134 A136	L95-L150 HydrophobicContact CD2-CD1 4.41Å; L95-L150 HydrophobicContact CD2-CD2 4.07Å; V129-L150 HydrophobicContact CG1-CD1 4.11Å; G133-L150 WeakPolarHBondContact O-CD1 3.4Å; K134-L150 PolarHBondContact O-N 2.77Å; A136-L150 HydrophobicContact CB-CD1 4.07Å; A136-L150 HydrophobicContact CB-CD2 4.04Å; A136-L150 HydrophobicContact CB-CG 4.18Å
151	I	87.8	Confident	92.8	Very high	128 Å²	128	62.2 Å²	62.2	66%	0.656	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-41.3	177.4	-54.8	173.6	0	0	0	110.5	K134 N149	K134-I151 HydrophobicContact CB-CD1 4.16Å; K134-I151 HydrophobicContact CB-CG1 4.34Å; K134-I151 HydrophobicContact CD-CD1 4.12Å; K134-I151 HydrophobicContact CG-CD1 3.96Å; K134-I151 HydrophobicContact CG-CG1 4.3Å; N149-I151 VanDerWaalsContact C-N 3.29Å; N149-I151 PolarHBondContact O-N 2.91Å; N149-I151 VanDerWaalsContact OD1-CB 3.28Å; N149-I151 WeakPolarHBondContact OD1-CB 3.43Å; N149-I151 PolarHBondContact OD1-N 3.11Å
152	N	86.5	Confident	92.6	Very high	89 Å²	89	68 Å²	68	48%	0.476	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-3.8	-177.7	67.8	14.4	0	0	0	114	N149 R154	N149-N152 WeakPolarHBondContact CB-OD1 3.33Å; N149-N152 PolarHBondContact O-OD1 2.85Å; N149-N152 PolarHBondContact OD1-N 2.78Å; N152-R154 VanDerWaalsContact C-N 3.32Å; N152-R154 PolarHBondContact O-N 3.05Å; N152-R154 WeakPolarHBondContact OD1-CB 3.25Å; N152-R154 PolarHBondContact OD1-N 3.26Å
153	G	83.3	Confident	92.4	Very high	31 Å²	31	71.5 Å²	71.5	32%	0.32	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	22.8	179.2	0	0	0	0	0	114.7	N149	N149-G153 VanDerWaalsContact O-CA 3.32Å; N149-G153 WeakPolarHBondContact O-CA 3.35Å; N149-G153 PolarHBondContact O-N 3.42Å
154	R	89.1	Confident	92.3	Very high	180 Å²	180	69.8 Å²	69.8	68%	0.679	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	152.4	-176.8	-63.2	-176.2	178.7	178.3	-0.8	112.6	N149 N152 A156	N149-R154 PolarHBondContact N-O 2.72Å; N149-R154 PolarHBondContact O-N 3.21Å; N152-R154 VanDerWaalsContact C-N 3.32Å; N152-R154 PolarHBondContact O-N 3.05Å; N152-R154 WeakPolarHBondContact OD1-CB 3.25Å; N152-R154 PolarHBondContact OD1-N 3.26Å; R154-A156 PolarHBondContact O-N 3.21Å
155	S	92.6	Very high	92.2	Very high	62 Å²	62	69 Å²	69	43%	0.434	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	123.8	169.3	59.3	0	0	0	0	109.7
156	A	91.4	Very high	92.1	Very high	64 Å²	64	71.5 Å²	71.5	53%	0.529	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-43.5	175.7	0	0	0	0	0	111.6	T147 N149 R154	T147-A156 HydrophobicContact CG2-CB 4.4Å; T147-A156 PolarHBondContact O-N 3.32Å; N149-A156 HydrophobicContact CB-CB 4.49Å; R154-A156 PolarHBondContact O-N 3.21Å
157	F	92.9	Very high	92.2	Very high	115 Å²	115	70.6 Å²	70.6	50%	0.504	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	147.1	-176.3	-173	-110.1	0	0	0	111.4	R146 T147 K159	R146-F157 WeakPolarHBondContact CA-O 3.38Å; T147-F157 PolarHBondContact N-O 3.27Å; T147-F157 PolarHBondContact O-N 3.47Å; F157-K159 HydrophobicContact CD1-CB 4.46Å; F157-K159 HydrophobicContact CE1-CB 3.8Å; F157-K159 HydrophobicContact CZ-CB 4.49Å
158	I	94.8	Very high	92.3	Very high	81 Å²	81	69.5 Å²	69.5	42%	0.415	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	124.6	177.4	-57.3	-179.9	0	0	0	108.1	T144 R146	T144-I158 HydrophobicContact CG2-CG2 4.25Å; R146-I158 HydrophobicContact CG-CB 4.47Å; R146-I158 HydrophobicContact CG-CG1 4.04Å; R146-I158 HydrophobicContact CG-CG2 4.14Å
159	K	93.6	Very high	92.4	Very high	64 Å²	64	72.8 Å²	72.8	28%	0.278	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.9	175.7	-170.9	178	-179.5	-175	0	110.1	T144 L145 F157 I161 Y188	T144-K159 CarbonylContact C-O 3.59Å; T144-K159 VanDerWaalsContact CA-O 3.29Å; T144-K159 WeakPolarHBondContact CA-O 3.22Å; L145-K159 HydrophobicContact CB-CB 4.47Å; L145-K159 PolarHBondContact N-O 2.81Å; L145-K159 PolarHBondContact O-N 3.21Å; F157-K159 HydrophobicContact CD1-CB 4.46Å; F157-K159 HydrophobicContact CE1-CB 3.8Å; F157-K159 HydrophobicContact CZ-CB 4.49Å; K159-I161 HydrophobicContact CG-CG2 4.45Å; K159-I161 PolarHBondContact O-N 2.93Å; K159-Y188 VanDerWaalsContact NZ-CE1 3.3Å; K159-Y188 PolarHBondContact NZ-OH 3.42Å
160	N	94.1	Very high	92.6	Very high	106 Å²	106	71.4 Å²	71.4	57%	0.567	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	112.9	169	-171.9	-25.6	0	0	0	109.1	K143 K162	K143-N160 PolarHBondContact O-OD1 2.99Å; N160-K162 VanDerWaalsContact C-N 3.33Å; N160-K162 WeakPolarHBondContact OD1-CA 3.48Å; N160-K162 PolarHBondContact OD1-N 3.14Å
161	I	92.6	Very high	93	Very high	29 Å²	29	69.1 Å²	69.1	15%	0.149	35%	0.346	C	S	.	.			trans	-91.7	3.3	-179.3	52.5	163.9	0	0	0	112.2	K143 L145 K159 Q163 A165	K143-I161 WeakPolarHBondContact O-CG1 3.46Å; K143-I161 PolarHBondContact O-N 3.15Å; L145-I161 HydrophobicContact CB-CG2 4.01Å; K159-I161 HydrophobicContact CG-CG2 4.45Å; K159-I161 PolarHBondContact O-N 2.93Å; I161-Q163 WeakPolarHBondContact CD1-O 3.41Å; I161-Q163 WeakPolarHBondContact CG1-O 3.35Å; I161-Q163 PolarHBondContact O-N 3.32Å; I161-A165 HydrophobicContact CD1-CB 3.32Å
162	K	91.4	Very high	93.3	Very high	168 Å²	168	66 Å²	66	73%	0.73	33%	0.334	S	S	*	.	S	Bend	trans	60.7	-9.3	176	-58.4	-178	179.3	178.6	0	116.3	N160	N160-K162 VanDerWaalsContact C-N 3.33Å; N160-K162 WeakPolarHBondContact OD1-CA 3.48Å; N160-K162 PolarHBondContact OD1-N 3.14Å
163	Q	92.4	Very high	93.7	Very high	109 Å²	109	67.2 Å²	67.2	51%	0.509	34%	0.341	S	S	.	.	S	Bend	trans	-136.6	162.1	179.7	-61.7	-172.5	15.5	0	0	110.1	K143 I161 A165 V181	K143-Q163 WeakPolarHBondContact CA-O 3.49Å; I161-Q163 WeakPolarHBondContact CD1-O 3.41Å; I161-Q163 WeakPolarHBondContact CG1-O 3.35Å; I161-Q163 PolarHBondContact O-N 3.32Å; Q163-A165 PolarHBondContact O-N 3.12Å; Q163-V181 HydrophobicContact CB-CG1 3.47Å; Q163-V181 VanDerWaalsContact CB-CG1 3.47Å; Q163-V181 HydrophobicContact CG-CG1 4.35Å
164	N	93.2	Very high	94.2	Very high	61 Å²	61	65.9 Å²	65.9	33%	0.326	33%	0.326	S	S	.	.			trans	-77.3	114	-180	-68	0.4	0	0	0	108.6	T141 K143	T141-N164 PolarHBondContact O-OD1 3.27Å; K143-N164 WeakPolarHBondContact CE-OD1 3.3Å; K143-N164 WeakPolarHBondContact CG-OD1 3.42Å
165	A	95.3	Very high	94.5	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	140.7	167.3	0	0	0	0	0	110	T125 V139 I161 Q163 V179 V180 V181	T125-A165 PolarHBondContact OG1-O 2.6Å; V139-A165 HydrophobicContact CB-CB 3.74Å; V139-A165 HydrophobicContact CG1-CB 3.74Å; V139-A165 HydrophobicContact CG2-CB 4.07Å; I161-A165 HydrophobicContact CD1-CB 3.32Å; Q163-A165 PolarHBondContact O-N 3.12Å; A165-V179 HydrophobicContact CB-CG1 3.62Å; A165-V180 CarbonylContact C-O 3.55Å; A165-V180 VanDerWaalsContact CA-O 3.26Å; A165-V180 WeakPolarHBondContact CA-O 3.37Å; A165-V181 HydrophobicContact CB-CG2 4.02Å
166	H	94.4	Very high	94.6	Very high	54 Å²	54	58.5 Å²	58.5	25%	0.25	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	-31.1	-180	-60.3	-55.2	0	0	0	112.2	S126 V180	S126-H166 WeakPolarHBondContact CB-O 3.18Å; H166-V180 PolarHBondContact N-O 3.32Å
167	I	97.5	Very high	94.9	Very high	15 Å²	15	56.2 Å²	56.2	8%	0.077	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	140.7	-177.5	-46.5	171.8	0	0	0	109.7	V179 V180 I205 V208	I167-V179 WeakPolarHBondContact O-CA 3.34Å; I167-V180 HydrophobicContact CB-CB 3.86Å; I167-V180 HydrophobicContact CB-CG2 3.82Å; I167-V180 HydrophobicContact CD1-CB 4.49Å; I167-V180 HydrophobicContact CD1-CG2 4.38Å; I167-V180 HydrophobicContact CG1-CB 4.3Å; I167-V180 HydrophobicContact CG1-CG2 4.47Å; I167-V180 PolarHBondContact O-N 2.95Å; I167-I205 HydrophobicContact CD1-CG2 4.02Å; I167-V208 HydrophobicContact CB-CG2 4.45Å; I167-V208 HydrophobicContact CD1-CG2 4.47Å; I167-V208 HydrophobicContact CG2-CG2 3.71Å
168	V	97.8	Very high	95.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	138.2	165	65.2	0	0	0	0	108.4	S126 S128 L137 V139 L145 V178 V179	S126-V168 PolarHBondContact OG-N 2.93Å; S126-V168 VanDerWaalsContact OG-N 3.11Å; S126-V168 PolarHBondContact OG-O 3.27Å; S128-V168 WeakPolarHBondContact CB-O 3.45Å; L137-V168 HydrophobicContact CB-CG1 4.26Å; L137-V168 HydrophobicContact CB-CG2 3.73Å; L137-V168 HydrophobicContact CD1-CG2 3.8Å; L137-V168 HydrophobicContact CG-CG2 4.42Å; V139-V168 HydrophobicContact CG1-CB 4.09Å; V139-V168 HydrophobicContact CG1-CG1 4.42Å; V139-V168 HydrophobicContact CG2-CB 4Å; V139-V168 HydrophobicContact CG2-CG1 3.92Å; L145-V168 HydrophobicContact CD1-CG2 4.08Å; V168-V178 VanDerWaalsContact CA-O 3.32Å; V168-V178 WeakPolarHBondContact CA-O 3.47Å; V168-V179 HydrophobicContact CG2-CG2 4.27Å
169	R	97.8	Very high	95.3	Very high	81 Å²	81	46.9 Å²	46.9	31%	0.306	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	128.2	178.8	-128.6	69.3	175.1	-173.7	2.3	111.4	Y177 V178 V208 F210	R169-Y177 CarbonylContact O-C 3.5Å; R169-Y177 WeakPolarHBondContact O-CA 3.25Å; R169-Y177 WeakPolarHBondContact O-CB 3.5Å; R169-V178 HydrophobicContact CB-CG2 3.8Å; R169-V178 PolarHBondContact N-O 3.13Å; R169-V178 PolarHBondContact O-N 3.11Å; R169-V208 HydrophobicContact CB-CG2 4.36Å; R169-F210 HydrophobicContact CB-CE2 4.35Å
170	W	97.6	Very high	95.5	Very high	14 Å²	14	43.9 Å²	43.9	5%	0.053	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	147.9	167.3	-76.8	105.5	0	0	0	111.3	S128 V129 H130 L137 G174 R176 Y177 L190 F210	S128-W170 VanDerWaalsContact O-CD1 3.29Å; S128-W170 PolarHBondContact O-NE1 3.1Å; S128-W170 PolarHBondContact OG-N 3.43Å; V129-W170 VanDerWaalsContact C-CD1 3.46Å; H130-W170 HydrophobicContact CB-CD2 4.25Å; H130-W170 HydrophobicContact CB-CG 4.4Å; H130-W170 HydrophobicContact CB-CZ2 4.35Å; H130-W170 AromaticContact CD2-CD2 3.84Å; H130-W170 AromaticContact CD2-CE2 3.98Å; H130-W170 AromaticContact CD2-CE3 3.67Å; H130-W170 AromaticContact CD2-CH2 3.88Å; H130-W170 AromaticContact CD2-CZ3 3.71Å; L137-W170 HydrophobicContact CD1-CD2 4.04Å; L137-W170 HydrophobicContact CD1-CH2 4.08Å; L137-W170 HydrophobicContact CD1-CZ2 3.4Å; L137-W170 VanDerWaalsContact CD1-CZ2 3.4Å; L137-W170 HydrophobicContact CD2-CZ2 4.04Å; L137-W170 HydrophobicContact CG-CH2 4.47Å; L137-W170 HydrophobicContact CG-CZ2 3.46Å; L137-W170 VanDerWaalsContact CG-CZ2 3.46Å; W170-G174 WeakPolarHBondContact CZ3-O 3.4Å; W170-R176 VanDerWaalsContact CE3-O 3.24Å; W170-Y177 HydrophobicContact CE3-CD1 4.21Å; W170-Y177 HydrophobicContact CE3-CG 4.48Å; W170-Y177 AromaticContact CH2-CD1 3.86Å; W170-Y177 HydrophobicContact CH2-CD1 3.86Å; W170-Y177 HydrophobicContact CH2-CE1 4.41Å; W170-Y177 AromaticContact CZ3-CD1 3.67Å; W170-Y177 HydrophobicContact CZ3-CD1 3.67Å; W170-Y177 HydrophobicContact CZ3-CG 4.36Å; W170-L190 HydrophobicContact CH2-CD1 3.8Å; W170-L190 HydrophobicContact CH2-CD2 4.23Å; W170-L190 HydrophobicContact CH2-CG 4.49Å; W170-L190 HydrophobicContact CZ3-CB 4.41Å; W170-L190 HydrophobicContact CZ3-CD1 4.24Å; W170-L190 HydrophobicContact CZ3-CD2 4.15Å; W170-F210 VanDerWaalsContact O-CD2 3.23Å; W170-F210 WeakPolarHBondContact O-CD2 3.36Å; W170-F210 WeakPolarHBondContact O-CE2 3.19Å
171	S	96.6	Very high	95.5	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.007	19%	0.19	C	C	.	.			trans	-67.6	152.8	163.8	69.3	0	0	0	0	110.1	D173 G174 D175 R176 N213	S171-D173 PolarHBondContact O-N 3.12Å; S171-G174 PolarHBondContact O-N 3.36Å; S171-G174 PolarHBondContact OG-N 3.21Å; S171-D175 PolarHBondContact OG-N 3.03Å; S171-D175 PolarHBondContact OG-OD1 3.46Å; S171-R176 WeakPolarHBondContact CB-O 3.01Å; S171-R176 PolarHBondContact N-O 3.32Å; S171-R176 PolarHBondContact OG-N 3Å; S171-R176 VanDerWaalsContact OG-N 3.14Å; S171-R176 PolarHBondContact OG-O 3.48Å; S171-R176 VanDerWaalsContact OG-O 3.12Å; S171-N213 WeakPolarHBondContact CB-OD1 3.24Å; S171-N213 PolarHBondContact OG-OD1 3.36Å
172	P	94.1	Very high	95.4	Very high	62 Å²	62	42.1 Å²	42.1	40%	0.403	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-32.5	177.4	-28.8	36	0	0	0	114.7	P131 F210	P131-P172 WeakPolarHBondContact CG-O 3.18Å; P172-F210 HydrophobicContact CG-CB 3.87Å
173	D	95	Very high	95.6	Very high	115 Å²	115	36.2 Å²	36.2	62%	0.615	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-13.7	177.4	-63.9	-19.2	0	0	0	112.6	S171 D175 N213	S171-D173 PolarHBondContact O-N 3.12Å; D173-D175 VanDerWaalsContact C-N 3.26Å; D173-D175 PolarHBondContact O-N 3.04Å; D173-N213 WeakPolarHBondContact CB-OD1 3.39Å; D173-N213 PolarHBondContact N-OD1 2.87Å; D173-N213 VanDerWaalsContact N-OD1 3.1Å; D173-N213 WeakPolarHBondContact OD2-CB 3.43Å; D173-N213 PolarHBondContact OD2-ND2 3.09Å
174	G	94.9	Very high	95.7	Very high	2 Å²	2	35.7 Å²	35.7	2%	0.021	18%	0.178	C	C	.	.	S	Bend	trans	77.6	5.9	179.4	0	0	0	0	0	114.7	H130 W170 S171 R176 L190	H130-G174 WeakPolarHBondContact NE2-CA 3.32Å; H130-G174 PolarHBondContact NE2-O 3.14Å; W170-G174 WeakPolarHBondContact CZ3-O 3.4Å; S171-G174 PolarHBondContact O-N 3.36Å; S171-G174 PolarHBondContact OG-N 3.21Å; G174-R176 VanDerWaalsContact C-N 3.29Å; G174-L190 WeakPolarHBondContact O-CD2 3.31Å
175	D	94.9	Very high	95.9	Very high	50 Å²	50	32.8 Å²	32.8	27%	0.267	16%	0.162	S	C	.	.	S	Bend	trans	-74.6	-21	177.2	72.6	-41.1	0	0	0	112.9	S171 D173 L190 N213	S171-D175 PolarHBondContact OG-N 3.03Å; S171-D175 PolarHBondContact OG-OD1 3.46Å; D173-D175 VanDerWaalsContact C-N 3.26Å; D173-D175 PolarHBondContact O-N 3.04Å; D175-L190 VanDerWaalsContact O-CB 3.31Å; D175-L190 WeakPolarHBondContact O-CB 3.34Å; D175-L190 PolarHBondContact O-N 3.37Å; D175-N213 PolarHBondContact OD1-ND2 3.25Å; D175-N213 PolarHBondContact OD1-OD1 2.84Å
176	R	95.6	Very high	96	Very high	37 Å²	37	34.6 Å²	34.6	14%	0.14	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	161.9	-175.8	-66.5	167.2	-163.5	-105	9.5	111.6	W170 S171 G174 Y188	W170-R176 VanDerWaalsContact CE3-O 3.24Å; S171-R176 WeakPolarHBondContact CB-O 3.01Å; S171-R176 PolarHBondContact N-O 3.32Å; S171-R176 PolarHBondContact OG-N 3Å; S171-R176 VanDerWaalsContact OG-N 3.14Å; S171-R176 PolarHBondContact OG-O 3.48Å; S171-R176 VanDerWaalsContact OG-O 3.12Å; G174-R176 VanDerWaalsContact C-N 3.29Å; R176-Y188 CarbonylContact C-O 3.58Å; R176-Y188 WeakPolarHBondContact CA-O 3.39Å; R176-Y188 VanDerWaalsContact CB-O 3.31Å; R176-Y188 WeakPolarHBondContact CB-O 3.29Å
