Q5JP53_HUMAN Loading...

Tubulin beta chain

Tubulin is the major constituent of microtubules, a cylinder consisting of laterally associated linear protofilaments composed of alpha- and beta-tubulin heterodimers. Microtubules grow by the addition of GTP-tubulin dimers to the microtubule end, where a stabilizing cap forms. Below the cap, tubulin dimers are in GDP-bound state, owing to GTPase activity of alpha-tubulin.

AlphaFold DB , UniProt , Accession Q5JP53, Species HUMAN (Homo sapiens, Human), Gene TUBB, Length 426 aa.

Structure Viewer

Loading PAE data...

(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	85.4	Confident	90	Very high	86 Å²	86	29.4 Å²	29.4	42%	0.424	15%	0.15	S	C	.	.				0	-68.8	0	-60.2	-50.6	-69.2	0	0	114.3	W3 E4 V5 N208	M1-W3 PolarHBondContact O-N 3.37Å; M1-E4 WeakPolarHBondContact CA-OE1 3.45Å; M1-E4 PolarHBondContact N-OE1 3.26Å; M1-E4 WeakPolarHBondContact O-CB 2.88Å; M1-E4 PolarHBondContact O-N 3Å; M1-V5 PolarHBondContact O-N 3.46Å; M1-N208 HydrophobicContact CG-CB 3.98Å
2	F	92.1	Very high	90.1	Very high	23 Å²	23	27.3 Å²	27.3	10%	0.101	14%	0.14	C	C	.	.	H	α-helix	trans	-52.8	-54.2	-178.8	171	-110.2	0	0	0	112.7	E4 V5 I6 Y32 M215 T219	F2-E4 PolarHBondContact O-N 3.49Å; F2-V5 PolarHBondContact O-N 2.89Å; F2-V5 VanDerWaalsContact O-N 3.13Å; F2-I6 HydrophobicContact CD1-CD1 4.3Å; F2-I6 HydrophobicContact CD2-CG2 4.1Å; F2-I6 HydrophobicContact CE1-CD1 3.65Å; F2-I6 HydrophobicContact CE1-CG1 4.28Å; F2-I6 HydrophobicContact CE2-CG2 3.58Å; F2-I6 HydrophobicContact CZ-CD1 3.8Å; F2-I6 HydrophobicContact CZ-CG1 4.34Å; F2-I6 HydrophobicContact CZ-CG2 3.86Å; F2-I6 WeakPolarHBondContact O-CG1 3.17Å; F2-I6 PolarHBondContact O-N 3.36Å; F2-Y32 HydrophobicContact CE1-CD1 4.34Å; F2-Y32 HydrophobicContact CE1-CE1 4.05Å; F2-Y32 HydrophobicContact CZ-CE1 4.05Å; F2-M215 HydrophobicContact CB-CE 3.84Å; F2-M215 HydrophobicContact CB-SD 4.07Å; F2-M215 HydrophobicContact CD1-CE 4.08Å; F2-M215 HydrophobicContact CD2-CB 3.5Å; F2-M215 VanDerWaalsContact CD2-CB 3.5Å; F2-M215 HydrophobicContact CD2-CE 3.71Å; F2-M215 HydrophobicContact CD2-CG 4.46Å; F2-M215 HydrophobicContact CD2-SD 4.22Å; F2-M215 HydrophobicContact CE2-CB 3.82Å; F2-M215 HydrophobicContact CE2-CE 4.26Å; F2-M215 HydrophobicContact CG-CB 4.45Å; F2-M215 HydrophobicContact CG-CE 3.59Å; F2-M215 HydrophobicContact CG-SD 4.29Å; F2-T219 HydrophobicContact CE2-CG2 4.39Å; F2-T219 HydrophobicContact CZ-CG2 4.29Å
3	W	93.1	Very high	90.2	Very high	44 Å²	44	27.8 Å²	27.8	17%	0.167	14%	0.143	C	C	.	.	H	α-helix	trans	-57.5	-33.3	176.8	-71.8	109.7	0	0	0	113.7	M1 I6 S7 Y32 Y33 P43 A45 F67	M1-W3 PolarHBondContact O-N 3.37Å; W3-I6 HydrophobicContact CD2-CD1 4.26Å; W3-I6 HydrophobicContact CE3-CD1 3.47Å; W3-I6 VanDerWaalsContact CE3-CD1 3.47Å; W3-I6 HydrophobicContact CE3-CG1 4.06Å; W3-I6 HydrophobicContact CH2-CD1 4.42Å; W3-I6 HydrophobicContact CZ3-CD1 3.57Å; W3-S7 WeakPolarHBondContact O-CB 3.27Å; W3-S7 PolarHBondContact O-N 3.48Å; W3-S7 PolarHBondContact O-OG 2.98Å; W3-Y32 AromaticContact CH2-CD1 3.73Å; W3-Y32 HydrophobicContact CH2-CD1 3.73Å; W3-Y32 HydrophobicContact CH2-CG 4.34Å; W3-Y32 WeakPolarHBondContact CH2-O 3.45Å; W3-Y32 HydrophobicContact CZ2-CD1 4.41Å; W3-Y32 HydrophobicContact CZ3-CD1 4.24Å; W3-Y32 HydrophobicContact CZ3-CG 4.49Å; W3-Y32 WeakPolarHBondContact CZ3-O 3.43Å; W3-Y33 HydrophobicContact CE3-CE1 4.32Å; W3-Y33 HydrophobicContact CZ3-CE1 4.23Å; W3-Y33 HydrophobicContact CZ3-CE2 4.34Å; W3-P43 HydrophobicContact CD2-CB 3.95Å; W3-P43 HydrophobicContact CD2-CG 4.29Å; W3-P43 HydrophobicContact CE3-CB 3.6Å; W3-P43 HydrophobicContact CE3-CG 3.8Å; W3-P43 HydrophobicContact CH2-CB 3.76Å; W3-P43 HydrophobicContact CZ2-CB 4.09Å; W3-P43 HydrophobicContact CZ3-CB 3.51Å; W3-P43 HydrophobicContact CZ3-CG 4.05Å; W3-A45 HydrophobicContact CZ2-CB 3.61Å; W3-F67 HydrophobicContact CB-CE1 4.3Å; W3-F67 HydrophobicContact CB-CZ 3.87Å; W3-F67 AromaticContact CD1-CE1 3.56Å; W3-F67 AromaticContact CD1-CZ 3.59Å; W3-F67 HydrophobicContact CD2-CE1 4.2Å; W3-F67 AromaticContact CG-CE1 3.77Å; W3-F67 HydrophobicContact CG-CE1 3.77Å; W3-F67 AromaticContact CG-CZ 3.76Å; W3-F67 HydrophobicContact CG-CZ 3.76Å; W3-F67 AromaticContact NE1-CE1 3.9Å
4	E	91	Very high	90.2	Very high	55 Å²	55	29.7 Å²	29.7	26%	0.257	16%	0.158	S	C	.	.	H	α-helix	trans	-67.9	-46.2	177.5	-56.7	168.7	-137.5	0	0	110.4	M1 F2 S7 D8 P62 F63	M1-E4 WeakPolarHBondContact CA-OE1 3.45Å; M1-E4 PolarHBondContact N-OE1 3.26Å; M1-E4 WeakPolarHBondContact O-CB 2.88Å; M1-E4 PolarHBondContact O-N 3Å; F2-E4 PolarHBondContact O-N 3.49Å; E4-S7 PolarHBondContact O-N 3.2Å; E4-D8 WeakPolarHBondContact O-CB 3.31Å; E4-D8 PolarHBondContact O-N 3.48Å; E4-P62 HydrophobicContact CG-CG 4.38Å; E4-P62 WeakPolarHBondContact OE2-CG 3.48Å; E4-F63 HydrophobicContact CB-CD2 3.96Å; E4-F63 HydrophobicContact CB-CE2 4.24Å; E4-F63 HydrophobicContact CG-CB 4.1Å; E4-F63 HydrophobicContact CG-CD2 3.64Å; E4-F63 HydrophobicContact CG-CE2 4.4Å; E4-F63 HydrophobicContact CG-CG 4.11Å
5	V	89.9	Confident	90	Very high	33 Å²	33	33.3 Å²	33.3	20%	0.2	18%	0.182	C	C	.	.	H	α-helix	trans	-63.8	-46.7	178.9	174.9	0	0	0	0	111	M1 F2 D8 E9	M1-V5 PolarHBondContact O-N 3.46Å; F2-V5 PolarHBondContact O-N 2.89Å; F2-V5 VanDerWaalsContact O-N 3.13Å; V5-D8 PolarHBondContact O-N 3.45Å; V5-E9 WeakPolarHBondContact O-CG 3.29Å; V5-E9 PolarHBondContact O-N 3.14Å
6	I	91.6	Very high	89.9	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-73.3	-34.4	-179.4	62.6	157.9	0	0	0	112.3	F2 W3 D8 E9 H10 Y32 Y33	F2-I6 HydrophobicContact CD1-CD1 4.3Å; F2-I6 HydrophobicContact CD2-CG2 4.1Å; F2-I6 HydrophobicContact CE1-CD1 3.65Å; F2-I6 HydrophobicContact CE1-CG1 4.28Å; F2-I6 HydrophobicContact CE2-CG2 3.58Å; F2-I6 HydrophobicContact CZ-CD1 3.8Å; F2-I6 HydrophobicContact CZ-CG1 4.34Å; F2-I6 HydrophobicContact CZ-CG2 3.86Å; F2-I6 WeakPolarHBondContact O-CG1 3.17Å; F2-I6 PolarHBondContact O-N 3.36Å; W3-I6 HydrophobicContact CD2-CD1 4.26Å; W3-I6 HydrophobicContact CE3-CD1 3.47Å; W3-I6 VanDerWaalsContact CE3-CD1 3.47Å; W3-I6 HydrophobicContact CE3-CG1 4.06Å; W3-I6 HydrophobicContact CH2-CD1 4.42Å; W3-I6 HydrophobicContact CZ3-CD1 3.57Å; I6-D8 VanDerWaalsContact C-N 3.27Å; I6-D8 PolarHBondContact O-N 2.78Å; I6-E9 PolarHBondContact O-N 3.47Å; I6-H10 WeakPolarHBondContact O-CB 3.16Å; I6-H10 PolarHBondContact O-CD2 3.33Å; I6-H10 PolarHBondContact O-N 2.78Å; I6-Y32 HydrophobicContact CD1-CD1 4.36Å; I6-Y32 HydrophobicContact CD1-CG 4.2Å; I6-Y33 HydrophobicContact CD1-CE2 4.24Å
7	S	91.3	Very high	89.9	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59	-45.3	173.3	-63.7	0	0	0	0	110	W3 E4 H10 G11 I12 Y33 F63	W3-S7 WeakPolarHBondContact O-CB 3.27Å; W3-S7 PolarHBondContact O-N 3.48Å; W3-S7 PolarHBondContact O-OG 2.98Å; E4-S7 PolarHBondContact O-N 3.2Å; S7-H10 CarbonylContact O-C 3.41Å; S7-H10 PolarHBondContact O-N 3.46Å; S7-G11 PolarHBondContact O-N 3.02Å; S7-I12 PolarHBondContact O-N 2.88Å; S7-Y33 VanDerWaalsContact CA-OH 3.24Å; S7-Y33 WeakPolarHBondContact CA-OH 3.34Å; S7-Y33 PolarHBondContact N-OH 3.17Å; S7-Y33 PolarHBondContact OG-OH 3.21Å; S7-F63 VanDerWaalsContact CB-CE1 3.46Å
8	D	89.2	Confident	90	Very high	54 Å²	54	33.1 Å²	33.1	29%	0.289	18%	0.177	S	C	.	.	H	α-helix	trans	-66.4	-38.6	179.6	-167.3	29.1	0	0	0	112.8	E4 V5 I6 H10 G11 R341	E4-D8 WeakPolarHBondContact O-CB 3.31Å; E4-D8 PolarHBondContact O-N 3.48Å; V5-D8 PolarHBondContact O-N 3.45Å; I6-D8 VanDerWaalsContact C-N 3.27Å; I6-D8 PolarHBondContact O-N 2.78Å; D8-H10 VanDerWaalsContact C-N 3.3Å; D8-H10 PolarHBondContact O-N 2.97Å; D8-G11 PolarHBondContact O-N 3.26Å; D8-R341 IonicContact OD1-CZ 3.38Å; D8-R341 IonicContact OD1-NE 3.47Å; D8-R341 IonicContact OD1-NH1 2.65Å; D8-R341 PolarHBondContact OD1-NH1 2.85Å; D8-R341 IonicContact OD1-NH2 3.09Å; D8-R341 WeakPolarHBondContact OD2-CD 3.26Å; D8-R341 IonicContact OD2-CZ 3.2Å; D8-R341 IonicContact OD2-NE 2.65Å; D8-R341 PolarHBondContact OD2-NE 3.39Å; D8-R341 IonicContact OD2-NH1 3.77Å; D8-R341 PolarHBondContact OD2-NH1 3.43Å
9	E	88.3	Confident	89.9	Confident	12 Å²	12	38.4 Å²	38.4	6%	0.056	20%	0.201	C	C	.	.	H	α-helix	trans	-65.3	-32.5	172.4	-74.8	-174.6	-171.8	0	0	113.3	V5 I6 Q25 S216 R223 F224 R300	V5-E9 WeakPolarHBondContact O-CG 3.29Å; V5-E9 PolarHBondContact O-N 3.14Å; I6-E9 PolarHBondContact O-N 3.47Å; E9-Q25 PolarHBondContact O-NE2 3.27Å; E9-S216 PolarHBondContact OE1-OG 3.05Å; E9-S216 PolarHBondContact OE2-OG 3.3Å; E9-R223 IonicContact OE2-CZ 3.51Å; E9-R223 VanDerWaalsContact OE2-CZ 3.24Å; E9-R223 IonicContact OE2-NH1 3.26Å; E9-R223 PolarHBondContact OE2-NH1 3.24Å; E9-R223 IonicContact OE2-NH2 2.87Å; E9-R223 PolarHBondContact OE2-NH2 3.14Å; E9-F224 HydrophobicContact CB-CZ 4.19Å; E9-R300 IonicContact OE1-CZ 3.66Å; E9-R300 IonicContact OE1-NH1 2.77Å; E9-R300 PolarHBondContact OE1-NH1 3.31Å; E9-R300 IonicContact OE1-NH2 2.75Å; E9-R300 PolarHBondContact OE1-NH2 3.14Å; E9-R300 IonicContact OE2-CZ 2.84Å; E9-R300 IonicContact OE2-NH1 3.66Å; E9-R300 PolarHBondContact OE2-NH1 3.3Å; E9-R300 IonicContact OE2-NH2 3.36Å; E9-R300 PolarHBondContact OE2-NH2 3.05Å
10	H	88.9	Confident	89.5	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	0.8	175.6	-74.5	-74.2	0	0	0	113.5	I6 S7 D8 I12 Y18 Q25 I29 R223 F224	I6-H10 WeakPolarHBondContact O-CB 3.16Å; I6-H10 PolarHBondContact O-CD2 3.33Å; I6-H10 PolarHBondContact O-N 2.78Å; S7-H10 CarbonylContact O-C 3.41Å; S7-H10 PolarHBondContact O-N 3.46Å; D8-H10 VanDerWaalsContact C-N 3.3Å; D8-H10 PolarHBondContact O-N 2.97Å; H10-I12 VanDerWaalsContact C-N 3.29Å; H10-I12 HydrophobicContact CB-CD1 4.21Å; H10-I12 HydrophobicContact CB-CG1 4.31Å; H10-I12 PolarHBondContact O-N 3.12Å; H10-Y18 VanDerWaalsContact O-CD2 3.27Å; H10-Y18 WeakPolarHBondContact O-CD2 3.26Å; H10-Y18 WeakPolarHBondContact O-CE2 3.35Å; H10-Q25 PolarHBondContact ND1-O 3.31Å; H10-I29 HydrophobicContact CB-CD1 3.52Å; H10-I29 VanDerWaalsContact ND1-CD1 3.34Å; H10-I29 WeakPolarHBondContact ND1-CD1 3.27Å; H10-R223 PolarHBondContact NE2-NH1 3.29Å; H10-F224 AromaticContact CE1-CE1 3.56Å; H10-F224 AromaticContact CE1-CZ 3.84Å; H10-F224 AromaticContact ND1-CE1 3.86Å
11	G	89.2	Confident	89.2	Confident	15 Å²	15	43.7 Å²	43.7	16%	0.155	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	25.5	-179.7	0	0	0	0	0	114.3	S7 D8 H19 G20	S7-G11 PolarHBondContact O-N 3.02Å; D8-G11 PolarHBondContact O-N 3.26Å; G11-H19 PolarHBondContact O-N 2.82Å; G11-G20 PolarHBondContact O-N 3.21Å
12	I	91.4	Very high	89	Confident	5 Å²	5	41.6 Å²	41.6	3%	0.026	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-89.1	129.1	176.7	-64.1	170.6	0	0	0	109.4	S7 H10 I29 Y33 Y41 F63 I66	S7-I12 PolarHBondContact O-N 2.88Å; H10-I12 VanDerWaalsContact C-N 3.29Å; H10-I12 HydrophobicContact CB-CD1 4.21Å; H10-I12 HydrophobicContact CB-CG1 4.31Å; H10-I12 PolarHBondContact O-N 3.12Å; I12-I29 HydrophobicContact CD1-CD1 3.73Å; I12-I29 HydrophobicContact CD1-CG1 4.23Å; I12-Y33 HydrophobicContact CD1-CD1 3.76Å; I12-Y33 HydrophobicContact CD1-CD2 4Å; I12-Y33 HydrophobicContact CD1-CE1 3.63Å; I12-Y33 HydrophobicContact CD1-CE2 3.9Å; I12-Y33 HydrophobicContact CD1-CG 3.96Å; I12-Y41 HydrophobicContact CD1-CD2 4.31Å; I12-Y41 HydrophobicContact CD1-CG 4.06Å; I12-Y41 HydrophobicContact CG1-CD2 4.37Å; I12-F63 WeakPolarHBondContact O-CE1 3.4Å; I12-I66 HydrophobicContact CG2-CD1 3.72Å
13	D	91.1	Very high	88.5	Confident	34 Å²	34	46.9 Å²	46.9	18%	0.182	26%	0.257	C	S	.	.			trans	-82.3	169.6	174.9	76.2	17.1	0	0	0	112.6	T15 G16 T17 H19	D13-T15 VanDerWaalsContact CG-OG1 3.31Å; D13-T15 PolarHBondContact O-N 3.07Å; D13-T15 VanDerWaalsContact OD1-C 3.32Å; D13-T15 VanDerWaalsContact OD1-CA 3.24Å; D13-T15 WeakPolarHBondContact OD1-CA 3.47Å; D13-T15 WeakPolarHBondContact OD1-CB 3.48Å; D13-T15 PolarHBondContact OD1-N 3.3Å; D13-T15 PolarHBondContact OD1-OG1 2.67Å; D13-T15 PolarHBondContact OD2-OG1 3.28Å; D13-G16 PolarHBondContact O-N 2.87Å; D13-G16 PolarHBondContact OD1-N 3.1Å; D13-T17 PolarHBondContact N-O 2.91Å; D13-T17 PolarHBondContact OD1-N 2.98Å; D13-T17 PolarHBondContact OD1-OG1 3.21Å; D13-T17 VanDerWaalsContact OD1-OG1 3.1Å; D13-T17 PolarHBondContact OD2-OG1 3.2Å; D13-H19 IonicContact OD2-CD2 2.85Å; D13-H19 PolarHBondContact OD2-CD2 3Å; D13-H19 IonicContact OD2-NE2 3.3Å; D13-H19 PolarHBondContact OD2-NE2 2.92Å
14	P	89.7	Confident	88	Confident	54 Å²	54	48.3 Å²	48.3	35%	0.351	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-14.9	177.3	-28.6	37.9	0	0	0	115.8	P62 F63	P14-P62 WeakPolarHBondContact CB-O 3.25Å; P14-F63 HydrophobicContact CB-CD1 4.4Å; P14-F63 HydrophobicContact CG-CD1 4.31Å; P14-F63 HydrophobicContact CG-CD2 4.48Å; P14-F63 HydrophobicContact CG-CE1 4.09Å; P14-F63 HydrophobicContact CG-CE2 4.3Å; P14-F63 HydrophobicContact CG-CZ 4.1Å
15	T	87.4	Confident	87.7	Confident	84 Å²	84	47 Å²	47	52%	0.515	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-3	178	76.5	0	0	0	0	112.9	D13 T17	D13-T15 VanDerWaalsContact CG-OG1 3.31Å; D13-T15 PolarHBondContact O-N 3.07Å; D13-T15 VanDerWaalsContact OD1-C 3.32Å; D13-T15 VanDerWaalsContact OD1-CA 3.24Å; D13-T15 WeakPolarHBondContact OD1-CA 3.47Å; D13-T15 WeakPolarHBondContact OD1-CB 3.48Å; D13-T15 PolarHBondContact OD1-N 3.3Å; D13-T15 PolarHBondContact OD1-OG1 2.67Å; D13-T15 PolarHBondContact OD2-OG1 3.28Å; T15-T17 PolarHBondContact OG1-OG1 2.81Å
16	G	88.1	Confident	87.6	Confident	1 Å²	1	48 Å²	48	1%	0.01	27%	0.266	C	S	.	.	S	Bend	trans	86.9	4.8	-179.2	0	0	0	0	0	113.8	D13 K40 Y41	D13-G16 PolarHBondContact O-N 2.87Å; D13-G16 PolarHBondContact OD1-N 3.1Å; G16-K40 CarbonylContact O-C 3.47Å; G16-K40 WeakPolarHBondContact O-CA 3.38Å; G16-Y41 PolarHBondContact O-N 2.89Å
17	T	90.4	Very high	87.1	Confident	39 Å²	39	52.7 Å²	52.7	24%	0.239	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-86	139.9	178.3	24.6	0	0	0	0	111.8	D13 T15 K40	D13-T17 PolarHBondContact N-O 2.91Å; D13-T17 PolarHBondContact OD1-N 2.98Å; D13-T17 PolarHBondContact OD1-OG1 3.21Å; D13-T17 VanDerWaalsContact OD1-OG1 3.1Å; D13-T17 PolarHBondContact OD2-OG1 3.2Å; T15-T17 PolarHBondContact OG1-OG1 2.81Å; T17-K40 HydrophobicContact CG2-CG 4.46Å
18	Y	91.4	Very high	86.8	Confident	55 Å²	55	56.2 Å²	56.2	22%	0.216	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-80.1	124.3	176.6	175.9	-98.7	0	0	0	111	H10 G20 S22 Q25 L26	H10-Y18 VanDerWaalsContact O-CD2 3.27Å; H10-Y18 WeakPolarHBondContact O-CD2 3.26Å; H10-Y18 WeakPolarHBondContact O-CE2 3.35Å; Y18-G20 VanDerWaalsContact OH-C 3.31Å; Y18-G20 WeakPolarHBondContact OH-CA 3.39Å; Y18-G20 PolarHBondContact OH-O 2.84Å; Y18-S22 PolarHBondContact OH-N 2.79Å; Y18-S22 PolarHBondContact OH-O 2.77Å; Y18-Q25 HydrophobicContact CE2-CB 4.07Å; Y18-Q25 PolarHBondContact OH-OE1 3.41Å; Y18-L26 HydrophobicContact CD1-CD1 3.99Å; Y18-L26 HydrophobicContact CD1-CD2 4.43Å; Y18-L26 HydrophobicContact CD1-CG 4.5Å; Y18-L26 HydrophobicContact CD2-CD1 4.43Å; Y18-L26 HydrophobicContact CD2-CD2 3.55Å; Y18-L26 HydrophobicContact CD2-CG 4.06Å; Y18-L26 HydrophobicContact CE1-CD1 3.74Å; Y18-L26 HydrophobicContact CE1-CG 4.21Å; Y18-L26 HydrophobicContact CE2-CD1 4.19Å; Y18-L26 HydrophobicContact CE2-CD2 3.72Å; Y18-L26 HydrophobicContact CE2-CG 3.73Å; Y18-L26 HydrophobicContact CG-CD1 4.32Å; Y18-L26 HydrophobicContact CG-CD2 3.92Å; Y18-L26 HydrophobicContact CG-CG 4.42Å
19	H	88.3	Confident	86.8	Confident	134 Å²	134	54.3 Å²	54.3	62%	0.62	29%	0.293	S	S	*	.			trans	-128.1	26.9	174.5	-70.9	-71.1	0	0	0	111.2	G11 D13	G11-H19 PolarHBondContact O-N 2.82Å; D13-H19 IonicContact OD2-CD2 2.85Å; D13-H19 PolarHBondContact OD2-CD2 3Å; D13-H19 IonicContact OD2-NE2 3.3Å; D13-H19 PolarHBondContact OD2-NE2 2.92Å
20	G	82.4	Confident	86.8	Confident	19 Å²	19	57.4 Å²	57.4	20%	0.196	32%	0.317	C	S	.	.			trans	-75.9	163.8	178.7	0	0	0	0	0	113.4	G11 Y18	G11-G20 PolarHBondContact O-N 3.21Å; Y18-G20 VanDerWaalsContact OH-C 3.31Å; Y18-G20 WeakPolarHBondContact OH-CA 3.39Å; Y18-G20 PolarHBondContact OH-O 2.84Å
21	D	82.2	Confident	86.8	Confident	169 Å²	169	59.1 Å²	59.1	90%	0.904	33%	0.327	S	S	*	.	S	Bend	trans	-106	-2.6	-175.5	-63.9	-43.3	0	0	0	112.8
22	S	81.4	Confident	86.9	Confident	43 Å²	43	59.7 Å²	59.7	30%	0.301	33%	0.325	S	S	.	.			trans	-137.9	126.5	-169.4	171.1	0	0	0	0	112.5	Y18 L24 Q25	Y18-S22 PolarHBondContact OH-N 2.79Å; Y18-S22 PolarHBondContact OH-O 2.77Å; S22-L24 PolarHBondContact O-N 3.13Å; S22-L24 PolarHBondContact OG-N 2.97Å; S22-Q25 VanDerWaalsContact O-CB 3.26Å; S22-Q25 WeakPolarHBondContact O-CB 3.48Å; S22-Q25 PolarHBondContact O-N 3.09Å; S22-Q25 PolarHBondContact O-OE1 2.98Å
23	D	82.8	Confident	87	Confident	134 Å²	134	59.6 Å²	59.6	72%	0.717	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-57.8	-35	178.6	-60.7	-29.1	0	0	0	113	Q25 L26 D27	D23-Q25 PolarHBondContact O-N 3.45Å; D23-L26 PolarHBondContact O-N 3.38Å; D23-D27 PolarHBondContact O-N 2.94Å
24	L	82.8	Confident	87	Confident	73 Å²	73	59 Å²	59	38%	0.382	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-58.2	-18.8	176.1	-62	174.7	0	0	0	113.9	S22 L26 P225 I338	S22-L24 PolarHBondContact O-N 3.13Å; S22-L24 PolarHBondContact OG-N 2.97Å; L24-L26 VanDerWaalsContact C-N 3.31Å; L24-P225 HydrophobicContact CD2-CG 3.99Å; L24-I338 HydrophobicContact CB-CD1 3.72Å; L24-I338 HydrophobicContact CD1-CD1 4.31Å
25	Q	84.6	Confident	87	Confident	29 Å²	29	63.2 Å²	63.2	14%	0.136	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-73.4	-25.3	175	-66.1	173	-45.3	0	0	112.2	E9 H10 Y18 S22 D23	E9-Q25 PolarHBondContact O-NE2 3.27Å; H10-Q25 PolarHBondContact ND1-O 3.31Å; Y18-Q25 HydrophobicContact CE2-CB 4.07Å; Y18-Q25 PolarHBondContact OH-OE1 3.41Å; S22-Q25 VanDerWaalsContact O-CB 3.26Å; S22-Q25 WeakPolarHBondContact O-CB 3.48Å; S22-Q25 PolarHBondContact O-N 3.09Å; S22-Q25 PolarHBondContact O-OE1 2.98Å; D23-Q25 PolarHBondContact O-N 3.45Å
26	L	86.3	Confident	86.9	Confident	54 Å²	54	60.8 Å²	60.8	28%	0.283	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-24.4	-178.8	-68.1	176.6	0	0	0	113	Y18 D23 L24 R28 I29 Y41	Y18-L26 HydrophobicContact CD1-CD1 3.99Å; Y18-L26 HydrophobicContact CD1-CD2 4.43Å; Y18-L26 HydrophobicContact CD1-CG 4.5Å; Y18-L26 HydrophobicContact CD2-CD1 4.43Å; Y18-L26 HydrophobicContact CD2-CD2 3.55Å; Y18-L26 HydrophobicContact CD2-CG 4.06Å; Y18-L26 HydrophobicContact CE1-CD1 3.74Å; Y18-L26 HydrophobicContact CE1-CG 4.21Å; Y18-L26 HydrophobicContact CE2-CD1 4.19Å; Y18-L26 HydrophobicContact CE2-CD2 3.72Å; Y18-L26 HydrophobicContact CE2-CG 3.73Å; Y18-L26 HydrophobicContact CG-CD1 4.32Å; Y18-L26 HydrophobicContact CG-CD2 3.92Å; Y18-L26 HydrophobicContact CG-CG 4.42Å; D23-L26 PolarHBondContact O-N 3.38Å; L24-L26 VanDerWaalsContact C-N 3.31Å; L26-R28 PolarHBondContact O-N 3.33Å; L26-I29 HydrophobicContact CD2-CG2 4.5Å; L26-I29 VanDerWaalsContact O-CG2 3.31Å; L26-I29 WeakPolarHBondContact O-CG2 3.47Å; L26-I29 PolarHBondContact O-N 3.32Å; L26-I29 VanDerWaalsContact O-N 3.14Å; L26-Y41 HydrophobicContact CD2-CE2 4.1Å
27	D	83.1	Confident	86.6	Confident	98 Å²	98	67.5 Å²	67.5	52%	0.524	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-37.4	-174.4	-81.2	-4.9	0	0	0	115	D23 P225	D23-D27 PolarHBondContact O-N 2.94Å; D27-P225 HydrophobicContact CB-CG 4.26Å
28	R	84.7	Confident	86.1	Confident	74 Å²	74	69.3 Å²	69.3	28%	0.279	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127	29.5	179.4	-70.2	-166.1	179.9	174.7	3.8	113.2	L26 S30 V31 C221 L222 R223 N229	L26-R28 PolarHBondContact O-N 3.33Å; R28-S30 PolarHBondContact O-N 3.01Å; R28-V31 HydrophobicContact CB-CG2 4.21Å; R28-V31 WeakPolarHBondContact O-CG2 3.35Å; R28-V31 PolarHBondContact O-N 2.78Å; R28-C221 PolarHBondContact NH1-O 3.32Å; R28-L222 WeakPolarHBondContact CD-O 3.34Å; R28-R223 WeakPolarHBondContact CB-O 3.35Å; R28-N229 PolarHBondContact NH2-OD1 3.05Å
29	I	88	Confident	85.7	Confident	13 Å²	13	68.3 Å²	68.3	7%	0.067	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-63.6	-29.1	179.2	-160.2	68.7	0	0	0	112.6	H10 I12 L26 V31 Y32 Y33 Y41	H10-I29 HydrophobicContact CB-CD1 3.52Å; H10-I29 VanDerWaalsContact ND1-CD1 3.34Å; H10-I29 WeakPolarHBondContact ND1-CD1 3.27Å; I12-I29 HydrophobicContact CD1-CD1 3.73Å; I12-I29 HydrophobicContact CD1-CG1 4.23Å; L26-I29 HydrophobicContact CD2-CG2 4.5Å; L26-I29 VanDerWaalsContact O-CG2 3.31Å; L26-I29 WeakPolarHBondContact O-CG2 3.47Å; L26-I29 PolarHBondContact O-N 3.32Å; L26-I29 VanDerWaalsContact O-N 3.14Å; I29-V31 PolarHBondContact O-N 3.43Å; I29-V31 VanDerWaalsContact O-N 3.09Å; I29-Y32 PolarHBondContact O-N 3.16Å; I29-Y33 HydrophobicContact CD1-CD2 3.58Å; I29-Y33 HydrophobicContact CD1-CE2 3.98Å; I29-Y33 HydrophobicContact CD1-CG 4.35Å; I29-Y33 HydrophobicContact CG1-CD2 3.88Å; I29-Y33 HydrophobicContact CG1-CG 4.26Å; I29-Y33 PolarHBondContact O-N 2.8Å; I29-Y41 HydrophobicContact CG1-CD1 3.93Å; I29-Y41 HydrophobicContact CG1-CE1 4.14Å; I29-Y41 HydrophobicContact CG1-CG 4.41Å; I29-Y41 HydrophobicContact CG2-CD1 4.16Å; I29-Y41 HydrophobicContact CG2-CE1 3.65Å
30	S	88.3	Confident	85.8	Confident	78 Å²	78	66.7 Å²	66.7	55%	0.545	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-63.2	-12.9	179.9	58.4	0	0	0	0	114.9	R28 Y33	R28-S30 PolarHBondContact O-N 3.01Å; S30-Y33 WeakPolarHBondContact CA-O 3.4Å
31	V	88.8	Confident	86.2	Confident	36 Å²	36	67 Å²	67	22%	0.218	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-66.7	-46.6	177.2	178.4	0	0	0	0	110.8	R28 I29 R44 L222	R28-V31 HydrophobicContact CB-CG2 4.21Å; R28-V31 WeakPolarHBondContact O-CG2 3.35Å; R28-V31 PolarHBondContact O-N 2.78Å; I29-V31 PolarHBondContact O-N 3.43Å; I29-V31 VanDerWaalsContact O-N 3.09Å; V31-R44 PolarHBondContact O-NH1 2.99Å; V31-L222 HydrophobicContact CG1-CB 4.3Å
32	Y	92.1	Very high	86.7	Confident	27 Å²	27	60.2 Å²	60.2	11%	0.106	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-16.5	-175.3	-79.8	-81	0	0	0	114	F2 W3 I6 I29 R44 Q116 T219 R223	F2-Y32 HydrophobicContact CE1-CD1 4.34Å; F2-Y32 HydrophobicContact CE1-CE1 4.05Å; F2-Y32 HydrophobicContact CZ-CE1 4.05Å; W3-Y32 AromaticContact CH2-CD1 3.73Å; W3-Y32 HydrophobicContact CH2-CD1 3.73Å; W3-Y32 HydrophobicContact CH2-CG 4.34Å; W3-Y32 WeakPolarHBondContact CH2-O 3.45Å; W3-Y32 HydrophobicContact CZ2-CD1 4.41Å; W3-Y32 HydrophobicContact CZ3-CD1 4.24Å; W3-Y32 HydrophobicContact CZ3-CG 4.49Å; W3-Y32 WeakPolarHBondContact CZ3-O 3.43Å; I6-Y32 HydrophobicContact CD1-CD1 4.36Å; I6-Y32 HydrophobicContact CD1-CG 4.2Å; I29-Y32 PolarHBondContact O-N 3.16Å; Y32-R44 PolarHBondContact O-N 3.41Å; Y32-Q116 PolarHBondContact OH-OE1 3.5Å; Y32-T219 WeakPolarHBondContact OH-CG2 2.86Å; Y32-R223 HydrophobicContact CD2-CG 3.52Å; Y32-R223 HydrophobicContact CE2-CG 3.58Å
33	Y	93.3	Very high	87.3	Confident	3 Å²	3	58.2 Å²	58.2	1%	0.012	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	139.8	-179	-60.8	-95.2	0	0	0	111.5	W3 I6 S7 I12 I29 S30 V42 P43 I66	W3-Y33 HydrophobicContact CE3-CE1 4.32Å; W3-Y33 HydrophobicContact CZ3-CE1 4.23Å; W3-Y33 HydrophobicContact CZ3-CE2 4.34Å; I6-Y33 HydrophobicContact CD1-CE2 4.24Å; S7-Y33 VanDerWaalsContact CA-OH 3.24Å; S7-Y33 WeakPolarHBondContact CA-OH 3.34Å; S7-Y33 PolarHBondContact N-OH 3.17Å; S7-Y33 PolarHBondContact OG-OH 3.21Å; I12-Y33 HydrophobicContact CD1-CD1 3.76Å; I12-Y33 HydrophobicContact CD1-CD2 4Å; I12-Y33 HydrophobicContact CD1-CE1 3.63Å; I12-Y33 HydrophobicContact CD1-CE2 3.9Å; I12-Y33 HydrophobicContact CD1-CG 3.96Å; I29-Y33 HydrophobicContact CD1-CD2 3.58Å; I29-Y33 HydrophobicContact CD1-CE2 3.98Å; I29-Y33 HydrophobicContact CD1-CG 4.35Å; I29-Y33 HydrophobicContact CG1-CD2 3.88Å; I29-Y33 HydrophobicContact CG1-CG 4.26Å; I29-Y33 PolarHBondContact O-N 2.8Å; S30-Y33 WeakPolarHBondContact CA-O 3.4Å; Y33-V42 CarbonylContact C-O 3.39Å; Y33-V42 WeakPolarHBondContact CA-O 3.21Å; Y33-P43 HydrophobicContact CD1-CG 4.07Å; Y33-P43 HydrophobicContact CE1-CG 3.74Å; Y33-I66 HydrophobicContact CE1-CD1 4.45Å
34	N	91.2	Very high	87.8	Confident	21 Å²	21	55 Å²	55	11%	0.112	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	131.8	166	-67.3	-33.5	0	0	0	108.8	A36 V42 R44 E105	N34-A36 PolarHBondContact O-N 3.14Å; N34-V42 PolarHBondContact N-O 2.95Å; N34-V42 PolarHBondContact O-N 3.09Å; N34-R44 PolarHBondContact OD1-NE 3.26Å; N34-R44 PolarHBondContact OD1-NH2 3.18Å; N34-E105 PolarHBondContact ND2-OE2 3.38Å
35	E	88.8	Confident	88.4	Confident	143 Å²	143	52 Å²	52	67%	0.668	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.3	111.1	172.9	-170.2	177.7	173.3	0	0	109.5	Y41	E35-Y41 HydrophobicContact CB-CD1 4.46Å; E35-Y41 HydrophobicContact CB-CE1 4.19Å; E35-Y41 HydrophobicContact CG-CE1 4.08Å
36	A	86.4	Confident	88.9	Confident	34 Å²	34	53.2 Å²	53.2	28%	0.281	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	165.8	175.2	0	0	0	0	0	111.3	N34 G38 G39 K40 V42	N34-A36 PolarHBondContact O-N 3.14Å; A36-G38 PolarHBondContact O-N 3.37Å; A36-G39 PolarHBondContact O-N 2.77Å; A36-K40 WeakPolarHBondContact CA-O 3.33Å; A36-K40 HydrophobicContact CB-CB 4.35Å; A36-K40 WeakPolarHBondContact CB-O 3.21Å; A36-K40 PolarHBondContact N-O 3.4Å; A36-V42 HydrophobicContact CB-CG2 4.15Å
37	T	82	Confident	89.3	Confident	142 Å²	142	51.9 Å²	51.9	87%	0.871	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	132.2	177.4	48.3	0	0	0	0	111.9
38	G	79.1	Confident	89.8	Confident	76 Å²	76	49.5 Å²	49.5	78%	0.784	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.3	22.4	177.8	0	0	0	0	0	114.8	A36 K40	A36-G38 PolarHBondContact O-N 3.37Å; G38-K40 VanDerWaalsContact C-N 3.3Å; G38-K40 PolarHBondContact O-N 2.84Å
39	G	82.5	Confident	90.2	Very high	34 Å²	34	47.2 Å²	47.2	35%	0.351	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	30.2	177.3	0	0	0	0	0	112.9	A36	A36-G39 PolarHBondContact O-N 2.77Å
40	K	90.3	Very high	90.3	Very high	100 Å²	100	46.7 Å²	46.7	44%	0.435	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	128.9	178.1	-71.7	-168.5	174.8	-163.6	0	110.2	G16 T17 A36 G38	G16-K40 CarbonylContact O-C 3.47Å; G16-K40 WeakPolarHBondContact O-CA 3.38Å; T17-K40 HydrophobicContact CG2-CG 4.46Å; A36-K40 WeakPolarHBondContact CA-O 3.33Å; A36-K40 HydrophobicContact CB-CB 4.35Å; A36-K40 WeakPolarHBondContact CB-O 3.21Å; A36-K40 PolarHBondContact N-O 3.4Å; G38-K40 VanDerWaalsContact C-N 3.3Å; G38-K40 PolarHBondContact O-N 2.84Å
41	Y	92.5	Very high	90.2	Very high	25 Å²	25	47.4 Å²	47.4	10%	0.098	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	122.3	176.7	-64.2	-77.3	0	0	0	109.7	I12 G16 L26 I29 E35	I12-Y41 HydrophobicContact CD1-CD2 4.31Å; I12-Y41 HydrophobicContact CD1-CG 4.06Å; I12-Y41 HydrophobicContact CG1-CD2 4.37Å; G16-Y41 PolarHBondContact O-N 2.89Å; L26-Y41 HydrophobicContact CD2-CE2 4.1Å; I29-Y41 HydrophobicContact CG1-CD1 3.93Å; I29-Y41 HydrophobicContact CG1-CE1 4.14Å; I29-Y41 HydrophobicContact CG1-CG 4.41Å; I29-Y41 HydrophobicContact CG2-CD1 4.16Å; I29-Y41 HydrophobicContact CG2-CE1 3.65Å; E35-Y41 HydrophobicContact CB-CD1 4.46Å; E35-Y41 HydrophobicContact CB-CE1 4.19Å; E35-Y41 HydrophobicContact CG-CE1 4.08Å
42	V	92.6	Very high	90	Very high	27 Å²	27	48.6 Å²	48.6	16%	0.164	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	125.7	179.7	178.9	0	0	0	0	108.5	Y33 N34 A36 R44 R68	Y33-V42 CarbonylContact C-O 3.39Å; Y33-V42 WeakPolarHBondContact CA-O 3.21Å; N34-V42 PolarHBondContact N-O 2.95Å; N34-V42 PolarHBondContact O-N 3.09Å; A36-V42 HydrophobicContact CB-CG2 4.15Å; V42-R44 PolarHBondContact O-N 3.26Å; V42-R68 HydrophobicContact CG1-CB 4.18Å
43	P	94.1	Very high	89.7	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.8	133.4	174.3	-33.8	40.3	0	0	0	113.2	W3 Y33 A45 I66 F67	W3-P43 HydrophobicContact CD2-CB 3.95Å; W3-P43 HydrophobicContact CD2-CG 4.29Å; W3-P43 HydrophobicContact CE3-CB 3.6Å; W3-P43 HydrophobicContact CE3-CG 3.8Å; W3-P43 HydrophobicContact CH2-CB 3.76Å; W3-P43 HydrophobicContact CZ2-CB 4.09Å; W3-P43 HydrophobicContact CZ3-CB 3.51Å; W3-P43 HydrophobicContact CZ3-CG 4.05Å; Y33-P43 HydrophobicContact CD1-CG 4.07Å; Y33-P43 HydrophobicContact CE1-CG 3.74Å; P43-A45 HydrophobicContact CB-CB 4.11Å; P43-A45 PolarHBondContact O-N 3.49Å; P43-I66 HydrophobicContact CG-CD1 4.2Å; P43-I66 HydrophobicContact CG-CG1 4.37Å; P43-I66 HydrophobicContact CG-CG2 3.7Å; P43-F67 HydrophobicContact CB-CD1 4.06Å; P43-F67 HydrophobicContact CB-CE1 4.03Å; P43-F67 HydrophobicContact CG-CD1 4.25Å; P43-F67 HydrophobicContact CG-CE1 4.17Å
44	R	93.3	Very high	89.2	Confident	66 Å²	66	51.4 Å²	51.4	25%	0.249	31%	0.31	C	S	.	.			trans	-78.4	73.3	164.7	-168.5	-179.6	-62.8	143.2	2.3	108.7	V31 Y32 N34 V42 E105 C109	V31-R44 PolarHBondContact O-NH1 2.99Å; Y32-R44 PolarHBondContact O-N 3.41Å; N34-R44 PolarHBondContact OD1-NE 3.26Å; N34-R44 PolarHBondContact OD1-NH2 3.18Å; V42-R44 PolarHBondContact O-N 3.26Å; R44-E105 HydrophobicContact CG-CB 4.35Å; R44-C109 PolarHBondContact NE-SG 3.17Å; R44-C109 VanDerWaalsContact NE-SG 3.38Å; R44-C109 PolarHBondContact NH1-SG 2.73Å
45	A	94.1	Very high	88.8	Confident	11 Å²	11	50.8 Å²	50.8	9%	0.091	31%	0.307	C	S	.	.			trans	-125.1	143.5	-178.6	0	0	0	0	0	110.2	W3 P43 L47 F67 N71	W3-A45 HydrophobicContact CZ2-CB 3.61Å; P43-A45 HydrophobicContact CB-CB 4.11Å; P43-A45 PolarHBondContact O-N 3.49Å; A45-L47 HydrophobicContact CB-CD1 4.48Å; A45-F67 HydrophobicContact CB-CD1 3.93Å; A45-F67 HydrophobicContact CB-CE1 3.86Å; A45-N71 VanDerWaalsContact O-CB 3.29Å; A45-N71 WeakPolarHBondContact O-CB 3.24Å; A45-N71 PolarHBondContact O-ND2 3.32Å
46	I	94.8	Very high	88.6	Confident	54 Å²	54	49.2 Å²	49.2	28%	0.277	30%	0.303	S	S	.	.			trans	-120.4	123.8	170.8	-55.6	174	0	0	0	106.1	V48 V98 V101 V102	I46-V48 HydrophobicContact CG2-CG2 3.84Å; I46-V98 HydrophobicContact CG2-CG1 4.3Å; I46-V101 HydrophobicContact CD1-CB 4.36Å; I46-V101 HydrophobicContact CD1-CG1 3.89Å; I46-V101 HydrophobicContact CG1-CG1 3.89Å; I46-V101 HydrophobicContact CG2-CG1 4.17Å; I46-V102 HydrophobicContact CD1-CB 4.11Å; I46-V102 HydrophobicContact CD1-CG2 3.45Å; I46-V102 VanDerWaalsContact CD1-CG2 3.45Å
47	L	94.5	Very high	88.6	Confident	27 Å²	27	51.5 Å²	51.5	14%	0.141	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	118.7	-178.7	-61.8	98.1	0	0	0	107.9	A45 M55 V58 F67 N71 F72 V73	A45-L47 HydrophobicContact CB-CD1 4.48Å; L47-M55 HydrophobicContact CB-CE 4.45Å; L47-M55 HydrophobicContact CB-SD 4.16Å; L47-V58 HydrophobicContact CD2-CB 4.43Å; L47-V58 HydrophobicContact CD2-CG1 3.64Å; L47-V58 HydrophobicContact CD2-CG2 4.45Å; L47-F67 HydrophobicContact CD1-CB 4.18Å; L47-F67 HydrophobicContact CD1-CD1 3.91Å; L47-F67 HydrophobicContact CD1-CG 4.03Å; L47-N71 PolarHBondContact N-O 2.87Å; L47-F72 HydrophobicContact CB-CD1 4.09Å; L47-F72 HydrophobicContact CB-CE1 4.33Å; L47-F72 HydrophobicContact CD1-CD1 4.34Å; L47-F72 HydrophobicContact CD1-CD2 4.5Å; L47-F72 HydrophobicContact CD1-CE1 4.05Å; L47-F72 HydrophobicContact CD1-CE2 4.24Å; L47-F72 HydrophobicContact CD1-CZ 4.01Å; L47-F72 HydrophobicContact CD2-CD1 4.47Å; L47-F72 HydrophobicContact CD2-CE1 3.9Å; L47-F72 HydrophobicContact CD2-CZ 4.38Å; L47-F72 HydrophobicContact CG-CE1 4.33Å; L47-V73 PolarHBondContact O-N 2.82Å
48	V	93.8	Very high	88.9	Confident	47 Å²	47	47.1 Å²	47.1	29%	0.285	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.9	-174.2	-172.9	0	0	0	0	108.9	I46 V73 V98 M129	I46-V48 HydrophobicContact CG2-CG2 3.84Å; V48-V73 VanDerWaalsContact CA-O 3.32Å; V48-V73 WeakPolarHBondContact CA-O 3.39Å; V48-V98 HydrophobicContact CB-CG2 4.39Å; V48-V98 HydrophobicContact CG1-CG2 3.66Å; V48-V98 HydrophobicContact CG2-CB 4.4Å; V48-V98 HydrophobicContact CG2-CG1 3.66Å; V48-V98 HydrophobicContact CG2-CG2 3.76Å; V48-M129 HydrophobicContact CG1-CE 3.5Å; V48-M129 HydrophobicContact CG1-SD 3.78Å
49	D	93.8	Very high	89.2	Confident	27 Å²	27	47.1 Å²	47.1	14%	0.144	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	147.1	166.4	-158.3	-18.5	0	0	0	110.6	E51 T54 M55 V73 F74 G75	D49-E51 PolarHBondContact OD1-N 3.47Å; D49-E51 VanDerWaalsContact OD1-N 3.15Å; D49-T54 WeakPolarHBondContact CB-OG1 3.29Å; D49-T54 VanDerWaalsContact OD2-CB 3.25Å; D49-T54 WeakPolarHBondContact OD2-CB 3.37Å; D49-T54 WeakPolarHBondContact OD2-CG2 3.42Å; D49-T54 PolarHBondContact OD2-OG1 2.99Å; D49-M55 HydrophobicContact CB-CE 3.26Å; D49-V73 PolarHBondContact N-O 3.25Å; D49-F74 CarbonylContact O-C 3.44Å; D49-F74 WeakPolarHBondContact O-CA 3.48Å; D49-F74 WeakPolarHBondContact O-CB 3.34Å; D49-G75 PolarHBondContact O-N 3.27Å
50	L	89.9	Confident	89.4	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	28%	0.282	C	S	.	.	S	Bend	trans	-76.7	-19.8	173.2	-72.6	172.9	0	0	0	111.2	G75 S77 A79 E90 L94 T125 M129	L50-G75 CarbonylContact O-C 3.57Å; L50-G75 WeakPolarHBondContact O-CA 3.43Å; L50-S77 CarbonylContact C-O 3.57Å; L50-S77 WeakPolarHBondContact CB-O 3.37Å; L50-S77 CarbonylContact O-C 3.56Å; L50-S77 PolarHBondContact O-N 2.81Å; L50-A79 HydrophobicContact CD1-CB 3.95Å; L50-E90 HydrophobicContact CD1-CB 4.21Å; L50-E90 HydrophobicContact CD2-CB 4.16Å; L50-L94 HydrophobicContact CD2-CB 4.18Å; L50-L94 HydrophobicContact CD2-CD2 3.73Å; L50-T125 HydrophobicContact CB-CG2 4Å; L50-T125 HydrophobicContact CD1-CG2 3.92Å; L50-T125 HydrophobicContact CG-CG2 3.75Å; L50-M129 HydrophobicContact CD1-SD 4.41Å; L50-M129 HydrophobicContact CD2-SD 4.14Å; L50-M129 HydrophobicContact CG-SD 4.02Å
51	E	87.2	Confident	89.2	Confident	92 Å²	92	46.6 Å²	46.6	43%	0.43	27%	0.273	S	S	.	.	S	Bend	trans	-97.7	131.8	175.4	-65.3	-174.3	178.7	0	0	112.7	D49 G53 T54	D49-E51 PolarHBondContact OD1-N 3.47Å; D49-E51 VanDerWaalsContact OD1-N 3.15Å; E51-G53 VanDerWaalsContact C-N 3.34Å; E51-G53 PolarHBondContact O-N 3.49Å; E51-T54 PolarHBondContact O-OG1 3.27Å
52	P	84.4	Confident	88.9	Confident	62 Å²	62	49.5 Å²	49.5	40%	0.403	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-25.5	179.9	27.7	-34.3	0	0	0	113.3	T54 M55 F74	P52-T54 VanDerWaalsContact C-N 3.31Å; P52-T54 PolarHBondContact O-N 2.83Å; P52-M55 WeakPolarHBondContact O-CB 3.31Å; P52-M55 PolarHBondContact O-N 2.97Å; P52-F74 HydrophobicContact CB-CD2 4.09Å; P52-F74 HydrophobicContact CB-CE2 4.48Å
53	G	84.9	Confident	88.8	Confident	41 Å²	41	49.6 Å²	49.6	42%	0.423	29%	0.294	S	S	.	.	H	α-helix	trans	-68.3	-25.4	-171.5	0	0	0	0	0	114.8	E51 M55 S57	E51-G53 VanDerWaalsContact C-N 3.34Å; E51-G53 PolarHBondContact O-N 3.49Å; G53-M55 VanDerWaalsContact C-N 3.31Å; G53-S57 PolarHBondContact O-N 2.7Å; G53-S57 PolarHBondContact O-OG 3.19Å
54	T	82.8	Confident	88.4	Confident	47 Å²	47	49.8 Å²	49.8	29%	0.288	30%	0.295	S	S	.	.	H	α-helix	trans	-70.2	-32	177	56.5	0	0	0	0	111.4	D49 E51 P52 D56 S57 V58	D49-T54 WeakPolarHBondContact CB-OG1 3.29Å; D49-T54 VanDerWaalsContact OD2-CB 3.25Å; D49-T54 WeakPolarHBondContact OD2-CB 3.37Å; D49-T54 WeakPolarHBondContact OD2-CG2 3.42Å; D49-T54 PolarHBondContact OD2-OG1 2.99Å; E51-T54 PolarHBondContact O-OG1 3.27Å; P52-T54 VanDerWaalsContact C-N 3.31Å; P52-T54 PolarHBondContact O-N 2.83Å; T54-D56 PolarHBondContact O-N 2.95Å; T54-S57 WeakPolarHBondContact O-CB 3.48Å; T54-S57 PolarHBondContact O-N 2.79Å; T54-V58 WeakPolarHBondContact O-CG2 3.37Å; T54-V58 PolarHBondContact O-N 3.03Å
