A0A096NFN8_PAPAN Loading...

Eukaryotic translation initiation factor 3 subunit I

Component of the eukaryotic translation initiation factor 3 (eIF-3) complex, which is required for several steps in the initiation of protein synthesis. The eIF-3 complex associates with the 40S ribosome and facilitates the recruitment of eIF-1, eIF-1A, eIF-2:GTP:methionyl-tRNAi and eIF-5 to form the 43S pre-initiation complex (43S PIC). The eIF-3 complex stimulates mRNA recruitment to the 43S PIC and scanning of the mRNA for AUG recognition. The eIF-3 complex is also required for disassembly and recycling of post-termination ribosomal complexes and subsequently prevents premature joining of the 40S and 60S ribosomal subunits prior to initiation. The eIF-3 complex specifically targets and initiates translation of a subset of mRNAs involved in cell proliferation, including cell cycling, differentiation and apoptosis, and uses different modes of RNA stem-loop binding to exert either translational activation or repression.

AlphaFold DB (Q13347), UniProt , Accession A0A096NFN8, Species PAPAN (Papio anubis, Olive baboon), Gene EIF3I, Length 325 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	69.9	Low	92.1	Very high	135 Å²	135	92.7 Å²	92.7	67%	0.665	44%	0.441	S	S	*	.				0	171.8	0	-88.1	166.4	-94.2	0	0	111.3	D315	M1-D315 WeakPolarHBondContact CE-OD1 3.33Å; M1-D315 WeakPolarHBondContact CG-OD1 3.28Å; M1-D315 PolarHBondContact N-OD1 3.16Å; M1-D315 PolarHBondContact N-OD2 3.22Å
2	K	86.7	Confident	92.5	Very high	201 Å²	201	86.1 Å²	86.1	87%	0.874	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-70.9	136	165.4	-78.4	-173.4	178.5	-179.8	0	108.9
3	P	92.4	Very high	92.9	Very high	51 Å²	51	79.5 Å²	79.5	33%	0.331	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-71.8	153.7	176.7	29.4	-34	0	0	0	111.9	R310 I311	P3-R310 HydrophobicContact CB-CB 4.22Å; P3-I311 CarbonylContact C-O 3.56Å; P3-I311 WeakPolarHBondContact CA-O 3.09Å; P3-I311 VanDerWaalsContact CB-O 3.22Å; P3-I311 WeakPolarHBondContact CB-O 3.37Å
4	I	95.7	Very high	93.3	Very high	44 Å²	44	76.1 Å²	76.1	23%	0.226	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	128.2	165.7	-52.3	-176.4	0	0	0	107.5	L6 R310 I311 Y313	I4-L6 HydrophobicContact CG2-CD2 4.07Å; I4-R310 CarbonylContact O-C 3.59Å; I4-R310 WeakPolarHBondContact O-CA 3.45Å; I4-I311 HydrophobicContact CB-CB 4.13Å; I4-I311 HydrophobicContact CB-CG1 4.34Å; I4-I311 PolarHBondContact N-O 3.05Å; I4-I311 PolarHBondContact O-N 3.26Å; I4-Y313 HydrophobicContact CD1-CE2 3.81Å; I4-Y313 HydrophobicContact CG1-CE2 4.29Å
5	L	96.2	Very high	93.6	Very high	89 Å²	89	73.1 Å²	73.1	47%	0.466	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	118.7	-178	-174.3	70.5	0	0	0	110	Y308 R310	L5-Y308 HydrophobicContact CD1-CD1 3.64Å; L5-Y308 HydrophobicContact CD1-CE1 4.48Å; L5-Y308 HydrophobicContact CD1-CG 3.91Å; L5-Y308 HydrophobicContact CD2-CD1 3.96Å; L5-Y308 HydrophobicContact CD2-CE1 4.01Å; L5-Y308 HydrophobicContact CG-CD1 3.82Å; L5-Y308 HydrophobicContact CG-CE1 4.35Å; L5-R310 HydrophobicContact CD1-CG 3.72Å
6	L	97.3	Very high	93.9	Very high	2 Å²	2	68.8 Å²	68.8	1%	0.01	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	121.8	175.5	-42.1	-177.6	0	0	0	108.8	I4 L25 W37 G42 V309 I311	I4-L6 HydrophobicContact CG2-CD2 4.07Å; L6-L25 HydrophobicContact CD1-CD2 3.79Å; L6-W37 HydrophobicContact CB-CD2 4.09Å; L6-W37 HydrophobicContact CB-CE3 4.05Å; L6-W37 HydrophobicContact CB-CH2 4.18Å; L6-W37 HydrophobicContact CB-CZ2 4.19Å; L6-W37 HydrophobicContact CB-CZ3 4.07Å; L6-W37 HydrophobicContact CD1-CB 4.19Å; L6-W37 HydrophobicContact CD1-CD2 3.99Å; L6-W37 HydrophobicContact CD1-CE3 4.46Å; L6-W37 HydrophobicContact CD1-CG 3.83Å; L6-W37 HydrophobicContact CD2-CD2 4.4Å; L6-W37 HydrophobicContact CD2-CE3 4.06Å; L6-W37 HydrophobicContact CG-CD2 4.39Å; L6-W37 HydrophobicContact CG-CE3 4.41Å; L6-G42 WeakPolarHBondContact CD2-O 3.41Å; L6-V309 HydrophobicContact CB-CB 4.12Å; L6-V309 HydrophobicContact CD1-CB 4.05Å; L6-V309 HydrophobicContact CD1-CG1 3.92Å; L6-V309 HydrophobicContact CG-CB 4.31Å; L6-V309 HydrophobicContact CG-CG1 4.49Å; L6-V309 PolarHBondContact N-O 2.8Å; L6-V309 PolarHBondContact O-N 3.15Å; L6-I311 HydrophobicContact CD1-CD1 4.17Å; L6-I311 HydrophobicContact CD1-CG1 4.17Å; L6-I311 HydrophobicContact CD2-CD1 4.19Å; L6-I311 HydrophobicContact CD2-CG1 4.41Å; L6-I311 HydrophobicContact CG-CG1 4.34Å
7	Q	95.1	Very high	94.1	Very high	134 Å²	134	69.4 Å²	69.4	63%	0.626	33%	0.332	S	S	*	.			trans	-124.2	102.3	180	-176.1	178.1	-2.5	0	0	109.6	Y308	Q7-Y308 HydrophobicContact CB-CD1 4.03Å; Q7-Y308 HydrophobicContact CB-CE1 3.83Å; Q7-Y308 HydrophobicContact CG-CD1 4.2Å; Q7-Y308 HydrophobicContact CG-CE1 3.64Å
8	G	93.5	Very high	94.4	Very high	17 Å²	17	66.4 Å²	66.4	18%	0.175	32%	0.318	C	S	.	.			trans	-153.5	1.4	179.8	0	0	0	0	0	115.5	N35	G8-N35 PolarHBondContact O-ND2 2.65Å
9	H	96.3	Very high	94.5	Very high	18 Å²	18	63.4 Å²	63.4	8%	0.083	30%	0.303	C	S	.	.			trans	-116.4	147.8	173.8	-66.7	-80.4	0	0	0	109.4	I13 T27 A29 D31 I33 N35	H9-I13 HydrophobicContact CB-CD1 4Å; H9-T27 PolarHBondContact CE1-O 3.27Å; H9-T27 PolarHBondContact NE2-O 2.93Å; H9-T27 VanDerWaalsContact NE2-O 3.16Å; H9-T27 PolarHBondContact NE2-OG1 2.99Å; H9-A29 HydrophobicContact CB-CB 3.79Å; H9-A29 VanDerWaalsContact ND1-CB 3.32Å; H9-A29 WeakPolarHBondContact ND1-CB 3.44Å; H9-D31 WeakPolarHBondContact CA-OD2 3.43Å; H9-D31 VanDerWaalsContact CB-OD2 3.3Å; H9-D31 WeakPolarHBondContact CB-OD2 3.32Å; H9-D31 IonicContact CE1-OD1 2.68Å; H9-D31 IonicContact CG-OD2 3.16Å; H9-D31 IonicContact ND1-OD1 2.59Å; H9-D31 PolarHBondContact ND1-OD1 2.77Å; H9-D31 IonicContact ND1-OD2 2.86Å; H9-D31 PolarHBondContact ND1-OD2 3.07Å; H9-I33 PolarHBondContact CE1-O 3.03Å; H9-I33 VanDerWaalsContact CE1-O 3.24Å; H9-N35 PolarHBondContact CD2-ND2 2.89Å; H9-N35 PolarHBondContact CE1-ND2 2.73Å; H9-N35 PolarHBondContact NE2-ND2 2.96Å
10	E	93.9	Very high	94.5	Very high	174 Å²	174	66.3 Å²	66.3	81%	0.813	31%	0.311	S	S	*	.	S	Bend	trans	-96.8	-8.7	175.6	-63.2	-171.9	166.1	0	0	111.8	D31	E10-D31 PolarHBondContact N-OD2 3.3Å
11	R	96.3	Very high	94.5	Very high	155 Å²	155	68.7 Å²	68.7	59%	0.585	32%	0.322	S	S	*	.	S	Bend	trans	-129.6	164.8	-177.5	-60	-64.8	-177.3	156.4	0.9	111.1	I13 A29 K30 D31 G307	R11-I13 PolarHBondContact O-N 2.87Å; R11-A29 WeakPolarHBondContact O-CB 3.45Å; R11-K30 HydrophobicContact CB-CB 3.94Å; R11-D31 HydrophobicContact CB-CB 3.98Å; R11-D31 HydrophobicContact CG-CB 3.82Å; R11-D31 PolarHBondContact N-OD2 2.87Å; R11-G307 WeakPolarHBondContact O-CA 3.33Å
12	S	96.2	Very high	95.8	Very high	13 Å²	13	62.3 Å²	62.3	9%	0.091	29%	0.291	C	S	.	.			trans	-42.1	126.8	175.2	-30	0	0	0	0	113	A29 K30 E305	S12-A29 CarbonylContact O-C 3.55Å; S12-A29 WeakPolarHBondContact O-CA 3.29Å; S12-A29 VanDerWaalsContact O-CB 3.26Å; S12-A29 WeakPolarHBondContact O-CB 3.46Å; S12-K30 PolarHBondContact O-N 3.06Å; S12-K30 PolarHBondContact OG-NZ 3.16Å; S12-E305 VanDerWaalsContact CB-CD 3.41Å; S12-E305 WeakPolarHBondContact CB-OE1 3.21Å; S12-E305 VanDerWaalsContact CB-OE2 3.29Å; S12-E305 WeakPolarHBondContact CB-OE2 3.23Å; S12-E305 PolarHBondContact OG-OE1 3.14Å
13	I	98.2	Very high	96.3	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	138.7	174.6	-54.2	-58.5	0	0	0	109.3	H9 R11 I16 V28 A29 N289 G304 G307 V309	H9-I13 HydrophobicContact CB-CD1 4Å; R11-I13 PolarHBondContact O-N 2.87Å; I13-I16 HydrophobicContact CG2-CG2 3.72Å; I13-V28 WeakPolarHBondContact CG2-O 3.3Å; I13-A29 HydrophobicContact CD1-CB 4.24Å; I13-N289 WeakPolarHBondContact O-CB 3.36Å; I13-N289 PolarHBondContact O-ND2 2.74Å; I13-G304 PolarHBondContact N-O 2.68Å; I13-G307 WeakPolarHBondContact CD1-O 3.3Å; I13-V309 HydrophobicContact CD1-CG2 3.79Å; I13-V309 HydrophobicContact CG1-CG2 3.74Å; I13-V309 HydrophobicContact CG2-CG2 4.11Å
14	T	97.9	Very high	96.6	Very high	32 Å²	32	54.8 Å²	54.8	20%	0.196	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-47.7	-180	44.9	0	0	0	0	110.7	V28 A29 K30 V55	T14-V28 PolarHBondContact N-O 2.81Å; T14-V28 WeakPolarHBondContact OG1-CG2 3.23Å; T14-V28 PolarHBondContact OG1-O 3.48Å; T14-A29 WeakPolarHBondContact OG1-CA 3.35Å; T14-A29 PolarHBondContact OG1-N 2.92Å; T14-K30 HydrophobicContact CG2-CG 3.76Å; T14-V55 WeakPolarHBondContact CB-O 3.35Å; T14-V55 PolarHBondContact OG1-O 2.93Å
15	Q	98.2	Very high	96.7	Very high	32 Å²	32	52.7 Å²	52.7	15%	0.15	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	149	174.9	-162.8	174.1	41.5	0	0	111	V28 V58	Q15-V28 HydrophobicContact CB-CG2 3.72Å; Q15-V28 WeakPolarHBondContact O-CG2 3.33Å; Q15-V28 PolarHBondContact O-N 3.2Å; Q15-V58 PolarHBondContact OE1-O 2.9Å
16	I	98.3	Very high	96.8	Very high	3 Å²	3	48.4 Å²	48.4	2%	0.015	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	145.3	164.9	62.7	170.6	0	0	0	109.2	I13 L25 F26 T27 S290 A292 S301 V309	I13-I16 HydrophobicContact CG2-CG2 3.72Å; I16-L25 HydrophobicContact CB-CD1 4.21Å; I16-F26 WeakPolarHBondContact CA-O 3.29Å; I16-T27 HydrophobicContact CG2-CG2 3.96Å; I16-S290 PolarHBondContact N-OG 3.28Å; I16-S290 VanDerWaalsContact N-OG 3.11Å; I16-A292 HydrophobicContact CD1-CB 4.17Å; I16-A292 HydrophobicContact CG1-CB 4.18Å; I16-S301 VanDerWaalsContact CD1-C 3.49Å; I16-S301 VanDerWaalsContact CD1-CB 3.49Å; I16-S301 WeakPolarHBondContact CD1-O 3.33Å; I16-V309 HydrophobicContact CG2-CG1 4.11Å; I16-V309 HydrophobicContact CG2-CG2 3.69Å
17	K	98.1	Very high	96.9	Very high	79 Å²	79	48.4 Å²	48.4	34%	0.343	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	125.7	-179.6	-165.5	70	-173.4	-94.3	0	110.4	F26 V58 D59	K17-F26 PolarHBondContact N-O 2.78Å; K17-F26 PolarHBondContact O-N 3.49Å; K17-V58 HydrophobicContact CB-CG1 4.1Å; K17-D59 IonicContact NZ-OD1 3.42Å; K17-D59 PolarHBondContact NZ-OD1 2.92Å
18	Y	98.3	Very high	97	Very high	17 Å²	17	42 Å²	42	7%	0.067	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	150.6	167.2	-71.7	-74.4	0	0	0	110.3	L24 L25 A292 F293 H294 S301	Y18-L24 WeakPolarHBondContact CA-O 3.44Å; Y18-L25 HydrophobicContact CD1-CB 3.9Å; Y18-L25 HydrophobicContact CD1-CD1 3.86Å; Y18-L25 HydrophobicContact CD1-CG 4.35Å; Y18-L25 HydrophobicContact CD2-CD1 4.3Å; Y18-L25 HydrophobicContact CE1-CB 3.82Å; Y18-L25 HydrophobicContact CE1-CD1 3.85Å; Y18-L25 HydrophobicContact CE1-CD2 3.98Å; Y18-L25 HydrophobicContact CE1-CG 4.1Å; Y18-L25 HydrophobicContact CE2-CD1 4.32Å; Y18-L25 HydrophobicContact CG-CD1 4.09Å; Y18-A292 HydrophobicContact CD2-CB 4.06Å; Y18-A292 HydrophobicContact CE2-CB 4.19Å; Y18-F293 VanDerWaalsContact CD2-O 3.27Å; Y18-F293 WeakPolarHBondContact CD2-O 3.49Å; Y18-H294 AromaticContact CD1-CD2 3.95Å; Y18-H294 HydrophobicContact CE1-CB 4.49Å; Y18-H294 AromaticContact CE1-CD2 3.62Å; Y18-H294 HydrophobicContact CE2-CB 4.01Å; Y18-H294 AromaticContact CZ-CD2 3.93Å; Y18-S301 WeakPolarHBondContact OH-CB 3.33Å; Y18-S301 PolarHBondContact OH-OG 2.95Å
19	N	96.9	Very high	97.3	Very high	9 Å²	9	41.2 Å²	41.2	5%	0.048	19%	0.186	C	C	.	.			trans	-71.6	174	161.8	77.2	-37.8	0	0	0	111.3	E21 G22 D23 L24 F26 T64	N19-E21 PolarHBondContact O-N 3.3Å; N19-G22 PolarHBondContact O-N 3.47Å; N19-G22 WeakPolarHBondContact OD1-CA 3.32Å; N19-G22 PolarHBondContact OD1-N 3Å; N19-D23 PolarHBondContact ND2-OD1 2.86Å; N19-D23 PolarHBondContact OD1-N 2.88Å; N19-D23 PolarHBondContact OD1-OD1 3.49Å; N19-L24 HydrophobicContact CB-CB 4.33Å; N19-L24 PolarHBondContact N-O 3.27Å; N19-L24 PolarHBondContact OD1-N 2.95Å; N19-L24 PolarHBondContact OD1-O 2.79Å; N19-L24 VanDerWaalsContact OD1-O 3.12Å; N19-F26 HydrophobicContact CB-CE2 4.15Å; N19-T64 HydrophobicContact CB-CG2 3.76Å; N19-T64 PolarHBondContact ND2-OG1 3.24Å; N19-T64 VanDerWaalsContact ND2-OG1 3.16Å
20	R	94.4	Very high	97.3	Very high	121 Å²	121	44.5 Å²	44.5	46%	0.457	20%	0.2	S	C	.	.	S	Bend	trans	-52.9	-44.7	-178.7	-179.5	-163.4	129.9	154.3	-8.4	114.1	W62	R20-W62 WeakPolarHBondContact CD-O 3.49Å; R20-W62 HydrophobicContact CG-CD2 4.34Å; R20-W62 VanDerWaalsContact NH1-NE1 3.17Å
21	E	95.4	Very high	97.4	Very high	117 Å²	117	36.7 Å²	36.7	55%	0.547	16%	0.164	S	C	.	.	S	Bend	trans	-86.1	-15.6	-176.8	-61.2	-61.8	144.4	0	0	112.6	N19 D23	N19-E21 PolarHBondContact O-N 3.3Å; E21-D23 VanDerWaalsContact C-N 3.31Å; E21-D23 PolarHBondContact O-N 3.21Å
22	G	96.8	Very high	97.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	86	-10.6	177.3	0	0	0	0	0	115.1	N19 L24 S39 H294	N19-G22 PolarHBondContact O-N 3.47Å; N19-G22 WeakPolarHBondContact OD1-CA 3.32Å; N19-G22 PolarHBondContact OD1-N 3Å; G22-L24 VanDerWaalsContact C-N 3.26Å; G22-L24 PolarHBondContact O-N 2.88Å; G22-S39 WeakPolarHBondContact O-CB 3.42Å; G22-S39 PolarHBondContact O-OG 3.19Å; G22-H294 PolarHBondContact O-CD2 2.89Å; G22-H294 PolarHBondContact O-NE2 2.87Å
23	D	96.9	Very high	97.5	Very high	80 Å²	80	33.5 Å²	33.5	43%	0.428	16%	0.16	S	C	.	.	S	Bend	trans	-65.9	-26.2	-179.5	67.2	-46.8	0	0	0	113.3	N19 E21 Y38 S39	N19-D23 PolarHBondContact ND2-OD1 2.86Å; N19-D23 PolarHBondContact OD1-N 2.88Å; N19-D23 PolarHBondContact OD1-OD1 3.49Å; E21-D23 VanDerWaalsContact C-N 3.31Å; E21-D23 PolarHBondContact O-N 3.21Å; D23-Y38 WeakPolarHBondContact O-CA 3.46Å; D23-S39 WeakPolarHBondContact CA-OG 3.27Å; D23-S39 PolarHBondContact O-N 3.47Å; D23-S39 PolarHBondContact O-OG 2.96Å
24	L	98	Very high	97.5	Very high	14 Å²	14	33.5 Å²	33.5	7%	0.073	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	136.1	174.4	-59.1	-173.3	0	0	0	112.5	Y18 N19 G22 F26 V36 W37 Y38 L45 T64	Y18-L24 WeakPolarHBondContact CA-O 3.44Å; N19-L24 HydrophobicContact CB-CB 4.33Å; N19-L24 PolarHBondContact N-O 3.27Å; N19-L24 PolarHBondContact OD1-N 2.95Å; N19-L24 PolarHBondContact OD1-O 2.79Å; N19-L24 VanDerWaalsContact OD1-O 3.12Å; G22-L24 VanDerWaalsContact C-N 3.26Å; G22-L24 PolarHBondContact O-N 2.88Å; L24-F26 HydrophobicContact CB-CE2 4.37Å; L24-F26 HydrophobicContact CB-CZ 4.39Å; L24-F26 HydrophobicContact CD1-CZ 4.36Å; L24-V36 HydrophobicContact CB-CG2 4.18Å; L24-V36 HydrophobicContact CD1-CG2 4.15Å; L24-V36 HydrophobicContact CD2-CG2 4.24Å; L24-V36 HydrophobicContact CG-CG2 4.43Å; L24-W37 WeakPolarHBondContact CA-O 3.45Å; L24-Y38 HydrophobicContact CD2-CD1 3.84Å; L24-Y38 HydrophobicContact CD2-CE1 4.01Å; L24-L45 HydrophobicContact CD1-CD2 4.25Å; L24-L45 HydrophobicContact CD2-CD2 3.68Å; L24-T64 HydrophobicContact CD1-CG2 3.88Å
25	L	98.5	Very high	97.5	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	123	171.4	177.8	55.8	0	0	0	109.1	L6 I16 Y18 T27 V36 W37 V309 I311	L6-L25 HydrophobicContact CD1-CD2 3.79Å; I16-L25 HydrophobicContact CB-CD1 4.21Å; Y18-L25 HydrophobicContact CD1-CB 3.9Å; Y18-L25 HydrophobicContact CD1-CD1 3.86Å; Y18-L25 HydrophobicContact CD1-CG 4.35Å; Y18-L25 HydrophobicContact CD2-CD1 4.3Å; Y18-L25 HydrophobicContact CE1-CB 3.82Å; Y18-L25 HydrophobicContact CE1-CD1 3.85Å; Y18-L25 HydrophobicContact CE1-CD2 3.98Å; Y18-L25 HydrophobicContact CE1-CG 4.1Å; Y18-L25 HydrophobicContact CE2-CD1 4.32Å; Y18-L25 HydrophobicContact CG-CD1 4.09Å; L25-T27 HydrophobicContact CG-CG2 4.16Å; L25-V36 WeakPolarHBondContact O-CA 3.33Å; L25-W37 PolarHBondContact N-O 3.01Å; L25-W37 VanDerWaalsContact O-CD1 3.3Å; L25-W37 PolarHBondContact O-N 3.34Å; L25-V309 HydrophobicContact CD2-CG1 4.2Å; L25-I311 HydrophobicContact CD2-CD1 4.26Å; L25-I311 HydrophobicContact CD2-CG1 4.34Å
26	F	98.5	Very high	97.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	139.7	172.5	-58	-80.5	0	0	0	110.3	I16 K17 N19 L24 N35 V36 Y48 V58 A60 T64 V67	I16-F26 WeakPolarHBondContact CA-O 3.29Å; K17-F26 PolarHBondContact N-O 2.78Å; K17-F26 PolarHBondContact O-N 3.49Å; N19-F26 HydrophobicContact CB-CE2 4.15Å; L24-F26 HydrophobicContact CB-CE2 4.37Å; L24-F26 HydrophobicContact CB-CZ 4.39Å; L24-F26 HydrophobicContact CD1-CZ 4.36Å; F26-N35 WeakPolarHBondContact CA-O 3.46Å; F26-V36 HydrophobicContact CD1-CB 3.78Å; F26-V36 HydrophobicContact CD1-CG2 3.81Å; F26-V36 HydrophobicContact CE1-CB 3.76Å; F26-V36 HydrophobicContact CE1-CG2 3.46Å; F26-V36 VanDerWaalsContact CE1-CG2 3.46Å; F26-V36 HydrophobicContact CZ-CG2 4.07Å; F26-Y48 HydrophobicContact CD1-CE2 4.31Å; F26-Y48 HydrophobicContact CE1-CE2 4.26Å; F26-V58 HydrophobicContact CB-CG1 4.1Å; F26-V58 HydrophobicContact CB-CG2 3.84Å; F26-V58 HydrophobicContact CG-CG2 4.32Å; F26-A60 HydrophobicContact CD2-CB 4.11Å; F26-A60 HydrophobicContact CE2-CB 3.51Å; F26-A60 HydrophobicContact CZ-CB 4.1Å; F26-T64 HydrophobicContact CZ-CG2 4.36Å; F26-V67 HydrophobicContact CD1-CG1 4.26Å; F26-V67 HydrophobicContact CD1-CG2 4.26Å; F26-V67 HydrophobicContact CE1-CG1 4.33Å; F26-V67 HydrophobicContact CE1-CG2 3.52Å; F26-V67 HydrophobicContact CZ-CG2 3.74Å
27	T	98.5	Very high	97.5	Very high	1 Å²	1	31 Å²	31	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	135.2	179.8	69.3	0	0	0	0	110.8	H9 I16 L25 N35 W37 V309	H9-T27 PolarHBondContact CE1-O 3.27Å; H9-T27 PolarHBondContact NE2-O 2.93Å; H9-T27 VanDerWaalsContact NE2-O 3.16Å; H9-T27 PolarHBondContact NE2-OG1 2.99Å; I16-T27 HydrophobicContact CG2-CG2 3.96Å; L25-T27 HydrophobicContact CG-CG2 4.16Å; T27-N35 PolarHBondContact N-O 2.94Å; T27-N35 PolarHBondContact O-N 3.31Å; T27-W37 PolarHBondContact OG1-NE1 3.24Å; T27-V309 HydrophobicContact CG2-CB 4.33Å; T27-V309 HydrophobicContact CG2-CG1 4.35Å; T27-V309 HydrophobicContact CG2-CG2 3.76Å