177	Y	96.8	Very high	96.1	Very high	16 Å²	16	32 Å²	32	6%	0.063	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	155.1	167.6	60.8	-87.1	0	0	0	110.4	L137 L145 R169 W170 V179 Y188	L137-Y177 HydrophobicContact CD1-CD1 3.89Å; L137-Y177 HydrophobicContact CD1-CD2 3.57Å; L137-Y177 HydrophobicContact CD1-CE1 4.38Å; L137-Y177 HydrophobicContact CD1-CE2 4.1Å; L137-Y177 HydrophobicContact CD1-CG 3.45Å; L137-Y177 VanDerWaalsContact CD1-CG 3.45Å; L145-Y177 HydrophobicContact CD2-CE2 3.71Å; R169-Y177 CarbonylContact O-C 3.5Å; R169-Y177 WeakPolarHBondContact O-CA 3.25Å; R169-Y177 WeakPolarHBondContact O-CB 3.5Å; W170-Y177 HydrophobicContact CE3-CD1 4.21Å; W170-Y177 HydrophobicContact CE3-CG 4.48Å; W170-Y177 AromaticContact CH2-CD1 3.86Å; W170-Y177 HydrophobicContact CH2-CD1 3.86Å; W170-Y177 HydrophobicContact CH2-CE1 4.41Å; W170-Y177 AromaticContact CZ3-CD1 3.67Å; W170-Y177 HydrophobicContact CZ3-CD1 3.67Å; W170-Y177 HydrophobicContact CZ3-CG 4.36Å; Y177-V179 HydrophobicContact CD2-CG2 3.89Å; Y177-V179 HydrophobicContact CE2-CG2 3.88Å; Y177-Y188 AromaticContact CD2-CD2 3.96Å; Y177-Y188 HydrophobicContact CD2-CD2 3.96Å; Y177-Y188 HydrophobicContact CD2-CG 4.04Å; Y177-Y188 VanDerWaalsContact CE1-CB 3.44Å; Y177-Y188 HydrophobicContact CE1-CG 4.18Å; Y177-Y188 HydrophobicContact CE2-CD1 4.03Å; Y177-Y188 AromaticContact CE2-CD2 3.44Å; Y177-Y188 HydrophobicContact CE2-CD2 3.44Å; Y177-Y188 VanDerWaalsContact CE2-CD2 3.44Å; Y177-Y188 HydrophobicContact CE2-CE2 4.22Å; Y177-Y188 AromaticContact CE2-CG 3.32Å; Y177-Y188 HydrophobicContact CE2-CG 3.32Å; Y177-Y188 AromaticContact CZ-CD1 3.79Å; Y177-Y188 AromaticContact CZ-CG 3.41Å; Y177-Y188 VanDerWaalsContact CZ-CG 3.41Å; Y177-Y188 PolarHBondContact N-O 2.97Å; Y177-Y188 PolarHBondContact O-N 2.58Å; Y177-Y188 WeakPolarHBondContact OH-CD1 3.47Å
178	V	97.8	Very high	96	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	143.4	175.5	-63.6	0	0	0	0	110.3	V168 R169 I185 D186 I187 V208 F210 L216	V168-V178 VanDerWaalsContact CA-O 3.32Å; V168-V178 WeakPolarHBondContact CA-O 3.47Å; R169-V178 HydrophobicContact CB-CG2 3.8Å; R169-V178 PolarHBondContact N-O 3.13Å; R169-V178 PolarHBondContact O-N 3.11Å; V178-I185 HydrophobicContact CB-CG2 3.85Å; V178-I185 HydrophobicContact CG1-CG2 4.07Å; V178-D186 CarbonylContact C-O 3.48Å; V178-D186 WeakPolarHBondContact CA-O 3.32Å; V178-I187 HydrophobicContact CG1-CG1 4.13Å; V178-V208 HydrophobicContact CG2-CG2 4.26Å; V178-F210 HydrophobicContact CG1-CE2 4.36Å; V178-F210 HydrophobicContact CG1-CZ 3.9Å; V178-F210 HydrophobicContact CG2-CE2 4.07Å; V178-F210 HydrophobicContact CG2-CZ 4.44Å; V178-L216 HydrophobicContact CG1-CD2 4.21Å; V178-L216 HydrophobicContact CG2-CD1 4.49Å; V178-L216 HydrophobicContact CG2-CD2 4.36Å
179	V	97.6	Very high	95.8	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.3	173.1	-178	0	0	0	0	108	V139 L145 A165 I167 V168 Y177 V181 D186 Y188	V139-V179 HydrophobicContact CG1-CG1 4.41Å; L145-V179 HydrophobicContact CD1-CG2 4.33Å; L145-V179 HydrophobicContact CD2-CG2 4.15Å; A165-V179 HydrophobicContact CB-CG1 3.62Å; I167-V179 WeakPolarHBondContact O-CA 3.34Å; V168-V179 HydrophobicContact CG2-CG2 4.27Å; Y177-V179 HydrophobicContact CD2-CG2 3.89Å; Y177-V179 HydrophobicContact CE2-CG2 3.88Å; V179-V181 HydrophobicContact CG1-CG2 4.24Å; V179-D186 PolarHBondContact N-O 3.13Å; V179-D186 PolarHBondContact O-N 2.8Å; V179-Y188 HydrophobicContact CB-CD2 4.47Å; V179-Y188 HydrophobicContact CB-CE2 4.05Å; V179-Y188 HydrophobicContact CG2-CD2 3.91Å; V179-Y188 HydrophobicContact CG2-CE2 3.74Å
180	V	97.4	Very high	95.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	121.2	-179.4	-175.4	0	0	0	0	109.5	A165 H166 I167 K184 I185 I205 V208	A165-V180 CarbonylContact C-O 3.55Å; A165-V180 VanDerWaalsContact CA-O 3.26Å; A165-V180 WeakPolarHBondContact CA-O 3.37Å; H166-V180 PolarHBondContact N-O 3.32Å; I167-V180 HydrophobicContact CB-CB 3.86Å; I167-V180 HydrophobicContact CB-CG2 3.82Å; I167-V180 HydrophobicContact CD1-CB 4.49Å; I167-V180 HydrophobicContact CD1-CG2 4.38Å; I167-V180 HydrophobicContact CG1-CB 4.3Å; I167-V180 HydrophobicContact CG1-CG2 4.47Å; I167-V180 PolarHBondContact O-N 2.95Å; V180-K184 CarbonylContact C-O 3.56Å; V180-K184 VanDerWaalsContact CA-O 3.29Å; V180-K184 WeakPolarHBondContact CA-O 3.38Å; V180-I185 HydrophobicContact CG2-CG1 4.2Å; V180-I185 HydrophobicContact CG2-CG2 4.45Å; V180-I205 HydrophobicContact CG1-CB 3.82Å; V180-I205 HydrophobicContact CG1-CD1 3.65Å; V180-I205 HydrophobicContact CG1-CG1 4.34Å; V180-I205 HydrophobicContact CG1-CG2 3.99Å; V180-V208 HydrophobicContact CG2-CG1 4.01Å; V180-V208 HydrophobicContact CG2-CG2 4.23Å
181	V	95.4	Very high	94.9	Very high	12 Å²	12	40.6 Å²	40.6	7%	0.073	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	112.5	176.9	179.9	0	0	0	0	107.5	Q163 A165 V179 D183 K184	Q163-V181 HydrophobicContact CB-CG1 3.47Å; Q163-V181 VanDerWaalsContact CB-CG1 3.47Å; Q163-V181 HydrophobicContact CG-CG1 4.35Å; A165-V181 HydrophobicContact CB-CG2 4.02Å; V179-V181 HydrophobicContact CG1-CG2 4.24Å; V181-D183 PolarHBondContact O-N 2.94Å; V181-K184 PolarHBondContact N-O 2.87Å; V181-K184 PolarHBondContact O-N 2.81Å
182	D	91	Very high	94.4	Very high	86 Å²	86	44.3 Å²	44.3	46%	0.46	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	-104	-173.7	-163.1	19.8	0	0	0	113.3
183	D	93.8	Very high	93.7	Very high	45 Å²	45	44.3 Å²	44.3	24%	0.241	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-0.1	178.6	68.6	-23.3	0	0	0	113.3	V181 N201	V181-D183 PolarHBondContact O-N 2.94Å; D183-N201 WeakPolarHBondContact CB-O 3.36Å; D183-N201 PolarHBondContact O-N 2.71Å
184	K	95.7	Very high	93.4	Very high	97 Å²	97	41.3 Å²	41.3	42%	0.422	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	145.6	-177.6	-67.4	174.2	-172.3	176.7	0	112.4	V180 V181 T198 I199 T200	V180-K184 CarbonylContact C-O 3.56Å; V180-K184 VanDerWaalsContact CA-O 3.29Å; V180-K184 WeakPolarHBondContact CA-O 3.38Å; V181-K184 PolarHBondContact N-O 2.87Å; V181-K184 PolarHBondContact O-N 2.81Å; K184-T198 HydrophobicContact CB-CG2 4.28Å; K184-I199 CarbonylContact C-O 3.59Å; K184-I199 WeakPolarHBondContact CA-O 3.45Å; K184-T200 HydrophobicContact CG-CG2 4.28Å
185	I	97.4	Very high	93.3	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	107	176.4	-51.4	172.6	0	0	0	107.2	V178 V180 T198 I199 I205 L216 I218	V178-I185 HydrophobicContact CB-CG2 3.85Å; V178-I185 HydrophobicContact CG1-CG2 4.07Å; V180-I185 HydrophobicContact CG2-CG1 4.2Å; V180-I185 HydrophobicContact CG2-CG2 4.45Å; I185-T198 CarbonylContact O-C 3.49Å; I185-T198 VanDerWaalsContact O-CA 3.3Å; I185-T198 WeakPolarHBondContact O-CA 3.24Å; I185-I199 HydrophobicContact CB-CB 4.4Å; I185-I199 PolarHBondContact N-O 2.85Å; I185-I199 PolarHBondContact O-N 3Å; I185-I205 HydrophobicContact CD1-CD1 3.71Å; I185-I205 HydrophobicContact CG1-CD1 3.44Å; I185-I205 VanDerWaalsContact CG1-CD1 3.44Å; I185-L216 HydrophobicContact CD1-CD2 4.42Å; I185-L216 HydrophobicContact CG2-CD2 4.26Å; I185-I218 HydrophobicContact CD1-CD1 3.21Å; I185-I218 HydrophobicContact CD1-CG1 3.61Å; I185-I218 HydrophobicContact CD1-CG2 4.14Å
186	D	96.4	Very high	93.3	Very high	38 Å²	38	44.9 Å²	44.9	20%	0.203	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	126.6	172.1	-73.3	-23.7	0	0	0	109.6	V178 V179 Y188 V195 T198	V178-D186 CarbonylContact C-O 3.48Å; V178-D186 WeakPolarHBondContact CA-O 3.32Å; V179-D186 PolarHBondContact N-O 3.13Å; V179-D186 PolarHBondContact O-N 2.8Å; D186-Y188 HydrophobicContact CB-CD2 4.28Å; D186-Y188 HydrophobicContact CB-CE2 3.62Å; D186-V195 HydrophobicContact CB-CG1 4.41Å; D186-T198 VanDerWaalsContact OD1-CG2 3.23Å; D186-T198 WeakPolarHBondContact OD1-CG2 3.09Å; D186-T198 PolarHBondContact OD1-OG1 2.77Å
187	I	96.9	Very high	93.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	121.8	-179.8	-58.4	160.3	0	0	0	108.2	V178 V195 T196 G197 I199 V230 A233	V178-I187 HydrophobicContact CG1-CG1 4.13Å; I187-V195 CarbonylContact O-C 3.57Å; I187-V195 VanDerWaalsContact O-CA 3.28Å; I187-V195 WeakPolarHBondContact O-CA 3.26Å; I187-T196 WeakPolarHBondContact CG2-OG1 3.28Å; I187-T196 PolarHBondContact O-N 3.02Å; I187-T196 PolarHBondContact O-OG1 2.84Å; I187-G197 WeakPolarHBondContact CB-O 3.32Å; I187-G197 PolarHBondContact N-O 2.95Å; I187-I199 HydrophobicContact CD1-CD1 3.84Å; I187-I199 HydrophobicContact CD1-CG1 4.11Å; I187-V230 HydrophobicContact CB-CG1 4.27Å; I187-V230 HydrophobicContact CD1-CB 4.36Å; I187-V230 HydrophobicContact CD1-CG1 3.85Å; I187-V230 HydrophobicContact CG1-CG1 3.93Å; I187-V230 HydrophobicContact CG2-CG1 3.34Å; I187-A233 HydrophobicContact CD1-CB 4.25Å
188	Y	95.2	Very high	93.1	Very high	7 Å²	7	46.2 Å²	46.2	3%	0.027	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	140.5	179.8	-72.9	-93.1	0	0	0	111.2	K159 R176 Y177 V179 D186 S194 V195	K159-Y188 VanDerWaalsContact NZ-CE1 3.3Å; K159-Y188 PolarHBondContact NZ-OH 3.42Å; R176-Y188 CarbonylContact C-O 3.58Å; R176-Y188 WeakPolarHBondContact CA-O 3.39Å; R176-Y188 VanDerWaalsContact CB-O 3.31Å; R176-Y188 WeakPolarHBondContact CB-O 3.29Å; Y177-Y188 AromaticContact CD2-CD2 3.96Å; Y177-Y188 HydrophobicContact CD2-CD2 3.96Å; Y177-Y188 HydrophobicContact CD2-CG 4.04Å; Y177-Y188 VanDerWaalsContact CE1-CB 3.44Å; Y177-Y188 HydrophobicContact CE1-CG 4.18Å; Y177-Y188 HydrophobicContact CE2-CD1 4.03Å; Y177-Y188 AromaticContact CE2-CD2 3.44Å; Y177-Y188 HydrophobicContact CE2-CD2 3.44Å; Y177-Y188 VanDerWaalsContact CE2-CD2 3.44Å; Y177-Y188 HydrophobicContact CE2-CE2 4.22Å; Y177-Y188 AromaticContact CE2-CG 3.32Å; Y177-Y188 HydrophobicContact CE2-CG 3.32Å; Y177-Y188 AromaticContact CZ-CD1 3.79Å; Y177-Y188 AromaticContact CZ-CG 3.41Å; Y177-Y188 VanDerWaalsContact CZ-CG 3.41Å; Y177-Y188 PolarHBondContact N-O 2.97Å; Y177-Y188 PolarHBondContact O-N 2.58Å; Y177-Y188 WeakPolarHBondContact OH-CD1 3.47Å; V179-Y188 HydrophobicContact CB-CD2 4.47Å; V179-Y188 HydrophobicContact CB-CE2 4.05Å; V179-Y188 HydrophobicContact CG2-CD2 3.91Å; V179-Y188 HydrophobicContact CG2-CE2 3.74Å; D186-Y188 HydrophobicContact CB-CD2 4.28Å; D186-Y188 HydrophobicContact CB-CE2 3.62Å; Y188-S194 WeakPolarHBondContact CA-O 3.34Å; Y188-V195 HydrophobicContact CD1-CG2 4.07Å; Y188-V195 HydrophobicContact CE1-CG2 3.43Å; Y188-V195 VanDerWaalsContact CE1-CG2 3.43Å; Y188-V195 HydrophobicContact CE2-CG2 4.06Å; Y188-V195 VanDerWaalsContact CZ-CG2 3.44Å
189	K	93.5	Very high	93.1	Very high	56 Å²	56	46.5 Å²	46.5	24%	0.243	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	133.4	166.8	-167.2	177	-177.1	-162	0	109.8	E191 A193 S194 T196	K189-E191 WeakPolarHBondContact CE-OE2 3.43Å; K189-E191 IonicContact NZ-OE2 3.74Å; K189-E191 PolarHBondContact NZ-OE2 3.47Å; K189-A193 WeakPolarHBondContact O-CA 3.48Å; K189-A193 PolarHBondContact O-N 2.81Å; K189-S194 PolarHBondContact N-O 3.05Å; K189-T196 HydrophobicContact CB-CG2 3.72Å
190	L	89.6	Confident	93	Very high	70 Å²	70	49.9 Å²	49.9	37%	0.366	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-44	-176.6	-178.5	56	0	0	0	112.1	W170 G174 D175 T192 A193	W170-L190 HydrophobicContact CH2-CD1 3.8Å; W170-L190 HydrophobicContact CH2-CD2 4.23Å; W170-L190 HydrophobicContact CH2-CG 4.49Å; W170-L190 HydrophobicContact CZ3-CB 4.41Å; W170-L190 HydrophobicContact CZ3-CD1 4.24Å; W170-L190 HydrophobicContact CZ3-CD2 4.15Å; G174-L190 WeakPolarHBondContact O-CD2 3.31Å; D175-L190 VanDerWaalsContact O-CB 3.31Å; D175-L190 WeakPolarHBondContact O-CB 3.34Å; D175-L190 PolarHBondContact O-N 3.37Å; L190-T192 PolarHBondContact O-N 3.17Å; L190-A193 PolarHBondContact O-N 3.06Å
191	E	87.5	Confident	92.9	Very high	157 Å²	157	50 Å²	50	73%	0.734	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-41.4	-176.3	-65.3	178.9	157.3	0	0	113.3	K189	K189-E191 WeakPolarHBondContact CE-OE2 3.43Å; K189-E191 IonicContact NZ-OE2 3.74Å; K189-E191 PolarHBondContact NZ-OE2 3.47Å
192	T	85.2	Confident	92.8	Very high	80 Å²	80	53.7 Å²	53.7	49%	0.491	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-11.3	-176	59.4	0	0	0	0	113	L190 S194	L190-T192 PolarHBondContact O-N 3.17Å; T192-S194 WeakPolarHBondContact CB-OG 3.01Å; T192-S194 PolarHBondContact O-N 2.89Å; T192-S194 PolarHBondContact OG1-OG 2.96Å
193	A	81.2	Confident	92.9	Very high	62 Å²	62	55.2 Å²	55.2	51%	0.512	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	25	-171.5	0	0	0	0	0	114	K189 L190	K189-A193 WeakPolarHBondContact O-CA 3.48Å; K189-A193 PolarHBondContact O-N 2.81Å; L190-A193 PolarHBondContact O-N 3.06Å
194	S	88.4	Confident	93	Very high	51 Å²	51	59 Å²	59	36%	0.357	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	155.5	-175.3	69.4	0	0	0	0	111.2	Y188 K189 T192 T196	Y188-S194 WeakPolarHBondContact CA-O 3.34Å; K189-S194 PolarHBondContact N-O 3.05Å; T192-S194 WeakPolarHBondContact CB-OG 3.01Å; T192-S194 PolarHBondContact O-N 2.89Å; T192-S194 PolarHBondContact OG1-OG 2.96Å; S194-T196 PolarHBondContact O-N 2.97Å
195	V	93.1	Very high	93.1	Very high	59 Å²	59	54.6 Å²	54.6	36%	0.358	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	122.1	170.1	-178.6	0	0	0	0	107.8	D186 I187 Y188 G197	D186-V195 HydrophobicContact CB-CG1 4.41Å; I187-V195 CarbonylContact O-C 3.57Å; I187-V195 VanDerWaalsContact O-CA 3.28Å; I187-V195 WeakPolarHBondContact O-CA 3.26Å; Y188-V195 HydrophobicContact CD1-CG2 4.07Å; Y188-V195 HydrophobicContact CE1-CG2 3.43Å; Y188-V195 VanDerWaalsContact CE1-CG2 3.43Å; Y188-V195 HydrophobicContact CE2-CG2 4.06Å; Y188-V195 VanDerWaalsContact CZ-CG2 3.44Å; V195-G197 WeakPolarHBondContact CG1-O 3.47Å
196	T	93.4	Very high	93	Very high	69 Å²	69	56 Å²	56	42%	0.423	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	-23.6	176.1	53.8	0	0	0	0	112.4	I187 K189 S194	I187-T196 WeakPolarHBondContact CG2-OG1 3.28Å; I187-T196 PolarHBondContact O-N 3.02Å; I187-T196 PolarHBondContact O-OG1 2.84Å; K189-T196 HydrophobicContact CB-CG2 3.72Å; S194-T196 PolarHBondContact O-N 2.97Å