55	M	82.8	Confident	88.1	Confident	9 Å²	9	53.8 Å²	53.8	4%	0.044	32%	0.317	C	S	.	.	H	α-helix	trans	-66.4	-39.2	179.4	-58.8	-58.4	144.1	0	0	112.3	L47 D49 P52 G53 S57 V58 R59 F72 F74	L47-M55 HydrophobicContact CB-CE 4.45Å; L47-M55 HydrophobicContact CB-SD 4.16Å; D49-M55 HydrophobicContact CB-CE 3.26Å; P52-M55 WeakPolarHBondContact O-CB 3.31Å; P52-M55 PolarHBondContact O-N 2.97Å; G53-M55 VanDerWaalsContact C-N 3.31Å; M55-S57 VanDerWaalsContact C-N 3.3Å; M55-S57 PolarHBondContact O-N 3.45Å; M55-V58 PolarHBondContact O-N 2.95Å; M55-R59 WeakPolarHBondContact O-CG 2.81Å; M55-R59 PolarHBondContact O-N 2.89Å; M55-F72 HydrophobicContact CB-CD1 4.41Å; M55-F72 HydrophobicContact CG-CD1 4.43Å; M55-F72 HydrophobicContact SD-CD1 3.56Å; M55-F72 VanDerWaalsContact SD-CD1 3.56Å; M55-F72 HydrophobicContact SD-CE1 4.22Å; M55-F74 HydrophobicContact CG-CB 3.99Å; M55-F74 HydrophobicContact CG-CD1 4.14Å; M55-F74 HydrophobicContact CG-CG 4.18Å
56	D	84.5	Confident	87.9	Confident	110 Å²	110	53.8 Å²	53.8	59%	0.588	32%	0.315	S	S	*	.	H	α-helix	trans	-65.5	-37.7	175.4	-70.7	-24.7	0	0	0	111.5	T54 R59 S60	T54-D56 PolarHBondContact O-N 2.95Å; D56-R59 PolarHBondContact O-N 2.99Å; D56-S60 WeakPolarHBondContact O-CB 3.42Å; D56-S60 PolarHBondContact O-N 2.65Å; D56-S60 PolarHBondContact O-OG 3.47Å
57	S	86.9	Confident	87.8	Confident	81 Å²	81	52.2 Å²	52.2	57%	0.566	31%	0.307	S	S	*	.	H	α-helix	trans	-65.8	-39.3	175.7	-58.4	0	0	0	0	111.6	G53 T54 M55 S60 G61	G53-S57 PolarHBondContact O-N 2.7Å; G53-S57 PolarHBondContact O-OG 3.19Å; T54-S57 WeakPolarHBondContact O-CB 3.48Å; T54-S57 PolarHBondContact O-N 2.79Å; M55-S57 VanDerWaalsContact C-N 3.3Å; M55-S57 PolarHBondContact O-N 3.45Å; S57-S60 WeakPolarHBondContact CA-OG 3.3Å; S57-S60 PolarHBondContact O-OG 3.02Å; S57-S60 VanDerWaalsContact O-OG 3.07Å; S57-G61 PolarHBondContact O-N 3.43Å
58	V	87.6	Confident	87.5	Confident	50 Å²	50	54.5 Å²	54.5	30%	0.303	31%	0.313	S	S	.	.	H	α-helix	trans	-69.8	-44.4	176.3	175.6	0	0	0	0	111.4	L47 T54 M55 S60 G61 G64 F67 F72	L47-V58 HydrophobicContact CD2-CB 4.43Å; L47-V58 HydrophobicContact CD2-CG1 3.64Å; L47-V58 HydrophobicContact CD2-CG2 4.45Å; T54-V58 WeakPolarHBondContact O-CG2 3.37Å; T54-V58 PolarHBondContact O-N 3.03Å; M55-V58 PolarHBondContact O-N 2.95Å; V58-S60 VanDerWaalsContact C-N 3.3Å; V58-S60 PolarHBondContact O-N 2.65Å; V58-G61 PolarHBondContact O-N 3.44Å; V58-G61 VanDerWaalsContact O-N 3.08Å; V58-G64 WeakPolarHBondContact O-CA 3.24Å; V58-F67 HydrophobicContact CG1-CD2 4.29Å; V58-F67 HydrophobicContact CG1-CE2 4.14Å; V58-F72 HydrophobicContact CG1-CE1 4.41Å
59	R	85.6	Confident	87.3	Confident	77 Å²	77	56.4 Å²	56.4	29%	0.291	33%	0.327	S	S	.	.	H	α-helix	trans	-65	-32.6	179.3	-72.3	-177.8	-147.3	-103.4	2.3	113.1	M55 D56 G61 Q65 F72	M55-R59 WeakPolarHBondContact O-CG 2.81Å; M55-R59 PolarHBondContact O-N 2.89Å; D56-R59 PolarHBondContact O-N 2.99Å; R59-G61 VanDerWaalsContact C-N 3.28Å; R59-Q65 PolarHBondContact O-NE2 3.41Å; R59-F72 HydrophobicContact CG-CE1 4.13Å; R59-F72 HydrophobicContact CG-CZ 4.15Å
60	S	87.8	Confident	87.1	Confident	97 Å²	97	60.1 Å²	60.1	68%	0.678	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-10.4	175.1	58.6	0	0	0	0	113.6	D56 S57 V58	D56-S60 WeakPolarHBondContact O-CB 3.42Å; D56-S60 PolarHBondContact O-N 2.65Å; D56-S60 PolarHBondContact O-OG 3.47Å; S57-S60 WeakPolarHBondContact CA-OG 3.3Å; S57-S60 PolarHBondContact O-OG 3.02Å; S57-S60 VanDerWaalsContact O-OG 3.07Å; V58-S60 VanDerWaalsContact C-N 3.3Å; V58-S60 PolarHBondContact O-N 2.65Å
61	G	86.4	Confident	87.2	Confident	25 Å²	25	60.1 Å²	60.1	26%	0.258	35%	0.347	S	S	.	.	S	Bend	trans	-64.9	164.6	173.5	0	0	0	0	0	113.3	S57 V58 R59 F63 G64	S57-G61 PolarHBondContact O-N 3.43Å; V58-G61 PolarHBondContact O-N 3.44Å; V58-G61 VanDerWaalsContact O-N 3.08Å; R59-G61 VanDerWaalsContact C-N 3.28Å; G61-F63 VanDerWaalsContact C-N 3.27Å; G61-F63 PolarHBondContact O-N 2.9Å; G61-G64 PolarHBondContact O-N 2.63Å
62	P	86.3	Confident	87.4	Confident	86 Å²	86	56.5 Å²	56.5	56%	0.558	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-33.7	-172.8	23.9	-33.9	0	0	0	113.5	E4 P14	E4-P62 HydrophobicContact CG-CG 4.38Å; E4-P62 WeakPolarHBondContact OE2-CG 3.48Å; P14-P62 WeakPolarHBondContact CB-O 3.25Å
63	F	88.5	Confident	87.7	Confident	30 Å²	30	54.3 Å²	54.3	13%	0.132	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	16	176.1	-75.8	-101.5	0	0	0	112.2	E4 S7 I12 P14 G61 Q65 I66	E4-F63 HydrophobicContact CB-CD2 3.96Å; E4-F63 HydrophobicContact CB-CE2 4.24Å; E4-F63 HydrophobicContact CG-CB 4.1Å; E4-F63 HydrophobicContact CG-CD2 3.64Å; E4-F63 HydrophobicContact CG-CE2 4.4Å; E4-F63 HydrophobicContact CG-CG 4.11Å; S7-F63 VanDerWaalsContact CB-CE1 3.46Å; I12-F63 WeakPolarHBondContact O-CE1 3.4Å; P14-F63 HydrophobicContact CB-CD1 4.4Å; P14-F63 HydrophobicContact CG-CD1 4.31Å; P14-F63 HydrophobicContact CG-CD2 4.48Å; P14-F63 HydrophobicContact CG-CE1 4.09Å; P14-F63 HydrophobicContact CG-CE2 4.3Å; P14-F63 HydrophobicContact CG-CZ 4.1Å; G61-F63 VanDerWaalsContact C-N 3.27Å; G61-F63 PolarHBondContact O-N 2.9Å; F63-Q65 PolarHBondContact O-N 3.19Å; F63-Q65 VanDerWaalsContact O-N 3.14Å; F63-I66 HydrophobicContact CB-CG2 4.36Å; F63-I66 WeakPolarHBondContact O-CG2 3.47Å; F63-I66 PolarHBondContact O-N 3.25Å
64	G	86.3	Confident	88	Confident	4 Å²	4	56.9 Å²	56.9	4%	0.041	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-61.3	-26.9	-175.4	0	0	0	0	0	114.6	V58 G61	V58-G64 WeakPolarHBondContact O-CA 3.24Å; G61-G64 PolarHBondContact O-N 2.63Å
65	Q	87.3	Confident	88.2	Confident	151 Å²	151	55.2 Å²	55.2	71%	0.706	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-83.2	-10.8	-176.9	-57.6	-58.7	-43.8	0	0	114	R59 F63 F67	R59-Q65 PolarHBondContact O-NE2 3.41Å; F63-Q65 PolarHBondContact O-N 3.19Å; F63-Q65 VanDerWaalsContact O-N 3.14Å; Q65-F67 VanDerWaalsContact C-N 3.33Å
66	I	90.9	Very high	88.3	Confident	10 Å²	10	64 Å²	64	5%	0.051	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-77.7	-24.3	-179.9	-154.7	-178.2	0	0	0	111.8	I12 Y33 P43 F63	I12-I66 HydrophobicContact CG2-CD1 3.72Å; Y33-I66 HydrophobicContact CE1-CD1 4.45Å; P43-I66 HydrophobicContact CG-CD1 4.2Å; P43-I66 HydrophobicContact CG-CG1 4.37Å; P43-I66 HydrophobicContact CG-CG2 3.7Å; F63-I66 HydrophobicContact CB-CG2 4.36Å; F63-I66 WeakPolarHBondContact O-CG2 3.47Å; F63-I66 PolarHBondContact O-N 3.25Å
67	F	91.7	Very high	88.3	Confident	22 Å²	22	61 Å²	61	10%	0.096	34%	0.335	C	S	.	.	S	Bend	trans	-73.2	140.8	-177.7	-63.5	-70.2	0	0	0	111.2	W3 P43 A45 L47 V58 Q65 P69 F72	W3-F67 HydrophobicContact CB-CE1 4.3Å; W3-F67 HydrophobicContact CB-CZ 3.87Å; W3-F67 AromaticContact CD1-CE1 3.56Å; W3-F67 AromaticContact CD1-CZ 3.59Å; W3-F67 HydrophobicContact CD2-CE1 4.2Å; W3-F67 AromaticContact CG-CE1 3.77Å; W3-F67 HydrophobicContact CG-CE1 3.77Å; W3-F67 AromaticContact CG-CZ 3.76Å; W3-F67 HydrophobicContact CG-CZ 3.76Å; W3-F67 AromaticContact NE1-CE1 3.9Å; P43-F67 HydrophobicContact CB-CD1 4.06Å; P43-F67 HydrophobicContact CB-CE1 4.03Å; P43-F67 HydrophobicContact CG-CD1 4.25Å; P43-F67 HydrophobicContact CG-CE1 4.17Å; A45-F67 HydrophobicContact CB-CD1 3.93Å; A45-F67 HydrophobicContact CB-CE1 3.86Å; L47-F67 HydrophobicContact CD1-CB 4.18Å; L47-F67 HydrophobicContact CD1-CD1 3.91Å; L47-F67 HydrophobicContact CD1-CG 4.03Å; V58-F67 HydrophobicContact CG1-CD2 4.29Å; V58-F67 HydrophobicContact CG1-CE2 4.14Å; Q65-F67 VanDerWaalsContact C-N 3.33Å; F67-P69 WeakPolarHBondContact O-CD 3.37Å; F67-F72 HydrophobicContact CB-CE2 3.57Å; F67-F72 HydrophobicContact CB-CZ 3.62Å; F67-F72 HydrophobicContact CD2-CZ 4.4Å; F67-F72 HydrophobicContact CG-CZ 4.28Å
68	R	89.3	Confident	88.2	Confident	74 Å²	74	58.3 Å²	58.3	28%	0.279	32%	0.32	S	S	.	.			trans	-65.2	123.5	175.7	-174.3	176.3	-73.3	165.6	-5.5	109.5	V42 D70 N71 F72 E105	V42-R68 HydrophobicContact CG1-CB 4.18Å; R68-D70 HydrophobicContact CG-CB 4.11Å; R68-D70 PolarHBondContact O-N 3.43Å; R68-N71 HydrophobicContact CB-CB 4.31Å; R68-N71 WeakPolarHBondContact CD-OD1 3.19Å; R68-N71 PolarHBondContact O-N 3.41Å; R68-F72 VanDerWaalsContact O-CD2 3.26Å; R68-F72 WeakPolarHBondContact O-CD2 3.14Å; R68-F72 WeakPolarHBondContact O-CE2 2.77Å; R68-E105 IonicContact CZ-OE1 3.55Å; R68-E105 IonicContact NH1-OE1 3.75Å; R68-E105 PolarHBondContact NH1-OE1 2.81Å
69	P	88.3	Confident	88	Confident	88 Å²	88	56 Å²	56	57%	0.571	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-57.2	-32.7	-179.9	-28.1	36.4	0	0	0	114.1	F67 N71 F72	F67-P69 WeakPolarHBondContact O-CD 3.37Å; P69-N71 PolarHBondContact O-N 3.2Å; P69-F72 WeakPolarHBondContact O-CD2 3.42Å; P69-F72 PolarHBondContact O-N 2.75Å
70	D	89.5	Confident	88	Confident	105 Å²	105	54.9 Å²	54.9	56%	0.561	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-67	-20.2	177.8	-58.1	-9.6	0	0	0	113.3	R68 F72 K104	R68-D70 HydrophobicContact CG-CB 4.11Å; R68-D70 PolarHBondContact O-N 3.43Å; D70-F72 VanDerWaalsContact C-N 3.3Å; D70-K104 IonicContact OD2-NZ 2.76Å
71	N	91.5	Very high	88.1	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.011	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-92.2	7.3	-176.8	-64.9	14.4	0	0	0	112.5	A45 L47 R68 P69 V101 E105	A45-N71 VanDerWaalsContact O-CB 3.29Å; A45-N71 WeakPolarHBondContact O-CB 3.24Å; A45-N71 PolarHBondContact O-ND2 3.32Å; L47-N71 PolarHBondContact N-O 2.87Å; R68-N71 HydrophobicContact CB-CB 4.31Å; R68-N71 WeakPolarHBondContact CD-OD1 3.19Å; R68-N71 PolarHBondContact O-N 3.41Å; P69-N71 PolarHBondContact O-N 3.2Å; N71-V101 HydrophobicContact CB-CG1 4.27Å; N71-E105 PolarHBondContact ND2-OE1 3.38Å
72	F	91.8	Very high	88.4	Confident	16 Å²	16	52.6 Å²	52.6	7%	0.07	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	105.6	171.5	-70.5	-99.6	0	0	0	108.7	L47 M55 V58 R59 F67 R68 P69 D70 F74	L47-F72 HydrophobicContact CB-CD1 4.09Å; L47-F72 HydrophobicContact CB-CE1 4.33Å; L47-F72 HydrophobicContact CD1-CD1 4.34Å; L47-F72 HydrophobicContact CD1-CD2 4.5Å; L47-F72 HydrophobicContact CD1-CE1 4.05Å; L47-F72 HydrophobicContact CD1-CE2 4.24Å; L47-F72 HydrophobicContact CD1-CZ 4.01Å; L47-F72 HydrophobicContact CD2-CD1 4.47Å; L47-F72 HydrophobicContact CD2-CE1 3.9Å; L47-F72 HydrophobicContact CD2-CZ 4.38Å; L47-F72 HydrophobicContact CG-CE1 4.33Å; M55-F72 HydrophobicContact CB-CD1 4.41Å; M55-F72 HydrophobicContact CG-CD1 4.43Å; M55-F72 HydrophobicContact SD-CD1 3.56Å; M55-F72 VanDerWaalsContact SD-CD1 3.56Å; M55-F72 HydrophobicContact SD-CE1 4.22Å; V58-F72 HydrophobicContact CG1-CE1 4.41Å; R59-F72 HydrophobicContact CG-CE1 4.13Å; R59-F72 HydrophobicContact CG-CZ 4.15Å; F67-F72 HydrophobicContact CB-CE2 3.57Å; F67-F72 HydrophobicContact CB-CZ 3.62Å; F67-F72 HydrophobicContact CD2-CZ 4.4Å; F67-F72 HydrophobicContact CG-CZ 4.28Å; R68-F72 VanDerWaalsContact O-CD2 3.26Å; R68-F72 WeakPolarHBondContact O-CD2 3.14Å; R68-F72 WeakPolarHBondContact O-CE2 2.77Å; P69-F72 WeakPolarHBondContact O-CD2 3.42Å; P69-F72 PolarHBondContact O-N 2.75Å; D70-F72 VanDerWaalsContact C-N 3.3Å; F72-F74 HydrophobicContact CB-CD1 4.47Å
73	V	91.8	Very high	88.8	Confident	15 Å²	15	48.8 Å²	48.8	9%	0.091	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	116.1	176.6	-176	0	0	0	0	107.5	L47 V48 D49 L94 V98 V101	L47-V73 PolarHBondContact O-N 2.82Å; V48-V73 VanDerWaalsContact CA-O 3.32Å; V48-V73 WeakPolarHBondContact CA-O 3.39Å; D49-V73 PolarHBondContact N-O 3.25Å; V73-L94 HydrophobicContact CG1-CD1 3.66Å; V73-L94 HydrophobicContact CG1-CD2 4.32Å; V73-L94 HydrophobicContact CG1-CG 3.93Å; V73-V98 HydrophobicContact CB-CG2 3.99Å; V73-V98 HydrophobicContact CG1-CG2 3.59Å; V73-V98 HydrophobicContact CG2-CG2 4.45Å; V73-V101 HydrophobicContact CG2-CG2 3.84Å
74	F	90.8	Very high	89	Confident	96 Å²	96	47.3 Å²	47.3	42%	0.421	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	145.9	-177.5	59.9	-86.9	0	0	0	113.8	D49 P52 M55 F72	D49-F74 CarbonylContact O-C 3.44Å; D49-F74 WeakPolarHBondContact O-CA 3.48Å; D49-F74 WeakPolarHBondContact O-CB 3.34Å; P52-F74 HydrophobicContact CB-CD2 4.09Å; P52-F74 HydrophobicContact CB-CE2 4.48Å; M55-F74 HydrophobicContact CG-CB 3.99Å; M55-F74 HydrophobicContact CG-CD1 4.14Å; M55-F74 HydrophobicContact CG-CG 4.18Å; F72-F74 HydrophobicContact CB-CD1 4.47Å
75	G	87.6	Confident	89.3	Confident	11 Å²	11	50.1 Å²	50.1	11%	0.113	27%	0.272	C	S	.	.			trans	-82.9	175.9	174	0	0	0	0	0	112.8	D49 L50	D49-G75 PolarHBondContact O-N 3.27Å; L50-G75 CarbonylContact O-C 3.57Å; L50-G75 WeakPolarHBondContact O-CA 3.43Å
76	Q	84.9	Confident	89.5	Confident	195 Å²	195	42.9 Å²	42.9	91%	0.911	24%	0.238	S	C	*	.	S	Bend	trans	-104.6	-13.5	169.9	-62.9	-171.7	3.3	0	0	112.5
77	S	83.5	Confident	89.7	Confident	45 Å²	45	43.2 Å²	43.2	32%	0.315	24%	0.24	S	C	.	.	S	Bend	trans	-123.9	122.9	-172	-174.4	0	0	0	0	108.4	L50 E90	L50-S77 CarbonylContact C-O 3.57Å; L50-S77 WeakPolarHBondContact CB-O 3.37Å; L50-S77 CarbonylContact O-C 3.56Å; L50-S77 PolarHBondContact O-N 2.81Å; S77-E90 VanDerWaalsContact CB-CD 3.47Å; S77-E90 WeakPolarHBondContact CB-OE1 3.35Å; S77-E90 WeakPolarHBondContact CB-OE2 3.29Å; S77-E90 VanDerWaalsContact OG-CD 3.3Å; S77-E90 PolarHBondContact OG-OE1 2.98Å
78	G	84.4	Confident	89.7	Confident	25 Å²	25	47 Å²	47	26%	0.258	25%	0.254	S	S	.	.			trans	-80	152.4	179.2	0	0	0	0	0	112.8	G80	G78-G80 PolarHBondContact O-N 2.89Å
79	A	84.4	Confident	89.8	Confident	2 Å²	2	45.4 Å²	45.4	2%	0.017	25%	0.252	C	S	.	.			trans	-70.3	-17	176.7	0	0	0	0	0	113.7	L50 N81 N82 K85	L50-A79 HydrophobicContact CD1-CB 3.95Å; A79-N81 VanDerWaalsContact C-N 3.35Å; A79-N81 PolarHBondContact O-N 3.32Å; A79-N82 WeakPolarHBondContact O-CB 3.47Å; A79-N82 PolarHBondContact O-N 3Å; A79-K85 HydrophobicContact CB-CB 4.42Å
80	G	86.2	Confident	89.8	Confident	53 Å²	53	44 Å²	44	55%	0.546	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	39.7	175.9	0	0	0	0	0	114.5	G78 N82	G78-G80 PolarHBondContact O-N 2.89Å; G80-N82 PolarHBondContact O-N 3.25Å
81	N	88.6	Confident	89.8	Confident	67 Å²	67	39 Å²	39	36%	0.358	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	27.1	-174.4	-63.5	-34	0	0	0	114.9	A79 T160 V162 N166	A79-N81 VanDerWaalsContact C-N 3.35Å; A79-N81 PolarHBondContact O-N 3.32Å; N81-T160 HydrophobicContact CB-CG2 4.08Å; N81-V162 HydrophobicContact CB-CG2 4.29Å; N81-V162 WeakPolarHBondContact O-CG2 3.41Å; N81-N166 PolarHBondContact O-ND2 2.62Å
82	N	92.2	Very high	89.8	Confident	8 Å²	8	40.6 Å²	40.6	4%	0.043	23%	0.225	C	C	.	.			trans	-109.7	114.7	174.5	-172.7	-17.8	0	0	0	110.3	A79 G80 A84 K85 G86 G124 W379 Y380	A79-N82 WeakPolarHBondContact O-CB 3.47Å; A79-N82 PolarHBondContact O-N 3Å; G80-N82 PolarHBondContact O-N 3.25Å; N82-A84 VanDerWaalsContact C-N 3.35Å; N82-A84 PolarHBondContact O-N 3.09Å; N82-A84 WeakPolarHBondContact OD1-CB 3.4Å; N82-A84 PolarHBondContact OD1-N 2.8Å; N82-K85 HydrophobicContact CB-CB 4.21Å; N82-K85 HydrophobicContact CB-CD 4.26Å; N82-K85 HydrophobicContact CB-CG 4.09Å; N82-K85 PolarHBondContact O-N 2.91Å; N82-G86 PolarHBondContact O-N 3.07Å; N82-G124 WeakPolarHBondContact O-CA 3.07Å; N82-W379 PolarHBondContact ND2-O 2.74Å; N82-Y380 WeakPolarHBondContact OD1-CD1 3.4Å; N82-Y380 WeakPolarHBondContact OD1-CE1 3.21Å
83	W	94.8	Very high	89.8	Confident	5 Å²	5	47.2 Å²	47.2	2%	0.019	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-41	176.9	-176.4	98.1	0	0	0	112.6	K85 G86 H87 Y88 G128 N166 L169 S170 Q173 Y380 M385	W83-K85 VanDerWaalsContact C-N 3.26Å; W83-K85 PolarHBondContact O-N 3.2Å; W83-G86 CarbonylContact O-C 3.59Å; W83-G86 PolarHBondContact O-N 3.09Å; W83-H87 HydrophobicContact CD2-CB 4.12Å; W83-H87 HydrophobicContact CE3-CB 3.88Å; W83-H87 HydrophobicContact CH2-CB 3.75Å; W83-H87 AromaticContact CH2-CD2 3.42Å; W83-H87 VanDerWaalsContact CH2-CD2 3.42Å; W83-H87 WeakPolarHBondContact CH2-CD2 2.97Å; W83-H87 AromaticContact CH2-CE1 3.95Å; W83-H87 AromaticContact CH2-CG 3.32Å; W83-H87 AromaticContact CH2-ND1 3.68Å; W83-H87 AromaticContact CH2-NE2 3.83Å; W83-H87 HydrophobicContact CZ2-CB 4.01Å; W83-H87 AromaticContact CZ2-CE1 3.91Å; W83-H87 AromaticContact CZ2-CG 3.59Å; W83-H87 AromaticContact CZ2-ND1 3.49Å; W83-H87 WeakPolarHBondContact CZ2-ND1 3.32Å; W83-H87 HydrophobicContact CZ3-CB 3.69Å; W83-H87 AromaticContact CZ3-CD2 3.92Å; W83-H87 AromaticContact CZ3-CG 3.77Å; W83-H87 WeakPolarHBondContact O-CB 3.39Å; W83-H87 PolarHBondContact O-N 3.19Å; W83-Y88 HydrophobicContact CZ3-CD2 4.44Å; W83-Y88 AromaticContact CZ3-CE2 3.89Å; W83-Y88 HydrophobicContact CZ3-CE2 3.89Å; W83-G128 VanDerWaalsContact CD1-N 3.31Å; W83-N166 HydrophobicContact CB-CB 4.17Å; W83-N166 WeakPolarHBondContact CB-OD1 3.16Å; W83-N166 PolarHBondContact N-OD1 2.85Å; W83-L169 HydrophobicContact CB-CD1 4.34Å; W83-L169 HydrophobicContact CD2-CB 3.82Å; W83-L169 HydrophobicContact CD2-CD1 3.91Å; W83-L169 HydrophobicContact CE3-CB 4.19Å; W83-L169 HydrophobicContact CE3-CD1 3.7Å; W83-L169 HydrophobicContact CE3-CG 4.5Å; W83-L169 HydrophobicContact CG-CB 4.18Å; W83-L169 HydrophobicContact CG-CD1 4.2Å; W83-L169 HydrophobicContact CH2-CB 4.5Å; W83-L169 HydrophobicContact CZ2-CB 4.14Å; W83-L169 HydrophobicContact CZ3-CD1 4.31Å; W83-S170 VanDerWaalsContact CD1-OG 3.26Å; W83-S170 PolarHBondContact NE1-OG 3.25Å; W83-S170 VanDerWaalsContact NE1-OG 3.16Å; W83-Q173 HydrophobicContact CZ2-CG 4.22Å; W83-Y380 HydrophobicContact CB-CE1 4.1Å; W83-M385 HydrophobicContact CE3-SD 4.36Å; W83-M385 HydrophobicContact CZ3-SD 4.3Å
84	A	93.8	Very high	89.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.5	-34.1	-178.3	0	0	0	0	0	111.9	N82 H87 Y88 Y380 E383 M385	N82-A84 VanDerWaalsContact C-N 3.35Å; N82-A84 PolarHBondContact O-N 3.09Å; N82-A84 WeakPolarHBondContact OD1-CB 3.4Å; N82-A84 PolarHBondContact OD1-N 2.8Å; A84-H87 PolarHBondContact O-N 3.49Å; A84-Y88 HydrophobicContact CB-CD2 4.42Å; A84-Y88 WeakPolarHBondContact O-CB 3.43Å; A84-Y88 PolarHBondContact O-N 2.71Å; A84-Y380 HydrophobicContact CB-CD1 3.95Å; A84-E383 HydrophobicContact CB-CB 3.89Å; A84-E383 HydrophobicContact CB-CG 4.33Å; A84-M385 HydrophobicContact CB-CB 4.45Å; A84-M385 HydrophobicContact CB-SD 4.29Å
85	K	92.4	Very high	89.9	Confident	62 Å²	62	43.3 Å²	43.3	27%	0.27	24%	0.239	S	C	.	.	H	α-helix	trans	-64.3	-44.2	172.6	-75.3	-168.9	168.2	-165.2	0	113	A79 N82 W83 H87 T89 E90 G91 E383	A79-K85 HydrophobicContact CB-CB 4.42Å; N82-K85 HydrophobicContact CB-CB 4.21Å; N82-K85 HydrophobicContact CB-CD 4.26Å; N82-K85 HydrophobicContact CB-CG 4.09Å; N82-K85 PolarHBondContact O-N 2.91Å; W83-K85 VanDerWaalsContact C-N 3.26Å; W83-K85 PolarHBondContact O-N 3.2Å; K85-H87 VanDerWaalsContact C-N 3.29Å; K85-H87 PolarHBondContact O-N 2.95Å; K85-T89 VanDerWaalsContact CA-OG1 3.29Å; K85-T89 WeakPolarHBondContact CA-OG1 3.35Å; K85-T89 CarbonylContact O-C 3.56Å; K85-T89 PolarHBondContact O-N 2.89Å; K85-T89 PolarHBondContact O-OG1 3.13Å; K85-E90 PolarHBondContact O-N 3.25Å; K85-G91 PolarHBondContact O-N 3.07Å; K85-E383 VanDerWaalsContact CE-CD 3.45Å; K85-E383 WeakPolarHBondContact CE-OE1 3.34Å; K85-E383 VanDerWaalsContact CG-CD 3.47Å; K85-E383 HydrophobicContact CG-CG 3.75Å; K85-E383 WeakPolarHBondContact CG-OE2 3.49Å; K85-E383 IonicContact NZ-OE1 3.9Å
86	G	92.3	Very high	90.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66.3	-32.4	176.4	0	0	0	0	0	112.6	N82 W83 G91 M129	N82-G86 PolarHBondContact O-N 3.07Å; W83-G86 CarbonylContact O-C 3.59Å; W83-G86 PolarHBondContact O-N 3.09Å; G86-G91 WeakPolarHBondContact O-CA 3.42Å; G86-M129 VanDerWaalsContact O-CA 3.22Å; G86-M129 WeakPolarHBondContact O-CA 3.3Å; G86-M129 WeakPolarHBondContact O-CB 3.42Å; G86-M129 PolarHBondContact O-N 3.14Å
87	H	93.6	Very high	90.6	Very high	17 Å²	17	41.2 Å²	41.2	8%	0.079	24%	0.236	C	C	.	.	H	α-helix	trans	-93	-40.2	-172.7	-159.3	79.3	0	0	0	114.1	W83 A84 K85 G128 T131 L132	W83-H87 HydrophobicContact CD2-CB 4.12Å; W83-H87 HydrophobicContact CE3-CB 3.88Å; W83-H87 HydrophobicContact CH2-CB 3.75Å; W83-H87 AromaticContact CH2-CD2 3.42Å; W83-H87 VanDerWaalsContact CH2-CD2 3.42Å; W83-H87 WeakPolarHBondContact CH2-CD2 2.97Å; W83-H87 AromaticContact CH2-CE1 3.95Å; W83-H87 AromaticContact CH2-CG 3.32Å; W83-H87 AromaticContact CH2-ND1 3.68Å; W83-H87 AromaticContact CH2-NE2 3.83Å; W83-H87 HydrophobicContact CZ2-CB 4.01Å; W83-H87 AromaticContact CZ2-CE1 3.91Å; W83-H87 AromaticContact CZ2-CG 3.59Å; W83-H87 AromaticContact CZ2-ND1 3.49Å; W83-H87 WeakPolarHBondContact CZ2-ND1 3.32Å; W83-H87 HydrophobicContact CZ3-CB 3.69Å; W83-H87 AromaticContact CZ3-CD2 3.92Å; W83-H87 AromaticContact CZ3-CG 3.77Å; W83-H87 WeakPolarHBondContact O-CB 3.39Å; W83-H87 PolarHBondContact O-N 3.19Å; A84-H87 PolarHBondContact O-N 3.49Å; K85-H87 VanDerWaalsContact C-N 3.29Å; K85-H87 PolarHBondContact O-N 2.95Å; H87-G128 PolarHBondContact ND1-O 3.21Å; H87-T131 PolarHBondContact ND1-OG1 3.12Å; H87-L132 WeakPolarHBondContact O-CD2 3.28Å
88	Y	91.8	Very high	91.1	Very high	101 Å²	101	39.1 Å²	39.1	40%	0.396	22%	0.221	S	C	.	.	H	α-helix	trans	-111.7	-26.1	-170.6	-68	-61.7	0	0	0	114.7	W83 A84 M385 E389	W83-Y88 HydrophobicContact CZ3-CD2 4.44Å; W83-Y88 AromaticContact CZ3-CE2 3.89Å; W83-Y88 HydrophobicContact CZ3-CE2 3.89Å; A84-Y88 HydrophobicContact CB-CD2 4.42Å; A84-Y88 WeakPolarHBondContact O-CB 3.43Å; A84-Y88 PolarHBondContact O-N 2.71Å; Y88-M385 HydrophobicContact CE2-CB 4.36Å; Y88-M385 HydrophobicContact CE2-CG 4.12Å; Y88-E389 PolarHBondContact OH-OE2 3.28Å
89	T	90.9	Very high	91.6	Very high	40 Å²	40	38.1 Å²	38.1	25%	0.245	21%	0.21	C	C	.	.	S	Bend	trans	-112.3	-97.7	-174.8	62.9	0	0	0	0	111.9	K85 G91 A92 E93 E383	K85-T89 VanDerWaalsContact CA-OG1 3.29Å; K85-T89 WeakPolarHBondContact CA-OG1 3.35Å; K85-T89 CarbonylContact O-C 3.56Å; K85-T89 PolarHBondContact O-N 2.89Å; K85-T89 PolarHBondContact O-OG1 3.13Å; T89-G91 VanDerWaalsContact C-N 3.33Å; T89-G91 PolarHBondContact O-N 2.76Å; T89-A92 WeakPolarHBondContact O-CB 3.28Å; T89-A92 PolarHBondContact O-N 3.4Å; T89-A92 VanDerWaalsContact O-N 3.07Å; T89-E93 PolarHBondContact O-N 2.98Å; T89-E383 HydrophobicContact CG2-CB 4.26Å; T89-E383 VanDerWaalsContact CG2-OE2 3.27Å; T89-E383 WeakPolarHBondContact CG2-OE2 3.38Å; T89-E383 PolarHBondContact OG1-OE2 2.9Å
90	E	89.8	Confident	92.1	Very high	59 Å²	59	42.5 Å²	42.5	28%	0.276	23%	0.233	S	C	.	.	H	α-helix	trans	-58.6	-41.3	-172.8	-60.7	-75.9	-175.9	0	0	112.9	L50 S77 K85 E93 L94	L50-E90 HydrophobicContact CD1-CB 4.21Å; L50-E90 HydrophobicContact CD2-CB 4.16Å; S77-E90 VanDerWaalsContact CB-CD 3.47Å; S77-E90 WeakPolarHBondContact CB-OE1 3.35Å; S77-E90 WeakPolarHBondContact CB-OE2 3.29Å; S77-E90 VanDerWaalsContact OG-CD 3.3Å; S77-E90 PolarHBondContact OG-OE1 2.98Å; K85-E90 PolarHBondContact O-N 3.25Å; E90-E93 PolarHBondContact O-N 3.4Å; E90-L94 PolarHBondContact O-N 3.24Å
91	G	89.1	Confident	92.5	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-73	-28.2	178.5	0	0	0	0	0	113.6	K85 G86 T89 E93 L94 V95	K85-G91 PolarHBondContact O-N 3.07Å; G86-G91 WeakPolarHBondContact O-CA 3.42Å; T89-G91 VanDerWaalsContact C-N 3.33Å; T89-G91 PolarHBondContact O-N 2.76Å; G91-E93 VanDerWaalsContact C-N 3.34Å; G91-L94 PolarHBondContact O-N 2.69Å; G91-V95 WeakPolarHBondContact O-CB 3.48Å; G91-V95 PolarHBondContact O-N 3.34Å
92	A	91.1	Very high	92.7	Very high	35 Å²	35	38.1 Å²	38.1	29%	0.289	20%	0.198	S	C	.	.	H	α-helix	trans	-70.6	-30.3	174.9	0	0	0	0	0	112.2	T89 V95 L132	T89-A92 WeakPolarHBondContact O-CB 3.28Å; T89-A92 PolarHBondContact O-N 3.4Å; T89-A92 VanDerWaalsContact O-N 3.07Å; A92-V95 WeakPolarHBondContact O-CG1 3.1Å; A92-L132 HydrophobicContact CB-CD2 4.14Å
93	E	91.1	Very high	92.8	Very high	156 Å²	156	41.6 Å²	41.6	73%	0.729	21%	0.211	S	C	*	.	H	α-helix	trans	-71.9	-33.4	172.6	-64.8	-171.4	176.4	0	0	112.3	T89 E90 G91	T89-E93 PolarHBondContact O-N 2.98Å; E90-E93 PolarHBondContact O-N 3.4Å; G91-E93 VanDerWaalsContact C-N 3.34Å
94	L	92.6	Very high	92.8	Very high	22 Å²	22	46.5 Å²	46.5	12%	0.115	23%	0.232	C	C	.	.	H	α-helix	trans	-87	-24.9	-177	-168	63.8	0	0	0	113.6	L50 V73 E90 G91 D96 S97 V98 M129	L50-L94 HydrophobicContact CD2-CB 4.18Å; L50-L94 HydrophobicContact CD2-CD2 3.73Å; V73-L94 HydrophobicContact CG1-CD1 3.66Å; V73-L94 HydrophobicContact CG1-CD2 4.32Å; V73-L94 HydrophobicContact CG1-CG 3.93Å; E90-L94 PolarHBondContact O-N 3.24Å; G91-L94 PolarHBondContact O-N 2.69Å; L94-D96 VanDerWaalsContact C-N 3.29Å; L94-D96 PolarHBondContact O-N 3.21Å; L94-S97 WeakPolarHBondContact O-CB 3.29Å; L94-S97 PolarHBondContact O-N 2.85Å; L94-S97 VanDerWaalsContact O-N 3.11Å; L94-V98 PolarHBondContact O-N 2.83Å; L94-M129 HydrophobicContact CB-CE 3.76Å; L94-M129 HydrophobicContact CD2-CE 3.86Å; L94-M129 HydrophobicContact CD2-SD 4.28Å; L94-M129 HydrophobicContact CG-CE 3.83Å
95	V	93.5	Very high	92.7	Very high	7 Å²	7	46.8 Å²	46.8	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-58.9	-37.5	-172.3	74	0	0	0	0	112.8	G91 A92 S97 V98 L99 L132 L133	G91-V95 WeakPolarHBondContact O-CB 3.48Å; G91-V95 PolarHBondContact O-N 3.34Å; A92-V95 WeakPolarHBondContact O-CG1 3.1Å; V95-S97 VanDerWaalsContact C-N 3.3Å; V95-S97 PolarHBondContact O-N 3.18Å; V95-V98 WeakPolarHBondContact O-CB 3.32Å; V95-V98 PolarHBondContact O-N 3.12Å; V95-V98 VanDerWaalsContact O-N 3.09Å; V95-L99 HydrophobicContact CG2-CD1 4.25Å; V95-L99 HydrophobicContact CG2-CG 4.34Å; V95-L99 WeakPolarHBondContact O-CG 3.48Å; V95-L99 PolarHBondContact O-N 3.39Å; V95-L132 HydrophobicContact CB-CD2 4.03Å; V95-L132 HydrophobicContact CG1-CD2 4.01Å; V95-L132 HydrophobicContact CG2-CD2 4.26Å; V95-L132 HydrophobicContact CG2-CG 4.34Å; V95-L133 HydrophobicContact CG2-CB 4.46Å; V95-L133 HydrophobicContact CG2-CD1 4.02Å
96	D	92.9	Very high	92.6	Very high	101 Å²	101	44.6 Å²	44.6	54%	0.54	23%	0.227	S	C	.	.	H	α-helix	trans	-62.5	-39.6	179.6	-73.5	-24.9	0	0	0	111.6	L94 V98 L99 D100	L94-D96 VanDerWaalsContact C-N 3.29Å; L94-D96 PolarHBondContact O-N 3.21Å; D96-V98 VanDerWaalsContact C-N 3.31Å; D96-V98 PolarHBondContact O-N 3.37Å; D96-L99 PolarHBondContact O-N 3.35Å; D96-D100 PolarHBondContact O-N 3.38Å
97	S	93.5	Very high	92.6	Very high	61 Å²	61	52.6 Å²	52.6	43%	0.427	26%	0.264	S	S	.	.	H	α-helix	trans	-65.6	-36.2	175.6	-62.2	0	0	0	0	111.8	L94 V95 V101	L94-S97 WeakPolarHBondContact O-CB 3.29Å; L94-S97 PolarHBondContact O-N 2.85Å; L94-S97 VanDerWaalsContact O-N 3.11Å; V95-S97 VanDerWaalsContact C-N 3.3Å; V95-S97 PolarHBondContact O-N 3.18Å; S97-V101 PolarHBondContact O-N 3.37Å
98	V	94.4	Very high	92.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.5	-45.5	174.9	179.8	0	0	0	0	110.4	I46 V48 V73 L94 V95 D96 D100 V101 V102 M129 L133	I46-V98 HydrophobicContact CG2-CG1 4.3Å; V48-V98 HydrophobicContact CB-CG2 4.39Å; V48-V98 HydrophobicContact CG1-CG2 3.66Å; V48-V98 HydrophobicContact CG2-CB 4.4Å; V48-V98 HydrophobicContact CG2-CG1 3.66Å; V48-V98 HydrophobicContact CG2-CG2 3.76Å; V73-V98 HydrophobicContact CB-CG2 3.99Å; V73-V98 HydrophobicContact CG1-CG2 3.59Å; V73-V98 HydrophobicContact CG2-CG2 4.45Å; L94-V98 PolarHBondContact O-N 2.83Å; V95-V98 WeakPolarHBondContact O-CB 3.32Å; V95-V98 PolarHBondContact O-N 3.12Å; V95-V98 VanDerWaalsContact O-N 3.09Å; D96-V98 VanDerWaalsContact C-N 3.31Å; D96-V98 PolarHBondContact O-N 3.37Å; V98-D100 VanDerWaalsContact C-N 3.28Å; V98-D100 PolarHBondContact O-N 3.46Å; V98-V101 PolarHBondContact O-N 3.18Å; V98-V101 VanDerWaalsContact O-N 3.09Å; V98-V102 HydrophobicContact CG1-CG2 4.23Å; V98-V102 WeakPolarHBondContact O-CG2 3.39Å; V98-V102 PolarHBondContact O-N 3.1Å; V98-M129 HydrophobicContact CG2-CE 3.73Å; V98-L133 HydrophobicContact CB-CD1 4.35Å; V98-L133 HydrophobicContact CG1-CD1 3.78Å; V98-L133 HydrophobicContact CG1-CD2 3.93Å
99	L	94.3	Very high	92.2	Very high	4 Å²	4	50.8 Å²	50.8	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-60.7	-36.7	180	-73.2	170.7	0	0	0	112	V95 D96 V101 V102 R103 L133 K136 I137	V95-L99 HydrophobicContact CG2-CD1 4.25Å; V95-L99 HydrophobicContact CG2-CG 4.34Å; V95-L99 WeakPolarHBondContact O-CG 3.48Å; V95-L99 PolarHBondContact O-N 3.39Å; D96-L99 PolarHBondContact O-N 3.35Å; L99-V101 VanDerWaalsContact C-N 3.32Å; L99-V101 PolarHBondContact O-N 2.74Å; L99-V102 WeakPolarHBondContact O-CB 3.43Å; L99-V102 PolarHBondContact O-N 3.38Å; L99-R103 VanDerWaalsContact O-CG 3.3Å; L99-R103 WeakPolarHBondContact O-CG 3.13Å; L99-R103 PolarHBondContact O-N 2.8Å; L99-L133 HydrophobicContact CD2-CD1 3.89Å; L99-L133 HydrophobicContact CG-CD1 4.25Å; L99-K136 HydrophobicContact CD1-CB 3.83Å; L99-K136 HydrophobicContact CD1-CD 4.48Å; L99-K136 HydrophobicContact CD1-CG 4.21Å; L99-K136 HydrophobicContact CD2-CB 4.07Å; L99-I137 HydrophobicContact CD2-CG1 3.99Å
100	D	94.6	Very high	92.1	Very high	95 Å²	95	57.4 Å²	57.4	51%	0.508	30%	0.302	S	S	.	.	H	α-helix	trans	-62.6	-38.6	174.8	-75.3	-15	0	0	0	112.7	D96 V98 R103 K104	D96-D100 PolarHBondContact O-N 3.38Å; V98-D100 VanDerWaalsContact C-N 3.28Å; V98-D100 PolarHBondContact O-N 3.46Å; D100-R103 IonicContact OD1-NH1 3.57Å; D100-R103 PolarHBondContact OD1-NH1 2.72Å; D100-K104 WeakPolarHBondContact O-CB 3.24Å; D100-K104 PolarHBondContact O-N 2.98Å; D100-K104 VanDerWaalsContact O-N 3.08Å
101	V	94.5	Very high	92	Very high	20 Å²	20	59.3 Å²	59.3	12%	0.121	32%	0.321	C	S	.	.	H	α-helix	trans	-69.7	-40.3	173.8	-177.8	0	0	0	0	110.8	I46 N71 V73 S97 V98 L99 R103 K104 E105	I46-V101 HydrophobicContact CD1-CB 4.36Å; I46-V101 HydrophobicContact CD1-CG1 3.89Å; I46-V101 HydrophobicContact CG1-CG1 3.89Å; I46-V101 HydrophobicContact CG2-CG1 4.17Å; N71-V101 HydrophobicContact CB-CG1 4.27Å; V73-V101 HydrophobicContact CG2-CG2 3.84Å; S97-V101 PolarHBondContact O-N 3.37Å; V98-V101 PolarHBondContact O-N 3.18Å; V98-V101 VanDerWaalsContact O-N 3.09Å; L99-V101 VanDerWaalsContact C-N 3.32Å; L99-V101 PolarHBondContact O-N 2.74Å; V101-R103 VanDerWaalsContact C-N 3.35Å; V101-R103 PolarHBondContact O-N 2.88Å; V101-K104 PolarHBondContact O-N 2.7Å; V101-E105 PolarHBondContact O-N 2.84Å
102	V	94.3	Very high	91.9	Very high	7 Å²	7	60.3 Å²	60.3	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-58.1	-47.5	175.1	173.7	0	0	0	0	110.5	I46 V98 L99 K104 E105 A106 F115 I137 Y141	I46-V102 HydrophobicContact CD1-CB 4.11Å; I46-V102 HydrophobicContact CD1-CG2 3.45Å; I46-V102 VanDerWaalsContact CD1-CG2 3.45Å; V98-V102 HydrophobicContact CG1-CG2 4.23Å; V98-V102 WeakPolarHBondContact O-CG2 3.39Å; V98-V102 PolarHBondContact O-N 3.1Å; L99-V102 WeakPolarHBondContact O-CB 3.43Å; L99-V102 PolarHBondContact O-N 3.38Å; V102-K104 PolarHBondContact O-N 2.87Å; V102-E105 PolarHBondContact O-N 3.01Å; V102-A106 VanDerWaalsContact O-CB 3.28Å; V102-A106 WeakPolarHBondContact O-CB 3.32Å; V102-A106 PolarHBondContact O-N 3.17Å; V102-F115 HydrophobicContact CG1-CD1 4.37Å; V102-F115 HydrophobicContact CG1-CE1 3.56Å; V102-F115 HydrophobicContact CG1-CZ 4.09Å; V102-I137 HydrophobicContact CG1-CD1 4.33Å; V102-I137 HydrophobicContact CG1-CG1 4.49Å; V102-I137 HydrophobicContact CG2-CD1 4.39Å; V102-Y141 HydrophobicContact CG1-CE2 4.41Å
103	R	94.3	Very high	91.7	Very high	81 Å²	81	62.5 Å²	62.5	31%	0.306	33%	0.33	S	S	.	.	H	α-helix	trans	-58.5	-47.8	176.5	-73	169.9	-172.1	131.1	10.2	111.7	L99 D100 V101 E105 A106 E107 E140	L99-R103 VanDerWaalsContact O-CG 3.3Å; L99-R103 WeakPolarHBondContact O-CG 3.13Å; L99-R103 PolarHBondContact O-N 2.8Å; D100-R103 IonicContact OD1-NH1 3.57Å; D100-R103 PolarHBondContact OD1-NH1 2.72Å; V101-R103 VanDerWaalsContact C-N 3.35Å; V101-R103 PolarHBondContact O-N 2.88Å; R103-E105 VanDerWaalsContact C-N 3.33Å; R103-E105 PolarHBondContact O-N 3.03Å; R103-A106 PolarHBondContact O-N 3.36Å; R103-E107 WeakPolarHBondContact O-CG 3.4Å; R103-E107 PolarHBondContact O-N 3.41Å; R103-E140 WeakPolarHBondContact CD-OE1 3.43Å; R103-E140 WeakPolarHBondContact CG-OE1 3.32Å; R103-E140 IonicContact CZ-OE1 3.24Å; R103-E140 IonicContact CZ-OE2 2.75Å; R103-E140 VanDerWaalsContact NE-CD 3.34Å; R103-E140 IonicContact NE-OE1 3.27Å; R103-E140 PolarHBondContact NE-OE1 2.93Å; R103-E140 IonicContact NE-OE2 2.81Å; R103-E140 PolarHBondContact NE-OE2 3.24Å; R103-E140 VanDerWaalsContact NE-OE2 3.11Å; R103-E140 IonicContact NH2-OE1 2.82Å; R103-E140 IonicContact NH2-OE2 3.48Å; R103-E140 PolarHBondContact NH2-OE2 3.38Å
104	K	93.4	Very high	91.7	Very high	108 Å²	108	55.9 Å²	55.9	47%	0.47	30%	0.304	S	S	.	.	H	α-helix	trans	-59.2	-43	179.1	-175.6	-177.9	176.8	-174.3	0	112.2	D70 D100 V101 V102 S108	D70-K104 IonicContact OD2-NZ 2.76Å; D100-K104 WeakPolarHBondContact O-CB 3.24Å; D100-K104 PolarHBondContact O-N 2.98Å; D100-K104 VanDerWaalsContact O-N 3.08Å; V101-K104 PolarHBondContact O-N 2.7Å; V102-K104 PolarHBondContact O-N 2.87Å; K104-S108 PolarHBondContact O-N 2.93Å
105	E	92	Very high	91.8	Very high	7 Å²	7	56.4 Å²	56.4	3%	0.033	31%	0.305	C	S	.	.	H	α-helix	trans	-71.6	-38.3	176.5	-68	-65.4	156.1	0	0	111.5	N34 R44 R68 N71 V101 V102 R103 S108 C109	N34-E105 PolarHBondContact ND2-OE2 3.38Å; R44-E105 HydrophobicContact CG-CB 4.35Å; R68-E105 IonicContact CZ-OE1 3.55Å; R68-E105 IonicContact NH1-OE1 3.75Å; R68-E105 PolarHBondContact NH1-OE1 2.81Å; N71-E105 PolarHBondContact ND2-OE1 3.38Å; V101-E105 PolarHBondContact O-N 2.84Å; V102-E105 PolarHBondContact O-N 3.01Å; R103-E105 VanDerWaalsContact C-N 3.33Å; R103-E105 PolarHBondContact O-N 3.03Å; E105-S108 PolarHBondContact O-N 3.27Å; E105-S108 PolarHBondContact O-OG 3.36Å; E105-C109 PolarHBondContact O-N 3.11Å; E105-C109 PolarHBondContact O-SG 3.33Å
106	A	90.9	Very high	91.8	Very high	15 Å²	15	58.9 Å²	58.9	12%	0.124	32%	0.316	C	S	.	.	H	α-helix	trans	-63.2	-42.6	176.8	0	0	0	0	0	112.5	V102 R103 S108 C109 L112 Y141	V102-A106 VanDerWaalsContact O-CB 3.28Å; V102-A106 WeakPolarHBondContact O-CB 3.32Å; V102-A106 PolarHBondContact O-N 3.17Å; R103-A106 PolarHBondContact O-N 3.36Å; A106-S108 PolarHBondContact O-N 2.94Å; A106-C109 WeakPolarHBondContact O-CB 3.48Å; A106-C109 PolarHBondContact O-N 3.39Å; A106-L112 HydrophobicContact CB-CD2 4.08Å; A106-Y141 HydrophobicContact CB-CE1 4.32Å
107	E	91.5	Very high	91.9	Very high	169 Å²	169	55.8 Å²	55.8	79%	0.79	30%	0.3	S	S	*	.	H	α-helix	trans	-65.8	-26.5	175.5	-73.4	-175.4	168.9	0	0	112.9	R103 C109	R103-E107 WeakPolarHBondContact O-CG 3.4Å; R103-E107 PolarHBondContact O-N 3.41Å; E107-C109 PolarHBondContact O-N 2.94Å
108	S	89.4	Confident	92	Very high	61 Å²	61	56.9 Å²	56.9	43%	0.427	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-7.1	176.2	78.3	0	0	0	0	113.9	K104 E105 A106	K104-S108 PolarHBondContact O-N 2.93Å; E105-S108 PolarHBondContact O-N 3.27Å; E105-S108 PolarHBondContact O-OG 3.36Å; A106-S108 PolarHBondContact O-N 2.94Å
109	C	89.1	Confident	92	Very high	18 Å²	18	57.7 Å²	57.7	12%	0.122	31%	0.308	C	S	.	.			trans	-91.5	132.4	-179.4	-61.4	0	0	0	0	111.5	R44 E105 A106 E107 L112	R44-C109 PolarHBondContact NE-SG 3.17Å; R44-C109 VanDerWaalsContact NE-SG 3.38Å; R44-C109 PolarHBondContact NH1-SG 2.73Å; E105-C109 PolarHBondContact O-N 3.11Å; E105-C109 PolarHBondContact O-SG 3.33Å; A106-C109 WeakPolarHBondContact O-CB 3.48Å; A106-C109 PolarHBondContact O-N 3.39Å; E107-C109 PolarHBondContact O-N 2.94Å; C109-L112 HydrophobicContact CB-CB 4.29Å
110	D	87.4	Confident	91.9	Very high	179 Å²	179	60 Å²	60	96%	0.957	32%	0.324	S	S	*	.	S	Bend	trans	-62.9	-44.8	172.3	-63.1	-35.7	0	0	0	112.1
111	C	87.2	Confident	91.7	Very high	99 Å²	99	55.7 Å²	55.7	67%	0.669	30%	0.301	S	S	*	.	S	Bend	trans	-148.1	99.1	176.1	-172.2	0	0	0	0	110.3	Q113	C111-Q113 PolarHBondContact O-N 2.76Å
112	L	88.8	Confident	91.4	Very high	22 Å²	22	55 Å²	55	12%	0.115	30%	0.298	C	S	.	.			trans	-68.4	122.6	178.6	-178.8	65.5	0	0	0	111	A106 C109 F115 R144	A106-L112 HydrophobicContact CB-CD2 4.08Å; C109-L112 HydrophobicContact CB-CB 4.29Å; L112-F115 HydrophobicContact CD2-CE1 4.12Å; L112-F115 HydrophobicContact CD2-CE2 4Å; L112-F115 HydrophobicContact CD2-CZ 3.58Å; L112-R144 HydrophobicContact CD2-CG 4.32Å; L112-R144 WeakPolarHBondContact O-CD 3.39Å; L112-R144 PolarHBondContact O-NH1 2.83Å