28	V	98.5	Very high	97.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	155.3	177.4	-70.4	0	0	0	0	110.7	I13 T14 Q15 V34 V55 V58	I13-V28 WeakPolarHBondContact CG2-O 3.3Å; T14-V28 PolarHBondContact N-O 2.81Å; T14-V28 WeakPolarHBondContact OG1-CG2 3.23Å; T14-V28 PolarHBondContact OG1-O 3.48Å; Q15-V28 HydrophobicContact CB-CG2 3.72Å; Q15-V28 WeakPolarHBondContact O-CG2 3.33Å; Q15-V28 PolarHBondContact O-N 3.2Å; V28-V34 HydrophobicContact CG1-CB 4.19Å; V28-V34 HydrophobicContact CG1-CG1 3.78Å; V28-V34 HydrophobicContact CG1-CG2 4Å; V28-V55 HydrophobicContact CB-CB 3.96Å; V28-V55 HydrophobicContact CB-CG1 3.86Å; V28-V55 HydrophobicContact CG1-CB 4.03Å; V28-V55 HydrophobicContact CG1-CG1 3.55Å; V28-V55 HydrophobicContact CG2-CG1 4.49Å; V28-V58 HydrophobicContact CG1-CB 3.82Å; V28-V58 HydrophobicContact CG1-CG1 3.98Å; V28-V58 HydrophobicContact CG2-CB 4.17Å; V28-V58 HydrophobicContact CG2-CG1 3.74Å
29	A	98.2	Very high	97.4	Very high	0 Å²	0	31 Å²	31	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	178.7	-171.9	0	0	0	0	0	113.3	H9 R11 S12 I13 T14 D31 V55	H9-A29 HydrophobicContact CB-CB 3.79Å; H9-A29 VanDerWaalsContact ND1-CB 3.32Å; H9-A29 WeakPolarHBondContact ND1-CB 3.44Å; R11-A29 WeakPolarHBondContact O-CB 3.45Å; S12-A29 CarbonylContact O-C 3.55Å; S12-A29 WeakPolarHBondContact O-CA 3.29Å; S12-A29 VanDerWaalsContact O-CB 3.26Å; S12-A29 WeakPolarHBondContact O-CB 3.46Å; I13-A29 HydrophobicContact CD1-CB 4.24Å; T14-A29 WeakPolarHBondContact OG1-CA 3.35Å; T14-A29 PolarHBondContact OG1-N 2.92Å; A29-D31 PolarHBondContact O-N 3.12Å; A29-V55 CarbonylContact C-O 3.59Å; A29-V55 PolarHBondContact O-N 3.35Å
30	K	97.7	Very high	97.3	Very high	87 Å²	87	35.6 Å²	35.6	38%	0.378	17%	0.173	S	C	.	.	S	Bend	trans	-68.7	23.7	169.7	-56.6	177.5	-163.1	162.7	0	113	R11 S12 T14 A54 E251 E305	R11-K30 HydrophobicContact CB-CB 3.94Å; S12-K30 PolarHBondContact O-N 3.06Å; S12-K30 PolarHBondContact OG-NZ 3.16Å; T14-K30 HydrophobicContact CG2-CG 3.76Å; K30-A54 HydrophobicContact CB-CB 4.35Å; K30-E251 IonicContact NZ-OE1 2.84Å; K30-E305 IonicContact NZ-OE1 2.71Å; K30-E305 PolarHBondContact NZ-OE1 3.21Å; K30-E305 IonicContact NZ-OE2 3.45Å; K30-E305 PolarHBondContact NZ-OE2 2.92Å
31	D	96.7	Very high	97.3	Very high	10 Å²	10	33.7 Å²	33.7	5%	0.053	17%	0.171	C	C	.	.	S	Bend	trans	-124.6	169.4	173.7	65.6	33.2	0	0	0	109.8	H9 E10 R11 A29 I33 A54 V55	H9-D31 WeakPolarHBondContact CA-OD2 3.43Å; H9-D31 VanDerWaalsContact CB-OD2 3.3Å; H9-D31 WeakPolarHBondContact CB-OD2 3.32Å; H9-D31 IonicContact CE1-OD1 2.68Å; H9-D31 IonicContact CG-OD2 3.16Å; H9-D31 IonicContact ND1-OD1 2.59Å; H9-D31 PolarHBondContact ND1-OD1 2.77Å; H9-D31 IonicContact ND1-OD2 2.86Å; H9-D31 PolarHBondContact ND1-OD2 3.07Å; E10-D31 PolarHBondContact N-OD2 3.3Å; R11-D31 HydrophobicContact CB-CB 3.98Å; R11-D31 HydrophobicContact CG-CB 3.82Å; R11-D31 PolarHBondContact N-OD2 2.87Å; A29-D31 PolarHBondContact O-N 3.12Å; D31-I33 PolarHBondContact O-N 3.16Å; D31-I33 WeakPolarHBondContact OD1-CB 3.28Å; D31-I33 PolarHBondContact OD1-N 2.95Å; D31-A54 WeakPolarHBondContact O-CA 3.3Å; D31-V55 PolarHBondContact O-N 3.17Å; D31-V55 VanDerWaalsContact O-N 3.15Å
32	P	97.1	Very high	97.3	Very high	54 Å²	54	28.7 Å²	28.7	35%	0.351	15%	0.151	S	C	.	.	S	Bend	trans	-81.6	11.7	-175.4	32.9	-34.1	0	0	0	113.8	H51 G53	P32-H51 HydrophobicContact CB-CB 4.32Å; P32-H51 VanDerWaalsContact CB-O 3.3Å; P32-H51 WeakPolarHBondContact CB-O 3.47Å; P32-G53 WeakPolarHBondContact CA-O 3.41Å
33	I	97	Very high	97.3	Very high	48 Å²	48	34.1 Å²	34.1	25%	0.246	18%	0.177	C	C	.	.			trans	-98.5	139.8	-169.2	-54.3	-176.7	0	0	0	109.3	H9 D31 N35 T47	H9-I33 PolarHBondContact CE1-O 3.03Å; H9-I33 VanDerWaalsContact CE1-O 3.24Å; D31-I33 PolarHBondContact O-N 3.16Å; D31-I33 WeakPolarHBondContact OD1-CB 3.28Å; D31-I33 PolarHBondContact OD1-N 2.95Å; I33-N35 WeakPolarHBondContact CG2-ND2 3.48Å; I33-T47 HydrophobicContact CG2-CG2 3.46Å; I33-T47 VanDerWaalsContact CG2-CG2 3.46Å
34	V	98.1	Very high	97.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	115.5	169.6	-173.9	0	0	0	0	106.1	V28 T47 Y48 V55 V58 T69	V28-V34 HydrophobicContact CG1-CB 4.19Å; V28-V34 HydrophobicContact CG1-CG1 3.78Å; V28-V34 HydrophobicContact CG1-CG2 4Å; V34-T47 CarbonylContact O-C 3.59Å; V34-T47 VanDerWaalsContact O-CA 3.29Å; V34-T47 WeakPolarHBondContact O-CA 3.15Å; V34-Y48 HydrophobicContact CB-CD2 3.91Å; V34-Y48 HydrophobicContact CB-CG 4.47Å; V34-Y48 HydrophobicContact CG1-CD2 3.66Å; V34-Y48 HydrophobicContact CG1-CE2 4.35Å; V34-Y48 PolarHBondContact O-N 2.89Å; V34-V55 HydrophobicContact CG2-CG1 4.2Å; V34-V55 HydrophobicContact CG2-CG2 4.04Å; V34-V58 HydrophobicContact CG1-CG2 4.47Å; V34-T69 HydrophobicContact CG1-CG2 3.9Å; V34-T69 HydrophobicContact CG2-CG2 3.94Å
35	N	98.1	Very high	97.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	148.1	178.8	-66.8	-69.6	0	0	0	110.5	G8 H9 F26 T27 I33 W37 R44 T47	G8-N35 PolarHBondContact O-ND2 2.65Å; H9-N35 PolarHBondContact CD2-ND2 2.89Å; H9-N35 PolarHBondContact CE1-ND2 2.73Å; H9-N35 PolarHBondContact NE2-ND2 2.96Å; F26-N35 WeakPolarHBondContact CA-O 3.46Å; T27-N35 PolarHBondContact N-O 2.94Å; T27-N35 PolarHBondContact O-N 3.31Å; I33-N35 WeakPolarHBondContact CG2-ND2 3.48Å; N35-W37 HydrophobicContact CB-CZ2 3.77Å; N35-R44 VanDerWaalsContact OD1-CD 3.23Å; N35-R44 WeakPolarHBondContact OD1-CD 3.07Å; N35-R44 PolarHBondContact OD1-NH1 3.31Å; N35-T47 PolarHBondContact OD1-OG1 3.16Å
36	V	98.2	Very high	97	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.012	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	135.8	168.8	57.1	0	0	0	0	109.6	L24 L25 F26 L45 G46 Y48	L24-V36 HydrophobicContact CB-CG2 4.18Å; L24-V36 HydrophobicContact CD1-CG2 4.15Å; L24-V36 HydrophobicContact CD2-CG2 4.24Å; L24-V36 HydrophobicContact CG-CG2 4.43Å; L25-V36 WeakPolarHBondContact O-CA 3.33Å; F26-V36 HydrophobicContact CD1-CB 3.78Å; F26-V36 HydrophobicContact CD1-CG2 3.81Å; F26-V36 HydrophobicContact CE1-CB 3.76Å; F26-V36 HydrophobicContact CE1-CG2 3.46Å; F26-V36 VanDerWaalsContact CE1-CG2 3.46Å; F26-V36 HydrophobicContact CZ-CG2 4.07Å; V36-L45 HydrophobicContact CG1-CB 4.15Å; V36-L45 HydrophobicContact CG1-CD2 4.36Å; V36-L45 HydrophobicContact CG1-CG 4.21Å; V36-L45 HydrophobicContact CG2-CD2 4.23Å; V36-L45 PolarHBondContact O-N 2.62Å; V36-G46 PolarHBondContact N-O 3.36Å; V36-G46 PolarHBondContact O-N 3.41Å; V36-Y48 HydrophobicContact CB-CE2 4.13Å; V36-Y48 HydrophobicContact CG1-CE2 3.94Å
37	W	98.3	Very high	96.9	Very high	11 Å²	11	42.5 Å²	42.5	4%	0.042	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	145.4	-172.1	-47.9	83.8	0	0	0	110.5	L6 L24 L25 T27 N35 S39 E43 R44	L6-W37 HydrophobicContact CB-CD2 4.09Å; L6-W37 HydrophobicContact CB-CE3 4.05Å; L6-W37 HydrophobicContact CB-CH2 4.18Å; L6-W37 HydrophobicContact CB-CZ2 4.19Å; L6-W37 HydrophobicContact CB-CZ3 4.07Å; L6-W37 HydrophobicContact CD1-CB 4.19Å; L6-W37 HydrophobicContact CD1-CD2 3.99Å; L6-W37 HydrophobicContact CD1-CE3 4.46Å; L6-W37 HydrophobicContact CD1-CG 3.83Å; L6-W37 HydrophobicContact CD2-CD2 4.4Å; L6-W37 HydrophobicContact CD2-CE3 4.06Å; L6-W37 HydrophobicContact CG-CD2 4.39Å; L6-W37 HydrophobicContact CG-CE3 4.41Å; L24-W37 WeakPolarHBondContact CA-O 3.45Å; L25-W37 PolarHBondContact N-O 3.01Å; L25-W37 VanDerWaalsContact O-CD1 3.3Å; L25-W37 PolarHBondContact O-N 3.34Å; T27-W37 PolarHBondContact OG1-NE1 3.24Å; N35-W37 HydrophobicContact CB-CZ2 3.77Å; W37-S39 PolarHBondContact O-N 3.26Å; W37-E43 CarbonylContact C-O 3.6Å; W37-E43 VanDerWaalsContact CA-O 3.3Å; W37-E43 WeakPolarHBondContact CA-O 3.43Å; W37-R44 HydrophobicContact CD2-CB 4.27Å; W37-R44 HydrophobicContact CD2-CG 4.36Å; W37-R44 HydrophobicContact CE3-CB 3.61Å; W37-R44 HydrophobicContact CE3-CG 4.16Å; W37-R44 HydrophobicContact CH2-CB 4.13Å; W37-R44 HydrophobicContact CH2-CG 4.31Å; W37-R44 HydrophobicContact CZ3-CB 3.55Å; W37-R44 HydrophobicContact CZ3-CG 4.16Å
38	Y	97.7	Very high	96.9	Very high	93 Å²	93	42.7 Å²	42.7	37%	0.365	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	119.6	163	-71.6	-60.9	0	0	0	109.4	D23 L24 V40 N41 G42 E43 L45	D23-Y38 WeakPolarHBondContact O-CA 3.46Å; L24-Y38 HydrophobicContact CD2-CD1 3.84Å; L24-Y38 HydrophobicContact CD2-CE1 4.01Å; Y38-V40 VanDerWaalsContact C-N 3.29Å; Y38-V40 PolarHBondContact O-N 3.12Å; Y38-N41 VanDerWaalsContact CB-OD1 3.27Å; Y38-N41 WeakPolarHBondContact CB-OD1 3.42Å; Y38-N41 PolarHBondContact O-OD1 3.1Å; Y38-G42 VanDerWaalsContact O-CA 3.29Å; Y38-G42 WeakPolarHBondContact O-CA 3.09Å; Y38-G42 PolarHBondContact O-N 2.93Å; Y38-E43 HydrophobicContact CD2-CB 4.27Å; Y38-E43 PolarHBondContact N-O 2.75Å; Y38-L45 HydrophobicContact CD2-CB 4.34Å; Y38-L45 HydrophobicContact CE1-CD2 4.39Å; Y38-L45 HydrophobicContact CE2-CB 4.14Å; Y38-L45 HydrophobicContact CE2-CD1 4.04Å
39	S	96.1	Very high	96.7	Very high	4 Å²	4	50.1 Å²	50.1	3%	0.028	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-31.6	-175.4	65.4	0	0	0	0	113.5	G22 D23 W37 N41 I311 Y313	G22-S39 WeakPolarHBondContact O-CB 3.42Å; G22-S39 PolarHBondContact O-OG 3.19Å; D23-S39 WeakPolarHBondContact CA-OG 3.27Å; D23-S39 PolarHBondContact O-N 3.47Å; D23-S39 PolarHBondContact O-OG 2.96Å; W37-S39 PolarHBondContact O-N 3.26Å; S39-N41 PolarHBondContact O-N 2.8Å; S39-I311 WeakPolarHBondContact O-CD1 3.35Å; S39-Y313 PolarHBondContact O-OH 3.46Å
40	V	94.9	Very high	96.5	Very high	106 Å²	106	51.7 Å²	51.7	64%	0.642	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-33.9	-173.9	65.1	0	0	0	0	113.7	Y38	Y38-V40 VanDerWaalsContact C-N 3.29Å; Y38-V40 PolarHBondContact O-N 3.12Å
41	N	94.7	Very high	96.5	Very high	80 Å²	80	48 Å²	48	43%	0.428	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	-12.1	-174.8	70	-7.8	0	0	0	113.8	Y38 S39 E43	Y38-N41 VanDerWaalsContact CB-OD1 3.27Å; Y38-N41 WeakPolarHBondContact CB-OD1 3.42Å; Y38-N41 PolarHBondContact O-OD1 3.1Å; S39-N41 PolarHBondContact O-N 2.8Å; N41-E43 VanDerWaalsContact C-N 3.32Å; N41-E43 PolarHBondContact ND2-OE2 3.36Å; N41-E43 VanDerWaalsContact ND2-OE2 3.15Å; N41-E43 VanDerWaalsContact OD1-CB 3.3Å; N41-E43 WeakPolarHBondContact OD1-CB 3.4Å; N41-E43 PolarHBondContact OD1-N 3.34Å
42	G	95.2	Very high	96.5	Very high	12 Å²	12	53.2 Å²	53.2	12%	0.124	29%	0.289	C	S	.	.			trans	73.7	17	-176.2	0	0	0	0	0	115.1	L6 Y38	L6-G42 WeakPolarHBondContact CD2-O 3.41Å; Y38-G42 VanDerWaalsContact O-CA 3.29Å; Y38-G42 WeakPolarHBondContact O-CA 3.09Å; Y38-G42 PolarHBondContact O-N 2.93Å
43	E	96.3	Very high	96.4	Very high	115 Å²	115	51.6 Å²	51.6	54%	0.537	28%	0.281	S	S	.	.			trans	-72	136.3	173.5	-178.7	171	-170.5	0	0	110.4	W37 Y38 N41 L45	W37-E43 CarbonylContact C-O 3.6Å; W37-E43 VanDerWaalsContact CA-O 3.3Å; W37-E43 WeakPolarHBondContact CA-O 3.43Å; Y38-E43 HydrophobicContact CD2-CB 4.27Å; Y38-E43 PolarHBondContact N-O 2.75Å; N41-E43 VanDerWaalsContact C-N 3.32Å; N41-E43 PolarHBondContact ND2-OE2 3.36Å; N41-E43 VanDerWaalsContact ND2-OE2 3.15Å; N41-E43 VanDerWaalsContact OD1-CB 3.3Å; N41-E43 WeakPolarHBondContact OD1-CB 3.4Å; N41-E43 PolarHBondContact OD1-N 3.34Å; E43-L45 PolarHBondContact O-N 2.9Å
44	R	97.1	Very high	96.5	Very high	124 Å²	124	50.2 Å²	50.2	47%	0.468	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	110	176.8	-171.1	168.6	56.4	176.9	-2.9	109.8	N35 W37 T47	N35-R44 VanDerWaalsContact OD1-CD 3.23Å; N35-R44 WeakPolarHBondContact OD1-CD 3.07Å; N35-R44 PolarHBondContact OD1-NH1 3.31Å; W37-R44 HydrophobicContact CD2-CB 4.27Å; W37-R44 HydrophobicContact CD2-CG 4.36Å; W37-R44 HydrophobicContact CE3-CB 3.61Å; W37-R44 HydrophobicContact CE3-CG 4.16Å; W37-R44 HydrophobicContact CH2-CB 4.13Å; W37-R44 HydrophobicContact CH2-CG 4.31Å; W37-R44 HydrophobicContact CZ3-CB 3.55Å; W37-R44 HydrophobicContact CZ3-CG 4.16Å; R44-T47 PolarHBondContact NH1-OG1 3.01Å
45	L	95.6	Very high	96.5	Very high	75 Å²	75	50.2 Å²	50.2	39%	0.393	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	-42.2	172.7	170.9	59.1	0	0	0	111.1	L24 V36 Y38 E43	L24-L45 HydrophobicContact CD1-CD2 4.25Å; L24-L45 HydrophobicContact CD2-CD2 3.68Å; V36-L45 HydrophobicContact CG1-CB 4.15Å; V36-L45 HydrophobicContact CG1-CD2 4.36Å; V36-L45 HydrophobicContact CG1-CG 4.21Å; V36-L45 HydrophobicContact CG2-CD2 4.23Å; V36-L45 PolarHBondContact O-N 2.62Å; Y38-L45 HydrophobicContact CD2-CB 4.34Å; Y38-L45 HydrophobicContact CE1-CD2 4.39Å; Y38-L45 HydrophobicContact CE2-CB 4.14Å; Y38-L45 HydrophobicContact CE2-CD1 4.04Å; E43-L45 PolarHBondContact O-N 2.9Å
46	G	95.5	Very high	96.5	Very high	23 Å²	23	52.7 Å²	52.7	24%	0.237	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.5	-179.5	-176	0	0	0	0	0	115.3	V36	V36-G46 PolarHBondContact N-O 3.36Å; V36-G46 PolarHBondContact O-N 3.41Å
47	T	96.5	Very high	96.5	Very high	47 Å²	47	52.7 Å²	52.7	29%	0.288	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	122.9	-179.7	-59.7	0	0	0	0	109.6	I33 V34 N35 R44 M49	I33-T47 HydrophobicContact CG2-CG2 3.46Å; I33-T47 VanDerWaalsContact CG2-CG2 3.46Å; V34-T47 CarbonylContact O-C 3.59Å; V34-T47 VanDerWaalsContact O-CA 3.29Å; V34-T47 WeakPolarHBondContact O-CA 3.15Å; N35-T47 PolarHBondContact OD1-OG1 3.16Å; R44-T47 PolarHBondContact NH1-OG1 3.01Å; T47-M49 HydrophobicContact CG2-CG 4.13Å
48	Y	97	Very high	96.5	Very high	5 Å²	5	52.2 Å²	52.2	2%	0.02	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	125.6	172.5	-46.9	-91.6	0	0	0	109.1	F26 V34 V36 W79 C81	F26-Y48 HydrophobicContact CD1-CE2 4.31Å; F26-Y48 HydrophobicContact CE1-CE2 4.26Å; V34-Y48 HydrophobicContact CB-CD2 3.91Å; V34-Y48 HydrophobicContact CB-CG 4.47Å; V34-Y48 HydrophobicContact CG1-CD2 3.66Å; V34-Y48 HydrophobicContact CG1-CE2 4.35Å; V34-Y48 PolarHBondContact O-N 2.89Å; V36-Y48 HydrophobicContact CB-CE2 4.13Å; V36-Y48 HydrophobicContact CG1-CE2 3.94Å; Y48-W79 HydrophobicContact CD1-CB 3.72Å; Y48-W79 AromaticContact CD1-CD2 3.99Å; Y48-W79 HydrophobicContact CD1-CD2 3.99Å; Y48-W79 HydrophobicContact CD1-CE3 4.07Å; Y48-W79 AromaticContact CD1-CG 3.85Å; Y48-W79 HydrophobicContact CD1-CG 3.85Å; Y48-W79 HydrophobicContact CE1-CB 3.95Å; Y48-W79 HydrophobicContact CG-CD2 4.19Å; Y48-W79 HydrophobicContact CG-CE3 4.41Å; Y48-W79 HydrophobicContact CG-CG 4.24Å; Y48-C81 PolarHBondContact OH-O 2.77Å
49	M	94.4	Very high	96.5	Very high	157 Å²	157	48.7 Å²	48.7	77%	0.773	27%	0.273	S	S	*	.			trans	-117.8	128.9	-178.2	-67	-171.2	-70.9	0	0	110.3	T47	T47-M49 HydrophobicContact CG2-CG 4.13Å
50	G	94.1	Very high	96.5	Very high	32 Å²	32	49.2 Å²	49.2	33%	0.33	28%	0.277	S	S	.	.			trans	162.3	-24.1	174.4	0	0	0	0	0	114.4	R77	G50-R77 PolarHBondContact O-NH2 2.92Å
51	H	97.3	Very high	96.6	Very high	11 Å²	11	44.6 Å²	44.6	5%	0.051	25%	0.249	C	C	.	.			trans	-62.4	152.4	165.7	-79.2	-69.7	0	0	0	111.3	P32 V55 T69 S71 D73 S75 R77	P32-H51 HydrophobicContact CB-CB 4.32Å; P32-H51 VanDerWaalsContact CB-O 3.3Å; P32-H51 WeakPolarHBondContact CB-O 3.47Å; H51-V55 HydrophobicContact CB-CG2 3.91Å; H51-T69 PolarHBondContact NE2-OG1 3.21Å; H51-S71 WeakPolarHBondContact CE1-CB 3.24Å; H51-S71 WeakPolarHBondContact ND1-CB 3.47Å; H51-S71 PolarHBondContact ND1-OG 2.79Å; H51-D73 VanDerWaalsContact CA-OD2 3.24Å; H51-D73 WeakPolarHBondContact CA-OD2 3.33Å; H51-D73 IonicContact CE1-OD1 3.91Å; H51-D73 IonicContact CG-OD2 3.59Å; H51-D73 IonicContact ND1-OD1 3.82Å; H51-D73 PolarHBondContact ND1-OD1 2.85Å; H51-D73 VanDerWaalsContact ND1-OD1 3.17Å; H51-D73 IonicContact ND1-OD2 3.73Å; H51-D73 PolarHBondContact ND1-OD2 2.8Å; H51-S75 PolarHBondContact CE1-OG 2.86Å; H51-R77 PolarHBondContact CE1-NH1 3.39Å; H51-R77 VanDerWaalsContact CE1-NH1 3.35Å; H51-R77 PolarHBondContact ND1-NH1 3.15Å
52	T	96.9	Very high	96.5	Very high	119 Å²	119	46.5 Å²	46.5	73%	0.73	25%	0.25	S	S	*	.			trans	-119.8	-0.2	178.1	58.3	0	0	0	0	113.6	D73	T52-D73 PolarHBondContact N-OD2 3.04Å; T52-D73 WeakPolarHBondContact OG1-CB 3.36Å
53	G	96.4	Very high	96.4	Very high	19 Å²	19	50.4 Å²	50.4	20%	0.196	27%	0.268	C	S	.	.	S	Bend	trans	-142.9	172.6	176.8	0	0	0	0	0	111.7	P32 V55 S71	P32-G53 WeakPolarHBondContact CA-O 3.41Å; G53-V55 PolarHBondContact O-N 3.48Å; G53-S71 PolarHBondContact O-OG 2.88Å
54	A	97.7	Very high	96.4	Very high	20 Å²	20	46.3 Å²	46.3	17%	0.165	25%	0.251	C	S	.	.			trans	-44.6	122	179.7	0	0	0	0	0	112.9	K30 D31 S71 A72	K30-A54 HydrophobicContact CB-CB 4.35Å; D31-A54 WeakPolarHBondContact O-CA 3.3Å; A54-S71 WeakPolarHBondContact O-CA 3.23Å; A54-S71 PolarHBondContact O-OG 2.82Å; A54-A72 HydrophobicContact CB-CB 4.04Å; A54-A72 WeakPolarHBondContact O-CB 3.33Å; A54-A72 PolarHBondContact O-N 2.77Å
55	V	98.4	Very high	96.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	125.4	174.5	-170.7	0	0	0	0	108.6	T14 V28 A29 D31 V34 H51 G53 G70	T14-V55 WeakPolarHBondContact CB-O 3.35Å; T14-V55 PolarHBondContact OG1-O 2.93Å; V28-V55 HydrophobicContact CB-CB 3.96Å; V28-V55 HydrophobicContact CB-CG1 3.86Å; V28-V55 HydrophobicContact CG1-CB 4.03Å; V28-V55 HydrophobicContact CG1-CG1 3.55Å; V28-V55 HydrophobicContact CG2-CG1 4.49Å; A29-V55 CarbonylContact C-O 3.59Å; A29-V55 PolarHBondContact O-N 3.35Å; D31-V55 PolarHBondContact O-N 3.17Å; D31-V55 VanDerWaalsContact O-N 3.15Å; V34-V55 HydrophobicContact CG2-CG1 4.2Å; V34-V55 HydrophobicContact CG2-CG2 4.04Å; H51-V55 HydrophobicContact CB-CG2 3.91Å; G53-V55 PolarHBondContact O-N 3.48Å; V55-G70 WeakPolarHBondContact CG1-O 3.22Å
56	W	97.7	Very high	96.4	Very high	52 Å²	52	45 Å²	45	20%	0.197	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-27.6	-172.4	-67.1	-15.8	0	0	0	113.5	G70 A72 A95 V96 R97	W56-G70 PolarHBondContact N-O 3.5Å; W56-A72 HydrophobicContact CH2-CB 4.18Å; W56-A72 HydrophobicContact CZ2-CB 3.62Å; W56-A95 HydrophobicContact CE3-CB 4.18Å; W56-A95 HydrophobicContact CH2-CB 3.39Å; W56-A95 HydrophobicContact CZ2-CB 4.44Å; W56-A95 HydrophobicContact CZ3-CB 3.23Å; W56-V96 VanDerWaalsContact CE3-O 3.26Å; W56-R97 HydrophobicContact CE3-CG 4.19Å; W56-R97 VanDerWaalsContact CE3-CZ 3.44Å; W56-R97 HydrophobicContact CZ3-CG 4.13Å; W56-R97 VanDerWaalsContact CZ3-NE 3.27Å; W56-R97 VanDerWaalsContact CZ3-NH1 3.32Å