197	G	93.5	Very high	93	Very high	13 Å²	13	55.2 Å²	55.2	13%	0.134	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	159.6	176.9	0	0	0	0	0	111.5	I187 V195	I187-G197 WeakPolarHBondContact CB-O 3.32Å; I187-G197 PolarHBondContact N-O 2.95Å; V195-G197 WeakPolarHBondContact CG1-O 3.47Å
198	T	95.9	Very high	93.1	Very high	67 Å²	67	55.3 Å²	55.3	41%	0.411	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	132.6	173.9	-59.8	0	0	0	0	108.5	K184 I185 D186	K184-T198 HydrophobicContact CB-CG2 4.28Å; I185-T198 CarbonylContact O-C 3.49Å; I185-T198 VanDerWaalsContact O-CA 3.3Å; I185-T198 WeakPolarHBondContact O-CA 3.24Å; D186-T198 VanDerWaalsContact OD1-CG2 3.23Å; D186-T198 WeakPolarHBondContact OD1-CG2 3.09Å; D186-T198 PolarHBondContact OD1-OG1 2.77Å
199	I	96.3	Very high	93.2	Very high	6 Å²	6	57.7 Å²	57.7	3%	0.031	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	133.9	176.6	-58.6	175.4	0	0	0	107.9	K184 I185 I187 C228 A233 W235	K184-I199 CarbonylContact C-O 3.59Å; K184-I199 WeakPolarHBondContact CA-O 3.45Å; I185-I199 HydrophobicContact CB-CB 4.4Å; I185-I199 PolarHBondContact N-O 2.85Å; I185-I199 PolarHBondContact O-N 3Å; I187-I199 HydrophobicContact CD1-CD1 3.84Å; I187-I199 HydrophobicContact CD1-CG1 4.11Å; I199-C228 HydrophobicContact CD1-CB 3.55Å; I199-C228 WeakPolarHBondContact CD1-SG 3.43Å; I199-A233 HydrophobicContact CD1-CB 4.49Å; I199-A233 HydrophobicContact CG1-CB 4.13Å; I199-W235 HydrophobicContact CG2-CD2 4.39Å; I199-W235 HydrophobicContact CG2-CH2 3.72Å; I199-W235 HydrophobicContact CG2-CZ2 3.27Å; I199-W235 HydrophobicContact CG2-CZ3 4.41Å
200	T	96.5	Very high	93.3	Very high	72 Å²	72	55.6 Å²	55.6	44%	0.442	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	120.6	177.3	-52.5	0	0	0	0	109.2	K184 W235	K184-T200 HydrophobicContact CG-CG2 4.28Å; T200-W235 WeakPolarHBondContact O-CZ2 3.41Å
201	N	94.7	Very high	93.6	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.011	30%	0.295	C	S	.	.			trans	-86.9	144.8	173.2	-170.8	58.4	0	0	0	109.8	D183 K203 I205 R226 W235	D183-N201 WeakPolarHBondContact CB-O 3.36Å; D183-N201 PolarHBondContact O-N 2.71Å; N201-K203 PolarHBondContact ND2-N 3.2Å; N201-K203 PolarHBondContact ND2-O 3.16Å; N201-K203 PolarHBondContact O-N 2.96Å; N201-K203 VanDerWaalsContact O-N 3.16Å; N201-I205 HydrophobicContact CB-CD1 3.92Å; N201-I205 HydrophobicContact CB-CG1 3.89Å; N201-R226 PolarHBondContact OD1-NH1 3.46Å; N201-W235 HydrophobicContact CB-CH2 4.38Å; N201-W235 HydrophobicContact CB-CZ2 4.46Å
202	P	93	Very high	93.8	Very high	90 Å²	90	47.4 Å²	47.4	58%	0.584	27%	0.272	S	S	*	.	S	Bend	trans	-63.9	-21.3	-179.2	-25.4	35.7	0	0	0	115
203	K	94.4	Very high	94.1	Very high	118 Å²	118	44.8 Å²	44.8	51%	0.513	26%	0.256	S	S	.	.	S	Bend	trans	-131.6	164.8	-176.8	-65.5	-65.7	-175.3	179.9	0	110.7	N201 I205 D222	N201-K203 PolarHBondContact ND2-N 3.2Å; N201-K203 PolarHBondContact ND2-O 3.16Å; N201-K203 PolarHBondContact O-N 2.96Å; N201-K203 VanDerWaalsContact O-N 3.16Å; K203-I205 PolarHBondContact O-N 3.29Å; K203-D222 HydrophobicContact CB-CB 4.46Å; K203-D222 HydrophobicContact CG-CB 4.1Å
204	R	94.9	Very high	94.7	Very high	125 Å²	125	43.3 Å²	43.3	47%	0.472	24%	0.242	S	C	.	.			trans	-57.3	135.7	175.7	-174.4	-179.7	-179	-169.5	1.5	110.9	G220 D221	R204-G220 CarbonylContact O-C 3.58Å; R204-G220 WeakPolarHBondContact O-CA 3.44Å; R204-D221 HydrophobicContact CB-CB 4.45Å; R204-D221 PolarHBondContact O-N 3.02Å
205	I	97.1	Very high	95	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.026	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	132	-178.2	-61.9	160	0	0	0	109.6	I167 V180 I185 N201 K203 V208 I218	I167-I205 HydrophobicContact CD1-CG2 4.02Å; V180-I205 HydrophobicContact CG1-CB 3.82Å; V180-I205 HydrophobicContact CG1-CD1 3.65Å; V180-I205 HydrophobicContact CG1-CG1 4.34Å; V180-I205 HydrophobicContact CG1-CG2 3.99Å; I185-I205 HydrophobicContact CD1-CD1 3.71Å; I185-I205 HydrophobicContact CG1-CD1 3.44Å; I185-I205 VanDerWaalsContact CG1-CD1 3.44Å; N201-I205 HydrophobicContact CB-CD1 3.92Å; N201-I205 HydrophobicContact CB-CG1 3.89Å; K203-I205 PolarHBondContact O-N 3.29Å; I205-V208 HydrophobicContact CG2-CG1 3.67Å; I205-I218 HydrophobicContact CD1-CG2 4.29Å; I205-I218 HydrophobicContact CG1-CG2 3.98Å; I205-I218 HydrophobicContact CG2-CG2 4.13Å
206	S	96.6	Very high	95.2	Very high	28 Å²	28	38.7 Å²	38.7	20%	0.196	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	-31.9	177	-80.4	0	0	0	0	112.2	A219 K247	S206-A219 PolarHBondContact N-O 2.89Å; S206-K247 PolarHBondContact OG-NZ 2.62Å
207	S	97	Very high	95.4	Very high	22 Å²	22	35.4 Å²	35.4	15%	0.154	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	144.4	-177.2	-169.7	0	0	0	0	111.5	A219 V249	S207-A219 PolarHBondContact N-O 2.9Å; S207-A219 PolarHBondContact O-N 2.79Å; S207-V249 PolarHBondContact OG-N 2.78Å; S207-V249 VanDerWaalsContact OG-N 3.17Å
208	V	97.7	Very high	95.6	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.018	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	140.7	171	-59.5	0	0	0	0	110.1	I167 R169 V178 V180 I205 L216 A217 I218	I167-V208 HydrophobicContact CB-CG2 4.45Å; I167-V208 HydrophobicContact CD1-CG2 4.47Å; I167-V208 HydrophobicContact CG2-CG2 3.71Å; R169-V208 HydrophobicContact CB-CG2 4.36Å; V178-V208 HydrophobicContact CG2-CG2 4.26Å; V180-V208 HydrophobicContact CG2-CG1 4.01Å; V180-V208 HydrophobicContact CG2-CG2 4.23Å; I205-V208 HydrophobicContact CG2-CG1 3.67Å; V208-L216 HydrophobicContact CB-CD1 4.23Å; V208-L216 HydrophobicContact CB-CD2 4.37Å; V208-L216 HydrophobicContact CB-CG 4.42Å; V208-A217 CarbonylContact C-O 3.53Å; V208-A217 VanDerWaalsContact CA-O 3.26Å; V208-A217 WeakPolarHBondContact CA-O 3.23Å; V208-I218 HydrophobicContact CG1-CG1 4.08Å; V208-I218 HydrophobicContact CG1-CG2 4.42Å
209	K	97.4	Very high	95.7	Very high	56 Å²	56	31.7 Å²	31.7	24%	0.243	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	127.1	-179.9	-178.7	72.1	-175.8	-153.7	0	110.3	L211 A217 V249 D250 S251	K209-L211 PolarHBondContact O-N 2.92Å; K209-A217 PolarHBondContact N-O 3.26Å; K209-A217 PolarHBondContact O-N 3.31Å; K209-V249 HydrophobicContact CB-CB 4.48Å; K209-V249 HydrophobicContact CB-CG1 4.09Å; K209-D250 WeakPolarHBondContact CE-OD1 3.24Å; K209-D250 IonicContact NZ-OD1 2.71Å; K209-D250 PolarHBondContact NZ-OD1 3.04Å; K209-S251 VanDerWaalsContact CE-OG 3.25Å; K209-S251 WeakPolarHBondContact CE-OG 3.21Å; K209-S251 WeakPolarHBondContact CG-OG 3.37Å
210	F	96.6	Very high	95.6	Very high	12 Å²	12	31.4 Å²	31.4	5%	0.053	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	127.1	169.6	-79.9	-83.3	0	0	0	109.8	R169 W170 P172 V178 N212 L216 V230 S251	R169-F210 HydrophobicContact CB-CE2 4.35Å; W170-F210 VanDerWaalsContact O-CD2 3.23Å; W170-F210 WeakPolarHBondContact O-CD2 3.36Å; W170-F210 WeakPolarHBondContact O-CE2 3.19Å; P172-F210 HydrophobicContact CG-CB 3.87Å; V178-F210 HydrophobicContact CG1-CE2 4.36Å; V178-F210 HydrophobicContact CG1-CZ 3.9Å; V178-F210 HydrophobicContact CG2-CE2 4.07Å; V178-F210 HydrophobicContact CG2-CZ 4.44Å; F210-N212 WeakPolarHBondContact CD1-O 3.49Å; F210-L216 HydrophobicContact CB-CD1 4.48Å; F210-L216 HydrophobicContact CD1-CB 4.49Å; F210-L216 HydrophobicContact CD1-CD1 3.95Å; F210-L216 HydrophobicContact CD2-CD1 3.72Å; F210-L216 HydrophobicContact CE1-CD1 4.12Å; F210-L216 HydrophobicContact CE2-CD1 3.87Å; F210-L216 HydrophobicContact CG-CD1 3.77Å; F210-L216 HydrophobicContact CZ-CD1 4.08Å; F210-V230 HydrophobicContact CE1-CG1 4.49Å; F210-V230 HydrophobicContact CE1-CG2 4.01Å; F210-S251 PolarHBondContact O-OG 3.48Å
211	L	94.7	Very high	95.6	Very high	6 Å²	6	31 Å²	31	3%	0.031	16%	0.159	C	C	.	.	S	Bend	trans	-88.7	-34	174.6	-54.3	-173.5	0	0	0	111.1	K209 V215 A217 F227 L260 L274 L276	K209-L211 PolarHBondContact O-N 2.92Å; L211-V215 HydrophobicContact CB-CB 4.5Å; L211-V215 HydrophobicContact CB-CG1 4.45Å; L211-V215 HydrophobicContact CD1-CG1 4.1Å; L211-V215 HydrophobicContact CG-CG1 4.49Å; L211-V215 PolarHBondContact N-O 3.35Å; L211-A217 HydrophobicContact CD1-CB 4.09Å; L211-A217 HydrophobicContact CD2-CB 3.83Å; L211-A217 HydrophobicContact CG-CB 3.96Å; L211-F227 HydrophobicContact CD1-CD1 4.08Å; L211-F227 HydrophobicContact CD1-CE1 3.91Å; L211-F227 HydrophobicContact CD1-CE2 4.47Å; L211-F227 HydrophobicContact CD1-CG 4.43Å; L211-F227 HydrophobicContact CD1-CZ 4.13Å; L211-L260 HydrophobicContact CD2-CD1 3.61Å; L211-L274 HydrophobicContact CD1-CD2 3.47Å; L211-L274 VanDerWaalsContact CD1-CD2 3.47Å; L211-L276 HydrophobicContact CB-CD2 4.17Å; L211-L276 HydrophobicContact CD1-CD2 4.48Å
212	N	92.1	Very high	95.6	Very high	49 Å²	49	31.8 Å²	31.8	26%	0.262	16%	0.164	S	C	.	.	S	Bend	trans	-148	-165.9	165.3	61.4	29.7	0	0	0	108.1	F210 S214 V215 L276	F210-N212 WeakPolarHBondContact CD1-O 3.49Å; N212-S214 VanDerWaalsContact C-N 3.26Å; N212-S214 PolarHBondContact O-N 2.81Å; N212-S214 PolarHBondContact OD1-N 2.85Å; N212-V215 WeakPolarHBondContact OD1-CB 3.31Å; N212-V215 WeakPolarHBondContact OD1-CG2 3.39Å; N212-V215 PolarHBondContact OD1-N 3.21Å; N212-L276 HydrophobicContact CB-CD1 4.06Å
213	N	92.4	Very high	95.7	Very high	26 Å²	26	31 Å²	31	14%	0.139	15%	0.152	C	C	.	.	S	Bend	trans	-69.8	-20.2	-178.2	-154.2	56.2	0	0	0	114.5	S171 D173 D175	S171-N213 WeakPolarHBondContact CB-OD1 3.24Å; S171-N213 PolarHBondContact OG-OD1 3.36Å; D173-N213 WeakPolarHBondContact CB-OD1 3.39Å; D173-N213 PolarHBondContact N-OD1 2.87Å; D173-N213 VanDerWaalsContact N-OD1 3.1Å; D173-N213 WeakPolarHBondContact OD2-CB 3.43Å; D173-N213 PolarHBondContact OD2-ND2 3.09Å; D175-N213 PolarHBondContact OD1-ND2 3.25Å; D175-N213 PolarHBondContact OD1-OD1 2.84Å
214	S	92.4	Very high	95.8	Very high	31 Å²	31	26.4 Å²	26.4	22%	0.217	13%	0.134	C	C	.	.	S	Bend	trans	-111.2	-24.7	-174	-45.8	0	0	0	0	113.3	N212 D229 V230 E231	N212-S214 VanDerWaalsContact C-N 3.26Å; N212-S214 PolarHBondContact O-N 2.81Å; N212-S214 PolarHBondContact OD1-N 2.85Å; S214-D229 CarbonylContact O-C 3.55Å; S214-D229 WeakPolarHBondContact O-CA 3.39Å; S214-V230 WeakPolarHBondContact O-CB 3.36Å; S214-V230 WeakPolarHBondContact O-CG2 3.42Å; S214-V230 PolarHBondContact O-N 3.4Å; S214-E231 PolarHBondContact OG-OE1 2.78Å
215	V	95.3	Very high	96	Very high	12 Å²	12	20.4 Å²	20.4	7%	0.073	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.2	-173.6	-177	0	0	0	0	110.3	L211 N212 F227 C228 L280	L211-V215 HydrophobicContact CB-CB 4.5Å; L211-V215 HydrophobicContact CB-CG1 4.45Å; L211-V215 HydrophobicContact CD1-CG1 4.1Å; L211-V215 HydrophobicContact CG-CG1 4.49Å; L211-V215 PolarHBondContact N-O 3.35Å; N212-V215 WeakPolarHBondContact OD1-CB 3.31Å; N212-V215 WeakPolarHBondContact OD1-CG2 3.39Å; N212-V215 PolarHBondContact OD1-N 3.21Å; V215-F227 HydrophobicContact CG1-CB 4.17Å; V215-C228 WeakPolarHBondContact CA-O 3.44Å; V215-L280 HydrophobicContact CG1-CD1 4.11Å; V215-L280 HydrophobicContact CG2-CD1 3.88Å
216	L	97	Very high	95.9	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	127.8	177.8	-174.8	78.4	0	0	0	110.2	V178 I185 V208 F210 I218 F227 C228 V230	V178-L216 HydrophobicContact CG1-CD2 4.21Å; V178-L216 HydrophobicContact CG2-CD1 4.49Å; V178-L216 HydrophobicContact CG2-CD2 4.36Å; I185-L216 HydrophobicContact CD1-CD2 4.42Å; I185-L216 HydrophobicContact CG2-CD2 4.26Å; V208-L216 HydrophobicContact CB-CD1 4.23Å; V208-L216 HydrophobicContact CB-CD2 4.37Å; V208-L216 HydrophobicContact CB-CG 4.42Å; F210-L216 HydrophobicContact CB-CD1 4.48Å; F210-L216 HydrophobicContact CD1-CB 4.49Å; F210-L216 HydrophobicContact CD1-CD1 3.95Å; F210-L216 HydrophobicContact CD2-CD1 3.72Å; F210-L216 HydrophobicContact CE1-CD1 4.12Å; F210-L216 HydrophobicContact CE2-CD1 3.87Å; F210-L216 HydrophobicContact CG-CD1 3.77Å; F210-L216 HydrophobicContact CZ-CD1 4.08Å; L216-I218 HydrophobicContact CD2-CD1 4.2Å; L216-I218 HydrophobicContact CD2-CG1 4.02Å; L216-I218 HydrophobicContact CG-CG1 4.21Å; L216-F227 WeakPolarHBondContact O-CA 3.16Å; L216-C228 PolarHBondContact N-O 3.12Å; L216-C228 PolarHBondContact O-N 3.14Å; L216-V230 HydrophobicContact CB-CG2 3.63Å
217	A	97.6	Very high	95.9	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	135.4	168.7	0	0	0	0	0	111.2	V208 K209 L211 F227 V249 L260	V208-A217 CarbonylContact C-O 3.53Å; V208-A217 VanDerWaalsContact CA-O 3.26Å; V208-A217 WeakPolarHBondContact CA-O 3.23Å; K209-A217 PolarHBondContact N-O 3.26Å; K209-A217 PolarHBondContact O-N 3.31Å; L211-A217 HydrophobicContact CD1-CB 4.09Å; L211-A217 HydrophobicContact CD2-CB 3.83Å; L211-A217 HydrophobicContact CG-CB 3.96Å; A217-F227 HydrophobicContact CB-CD1 3.78Å; A217-F227 HydrophobicContact CB-CE1 3.77Å; A217-V249 HydrophobicContact CB-CG1 4.07Å; A217-L260 HydrophobicContact CB-CD1 4.08Å
218	I	97.9	Very high	95.9	Very high	1 Å²	1	19 Å²	19	1%	0.005	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.7	-173.9	-61.1	155.4	0	0	0	108.5	I185 I205 V208 L216 R226 C228 W235	I185-I218 HydrophobicContact CD1-CD1 3.21Å; I185-I218 HydrophobicContact CD1-CG1 3.61Å; I185-I218 HydrophobicContact CD1-CG2 4.14Å; I205-I218 HydrophobicContact CD1-CG2 4.29Å; I205-I218 HydrophobicContact CG1-CG2 3.98Å; I205-I218 HydrophobicContact CG2-CG2 4.13Å; V208-I218 HydrophobicContact CG1-CG1 4.08Å; V208-I218 HydrophobicContact CG1-CG2 4.42Å; L216-I218 HydrophobicContact CD2-CD1 4.2Å; L216-I218 HydrophobicContact CD2-CG1 4.02Å; L216-I218 HydrophobicContact CG-CG1 4.21Å; I218-R226 PolarHBondContact N-O 3.29Å; I218-R226 PolarHBondContact O-N 2.76Å; I218-C228 HydrophobicContact CD1-CB 4.35Å; I218-C228 WeakPolarHBondContact CD1-SG 3.38Å; I218-W235 HydrophobicContact CD1-CH2 3.61Å; I218-W235 HydrophobicContact CD1-CZ3 3.52Å