113	Q	85.9	Confident	91.1	Very high	81 Å²	81	55.1 Å²	55.1	38%	0.379	30%	0.301	S	S	.	.			trans	-78.7	-43.2	176.1	-64.8	-171.7	15	0	0	112.2	C111 I145 L232	C111-Q113 PolarHBondContact O-N 2.76Å; Q113-I145 PolarHBondContact O-N 3.36Å; Q113-L232 HydrophobicContact CB-CD1 4.31Å
114	G	91	Very high	90.9	Very high	17 Å²	17	51.4 Å²	51.4	18%	0.175	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.3	-173.1	-170	0	0	0	0	0	112.3	I145	G114-I145 CarbonylContact C-O 3.49Å; G114-I145 WeakPolarHBondContact CA-O 3.41Å
115	F	94.4	Very high	90.8	Very high	33 Å²	33	47.2 Å²	47.2	15%	0.145	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	142.7	179	-58.4	-84.3	0	0	0	110.1	V102 L112 I137 Y141 R144 I145 M146 N147	V102-F115 HydrophobicContact CG1-CD1 4.37Å; V102-F115 HydrophobicContact CG1-CE1 3.56Å; V102-F115 HydrophobicContact CG1-CZ 4.09Å; L112-F115 HydrophobicContact CD2-CE1 4.12Å; L112-F115 HydrophobicContact CD2-CE2 4Å; L112-F115 HydrophobicContact CD2-CZ 3.58Å; F115-I137 HydrophobicContact CD1-CD1 4.42Å; F115-I137 HydrophobicContact CD1-CG2 4.38Å; F115-I137 HydrophobicContact CD2-CG2 3.3Å; F115-I137 HydrophobicContact CE1-CG2 4.38Å; F115-I137 HydrophobicContact CE2-CG2 3.28Å; F115-I137 HydrophobicContact CG-CG2 3.86Å; F115-I137 HydrophobicContact CZ-CG2 3.84Å; F115-Y141 AromaticContact CE2-CD2 3.83Å; F115-Y141 HydrophobicContact CE2-CD2 3.83Å; F115-Y141 AromaticContact CE2-CG 3.9Å; F115-Y141 HydrophobicContact CE2-CG 3.9Å; F115-Y141 AromaticContact CZ-CD2 3.64Å; F115-Y141 HydrophobicContact CZ-CD2 3.64Å; F115-Y141 AromaticContact CZ-CE2 3.93Å; F115-Y141 HydrophobicContact CZ-CE2 3.93Å; F115-Y141 AromaticContact CZ-CG 3.98Å; F115-Y141 HydrophobicContact CZ-CG 3.98Å; F115-R144 HydrophobicContact CD2-CB 4.48Å; F115-R144 HydrophobicContact CE2-CB 4.21Å; F115-I145 PolarHBondContact N-O 2.98Å; F115-M146 HydrophobicContact CB-CE 3.85Å; F115-M146 HydrophobicContact CB-SD 3.9Å; F115-M146 HydrophobicContact CD2-CE 4.09Å; F115-M146 HydrophobicContact CG-CE 4.25Å; F115-N147 PolarHBondContact O-N 3.28Å
116	Q	93.4	Very high	90.7	Very high	59 Å²	59	48 Å²	48	28%	0.276	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	110	176	-178.9	-178.1	-10.6	0	0	108.7	Y32 N147 F149	Y32-Q116 PolarHBondContact OH-OE1 3.5Å; Q116-N147 CarbonylContact C-O 3.58Å; Q116-N147 WeakPolarHBondContact CA-O 3.48Å; Q116-F149 HydrophobicContact CG-CD2 3.8Å; Q116-F149 HydrophobicContact CG-CE2 3.67Å
117	L	95.2	Very high	90.8	Very high	36 Å²	36	47.3 Å²	47.3	19%	0.188	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	135.2	175.5	-172.7	67.8	0	0	0	110.7	H119 I134 N147 T148 F149	L117-H119 HydrophobicContact CD2-CB 4.36Å; L117-H119 WeakPolarHBondContact CD2-ND1 3.09Å; L117-H119 HydrophobicContact CG-CB 4.34Å; L117-I134 HydrophobicContact CD2-CD1 3.59Å; L117-I134 HydrophobicContact CD2-CG1 3.72Å; L117-N147 PolarHBondContact N-O 2.91Å; L117-T148 HydrophobicContact CB-CG2 4.28Å; L117-T148 CarbonylContact O-C 3.57Å; L117-T148 WeakPolarHBondContact O-CA 3.18Å; L117-F149 PolarHBondContact O-N 3.3Å
118	T	94.9	Very high	90.9	Very high	84 Å²	84	39.2 Å²	39.2	52%	0.515	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	115.3	170.3	53.6	0	0	0	0	108.8	F149 M215	T118-F149 HydrophobicContact CG2-CB 4.05Å; T118-F149 HydrophobicContact CG2-CD2 4.33Å; T118-F149 HydrophobicContact CG2-CG 4.49Å; T118-M215 HydrophobicContact CG2-CE 3.29Å; T118-M215 HydrophobicContact CG2-SD 4.24Å
119	H	94.9	Very high	91.1	Very high	17 Å²	17	36.5 Å²	36.5	8%	0.079	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	166.9	-175.6	68.5	173.8	0	0	0	112.5	L117 G126 F149 S150 V151	L117-H119 HydrophobicContact CD2-CB 4.36Å; L117-H119 WeakPolarHBondContact CD2-ND1 3.09Å; L117-H119 HydrophobicContact CG-CB 4.34Å; H119-G126 WeakPolarHBondContact CB-O 3.2Å; H119-G126 PolarHBondContact ND1-O 2.98Å; H119-F149 PolarHBondContact N-O 3.42Å; H119-F149 VanDerWaalsContact N-O 3.1Å; H119-S150 PolarHBondContact CD2-OG 3.24Å; H119-S150 PolarHBondContact NE2-OG 3.47Å; H119-V151 PolarHBondContact O-N 3.07Å
120	S	92.4	Very high	91.3	Very high	53 Å²	53	36 Å²	36	37%	0.371	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	137.8	172.1	63.5	0	0	0	0	110.2	G126 S127	S120-G126 CarbonylContact O-C 3.41Å; S120-S127 WeakPolarHBondContact O-CB 3.37Å; S120-S127 PolarHBondContact O-N 3.14Å
121	L	91.4	Very high	91.7	Very high	4 Å²	4	27.5 Å²	27.5	2%	0.021	17%	0.17	C	C	.	.	S	Bend	trans	-82.3	-19.8	179.9	-56	179.9	0	0	0	112.6	S127 V151 V152 N166 A167 V171 L174	L121-S127 WeakPolarHBondContact O-CB 3.26Å; L121-V151 PolarHBondContact N-O 2.69Å; L121-V152 HydrophobicContact CD1-CG2 4.3Å; L121-N166 CarbonylContact O-C 3.23Å; L121-N166 VanDerWaalsContact O-C 3.23Å; L121-N166 VanDerWaalsContact O-CB 3.31Å; L121-N166 WeakPolarHBondContact O-CB 3.5Å; L121-A167 HydrophobicContact CB-CB 4.18Å; L121-A167 PolarHBondContact O-N 2.97Å; L121-V171 HydrophobicContact CD1-CG2 4.11Å; L121-L174 HydrophobicContact CD1-CD1 4.31Å; L121-L174 HydrophobicContact CD2-CD1 3.63Å
122	G	86.8	Confident	92	Very high	5 Å²	5	23.7 Å²	23.7	5%	0.052	14%	0.143	C	C	.	.	S	Bend	trans	-82.4	-20.7	-179.3	0	0	0	0	0	114.9	N166	G122-N166 PolarHBondContact O-ND2 2.92Å
123	G	89.2	Confident	92.3	Very high	10 Å²	10	23.4 Å²	23.4	10%	0.103	14%	0.142	C	C	.	.	S	Bend	trans	-75.3	-167.1	-178.1	0	0	0	0	0	113.3	S127 N166	G123-S127 WeakPolarHBondContact O-CB 3.37Å; G123-S127 PolarHBondContact O-OG 3.25Å; G123-N166 WeakPolarHBondContact O-CB 3.11Å; G123-N166 VanDerWaalsContact O-CG 3.24Å; G123-N166 PolarHBondContact O-ND2 2.83Å
124	G	88.9	Confident	92.8	Very high	3 Å²	3	19.8 Å²	19.8	3%	0.031	13%	0.125	C	C	.	.	S	Bend	trans	-107.1	-45.2	169.4	0	0	0	0	0	112.9	N82 S127 G128	N82-G124 WeakPolarHBondContact O-CA 3.07Å; G124-S127 PolarHBondContact O-OG 3.1Å; G124-G128 PolarHBondContact O-N 3.3Å
125	T	91.9	Very high	92.9	Very high	20 Å²	20	20.1 Å²	20.1	12%	0.123	13%	0.125	C	C	.	.	I	π-helix	trans	-69.8	-59.8	178.5	-48.9	0	0	0	0	111.3	L50 S127 M129 G130	L50-T125 HydrophobicContact CB-CG2 4Å; L50-T125 HydrophobicContact CD1-CG2 3.92Å; L50-T125 HydrophobicContact CG-CG2 3.75Å; T125-S127 PolarHBondContact O-N 3.21Å; T125-M129 HydrophobicContact CG2-CB 4.42Å; T125-M129 HydrophobicContact CG2-SD 4.31Å; T125-M129 WeakPolarHBondContact O-CA 3.37Å; T125-M129 WeakPolarHBondContact O-CB 3.33Å; T125-M129 PolarHBondContact O-N 3.36Å; T125-G130 PolarHBondContact O-N 3.43Å
126	G	90.8	Very high	92.9	Very high	23 Å²	23	21.9 Å²	21.9	24%	0.237	13%	0.132	C	C	.	.	I	π-helix	trans	-60.7	-34.8	-176.1	0	0	0	0	0	112.7	H119 S120 G130	H119-G126 WeakPolarHBondContact CB-O 3.2Å; H119-G126 PolarHBondContact ND1-O 2.98Å; S120-G126 CarbonylContact O-C 3.41Å; G126-G130 VanDerWaalsContact O-CA 3.31Å; G126-G130 WeakPolarHBondContact O-CA 3.4Å; G126-G130 PolarHBondContact O-N 3.44Å
127	S	92.4	Very high	92.9	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.121	C	C	.	.	I	π-helix	trans	-79.2	-65.4	-179.8	64.5	0	0	0	0	110.9	S120 L121 G123 G124 T125 T131 S170	S120-S127 WeakPolarHBondContact O-CB 3.37Å; S120-S127 PolarHBondContact O-N 3.14Å; L121-S127 WeakPolarHBondContact O-CB 3.26Å; G123-S127 WeakPolarHBondContact O-CB 3.37Å; G123-S127 PolarHBondContact O-OG 3.25Å; G124-S127 PolarHBondContact O-OG 3.1Å; T125-S127 PolarHBondContact O-N 3.21Å; S127-T131 VanDerWaalsContact O-CG2 3.31Å; S127-T131 WeakPolarHBondContact O-CG2 3.29Å; S127-T131 PolarHBondContact O-N 3.25Å; S127-T131 PolarHBondContact O-OG1 3.47Å; S127-S170 VanDerWaalsContact CB-OG 3.26Å; S127-S170 WeakPolarHBondContact CB-OG 3.45Å
128	G	93	Very high	92.8	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.124	C	C	.	.	I	π-helix	trans	-70.6	-51.3	-173.1	0	0	0	0	0	113.8	W83 H87 G124 G130 T131 L132	W83-G128 VanDerWaalsContact CD1-N 3.31Å; H87-G128 PolarHBondContact ND1-O 3.21Å; G124-G128 PolarHBondContact O-N 3.3Å; G128-G130 VanDerWaalsContact C-N 3.34Å; G128-T131 PolarHBondContact O-OG1 3.49Å; G128-T131 VanDerWaalsContact O-OG1 3.09Å; G128-L132 WeakPolarHBondContact O-CB 3.49Å; G128-L132 PolarHBondContact O-N 2.99Å; G128-L132 VanDerWaalsContact O-N 3.1Å
129	M	94.1	Very high	92.7	Very high	3 Å²	3	23 Å²	23	2%	0.015	13%	0.128	C	C	.	.	I	π-helix	trans	-71.2	-34.5	177.8	-170.2	-172.5	176.9	0	0	110.8	V48 L50 G86 L94 V98 T125 L132 L133	V48-M129 HydrophobicContact CG1-CE 3.5Å; V48-M129 HydrophobicContact CG1-SD 3.78Å; L50-M129 HydrophobicContact CD1-SD 4.41Å; L50-M129 HydrophobicContact CD2-SD 4.14Å; L50-M129 HydrophobicContact CG-SD 4.02Å; G86-M129 VanDerWaalsContact O-CA 3.22Å; G86-M129 WeakPolarHBondContact O-CA 3.3Å; G86-M129 WeakPolarHBondContact O-CB 3.42Å; G86-M129 PolarHBondContact O-N 3.14Å; L94-M129 HydrophobicContact CB-CE 3.76Å; L94-M129 HydrophobicContact CD2-CE 3.86Å; L94-M129 HydrophobicContact CD2-SD 4.28Å; L94-M129 HydrophobicContact CG-CE 3.83Å; V98-M129 HydrophobicContact CG2-CE 3.73Å; T125-M129 HydrophobicContact CG2-CB 4.42Å; T125-M129 HydrophobicContact CG2-SD 4.31Å; T125-M129 WeakPolarHBondContact O-CA 3.37Å; T125-M129 WeakPolarHBondContact O-CB 3.33Å; T125-M129 PolarHBondContact O-N 3.36Å; M129-L132 PolarHBondContact O-N 3.19Å; M129-L133 WeakPolarHBondContact O-CB 3.33Å; M129-L133 PolarHBondContact O-N 2.96Å
130	G	94.1	Very high	92.6	Very high	7 Å²	7	25.8 Å²	25.8	7%	0.072	14%	0.141	C	C	.	.	H	α-helix	trans	-61.3	-47	176	0	0	0	0	0	112.5	T125 G126 G128 L133 I134	T125-G130 PolarHBondContact O-N 3.43Å; G126-G130 VanDerWaalsContact O-CA 3.31Å; G126-G130 WeakPolarHBondContact O-CA 3.4Å; G126-G130 PolarHBondContact O-N 3.44Å; G128-G130 VanDerWaalsContact C-N 3.34Å; G130-L133 PolarHBondContact O-N 3.24Å; G130-I134 VanDerWaalsContact O-CG1 3.3Å; G130-I134 WeakPolarHBondContact O-CG1 3.36Å; G130-I134 PolarHBondContact O-N 2.93Å
131	T	94.4	Very high	92.7	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.006	13%	0.131	C	C	.	.	H	α-helix	trans	-69	-35.7	176.7	55.2	0	0	0	0	113	H87 S127 G128 L133 I134 S135 Q173	H87-T131 PolarHBondContact ND1-OG1 3.12Å; S127-T131 VanDerWaalsContact O-CG2 3.31Å; S127-T131 WeakPolarHBondContact O-CG2 3.29Å; S127-T131 PolarHBondContact O-N 3.25Å; S127-T131 PolarHBondContact O-OG1 3.47Å; G128-T131 PolarHBondContact O-OG1 3.49Å; G128-T131 VanDerWaalsContact O-OG1 3.09Å; T131-L133 VanDerWaalsContact C-N 3.33Å; T131-L133 PolarHBondContact O-N 3.05Å; T131-I134 PolarHBondContact O-N 3.04Å; T131-S135 PolarHBondContact O-N 3.45Å; T131-Q173 HydrophobicContact CG2-CB 3.77Å; T131-Q173 HydrophobicContact CG2-CG 4.45Å
132	L	94.6	Very high	92.7	Very high	20 Å²	20	28.6 Å²	28.6	11%	0.105	15%	0.153	C	C	.	.	H	α-helix	trans	-59.2	-46.6	172.2	-178.3	67.2	0	0	0	111.1	H87 A92 V95 G128 M129 I134 S135 K136	H87-L132 WeakPolarHBondContact O-CD2 3.28Å; A92-L132 HydrophobicContact CB-CD2 4.14Å; V95-L132 HydrophobicContact CB-CD2 4.03Å; V95-L132 HydrophobicContact CG1-CD2 4.01Å; V95-L132 HydrophobicContact CG2-CD2 4.26Å; V95-L132 HydrophobicContact CG2-CG 4.34Å; G128-L132 WeakPolarHBondContact O-CB 3.49Å; G128-L132 PolarHBondContact O-N 2.99Å; G128-L132 VanDerWaalsContact O-N 3.1Å; M129-L132 PolarHBondContact O-N 3.19Å; L132-I134 VanDerWaalsContact C-N 3.35Å; L132-I134 PolarHBondContact O-N 2.91Å; L132-S135 PolarHBondContact O-N 2.88Å; L132-K136 WeakPolarHBondContact O-CG 3.41Å; L132-K136 PolarHBondContact O-N 3.05Å
133	L	94.9	Very high	92.8	Very high	16 Å²	16	34.5 Å²	34.5	8%	0.084	18%	0.183	C	C	.	.	H	α-helix	trans	-62.6	-42.2	178.3	-177.3	65	0	0	0	111.4	V95 V98 L99 M129 G130 T131 S135 K136 I137	V95-L133 HydrophobicContact CG2-CB 4.46Å; V95-L133 HydrophobicContact CG2-CD1 4.02Å; V98-L133 HydrophobicContact CB-CD1 4.35Å; V98-L133 HydrophobicContact CG1-CD1 3.78Å; V98-L133 HydrophobicContact CG1-CD2 3.93Å; L99-L133 HydrophobicContact CD2-CD1 3.89Å; L99-L133 HydrophobicContact CG-CD1 4.25Å; M129-L133 WeakPolarHBondContact O-CB 3.33Å; M129-L133 PolarHBondContact O-N 2.96Å; G130-L133 PolarHBondContact O-N 3.24Å; T131-L133 VanDerWaalsContact C-N 3.33Å; T131-L133 PolarHBondContact O-N 3.05Å; L133-S135 PolarHBondContact O-N 3.38Å; L133-K136 PolarHBondContact O-N 3.13Å; L133-I137 HydrophobicContact CD1-CD1 3.97Å; L133-I137 HydrophobicContact CD1-CG1 4.2Å; L133-I137 HydrophobicContact CD2-CD1 4.39Å; L133-I137 HydrophobicContact CG-CD1 3.79Å; L133-I137 HydrophobicContact CG-CG1 4.35Å; L133-I137 WeakPolarHBondContact O-CB 3.32Å; L133-I137 VanDerWaalsContact O-CG1 3.25Å; L133-I137 WeakPolarHBondContact O-CG1 3.46Å; L133-I137 PolarHBondContact O-N 3.06Å
134	I	95.3	Very high	92.8	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-57.5	-50.1	175.6	-71.3	167	0	0	0	110.7	L117 G130 T131 L132 K136 I137 R138 M146 T148 L174 N177 T178	L117-I134 HydrophobicContact CD2-CD1 3.59Å; L117-I134 HydrophobicContact CD2-CG1 3.72Å; G130-I134 VanDerWaalsContact O-CG1 3.3Å; G130-I134 WeakPolarHBondContact O-CG1 3.36Å; G130-I134 PolarHBondContact O-N 2.93Å; T131-I134 PolarHBondContact O-N 3.04Å; L132-I134 VanDerWaalsContact C-N 3.35Å; L132-I134 PolarHBondContact O-N 2.91Å; I134-K136 PolarHBondContact O-N 3.37Å; I134-I137 PolarHBondContact O-N 3.22Å; I134-R138 WeakPolarHBondContact O-CB 3.22Å; I134-R138 PolarHBondContact O-N 2.88Å; I134-M146 HydrophobicContact CG1-SD 4.22Å; I134-M146 HydrophobicContact CG2-CE 4.46Å; I134-M146 HydrophobicContact CG2-CG 3.99Å; I134-M146 HydrophobicContact CG2-SD 4.45Å; I134-T148 HydrophobicContact CD1-CG2 3.68Å; I134-L174 HydrophobicContact CD1-CD2 3.66Å; I134-N177 HydrophobicContact CG2-CB 3.55Å; I134-T178 HydrophobicContact CD1-CG2 4.04Å; I134-T178 HydrophobicContact CG2-CG2 3.85Å
135	S	93.9	Very high	92.9	Very high	25 Å²	25	38.5 Å²	38.5	18%	0.175	20%	0.195	C	C	.	.	H	α-helix	trans	-59.2	-46.7	-179.9	175.6	0	0	0	0	111.3	T131 L132 L133 I137 R138 E139	T131-S135 PolarHBondContact O-N 3.45Å; L132-S135 PolarHBondContact O-N 2.88Å; L133-S135 PolarHBondContact O-N 3.38Å; S135-I137 PolarHBondContact O-N 3.38Å; S135-R138 PolarHBondContact O-N 2.9Å; S135-R138 VanDerWaalsContact O-N 3.15Å; S135-E139 WeakPolarHBondContact O-CG 3.25Å; S135-E139 PolarHBondContact O-N 2.92Å
136	K	94.3	Very high	93	Very high	69 Å²	69	37.8 Å²	37.8	30%	0.3	19%	0.19	S	C	.	.	H	α-helix	trans	-63.7	-40.6	177.7	-68.9	-72.7	152.1	-146.8	0	113.2	L99 L132 L133 I134 R138 E139 E140	L99-K136 HydrophobicContact CD1-CB 3.83Å; L99-K136 HydrophobicContact CD1-CD 4.48Å; L99-K136 HydrophobicContact CD1-CG 4.21Å; L99-K136 HydrophobicContact CD2-CB 4.07Å; L132-K136 WeakPolarHBondContact O-CG 3.41Å; L132-K136 PolarHBondContact O-N 3.05Å; L133-K136 PolarHBondContact O-N 3.13Å; I134-K136 PolarHBondContact O-N 3.37Å; K136-R138 VanDerWaalsContact C-N 3.31Å; K136-E139 IonicContact NZ-OE1 2.89Å; K136-E139 PolarHBondContact NZ-OE1 3.08Å; K136-E139 IonicContact NZ-OE2 3.55Å; K136-E139 PolarHBondContact NZ-OE2 3.26Å; K136-E139 PolarHBondContact O-N 3.47Å; K136-E140 PolarHBondContact O-N 3.08Å; K136-E140 VanDerWaalsContact O-N 3.1Å
137	I	94.3	Very high	93.1	Very high	10 Å²	10	37 Å²	37	5%	0.051	18%	0.181	C	C	.	.	H	α-helix	trans	-66	-37.2	175.3	-69.7	175	0	0	0	110.5	L99 V102 F115 L133 I134 S135 E140 Y141 M146	L99-I137 HydrophobicContact CD2-CG1 3.99Å; V102-I137 HydrophobicContact CG1-CD1 4.33Å; V102-I137 HydrophobicContact CG1-CG1 4.49Å; V102-I137 HydrophobicContact CG2-CD1 4.39Å; F115-I137 HydrophobicContact CD1-CD1 4.42Å; F115-I137 HydrophobicContact CD1-CG2 4.38Å; F115-I137 HydrophobicContact CD2-CG2 3.3Å; F115-I137 HydrophobicContact CE1-CG2 4.38Å; F115-I137 HydrophobicContact CE2-CG2 3.28Å; F115-I137 HydrophobicContact CG-CG2 3.86Å; F115-I137 HydrophobicContact CZ-CG2 3.84Å; L133-I137 HydrophobicContact CD1-CD1 3.97Å; L133-I137 HydrophobicContact CD1-CG1 4.2Å; L133-I137 HydrophobicContact CD2-CD1 4.39Å; L133-I137 HydrophobicContact CG-CD1 3.79Å; L133-I137 HydrophobicContact CG-CG1 4.35Å; L133-I137 WeakPolarHBondContact O-CB 3.32Å; L133-I137 VanDerWaalsContact O-CG1 3.25Å; L133-I137 WeakPolarHBondContact O-CG1 3.46Å; L133-I137 PolarHBondContact O-N 3.06Å; I134-I137 PolarHBondContact O-N 3.22Å; S135-I137 PolarHBondContact O-N 3.38Å; I137-E140 PolarHBondContact O-N 3.48Å; I137-Y141 HydrophobicContact CG2-CD2 4.12Å; I137-Y141 WeakPolarHBondContact O-CA 3.38Å; I137-Y141 WeakPolarHBondContact O-CB 3.3Å; I137-Y141 PolarHBondContact O-N 3.3Å; I137-M146 HydrophobicContact CB-CE 3.73Å; I137-M146 HydrophobicContact CD1-CE 4.36Å; I137-M146 HydrophobicContact CG2-CE 3.34Å
138	R	92.2	Very high	93.2	Very high	67 Å²	67	37 Å²	37	25%	0.253	18%	0.181	S	C	.	.	H	α-helix	trans	-67.7	-36.4	177.8	-169.9	59.3	168.6	-156.3	-13.2	112	I134 S135 K136 P142 R144 D179	I134-R138 WeakPolarHBondContact O-CB 3.22Å; I134-R138 PolarHBondContact O-N 2.88Å; S135-R138 PolarHBondContact O-N 2.9Å; S135-R138 VanDerWaalsContact O-N 3.15Å; K136-R138 VanDerWaalsContact C-N 3.31Å; R138-P142 WeakPolarHBondContact O-CA 3.34Å; R138-R144 PolarHBondContact NH1-O 2.83Å; R138-D179 IonicContact CZ-OD1 3.06Å; R138-D179 IonicContact CZ-OD2 3.41Å; R138-D179 IonicContact NH1-OD1 3.53Å; R138-D179 PolarHBondContact NH1-OD1 3.02Å; R138-D179 IonicContact NH1-OD2 3.23Å; R138-D179 PolarHBondContact NH1-OD2 3.29Å; R138-D179 IonicContact NH2-OD1 2.79Å; R138-D179 PolarHBondContact NH2-OD1 3.34Å; R138-D179 IonicContact NH2-OD2 3.97Å
139	E	92.9	Very high	93.3	Very high	126 Å²	126	37.3 Å²	37.3	59%	0.589	18%	0.182	S	C	*	.	H	α-helix	trans	-63	-43.6	172.2	-72	174.8	177.6	0	0	112	S135 K136	S135-E139 WeakPolarHBondContact O-CG 3.25Å; S135-E139 PolarHBondContact O-N 2.92Å; K136-E139 IonicContact NZ-OE1 2.89Å; K136-E139 PolarHBondContact NZ-OE1 3.08Å; K136-E139 IonicContact NZ-OE2 3.55Å; K136-E139 PolarHBondContact NZ-OE2 3.26Å; K136-E139 PolarHBondContact O-N 3.47Å
140	E	93.6	Very high	93.3	Very high	75 Å²	75	37.2 Å²	37.2	35%	0.35	18%	0.181	S	C	.	.	H	α-helix	trans	-82.3	-32.2	-176.4	-169.8	166.4	179	0	0	113.5	R103 K136 I137 P142	R103-E140 WeakPolarHBondContact CD-OE1 3.43Å; R103-E140 WeakPolarHBondContact CG-OE1 3.32Å; R103-E140 IonicContact CZ-OE1 3.24Å; R103-E140 IonicContact CZ-OE2 2.75Å; R103-E140 VanDerWaalsContact NE-CD 3.34Å; R103-E140 IonicContact NE-OE1 3.27Å; R103-E140 PolarHBondContact NE-OE1 2.93Å; R103-E140 IonicContact NE-OE2 2.81Å; R103-E140 PolarHBondContact NE-OE2 3.24Å; R103-E140 VanDerWaalsContact NE-OE2 3.11Å; R103-E140 IonicContact NH2-OE1 2.82Å; R103-E140 IonicContact NH2-OE2 3.48Å; R103-E140 PolarHBondContact NH2-OE2 3.38Å; K136-E140 PolarHBondContact O-N 3.08Å; K136-E140 VanDerWaalsContact O-N 3.1Å; I137-E140 PolarHBondContact O-N 3.48Å; E140-P142 VanDerWaalsContact C-CD 3.47Å
141	Y	93.4	Very high	93.2	Very high	43 Å²	43	38.3 Å²	38.3	17%	0.169	19%	0.187	C	C	.	.			trans	-128.8	63.3	-176.6	-58.5	-78.8	0	0	0	112.1	V102 A106 F115 I137 D143 R144	V102-Y141 HydrophobicContact CG1-CE2 4.41Å; A106-Y141 HydrophobicContact CB-CE1 4.32Å; F115-Y141 AromaticContact CE2-CD2 3.83Å; F115-Y141 HydrophobicContact CE2-CD2 3.83Å; F115-Y141 AromaticContact CE2-CG 3.9Å; F115-Y141 HydrophobicContact CE2-CG 3.9Å; F115-Y141 AromaticContact CZ-CD2 3.64Å; F115-Y141 HydrophobicContact CZ-CD2 3.64Å; F115-Y141 AromaticContact CZ-CE2 3.93Å; F115-Y141 HydrophobicContact CZ-CE2 3.93Å; F115-Y141 AromaticContact CZ-CG 3.98Å; F115-Y141 HydrophobicContact CZ-CG 3.98Å; I137-Y141 HydrophobicContact CG2-CD2 4.12Å; I137-Y141 WeakPolarHBondContact O-CA 3.38Å; I137-Y141 WeakPolarHBondContact O-CB 3.3Å; I137-Y141 PolarHBondContact O-N 3.3Å; Y141-D143 VanDerWaalsContact C-N 3.27Å; Y141-D143 PolarHBondContact O-N 3.32Å; Y141-R144 HydrophobicContact CD1-CG 4.48Å; Y141-R144 PolarHBondContact O-N 3Å; Y141-R144 VanDerWaalsContact O-N 3.17Å
142	P	90.9	Very high	93	Very high	74 Å²	74	38.3 Å²	38.3	48%	0.481	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-30.6	-175.3	25.4	-35.3	0	0	0	113.3	R138 E140 R144	R138-P142 WeakPolarHBondContact O-CA 3.34Å; E140-P142 VanDerWaalsContact C-CD 3.47Å; P142-R144 VanDerWaalsContact C-N 3.26Å; P142-R144 PolarHBondContact O-N 3.48Å
143	D	88.9	Confident	92.5	Very high	128 Å²	128	38 Å²	38	68%	0.684	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	0.9	-178.7	-64.4	-36.9	0	0	0	113.7	Y141 R233	Y141-D143 VanDerWaalsContact C-N 3.27Å; Y141-D143 PolarHBondContact O-N 3.32Å; D143-R233 PolarHBondContact O-NH2 3.47Å
144	R	90.9	Very high	91.8	Very high	92 Å²	92	37.3 Å²	37.3	35%	0.347	18%	0.182	S	C	.	.	S	Bend	trans	-104.8	143.1	-175.7	-58	-59.4	178.9	-171.8	-8.9	110.9	L112 F115 R138 Y141 P142	L112-R144 HydrophobicContact CD2-CG 4.32Å; L112-R144 WeakPolarHBondContact O-CD 3.39Å; L112-R144 PolarHBondContact O-NH1 2.83Å; F115-R144 HydrophobicContact CD2-CB 4.48Å; F115-R144 HydrophobicContact CE2-CB 4.21Å; R138-R144 PolarHBondContact NH1-O 2.83Å; Y141-R144 HydrophobicContact CD1-CG 4.48Å; Y141-R144 PolarHBondContact O-N 3Å; Y141-R144 VanDerWaalsContact O-N 3.17Å; P142-R144 VanDerWaalsContact C-N 3.26Å; P142-R144 PolarHBondContact O-N 3.48Å
145	I	90.6	Very high	90.7	Very high	6 Å²	6	40.8 Å²	40.8	3%	0.031	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	132.5	179.8	-67.4	-66.9	0	0	0	109.8	Q113 G114 F115 N147 D179 L232 R233 A236	Q113-I145 PolarHBondContact O-N 3.36Å; G114-I145 CarbonylContact C-O 3.49Å; G114-I145 WeakPolarHBondContact CA-O 3.41Å; F115-I145 PolarHBondContact N-O 2.98Å; I145-N147 WeakPolarHBondContact CG2-OD1 3.31Å; I145-D179 VanDerWaalsContact CA-OD2 3.31Å; I145-D179 WeakPolarHBondContact CA-OD2 3.44Å; I145-D179 HydrophobicContact CD1-CB 4.23Å; I145-D179 HydrophobicContact CG2-CB 4.35Å; I145-L232 HydrophobicContact CB-CB 4.43Å; I145-L232 HydrophobicContact CG2-CB 4.15Å; I145-R233 HydrophobicContact CD1-CB 4.44Å; I145-R233 HydrophobicContact CG1-CB 4.21Å; I145-A236 HydrophobicContact CD1-CB 4.28Å
146	M	93.4	Very high	89.6	Confident	5 Å²	5	44.4 Å²	44.4	3%	0.025	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	111.9	175.1	-179.6	60.4	69	0	0	110.5	F115 I134 I137 T178 D179 E180	F115-M146 HydrophobicContact CB-CE 3.85Å; F115-M146 HydrophobicContact CB-SD 3.9Å; F115-M146 HydrophobicContact CD2-CE 4.09Å; F115-M146 HydrophobicContact CG-CE 4.25Å; I134-M146 HydrophobicContact CG1-SD 4.22Å; I134-M146 HydrophobicContact CG2-CE 4.46Å; I134-M146 HydrophobicContact CG2-CG 3.99Å; I134-M146 HydrophobicContact CG2-SD 4.45Å; I137-M146 HydrophobicContact CB-CE 3.73Å; I137-M146 HydrophobicContact CD1-CE 4.36Å; I137-M146 HydrophobicContact CG2-CE 3.34Å; M146-T178 HydrophobicContact CG-CG2 3.99Å; M146-D179 PolarHBondContact N-OD2 3.27Å; M146-D179 PolarHBondContact O-N 3.31Å; M146-E180 PolarHBondContact O-N 3.41Å
147	N	92.8	Very high	88.4	Confident	7 Å²	7	42.5 Å²	42.5	4%	0.037	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	136.6	179.5	-76.6	15.3	0	0	0	111	F115 Q116 L117 I145 E180 L232	F115-N147 PolarHBondContact O-N 3.28Å; Q116-N147 CarbonylContact C-O 3.58Å; Q116-N147 WeakPolarHBondContact CA-O 3.48Å; L117-N147 PolarHBondContact N-O 2.91Å; I145-N147 WeakPolarHBondContact CG2-OD1 3.31Å; N147-E180 CarbonylContact C-O 3.19Å; N147-E180 WeakPolarHBondContact CA-O 3.39Å; N147-E180 PolarHBondContact ND2-OE2 2.91Å; N147-E180 WeakPolarHBondContact OD1-CB 3.35Å; N147-L232 VanDerWaalsContact ND2-CD2 3.32Å; N147-L232 WeakPolarHBondContact ND2-CD2 3.49Å
148	T	95.1	Very high	87.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	139.3	175.8	79.9	0	0	0	0	112.5	L117 I134 S150 L174 T178 E180 T181 Y182	L117-T148 HydrophobicContact CB-CG2 4.28Å; L117-T148 CarbonylContact O-C 3.57Å; L117-T148 WeakPolarHBondContact O-CA 3.18Å; I134-T148 HydrophobicContact CD1-CG2 3.68Å; T148-S150 PolarHBondContact OG1-OG 2.82Å; T148-L174 HydrophobicContact CG2-CD2 3.99Å; T148-T178 HydrophobicContact CG2-CG2 3.56Å; T148-E180 PolarHBondContact N-O 3.2Å; T148-T181 WeakPolarHBondContact OG1-CG2 3.42Å; T148-T181 PolarHBondContact OG1-OG1 2.94Å; T148-Y182 WeakPolarHBondContact O-CD2 3.26Å; T148-Y182 PolarHBondContact O-N 2.84Å
149	F	95.2	Very high	86.1	Confident	6 Å²	6	48 Å²	48	3%	0.026	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	99	164.8	-69.8	-89.1	0	0	0	106.8	Q116 L117 T118 H119 Y182 I184 M215 V218	Q116-F149 HydrophobicContact CG-CD2 3.8Å; Q116-F149 HydrophobicContact CG-CE2 3.67Å; L117-F149 PolarHBondContact O-N 3.3Å; T118-F149 HydrophobicContact CG2-CB 4.05Å; T118-F149 HydrophobicContact CG2-CD2 4.33Å; T118-F149 HydrophobicContact CG2-CG 4.49Å; H119-F149 PolarHBondContact N-O 3.42Å; H119-F149 VanDerWaalsContact N-O 3.1Å; F149-Y182 HydrophobicContact CD1-CD2 4.06Å; F149-Y182 AromaticContact CD1-CG 3.95Å; F149-Y182 HydrophobicContact CD1-CG 3.95Å; F149-Y182 HydrophobicContact CE1-CD1 4.23Å; F149-Y182 AromaticContact CE1-CD2 3.67Å; F149-Y182 HydrophobicContact CE1-CD2 3.67Å; F149-Y182 HydrophobicContact CE1-CE2 4.35Å; F149-Y182 AromaticContact CE1-CG 3.63Å; F149-Y182 HydrophobicContact CE1-CG 3.63Å; F149-Y182 HydrophobicContact CE2-CD2 4.11Å; F149-Y182 HydrophobicContact CE2-CE2 4.46Å; F149-Y182 HydrophobicContact CG-CD2 4.48Å; F149-Y182 AromaticContact CZ-CD2 3.71Å; F149-Y182 HydrophobicContact CZ-CD2 3.71Å; F149-Y182 HydrophobicContact CZ-CE2 4.03Å; F149-Y182 HydrophobicContact CZ-CG 4.14Å; F149-I184 HydrophobicContact CB-CD1 4.34Å; F149-I184 HydrophobicContact CD1-CD1 4.22Å; F149-M215 HydrophobicContact CD1-CG 3.65Å; F149-M215 HydrophobicContact CD2-CE 4.13Å; F149-M215 HydrophobicContact CE1-CB 4.39Å; F149-M215 HydrophobicContact CE1-CG 3.73Å; F149-M215 HydrophobicContact CG-CE 4.23Å; F149-M215 HydrophobicContact CG-CG 4.1Å; F149-M215 HydrophobicContact CG-SD 4.47Å; F149-M215 HydrophobicContact CZ-CG 4.26Å; F149-V218 HydrophobicContact CZ-CB 4.37Å; F149-V218 HydrophobicContact CZ-CG1 4.12Å
150	S	94.3	Very high	85.6	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	110.9	-169.4	-69.2	0	0	0	0	110	H119 T148 V152 Y182 I184	H119-S150 PolarHBondContact CD2-OG 3.24Å; H119-S150 PolarHBondContact NE2-OG 3.47Å; T148-S150 PolarHBondContact OG1-OG 2.82Å; S150-V152 PolarHBondContact O-N 2.92Å; S150-Y182 PolarHBondContact N-O 3.44Å; S150-I184 PolarHBondContact O-N 3.49Å
151	V	92.4	Very high	85.1	Confident	31 Å²	31	44.4 Å²	44.4	19%	0.188	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	114.9	176	-175.4	0	0	0	0	109.4	H119 L121 I184 N186	H119-V151 PolarHBondContact O-N 3.07Å; L121-V151 PolarHBondContact N-O 2.69Å; V151-I184 CarbonylContact C-O 3.58Å; V151-I184 VanDerWaalsContact CA-O 3.28Å; V151-I184 WeakPolarHBondContact CA-O 3.44Å; V151-I184 HydrophobicContact CG2-CB 4.36Å; V151-N186 WeakPolarHBondContact CG1-ND2 3.13Å; V151-N186 WeakPolarHBondContact CG1-OD1 3.47Å
152	V	89.2	Confident	85	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	132.2	-179.1	-174.5	0	0	0	0	108.7	L121 S150 I184 N186 L359 I363	L121-V152 HydrophobicContact CD1-CG2 4.3Å; S150-V152 PolarHBondContact O-N 2.92Å; V152-I184 PolarHBondContact N-O 3.09Å; V152-N186 PolarHBondContact O-N 3.43Å; V152-L359 HydrophobicContact CB-CD1 4.45Å; V152-L359 HydrophobicContact CG1-CD1 4.1Å; V152-L359 HydrophobicContact CG1-CD2 4.24Å; V152-L359 HydrophobicContact CG1-CG 4.23Å; V152-L359 HydrophobicContact CG2-CD1 4.39Å; V152-L359 HydrophobicContact CG2-CD2 3.85Å; V152-I363 HydrophobicContact CG1-CD1 3.62Å; V152-I363 HydrophobicContact CG1-CG1 4.38Å
153	P	84.9	Confident	85	Confident	14 Å²	14	40.1 Å²	40.1	9%	0.091	22%	0.215	C	C	.	.			trans	-64.9	153.7	178.5	25	-32.9	0	0	0	112.3	E163 A167	P153-E163 HydrophobicContact CB-CB 3.72Å; P153-E163 HydrophobicContact CB-CG 4.18Å; P153-E163 WeakPolarHBondContact CB-OE2 3.4Å; P153-E163 HydrophobicContact CG-CB 4Å; P153-A167 HydrophobicContact CG-CB 3.9Å
154	S	79.4	Confident	85.1	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.007	19%	0.186	C	C	.	.			trans	-141.8	134.5	172.3	176.4	0	0	0	0	110.6	K156 V157 S158 E187	S154-K156 PolarHBondContact O-N 3.45Å; S154-K156 VanDerWaalsContact O-N 3.09Å; S154-K156 PolarHBondContact OG-N 3.42Å; S154-V157 PolarHBondContact O-N 2.89Å; S154-S158 PolarHBondContact O-N 2.87Å; S154-S158 VanDerWaalsContact O-N 3.09Å; S154-E187 WeakPolarHBondContact OG-CB 3.29Å
155	P	71.8	Confident	85.2	Confident	76 Å²	76	30.1 Å²	30.1	49%	0.494	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-12	177.2	28.2	-36	0	0	0	113.4	V157	P155-V157 VanDerWaalsContact C-N 3.33Å
156	K	71.9	Confident	85.4	Confident	101 Å²	101	29.8 Å²	29.8	44%	0.439	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-21.7	173.2	-68	-174.6	-175	157.2	0	112.9	S154 E187 D191	S154-K156 PolarHBondContact O-N 3.45Å; S154-K156 VanDerWaalsContact O-N 3.09Å; S154-K156 PolarHBondContact OG-N 3.42Å; K156-E187 HydrophobicContact CD-CG 4.06Å; K156-E187 WeakPolarHBondContact CE-OE1 3.46Å; K156-E187 IonicContact NZ-OE1 3.89Å; K156-E187 PolarHBondContact NZ-OE1 2.78Å; K156-D191 IonicContact NZ-OD1 3.29Å; K156-D191 IonicContact NZ-OD2 2.73Å; K156-D191 PolarHBondContact NZ-OD2 3.18Å
157	V	69	Low	85.4	Confident	30 Å²	30	29.6 Å²	29.6	18%	0.182	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-27.3	-170.3	179.2	0	0	0	0	111.8	S154 P155 N186 Y190 Y204	S154-V157 PolarHBondContact O-N 2.89Å; P155-V157 VanDerWaalsContact C-N 3.33Å; V157-N186 HydrophobicContact CB-CB 4.14Å; V157-N186 HydrophobicContact CG1-CB 4.32Å; V157-N186 HydrophobicContact CG2-CB 3.99Å; V157-Y190 HydrophobicContact CG2-CD2 4.25Å; V157-Y190 HydrophobicContact CG2-CG 4.41Å; V157-Y204 HydrophobicContact CG1-CE1 3.78Å; V157-Y204 PolarHBondContact O-OH 3.46Å
158	S	69	Low	85.4	Confident	27 Å²	27	29.3 Å²	29.3	19%	0.189	17%	0.165	C	C	.	.			trans	-130.1	140.1	179	-176.9	0	0	0	0	111.8	S154 T160 E163	S154-S158 PolarHBondContact O-N 2.87Å; S154-S158 VanDerWaalsContact O-N 3.09Å; S158-T160 VanDerWaalsContact C-N 3.33Å; S158-T160 PolarHBondContact OG-N 3.43Å; S158-T160 PolarHBondContact OG-OG1 3.49Å; S158-E163 WeakPolarHBondContact CB-OE1 3.31Å; S158-E163 PolarHBondContact OG-OE1 2.84Å
159	D	69.3	Low	85.4	Confident	166 Å²	166	29.5 Å²	29.5	89%	0.888	17%	0.166	S	C	*	.			trans	-89	1	176.2	-66.9	-42	0	0	0	112.6	V161	D159-V161 PolarHBondContact O-N 2.79Å
160	T	81	Confident	85.4	Confident	43 Å²	43	29.2 Å²	29.2	26%	0.264	17%	0.165	S	C	.	.			trans	-75.1	115.3	-176.4	-58.6	0	0	0	0	110.4	N81 S158 V162 E163	N81-T160 HydrophobicContact CB-CG2 4.08Å; S158-T160 VanDerWaalsContact C-N 3.33Å; S158-T160 PolarHBondContact OG-N 3.43Å; S158-T160 PolarHBondContact OG-OG1 3.49Å; T160-V162 VanDerWaalsContact C-N 3.33Å; T160-V162 HydrophobicContact CG2-CG2 3.66Å; T160-V162 PolarHBondContact O-N 2.78Å; T160-E163 HydrophobicContact CG2-CG 3.98Å; T160-E163 WeakPolarHBondContact O-CG 3.02Å
161	V	84.5	Confident	85.3	Confident	81 Å²	81	29.3 Å²	29.3	49%	0.491	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-24.3	-175	-63.6	0	0	0	0	113.9	D159 P164 M370 F376	D159-V161 PolarHBondContact O-N 2.79Å; V161-P164 VanDerWaalsContact O-CD 3.32Å; V161-P164 WeakPolarHBondContact O-CD 3.46Å; V161-M370 WeakPolarHBondContact O-CE 3.46Å; V161-F376 HydrophobicContact CG2-CD2 4.04Å; V161-F376 HydrophobicContact CG2-CE2 3.53Å; V161-F376 HydrophobicContact CG2-CZ 3.95Å
162	V	90.4	Very high	85.4	Confident	4 Å²	4	29.5 Å²	29.5	2%	0.024	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-2.1	-174.4	-62.5	0	0	0	0	114.8	N81 T160 P164 Y165 N166 F376	N81-V162 HydrophobicContact CB-CG2 4.29Å; N81-V162 WeakPolarHBondContact O-CG2 3.41Å; T160-V162 VanDerWaalsContact C-N 3.33Å; T160-V162 HydrophobicContact CG2-CG2 3.66Å; T160-V162 PolarHBondContact O-N 2.78Å; V162-P164 VanDerWaalsContact C-N 3.33Å; V162-Y165 WeakPolarHBondContact O-CB 3.25Å; V162-Y165 PolarHBondContact O-N 2.8Å; V162-Y165 VanDerWaalsContact O-N 3.08Å; V162-N166 PolarHBondContact O-N 2.89Å; V162-F376 HydrophobicContact CG1-CB 3.78Å; V162-F376 HydrophobicContact CG1-CD2 4.12Å; V162-F376 HydrophobicContact CG1-CG 3.89Å
163	E	90.4	Very high	85.6	Confident	23 Å²	23	31.1 Å²	31.1	11%	0.107	17%	0.172	C	C	.	.	H	α-helix	trans	-55.2	-37.2	-179.6	-64.8	-177.9	161.1	0	0	114.7	P153 S158 T160 Y165 N166 A167	P153-E163 HydrophobicContact CB-CB 3.72Å; P153-E163 HydrophobicContact CB-CG 4.18Å; P153-E163 WeakPolarHBondContact CB-OE2 3.4Å; P153-E163 HydrophobicContact CG-CB 4Å; S158-E163 WeakPolarHBondContact CB-OE1 3.31Å; S158-E163 PolarHBondContact OG-OE1 2.84Å; T160-E163 HydrophobicContact CG2-CG 3.98Å; T160-E163 WeakPolarHBondContact O-CG 3.02Å; E163-Y165 VanDerWaalsContact C-N 3.29Å; E163-Y165 PolarHBondContact O-N 3.25Å; E163-N166 PolarHBondContact O-N 2.86Å; E163-A167 WeakPolarHBondContact O-CB 3.19Å; E163-A167 PolarHBondContact O-N 3.25Å
164	P	92.1	Very high	86	Confident	10 Å²	10	30.5 Å²	30.5	7%	0.065	17%	0.168	C	C	.	.	H	α-helix	trans	-61.6	-35.3	176.8	-24.6	35.7	0	0	0	113.2	V161 V162 T168 Q366 F367	V161-P164 VanDerWaalsContact O-CD 3.32Å; V161-P164 WeakPolarHBondContact O-CD 3.46Å; V162-P164 VanDerWaalsContact C-N 3.33Å; P164-T168 WeakPolarHBondContact O-CB 3.27Å; P164-T168 PolarHBondContact O-N 3.26Å; P164-T168 PolarHBondContact O-OG1 3.39Å; P164-Q366 HydrophobicContact CB-CB 3.94Å; P164-Q366 HydrophobicContact CG-CB 3.73Å; P164-F367 HydrophobicContact CB-CB 4.33Å
165	Y	93.4	Very high	86.7	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.4	-51.6	174.9	-72.6	-52.6	0	0	0	111	V162 E163 A167 T168 L169 F367 M370 F371 A375 Y380 F390	V162-Y165 WeakPolarHBondContact O-CB 3.25Å; V162-Y165 PolarHBondContact O-N 2.8Å; V162-Y165 VanDerWaalsContact O-N 3.08Å; E163-Y165 VanDerWaalsContact C-N 3.29Å; E163-Y165 PolarHBondContact O-N 3.25Å; Y165-A167 VanDerWaalsContact C-N 3.27Å; Y165-A167 PolarHBondContact O-N 2.87Å; Y165-T168 PolarHBondContact O-N 2.7Å; Y165-L169 VanDerWaalsContact O-CG 3.29Å; Y165-L169 WeakPolarHBondContact O-CG 3.08Å; Y165-L169 PolarHBondContact O-N 3.07Å; Y165-L169 VanDerWaalsContact O-N 3.08Å; Y165-F367 AromaticContact CD1-CD2 3.57Å; Y165-F367 HydrophobicContact CD1-CD2 3.57Å; Y165-F367 AromaticContact CD1-CE2 3.42Å; Y165-F367 HydrophobicContact CD1-CE2 3.42Å; Y165-F367 VanDerWaalsContact CD1-CE2 3.42Å; Y165-F367 HydrophobicContact CD1-CZ 4.19Å; Y165-F367 HydrophobicContact CE1-CD2 4.13Å; Y165-F367 AromaticContact CE1-CE2 3.96Å; Y165-F367 HydrophobicContact CE1-CE2 3.96Å; Y165-F367 HydrophobicContact CE1-CZ 4.33Å; Y165-F367 HydrophobicContact CG-CD2 4.5Å; Y165-M370 HydrophobicContact CD2-CE 3.73Å; Y165-M370 HydrophobicContact CE1-CB 4.42Å; Y165-M370 HydrophobicContact CE2-CB 4.13Å; Y165-M370 HydrophobicContact CE2-CE 3.53Å; Y165-M370 VanDerWaalsContact OH-C 3.22Å; Y165-M370 PolarHBondContact OH-O 2.85Å; Y165-F371 HydrophobicContact CE1-CB 4.03Å; Y165-F371 HydrophobicContact CE1-CD2 4.12Å; Y165-F371 VanDerWaalsContact OH-CA 3.31Å; Y165-F371 WeakPolarHBondContact OH-CA 3.48Å; Y165-F371 PolarHBondContact OH-N 3.17Å; Y165-A375 VanDerWaalsContact CE2-O 3.25Å; Y165-A375 WeakPolarHBondContact CE2-O 2.91Å; Y165-A375 PolarHBondContact OH-O 2.69Å; Y165-Y380 HydrophobicContact CD2-CE2 4.02Å; Y165-Y380 HydrophobicContact CG-CE2 4.44Å; Y165-F390 AromaticContact CD1-CD1 3.81Å; Y165-F390 HydrophobicContact CD1-CD1 3.81Å; Y165-F390 AromaticContact CD1-CE1 3.63Å; Y165-F390 HydrophobicContact CD1-CE1 3.63Å; Y165-F390 HydrophobicContact CE1-CD1 4.12Å; Y165-F390 HydrophobicContact CE1-CE1 4.16Å; Y165-F390 HydrophobicContact CG-CE1 4.07Å