57	C	97.9	Very high	96.5	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.014	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	150.9	-178.5	51.6	0	0	0	0	112.3	T69 G70 T98 C99	C57-T69 WeakPolarHBondContact O-CA 3.3Å; C57-G70 PolarHBondContact N-O 3.33Å; C57-G70 PolarHBondContact O-N 3.31Å; C57-G70 VanDerWaalsContact SG-CA 3.57Å; C57-T98 VanDerWaalsContact SG-CA 3.52Å; C57-C99 PolarHBondContact SG-N 3.18Å
58	V	98.3	Very high	96.6	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	138.4	175	61.1	0	0	0	0	110.3	Q15 K17 F26 V28 V34 V67 L68 T69	Q15-V58 PolarHBondContact OE1-O 2.9Å; K17-V58 HydrophobicContact CB-CG1 4.1Å; F26-V58 HydrophobicContact CB-CG1 4.1Å; F26-V58 HydrophobicContact CB-CG2 3.84Å; F26-V58 HydrophobicContact CG-CG2 4.32Å; V28-V58 HydrophobicContact CG1-CB 3.82Å; V28-V58 HydrophobicContact CG1-CG1 3.98Å; V28-V58 HydrophobicContact CG2-CB 4.17Å; V28-V58 HydrophobicContact CG2-CG1 3.74Å; V34-V58 HydrophobicContact CG1-CG2 4.47Å; V58-V67 HydrophobicContact CG2-CG1 3.67Å; V58-L68 WeakPolarHBondContact CA-O 3.35Å; V58-T69 HydrophobicContact CB-CG2 4.17Å; V58-T69 HydrophobicContact CG2-CG2 3.84Å
59	D	97.9	Very high	96.7	Very high	18 Å²	18	41.4 Å²	41.4	10%	0.096	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	157.2	171	-159.2	34.7	0	0	0	110.5	K17 V67 L68 G100 F101	K17-D59 IonicContact NZ-OD1 3.42Å; K17-D59 PolarHBondContact NZ-OD1 2.92Å; D59-V67 CarbonylContact O-C 3.59Å; D59-V67 WeakPolarHBondContact O-CA 3.46Å; D59-V67 WeakPolarHBondContact O-CG1 3.39Å; D59-L68 PolarHBondContact N-O 3.46Å; D59-L68 PolarHBondContact O-N 3.02Å; D59-G100 WeakPolarHBondContact OD2-CA 3.35Å; D59-F101 HydrophobicContact CB-CD2 4.27Å; D59-F101 PolarHBondContact OD2-N 3.34Å
60	A	97.3	Very high	96.8	Very high	15 Å²	15	34 Å²	34	12%	0.124	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	144.8	176.1	0	0	0	0	0	109.6	F26 H66 F101	F26-A60 HydrophobicContact CD2-CB 4.11Å; F26-A60 HydrophobicContact CE2-CB 3.51Å; F26-A60 HydrophobicContact CZ-CB 4.1Å; A60-H66 WeakPolarHBondContact CA-O 3.23Å; A60-F101 VanDerWaalsContact C-CD2 3.48Å
61	D	95.6	Very high	97	Very high	10 Å²	10	32.4 Å²	32.4	5%	0.053	17%	0.168	C	C	.	.			trans	-69.8	164	177.9	75.6	-18.3	0	0	0	111.9	D63 T64 K65 H66 F101	D61-D63 PolarHBondContact O-N 2.81Å; D61-D63 VanDerWaalsContact O-N 3.16Å; D61-T64 PolarHBondContact O-N 3.33Å; D61-T64 VanDerWaalsContact OD1-CA 3.32Å; D61-T64 WeakPolarHBondContact OD1-CA 3.32Å; D61-T64 PolarHBondContact OD1-N 3.24Å; D61-K65 PolarHBondContact OD1-N 3.19Å; D61-H66 HydrophobicContact CB-CB 4.33Å; D61-H66 PolarHBondContact N-O 2.83Å; D61-H66 PolarHBondContact OD1-N 2.9Å; D61-H66 IonicContact OD2-CE1 2.9Å; D61-H66 IonicContact OD2-CG 2.69Å; D61-H66 IonicContact OD2-ND1 3.62Å; D61-H66 PolarHBondContact OD2-ND1 3.01Å; D61-F101 HydrophobicContact CB-CB 4.47Å; D61-F101 HydrophobicContact CB-CD1 3.81Å; D61-F101 HydrophobicContact CB-CD2 4.07Å; D61-F101 HydrophobicContact CB-CE1 3.94Å; D61-F101 HydrophobicContact CB-CE2 4.17Å; D61-F101 HydrophobicContact CB-CG 3.88Å; D61-F101 HydrophobicContact CB-CZ 4.11Å
62	W	93.2	Very high	97	Very high	119 Å²	119	33.7 Å²	33.7	45%	0.451	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.9	-172.5	-161.6	-107.9	0	0	0	113.3	R20 F103 M200	R20-W62 WeakPolarHBondContact CD-O 3.49Å; R20-W62 HydrophobicContact CG-CD2 4.34Å; R20-W62 VanDerWaalsContact NH1-NE1 3.17Å; W62-F103 HydrophobicContact CZ3-CD1 4.48Å; W62-M200 HydrophobicContact CH2-CE 4.47Å; W62-M200 HydrophobicContact CZ3-CE 4.43Å
63	D	93.7	Very high	97	Very high	95 Å²	95	29.6 Å²	29.6	51%	0.508	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-1	178.1	-79.8	1.4	0	0	0	113.4	D61 K65	D61-D63 PolarHBondContact O-N 2.81Å; D61-D63 VanDerWaalsContact O-N 3.16Å; D63-K65 HydrophobicContact CB-CD 3.85Å; D63-K65 HydrophobicContact CB-CG 4.09Å; D63-K65 PolarHBondContact O-N 3.16Å; D63-K65 IonicContact OD2-NZ 2.65Å; D63-K65 PolarHBondContact OD2-NZ 2.93Å
64	T	95.7	Very high	97	Very high	29 Å²	29	31.2 Å²	31.2	18%	0.178	16%	0.158	C	C	.	.	S	Bend	trans	54.6	34.8	-174.5	-37.8	0	0	0	0	113.6	N19 L24 F26 D61 C81	N19-T64 HydrophobicContact CB-CG2 3.76Å; N19-T64 PolarHBondContact ND2-OG1 3.24Å; N19-T64 VanDerWaalsContact ND2-OG1 3.16Å; L24-T64 HydrophobicContact CD1-CG2 3.88Å; F26-T64 HydrophobicContact CZ-CG2 4.36Å; D61-T64 PolarHBondContact O-N 3.33Å; D61-T64 VanDerWaalsContact OD1-CA 3.32Å; D61-T64 WeakPolarHBondContact OD1-CA 3.32Å; D61-T64 PolarHBondContact OD1-N 3.24Å; T64-C81 WeakPolarHBondContact O-CB 3.39Å
65	K	95.9	Very high	97	Very high	114 Å²	114	30.5 Å²	30.5	50%	0.496	15%	0.152	S	C	.	.	S	Bend	trans	-91.7	-31.9	173.2	-69.6	166	-175.5	155.3	0	111.7	D61 D63 C81	D61-K65 PolarHBondContact OD1-N 3.19Å; D63-K65 HydrophobicContact CB-CD 3.85Å; D63-K65 HydrophobicContact CB-CG 4.09Å; D63-K65 PolarHBondContact O-N 3.16Å; D63-K65 IonicContact OD2-NZ 2.65Å; D63-K65 PolarHBondContact OD2-NZ 2.93Å; K65-C81 WeakPolarHBondContact O-CB 3.36Å; K65-C81 PolarHBondContact O-N 3.02Å
66	H	97	Very high	96.9	Very high	57 Å²	57	30.5 Å²	30.5	26%	0.264	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142.5	-174.1	-50.7	105.3	0	0	0	111.8	A60 D61 L78 W79 F101	A60-H66 WeakPolarHBondContact CA-O 3.23Å; D61-H66 HydrophobicContact CB-CB 4.33Å; D61-H66 PolarHBondContact N-O 2.83Å; D61-H66 PolarHBondContact OD1-N 2.9Å; D61-H66 IonicContact OD2-CE1 2.9Å; D61-H66 IonicContact OD2-CG 2.69Å; D61-H66 IonicContact OD2-ND1 3.62Å; D61-H66 PolarHBondContact OD2-ND1 3.01Å; H66-L78 HydrophobicContact CB-CD1 4.05Å; H66-W79 VanDerWaalsContact CA-O 3.28Å; H66-W79 WeakPolarHBondContact CA-O 3.23Å; H66-F101 HydrophobicContact CB-CE1 4.04Å; H66-F101 HydrophobicContact CB-CZ 3.71Å
67	V	98	Very high	96.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	137.1	173.4	-174.7	0	0	0	0	108.3	F26 V58 D59 T69 L78 W79 C81	F26-V67 HydrophobicContact CD1-CG1 4.26Å; F26-V67 HydrophobicContact CD1-CG2 4.26Å; F26-V67 HydrophobicContact CE1-CG1 4.33Å; F26-V67 HydrophobicContact CE1-CG2 3.52Å; F26-V67 HydrophobicContact CZ-CG2 3.74Å; V58-V67 HydrophobicContact CG2-CG1 3.67Å; D59-V67 CarbonylContact O-C 3.59Å; D59-V67 WeakPolarHBondContact O-CA 3.46Å; D59-V67 WeakPolarHBondContact O-CG1 3.39Å; V67-T69 HydrophobicContact CG1-CG2 4.23Å; V67-L78 CarbonylContact O-C 3.59Å; V67-L78 WeakPolarHBondContact O-CA 3.34Å; V67-W79 HydrophobicContact CB-CB 4.3Å; V67-W79 PolarHBondContact N-O 3.01Å; V67-W79 PolarHBondContact O-N 3.22Å; V67-C81 HydrophobicContact CG2-CB 3.91Å
68	L	98.3	Very high	96.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.5	177.5	-171.3	70.9	0	0	0	108.7	V58 D59 C76 R77 L78 C99 F101 I108	V58-L68 WeakPolarHBondContact CA-O 3.35Å; D59-L68 PolarHBondContact N-O 3.46Å; D59-L68 PolarHBondContact O-N 3.02Å; L68-C76 WeakPolarHBondContact CD1-SG 3.41Å; L68-R77 WeakPolarHBondContact CA-O 3.22Å; L68-L78 HydrophobicContact CD1-CD1 4.16Å; L68-C99 HydrophobicContact CD2-CB 3.66Å; L68-C99 HydrophobicContact CG-CB 4.03Å; L68-F101 HydrophobicContact CB-CD2 4.18Å; L68-F101 HydrophobicContact CB-CE2 3.44Å; L68-F101 VanDerWaalsContact CB-CE2 3.44Å; L68-F101 HydrophobicContact CB-CZ 3.72Å; L68-I108 HydrophobicContact CD1-CB 4.48Å; L68-I108 HydrophobicContact CD1-CD1 3.77Å; L68-I108 HydrophobicContact CD1-CG2 4.28Å; L68-I108 HydrophobicContact CD2-CB 3.78Å; L68-I108 HydrophobicContact CD2-CD1 4.49Å; L68-I108 HydrophobicContact CD2-CG2 3.8Å
69	T	98.5	Very high	96.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	141.5	179.4	59.3	0	0	0	0	112	V34 H51 C57 V58 V67 C76 R77 W79	V34-T69 HydrophobicContact CG1-CG2 3.9Å; V34-T69 HydrophobicContact CG2-CG2 3.94Å; H51-T69 PolarHBondContact NE2-OG1 3.21Å; C57-T69 WeakPolarHBondContact O-CA 3.3Å; V58-T69 HydrophobicContact CB-CG2 4.17Å; V58-T69 HydrophobicContact CG2-CG2 3.84Å; V67-T69 HydrophobicContact CG1-CG2 4.23Å; T69-C76 CarbonylContact O-C 3.35Å; T69-C76 VanDerWaalsContact O-CA 3.23Å; T69-C76 WeakPolarHBondContact O-CA 3.49Å; T69-C76 PolarHBondContact O-SG 2.88Å; T69-R77 PolarHBondContact N-O 2.61Å; T69-R77 PolarHBondContact O-N 3.49Å; T69-W79 PolarHBondContact OG1-NE1 3.47Å
70	G	98	Very high	96.8	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	138.5	177.8	0	0	0	0	0	112.4	V55 W56 C57	V55-G70 WeakPolarHBondContact CG1-O 3.22Å; W56-G70 PolarHBondContact N-O 3.5Å; C57-G70 PolarHBondContact N-O 3.33Å; C57-G70 PolarHBondContact O-N 3.31Å; C57-G70 VanDerWaalsContact SG-CA 3.57Å
71	S	98	Very high	96.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	162.1	-169.2	173.9	0	0	0	0	114.9	H51 G53 A54 D73 N74 S75 V96	H51-S71 WeakPolarHBondContact CE1-CB 3.24Å; H51-S71 WeakPolarHBondContact ND1-CB 3.47Å; H51-S71 PolarHBondContact ND1-OG 2.79Å; G53-S71 PolarHBondContact O-OG 2.88Å; A54-S71 WeakPolarHBondContact O-CA 3.23Å; A54-S71 PolarHBondContact O-OG 2.82Å; S71-D73 VanDerWaalsContact CB-OD1 3.29Å; S71-D73 WeakPolarHBondContact CB-OD1 3.39Å; S71-D73 PolarHBondContact O-N 3.03Å; S71-D73 PolarHBondContact OG-N 3.04Å; S71-D73 VanDerWaalsContact OG-N 3.1Å; S71-D73 PolarHBondContact OG-OD1 2.96Å; S71-N74 PolarHBondContact O-N 3.23Å; S71-S75 PolarHBondContact N-O 2.89Å; S71-V96 PolarHBondContact O-N 2.86Å
72	A	97	Very high	96.8	Very high	37 Å²	37	39.2 Å²	39.2	31%	0.306	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-12.6	165.3	0	0	0	0	0	114.6	A54 W56 N74	A54-A72 HydrophobicContact CB-CB 4.04Å; A54-A72 WeakPolarHBondContact O-CB 3.33Å; A54-A72 PolarHBondContact O-N 2.77Å; W56-A72 HydrophobicContact CH2-CB 4.18Å; W56-A72 HydrophobicContact CZ2-CB 3.62Å; A72-N74 PolarHBondContact O-N 2.84Å
73	D	96.5	Very high	96.9	Very high	33 Å²	33	36.8 Å²	36.8	18%	0.176	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	12.9	174.5	73.6	-1	0	0	0	114.6	H51 T52 S71 S75 R77	H51-D73 VanDerWaalsContact CA-OD2 3.24Å; H51-D73 WeakPolarHBondContact CA-OD2 3.33Å; H51-D73 IonicContact CE1-OD1 3.91Å; H51-D73 IonicContact CG-OD2 3.59Å; H51-D73 IonicContact ND1-OD1 3.82Å; H51-D73 PolarHBondContact ND1-OD1 2.85Å; H51-D73 VanDerWaalsContact ND1-OD1 3.17Å; H51-D73 IonicContact ND1-OD2 3.73Å; H51-D73 PolarHBondContact ND1-OD2 2.8Å; T52-D73 PolarHBondContact N-OD2 3.04Å; T52-D73 WeakPolarHBondContact OG1-CB 3.36Å; S71-D73 VanDerWaalsContact CB-OD1 3.29Å; S71-D73 WeakPolarHBondContact CB-OD1 3.39Å; S71-D73 PolarHBondContact O-N 3.03Å; S71-D73 PolarHBondContact OG-N 3.04Å; S71-D73 VanDerWaalsContact OG-N 3.1Å; S71-D73 PolarHBondContact OG-OD1 2.96Å; D73-S75 WeakPolarHBondContact OD1-CB 3.27Å; D73-S75 PolarHBondContact OD1-N 3.13Å; D73-S75 PolarHBondContact OD1-OG 2.68Å; D73-R77 IonicContact OD1-NH1 2.77Å; D73-R77 IonicContact OD2-CZ 3.8Å; D73-R77 IonicContact OD2-NH1 3.61Å; D73-R77 PolarHBondContact OD2-NH1 2.86Å
74	N	96.2	Very high	96.9	Very high	53 Å²	53	33.6 Å²	33.6	28%	0.283	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	45.4	-177	-60.1	-12.4	0	0	0	112.6	S71 A72 T92 A95	S71-N74 PolarHBondContact O-N 3.23Å; A72-N74 PolarHBondContact O-N 2.84Å; N74-T92 WeakPolarHBondContact CA-OG1 3.22Å; N74-T92 WeakPolarHBondContact CB-O 3.08Å; N74-T92 PolarHBondContact O-N 3.26Å; N74-T92 PolarHBondContact O-OG1 3Å; N74-T92 VanDerWaalsContact O-OG1 3.11Å; N74-A95 WeakPolarHBondContact OD1-CA 3.44Å; N74-A95 PolarHBondContact OD1-N 2.85Å
75	S	97	Very high	97	Very high	5 Å²	5	38.7 Å²	38.7	4%	0.035	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	156.1	171.5	74.6	0	0	0	0	113.9	H51 S71 D73 R77 L90 V96	H51-S75 PolarHBondContact CE1-OG 2.86Å; S71-S75 PolarHBondContact N-O 2.89Å; D73-S75 WeakPolarHBondContact OD1-CB 3.27Å; D73-S75 PolarHBondContact OD1-N 3.13Å; D73-S75 PolarHBondContact OD1-OG 2.68Å; S75-R77 PolarHBondContact OG-NH1 2.79Å; S75-L90 CarbonylContact C-O 3.52Å; S75-L90 WeakPolarHBondContact CA-O 3.27Å; S75-L90 WeakPolarHBondContact CB-O 3.38Å; S75-V96 WeakPolarHBondContact O-CG2 3.32Å
76	C	97.5	Very high	97	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.5	161.6	-166.5	0	0	0	0	108.5	L68 T69 L90 V96 F110	L68-C76 WeakPolarHBondContact CD1-SG 3.41Å; T69-C76 CarbonylContact O-C 3.35Å; T69-C76 VanDerWaalsContact O-CA 3.23Å; T69-C76 WeakPolarHBondContact O-CA 3.49Å; T69-C76 PolarHBondContact O-SG 2.88Å; C76-L90 HydrophobicContact CB-CB 4.32Å; C76-L90 PolarHBondContact N-O 2.89Å; C76-L90 PolarHBondContact O-N 2.83Å; C76-V96 HydrophobicContact CB-CG1 4.49Å; C76-V96 HydrophobicContact CB-CG2 4.21Å; C76-F110 HydrophobicContact CB-CD1 3.87Å; C76-F110 HydrophobicContact CB-CE1 4.06Å; C76-F110 HydrophobicContact CB-CG 4.19Å
77	R	97.9	Very high	96.9	Very high	24 Å²	24	38.8 Å²	38.8	9%	0.091	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	136.4	-178	-74.6	-177.1	168.3	86.2	-2.2	110.8	G50 H51 L68 T69 D73 S75 W79 Q86 L89	G50-R77 PolarHBondContact O-NH2 2.92Å; H51-R77 PolarHBondContact CE1-NH1 3.39Å; H51-R77 VanDerWaalsContact CE1-NH1 3.35Å; H51-R77 PolarHBondContact ND1-NH1 3.15Å; L68-R77 WeakPolarHBondContact CA-O 3.22Å; T69-R77 PolarHBondContact N-O 2.61Å; T69-R77 PolarHBondContact O-N 3.49Å; D73-R77 IonicContact OD1-NH1 2.77Å; D73-R77 IonicContact OD2-CZ 3.8Å; D73-R77 IonicContact OD2-NH1 3.61Å; D73-R77 PolarHBondContact OD2-NH1 2.86Å; S75-R77 PolarHBondContact OG-NH1 2.79Å; R77-W79 HydrophobicContact CB-CZ2 3.73Å; R77-W79 HydrophobicContact CG-CZ2 4.17Å; R77-Q86 VanDerWaalsContact CD-OE1 3.29Å; R77-Q86 HydrophobicContact CG-CG 4.4Å; R77-L89 HydrophobicContact CG-CD1 3.71Å
78	L	97.5	Very high	96.8	Very high	13 Å²	13	39.1 Å²	39.1	7%	0.068	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	133.6	169.5	-170.9	72	0	0	0	108.6	H66 V67 L68 Q86 L87 A88 F101 L127	H66-L78 HydrophobicContact CB-CD1 4.05Å; V67-L78 CarbonylContact O-C 3.59Å; V67-L78 WeakPolarHBondContact O-CA 3.34Å; L68-L78 HydrophobicContact CD1-CD1 4.16Å; L78-Q86 CarbonylContact O-C 3.53Å; L78-L87 HydrophobicContact CB-CB 4.46Å; L78-L87 HydrophobicContact CD2-CB 4.16Å; L78-L87 HydrophobicContact CD2-CD1 4.37Å; L78-L87 HydrophobicContact CG-CB 4.31Å; L78-L87 HydrophobicContact CG-CD1 4.47Å; L78-L87 PolarHBondContact O-N 3.35Å; L78-A88 HydrophobicContact CB-CB 3.84Å; L78-A88 HydrophobicContact CD2-CB 4.39Å; L78-A88 PolarHBondContact N-O 3.46Å; L78-A88 VanDerWaalsContact N-O 3.1Å; L78-A88 PolarHBondContact O-N 2.94Å; L78-F101 HydrophobicContact CD1-CE1 3.85Å; L78-F101 HydrophobicContact CD1-CZ 3.62Å; L78-L127 HydrophobicContact CD1-CD1 4.25Å; L78-L127 HydrophobicContact CD2-CD1 4.04Å; L78-L127 HydrophobicContact CD2-CD2 3.99Å
79	W	97.9	Very high	96.7	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.008	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	146.4	-179	-47	89.4	0	0	0	110.9	Y48 H66 V67 T69 R77 K85 Q86	Y48-W79 HydrophobicContact CD1-CB 3.72Å; Y48-W79 AromaticContact CD1-CD2 3.99Å; Y48-W79 HydrophobicContact CD1-CD2 3.99Å; Y48-W79 HydrophobicContact CD1-CE3 4.07Å; Y48-W79 AromaticContact CD1-CG 3.85Å; Y48-W79 HydrophobicContact CD1-CG 3.85Å; Y48-W79 HydrophobicContact CE1-CB 3.95Å; Y48-W79 HydrophobicContact CG-CD2 4.19Å; Y48-W79 HydrophobicContact CG-CE3 4.41Å; Y48-W79 HydrophobicContact CG-CG 4.24Å; H66-W79 VanDerWaalsContact CA-O 3.28Å; H66-W79 WeakPolarHBondContact CA-O 3.23Å; V67-W79 HydrophobicContact CB-CB 4.3Å; V67-W79 PolarHBondContact N-O 3.01Å; V67-W79 PolarHBondContact O-N 3.22Å; T69-W79 PolarHBondContact OG1-NE1 3.47Å; R77-W79 HydrophobicContact CB-CZ2 3.73Å; R77-W79 HydrophobicContact CG-CZ2 4.17Å; W79-K85 CarbonylContact C-O 3.53Å; W79-K85 WeakPolarHBondContact CA-O 3.16Å; W79-Q86 HydrophobicContact CE3-CB 3.81Å; W79-Q86 HydrophobicContact CE3-CG 4.26Å; W79-Q86 HydrophobicContact CH2-CB 4.42Å; W79-Q86 HydrophobicContact CH2-CG 4.42Å; W79-Q86 HydrophobicContact CZ3-CB 3.67Å; W79-Q86 HydrophobicContact CZ3-CG 4.1Å
80	D	97	Very high	96.6	Very high	45 Å²	45	42 Å²	42	24%	0.241	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	121.1	162	177.4	-69.4	0	0	0	108.4	E82 T83 G84 K85 L87	D80-E82 PolarHBondContact O-N 2.85Å; D80-E82 PolarHBondContact OD1-N 2.98Å; D80-T83 WeakPolarHBondContact CB-OG1 3.48Å; D80-T83 WeakPolarHBondContact OD1-CB 3.37Å; D80-T83 WeakPolarHBondContact OD1-CG2 3.33Å; D80-T83 PolarHBondContact OD1-N 3.35Å; D80-T83 PolarHBondContact OD1-OG1 3.37Å; D80-G84 WeakPolarHBondContact O-CA 3.43Å; D80-G84 PolarHBondContact O-N 3.02Å; D80-K85 HydrophobicContact CB-CB 4.41Å; D80-K85 PolarHBondContact N-O 3.02Å; D80-L87 HydrophobicContact CB-CD1 4.01Å; D80-L87 HydrophobicContact CB-CD2 4.12Å; D80-L87 HydrophobicContact CB-CG 4Å
81	C	96.5	Very high	96.4	Very high	10 Å²	10	48.7 Å²	48.7	7%	0.068	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-35	-170	-170	0	0	0	0	112.9	Y48 T64 K65 V67	Y48-C81 PolarHBondContact OH-O 2.77Å; T64-C81 WeakPolarHBondContact O-CB 3.39Å; K65-C81 WeakPolarHBondContact O-CB 3.36Å; K65-C81 PolarHBondContact O-N 3.02Å; V67-C81 HydrophobicContact CG2-CB 3.91Å
82	E	95.1	Very high	96.2	Very high	187 Å²	187	49.7 Å²	49.7	87%	0.874	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-44.8	-176.7	-175.3	-175.4	166.4	0	0	111.7	D80	D80-E82 PolarHBondContact O-N 2.85Å; D80-E82 PolarHBondContact OD1-N 2.98Å
83	T	95.6	Very high	96	Very high	68 Å²	68	53.3 Å²	53.3	42%	0.417	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-10.2	-170	67.6	0	0	0	0	114.2	D80 K85	D80-T83 WeakPolarHBondContact CB-OG1 3.48Å; D80-T83 WeakPolarHBondContact OD1-CB 3.37Å; D80-T83 WeakPolarHBondContact OD1-CG2 3.33Å; D80-T83 PolarHBondContact OD1-N 3.35Å; D80-T83 PolarHBondContact OD1-OG1 3.37Å; T83-K85 PolarHBondContact O-N 2.69Å; T83-K85 WeakPolarHBondContact OG1-CG 3.39Å
84	G	94.8	Very high	95.8	Very high	28 Å²	28	51.9 Å²	51.9	29%	0.289	27%	0.265	S	S	.	.			trans	72.3	6.3	-177.9	0	0	0	0	0	114.8	D80	D80-G84 WeakPolarHBondContact O-CA 3.43Å; D80-G84 PolarHBondContact O-N 3.02Å