219	A	97.3	Very high	95.7	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	149.4	177.7	0	0	0	0	0	110.9	S206 S207 V225 V246 V249	S206-A219 PolarHBondContact N-O 2.89Å; S207-A219 PolarHBondContact N-O 2.9Å; S207-A219 PolarHBondContact O-N 2.79Å; A219-V225 HydrophobicContact CB-CG2 4.29Å; A219-V246 HydrophobicContact CB-CB 3.82Å; A219-V246 HydrophobicContact CB-CG1 3.62Å; A219-V249 HydrophobicContact CB-CG2 3.3Å
220	G	95.9	Very high	95.6	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	-154.1	-170.5	0	0	0	0	0	115	R204 D222 R245 V246	R204-G220 CarbonylContact O-C 3.58Å; R204-G220 WeakPolarHBondContact O-CA 3.44Å; G220-D222 PolarHBondContact O-N 2.89Å; G220-R245 WeakPolarHBondContact O-CB 3.33Å; G220-V246 PolarHBondContact N-O 3.21Å; G220-V246 PolarHBondContact O-N 3.3Å; G220-V246 VanDerWaalsContact O-O 3.1Å
221	D	95.1	Very high	95.4	Very high	63 Å²	63	21.7 Å²	21.7	34%	0.337	11%	0.112	S	C	.	.	S	Bend	trans	-75.9	20	179.2	-73.5	-11.9	0	0	0	113.3	R204	R204-D221 HydrophobicContact CB-CB 4.45Å; R204-D221 PolarHBondContact O-N 3.02Å
222	D	94.4	Very high	95.2	Very high	20 Å²	20	28.2 Å²	28.2	11%	0.107	14%	0.14	C	C	.	.	S	Bend	trans	-123.3	171.1	173.3	55.6	12.5	0	0	0	112.9	K203 G220 T224 R226 R245 V246	K203-D222 HydrophobicContact CB-CB 4.46Å; K203-D222 HydrophobicContact CG-CB 4.1Å; G220-D222 PolarHBondContact O-N 2.89Å; D222-T224 PolarHBondContact O-N 3.4Å; D222-T224 PolarHBondContact OD1-OG1 2.84Å; D222-T224 PolarHBondContact OD2-OG1 3.1Å; D222-R226 IonicContact OD1-NH1 3.3Å; D222-R226 IonicContact OD2-CZ 2.73Å; D222-R226 IonicContact OD2-NH1 2.99Å; D222-R226 PolarHBondContact OD2-NH1 3.2Å; D222-R226 IonicContact OD2-NH2 3.91Å; D222-R226 PolarHBondContact OD2-NH2 2.83Å; D222-R226 VanDerWaalsContact OD2-NH2 3.16Å; D222-R245 VanDerWaalsContact O-CA 3.32Å; D222-R245 WeakPolarHBondContact O-CA 3.43Å; D222-V246 PolarHBondContact O-N 3.34Å; D222-V246 VanDerWaalsContact O-N 3.17Å
223	E	96.3	Very high	95.3	Very high	72 Å²	72	27.4 Å²	27.4	34%	0.336	14%	0.14	S	C	.	.	S	Bend	trans	-75.1	-9.1	179.1	44.6	175.1	-144.8	0	0	114.1	K240 A241 H242	E223-K240 HydrophobicContact CB-CG 4.29Å; E223-K240 HydrophobicContact CG-CG 4.41Å; E223-K240 WeakPolarHBondContact OE1-CD 3.44Å; E223-K240 IonicContact OE1-NZ 2.83Å; E223-K240 WeakPolarHBondContact OE2-CE 3.34Å; E223-K240 IonicContact OE2-NZ 2.92Å; E223-K240 PolarHBondContact OE2-NZ 3.26Å; E223-A241 PolarHBondContact O-N 3.44Å; E223-H242 WeakPolarHBondContact CB-O 3.37Å; E223-H242 PolarHBondContact O-N 2.95Å; E223-H242 VanDerWaalsContact O-N 3.1Å
224	T	97.1	Very high	95.3	Very high	22 Å²	22	32.8 Å²	32.8	14%	0.135	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	143.3	-170	53.5	0	0	0	0	112.1	D222 R226 F239	D222-T224 PolarHBondContact O-N 3.4Å; D222-T224 PolarHBondContact OD1-OG1 2.84Å; D222-T224 PolarHBondContact OD2-OG1 3.1Å; T224-R226 PolarHBondContact OG1-NH1 3.3Å; T224-R226 PolarHBondContact OG1-NH2 3.49Å; T224-F239 VanDerWaalsContact CA-O 3.27Å; T224-F239 WeakPolarHBondContact CA-O 3.18Å
225	V	97.5	Very high	95.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	132.8	161.8	176.9	0	0	0	0	108.1	A219 F227 F239 A241 V246 V249 L260 T262	A219-V225 HydrophobicContact CB-CG2 4.29Å; V225-F227 HydrophobicContact CG1-CD1 4.26Å; V225-F227 HydrophobicContact CG1-CE1 3.72Å; V225-F239 HydrophobicContact CB-CD1 4.48Å; V225-F239 HydrophobicContact CB-CE1 3.71Å; V225-F239 HydrophobicContact CB-CZ 3.83Å; V225-F239 HydrophobicContact CG1-CE1 4.01Å; V225-F239 HydrophobicContact CG1-CZ 4.31Å; V225-F239 HydrophobicContact CG2-CZ 4.48Å; V225-F239 PolarHBondContact N-O 3.15Å; V225-F239 WeakPolarHBondContact O-CD1 3.31Å; V225-F239 PolarHBondContact O-N 3.18Å; V225-F239 VanDerWaalsContact O-N 3.15Å; V225-A241 HydrophobicContact CB-CB 4.42Å; V225-A241 HydrophobicContact CG2-CB 3.79Å; V225-V246 HydrophobicContact CG2-CB 4.47Å; V225-V246 HydrophobicContact CG2-CG1 4.11Å; V225-V246 HydrophobicContact CG2-CG2 4.25Å; V225-V249 HydrophobicContact CG2-CG2 4.5Å; V225-L260 HydrophobicContact CG1-CD2 4.18Å; V225-T262 HydrophobicContact CG2-CG2 3.93Å
226	R	96.8	Very high	95.4	Very high	25 Å²	25	38.3 Å²	38.3	9%	0.094	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	143.2	179.9	-57.4	-169.6	178.8	76	11.1	110.5	N201 I218 D222 T224 W235 E238	N201-R226 PolarHBondContact OD1-NH1 3.46Å; I218-R226 PolarHBondContact N-O 3.29Å; I218-R226 PolarHBondContact O-N 2.76Å; D222-R226 IonicContact OD1-NH1 3.3Å; D222-R226 IonicContact OD2-CZ 2.73Å; D222-R226 IonicContact OD2-NH1 2.99Å; D222-R226 PolarHBondContact OD2-NH1 3.2Å; D222-R226 IonicContact OD2-NH2 3.91Å; D222-R226 PolarHBondContact OD2-NH2 2.83Å; D222-R226 VanDerWaalsContact OD2-NH2 3.16Å; T224-R226 PolarHBondContact OG1-NH1 3.3Å; T224-R226 PolarHBondContact OG1-NH2 3.49Å; R226-W235 HydrophobicContact CB-CE3 3.74Å; R226-W235 HydrophobicContact CB-CH2 4.11Å; R226-W235 HydrophobicContact CB-CZ3 3.33Å; R226-W235 HydrophobicContact CG-CZ3 4.3Å; R226-E238 HydrophobicContact CB-CB 4.46Å; R226-E238 HydrophobicContact CG-CB 3.86Å; R226-E238 IonicContact NE-OE2 3.9Å; R226-E238 PolarHBondContact NE-OE2 3.37Å; R226-E238 VanDerWaalsContact NE-OE2 3.09Å
227	F	96.5	Very high	95.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	136.6	173.3	-55.5	-25.6	0	0	0	109.7	L211 V215 L216 A217 V225 V236 C237 F239 L260 L274 L280 P283	L211-F227 HydrophobicContact CD1-CD1 4.08Å; L211-F227 HydrophobicContact CD1-CE1 3.91Å; L211-F227 HydrophobicContact CD1-CE2 4.47Å; L211-F227 HydrophobicContact CD1-CG 4.43Å; L211-F227 HydrophobicContact CD1-CZ 4.13Å; V215-F227 HydrophobicContact CG1-CB 4.17Å; L216-F227 WeakPolarHBondContact O-CA 3.16Å; A217-F227 HydrophobicContact CB-CD1 3.78Å; A217-F227 HydrophobicContact CB-CE1 3.77Å; V225-F227 HydrophobicContact CG1-CD1 4.26Å; V225-F227 HydrophobicContact CG1-CE1 3.72Å; F227-V236 HydrophobicContact CB-CG2 3.74Å; F227-V236 WeakPolarHBondContact O-CG2 3.26Å; F227-V236 PolarHBondContact O-N 3.43Å; F227-C237 HydrophobicContact CB-CB 4.12Å; F227-C237 HydrophobicContact CD2-CB 3.62Å; F227-C237 HydrophobicContact CE2-CB 4.42Å; F227-C237 HydrophobicContact CG-CB 4.23Å; F227-C237 PolarHBondContact N-O 3.19Å; F227-C237 PolarHBondContact O-N 2.77Å; F227-F239 HydrophobicContact CE1-CE1 4.1Å; F227-F239 HydrophobicContact CE2-CE1 4.28Å; F227-F239 HydrophobicContact CZ-CD1 4.49Å; F227-F239 AromaticContact CZ-CE1 3.67Å; F227-F239 HydrophobicContact CZ-CE1 3.67Å; F227-F239 HydrophobicContact CZ-CZ 4.47Å; F227-L260 HydrophobicContact CE1-CD2 3.93Å; F227-L260 HydrophobicContact CZ-CD2 3.87Å; F227-L274 HydrophobicContact CD2-CD2 4.27Å; F227-L274 HydrophobicContact CE2-CD1 3.95Å; F227-L274 HydrophobicContact CE2-CD2 3.56Å; F227-L274 HydrophobicContact CE2-CG 4.38Å; F227-L274 HydrophobicContact CZ-CD2 3.86Å; F227-L280 HydrophobicContact CD2-CD2 4.41Å; F227-P283 HydrophobicContact CE2-CG 3.64Å; F227-P283 HydrophobicContact CZ-CG 3.65Å
228	C	95.4	Very high	95.1	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	144.2	171.6	65.2	0	0	0	0	112.2	I199 V215 L216 I218 K234 W235	I199-C228 HydrophobicContact CD1-CB 3.55Å; I199-C228 WeakPolarHBondContact CD1-SG 3.43Å; V215-C228 WeakPolarHBondContact CA-O 3.44Å; L216-C228 PolarHBondContact N-O 3.12Å; L216-C228 PolarHBondContact O-N 3.14Å; I218-C228 HydrophobicContact CD1-CB 4.35Å; I218-C228 WeakPolarHBondContact CD1-SG 3.38Å; C228-K234 CarbonylContact C-O 3.53Å; C228-K234 VanDerWaalsContact CA-O 3.24Å; C228-K234 WeakPolarHBondContact CA-O 3.45Å; C228-K234 WeakPolarHBondContact CB-O 3.44Å; C228-W235 HydrophobicContact CB-CD2 4.48Å; C228-W235 HydrophobicContact CB-CE3 3.82Å; C228-W235 HydrophobicContact CB-CZ3 4.03Å
229	D	94.8	Very high	95.1	Very high	16 Å²	16	46 Å²	46	9%	0.086	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	114.9	164.8	-179.4	-36.5	0	0	0	108.1	S214 E231 K232 A233 K234 V236	S214-D229 CarbonylContact O-C 3.55Å; S214-D229 WeakPolarHBondContact O-CA 3.39Å; D229-E231 VanDerWaalsContact C-N 3.34Å; D229-E231 WeakPolarHBondContact OD1-CA 3.17Å; D229-E231 WeakPolarHBondContact OD1-CB 3.24Å; D229-E231 PolarHBondContact OD1-N 3.22Å; D229-K232 HydrophobicContact CB-CB 4.37Å; D229-K232 PolarHBondContact OD1-N 3.4Å; D229-K232 WeakPolarHBondContact OD2-CD 3.37Å; D229-K232 WeakPolarHBondContact OD2-CE 3.47Å; D229-K232 IonicContact OD2-NZ 2.77Å; D229-K232 PolarHBondContact OD2-NZ 2.76Å; D229-K232 VanDerWaalsContact OD2-NZ 3.11Å; D229-A233 WeakPolarHBondContact O-CA 3.38Å; D229-A233 PolarHBondContact O-N 3.37Å; D229-K234 PolarHBondContact N-O 3.47Å; D229-K234 PolarHBondContact O-N 3.49Å; D229-K234 VanDerWaalsContact O-N 3.1Å; D229-V236 HydrophobicContact CB-CG1 3.71Å
230	V	94.2	Very high	95	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.012	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-22.9	-176	177.5	0	0	0	0	111.7	I187 F210 S214 L216	I187-V230 HydrophobicContact CB-CG1 4.27Å; I187-V230 HydrophobicContact CD1-CB 4.36Å; I187-V230 HydrophobicContact CD1-CG1 3.85Å; I187-V230 HydrophobicContact CG1-CG1 3.93Å; I187-V230 HydrophobicContact CG2-CG1 3.34Å; F210-V230 HydrophobicContact CE1-CG1 4.49Å; F210-V230 HydrophobicContact CE1-CG2 4.01Å; S214-V230 WeakPolarHBondContact O-CB 3.36Å; S214-V230 WeakPolarHBondContact O-CG2 3.42Å; S214-V230 PolarHBondContact O-N 3.4Å; L216-V230 HydrophobicContact CB-CG2 3.63Å
231	E	91.9	Very high	95.1	Very high	110 Å²	110	50.5 Å²	50.5	51%	0.514	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-42.6	176.3	-65.2	178	-161.6	0	0	111.1	S214 D229	S214-E231 PolarHBondContact OG-OE1 2.78Å; D229-E231 VanDerWaalsContact C-N 3.34Å; D229-E231 WeakPolarHBondContact OD1-CA 3.17Å; D229-E231 WeakPolarHBondContact OD1-CB 3.24Å; D229-E231 PolarHBondContact OD1-N 3.22Å
232	K	91.5	Very high	95.2	Very high	142 Å²	142	47.5 Å²	47.5	62%	0.617	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-12.2	179.3	-61.9	175.4	-166.9	137.4	0	113.1	D229 K234	D229-K232 HydrophobicContact CB-CB 4.37Å; D229-K232 PolarHBondContact OD1-N 3.4Å; D229-K232 WeakPolarHBondContact OD2-CD 3.37Å; D229-K232 WeakPolarHBondContact OD2-CE 3.47Å; D229-K232 IonicContact OD2-NZ 2.77Å; D229-K232 PolarHBondContact OD2-NZ 2.76Å; D229-K232 VanDerWaalsContact OD2-NZ 3.11Å; K232-K234 VanDerWaalsContact C-N 3.3Å; K232-K234 HydrophobicContact CB-CB 4.36Å; K232-K234 HydrophobicContact CB-CD 4.43Å; K232-K234 HydrophobicContact CB-CG 4.38Å; K232-K234 PolarHBondContact O-N 2.83Å
233	A	93.4	Very high	95.2	Very high	33 Å²	33	52.5 Å²	52.5	27%	0.273	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	46.3	-170.9	0	0	0	0	0	112.6	I187 I199 D229	I187-A233 HydrophobicContact CD1-CB 4.25Å; I199-A233 HydrophobicContact CD1-CB 4.49Å; I199-A233 HydrophobicContact CG1-CB 4.13Å; D229-A233 WeakPolarHBondContact O-CA 3.38Å; D229-A233 PolarHBondContact O-N 3.37Å
234	K	93.3	Very high	95.2	Very high	138 Å²	138	51.9 Å²	51.9	60%	0.6	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	145.6	-175.9	-75.3	-178.2	-178.5	-176.9	0	112.1	C228 D229 K232	C228-K234 CarbonylContact C-O 3.53Å; C228-K234 VanDerWaalsContact CA-O 3.24Å; C228-K234 WeakPolarHBondContact CA-O 3.45Å; C228-K234 WeakPolarHBondContact CB-O 3.44Å; D229-K234 PolarHBondContact N-O 3.47Å; D229-K234 PolarHBondContact O-N 3.49Å; D229-K234 VanDerWaalsContact O-N 3.1Å; K232-K234 VanDerWaalsContact C-N 3.3Å; K232-K234 HydrophobicContact CB-CB 4.36Å; K232-K234 HydrophobicContact CB-CD 4.43Å; K232-K234 HydrophobicContact CB-CG 4.38Å; K232-K234 PolarHBondContact O-N 2.83Å
235	W	94.9	Very high	95.2	Very high	103 Å²	103	55 Å²	55	39%	0.39	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	134	168.7	-61.3	114.1	0	0	0	110	I199 T200 N201 I218 R226 C228	I199-W235 HydrophobicContact CG2-CD2 4.39Å; I199-W235 HydrophobicContact CG2-CH2 3.72Å; I199-W235 HydrophobicContact CG2-CZ2 3.27Å; I199-W235 HydrophobicContact CG2-CZ3 4.41Å; T200-W235 WeakPolarHBondContact O-CZ2 3.41Å; N201-W235 HydrophobicContact CB-CH2 4.38Å; N201-W235 HydrophobicContact CB-CZ2 4.46Å; I218-W235 HydrophobicContact CD1-CH2 3.61Å; I218-W235 HydrophobicContact CD1-CZ3 3.52Å; R226-W235 HydrophobicContact CB-CE3 3.74Å; R226-W235 HydrophobicContact CB-CH2 4.11Å; R226-W235 HydrophobicContact CB-CZ3 3.33Å; R226-W235 HydrophobicContact CG-CZ3 4.3Å; C228-W235 HydrophobicContact CB-CD2 4.48Å; C228-W235 HydrophobicContact CB-CE3 3.82Å; C228-W235 HydrophobicContact CB-CZ3 4.03Å
236	V	94.4	Very high	95.2	Very high	56 Å²	56	55 Å²	55	34%	0.339	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	-27.7	-178.6	-68.5	0	0	0	0	112.7	F227 D229 L280	F227-V236 HydrophobicContact CB-CG2 3.74Å; F227-V236 WeakPolarHBondContact O-CG2 3.26Å; F227-V236 PolarHBondContact O-N 3.43Å; D229-V236 HydrophobicContact CB-CG1 3.71Å; V236-L280 HydrophobicContact CB-CD1 4Å; V236-L280 HydrophobicContact CG2-CD1 3.46Å; V236-L280 VanDerWaalsContact CG2-CD1 3.46Å
237	C	94.1	Very high	95.2	Very high	14 Å²	14	55.8 Å²	55.8	10%	0.095	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	147.6	178	-174	0	0	0	0	109.9	F227 L280	F227-C237 HydrophobicContact CB-CB 4.12Å; F227-C237 HydrophobicContact CD2-CB 3.62Å; F227-C237 HydrophobicContact CE2-CB 4.42Å; F227-C237 HydrophobicContact CG-CB 4.23Å; F227-C237 PolarHBondContact N-O 3.19Å; F227-C237 PolarHBondContact O-N 2.77Å; C237-L280 HydrophobicContact CB-CB 4.38Å
238	E	95	Very high	95.2	Very high	126 Å²	126	56 Å²	56	59%	0.589	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.8	146.9	165.6	64.4	175.2	-174.1	0	0	110	R226	R226-E238 HydrophobicContact CB-CB 4.46Å; R226-E238 HydrophobicContact CG-CB 3.86Å; R226-E238 IonicContact NE-OE2 3.9Å; R226-E238 PolarHBondContact NE-OE2 3.37Å; R226-E238 VanDerWaalsContact NE-OE2 3.09Å