166	N	93.8	Very high	87.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.7	-41.5	179.8	-61.5	-27.1	0	0	0	111.3	N81 W83 L121 G122 G123 V162 E163 S170 Y380	N81-N166 PolarHBondContact O-ND2 2.62Å; W83-N166 HydrophobicContact CB-CB 4.17Å; W83-N166 WeakPolarHBondContact CB-OD1 3.16Å; W83-N166 PolarHBondContact N-OD1 2.85Å; L121-N166 CarbonylContact O-C 3.23Å; L121-N166 VanDerWaalsContact O-C 3.23Å; L121-N166 VanDerWaalsContact O-CB 3.31Å; L121-N166 WeakPolarHBondContact O-CB 3.5Å; G122-N166 PolarHBondContact O-ND2 2.92Å; G123-N166 WeakPolarHBondContact O-CB 3.11Å; G123-N166 VanDerWaalsContact O-CG 3.24Å; G123-N166 PolarHBondContact O-ND2 2.83Å; V162-N166 PolarHBondContact O-N 2.89Å; E163-N166 PolarHBondContact O-N 2.86Å; N166-S170 VanDerWaalsContact O-CB 3.29Å; N166-S170 WeakPolarHBondContact O-CB 3.38Å; N166-S170 PolarHBondContact O-N 3.37Å; N166-S170 PolarHBondContact O-OG 3.36Å; N166-Y380 WeakPolarHBondContact OD1-CE1 3.4Å; N166-Y380 PolarHBondContact OD1-OH 3.29Å
167	A	93.1	Very high	88.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-68.2	-46	180	0	0	0	0	0	112.5	L121 P153 E163 Y165 L169 S170 V171 I363	L121-A167 HydrophobicContact CB-CB 4.18Å; L121-A167 PolarHBondContact O-N 2.97Å; P153-A167 HydrophobicContact CG-CB 3.9Å; E163-A167 WeakPolarHBondContact O-CB 3.19Å; E163-A167 PolarHBondContact O-N 3.25Å; Y165-A167 VanDerWaalsContact C-N 3.27Å; Y165-A167 PolarHBondContact O-N 2.87Å; A167-L169 PolarHBondContact O-N 3.11Å; A167-S170 PolarHBondContact O-N 3.05Å; A167-V171 VanDerWaalsContact O-CG2 3.31Å; A167-V171 WeakPolarHBondContact O-CG2 3.23Å; A167-V171 PolarHBondContact O-N 3.05Å; A167-I363 HydrophobicContact CB-CG2 3.98Å
168	T	94	Very high	89.7	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-61.5	-46	178.8	-62.1	0	0	0	0	111.7	P164 Y165 S170 V171 H172 F367 A393 M397	P164-T168 WeakPolarHBondContact O-CB 3.27Å; P164-T168 PolarHBondContact O-N 3.26Å; P164-T168 PolarHBondContact O-OG1 3.39Å; Y165-T168 PolarHBondContact O-N 2.7Å; T168-S170 VanDerWaalsContact C-N 3.3Å; T168-S170 PolarHBondContact O-N 3.09Å; T168-V171 PolarHBondContact O-N 3.06Å; T168-H172 PolarHBondContact O-N 2.96Å; T168-H172 VanDerWaalsContact O-N 3.12Å; T168-F367 VanDerWaalsContact CB-CD2 3.5Å; T168-F367 HydrophobicContact CG2-CD2 3.84Å; T168-F367 HydrophobicContact CG2-CE2 3.78Å; T168-F367 HydrophobicContact CG2-CG 4.3Å; T168-F367 HydrophobicContact CG2-CZ 4.28Å; T168-F367 VanDerWaalsContact OG1-CD2 3.28Å; T168-F367 WeakPolarHBondContact OG1-CD2 3.33Å; T168-A393 HydrophobicContact CG2-CB 4.04Å; T168-M397 HydrophobicContact CG2-CE 4.12Å
169	L	94.6	Very high	90.8	Very high	5 Å²	5	28.1 Å²	28.1	3%	0.026	15%	0.15	C	C	.	.	H	α-helix	trans	-63.5	-37.3	177	-64.2	171.3	0	0	0	112.1	W83 Y165 A167 Q173 Y380 M385 F390 A393	W83-L169 HydrophobicContact CB-CD1 4.34Å; W83-L169 HydrophobicContact CD2-CB 3.82Å; W83-L169 HydrophobicContact CD2-CD1 3.91Å; W83-L169 HydrophobicContact CE3-CB 4.19Å; W83-L169 HydrophobicContact CE3-CD1 3.7Å; W83-L169 HydrophobicContact CE3-CG 4.5Å; W83-L169 HydrophobicContact CG-CB 4.18Å; W83-L169 HydrophobicContact CG-CD1 4.2Å; W83-L169 HydrophobicContact CH2-CB 4.5Å; W83-L169 HydrophobicContact CZ2-CB 4.14Å; W83-L169 HydrophobicContact CZ3-CD1 4.31Å; Y165-L169 VanDerWaalsContact O-CG 3.29Å; Y165-L169 WeakPolarHBondContact O-CG 3.08Å; Y165-L169 PolarHBondContact O-N 3.07Å; Y165-L169 VanDerWaalsContact O-N 3.08Å; A167-L169 PolarHBondContact O-N 3.11Å; L169-Q173 PolarHBondContact O-N 3.36Å; L169-Y380 HydrophobicContact CD1-CD1 4.41Å; L169-Y380 HydrophobicContact CD1-CE1 4.39Å; L169-M385 HydrophobicContact CD1-CE 3.64Å; L169-M385 HydrophobicContact CD1-SD 4.07Å; L169-M385 HydrophobicContact CD2-CE 3.38Å; L169-M385 HydrophobicContact CG-CE 4.15Å; L169-F390 HydrophobicContact CD1-CE1 3.92Å; L169-F390 HydrophobicContact CD1-CZ 4.14Å; L169-F390 HydrophobicContact CD2-CD1 4.47Å; L169-A393 HydrophobicContact CD2-CB 3.76Å
170	S	94.5	Very high	91.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-71.3	-43.2	178.9	-57.6	0	0	0	0	112.5	W83 S127 N166 A167 T168 H172 Q173 L174	W83-S170 VanDerWaalsContact CD1-OG 3.26Å; W83-S170 PolarHBondContact NE1-OG 3.25Å; W83-S170 VanDerWaalsContact NE1-OG 3.16Å; S127-S170 VanDerWaalsContact CB-OG 3.26Å; S127-S170 WeakPolarHBondContact CB-OG 3.45Å; N166-S170 VanDerWaalsContact O-CB 3.29Å; N166-S170 WeakPolarHBondContact O-CB 3.38Å; N166-S170 PolarHBondContact O-N 3.37Å; N166-S170 PolarHBondContact O-OG 3.36Å; A167-S170 PolarHBondContact O-N 3.05Å; T168-S170 VanDerWaalsContact C-N 3.3Å; T168-S170 PolarHBondContact O-N 3.09Å; S170-H172 VanDerWaalsContact C-N 3.28Å; S170-H172 PolarHBondContact O-N 2.87Å; S170-Q173 PolarHBondContact O-N 3.21Å; S170-Q173 VanDerWaalsContact O-N 3.12Å; S170-L174 VanDerWaalsContact O-CG 3.31Å; S170-L174 WeakPolarHBondContact O-CG 3.49Å; S170-L174 PolarHBondContact O-N 2.74Å
171	V	93.6	Very high	92.6	Very high	2 Å²	2	18.2 Å²	18.2	1%	0.012	10%	0.095	C	C	.	.	H	α-helix	trans	-61.9	-40.3	178.4	169.9	0	0	0	0	110.6	L121 A167 T168 Q173 L174 V175 F247 F360 M397 L400	L121-V171 HydrophobicContact CD1-CG2 4.11Å; A167-V171 VanDerWaalsContact O-CG2 3.31Å; A167-V171 WeakPolarHBondContact O-CG2 3.23Å; A167-V171 PolarHBondContact O-N 3.05Å; T168-V171 PolarHBondContact O-N 3.06Å; V171-Q173 PolarHBondContact O-N 3Å; V171-L174 PolarHBondContact O-N 3.03Å; V171-V175 HydrophobicContact CG1-CG2 4.1Å; V171-V175 VanDerWaalsContact O-CG2 3.27Å; V171-V175 WeakPolarHBondContact O-CG2 3.18Å; V171-V175 PolarHBondContact O-N 3.26Å; V171-F247 HydrophobicContact CG1-CZ 4.23Å; V171-F360 HydrophobicContact CG1-CD1 4.25Å; V171-F360 HydrophobicContact CG1-CE1 3.74Å; V171-F360 HydrophobicContact CG2-CE1 4.04Å; V171-M397 HydrophobicContact CB-CE 3.38Å; V171-M397 HydrophobicContact CB-SD 4.31Å; V171-M397 HydrophobicContact CG1-CE 3.44Å; V171-M397 VanDerWaalsContact CG1-CE 3.44Å; V171-M397 HydrophobicContact CG1-SD 3.69Å; V171-M397 HydrophobicContact CG2-CE 3.88Å; V171-L400 HydrophobicContact CG1-CD2 4.39Å
172	H	93.8	Very high	93.1	Very high	34 Å²	34	14.3 Å²	14.3	16%	0.157	7%	0.071	C	C	.	.	H	α-helix	trans	-50.8	-45.9	173.4	170.5	31.9	0	0	0	111.9	T168 S170 E176 A393 N396	T168-H172 PolarHBondContact O-N 2.96Å; T168-H172 VanDerWaalsContact O-N 3.12Å; S170-H172 VanDerWaalsContact C-N 3.28Å; S170-H172 PolarHBondContact O-N 2.87Å; H172-E176 IonicContact CE1-OE1 3.91Å; H172-E176 IonicContact ND1-OE1 3.78Å; H172-A393 HydrophobicContact CB-CB 3.94Å; H172-N396 PolarHBondContact CE1-ND2 3.1Å; H172-N396 PolarHBondContact ND1-ND2 3.08Å
173	Q	93.6	Very high	93.2	Very high	36 Å²	36	14.3 Å²	14.3	17%	0.168	7%	0.071	C	C	.	.	H	α-helix	trans	-72.3	-33.2	177.7	-64.4	-61.9	-37.5	0	0	113.5	W83 T131 L169 S170 V171 N177	W83-Q173 HydrophobicContact CZ2-CG 4.22Å; T131-Q173 HydrophobicContact CG2-CB 3.77Å; T131-Q173 HydrophobicContact CG2-CG 4.45Å; L169-Q173 PolarHBondContact O-N 3.36Å; S170-Q173 PolarHBondContact O-N 3.21Å; S170-Q173 VanDerWaalsContact O-N 3.12Å; V171-Q173 PolarHBondContact O-N 3Å; Q173-N177 WeakPolarHBondContact O-CB 3.37Å; Q173-N177 PolarHBondContact O-N 3.2Å; Q173-N177 VanDerWaalsContact O-N 3.14Å; Q173-N177 PolarHBondContact O-ND2 3.4Å; Q173-N177 PolarHBondContact OE1-ND2 3.33Å
174	L	93.9	Very high	93.3	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-68.9	-38.1	179.3	-68.8	171.7	0	0	0	112.2	L121 I134 T148 S170 V171 E176 T178 H246 F247	L121-L174 HydrophobicContact CD1-CD1 4.31Å; L121-L174 HydrophobicContact CD2-CD1 3.63Å; I134-L174 HydrophobicContact CD1-CD2 3.66Å; T148-L174 HydrophobicContact CG2-CD2 3.99Å; S170-L174 VanDerWaalsContact O-CG 3.31Å; S170-L174 WeakPolarHBondContact O-CG 3.49Å; S170-L174 PolarHBondContact O-N 2.74Å; V171-L174 PolarHBondContact O-N 3.03Å; L174-E176 PolarHBondContact O-N 3.08Å; L174-T178 HydrophobicContact CB-CG2 4.45Å; L174-T178 HydrophobicContact CD2-CG2 3.54Å; L174-T178 PolarHBondContact O-N 3.15Å; L174-T178 VanDerWaalsContact O-N 3.16Å; L174-T178 PolarHBondContact O-OG1 2.75Å; L174-H246 PolarHBondContact O-NE2 2.94Å; L174-F247 HydrophobicContact CB-CE1 4.31Å; L174-F247 HydrophobicContact CB-CZ 4.3Å
175	V	93.1	Very high	93.3	Very high	8 Å²	8	12.8 Å²	12.8	5%	0.048	6%	0.063	C	C	.	.	H	α-helix	trans	-56.7	-33.9	178.9	172	0	0	0	0	111.8	V171 R244 H246 F247 L400	V171-V175 HydrophobicContact CG1-CG2 4.1Å; V171-V175 VanDerWaalsContact O-CG2 3.27Å; V171-V175 WeakPolarHBondContact O-CG2 3.18Å; V171-V175 PolarHBondContact O-N 3.26Å; V175-R244 HydrophobicContact CG1-CB 4.27Å; V175-R244 HydrophobicContact CG1-CG 4.13Å; V175-H246 PolarHBondContact O-CE1 2.78Å; V175-F247 HydrophobicContact CG2-CE2 3.75Å; V175-F247 HydrophobicContact CG2-CZ 3.71Å; V175-L400 HydrophobicContact CG2-CD1 4.45Å; V175-L400 HydrophobicContact CG2-CD2 3.86Å
176	E	89.7	Confident	93	Very high	111 Å²	111	14.1 Å²	14.1	52%	0.519	7%	0.07	S	C	.	.	H	α-helix	trans	-97.9	-33.6	-174.7	-65.5	177.8	-169.8	0	0	112.9	H172 L174	H172-E176 IonicContact CE1-OE1 3.91Å; H172-E176 IonicContact ND1-OE1 3.78Å; L174-E176 PolarHBondContact O-N 3.08Å
177	N	92.6	Very high	92.6	Very high	25 Å²	25	15.8 Å²	15.8	13%	0.134	8%	0.078	C	C	.	.	H	α-helix	trans	-106.7	-2.9	-167.5	-59.1	-67.6	0	0	0	114.9	I134 Q173	I134-N177 HydrophobicContact CG2-CB 3.55Å; Q173-N177 WeakPolarHBondContact O-CB 3.37Å; Q173-N177 PolarHBondContact O-N 3.2Å; Q173-N177 VanDerWaalsContact O-N 3.14Å; Q173-N177 PolarHBondContact O-ND2 3.4Å; Q173-N177 PolarHBondContact OE1-ND2 3.33Å
178	T	93.6	Very high	92.4	Very high	7 Å²	7	16.1 Å²	16.1	4%	0.043	8%	0.081	C	C	.	.			trans	-117.1	147.4	-179.6	71.1	0	0	0	0	112.7	I134 M146 T148 L174 T181 H246	I134-T178 HydrophobicContact CD1-CG2 4.04Å; I134-T178 HydrophobicContact CG2-CG2 3.85Å; M146-T178 HydrophobicContact CG-CG2 3.99Å; T148-T178 HydrophobicContact CG2-CG2 3.56Å; L174-T178 HydrophobicContact CB-CG2 4.45Å; L174-T178 HydrophobicContact CD2-CG2 3.54Å; L174-T178 PolarHBondContact O-N 3.15Å; L174-T178 VanDerWaalsContact O-N 3.16Å; L174-T178 PolarHBondContact O-OG1 2.75Å; T178-T181 PolarHBondContact OG1-OG1 3.4Å; T178-H246 PolarHBondContact O-CE1 3.36Å; T178-H246 VanDerWaalsContact O-CE1 3.32Å; T178-H246 PolarHBondContact O-NE2 3.48Å; T178-H246 PolarHBondContact OG1-CD2 2.88Å; T178-H246 PolarHBondContact OG1-NE2 3.12Å
179	D	92.4	Very high	92.2	Very high	35 Å²	35	16.1 Å²	16.1	19%	0.187	8%	0.081	C	C	.	.	S	Bend	trans	-94.4	-31.2	177.6	-56.5	-65.8	0	0	0	111.3	R138 I145 M146 H246	R138-D179 IonicContact CZ-OD1 3.06Å; R138-D179 IonicContact CZ-OD2 3.41Å; R138-D179 IonicContact NH1-OD1 3.53Å; R138-D179 PolarHBondContact NH1-OD1 3.02Å; R138-D179 IonicContact NH1-OD2 3.23Å; R138-D179 PolarHBondContact NH1-OD2 3.29Å; R138-D179 IonicContact NH2-OD1 2.79Å; R138-D179 PolarHBondContact NH2-OD1 3.34Å; R138-D179 IonicContact NH2-OD2 3.97Å; I145-D179 VanDerWaalsContact CA-OD2 3.31Å; I145-D179 WeakPolarHBondContact CA-OD2 3.44Å; I145-D179 HydrophobicContact CD1-CB 4.23Å; I145-D179 HydrophobicContact CG2-CB 4.35Å; M146-D179 PolarHBondContact N-OD2 3.27Å; M146-D179 PolarHBondContact O-N 3.31Å; D179-H246 WeakPolarHBondContact O-CB 3.32Å
180	E	92.5	Very high	91.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	128.6	175.1	-57.9	-178.5	174.3	0	0	111.1	M146 N147 T148 Y182 A236 F248	M146-E180 PolarHBondContact O-N 3.41Å; N147-E180 CarbonylContact C-O 3.19Å; N147-E180 WeakPolarHBondContact CA-O 3.39Å; N147-E180 PolarHBondContact ND2-OE2 2.91Å; N147-E180 WeakPolarHBondContact OD1-CB 3.35Å; T148-E180 PolarHBondContact N-O 3.2Å; E180-Y182 HydrophobicContact CB-CE2 4.23Å; E180-Y182 PolarHBondContact OE2-OH 3.27Å; E180-A236 HydrophobicContact CG-CB 4.14Å; E180-A236 WeakPolarHBondContact OE1-CA 3.44Å; E180-A236 VanDerWaalsContact OE1-CB 3.28Å; E180-A236 WeakPolarHBondContact OE1-CB 3.35Å; E180-A236 PolarHBondContact OE1-N 3.43Å; E180-F248 HydrophobicContact CB-CD2 4.37Å; E180-F248 HydrophobicContact CB-CE2 3.7Å; E180-F248 HydrophobicContact CB-CZ 4.48Å; E180-F248 HydrophobicContact CG-CE2 3.71Å; E180-F248 HydrophobicContact CG-CZ 4.21Å
181	T	94.8	Very high	91.6	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	115.7	174.7	-71.7	0	0	0	0	110.9	T148 T178 C183 H246 F247 F248	T148-T181 WeakPolarHBondContact OG1-CG2 3.42Å; T148-T181 PolarHBondContact OG1-OG1 2.94Å; T178-T181 PolarHBondContact OG1-OG1 3.4Å; T181-C183 PolarHBondContact O-N 3.06Å; T181-H246 PolarHBondContact N-O 2.96Å; T181-F247 HydrophobicContact CG2-CD1 3.6Å; T181-F247 HydrophobicContact CG2-CE1 3.78Å; T181-F247 CarbonylContact O-C 3.49Å; T181-F247 WeakPolarHBondContact O-CA 3.44Å; T181-F248 PolarHBondContact O-N 2.97Å
182	Y	94.9	Very high	91.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	107.3	174	-61.8	-89.9	0	0	0	109.3	T148 F149 S150 E180 I184 V218 L235 F248 I350	T148-Y182 WeakPolarHBondContact O-CD2 3.26Å; T148-Y182 PolarHBondContact O-N 2.84Å; F149-Y182 HydrophobicContact CD1-CD2 4.06Å; F149-Y182 AromaticContact CD1-CG 3.95Å; F149-Y182 HydrophobicContact CD1-CG 3.95Å; F149-Y182 HydrophobicContact CE1-CD1 4.23Å; F149-Y182 AromaticContact CE1-CD2 3.67Å; F149-Y182 HydrophobicContact CE1-CD2 3.67Å; F149-Y182 HydrophobicContact CE1-CE2 4.35Å; F149-Y182 AromaticContact CE1-CG 3.63Å; F149-Y182 HydrophobicContact CE1-CG 3.63Å; F149-Y182 HydrophobicContact CE2-CD2 4.11Å; F149-Y182 HydrophobicContact CE2-CE2 4.46Å; F149-Y182 HydrophobicContact CG-CD2 4.48Å; F149-Y182 AromaticContact CZ-CD2 3.71Å; F149-Y182 HydrophobicContact CZ-CD2 3.71Å; F149-Y182 HydrophobicContact CZ-CE2 4.03Å; F149-Y182 HydrophobicContact CZ-CG 4.14Å; S150-Y182 PolarHBondContact N-O 3.44Å; E180-Y182 HydrophobicContact CB-CE2 4.23Å; E180-Y182 PolarHBondContact OE2-OH 3.27Å; Y182-I184 PolarHBondContact O-N 3.42Å; Y182-V218 HydrophobicContact CD1-CG1 4.46Å; Y182-V218 HydrophobicContact CD1-CG2 4.18Å; Y182-V218 HydrophobicContact CE1-CB 4.41Å; Y182-V218 HydrophobicContact CE1-CG1 3.6Å; Y182-V218 HydrophobicContact CE1-CG2 3.86Å; Y182-V218 HydrophobicContact CE2-CG1 4.13Å; Y182-V218 VanDerWaalsContact CZ-CG1 3.44Å; Y182-V218 WeakPolarHBondContact OH-CG1 3.12Å; Y182-L235 WeakPolarHBondContact OH-CD2 3.47Å; Y182-F248 HydrophobicContact CD1-CB 4.21Å; Y182-F248 HydrophobicContact CD1-CD2 4.13Å; Y182-F248 HydrophobicContact CE1-CB 4.48Å; Y182-F248 AromaticContact CE1-CD2 3.74Å; Y182-F248 HydrophobicContact CE1-CD2 3.74Å; Y182-F248 HydrophobicContact CE2-CD2 4.41Å; Y182-F248 AromaticContact CZ-CD2 3.86Å; Y182-I350 HydrophobicContact CD1-CG2 4.41Å; Y182-I350 HydrophobicContact CE1-CD1 4.08Å; Y182-I350 HydrophobicContact CE1-CG1 4.23Å; Y182-I350 HydrophobicContact CE1-CG2 3.76Å
183	C	93.5	Very high	91	Very high	4 Å²	4	19.5 Å²	19.5	3%	0.027	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	111.7	179.2	-68.3	0	0	0	0	110.4	T181 F248 P250 I356 L359	T181-C183 PolarHBondContact O-N 3.06Å; C183-F248 WeakPolarHBondContact CB-O 3.44Å; C183-F248 PolarHBondContact N-O 3.32Å; C183-P250 WeakPolarHBondContact O-CD 3.37Å; C183-P250 WeakPolarHBondContact O-CG 3.39Å; C183-I356 HydrophobicContact CB-CD1 4.02Å; C183-L359 HydrophobicContact CB-CD2 4.33Å
184	I	92.9	Very high	90.7	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	111.3	176.5	-57	173.9	0	0	0	107.8	F149 S150 V151 V152 Y182 L189 V211 P250	F149-I184 HydrophobicContact CB-CD1 4.34Å; F149-I184 HydrophobicContact CD1-CD1 4.22Å; S150-I184 PolarHBondContact O-N 3.49Å; V151-I184 CarbonylContact C-O 3.58Å; V151-I184 VanDerWaalsContact CA-O 3.28Å; V151-I184 WeakPolarHBondContact CA-O 3.44Å; V151-I184 HydrophobicContact CG2-CB 4.36Å; V152-I184 PolarHBondContact N-O 3.09Å; Y182-I184 PolarHBondContact O-N 3.42Å; I184-L189 HydrophobicContact CG2-CD1 3.61Å; I184-L189 HydrophobicContact CG2-CD2 4.45Å; I184-L189 HydrophobicContact CG2-CG 4.18Å; I184-V211 HydrophobicContact CD1-CG1 3.75Å; I184-V211 HydrophobicContact CD1-CG2 4.28Å; I184-V211 HydrophobicContact CG2-CG2 3.68Å; I184-P250 HydrophobicContact CG1-CG 4.31Å
185	D	90.9	Very high	90.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	120.5	-178.8	-169.6	-9.8	0	0	0	111.5	E187 A188 L189 M282 A284 L359 R362	D185-E187 PolarHBondContact O-N 3.3Å; D185-E187 VanDerWaalsContact OD1-CB 3.26Å; D185-E187 WeakPolarHBondContact OD1-CB 3.47Å; D185-E187 PolarHBondContact OD1-N 2.86Å; D185-A188 HydrophobicContact CB-CB 4.16Å; D185-A188 PolarHBondContact O-N 2.84Å; D185-A188 VanDerWaalsContact O-N 3.12Å; D185-L189 WeakPolarHBondContact O-CG 3.49Å; D185-L189 PolarHBondContact O-N 2.98Å; D185-M282 PolarHBondContact N-O 3.18Å; D185-A284 WeakPolarHBondContact OD2-CB 3.44Å; D185-A284 PolarHBondContact OD2-N 3.04Å; D185-L359 HydrophobicContact CB-CD1 4.01Å; D185-L359 WeakPolarHBondContact OD2-CD1 3.4Å; D185-R362 IonicContact OD1-NH2 2.92Å; D185-R362 IonicContact OD2-CZ 3.58Å; D185-R362 VanDerWaalsContact OD2-CZ 3.29Å; D185-R362 IonicContact OD2-NH1 3.76Å; D185-R362 PolarHBondContact OD2-NH1 3.35Å; D185-R362 IonicContact OD2-NH2 3.4Å; D185-R362 PolarHBondContact OD2-NH2 2.83Å
186	N	87.4	Confident	89.8	Confident	27 Å²	27	31.3 Å²	31.3	14%	0.144	15%	0.145	C	C	.	.	H	α-helix	trans	-57.5	-30.2	173.7	-81.3	-25.3	0	0	0	112.8	V151 V152 V157 Y190	V151-N186 WeakPolarHBondContact CG1-ND2 3.13Å; V151-N186 WeakPolarHBondContact CG1-OD1 3.47Å; V152-N186 PolarHBondContact O-N 3.43Å; V157-N186 HydrophobicContact CB-CB 4.14Å; V157-N186 HydrophobicContact CG1-CB 4.32Å; V157-N186 HydrophobicContact CG2-CB 3.99Å; N186-Y190 VanDerWaalsContact O-CB 3.31Å; N186-Y190 WeakPolarHBondContact O-CB 3.35Å; N186-Y190 PolarHBondContact O-N 2.85Å
187	E	86.2	Confident	89.6	Confident	35 Å²	35	27.6 Å²	27.6	16%	0.164	13%	0.128	C	C	.	.	H	α-helix	trans	-63.2	-48.1	175	-174.2	156.1	-176.6	0	0	111.9	S154 K156 D185 Y190 D191 A284 R362	S154-E187 WeakPolarHBondContact OG-CB 3.29Å; K156-E187 HydrophobicContact CD-CG 4.06Å; K156-E187 WeakPolarHBondContact CE-OE1 3.46Å; K156-E187 IonicContact NZ-OE1 3.89Å; K156-E187 PolarHBondContact NZ-OE1 2.78Å; D185-E187 PolarHBondContact O-N 3.3Å; D185-E187 VanDerWaalsContact OD1-CB 3.26Å; D185-E187 WeakPolarHBondContact OD1-CB 3.47Å; D185-E187 PolarHBondContact OD1-N 2.86Å; E187-Y190 PolarHBondContact O-N 3.08Å; E187-D191 WeakPolarHBondContact O-CB 3.35Å; E187-D191 PolarHBondContact O-N 3.45Å; E187-A284 HydrophobicContact CB-CB 4.07Å; E187-A284 HydrophobicContact CG-CB 4.12Å; E187-R362 IonicContact OE2-CZ 3.97Å; E187-R362 IonicContact OE2-NE 2.69Å; E187-R362 IonicContact OE2-NH1 3.57Å; E187-R362 PolarHBondContact OE2-NH1 2.96Å
188	A	89	Confident	89.3	Confident	7 Å²	7	33.6 Å²	33.6	6%	0.058	15%	0.153	C	C	.	.	H	α-helix	trans	-66.7	-43.3	179.9	0	0	0	0	0	111.2	D185 Y190 D191 I192 A284	D185-A188 HydrophobicContact CB-CB 4.16Å; D185-A188 PolarHBondContact O-N 2.84Å; D185-A188 VanDerWaalsContact O-N 3.12Å; A188-Y190 VanDerWaalsContact C-N 3.32Å; A188-Y190 PolarHBondContact O-N 2.83Å; A188-D191 PolarHBondContact O-N 2.82Å; A188-I192 WeakPolarHBondContact O-CB 3.42Å; A188-I192 VanDerWaalsContact O-CG1 3.27Å; A188-I192 WeakPolarHBondContact O-CG1 2.9Å; A188-I192 PolarHBondContact O-N 3.38Å; A188-A284 HydrophobicContact CB-CB 4.03Å
189	L	89.6	Confident	88.8	Confident	1 Å²	1	36 Å²	36	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-60.1	-43	176.2	-64.9	179.9	0	0	0	111.7	I184 D185 I192 C193 L207 L210 V211 M282	I184-L189 HydrophobicContact CG2-CD1 3.61Å; I184-L189 HydrophobicContact CG2-CD2 4.45Å; I184-L189 HydrophobicContact CG2-CG 4.18Å; D185-L189 WeakPolarHBondContact O-CG 3.49Å; D185-L189 PolarHBondContact O-N 2.98Å; L189-I192 PolarHBondContact O-N 3.29Å; L189-C193 WeakPolarHBondContact O-CB 3.45Å; L189-C193 PolarHBondContact O-N 3.11Å; L189-C193 PolarHBondContact O-SG 2.87Å; L189-C193 VanDerWaalsContact O-SG 3.36Å; L189-L207 HydrophobicContact CB-CB 4.47Å; L189-L207 HydrophobicContact CB-CD2 4.09Å; L189-L207 HydrophobicContact CB-CG 3.91Å; L189-L207 HydrophobicContact CD1-CB 4.24Å; L189-L207 HydrophobicContact CD1-CD2 4.47Å; L189-L207 HydrophobicContact CD1-CG 4.45Å; L189-L210 HydrophobicContact CD2-CB 3.88Å; L189-L210 HydrophobicContact CD2-CD1 3.99Å; L189-V211 HydrophobicContact CD1-CG2 3.58Å; L189-V211 HydrophobicContact CD2-CG2 4.5Å; L189-M282 HydrophobicContact CD2-CB 4.26Å; L189-M282 HydrophobicContact CD2-CG 4.07Å; L189-M282 HydrophobicContact CD2-SD 3.91Å
190	Y	87.6	Confident	88.4	Confident	71 Å²	71	39.9 Å²	39.9	28%	0.278	19%	0.19	S	C	.	.	H	α-helix	trans	-63.6	-46.4	176.9	-171	-87.6	0	0	0	111.5	V157 N186 E187 A188 I192 C193 F194 P202	V157-Y190 HydrophobicContact CG2-CD2 4.25Å; V157-Y190 HydrophobicContact CG2-CG 4.41Å; N186-Y190 VanDerWaalsContact O-CB 3.31Å; N186-Y190 WeakPolarHBondContact O-CB 3.35Å; N186-Y190 PolarHBondContact O-N 2.85Å; E187-Y190 PolarHBondContact O-N 3.08Å; A188-Y190 VanDerWaalsContact C-N 3.32Å; A188-Y190 PolarHBondContact O-N 2.83Å; Y190-I192 VanDerWaalsContact C-N 3.33Å; Y190-I192 PolarHBondContact O-N 2.77Å; Y190-C193 PolarHBondContact O-N 2.97Å; Y190-F194 HydrophobicContact CE1-CB 4.29Å; Y190-F194 WeakPolarHBondContact O-CB 3.34Å; Y190-F194 PolarHBondContact O-N 2.81Å; Y190-P202 HydrophobicContact CD2-CB 4.07Å; Y190-P202 HydrophobicContact CD2-CG 4.06Å; Y190-P202 HydrophobicContact CE2-CB 4Å; Y190-P202 HydrophobicContact CE2-CG 3.76Å
191	D	88	Confident	88	Confident	38 Å²	38	45 Å²	45	20%	0.203	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-37	178.9	-81.3	-8.9	0	0	0	111.8	K156 E187 A188 R195	K156-D191 IonicContact NZ-OD1 3.29Å; K156-D191 IonicContact NZ-OD2 2.73Å; K156-D191 PolarHBondContact NZ-OD2 3.18Å; E187-D191 WeakPolarHBondContact O-CB 3.35Å; E187-D191 PolarHBondContact O-N 3.45Å; A188-D191 PolarHBondContact O-N 2.82Å; D191-R195 WeakPolarHBondContact O-CA 3.46Å; D191-R195 WeakPolarHBondContact O-CB 3.27Å; D191-R195 WeakPolarHBondContact O-CG 3.49Å; D191-R195 PolarHBondContact O-N 2.88Å
192	I	88.3	Confident	87.5	Confident	4 Å²	4	46 Å²	46	2%	0.021	23%	0.228	C	C	.	.	I	π-helix	trans	-61.6	-52.1	171.9	-73.8	166.7	0	0	0	110.7	A188 L189 Y190 F194 T196 L197 L210 L255 K279 M281	A188-I192 WeakPolarHBondContact O-CB 3.42Å; A188-I192 VanDerWaalsContact O-CG1 3.27Å; A188-I192 WeakPolarHBondContact O-CG1 2.9Å; A188-I192 PolarHBondContact O-N 3.38Å; L189-I192 PolarHBondContact O-N 3.29Å; Y190-I192 VanDerWaalsContact C-N 3.33Å; Y190-I192 PolarHBondContact O-N 2.77Å; I192-F194 VanDerWaalsContact C-N 3.33Å; I192-F194 PolarHBondContact O-N 2.75Å; I192-T196 WeakPolarHBondContact O-CA 3.41Å; I192-T196 WeakPolarHBondContact O-CB 3.31Å; I192-T196 PolarHBondContact O-N 2.8Å; I192-L197 PolarHBondContact O-N 3Å; I192-L210 HydrophobicContact CB-CD1 4.23Å; I192-L210 HydrophobicContact CG2-CD1 3.66Å; I192-L255 HydrophobicContact CD1-CD1 4.11Å; I192-L255 HydrophobicContact CG1-CD1 4.36Å; I192-L255 HydrophobicContact CG2-CD1 3.78Å; I192-L255 HydrophobicContact CG2-CD2 4.44Å; I192-K279 VanDerWaalsContact CG1-O 3.32Å; I192-K279 WeakPolarHBondContact CG1-O 3.42Å; I192-M281 WeakPolarHBondContact CD1-O 3.35Å
193	C	87.4	Confident	87.1	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.252	C	S	.	.	I	π-helix	trans	-60.3	-44.6	-178.7	-75.6	0	0	0	0	111.7	L189 Y190 L197 K198 L199 P202	L189-C193 WeakPolarHBondContact O-CB 3.45Å; L189-C193 PolarHBondContact O-N 3.11Å; L189-C193 PolarHBondContact O-SG 2.87Å; L189-C193 VanDerWaalsContact O-SG 3.36Å; Y190-C193 PolarHBondContact O-N 2.97Å; C193-L197 CarbonylContact O-C 3.51Å; C193-L197 WeakPolarHBondContact O-CB 3.2Å; C193-K198 PolarHBondContact O-N 3.1Å; C193-L199 HydrophobicContact CB-CD1 4.31Å; C193-L199 WeakPolarHBondContact O-CB 3.34Å; C193-L199 PolarHBondContact O-N 3.15Å; C193-P202 HydrophobicContact CB-CB 3.73Å; C193-P202 HydrophobicContact CB-CG 3.76Å
194	F	86.4	Confident	86.7	Confident	98 Å²	98	56.1 Å²	56.1	43%	0.43	28%	0.276	S	S	.	.	I	π-helix	trans	-75.4	-50.8	-177	-172.7	-102.6	0	0	0	112.6	Y190 I192 K198 L199 P202	Y190-F194 HydrophobicContact CE1-CB 4.29Å; Y190-F194 WeakPolarHBondContact O-CB 3.34Å; Y190-F194 PolarHBondContact O-N 2.81Å; I192-F194 VanDerWaalsContact C-N 3.33Å; I192-F194 PolarHBondContact O-N 2.75Å; F194-K198 WeakPolarHBondContact O-CA 3.41Å; F194-L199 WeakPolarHBondContact CD2-O 3.48Å; F194-P202 HydrophobicContact CB-CG 4.25Å
195	R	84.7	Confident	86.4	Confident	154 Å²	154	58.1 Å²	58.1	58%	0.581	30%	0.296	S	S	*	.	I	π-helix	trans	-86.1	-41.3	-172.5	-59.2	-179.5	178.3	179	0.8	113.1	D191 K198	D191-R195 WeakPolarHBondContact O-CA 3.46Å; D191-R195 WeakPolarHBondContact O-CB 3.27Å; D191-R195 WeakPolarHBondContact O-CG 3.49Å; D191-R195 PolarHBondContact O-N 2.88Å; R195-K198 WeakPolarHBondContact O-CD 3.25Å; R195-K198 VanDerWaalsContact O-CE 3.23Å; R195-K198 WeakPolarHBondContact O-CE 3.41Å; R195-K198 PolarHBondContact O-NZ 3.39Å
196	T	84	Confident	86.1	Confident	39 Å²	39	60.2 Å²	60.2	24%	0.239	31%	0.308	C	S	.	.	I	π-helix	trans	-90.7	-50.8	-174.1	-56.2	0	0	0	0	111.3	I192 K198 L255	I192-T196 WeakPolarHBondContact O-CA 3.41Å; I192-T196 WeakPolarHBondContact O-CB 3.31Å; I192-T196 PolarHBondContact O-N 2.8Å; T196-K198 VanDerWaalsContact C-N 3.3Å; T196-K198 PolarHBondContact O-N 3.35Å; T196-L255 HydrophobicContact CG2-CB 4.08Å
197	L	84.4	Confident	86.2	Confident	33 Å²	33	59.1 Å²	59.1	17%	0.173	30%	0.302	C	S	.	.	S	Bend	trans	-80.7	-10.6	179.9	-59.1	179.1	0	0	0	113.6	I192 C193 L199 L210 S257	I192-L197 PolarHBondContact O-N 3Å; C193-L197 CarbonylContact O-C 3.51Å; C193-L197 WeakPolarHBondContact O-CB 3.2Å; L197-L199 VanDerWaalsContact C-N 3.27Å; L197-L199 HydrophobicContact CB-CD1 4.32Å; L197-L199 HydrophobicContact CB-CG 4.09Å; L197-L199 HydrophobicContact CD1-CD1 4.48Å; L197-L199 PolarHBondContact O-N 3Å; L197-L210 HydrophobicContact CD1-CD2 4.4Å; L197-S257 VanDerWaalsContact O-CB 3.29Å; L197-S257 WeakPolarHBondContact O-CB 3.36Å
198	K	86.1	Confident	86.3	Confident	151 Å²	151	61 Å²	61	66%	0.657	31%	0.313	S	S	*	.			trans	60.5	33.2	180	-54.3	-59.8	-174.5	-165.8	0	113.3	C193 F194 R195 T196	C193-K198 PolarHBondContact O-N 3.1Å; F194-K198 WeakPolarHBondContact O-CA 3.41Å; R195-K198 WeakPolarHBondContact O-CD 3.25Å; R195-K198 VanDerWaalsContact O-CE 3.23Å; R195-K198 WeakPolarHBondContact O-CE 3.41Å; R195-K198 PolarHBondContact O-NZ 3.39Å; T196-K198 VanDerWaalsContact C-N 3.3Å; T196-K198 PolarHBondContact O-N 3.35Å
199	L	84.3	Confident	86.2	Confident	58 Å²	58	66 Å²	66	30%	0.304	34%	0.335	S	S	.	.			trans	-82.5	118.1	172.6	-60	177.3	0	0	0	108.9	C193 F194 L197 T201 D206	C193-L199 HydrophobicContact CB-CD1 4.31Å; C193-L199 WeakPolarHBondContact O-CB 3.34Å; C193-L199 PolarHBondContact O-N 3.15Å; F194-L199 WeakPolarHBondContact CD2-O 3.48Å; L197-L199 VanDerWaalsContact C-N 3.27Å; L197-L199 HydrophobicContact CB-CD1 4.32Å; L197-L199 HydrophobicContact CB-CG 4.09Å; L197-L199 HydrophobicContact CD1-CD1 4.48Å; L197-L199 PolarHBondContact O-N 3Å; L199-T201 VanDerWaalsContact C-N 3.29Å; L199-T201 PolarHBondContact O-N 2.87Å; L199-D206 HydrophobicContact CD1-CB 4.04Å
200	T	83.1	Confident	86.2	Confident	116 Å²	116	66.4 Å²	66.4	71%	0.712	34%	0.337	S	S	*	.	S	Bend	trans	-67.2	-31.1	-178.2	46.3	0	0	0	0	113
201	T	83.5	Confident	86.3	Confident	107 Å²	107	63.9 Å²	63.9	66%	0.656	33%	0.329	S	S	*	.	S	Bend	trans	-137.1	84.9	-179.6	52	0	0	0	0	109.1	L199 T203	L199-T201 VanDerWaalsContact C-N 3.29Å; L199-T201 PolarHBondContact O-N 2.87Å; T201-T203 PolarHBondContact O-N 3.45Å
202	P	84.9	Confident	86.5	Confident	21 Å²	21	62.2 Å²	62.2	14%	0.136	32%	0.32	C	S	.	.			trans	-59.7	132.3	175.9	-22.7	34.2	0	0	0	111.4	Y190 C193 F194 L207	Y190-P202 HydrophobicContact CD2-CB 4.07Å; Y190-P202 HydrophobicContact CD2-CG 4.06Å; Y190-P202 HydrophobicContact CE2-CB 4Å; Y190-P202 HydrophobicContact CE2-CG 3.76Å; C193-P202 HydrophobicContact CB-CB 3.73Å; C193-P202 HydrophobicContact CB-CG 3.76Å; F194-P202 HydrophobicContact CB-CG 4.25Å; P202-L207 HydrophobicContact CB-CD1 4.02Å
203	T	87.4	Confident	86.5	Confident	80 Å²	80	63 Å²	63	49%	0.491	33%	0.327	S	S	.	.			trans	-104.4	160.9	174.2	67	0	0	0	0	110.6	T201 G205 D206 L207	T201-T203 PolarHBondContact O-N 3.45Å; T203-G205 PolarHBondContact O-N 3.16Å; T203-G205 VanDerWaalsContact O-N 3.12Å; T203-G205 PolarHBondContact OG1-N 2.93Å; T203-D206 PolarHBondContact N-OD2 2.94Å; T203-D206 WeakPolarHBondContact O-CB 3.07Å; T203-D206 PolarHBondContact O-N 2.95Å; T203-D206 PolarHBondContact OG1-OD2 3.44Å; T203-L207 WeakPolarHBondContact O-CD1 3.41Å; T203-L207 PolarHBondContact O-N 2.94Å
204	Y	84.4	Confident	86.6	Confident	138 Å²	138	63 Å²	63	54%	0.541	33%	0.327	S	S	.	.	H	α-helix	trans	-56.2	-28.2	172.8	-76.2	-69	0	0	0	113	V157 D206 L207 N208	V157-Y204 HydrophobicContact CG1-CE1 3.78Å; V157-Y204 PolarHBondContact O-OH 3.46Å; Y204-D206 VanDerWaalsContact C-N 3.31Å; Y204-D206 PolarHBondContact O-N 2.79Å; Y204-L207 PolarHBondContact O-N 3.3Å; Y204-N208 WeakPolarHBondContact O-CB 3.46Å; Y204-N208 PolarHBondContact O-N 2.95Å; Y204-N208 PolarHBondContact O-ND2 3.05Å
205	G	85.8	Confident	86.8	Confident	42 Å²	42	58.7 Å²	58.7	43%	0.433	31%	0.309	S	S	.	.	H	α-helix	trans	-61.2	-39.3	172.6	0	0	0	0	0	112.8	T203 H209	T203-G205 PolarHBondContact O-N 3.16Å; T203-G205 VanDerWaalsContact O-N 3.12Å; T203-G205 PolarHBondContact OG1-N 2.93Å; G205-H209 WeakPolarHBondContact O-CB 3.27Å; G205-H209 PolarHBondContact O-N 3.25Å
206	D	86.4	Confident	87.1	Confident	44 Å²	44	51.4 Å²	51.4	24%	0.235	28%	0.281	C	S	.	.	H	α-helix	trans	-71.1	-42.7	178	-56.1	-59.6	0	0	0	111.5	L199 T203 Y204 H209 L210	L199-D206 HydrophobicContact CD1-CB 4.04Å; T203-D206 PolarHBondContact N-OD2 2.94Å; T203-D206 WeakPolarHBondContact O-CB 3.07Å; T203-D206 PolarHBondContact O-N 2.95Å; T203-D206 PolarHBondContact OG1-OD2 3.44Å; Y204-D206 VanDerWaalsContact C-N 3.31Å; Y204-D206 PolarHBondContact O-N 2.79Å; D206-H209 WeakPolarHBondContact O-CB 3.41Å; D206-H209 PolarHBondContact O-N 3.49Å; D206-L210 PolarHBondContact O-N 2.74Å
207	L	88.1	Confident	87.3	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-61.8	-47.2	175.4	-79.9	73	0	0	0	110.4	L189 P202 T203 Y204 H209 L210 V211	L189-L207 HydrophobicContact CB-CB 4.47Å; L189-L207 HydrophobicContact CB-CD2 4.09Å; L189-L207 HydrophobicContact CB-CG 3.91Å; L189-L207 HydrophobicContact CD1-CB 4.24Å; L189-L207 HydrophobicContact CD1-CD2 4.47Å; L189-L207 HydrophobicContact CD1-CG 4.45Å; P202-L207 HydrophobicContact CB-CD1 4.02Å; T203-L207 WeakPolarHBondContact O-CD1 3.41Å; T203-L207 PolarHBondContact O-N 2.94Å; Y204-L207 PolarHBondContact O-N 3.3Å; L207-H209 PolarHBondContact O-N 3.2Å; L207-L210 WeakPolarHBondContact O-CB 3.47Å; L207-L210 PolarHBondContact O-N 3.27Å; L207-L210 VanDerWaalsContact O-N 3.12Å; L207-V211 WeakPolarHBondContact O-CG2 3.49Å; L207-V211 PolarHBondContact O-N 2.81Å
208	N	89.4	Confident	87.4	Confident	75 Å²	75	48.4 Å²	48.4	40%	0.401	26%	0.264	S	S	.	.	H	α-helix	trans	-64.7	-28.8	179	-69.7	-19.3	0	0	0	112.4	M1 Y204 S212	M1-N208 HydrophobicContact CG-CB 3.98Å; Y204-N208 WeakPolarHBondContact O-CB 3.46Å; Y204-N208 PolarHBondContact O-N 2.95Å; Y204-N208 PolarHBondContact O-ND2 3.05Å; N208-S212 VanDerWaalsContact O-CB 3.27Å; N208-S212 WeakPolarHBondContact O-CB 3.42Å; N208-S212 PolarHBondContact O-N 3.25Å; N208-S212 PolarHBondContact O-OG 2.84Å
209	H	87	Confident	87.5	Confident	113 Å²	113	41.4 Å²	41.4	52%	0.523	23%	0.234	S	C	.	.	H	α-helix	trans	-63.2	-45.9	173	-175.8	50.3	0	0	0	111.2	G205 D206 L207 S212 A213	G205-H209 WeakPolarHBondContact O-CB 3.27Å; G205-H209 PolarHBondContact O-N 3.25Å; D206-H209 WeakPolarHBondContact O-CB 3.41Å; D206-H209 PolarHBondContact O-N 3.49Å; L207-H209 PolarHBondContact O-N 3.2Å; H209-S212 WeakPolarHBondContact CA-OG 3.49Å; H209-S212 PolarHBondContact O-N 3.32Å; H209-S212 PolarHBondContact O-OG 3.48Å; H209-A213 PolarHBondContact O-N 3.33Å
210	L	88	Confident	87.6	Confident	8 Å²	8	38.7 Å²	38.7	4%	0.042	22%	0.22	C	C	.	.	H	α-helix	trans	-61.3	-47.3	175.3	-66.8	178	0	0	0	111.9	L189 I192 L197 D206 L207 S212 A213 T214 L255 M282	L189-L210 HydrophobicContact CD2-CB 3.88Å; L189-L210 HydrophobicContact CD2-CD1 3.99Å; I192-L210 HydrophobicContact CB-CD1 4.23Å; I192-L210 HydrophobicContact CG2-CD1 3.66Å; L197-L210 HydrophobicContact CD1-CD2 4.4Å; D206-L210 PolarHBondContact O-N 2.74Å; L207-L210 WeakPolarHBondContact O-CB 3.47Å; L207-L210 PolarHBondContact O-N 3.27Å; L207-L210 VanDerWaalsContact O-N 3.12Å; L210-S212 VanDerWaalsContact C-N 3.32Å; L210-S212 PolarHBondContact O-N 2.99Å; L210-A213 PolarHBondContact O-N 2.97Å; L210-T214 PolarHBondContact O-N 2.96Å; L210-T214 VanDerWaalsContact O-N 3.08Å; L210-T214 PolarHBondContact O-OG1 2.82Å; L210-L255 HydrophobicContact CD2-CD2 3.49Å; L210-L255 VanDerWaalsContact CD2-CD2 3.49Å; L210-M282 HydrophobicContact CB-CE 3.94Å
211	V	91.3	Very high	87.4	Confident	19 Å²	19	34.2 Å²	34.2	12%	0.115	19%	0.193	C	C	.	.	H	α-helix	trans	-57	-47.5	176.6	172.4	0	0	0	0	111	I184 L189 L207 A213 T214 M215	I184-V211 HydrophobicContact CD1-CG1 3.75Å; I184-V211 HydrophobicContact CD1-CG2 4.28Å; I184-V211 HydrophobicContact CG2-CG2 3.68Å; L189-V211 HydrophobicContact CD1-CG2 3.58Å; L189-V211 HydrophobicContact CD2-CG2 4.5Å; L207-V211 WeakPolarHBondContact O-CG2 3.49Å; L207-V211 PolarHBondContact O-N 2.81Å; V211-A213 VanDerWaalsContact C-N 3.32Å; V211-A213 PolarHBondContact O-N 2.78Å; V211-T214 PolarHBondContact O-N 3.21Å; V211-M215 HydrophobicContact CG1-CG 4.23Å; V211-M215 HydrophobicContact CG1-SD 3.81Å; V211-M215 VanDerWaalsContact O-CG 3.31Å; V211-M215 WeakPolarHBondContact O-CG 3.07Å; V211-M215 PolarHBondContact O-N 3.14Å
212	S	90.8	Very high	87.3	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.014	17%	0.165	C	C	.	.	H	α-helix	trans	-64	-35.2	-179.6	69.2	0	0	0	0	113.1	N208 H209 L210 S216	N208-S212 VanDerWaalsContact O-CB 3.27Å; N208-S212 WeakPolarHBondContact O-CB 3.42Å; N208-S212 PolarHBondContact O-N 3.25Å; N208-S212 PolarHBondContact O-OG 2.84Å; H209-S212 WeakPolarHBondContact CA-OG 3.49Å; H209-S212 PolarHBondContact O-N 3.32Å; H209-S212 PolarHBondContact O-OG 3.48Å; L210-S212 VanDerWaalsContact C-N 3.32Å; L210-S212 PolarHBondContact O-N 2.99Å; S212-S216 VanDerWaalsContact O-CB 3.3Å; S212-S216 WeakPolarHBondContact O-CB 3.32Å; S212-S216 PolarHBondContact O-N 3.5Å
213	A	88.8	Confident	87.3	Confident	20 Å²	20	28.6 Å²	28.6	17%	0.165	16%	0.158	C	C	.	.	H	α-helix	trans	-66.2	-43.6	176.1	0	0	0	0	0	111.5	H209 L210 V211 S216 G217 F252	H209-A213 PolarHBondContact O-N 3.33Å; L210-A213 PolarHBondContact O-N 2.97Å; V211-A213 VanDerWaalsContact C-N 3.32Å; V211-A213 PolarHBondContact O-N 2.78Å; A213-S216 PolarHBondContact O-N 3.29Å; A213-G217 PolarHBondContact O-N 3.07Å; A213-F252 HydrophobicContact CB-CD2 4.35Å; A213-F252 HydrophobicContact CB-CE1 4.34Å; A213-F252 HydrophobicContact CB-CE2 4.15Å; A213-F252 HydrophobicContact CB-CZ 4.15Å
214	T	89.6	Confident	87.1	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.5	-48.2	175	-68	0	0	0	0	111.9	L210 V211 S216 G217 V218 P250 M282	L210-T214 PolarHBondContact O-N 2.96Å; L210-T214 VanDerWaalsContact O-N 3.08Å; L210-T214 PolarHBondContact O-OG1 2.82Å; V211-T214 PolarHBondContact O-N 3.21Å; T214-S216 VanDerWaalsContact C-N 3.29Å; T214-S216 PolarHBondContact O-N 3.49Å; T214-G217 CarbonylContact O-C 3.52Å; T214-G217 WeakPolarHBondContact O-CA 3.28Å; T214-G217 PolarHBondContact O-N 3Å; T214-V218 HydrophobicContact CG2-CG2 4.26Å; T214-V218 WeakPolarHBondContact O-CG2 3.35Å; T214-V218 PolarHBondContact O-N 3.49Å; T214-P250 HydrophobicContact CG2-CB 3.48Å; T214-P250 VanDerWaalsContact CG2-CB 3.48Å; T214-P250 HydrophobicContact CG2-CG 4.29Å; T214-M282 HydrophobicContact CG2-SD 4.19Å; T214-M282 WeakPolarHBondContact OG1-CE 3.48Å; T214-M282 PolarHBondContact OG1-SD 3.09Å