85	K	96.4	Very high	95.7	Very high	136 Å²	136	49.4 Å²	49.4	59%	0.591	25%	0.252	S	S	*	.			trans	-76.8	136.3	-176.3	-69.2	173.9	-174.1	164.7	0	111.2	W79 D80 T83 L87	W79-K85 CarbonylContact C-O 3.53Å; W79-K85 WeakPolarHBondContact CA-O 3.16Å; D80-K85 HydrophobicContact CB-CB 4.41Å; D80-K85 PolarHBondContact N-O 3.02Å; T83-K85 PolarHBondContact O-N 2.69Å; T83-K85 WeakPolarHBondContact OG1-CG 3.39Å; K85-L87 PolarHBondContact O-N 2.98Å
86	Q	96.5	Very high	95.7	Very high	84 Å²	84	49.1 Å²	49.1	39%	0.393	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	115.9	169.7	-165.1	-161.8	-92.2	0	0	109.2	R77 L78 W79	R77-Q86 VanDerWaalsContact CD-OE1 3.29Å; R77-Q86 HydrophobicContact CG-CG 4.4Å; L78-Q86 CarbonylContact O-C 3.53Å; W79-Q86 HydrophobicContact CE3-CB 3.81Å; W79-Q86 HydrophobicContact CE3-CG 4.26Å; W79-Q86 HydrophobicContact CH2-CB 4.42Å; W79-Q86 HydrophobicContact CH2-CG 4.42Å; W79-Q86 HydrophobicContact CZ3-CB 3.67Å; W79-Q86 HydrophobicContact CZ3-CG 4.1Å
87	L	95.3	Very high	95.6	Very high	90 Å²	90	52.7 Å²	52.7	47%	0.471	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-39.5	177.4	-65.3	177.1	0	0	0	111.9	L78 D80 K85	L78-L87 HydrophobicContact CB-CB 4.46Å; L78-L87 HydrophobicContact CD2-CB 4.16Å; L78-L87 HydrophobicContact CD2-CD1 4.37Å; L78-L87 HydrophobicContact CG-CB 4.31Å; L78-L87 HydrophobicContact CG-CD1 4.47Å; L78-L87 PolarHBondContact O-N 3.35Å; D80-L87 HydrophobicContact CB-CD1 4.01Å; D80-L87 HydrophobicContact CB-CD2 4.12Å; D80-L87 HydrophobicContact CB-CG 4Å; K85-L87 PolarHBondContact O-N 2.98Å
88	A	95	Very high	95.6	Very high	7 Å²	7	51.8 Å²	51.8	6%	0.058	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	153.3	-179.9	0	0	0	0	0	112.2	L78 I133	L78-A88 HydrophobicContact CB-CB 3.84Å; L78-A88 HydrophobicContact CD2-CB 4.39Å; L78-A88 PolarHBondContact N-O 3.46Å; L78-A88 VanDerWaalsContact N-O 3.1Å; L78-A88 PolarHBondContact O-N 2.94Å; A88-I133 HydrophobicContact CB-CD1 4.4Å; A88-I133 HydrophobicContact CB-CG2 3.61Å
89	L	95.6	Very high	95.6	Very high	57 Å²	57	51.5 Å²	51.5	30%	0.298	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	104.5	174.1	173.6	64	0	0	0	109.3	R77 K91	R77-L89 HydrophobicContact CG-CD1 3.71Å; L89-K91 HydrophobicContact CG-CG 4.38Å
90	L	96.3	Very high	95.5	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	118.2	175.5	-57.5	176.8	0	0	0	108.5	S75 C76 I108 F110 F125 I133 N136	S75-L90 CarbonylContact C-O 3.52Å; S75-L90 WeakPolarHBondContact CA-O 3.27Å; S75-L90 WeakPolarHBondContact CB-O 3.38Å; C76-L90 HydrophobicContact CB-CB 4.32Å; C76-L90 PolarHBondContact N-O 2.89Å; C76-L90 PolarHBondContact O-N 2.83Å; L90-I108 HydrophobicContact CD1-CD1 3.66Å; L90-F110 HydrophobicContact CB-CE1 4.27Å; L90-F110 HydrophobicContact CB-CZ 4.5Å; L90-F110 HydrophobicContact CD1-CE1 3.8Å; L90-F125 HydrophobicContact CD1-CD1 4.15Å; L90-F125 HydrophobicContact CD1-CD2 3.84Å; L90-F125 HydrophobicContact CD1-CE1 4.24Å; L90-F125 HydrophobicContact CD1-CE2 3.94Å; L90-F125 HydrophobicContact CD1-CG 3.95Å; L90-F125 HydrophobicContact CD1-CZ 4.13Å; L90-F125 HydrophobicContact CD2-CD1 4.03Å; L90-F125 HydrophobicContact CD2-CE1 3.7Å; L90-F125 HydrophobicContact CD2-CZ 4.05Å; L90-I133 HydrophobicContact CD2-CB 4.4Å; L90-I133 HydrophobicContact CD2-CG1 4.48Å; L90-I133 HydrophobicContact CD2-CG2 4.12Å; L90-N136 VanDerWaalsContact CA-OD1 3.27Å; L90-N136 WeakPolarHBondContact CA-OD1 3.47Å
91	K	95.2	Very high	95.5	Very high	140 Å²	140	50.1 Å²	50.1	61%	0.609	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	134.6	-178.9	-65.9	177.1	-176.5	169.4	0	110	L89 N136	L89-K91 HydrophobicContact CG-CG 4.38Å; K91-N136 PolarHBondContact N-OD1 2.82Å; K91-N136 PolarHBondContact O-ND2 3Å; K91-N136 PolarHBondContact O-OD1 3.31Å
92	T	93.9	Very high	95.4	Very high	21 Å²	21	51 Å²	51	13%	0.129	26%	0.256	C	S	.	.			trans	-118	162.7	178.4	60.2	0	0	0	0	110.8	N74 S94 V96 F110 T112	N74-T92 WeakPolarHBondContact CA-OG1 3.22Å; N74-T92 WeakPolarHBondContact CB-O 3.08Å; N74-T92 PolarHBondContact O-N 3.26Å; N74-T92 PolarHBondContact O-OG1 3Å; N74-T92 VanDerWaalsContact O-OG1 3.11Å; T92-S94 VanDerWaalsContact CB-O 3.29Å; T92-S94 WeakPolarHBondContact CB-O 3.37Å; T92-S94 PolarHBondContact OG1-O 2.86Å; T92-V96 HydrophobicContact CG2-CG2 3.8Å; T92-F110 HydrophobicContact CG2-CD2 4.3Å; T92-F110 HydrophobicContact CG2-CE2 3.41Å; T92-F110 VanDerWaalsContact CG2-CE2 3.41Å; T92-F110 HydrophobicContact CG2-CZ 3.84Å; T92-T112 HydrophobicContact CG2-CG2 3.98Å
93	N	91.4	Very high	95.1	Very high	113 Å²	113	45.1 Å²	45.1	60%	0.604	23%	0.228	S	C	*	.	S	Bend	trans	-83.7	-19.7	176.5	-66.5	-16.8	0	0	0	112.4	Y118	N93-Y118 HydrophobicContact CB-CD1 3.62Å; N93-Y118 HydrophobicContact CB-CD2 4.34Å; N93-Y118 HydrophobicContact CB-CE1 3.66Å; N93-Y118 HydrophobicContact CB-CE2 4.37Å; N93-Y118 HydrophobicContact CB-CG 3.98Å; N93-Y118 WeakPolarHBondContact O-CD2 3.32Å
94	S	93.1	Very high	94.7	Very high	2 Å²	2	44 Å²	44	1%	0.014	23%	0.23	C	C	.	.	S	Bend	trans	-144	162.5	177	58.7	0	0	0	0	110.2	T92 T112 D113	T92-S94 VanDerWaalsContact CB-O 3.29Å; T92-S94 WeakPolarHBondContact CB-O 3.37Å; T92-S94 PolarHBondContact OG1-O 2.86Å; S94-T112 WeakPolarHBondContact OG-CB 3.41Å; S94-D113 VanDerWaalsContact CB-O 3.27Å; S94-D113 WeakPolarHBondContact CB-O 3.47Å; S94-D113 PolarHBondContact OG-O 2.79Å
95	A	94.9	Very high	94.4	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.008	22%	0.223	C	C	.	.			trans	-61.7	145.5	-169.5	0	0	0	0	0	113.7	W56 N74 T112 D113	W56-A95 HydrophobicContact CE3-CB 4.18Å; W56-A95 HydrophobicContact CH2-CB 3.39Å; W56-A95 HydrophobicContact CZ2-CB 4.44Å; W56-A95 HydrophobicContact CZ3-CB 3.23Å; N74-A95 WeakPolarHBondContact OD1-CA 3.44Å; N74-A95 PolarHBondContact OD1-N 2.85Å; A95-T112 CarbonylContact O-C 3.48Å; A95-T112 WeakPolarHBondContact O-CA 3.48Å; A95-D113 PolarHBondContact O-N 2.92Å
96	V	96.8	Very high	94.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	119.5	-175.1	-179.8	0	0	0	0	110.7	W56 S71 S75 C76 T92 F110 S111	W56-V96 VanDerWaalsContact CE3-O 3.26Å; S71-V96 PolarHBondContact O-N 2.86Å; S75-V96 WeakPolarHBondContact O-CG2 3.32Å; C76-V96 HydrophobicContact CB-CG1 4.49Å; C76-V96 HydrophobicContact CB-CG2 4.21Å; T92-V96 HydrophobicContact CG2-CG2 3.8Å; V96-F110 HydrophobicContact CG1-CB 3.75Å; V96-F110 HydrophobicContact CG1-CD2 4.12Å; V96-F110 HydrophobicContact CG1-CG 4.17Å; V96-F110 HydrophobicContact CG2-CD2 4.2Å; V96-S111 CarbonylContact C-O 3.57Å; V96-S111 WeakPolarHBondContact CA-O 3.29Å
97	R	95.8	Very high	94.2	Very high	74 Å²	74	37.1 Å²	37.1	28%	0.279	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	-48.9	-170.5	-81.8	-75.6	173.5	-149.3	-3.4	114.1	W56 S111 D113	W56-R97 HydrophobicContact CE3-CG 4.19Å; W56-R97 VanDerWaalsContact CE3-CZ 3.44Å; W56-R97 HydrophobicContact CZ3-CG 4.13Å; W56-R97 VanDerWaalsContact CZ3-NE 3.27Å; W56-R97 VanDerWaalsContact CZ3-NH1 3.32Å; R97-S111 PolarHBondContact N-O 2.71Å; R97-D113 HydrophobicContact CG-CB 3.83Å; R97-D113 IonicContact CZ-OD2 2.68Å; R97-D113 IonicContact NE-OD2 2.69Å; R97-D113 PolarHBondContact NE-OD2 2.95Å; R97-D113 IonicContact NH2-OD2 3.63Å; R97-D113 PolarHBondContact NH2-OD2 3.35Å
98	T	96.9	Very high	94.2	Very high	6 Å²	6	32.9 Å²	32.9	4%	0.037	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	157.6	169.1	-174.6	0	0	0	0	109.9	C57 F110 S111 I149 A152	C57-T98 VanDerWaalsContact SG-CA 3.52Å; T98-F110 CarbonylContact O-C 3.58Å; T98-F110 WeakPolarHBondContact O-CA 3.16Å; T98-F110 VanDerWaalsContact O-CB 3.31Å; T98-F110 WeakPolarHBondContact O-CB 3.44Å; T98-S111 WeakPolarHBondContact CG2-OG 3.46Å; T98-S111 PolarHBondContact N-OG 3.03Å; T98-S111 PolarHBondContact O-N 3.05Å; T98-I149 HydrophobicContact CG2-CG2 4.32Å; T98-A152 HydrophobicContact CG2-CB 3.76Å; T98-A152 PolarHBondContact OG1-O 2.93Å; T98-A152 VanDerWaalsContact OG1-O 3.12Å
99	C	97.5	Very high	94.3	Very high	7 Å²	7	32.7 Å²	32.7	5%	0.047	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	156.3	171.7	69.2	0	0	0	0	109.5	C57 L68 M109 F110	C57-C99 PolarHBondContact SG-N 3.18Å; L68-C99 HydrophobicContact CD2-CB 3.66Å; L68-C99 HydrophobicContact CG-CB 4.03Å; C99-M109 CarbonylContact C-O 3.51Å; C99-M109 VanDerWaalsContact CA-O 3.27Å; C99-M109 WeakPolarHBondContact CA-O 3.17Å; C99-F110 HydrophobicContact CB-CB 3.81Å
100	G	96.7	Very high	94.3	Very high	3 Å²	3	30.1 Å²	30.1	3%	0.031	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.4	151.5	174.4	0	0	0	0	0	114.9	D59 M109 W154	D59-G100 WeakPolarHBondContact OD2-CA 3.35Å; G100-M109 PolarHBondContact N-O 3.04Å; G100-M109 PolarHBondContact O-N 2.82Å; G100-W154 PolarHBondContact O-NE1 2.78Å
101	F	96.5	Very high	94.3	Very high	14 Å²	14	30 Å²	30	6%	0.061	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	142.8	174.5	-67.7	-90.1	0	0	0	111.5	D59 A60 D61 H66 L68 L78 I108 L127 W154	D59-F101 HydrophobicContact CB-CD2 4.27Å; D59-F101 PolarHBondContact OD2-N 3.34Å; A60-F101 VanDerWaalsContact C-CD2 3.48Å; D61-F101 HydrophobicContact CB-CB 4.47Å; D61-F101 HydrophobicContact CB-CD1 3.81Å; D61-F101 HydrophobicContact CB-CD2 4.07Å; D61-F101 HydrophobicContact CB-CE1 3.94Å; D61-F101 HydrophobicContact CB-CE2 4.17Å; D61-F101 HydrophobicContact CB-CG 3.88Å; D61-F101 HydrophobicContact CB-CZ 4.11Å; H66-F101 HydrophobicContact CB-CE1 4.04Å; H66-F101 HydrophobicContact CB-CZ 3.71Å; L68-F101 HydrophobicContact CB-CD2 4.18Å; L68-F101 HydrophobicContact CB-CE2 3.44Å; L68-F101 VanDerWaalsContact CB-CE2 3.44Å; L68-F101 HydrophobicContact CB-CZ 3.72Å; L78-F101 HydrophobicContact CD1-CE1 3.85Å; L78-F101 HydrophobicContact CD1-CZ 3.62Å; F101-I108 HydrophobicContact CD1-CG2 3.41Å; F101-I108 VanDerWaalsContact CD1-CG2 3.41Å; F101-I108 HydrophobicContact CE1-CG2 3.51Å; F101-I108 HydrophobicContact CG-CG2 4.13Å; F101-I108 HydrophobicContact CZ-CG2 4.31Å; F101-L127 HydrophobicContact CE1-CD1 4.06Å; F101-W154 VanDerWaalsContact C-CD1 3.48Å; F101-W154 PolarHBondContact O-NE1 3.46Å
102	D	94.3	Very high	94.3	Very high	28 Å²	28	23.8 Å²	23.8	15%	0.15	13%	0.134	C	C	.	.			trans	-69.2	160.1	161.9	177.4	45.6	0	0	0	110.8	G104 G105 I107 W154 G158	D102-G104 PolarHBondContact O-N 2.59Å; D102-G104 VanDerWaalsContact O-N 3.09Å; D102-G105 PolarHBondContact O-N 3.26Å; D102-I107 HydrophobicContact CB-CB 3.98Å; D102-I107 PolarHBondContact N-O 3.11Å; D102-W154 HydrophobicContact CB-CD2 4.13Å; D102-W154 HydrophobicContact CB-CE3 4.32Å; D102-W154 HydrophobicContact CB-CH2 3.99Å; D102-W154 HydrophobicContact CB-CZ2 3.78Å; D102-W154 HydrophobicContact CB-CZ3 4.24Å; D102-G158 WeakPolarHBondContact OD1-CA 3.38Å
103	F	88.9	Confident	94.1	Very high	65 Å²	65	23.3 Å²	23.3	29%	0.285	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51	-35.2	-179.6	-69.5	-83.3	0	0	0	114.4	W62 G105 G155 M200	W62-F103 HydrophobicContact CZ3-CD1 4.48Å; F103-G105 PolarHBondContact O-N 3.34Å; F103-G155 WeakPolarHBondContact CE2-O 3.29Å; F103-M200 HydrophobicContact CE1-CE 3.55Å; F103-M200 HydrophobicContact CE1-SD 3.55Å; F103-M200 VanDerWaalsContact CE1-SD 3.55Å; F103-M200 HydrophobicContact CZ-CE 3.92Å; F103-M200 HydrophobicContact CZ-CG 4.37Å; F103-M200 HydrophobicContact CZ-SD 3.62Å
104	G	87.5	Confident	93.9	Very high	45 Å²	45	22.7 Å²	22.7	46%	0.464	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-6.1	178.4	0	0	0	0	0	114.7	D102 N106	D102-G104 PolarHBondContact O-N 2.59Å; D102-G104 VanDerWaalsContact O-N 3.09Å; G104-N106 PolarHBondContact O-N 3.21Å; G104-N106 PolarHBondContact O-ND2 3.48Å
105	G	88.8	Confident	93.4	Very high	12 Å²	12	26.1 Å²	26.1	12%	0.124	14%	0.138	C	C	.	.	S	Bend	trans	66.2	-2.4	-171.3	0	0	0	0	0	114.8	D102 F103	D102-G105 PolarHBondContact O-N 3.26Å; F103-G105 PolarHBondContact O-N 3.34Å
106	N	92.4	Very high	92.6	Very high	61 Å²	61	35.4 Å²	35.4	33%	0.326	18%	0.184	S	C	.	.	S	Bend	trans	-86.7	-31.5	-173.7	-61.3	-67	0	0	0	113.1	G104 L127 R128	G104-N106 PolarHBondContact O-N 3.21Å; G104-N106 PolarHBondContact O-ND2 3.48Å; N106-L127 WeakPolarHBondContact O-CB 3.41Å; N106-L127 PolarHBondContact O-N 2.75Å; N106-R128 HydrophobicContact CB-CG 4.19Å; N106-R128 WeakPolarHBondContact OD1-CD 3.32Å
107	I	94.9	Very high	91.8	Very high	30 Å²	30	39.4 Å²	39.4	15%	0.154	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	134.8	-177.3	-59.2	171.4	0	0	0	108.1	D102 F124 F125 Y139 W154	D102-I107 HydrophobicContact CB-CB 3.98Å; D102-I107 PolarHBondContact N-O 3.11Å; I107-F124 HydrophobicContact CG2-CD1 4.44Å; I107-F125 WeakPolarHBondContact CA-O 3.28Å; I107-Y139 HydrophobicContact CG2-CE1 4.2Å; I107-W154 HydrophobicContact CG2-CH2 3.88Å; I107-W154 HydrophobicContact CG2-CZ2 3.93Å
108	I	96.1	Very high	91.2	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	142.6	167.6	56.2	168.4	0	0	0	109.5	L68 L90 F101 F124 F125 L127	L68-I108 HydrophobicContact CD1-CB 4.48Å; L68-I108 HydrophobicContact CD1-CD1 3.77Å; L68-I108 HydrophobicContact CD1-CG2 4.28Å; L68-I108 HydrophobicContact CD2-CB 3.78Å; L68-I108 HydrophobicContact CD2-CD1 4.49Å; L68-I108 HydrophobicContact CD2-CG2 3.8Å; L90-I108 HydrophobicContact CD1-CD1 3.66Å; F101-I108 HydrophobicContact CD1-CG2 3.41Å; F101-I108 VanDerWaalsContact CD1-CG2 3.41Å; F101-I108 HydrophobicContact CE1-CG2 3.51Å; F101-I108 HydrophobicContact CG-CG2 4.13Å; F101-I108 HydrophobicContact CZ-CG2 4.31Å; I108-F124 WeakPolarHBondContact O-CA 3.39Å; I108-F125 HydrophobicContact CD1-CB 4.23Å; I108-F125 HydrophobicContact CG1-CB 3.84Å; I108-F125 PolarHBondContact N-O 3.1Å; I108-F125 PolarHBondContact O-N 2.9Å; I108-L127 HydrophobicContact CD1-CD2 3.86Å; I108-L127 HydrophobicContact CG1-CD2 4.02Å; I108-L127 HydrophobicContact CG1-CG 4.41Å; I108-L127 HydrophobicContact CG2-CD1 3.92Å; I108-L127 HydrophobicContact CG2-CD2 4.47Å; I108-L127 HydrophobicContact CG2-CG 4.27Å
109	M	96	Very high	90.7	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	154.5	163.3	67	146.3	175.4	0	0	110.9	C99 G100 V122 S123 F124 W154 I161	C99-M109 CarbonylContact C-O 3.51Å; C99-M109 VanDerWaalsContact CA-O 3.27Å; C99-M109 WeakPolarHBondContact CA-O 3.17Å; G100-M109 PolarHBondContact N-O 3.04Å; G100-M109 PolarHBondContact O-N 2.82Å; M109-V122 HydrophobicContact CB-CG1 4.24Å; M109-V122 HydrophobicContact SD-CG1 4.19Å; M109-S123 VanDerWaalsContact CA-O 3.3Å; M109-S123 WeakPolarHBondContact CA-O 3.42Å; M109-F124 HydrophobicContact CB-CD1 3.96Å; M109-F124 HydrophobicContact CB-CE1 3.97Å; M109-F124 HydrophobicContact CB-CG 4.49Å; M109-F124 HydrophobicContact CB-CZ 4.49Å; M109-W154 HydrophobicContact CB-CZ2 4.04Å; M109-W154 HydrophobicContact CE-CG 4.33Å; M109-W154 HydrophobicContact CG-CZ2 4.01Å; M109-I161 HydrophobicContact CE-CD1 3.83Å; M109-I161 HydrophobicContact CE-CG2 4.1Å; M109-I161 HydrophobicContact CG-CD1 4.28Å; M109-I161 HydrophobicContact SD-CB 4.47Å; M109-I161 HydrophobicContact SD-CD1 3.49Å; M109-I161 WeakPolarHBondContact SD-CD1 3.42Å; M109-I161 HydrophobicContact SD-CG1 3.84Å; M109-I161 HydrophobicContact SD-CG2 3.76Å
110	F	97	Very high	90.4	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	153.4	160.5	61.7	-100	0	0	0	111.5	C76 L90 T92 V96 T98 C99 T112 V122 S123 F125	C76-F110 HydrophobicContact CB-CD1 3.87Å; C76-F110 HydrophobicContact CB-CE1 4.06Å; C76-F110 HydrophobicContact CB-CG 4.19Å; L90-F110 HydrophobicContact CB-CE1 4.27Å; L90-F110 HydrophobicContact CB-CZ 4.5Å; L90-F110 HydrophobicContact CD1-CE1 3.8Å; T92-F110 HydrophobicContact CG2-CD2 4.3Å; T92-F110 HydrophobicContact CG2-CE2 3.41Å; T92-F110 VanDerWaalsContact CG2-CE2 3.41Å; T92-F110 HydrophobicContact CG2-CZ 3.84Å; V96-F110 HydrophobicContact CG1-CB 3.75Å; V96-F110 HydrophobicContact CG1-CD2 4.12Å; V96-F110 HydrophobicContact CG1-CG 4.17Å; V96-F110 HydrophobicContact CG2-CD2 4.2Å; T98-F110 CarbonylContact O-C 3.58Å; T98-F110 WeakPolarHBondContact O-CA 3.16Å; T98-F110 VanDerWaalsContact O-CB 3.31Å; T98-F110 WeakPolarHBondContact O-CB 3.44Å; C99-F110 HydrophobicContact CB-CB 3.81Å; F110-T112 HydrophobicContact CD2-CG2 4.24Å; F110-T112 HydrophobicContact CE2-CG2 4.1Å; F110-V122 WeakPolarHBondContact O-CA 3.37Å; F110-S123 PolarHBondContact N-O 3.01Å; F110-S123 PolarHBondContact O-N 2.85Å; F110-F125 AromaticContact CE1-CD2 3.74Å; F110-F125 HydrophobicContact CE1-CD2 3.74Å; F110-F125 AromaticContact CE1-CE2 3.37Å; F110-F125 HydrophobicContact CE1-CE2 3.37Å; F110-F125 HydrophobicContact CE1-CZ 4.38Å; F110-F125 HydrophobicContact CZ-CD2 4.34Å; F110-F125 AromaticContact CZ-CE2 3.54Å; F110-F125 HydrophobicContact CZ-CE2 3.54Å; F110-F125 HydrophobicContact CZ-CZ 4.33Å
111	S	95.9	Very high	90.2	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	147.5	174.2	78.7	0	0	0	0	112.3	V96 R97 T98 F121	V96-S111 CarbonylContact C-O 3.57Å; V96-S111 WeakPolarHBondContact CA-O 3.29Å; R97-S111 PolarHBondContact N-O 2.71Å; T98-S111 WeakPolarHBondContact CG2-OG 3.46Å; T98-S111 PolarHBondContact N-OG 3.03Å; T98-S111 PolarHBondContact O-N 3.05Å; S111-F121 CarbonylContact C-O 3.59Å; S111-F121 WeakPolarHBondContact CA-O 3.3Å
112	T	94.8	Very high	90.2	Very high	10 Å²	10	47.6 Å²	47.6	6%	0.061	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	147.3	177.9	64.2	0	0	0	0	112.3	T92 S94 A95 F110 C120 F121	T92-T112 HydrophobicContact CG2-CG2 3.98Å; S94-T112 WeakPolarHBondContact OG-CB 3.41Å; A95-T112 CarbonylContact O-C 3.48Å; A95-T112 WeakPolarHBondContact O-CA 3.48Å; F110-T112 HydrophobicContact CD2-CG2 4.24Å; F110-T112 HydrophobicContact CE2-CG2 4.1Å; T112-C120 WeakPolarHBondContact O-CA 3.36Å; T112-C120 WeakPolarHBondContact O-CB 3.33Å; T112-C120 PolarHBondContact O-SG 2.74Å; T112-F121 PolarHBondContact N-O 3.15Å; T112-F121 PolarHBondContact OG1-N 3.26Å; T112-F121 VanDerWaalsContact OG1-N 3.16Å