239	F	96.6	Very high	95.4	Very high	23 Å²	23	56.4 Å²	56.4	10%	0.101	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	152.4	176.3	69.4	-74.7	0	0	0	110.5	T224 V225 F227 A241 L260 W272 P283	T224-F239 VanDerWaalsContact CA-O 3.27Å; T224-F239 WeakPolarHBondContact CA-O 3.18Å; V225-F239 HydrophobicContact CB-CD1 4.48Å; V225-F239 HydrophobicContact CB-CE1 3.71Å; V225-F239 HydrophobicContact CB-CZ 3.83Å; V225-F239 HydrophobicContact CG1-CE1 4.01Å; V225-F239 HydrophobicContact CG1-CZ 4.31Å; V225-F239 HydrophobicContact CG2-CZ 4.48Å; V225-F239 PolarHBondContact N-O 3.15Å; V225-F239 WeakPolarHBondContact O-CD1 3.31Å; V225-F239 PolarHBondContact O-N 3.18Å; V225-F239 VanDerWaalsContact O-N 3.15Å; F227-F239 HydrophobicContact CE1-CE1 4.1Å; F227-F239 HydrophobicContact CE2-CE1 4.28Å; F227-F239 HydrophobicContact CZ-CD1 4.49Å; F227-F239 AromaticContact CZ-CE1 3.67Å; F227-F239 HydrophobicContact CZ-CE1 3.67Å; F227-F239 HydrophobicContact CZ-CZ 4.47Å; F239-A241 HydrophobicContact CD2-CB 4.28Å; F239-A241 HydrophobicContact CE2-CB 3.7Å; F239-A241 HydrophobicContact CZ-CB 4.24Å; F239-A241 PolarHBondContact O-N 2.89Å; F239-L260 HydrophobicContact CE1-CD2 4.33Å; F239-L260 HydrophobicContact CZ-CD2 3.87Å; F239-W272 HydrophobicContact CD2-CE3 4.35Å; F239-W272 HydrophobicContact CD2-CH2 4.31Å; F239-W272 HydrophobicContact CD2-CZ3 4.14Å; F239-W272 AromaticContact CE2-CD2 3.74Å; F239-W272 HydrophobicContact CE2-CD2 3.74Å; F239-W272 AromaticContact CE2-CE2 3.8Å; F239-W272 AromaticContact CE2-CE3 3.78Å; F239-W272 HydrophobicContact CE2-CE3 3.78Å; F239-W272 HydrophobicContact CE2-CG 4.38Å; F239-W272 AromaticContact CE2-CH2 3.97Å; F239-W272 HydrophobicContact CE2-CH2 3.97Å; F239-W272 AromaticContact CE2-CZ2 3.92Å; F239-W272 HydrophobicContact CE2-CZ2 3.92Å; F239-W272 AromaticContact CE2-CZ3 3.89Å; F239-W272 HydrophobicContact CE2-CZ3 3.89Å; F239-W272 HydrophobicContact CZ-CD2 4.32Å; F239-P283 HydrophobicContact CD1-CG 3.92Å; F239-P283 HydrophobicContact CE1-CG 3.53Å; F239-P283 HydrophobicContact CE2-CG 4.33Å; F239-P283 HydrophobicContact CG-CG 4.5Å; F239-P283 HydrophobicContact CZ-CB 4.33Å; F239-P283 HydrophobicContact CZ-CG 3.75Å
240	K	96.9	Very high	95.5	Very high	94 Å²	94	56.5 Å²	56.5	41%	0.409	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	111.3	172.3	179.5	171.4	171.9	156.5	0	108.9	E223 H242 E243	E223-K240 HydrophobicContact CB-CG 4.29Å; E223-K240 HydrophobicContact CG-CG 4.41Å; E223-K240 WeakPolarHBondContact OE1-CD 3.44Å; E223-K240 IonicContact OE1-NZ 2.83Å; E223-K240 WeakPolarHBondContact OE2-CE 3.34Å; E223-K240 IonicContact OE2-NZ 2.92Å; E223-K240 PolarHBondContact OE2-NZ 3.26Å; K240-H242 WeakPolarHBondContact CE-O 3.32Å; K240-H242 WeakPolarHBondContact CG-O 3.4Å; K240-E243 WeakPolarHBondContact CE-OE1 3.32Å; K240-E243 WeakPolarHBondContact CE-OE2 3.48Å; K240-E243 IonicContact NZ-OE1 3.42Å; K240-E243 PolarHBondContact NZ-OE1 3.46Å; K240-E243 IonicContact NZ-OE2 3.09Å; K240-E243 PolarHBondContact NZ-OE2 3.44Å
241	A	96.3	Very high	95.5	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.008	27%	0.271	C	S	.	.			trans	-91.4	-40.3	-179.3	0	0	0	0	0	111.6	E223 V225 F239 V246 K270 W272	E223-A241 PolarHBondContact O-N 3.44Å; V225-A241 HydrophobicContact CB-CB 4.42Å; V225-A241 HydrophobicContact CG2-CB 3.79Å; F239-A241 HydrophobicContact CD2-CB 4.28Å; F239-A241 HydrophobicContact CE2-CB 3.7Å; F239-A241 HydrophobicContact CZ-CB 4.24Å; F239-A241 PolarHBondContact O-N 2.89Å; A241-V246 HydrophobicContact CB-CG2 4.46Å; A241-K270 VanDerWaalsContact O-CD 3.24Å; A241-K270 WeakPolarHBondContact O-CD 3.49Å; A241-K270 WeakPolarHBondContact O-CE 3.26Å; A241-K270 PolarHBondContact O-NZ 3.03Å; A241-W272 HydrophobicContact CB-CH2 4.47Å; A241-W272 HydrophobicContact CB-CZ2 3.8Å; A241-W272 WeakPolarHBondContact O-CZ2 3.29Å
242	H	97.6	Very high	95.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.251	C	S	.	.			trans	-135.2	177.1	-170	-77.1	-85.4	0	0	0	111.7	E223 K240 T244 V246 T262 S264 D266 Y268	E223-H242 WeakPolarHBondContact CB-O 3.37Å; E223-H242 PolarHBondContact O-N 2.95Å; E223-H242 VanDerWaalsContact O-N 3.1Å; K240-H242 WeakPolarHBondContact CE-O 3.32Å; K240-H242 WeakPolarHBondContact CG-O 3.4Å; H242-T244 WeakPolarHBondContact CB-O 3.48Å; H242-V246 HydrophobicContact CB-CG2 3.97Å; H242-T262 WeakPolarHBondContact NE2-CB 3.11Å; H242-T262 PolarHBondContact NE2-OG1 3.43Å; H242-S264 WeakPolarHBondContact ND1-CB 3.32Å; H242-D266 VanDerWaalsContact CB-OD2 3.25Å; H242-D266 WeakPolarHBondContact CB-OD2 3.34Å; H242-D266 IonicContact CE1-OD1 2.93Å; H242-D266 IonicContact CG-OD2 3.58Å; H242-D266 IonicContact ND1-OD1 3.11Å; H242-D266 PolarHBondContact ND1-OD1 2.81Å; H242-D266 IonicContact ND1-OD2 2.73Å; H242-D266 PolarHBondContact ND1-OD2 2.82Å; H242-Y268 PolarHBondContact CE1-O 3.43Å; H242-Y268 VanDerWaalsContact CE1-O 3.31Å
243	E	95.6	Very high	95.4	Very high	126 Å²	126	51.5 Å²	51.5	59%	0.589	25%	0.25	S	C	*	.	S	Bend	trans	-95.6	-12	173.6	-62.6	-55.5	137.1	0	0	112.5	K240 D266	K240-E243 WeakPolarHBondContact CE-OE1 3.32Å; K240-E243 WeakPolarHBondContact CE-OE2 3.48Å; K240-E243 IonicContact NZ-OE1 3.42Å; K240-E243 PolarHBondContact NZ-OE1 3.46Å; K240-E243 IonicContact NZ-OE2 3.09Å; K240-E243 PolarHBondContact NZ-OE2 3.44Å; E243-D266 PolarHBondContact N-OD2 2.85Å
244	T	96	Very high	95	Very high	58 Å²	58	50.7 Å²	50.7	36%	0.356	24%	0.241	S	C	.	.	S	Bend	trans	-139.8	179.8	176.8	76.5	0	0	0	0	110.5	H242 V246 S264 D266	H242-T244 WeakPolarHBondContact CB-O 3.48Å; T244-V246 PolarHBondContact O-N 3.46Å; T244-S264 PolarHBondContact O-OG 2.82Å; T244-S264 VanDerWaalsContact O-OG 3.13Å; T244-S264 PolarHBondContact OG1-OG 3.26Å; T244-D266 HydrophobicContact CG2-CB 4.19Å; T244-D266 PolarHBondContact OG1-N 2.87Å
245	R	96.3	Very high	94.5	Very high	89 Å²	89	50.6 Å²	50.6	34%	0.336	25%	0.248	S	C	.	.			trans	-46.8	128.7	-177.3	62.2	-178.2	-175.7	-156.1	-9.3	114.2	G220 D222 K247 S264 N265	G220-R245 WeakPolarHBondContact O-CB 3.33Å; D222-R245 VanDerWaalsContact O-CA 3.32Å; D222-R245 WeakPolarHBondContact O-CA 3.43Å; R245-K247 HydrophobicContact CG-CD 4.28Å; R245-K247 PolarHBondContact O-N 2.89Å; R245-S264 WeakPolarHBondContact O-CA 3.35Å; R245-S264 PolarHBondContact O-OG 3.5Å; R245-N265 HydrophobicContact CG-CB 3.78Å; R245-N265 PolarHBondContact NE-ND2 2.91Å; R245-N265 PolarHBondContact NE-OD1 2.9Å; R245-N265 PolarHBondContact NH2-ND2 3.46Å; R245-N265 PolarHBondContact O-N 3.39Å
246	V	97.9	Very high	94	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	110.2	174.8	-173.6	0	0	0	0	109.3	A219 G220 D222 V225 A241 H242 T244 V249	A219-V246 HydrophobicContact CB-CB 3.82Å; A219-V246 HydrophobicContact CB-CG1 3.62Å; G220-V246 PolarHBondContact N-O 3.21Å; G220-V246 PolarHBondContact O-N 3.3Å; G220-V246 VanDerWaalsContact O-O 3.1Å; D222-V246 PolarHBondContact O-N 3.34Å; D222-V246 VanDerWaalsContact O-N 3.17Å; V225-V246 HydrophobicContact CG2-CB 4.47Å; V225-V246 HydrophobicContact CG2-CG1 4.11Å; V225-V246 HydrophobicContact CG2-CG2 4.25Å; A241-V246 HydrophobicContact CB-CG2 4.46Å; H242-V246 HydrophobicContact CB-CG2 3.97Å; T244-V246 PolarHBondContact O-N 3.46Å; V246-V249 HydrophobicContact CG1-CG2 4.18Å
247	K	97.2	Very high	93.7	Very high	40 Å²	40	52.4 Å²	52.4	17%	0.174	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-33.7	-172.9	-75	-56.5	-55	166.8	0	113.8	S206 R245 A263 N265 L295	S206-K247 PolarHBondContact OG-NZ 2.62Å; R245-K247 HydrophobicContact CG-CD 4.28Å; R245-K247 PolarHBondContact O-N 2.89Å; K247-A263 PolarHBondContact N-O 3.04Å; K247-N265 WeakPolarHBondContact CG-OD1 3.15Å; K247-L295 VanDerWaalsContact CG-O 3.32Å; K247-L295 WeakPolarHBondContact CG-O 3.46Å
248	A	97.2	Very high	93.6	Very high	6 Å²	6	51.8 Å²	51.8	5%	0.05	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	143	-176.6	0	0	0	0	0	111.5	A263 L298	A248-A263 HydrophobicContact CB-CB 4.4Å; A248-A263 PolarHBondContact N-O 2.91Å; A248-A263 PolarHBondContact O-N 2.85Å; A248-L298 HydrophobicContact CB-CB 3.57Å
249	V	97.8	Very high	93.6	Very high	7 Å²	7	45.8 Å²	45.8	4%	0.042	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	134.2	173.3	177.5	0	0	0	0	108.1	S207 K209 A217 A219 V225 V246 L260 L261 T262	S207-V249 PolarHBondContact OG-N 2.78Å; S207-V249 VanDerWaalsContact OG-N 3.17Å; K209-V249 HydrophobicContact CB-CB 4.48Å; K209-V249 HydrophobicContact CB-CG1 4.09Å; A217-V249 HydrophobicContact CB-CG1 4.07Å; A219-V249 HydrophobicContact CB-CG2 3.3Å; V225-V249 HydrophobicContact CG2-CG2 4.5Å; V246-V249 HydrophobicContact CG1-CG2 4.18Å; V249-L260 HydrophobicContact CG1-CD1 3.39Å; V249-L260 HydrophobicContact CG1-CG 4.19Å; V249-L261 VanDerWaalsContact CA-O 3.31Å; V249-L261 WeakPolarHBondContact CA-O 3.43Å; V249-T262 HydrophobicContact CG2-CG2 4.36Å
250	D	96.9	Very high	93.6	Very high	18 Å²	18	44.7 Å²	44.7	10%	0.096	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	165.9	168.2	-158	11.1	0	0	0	109.6	K209 L261 L298 A299 V300	K209-D250 WeakPolarHBondContact CE-OD1 3.24Å; K209-D250 IonicContact NZ-OD1 2.71Å; K209-D250 PolarHBondContact NZ-OD1 3.04Å; D250-L261 PolarHBondContact N-O 2.89Å; D250-L261 PolarHBondContact O-N 3.16Å; D250-L298 HydrophobicContact CB-CD2 4.42Å; D250-L298 HydrophobicContact CB-CG 4.45Å; D250-A299 WeakPolarHBondContact OD2-CA 3.34Å; D250-V300 WeakPolarHBondContact OD2-CG1 3.37Å; D250-V300 PolarHBondContact OD2-N 2.76Å
251	S	95	Very high	93.6	Very high	16 Å²	16	40.2 Å²	40.2	11%	0.112	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	150.6	-179.3	62.8	0	0	0	0	111.5	K209 F210 V259	K209-S251 VanDerWaalsContact CE-OG 3.25Å; K209-S251 WeakPolarHBondContact CE-OG 3.21Å; K209-S251 WeakPolarHBondContact CG-OG 3.37Å; F210-S251 PolarHBondContact O-OG 3.48Å; S251-V259 WeakPolarHBondContact CA-O 3.47Å
252	L	91.5	Very high	93.6	Very high	20 Å²	20	40.1 Å²	40.1	11%	0.105	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	151	167.7	67.9	151.9	0	0	0	110.5	L5 V254 V259 L261 V300	L5-L252 HydrophobicContact CD2-CD1 4.2Å; L252-V254 HydrophobicContact CD1-CG2 3.32Å; L252-V254 HydrophobicContact CG-CG2 3.84Å; L252-V259 HydrophobicContact CD2-CB 3.72Å; L252-V259 HydrophobicContact CD2-CG1 3.91Å; L252-V259 HydrophobicContact CG-CB 4.04Å; L252-V259 PolarHBondContact N-O 3.48Å; L252-V259 PolarHBondContact O-N 2.74Å; L252-L261 HydrophobicContact CD2-CD1 3.99Å; L252-L261 HydrophobicContact CD2-CD2 4.4Å; L252-L261 HydrophobicContact CD2-CG 4.12Å; L252-V300 HydrophobicContact CB-CG1 4.23Å; L252-V300 HydrophobicContact CD1-CG2 4.34Å; L252-V300 HydrophobicContact CD2-CB 4.48Å; L252-V300 HydrophobicContact CD2-CG2 3.98Å
253	I	89.5	Confident	93.7	Very high	113 Å²	113	40.1 Å²	40.1	58%	0.579	20%	0.203	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	126.2	169.7	-59.7	172.8	0	0	0	107.3
254	V	84.8	Confident	93.8	Very high	16 Å²	16	34.1 Å²	34.1	10%	0.097	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	113.6	175.7	-178.4	0	0	0	0	107.3	W28 L252 D256 Y257 V259	W28-V254 HydrophobicContact CH2-CG2 4.11Å; L252-V254 HydrophobicContact CD1-CG2 3.32Å; L252-V254 HydrophobicContact CG-CG2 3.84Å; V254-D256 PolarHBondContact O-N 3.11Å; V254-Y257 HydrophobicContact CB-CE2 4.29Å; V254-Y257 PolarHBondContact N-O 3.31Å; V254-Y257 VanDerWaalsContact O-CD1 3.32Å; V254-Y257 WeakPolarHBondContact O-CD1 3.35Å; V254-Y257 WeakPolarHBondContact O-CE1 3.31Å; V254-Y257 PolarHBondContact O-N 3.43Å; V254-Y257 VanDerWaalsContact O-O 3.1Å; V254-V259 HydrophobicContact CB-CG2 4.32Å; V254-V259 HydrophobicContact CG2-CG2 3.98Å
255	D	82.8	Confident	93.8	Very high	137 Å²	137	32.4 Å²	32.4	73%	0.733	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.7	-110.8	-173.4	-50.6	-42	0	0	0	110.8
256	D	84.3	Confident	93.8	Very high	159 Å²	159	30 Å²	30	85%	0.85	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.8	10.2	-175.9	-61.6	-33.7	0	0	0	114.2	V254	V254-D256 PolarHBondContact O-N 3.11Å
257	Y	88.7	Confident	93.7	Very high	37 Å²	37	30 Å²	30	15%	0.145	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	158.4	179.7	63.4	-85.7	0	0	0	113.1	V254 V259 K273	V254-Y257 HydrophobicContact CB-CE2 4.29Å; V254-Y257 PolarHBondContact N-O 3.31Å; V254-Y257 VanDerWaalsContact O-CD1 3.32Å; V254-Y257 WeakPolarHBondContact O-CD1 3.35Å; V254-Y257 WeakPolarHBondContact O-CE1 3.31Å; V254-Y257 PolarHBondContact O-N 3.43Å; V254-Y257 VanDerWaalsContact O-O 3.1Å; Y257-V259 HydrophobicContact CD2-CG2 3.88Å; Y257-V259 HydrophobicContact CE2-CG2 3.49Å; Y257-V259 VanDerWaalsContact CE2-CG2 3.49Å; Y257-K273 HydrophobicContact CD2-CD 4.22Å; Y257-K273 HydrophobicContact CD2-CG 3.69Å; Y257-K273 HydrophobicContact CE2-CD 4.24Å; Y257-K273 HydrophobicContact CE2-CG 4.05Å; Y257-K273 HydrophobicContact CG-CG 4.26Å
258	C	92.5	Very high	93.7	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.007	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	132	175.3	-171.3	0	0	0	0	108.7	L274 L276	C258-L274 HydrophobicContact CB-CB 4.32Å; C258-L274 PolarHBondContact N-O 2.71Å; C258-L274 PolarHBondContact O-N 3.11Å; C258-L274 VanDerWaalsContact O-O 3.13Å; C258-L276 HydrophobicContact CB-CD1 3.83Å; C258-L276 HydrophobicContact CB-CG 4Å
259	V	93.7	Very high	93.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	116	166.4	179	0	0	0	0	107.8	W28 S251 L252 V254 Y257 L261 M271 W272 L286	W28-V259 HydrophobicContact CH2-CB 4.48Å; W28-V259 HydrophobicContact CH2-CG1 4.32Å; W28-V259 HydrophobicContact CH2-CG2 3.74Å; W28-V259 HydrophobicContact CZ2-CG2 4.14Å; W28-V259 HydrophobicContact CZ3-CG1 3.99Å; W28-V259 HydrophobicContact CZ3-CG2 4.25Å; S251-V259 WeakPolarHBondContact CA-O 3.47Å; L252-V259 HydrophobicContact CD2-CB 3.72Å; L252-V259 HydrophobicContact CD2-CG1 3.91Å; L252-V259 HydrophobicContact CG-CB 4.04Å; L252-V259 PolarHBondContact N-O 3.48Å; L252-V259 PolarHBondContact O-N 2.74Å; V254-V259 HydrophobicContact CB-CG2 4.32Å; V254-V259 HydrophobicContact CG2-CG2 3.98Å; Y257-V259 HydrophobicContact CD2-CG2 3.88Å; Y257-V259 HydrophobicContact CE2-CG2 3.49Å; Y257-V259 VanDerWaalsContact CE2-CG2 3.49Å; V259-L261 HydrophobicContact CG1-CD2 4.01Å; V259-M271 HydrophobicContact CG1-CB 4.44Å; V259-W272 CarbonylContact C-O 3.5Å; V259-W272 VanDerWaalsContact CA-O 3.3Å; V259-W272 WeakPolarHBondContact CA-O 3.47Å; V259-L286 HydrophobicContact CG1-CD1 4.32Å; V259-L286 HydrophobicContact CG2-CD1 4.1Å