215	M	91.1	Very high	86.5	Confident	8 Å²	8	20.6 Å²	20.6	4%	0.039	12%	0.124	C	C	.	.	H	α-helix	trans	-59.4	-42.3	177.3	-70.9	177.7	71.8	0	0	111.6	F2 T118 F149 V211 G217 T219	F2-M215 HydrophobicContact CB-CE 3.84Å; F2-M215 HydrophobicContact CB-SD 4.07Å; F2-M215 HydrophobicContact CD1-CE 4.08Å; F2-M215 HydrophobicContact CD2-CB 3.5Å; F2-M215 VanDerWaalsContact CD2-CB 3.5Å; F2-M215 HydrophobicContact CD2-CE 3.71Å; F2-M215 HydrophobicContact CD2-CG 4.46Å; F2-M215 HydrophobicContact CD2-SD 4.22Å; F2-M215 HydrophobicContact CE2-CB 3.82Å; F2-M215 HydrophobicContact CE2-CE 4.26Å; F2-M215 HydrophobicContact CG-CB 4.45Å; F2-M215 HydrophobicContact CG-CE 3.59Å; F2-M215 HydrophobicContact CG-SD 4.29Å; T118-M215 HydrophobicContact CG2-CE 3.29Å; T118-M215 HydrophobicContact CG2-SD 4.24Å; F149-M215 HydrophobicContact CD1-CG 3.65Å; F149-M215 HydrophobicContact CD2-CE 4.13Å; F149-M215 HydrophobicContact CE1-CB 4.39Å; F149-M215 HydrophobicContact CE1-CG 3.73Å; F149-M215 HydrophobicContact CG-CE 4.23Å; F149-M215 HydrophobicContact CG-CG 4.1Å; F149-M215 HydrophobicContact CG-SD 4.47Å; F149-M215 HydrophobicContact CZ-CG 4.26Å; V211-M215 HydrophobicContact CG1-CG 4.23Å; V211-M215 HydrophobicContact CG1-SD 3.81Å; V211-M215 VanDerWaalsContact O-CG 3.31Å; V211-M215 WeakPolarHBondContact O-CG 3.07Å; V211-M215 PolarHBondContact O-N 3.14Å; M215-G217 VanDerWaalsContact C-N 3.31Å; M215-G217 PolarHBondContact O-N 3.4Å; M215-T219 WeakPolarHBondContact O-CB 3.44Å; M215-T219 VanDerWaalsContact O-CG2 3.22Å; M215-T219 WeakPolarHBondContact O-CG2 3.42Å; M215-T219 PolarHBondContact O-N 3.48Å; M215-T219 VanDerWaalsContact O-N 3.1Å; M215-T219 PolarHBondContact O-OG1 3.3Å
216	S	90.5	Very high	85.6	Confident	1 Å²	1	19.6 Å²	19.6	1%	0.007	11%	0.113	C	C	.	.	H	α-helix	trans	-59.9	-43.8	173.5	175.4	0	0	0	0	111.3	E9 S212 A213 T214 T219 T220 R223 R300	E9-S216 PolarHBondContact OE1-OG 3.05Å; E9-S216 PolarHBondContact OE2-OG 3.3Å; S212-S216 VanDerWaalsContact O-CB 3.3Å; S212-S216 WeakPolarHBondContact O-CB 3.32Å; S212-S216 PolarHBondContact O-N 3.5Å; A213-S216 PolarHBondContact O-N 3.29Å; T214-S216 VanDerWaalsContact C-N 3.29Å; T214-S216 PolarHBondContact O-N 3.49Å; S216-T219 PolarHBondContact O-N 3.19Å; S216-T219 PolarHBondContact O-OG1 3.04Å; S216-T220 PolarHBondContact O-N 3.02Å; S216-T220 VanDerWaalsContact O-N 3.09Å; S216-T220 PolarHBondContact O-OG1 3.44Å; S216-R223 PolarHBondContact O-NH2 2.91Å; S216-R223 PolarHBondContact OG-NH2 3.46Å; S216-R300 PolarHBondContact OG-NH1 2.81Å
217	G	87.6	Confident	84.2	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.4	-52.9	176.9	0	0	0	0	0	114.6	A213 T214 M215 T219 T220 T348	A213-G217 PolarHBondContact O-N 3.07Å; T214-G217 CarbonylContact O-C 3.52Å; T214-G217 WeakPolarHBondContact O-CA 3.28Å; T214-G217 PolarHBondContact O-N 3Å; M215-G217 VanDerWaalsContact C-N 3.31Å; M215-G217 PolarHBondContact O-N 3.4Å; G217-T219 VanDerWaalsContact C-N 3.29Å; G217-T219 PolarHBondContact O-N 2.92Å; G217-T220 WeakPolarHBondContact O-CB 3.01Å; G217-T220 PolarHBondContact O-N 3.48Å; G217-T220 PolarHBondContact O-OG1 2.95Å; G217-T220 VanDerWaalsContact O-OG1 3.07Å; G217-T348 WeakPolarHBondContact CA-OG1 3.37Å
218	V	86.8	Confident	82.9	Confident	10 Å²	10	28.3 Å²	28.3	6%	0.061	16%	0.155	C	C	.	.	H	α-helix	trans	-59.2	-42.5	178.5	173.1	0	0	0	0	110.8	F149 Y182 T214 T220 T348 I350	F149-V218 HydrophobicContact CZ-CB 4.37Å; F149-V218 HydrophobicContact CZ-CG1 4.12Å; Y182-V218 HydrophobicContact CD1-CG1 4.46Å; Y182-V218 HydrophobicContact CD1-CG2 4.18Å; Y182-V218 HydrophobicContact CE1-CB 4.41Å; Y182-V218 HydrophobicContact CE1-CG1 3.6Å; Y182-V218 HydrophobicContact CE1-CG2 3.86Å; Y182-V218 HydrophobicContact CE2-CG1 4.13Å; Y182-V218 VanDerWaalsContact CZ-CG1 3.44Å; Y182-V218 WeakPolarHBondContact OH-CG1 3.12Å; T214-V218 HydrophobicContact CG2-CG2 4.26Å; T214-V218 WeakPolarHBondContact O-CG2 3.35Å; T214-V218 PolarHBondContact O-N 3.49Å; V218-T220 VanDerWaalsContact C-N 3.28Å; V218-T220 PolarHBondContact O-N 3.22Å; V218-T348 HydrophobicContact CG2-CG2 3.98Å; V218-I350 HydrophobicContact CB-CD1 4.37Å; V218-I350 HydrophobicContact CG1-CD1 4.08Å; V218-I350 HydrophobicContact CG2-CD1 3.92Å; V218-I350 HydrophobicContact CG2-CG1 4.04Å
219	T	88.6	Confident	81.2	Confident	4 Å²	4	28.8 Å²	28.8	3%	0.025	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-0.9	-177.5	61.7	0	0	0	0	113.8	F2 Y32 M215 S216 G217 C221 L222 R223	F2-T219 HydrophobicContact CE2-CG2 4.39Å; F2-T219 HydrophobicContact CZ-CG2 4.29Å; Y32-T219 WeakPolarHBondContact OH-CG2 2.86Å; M215-T219 WeakPolarHBondContact O-CB 3.44Å; M215-T219 VanDerWaalsContact O-CG2 3.22Å; M215-T219 WeakPolarHBondContact O-CG2 3.42Å; M215-T219 PolarHBondContact O-N 3.48Å; M215-T219 VanDerWaalsContact O-N 3.1Å; M215-T219 PolarHBondContact O-OG1 3.3Å; S216-T219 PolarHBondContact O-N 3.19Å; S216-T219 PolarHBondContact O-OG1 3.04Å; G217-T219 VanDerWaalsContact C-N 3.29Å; G217-T219 PolarHBondContact O-N 2.92Å; T219-C221 VanDerWaalsContact C-N 3.33Å; T219-C221 PolarHBondContact O-N 3.22Å; T219-L222 WeakPolarHBondContact O-CB 3.48Å; T219-L222 PolarHBondContact O-N 3.43Å; T219-L222 VanDerWaalsContact O-N 3.14Å; T219-R223 WeakPolarHBondContact O-CG 3.47Å; T219-R223 PolarHBondContact O-N 3.12Å; T219-R223 VanDerWaalsContact O-N 3.09Å; T219-R223 PolarHBondContact OG1-NE 2.9Å; T219-R223 VanDerWaalsContact OG1-NE 3.13Å
220	T	86.8	Confident	79.9	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.5	-41.6	-177.2	-65.3	0	0	0	0	111.7	S216 G217 V218 L222 R223 F224 V298 R300 C336	S216-T220 PolarHBondContact O-N 3.02Å; S216-T220 VanDerWaalsContact O-N 3.09Å; S216-T220 PolarHBondContact O-OG1 3.44Å; G217-T220 WeakPolarHBondContact O-CB 3.01Å; G217-T220 PolarHBondContact O-N 3.48Å; G217-T220 PolarHBondContact O-OG1 2.95Å; G217-T220 VanDerWaalsContact O-OG1 3.07Å; V218-T220 VanDerWaalsContact C-N 3.28Å; V218-T220 PolarHBondContact O-N 3.22Å; T220-L222 PolarHBondContact O-N 3.5Å; T220-R223 PolarHBondContact O-N 2.76Å; T220-F224 HydrophobicContact CG2-CD2 4.06Å; T220-F224 PolarHBondContact O-N 3Å; T220-V298 HydrophobicContact CG2-CG1 4.39Å; T220-R300 HydrophobicContact CG2-CG 4Å; T220-R300 WeakPolarHBondContact OG1-CD 3.08Å; T220-R300 PolarHBondContact OG1-NE 3.32Å; T220-R300 PolarHBondContact OG1-NH1 2.92Å; T220-C336 HydrophobicContact CG2-CB 3.63Å
221	C	77.9	Confident	78.9	Confident	22 Å²	22	27.3 Å²	27.3	15%	0.149	16%	0.155	C	C	.	.	H	α-helix	trans	-62.7	-23.4	-180	-61.8	0	0	0	0	113.3	R28 T219	R28-C221 PolarHBondContact NH1-O 3.32Å; T219-C221 VanDerWaalsContact C-N 3.33Å; T219-C221 PolarHBondContact O-N 3.22Å
222	L	82.3	Confident	78	Confident	11 Å²	11	27.4 Å²	27.4	6%	0.058	16%	0.155	C	C	.	.	H	α-helix	trans	-86.4	-44.9	177.7	-51.5	173.2	0	0	0	110.8	R28 V31 T219 T220 L232	R28-L222 WeakPolarHBondContact CD-O 3.34Å; V31-L222 HydrophobicContact CG1-CB 4.3Å; T219-L222 WeakPolarHBondContact O-CB 3.48Å; T219-L222 PolarHBondContact O-N 3.43Å; T219-L222 VanDerWaalsContact O-N 3.14Å; T220-L222 PolarHBondContact O-N 3.5Å; L222-L232 HydrophobicContact CD1-CD1 4.29Å; L222-L232 HydrophobicContact CD1-CD2 3.52Å; L222-L232 HydrophobicContact CD1-CG 3.73Å; L222-L232 HydrophobicContact CD2-CD2 4.15Å; L222-L232 HydrophobicContact CD2-CG 3.89Å; L222-L232 HydrophobicContact CG-CD2 4.36Å; L222-L232 HydrophobicContact CG-CG 4.46Å
223	R	85.4	Confident	77.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-78.2	-25.4	-171.1	-71.9	-173.9	-56.4	104.7	-0.8	114.9	E9 H10 R28 Y32 S216 T219 T220	E9-R223 IonicContact OE2-CZ 3.51Å; E9-R223 VanDerWaalsContact OE2-CZ 3.24Å; E9-R223 IonicContact OE2-NH1 3.26Å; E9-R223 PolarHBondContact OE2-NH1 3.24Å; E9-R223 IonicContact OE2-NH2 2.87Å; E9-R223 PolarHBondContact OE2-NH2 3.14Å; H10-R223 PolarHBondContact NE2-NH1 3.29Å; R28-R223 WeakPolarHBondContact CB-O 3.35Å; Y32-R223 HydrophobicContact CD2-CG 3.52Å; Y32-R223 HydrophobicContact CE2-CG 3.58Å; S216-R223 PolarHBondContact O-NH2 2.91Å; S216-R223 PolarHBondContact OG-NH2 3.46Å; T219-R223 WeakPolarHBondContact O-CG 3.47Å; T219-R223 PolarHBondContact O-N 3.12Å; T219-R223 VanDerWaalsContact O-N 3.09Å; T219-R223 PolarHBondContact OG1-NE 2.9Å; T219-R223 VanDerWaalsContact OG1-NE 3.13Å; T220-R223 PolarHBondContact O-N 2.76Å
224	F	83.2	Confident	77.2	Confident	1 Å²	1	36.9 Å²	36.9	0%	0.004	19%	0.189	C	C	.	.	S	Bend	trans	-125.9	143.5	-179.4	-61.2	-65	0	0	0	110.8	E9 H10 T220 G226 I338	E9-F224 HydrophobicContact CB-CZ 4.19Å; H10-F224 AromaticContact CE1-CE1 3.56Å; H10-F224 AromaticContact CE1-CZ 3.84Å; H10-F224 AromaticContact ND1-CE1 3.86Å; T220-F224 HydrophobicContact CG2-CD2 4.06Å; T220-F224 PolarHBondContact O-N 3Å; F224-G226 PolarHBondContact O-N 3.42Å; F224-I338 HydrophobicContact CB-CD1 4.39Å; F224-I338 HydrophobicContact CD1-CD1 3.33Å; F224-I338 HydrophobicContact CE1-CD1 3.61Å; F224-I338 HydrophobicContact CE1-CG2 4.34Å; F224-I338 HydrophobicContact CE2-CG2 4.27Å; F224-I338 HydrophobicContact CG-CD1 3.87Å; F224-I338 HydrophobicContact CZ-CD1 4.35Å; F224-I338 HydrophobicContact CZ-CG2 4.07Å
225	P	72.3	Confident	76.8	Confident	49 Å²	49	38.2 Å²	38.2	32%	0.318	20%	0.196	S	C	.	.			trans	-63.7	122.3	169.2	28.1	-33	0	0	0	109	L24 D27	L24-P225 HydrophobicContact CD2-CG 3.99Å; D27-P225 HydrophobicContact CB-CG 4.26Å
226	G	66.3	Low	76.4	Confident	20 Å²	20	38.4 Å²	38.4	21%	0.206	20%	0.199	C	C	.	.			trans	-122	159.2	175.4	0	0	0	0	0	110.8	F224 L228 N229	F224-G226 PolarHBondContact O-N 3.42Å; G226-L228 PolarHBondContact O-N 3.18Å; G226-N229 PolarHBondContact O-OD1 3.05Å
227	Q	56.6	Low	76.2	Confident	145 Å²	145	43.6 Å²	43.6	68%	0.678	23%	0.23	S	C	*	.	S	Bend	trans	-65.2	-26.9	178.3	-62.5	-166.9	7.8	0	0	112.1	M305	Q227-M305 HydrophobicContact CB-CE 3.97Å; Q227-M305 HydrophobicContact CG-CE 3.75Å; Q227-M305 PolarHBondContact OE1-SD 2.85Å
228	L	60.5	Low	76.2	Confident	87 Å²	87	46.7 Å²	46.7	46%	0.455	25%	0.247	S	C	.	.	S	Bend	trans	-99.9	89.7	168.3	-147.3	102.7	0	0	0	109.1	G226 A230 A334	G226-L228 PolarHBondContact O-N 3.18Å; L228-A230 PolarHBondContact O-N 3.44Å; L228-A334 HydrophobicContact CB-CB 4.34Å; L228-A334 HydrophobicContact CD2-CB 4.35Å
229	N	53.2	Low	76.2	Confident	84 Å²	84	46.2 Å²	46.2	45%	0.449	24%	0.244	S	C	.	.			trans	-68.9	100.4	172.7	-74.7	-47.5	0	0	0	109.3	R28 G226 K234	R28-N229 PolarHBondContact NH2-OD1 3.05Å; G226-N229 PolarHBondContact O-OD1 3.05Å; N229-K234 PolarHBondContact O-NZ 2.9Å; N229-K234 VanDerWaalsContact O-NZ 3.07Å
230	A	59.7	Low	76.3	Confident	12 Å²	12	47.4 Å²	47.4	10%	0.099	25%	0.251	C	S	.	.			trans	-111.6	109.6	170	0	0	0	0	0	108.4	L228	L228-A230 PolarHBondContact O-N 3.44Å
231	D	68.4	Low	76.3	Confident	78 Å²	78	49.8 Å²	49.8	42%	0.417	27%	0.267	S	S	.	.			trans	-71.2	167.5	161.2	58.4	-6	0	0	0	109.5	R233 K234 L235	D231-R233 PolarHBondContact O-N 3.19Å; D231-K234 PolarHBondContact O-N 2.96Å; D231-K234 WeakPolarHBondContact OD1-CA 3.42Å; D231-K234 WeakPolarHBondContact OD1-CB 3.4Å; D231-K234 PolarHBondContact OD1-N 2.92Å; D231-L235 PolarHBondContact O-N 3.36Å
232	L	72.1	Confident	76.8	Confident	22 Å²	22	51.2 Å²	51.2	12%	0.115	27%	0.27	C	S	.	.	H	α-helix	trans	-54.3	-41	177.5	-76.7	178.5	0	0	0	111.9	Q113 I145 N147 L222 K234 L235 A236	Q113-L232 HydrophobicContact CB-CD1 4.31Å; I145-L232 HydrophobicContact CB-CB 4.43Å; I145-L232 HydrophobicContact CG2-CB 4.15Å; N147-L232 VanDerWaalsContact ND2-CD2 3.32Å; N147-L232 WeakPolarHBondContact ND2-CD2 3.49Å; L222-L232 HydrophobicContact CD1-CD1 4.29Å; L222-L232 HydrophobicContact CD1-CD2 3.52Å; L222-L232 HydrophobicContact CD1-CG 3.73Å; L222-L232 HydrophobicContact CD2-CD2 4.15Å; L222-L232 HydrophobicContact CD2-CG 3.89Å; L222-L232 HydrophobicContact CG-CD2 4.36Å; L222-L232 HydrophobicContact CG-CG 4.46Å; L232-K234 PolarHBondContact O-N 3.42Å; L232-L235 WeakPolarHBondContact O-CB 3.42Å; L232-L235 PolarHBondContact O-N 3.26Å; L232-A236 PolarHBondContact O-N 2.98Å
233	R	80.3	Confident	77	Confident	122 Å²	122	56 Å²	56	46%	0.46	30%	0.302	S	S	.	.	H	α-helix	trans	-64.3	-42.5	179.6	-175.5	173	-65.3	-77.6	-0.8	112.5	D143 I145 D231 L235 A236 V237	D143-R233 PolarHBondContact O-NH2 3.47Å; I145-R233 HydrophobicContact CD1-CB 4.44Å; I145-R233 HydrophobicContact CG1-CB 4.21Å; D231-R233 PolarHBondContact O-N 3.19Å; R233-L235 VanDerWaalsContact C-N 3.33Å; R233-A236 PolarHBondContact O-N 2.86Å; R233-V237 HydrophobicContact CG-CG2 4.43Å; R233-V237 WeakPolarHBondContact O-CB 3.44Å; R233-V237 VanDerWaalsContact O-CG2 3.24Å; R233-V237 WeakPolarHBondContact O-CG2 3.23Å; R233-V237 PolarHBondContact O-N 3.25Å
234	K	82.4	Confident	77.2	Confident	98 Å²	98	59.8 Å²	59.8	43%	0.426	32%	0.316	S	S	.	.	H	α-helix	trans	-71.9	-29.6	177.4	-172.9	174.4	179.6	-172.9	0	111.8	N229 D231 L232 N238	N229-K234 PolarHBondContact O-NZ 2.9Å; N229-K234 VanDerWaalsContact O-NZ 3.07Å; D231-K234 PolarHBondContact O-N 2.96Å; D231-K234 WeakPolarHBondContact OD1-CA 3.42Å; D231-K234 WeakPolarHBondContact OD1-CB 3.4Å; D231-K234 PolarHBondContact OD1-N 2.92Å; L232-K234 PolarHBondContact O-N 3.42Å; K234-N238 WeakPolarHBondContact O-CB 3.2Å; K234-N238 PolarHBondContact O-N 2.79Å; K234-N238 PolarHBondContact O-ND2 3.28Å
235	L	80.6	Confident	77.7	Confident	29 Å²	29	59.8 Å²	59.8	15%	0.152	32%	0.316	C	S	.	.	H	α-helix	trans	-62.3	-52	169	-172	66.4	0	0	0	109.9	Y182 D231 L232 R233 V237 N238 M239 A296 I350	Y182-L235 WeakPolarHBondContact OH-CD2 3.47Å; D231-L235 PolarHBondContact O-N 3.36Å; L232-L235 WeakPolarHBondContact O-CB 3.42Å; L232-L235 PolarHBondContact O-N 3.26Å; R233-L235 VanDerWaalsContact C-N 3.33Å; L235-V237 PolarHBondContact O-N 3.44Å; L235-N238 PolarHBondContact O-N 3.02Å; L235-N238 VanDerWaalsContact O-N 3.11Å; L235-M239 HydrophobicContact CD1-CG 3.91Å; L235-M239 HydrophobicContact CG-CG 4.21Å; L235-M239 VanDerWaalsContact O-CB 3.32Å; L235-M239 WeakPolarHBondContact O-CB 3.44Å; L235-M239 VanDerWaalsContact O-CG 3.29Å; L235-M239 WeakPolarHBondContact O-CG 3.46Å; L235-M239 PolarHBondContact O-N 3.29Å; L235-A296 HydrophobicContact CD1-CB 4.28Å; L235-I350 HydrophobicContact CD2-CD1 4.44Å
236	A	83.9	Confident	78.7	Confident	11 Å²	11	57.4 Å²	57.4	9%	0.091	30%	0.301	C	S	.	.	H	α-helix	trans	-55.6	-50.5	179.1	0	0	0	0	0	111.8	I145 E180 L232 R233 N238 M239 V240	I145-A236 HydrophobicContact CD1-CB 4.28Å; E180-A236 HydrophobicContact CG-CB 4.14Å; E180-A236 WeakPolarHBondContact OE1-CA 3.44Å; E180-A236 VanDerWaalsContact OE1-CB 3.28Å; E180-A236 WeakPolarHBondContact OE1-CB 3.35Å; E180-A236 PolarHBondContact OE1-N 3.43Å; L232-A236 PolarHBondContact O-N 2.98Å; R233-A236 PolarHBondContact O-N 2.86Å; A236-N238 VanDerWaalsContact C-N 3.27Å; A236-N238 PolarHBondContact O-N 3.11Å; A236-M239 PolarHBondContact O-N 3.44Å; A236-M239 VanDerWaalsContact O-N 3.1Å; A236-V240 WeakPolarHBondContact O-CB 3.22Å; A236-V240 PolarHBondContact O-N 3.37Å
237	V	86.4	Confident	80	Confident	111 Å²	111	56.6 Å²	56.6	67%	0.673	29%	0.292	S	S	*	.	H	α-helix	trans	-61.6	-32.4	179.7	171.2	0	0	0	0	112.8	R233 L235	R233-V237 HydrophobicContact CG-CG2 4.43Å; R233-V237 WeakPolarHBondContact O-CB 3.44Å; R233-V237 VanDerWaalsContact O-CG2 3.24Å; R233-V237 WeakPolarHBondContact O-CG2 3.23Å; R233-V237 PolarHBondContact O-N 3.25Å; L235-V237 PolarHBondContact O-N 3.44Å
238	N	87	Confident	81.8	Confident	64 Å²	64	49.7 Å²	49.7	34%	0.342	26%	0.259	S	S	.	.	H	α-helix	trans	-83	-24	177.5	-77.1	-63.2	0	0	0	113.1	K234 L235 A236 T294 K332	K234-N238 WeakPolarHBondContact O-CB 3.2Å; K234-N238 PolarHBondContact O-N 2.79Å; K234-N238 PolarHBondContact O-ND2 3.28Å; L235-N238 PolarHBondContact O-N 3.02Å; L235-N238 VanDerWaalsContact O-N 3.11Å; A236-N238 VanDerWaalsContact C-N 3.27Å; A236-N238 PolarHBondContact O-N 3.11Å; N238-T294 WeakPolarHBondContact O-CG2 3.4Å; N238-K332 HydrophobicContact CB-CG 4.36Å; N238-K332 WeakPolarHBondContact OD1-CE 3.49Å
239	M	86.5	Confident	83.4	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-102.8	-24.7	-171.1	-69.6	-59.7	-61.3	0	0	113.6	L235 A236 P241 F248 T294 A296 I350 N352	L235-M239 HydrophobicContact CD1-CG 3.91Å; L235-M239 HydrophobicContact CG-CG 4.21Å; L235-M239 VanDerWaalsContact O-CB 3.32Å; L235-M239 WeakPolarHBondContact O-CB 3.44Å; L235-M239 VanDerWaalsContact O-CG 3.29Å; L235-M239 WeakPolarHBondContact O-CG 3.46Å; L235-M239 PolarHBondContact O-N 3.29Å; A236-M239 PolarHBondContact O-N 3.44Å; A236-M239 VanDerWaalsContact O-N 3.1Å; M239-P241 VanDerWaalsContact O-CD 3.23Å; M239-P241 WeakPolarHBondContact O-CD 3.27Å; M239-F248 HydrophobicContact CB-CE1 3.76Å; M239-F248 HydrophobicContact CB-CE2 4.32Å; M239-F248 HydrophobicContact CB-CZ 3.46Å; M239-F248 VanDerWaalsContact CB-CZ 3.46Å; M239-F248 HydrophobicContact CE-CD1 4.37Å; M239-F248 HydrophobicContact CE-CE1 4.26Å; M239-F248 HydrophobicContact CG-CZ 4.41Å; M239-T294 WeakPolarHBondContact CA-OG1 3.15Å; M239-T294 WeakPolarHBondContact CE-OG1 3.32Å; M239-T294 PolarHBondContact O-OG1 2.88Å; M239-A296 HydrophobicContact CE-CB 4.24Å; M239-A296 HydrophobicContact CG-CB 4.41Å; M239-A296 HydrophobicContact SD-CB 3.51Å; M239-A296 VanDerWaalsContact SD-CB 3.51Å; M239-I350 HydrophobicContact CE-CB 4.29Å; M239-I350 HydrophobicContact CE-CG2 3.9Å; M239-I350 VanDerWaalsContact CE-O 3.25Å; M239-I350 WeakPolarHBondContact CE-O 3.4Å; M239-N352 HydrophobicContact CE-CB 4.39Å; M239-N352 PolarHBondContact O-ND2 3.45Å
240	V	90.3	Very high	85.3	Confident	29 Å²	29	41.5 Å²	41.5	18%	0.176	22%	0.216	C	C	.	.			trans	-112	93.3	-175.1	-173.7	0	0	0	0	109.3	A236 F242 H246 F248	A236-V240 WeakPolarHBondContact O-CB 3.22Å; A236-V240 PolarHBondContact O-N 3.37Å; V240-F242 WeakPolarHBondContact CG1-O 3.42Å; V240-H246 HydrophobicContact CG1-CB 3.95Å; V240-H246 HydrophobicContact CG2-CB 3.84Å; V240-F248 HydrophobicContact CG2-CE1 4.13Å; V240-F248 HydrophobicContact CG2-CZ 3.63Å
241	P	86.8	Confident	86.8	Confident	50 Å²	50	41 Å²	41	33%	0.325	21%	0.211	S	C	.	.	S	Bend	trans	-71.4	-33.7	174.5	27.9	-32.7	0	0	0	111.8	M239 L293 I327	M239-P241 VanDerWaalsContact O-CD 3.23Å; M239-P241 WeakPolarHBondContact O-CD 3.27Å; P241-L293 HydrophobicContact CG-CB 4.3Å; P241-L293 HydrophobicContact CG-CD1 4.4Å; P241-I327 HydrophobicContact CB-CD1 4.13Å; P241-I327 HydrophobicContact CG-CD1 4.22Å
242	F	89.6	Confident	87.8	Confident	51 Å²	51	37.9 Å²	37.9	22%	0.224	20%	0.195	C	C	.	.	S	Bend	trans	-125.1	133.9	-179.3	-58.6	-71	0	0	0	110.4	V240 R244 L245 W326 Y407	V240-F242 WeakPolarHBondContact CG1-O 3.42Å; F242-R244 VanDerWaalsContact C-N 3.28Å; F242-R244 PolarHBondContact O-N 3.09Å; F242-R244 VanDerWaalsContact O-N 3.14Å; F242-L245 HydrophobicContact CB-CB 4.3Å; F242-L245 HydrophobicContact CB-CD1 4.32Å; F242-L245 HydrophobicContact CB-CG 4.15Å; F242-L245 HydrophobicContact CD2-CD1 3.99Å; F242-L245 PolarHBondContact O-N 3.25Å; F242-W326 AromaticContact CE2-CH2 3.51Å; F242-W326 HydrophobicContact CE2-CH2 3.51Å; F242-W326 HydrophobicContact CE2-CZ2 4.23Å; F242-W326 HydrophobicContact CE2-CZ3 4.27Å; F242-W326 AromaticContact CZ-CH2 3.84Å; F242-W326 HydrophobicContact CZ-CH2 3.84Å; F242-W326 HydrophobicContact CZ-CZ3 4.21Å; F242-Y407 HydrophobicContact CD2-CD1 4.46Å; F242-Y407 HydrophobicContact CD2-CD2 4.33Å; F242-Y407 HydrophobicContact CD2-CE1 4.06Å; F242-Y407 AromaticContact CD2-CE2 3.9Å; F242-Y407 HydrophobicContact CD2-CE2 3.9Å; F242-Y407 AromaticContact CD2-CZ 3.74Å; F242-Y407 AromaticContact CE1-CE1 3.95Å; F242-Y407 HydrophobicContact CE1-CE1 3.95Å; F242-Y407 AromaticContact CE1-CZ 3.82Å; F242-Y407 WeakPolarHBondContact CE1-OH 3.49Å; F242-Y407 AromaticContact CE2-CD1 3.61Å; F242-Y407 HydrophobicContact CE2-CD1 3.61Å; F242-Y407 HydrophobicContact CE2-CD2 4.24Å; F242-Y407 AromaticContact CE2-CE1 3.24Å; F242-Y407 HydrophobicContact CE2-CE1 3.24Å; F242-Y407 AromaticContact CE2-CE2 3.92Å; F242-Y407 HydrophobicContact CE2-CE2 3.92Å; F242-Y407 HydrophobicContact CE2-CG 4.09Å; F242-Y407 AromaticContact CE2-CZ 3.4Å; F242-Y407 HydrophobicContact CG-CE2 4.31Å; F242-Y407 AromaticContact CZ-CD1 3.95Å; F242-Y407 HydrophobicContact CZ-CD1 3.95Å; F242-Y407 AromaticContact CZ-CE1 3.2Å; F242-Y407 HydrophobicContact CZ-CE1 3.2Å; F242-Y407 HydrophobicContact CZ-CE2 4.42Å; F242-Y407 AromaticContact CZ-CZ 3.47Å; F242-Y407 VanDerWaalsContact CZ-CZ 3.47Å
243	P	85.8	Confident	88.7	Confident	111 Å²	111	36.9 Å²	36.9	72%	0.721	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	-36.9	-172.2	-28.7	35	0	0	0	115	H246	P243-H246 PolarHBondContact O-ND1 2.79Å
244	R	90.1	Very high	89.1	Confident	81 Å²	81	31.4 Å²	31.4	31%	0.306	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-22.2	-179.7	-66.3	172	59.1	117.1	7.5	113.5	V175 F242 H246 N396 L400 E403	V175-R244 HydrophobicContact CG1-CB 4.27Å; V175-R244 HydrophobicContact CG1-CG 4.13Å; F242-R244 VanDerWaalsContact C-N 3.28Å; F242-R244 PolarHBondContact O-N 3.09Å; F242-R244 VanDerWaalsContact O-N 3.14Å; R244-H246 PolarHBondContact O-N 3.1Å; R244-N396 PolarHBondContact NH2-OD1 3.05Å; R244-L400 HydrophobicContact CB-CD1 4.5Å; R244-E403 WeakPolarHBondContact CD-OE1 3.32Å; R244-E403 IonicContact CZ-OE1 2.74Å; R244-E403 VanDerWaalsContact CZ-OE1 3.23Å; R244-E403 IonicContact CZ-OE2 3.32Å; R244-E403 VanDerWaalsContact NE-CD 3.33Å; R244-E403 IonicContact NE-OE1 3.39Å; R244-E403 PolarHBondContact NE-OE1 3.02Å; R244-E403 IonicContact NE-OE2 3.53Å; R244-E403 PolarHBondContact NE-OE2 3.32Å; R244-E403 IonicContact NH2-OE1 2.72Å
245	L	92.4	Very high	89.1	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.151	C	C	.	.			trans	-97.2	59.5	-175.9	-52.7	-171.8	0	0	0	111.4	F242 L293 N352 L400 E403 Y404 Y407	F242-L245 HydrophobicContact CB-CB 4.3Å; F242-L245 HydrophobicContact CB-CD1 4.32Å; F242-L245 HydrophobicContact CB-CG 4.15Å; F242-L245 HydrophobicContact CD2-CD1 3.99Å; F242-L245 PolarHBondContact O-N 3.25Å; L245-L293 HydrophobicContact CD1-CD1 4.17Å; L245-N352 PolarHBondContact O-ND2 3.25Å; L245-L400 HydrophobicContact CD2-CD1 3.83Å; L245-E403 HydrophobicContact CD2-CB 4.14Å; L245-Y404 HydrophobicContact CB-CE1 4.03Å; L245-Y404 HydrophobicContact CD1-CD1 4.26Å; L245-Y404 HydrophobicContact CD1-CE1 4.23Å; L245-Y404 HydrophobicContact CD2-CD1 3.98Å; L245-Y404 HydrophobicContact CD2-CD2 4Å; L245-Y404 HydrophobicContact CD2-CE1 3.73Å; L245-Y404 HydrophobicContact CD2-CE2 3.71Å; L245-Y404 HydrophobicContact CD2-CG 4.11Å; L245-Y404 HydrophobicContact CG-CE1 4.21Å; L245-Y407 HydrophobicContact CD1-CD2 3.44Å; L245-Y407 VanDerWaalsContact CD1-CD2 3.44Å; L245-Y407 HydrophobicContact CD1-CE2 3.69Å; L245-Y407 HydrophobicContact CD1-CG 4.41Å
246	H	93.6	Very high	88.6	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.151	C	C	.	.			trans	-110	19.2	-178.4	60.2	-99	0	0	0	113.5	L174 V175 T178 D179 T181 V240 P243 R244	L174-H246 PolarHBondContact O-NE2 2.94Å; V175-H246 PolarHBondContact O-CE1 2.78Å; T178-H246 PolarHBondContact O-CE1 3.36Å; T178-H246 VanDerWaalsContact O-CE1 3.32Å; T178-H246 PolarHBondContact O-NE2 3.48Å; T178-H246 PolarHBondContact OG1-CD2 2.88Å; T178-H246 PolarHBondContact OG1-NE2 3.12Å; D179-H246 WeakPolarHBondContact O-CB 3.32Å; T181-H246 PolarHBondContact N-O 2.96Å; V240-H246 HydrophobicContact CG1-CB 3.95Å; V240-H246 HydrophobicContact CG2-CB 3.84Å; P243-H246 PolarHBondContact O-ND1 2.79Å; R244-H246 PolarHBondContact O-N 3.1Å
247	F	94.6	Very high	87.9	Confident	2 Å²	2	27.3 Å²	27.3	1%	0.009	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	112.4	178	-63.6	-86.3	0	0	0	110.6	V171 L174 V175 T181 I356 F360 L400	V171-F247 HydrophobicContact CG1-CZ 4.23Å; L174-F247 HydrophobicContact CB-CE1 4.31Å; L174-F247 HydrophobicContact CB-CZ 4.3Å; V175-F247 HydrophobicContact CG2-CE2 3.75Å; V175-F247 HydrophobicContact CG2-CZ 3.71Å; T181-F247 HydrophobicContact CG2-CD1 3.6Å; T181-F247 HydrophobicContact CG2-CE1 3.78Å; T181-F247 CarbonylContact O-C 3.49Å; T181-F247 WeakPolarHBondContact O-CA 3.44Å; F247-I356 HydrophobicContact CB-CG1 4.32Å; F247-F360 HydrophobicContact CB-CE2 4.32Å; F247-F360 HydrophobicContact CB-CZ 4.15Å; F247-F360 AromaticContact CD1-CZ 3.72Å; F247-F360 HydrophobicContact CD1-CZ 3.72Å; F247-F360 HydrophobicContact CD2-CE2 4.26Å; F247-F360 AromaticContact CD2-CZ 3.91Å; F247-F360 HydrophobicContact CD2-CZ 3.91Å; F247-F360 HydrophobicContact CE1-CZ 4.03Å; F247-F360 HydrophobicContact CE2-CZ 4.22Å; F247-F360 HydrophobicContact CG-CE2 4.16Å; F247-F360 AromaticContact CG-CZ 3.64Å; F247-F360 HydrophobicContact CG-CZ 3.64Å; F247-F360 HydrophobicContact CZ-CZ 4.27Å; F247-L400 HydrophobicContact CD2-CD2 4.21Å; F247-L400 HydrophobicContact CE2-CD1 4.36Å; F247-L400 HydrophobicContact CE2-CD2 3.76Å; F247-L400 HydrophobicContact CZ-CD2 4.42Å
248	F	94.4	Very high	86.9	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	145.6	-177.3	-56.2	-39.4	0	0	0	112.4	E180 T181 Y182 C183 M239 V240 P250 I350 G351 N352	E180-F248 HydrophobicContact CB-CD2 4.37Å; E180-F248 HydrophobicContact CB-CE2 3.7Å; E180-F248 HydrophobicContact CB-CZ 4.48Å; E180-F248 HydrophobicContact CG-CE2 3.71Å; E180-F248 HydrophobicContact CG-CZ 4.21Å; T181-F248 PolarHBondContact O-N 2.97Å; Y182-F248 HydrophobicContact CD1-CB 4.21Å; Y182-F248 HydrophobicContact CD1-CD2 4.13Å; Y182-F248 HydrophobicContact CE1-CB 4.48Å; Y182-F248 AromaticContact CE1-CD2 3.74Å; Y182-F248 HydrophobicContact CE1-CD2 3.74Å; Y182-F248 HydrophobicContact CE2-CD2 4.41Å; Y182-F248 AromaticContact CZ-CD2 3.86Å; C183-F248 WeakPolarHBondContact CB-O 3.44Å; C183-F248 PolarHBondContact N-O 3.32Å; M239-F248 HydrophobicContact CB-CE1 3.76Å; M239-F248 HydrophobicContact CB-CE2 4.32Å; M239-F248 HydrophobicContact CB-CZ 3.46Å; M239-F248 VanDerWaalsContact CB-CZ 3.46Å; M239-F248 HydrophobicContact CE-CD1 4.37Å; M239-F248 HydrophobicContact CE-CE1 4.26Å; M239-F248 HydrophobicContact CG-CZ 4.41Å; V240-F248 HydrophobicContact CG2-CE1 4.13Å; V240-F248 HydrophobicContact CG2-CZ 3.63Å; F248-P250 VanDerWaalsContact O-CD 3.27Å; F248-P250 WeakPolarHBondContact O-CD 3.28Å; F248-I350 HydrophobicContact CB-CG2 3.73Å; F248-I350 HydrophobicContact CD1-CG2 4.38Å; F248-I350 HydrophobicContact CD2-CG2 3.79Å; F248-I350 HydrophobicContact CE2-CG2 4.49Å; F248-I350 HydrophobicContact CG-CG2 3.71Å; F248-G351 WeakPolarHBondContact CA-O 3.46Å; F248-N352 HydrophobicContact CD1-CB 3.89Å; F248-N352 HydrophobicContact CE1-CB 3.98Å
249	M	92.6	Very high	85.8	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	103.3	166.8	-65.1	-179.9	66.8	0	0	108.9	M281 A283 C285 P287 G351 A355 I356	M249-M281 HydrophobicContact CE-CB 4.36Å; M249-M281 HydrophobicContact CE-CG 4.31Å; M249-A283 HydrophobicContact CB-CB 4.37Å; M249-A283 HydrophobicContact CE-CB 4.1Å; M249-A283 HydrophobicContact CG-CB 4.02Å; M249-C285 HydrophobicContact CE-CB 3.63Å; M249-C285 HydrophobicContact SD-CB 4.33Å; M249-P287 HydrophobicContact CE-CG 4.31Å; M249-G351 PolarHBondContact N-O 2.99Å; M249-G351 PolarHBondContact O-N 3.39Å; M249-A355 HydrophobicContact SD-CB 4.43Å; M249-I356 HydrophobicContact CG-CB 4.38Å; M249-I356 HydrophobicContact CG-CD1 3.53Å; M249-I356 HydrophobicContact CG-CG1 4.47Å; M249-I356 HydrophobicContact SD-CB 4.46Å; M249-I356 HydrophobicContact SD-CD1 4.36Å
250	P	92.9	Very high	84.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	148.7	174.2	22.5	-18.6	0	0	0	111	C183 I184 T214 F248 M282 F349	C183-P250 WeakPolarHBondContact O-CD 3.37Å; C183-P250 WeakPolarHBondContact O-CG 3.39Å; I184-P250 HydrophobicContact CG1-CG 4.31Å; T214-P250 HydrophobicContact CG2-CB 3.48Å; T214-P250 VanDerWaalsContact CG2-CB 3.48Å; T214-P250 HydrophobicContact CG2-CG 4.29Å; F248-P250 VanDerWaalsContact O-CD 3.27Å; F248-P250 WeakPolarHBondContact O-CD 3.28Å; P250-M282 HydrophobicContact CG-CB 4.11Å; P250-M282 WeakPolarHBondContact O-CB 3.42Å; P250-M282 PolarHBondContact O-N 3.5Å; P250-F349 CarbonylContact C-O 3.5Å; P250-F349 VanDerWaalsContact CA-O 3.31Å; P250-F349 WeakPolarHBondContact CA-O 3.45Å
251	G	91.3	Very high	83.7	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	155.9	170.2	0	0	0	0	0	110.6	N280 F349	G251-N280 WeakPolarHBondContact CA-O 3.45Å; G251-F349 PolarHBondContact N-O 2.88Å; G251-F349 PolarHBondContact O-N 3.09Å
252	F	90.6	Very high	82.5	Confident	14 Å²	14	44 Å²	44	6%	0.061	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	141.4	176.9	-174.2	-95.6	0	0	0	110.6	A213 L255 N280 M282 L343 A346	A213-F252 HydrophobicContact CB-CD2 4.35Å; A213-F252 HydrophobicContact CB-CE1 4.34Å; A213-F252 HydrophobicContact CB-CE2 4.15Å; A213-F252 HydrophobicContact CB-CZ 4.15Å; F252-L255 HydrophobicContact CD1-CD2 4.04Å; F252-L255 WeakPolarHBondContact O-CG 3.43Å; F252-N280 PolarHBondContact O-ND2 2.91Å; F252-M282 HydrophobicContact CB-CE 3.72Å; F252-L343 HydrophobicContact CE1-CD1 4.36Å; F252-L343 HydrophobicContact CZ-CD1 4.17Å; F252-A346 HydrophobicContact CE2-CB 4.14Å; F252-A346 HydrophobicContact CZ-CB 3.91Å
253	A	90	Very high	81.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	145.8	168.8	0	0	0	0	0	109.8	L271 Q274 V275 A346 V347	A253-L271 HydrophobicContact CB-CD2 4.12Å; A253-Q274 HydrophobicContact CB-CB 4.17Å; A253-Q274 HydrophobicContact CB-CG 4.46Å; A253-V275 HydrophobicContact CB-CG2 3.64Å; A253-A346 CarbonylContact O-C 3.56Å; A253-A346 VanDerWaalsContact O-CA 3.29Å; A253-A346 WeakPolarHBondContact O-CA 3.39Å; A253-V347 PolarHBondContact N-O 3.49Å; A253-V347 PolarHBondContact O-N 2.8Å
254	P	88.4	Confident	80.5	Confident	7 Å²	7	51 Å²	51	5%	0.045	24%	0.239	C	C	.	.			cis	-85	139.2	2.2	33.5	-35.4	0	0	0	113.5	T256 L266 L271 L343	P254-T256 HydrophobicContact CB-CG2 4.22Å; P254-L266 HydrophobicContact CB-CD2 3.38Å; P254-L266 HydrophobicContact CG-CD1 4.01Å; P254-L266 HydrophobicContact CG-CD2 3.59Å; P254-L266 HydrophobicContact CG-CG 4.47Å; P254-L271 HydrophobicContact CB-CD2 4.2Å; P254-L271 HydrophobicContact CG-CD2 4.4Å; P254-L343 HydrophobicContact CG-CD1 4.27Å; P254-L343 HydrophobicContact CG-CD2 3.99Å
255	L	82.9	Confident	79.3	Confident	9 Å²	9	50.3 Å²	50.3	5%	0.047	25%	0.25	C	C	.	.			trans	-99.2	94.1	164.2	-62.3	173.1	0	0	0	108.1	I192 T196 L210 F252 Q274 N280	I192-L255 HydrophobicContact CD1-CD1 4.11Å; I192-L255 HydrophobicContact CG1-CD1 4.36Å; I192-L255 HydrophobicContact CG2-CD1 3.78Å; I192-L255 HydrophobicContact CG2-CD2 4.44Å; T196-L255 HydrophobicContact CG2-CB 4.08Å; L210-L255 HydrophobicContact CD2-CD2 3.49Å; L210-L255 VanDerWaalsContact CD2-CD2 3.49Å; F252-L255 HydrophobicContact CD1-CD2 4.04Å; F252-L255 WeakPolarHBondContact O-CG 3.43Å; L255-Q274 PolarHBondContact O-NE2 3.34Å; L255-N280 HydrophobicContact CD1-CB 4.27Å; L255-N280 WeakPolarHBondContact CD1-ND2 3.46Å
256	T	69.9	Low	78.7	Confident	25 Å²	25	52.4 Å²	52.4	15%	0.153	26%	0.261	C	S	.	.			trans	-120.8	135	179	53.1	0	0	0	0	110.8	P254	P254-T256 HydrophobicContact CB-CG2 4.22Å
257	S	69.9	Low	78.5	Confident	18 Å²	18	55 Å²	55	13%	0.126	28%	0.277	C	S	.	.			trans	-62.7	151.8	169.9	74.8	0	0	0	0	110.5	L197 G259 S260 Q261	L197-S257 VanDerWaalsContact O-CB 3.29Å; L197-S257 WeakPolarHBondContact O-CB 3.36Å; S257-G259 PolarHBondContact O-N 3.4Å; S257-G259 VanDerWaalsContact O-N 3.1Å; S257-S260 PolarHBondContact O-N 2.83Å; S257-S260 WeakPolarHBondContact OG-CB 3.4Å; S257-S260 PolarHBondContact OG-N 3.43Å; S257-S260 PolarHBondContact OG-OG 2.87Å; S257-S260 VanDerWaalsContact OG-OG 3.08Å; S257-Q261 PolarHBondContact O-N 3.13Å; S257-Q261 VanDerWaalsContact O-N 3.12Å
258	R	65.5	Low	78.2	Confident	230 Å²	230	55.2 Å²	55.2	87%	0.868	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-30.7	178.3	-65.7	-177.6	-179.3	177.8	1.6	113
259	G	62.7	Low	78	Confident	53 Å²	53	56.7 Å²	56.7	55%	0.546	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-27.2	178.2	0	0	0	0	0	114.6	S257 Y263	S257-G259 PolarHBondContact O-N 3.4Å; S257-G259 VanDerWaalsContact O-N 3.1Å; G259-Y263 WeakPolarHBondContact O-CD2 3.3Å
260	S	67.6	Low	77.8	Confident	62 Å²	62	59.8 Å²	59.8	43%	0.434	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-12.5	-178.7	-60	0	0	0	0	113.6	S257 Q262 Y263 R264	S257-S260 PolarHBondContact O-N 2.83Å; S257-S260 WeakPolarHBondContact OG-CB 3.4Å; S257-S260 PolarHBondContact OG-N 3.43Å; S257-S260 PolarHBondContact OG-OG 2.87Å; S257-S260 VanDerWaalsContact OG-OG 3.08Å; S260-Q262 VanDerWaalsContact C-N 3.26Å; S260-Q262 PolarHBondContact O-N 2.76Å; S260-Y263 PolarHBondContact O-N 3.41Å; S260-Y263 VanDerWaalsContact O-N 3.14Å; S260-R264 PolarHBondContact O-N 3Å
261	Q	66.4	Low	77.7	Confident	90 Å²	90	59.8 Å²	59.8	42%	0.421	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-31.2	-177.2	-166.5	178.2	0.2	0	0	113.5	S257	S257-Q261 PolarHBondContact O-N 3.13Å; S257-Q261 VanDerWaalsContact O-N 3.12Å
262	Q	62.2	Low	77.6	Confident	172 Å²	172	59.9 Å²	59.9	80%	0.804	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-18.4	179.5	-65.5	-175.5	2	0	0	114	S260	S260-Q262 VanDerWaalsContact C-N 3.26Å; S260-Q262 PolarHBondContact O-N 2.76Å
263	Y	66.1	Low	77.5	Confident	199 Å²	199	65.3 Å²	65.3	78%	0.78	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-8.7	-172.1	-61.6	-77.3	0	0	0	113.7	G259 S260	G259-Y263 WeakPolarHBondContact O-CD2 3.3Å; S260-Y263 PolarHBondContact O-N 3.41Å; S260-Y263 VanDerWaalsContact O-N 3.14Å
264	R	67.2	Low	77.4	Confident	110 Å²	110	66 Å²	66	42%	0.415	33%	0.332	S	S	.	.			trans	-106.5	122.3	-175.8	-157.7	173.2	-172.9	168.5	4.4	110.7	S260 L266 E270	S260-R264 PolarHBondContact O-N 3Å; R264-L266 PolarHBondContact O-N 3.32Å; R264-E270 IonicContact NE-OE2 3.11Å; R264-E270 PolarHBondContact NE-OE2 3.15Å
265	A	65.2	Low	77.3	Confident	65 Å²	65	65.8 Å²	65.8	54%	0.537	33%	0.33	S	S	.	.			trans	-81	99.9	174.1	0	0	0	0	0	109	T267 E270	A265-T267 PolarHBondContact O-N 3.02Å; A265-T267 VanDerWaalsContact O-N 3.09Å; A265-E270 VanDerWaalsContact O-CD 3.25Å
266	L	79.4	Confident	77.5	Confident	45 Å²	45	66.7 Å²	66.7	24%	0.236	33%	0.334	C	S	.	.			trans	-63.3	113.8	173.7	-65.9	166.6	0	0	0	108.8	P254 R264 L271 M345	P254-L266 HydrophobicContact CB-CD2 3.38Å; P254-L266 HydrophobicContact CG-CD1 4.01Å; P254-L266 HydrophobicContact CG-CD2 3.59Å; P254-L266 HydrophobicContact CG-CG 4.47Å; R264-L266 PolarHBondContact O-N 3.32Å; L266-L271 HydrophobicContact CD2-CD2 4.24Å; L266-M345 HydrophobicContact CB-CE 4.13Å; L266-M345 WeakPolarHBondContact O-CE 3.31Å
267	T	88.4	Confident	78.4	Confident	55 Å²	55	67.9 Å²	67.9	34%	0.337	34%	0.339	S	S	.	.			trans	-128	160	175.1	61.7	0	0	0	0	109.5	A265 E270 L271	A265-T267 PolarHBondContact O-N 3.02Å; A265-T267 VanDerWaalsContact O-N 3.09Å; T267-E270 PolarHBondContact O-N 3.02Å; T267-E270 WeakPolarHBondContact OG1-CG 3.4Å; T267-L271 WeakPolarHBondContact O-CG 3.49Å; T267-L271 PolarHBondContact O-N 3.04Å
268	V	88.6	Confident	79.1	Confident	5 Å²	5	68.4 Å²	68.4	3%	0.03	35%	0.345	C	S	.	.	H	α-helix	trans	-56.5	-46.6	179	178.5	0	0	0	0	111.8	E270 L271 T272 F299 M303 E307 V308 Q311	V268-E270 VanDerWaalsContact C-N 3.35Å; V268-E270 PolarHBondContact O-N 3.18Å; V268-L271 PolarHBondContact O-N 3.05Å; V268-T272 PolarHBondContact O-N 3Å; V268-T272 PolarHBondContact O-OG1 2.97Å; V268-F299 HydrophobicContact CG1-CE1 4.17Å; V268-M303 HydrophobicContact CG2-CB 4.02Å; V268-M303 HydrophobicContact CG2-SD 4.19Å; V268-E307 HydrophobicContact CB-CG 4.15Å; V268-E307 HydrophobicContact CG1-CG 4.31Å; V268-V308 HydrophobicContact CG1-CB 4.43Å; V268-V308 HydrophobicContact CG1-CG2 3.81Å; V268-V308 HydrophobicContact CG2-CG2 4.43Å; V268-Q311 HydrophobicContact CG1-CG 4.19Å