113	D	90.8	Very high	90.2	Very high	11 Å²	11	46.8 Å²	46.8	6%	0.059	26%	0.256	C	S	.	.			trans	-69.6	151.5	176.3	-156.1	-10.5	0	0	0	111.7	S94 A95 R97 Q115 K148	S94-D113 VanDerWaalsContact CB-O 3.27Å; S94-D113 WeakPolarHBondContact CB-O 3.47Å; S94-D113 PolarHBondContact OG-O 2.79Å; A95-D113 PolarHBondContact O-N 2.92Å; R97-D113 HydrophobicContact CG-CB 3.83Å; R97-D113 IonicContact CZ-OD2 2.68Å; R97-D113 IonicContact NE-OD2 2.69Å; R97-D113 PolarHBondContact NE-OD2 2.95Å; R97-D113 IonicContact NH2-OD2 3.63Å; R97-D113 PolarHBondContact NH2-OD2 3.35Å; D113-Q115 HydrophobicContact CB-CG 4.47Å; D113-Q115 PolarHBondContact O-N 2.81Å; D113-K148 WeakPolarHBondContact OD1-CD 3.49Å; D113-K148 WeakPolarHBondContact OD1-CE 3.4Å; D113-K148 IonicContact OD1-NZ 2.92Å; D113-K148 PolarHBondContact OD1-NZ 3.04Å; D113-K148 IonicContact OD2-NZ 3.85Å
114	K	86.7	Confident	90.6	Very high	100 Å²	100	43.7 Å²	43.7	44%	0.435	24%	0.243	S	C	.	.			trans	-82.2	110.2	170.7	-172.7	170.6	179.2	172.3	0	108.1	C120 N145 K148	K114-C120 HydrophobicContact CB-CB 4.28Å; K114-N145 PolarHBondContact NZ-O 3.22Å; K114-K148 HydrophobicContact CB-CB 3.96Å; K114-K148 HydrophobicContact CB-CD 4.41Å
115	Q	82.5	Confident	91	Very high	75 Å²	75	41.7 Å²	41.7	35%	0.35	22%	0.221	S	C	.	.	B	Isolated β-bridge	trans	-116.3	166.9	178.3	-66.7	-175.5	3.2	0	0	109.9	D113 G117 Y118	D113-Q115 HydrophobicContact CB-CG 4.47Å; D113-Q115 PolarHBondContact O-N 2.81Å; Q115-G117 PolarHBondContact O-N 2.64Å; Q115-Y118 PolarHBondContact N-O 3.01Å; Q115-Y118 VanDerWaalsContact N-O 3.17Å; Q115-Y118 PolarHBondContact O-N 3.19Å
116	M	77.9	Confident	91.2	Very high	196 Å²	196	42.4 Å²	42.4	97%	0.966	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	114.1	179.8	-72	-168.8	178.2	0	0	110.7
117	G	79	Confident	91.3	Very high	84 Å²	84	41.2 Å²	41.2	87%	0.866	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.6	-10	-177.2	0	0	0	0	0	116	Q115	Q115-G117 PolarHBondContact O-N 2.64Å
118	Y	83.8	Confident	91.2	Very high	113 Å²	113	47.2 Å²	47.2	44%	0.443	24%	0.237	S	C	.	.	B	Isolated β-bridge	trans	-122.9	126.8	-177.7	-61.3	-61.5	0	0	0	112.5	N93 Q115	N93-Y118 HydrophobicContact CB-CD1 3.62Å; N93-Y118 HydrophobicContact CB-CD2 4.34Å; N93-Y118 HydrophobicContact CB-CE1 3.66Å; N93-Y118 HydrophobicContact CB-CE2 4.37Å; N93-Y118 HydrophobicContact CB-CG 3.98Å; N93-Y118 WeakPolarHBondContact O-CD2 3.32Å; Q115-Y118 PolarHBondContact N-O 3.01Å; Q115-Y118 VanDerWaalsContact N-O 3.17Å; Q115-Y118 PolarHBondContact O-N 3.19Å
119	Q	87.1	Confident	91	Very high	102 Å²	102	50 Å²	50	48%	0.477	25%	0.251	S	S	.	.			trans	-74.5	154.9	175.6	-71.2	170.8	-34.3	0	0	111.6	F121 N145	Q119-F121 HydrophobicContact CB-CD2 4.29Å; Q119-F121 HydrophobicContact CB-CE2 3.64Å; Q119-F121 HydrophobicContact CB-CZ 4.01Å; Q119-F121 WeakPolarHBondContact O-CD2 3.35Å; Q119-N145 PolarHBondContact NE2-OD1 2.89Å; Q119-N145 VanDerWaalsContact NE2-OD1 3.1Å
120	C	91.1	Very high	90.7	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	131.2	168	175.3	0	0	0	0	108.6	T112 K114 C144 K148 I149	T112-C120 WeakPolarHBondContact O-CA 3.36Å; T112-C120 WeakPolarHBondContact O-CB 3.33Å; T112-C120 PolarHBondContact O-SG 2.74Å; K114-C120 HydrophobicContact CB-CB 4.28Å; C120-C144 HydrophobicContact CB-CB 3.98Å; C120-C144 PolarHBondContact O-N 2.98Å; C120-K148 HydrophobicContact CB-CB 4.2Å; C120-I149 PolarHBondContact SG-N 3.2Å; C120-I149 VanDerWaalsContact SG-N 3.41Å
121	F	93.1	Very high	90.5	Very high	60 Å²	60	56 Å²	56	26%	0.263	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	149.5	172.7	-67.7	-88.4	0	0	0	110.4	S111 T112 Q119 K141 I142 P143	S111-F121 CarbonylContact C-O 3.59Å; S111-F121 WeakPolarHBondContact CA-O 3.3Å; T112-F121 PolarHBondContact N-O 3.15Å; T112-F121 PolarHBondContact OG1-N 3.26Å; T112-F121 VanDerWaalsContact OG1-N 3.16Å; Q119-F121 HydrophobicContact CB-CD2 4.29Å; Q119-F121 HydrophobicContact CB-CE2 3.64Å; Q119-F121 HydrophobicContact CB-CZ 4.01Å; Q119-F121 WeakPolarHBondContact O-CD2 3.35Å; F121-K141 HydrophobicContact CD1-CB 4.22Å; F121-I142 CarbonylContact C-O 3.53Å; F121-I142 VanDerWaalsContact CA-O 3.22Å; F121-I142 WeakPolarHBondContact CA-O 2.95Å; F121-P143 HydrophobicContact CD1-CB 4.11Å; F121-P143 HydrophobicContact CE1-CB 3.79Å
122	V	94.9	Very high	90.3	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.006	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124.3	153.4	-168.3	0	0	0	0	107.6	M109 F110 F124 K141 I142 I149	M109-V122 HydrophobicContact CB-CG1 4.24Å; M109-V122 HydrophobicContact SD-CG1 4.19Å; F110-V122 WeakPolarHBondContact O-CA 3.37Å; V122-F124 HydrophobicContact CB-CE2 3.95Å; V122-F124 HydrophobicContact CG1-CD2 4.24Å; V122-F124 HydrophobicContact CG1-CE2 3.48Å; V122-F124 VanDerWaalsContact CG1-CE2 3.48Å; V122-F124 HydrophobicContact CG1-CZ 3.71Å; V122-K141 CarbonylContact O-C 3.52Å; V122-K141 WeakPolarHBondContact O-CA 3.23Å; V122-I142 HydrophobicContact CB-CB 4.26Å; V122-I142 PolarHBondContact N-O 2.99Å; V122-I142 PolarHBondContact O-N 3.05Å; V122-I149 HydrophobicContact CG2-CD1 3.29Å
123	S	95.7	Very high	90	Very high	10 Å²	10	58.2 Å²	58.2	7%	0.07	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	139.4	177.9	-60.2	0	0	0	0	110.2	M109 F110	M109-S123 VanDerWaalsContact CA-O 3.3Å; M109-S123 WeakPolarHBondContact CA-O 3.42Å; F110-S123 PolarHBondContact N-O 3.01Å; F110-S123 PolarHBondContact O-N 2.85Å
124	F	95.9	Very high	90	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	128.2	-178.4	-60.7	-107.4	0	0	0	110.3	I107 I108 M109 V122 P138 Y139 M140 I142 W154 I161	I107-F124 HydrophobicContact CG2-CD1 4.44Å; I108-F124 WeakPolarHBondContact O-CA 3.39Å; M109-F124 HydrophobicContact CB-CD1 3.96Å; M109-F124 HydrophobicContact CB-CE1 3.97Å; M109-F124 HydrophobicContact CB-CG 4.49Å; M109-F124 HydrophobicContact CB-CZ 4.49Å; V122-F124 HydrophobicContact CB-CE2 3.95Å; V122-F124 HydrophobicContact CG1-CD2 4.24Å; V122-F124 HydrophobicContact CG1-CE2 3.48Å; V122-F124 VanDerWaalsContact CG1-CE2 3.48Å; V122-F124 HydrophobicContact CG1-CZ 3.71Å; F124-P138 WeakPolarHBondContact O-CA 3.33Å; F124-P138 WeakPolarHBondContact O-CB 3.39Å; F124-Y139 HydrophobicContact CB-CD1 4.26Å; F124-Y139 HydrophobicContact CB-CE1 3.53Å; F124-Y139 HydrophobicContact CB-CE2 4.3Å; F124-Y139 VanDerWaalsContact O-CD1 3.23Å; F124-Y139 WeakPolarHBondContact O-CD1 3.39Å; F124-Y139 PolarHBondContact O-N 3.09Å; F124-M140 HydrophobicContact CB-CB 4.28Å; F124-M140 HydrophobicContact CD1-CE 4.08Å; F124-M140 HydrophobicContact CD2-CB 4.22Å; F124-M140 HydrophobicContact CD2-CE 3.47Å; F124-M140 VanDerWaalsContact CD2-CE 3.47Å; F124-M140 HydrophobicContact CD2-CG 4.39Å; F124-M140 HydrophobicContact CE1-CE 4.06Å; F124-M140 HydrophobicContact CE2-CE 3.49Å; F124-M140 VanDerWaalsContact CE2-CE 3.49Å; F124-M140 HydrophobicContact CG-CE 3.79Å; F124-M140 HydrophobicContact CZ-CE 3.78Å; F124-M140 PolarHBondContact N-O 2.88Å; F124-I142 HydrophobicContact CE2-CD1 3.55Å; F124-I142 HydrophobicContact CE2-CG1 3.89Å; F124-I142 HydrophobicContact CZ-CD1 3.87Å; F124-W154 AromaticContact CD1-CH2 3.84Å; F124-W154 HydrophobicContact CD1-CH2 3.84Å; F124-W154 HydrophobicContact CD1-CZ2 4.15Å; F124-W154 AromaticContact CE1-CH2 3.76Å; F124-W154 HydrophobicContact CE1-CH2 3.76Å; F124-W154 HydrophobicContact CE1-CZ2 4.14Å; F124-W154 HydrophobicContact CE1-CZ3 4.4Å; F124-I161 HydrophobicContact CE1-CD1 4.07Å; F124-I161 HydrophobicContact CE1-CG1 3.74Å; F124-I161 HydrophobicContact CZ-CD1 4.44Å; F124-I161 HydrophobicContact CZ-CG1 3.63Å
125	F	95.7	Very high	90.3	Very high	3 Å²	3	64.2 Å²	64.2	1%	0.013	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.8	176.8	-68.6	-105.7	0	0	0	109.6	L90 I107 I108 F110 Q132 P138	L90-F125 HydrophobicContact CD1-CD1 4.15Å; L90-F125 HydrophobicContact CD1-CD2 3.84Å; L90-F125 HydrophobicContact CD1-CE1 4.24Å; L90-F125 HydrophobicContact CD1-CE2 3.94Å; L90-F125 HydrophobicContact CD1-CG 3.95Å; L90-F125 HydrophobicContact CD1-CZ 4.13Å; L90-F125 HydrophobicContact CD2-CD1 4.03Å; L90-F125 HydrophobicContact CD2-CE1 3.7Å; L90-F125 HydrophobicContact CD2-CZ 4.05Å; I107-F125 WeakPolarHBondContact CA-O 3.28Å; I108-F125 HydrophobicContact CD1-CB 4.23Å; I108-F125 HydrophobicContact CG1-CB 3.84Å; I108-F125 PolarHBondContact N-O 3.1Å; I108-F125 PolarHBondContact O-N 2.9Å; F110-F125 AromaticContact CE1-CD2 3.74Å; F110-F125 HydrophobicContact CE1-CD2 3.74Å; F110-F125 AromaticContact CE1-CE2 3.37Å; F110-F125 HydrophobicContact CE1-CE2 3.37Å; F110-F125 HydrophobicContact CE1-CZ 4.38Å; F110-F125 HydrophobicContact CZ-CD2 4.34Å; F110-F125 AromaticContact CZ-CE2 3.54Å; F110-F125 HydrophobicContact CZ-CE2 3.54Å; F110-F125 HydrophobicContact CZ-CZ 4.33Å; F125-Q132 HydrophobicContact CD1-CB 3.96Å; F125-Q132 WeakPolarHBondContact CE1-O 3.13Å; F125-P138 HydrophobicContact CD1-CB 4.24Å; F125-P138 HydrophobicContact CD2-CB 3.76Å; F125-P138 HydrophobicContact CE1-CB 4.04Å; F125-P138 HydrophobicContact CE1-CG 4.47Å; F125-P138 HydrophobicContact CE2-CB 3.53Å; F125-P138 HydrophobicContact CE2-CG 3.95Å; F125-P138 HydrophobicContact CG-CB 4.11Å; F125-P138 HydrophobicContact CZ-CB 3.69Å; F125-P138 VanDerWaalsContact CZ-CD 3.5Å; F125-P138 HydrophobicContact CZ-CG 3.86Å
126	D	94.8	Very high	90.8	Very high	28 Å²	28	63.2 Å²	63.2	15%	0.15	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	112	169	-169	-21.5	0	0	0	109	R128 D129 Y139	D126-R128 PolarHBondContact O-N 3.32Å; D126-R128 VanDerWaalsContact O-N 3.13Å; D126-R128 VanDerWaalsContact OD1-CB 3.23Å; D126-R128 WeakPolarHBondContact OD1-CB 3.22Å; D126-R128 WeakPolarHBondContact OD1-CG 3.33Å; D126-R128 IonicContact OD1-CZ 3.17Å; D126-R128 PolarHBondContact OD1-N 3.14Å; D126-R128 IonicContact OD1-NE 3.5Å; D126-R128 PolarHBondContact OD1-NE 3Å; D126-R128 IonicContact OD1-NH2 3.55Å; D126-R128 IonicContact OD2-CZ 2.77Å; D126-R128 IonicContact OD2-NE 2.93Å; D126-R128 PolarHBondContact OD2-NE 2.87Å; D126-R128 IonicContact OD2-NH2 3.41Å; D126-R128 PolarHBondContact OD2-NH2 2.75Å; D126-D129 PolarHBondContact O-N 3.36Å; D126-Y139 HydrophobicContact CB-CD1 4.31Å; D126-Y139 HydrophobicContact CB-CE1 4.45Å
127	L	93.3	Very high	91.5	Very high	35 Å²	35	60.1 Å²	60.1	18%	0.183	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-13.6	-179.6	-61.2	-176.6	0	0	0	113	L78 F101 N106 I108 D129 I133	L78-L127 HydrophobicContact CD1-CD1 4.25Å; L78-L127 HydrophobicContact CD2-CD1 4.04Å; L78-L127 HydrophobicContact CD2-CD2 3.99Å; F101-L127 HydrophobicContact CE1-CD1 4.06Å; N106-L127 WeakPolarHBondContact O-CB 3.41Å; N106-L127 PolarHBondContact O-N 2.75Å; I108-L127 HydrophobicContact CD1-CD2 3.86Å; I108-L127 HydrophobicContact CG1-CD2 4.02Å; I108-L127 HydrophobicContact CG1-CG 4.41Å; I108-L127 HydrophobicContact CG2-CD1 3.92Å; I108-L127 HydrophobicContact CG2-CD2 4.47Å; I108-L127 HydrophobicContact CG2-CG 4.27Å; L127-D129 VanDerWaalsContact C-N 3.27Å; L127-I133 HydrophobicContact CD2-CD1 3.89Å
128	R	93.2	Very high	92.2	Very high	157 Å²	157	57 Å²	57	59%	0.592	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-9.6	174.4	-55.6	171.3	-67.5	-170.4	4.5	112.9	N106 D126 P130	N106-R128 HydrophobicContact CB-CG 4.19Å; N106-R128 WeakPolarHBondContact OD1-CD 3.32Å; D126-R128 PolarHBondContact O-N 3.32Å; D126-R128 VanDerWaalsContact O-N 3.13Å; D126-R128 VanDerWaalsContact OD1-CB 3.23Å; D126-R128 WeakPolarHBondContact OD1-CB 3.22Å; D126-R128 WeakPolarHBondContact OD1-CG 3.33Å; D126-R128 IonicContact OD1-CZ 3.17Å; D126-R128 PolarHBondContact OD1-N 3.14Å; D126-R128 IonicContact OD1-NE 3.5Å; D126-R128 PolarHBondContact OD1-NE 3Å; D126-R128 IonicContact OD1-NH2 3.55Å; D126-R128 IonicContact OD2-CZ 2.77Å; D126-R128 IonicContact OD2-NE 2.93Å; D126-R128 PolarHBondContact OD2-NE 2.87Å; D126-R128 IonicContact OD2-NH2 3.41Å; D126-R128 PolarHBondContact OD2-NH2 2.75Å; R128-P130 WeakPolarHBondContact O-CD 3.14Å
129	D	92.7	Very high	92.7	Very high	59 Å²	59	56.5 Å²	56.5	32%	0.316	28%	0.282	S	S	.	.			trans	-115.1	92.1	176.8	-178.5	0.9	0	0	0	110.1	D126 L127 S131 Q132	D126-D129 PolarHBondContact O-N 3.36Å; L127-D129 VanDerWaalsContact C-N 3.27Å; D129-S131 PolarHBondContact O-N 3.24Å; D129-S131 WeakPolarHBondContact OD1-CB 3.48Å; D129-S131 PolarHBondContact OD1-N 2.75Å; D129-S131 VanDerWaalsContact OD1-N 3.12Å; D129-S131 PolarHBondContact OD1-OG 3.22Å; D129-S131 PolarHBondContact OD2-OG 3.28Å; D129-Q132 HydrophobicContact CB-CG 4.23Å; D129-Q132 PolarHBondContact O-N 3.26Å; D129-Q132 VanDerWaalsContact O-N 3.15Å; D129-Q132 WeakPolarHBondContact OD2-CG 3.26Å; D129-Q132 PolarHBondContact OD2-NE2 2.97Å
130	P	89.3	Confident	93	Very high	78 Å²	78	52.8 Å²	52.8	51%	0.506	27%	0.265	S	S	.	.	H	α-helix	trans	-56.4	-26.3	-179.9	-26.1	35	0	0	0	113.5	R128 Q132 I133 D134	R128-P130 WeakPolarHBondContact O-CD 3.14Å; P130-Q132 VanDerWaalsContact C-N 3.26Å; P130-Q132 PolarHBondContact O-N 3.43Å; P130-I133 PolarHBondContact O-N 2.83Å; P130-I133 VanDerWaalsContact O-N 3.07Å; P130-D134 PolarHBondContact O-N 2.86Å
131	S	92.2	Very high	93.2	Very high	55 Å²	55	58.6 Å²	58.6	39%	0.385	29%	0.29	S	S	.	.	H	α-helix	trans	-65.4	-29.6	-177.7	77.8	0	0	0	0	112.7	D129 I133 N135	D129-S131 PolarHBondContact O-N 3.24Å; D129-S131 WeakPolarHBondContact OD1-CB 3.48Å; D129-S131 PolarHBondContact OD1-N 2.75Å; D129-S131 VanDerWaalsContact OD1-N 3.12Å; D129-S131 PolarHBondContact OD1-OG 3.22Å; D129-S131 PolarHBondContact OD2-OG 3.28Å; S131-I133 VanDerWaalsContact C-N 3.35Å; S131-N135 WeakPolarHBondContact O-CB 3.47Å; S131-N135 VanDerWaalsContact O-CG 3.32Å; S131-N135 PolarHBondContact O-N 3.08Å; S131-N135 PolarHBondContact O-ND2 2.78Å
132	Q	91.1	Very high	93.2	Very high	22 Å²	22	56 Å²	56	10%	0.103	28%	0.279	C	S	.	.	H	α-helix	trans	-67.5	-38.5	174	-65.6	177.7	35.8	0	0	111.3	F125 D129 P130 N136 E137	F125-Q132 HydrophobicContact CD1-CB 3.96Å; F125-Q132 WeakPolarHBondContact CE1-O 3.13Å; D129-Q132 HydrophobicContact CB-CG 4.23Å; D129-Q132 PolarHBondContact O-N 3.26Å; D129-Q132 VanDerWaalsContact O-N 3.15Å; D129-Q132 WeakPolarHBondContact OD2-CG 3.26Å; D129-Q132 PolarHBondContact OD2-NE2 2.97Å; P130-Q132 VanDerWaalsContact C-N 3.26Å; P130-Q132 PolarHBondContact O-N 3.43Å; Q132-N136 CarbonylContact O-C 3.55Å; Q132-N136 VanDerWaalsContact O-CA 3.23Å; Q132-N136 WeakPolarHBondContact O-CA 3.48Å; Q132-N136 PolarHBondContact O-N 2.94Å; Q132-E137 WeakPolarHBondContact CA-O 3.22Å; Q132-E137 WeakPolarHBondContact CB-O 3.45Å; Q132-E137 WeakPolarHBondContact CG-O 3.22Å; Q132-E137 PolarHBondContact O-N 3.33Å
133	I	90.2	Very high	92.9	Very high	33 Å²	33	59.2 Å²	59.2	17%	0.169	30%	0.3	C	S	.	.	H	α-helix	trans	-72	-51	178.3	-59.9	175.9	0	0	0	110.1	A88 L90 L127 P130 S131 N135 N136	A88-I133 HydrophobicContact CB-CD1 4.4Å; A88-I133 HydrophobicContact CB-CG2 3.61Å; L90-I133 HydrophobicContact CD2-CB 4.4Å; L90-I133 HydrophobicContact CD2-CG1 4.48Å; L90-I133 HydrophobicContact CD2-CG2 4.12Å; L127-I133 HydrophobicContact CD2-CD1 3.89Å; P130-I133 PolarHBondContact O-N 2.83Å; P130-I133 VanDerWaalsContact O-N 3.07Å; S131-I133 VanDerWaalsContact C-N 3.35Å; I133-N135 PolarHBondContact O-N 2.92Å; I133-N136 PolarHBondContact O-N 3.41Å; I133-N136 VanDerWaalsContact O-N 3.16Å
134	D	89.6	Confident	92.6	Very high	131 Å²	131	59 Å²	59	70%	0.701	30%	0.298	S	S	*	.	H	α-helix	trans	-63.6	-41.6	-176.2	-71.7	-28.2	0	0	0	112.4	P130	P130-D134 PolarHBondContact O-N 2.86Å
135	N	92.7	Very high	91.5	Very high	107 Å²	107	62.5 Å²	62.5	57%	0.572	32%	0.317	S	S	*	.	H	α-helix	trans	-85.2	-10.2	176.8	-60	-44.2	0	0	0	113	S131 I133 E137	S131-N135 WeakPolarHBondContact O-CB 3.47Å; S131-N135 VanDerWaalsContact O-CG 3.32Å; S131-N135 PolarHBondContact O-N 3.08Å; S131-N135 PolarHBondContact O-ND2 2.78Å; I133-N135 PolarHBondContact O-N 2.92Å; N135-E137 VanDerWaalsContact C-N 3.28Å; N135-E137 HydrophobicContact CB-CB 4.39Å; N135-E137 HydrophobicContact CB-CG 4.07Å; N135-E137 PolarHBondContact O-N 3.07Å
136	N	92.8	Very high	90.6	Very high	53 Å²	53	69.5 Å²	69.5	28%	0.283	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	38.8	-173.5	-166	83	0	0	0	112.8	L90 K91 Q132 I133	L90-N136 VanDerWaalsContact CA-OD1 3.27Å; L90-N136 WeakPolarHBondContact CA-OD1 3.47Å; K91-N136 PolarHBondContact N-OD1 2.82Å; K91-N136 PolarHBondContact O-ND2 3Å; K91-N136 PolarHBondContact O-OD1 3.31Å; Q132-N136 CarbonylContact O-C 3.55Å; Q132-N136 VanDerWaalsContact O-CA 3.23Å; Q132-N136 WeakPolarHBondContact O-CA 3.48Å; Q132-N136 PolarHBondContact O-N 2.94Å; I133-N136 PolarHBondContact O-N 3.41Å; I133-N136 VanDerWaalsContact O-N 3.16Å
137	E	93.4	Very high	90.2	Very high	132 Å²	132	68.9 Å²	68.9	62%	0.617	35%	0.352	S	S	*	.			trans	-114.7	102	-178.8	-68.5	-167.8	151	0	0	110.3	Q132 N135	Q132-E137 WeakPolarHBondContact CA-O 3.22Å; Q132-E137 WeakPolarHBondContact CB-O 3.45Å; Q132-E137 WeakPolarHBondContact CG-O 3.22Å; Q132-E137 PolarHBondContact O-N 3.33Å; N135-E137 VanDerWaalsContact C-N 3.28Å; N135-E137 HydrophobicContact CB-CB 4.39Å; N135-E137 HydrophobicContact CB-CG 4.07Å; N135-E137 PolarHBondContact O-N 3.07Å
138	P	93.9	Very high	90.2	Very high	18 Å²	18	68.8 Å²	68.8	12%	0.117	35%	0.35	C	S	.	.			trans	-70.1	144.9	174.4	25.8	-30.5	0	0	0	111.2	F124 F125 M140 K141	F124-P138 WeakPolarHBondContact O-CA 3.33Å; F124-P138 WeakPolarHBondContact O-CB 3.39Å; F125-P138 HydrophobicContact CD1-CB 4.24Å; F125-P138 HydrophobicContact CD2-CB 3.76Å; F125-P138 HydrophobicContact CE1-CB 4.04Å; F125-P138 HydrophobicContact CE1-CG 4.47Å; F125-P138 HydrophobicContact CE2-CB 3.53Å; F125-P138 HydrophobicContact CE2-CG 3.95Å; F125-P138 HydrophobicContact CG-CB 4.11Å; F125-P138 HydrophobicContact CZ-CB 3.69Å; F125-P138 VanDerWaalsContact CZ-CD 3.5Å; F125-P138 HydrophobicContact CZ-CG 3.86Å; P138-M140 PolarHBondContact O-N 3.17Å; P138-K141 VanDerWaalsContact CD-CE 3.44Å; P138-K141 HydrophobicContact CG-CD 4Å; P138-K141 HydrophobicContact CG-CG 3.6Å