260	L	96.3	Very high	93.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	133.8	172.4	-174.4	78.7	0	0	0	109	L211 A217 V225 F227 F239 V249 T262 M271 W272	L211-L260 HydrophobicContact CD2-CD1 3.61Å; A217-L260 HydrophobicContact CB-CD1 4.08Å; V225-L260 HydrophobicContact CG1-CD2 4.18Å; F227-L260 HydrophobicContact CE1-CD2 3.93Å; F227-L260 HydrophobicContact CZ-CD2 3.87Å; F239-L260 HydrophobicContact CE1-CD2 4.33Å; F239-L260 HydrophobicContact CZ-CD2 3.87Å; V249-L260 HydrophobicContact CG1-CD1 3.39Å; V249-L260 HydrophobicContact CG1-CG 4.19Å; L260-T262 HydrophobicContact CD2-CG2 3.88Å; L260-T262 HydrophobicContact CG-CG2 4.15Å; L260-M271 CarbonylContact O-C 3.57Å; L260-M271 WeakPolarHBondContact O-CA 3.49Å; L260-W272 HydrophobicContact CB-CB 4.2Å; L260-W272 PolarHBondContact N-O 3.4Å; L260-W272 PolarHBondContact O-N 2.86Å
261	L	97	Very high	93.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	132.3	174	-53.9	174.7	0	0	0	108.9	L7 V249 D250 L252 V259 K270 M271 L298 V300	L7-L261 HydrophobicContact CD2-CD1 3.58Å; L7-L261 HydrophobicContact CD2-CD2 3.68Å; L7-L261 HydrophobicContact CD2-CG 4.25Å; V249-L261 VanDerWaalsContact CA-O 3.31Å; V249-L261 WeakPolarHBondContact CA-O 3.43Å; D250-L261 PolarHBondContact N-O 2.89Å; D250-L261 PolarHBondContact O-N 3.16Å; L252-L261 HydrophobicContact CD2-CD1 3.99Å; L252-L261 HydrophobicContact CD2-CD2 4.4Å; L252-L261 HydrophobicContact CD2-CG 4.12Å; V259-L261 HydrophobicContact CG1-CD2 4.01Å; L261-K270 WeakPolarHBondContact CA-O 3Å; L261-M271 HydrophobicContact CD2-CB 4.14Å; L261-M271 HydrophobicContact CD2-CG 3.42Å; L261-M271 VanDerWaalsContact CD2-CG 3.42Å; L261-L298 HydrophobicContact CB-CD2 3.63Å; L261-V300 HydrophobicContact CD1-CB 3.64Å; L261-V300 HydrophobicContact CD1-CG2 4.03Å
262	T	98.1	Very high	93.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	135.1	179	60	0	0	0	0	109.6	V225 H242 V249 L260 I269 K270 W272	V225-T262 HydrophobicContact CG2-CG2 3.93Å; H242-T262 WeakPolarHBondContact NE2-CB 3.11Å; H242-T262 PolarHBondContact NE2-OG1 3.43Å; V249-T262 HydrophobicContact CG2-CG2 4.36Å; L260-T262 HydrophobicContact CD2-CG2 3.88Å; L260-T262 HydrophobicContact CG-CG2 4.15Å; T262-I269 CarbonylContact O-C 3.46Å; T262-I269 VanDerWaalsContact O-CA 3.29Å; T262-I269 WeakPolarHBondContact O-CA 3.12Å; T262-K270 PolarHBondContact N-O 3.41Å; T262-K270 PolarHBondContact O-N 2.73Å; T262-W272 PolarHBondContact OG1-NE1 2.91Å
263	A	97.9	Very high	93.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	133.2	175.3	0	0	0	0	0	110	K247 A248 L295 L298	K247-A263 PolarHBondContact N-O 3.04Å; A248-A263 HydrophobicContact CB-CB 4.4Å; A248-A263 PolarHBondContact N-O 2.91Å; A248-A263 PolarHBondContact O-N 2.85Å; A263-L295 HydrophobicContact CB-CB 4.06Å; A263-L295 HydrophobicContact CB-CD1 3.79Å; A263-L298 HydrophobicContact CB-CB 3.94Å; A263-L298 HydrophobicContact CB-CD1 4.21Å; A263-L298 HydrophobicContact CB-CD2 3.89Å; A263-L298 HydrophobicContact CB-CG 4.25Å
264	S	97.9	Very high	93.9	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	161.7	-173.3	174.8	0	0	0	0	112.9	H242 T244 R245 D266 G267 Y268 L295	H242-S264 WeakPolarHBondContact ND1-CB 3.32Å; T244-S264 PolarHBondContact O-OG 2.82Å; T244-S264 VanDerWaalsContact O-OG 3.13Å; T244-S264 PolarHBondContact OG1-OG 3.26Å; R245-S264 WeakPolarHBondContact O-CA 3.35Å; R245-S264 PolarHBondContact O-OG 3.5Å; S264-D266 VanDerWaalsContact CB-OD1 3.23Å; S264-D266 WeakPolarHBondContact CB-OD1 3.48Å; S264-D266 PolarHBondContact O-N 2.84Å; S264-D266 VanDerWaalsContact OG-CG 3.31Å; S264-D266 PolarHBondContact OG-N 3.01Å; S264-D266 PolarHBondContact OG-OD1 2.9Å; S264-D266 PolarHBondContact OG-OD2 3.21Å; S264-G267 PolarHBondContact O-N 3Å; S264-Y268 PolarHBondContact N-O 3.39Å; S264-L295 WeakPolarHBondContact O-CB 3.43Å; S264-L295 PolarHBondContact O-N 2.83Å
265	N	96.8	Very high	94.1	Very high	21 Å²	21	30 Å²	30	11%	0.112	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-11.1	170.6	-97.8	82.2	0	0	0	113.6	R245 K247 G267	R245-N265 HydrophobicContact CG-CB 3.78Å; R245-N265 PolarHBondContact NE-ND2 2.91Å; R245-N265 PolarHBondContact NE-OD1 2.9Å; R245-N265 PolarHBondContact NH2-ND2 3.46Å; R245-N265 PolarHBondContact O-N 3.39Å; K247-N265 WeakPolarHBondContact CG-OD1 3.15Å; N265-G267 PolarHBondContact O-N 2.87Å
266	D	96.4	Very high	94.2	Very high	38 Å²	38	26.3 Å²	26.3	20%	0.203	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-7.2	174.3	64.2	13	0	0	0	113.2	H242 E243 T244 S264 Y268	H242-D266 VanDerWaalsContact CB-OD2 3.25Å; H242-D266 WeakPolarHBondContact CB-OD2 3.34Å; H242-D266 IonicContact CE1-OD1 2.93Å; H242-D266 IonicContact CG-OD2 3.58Å; H242-D266 IonicContact ND1-OD1 3.11Å; H242-D266 PolarHBondContact ND1-OD1 2.81Å; H242-D266 IonicContact ND1-OD2 2.73Å; H242-D266 PolarHBondContact ND1-OD2 2.82Å; E243-D266 PolarHBondContact N-OD2 2.85Å; T244-D266 HydrophobicContact CG2-CB 4.19Å; T244-D266 PolarHBondContact OG1-N 2.87Å; S264-D266 VanDerWaalsContact CB-OD1 3.23Å; S264-D266 WeakPolarHBondContact CB-OD1 3.48Å; S264-D266 PolarHBondContact O-N 2.84Å; S264-D266 VanDerWaalsContact OG-CG 3.31Å; S264-D266 PolarHBondContact OG-N 3.01Å; S264-D266 PolarHBondContact OG-OD1 2.9Å; S264-D266 PolarHBondContact OG-OD2 3.21Å; D266-Y268 HydrophobicContact CB-CD2 4.39Å; D266-Y268 WeakPolarHBondContact OD1-CB 3.48Å; D266-Y268 PolarHBondContact OD1-N 3.35Å
267	G	95.6	Very high	94.1	Very high	1 Å²	1	25 Å²	25	1%	0.01	11%	0.113	C	C	.	.	S	Bend	trans	97	-6.6	-179.9	0	0	0	0	0	114.7	S264 N265 T291 A293	S264-G267 PolarHBondContact O-N 3Å; N265-G267 PolarHBondContact O-N 2.87Å; G267-T291 WeakPolarHBondContact O-CB 3.39Å; G267-T291 PolarHBondContact O-N 3.33Å; G267-T291 PolarHBondContact O-OG1 2.7Å; G267-A293 VanDerWaalsContact CA-O 3.25Å; G267-A293 WeakPolarHBondContact CA-O 3.36Å
268	Y	97.6	Very high	93.3	Very high	73 Å²	73	33 Å²	33	29%	0.286	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	141.2	-175.6	-69.3	-98	0	0	0	112.5	H242 S264 D266 E288 V289 N290	H242-Y268 PolarHBondContact CE1-O 3.43Å; H242-Y268 VanDerWaalsContact CE1-O 3.31Å; S264-Y268 PolarHBondContact N-O 3.39Å; D266-Y268 HydrophobicContact CB-CD2 4.39Å; D266-Y268 WeakPolarHBondContact OD1-CB 3.48Å; D266-Y268 PolarHBondContact OD1-N 3.35Å; Y268-E288 HydrophobicContact CD1-CB 4.42Å; Y268-E288 HydrophobicContact CD1-CG 4.4Å; Y268-V289 WeakPolarHBondContact CA-O 3.28Å; Y268-N290 HydrophobicContact CD1-CB 4.03Å; Y268-N290 HydrophobicContact CE1-CB 3.62Å; Y268-N290 HydrophobicContact CE2-CB 4.48Å; Y268-N290 PolarHBondContact OH-ND2 3.09Å; Y268-N290 VanDerWaalsContact OH-ND2 3.16Å
269	I	97.6	Very high	92.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.8	156.5	-51.9	169.8	0	0	0	106.8	L7 A9 Y19 T262 E288 V289 T291 L295 L298	L7-I269 HydrophobicContact CD1-CG2 3.95Å; A9-I269 HydrophobicContact CB-CD1 3.61Å; A9-I269 HydrophobicContact CB-CG1 4.37Å; Y19-I269 HydrophobicContact CD2-CD1 4.24Å; Y19-I269 HydrophobicContact CE2-CD1 4.43Å; T262-I269 CarbonylContact O-C 3.46Å; T262-I269 VanDerWaalsContact O-CA 3.29Å; T262-I269 WeakPolarHBondContact O-CA 3.12Å; I269-E288 CarbonylContact O-C 3.51Å; I269-E288 VanDerWaalsContact O-CA 3.29Å; I269-E288 WeakPolarHBondContact O-CA 3.33Å; I269-V289 HydrophobicContact CB-CG1 3.79Å; I269-V289 HydrophobicContact CD1-CG1 4.27Å; I269-V289 HydrophobicContact CG1-CG1 4.34Å; I269-V289 PolarHBondContact N-O 2.76Å; I269-V289 PolarHBondContact O-N 2.84Å; I269-T291 HydrophobicContact CD1-CG2 4.02Å; I269-T291 HydrophobicContact CG1-CG2 4.19Å; I269-L295 HydrophobicContact CD1-CD1 4.15Å; I269-L295 HydrophobicContact CG1-CD1 3.35Å; I269-L298 HydrophobicContact CD1-CD1 4.38Å; I269-L298 HydrophobicContact CG2-CD1 4.02Å
270	K	96.9	Very high	92.2	Very high	26 Å²	26	42.5 Å²	42.5	11%	0.113	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	145.2	178.6	-62.3	-174.4	179.5	-171.5	0	111	A241 L261 T262 W272 L285 E288	A241-K270 VanDerWaalsContact O-CD 3.24Å; A241-K270 WeakPolarHBondContact O-CD 3.49Å; A241-K270 WeakPolarHBondContact O-CE 3.26Å; A241-K270 PolarHBondContact O-NZ 3.03Å; L261-K270 WeakPolarHBondContact CA-O 3Å; T262-K270 PolarHBondContact N-O 3.41Å; T262-K270 PolarHBondContact O-N 2.73Å; K270-W272 HydrophobicContact CB-CZ2 3.86Å; K270-W272 HydrophobicContact CD-CH2 4.17Å; K270-W272 HydrophobicContact CD-CZ2 3.53Å; K270-W272 HydrophobicContact CG-CZ2 4.35Å; K270-L285 HydrophobicContact CB-CD1 3.93Å; K270-L285 HydrophobicContact CD-CD1 4.21Å; K270-L285 HydrophobicContact CG-CD1 4.31Å; K270-E288 HydrophobicContact CB-CB 4.49Å; K270-E288 WeakPolarHBondContact CE-OE2 3.36Å; K270-E288 HydrophobicContact CG-CB 3.78Å; K270-E288 IonicContact NZ-OE2 3.38Å
271	M	95.7	Very high	91.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127	179.1	-66.7	158.8	-69.5	0	0	108.8	L7 V21 W28 A30 V259 L260 L261 L286 G287	L7-M271 HydrophobicContact CD1-CE 4.49Å; L7-M271 HydrophobicContact CD1-CG 4.28Å; L7-M271 HydrophobicContact CD1-SD 3.86Å; V21-M271 HydrophobicContact CG1-SD 3.91Å; V21-M271 HydrophobicContact CG2-SD 3.78Å; W28-M271 HydrophobicContact CB-CE 4.38Å; W28-M271 HydrophobicContact CB-SD 4.35Å; W28-M271 HydrophobicContact CE3-SD 3.83Å; A30-M271 HydrophobicContact CB-CE 4.28Å; V259-M271 HydrophobicContact CG1-CB 4.44Å; L260-M271 CarbonylContact O-C 3.57Å; L260-M271 WeakPolarHBondContact O-CA 3.49Å; L261-M271 HydrophobicContact CD2-CB 4.14Å; L261-M271 HydrophobicContact CD2-CG 3.42Å; L261-M271 VanDerWaalsContact CD2-CG 3.42Å; M271-L286 HydrophobicContact CB-CB 4.22Å; M271-L286 PolarHBondContact O-N 2.98Å; M271-G287 WeakPolarHBondContact CE-O 3.46Å; M271-G287 PolarHBondContact N-O 2.96Å
272	W	95.4	Very high	91.4	Very high	18 Å²	18	52.5 Å²	52.5	7%	0.068	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.6	-176	-44.2	80.8	0	0	0	111	F239 A241 V259 L260 T262 K270 P283 V284 L285	F239-W272 HydrophobicContact CD2-CE3 4.35Å; F239-W272 HydrophobicContact CD2-CH2 4.31Å; F239-W272 HydrophobicContact CD2-CZ3 4.14Å; F239-W272 AromaticContact CE2-CD2 3.74Å; F239-W272 HydrophobicContact CE2-CD2 3.74Å; F239-W272 AromaticContact CE2-CE2 3.8Å; F239-W272 AromaticContact CE2-CE3 3.78Å; F239-W272 HydrophobicContact CE2-CE3 3.78Å; F239-W272 HydrophobicContact CE2-CG 4.38Å; F239-W272 AromaticContact CE2-CH2 3.97Å; F239-W272 HydrophobicContact CE2-CH2 3.97Å; F239-W272 AromaticContact CE2-CZ2 3.92Å; F239-W272 HydrophobicContact CE2-CZ2 3.92Å; F239-W272 AromaticContact CE2-CZ3 3.89Å; F239-W272 HydrophobicContact CE2-CZ3 3.89Å; F239-W272 HydrophobicContact CZ-CD2 4.32Å; A241-W272 HydrophobicContact CB-CH2 4.47Å; A241-W272 HydrophobicContact CB-CZ2 3.8Å; A241-W272 WeakPolarHBondContact O-CZ2 3.29Å; V259-W272 CarbonylContact C-O 3.5Å; V259-W272 VanDerWaalsContact CA-O 3.3Å; V259-W272 WeakPolarHBondContact CA-O 3.47Å; L260-W272 HydrophobicContact CB-CB 4.2Å; L260-W272 PolarHBondContact N-O 3.4Å; L260-W272 PolarHBondContact O-N 2.86Å; T262-W272 PolarHBondContact OG1-NE1 2.91Å; K270-W272 HydrophobicContact CB-CZ2 3.86Å; K270-W272 HydrophobicContact CD-CH2 4.17Å; K270-W272 HydrophobicContact CD-CZ2 3.53Å; K270-W272 HydrophobicContact CG-CZ2 4.35Å; W272-P283 HydrophobicContact CB-CB 3.55Å; W272-P283 HydrophobicContact CE3-CB 4.36Å; W272-P283 HydrophobicContact CG-CB 4.3Å; W272-V284 CarbonylContact C-O 3.6Å; W272-V284 WeakPolarHBondContact CA-O 3.41Å; W272-L285 HydrophobicContact CD2-CD1 4.07Å; W272-L285 HydrophobicContact CE3-CB 3.96Å; W272-L285 HydrophobicContact CE3-CD1 4.03Å; W272-L285 HydrophobicContact CH2-CD1 4.04Å; W272-L285 HydrophobicContact CZ2-CD1 4.08Å; W272-L285 HydrophobicContact CZ3-CB 3.89Å; W272-L285 HydrophobicContact CZ3-CD1 4.02Å; W272-L285 HydrophobicContact CZ3-CG 4.5Å
273	K	93.3	Very high	91.2	Very high	46 Å²	46	53.1 Å²	53.1	20%	0.2	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	126.7	171.7	-175.1	167.5	-178.1	179.9	0	109.8	Y257 H275 P283 V284 L286	Y257-K273 HydrophobicContact CD2-CD 4.22Å; Y257-K273 HydrophobicContact CD2-CG 3.69Å; Y257-K273 HydrophobicContact CE2-CD 4.24Å; Y257-K273 HydrophobicContact CE2-CG 4.05Å; Y257-K273 HydrophobicContact CG-CG 4.26Å; K273-H275 VanDerWaalsContact CE-NE2 3.28Å; K273-H275 WeakPolarHBondContact CE-NE2 3.41Å; K273-P283 CarbonylContact O-C 3.54Å; K273-P283 VanDerWaalsContact O-CA 3.25Å; K273-P283 WeakPolarHBondContact O-CA 3.3Å; K273-V284 HydrophobicContact CB-CB 4.49Å; K273-V284 PolarHBondContact N-O 3.19Å; K273-V284 PolarHBondContact O-N 3.03Å; K273-L286 HydrophobicContact CB-CD1 3.82Å; K273-L286 HydrophobicContact CB-CD2 3.82Å; K273-L286 HydrophobicContact CB-CG 3.71Å; K273-L286 HydrophobicContact CD-CD2 4.15Å
274	L	92.8	Very high	91	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	127.1	178	178.8	63.5	0	0	0	110.5	L211 F227 C258 L276 L280 E281 P283	L211-L274 HydrophobicContact CD1-CD2 3.47Å; L211-L274 VanDerWaalsContact CD1-CD2 3.47Å; F227-L274 HydrophobicContact CD2-CD2 4.27Å; F227-L274 HydrophobicContact CE2-CD1 3.95Å; F227-L274 HydrophobicContact CE2-CD2 3.56Å; F227-L274 HydrophobicContact CE2-CG 4.38Å; F227-L274 HydrophobicContact CZ-CD2 3.86Å; C258-L274 HydrophobicContact CB-CB 4.32Å; C258-L274 PolarHBondContact N-O 2.71Å; C258-L274 PolarHBondContact O-N 3.11Å; C258-L274 VanDerWaalsContact O-O 3.13Å; L274-L276 HydrophobicContact CD2-CD2 3.81Å; L274-L276 HydrophobicContact CG-CD2 4.19Å; L274-L280 HydrophobicContact CD1-CD2 3.76Å; L274-L280 HydrophobicContact CD2-CD2 4.2Å; L274-L280 HydrophobicContact CG-CD2 4.23Å; L274-E281 WeakPolarHBondContact CD1-O 3.23Å; L274-P283 HydrophobicContact CD1-CG 4.11Å
275	H	89.6	Confident	90.8	Very high	72 Å²	72	61.3 Å²	61.3	33%	0.333	30%	0.302	S	S	.	.			trans	-94.3	117.7	169.8	-70.3	-72	0	0	0	109.7	K273 K277	K273-H275 VanDerWaalsContact CE-NE2 3.28Å; K273-H275 WeakPolarHBondContact CE-NE2 3.41Å; H275-K277 HydrophobicContact CB-CG 4.3Å; H275-K277 PolarHBondContact O-N 2.87Å