269	P	90.6	Very high	80	Confident	32 Å²	32	64.1 Å²	64.1	21%	0.208	33%	0.333	C	S	.	.	H	α-helix	trans	-61.6	-39	177.8	-22.4	33.6	0	0	0	113.7	Q273 Q311	P269-Q273 WeakPolarHBondContact O-CB 3.31Å; P269-Q273 WeakPolarHBondContact O-CG 3.26Å; P269-Q273 PolarHBondContact O-N 2.95Å; P269-Q311 HydrophobicContact CB-CG 4.19Å; P269-Q311 HydrophobicContact CG-CG 3.95Å
270	E	88.3	Confident	81.1	Confident	64 Å²	64	61.8 Å²	61.8	30%	0.299	31%	0.308	S	S	.	.	H	α-helix	trans	-65.9	-42.2	176.5	-77.3	-169.4	-158.6	0	0	111.8	R264 A265 T267 V268 Q273 Q274	R264-E270 IonicContact NE-OE2 3.11Å; R264-E270 PolarHBondContact NE-OE2 3.15Å; A265-E270 VanDerWaalsContact O-CD 3.25Å; T267-E270 PolarHBondContact O-N 3.02Å; T267-E270 WeakPolarHBondContact OG1-CG 3.4Å; V268-E270 VanDerWaalsContact C-N 3.35Å; V268-E270 PolarHBondContact O-N 3.18Å; E270-Q273 PolarHBondContact O-N 3.45Å; E270-Q274 VanDerWaalsContact O-CB 3.32Å; E270-Q274 WeakPolarHBondContact O-CB 3.4Å; E270-Q274 PolarHBondContact O-N 3.3Å
271	L	89.6	Confident	82.1	Confident	1 Å²	1	59 Å²	59	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-62.6	-46.6	177	-71.6	168.7	0	0	0	110.9	A253 P254 L266 T267 V268 Q273 Q274 V275 M345 V347	A253-L271 HydrophobicContact CB-CD2 4.12Å; P254-L271 HydrophobicContact CB-CD2 4.2Å; P254-L271 HydrophobicContact CG-CD2 4.4Å; L266-L271 HydrophobicContact CD2-CD2 4.24Å; T267-L271 WeakPolarHBondContact O-CG 3.49Å; T267-L271 PolarHBondContact O-N 3.04Å; V268-L271 PolarHBondContact O-N 3.05Å; L271-Q273 PolarHBondContact O-N 3.06Å; L271-Q274 PolarHBondContact O-N 3.01Å; L271-V275 WeakPolarHBondContact O-CB 3.28Å; L271-V275 VanDerWaalsContact O-CG2 3.25Å; L271-V275 WeakPolarHBondContact O-CG2 3.21Å; L271-V275 PolarHBondContact O-N 2.74Å; L271-M345 HydrophobicContact CD1-CB 3.74Å; L271-V347 HydrophobicContact CB-CG2 3.69Å; L271-V347 HydrophobicContact CD1-CG2 4Å; L271-V347 HydrophobicContact CD2-CG2 4.39Å; L271-V347 HydrophobicContact CG-CG2 4.23Å
272	T	89.6	Confident	83.1	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.012	27%	0.267	C	S	.	.	H	α-helix	trans	-60.6	-45.5	177.4	-55.1	0	0	0	0	111.2	V268 Q274 V275 F276 Q311 M312 V315	V268-T272 PolarHBondContact O-N 3Å; V268-T272 PolarHBondContact O-OG1 2.97Å; T272-Q274 VanDerWaalsContact C-N 3.33Å; T272-Q274 PolarHBondContact O-N 3.14Å; T272-V275 PolarHBondContact O-N 3.21Å; T272-F276 HydrophobicContact CG2-CD2 4.32Å; T272-F276 HydrophobicContact CG2-CE2 4.27Å; T272-F276 WeakPolarHBondContact O-CD2 3.31Å; T272-F276 PolarHBondContact O-N 3.06Å; T272-Q311 HydrophobicContact CG2-CB 4.23Å; T272-M312 HydrophobicContact CG2-SD 3.7Å; T272-V315 HydrophobicContact CG2-CG2 3.68Å
273	Q	87.9	Confident	84.3	Confident	128 Å²	128	46.5 Å²	46.5	60%	0.598	23%	0.229	S	C	*	.	H	α-helix	trans	-63.5	-39.6	176.9	-74.8	178.4	14.5	0	0	112.7	P269 E270 L271 D277	P269-Q273 WeakPolarHBondContact O-CB 3.31Å; P269-Q273 WeakPolarHBondContact O-CG 3.26Å; P269-Q273 PolarHBondContact O-N 2.95Å; E270-Q273 PolarHBondContact O-N 3.45Å; L271-Q273 PolarHBondContact O-N 3.06Å; Q273-D277 PolarHBondContact O-N 2.91Å
274	Q	88.2	Confident	85.2	Confident	15 Å²	15	38.7 Å²	38.7	7%	0.07	21%	0.206	C	C	.	.	H	α-helix	trans	-69.3	-36.9	-178.5	-156.9	-170.6	-9.7	0	0	111.7	A253 L255 E270 L271 T272 F276 D277 N280	A253-Q274 HydrophobicContact CB-CB 4.17Å; A253-Q274 HydrophobicContact CB-CG 4.46Å; L255-Q274 PolarHBondContact O-NE2 3.34Å; E270-Q274 VanDerWaalsContact O-CB 3.32Å; E270-Q274 WeakPolarHBondContact O-CB 3.4Å; E270-Q274 PolarHBondContact O-N 3.3Å; L271-Q274 PolarHBondContact O-N 3.01Å; T272-Q274 VanDerWaalsContact C-N 3.33Å; T272-Q274 PolarHBondContact O-N 3.14Å; Q274-F276 VanDerWaalsContact C-N 3.33Å; Q274-F276 PolarHBondContact O-N 3.22Å; Q274-D277 WeakPolarHBondContact O-CB 3.45Å; Q274-D277 PolarHBondContact O-N 3.14Å; Q274-N280 VanDerWaalsContact CD-ND2 3.31Å; Q274-N280 VanDerWaalsContact CG-ND2 3.33Å; Q274-N280 WeakPolarHBondContact CG-ND2 3.32Å; Q274-N280 PolarHBondContact NE2-ND2 3.12Å; Q274-N280 PolarHBondContact NE2-OD1 3.2Å; Q274-N280 WeakPolarHBondContact O-CB 3.17Å; Q274-N280 VanDerWaalsContact O-CG 3.31Å
275	V	87.7	Confident	86.1	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.012	19%	0.188	C	C	.	.	H	α-helix	trans	-61.5	-39.4	178.8	157.7	0	0	0	0	112.6	A253 L271 T272 D277 M281 V347 F349	A253-V275 HydrophobicContact CB-CG2 3.64Å; L271-V275 WeakPolarHBondContact O-CB 3.28Å; L271-V275 VanDerWaalsContact O-CG2 3.25Å; L271-V275 WeakPolarHBondContact O-CG2 3.21Å; L271-V275 PolarHBondContact O-N 2.74Å; T272-V275 PolarHBondContact O-N 3.21Å; V275-D277 VanDerWaalsContact C-N 3.3Å; V275-D277 PolarHBondContact O-N 2.88Å; V275-M281 VanDerWaalsContact O-CE 3.26Å; V275-M281 WeakPolarHBondContact O-CE 3.38Å; V275-V347 HydrophobicContact CG2-CB 3.7Å; V275-V347 HydrophobicContact CG2-CG1 3.66Å; V275-F349 HydrophobicContact CG1-CB 3.46Å; V275-F349 VanDerWaalsContact CG1-CB 3.46Å; V275-F349 HydrophobicContact CG1-CD2 3.22Å; V275-F349 HydrophobicContact CG1-CE2 4.08Å; V275-F349 HydrophobicContact CG1-CG 3.54Å
276	F	87.1	Confident	87.1	Confident	28 Å²	28	33 Å²	33	12%	0.123	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	3.9	178.2	-74.3	-82.5	0	0	0	113.6	T272 Q274 Y292 V295 M312 V315 F323 F349	T272-F276 HydrophobicContact CG2-CD2 4.32Å; T272-F276 HydrophobicContact CG2-CE2 4.27Å; T272-F276 WeakPolarHBondContact O-CD2 3.31Å; T272-F276 PolarHBondContact O-N 3.06Å; Q274-F276 VanDerWaalsContact C-N 3.33Å; Q274-F276 PolarHBondContact O-N 3.22Å; F276-Y292 HydrophobicContact CD1-CE2 4.25Å; F276-Y292 HydrophobicContact CE1-CE2 4.35Å; F276-V295 HydrophobicContact CZ-CG1 4.27Å; F276-M312 HydrophobicContact CE2-CE 3.89Å; F276-M312 HydrophobicContact CE2-SD 4.01Å; F276-M312 HydrophobicContact CZ-CE 3.9Å; F276-V315 HydrophobicContact CD1-CG1 4.29Å; F276-V315 HydrophobicContact CD2-CG1 3.76Å; F276-V315 HydrophobicContact CD2-CG2 4.41Å; F276-V315 HydrophobicContact CE1-CG1 4.33Å; F276-V315 HydrophobicContact CE2-CB 4.37Å; F276-V315 HydrophobicContact CE2-CG1 3.81Å; F276-V315 HydrophobicContact CG-CG1 4Å; F276-V315 HydrophobicContact CZ-CG1 4.09Å; F276-F323 HydrophobicContact CE1-CE1 4.38Å; F276-F323 AromaticContact CE1-CZ 3.81Å; F276-F323 HydrophobicContact CE1-CZ 3.81Å; F276-F323 HydrophobicContact CZ-CZ 4.23Å; F276-F349 HydrophobicContact CD1-CE2 4.12Å; F276-F349 HydrophobicContact CD1-CZ 4.42Å; F276-F349 AromaticContact CE1-CE2 3.66Å; F276-F349 HydrophobicContact CE1-CE2 3.66Å; F276-F349 HydrophobicContact CE1-CZ 4.15Å; F276-F349 AromaticContact CZ-CE2 3.92Å; F276-F349 HydrophobicContact CZ-CE2 3.92Å
277	D	87.9	Confident	87.4	Confident	49 Å²	49	31.1 Å²	31.1	26%	0.262	17%	0.166	S	C	.	.	S	Bend	trans	-78.2	132.8	173.4	-166.6	4.2	0	0	0	110	Q273 Q274 V275 K279 N280	Q273-D277 PolarHBondContact O-N 2.91Å; Q274-D277 WeakPolarHBondContact O-CB 3.45Å; Q274-D277 PolarHBondContact O-N 3.14Å; V275-D277 VanDerWaalsContact C-N 3.3Å; V275-D277 PolarHBondContact O-N 2.88Å; D277-K279 PolarHBondContact O-N 2.79Å; D277-K279 VanDerWaalsContact O-N 3.08Å; D277-N280 PolarHBondContact O-N 3.46Å
278	A	85.4	Confident	87.4	Confident	29 Å²	29	35.8 Å²	35.8	24%	0.24	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-57.2	-28.4	178.7	0	0	0	0	0	112	N280 M281	A278-N280 PolarHBondContact O-N 3.09Å; A278-M281 PolarHBondContact O-N 3.31Å
279	K	84.7	Confident	87.4	Confident	141 Å²	141	40.7 Å²	40.7	61%	0.613	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-70.6	-14.4	178.9	-62.3	176.1	-173	165.6	0	114.4	I192 D277	I192-K279 VanDerWaalsContact CG1-O 3.32Å; I192-K279 WeakPolarHBondContact CG1-O 3.42Å; D277-K279 PolarHBondContact O-N 2.79Å; D277-K279 VanDerWaalsContact O-N 3.08Å
280	N	84.9	Confident	87.3	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.021	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-101.7	-2.9	-178.4	-91.3	60.3	0	0	0	112.7	G251 F252 L255 Q274 D277 A278	G251-N280 WeakPolarHBondContact CA-O 3.45Å; F252-N280 PolarHBondContact O-ND2 2.91Å; L255-N280 HydrophobicContact CD1-CB 4.27Å; L255-N280 WeakPolarHBondContact CD1-ND2 3.46Å; Q274-N280 VanDerWaalsContact CD-ND2 3.31Å; Q274-N280 VanDerWaalsContact CG-ND2 3.33Å; Q274-N280 WeakPolarHBondContact CG-ND2 3.32Å; Q274-N280 PolarHBondContact NE2-ND2 3.12Å; Q274-N280 PolarHBondContact NE2-OD1 3.2Å; Q274-N280 WeakPolarHBondContact O-CB 3.17Å; Q274-N280 VanDerWaalsContact O-CG 3.31Å; D277-N280 PolarHBondContact O-N 3.46Å; A278-N280 PolarHBondContact O-N 3.09Å
281	M	88.1	Confident	87.5	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.01	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-75.5	138.3	175.1	-61.8	-58.2	171.6	0	0	110.2	I192 M249 V275 A278 A283 P287 Y292 F349	I192-M281 WeakPolarHBondContact CD1-O 3.35Å; M249-M281 HydrophobicContact CE-CB 4.36Å; M249-M281 HydrophobicContact CE-CG 4.31Å; V275-M281 VanDerWaalsContact O-CE 3.26Å; V275-M281 WeakPolarHBondContact O-CE 3.38Å; A278-M281 PolarHBondContact O-N 3.31Å; M281-A283 VanDerWaalsContact C-N 3.32Å; M281-P287 HydrophobicContact CE-CG 3.85Å; M281-P287 HydrophobicContact CG-CG 3.87Å; M281-P287 HydrophobicContact SD-CG 4.49Å; M281-Y292 WeakPolarHBondContact CE-OH 3.48Å; M281-F349 HydrophobicContact CE-CD1 3.8Å; M281-F349 HydrophobicContact CE-CE1 3.48Å; M281-F349 VanDerWaalsContact CE-CE1 3.48Å; M281-F349 HydrophobicContact CE-CZ 4.1Å; M281-F349 HydrophobicContact SD-CD1 3.82Å; M281-F349 HydrophobicContact SD-CE1 3.86Å
282	M	87.6	Confident	87.6	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.193	C	C	.	.	S	Bend	trans	-90.7	1.6	175.5	-61.5	-163.3	174.9	0	0	112.9	D185 L189 L210 T214 P250 F252	D185-M282 PolarHBondContact N-O 3.18Å; L189-M282 HydrophobicContact CD2-CB 4.26Å; L189-M282 HydrophobicContact CD2-CG 4.07Å; L189-M282 HydrophobicContact CD2-SD 3.91Å; L210-M282 HydrophobicContact CB-CE 3.94Å; T214-M282 HydrophobicContact CG2-SD 4.19Å; T214-M282 WeakPolarHBondContact OG1-CE 3.48Å; T214-M282 PolarHBondContact OG1-SD 3.09Å; P250-M282 HydrophobicContact CG-CB 4.11Å; P250-M282 WeakPolarHBondContact O-CB 3.42Å; P250-M282 PolarHBondContact O-N 3.5Å; F252-M282 HydrophobicContact CB-CE 3.72Å
283	A	87.7	Confident	87.8	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.008	19%	0.192	C	C	.	.	S	Bend	trans	-108.5	135.6	164.8	0	0	0	0	0	108.4	M249 M281 C285 I356	M249-A283 HydrophobicContact CB-CB 4.37Å; M249-A283 HydrophobicContact CE-CB 4.1Å; M249-A283 HydrophobicContact CG-CB 4.02Å; M281-A283 VanDerWaalsContact C-N 3.32Å; A283-C285 PolarHBondContact O-N 3.35Å; A283-I356 HydrophobicContact CB-CD1 4.15Å
284	A	86	Confident	88	Confident	34 Å²	34	34.5 Å²	34.5	28%	0.281	17%	0.165	S	C	.	.	S	Bend	trans	-81	65.3	-177.1	0	0	0	0	0	111	D185 E187 A188	D185-A284 WeakPolarHBondContact OD2-CB 3.44Å; D185-A284 PolarHBondContact OD2-N 3.04Å; E187-A284 HydrophobicContact CB-CB 4.07Å; E187-A284 HydrophobicContact CG-CB 4.12Å; A188-A284 HydrophobicContact CB-CB 4.03Å
285	C	85.4	Confident	88.1	Confident	8 Å²	8	33.8 Å²	33.8	5%	0.054	16%	0.162	C	C	.	.	S	Bend	trans	-130.9	145.4	174.4	-43	0	0	0	0	108.6	M249 A283 P287 A355 E358	M249-C285 HydrophobicContact CE-CB 3.63Å; M249-C285 HydrophobicContact SD-CB 4.33Å; A283-C285 PolarHBondContact O-N 3.35Å; C285-P287 VanDerWaalsContact O-CD 3.31Å; C285-P287 WeakPolarHBondContact O-CD 3.47Å; C285-A355 HydrophobicContact CB-CB 4.37Å; C285-A355 WeakPolarHBondContact CB-O 3.01Å; C285-E358 WeakPolarHBondContact CA-OE2 3.39Å; C285-E358 HydrophobicContact CB-CB 4.28Å
286	D	86.3	Confident	88.3	Confident	47 Å²	47	34 Å²	34	25%	0.251	16%	0.164	S	C	.	.			trans	-86.1	113.3	171.4	-166.8	-24	0	0	0	109.2	R288 H289 A355 E358	D286-R288 PolarHBondContact O-N 3.17Å; D286-R288 VanDerWaalsContact OD1-CB 3.28Å; D286-R288 WeakPolarHBondContact OD1-CB 3.33Å; D286-R288 VanDerWaalsContact OD1-CG 3.32Å; D286-R288 WeakPolarHBondContact OD1-CG 3.44Å; D286-R288 PolarHBondContact OD1-N 3.06Å; D286-H289 PolarHBondContact O-N 3.33Å; D286-A355 WeakPolarHBondContact O-CB 3.36Å; D286-E358 PolarHBondContact N-OE2 3.49Å; D286-E358 VanDerWaalsContact N-OE2 3.13Å
287	P	85.9	Confident	88.4	Confident	7 Å²	7	32.8 Å²	32.8	5%	0.045	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-62	-15.9	-179.9	-18.4	30.9	0	0	0	113.6	M249 M281 C285 H289 G290 Y292	M249-P287 HydrophobicContact CE-CG 4.31Å; M281-P287 HydrophobicContact CE-CG 3.85Å; M281-P287 HydrophobicContact CG-CG 3.87Å; M281-P287 HydrophobicContact SD-CG 4.49Å; C285-P287 VanDerWaalsContact O-CD 3.31Å; C285-P287 WeakPolarHBondContact O-CD 3.47Å; P287-H289 VanDerWaalsContact C-N 3.29Å; P287-G290 PolarHBondContact O-N 3.11Å; P287-Y292 HydrophobicContact CB-CE1 4.37Å; P287-Y292 HydrophobicContact CB-CE2 4.14Å; P287-Y292 WeakPolarHBondContact CB-OH 3.04Å; P287-Y292 WeakPolarHBondContact CG-OH 3.32Å
288	R	87.1	Confident	88.5	Confident	152 Å²	152	30.7 Å²	30.7	57%	0.574	15%	0.148	S	C	*	.	G	3₁₀ helix	trans	-75.2	-17.8	176.9	-60	173.3	-178.3	-173.1	2	113.3	D286 G290 Y322	D286-R288 PolarHBondContact O-N 3.17Å; D286-R288 VanDerWaalsContact OD1-CB 3.28Å; D286-R288 WeakPolarHBondContact OD1-CB 3.33Å; D286-R288 VanDerWaalsContact OD1-CG 3.32Å; D286-R288 WeakPolarHBondContact OD1-CG 3.44Å; D286-R288 PolarHBondContact OD1-N 3.06Å; R288-G290 VanDerWaalsContact C-N 3.27Å; R288-Y322 HydrophobicContact CB-CE1 4.02Å; R288-Y322 HydrophobicContact CG-CE1 4.46Å; R288-Y322 WeakPolarHBondContact O-CE1 3.31Å
289	H	89.2	Confident	88.7	Confident	109 Å²	109	29.4 Å²	29.4	51%	0.505	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	-82.1	-8.1	175.5	-66.1	165.5	0	0	0	113	D286 P287 E358 Q408	D286-H289 PolarHBondContact O-N 3.33Å; P287-H289 VanDerWaalsContact C-N 3.29Å; H289-E358 IonicContact CE1-OE1 2.77Å; H289-E358 IonicContact CG-OE1 3.91Å; H289-E358 IonicContact ND1-OE1 3.53Å; H289-E358 PolarHBondContact ND1-OE1 3.38Å; H289-Q408 PolarHBondContact O-NE2 2.93Å
290	G	89.2	Confident	88.9	Confident	4 Å²	4	22.8 Å²	22.8	4%	0.041	11%	0.108	C	C	.	.	S	Bend	trans	-130.8	-166.5	177.6	0	0	0	0	0	112.7	P287 R288 T354	P287-G290 PolarHBondContact O-N 3.11Å; R288-G290 VanDerWaalsContact C-N 3.27Å; G290-T354 VanDerWaalsContact CA-OG1 3.31Å; G290-T354 WeakPolarHBondContact CA-OG1 3.36Å
291	R	92	Very high	89	Confident	80 Å²	80	22.6 Å²	22.6	30%	0.302	11%	0.107	S	C	.	.			trans	-122.1	150.3	172.8	-62.4	-178.2	177.9	171.2	2.6	109.7	Y322 V324 S353 T354 Q408 A410	R291-Y322 CarbonylContact C-O 3.58Å; R291-Y322 VanDerWaalsContact CA-O 3.28Å; R291-Y322 WeakPolarHBondContact CA-O 3.22Å; R291-V324 HydrophobicContact CB-CG2 3.78Å; R291-S353 VanDerWaalsContact O-CA 3.32Å; R291-S353 WeakPolarHBondContact O-CA 3.49Å; R291-S353 PolarHBondContact O-OG 3.32Å; R291-S353 VanDerWaalsContact O-OG 3.05Å; R291-T354 PolarHBondContact N-OG1 3.28Å; R291-T354 PolarHBondContact O-N 3.21Å; R291-T354 PolarHBondContact O-OG1 3.43Å; R291-Q408 PolarHBondContact NH1-O 3.31Å; R291-A410 PolarHBondContact NH1-O 3.48Å
292	Y	92.7	Very high	88.8	Confident	8 Å²	8	33.1 Å²	33.1	3%	0.031	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	119.8	172	-71.3	-71.4	0	0	0	109.6	F276 M281 P287 V295 Y322 F323 V324 N330 F349	F276-Y292 HydrophobicContact CD1-CE2 4.25Å; F276-Y292 HydrophobicContact CE1-CE2 4.35Å; M281-Y292 WeakPolarHBondContact CE-OH 3.48Å; P287-Y292 HydrophobicContact CB-CE1 4.37Å; P287-Y292 HydrophobicContact CB-CE2 4.14Å; P287-Y292 WeakPolarHBondContact CB-OH 3.04Å; P287-Y292 WeakPolarHBondContact CG-OH 3.32Å; Y292-V295 HydrophobicContact CD1-CG2 3.67Å; Y292-V295 HydrophobicContact CD2-CG2 4.47Å; Y292-V295 HydrophobicContact CE1-CG2 4.34Å; Y292-V295 HydrophobicContact CG-CG2 3.74Å; Y292-Y322 PolarHBondContact N-O 3.3Å; Y292-F323 HydrophobicContact CD2-CD1 4.38Å; Y292-F323 HydrophobicContact CD2-CE1 4.05Å; Y292-F323 HydrophobicContact CD2-CZ 4.28Å; Y292-F323 HydrophobicContact CG-CE1 4.33Å; Y292-V324 WeakPolarHBondContact O-CG2 3.41Å; Y292-V324 PolarHBondContact O-N 3.42Å; Y292-V324 VanDerWaalsContact O-N 3.11Å; Y292-N330 PolarHBondContact O-ND2 3Å; Y292-F349 HydrophobicContact CD1-CZ 4.34Å; Y292-F349 AromaticContact CE1-CE1 4Å; Y292-F349 HydrophobicContact CE1-CE1 4Å; Y292-F349 AromaticContact CE1-CZ 3.56Å; Y292-F349 HydrophobicContact CE1-CZ 3.56Å; Y292-F349 AromaticContact CZ-CZ 3.81Å
293	L	92.1	Very high	88.8	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	-56.8	168.8	-63.2	170	0	0	0	108.5	P241 L245 V324 W326 I327 N330 N352 T354	P241-L293 HydrophobicContact CG-CB 4.3Å; P241-L293 HydrophobicContact CG-CD1 4.4Å; L245-L293 HydrophobicContact CD1-CD1 4.17Å; L293-V324 HydrophobicContact CD2-CG2 3.95Å; L293-W326 HydrophobicContact CD2-CH2 4.1Å; L293-W326 HydrophobicContact CD2-CZ2 3.79Å; L293-I327 HydrophobicContact CB-CD1 4.36Å; L293-I327 WeakPolarHBondContact O-CD1 3.25Å; L293-N330 WeakPolarHBondContact O-CB 3.29Å; L293-N330 PolarHBondContact O-ND2 3.21Å; L293-N330 VanDerWaalsContact O-ND2 3.07Å; L293-N352 HydrophobicContact CB-CB 4.45Å; L293-N352 PolarHBondContact N-O 3Å; L293-T354 HydrophobicContact CD2-CG2 4.49Å; L293-T354 HydrophobicContact CG-CG2 4.36Å
294	T	91.9	Very high	88.8	Confident	5 Å²	5	37.6 Å²	37.6	3%	0.031	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	151.8	-179.9	63.5	0	0	0	0	110.5	N238 M239 I327 N330 N352	N238-T294 WeakPolarHBondContact O-CG2 3.4Å; M239-T294 WeakPolarHBondContact CA-OG1 3.15Å; M239-T294 WeakPolarHBondContact CE-OG1 3.32Å; M239-T294 PolarHBondContact O-OG1 2.88Å; T294-I327 HydrophobicContact CG2-CD1 4.37Å; T294-N330 WeakPolarHBondContact CA-O 3.37Å; T294-N352 PolarHBondContact N-O 2.6Å; T294-N352 PolarHBondContact O-N 2.82Å; T294-N352 WeakPolarHBondContact OG1-CB 3.48Å
295	V	92.3	Very high	88.7	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	130.7	179.2	171.3	0	0	0	0	109.4	F276 Y292 F323 N330 V331 K332 F349 I350	F276-V295 HydrophobicContact CZ-CG1 4.27Å; Y292-V295 HydrophobicContact CD1-CG2 3.67Å; Y292-V295 HydrophobicContact CD2-CG2 4.47Å; Y292-V295 HydrophobicContact CE1-CG2 4.34Å; Y292-V295 HydrophobicContact CG-CG2 3.74Å; V295-F323 HydrophobicContact CG2-CE1 3.99Å; V295-N330 PolarHBondContact N-O 2.93Å; V295-V331 HydrophobicContact CB-CG2 4.29Å; V295-V331 HydrophobicContact CG1-CG1 4.34Å; V295-V331 CarbonylContact O-C 3.58Å; V295-V331 WeakPolarHBondContact O-CA 3.06Å; V295-K332 PolarHBondContact O-N 3.46Å; V295-F349 HydrophobicContact CB-CE2 4.4Å; V295-F349 HydrophobicContact CG1-CD2 3.98Å; V295-F349 HydrophobicContact CG1-CE2 3.31Å; V295-F349 HydrophobicContact CG1-CZ 4.01Å; V295-F349 HydrophobicContact CG2-CE2 4.24Å; V295-F349 HydrophobicContact CG2-CZ 4.16Å; V295-I350 WeakPolarHBondContact CA-O 3.41Å
296	A	89.8	Confident	88.9	Confident	7 Å²	7	45.2 Å²	45.2	6%	0.058	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.4	164.9	0	0	0	0	0	110.5	L235 M239 K332 I350	L235-A296 HydrophobicContact CD1-CB 4.28Å; M239-A296 HydrophobicContact CE-CB 4.24Å; M239-A296 HydrophobicContact CG-CB 4.41Å; M239-A296 HydrophobicContact SD-CB 3.51Å; M239-A296 VanDerWaalsContact SD-CB 3.51Å; A296-K332 CarbonylContact C-O 3.57Å; A296-K332 VanDerWaalsContact CA-O 3.32Å; A296-K332 WeakPolarHBondContact CA-O 3.33Å; A296-I350 HydrophobicContact CB-CB 4.27Å; A296-I350 HydrophobicContact CB-CD1 4.5Å; A296-I350 PolarHBondContact N-O 3.15Å; A296-I350 PolarHBondContact O-N 2.98Å
297	A	90.2	Very high	89.1	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.008	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	116.1	173.9	0	0	0	0	0	109.9	F299 M312 K332 T333 A334 V347 T348	A297-F299 HydrophobicContact CB-CD2 4.22Å; A297-F299 HydrophobicContact CB-CE2 3.7Å; A297-M312 HydrophobicContact CB-CE 3.92Å; A297-M312 HydrophobicContact CB-SD 4.39Å; A297-K332 PolarHBondContact N-O 2.98Å; A297-T333 WeakPolarHBondContact O-CA 3.27Å; A297-A334 PolarHBondContact O-N 3.45Å; A297-V347 HydrophobicContact CB-CG1 4.38Å; A297-T348 CarbonylContact C-O 3.5Å; A297-T348 WeakPolarHBondContact CA-O 3.38Å
298	V	89.9	Confident	89.2	Confident	6 Å²	6	46.2 Å²	46.2	4%	0.036	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	101.1	178.5	-174	0	0	0	0	108.9	T220 A334 V347 T348	T220-V298 HydrophobicContact CG2-CG1 4.39Å; V298-A334 CarbonylContact C-O 3.53Å; V298-A334 HydrophobicContact CG2-CB 4.42Å; V298-V347 CarbonylContact O-C 3.52Å; V298-V347 WeakPolarHBondContact O-CA 3.28Å; V298-T348 PolarHBondContact N-O 3.49Å; V298-T348 PolarHBondContact O-N 3.39Å
299	F	90.6	Very high	89.3	Confident	1 Å²	1	42.8 Å²	42.8	0%	0.004	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	136.3	174.7	-72.6	-100.8	0	0	0	110.4	V268 A297 M303 V308 M312 A334 V335 C336 V347	V268-F299 HydrophobicContact CG1-CE1 4.17Å; A297-F299 HydrophobicContact CB-CD2 4.22Å; A297-F299 HydrophobicContact CB-CE2 3.7Å; F299-M303 HydrophobicContact CB-CE 3.74Å; F299-M303 HydrophobicContact CB-SD 3.56Å; F299-M303 VanDerWaalsContact CB-SD 3.56Å; F299-M303 HydrophobicContact CD1-CE 4.29Å; F299-M303 HydrophobicContact CD1-SD 3.56Å; F299-M303 VanDerWaalsContact CD1-SD 3.56Å; F299-M303 HydrophobicContact CG-SD 3.92Å; F299-V308 HydrophobicContact CD1-CG1 4.27Å; F299-V308 HydrophobicContact CD1-CG2 4.05Å; F299-V308 HydrophobicContact CD2-CG1 3.6Å; F299-V308 HydrophobicContact CE1-CG1 4.19Å; F299-V308 HydrophobicContact CE1-CG2 4.31Å; F299-V308 HydrophobicContact CE2-CG1 3.5Å; F299-V308 VanDerWaalsContact CE2-CG1 3.5Å; F299-V308 HydrophobicContact CG-CG1 4.02Å; F299-V308 HydrophobicContact CG-CG2 4.26Å; F299-V308 HydrophobicContact CZ-CG1 3.82Å; F299-M312 HydrophobicContact CE2-CG 4.33Å; F299-M312 HydrophobicContact CE2-SD 4.15Å; F299-M312 HydrophobicContact CZ-CG 4.41Å; F299-M312 HydrophobicContact CZ-SD 4.1Å; F299-A334 PolarHBondContact N-O 3.06Å; F299-V335 HydrophobicContact CB-CG2 4.21Å; F299-V335 CarbonylContact O-C 3.53Å; F299-V335 WeakPolarHBondContact O-CA 3.41Å; F299-C336 PolarHBondContact O-N 2.77Å; F299-V347 HydrophobicContact CD1-CB 4.35Å; F299-V347 HydrophobicContact CD1-CG1 4.23Å; F299-V347 HydrophobicContact CD1-CG2 3.23Å; F299-V347 HydrophobicContact CD2-CG1 4.14Å; F299-V347 HydrophobicContact CE1-CB 4.39Å; F299-V347 HydrophobicContact CE1-CG1 4.12Å; F299-V347 HydrophobicContact CE1-CG2 3.35Å; F299-V347 HydrophobicContact CE2-CG1 4.03Å; F299-V347 HydrophobicContact CG-CG1 4.22Å; F299-V347 HydrophobicContact CG-CG2 3.89Å; F299-V347 HydrophobicContact CZ-CG1 4Å; F299-V347 HydrophobicContact CZ-CG2 4.08Å
300	R	88.7	Confident	89.4	Confident	3 Å²	3	42.6 Å²	42.6	1%	0.011	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	136.2	-179.8	-61.1	-173.5	65.7	179.9	-0.4	110.8	E9 S216 T220 M303 C336 I338 M345 A346	E9-R300 IonicContact OE1-CZ 3.66Å; E9-R300 IonicContact OE1-NH1 2.77Å; E9-R300 PolarHBondContact OE1-NH1 3.31Å; E9-R300 IonicContact OE1-NH2 2.75Å; E9-R300 PolarHBondContact OE1-NH2 3.14Å; E9-R300 IonicContact OE2-CZ 2.84Å; E9-R300 IonicContact OE2-NH1 3.66Å; E9-R300 PolarHBondContact OE2-NH1 3.3Å; E9-R300 IonicContact OE2-NH2 3.36Å; E9-R300 PolarHBondContact OE2-NH2 3.05Å; S216-R300 PolarHBondContact OG-NH1 2.81Å; T220-R300 HydrophobicContact CG2-CG 4Å; T220-R300 WeakPolarHBondContact OG1-CD 3.08Å; T220-R300 PolarHBondContact OG1-NE 3.32Å; T220-R300 PolarHBondContact OG1-NH1 2.92Å; R300-M303 VanDerWaalsContact C-CE 3.43Å; R300-M303 WeakPolarHBondContact O-CE 3.32Å; R300-C336 CarbonylContact C-O 3.57Å; R300-C336 WeakPolarHBondContact CA-O 3.31Å; R300-C336 HydrophobicContact CG-CB 4.44Å; R300-I338 PolarHBondContact NE-O 3.02Å; R300-I338 VanDerWaalsContact NE-O 3.16Å; R300-I338 PolarHBondContact NH2-O 3.37Å; R300-M345 WeakPolarHBondContact O-CA 3.4Å; R300-A346 PolarHBondContact N-O 3.4Å; R300-A346 PolarHBondContact O-N 3.33Å
301	G	87	Confident	89.5	Confident	0 Å²	0	44 Å²	44	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	108.2	169.4	-178.7	0	0	0	0	0	113.2	M303 C336	G301-M303 VanDerWaalsContact O-CE 3.29Å; G301-M303 WeakPolarHBondContact O-CE 3.47Å; G301-M303 PolarHBondContact O-N 3.24Å; G301-M303 VanDerWaalsContact O-N 3.14Å; G301-C336 PolarHBondContact N-O 2.93Å
302	R	84.3	Confident	89.4	Confident	222 Å²	222	40.7 Å²	40.7	84%	0.838	19%	0.191	S	C	*	.	S	Bend	trans	-72.9	107.2	-177.5	-63.8	-176.6	-173.6	-173.9	1.3	110.6
303	M	86.8	Confident	89.2	Confident	31 Å²	31	44.8 Å²	44.8	15%	0.153	21%	0.213	C	C	.	.			trans	-145.1	162.5	179	65.9	-169	86.9	0	0	112.1	V268 F299 R300 G301 V308 V335 M345	V268-M303 HydrophobicContact CG2-CB 4.02Å; V268-M303 HydrophobicContact CG2-SD 4.19Å; F299-M303 HydrophobicContact CB-CE 3.74Å; F299-M303 HydrophobicContact CB-SD 3.56Å; F299-M303 VanDerWaalsContact CB-SD 3.56Å; F299-M303 HydrophobicContact CD1-CE 4.29Å; F299-M303 HydrophobicContact CD1-SD 3.56Å; F299-M303 VanDerWaalsContact CD1-SD 3.56Å; F299-M303 HydrophobicContact CG-SD 3.92Å; R300-M303 VanDerWaalsContact C-CE 3.43Å; R300-M303 WeakPolarHBondContact O-CE 3.32Å; G301-M303 VanDerWaalsContact O-CE 3.29Å; G301-M303 WeakPolarHBondContact O-CE 3.47Å; G301-M303 PolarHBondContact O-N 3.24Å; G301-M303 VanDerWaalsContact O-N 3.14Å; M303-V308 HydrophobicContact CG-CG2 3.91Å; M303-V308 HydrophobicContact SD-CG2 3.55Å; M303-V308 VanDerWaalsContact SD-CG2 3.55Å; M303-V335 HydrophobicContact CG-CG1 3.96Å; M303-M345 HydrophobicContact CB-SD 4.47Å; M303-M345 HydrophobicContact CE-CG 4.4Å
304	S	87.2	Confident	89.2	Confident	64 Å²	64	47.4 Å²	47.4	45%	0.448	23%	0.227	S	C	.	.			trans	-81	120.5	177.2	179.6	0	0	0	0	110.2	K306 E307 V308	S304-K306 PolarHBondContact O-N 3.18Å; S304-E307 WeakPolarHBondContact O-CB 3.36Å; S304-E307 PolarHBondContact O-N 2.92Å; S304-V308 PolarHBondContact O-N 3.46Å; S304-V308 VanDerWaalsContact O-N 3.14Å
305	M	84.3	Confident	89.1	Confident	62 Å²	62	47.9 Å²	47.9	31%	0.305	23%	0.23	S	C	.	.	H	α-helix	trans	-58.4	-38.7	176.9	-64.8	-166.1	-177.6	0	0	112.4	Q227 E307 V308 D309 V335	Q227-M305 HydrophobicContact CB-CE 3.97Å; Q227-M305 HydrophobicContact CG-CE 3.75Å; Q227-M305 PolarHBondContact OE1-SD 2.85Å; M305-E307 PolarHBondContact O-N 3.21Å; M305-V308 WeakPolarHBondContact O-CB 3.31Å; M305-V308 PolarHBondContact O-N 3Å; M305-V308 VanDerWaalsContact O-N 3.12Å; M305-D309 PolarHBondContact O-N 2.91Å; M305-V335 HydrophobicContact CE-CB 4.02Å; M305-V335 HydrophobicContact CE-CG1 4.35Å; M305-V335 HydrophobicContact CG-CG2 4.24Å
306	K	88.8	Confident	88.9	Confident	141 Å²	141	50 Å²	50	61%	0.613	24%	0.24	S	C	*	.	H	α-helix	trans	-57.3	-40.9	176.3	-178.1	179.8	170.7	-178.8	0	111.8	S304 E310	S304-K306 PolarHBondContact O-N 3.18Å; K306-E310 WeakPolarHBondContact CE-OE1 3.49Å; K306-E310 IonicContact NZ-OE1 3.82Å; K306-E310 WeakPolarHBondContact O-CB 3.18Å; K306-E310 VanDerWaalsContact O-CG 3.26Å; K306-E310 WeakPolarHBondContact O-CG 3.21Å; K306-E310 PolarHBondContact O-N 3.43Å
307	E	90.4	Very high	88.8	Confident	75 Å²	75	55 Å²	55	35%	0.35	27%	0.265	S	S	.	.	H	α-helix	trans	-70.2	-39.5	179.1	-170.8	178.8	-178.6	0	0	111.2	V268 S304 M305 Q311	V268-E307 HydrophobicContact CB-CG 4.15Å; V268-E307 HydrophobicContact CG1-CG 4.31Å; S304-E307 WeakPolarHBondContact O-CB 3.36Å; S304-E307 PolarHBondContact O-N 2.92Å; M305-E307 PolarHBondContact O-N 3.21Å; E307-Q311 VanDerWaalsContact O-CG 3.31Å; E307-Q311 WeakPolarHBondContact O-CG 3.19Å; E307-Q311 PolarHBondContact O-N 3.39Å
308	V	89.2	Confident	88.8	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.9	-50.2	174.9	174.1	0	0	0	0	110.8	V268 F299 M303 S304 M305 E310 Q311 M312 T333 V335	V268-V308 HydrophobicContact CG1-CB 4.43Å; V268-V308 HydrophobicContact CG1-CG2 3.81Å; V268-V308 HydrophobicContact CG2-CG2 4.43Å; F299-V308 HydrophobicContact CD1-CG1 4.27Å; F299-V308 HydrophobicContact CD1-CG2 4.05Å; F299-V308 HydrophobicContact CD2-CG1 3.6Å; F299-V308 HydrophobicContact CE1-CG1 4.19Å; F299-V308 HydrophobicContact CE1-CG2 4.31Å; F299-V308 HydrophobicContact CE2-CG1 3.5Å; F299-V308 VanDerWaalsContact CE2-CG1 3.5Å; F299-V308 HydrophobicContact CG-CG1 4.02Å; F299-V308 HydrophobicContact CG-CG2 4.26Å; F299-V308 HydrophobicContact CZ-CG1 3.82Å; M303-V308 HydrophobicContact CG-CG2 3.91Å; M303-V308 HydrophobicContact SD-CG2 3.55Å; M303-V308 VanDerWaalsContact SD-CG2 3.55Å; S304-V308 PolarHBondContact O-N 3.46Å; S304-V308 VanDerWaalsContact O-N 3.14Å; M305-V308 WeakPolarHBondContact O-CB 3.31Å; M305-V308 PolarHBondContact O-N 3Å; M305-V308 VanDerWaalsContact O-N 3.12Å; V308-E310 PolarHBondContact O-N 3.45Å; V308-Q311 PolarHBondContact O-N 2.85Å; V308-M312 HydrophobicContact CG1-CG 4.43Å; V308-M312 VanDerWaalsContact O-CG 3.29Å; V308-M312 WeakPolarHBondContact O-CG 3.43Å; V308-M312 PolarHBondContact O-N 3.2Å; V308-T333 HydrophobicContact CG1-CG2 4.3Å; V308-V335 HydrophobicContact CG1-CG2 4.5Å; V308-V335 HydrophobicContact CG2-CG2 4.44Å
309	D	88.2	Confident	88.7	Confident	80 Å²	80	64.1 Å²	64.1	43%	0.428	31%	0.307	S	S	.	.	H	α-helix	trans	-64.8	-41.8	-178.7	-65.7	-24.5	0	0	0	111.6	M305 Q311 M312 L313 T333	M305-D309 PolarHBondContact O-N 2.91Å; D309-Q311 PolarHBondContact O-N 3.19Å; D309-M312 PolarHBondContact O-N 3.1Å; D309-L313 VanDerWaalsContact O-CB 3.3Å; D309-L313 WeakPolarHBondContact O-CB 3.31Å; D309-L313 PolarHBondContact O-N 3.26Å; D309-T333 PolarHBondContact OD1-OG1 3.12Å
310	E	91.3	Very high	88.5	Confident	104 Å²	104	67.2 Å²	67.2	49%	0.486	33%	0.329	S	S	.	.	H	α-helix	trans	-61.4	-41.7	174.8	-78.5	176.9	-176.5	0	0	112.1	K306 V308 N314	K306-E310 WeakPolarHBondContact CE-OE1 3.49Å; K306-E310 IonicContact NZ-OE1 3.82Å; K306-E310 WeakPolarHBondContact O-CB 3.18Å; K306-E310 VanDerWaalsContact O-CG 3.26Å; K306-E310 WeakPolarHBondContact O-CG 3.21Å; K306-E310 PolarHBondContact O-N 3.43Å; V308-E310 PolarHBondContact O-N 3.45Å; E310-N314 VanDerWaalsContact O-CB 3.25Å; E310-N314 WeakPolarHBondContact O-CB 3.39Å; E310-N314 PolarHBondContact O-N 3Å
311	Q	91.4	Very high	88.5	Confident	35 Å²	35	70.6 Å²	70.6	16%	0.164	35%	0.353	C	S	.	.	H	α-helix	trans	-69.8	-39.8	178.5	-69.8	-50.7	-48.8	0	0	112.5	V268 P269 T272 E307 V308 D309 N314 V315	V268-Q311 HydrophobicContact CG1-CG 4.19Å; P269-Q311 HydrophobicContact CB-CG 4.19Å; P269-Q311 HydrophobicContact CG-CG 3.95Å; T272-Q311 HydrophobicContact CG2-CB 4.23Å; E307-Q311 VanDerWaalsContact O-CG 3.31Å; E307-Q311 WeakPolarHBondContact O-CG 3.19Å; E307-Q311 PolarHBondContact O-N 3.39Å; V308-Q311 PolarHBondContact O-N 2.85Å; D309-Q311 PolarHBondContact O-N 3.19Å; Q311-N314 WeakPolarHBondContact O-CB 3.41Å; Q311-N314 PolarHBondContact O-N 3.07Å; Q311-V315 PolarHBondContact O-N 3.41Å
312	M	89.7	Confident	88.6	Confident	9 Å²	9	74.3 Å²	74.3	4%	0.044	37%	0.368	C	S	.	.	H	α-helix	trans	-67.1	-42.2	178.3	-68	-66.1	-61.1	0	0	111.2	T272 F276 A297 F299 V308 D309 N314 V315 Q316 V331 T333	T272-M312 HydrophobicContact CG2-SD 3.7Å; F276-M312 HydrophobicContact CE2-CE 3.89Å; F276-M312 HydrophobicContact CE2-SD 4.01Å; F276-M312 HydrophobicContact CZ-CE 3.9Å; A297-M312 HydrophobicContact CB-CE 3.92Å; A297-M312 HydrophobicContact CB-SD 4.39Å; F299-M312 HydrophobicContact CE2-CG 4.33Å; F299-M312 HydrophobicContact CE2-SD 4.15Å; F299-M312 HydrophobicContact CZ-CG 4.41Å; F299-M312 HydrophobicContact CZ-SD 4.1Å; V308-M312 HydrophobicContact CG1-CG 4.43Å; V308-M312 VanDerWaalsContact O-CG 3.29Å; V308-M312 WeakPolarHBondContact O-CG 3.43Å; V308-M312 PolarHBondContact O-N 3.2Å; D309-M312 PolarHBondContact O-N 3.1Å; M312-N314 VanDerWaalsContact C-N 3.33Å; M312-N314 PolarHBondContact O-N 3.41Å; M312-V315 PolarHBondContact O-N 2.67Å; M312-Q316 PolarHBondContact O-N 3.33Å; M312-V331 HydrophobicContact CE-CG1 3.29Å; M312-T333 HydrophobicContact CB-CG2 4.11Å; M312-T333 HydrophobicContact CE-CG2 4.19Å; M312-T333 HydrophobicContact CG-CG2 3.59Å; M312-T333 HydrophobicContact SD-CG2 4.49Å
313	L	89.6	Confident	88.9	Confident	94 Å²	94	64.2 Å²	64.2	49%	0.492	33%	0.33	S	S	.	.	H	α-helix	trans	-63	-38.9	173.5	-174.9	64.6	0	0	0	112	D309 Q316 N317	D309-L313 VanDerWaalsContact O-CB 3.3Å; D309-L313 WeakPolarHBondContact O-CB 3.31Å; D309-L313 PolarHBondContact O-N 3.26Å; L313-Q316 PolarHBondContact O-N 3.48Å; L313-N317 WeakPolarHBondContact O-CB 3.44Å; L313-N317 VanDerWaalsContact O-CG 3.27Å; L313-N317 PolarHBondContact O-N 2.95Å; L313-N317 PolarHBondContact O-ND2 3.09Å
314	N	91.8	Very high	89	Confident	56 Å²	56	63 Å²	63	30%	0.299	32%	0.324	S	S	.	.	H	α-helix	trans	-63.2	-40.8	176.2	-174.4	26.9	0	0	0	112.3	E310 Q311 M312 K318	E310-N314 VanDerWaalsContact O-CB 3.25Å; E310-N314 WeakPolarHBondContact O-CB 3.39Å; E310-N314 PolarHBondContact O-N 3Å; Q311-N314 WeakPolarHBondContact O-CB 3.41Å; Q311-N314 PolarHBondContact O-N 3.07Å; M312-N314 VanDerWaalsContact C-N 3.33Å; M312-N314 PolarHBondContact O-N 3.41Å; N314-K318 PolarHBondContact ND2-NZ 3.42Å; N314-K318 WeakPolarHBondContact O-CB 3.49Å; N314-K318 VanDerWaalsContact O-CG 3.32Å; N314-K318 WeakPolarHBondContact O-CG 3.36Å; N314-K318 PolarHBondContact O-N 2.98Å; N314-K318 VanDerWaalsContact O-N 3.07Å; N314-K318 WeakPolarHBondContact OD1-CE 3.45Å; N314-K318 PolarHBondContact OD1-NZ 2.89Å
315	V	89.5	Confident	88.8	Confident	15 Å²	15	67 Å²	67	9%	0.091	34%	0.336	C	S	.	.	H	α-helix	trans	-65.4	-47	174.6	171.4	0	0	0	0	110.5	T272 F276 Q311 M312 N317 K318 N319	T272-V315 HydrophobicContact CG2-CG2 3.68Å; F276-V315 HydrophobicContact CD1-CG1 4.29Å; F276-V315 HydrophobicContact CD2-CG1 3.76Å; F276-V315 HydrophobicContact CD2-CG2 4.41Å; F276-V315 HydrophobicContact CE1-CG1 4.33Å; F276-V315 HydrophobicContact CE2-CB 4.37Å; F276-V315 HydrophobicContact CE2-CG1 3.81Å; F276-V315 HydrophobicContact CG-CG1 4Å; F276-V315 HydrophobicContact CZ-CG1 4.09Å; Q311-V315 PolarHBondContact O-N 3.41Å; M312-V315 PolarHBondContact O-N 2.67Å; V315-N317 VanDerWaalsContact C-N 3.32Å; V315-N317 PolarHBondContact O-N 3.16Å; V315-K318 PolarHBondContact O-N 2.72Å; V315-N319 VanDerWaalsContact O-CB 3.27Å; V315-N319 WeakPolarHBondContact O-CB 3.48Å; V315-N319 PolarHBondContact O-N 2.92Å
316	Q	87.8	Confident	88.8	Confident	45 Å²	45	66.1 Å²	66.1	21%	0.21	33%	0.329	C	S	.	.	H	α-helix	trans	-58.4	-43.9	178.9	-166.9	177.9	13	0	0	111.9	M312 L313 N319 S320 F323 N330	M312-Q316 PolarHBondContact O-N 3.33Å; L313-Q316 PolarHBondContact O-N 3.48Å; Q316-N319 CarbonylContact O-C 3.59Å; Q316-N319 PolarHBondContact O-N 2.95Å; Q316-S320 WeakPolarHBondContact O-CA 3.26Å; Q316-S320 PolarHBondContact O-N 3.25Å; Q316-F323 HydrophobicContact CB-CE2 4.46Å; Q316-F323 HydrophobicContact CG-CD2 4.15Å; Q316-F323 HydrophobicContact CG-CE2 4.39Å; Q316-F323 HydrophobicContact CG-CG 4.35Å; Q316-N330 PolarHBondContact NE2-OD1 3.44Å
317	N	88.9	Confident	88.5	Confident	111 Å²	111	60.9 Å²	60.9	59%	0.594	31%	0.307	S	S	*	.	H	α-helix	trans	-68.1	-36.7	178.7	-73.2	-24.4	0	0	0	113.5	L313 V315 N319	L313-N317 WeakPolarHBondContact O-CB 3.44Å; L313-N317 VanDerWaalsContact O-CG 3.27Å; L313-N317 PolarHBondContact O-N 2.95Å; L313-N317 PolarHBondContact O-ND2 3.09Å; V315-N317 VanDerWaalsContact C-N 3.32Å; V315-N317 PolarHBondContact O-N 3.16Å; N317-N319 VanDerWaalsContact C-N 3.35Å
318	K	89.8	Confident	88	Confident	140 Å²	140	62.1 Å²	62.1	61%	0.609	32%	0.322	S	S	*	.	H	α-helix	trans	-72.5	-32.4	178.1	-78	174.3	176.5	168.4	0	112.7	N314 V315	N314-K318 PolarHBondContact ND2-NZ 3.42Å; N314-K318 WeakPolarHBondContact O-CB 3.49Å; N314-K318 VanDerWaalsContact O-CG 3.32Å; N314-K318 WeakPolarHBondContact O-CG 3.36Å; N314-K318 PolarHBondContact O-N 2.98Å; N314-K318 VanDerWaalsContact O-N 3.07Å; N314-K318 WeakPolarHBondContact OD1-CE 3.45Å; N314-K318 PolarHBondContact OD1-NZ 2.89Å; V315-K318 PolarHBondContact O-N 2.72Å