139	Y	93.7	Very high	90.2	Very high	102 Å²	102	61.3 Å²	61.3	40%	0.4	32%	0.322	S	S	.	.	S	Bend	trans	-64.1	-24.5	175.8	76.7	-94	0	0	0	113.2	I107 F124 D126	I107-Y139 HydrophobicContact CG2-CE1 4.2Å; F124-Y139 HydrophobicContact CB-CD1 4.26Å; F124-Y139 HydrophobicContact CB-CE1 3.53Å; F124-Y139 HydrophobicContact CB-CE2 4.3Å; F124-Y139 VanDerWaalsContact O-CD1 3.23Å; F124-Y139 WeakPolarHBondContact O-CD1 3.39Å; F124-Y139 PolarHBondContact O-N 3.09Å; D126-Y139 HydrophobicContact CB-CD1 4.31Å; D126-Y139 HydrophobicContact CB-CE1 4.45Å
140	M	94.4	Very high	90.4	Very high	25 Å²	25	59.3 Å²	59.3	12%	0.123	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	139.6	177.5	-170.9	171.2	69.2	0	0	112.1	F124 P138 I142 A175	F124-M140 HydrophobicContact CB-CB 4.28Å; F124-M140 HydrophobicContact CD1-CE 4.08Å; F124-M140 HydrophobicContact CD2-CB 4.22Å; F124-M140 HydrophobicContact CD2-CE 3.47Å; F124-M140 VanDerWaalsContact CD2-CE 3.47Å; F124-M140 HydrophobicContact CD2-CG 4.39Å; F124-M140 HydrophobicContact CE1-CE 4.06Å; F124-M140 HydrophobicContact CE2-CE 3.49Å; F124-M140 VanDerWaalsContact CE2-CE 3.49Å; F124-M140 HydrophobicContact CG-CE 3.79Å; F124-M140 HydrophobicContact CZ-CE 3.78Å; F124-M140 PolarHBondContact N-O 2.88Å; P138-M140 PolarHBondContact O-N 3.17Å; M140-I142 HydrophobicContact CE-CD1 4.31Å; M140-I142 HydrophobicContact CE-CG1 4.49Å; M140-A175 VanDerWaalsContact CE-O 3.28Å; M140-A175 WeakPolarHBondContact CE-O 3.43Å
141	K	93.9	Very high	90.7	Very high	122 Å²	122	55.9 Å²	55.9	53%	0.53	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	126.5	170.7	-62.7	-176	-177	175.1	0	110.1	F121 V122 P138	F121-K141 HydrophobicContact CD1-CB 4.22Å; V122-K141 CarbonylContact O-C 3.52Å; V122-K141 WeakPolarHBondContact O-CA 3.23Å; P138-K141 VanDerWaalsContact CD-CE 3.44Å; P138-K141 HydrophobicContact CG-CD 4Å; P138-K141 HydrophobicContact CG-CG 3.6Å
142	I	92.9	Very high	90.9	Very high	5 Å²	5	53.4 Å²	53.4	3%	0.026	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	116.9	175.4	-54.4	177.7	0	0	0	108.5	F121 V122 F124 M140 Y173	F121-I142 CarbonylContact C-O 3.53Å; F121-I142 VanDerWaalsContact CA-O 3.22Å; F121-I142 WeakPolarHBondContact CA-O 2.95Å; V122-I142 HydrophobicContact CB-CB 4.26Å; V122-I142 PolarHBondContact N-O 2.99Å; V122-I142 PolarHBondContact O-N 3.05Å; F124-I142 HydrophobicContact CE2-CD1 3.55Å; F124-I142 HydrophobicContact CE2-CG1 3.89Å; F124-I142 HydrophobicContact CZ-CD1 3.87Å; M140-I142 HydrophobicContact CE-CD1 4.31Å; M140-I142 HydrophobicContact CE-CG1 4.49Å; I142-Y173 HydrophobicContact CD1-CD1 4.31Å; I142-Y173 HydrophobicContact CD1-CG 4.23Å; I142-Y173 HydrophobicContact CG2-CD1 3.66Å; I142-Y173 HydrophobicContact CG2-CE1 3.67Å; I142-Y173 HydrophobicContact CG2-CG 4.41Å
143	P	90.3	Very high	91.2	Very high	69 Å²	69	53.7 Å²	53.7	45%	0.448	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	127.4	176.2	29.5	-32.2	0	0	0	112	F121	F121-P143 HydrophobicContact CD1-CB 4.11Å; F121-P143 HydrophobicContact CE1-CB 3.79Å
144	C	87.4	Confident	91.4	Very high	4 Å²	4	52.9 Å²	52.9	3%	0.027	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	84.1	177.3	-59	0	0	0	0	109.4	C120 I149	C120-C144 HydrophobicContact CB-CB 3.98Å; C120-C144 PolarHBondContact O-N 2.98Å; C144-I149 HydrophobicContact CB-CD1 4.47Å; C144-I149 HydrophobicContact CB-CG1 4.46Å; C144-I149 WeakPolarHBondContact SG-CD1 3.27Å
145	N	74.7	Confident	91.6	Very high	75 Å²	75	46.7 Å²	46.7	40%	0.401	24%	0.238	S	C	.	.			trans	-77.3	-46.6	-167.9	-70.8	-35.8	0	0	0	113.7	K114 Q119	K114-N145 PolarHBondContact NZ-O 3.22Å; Q119-N145 PolarHBondContact NE2-OD1 2.89Å; Q119-N145 VanDerWaalsContact NE2-OD1 3.1Å
146	D	76.4	Confident	91.5	Very high	150 Å²	150	43.1 Å²	43.1	80%	0.802	22%	0.22	S	C	*	.	S	Bend	trans	-73.2	-54.6	-166.6	-53	-63	0	0	0	111.4
147	S	87	Confident	91.2	Very high	14 Å²	14	47.8 Å²	47.8	10%	0.098	25%	0.245	C	C	.	.	S	Bend	trans	-135.4	139.4	-178.4	-171.4	0	0	0	0	110.5	H165 E166 S167	S147-H165 PolarHBondContact O-ND1 3.09Å; S147-E166 PolarHBondContact OG-N 3.25Å; S147-S167 WeakPolarHBondContact CB-OG 3.35Å; S147-S167 VanDerWaalsContact OG-CB 3.27Å; S147-S167 WeakPolarHBondContact OG-CB 3.34Å; S147-S167 PolarHBondContact OG-N 3.39Å; S147-S167 PolarHBondContact OG-OG 3.21Å
148	K	91.4	Very high	90.9	Very high	33 Å²	33	42.1 Å²	42.1	14%	0.143	22%	0.222	C	C	.	.			trans	-72.1	146.7	-179.2	63.3	173	178	-171.8	0	111.6	D113 K114 C120 T150 H165 E166	D113-K148 WeakPolarHBondContact OD1-CD 3.49Å; D113-K148 WeakPolarHBondContact OD1-CE 3.4Å; D113-K148 IonicContact OD1-NZ 2.92Å; D113-K148 PolarHBondContact OD1-NZ 3.04Å; D113-K148 IonicContact OD2-NZ 3.85Å; K114-K148 HydrophobicContact CB-CB 3.96Å; K114-K148 HydrophobicContact CB-CD 4.41Å; C120-K148 HydrophobicContact CB-CB 4.2Å; K148-T150 HydrophobicContact CG-CG2 4.41Å; K148-H165 VanDerWaalsContact O-CA 3.3Å; K148-H165 WeakPolarHBondContact O-CA 3.34Å; K148-E166 VanDerWaalsContact CE-CD 3.44Å; K148-E166 WeakPolarHBondContact CE-OE1 3.49Å; K148-E166 WeakPolarHBondContact CE-OE2 3.35Å; K148-E166 HydrophobicContact CG-CB 3.85Å; K148-E166 WeakPolarHBondContact CG-OE2 3.35Å; K148-E166 PolarHBondContact O-N 3.24Å; K148-E166 VanDerWaalsContact O-N 3.08Å
149	I	94.4	Very high	90.7	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	132.4	170	-67.2	175.4	0	0	0	108.8	T98 C120 V122 C144 A152 A163 G164 H165 Y173	T98-I149 HydrophobicContact CG2-CG2 4.32Å; C120-I149 PolarHBondContact SG-N 3.2Å; C120-I149 VanDerWaalsContact SG-N 3.41Å; V122-I149 HydrophobicContact CG2-CD1 3.29Å; C144-I149 HydrophobicContact CB-CD1 4.47Å; C144-I149 HydrophobicContact CB-CG1 4.46Å; C144-I149 WeakPolarHBondContact SG-CD1 3.27Å; I149-A152 HydrophobicContact CG2-CB 3.93Å; I149-A163 HydrophobicContact CD1-CB 3.76Å; I149-A163 HydrophobicContact CG1-CB 4.01Å; I149-A163 HydrophobicContact CG2-CB 4.28Å; I149-G164 WeakPolarHBondContact CA-O 3.32Å; I149-H165 VanDerWaalsContact CG1-CE1 3.47Å; I149-H165 WeakPolarHBondContact CG1-CE1 3.3Å; I149-Y173 HydrophobicContact CD1-CE2 4.31Å
150	T	95.6	Very high	90.7	Very high	17 Å²	17	41.4 Å²	41.4	10%	0.104	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	-32.8	-179.8	45.4	0	0	0	0	112.1	K148 G164 E166 Q190 I191	K148-T150 HydrophobicContact CG-CG2 4.41Å; T150-G164 PolarHBondContact N-O 2.92Å; T150-G164 PolarHBondContact OG1-O 2.63Å; T150-G164 VanDerWaalsContact OG1-O 3.12Å; T150-E166 HydrophobicContact CG2-CB 4.11Å; T150-Q190 HydrophobicContact CG2-CG 4.07Å; T150-I191 VanDerWaalsContact CB-O 3.25Å; T150-I191 WeakPolarHBondContact CB-O 3.17Å; T150-I191 PolarHBondContact OG1-O 2.88Å
151	S	96.6	Very high	90.8	Very high	7 Å²	7	40.2 Å²	40.2	5%	0.049	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	149.4	164.5	-179.2	0	0	0	0	109.3	G164 I194	S151-G164 PolarHBondContact O-N 2.8Å; S151-I194 PolarHBondContact OG-N 3.12Å
152	A	96.9	Very high	91	Very high	3 Å²	3	34.4 Å²	34.4	3%	0.025	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	149.7	171	0	0	0	0	0	110.8	T98 I149 I161 I162 A163	T98-A152 HydrophobicContact CG2-CB 3.76Å; T98-A152 PolarHBondContact OG1-O 2.93Å; T98-A152 VanDerWaalsContact OG1-O 3.12Å; I149-A152 HydrophobicContact CG2-CB 3.93Å; A152-I161 HydrophobicContact CB-CG2 3.87Å; A152-I162 CarbonylContact C-O 3.55Å; A152-I162 WeakPolarHBondContact CA-O 3.47Å; A152-I162 WeakPolarHBondContact CB-O 3.15Å; A152-A163 HydrophobicContact CB-CB 3.72Å
153	V	96.6	Very high	91.1	Very high	27 Å²	27	34.2 Å²	34.2	16%	0.164	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	155.8	-177.9	-62.6	0	0	0	0	110.5	I161 I162 I194 L196	V153-I161 CarbonylContact O-C 3.55Å; V153-I161 WeakPolarHBondContact O-CA 3.31Å; V153-I162 HydrophobicContact CG2-CB 4.16Å; V153-I162 PolarHBondContact N-O 3.05Å; V153-I162 PolarHBondContact O-N 2.95Å; V153-I194 HydrophobicContact CG1-CB 4.43Å; V153-I194 HydrophobicContact CG1-CG2 4.34Å; V153-I194 WeakPolarHBondContact CG1-O 3.19Å; V153-I194 HydrophobicContact CG2-CG2 3.71Å; V153-L196 HydrophobicContact CB-CD1 4.17Å; V153-L196 HydrophobicContact CG2-CD1 3.95Å; V153-L196 HydrophobicContact CG2-CG 4.2Å
154	W	95.6	Very high	91.5	Very high	17 Å²	17	30.9 Å²	30.9	6%	0.064	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	132.3	168.2	-72	94.8	0	0	0	110.2	G100 F101 D102 I107 M109 F124 I161 A175 L196	G100-W154 PolarHBondContact O-NE1 2.78Å; F101-W154 VanDerWaalsContact C-CD1 3.48Å; F101-W154 PolarHBondContact O-NE1 3.46Å; D102-W154 HydrophobicContact CB-CD2 4.13Å; D102-W154 HydrophobicContact CB-CE3 4.32Å; D102-W154 HydrophobicContact CB-CH2 3.99Å; D102-W154 HydrophobicContact CB-CZ2 3.78Å; D102-W154 HydrophobicContact CB-CZ3 4.24Å; I107-W154 HydrophobicContact CG2-CH2 3.88Å; I107-W154 HydrophobicContact CG2-CZ2 3.93Å; M109-W154 HydrophobicContact CB-CZ2 4.04Å; M109-W154 HydrophobicContact CE-CG 4.33Å; M109-W154 HydrophobicContact CG-CZ2 4.01Å; F124-W154 AromaticContact CD1-CH2 3.84Å; F124-W154 HydrophobicContact CD1-CH2 3.84Å; F124-W154 HydrophobicContact CD1-CZ2 4.15Å; F124-W154 AromaticContact CE1-CH2 3.76Å; F124-W154 HydrophobicContact CE1-CH2 3.76Å; F124-W154 HydrophobicContact CE1-CZ2 4.14Å; F124-W154 HydrophobicContact CE1-CZ3 4.4Å; W154-I161 HydrophobicContact CB-CD1 4.36Å; W154-I161 HydrophobicContact CD2-CD1 3.3Å; W154-I161 HydrophobicContact CE3-CD1 3.3Å; W154-I161 HydrophobicContact CG-CD1 3.81Å; W154-I161 HydrophobicContact CH2-CD1 4.07Å; W154-I161 HydrophobicContact CZ2-CD1 4.06Å; W154-I161 HydrophobicContact CZ3-CD1 3.72Å; W154-A175 HydrophobicContact CH2-CB 4.4Å; W154-A175 HydrophobicContact CZ3-CB 3.69Å; W154-L196 WeakPolarHBondContact O-CD1 3.38Å
155	G	93.3	Very high	91.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.167	C	C	.	.			trans	-76.1	-179.2	168.9	0	0	0	0	0	112	F103 G158 C160	F103-G155 WeakPolarHBondContact CE2-O 3.29Å; G155-G158 PolarHBondContact O-N 2.65Å; G155-C160 PolarHBondContact N-O 2.92Å
156	P	89.2	Confident	92.9	Very high	32 Å²	32	31.6 Å²	31.6	21%	0.208	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-56.7	146.4	-179.3	24.5	-34.6	0	0	0	112.3	G158 E159	P156-G158 PolarHBondContact O-N 3.47Å; P156-E159 PolarHBondContact O-N 2.88Å
157	L	86.7	Confident	93.8	Very high	152 Å²	152	25.9 Å²	25.9	80%	0.796	14%	0.14	S	C	*	.	G	3₁₀ helix	trans	59.7	8.8	176.1	-53.8	175.1	0	0	0	116.1	E159	L157-E159 HydrophobicContact CB-CG 4.1Å; L157-E159 PolarHBondContact O-N 3.24Å
158	G	87.3	Confident	94.2	Very high	13 Å²	13	25.2 Å²	25.2	13%	0.134	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	71.9	11.5	-178	0	0	0	0	0	114	D102 G155 P156 A175	D102-G158 WeakPolarHBondContact OD1-CA 3.38Å; G155-G158 PolarHBondContact O-N 2.65Å; P156-G158 PolarHBondContact O-N 3.47Å; G158-A175 WeakPolarHBondContact O-CB 3.29Å
159	E	90.3	Very high	94.5	Very high	97 Å²	97	25.5 Å²	25.5	45%	0.453	14%	0.137	S	C	.	.	S	Bend	trans	-83.7	-19.5	-174.5	-60.9	-152.6	120.5	0	0	113.8	P156 L157 A175 K176	P156-E159 PolarHBondContact O-N 2.88Å; L157-E159 HydrophobicContact CB-CG 4.1Å; L157-E159 PolarHBondContact O-N 3.24Å; E159-A175 WeakPolarHBondContact O-CB 3.2Å; E159-A175 PolarHBondContact O-N 2.52Å; E159-K176 IonicContact OE1-NZ 3.22Å; E159-K176 PolarHBondContact OE1-NZ 2.86Å
160	C	94.7	Very high	94.7	Very high	7 Å²	7	25.5 Å²	25.5	5%	0.047	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	164.8	-179.3	67.6	0	0	0	0	113.2	G155 Q172 Y173 L181	G155-C160 PolarHBondContact N-O 2.92Å; C160-Q172 HydrophobicContact CB-CG 3.79Å; C160-Q172 PolarHBondContact SG-NE2 2.81Å; C160-Q172 VanDerWaalsContact SG-NE2 3.42Å; C160-Y173 CarbonylContact C-O 3.56Å; C160-Y173 WeakPolarHBondContact CA-O 3.41Å; C160-Y173 WeakPolarHBondContact CB-O 3.3Å; C160-L181 HydrophobicContact CB-CD1 4.11Å
161	I	95.8	Very high	94.7	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	132	167.7	-59.4	-51	0	0	0	108.6	M109 F124 A152 V153 W154 Q172 Y173	M109-I161 HydrophobicContact CE-CD1 3.83Å; M109-I161 HydrophobicContact CE-CG2 4.1Å; M109-I161 HydrophobicContact CG-CD1 4.28Å; M109-I161 HydrophobicContact SD-CB 4.47Å; M109-I161 HydrophobicContact SD-CD1 3.49Å; M109-I161 WeakPolarHBondContact SD-CD1 3.42Å; M109-I161 HydrophobicContact SD-CG1 3.84Å; M109-I161 HydrophobicContact SD-CG2 3.76Å; F124-I161 HydrophobicContact CE1-CD1 4.07Å; F124-I161 HydrophobicContact CE1-CG1 3.74Å; F124-I161 HydrophobicContact CZ-CD1 4.44Å; F124-I161 HydrophobicContact CZ-CG1 3.63Å; A152-I161 HydrophobicContact CB-CG2 3.87Å; V153-I161 CarbonylContact O-C 3.55Å; V153-I161 WeakPolarHBondContact O-CA 3.31Å; W154-I161 HydrophobicContact CB-CD1 4.36Å; W154-I161 HydrophobicContact CD2-CD1 3.3Å; W154-I161 HydrophobicContact CE3-CD1 3.3Å; W154-I161 HydrophobicContact CG-CD1 3.81Å; W154-I161 HydrophobicContact CH2-CD1 4.07Å; W154-I161 HydrophobicContact CZ2-CD1 4.06Å; W154-I161 HydrophobicContact CZ3-CD1 3.72Å; I161-Q172 CarbonylContact O-C 3.51Å; I161-Q172 WeakPolarHBondContact O-CA 3.38Å; I161-Y173 PolarHBondContact N-O 2.83Å; I161-Y173 PolarHBondContact O-N 2.89Å
162	I	97	Very high	94.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	118.1	170.6	-54.4	175.2	0	0	0	107.5	A152 V153 L170 F203 L220	A152-I162 CarbonylContact C-O 3.55Å; A152-I162 WeakPolarHBondContact CA-O 3.47Å; A152-I162 WeakPolarHBondContact CB-O 3.15Å; V153-I162 HydrophobicContact CG2-CB 4.16Å; V153-I162 PolarHBondContact N-O 3.05Å; V153-I162 PolarHBondContact O-N 2.95Å; I162-L170 HydrophobicContact CG2-CD2 4.46Å; I162-F203 HydrophobicContact CD1-CD1 3.79Å; I162-F203 HydrophobicContact CD1-CE1 3.87Å; I162-F203 HydrophobicContact CG2-CE1 4.07Å; I162-F203 HydrophobicContact CG2-CE2 4.09Å; I162-F203 HydrophobicContact CG2-CZ 3.82Å; I162-L220 HydrophobicContact CD1-CD2 4.42Å; I162-L220 HydrophobicContact CG1-CD2 4.42Å; I162-L220 HydrophobicContact CG2-CD2 4.1Å
163	A	96.8	Very high	94.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	133.2	-176.7	0	0	0	0	0	112	I149 A152 L170 N171 Y173	I149-A163 HydrophobicContact CD1-CB 3.76Å; I149-A163 HydrophobicContact CG1-CB 4.01Å; I149-A163 HydrophobicContact CG2-CB 4.28Å; A152-A163 HydrophobicContact CB-CB 3.72Å; A163-L170 WeakPolarHBondContact O-CA 3.2Å; A163-N171 PolarHBondContact N-O 3.02Å; A163-N171 PolarHBondContact O-N 3.15Å; A163-Y173 HydrophobicContact CB-CD2 4.17Å; A163-Y173 HydrophobicContact CB-CE2 3.86Å
164	G	96.9	Very high	94.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	141	171.4	0	0	0	0	0	111.2	I149 T150 S151 I194	I149-G164 WeakPolarHBondContact CA-O 3.32Å; T150-G164 PolarHBondContact N-O 2.92Å; T150-G164 PolarHBondContact OG1-O 2.63Å; T150-G164 VanDerWaalsContact OG1-O 3.12Å; S151-G164 PolarHBondContact O-N 2.8Å; G164-I194 VanDerWaalsContact N-CD1 3.3Å
165	H	96.3	Very high	94.3	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.019	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	160.4	-173.3	-66	-100.3	0	0	0	113.2	S147 K148 I149 S167 G168 E169 N171 I191	S147-H165 PolarHBondContact O-ND1 3.09Å; K148-H165 VanDerWaalsContact O-CA 3.3Å; K148-H165 WeakPolarHBondContact O-CA 3.34Å; I149-H165 VanDerWaalsContact CG1-CE1 3.47Å; I149-H165 WeakPolarHBondContact CG1-CE1 3.3Å; H165-S167 WeakPolarHBondContact CB-OG 3.3Å; H165-S167 PolarHBondContact O-N 3.31Å; H165-S167 VanDerWaalsContact O-N 3.16Å; H165-G168 PolarHBondContact O-N 3Å; H165-G168 VanDerWaalsContact O-N 3.15Å; H165-E169 HydrophobicContact CB-CB 4.43Å; H165-E169 PolarHBondContact CD2-O 2.95Å; H165-E169 PolarHBondContact N-O 2.99Å; H165-N171 PolarHBondContact NE2-ND2 2.84Å; H165-I191 PolarHBondContact O-N 3.41Å
166	E	95.5	Very high	94.2	Very high	90 Å²	90	32.3 Å²	32.3	42%	0.421	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-22.2	173.1	-179.1	170.7	-131.2	0	0	113.3	S147 K148 T150 G168 Q190	S147-E166 PolarHBondContact OG-N 3.25Å; K148-E166 VanDerWaalsContact CE-CD 3.44Å; K148-E166 WeakPolarHBondContact CE-OE1 3.49Å; K148-E166 WeakPolarHBondContact CE-OE2 3.35Å; K148-E166 HydrophobicContact CG-CB 3.85Å; K148-E166 WeakPolarHBondContact CG-OE2 3.35Å; K148-E166 PolarHBondContact O-N 3.24Å; K148-E166 VanDerWaalsContact O-N 3.08Å; T150-E166 HydrophobicContact CG2-CB 4.11Å; E166-G168 VanDerWaalsContact C-N 3.35Å; E166-Q190 HydrophobicContact CG-CB 4.38Å; E166-Q190 WeakPolarHBondContact O-CA 3.41Å; E166-Q190 PolarHBondContact O-N 2.87Å; E166-Q190 VanDerWaalsContact O-N 3.12Å
167	S	95.8	Very high	94.3	Very high	29 Å²	29	33.7 Å²	33.7	20%	0.203	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-8.7	179.5	46.4	0	0	0	0	114.4	S147 H165 E169 K185	S147-S167 WeakPolarHBondContact CB-OG 3.35Å; S147-S167 VanDerWaalsContact OG-CB 3.27Å; S147-S167 WeakPolarHBondContact OG-CB 3.34Å; S147-S167 PolarHBondContact OG-N 3.39Å; S147-S167 PolarHBondContact OG-OG 3.21Å; H165-S167 WeakPolarHBondContact CB-OG 3.3Å; H165-S167 PolarHBondContact O-N 3.31Å; H165-S167 VanDerWaalsContact O-N 3.16Å; S167-E169 VanDerWaalsContact C-N 3.32Å; S167-E169 WeakPolarHBondContact CB-OE2 3.44Å; S167-E169 VanDerWaalsContact OG-CD 3.26Å; S167-E169 PolarHBondContact OG-OE2 3.01Å; S167-K185 VanDerWaalsContact O-CE 3.25Å; S167-K185 WeakPolarHBondContact O-CE 3.49Å; S167-K185 PolarHBondContact O-NZ 2.91Å
168	G	96.7	Very high	94.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.146	C	C	.	.	S	Bend	trans	81.8	6.5	-170.5	0	0	0	0	0	114.8	H165 E166 H187 R189	H165-G168 PolarHBondContact O-N 3Å; H165-G168 VanDerWaalsContact O-N 3.15Å; E166-G168 VanDerWaalsContact C-N 3.35Å; G168-H187 WeakPolarHBondContact CA-O 3.39Å; G168-H187 PolarHBondContact O-N 3.48Å; G168-R189 VanDerWaalsContact CA-O 3.23Å; G168-R189 WeakPolarHBondContact CA-O 3.38Å