276	L	84.3	Confident	90.6	Very high	59 Å²	59	61.1 Å²	61.1	31%	0.309	30%	0.301	S	S	.	.			trans	-82.3	70.1	177.9	-61.9	171.9	0	0	0	109.7	L211 N212 C258 L274 L280	L211-L276 HydrophobicContact CB-CD2 4.17Å; L211-L276 HydrophobicContact CD1-CD2 4.48Å; N212-L276 HydrophobicContact CB-CD1 4.06Å; C258-L276 HydrophobicContact CB-CD1 3.83Å; C258-L276 HydrophobicContact CB-CG 4Å; L274-L276 HydrophobicContact CD2-CD2 3.81Å; L274-L276 HydrophobicContact CG-CD2 4.19Å; L276-L280 HydrophobicContact CD2-CD2 4.04Å
277	K	81.4	Confident	90.4	Very high	131 Å²	131	60 Å²	60	57%	0.57	30%	0.297	S	S	*	.			trans	-91.9	175.5	172.4	-65.2	178.4	-176.7	172.9	0	110.5	H275 E279	H275-K277 HydrophobicContact CB-CG 4.3Å; H275-K277 PolarHBondContact O-N 2.87Å; K277-E279 VanDerWaalsContact C-N 3.28Å; K277-E279 PolarHBondContact O-N 3.46Å
278	E	73.2	Confident	90.4	Very high	205 Å²	205	64.2 Å²	64.2	96%	0.958	32%	0.317	S	S	*	.	S	Bend	trans	-58.4	-39.3	176.3	-69.2	-172.5	165.6	0	0	112.5
279	E	78.1	Confident	90.4	Very high	171 Å²	171	61.6 Å²	61.6	80%	0.799	31%	0.309	S	S	*	.	S	Bend	trans	-103.2	120.6	167.9	-68.3	-173.6	173.2	0	0	109.6	K277 E281	K277-E279 VanDerWaalsContact C-N 3.28Å; K277-E279 PolarHBondContact O-N 3.46Å; E279-E281 PolarHBondContact O-N 2.96Å
280	L	85.1	Confident	90.3	Very high	30 Å²	30	65 Å²	65	16%	0.157	33%	0.327	C	S	.	.			trans	-84	111.3	-178.9	-87.4	146.7	0	0	0	110.4	V215 F227 V236 C237 L274 L276	V215-L280 HydrophobicContact CG1-CD1 4.11Å; V215-L280 HydrophobicContact CG2-CD1 3.88Å; F227-L280 HydrophobicContact CD2-CD2 4.41Å; V236-L280 HydrophobicContact CB-CD1 4Å; V236-L280 HydrophobicContact CG2-CD1 3.46Å; V236-L280 VanDerWaalsContact CG2-CD1 3.46Å; C237-L280 HydrophobicContact CB-CB 4.38Å; L274-L280 HydrophobicContact CD1-CD2 3.76Å; L274-L280 HydrophobicContact CD2-CD2 4.2Å; L274-L280 HydrophobicContact CG-CD2 4.23Å; L276-L280 HydrophobicContact CD2-CD2 4.04Å
281	E	86.6	Confident	90.2	Very high	122 Å²	122	64 Å²	64	57%	0.57	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-77.7	152	168.5	-68.1	172.4	-169.1	0	0	110.8	L274 E279	L274-E281 WeakPolarHBondContact CD1-O 3.23Å; E279-E281 PolarHBondContact O-N 2.96Å
282	P	89.5	Confident	90	Very high	87 Å²	87	70.1 Å²	70.1	57%	0.565	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-55.5	138.8	172.4	-25.4	34.8	0	0	0	112.1
283	P	93.4	Very high	90	Very high	13 Å²	13	69.6 Å²	69.6	8%	0.084	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-61.1	144.7	177.7	-21.4	31.3	0	0	0	113.1	F227 F239 W272 K273 L274	F227-P283 HydrophobicContact CE2-CG 3.64Å; F227-P283 HydrophobicContact CZ-CG 3.65Å; F239-P283 HydrophobicContact CD1-CG 3.92Å; F239-P283 HydrophobicContact CE1-CG 3.53Å; F239-P283 HydrophobicContact CE2-CG 4.33Å; F239-P283 HydrophobicContact CG-CG 4.5Å; F239-P283 HydrophobicContact CZ-CB 4.33Å; F239-P283 HydrophobicContact CZ-CG 3.75Å; W272-P283 HydrophobicContact CB-CB 3.55Å; W272-P283 HydrophobicContact CE3-CB 4.36Å; W272-P283 HydrophobicContact CG-CB 4.3Å; K273-P283 CarbonylContact O-C 3.54Å; K273-P283 VanDerWaalsContact O-CA 3.25Å; K273-P283 WeakPolarHBondContact O-CA 3.3Å; L274-P283 HydrophobicContact CD1-CG 4.11Å
284	V	93.6	Very high	90.2	Very high	97 Å²	97	73.5 Å²	73.5	59%	0.588	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.6	175.6	-179.6	0	0	0	0	109.5	W272 K273 L286	W272-V284 CarbonylContact C-O 3.6Å; W272-V284 WeakPolarHBondContact CA-O 3.41Å; K273-V284 HydrophobicContact CB-CB 4.49Å; K273-V284 PolarHBondContact N-O 3.19Å; K273-V284 PolarHBondContact O-N 3.03Å; V284-L286 PolarHBondContact O-N 2.88Å
285	L	94.9	Very high	90.4	Very high	76 Å²	76	73.4 Å²	73.4	40%	0.398	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	123	177.3	-174.4	68.5	0	0	0	110.3	K270 W272	K270-L285 HydrophobicContact CB-CD1 3.93Å; K270-L285 HydrophobicContact CD-CD1 4.21Å; K270-L285 HydrophobicContact CG-CD1 4.31Å; W272-L285 HydrophobicContact CD2-CD1 4.07Å; W272-L285 HydrophobicContact CE3-CB 3.96Å; W272-L285 HydrophobicContact CE3-CD1 4.03Å; W272-L285 HydrophobicContact CH2-CD1 4.04Å; W272-L285 HydrophobicContact CZ2-CD1 4.08Å; W272-L285 HydrophobicContact CZ3-CB 3.89Å; W272-L285 HydrophobicContact CZ3-CD1 4.02Å; W272-L285 HydrophobicContact CZ3-CG 4.5Å
286	L	92.8	Very high	90.7	Very high	17 Å²	17	70.8 Å²	70.8	9%	0.089	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-31.6	175.7	-71.3	174.7	0	0	0	112.5	W28 V259 M271 K273 V284	W28-L286 HydrophobicContact CB-CB 4.05Å; W28-L286 HydrophobicContact CD2-CB 4.38Å; W28-L286 HydrophobicContact CD2-CD1 3.96Å; W28-L286 HydrophobicContact CE3-CD1 4.37Å; W28-L286 HydrophobicContact CG-CB 3.93Å; W28-L286 HydrophobicContact CG-CD1 4.26Å; W28-L286 HydrophobicContact CZ2-CD1 4.32Å; W28-L286 PolarHBondContact N-O 2.68Å; W28-L286 VanDerWaalsContact N-O 3.16Å; V259-L286 HydrophobicContact CG1-CD1 4.32Å; V259-L286 HydrophobicContact CG2-CD1 4.1Å; M271-L286 HydrophobicContact CB-CB 4.22Å; M271-L286 PolarHBondContact O-N 2.98Å; K273-L286 HydrophobicContact CB-CD1 3.82Å; K273-L286 HydrophobicContact CB-CD2 3.82Å; K273-L286 HydrophobicContact CB-CG 3.71Å; K273-L286 HydrophobicContact CD-CD2 4.15Å; V284-L286 PolarHBondContact O-N 2.88Å
287	G	92.1	Very high	91.3	Very high	13 Å²	13	68.5 Å²	68.5	13%	0.134	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173	166.1	-179.2	0	0	0	0	0	111.7	M271	M271-G287 WeakPolarHBondContact CE-O 3.46Å; M271-G287 PolarHBondContact N-O 2.96Å
288	E	95.1	Very high	92.1	Very high	91 Å²	91	63 Å²	63	43%	0.425	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	158.6	179.4	64.2	179.3	-152.4	0	0	111.2	Y268 I269 K270	Y268-E288 HydrophobicContact CD1-CB 4.42Å; Y268-E288 HydrophobicContact CD1-CG 4.4Å; I269-E288 CarbonylContact O-C 3.51Å; I269-E288 VanDerWaalsContact O-CA 3.29Å; I269-E288 WeakPolarHBondContact O-CA 3.33Å; K270-E288 HydrophobicContact CB-CB 4.49Å; K270-E288 WeakPolarHBondContact CE-OE2 3.36Å; K270-E288 HydrophobicContact CG-CB 3.78Å; K270-E288 IonicContact NZ-OE2 3.38Å
289	V	96.3	Very high	93.2	Very high	18 Å²	18	53.5 Å²	53.5	11%	0.109	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	132.3	174.2	61.3	0	0	0	0	110.6	Y19 A30 Y268 I269	Y19-V289 HydrophobicContact CD1-CG1 4.42Å; Y19-V289 HydrophobicContact CD1-CG2 3.63Å; Y19-V289 HydrophobicContact CD2-CG1 4.32Å; Y19-V289 HydrophobicContact CE1-CG2 3.33Å; Y19-V289 HydrophobicContact CE2-CG1 4.48Å; Y19-V289 HydrophobicContact CE2-CG2 4.39Å; Y19-V289 HydrophobicContact CG-CG1 4.28Å; Y19-V289 HydrophobicContact CG-CG2 4.29Å; A30-V289 HydrophobicContact CB-CB 3.92Å; A30-V289 HydrophobicContact CB-CG1 4.05Å; A30-V289 HydrophobicContact CB-CG2 4.39Å; Y268-V289 WeakPolarHBondContact CA-O 3.28Å; I269-V289 HydrophobicContact CB-CG1 3.79Å; I269-V289 HydrophobicContact CD1-CG1 4.27Å; I269-V289 HydrophobicContact CG1-CG1 4.34Å; I269-V289 PolarHBondContact N-O 2.76Å; I269-V289 PolarHBondContact O-N 2.84Å
290	N	96.1	Very high	94	Very high	71 Å²	71	46.7 Å²	46.7	38%	0.38	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	119.7	176.1	-169.5	-14	0	0	0	109.8	Y268 T292	Y268-N290 HydrophobicContact CD1-CB 4.03Å; Y268-N290 HydrophobicContact CE1-CB 3.62Å; Y268-N290 HydrophobicContact CE2-CB 4.48Å; Y268-N290 PolarHBondContact OH-ND2 3.09Å; Y268-N290 VanDerWaalsContact OH-ND2 3.16Å; N290-T292 WeakPolarHBondContact OD1-CA 3.42Å; N290-T292 PolarHBondContact OD1-N 3.38Å
291	T	94.2	Very high	94.4	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.031	25%	0.249	C	C	.	.			trans	-92.7	-12.5	177.2	69.2	0	0	0	0	112.8	F17 Y19 G267 I269 A293 L295	F17-T291 HydrophobicContact CD2-CG2 4.5Å; Y19-T291 HydrophobicContact CE2-CG2 3.65Å; G267-T291 WeakPolarHBondContact O-CB 3.39Å; G267-T291 PolarHBondContact O-N 3.33Å; G267-T291 PolarHBondContact O-OG1 2.7Å; I269-T291 HydrophobicContact CD1-CG2 4.02Å; I269-T291 HydrophobicContact CG1-CG2 4.19Å; T291-A293 PolarHBondContact O-N 2.84Å; T291-A293 PolarHBondContact OG1-N 3.04Å; T291-A293 PolarHBondContact OG1-O 2.98Å; T291-L295 HydrophobicContact CG2-CD1 4.25Å; T291-L295 HydrophobicContact CG2-CD2 4.13Å; T291-L295 WeakPolarHBondContact OG1-CD2 3.12Å
292	T	92.9	Very high	94.4	Very high	129 Å²	129	48.5 Å²	48.5	79%	0.791	25%	0.253	S	S	*	.	S	Bend	trans	60.7	-0.8	-170.9	70.8	0	0	0	0	115.5	N290	N290-T292 WeakPolarHBondContact OD1-CA 3.42Å; N290-T292 PolarHBondContact OD1-N 3.38Å
293	A	95.3	Very high	93.8	Very high	7 Å²	7	47.2 Å²	47.2	6%	0.058	25%	0.245	C	C	.	.	S	Bend	trans	-110.9	151.4	-176	0	0	0	0	0	111.5	E13 F17 G267 T291 L295	E13-A293 HydrophobicContact CB-CB 4.47Å; E13-A293 HydrophobicContact CG-CB 4.39Å; F17-A293 HydrophobicContact CE2-CB 3.59Å; F17-A293 HydrophobicContact CZ-CB 3.64Å; G267-A293 VanDerWaalsContact CA-O 3.25Å; G267-A293 WeakPolarHBondContact CA-O 3.36Å; T291-A293 PolarHBondContact O-N 2.84Å; T291-A293 PolarHBondContact OG1-N 3.04Å; T291-A293 PolarHBondContact OG1-O 2.98Å; A293-L295 PolarHBondContact O-N 2.86Å; A293-L295 VanDerWaalsContact O-N 3.12Å
294	R	96.6	Very high	92.6	Very high	127 Å²	127	49.2 Å²	49.2	48%	0.479	26%	0.259	S	S	.	.			trans	-79.3	103.2	179.8	-68	174	-62.7	167.7	3.5	109.2	S11 Y12 E13	S11-R294 WeakPolarHBondContact CA-O 3.2Å; Y12-R294 HydrophobicContact CD2-CB 3.83Å; Y12-R294 WeakPolarHBondContact CD2-O 3.43Å; Y12-R294 PolarHBondContact N-O 3.34Å; E13-R294 IonicContact OE1-CZ 3.4Å; E13-R294 VanDerWaalsContact OE1-CZ 3.27Å; E13-R294 IonicContact OE1-NE 3.16Å; E13-R294 PolarHBondContact OE1-NE 3.16Å; E13-R294 IonicContact OE1-NH2 3.91Å; E13-R294 PolarHBondContact OE1-NH2 3.45Å; E13-R294 PolarHBondContact OE2-N 3.05Å
295	L	97.5	Very high	90.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	145.3	-174.4	-54.1	179.9	0	0	0	112.2	A9 G10 F17 K247 A263 S264 I269 T291 A293	A9-L295 HydrophobicContact CB-CD1 4.37Å; A9-L295 HydrophobicContact CB-CD2 4.01Å; G10-L295 WeakPolarHBondContact O-CA 3.03Å; F17-L295 HydrophobicContact CD2-CD2 4.27Å; F17-L295 HydrophobicContact CE2-CD2 4.38Å; K247-L295 VanDerWaalsContact CG-O 3.32Å; K247-L295 WeakPolarHBondContact CG-O 3.46Å; A263-L295 HydrophobicContact CB-CB 4.06Å; A263-L295 HydrophobicContact CB-CD1 3.79Å; S264-L295 WeakPolarHBondContact O-CB 3.43Å; S264-L295 PolarHBondContact O-N 2.83Å; I269-L295 HydrophobicContact CD1-CD1 4.15Å; I269-L295 HydrophobicContact CG1-CD1 3.35Å; T291-L295 HydrophobicContact CG2-CD1 4.25Å; T291-L295 HydrophobicContact CG2-CD2 4.13Å; T291-L295 WeakPolarHBondContact OG1-CD2 3.12Å; A293-L295 PolarHBondContact O-N 2.86Å; A293-L295 VanDerWaalsContact O-N 3.12Å
296	T	97.1	Very high	87.7	Confident	18 Å²	18	52.8 Å²	52.8	11%	0.11	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	-36.2	-174.9	50.2	0	0	0	0	113.2	G10 S11 Y12 V43	G10-T296 VanDerWaalsContact C-OG1 3.24Å; G10-T296 PolarHBondContact O-N 2.87Å; G10-T296 PolarHBondContact O-OG1 2.86Å; G10-T296 VanDerWaalsContact O-OG1 3.12Å; S11-T296 PolarHBondContact N-OG1 2.87Å; Y12-T296 HydrophobicContact CD1-CG2 3.99Å; Y12-T296 HydrophobicContact CD2-CG2 3.39Å; Y12-T296 HydrophobicContact CE1-CG2 4.03Å; Y12-T296 HydrophobicContact CE2-CG2 3.45Å; Y12-T296 VanDerWaalsContact CE2-CG2 3.45Å; Y12-T296 HydrophobicContact CG-CG2 3.68Å; V43-T296 VanDerWaalsContact O-CB 3.29Å; V43-T296 WeakPolarHBondContact O-CB 3.33Å; V43-T296 PolarHBondContact O-OG1 2.79Å
297	C	96.8	Very high	84.7	Confident	11 Å²	11	60.3 Å²	60.3	7%	0.074	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	155.8	-176.7	63.4	0	0	0	0	110.2	A9 G10 V46	A9-C297 VanDerWaalsContact CA-O 3.3Å; A9-C297 WeakPolarHBondContact CA-O 3.41Å; G10-C297 PolarHBondContact N-O 2.89Å; V46-C297 HydrophobicContact CG1-CB 3.84Å
298	L	97.7	Very high	81.8	Confident	16 Å²	16	65 Å²	65	8%	0.084	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	139.2	-174.5	-177.9	68.2	0	0	0	109.8	I8 A9 A248 D250 L261 A263 I269	I8-L298 CarbonylContact O-C 3.58Å; I8-L298 WeakPolarHBondContact O-CA 3.48Å; A9-L298 HydrophobicContact CB-CD1 4.19Å; A248-L298 HydrophobicContact CB-CB 3.57Å; D250-L298 HydrophobicContact CB-CD2 4.42Å; D250-L298 HydrophobicContact CB-CG 4.45Å; L261-L298 HydrophobicContact CB-CD2 3.63Å; A263-L298 HydrophobicContact CB-CB 3.94Å; A263-L298 HydrophobicContact CB-CD1 4.21Å; A263-L298 HydrophobicContact CB-CD2 3.89Å; A263-L298 HydrophobicContact CB-CG 4.25Å; I269-L298 HydrophobicContact CD1-CD1 4.38Å; I269-L298 HydrophobicContact CG2-CD1 4.02Å
299	A	96.3	Very high	78.8	Confident	5 Å²	5	67.7 Å²	67.7	4%	0.041	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	146.7	168	0	0	0	0	0	110.5	I8 V46 A48 D250	I8-A299 PolarHBondContact N-O 2.9Å; I8-A299 PolarHBondContact O-N 3.33Å; V46-A299 HydrophobicContact CB-CB 4.44Å; V46-A299 HydrophobicContact CG1-CB 3.77Å; V46-A299 HydrophobicContact CG2-CB 3.91Å; A48-A299 HydrophobicContact CB-CB 4.23Å; D250-A299 WeakPolarHBondContact OD2-CA 3.34Å
300	V	94.8	Very high	75.6	Confident	27 Å²	27	72.3 Å²	72.3	16%	0.164	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	135.3	165.1	67.8	0	0	0	0	110.9	L5 A48 D250 L252 L261	L5-V300 HydrophobicContact CD1-CG2 4.5Å; A48-V300 WeakPolarHBondContact CB-O 3.17Å; D250-V300 WeakPolarHBondContact OD2-CG1 3.37Å; D250-V300 PolarHBondContact OD2-N 2.76Å; L252-V300 HydrophobicContact CB-CG1 4.23Å; L252-V300 HydrophobicContact CD1-CG2 4.34Å; L252-V300 HydrophobicContact CD2-CB 4.48Å; L252-V300 HydrophobicContact CD2-CG2 3.98Å; L261-V300 HydrophobicContact CD1-CB 3.64Å; L261-V300 HydrophobicContact CD1-CG2 4.03Å