319	N	87.9	Confident	87.6	Confident	58 Å²	58	67.8 Å²	67.8	31%	0.31	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.3	27.7	-170	-69.7	-7.5	0	0	0	111.3	V315 Q316 N317 S321 Y322 F323	V315-N319 VanDerWaalsContact O-CB 3.27Å; V315-N319 WeakPolarHBondContact O-CB 3.48Å; V315-N319 PolarHBondContact O-N 2.92Å; Q316-N319 CarbonylContact O-C 3.59Å; Q316-N319 PolarHBondContact O-N 2.95Å; N317-N319 VanDerWaalsContact C-N 3.35Å; N319-S321 PolarHBondContact O-N 3.12Å; N319-S321 VanDerWaalsContact O-N 3.09Å; N319-Y322 HydrophobicContact CB-CD2 3.84Å; N319-Y322 WeakPolarHBondContact O-CB 3.47Å; N319-Y322 PolarHBondContact O-N 3.42Å; N319-F323 HydrophobicContact CB-CE2 4.13Å; N319-F323 VanDerWaalsContact O-CD2 3.32Å; N319-F323 WeakPolarHBondContact O-CD2 3.39Å
320	S	86.1	Confident	87.5	Confident	67 Å²	67	64.2 Å²	64.2	47%	0.469	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-56	-33.4	-170.5	61.5	0	0	0	0	112.9	Q316 Y322 F323	Q316-S320 WeakPolarHBondContact O-CA 3.26Å; Q316-S320 PolarHBondContact O-N 3.25Å; S320-Y322 PolarHBondContact O-N 3.48Å; S320-F323 PolarHBondContact O-N 3.01Å
321	S	88	Confident	87.3	Confident	73 Å²	73	60.5 Å²	60.5	51%	0.51	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-63.1	-20.6	176	59.2	0	0	0	0	115	N319	N319-S321 PolarHBondContact O-N 3.12Å; N319-S321 VanDerWaalsContact O-N 3.09Å
322	Y	89.4	Confident	87.1	Confident	79 Å²	79	62.4 Å²	62.4	31%	0.31	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-93.1	-5.1	177.2	-60.2	-63.8	0	0	0	112.3	R288 R291 Y292 N319 S320	R288-Y322 HydrophobicContact CB-CE1 4.02Å; R288-Y322 HydrophobicContact CG-CE1 4.46Å; R288-Y322 WeakPolarHBondContact O-CE1 3.31Å; R291-Y322 CarbonylContact C-O 3.58Å; R291-Y322 VanDerWaalsContact CA-O 3.28Å; R291-Y322 WeakPolarHBondContact CA-O 3.22Å; Y292-Y322 PolarHBondContact N-O 3.3Å; N319-Y322 HydrophobicContact CB-CD2 3.84Å; N319-Y322 WeakPolarHBondContact O-CB 3.47Å; N319-Y322 PolarHBondContact O-N 3.42Å; S320-Y322 PolarHBondContact O-N 3.48Å
323	F	90.1	Very high	87	Confident	9 Å²	9	63.5 Å²	63.5	4%	0.039	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-105.5	141.9	172	-66	-87.8	0	0	0	108.7	F276 Y292 V295 Q316 N319 S320 V331	F276-F323 HydrophobicContact CE1-CE1 4.38Å; F276-F323 AromaticContact CE1-CZ 3.81Å; F276-F323 HydrophobicContact CE1-CZ 3.81Å; F276-F323 HydrophobicContact CZ-CZ 4.23Å; Y292-F323 HydrophobicContact CD2-CD1 4.38Å; Y292-F323 HydrophobicContact CD2-CE1 4.05Å; Y292-F323 HydrophobicContact CD2-CZ 4.28Å; Y292-F323 HydrophobicContact CG-CE1 4.33Å; V295-F323 HydrophobicContact CG2-CE1 3.99Å; Q316-F323 HydrophobicContact CB-CE2 4.46Å; Q316-F323 HydrophobicContact CG-CD2 4.15Å; Q316-F323 HydrophobicContact CG-CE2 4.39Å; Q316-F323 HydrophobicContact CG-CG 4.35Å; N319-F323 HydrophobicContact CB-CE2 4.13Å; N319-F323 VanDerWaalsContact O-CD2 3.32Å; N319-F323 WeakPolarHBondContact O-CD2 3.39Å; S320-F323 PolarHBondContact O-N 3.01Å; F323-V331 HydrophobicContact CD1-CG2 4.1Å; F323-V331 HydrophobicContact CE1-CG2 3.69Å; F323-V331 HydrophobicContact CZ-CG2 4.42Å
324	V	88.9	Confident	86.8	Confident	6 Å²	6	59.6 Å²	59.6	4%	0.036	31%	0.314	C	S	.	.			trans	-68.8	132.4	175.4	170.9	0	0	0	0	110.3	R291 Y292 L293 W326 I327	R291-V324 HydrophobicContact CB-CG2 3.78Å; Y292-V324 WeakPolarHBondContact O-CG2 3.41Å; Y292-V324 PolarHBondContact O-N 3.42Å; Y292-V324 VanDerWaalsContact O-N 3.11Å; L293-V324 HydrophobicContact CD2-CG2 3.95Å; V324-W326 HydrophobicContact CG1-CD2 3.5Å; V324-W326 VanDerWaalsContact CG1-CD2 3.5Å; V324-W326 HydrophobicContact CG1-CE3 4.4Å; V324-W326 HydrophobicContact CG1-CG 3.56Å; V324-W326 HydrophobicContact CG1-CH2 4.46Å; V324-W326 HydrophobicContact CG1-CZ2 3.64Å; V324-I327 HydrophobicContact CG1-CG1 4.3Å
325	E	83.9	Confident	86.5	Confident	149 Å²	149	57.7 Å²	57.7	70%	0.696	30%	0.304	S	S	*	.	S	Bend	trans	-80.7	-29.8	-174.5	-62.4	-175.3	169.1	0	0	113.2
326	W	83.3	Confident	86.3	Confident	42 Å²	42	57.2 Å²	57.2	16%	0.159	30%	0.302	C	S	.	.	S	Bend	trans	-78.1	-15.7	-176.7	55.5	-103.4	0	0	0	114	F242 L293 V324 P328 Y407 A412 E415	F242-W326 AromaticContact CE2-CH2 3.51Å; F242-W326 HydrophobicContact CE2-CH2 3.51Å; F242-W326 HydrophobicContact CE2-CZ2 4.23Å; F242-W326 HydrophobicContact CE2-CZ3 4.27Å; F242-W326 AromaticContact CZ-CH2 3.84Å; F242-W326 HydrophobicContact CZ-CH2 3.84Å; F242-W326 HydrophobicContact CZ-CZ3 4.21Å; L293-W326 HydrophobicContact CD2-CH2 4.1Å; L293-W326 HydrophobicContact CD2-CZ2 3.79Å; V324-W326 HydrophobicContact CG1-CD2 3.5Å; V324-W326 VanDerWaalsContact CG1-CD2 3.5Å; V324-W326 HydrophobicContact CG1-CE3 4.4Å; V324-W326 HydrophobicContact CG1-CG 3.56Å; V324-W326 HydrophobicContact CG1-CH2 4.46Å; V324-W326 HydrophobicContact CG1-CZ2 3.64Å; W326-P328 WeakPolarHBondContact O-CD 3.26Å; W326-Y407 HydrophobicContact CZ2-CD1 4.15Å; W326-A412 HydrophobicContact CB-CB 4.41Å; W326-E415 VanDerWaalsContact CE3-OE1 3.23Å
327	I	83.3	Confident	86.1	Confident	31 Å²	31	59.2 Å²	59.2	16%	0.159	31%	0.314	C	S	.	.	S	Bend	trans	-96.7	97	167.9	-53.2	-179	0	0	0	109.4	P241 L293 T294 V324 N330	P241-I327 HydrophobicContact CB-CD1 4.13Å; P241-I327 HydrophobicContact CG-CD1 4.22Å; L293-I327 HydrophobicContact CB-CD1 4.36Å; L293-I327 WeakPolarHBondContact O-CD1 3.25Å; T294-I327 HydrophobicContact CG2-CD1 4.37Å; V324-I327 HydrophobicContact CG1-CG1 4.3Å; I327-N330 HydrophobicContact CB-CB 4.08Å; I327-N330 HydrophobicContact CG2-CB 3.69Å
328	P	80.3	Confident	85.8	Confident	102 Å²	102	55.2 Å²	55.2	66%	0.662	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	140.2	175.6	28.2	-35	0	0	0	110.7	W326 N330	W326-P328 WeakPolarHBondContact O-CD 3.26Å; P328-N330 VanDerWaalsContact C-N 3.34Å; P328-N330 PolarHBondContact O-N 3.12Å
329	N	80.9	Confident	85.6	Confident	118 Å²	118	50.9 Å²	50.9	63%	0.631	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	44.7	176	-56.1	-44.1	0	0	0	114.2	V331 K332	N329-V331 PolarHBondContact O-N 2.73Å; N329-K332 PolarHBondContact O-NZ 2.87Å
330	N	85.1	Confident	85.4	Confident	6 Å²	6	48.8 Å²	48.8	3%	0.032	27%	0.268	C	S	.	.			trans	-72.1	-6.6	-179.8	65.4	-15.3	0	0	0	115.6	Y292 L293 T294 V295 Q316 I327 P328	Y292-N330 PolarHBondContact O-ND2 3Å; L293-N330 WeakPolarHBondContact O-CB 3.29Å; L293-N330 PolarHBondContact O-ND2 3.21Å; L293-N330 VanDerWaalsContact O-ND2 3.07Å; T294-N330 WeakPolarHBondContact CA-O 3.37Å; V295-N330 PolarHBondContact N-O 2.93Å; Q316-N330 PolarHBondContact NE2-OD1 3.44Å; I327-N330 HydrophobicContact CB-CB 4.08Å; I327-N330 HydrophobicContact CG2-CB 3.69Å; P328-N330 VanDerWaalsContact C-N 3.34Å; P328-N330 PolarHBondContact O-N 3.12Å
331	V	87.2	Confident	84.9	Confident	25 Å²	25	54.3 Å²	54.3	15%	0.152	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	120.8	175.9	-176.6	0	0	0	0	109.8	V295 M312 F323 N329	V295-V331 HydrophobicContact CB-CG2 4.29Å; V295-V331 HydrophobicContact CG1-CG1 4.34Å; V295-V331 CarbonylContact O-C 3.58Å; V295-V331 WeakPolarHBondContact O-CA 3.06Å; M312-V331 HydrophobicContact CE-CG1 3.29Å; F323-V331 HydrophobicContact CD1-CG2 4.1Å; F323-V331 HydrophobicContact CE1-CG2 3.69Å; F323-V331 HydrophobicContact CZ-CG2 4.42Å; N329-V331 PolarHBondContact O-N 2.73Å
332	K	87.4	Confident	84.4	Confident	75 Å²	75	54 Å²	54	33%	0.326	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	133.5	173.7	-59	-52.9	-175.9	-149.4	0	110.6	N238 V295 A296 A297 N329	N238-K332 HydrophobicContact CB-CG 4.36Å; N238-K332 WeakPolarHBondContact OD1-CE 3.49Å; V295-K332 PolarHBondContact O-N 3.46Å; A296-K332 CarbonylContact C-O 3.57Å; A296-K332 VanDerWaalsContact CA-O 3.32Å; A296-K332 WeakPolarHBondContact CA-O 3.33Å; A297-K332 PolarHBondContact N-O 2.98Å; N329-K332 PolarHBondContact O-NZ 2.87Å
333	T	86.8	Confident	84.1	Confident	32 Å²	32	51.9 Å²	51.9	20%	0.196	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	136.8	176.7	52.1	0	0	0	0	109.5	A297 V308 D309 M312	A297-T333 WeakPolarHBondContact O-CA 3.27Å; V308-T333 HydrophobicContact CG1-CG2 4.3Å; D309-T333 PolarHBondContact OD1-OG1 3.12Å; M312-T333 HydrophobicContact CB-CG2 4.11Å; M312-T333 HydrophobicContact CE-CG2 4.19Å; M312-T333 HydrophobicContact CG-CG2 3.59Å; M312-T333 HydrophobicContact SD-CG2 4.49Å
334	A	85.5	Confident	83.9	Confident	12 Å²	12	60 Å²	60	10%	0.099	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	140.6	170.6	0	0	0	0	0	108.8	L228 A297 V298 F299	L228-A334 HydrophobicContact CB-CB 4.34Å; L228-A334 HydrophobicContact CD2-CB 4.35Å; A297-A334 PolarHBondContact O-N 3.45Å; V298-A334 CarbonylContact C-O 3.53Å; V298-A334 HydrophobicContact CG2-CB 4.42Å; F299-A334 PolarHBondContact N-O 3.06Å
335	V	86.2	Confident	83.8	Confident	16 Å²	16	61.1 Å²	61.1	10%	0.097	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	127.1	177.6	-176.2	0	0	0	0	108.8	F299 M303 M305 V308	F299-V335 HydrophobicContact CB-CG2 4.21Å; F299-V335 CarbonylContact O-C 3.53Å; F299-V335 WeakPolarHBondContact O-CA 3.41Å; M303-V335 HydrophobicContact CG-CG1 3.96Å; M305-V335 HydrophobicContact CE-CB 4.02Å; M305-V335 HydrophobicContact CE-CG1 4.35Å; M305-V335 HydrophobicContact CG-CG2 4.24Å; V308-V335 HydrophobicContact CG1-CG2 4.5Å; V308-V335 HydrophobicContact CG2-CG2 4.44Å
336	C	85.3	Confident	84.1	Confident	6 Å²	6	54 Å²	54	4%	0.041	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131.5	173.2	-178	0	0	0	0	109.5	T220 F299 R300 G301 I338	T220-C336 HydrophobicContact CG2-CB 3.63Å; F299-C336 PolarHBondContact O-N 2.77Å; R300-C336 CarbonylContact C-O 3.57Å; R300-C336 WeakPolarHBondContact CA-O 3.31Å; R300-C336 HydrophobicContact CG-CB 4.44Å; G301-C336 PolarHBondContact N-O 2.93Å; C336-I338 PolarHBondContact O-N 2.85Å
337	D	83.2	Confident	84.5	Confident	87 Å²	87	52.1 Å²	52.1	47%	0.465	28%	0.28	S	S	.	.	S	Bend	trans	-71.9	-18.5	-177.3	-69.6	-33.6	0	0	0	113.4	P339	D337-P339 VanDerWaalsContact O-CD 3.27Å; D337-P339 WeakPolarHBondContact O-CD 3.47Å
338	I	83.4	Confident	84.9	Confident	27 Å²	27	50.6 Å²	50.6	14%	0.138	27%	0.273	C	S	.	.			trans	-90.3	108.7	-177.5	-60.7	173.6	0	0	0	109.8	L24 F224 R300 C336	L24-I338 HydrophobicContact CB-CD1 3.72Å; L24-I338 HydrophobicContact CD1-CD1 4.31Å; F224-I338 HydrophobicContact CB-CD1 4.39Å; F224-I338 HydrophobicContact CD1-CD1 3.33Å; F224-I338 HydrophobicContact CE1-CD1 3.61Å; F224-I338 HydrophobicContact CE1-CG2 4.34Å; F224-I338 HydrophobicContact CE2-CG2 4.27Å; F224-I338 HydrophobicContact CG-CD1 3.87Å; F224-I338 HydrophobicContact CZ-CD1 4.35Å; F224-I338 HydrophobicContact CZ-CG2 4.07Å; R300-I338 PolarHBondContact NE-O 3.02Å; R300-I338 VanDerWaalsContact NE-O 3.16Å; R300-I338 PolarHBondContact NH2-O 3.37Å; C336-I338 PolarHBondContact O-N 2.85Å
339	P	85.4	Confident	85.5	Confident	49 Å²	49	45.8 Å²	45.8	32%	0.318	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-74.2	157.1	176.5	34	-35.6	0	0	0	111.2	D337 L343 K344	D337-P339 VanDerWaalsContact O-CD 3.27Å; D337-P339 WeakPolarHBondContact O-CD 3.47Å; P339-L343 WeakPolarHBondContact CB-O 3.21Å; P339-K344 WeakPolarHBondContact CB-O 3.45Å
340	P	83.8	Confident	86.1	Confident	14 Å²	14	40.2 Å²	40.2	9%	0.091	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-67.8	155.1	170.2	27.4	-30.3	0	0	0	110.9	G342 L343 A346	P340-G342 PolarHBondContact O-N 2.94Å; P340-L343 HydrophobicContact CG-CB 4.2Å; P340-L343 HydrophobicContact CG-CD1 4.2Å; P340-L343 PolarHBondContact O-N 3.38Å; P340-L343 VanDerWaalsContact O-O 3.06Å; P340-A346 HydrophobicContact CG-CB 3.54Å
341	R	75.3	Confident	86.4	Confident	183 Å²	183	39.9 Å²	39.9	69%	0.691	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	136.3	-176.2	-164.4	-179.5	-172.9	-171.8	14.5	111.8	D8 L343	D8-R341 IonicContact OD1-CZ 3.38Å; D8-R341 IonicContact OD1-NE 3.47Å; D8-R341 IonicContact OD1-NH1 2.65Å; D8-R341 PolarHBondContact OD1-NH1 2.85Å; D8-R341 IonicContact OD1-NH2 3.09Å; D8-R341 WeakPolarHBondContact OD2-CD 3.26Å; D8-R341 IonicContact OD2-CZ 3.2Å; D8-R341 IonicContact OD2-NE 2.65Å; D8-R341 PolarHBondContact OD2-NE 3.39Å; D8-R341 IonicContact OD2-NH1 3.77Å; D8-R341 PolarHBondContact OD2-NH1 3.43Å; R341-L343 VanDerWaalsContact C-N 3.26Å; R341-L343 PolarHBondContact O-N 3.41Å
342	G	77.8	Confident	86.7	Confident	65 Å²	65	38.7 Å²	38.7	67%	0.67	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.5	-4.2	178.8	0	0	0	0	0	114.8	P340	P340-G342 PolarHBondContact O-N 2.94Å
343	L	82.9	Confident	87	Confident	36 Å²	36	35.1 Å²	35.1	19%	0.188	19%	0.187	C	C	.	.			trans	-124.9	148.4	176.2	-63.8	171.1	0	0	0	110	F252 P254 P339 P340 R341 A346	F252-L343 HydrophobicContact CE1-CD1 4.36Å; F252-L343 HydrophobicContact CZ-CD1 4.17Å; P254-L343 HydrophobicContact CG-CD1 4.27Å; P254-L343 HydrophobicContact CG-CD2 3.99Å; P339-L343 WeakPolarHBondContact CB-O 3.21Å; P340-L343 HydrophobicContact CG-CB 4.2Å; P340-L343 HydrophobicContact CG-CD1 4.2Å; P340-L343 PolarHBondContact O-N 3.38Å; P340-L343 VanDerWaalsContact O-O 3.06Å; R341-L343 VanDerWaalsContact C-N 3.26Å; R341-L343 PolarHBondContact O-N 3.41Å; L343-A346 HydrophobicContact CD1-CB 4.41Å
344	K	85.3	Confident	87.4	Confident	178 Å²	178	33.6 Å²	33.6	77%	0.774	18%	0.178	S	C	*	.	S	Bend	trans	-87.9	-31.4	173.6	-69.9	-175.3	178.4	179.9	0	112.3	P339	P339-K344 WeakPolarHBondContact CB-O 3.45Å
345	M	88.3	Confident	87.7	Confident	31 Å²	31	33.1 Å²	33.1	15%	0.153	17%	0.174	C	C	.	.			trans	-143.9	143.5	178.8	-64.7	-176	-65.3	0	0	109.4	L266 L271 R300 M303	L266-M345 HydrophobicContact CB-CE 4.13Å; L266-M345 WeakPolarHBondContact O-CE 3.31Å; L271-M345 HydrophobicContact CD1-CB 3.74Å; R300-M345 WeakPolarHBondContact O-CA 3.4Å; M303-M345 HydrophobicContact CB-SD 4.47Å; M303-M345 HydrophobicContact CE-CG 4.4Å
346	A	90.3	Very high	88	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	159.7	173.3	0	0	0	0	0	109.8	F252 A253 R300 P340 L343	F252-A346 HydrophobicContact CE2-CB 4.14Å; F252-A346 HydrophobicContact CZ-CB 3.91Å; A253-A346 CarbonylContact O-C 3.56Å; A253-A346 VanDerWaalsContact O-CA 3.29Å; A253-A346 WeakPolarHBondContact O-CA 3.39Å; R300-A346 PolarHBondContact N-O 3.4Å; R300-A346 PolarHBondContact O-N 3.33Å; P340-A346 HydrophobicContact CG-CB 3.54Å; L343-A346 HydrophobicContact CD1-CB 4.41Å
347	V	91.4	Very high	88.3	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	131.1	174.5	-172.1	0	0	0	0	108.2	A253 L271 V275 A297 V298 F299	A253-V347 PolarHBondContact N-O 3.49Å; A253-V347 PolarHBondContact O-N 2.8Å; L271-V347 HydrophobicContact CB-CG2 3.69Å; L271-V347 HydrophobicContact CD1-CG2 4Å; L271-V347 HydrophobicContact CD2-CG2 4.39Å; L271-V347 HydrophobicContact CG-CG2 4.23Å; V275-V347 HydrophobicContact CG2-CB 3.7Å; V275-V347 HydrophobicContact CG2-CG1 3.66Å; A297-V347 HydrophobicContact CB-CG1 4.38Å; V298-V347 CarbonylContact O-C 3.52Å; V298-V347 WeakPolarHBondContact O-CA 3.28Å; F299-V347 HydrophobicContact CD1-CB 4.35Å; F299-V347 HydrophobicContact CD1-CG1 4.23Å; F299-V347 HydrophobicContact CD1-CG2 3.23Å; F299-V347 HydrophobicContact CD2-CG1 4.14Å; F299-V347 HydrophobicContact CE1-CB 4.39Å; F299-V347 HydrophobicContact CE1-CG1 4.12Å; F299-V347 HydrophobicContact CE1-CG2 3.35Å; F299-V347 HydrophobicContact CE2-CG1 4.03Å; F299-V347 HydrophobicContact CG-CG1 4.22Å; F299-V347 HydrophobicContact CG-CG2 3.89Å; F299-V347 HydrophobicContact CZ-CG1 4Å; F299-V347 HydrophobicContact CZ-CG2 4.08Å
348	T	91.8	Very high	88.7	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.4	170.4	-52	0	0	0	0	108.3	G217 V218 A297 V298	G217-T348 WeakPolarHBondContact CA-OG1 3.37Å; V218-T348 HydrophobicContact CG2-CG2 3.98Å; A297-T348 CarbonylContact C-O 3.5Å; A297-T348 WeakPolarHBondContact CA-O 3.38Å; V298-T348 PolarHBondContact N-O 3.49Å; V298-T348 PolarHBondContact O-N 3.39Å
349	F	92.6	Very high	89	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	137.3	-178.9	179.9	-99.2	0	0	0	109.4	P250 G251 V275 F276 M281 Y292 V295	P250-F349 CarbonylContact C-O 3.5Å; P250-F349 VanDerWaalsContact CA-O 3.31Å; P250-F349 WeakPolarHBondContact CA-O 3.45Å; G251-F349 PolarHBondContact N-O 2.88Å; G251-F349 PolarHBondContact O-N 3.09Å; V275-F349 HydrophobicContact CG1-CB 3.46Å; V275-F349 VanDerWaalsContact CG1-CB 3.46Å; V275-F349 HydrophobicContact CG1-CD2 3.22Å; V275-F349 HydrophobicContact CG1-CE2 4.08Å; V275-F349 HydrophobicContact CG1-CG 3.54Å; F276-F349 HydrophobicContact CD1-CE2 4.12Å; F276-F349 HydrophobicContact CD1-CZ 4.42Å; F276-F349 AromaticContact CE1-CE2 3.66Å; F276-F349 HydrophobicContact CE1-CE2 3.66Å; F276-F349 HydrophobicContact CE1-CZ 4.15Å; F276-F349 AromaticContact CZ-CE2 3.92Å; F276-F349 HydrophobicContact CZ-CE2 3.92Å; M281-F349 HydrophobicContact CE-CD1 3.8Å; M281-F349 HydrophobicContact CE-CE1 3.48Å; M281-F349 VanDerWaalsContact CE-CE1 3.48Å; M281-F349 HydrophobicContact CE-CZ 4.1Å; M281-F349 HydrophobicContact SD-CD1 3.82Å; M281-F349 HydrophobicContact SD-CE1 3.86Å; Y292-F349 HydrophobicContact CD1-CZ 4.34Å; Y292-F349 AromaticContact CE1-CE1 4Å; Y292-F349 HydrophobicContact CE1-CE1 4Å; Y292-F349 AromaticContact CE1-CZ 3.56Å; Y292-F349 HydrophobicContact CE1-CZ 3.56Å; Y292-F349 AromaticContact CZ-CZ 3.81Å; V295-F349 HydrophobicContact CB-CE2 4.4Å; V295-F349 HydrophobicContact CG1-CD2 3.98Å; V295-F349 HydrophobicContact CG1-CE2 3.31Å; V295-F349 HydrophobicContact CG1-CZ 4.01Å; V295-F349 HydrophobicContact CG2-CE2 4.24Å; V295-F349 HydrophobicContact CG2-CZ 4.16Å
350	I	92.5	Very high	89.3	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	106	173.4	-50	168.9	0	0	0	104.7	Y182 V218 L235 M239 F248 V295 A296	Y182-I350 HydrophobicContact CD1-CG2 4.41Å; Y182-I350 HydrophobicContact CE1-CD1 4.08Å; Y182-I350 HydrophobicContact CE1-CG1 4.23Å; Y182-I350 HydrophobicContact CE1-CG2 3.76Å; V218-I350 HydrophobicContact CB-CD1 4.37Å; V218-I350 HydrophobicContact CG1-CD1 4.08Å; V218-I350 HydrophobicContact CG2-CD1 3.92Å; V218-I350 HydrophobicContact CG2-CG1 4.04Å; L235-I350 HydrophobicContact CD2-CD1 4.44Å; M239-I350 HydrophobicContact CE-CB 4.29Å; M239-I350 HydrophobicContact CE-CG2 3.9Å; M239-I350 VanDerWaalsContact CE-O 3.25Å; M239-I350 WeakPolarHBondContact CE-O 3.4Å; F248-I350 HydrophobicContact CB-CG2 3.73Å; F248-I350 HydrophobicContact CD1-CG2 4.38Å; F248-I350 HydrophobicContact CD2-CG2 3.79Å; F248-I350 HydrophobicContact CE2-CG2 4.49Å; F248-I350 HydrophobicContact CG-CG2 3.71Å; V295-I350 WeakPolarHBondContact CA-O 3.41Å; A296-I350 HydrophobicContact CB-CB 4.27Å; A296-I350 HydrophobicContact CB-CD1 4.5Å; A296-I350 PolarHBondContact N-O 3.15Å; A296-I350 PolarHBondContact O-N 2.98Å
351	G	92.4	Very high	89.7	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.5	177.6	0	0	0	0	0	110.5	F248 M249	F248-G351 WeakPolarHBondContact CA-O 3.46Å; M249-G351 PolarHBondContact N-O 2.99Å; M249-G351 PolarHBondContact O-N 3.39Å
352	N	93.9	Very high	90.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	104.7	159.8	-166.6	-13.8	0	0	0	107.4	M239 L245 F248 L293 T294	M239-N352 HydrophobicContact CE-CB 4.39Å; M239-N352 PolarHBondContact O-ND2 3.45Å; L245-N352 PolarHBondContact O-ND2 3.25Å; F248-N352 HydrophobicContact CD1-CB 3.89Å; F248-N352 HydrophobicContact CE1-CB 3.98Å; L293-N352 HydrophobicContact CB-CB 4.45Å; L293-N352 PolarHBondContact N-O 3Å; T294-N352 PolarHBondContact N-O 2.6Å; T294-N352 PolarHBondContact O-N 2.82Å; T294-N352 WeakPolarHBondContact OG1-CB 3.48Å
353	S	93.4	Very high	91	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	141.3	-175.6	-177.1	0	0	0	0	110.9	R291 A355 I356	R291-S353 VanDerWaalsContact O-CA 3.32Å; R291-S353 WeakPolarHBondContact O-CA 3.49Å; R291-S353 PolarHBondContact O-OG 3.32Å; R291-S353 VanDerWaalsContact O-OG 3.05Å; S353-A355 PolarHBondContact O-N 3.44Å; S353-A355 VanDerWaalsContact O-N 3.14Å; S353-A355 PolarHBondContact OG-N 3.09Å; S353-I356 WeakPolarHBondContact O-CB 3.45Å; S353-I356 VanDerWaalsContact O-CG2 3.26Å; S353-I356 WeakPolarHBondContact O-CG2 3.44Å; S353-I356 PolarHBondContact O-N 3.07Å; S353-I356 VanDerWaalsContact O-N 3.15Å
354	T	93.7	Very high	91.4	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-63	-17.8	173.1	66.7	0	0	0	0	112.7	G290 R291 L293 I356 Q357 Y404 Q408	G290-T354 VanDerWaalsContact CA-OG1 3.31Å; G290-T354 WeakPolarHBondContact CA-OG1 3.36Å; R291-T354 PolarHBondContact N-OG1 3.28Å; R291-T354 PolarHBondContact O-N 3.21Å; R291-T354 PolarHBondContact O-OG1 3.43Å; L293-T354 HydrophobicContact CD2-CG2 4.49Å; L293-T354 HydrophobicContact CG-CG2 4.36Å; T354-I356 PolarHBondContact O-N 3.49Å; T354-Q357 WeakPolarHBondContact O-CB 3.45Å; T354-Q357 WeakPolarHBondContact O-CG 3.34Å; T354-Q357 PolarHBondContact O-N 3.29Å; T354-Y404 HydrophobicContact CG2-CD1 4.42Å; T354-Q408 HydrophobicContact CG2-CB 3.98Å; T354-Q408 PolarHBondContact OG1-OE1 3.27Å
355	A	93.2	Very high	91.7	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.008	9%	0.087	C	C	.	.	G	3₁₀ helix	trans	-62.5	-19.3	175	0	0	0	0	0	113.2	M249 C285 D286 S353 Q357 E358	M249-A355 HydrophobicContact SD-CB 4.43Å; C285-A355 HydrophobicContact CB-CB 4.37Å; C285-A355 WeakPolarHBondContact CB-O 3.01Å; D286-A355 WeakPolarHBondContact O-CB 3.36Å; S353-A355 PolarHBondContact O-N 3.44Å; S353-A355 VanDerWaalsContact O-N 3.14Å; S353-A355 PolarHBondContact OG-N 3.09Å; A355-Q357 PolarHBondContact O-N 3.03Å; A355-E358 PolarHBondContact O-N 3.37Å
356	I	92.9	Very high	91.7	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.095	C	C	.	.	G	3₁₀ helix	trans	-58.7	-20.9	175.6	-161.5	72.1	0	0	0	112.2	C183 F247 M249 A283 S353 T354 E358 L359 F360 Y404	C183-I356 HydrophobicContact CB-CD1 4.02Å; F247-I356 HydrophobicContact CB-CG1 4.32Å; M249-I356 HydrophobicContact CG-CB 4.38Å; M249-I356 HydrophobicContact CG-CD1 3.53Å; M249-I356 HydrophobicContact CG-CG1 4.47Å; M249-I356 HydrophobicContact SD-CB 4.46Å; M249-I356 HydrophobicContact SD-CD1 4.36Å; A283-I356 HydrophobicContact CB-CD1 4.15Å; S353-I356 WeakPolarHBondContact O-CB 3.45Å; S353-I356 VanDerWaalsContact O-CG2 3.26Å; S353-I356 WeakPolarHBondContact O-CG2 3.44Å; S353-I356 PolarHBondContact O-N 3.07Å; S353-I356 VanDerWaalsContact O-N 3.15Å; T354-I356 PolarHBondContact O-N 3.49Å; I356-E358 PolarHBondContact O-N 3.29Å; I356-E358 VanDerWaalsContact O-N 3.12Å; I356-L359 HydrophobicContact CD1-CB 4.38Å; I356-L359 HydrophobicContact CD1-CD2 4.23Å; I356-L359 WeakPolarHBondContact O-CB 3.16Å; I356-L359 PolarHBondContact O-N 3.4Å; I356-F360 HydrophobicContact CG1-CD2 4.47Å; I356-F360 HydrophobicContact CG1-CE2 3.9Å; I356-F360 HydrophobicContact CG2-CD2 4.45Å; I356-F360 HydrophobicContact CG2-CE2 4.05Å; I356-F360 WeakPolarHBondContact O-CD2 3.14Å; I356-F360 PolarHBondContact O-N 3.29Å; I356-Y404 HydrophobicContact CG2-CD1 4.04Å; I356-Y404 HydrophobicContact CG2-CD2 4.03Å; I356-Y404 HydrophobicContact CG2-CE1 3.58Å; I356-Y404 HydrophobicContact CG2-CE2 3.6Å; I356-Y404 HydrophobicContact CG2-CG 4.24Å
357	Q	91.6	Very high	91.8	Very high	7 Å²	7	20.6 Å²	20.6	3%	0.033	10%	0.095	C	C	.	.	H	α-helix	trans	-55.9	-27.9	173.6	74.3	173.9	-61.7	0	0	113.3	T354 A355 L359 F360 K361 V401 Q405	T354-Q357 WeakPolarHBondContact O-CB 3.45Å; T354-Q357 WeakPolarHBondContact O-CG 3.34Å; T354-Q357 PolarHBondContact O-N 3.29Å; A355-Q357 PolarHBondContact O-N 3.03Å; Q357-L359 VanDerWaalsContact C-N 3.29Å; Q357-L359 PolarHBondContact O-N 3.49Å; Q357-F360 PolarHBondContact O-N 3Å; Q357-K361 WeakPolarHBondContact O-CB 3.39Å; Q357-K361 VanDerWaalsContact O-CG 3.28Å; Q357-K361 WeakPolarHBondContact O-CG 3.12Å; Q357-K361 PolarHBondContact O-N 2.53Å; Q357-V401 HydrophobicContact CB-CG1 4.39Å; Q357-Q405 VanDerWaalsContact OE1-OE1 3.09Å
358	E	90.8	Very high	91.9	Very high	66 Å²	66	21.8 Å²	21.8	31%	0.308	10%	0.102	S	C	.	.	H	α-helix	trans	-62.5	-38.6	176.1	-66.6	-172	151.3	0	0	111.7	C285 D286 H289 A355 I356 R362	C285-E358 WeakPolarHBondContact CA-OE2 3.39Å; C285-E358 HydrophobicContact CB-CB 4.28Å; D286-E358 PolarHBondContact N-OE2 3.49Å; D286-E358 VanDerWaalsContact N-OE2 3.13Å; H289-E358 IonicContact CE1-OE1 2.77Å; H289-E358 IonicContact CG-OE1 3.91Å; H289-E358 IonicContact ND1-OE1 3.53Å; H289-E358 PolarHBondContact ND1-OE1 3.38Å; A355-E358 PolarHBondContact O-N 3.37Å; I356-E358 PolarHBondContact O-N 3.29Å; I356-E358 VanDerWaalsContact O-N 3.12Å; E358-R362 WeakPolarHBondContact O-CB 3.42Å; E358-R362 PolarHBondContact O-N 2.9Å
359	L	90.5	Very high	91.9	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-61.1	-48.8	175.9	-172.4	97.1	0	0	0	110.4	V152 C183 D185 I356 Q357 R362 I363	V152-L359 HydrophobicContact CB-CD1 4.45Å; V152-L359 HydrophobicContact CG1-CD1 4.1Å; V152-L359 HydrophobicContact CG1-CD2 4.24Å; V152-L359 HydrophobicContact CG1-CG 4.23Å; V152-L359 HydrophobicContact CG2-CD1 4.39Å; V152-L359 HydrophobicContact CG2-CD2 3.85Å; C183-L359 HydrophobicContact CB-CD2 4.33Å; D185-L359 HydrophobicContact CB-CD1 4.01Å; D185-L359 WeakPolarHBondContact OD2-CD1 3.4Å; I356-L359 HydrophobicContact CD1-CB 4.38Å; I356-L359 HydrophobicContact CD1-CD2 4.23Å; I356-L359 WeakPolarHBondContact O-CB 3.16Å; I356-L359 PolarHBondContact O-N 3.4Å; Q357-L359 VanDerWaalsContact C-N 3.29Å; Q357-L359 PolarHBondContact O-N 3.49Å; L359-R362 VanDerWaalsContact CD1-NH2 3.3Å; L359-R362 PolarHBondContact O-N 2.77Å; L359-I363 WeakPolarHBondContact O-CG1 3.42Å; L359-I363 PolarHBondContact O-N 3.35Å
360	F	91.6	Very high	91.8	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.009	13%	0.13	C	C	.	.	H	α-helix	trans	-69.4	-40.5	-178.8	-65	-57.9	0	0	0	112.2	V171 F247 I356 Q357 R362 I363 S364 M397 L400 V401 Y404	V171-F360 HydrophobicContact CG1-CD1 4.25Å; V171-F360 HydrophobicContact CG1-CE1 3.74Å; V171-F360 HydrophobicContact CG2-CE1 4.04Å; F247-F360 HydrophobicContact CB-CE2 4.32Å; F247-F360 HydrophobicContact CB-CZ 4.15Å; F247-F360 AromaticContact CD1-CZ 3.72Å; F247-F360 HydrophobicContact CD1-CZ 3.72Å; F247-F360 HydrophobicContact CD2-CE2 4.26Å; F247-F360 AromaticContact CD2-CZ 3.91Å; F247-F360 HydrophobicContact CD2-CZ 3.91Å; F247-F360 HydrophobicContact CE1-CZ 4.03Å; F247-F360 HydrophobicContact CE2-CZ 4.22Å; F247-F360 HydrophobicContact CG-CE2 4.16Å; F247-F360 AromaticContact CG-CZ 3.64Å; F247-F360 HydrophobicContact CG-CZ 3.64Å; F247-F360 HydrophobicContact CZ-CZ 4.27Å; I356-F360 HydrophobicContact CG1-CD2 4.47Å; I356-F360 HydrophobicContact CG1-CE2 3.9Å; I356-F360 HydrophobicContact CG2-CD2 4.45Å; I356-F360 HydrophobicContact CG2-CE2 4.05Å; I356-F360 WeakPolarHBondContact O-CD2 3.14Å; I356-F360 PolarHBondContact O-N 3.29Å; Q357-F360 PolarHBondContact O-N 3Å; F360-R362 VanDerWaalsContact C-N 3.31Å; F360-R362 PolarHBondContact O-N 2.69Å; F360-I363 PolarHBondContact O-N 2.86Å; F360-S364 VanDerWaalsContact O-CB 3.3Å; F360-S364 WeakPolarHBondContact O-CB 3.29Å; F360-S364 PolarHBondContact O-N 3.21Å; F360-M397 HydrophobicContact CB-SD 3.89Å; F360-M397 HydrophobicContact CD1-CE 4.38Å; F360-M397 HydrophobicContact CD1-SD 3.41Å; F360-M397 WeakPolarHBondContact CD1-SD 3.47Å; F360-M397 HydrophobicContact CE1-SD 4.22Å; F360-M397 HydrophobicContact CG-SD 3.92Å; F360-L400 HydrophobicContact CD2-CD2 4.17Å; F360-L400 HydrophobicContact CE1-CD2 4.29Å; F360-L400 HydrophobicContact CE2-CD2 3.88Å; F360-L400 HydrophobicContact CZ-CD2 3.94Å; F360-V401 HydrophobicContact CB-CG2 3.57Å; F360-Y404 HydrophobicContact CD2-CE2 4.39Å; F360-Y404 HydrophobicContact CE2-CE2 4.01Å
361	K	91.7	Very high	91.7	Very high	83 Å²	83	27.2 Å²	27.2	36%	0.361	14%	0.136	S	C	.	.	H	α-helix	trans	-57.4	-43.8	173	-76.3	177.3	-174	174.8	0	111.4	Q357 I363 S364 E365 V401	Q357-K361 WeakPolarHBondContact O-CB 3.39Å; Q357-K361 VanDerWaalsContact O-CG 3.28Å; Q357-K361 WeakPolarHBondContact O-CG 3.12Å; Q357-K361 PolarHBondContact O-N 2.53Å; K361-I363 PolarHBondContact O-N 3.29Å; K361-S364 PolarHBondContact O-N 3.33Å; K361-E365 WeakPolarHBondContact O-CB 3.31Å; K361-E365 WeakPolarHBondContact O-CG 3.34Å; K361-E365 PolarHBondContact O-N 3.01Å; K361-V401 HydrophobicContact CD-CG1 4.26Å; K361-V401 HydrophobicContact CG-CG1 3.86Å; K361-V401 HydrophobicContact CG-CG2 4.34Å
362	R	90.3	Very high	91.7	Very high	45 Å²	45	37.1 Å²	37.1	17%	0.17	17%	0.173	C	C	.	.	H	α-helix	trans	-61.4	-43.5	177.6	-174.1	-175.2	65.1	-155.6	-12	112.4	D185 E187 E358 L359 F360 Q366	D185-R362 IonicContact OD1-NH2 2.92Å; D185-R362 IonicContact OD2-CZ 3.58Å; D185-R362 VanDerWaalsContact OD2-CZ 3.29Å; D185-R362 IonicContact OD2-NH1 3.76Å; D185-R362 PolarHBondContact OD2-NH1 3.35Å; D185-R362 IonicContact OD2-NH2 3.4Å; D185-R362 PolarHBondContact OD2-NH2 2.83Å; E187-R362 IonicContact OE2-CZ 3.97Å; E187-R362 IonicContact OE2-NE 2.69Å; E187-R362 IonicContact OE2-NH1 3.57Å; E187-R362 PolarHBondContact OE2-NH1 2.96Å; E358-R362 WeakPolarHBondContact O-CB 3.42Å; E358-R362 PolarHBondContact O-N 2.9Å; L359-R362 VanDerWaalsContact CD1-NH2 3.3Å; L359-R362 PolarHBondContact O-N 2.77Å; F360-R362 VanDerWaalsContact C-N 3.31Å; F360-R362 PolarHBondContact O-N 2.69Å; R362-Q366 WeakPolarHBondContact O-CG 3.28Å; R362-Q366 PolarHBondContact O-N 3.39Å
363	I	89.8	Confident	91.6	Very high	5 Å²	5	47 Å²	47	3%	0.026	21%	0.21	C	C	.	.	H	α-helix	trans	-67.5	-45.2	177.6	-62.3	166.8	0	0	0	110	V152 A167 L359 F360 K361 E365 Q366 F367	V152-I363 HydrophobicContact CG1-CD1 3.62Å; V152-I363 HydrophobicContact CG1-CG1 4.38Å; A167-I363 HydrophobicContact CB-CG2 3.98Å; L359-I363 WeakPolarHBondContact O-CG1 3.42Å; L359-I363 PolarHBondContact O-N 3.35Å; F360-I363 PolarHBondContact O-N 2.86Å; K361-I363 PolarHBondContact O-N 3.29Å; I363-E365 PolarHBondContact O-N 3.06Å; I363-Q366 PolarHBondContact O-N 2.89Å; I363-F367 WeakPolarHBondContact O-CB 3.44Å; I363-F367 PolarHBondContact O-N 3.41Å
364	S	91.3	Very high	91.5	Very high	10 Å²	10	52.3 Å²	52.3	7%	0.07	23%	0.234	C	C	.	.	H	α-helix	trans	-59.2	-47.1	178.7	-175.9	0	0	0	0	111.5	F360 K361 Q366 F367 T368 N398	F360-S364 VanDerWaalsContact O-CB 3.3Å; F360-S364 WeakPolarHBondContact O-CB 3.29Å; F360-S364 PolarHBondContact O-N 3.21Å; K361-S364 PolarHBondContact O-N 3.33Å; S364-Q366 VanDerWaalsContact C-N 3.34Å; S364-Q366 PolarHBondContact O-N 3.37Å; S364-F367 WeakPolarHBondContact O-CB 3.48Å; S364-F367 PolarHBondContact O-N 3.25Å; S364-T368 WeakPolarHBondContact O-CB 3.29Å; S364-T368 PolarHBondContact O-N 3.5Å; S364-T368 PolarHBondContact O-OG1 2.99Å; S364-N398 PolarHBondContact OG-OD1 3.27Å
365	E	91.4	Very high	91.2	Very high	143 Å²	143	53.7 Å²	53.7	67%	0.668	25%	0.245	S	C	*	.	H	α-helix	trans	-59	-42.2	177.3	-76.9	-179.8	-174	0	0	113	K361 I363 A369	K361-E365 WeakPolarHBondContact O-CB 3.31Å; K361-E365 WeakPolarHBondContact O-CG 3.34Å; K361-E365 PolarHBondContact O-N 3.01Å; I363-E365 PolarHBondContact O-N 3.06Å; E365-A369 WeakPolarHBondContact O-CB 3.46Å; E365-A369 PolarHBondContact O-N 3.3Å
366	Q	89.5	Confident	91.1	Very high	68 Å²	68	57.3 Å²	57.3	32%	0.318	26%	0.261	S	S	.	.	H	α-helix	trans	-68.4	-41.4	177.2	-69.1	176.9	7.1	0	0	111.6	P164 R362 I363 S364 A369 M370	P164-Q366 HydrophobicContact CB-CB 3.94Å; P164-Q366 HydrophobicContact CG-CB 3.73Å; R362-Q366 WeakPolarHBondContact O-CG 3.28Å; R362-Q366 PolarHBondContact O-N 3.39Å; I363-Q366 PolarHBondContact O-N 2.89Å; S364-Q366 VanDerWaalsContact C-N 3.34Å; S364-Q366 PolarHBondContact O-N 3.37Å; Q366-A369 PolarHBondContact O-N 3.08Å; Q366-M370 WeakPolarHBondContact O-CG 3.47Å; Q366-M370 PolarHBondContact O-N 3.34Å
367	F	91.9	Very high	91	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.1	-54.5	174.3	176.8	-81.9	0	0	0	110.8	P164 Y165 T168 I363 S364 A369 M370 F371 F390 E394	P164-F367 HydrophobicContact CB-CB 4.33Å; Y165-F367 AromaticContact CD1-CD2 3.57Å; Y165-F367 HydrophobicContact CD1-CD2 3.57Å; Y165-F367 AromaticContact CD1-CE2 3.42Å; Y165-F367 HydrophobicContact CD1-CE2 3.42Å; Y165-F367 VanDerWaalsContact CD1-CE2 3.42Å; Y165-F367 HydrophobicContact CD1-CZ 4.19Å; Y165-F367 HydrophobicContact CE1-CD2 4.13Å; Y165-F367 AromaticContact CE1-CE2 3.96Å; Y165-F367 HydrophobicContact CE1-CE2 3.96Å; Y165-F367 HydrophobicContact CE1-CZ 4.33Å; Y165-F367 HydrophobicContact CG-CD2 4.5Å; T168-F367 VanDerWaalsContact CB-CD2 3.5Å; T168-F367 HydrophobicContact CG2-CD2 3.84Å; T168-F367 HydrophobicContact CG2-CE2 3.78Å; T168-F367 HydrophobicContact CG2-CG 4.3Å; T168-F367 HydrophobicContact CG2-CZ 4.28Å; T168-F367 VanDerWaalsContact OG1-CD2 3.28Å; T168-F367 WeakPolarHBondContact OG1-CD2 3.33Å; I363-F367 WeakPolarHBondContact O-CB 3.44Å; I363-F367 PolarHBondContact O-N 3.41Å; S364-F367 WeakPolarHBondContact O-CB 3.48Å; S364-F367 PolarHBondContact O-N 3.25Å; F367-A369 VanDerWaalsContact C-N 3.28Å; F367-A369 PolarHBondContact O-N 3.12Å; F367-M370 WeakPolarHBondContact O-CB 3.38Å; F367-M370 PolarHBondContact O-N 3Å; F367-F371 HydrophobicContact CD1-CB 4.23Å; F367-F371 HydrophobicContact CE1-CB 3.93Å; F367-F371 HydrophobicContact CE1-CD1 4.18Å; F367-F371 HydrophobicContact CE1-CG 4.03Å; F367-F371 HydrophobicContact CZ-CB 4.49Å; F367-F371 HydrophobicContact CZ-CG 4.4Å; F367-F371 WeakPolarHBondContact O-CB 3.38Å; F367-F371 PolarHBondContact O-N 3.21Å; F367-F390 AromaticContact CE2-CD1 3.93Å; F367-F390 HydrophobicContact CE2-CD1 3.93Å; F367-F390 HydrophobicContact CZ-CB 4.1Å; F367-F390 AromaticContact CZ-CD1 3.91Å; F367-F390 HydrophobicContact CZ-CD1 3.91Å; F367-F390 WeakPolarHBondContact CZ-O 3.31Å; F367-E394 HydrophobicContact CD1-CB 4.22Å; F367-E394 HydrophobicContact CD1-CG 4.04Å; F367-E394 HydrophobicContact CE1-CB 3.63Å; F367-E394 HydrophobicContact CE1-CG 3.87Å; F367-E394 HydrophobicContact CZ-CB 4.23Å
368	T	92.9	Very high	90.9	Very high	25 Å²	25	63 Å²	63	15%	0.153	29%	0.287	C	S	.	.	H	α-helix	trans	-59.7	-39.8	-179	-55.5	0	0	0	0	111.2	S364 M370 F371 R372 E394	S364-T368 WeakPolarHBondContact O-CB 3.29Å; S364-T368 PolarHBondContact O-N 3.5Å; S364-T368 PolarHBondContact O-OG1 2.99Å; T368-M370 VanDerWaalsContact C-N 3.3Å; T368-M370 PolarHBondContact O-N 3.04Å; T368-F371 PolarHBondContact O-N 3.39Å; T368-R372 HydrophobicContact CG2-CG 4.16Å; T368-R372 VanDerWaalsContact CG2-NE 3.32Å; T368-R372 VanDerWaalsContact O-CB 3.31Å; T368-R372 WeakPolarHBondContact O-CB 3.3Å; T368-R372 VanDerWaalsContact O-CG 3.23Å; T368-R372 WeakPolarHBondContact O-CG 3.35Å; T368-R372 PolarHBondContact O-N 3.4Å; T368-E394 WeakPolarHBondContact CB-OE1 3.49Å; T368-E394 PolarHBondContact OG1-OE1 3.18Å
369	A	91.3	Very high	90.9	Very high	52 Å²	52	65.2 Å²	65.2	43%	0.43	29%	0.293	S	S	.	.	H	α-helix	trans	-62	-36.8	177.6	0	0	0	0	0	112.8	E365 Q366 F367	E365-A369 WeakPolarHBondContact O-CB 3.46Å; E365-A369 PolarHBondContact O-N 3.3Å; Q366-A369 PolarHBondContact O-N 3.08Å; F367-A369 VanDerWaalsContact C-N 3.28Å; F367-A369 PolarHBondContact O-N 3.12Å
370	M	90.3	Very high	91.1	Very high	32 Å²	32	65.2 Å²	65.2	16%	0.158	29%	0.293	C	S	.	.	H	α-helix	trans	-77.2	-46.7	176.5	-71	-107.5	-69.5	0	0	112	V161 Y165 Q366 F367 T368 R372 R373 K374 A375	V161-M370 WeakPolarHBondContact O-CE 3.46Å; Y165-M370 HydrophobicContact CD2-CE 3.73Å; Y165-M370 HydrophobicContact CE1-CB 4.42Å; Y165-M370 HydrophobicContact CE2-CB 4.13Å; Y165-M370 HydrophobicContact CE2-CE 3.53Å; Y165-M370 VanDerWaalsContact OH-C 3.22Å; Y165-M370 PolarHBondContact OH-O 2.85Å; Q366-M370 WeakPolarHBondContact O-CG 3.47Å; Q366-M370 PolarHBondContact O-N 3.34Å; F367-M370 WeakPolarHBondContact O-CB 3.38Å; F367-M370 PolarHBondContact O-N 3Å; T368-M370 VanDerWaalsContact C-N 3.3Å; T368-M370 PolarHBondContact O-N 3.04Å; M370-R372 PolarHBondContact O-N 3.34Å; M370-R373 PolarHBondContact O-N 2.83Å; M370-R373 VanDerWaalsContact O-N 3.08Å; M370-K374 PolarHBondContact O-N 3.47Å; M370-A375 PolarHBondContact O-N 3.23Å