169	E	97	Very high	94.8	Very high	40 Å²	40	32.6 Å²	32.6	19%	0.187	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	149.1	170.8	-76	125.5	-154.6	0	0	112.2	H165 S167 V184 K185 I191	H165-E169 HydrophobicContact CB-CB 4.43Å; H165-E169 PolarHBondContact CD2-O 2.95Å; H165-E169 PolarHBondContact N-O 2.99Å; S167-E169 VanDerWaalsContact C-N 3.32Å; S167-E169 WeakPolarHBondContact CB-OE2 3.44Å; S167-E169 VanDerWaalsContact OG-CD 3.26Å; S167-E169 PolarHBondContact OG-OE2 3.01Å; E169-V184 CarbonylContact C-O 3.56Å; E169-V184 WeakPolarHBondContact CA-O 3.11Å; E169-K185 HydrophobicContact CG-CB 3.92Å; E169-K185 HydrophobicContact CG-CD 4.06Å; E169-K185 HydrophobicContact CG-CG 3.97Å; E169-K185 WeakPolarHBondContact OE1-CD 3.44Å; E169-K185 WeakPolarHBondContact OE1-CE 3.18Å; E169-K185 IonicContact OE1-NZ 2.67Å; E169-K185 PolarHBondContact OE1-NZ 3.11Å; E169-I191 WeakPolarHBondContact O-CD1 3.18Å
170	L	97.3	Very high	95	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	130	166.6	-75.8	164.1	0	0	0	108.9	I162 A163 N183 V184 I191 I194 F203 T205 F215 L220	I162-L170 HydrophobicContact CG2-CD2 4.46Å; A163-L170 WeakPolarHBondContact O-CA 3.2Å; L170-N183 WeakPolarHBondContact O-CA 3.25Å; L170-V184 PolarHBondContact N-O 3.13Å; L170-V184 PolarHBondContact O-N 2.8Å; L170-I191 HydrophobicContact CD2-CD1 3.7Å; L170-I191 HydrophobicContact CG-CD1 3.73Å; L170-I194 HydrophobicContact CD2-CD1 3.69Å; L170-F203 HydrophobicContact CD1-CE2 3.99Å; L170-F203 HydrophobicContact CD1-CZ 4.05Å; L170-F203 HydrophobicContact CD2-CE2 4.02Å; L170-F203 HydrophobicContact CD2-CZ 4.41Å; L170-T205 HydrophobicContact CD1-CG2 4.1Å; L170-T205 HydrophobicContact CD2-CG2 4Å; L170-F215 HydrophobicContact CD1-CD1 4.07Å; L170-F215 HydrophobicContact CD1-CD2 4.14Å; L170-F215 HydrophobicContact CD1-CE1 3.57Å; L170-F215 HydrophobicContact CD1-CE2 3.68Å; L170-F215 HydrophobicContact CD1-CG 4.33Å; L170-F215 HydrophobicContact CD1-CZ 3.37Å; L170-L220 HydrophobicContact CB-CD1 4.2Å
171	N	95.8	Very high	95	Very high	17 Å²	17	36 Å²	36	9%	0.091	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	136.4	175	-72.4	10.5	0	0	0	110.1	A163 H165 Y173 V182 N183	A163-N171 PolarHBondContact N-O 3.02Å; A163-N171 PolarHBondContact O-N 3.15Å; H165-N171 PolarHBondContact NE2-ND2 2.84Å; N171-Y173 HydrophobicContact CB-CD2 4.02Å; N171-Y173 HydrophobicContact CB-CE2 3.43Å; N171-Y173 VanDerWaalsContact CB-CE2 3.43Å; N171-Y173 PolarHBondContact ND2-OH 2.88Å; N171-V182 WeakPolarHBondContact CA-O 3.28Å; N171-N183 PolarHBondContact OD1-ND2 2.82Å
172	Q	95.5	Very high	95	Very high	13 Å²	13	38 Å²	38	6%	0.061	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	119.8	165	-166	-174.8	40.2	0	0	107.7	C160 I161 L181 V182 S217 T218 L220	C160-Q172 HydrophobicContact CB-CG 3.79Å; C160-Q172 PolarHBondContact SG-NE2 2.81Å; C160-Q172 VanDerWaalsContact SG-NE2 3.42Å; I161-Q172 CarbonylContact O-C 3.51Å; I161-Q172 WeakPolarHBondContact O-CA 3.38Å; Q172-L181 HydrophobicContact CB-CB 4.41Å; Q172-L181 HydrophobicContact CG-CB 4.45Å; Q172-L181 HydrophobicContact CG-CD1 4.39Å; Q172-L181 PolarHBondContact O-N 3.32Å; Q172-V182 HydrophobicContact CB-CB 4.07Å; Q172-V182 PolarHBondContact N-O 3.14Å; Q172-V182 PolarHBondContact O-N 3.46Å; Q172-V182 VanDerWaalsContact OE1-CG2 3.26Å; Q172-S217 PolarHBondContact NE2-O 3.28Å; Q172-T218 PolarHBondContact NE2-O 3.37Å; Q172-T218 VanDerWaalsContact NE2-O 3.16Å; Q172-T218 PolarHBondContact OE1-O 2.9Å; Q172-L220 HydrophobicContact CB-CD1 3.97Å; Q172-L220 HydrophobicContact CB-CD2 4.43Å; Q172-L220 HydrophobicContact CB-CG 4.28Å
173	Y	95.1	Very high	94.9	Very high	10 Å²	10	42.4 Å²	42.4	4%	0.039	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136.6	178.5	-64.9	-84.5	0	0	0	110.7	I142 I149 C160 I161 A163 N171 A175 E179 V180	I142-Y173 HydrophobicContact CD1-CD1 4.31Å; I142-Y173 HydrophobicContact CD1-CG 4.23Å; I142-Y173 HydrophobicContact CG2-CD1 3.66Å; I142-Y173 HydrophobicContact CG2-CE1 3.67Å; I142-Y173 HydrophobicContact CG2-CG 4.41Å; I149-Y173 HydrophobicContact CD1-CE2 4.31Å; C160-Y173 CarbonylContact C-O 3.56Å; C160-Y173 WeakPolarHBondContact CA-O 3.41Å; C160-Y173 WeakPolarHBondContact CB-O 3.3Å; I161-Y173 PolarHBondContact N-O 2.83Å; I161-Y173 PolarHBondContact O-N 2.89Å; A163-Y173 HydrophobicContact CB-CD2 4.17Å; A163-Y173 HydrophobicContact CB-CE2 3.86Å; N171-Y173 HydrophobicContact CB-CD2 4.02Å; N171-Y173 HydrophobicContact CB-CE2 3.43Å; N171-Y173 VanDerWaalsContact CB-CE2 3.43Å; N171-Y173 PolarHBondContact ND2-OH 2.88Å; Y173-A175 PolarHBondContact O-N 3.48Å; Y173-E179 CarbonylContact C-O 3.53Å; Y173-E179 WeakPolarHBondContact CA-O 3.45Å; Y173-V180 HydrophobicContact CD1-CG2 3.86Å; Y173-V180 HydrophobicContact CE1-CG2 3.51Å
174	S	94.3	Very high	94.9	Very high	13 Å²	13	44.2 Å²	44.2	9%	0.091	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	123.7	171.2	170.3	0	0	0	0	110.9	K176 S177 G178 E179	S174-K176 PolarHBondContact O-N 3.34Å; S174-K176 PolarHBondContact OG-N 3.39Å; S174-S177 VanDerWaalsContact CB-OG 3.22Å; S174-S177 WeakPolarHBondContact CB-OG 3.42Å; S174-S177 PolarHBondContact OG-N 3.47Å; S174-S177 PolarHBondContact OG-OG 2.69Å; S174-G178 VanDerWaalsContact O-CA 3.23Å; S174-G178 WeakPolarHBondContact O-CA 3.28Å; S174-G178 PolarHBondContact O-N 2.98Å; S174-E179 PolarHBondContact N-O 2.81Å
175	A	92.4	Very high	94.9	Very high	9 Å²	9	49.8 Å²	49.8	7%	0.074	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-8.3	174.6	0	0	0	0	0	113.1	M140 W154 G158 E159 Y173	M140-A175 VanDerWaalsContact CE-O 3.28Å; M140-A175 WeakPolarHBondContact CE-O 3.43Å; W154-A175 HydrophobicContact CH2-CB 4.4Å; W154-A175 HydrophobicContact CZ3-CB 3.69Å; G158-A175 WeakPolarHBondContact O-CB 3.29Å; E159-A175 WeakPolarHBondContact O-CB 3.2Å; E159-A175 PolarHBondContact O-N 2.52Å; Y173-A175 PolarHBondContact O-N 3.48Å
176	K	91.6	Very high	94.9	Very high	152 Å²	152	52.9 Å²	52.9	66%	0.661	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-35.8	-179.8	-63.2	173.6	-171.6	164.3	0	113.2	E159 S174	E159-K176 IonicContact OE1-NZ 3.22Å; E159-K176 PolarHBondContact OE1-NZ 2.86Å; S174-K176 PolarHBondContact O-N 3.34Å; S174-K176 PolarHBondContact OG-N 3.39Å
177	S	92.5	Very high	95	Very high	61 Å²	61	48.8 Å²	48.8	43%	0.427	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-14.8	-176.4	60.6	0	0	0	0	114.5	S174 E179	S174-S177 VanDerWaalsContact CB-OG 3.22Å; S174-S177 WeakPolarHBondContact CB-OG 3.42Å; S174-S177 PolarHBondContact OG-N 3.47Å; S174-S177 PolarHBondContact OG-OG 2.69Å; S177-E179 VanDerWaalsContact CB-OE2 3.23Å; S177-E179 WeakPolarHBondContact CB-OE2 3.39Å; S177-E179 PolarHBondContact O-N 3.01Å; S177-E179 PolarHBondContact OG-OE2 3.05Å
178	G	91.1	Very high	95.1	Very high	15 Å²	15	52 Å²	52	16%	0.155	28%	0.279	C	S	.	.			trans	74.7	0	-175.3	0	0	0	0	0	115.1	S174	S174-G178 VanDerWaalsContact O-CA 3.23Å; S174-G178 WeakPolarHBondContact O-CA 3.28Å; S174-G178 PolarHBondContact O-N 2.98Å
179	E	93.4	Very high	95.1	Very high	127 Å²	127	58.8 Å²	58.8	59%	0.593	31%	0.305	S	S	*	.			trans	-71.5	149.1	-179.7	-65.6	166.7	129.1	0	0	111.8	Y173 S174 S177 L181	Y173-E179 CarbonylContact C-O 3.53Å; Y173-E179 WeakPolarHBondContact CA-O 3.45Å; S174-E179 PolarHBondContact N-O 2.81Å; S177-E179 VanDerWaalsContact CB-OE2 3.23Å; S177-E179 WeakPolarHBondContact CB-OE2 3.39Å; S177-E179 PolarHBondContact O-N 3.01Å; S177-E179 PolarHBondContact OG-OE2 3.05Å; E179-L181 PolarHBondContact O-N 3.32Å
180	V	94	Very high	95.1	Very high	80 Å²	80	58.6 Å²	58.6	49%	0.485	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	114.9	170.5	-179.1	0	0	0	0	108.4	Y173 N183	Y173-V180 HydrophobicContact CD1-CG2 3.86Å; Y173-V180 HydrophobicContact CE1-CG2 3.51Å; V180-N183 HydrophobicContact CG1-CB 4.23Å
181	L	94.3	Very high	95.2	Very high	94 Å²	94	58.6 Å²	58.6	49%	0.492	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-45.8	175.7	-61.9	176.4	0	0	0	111	C160 Q172 E179	C160-L181 HydrophobicContact CB-CD1 4.11Å; Q172-L181 HydrophobicContact CB-CB 4.41Å; Q172-L181 HydrophobicContact CG-CB 4.45Å; Q172-L181 HydrophobicContact CG-CD1 4.39Å; Q172-L181 PolarHBondContact O-N 3.32Å; E179-L181 PolarHBondContact O-N 3.32Å
182	V	95.3	Very high	95.3	Very high	43 Å²	43	59.3 Å²	59.3	26%	0.261	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	142	-178.4	-172.7	0	0	0	0	109.4	N171 Q172 V184 L220	N171-V182 WeakPolarHBondContact CA-O 3.28Å; Q172-V182 HydrophobicContact CB-CB 4.07Å; Q172-V182 PolarHBondContact N-O 3.14Å; Q172-V182 PolarHBondContact O-N 3.46Å; Q172-V182 VanDerWaalsContact OE1-CG2 3.26Å; V182-V184 HydrophobicContact CG1-CG2 3.92Å; V182-L220 HydrophobicContact CB-CD1 3.99Å; V182-L220 HydrophobicContact CB-CG 4.22Å; V182-L220 HydrophobicContact CG1-CB 4.12Å; V182-L220 HydrophobicContact CG1-CD1 3.9Å; V182-L220 HydrophobicContact CG1-CG 4.04Å
183	N	95.2	Very high	95.4	Very high	94 Å²	94	59.2 Å²	59.2	50%	0.503	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	130.7	171.2	165.6	-101.8	0	0	0	108.9	L170 N171 V180	L170-N183 WeakPolarHBondContact O-CA 3.25Å; N171-N183 PolarHBondContact OD1-ND2 2.82Å; V180-N183 HydrophobicContact CG1-CB 4.23Å
184	V	96.8	Very high	95.5	Very high	37 Å²	37	58.9 Å²	58.9	22%	0.224	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	147.8	178.1	-167.2	0	0	0	0	109.6	E169 L170 V182 E186 L220	E169-V184 CarbonylContact C-O 3.56Å; E169-V184 WeakPolarHBondContact CA-O 3.11Å; L170-V184 PolarHBondContact N-O 3.13Å; L170-V184 PolarHBondContact O-N 2.8Å; V182-V184 HydrophobicContact CG1-CG2 3.92Å; V184-E186 HydrophobicContact CG1-CG 3.98Å; V184-L220 HydrophobicContact CG2-CB 3.82Å; V184-L220 HydrophobicContact CG2-CD1 4.33Å
185	K	96.7	Very high	95.7	Very high	117 Å²	117	60 Å²	60	51%	0.509	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	85.8	176.7	-171.1	171.1	-163.6	142.6	0	112.1	S167 E169	S167-K185 VanDerWaalsContact O-CE 3.25Å; S167-K185 WeakPolarHBondContact O-CE 3.49Å; S167-K185 PolarHBondContact O-NZ 2.91Å; E169-K185 HydrophobicContact CG-CB 3.92Å; E169-K185 HydrophobicContact CG-CD 4.06Å; E169-K185 HydrophobicContact CG-CG 3.97Å; E169-K185 WeakPolarHBondContact OE1-CD 3.44Å; E169-K185 WeakPolarHBondContact OE1-CE 3.18Å; E169-K185 IonicContact OE1-NZ 2.67Å; E169-K185 PolarHBondContact OE1-NZ 3.11Å
186	E	96.8	Very high	96	Very high	69 Å²	69	61.7 Å²	61.7	32%	0.322	32%	0.318	S	S	.	.			trans	-97.8	-22.4	179.9	-80.2	-53.3	121	0	0	114.8	V184 K213 F215 H222	V184-E186 HydrophobicContact CG1-CG 3.98Å; E186-K213 HydrophobicContact CB-CD 3.89Å; E186-K213 VanDerWaalsContact O-CE 3.28Å; E186-K213 WeakPolarHBondContact O-CE 3.34Å; E186-K213 IonicContact OE2-NZ 3.22Å; E186-K213 PolarHBondContact OE2-NZ 3.03Å; E186-F215 HydrophobicContact CB-CE1 4.01Å; E186-F215 HydrophobicContact CB-CZ 3.74Å; E186-F215 HydrophobicContact CG-CE1 3.63Å; E186-F215 HydrophobicContact CG-CZ 3.89Å; E186-H222 HydrophobicContact CG-CB 4.02Å; E186-H222 IonicContact OE2-CD2 2.69Å; E186-H222 IonicContact OE2-CG 3.92Å
187	H	98	Very high	96.2	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.019	29%	0.291	C	S	.	.			trans	-99.7	145.4	177.1	-75.9	-71.2	0	0	0	111.7	G168 R189 I191 T205 S207 D209 T211	G168-H187 WeakPolarHBondContact CA-O 3.39Å; G168-H187 PolarHBondContact O-N 3.48Å; H187-R189 WeakPolarHBondContact CB-O 3.34Å; H187-I191 HydrophobicContact CB-CG1 4.27Å; H187-T205 PolarHBondContact NE2-OG1 3.09Å; H187-S207 WeakPolarHBondContact CE1-CB 3.38Å; H187-S207 WeakPolarHBondContact ND1-CB 3.5Å; H187-S207 PolarHBondContact ND1-OG 2.95Å; H187-D209 WeakPolarHBondContact CA-OD2 3.34Å; H187-D209 WeakPolarHBondContact CB-OD2 3.42Å; H187-D209 IonicContact CE1-OD1 3.67Å; H187-D209 IonicContact CG-OD2 3.8Å; H187-D209 IonicContact ND1-OD1 2.82Å; H187-D209 PolarHBondContact ND1-OD1 3.33Å; H187-D209 IonicContact ND1-OD2 3.73Å; H187-D209 PolarHBondContact ND1-OD2 2.85Å; H187-T211 PolarHBondContact CE1-OG1 3.05Å; H187-T211 PolarHBondContact ND1-OG1 3.17Å
188	S	97.5	Very high	96.2	Very high	96 Å²	96	60 Å²	60	67%	0.671	30%	0.3	S	S	*	.	S	Bend	trans	-89.5	-6	177.3	62.4	0	0	0	0	113.2	D209	S188-D209 PolarHBondContact N-OD2 3.16Å; S188-D209 WeakPolarHBondContact OG-CB 2.97Å; S188-D209 PolarHBondContact OG-OD2 2.68Å
189	R	97.2	Very high	96.3	Very high	143 Å²	143	64.2 Å²	64.2	54%	0.54	32%	0.319	S	S	.	.	S	Bend	trans	-148.1	171	-179.6	-64.7	179.7	169.3	-169.1	-4.9	110.3	G168 H187 I191 S207 K208 D209	G168-R189 VanDerWaalsContact CA-O 3.23Å; G168-R189 WeakPolarHBondContact CA-O 3.38Å; H187-R189 WeakPolarHBondContact CB-O 3.34Å; R189-I191 PolarHBondContact O-N 3.42Å; R189-S207 PolarHBondContact O-OG 3.37Å; R189-K208 HydrophobicContact CB-CB 4.01Å; R189-K208 WeakPolarHBondContact CD-O 3.35Å; R189-K208 PolarHBondContact NH1-O 2.92Å; R189-D209 HydrophobicContact CB-CB 4.09Å; R189-D209 HydrophobicContact CG-CB 4.16Å
190	Q	97	Very high	96.3	Very high	37 Å²	37	60.1 Å²	60.1	17%	0.173	30%	0.301	C	S	.	.			trans	-39.6	126.9	174.6	170.7	177.6	0.5	0	0	113.8	T150 E166 N192 S207 K208	T150-Q190 HydrophobicContact CG2-CG 4.07Å; E166-Q190 HydrophobicContact CG-CB 4.38Å; E166-Q190 WeakPolarHBondContact O-CA 3.41Å; E166-Q190 PolarHBondContact O-N 2.87Å; E166-Q190 VanDerWaalsContact O-N 3.12Å; Q190-N192 PolarHBondContact NE2-OD1 3.34Å; Q190-S207 WeakPolarHBondContact O-CA 3.45Å; Q190-S207 PolarHBondContact O-OG 2.84Å; Q190-K208 HydrophobicContact CB-CD 4.16Å; Q190-K208 HydrophobicContact CB-CG 4.38Å; Q190-K208 HydrophobicContact CG-CD 4.46Å; Q190-K208 PolarHBondContact O-N 2.84Å; Q190-K208 VanDerWaalsContact OE1-CE 3.32Å
191	I	98.2	Very high	96.4	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	130.4	162.1	-60.6	171.9	0	0	0	108.1	T150 H165 E169 L170 H187 R189 D193 I194 A206	T150-I191 VanDerWaalsContact CB-O 3.25Å; T150-I191 WeakPolarHBondContact CB-O 3.17Å; T150-I191 PolarHBondContact OG1-O 2.88Å; H165-I191 PolarHBondContact O-N 3.41Å; E169-I191 WeakPolarHBondContact O-CD1 3.18Å; L170-I191 HydrophobicContact CD2-CD1 3.7Å; L170-I191 HydrophobicContact CG-CD1 3.73Å; H187-I191 HydrophobicContact CB-CG1 4.27Å; R189-I191 PolarHBondContact O-N 3.42Å; I191-D193 WeakPolarHBondContact CG2-O 3.37Å; I191-I194 HydrophobicContact CG2-CD1 4.36Å; I191-I194 HydrophobicContact CG2-CG1 3.94Å; I191-A206 CarbonylContact C-O 3.58Å; I191-A206 WeakPolarHBondContact CA-O 3.41Å
192	N	97.6	Very high	96.5	Very high	32 Å²	32	57.8 Å²	57.8	17%	0.171	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-37.1	-178.4	-65.6	-43.7	0	0	0	112.1	Q190 A206 K208 V232 N233	Q190-N192 PolarHBondContact NE2-OD1 3.34Å; N192-A206 PolarHBondContact N-O 2.9Å; N192-K208 VanDerWaalsContact ND2-CG 3.33Å; N192-K208 WeakPolarHBondContact ND2-CG 3.22Å; N192-K208 PolarHBondContact ND2-N 2.86Å; N192-K208 VanDerWaalsContact OD1-CE 3.26Å; N192-K208 WeakPolarHBondContact OD1-CE 3.49Å; N192-K208 WeakPolarHBondContact OD1-CG 3.14Å; N192-V232 PolarHBondContact ND2-O 2.96Å; N192-N233 WeakPolarHBondContact CB-O 3.38Å
193	D	98.3	Very high	96.6	Very high	11 Å²	11	55.8 Å²	55.8	6%	0.059	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	156.1	-175.1	-167.7	19.2	0	0	0	111	I191 Q195 T205 A206 N233 S234	I191-D193 WeakPolarHBondContact CG2-O 3.37Å; D193-Q195 PolarHBondContact OD2-NE2 2.89Å; D193-T205 WeakPolarHBondContact O-CA 3.43Å; D193-A206 HydrophobicContact CB-CB 4.21Å; D193-A206 PolarHBondContact O-N 2.91Å; D193-N233 WeakPolarHBondContact CB-O 3.16Å; D193-S234 VanDerWaalsContact OD2-CB 3.27Å; D193-S234 WeakPolarHBondContact OD2-CB 3.35Å; D193-S234 PolarHBondContact OD2-OG 2.86Å
194	I	98.4	Very high	96.8	Very high	3 Å²	3	51.3 Å²	51.3	2%	0.015	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	125.5	175.6	-60.2	-172.4	0	0	0	107.6	S151 V153 G164 L170 I191 F203 V204 T205	S151-I194 PolarHBondContact OG-N 3.12Å; V153-I194 HydrophobicContact CG1-CB 4.43Å; V153-I194 HydrophobicContact CG1-CG2 4.34Å; V153-I194 WeakPolarHBondContact CG1-O 3.19Å; V153-I194 HydrophobicContact CG2-CG2 3.71Å; G164-I194 VanDerWaalsContact N-CD1 3.3Å; L170-I194 HydrophobicContact CD2-CD1 3.69Å; I191-I194 HydrophobicContact CG2-CD1 4.36Å; I191-I194 HydrophobicContact CG2-CG1 3.94Å; I194-F203 HydrophobicContact CG2-CB 4.39Å; I194-F203 HydrophobicContact CG2-CD2 3.77Å; I194-F203 HydrophobicContact CG2-CE2 4.45Å; I194-F203 HydrophobicContact CG2-CG 4.34Å; I194-V204 WeakPolarHBondContact CA-O 3.46Å; I194-T205 HydrophobicContact CG1-CG2 4.27Å
195	Q	98.3	Very high	96.9	Very high	37 Å²	37	49.5 Å²	49.5	17%	0.173	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137	175.2	-60.5	-168.3	27	0	0	111.5	D193 F203 V204 S234 A235 A236 V291	D193-Q195 PolarHBondContact OD2-NE2 2.89Å; Q195-F203 CarbonylContact O-C 3.54Å; Q195-F203 VanDerWaalsContact O-CA 3.3Å; Q195-F203 WeakPolarHBondContact O-CA 3.27Å; Q195-F203 WeakPolarHBondContact O-CB 3.46Å; Q195-V204 HydrophobicContact CB-CG1 4.26Å; Q195-V204 PolarHBondContact N-O 2.94Å; Q195-V204 PolarHBondContact O-N 3.16Å; Q195-S234 PolarHBondContact NE2-OG 2.78Å; Q195-A235 VanDerWaalsContact CD-O 3.29Å; Q195-A235 WeakPolarHBondContact CG-O 3.41Å; Q195-A235 PolarHBondContact NE2-O 3.1Å; Q195-A236 VanDerWaalsContact OE1-CB 3.25Å; Q195-V291 PolarHBondContact NE2-O 2.95Å
196	L	96.9	Very high	97	Very high	44 Å²	44	44 Å²	44	23%	0.23	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	153.7	176.9	-73.2	149	0	0	0	111.7	V153 W154 M200 F203	V153-L196 HydrophobicContact CB-CD1 4.17Å; V153-L196 HydrophobicContact CG2-CD1 3.95Å; V153-L196 HydrophobicContact CG2-CG 4.2Å; W154-L196 WeakPolarHBondContact O-CD1 3.38Å; L196-M200 HydrophobicContact CB-CG 4.25Å; L196-M200 HydrophobicContact CD1-CG 4.2Å; L196-M200 HydrophobicContact CD2-CB 4.17Å; L196-M200 HydrophobicContact CD2-CG 4.31Å; L196-M200 HydrophobicContact CG-CG 4.48Å; L196-F203 HydrophobicContact CD2-CB 4Å; L196-F203 HydrophobicContact CG-CB 4.38Å