301	W	93.5	Very high	72.6	Confident	12 Å²	12	76.6 Å²	76.6	5%	0.045	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	140.1	166.9	-179.6	86.6	0	0	0	111	E6 I8 A48 S49 E50 V53 M67 P303	E6-W301 HydrophobicContact CB-CB 4.5Å; E6-W301 HydrophobicContact CB-CE3 4.07Å; E6-W301 HydrophobicContact CG-CE3 3.93Å; E6-W301 HydrophobicContact CG-CZ3 4.28Å; E6-W301 PolarHBondContact N-O 2.73Å; E6-W301 PolarHBondContact O-N 3.32Å; I8-W301 HydrophobicContact CD1-CB 3.45Å; I8-W301 VanDerWaalsContact CD1-CB 3.45Å; I8-W301 HydrophobicContact CD1-CG 4.47Å; A48-W301 HydrophobicContact CB-CB 4.16Å; S49-W301 PolarHBondContact O-NE1 2.84Å; E50-W301 PolarHBondContact O-NE1 2.71Å; V53-W301 HydrophobicContact CG2-CB 4.36Å; V53-W301 HydrophobicContact CG2-CG 4.34Å; M67-W301 HydrophobicContact CB-CD2 4.12Å; M67-W301 VanDerWaalsContact CB-CE2 3.48Å; M67-W301 HydrophobicContact CB-CH2 3.98Å; M67-W301 HydrophobicContact CB-CZ2 3.42Å; M67-W301 VanDerWaalsContact CB-CZ2 3.42Å; M67-W301 HydrophobicContact CE-CB 4.13Å; M67-W301 HydrophobicContact CE-CD2 3.58Å; M67-W301 HydrophobicContact CE-CE3 3.66Å; M67-W301 HydrophobicContact CE-CG 3.79Å; M67-W301 HydrophobicContact CE-CZ3 4.28Å; M67-W301 HydrophobicContact CG-CD2 4.03Å; M67-W301 HydrophobicContact CG-CG 4.16Å; M67-W301 HydrophobicContact CG-CZ2 4.2Å; W301-P303 HydrophobicContact CH2-CB 3.64Å; W301-P303 HydrophobicContact CH2-CG 4.11Å; W301-P303 HydrophobicContact CZ2-CB 4.21Å; W301-P303 HydrophobicContact CZ3-CB 4.12Å; W301-P303 HydrophobicContact CZ3-CG 4.08Å
302	R	86.9	Confident	69.6	Low	178 Å²	178	79 Å²	79	67%	0.672	45%	0.449	S	S	*	.			trans	-133.2	136.4	173.3	64.7	179.3	-175.9	158.8	1.3	110.4
303	P	76.9	Confident	66.7	Low	61 Å²	61	78.9 Å²	78.9	40%	0.396	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-70	130	168.4	26.4	-26.5	0	0	0	109	V4 W301 S305	V4-P303 WeakPolarHBondContact O-CD 3.29Å; W301-P303 HydrophobicContact CH2-CB 3.64Å; W301-P303 HydrophobicContact CH2-CG 4.11Å; W301-P303 HydrophobicContact CZ2-CB 4.21Å; W301-P303 HydrophobicContact CZ3-CB 4.12Å; W301-P303 HydrophobicContact CZ3-CG 4.08Å; P303-S305 PolarHBondContact O-N 2.91Å
304	S	68.2	Low	63.7	Low	54 Å²	54	84.1 Å²	84.1	38%	0.378	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-61.5	129.3	170.7	-49.1	0	0	0	0	109.2	E50 V306	E50-S304 VanDerWaalsContact CG-OG 3.24Å; E50-S304 WeakPolarHBondContact CG-OG 3.12Å; E50-S304 PolarHBondContact OE1-OG 3.42Å; S304-V306 PolarHBondContact O-N 2.82Å
305	S	53	Low	60.7	Low	112 Å²	112	87.3 Å²	87.3	78%	0.783	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-59.1	123.7	165.6	44.3	0	0	0	0	107.8	P303 Q307	P303-S305 PolarHBondContact O-N 2.91Å; S305-Q307 PolarHBondContact O-N 2.99Å; S305-Q307 VanDerWaalsContact O-N 3.09Å
306	V	32.4	Very low	57.8	Low	136 Å²	136	91.2 Å²	91.2	82%	0.824	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-56.9	116.1	-179.4	178	0	0	0	0	108.8	S304	S304-V306 PolarHBondContact O-N 2.82Å
307	Q	28.9	Very low	54.8	Low	175 Å²	175	93.2 Å²	93.2	82%	0.818	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-85.7	135.6	150.1	-69.8	-143.5	-4.2	0	0	107.9	S305 I309	S305-Q307 PolarHBondContact O-N 2.99Å; S305-Q307 VanDerWaalsContact O-N 3.09Å; Q307-I309 PolarHBondContact O-N 2.79Å
308	P	30.6	Very low	52.4	Low	111 Å²	111	96.9 Å²	96.9	72%	0.721	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-60.8	139.7	176.8	25.7	-31.8	0	0	0	109.3	S310	P308-S310 PolarHBondContact O-N 3.02Å
309	I	33.3	Very low	50.1	Low	149 Å²	149	101 Å²	101	76%	0.764	61%	0.607	S	S	*	*			trans	-50.3	110.8	173.3	-60.9	160.8	0	0	0	107.5	Q307 D311	Q307-I309 PolarHBondContact O-N 2.79Å; I309-D311 PolarHBondContact O-N 3.02Å
310	S	28.7	Very low	47.6	Very low	114 Å²	114	107.7 Å²	107.7	80%	0.797	64%	0.638	S	S	*	*			trans	-77.7	96.3	161.1	50.7	0	0	0	0	107.1	P308 G312	P308-S310 PolarHBondContact O-N 3.02Å; S310-G312 PolarHBondContact O-N 3.27Å
311	D	33	Very low	45.2	Very low	161 Å²	161	112.4 Å²	112.4	86%	0.861	66%	0.658	S	S	*	*			trans	-60.1	102.6	161.5	-85.5	-34.2	0	0	0	108.2	I309	I309-D311 PolarHBondContact O-N 3.02Å
312	G	30.8	Very low	42.9	Very low	56 Å²	56	116.7 Å²	116.7	58%	0.577	68%	0.681	S	S	*	*			trans	-158.2	130	170.9	0	0	0	0	0	108.8	S310 S314	S310-G312 PolarHBondContact O-N 3.27Å; G312-S314 PolarHBondContact O-N 2.91Å; G312-S314 VanDerWaalsContact O-N 3.09Å
313	P	31.9	Very low	41	Very low	126 Å²	126	110.9 Å²	110.9	82%	0.818	67%	0.671	S	S	*	*			trans	-65.4	119.1	-173.1	26.4	-31.6	0	0	0	109.4	K315	P313-K315 PolarHBondContact O-N 3.29Å
314	S	33.2	Very low	39.5	Very low	117 Å²	117	114.5 Å²	114.5	82%	0.818	68%	0.683	S	S	*	*			trans	-59.3	99.3	163.9	173.5	0	0	0	0	107.9	G312 A316	G312-S314 PolarHBondContact O-N 2.91Å; G312-S314 VanDerWaalsContact O-N 3.09Å; S314-A316 PolarHBondContact O-N 3.23Å
315	K	32.8	Very low	38.5	Very low	194 Å²	194	117.9 Å²	117.9	84%	0.843	69%	0.693	S	S	*	*			trans	-68.1	101.7	161.8	-82.3	-174.4	175.8	-177.3	0	106.7	P313 A317	P313-K315 PolarHBondContact O-N 3.29Å; K315-A317 PolarHBondContact O-N 3.06Å; K315-A317 VanDerWaalsContact O-N 3.08Å
316	A	37.1	Very low	38.1	Very low	83 Å²	83	117.7 Å²	117.7	69%	0.686	68%	0.683	S	S	*	*			trans	-58.9	108.3	160.5	0	0	0	0	0	107.5	S314 T318	S314-A316 PolarHBondContact O-N 3.23Å; A316-T318 PolarHBondContact O-N 3.28Å
317	A	34.7	Very low	38.8	Very low	60 Å²	60	114.1 Å²	114.1	50%	0.496	67%	0.667	S	S	.	*			trans	-64	109.2	168.4	0	0	0	0	0	107.3	K315	K315-A317 PolarHBondContact O-N 3.06Å; K315-A317 VanDerWaalsContact O-N 3.08Å
318	T	45.3	Very low	39.7	Very low	88 Å²	88	113.9 Å²	113.9	54%	0.54	66%	0.663	S	S	.	*			trans	-62.8	150.4	173.6	34.3	0	0	0	0	109.9	A316 E320 E321	A316-T318 PolarHBondContact O-N 3.28Å; T318-E320 PolarHBondContact O-N 3.02Å; T318-E321 PolarHBondContact O-N 2.82Å
319	S	50.2	Low	40.4	Very low	102 Å²	102	116.3 Å²	116.3	71%	0.713	66%	0.662	S	S	*	*	H	α-helix	trans	-52.4	-14.5	-176.9	43.4	0	0	0	0	115.7	A323	S319-A323 PolarHBondContact O-N 2.82Å
320	E	43.5	Very low	40.8	Very low	146 Å²	146	117.8 Å²	117.8	68%	0.682	66%	0.663	S	S	*	*	H	α-helix	trans	-79.4	-32.5	177.4	-71.2	-179.3	151.7	0	0	113.9	T318 A323 Q324	T318-E320 PolarHBondContact O-N 3.02Å; E320-A323 PolarHBondContact O-N 3.16Å; E320-Q324 PolarHBondContact O-N 3.19Å
321	E	45.3	Very low	41.2	Very low	125 Å²	125	123.6 Å²	123.6	58%	0.584	67%	0.668	S	S	*	*	H	α-helix	trans	-70.7	-37.7	178.2	-76	-176.9	148.5	0	0	111.2	T318 Q324 E325	T318-E321 PolarHBondContact O-N 2.82Å; E321-Q324 PolarHBondContact O-N 3.3Å; E321-E325 PolarHBondContact O-N 2.62Å
322	L	45.1	Very low	41.5	Very low	102 Å²	102	119.1 Å²	119.1	53%	0.534	66%	0.659	S	S	.	*	H	α-helix	trans	-66.6	-33.6	172.6	-94.4	136.3	0	0	0	112.7	L326	L322-L326 WeakPolarHBondContact O-CD1 3.36Å; L322-L326 PolarHBondContact O-N 3.12Å
323	A	45.4	Very low	41.7	Very low	56 Å²	56	127.4 Å²	127.4	46%	0.463	67%	0.673	S	S	.	*	H	α-helix	trans	-68.8	-35.9	177.4	0	0	0	0	0	112.2	S319 E320 A327	S319-A323 PolarHBondContact O-N 2.82Å; E320-A323 PolarHBondContact O-N 3.16Å; A323-A327 PolarHBondContact O-N 3.17Å; A323-A327 VanDerWaalsContact O-N 3.15Å
324	Q	45.8	Very low	41.5	Very low	138 Å²	138	126.1 Å²	126.1	65%	0.645	67%	0.673	S	S	*	*	H	α-helix	trans	-72.3	-34.6	176.9	-71.4	-176.5	3.9	0	0	112.9	E320 E321 A327 K328	E320-Q324 PolarHBondContact O-N 3.19Å; E321-Q324 PolarHBondContact O-N 3.3Å; Q324-A327 PolarHBondContact O-N 3.05Å; Q324-K328 PolarHBondContact O-N 2.85Å
325	E	47	Very low	41.4	Very low	124 Å²	124	128 Å²	128	58%	0.579	67%	0.673	S	S	*	*	H	α-helix	trans	-65	-41.8	172.2	-93.3	-127.6	136.7	0	0	112.6	E321 A327 K328 K329	E321-E325 PolarHBondContact O-N 2.62Å; E325-A327 VanDerWaalsContact C-N 3.32Å; E325-A327 PolarHBondContact O-N 2.83Å; E325-K328 PolarHBondContact O-N 2.89Å; E325-K329 PolarHBondContact O-N 3.29Å
326	L	45.1	Very low	41.2	Very low	109 Å²	109	124.8 Å²	124.8	57%	0.571	67%	0.669	S	S	*	*	H	α-helix	trans	-66.6	-33.1	177.7	-79.9	159.2	0	0	0	112.4	L322 K330	L322-L326 WeakPolarHBondContact O-CD1 3.36Å; L322-L326 PolarHBondContact O-N 3.12Å; L326-K330 PolarHBondContact O-N 3.4Å
327	A	46.6	Very low	40.7	Very low	60 Å²	60	129.5 Å²	129.5	50%	0.496	68%	0.677	S	S	.	*	H	α-helix	trans	-69.7	-35.1	174.8	0	0	0	0	0	112.6	A323 Q324 E325 K330	A323-A327 PolarHBondContact O-N 3.17Å; A323-A327 VanDerWaalsContact O-N 3.15Å; Q324-A327 PolarHBondContact O-N 3.05Å; E325-A327 VanDerWaalsContact C-N 3.32Å; E325-A327 PolarHBondContact O-N 2.83Å; A327-K330 PolarHBondContact O-N 2.84Å
328	K	49.3	Very low	40.4	Very low	171 Å²	171	136 Å²	136	74%	0.743	69%	0.694	S	S	*	*	H	α-helix	trans	-68	-37.4	174.9	-76.1	178.5	-179.8	174.2	0	112.3	Q324 E325 R331	Q324-K328 PolarHBondContact O-N 2.85Å; E325-K328 PolarHBondContact O-N 2.89Å; K328-R331 PolarHBondContact O-N 3.22Å
329	K	43.8	Very low	39.5	Very low	161 Å²	161	137.9 Å²	137.9	70%	0.7	71%	0.705	S	S	*	*	H	α-helix	trans	-70.4	-27.7	176.7	-85.2	176.2	177.4	165.4	0	114.1	E325 R331	E325-K329 PolarHBondContact O-N 3.29Å; K329-R331 VanDerWaalsContact C-N 3.28Å; K329-R331 PolarHBondContact O-N 3.3Å
330	K	42.1	Very low	38.6	Very low	180 Å²	180	140.3 Å²	140.3	78%	0.783	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-72.6	-12.8	177.6	-81.7	-174.6	176.4	-178.2	0	114.8	L326 A327 G332	L326-K330 PolarHBondContact O-N 3.4Å; A327-K330 PolarHBondContact O-N 2.84Å; K330-G332 VanDerWaalsContact C-N 3.3Å; K330-G332 PolarHBondContact O-N 2.86Å
331	R	37.5	Very low	37.9	Very low	237 Å²	237	139.4 Å²	139.4	89%	0.894	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-80.3	-3.6	176	-84	-176.6	169.5	179.4	-2.6	114.6	K328 K329	K328-R331 PolarHBondContact O-N 3.22Å; K329-R331 VanDerWaalsContact C-N 3.28Å; K329-R331 PolarHBondContact O-N 3.3Å
332	G	39.8	Very low	37.1	Very low	66 Å²	66	142.1 Å²	142.1	68%	0.68	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-106.8	2	-170.5	0	0	0	0	0	118.1	K330	K330-G332 VanDerWaalsContact C-N 3.3Å; K330-G332 PolarHBondContact O-N 2.86Å
333	R	35.2	Very low	36.3	Very low	231 Å²	231	143.8 Å²	143.8	87%	0.872	74%	0.735	S	S	*	*			trans	-148.9	92.4	178.6	-107.9	178.5	174.2	177.2	-2.7	111.4
334	A	27.7	Very low	35.7	Very low	99 Å²	99	150.5 Å²	150.5	82%	0.818	76%	0.757	S	S	*	*			trans	-108.1	104.3	161.3	0	0	0	0	0	107.7
335	I	29.9	Very low	34.9	Very low	156 Å²	156	148 Å²	148	80%	0.8	76%	0.755	S	S	*	*			trans	-120.2	122.2	158.2	-66.4	166.3	0	0	0	105.2
336	T	28.2	Very low	34.2	Very low	127 Å²	127	151.8 Å²	151.8	78%	0.779	77%	0.769	S	S	*	*			trans	-83.7	116.5	-171.9	-34.4	0	0	0	0	109.5
337	E	27.4	Very low	33.6	Very low	182 Å²	182	152 Å²	152	85%	0.85	78%	0.777	S	S	*	*			trans	-122.9	121	156.9	-83.8	-171.9	161.1	0	0	108.8
338	K	27.6	Very low	32.8	Very low	197 Å²	197	159.3 Å²	159.3	86%	0.857	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-76.3	119	177.5	-74.2	178.8	175.8	178.4	0	108.8
339	V	27.8	Very low	32	Very low	127 Å²	127	160.8 Å²	160.8	77%	0.77	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-95.6	120.3	165.2	177.6	0	0	0	0	108.2
340	I	29.8	Very low	31.5	Very low	153 Å²	153	163.2 Å²	163.2	79%	0.785	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-74	123	169	-63.9	167.1	0	0	0	106.9
341	V	29.3	Very low	31	Very low	126 Å²	126	164.3 Å²	164.3	76%	0.764	82%	0.82	S	S	*	*			trans	-91.2	111.7	174.7	178.9	0	0	0	0	107.5
342	E	29.6	Very low	30.7	Very low	182 Å²	182	162.8 Å²	162.8	85%	0.85	82%	0.819	S	S	*	*			trans	-85.9	120.1	161.5	-79.2	-171.1	158.3	0	0	108.9
343	D	28.4	Very low	30.5	Very low	138 Å²	138	167.6 Å²	167.6	74%	0.738	83%	0.83	S	S	*	*			trans	-91.2	105.7	-178.3	-170.7	11.5	0	0	0	108.9	S345	D343-S345 PolarHBondContact O-N 3.34Å
344	E	31.5	Very low	30.3	Very low	197 Å²	197	160.7 Å²	160.7	92%	0.921	83%	0.83	S	S	*	*			trans	-83.6	99.3	169.3	-82.1	-158.4	150.8	0	0	110.1
345	S	30.2	Very low	30.5	Very low	86 Å²	86	159.8 Å²	159.8	60%	0.601	83%	0.831	S	S	*	*			trans	-138.4	124.5	157.5	71	0	0	0	0	113.2	D343	D343-S345 PolarHBondContact O-N 3.34Å
346	K	31	Very low	30.9	Very low	203 Å²	203	161.6 Å²	161.6	88%	0.883	83%	0.833	S	S	*	*			trans	105	151.1	151.3	-71.8	-177.6	-177.2	173.2	0	120.4
347	P	32.9	Very low	31.4	Very low	114 Å²	114	164 Å²	164	74%	0.74	83%	0.832	S	S	*	*			trans	-102.8	152.4	-133.8	38.4	-34.9	0	0	0	114.3	K349	P347-K349 PolarHBondContact O-N 3.33Å
348	K	30.8	Very low	31.8	Very low	212 Å²	212	162.4 Å²	162.4	92%	0.922	84%	0.835	S	S	*	*			trans	-78.2	111.3	174.1	-77.1	-179.3	178.4	172.2	0	111.8
349	K	31.6	Very low	32.5	Very low	202 Å²	202	159.1 Å²	159.1	88%	0.878	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-61.3	127.2	163.6	-77.1	175.5	173.9	173.8	0	110.6	P347 K351	P347-K349 PolarHBondContact O-N 3.33Å; K349-K351 PolarHBondContact O-N 3.38Å
350	K	32.4	Very low	33.3	Very low	212 Å²	212	162.4 Å²	162.4	92%	0.922	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-66.1	117.9	165.3	-81.8	-179.6	174.4	176.9	0	109.8
351	K	33.1	Very low	34.2	Very low	204 Å²	204	167.1 Å²	167.1	89%	0.887	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-79.8	123.6	166	-89.1	-178.3	174.1	177.9	0	109.5	K349	K349-K351 PolarHBondContact O-N 3.38Å
352	K	31.5	Very low	34.4	Very low	205 Å²	205	169.2 Å²	169.2	89%	0.891	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-68.1	127	164.5	-79.8	175.6	170.2	177	0	109.1
353	N	34.5	Very low	34.7	Very low	167 Å²	167	168.5 Å²	168.5	89%	0.893	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-92.8	128.5	156.7	-92	-3.7	0	0	0	108.6
354	G	30.8	Very low	35	Very low	85 Å²	85	170.2 Å²	170.2	88%	0.876	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-83.4	131.9	178	0	0	0	0	0	112
355	G	32.3	Very low	35.2	Very low	81 Å²	81	168.6 Å²	168.6	84%	0.835	86%	0.862	S	S	*	*			trans	-113.5	120.3	154.5	0	0	0	0	0	107.9
356	K	37.3	Very low	35.5	Very low	194 Å²	194	173.8 Å²	173.8	84%	0.843	88%	0.879	S	S	*	*			trans	-97	124.5	177.7	-117.2	-179.6	-177.7	175.9	0	109.4
357	K	40.1	Very low	35.8	Very low	177 Å²	177	171.9 Å²	171.9	77%	0.77	88%	0.878	S	S	*	*			trans	52.1	123.7	138.3	-68.6	-175.8	174.4	-170.5	0	120.2
358	T	36.4	Very low	36	Very low	149 Å²	149	176 Å²	176	91%	0.914	89%	0.888	S	S	*	*				-151.3	142.3	111.4	0.5	0	0	0	0	111.3
359	V	41.2	Very low	36.5	Very low	128 Å²	128	173.2 Å²	173.2	78%	0.776	89%	0.886	S	S	*	*			trans	-113.1	145.7	-177.6	166.7	0	0	0	0	108
360	K	45.2	Very low	36.9	Very low	196 Å²	196	170.8 Å²	170.8	85%	0.852	89%	0.886	S	S	*	*			trans	160.8	142.1	147	-93.8	174.4	-177.4	-170.9	0	107.7
361	Q	47.4	Very low	37.3	Very low	252 Å²	252	167.1 Å²	167.1	100%	1.178	88%	0.883	S	S	*	*			cis	-155.4	0	-16.6	-156.9	176	2.4	0	0	105.3

Retrieved 361 of 361 residues in 103.1 ms (Link to these results)

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