371	F	91.9	Very high	91.1	Very high	31 Å²	31	67.7 Å²	67.7	14%	0.136	31%	0.308	C	S	.	.	H	α-helix	trans	-65.4	-39.8	-175.6	-170.5	-122.2	0	0	0	112.1	Y165 F367 T368 R373 K374 L377 F390	Y165-F371 HydrophobicContact CE1-CB 4.03Å; Y165-F371 HydrophobicContact CE1-CD2 4.12Å; Y165-F371 VanDerWaalsContact OH-CA 3.31Å; Y165-F371 WeakPolarHBondContact OH-CA 3.48Å; Y165-F371 PolarHBondContact OH-N 3.17Å; F367-F371 HydrophobicContact CD1-CB 4.23Å; F367-F371 HydrophobicContact CE1-CB 3.93Å; F367-F371 HydrophobicContact CE1-CD1 4.18Å; F367-F371 HydrophobicContact CE1-CG 4.03Å; F367-F371 HydrophobicContact CZ-CB 4.49Å; F367-F371 HydrophobicContact CZ-CG 4.4Å; F367-F371 WeakPolarHBondContact O-CB 3.38Å; F367-F371 PolarHBondContact O-N 3.21Å; T368-F371 PolarHBondContact O-N 3.39Å; F371-R373 PolarHBondContact O-N 3.04Å; F371-R373 VanDerWaalsContact O-N 3.11Å; F371-K374 WeakPolarHBondContact O-CA 3.47Å; F371-K374 PolarHBondContact O-N 2.86Å; F371-L377 HydrophobicContact CD2-CD1 4.36Å; F371-L377 HydrophobicContact CE2-CD1 4.12Å; F371-L377 HydrophobicContact CE2-CD2 4.29Å; F371-F390 HydrophobicContact CD2-CB 4.25Å; F371-F390 HydrophobicContact CE2-CB 3.6Å; F371-F390 HydrophobicContact CE2-CG 4.05Å; F371-F390 HydrophobicContact CZ-CB 3.84Å
372	R	91.4	Very high	91	Very high	208 Å²	208	66.7 Å²	66.7	79%	0.785	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.7	173.2	-77.6	179.8	-175.1	175	7.9	113.5	T368 M370	T368-R372 HydrophobicContact CG2-CG 4.16Å; T368-R372 VanDerWaalsContact CG2-NE 3.32Å; T368-R372 VanDerWaalsContact O-CB 3.31Å; T368-R372 WeakPolarHBondContact O-CB 3.3Å; T368-R372 VanDerWaalsContact O-CG 3.23Å; T368-R372 WeakPolarHBondContact O-CG 3.35Å; T368-R372 PolarHBondContact O-N 3.4Å; M370-R372 PolarHBondContact O-N 3.34Å
373	R	92.5	Very high	91.1	Very high	207 Å²	207	67.2 Å²	67.2	78%	0.781	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-3.4	177.6	-62.9	178	-176.8	174.2	3.5	112.6	M370 F371 A375	M370-R373 PolarHBondContact O-N 2.83Å; M370-R373 VanDerWaalsContact O-N 3.08Å; F371-R373 PolarHBondContact O-N 3.04Å; F371-R373 VanDerWaalsContact O-N 3.11Å; R373-A375 HydrophobicContact CB-CB 4.49Å; R373-A375 PolarHBondContact O-N 2.83Å; R373-A375 VanDerWaalsContact O-N 3.12Å
374	K	90.1	Very high	91	Very high	113 Å²	113	70.1 Å²	70.1	49%	0.491	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	33.3	-171.3	-60	-168.1	165.7	-149.7	0	112.6	M370 F371 L377 E387	M370-K374 PolarHBondContact O-N 3.47Å; F371-K374 WeakPolarHBondContact O-CA 3.47Å; F371-K374 PolarHBondContact O-N 2.86Å; K374-L377 HydrophobicContact CB-CD2 4.16Å; K374-L377 HydrophobicContact CD-CD2 4.3Å; K374-L377 HydrophobicContact CG-CD2 4.18Å; K374-E387 IonicContact NZ-OE1 2.83Å; K374-E387 PolarHBondContact NZ-OE1 3.31Å; K374-E387 IonicContact NZ-OE2 2.66Å; K374-E387 PolarHBondContact NZ-OE2 3.32Å
375	A	88.9	Confident	91	Very high	29 Å²	29	69.9 Å²	69.9	24%	0.24	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	134.3	-179	0	0	0	0	0	109.6	Y165 M370 R373 L377	Y165-A375 VanDerWaalsContact CE2-O 3.25Å; Y165-A375 WeakPolarHBondContact CE2-O 2.91Å; Y165-A375 PolarHBondContact OH-O 2.69Å; M370-A375 PolarHBondContact O-N 3.23Å; R373-A375 HydrophobicContact CB-CB 4.49Å; R373-A375 PolarHBondContact O-N 2.83Å; R373-A375 VanDerWaalsContact O-N 3.12Å; A375-L377 PolarHBondContact O-N 3.42Å
376	F	90.6	Very high	91	Very high	76 Å²	76	67.6 Å²	67.6	33%	0.333	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	8.4	178.6	-56.1	-78.7	0	0	0	116.6	V161 V162 H378 W379	V161-F376 HydrophobicContact CG2-CD2 4.04Å; V161-F376 HydrophobicContact CG2-CE2 3.53Å; V161-F376 HydrophobicContact CG2-CZ 3.95Å; V162-F376 HydrophobicContact CG1-CB 3.78Å; V162-F376 HydrophobicContact CG1-CD2 4.12Å; V162-F376 HydrophobicContact CG1-CG 3.89Å; F376-H378 VanDerWaalsContact C-N 3.28Å; F376-H378 PolarHBondContact O-N 2.97Å; F376-W379 HydrophobicContact CD1-CD2 4.28Å; F376-W379 AromaticContact CD1-CE2 3.99Å; F376-W379 HydrophobicContact CD1-CE3 4.4Å; F376-W379 HydrophobicContact CD1-CH2 4.01Å; F376-W379 AromaticContact CD1-CZ2 3.86Å; F376-W379 HydrophobicContact CD1-CZ2 3.86Å; F376-W379 HydrophobicContact CD1-CZ3 4.27Å; F376-W379 HydrophobicContact CE1-CH2 4.2Å; F376-W379 HydrophobicContact CE1-CZ2 4.12Å; F376-W379 WeakPolarHBondContact O-CB 3.41Å; F376-W379 PolarHBondContact O-N 3.05Å; F376-W379 VanDerWaalsContact O-N 3.11Å
377	L	90.4	Very high	91.1	Very high	6 Å²	6	67.8 Å²	67.8	3%	0.031	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-35.3	-176.3	-166.4	62.6	0	0	0	113	F371 K374 A375 W379 Y380 T381 E387 F390	F371-L377 HydrophobicContact CD2-CD1 4.36Å; F371-L377 HydrophobicContact CE2-CD1 4.12Å; F371-L377 HydrophobicContact CE2-CD2 4.29Å; K374-L377 HydrophobicContact CB-CD2 4.16Å; K374-L377 HydrophobicContact CD-CD2 4.3Å; K374-L377 HydrophobicContact CG-CD2 4.18Å; A375-L377 PolarHBondContact O-N 3.42Å; L377-W379 PolarHBondContact O-N 2.97Å; L377-W379 VanDerWaalsContact O-N 3.1Å; L377-Y380 PolarHBondContact O-N 3.49Å; L377-T381 HydrophobicContact CG-CG2 4.18Å; L377-T381 PolarHBondContact O-N 3.04Å; L377-T381 PolarHBondContact O-OG1 3.09Å; L377-E387 HydrophobicContact CD2-CG 3.84Å; L377-E387 VanDerWaalsContact CD2-OE1 3.26Å; L377-E387 WeakPolarHBondContact CD2-OE1 3.48Å; L377-F390 HydrophobicContact CD1-CD1 4.32Å; L377-F390 HydrophobicContact CD1-CD2 3.86Å; L377-F390 HydrophobicContact CD1-CE1 4.16Å; L377-F390 HydrophobicContact CD1-CE2 3.67Å; L377-F390 HydrophobicContact CD1-CG 4.19Å; L377-F390 HydrophobicContact CD1-CZ 3.84Å
378	H	90.6	Very high	91	Very high	120 Å²	120	73.3 Å²	73.3	56%	0.556	38%	0.376	S	S	*	.	H	α-helix	trans	-59.9	-19.5	177.1	70.4	-73.2	0	0	0	114.7	F376 Y380 T381 G382	F376-H378 VanDerWaalsContact C-N 3.28Å; F376-H378 PolarHBondContact O-N 2.97Å; H378-Y380 VanDerWaalsContact C-N 3.32Å; H378-T381 WeakPolarHBondContact CA-OG1 3.35Å; H378-G382 PolarHBondContact O-N 3.46Å; H378-G382 VanDerWaalsContact O-N 3.08Å
379	W	90.9	Very high	91	Very high	113 Å²	113	74.5 Å²	74.5	43%	0.428	38%	0.379	S	S	.	.	H	α-helix	trans	-72.3	-29.5	173.9	-68	3.3	0	0	0	111.9	N82 F376 L377 E383	N82-W379 PolarHBondContact ND2-O 2.74Å; F376-W379 HydrophobicContact CD1-CD2 4.28Å; F376-W379 AromaticContact CD1-CE2 3.99Å; F376-W379 HydrophobicContact CD1-CE3 4.4Å; F376-W379 HydrophobicContact CD1-CH2 4.01Å; F376-W379 AromaticContact CD1-CZ2 3.86Å; F376-W379 HydrophobicContact CD1-CZ2 3.86Å; F376-W379 HydrophobicContact CD1-CZ3 4.27Å; F376-W379 HydrophobicContact CE1-CH2 4.2Å; F376-W379 HydrophobicContact CE1-CZ2 4.12Å; F376-W379 WeakPolarHBondContact O-CB 3.41Å; F376-W379 PolarHBondContact O-N 3.05Å; F376-W379 VanDerWaalsContact O-N 3.11Å; L377-W379 PolarHBondContact O-N 2.97Å; L377-W379 VanDerWaalsContact O-N 3.1Å; W379-E383 WeakPolarHBondContact O-CG 3.27Å
380	Y	93.3	Very high	91	Very high	1 Å²	1	72 Å²	72	0%	0.004	36%	0.359	C	S	.	.	H	α-helix	trans	-90.3	-45.1	-179.9	-60.9	-98.9	0	0	0	110.6	N82 W83 A84 Y165 N166 L169 L377 H378 G382 E383 M385 F390	N82-Y380 WeakPolarHBondContact OD1-CD1 3.4Å; N82-Y380 WeakPolarHBondContact OD1-CE1 3.21Å; W83-Y380 HydrophobicContact CB-CE1 4.1Å; A84-Y380 HydrophobicContact CB-CD1 3.95Å; Y165-Y380 HydrophobicContact CD2-CE2 4.02Å; Y165-Y380 HydrophobicContact CG-CE2 4.44Å; N166-Y380 WeakPolarHBondContact OD1-CE1 3.4Å; N166-Y380 PolarHBondContact OD1-OH 3.29Å; L169-Y380 HydrophobicContact CD1-CD1 4.41Å; L169-Y380 HydrophobicContact CD1-CE1 4.39Å; L377-Y380 PolarHBondContact O-N 3.49Å; H378-Y380 VanDerWaalsContact C-N 3.32Å; Y380-G382 PolarHBondContact O-N 3.02Å; Y380-E383 PolarHBondContact O-N 2.88Å; Y380-M385 HydrophobicContact CD1-SD 4.33Å; Y380-M385 WeakPolarHBondContact O-CB 3.45Å; Y380-M385 PolarHBondContact O-N 2.98Å; Y380-F390 HydrophobicContact CD1-CE1 4.47Å; Y380-F390 AromaticContact CD1-CZ 3.79Å; Y380-F390 HydrophobicContact CD1-CZ 3.79Å; Y380-F390 HydrophobicContact CD2-CZ 4.03Å; Y380-F390 HydrophobicContact CG-CE1 4.39Å; Y380-F390 HydrophobicContact CG-CE2 4.38Å; Y380-F390 AromaticContact CG-CZ 3.53Å; Y380-F390 HydrophobicContact CG-CZ 3.53Å
381	T	91.8	Very high	91.2	Very high	55 Å²	55	73.8 Å²	73.8	34%	0.337	37%	0.372	S	S	.	.	H	α-helix	trans	-68.1	-26	177.9	64	0	0	0	0	112.8	L377 H378 E383 G384 M385 E387	L377-T381 HydrophobicContact CG-CG2 4.18Å; L377-T381 PolarHBondContact O-N 3.04Å; L377-T381 PolarHBondContact O-OG1 3.09Å; H378-T381 WeakPolarHBondContact CA-OG1 3.35Å; T381-E383 PolarHBondContact O-N 3.24Å; T381-G384 PolarHBondContact O-N 2.83Å; T381-M385 VanDerWaalsContact CA-O 3.29Å; T381-M385 WeakPolarHBondContact CA-O 3.48Å; T381-M385 WeakPolarHBondContact CG2-O 3.38Å; T381-E387 HydrophobicContact CG2-CG 4.33Å
382	G	90.7	Very high	91.2	Very high	62 Å²	62	77 Å²	77	64%	0.639	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-22	171.4	0	0	0	0	0	114.1	H378 Y380	H378-G382 PolarHBondContact O-N 3.46Å; H378-G382 VanDerWaalsContact O-N 3.08Å; Y380-G382 PolarHBondContact O-N 3.02Å
383	E	90.6	Very high	91.3	Very high	55 Å²	55	67 Å²	67	26%	0.257	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	6.1	177.6	-55.6	-66.5	145.9	0	0	112.2	A84 K85 T89 W379 Y380 T381	A84-E383 HydrophobicContact CB-CB 3.89Å; A84-E383 HydrophobicContact CB-CG 4.33Å; K85-E383 VanDerWaalsContact CE-CD 3.45Å; K85-E383 WeakPolarHBondContact CE-OE1 3.34Å; K85-E383 VanDerWaalsContact CG-CD 3.47Å; K85-E383 HydrophobicContact CG-CG 3.75Å; K85-E383 WeakPolarHBondContact CG-OE2 3.49Å; K85-E383 IonicContact NZ-OE1 3.9Å; T89-E383 HydrophobicContact CG2-CB 4.26Å; T89-E383 VanDerWaalsContact CG2-OE2 3.27Å; T89-E383 WeakPolarHBondContact CG2-OE2 3.38Å; T89-E383 PolarHBondContact OG1-OE2 2.9Å; W379-E383 WeakPolarHBondContact O-CG 3.27Å; Y380-E383 PolarHBondContact O-N 2.88Å; T381-E383 PolarHBondContact O-N 3.24Å
384	G	87.9	Confident	91.3	Very high	66 Å²	66	58.8 Å²	58.8	68%	0.68	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.8	2	174.6	0	0	0	0	0	115.7	T381	T381-G384 PolarHBondContact O-N 2.83Å
385	M	92.6	Very high	91.5	Very high	5 Å²	5	56.2 Å²	56.2	3%	0.025	32%	0.316	C	S	.	.			trans	-78.5	141	179.6	-163.6	-179.2	163.4	0	0	112	W83 A84 Y88 L169 Y380 T381 E389 F390	W83-M385 HydrophobicContact CE3-SD 4.36Å; W83-M385 HydrophobicContact CZ3-SD 4.3Å; A84-M385 HydrophobicContact CB-CB 4.45Å; A84-M385 HydrophobicContact CB-SD 4.29Å; Y88-M385 HydrophobicContact CE2-CB 4.36Å; Y88-M385 HydrophobicContact CE2-CG 4.12Å; L169-M385 HydrophobicContact CD1-CE 3.64Å; L169-M385 HydrophobicContact CD1-SD 4.07Å; L169-M385 HydrophobicContact CD2-CE 3.38Å; L169-M385 HydrophobicContact CG-CE 4.15Å; Y380-M385 HydrophobicContact CD1-SD 4.33Å; Y380-M385 WeakPolarHBondContact O-CB 3.45Å; Y380-M385 PolarHBondContact O-N 2.98Å; T381-M385 VanDerWaalsContact CA-O 3.29Å; T381-M385 WeakPolarHBondContact CA-O 3.48Å; T381-M385 WeakPolarHBondContact CG2-O 3.38Å; M385-E389 HydrophobicContact CE-CB 3.55Å; M385-E389 HydrophobicContact CG-CB 4.3Å; M385-E389 VanDerWaalsContact CG-OE2 3.31Å; M385-E389 WeakPolarHBondContact CG-OE2 3.48Å; M385-F390 HydrophobicContact CE-CD1 4.46Å; M385-F390 HydrophobicContact CE-CD2 3.53Å; M385-F390 HydrophobicContact CE-CE1 4.24Å; M385-F390 HydrophobicContact CE-CE2 3.27Å; M385-F390 HydrophobicContact CE-CG 4.13Å; M385-F390 HydrophobicContact CE-CZ 3.64Å; M385-F390 HydrophobicContact CG-CE2 4.14Å; M385-F390 HydrophobicContact SD-CD2 4.29Å; M385-F390 HydrophobicContact SD-CE2 3.45Å; M385-F390 WeakPolarHBondContact SD-CE2 3.4Å; M385-F390 HydrophobicContact SD-CZ 3.69Å
386	D	91.6	Very high	91.7	Very high	96 Å²	96	55.6 Å²	55.6	51%	0.513	31%	0.308	S	S	.	.			trans	-88.1	151.6	175.5	-160.1	-8.4	0	0	0	112	M388 E389	D386-M388 HydrophobicContact CB-CB 4.43Å; D386-M388 PolarHBondContact O-N 2.81Å; D386-E389 PolarHBondContact N-OE1 3.06Å; D386-E389 PolarHBondContact O-N 3.31Å
387	E	89.9	Confident	91.8	Very high	72 Å²	72	52.1 Å²	52.1	34%	0.336	29%	0.294	S	S	.	.	H	α-helix	trans	-61.3	-23.4	170.4	-59.1	-165.6	163.3	0	0	111.8	K374 L377 T381 F390 T391	K374-E387 IonicContact NZ-OE1 2.83Å; K374-E387 PolarHBondContact NZ-OE1 3.31Å; K374-E387 IonicContact NZ-OE2 2.66Å; K374-E387 PolarHBondContact NZ-OE2 3.32Å; L377-E387 HydrophobicContact CD2-CG 3.84Å; L377-E387 VanDerWaalsContact CD2-OE1 3.26Å; L377-E387 WeakPolarHBondContact CD2-OE1 3.48Å; T381-E387 HydrophobicContact CG2-CG 4.33Å; E387-F390 WeakPolarHBondContact O-CB 3.36Å; E387-F390 PolarHBondContact O-N 2.86Å; E387-T391 PolarHBondContact O-N 3.02Å; E387-T391 PolarHBondContact O-OG1 2.81Å
388	M	91.6	Very high	91.9	Very high	116 Å²	116	54.8 Å²	54.8	57%	0.571	31%	0.308	S	S	*	.	H	α-helix	trans	-64.9	-39.8	177	-168.4	161	-176.7	0	0	112	D386 F390 T391 E392	D386-M388 HydrophobicContact CB-CB 4.43Å; D386-M388 PolarHBondContact O-N 2.81Å; M388-F390 VanDerWaalsContact C-N 3.26Å; M388-F390 PolarHBondContact O-N 3.38Å; M388-T391 WeakPolarHBondContact O-CA 3.47Å; M388-T391 WeakPolarHBondContact O-CB 3.32Å; M388-T391 PolarHBondContact O-N 2.98Å; M388-E392 HydrophobicContact CG-CG 4.49Å; M388-E392 WeakPolarHBondContact O-CG 3.45Å; M388-E392 PolarHBondContact O-N 3.49Å
389	E	91.9	Very high	92	Very high	49 Å²	49	52.9 Å²	52.9	23%	0.229	30%	0.301	C	S	.	.	H	α-helix	trans	-60.7	-35.2	177.4	-71.2	176.8	-132.1	0	0	112.1	Y88 M385 D386 T391 E392 A393	Y88-E389 PolarHBondContact OH-OE2 3.28Å; M385-E389 HydrophobicContact CE-CB 3.55Å; M385-E389 HydrophobicContact CG-CB 4.3Å; M385-E389 VanDerWaalsContact CG-OE2 3.31Å; M385-E389 WeakPolarHBondContact CG-OE2 3.48Å; D386-E389 PolarHBondContact N-OE1 3.06Å; D386-E389 PolarHBondContact O-N 3.31Å; E389-T391 VanDerWaalsContact C-N 3.33Å; E389-E392 PolarHBondContact O-N 2.53Å; E389-A393 WeakPolarHBondContact O-CB 3.35Å; E389-A393 PolarHBondContact O-N 2.79Å
390	F	92.4	Very high	92.1	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64	-40.7	173.4	-75.3	-90.1	0	0	0	112.1	Y165 L169 F367 F371 L377 Y380 M385 E387 M388 E394	Y165-F390 AromaticContact CD1-CD1 3.81Å; Y165-F390 HydrophobicContact CD1-CD1 3.81Å; Y165-F390 AromaticContact CD1-CE1 3.63Å; Y165-F390 HydrophobicContact CD1-CE1 3.63Å; Y165-F390 HydrophobicContact CE1-CD1 4.12Å; Y165-F390 HydrophobicContact CE1-CE1 4.16Å; Y165-F390 HydrophobicContact CG-CE1 4.07Å; L169-F390 HydrophobicContact CD1-CE1 3.92Å; L169-F390 HydrophobicContact CD1-CZ 4.14Å; L169-F390 HydrophobicContact CD2-CD1 4.47Å; F367-F390 AromaticContact CE2-CD1 3.93Å; F367-F390 HydrophobicContact CE2-CD1 3.93Å; F367-F390 HydrophobicContact CZ-CB 4.1Å; F367-F390 AromaticContact CZ-CD1 3.91Å; F367-F390 HydrophobicContact CZ-CD1 3.91Å; F367-F390 WeakPolarHBondContact CZ-O 3.31Å; F371-F390 HydrophobicContact CD2-CB 4.25Å; F371-F390 HydrophobicContact CE2-CB 3.6Å; F371-F390 HydrophobicContact CE2-CG 4.05Å; F371-F390 HydrophobicContact CZ-CB 3.84Å; L377-F390 HydrophobicContact CD1-CD1 4.32Å; L377-F390 HydrophobicContact CD1-CD2 3.86Å; L377-F390 HydrophobicContact CD1-CE1 4.16Å; L377-F390 HydrophobicContact CD1-CE2 3.67Å; L377-F390 HydrophobicContact CD1-CG 4.19Å; L377-F390 HydrophobicContact CD1-CZ 3.84Å; Y380-F390 HydrophobicContact CD1-CE1 4.47Å; Y380-F390 AromaticContact CD1-CZ 3.79Å; Y380-F390 HydrophobicContact CD1-CZ 3.79Å; Y380-F390 HydrophobicContact CD2-CZ 4.03Å; Y380-F390 HydrophobicContact CG-CE1 4.39Å; Y380-F390 HydrophobicContact CG-CE2 4.38Å; Y380-F390 AromaticContact CG-CZ 3.53Å; Y380-F390 HydrophobicContact CG-CZ 3.53Å; M385-F390 HydrophobicContact CE-CD1 4.46Å; M385-F390 HydrophobicContact CE-CD2 3.53Å; M385-F390 HydrophobicContact CE-CE1 4.24Å; M385-F390 HydrophobicContact CE-CE2 3.27Å; M385-F390 HydrophobicContact CE-CG 4.13Å; M385-F390 HydrophobicContact CE-CZ 3.64Å; M385-F390 HydrophobicContact CG-CE2 4.14Å; M385-F390 HydrophobicContact SD-CD2 4.29Å; M385-F390 HydrophobicContact SD-CE2 3.45Å; M385-F390 WeakPolarHBondContact SD-CE2 3.4Å; M385-F390 HydrophobicContact SD-CZ 3.69Å; E387-F390 WeakPolarHBondContact O-CB 3.36Å; E387-F390 PolarHBondContact O-N 2.86Å; M388-F390 VanDerWaalsContact C-N 3.26Å; M388-F390 PolarHBondContact O-N 3.38Å; F390-E394 WeakPolarHBondContact O-CB 3.33Å; F390-E394 PolarHBondContact O-N 3.08Å
391	T	92.9	Very high	92.1	Very high	70 Å²	70	48 Å²	48	43%	0.429	29%	0.285	S	S	.	.	H	α-helix	trans	-70	-39.6	-179.6	-51	0	0	0	0	110.7	E387 M388 E389 E394 S395	E387-T391 PolarHBondContact O-N 3.02Å; E387-T391 PolarHBondContact O-OG1 2.81Å; M388-T391 WeakPolarHBondContact O-CA 3.47Å; M388-T391 WeakPolarHBondContact O-CB 3.32Å; M388-T391 PolarHBondContact O-N 2.98Å; E389-T391 VanDerWaalsContact C-N 3.33Å; T391-E394 PolarHBondContact O-N 3.19Å; T391-S395 WeakPolarHBondContact O-CB 3.48Å; T391-S395 PolarHBondContact O-N 3.27Å
392	E	93.3	Very high	92.1	Very high	97 Å²	97	48.8 Å²	48.8	45%	0.453	29%	0.292	S	S	.	.	H	α-helix	trans	-63.6	-46.3	175.1	-71.1	174.9	179.7	0	0	111.4	M388 E389 E394 S395 N396	M388-E392 HydrophobicContact CG-CG 4.49Å; M388-E392 WeakPolarHBondContact O-CG 3.45Å; M388-E392 PolarHBondContact O-N 3.49Å; E389-E392 PolarHBondContact O-N 2.53Å; E392-E394 PolarHBondContact O-N 3.45Å; E392-S395 PolarHBondContact O-N 3.5Å; E392-N396 WeakPolarHBondContact O-CB 3.4Å; E392-N396 PolarHBondContact O-N 3.32Å
393	A	93.2	Very high	92.2	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.5	-38.1	176.8	0	0	0	0	0	112.5	T168 L169 H172 E389 M397	T168-A393 HydrophobicContact CG2-CB 4.04Å; L169-A393 HydrophobicContact CD2-CB 3.76Å; H172-A393 HydrophobicContact CB-CB 3.94Å; E389-A393 WeakPolarHBondContact O-CB 3.35Å; E389-A393 PolarHBondContact O-N 2.79Å; A393-M397 WeakPolarHBondContact O-CB 3.42Å; A393-M397 PolarHBondContact O-N 2.86Å
394	E	92.9	Very high	92.2	Very high	33 Å²	33	45.4 Å²	45.4	15%	0.154	26%	0.26	C	S	.	.	H	α-helix	trans	-63.5	-44.4	173	-173.5	176.6	-144.1	0	0	111.4	F367 T368 F390 T391 E392 M397 N398	F367-E394 HydrophobicContact CD1-CB 4.22Å; F367-E394 HydrophobicContact CD1-CG 4.04Å; F367-E394 HydrophobicContact CE1-CB 3.63Å; F367-E394 HydrophobicContact CE1-CG 3.87Å; F367-E394 HydrophobicContact CZ-CB 4.23Å; T368-E394 WeakPolarHBondContact CB-OE1 3.49Å; T368-E394 PolarHBondContact OG1-OE1 3.18Å; F390-E394 WeakPolarHBondContact O-CB 3.33Å; F390-E394 PolarHBondContact O-N 3.08Å; T391-E394 PolarHBondContact O-N 3.19Å; E392-E394 PolarHBondContact O-N 3.45Å; E394-M397 PolarHBondContact O-N 3.02Å; E394-N398 VanDerWaalsContact O-CG 3.26Å; E394-N398 PolarHBondContact O-N 2.8Å; E394-N398 VanDerWaalsContact O-N 3.09Å; E394-N398 PolarHBondContact O-ND2 2.87Å
395	S	93.5	Very high	92.4	Very high	60 Å²	60	45 Å²	45	42%	0.42	24%	0.24	S	C	.	.	H	α-helix	trans	-60.8	-52.1	177.2	-166	0	0	0	0	111	T391 E392 M397 N398 D399	T391-S395 WeakPolarHBondContact O-CB 3.48Å; T391-S395 PolarHBondContact O-N 3.27Å; E392-S395 PolarHBondContact O-N 3.5Å; S395-M397 VanDerWaalsContact C-N 3.28Å; S395-M397 PolarHBondContact O-N 3.48Å; S395-N398 CarbonylContact O-C 3.57Å; S395-N398 WeakPolarHBondContact O-CA 3.46Å; S395-N398 WeakPolarHBondContact O-CB 3.39Å; S395-N398 PolarHBondContact O-N 3.49Å; S395-D399 PolarHBondContact O-N 3.23Å
396	N	93.3	Very high	92.3	Very high	15 Å²	15	49.3 Å²	49.3	8%	0.08	26%	0.26	C	S	.	.	H	α-helix	trans	-62.8	-36.1	-177.1	-163.9	3.7	0	0	0	112.1	H172 R244 E392 D399 L400	H172-N396 PolarHBondContact CE1-ND2 3.1Å; H172-N396 PolarHBondContact ND1-ND2 3.08Å; R244-N396 PolarHBondContact NH2-OD1 3.05Å; E392-N396 WeakPolarHBondContact O-CB 3.4Å; E392-N396 PolarHBondContact O-N 3.32Å; N396-D399 PolarHBondContact O-N 3.34Å; N396-L400 WeakPolarHBondContact O-CB 3.25Å; N396-L400 PolarHBondContact O-N 2.9Å
397	M	91.9	Very high	92.1	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.02	25%	0.245	C	C	.	.	H	α-helix	trans	-61.3	-43.7	171.9	-175.4	73.6	70.6	0	0	112	T168 V171 F360 A393 E394 S395 L400 V401	T168-M397 HydrophobicContact CG2-CE 4.12Å; V171-M397 HydrophobicContact CB-CE 3.38Å; V171-M397 HydrophobicContact CB-SD 4.31Å; V171-M397 HydrophobicContact CG1-CE 3.44Å; V171-M397 VanDerWaalsContact CG1-CE 3.44Å; V171-M397 HydrophobicContact CG1-SD 3.69Å; V171-M397 HydrophobicContact CG2-CE 3.88Å; F360-M397 HydrophobicContact CB-SD 3.89Å; F360-M397 HydrophobicContact CD1-CE 4.38Å; F360-M397 HydrophobicContact CD1-SD 3.41Å; F360-M397 WeakPolarHBondContact CD1-SD 3.47Å; F360-M397 HydrophobicContact CE1-SD 4.22Å; F360-M397 HydrophobicContact CG-SD 3.92Å; A393-M397 WeakPolarHBondContact O-CB 3.42Å; A393-M397 PolarHBondContact O-N 2.86Å; E394-M397 PolarHBondContact O-N 3.02Å; S395-M397 VanDerWaalsContact C-N 3.28Å; S395-M397 PolarHBondContact O-N 3.48Å; M397-L400 PolarHBondContact O-N 3.39Å; M397-V401 WeakPolarHBondContact O-CG2 3.49Å; M397-V401 PolarHBondContact O-N 3.28Å
398	N	93.1	Very high	92	Very high	62 Å²	62	45.1 Å²	45.1	33%	0.332	24%	0.236	S	C	.	.	H	α-helix	trans	-70.6	-34.1	178.8	-67.8	-35	0	0	0	112.2	S364 E394 S395 V401 S402	S364-N398 PolarHBondContact OG-OD1 3.27Å; E394-N398 VanDerWaalsContact O-CG 3.26Å; E394-N398 PolarHBondContact O-N 2.8Å; E394-N398 VanDerWaalsContact O-N 3.09Å; E394-N398 PolarHBondContact O-ND2 2.87Å; S395-N398 CarbonylContact O-C 3.57Å; S395-N398 WeakPolarHBondContact O-CA 3.46Å; S395-N398 WeakPolarHBondContact O-CB 3.39Å; S395-N398 PolarHBondContact O-N 3.49Å; N398-V401 PolarHBondContact O-N 3.27Å; N398-S402 WeakPolarHBondContact O-CB 2.86Å; N398-S402 PolarHBondContact O-N 3.33Å; N398-S402 PolarHBondContact O-OG 3.08Å
399	D	93.8	Very high	91.8	Very high	79 Å²	79	44.2 Å²	44.2	42%	0.422	23%	0.233	S	C	.	.	H	α-helix	trans	-63.7	-45.9	173	-62.5	-27.9	0	0	0	110.1	S395 N396 V401 S402 E403	S395-D399 PolarHBondContact O-N 3.23Å; N396-D399 PolarHBondContact O-N 3.34Å; D399-V401 VanDerWaalsContact C-N 3.34Å; D399-V401 PolarHBondContact O-N 3.38Å; D399-S402 CarbonylContact O-C 3.6Å; D399-S402 WeakPolarHBondContact O-CA 3.47Å; D399-S402 WeakPolarHBondContact O-CB 3.43Å; D399-S402 PolarHBondContact O-N 2.97Å; D399-E403 WeakPolarHBondContact O-CG 3.29Å; D399-E403 PolarHBondContact O-N 2.62Å
400	L	92.3	Very high	91.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.1	-43.8	174.1	-178.6	70.4	0	0	0	112.2	V171 V175 R244 L245 F247 F360 N396 M397 S402 E403 Y404	V171-L400 HydrophobicContact CG1-CD2 4.39Å; V175-L400 HydrophobicContact CG2-CD1 4.45Å; V175-L400 HydrophobicContact CG2-CD2 3.86Å; R244-L400 HydrophobicContact CB-CD1 4.5Å; L245-L400 HydrophobicContact CD2-CD1 3.83Å; F247-L400 HydrophobicContact CD2-CD2 4.21Å; F247-L400 HydrophobicContact CE2-CD1 4.36Å; F247-L400 HydrophobicContact CE2-CD2 3.76Å; F247-L400 HydrophobicContact CZ-CD2 4.42Å; F360-L400 HydrophobicContact CD2-CD2 4.17Å; F360-L400 HydrophobicContact CE1-CD2 4.29Å; F360-L400 HydrophobicContact CE2-CD2 3.88Å; F360-L400 HydrophobicContact CZ-CD2 3.94Å; N396-L400 WeakPolarHBondContact O-CB 3.25Å; N396-L400 PolarHBondContact O-N 2.9Å; M397-L400 PolarHBondContact O-N 3.39Å; L400-S402 VanDerWaalsContact C-N 3.27Å; L400-S402 PolarHBondContact O-N 3.04Å; L400-E403 PolarHBondContact O-N 3.11Å; L400-Y404 HydrophobicContact CD1-CD2 4.37Å; L400-Y404 HydrophobicContact CD1-CE2 3.85Å; L400-Y404 HydrophobicContact CD2-CE2 4.33Å; L400-Y404 HydrophobicContact CG-CD2 4.13Å; L400-Y404 HydrophobicContact CG-CE2 3.84Å; L400-Y404 WeakPolarHBondContact O-CD2 3.26Å; L400-Y404 PolarHBondContact O-N 3.49Å; L400-Y404 VanDerWaalsContact O-N 3.09Å
401	V	92.8	Very high	90.3	Very high	13 Å²	13	45.7 Å²	45.7	8%	0.079	25%	0.247	C	C	.	.	H	α-helix	trans	-61.6	-38.9	175.2	166.7	0	0	0	0	111.1	Q357 F360 K361 M397 N398 D399 Y404 Q405	Q357-V401 HydrophobicContact CB-CG1 4.39Å; F360-V401 HydrophobicContact CB-CG2 3.57Å; K361-V401 HydrophobicContact CD-CG1 4.26Å; K361-V401 HydrophobicContact CG-CG1 3.86Å; K361-V401 HydrophobicContact CG-CG2 4.34Å; M397-V401 WeakPolarHBondContact O-CG2 3.49Å; M397-V401 PolarHBondContact O-N 3.28Å; N398-V401 PolarHBondContact O-N 3.27Å; D399-V401 VanDerWaalsContact C-N 3.34Å; D399-V401 PolarHBondContact O-N 3.38Å; V401-Y404 PolarHBondContact O-N 3.05Å; V401-Q405 PolarHBondContact O-N 3.26Å
402	S	92.4	Very high	88.8	Confident	71 Å²	71	44.9 Å²	44.9	50%	0.497	25%	0.248	S	C	.	.	H	α-helix	trans	-69.8	-39.4	179.6	-58	0	0	0	0	111.6	N398 D399 L400 Q405 Q406	N398-S402 WeakPolarHBondContact O-CB 2.86Å; N398-S402 PolarHBondContact O-N 3.33Å; N398-S402 PolarHBondContact O-OG 3.08Å; D399-S402 CarbonylContact O-C 3.6Å; D399-S402 WeakPolarHBondContact O-CA 3.47Å; D399-S402 WeakPolarHBondContact O-CB 3.43Å; D399-S402 PolarHBondContact O-N 2.97Å; L400-S402 VanDerWaalsContact C-N 3.27Å; L400-S402 PolarHBondContact O-N 3.04Å; S402-Q405 WeakPolarHBondContact O-CB 3.34Å; S402-Q405 PolarHBondContact O-N 3.31Å; S402-Q406 PolarHBondContact O-N 2.96Å
403	E	91.7	Very high	87	Confident	46 Å²	46	48.9 Å²	48.9	22%	0.215	27%	0.267	C	S	.	.	H	α-helix	trans	-58.3	-48.6	172	-72.8	172.9	-173.1	0	0	111	R244 L245 D399 L400 Q405 Q406 Y407	R244-E403 WeakPolarHBondContact CD-OE1 3.32Å; R244-E403 IonicContact CZ-OE1 2.74Å; R244-E403 VanDerWaalsContact CZ-OE1 3.23Å; R244-E403 IonicContact CZ-OE2 3.32Å; R244-E403 VanDerWaalsContact NE-CD 3.33Å; R244-E403 IonicContact NE-OE1 3.39Å; R244-E403 PolarHBondContact NE-OE1 3.02Å; R244-E403 IonicContact NE-OE2 3.53Å; R244-E403 PolarHBondContact NE-OE2 3.32Å; R244-E403 IonicContact NH2-OE1 2.72Å; L245-E403 HydrophobicContact CD2-CB 4.14Å; D399-E403 WeakPolarHBondContact O-CG 3.29Å; D399-E403 PolarHBondContact O-N 2.62Å; L400-E403 PolarHBondContact O-N 3.11Å; E403-Q405 VanDerWaalsContact C-N 3.27Å; E403-Q405 PolarHBondContact O-N 3.1Å; E403-Q406 WeakPolarHBondContact O-CB 3.45Å; E403-Q406 PolarHBondContact O-N 2.97Å; E403-Y407 WeakPolarHBondContact O-CD2 3.31Å; E403-Y407 PolarHBondContact O-N 3.27Å; E403-Y407 VanDerWaalsContact O-N 3.12Å
404	Y	92.3	Very high	84.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.7	-37.8	175.6	-81.3	-64.5	0	0	0	112.7	L245 T354 I356 F360 L400 V401 Q408	L245-Y404 HydrophobicContact CB-CE1 4.03Å; L245-Y404 HydrophobicContact CD1-CD1 4.26Å; L245-Y404 HydrophobicContact CD1-CE1 4.23Å; L245-Y404 HydrophobicContact CD2-CD1 3.98Å; L245-Y404 HydrophobicContact CD2-CD2 4Å; L245-Y404 HydrophobicContact CD2-CE1 3.73Å; L245-Y404 HydrophobicContact CD2-CE2 3.71Å; L245-Y404 HydrophobicContact CD2-CG 4.11Å; L245-Y404 HydrophobicContact CG-CE1 4.21Å; T354-Y404 HydrophobicContact CG2-CD1 4.42Å; I356-Y404 HydrophobicContact CG2-CD1 4.04Å; I356-Y404 HydrophobicContact CG2-CD2 4.03Å; I356-Y404 HydrophobicContact CG2-CE1 3.58Å; I356-Y404 HydrophobicContact CG2-CE2 3.6Å; I356-Y404 HydrophobicContact CG2-CG 4.24Å; F360-Y404 HydrophobicContact CD2-CE2 4.39Å; F360-Y404 HydrophobicContact CE2-CE2 4.01Å; L400-Y404 HydrophobicContact CD1-CD2 4.37Å; L400-Y404 HydrophobicContact CD1-CE2 3.85Å; L400-Y404 HydrophobicContact CD2-CE2 4.33Å; L400-Y404 HydrophobicContact CG-CD2 4.13Å; L400-Y404 HydrophobicContact CG-CE2 3.84Å; L400-Y404 WeakPolarHBondContact O-CD2 3.26Å; L400-Y404 PolarHBondContact O-N 3.49Å; L400-Y404 VanDerWaalsContact O-N 3.09Å; V401-Y404 PolarHBondContact O-N 3.05Å; Y404-Q408 VanDerWaalsContact O-CB 3.32Å; Y404-Q408 WeakPolarHBondContact O-CB 3.36Å; Y404-Q408 PolarHBondContact O-N 3.22Å; Y404-Q408 VanDerWaalsContact O-N 3.09Å
405	Q	91.1	Very high	82.6	Confident	56 Å²	56	55.4 Å²	55.4	26%	0.262	30%	0.297	S	S	.	.	H	α-helix	trans	-68	-41.5	177.2	-173	62	52.1	0	0	111.6	Q357 V401 S402 E403 Y407 Q408 D409	Q357-Q405 VanDerWaalsContact OE1-OE1 3.09Å; V401-Q405 PolarHBondContact O-N 3.26Å; S402-Q405 WeakPolarHBondContact O-CB 3.34Å; S402-Q405 PolarHBondContact O-N 3.31Å; E403-Q405 VanDerWaalsContact C-N 3.27Å; E403-Q405 PolarHBondContact O-N 3.1Å; Q405-Y407 PolarHBondContact O-N 2.79Å; Q405-Q408 WeakPolarHBondContact O-CB 3.23Å; Q405-Q408 PolarHBondContact O-N 3.06Å; Q405-D409 PolarHBondContact NE2-OD1 3.4Å; Q405-D409 PolarHBondContact NE2-OD2 3.08Å; Q405-D409 PolarHBondContact O-N 3.48Å; Q405-D409 VanDerWaalsContact O-N 3.11Å
406	Q	90.4	Very high	80.1	Confident	97 Å²	97	61.2 Å²	61.2	45%	0.453	32%	0.318	S	S	.	.	H	α-helix	trans	-57.7	-50.9	177.2	-177.9	-179.9	-2	0	0	111.2	S402 E403 Q408 D409 A410	S402-Q406 PolarHBondContact O-N 2.96Å; E403-Q406 WeakPolarHBondContact O-CB 3.45Å; E403-Q406 PolarHBondContact O-N 2.97Å; Q406-Q408 VanDerWaalsContact C-N 3.26Å; Q406-Q408 PolarHBondContact O-N 3.18Å; Q406-D409 PolarHBondContact O-N 3.48Å; Q406-A410 WeakPolarHBondContact O-CB 3.31Å; Q406-A410 PolarHBondContact O-N 3.32Å
407	Y	88.4	Confident	77.7	Confident	51 Å²	51	66.5 Å²	66.5	20%	0.2	35%	0.346	C	S	.	.	H	α-helix	trans	-71.8	-19.9	178.9	-66.4	-66.6	0	0	0	114.1	F242 L245 W326 E403 Q405	F242-Y407 HydrophobicContact CD2-CD1 4.46Å; F242-Y407 HydrophobicContact CD2-CD2 4.33Å; F242-Y407 HydrophobicContact CD2-CE1 4.06Å; F242-Y407 AromaticContact CD2-CE2 3.9Å; F242-Y407 HydrophobicContact CD2-CE2 3.9Å; F242-Y407 AromaticContact CD2-CZ 3.74Å; F242-Y407 AromaticContact CE1-CE1 3.95Å; F242-Y407 HydrophobicContact CE1-CE1 3.95Å; F242-Y407 AromaticContact CE1-CZ 3.82Å; F242-Y407 WeakPolarHBondContact CE1-OH 3.49Å; F242-Y407 AromaticContact CE2-CD1 3.61Å; F242-Y407 HydrophobicContact CE2-CD1 3.61Å; F242-Y407 HydrophobicContact CE2-CD2 4.24Å; F242-Y407 AromaticContact CE2-CE1 3.24Å; F242-Y407 HydrophobicContact CE2-CE1 3.24Å; F242-Y407 AromaticContact CE2-CE2 3.92Å; F242-Y407 HydrophobicContact CE2-CE2 3.92Å; F242-Y407 HydrophobicContact CE2-CG 4.09Å; F242-Y407 AromaticContact CE2-CZ 3.4Å; F242-Y407 HydrophobicContact CG-CE2 4.31Å; F242-Y407 AromaticContact CZ-CD1 3.95Å; F242-Y407 HydrophobicContact CZ-CD1 3.95Å; F242-Y407 AromaticContact CZ-CE1 3.2Å; F242-Y407 HydrophobicContact CZ-CE1 3.2Å; F242-Y407 HydrophobicContact CZ-CE2 4.42Å; F242-Y407 AromaticContact CZ-CZ 3.47Å; F242-Y407 VanDerWaalsContact CZ-CZ 3.47Å; L245-Y407 HydrophobicContact CD1-CD2 3.44Å; L245-Y407 VanDerWaalsContact CD1-CD2 3.44Å; L245-Y407 HydrophobicContact CD1-CE2 3.69Å; L245-Y407 HydrophobicContact CD1-CG 4.41Å; W326-Y407 HydrophobicContact CZ2-CD1 4.15Å; E403-Y407 WeakPolarHBondContact O-CD2 3.31Å; E403-Y407 PolarHBondContact O-N 3.27Å; E403-Y407 VanDerWaalsContact O-N 3.12Å; Q405-Y407 PolarHBondContact O-N 2.79Å
408	Q	87.5	Confident	75.5	Confident	28 Å²	28	71.1 Å²	71.1	13%	0.131	37%	0.366	C	S	.	.	H	α-helix	trans	-70.2	-40.7	173	-178.6	167.9	-48.8	0	0	111.7	H289 R291 T354 Y404 Q405 Q406	H289-Q408 PolarHBondContact O-NE2 2.93Å; R291-Q408 PolarHBondContact NH1-O 3.31Å; T354-Q408 HydrophobicContact CG2-CB 3.98Å; T354-Q408 PolarHBondContact OG1-OE1 3.27Å; Y404-Q408 VanDerWaalsContact O-CB 3.32Å; Y404-Q408 WeakPolarHBondContact O-CB 3.36Å; Y404-Q408 PolarHBondContact O-N 3.22Å; Y404-Q408 VanDerWaalsContact O-N 3.09Å; Q405-Q408 WeakPolarHBondContact O-CB 3.23Å; Q405-Q408 PolarHBondContact O-N 3.06Å; Q406-Q408 VanDerWaalsContact C-N 3.26Å; Q406-Q408 PolarHBondContact O-N 3.18Å
409	D	86.8	Confident	73	Confident	98 Å²	98	70.4 Å²	70.4	52%	0.524	37%	0.374	S	S	.	.	H	α-helix	trans	-86	-21.5	-178.1	-64.5	-29.5	0	0	0	112.4	Q405 Q406 T411	Q405-D409 PolarHBondContact NE2-OD1 3.4Å; Q405-D409 PolarHBondContact NE2-OD2 3.08Å; Q405-D409 PolarHBondContact O-N 3.48Å; Q405-D409 VanDerWaalsContact O-N 3.11Å; Q406-D409 PolarHBondContact O-N 3.48Å; D409-T411 PolarHBondContact O-N 3.29Å
410	A	80.2	Confident	70.3	Confident	18 Å²	18	73.5 Å²	73.5	15%	0.149	39%	0.385	C	S	.	.			trans	-53	135.4	178.5	0	0	0	0	0	113	R291 Q406	R291-A410 PolarHBondContact NH1-O 3.48Å; Q406-A410 WeakPolarHBondContact O-CB 3.31Å; Q406-A410 PolarHBondContact O-N 3.32Å
411	T	73	Confident	67.7	Low	61 Å²	61	80 Å²	80	37%	0.374	42%	0.416	S	S	.	.			trans	-114.7	156.1	174.2	59.6	0	0	0	0	111.1	D409 E413 E414	D409-T411 PolarHBondContact O-N 3.29Å; T411-E413 PolarHBondContact O-N 2.98Å; T411-E414 PolarHBondContact N-OE2 3.47Å; T411-E414 PolarHBondContact O-N 3.12Å; T411-E414 PolarHBondContact OG1-OE2 3.21Å
412	A	61.8	Low	65.1	Low	54 Å²	54	83 Å²	83	45%	0.446	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-14.1	-176.7	0	0	0	0	0	114.3	W326	W326-A412 HydrophobicContact CB-CB 4.41Å
413	E	54.4	Low	62.6	Low	180 Å²	180	87.6 Å²	87.6	84%	0.841	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-16.9	176.3	-66	-176	170.1	0	0	113	T411	T411-E413 PolarHBondContact O-N 2.98Å
414	E	49.6	Very low	60	Low	98 Å²	98	93.9 Å²	93.9	46%	0.458	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-15.2	-175.5	-69.7	168.3	150.2	0	0	113	T411 F418	T411-E414 PolarHBondContact N-OE2 3.47Å; T411-E414 PolarHBondContact O-N 3.12Å; T411-E414 PolarHBondContact OG1-OE2 3.21Å; E414-F418 HydrophobicContact CB-CE2 4.19Å; E414-F418 WeakPolarHBondContact O-CD2 3.43Å; E414-F418 WeakPolarHBondContact O-CE2 3.48Å
415	E	43.9	Very low	57.4	Low	73 Å²	73	102.9 Å²	102.9	34%	0.341	53%	0.527	S	S	.	.	H	α-helix	trans	-73.5	-19.9	178.9	-95.5	-167.8	163.7	0	0	115.1	W326 D417 F418 G419	W326-E415 VanDerWaalsContact CE3-OE1 3.23Å; E415-D417 PolarHBondContact O-N 2.87Å; E415-F418 PolarHBondContact O-N 3.11Å; E415-G419 PolarHBondContact O-N 2.66Å
416	E	42.5	Very low	54.7	Low	181 Å²	181	107.5 Å²	107.5	85%	0.846	58%	0.575	S	S	*	*	H	α-helix	trans	-63.2	-22.2	175.6	-81.2	-171.5	169.2	0	0	112.2
417	D	40.9	Very low	52.9	Low	126 Å²	126	108 Å²	108	67%	0.674	58%	0.581	S	S	*	*	H	α-helix	trans	-90.4	-28.2	176.6	-117.2	-1.5	0	0	0	112.8	E415	E415-D417 PolarHBondContact O-N 2.87Å
418	F	46	Very low	51	Low	101 Å²	101	111 Å²	111	44%	0.443	60%	0.601	S	S	.	*	H	α-helix	trans	-84.1	-18.2	-175.7	-69.6	-67.8	0	0	0	114.2	E414 E415 E420	E414-F418 HydrophobicContact CB-CE2 4.19Å; E414-F418 WeakPolarHBondContact O-CD2 3.43Å; E414-F418 WeakPolarHBondContact O-CE2 3.48Å; E415-F418 PolarHBondContact O-N 3.11Å; F418-E420 VanDerWaalsContact C-N 3.33Å
419	G	41.1	Very low	49	Very low	48 Å²	48	115.6 Å²	115.6	50%	0.495	63%	0.627	S	S	.	*	H	α-helix	trans	-71.5	-24.8	174.8	0	0	0	0	0	113.9	E415	E415-G419 PolarHBondContact O-N 2.66Å
420	E	37.2	Very low	46.8	Very low	143 Å²	143	116.6 Å²	116.6	67%	0.668	63%	0.633	S	S	*	*	H	α-helix	trans	-81.6	-31.6	178.9	-69.8	-167.1	162.5	0	0	112.5	F418	F418-E420 VanDerWaalsContact C-N 3.33Å
421	E	37.1	Very low	44.7	Very low	137 Å²	137	122.8 Å²	122.8	64%	0.64	66%	0.663	S	S	*	*	H	α-helix	trans	-73.2	-30.7	179.2	-72.1	-170.9	158.5	0	0	113.3	E424	E421-E424 PolarHBondContact O-N 2.83Å
422	A	39.6	Very low	42.8	Very low	76 Å²	76	126.9 Å²	126.9	63%	0.628	68%	0.682	S	S	*	*	H	α-helix	trans	-75.3	-20.6	179	0	0	0	0	0	113.9
423	E	38.6	Very low	41.5	Very low	167 Å²	167	132.1 Å²	132.1	78%	0.78	70%	0.699	S	S	*	*	H	α-helix	trans	-82.9	-17.2	174.4	-78.2	-167.3	162.2	0	0	113.1
424	E	38	Very low	40.5	Very low	178 Å²	178	128.5 Å²	128.5	83%	0.832	69%	0.688	S	S	*	*	H	α-helix	trans	-85	-15.8	178.5	-77	-162.3	151.7	0	0	114.3	E421	E421-E424 PolarHBondContact O-N 2.83Å
425	E	37.8	Very low	39.7	Very low	190 Å²	190	131 Å²	131	89%	0.888	71%	0.708	S	S	*	*			trans	-105.7	10.7	179.5	-70.9	-161.5	154.4	0	0	115.5
426	A	33.9	Very low	39.3	Very low	152 Å²	152	136.3 Å²	136.3	100%	1.256	74%	0.741	S	S	*	*			trans	-94.9	0	178.5	0	0	0	0	0	115.1

Retrieved 426 of 426 residues in 1461.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).