197	S	96.3	Very high	97	Very high	14 Å²	14	40.7 Å²	40.7	10%	0.098	20%	0.201	C	C	.	.			trans	-61.5	159.7	156.8	53	0	0	0	0	111	D199 M200 T201 M202	S197-D199 VanDerWaalsContact C-N 3.27Å; S197-D199 VanDerWaalsContact CB-OD1 3.28Å; S197-D199 WeakPolarHBondContact CB-OD1 3.35Å; S197-D199 PolarHBondContact O-N 2.84Å; S197-D199 PolarHBondContact OG-OD1 3.44Å; S197-M200 PolarHBondContact O-N 2.67Å; S197-M200 WeakPolarHBondContact OG-CA 3.26Å; S197-M200 PolarHBondContact OG-N 3.07Å; S197-T201 PolarHBondContact OG-N 2.94Å; S197-M202 WeakPolarHBondContact CB-O 3.35Å; S197-M202 PolarHBondContact N-O 3.49Å; S197-M202 PolarHBondContact OG-N 2.99Å; S197-M202 PolarHBondContact OG-O 3.32Å
198	R	92.9	Very high	97	Very high	163 Å²	163	44.4 Å²	44.4	62%	0.615	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-33.2	-176.9	-178.3	178.6	-175	170	9.1	113.5	P239 P295	R198-P239 HydrophobicContact CB-CB 4.22Å; R198-P295 PolarHBondContact NH1-O 2.8Å
199	D	93	Very high	97	Very high	103 Å²	103	41.1 Å²	41.1	55%	0.551	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-0.5	177	64	-35.2	0	0	0	112.9	S197 T201	S197-D199 VanDerWaalsContact C-N 3.27Å; S197-D199 VanDerWaalsContact CB-OD1 3.28Å; S197-D199 WeakPolarHBondContact CB-OD1 3.35Å; S197-D199 PolarHBondContact O-N 2.84Å; S197-D199 PolarHBondContact OG-OD1 3.44Å; D199-T201 HydrophobicContact CB-CG2 4.49Å; D199-T201 VanDerWaalsContact CG-OG1 3.25Å; D199-T201 PolarHBondContact O-N 2.95Å; D199-T201 VanDerWaalsContact O-N 3.13Å; D199-T201 PolarHBondContact OD1-OG1 3.36Å; D199-T201 WeakPolarHBondContact OD2-CB 3.39Å; D199-T201 WeakPolarHBondContact OD2-CG2 3.18Å; D199-T201 PolarHBondContact OD2-OG1 3.43Å
200	M	93.8	Very high	96.9	Very high	42 Å²	42	36.5 Å²	36.5	21%	0.207	18%	0.178	C	C	.	.	S	Bend	trans	58.3	15.1	-179.2	-60.5	116.8	-173.1	0	0	115.7	W62 F103 L196 S197 S217	W62-M200 HydrophobicContact CH2-CE 4.47Å; W62-M200 HydrophobicContact CZ3-CE 4.43Å; F103-M200 HydrophobicContact CE1-CE 3.55Å; F103-M200 HydrophobicContact CE1-SD 3.55Å; F103-M200 VanDerWaalsContact CE1-SD 3.55Å; F103-M200 HydrophobicContact CZ-CE 3.92Å; F103-M200 HydrophobicContact CZ-CG 4.37Å; F103-M200 HydrophobicContact CZ-SD 3.62Å; L196-M200 HydrophobicContact CB-CG 4.25Å; L196-M200 HydrophobicContact CD1-CG 4.2Å; L196-M200 HydrophobicContact CD2-CB 4.17Å; L196-M200 HydrophobicContact CD2-CG 4.31Å; L196-M200 HydrophobicContact CG-CG 4.48Å; S197-M200 PolarHBondContact O-N 2.67Å; S197-M200 WeakPolarHBondContact OG-CA 3.26Å; S197-M200 PolarHBondContact OG-N 3.07Å; M200-S217 WeakPolarHBondContact O-CB 3.32Å; M200-S217 PolarHBondContact O-OG 3.29Å
201	T	95.5	Very high	97	Very high	69 Å²	69	35.2 Å²	35.2	42%	0.423	17%	0.173	S	C	.	.	S	Bend	trans	-72	-33.8	175.1	55.7	0	0	0	0	111.7	S197 D199 S217	S197-T201 PolarHBondContact OG-N 2.94Å; D199-T201 HydrophobicContact CB-CG2 4.49Å; D199-T201 VanDerWaalsContact CG-OG1 3.25Å; D199-T201 PolarHBondContact O-N 2.95Å; D199-T201 VanDerWaalsContact O-N 3.13Å; D199-T201 PolarHBondContact OD1-OG1 3.36Å; D199-T201 WeakPolarHBondContact OD2-CB 3.39Å; D199-T201 WeakPolarHBondContact OD2-CG2 3.18Å; D199-T201 PolarHBondContact OD2-OG1 3.43Å; T201-S217 WeakPolarHBondContact O-CB 3.44Å; T201-S217 PolarHBondContact O-N 3.23Å; T201-S217 PolarHBondContact O-OG 3.21Å; T201-S217 VanDerWaalsContact O-OG 3.07Å
202	M	97.1	Very high	97	Very high	56 Å²	56	35.2 Å²	35.2	28%	0.276	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	159.4	179.2	-48.5	-172.6	94.3	0	0	112.2	S197 L214 F215 Q223	S197-M202 WeakPolarHBondContact CB-O 3.35Å; S197-M202 PolarHBondContact N-O 3.49Å; S197-M202 PolarHBondContact OG-N 2.99Å; S197-M202 PolarHBondContact OG-O 3.32Å; M202-L214 HydrophobicContact CB-CD1 4.23Å; M202-L214 HydrophobicContact CE-CD1 4.42Å; M202-L214 HydrophobicContact CE-CD2 3.45Å; M202-L214 VanDerWaalsContact CE-CD2 3.45Å; M202-L214 HydrophobicContact CE-CG 3.76Å; M202-L214 HydrophobicContact SD-CD1 4.43Å; M202-L214 HydrophobicContact SD-CD2 4.04Å; M202-L214 HydrophobicContact SD-CG 4.38Å; M202-F215 CarbonylContact C-O 3.56Å; M202-F215 WeakPolarHBondContact CA-O 3.41Å; M202-F215 WeakPolarHBondContact CB-O 3.35Å; M202-Q223 HydrophobicContact CE-CB 4.19Å; M202-Q223 HydrophobicContact CE-CG 3.88Å
203	F	98.1	Very high	97.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	155.7	163.6	67.2	-85.4	0	0	0	111.6	I162 L170 I194 Q195 L196 T205 F215 D216 L220	I162-F203 HydrophobicContact CD1-CD1 3.79Å; I162-F203 HydrophobicContact CD1-CE1 3.87Å; I162-F203 HydrophobicContact CG2-CE1 4.07Å; I162-F203 HydrophobicContact CG2-CE2 4.09Å; I162-F203 HydrophobicContact CG2-CZ 3.82Å; L170-F203 HydrophobicContact CD1-CE2 3.99Å; L170-F203 HydrophobicContact CD1-CZ 4.05Å; L170-F203 HydrophobicContact CD2-CE2 4.02Å; L170-F203 HydrophobicContact CD2-CZ 4.41Å; I194-F203 HydrophobicContact CG2-CB 4.39Å; I194-F203 HydrophobicContact CG2-CD2 3.77Å; I194-F203 HydrophobicContact CG2-CE2 4.45Å; I194-F203 HydrophobicContact CG2-CG 4.34Å; Q195-F203 CarbonylContact O-C 3.54Å; Q195-F203 VanDerWaalsContact O-CA 3.3Å; Q195-F203 WeakPolarHBondContact O-CA 3.27Å; Q195-F203 WeakPolarHBondContact O-CB 3.46Å; L196-F203 HydrophobicContact CD2-CB 4Å; L196-F203 HydrophobicContact CG-CB 4.38Å; F203-T205 HydrophobicContact CD2-CG2 4Å; F203-T205 HydrophobicContact CE2-CG2 3.69Å; F203-F215 HydrophobicContact CD1-CB 3.85Å; F203-F215 HydrophobicContact CD2-CB 4.19Å; F203-F215 HydrophobicContact CD2-CD2 4.1Å; F203-F215 HydrophobicContact CD2-CG 4.48Å; F203-F215 HydrophobicContact CE1-CB 3.36Å; F203-F215 HydrophobicContact CE1-CG 4.16Å; F203-F215 HydrophobicContact CE2-CB 3.75Å; F203-F215 AromaticContact CE2-CD2 3.53Å; F203-F215 HydrophobicContact CE2-CD2 3.53Å; F203-F215 HydrophobicContact CE2-CE2 4.29Å; F203-F215 AromaticContact CE2-CG 3.77Å; F203-F215 HydrophobicContact CE2-CG 3.77Å; F203-F215 HydrophobicContact CG-CB 4.25Å; F203-F215 HydrophobicContact CZ-CB 3.31Å; F203-F215 HydrophobicContact CZ-CD1 4.25Å; F203-F215 AromaticContact CZ-CD2 3.87Å; F203-F215 HydrophobicContact CZ-CD2 3.87Å; F203-F215 AromaticContact CZ-CG 3.57Å; F203-F215 HydrophobicContact CZ-CG 3.57Å; F203-F215 PolarHBondContact N-O 2.85Å; F203-F215 PolarHBondContact O-N 2.98Å; F203-D216 WeakPolarHBondContact CE1-O 3.42Å; F203-L220 HydrophobicContact CE1-CD2 3.65Å; F203-L220 HydrophobicContact CZ-CD2 3.76Å
204	V	98.6	Very high	97.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	139	171.6	68.1	0	0	0	0	110.3	I194 Q195 A212 K213 A235 L237 V244	I194-V204 WeakPolarHBondContact CA-O 3.46Å; Q195-V204 HydrophobicContact CB-CG1 4.26Å; Q195-V204 PolarHBondContact N-O 2.94Å; Q195-V204 PolarHBondContact O-N 3.16Å; V204-A212 HydrophobicContact CG2-CB 4.15Å; V204-K213 CarbonylContact C-O 3.59Å; V204-K213 VanDerWaalsContact CA-O 3.3Å; V204-K213 WeakPolarHBondContact CA-O 3.44Å; V204-A235 HydrophobicContact CG1-CB 4.04Å; V204-A235 WeakPolarHBondContact CG1-O 3.47Å; V204-A235 HydrophobicContact CG2-CB 3.8Å; V204-L237 HydrophobicContact CB-CD1 4.28Å; V204-L237 HydrophobicContact CB-CD2 4.12Å; V204-L237 HydrophobicContact CB-CG 4.04Å; V204-L237 HydrophobicContact CG1-CD1 4.35Å; V204-L237 HydrophobicContact CG1-CD2 4.32Å; V204-L237 HydrophobicContact CG1-CG 3.85Å; V204-V244 HydrophobicContact CG2-CG2 4.06Å
205	T	98.7	Very high	97.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	155	169.9	60.3	0	0	0	0	110.8	L170 H187 D193 I194 F203 A212 K213 F215	L170-T205 HydrophobicContact CD1-CG2 4.1Å; L170-T205 HydrophobicContact CD2-CG2 4Å; H187-T205 PolarHBondContact NE2-OG1 3.09Å; D193-T205 WeakPolarHBondContact O-CA 3.43Å; I194-T205 HydrophobicContact CG1-CG2 4.27Å; F203-T205 HydrophobicContact CD2-CG2 4Å; F203-T205 HydrophobicContact CE2-CG2 3.69Å; T205-A212 WeakPolarHBondContact O-CA 3.25Å; T205-A212 WeakPolarHBondContact O-CB 3.36Å; T205-K213 PolarHBondContact N-O 2.58Å; T205-K213 PolarHBondContact O-N 2.83Å; T205-K213 PolarHBondContact OG1-N 2.69Å; T205-K213 PolarHBondContact OG1-O 2.77Å; T205-F215 HydrophobicContact CG2-CD2 3.96Å; T205-F215 HydrophobicContact CG2-CE2 3.62Å
206	A	98.5	Very high	97.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	138.6	166.4	0	0	0	0	0	110.3	I191 N192 D193 V232 A235	I191-A206 CarbonylContact C-O 3.58Å; I191-A206 WeakPolarHBondContact CA-O 3.41Å; N192-A206 PolarHBondContact N-O 2.9Å; D193-A206 HydrophobicContact CB-CB 4.21Å; D193-A206 PolarHBondContact O-N 2.91Å; A206-V232 CarbonylContact C-O 3.56Å; A206-V232 HydrophobicContact CB-CB 4.11Å; A206-V232 HydrophobicContact CB-CG1 3.69Å; A206-A235 HydrophobicContact CB-CB 4.16Å
207	S	98.2	Very high	97	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	154.3	-174.2	178.3	0	0	0	0	115.7	H187 R189 Q190 D209 N210 T211 V232	H187-S207 WeakPolarHBondContact CE1-CB 3.38Å; H187-S207 WeakPolarHBondContact ND1-CB 3.5Å; H187-S207 PolarHBondContact ND1-OG 2.95Å; R189-S207 PolarHBondContact O-OG 3.37Å; Q190-S207 WeakPolarHBondContact O-CA 3.45Å; Q190-S207 PolarHBondContact O-OG 2.84Å; S207-D209 WeakPolarHBondContact CB-OD1 3.27Å; S207-D209 PolarHBondContact O-N 3.04Å; S207-D209 VanDerWaalsContact OG-CG 3.23Å; S207-D209 PolarHBondContact OG-N 3.47Å; S207-D209 PolarHBondContact OG-OD1 2.95Å; S207-D209 PolarHBondContact OG-OD2 2.86Å; S207-N210 PolarHBondContact O-N 3.44Å; S207-T211 PolarHBondContact N-O 2.86Å; S207-V232 CarbonylContact C-O 3.59Å; S207-V232 PolarHBondContact N-O 2.89Å; S207-V232 PolarHBondContact O-N 2.99Å
208	K	96.5	Very high	96.9	Very high	83 Å²	83	36 Å²	36	36%	0.361	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-1.2	170.7	-65.3	-169	179.4	166.9	0	114.6	R189 Q190 N192 N210	R189-K208 HydrophobicContact CB-CB 4.01Å; R189-K208 WeakPolarHBondContact CD-O 3.35Å; R189-K208 PolarHBondContact NH1-O 2.92Å; Q190-K208 HydrophobicContact CB-CD 4.16Å; Q190-K208 HydrophobicContact CB-CG 4.38Å; Q190-K208 HydrophobicContact CG-CD 4.46Å; Q190-K208 PolarHBondContact O-N 2.84Å; Q190-K208 VanDerWaalsContact OE1-CE 3.32Å; N192-K208 VanDerWaalsContact ND2-CG 3.33Å; N192-K208 WeakPolarHBondContact ND2-CG 3.22Å; N192-K208 PolarHBondContact ND2-N 2.86Å; N192-K208 VanDerWaalsContact OD1-CE 3.26Å; N192-K208 WeakPolarHBondContact OD1-CE 3.49Å; N192-K208 WeakPolarHBondContact OD1-CG 3.14Å; K208-N210 VanDerWaalsContact C-N 3.26Å
209	D	97	Very high	97.1	Very high	26 Å²	26	31.6 Å²	31.6	14%	0.139	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	13	170.2	67.4	18	0	0	0	114.4	H187 S188 R189 S207 T211	H187-D209 WeakPolarHBondContact CA-OD2 3.34Å; H187-D209 WeakPolarHBondContact CB-OD2 3.42Å; H187-D209 IonicContact CE1-OD1 3.67Å; H187-D209 IonicContact CG-OD2 3.8Å; H187-D209 IonicContact ND1-OD1 2.82Å; H187-D209 PolarHBondContact ND1-OD1 3.33Å; H187-D209 IonicContact ND1-OD2 3.73Å; H187-D209 PolarHBondContact ND1-OD2 2.85Å; S188-D209 PolarHBondContact N-OD2 3.16Å; S188-D209 WeakPolarHBondContact OG-CB 2.97Å; S188-D209 PolarHBondContact OG-OD2 2.68Å; R189-D209 HydrophobicContact CB-CB 4.09Å; R189-D209 HydrophobicContact CG-CB 4.16Å; S207-D209 WeakPolarHBondContact CB-OD1 3.27Å; S207-D209 PolarHBondContact O-N 3.04Å; S207-D209 VanDerWaalsContact OG-CG 3.23Å; S207-D209 PolarHBondContact OG-N 3.47Å; S207-D209 PolarHBondContact OG-OD1 2.95Å; S207-D209 PolarHBondContact OG-OD2 2.86Å; D209-T211 VanDerWaalsContact C-N 3.26Å; D209-T211 PolarHBondContact O-N 3.38Å; D209-T211 WeakPolarHBondContact OD1-CB 3.32Å; D209-T211 PolarHBondContact OD1-N 3.32Å; D209-T211 VanDerWaalsContact OD1-N 3.17Å; D209-T211 PolarHBondContact OD1-OG1 3.41Å
210	N	97	Very high	97.2	Very high	46 Å²	46	26.7 Å²	26.7	25%	0.246	15%	0.145	C	C	.	.	S	Bend	trans	70	17.4	179.2	-44.2	-18.1	0	0	0	114.1	S207 K208 T228 R230 P231	S207-N210 PolarHBondContact O-N 3.44Å; K208-N210 VanDerWaalsContact C-N 3.26Å; N210-T228 WeakPolarHBondContact CB-O 3.44Å; N210-T228 PolarHBondContact O-N 2.64Å; N210-T228 PolarHBondContact O-OG1 2.62Å; N210-R230 VanDerWaalsContact CA-O 3.29Å; N210-R230 WeakPolarHBondContact CA-O 3.37Å; N210-R230 VanDerWaalsContact CB-O 3.28Å; N210-R230 WeakPolarHBondContact CB-O 3.19Å; N210-R230 VanDerWaalsContact CG-C 3.42Å; N210-P231 VanDerWaalsContact OD1-CD 3.31Å; N210-P231 WeakPolarHBondContact OD1-CD 3.34Å
211	T	98.3	Very high	97.4	Very high	10 Å²	10	30.5 Å²	30.5	6%	0.061	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	151.2	175.6	71	0	0	0	0	112.6	H187 S207 D209 T225 F226 R227	H187-T211 PolarHBondContact CE1-OG1 3.05Å; H187-T211 PolarHBondContact ND1-OG1 3.17Å; S207-T211 PolarHBondContact N-O 2.86Å; D209-T211 VanDerWaalsContact C-N 3.26Å; D209-T211 PolarHBondContact O-N 3.38Å; D209-T211 WeakPolarHBondContact OD1-CB 3.32Å; D209-T211 PolarHBondContact OD1-N 3.32Å; D209-T211 VanDerWaalsContact OD1-N 3.17Å; D209-T211 PolarHBondContact OD1-OG1 3.41Å; T211-T225 HydrophobicContact CG2-CG2 3.89Å; T211-F226 WeakPolarHBondContact CA-O 3.42Å; T211-R227 HydrophobicContact CG2-CG 4.2Å
212	A	98.6	Very high	97.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	144.1	152.8	0	0	0	0	0	108.3	V204 T205 F226 V232 A235 L246	V204-A212 HydrophobicContact CG2-CB 4.15Å; T205-A212 WeakPolarHBondContact O-CA 3.25Å; T205-A212 WeakPolarHBondContact O-CB 3.36Å; A212-F226 HydrophobicContact CB-CB 4.43Å; A212-F226 HydrophobicContact CB-CD2 4.3Å; A212-F226 PolarHBondContact N-O 2.98Å; A212-F226 PolarHBondContact O-N 3.24Å; A212-V232 HydrophobicContact CB-CG1 4.47Å; A212-A235 HydrophobicContact CB-CB 3.98Å; A212-L246 HydrophobicContact CB-CD1 3.94Å; A212-L246 HydrophobicContact CB-CD2 3.7Å; A212-L246 HydrophobicContact CB-CG 3.75Å
213	K	98.7	Very high	97.5	Very high	19 Å²	19	31.5 Å²	31.5	8%	0.083	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	142.7	179.8	-78.8	175.6	165.3	-93.1	0	110.9	E186 V204 T205 F215 H222 K224 T225	E186-K213 HydrophobicContact CB-CD 3.89Å; E186-K213 VanDerWaalsContact O-CE 3.28Å; E186-K213 WeakPolarHBondContact O-CE 3.34Å; E186-K213 IonicContact OE2-NZ 3.22Å; E186-K213 PolarHBondContact OE2-NZ 3.03Å; V204-K213 CarbonylContact C-O 3.59Å; V204-K213 VanDerWaalsContact CA-O 3.3Å; V204-K213 WeakPolarHBondContact CA-O 3.44Å; T205-K213 PolarHBondContact N-O 2.58Å; T205-K213 PolarHBondContact O-N 2.83Å; T205-K213 PolarHBondContact OG1-N 2.69Å; T205-K213 PolarHBondContact OG1-O 2.77Å; K213-F215 HydrophobicContact CB-CD2 4.23Å; K213-F215 HydrophobicContact CB-CE2 3.36Å; K213-F215 HydrophobicContact CB-CZ 3.8Å; K213-F215 HydrophobicContact CD-CZ 4.14Å; K213-H222 PolarHBondContact NZ-CD2 3.3Å; K213-K224 CarbonylContact C-O 3.6Å; K213-K224 VanDerWaalsContact CA-O 3.28Å; K213-K224 WeakPolarHBondContact CA-O 3.23Å; K213-T225 HydrophobicContact CG-CG2 4.09Å; K213-T225 PolarHBondContact NZ-OG1 3.23Å
214	L	98.6	Very high	97.5	Very high	5 Å²	5	34.4 Å²	34.4	3%	0.026	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	140	176.8	-169.5	71.3	0	0	0	109.7	M202 Q223 K224 F226 L237 L272	M202-L214 HydrophobicContact CB-CD1 4.23Å; M202-L214 HydrophobicContact CE-CD1 4.42Å; M202-L214 HydrophobicContact CE-CD2 3.45Å; M202-L214 VanDerWaalsContact CE-CD2 3.45Å; M202-L214 HydrophobicContact CE-CG 3.76Å; M202-L214 HydrophobicContact SD-CD1 4.43Å; M202-L214 HydrophobicContact SD-CD2 4.04Å; M202-L214 HydrophobicContact SD-CG 4.38Å; L214-Q223 HydrophobicContact CB-CB 4.37Å; L214-Q223 HydrophobicContact CD2-CB 4.27Å; L214-Q223 HydrophobicContact CG-CB 4.36Å; L214-Q223 PolarHBondContact O-N 2.94Å; L214-K224 HydrophobicContact CB-CB 3.85Å; L214-K224 HydrophobicContact CB-CG 4.45Å; L214-K224 HydrophobicContact CD2-CB 4.24Å; L214-K224 HydrophobicContact CD2-CG 3.97Å; L214-K224 PolarHBondContact N-O 3.07Å; L214-K224 PolarHBondContact O-N 2.86Å; L214-F226 HydrophobicContact CB-CE2 4.14Å; L214-L237 HydrophobicContact CD1-CD1 3.93Å; L214-L237 HydrophobicContact CD1-CD2 3.75Å; L214-L237 HydrophobicContact CD1-CG 4.48Å; L214-L272 HydrophobicContact CD1-CD2 4.42Å; L214-L272 HydrophobicContact CD2-CD2 4.22Å
215	F	98.5	Very high	97.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	153.3	-175.5	-65.7	-92.4	0	0	0	112	L170 E186 M202 F203 T205 K213 L220 E221 H222	L170-F215 HydrophobicContact CD1-CD1 4.07Å; L170-F215 HydrophobicContact CD1-CD2 4.14Å; L170-F215 HydrophobicContact CD1-CE1 3.57Å; L170-F215 HydrophobicContact CD1-CE2 3.68Å; L170-F215 HydrophobicContact CD1-CG 4.33Å; L170-F215 HydrophobicContact CD1-CZ 3.37Å; E186-F215 HydrophobicContact CB-CE1 4.01Å; E186-F215 HydrophobicContact CB-CZ 3.74Å; E186-F215 HydrophobicContact CG-CE1 3.63Å; E186-F215 HydrophobicContact CG-CZ 3.89Å; M202-F215 CarbonylContact C-O 3.56Å; M202-F215 WeakPolarHBondContact CA-O 3.41Å; M202-F215 WeakPolarHBondContact CB-O 3.35Å; F203-F215 HydrophobicContact CD1-CB 3.85Å; F203-F215 HydrophobicContact CD2-CB 4.19Å; F203-F215 HydrophobicContact CD2-CD2 4.1Å; F203-F215 HydrophobicContact CD2-CG 4.48Å; F203-F215 HydrophobicContact CE1-CB 3.36Å; F203-F215 HydrophobicContact CE1-CG 4.16Å; F203-F215 HydrophobicContact CE2-CB 3.75Å; F203-F215 AromaticContact CE2-CD2 3.53Å; F203-F215 HydrophobicContact CE2-CD2 3.53Å; F203-F215 HydrophobicContact CE2-CE2 4.29Å; F203-F215 AromaticContact CE2-CG 3.77Å; F203-F215 HydrophobicContact CE2-CG 3.77Å; F203-F215 HydrophobicContact CG-CB 4.25Å; F203-F215 HydrophobicContact CZ-CB 3.31Å; F203-F215 HydrophobicContact CZ-CD1 4.25Å; F203-F215 AromaticContact CZ-CD2 3.87Å; F203-F215 HydrophobicContact CZ-CD2 3.87Å; F203-F215 AromaticContact CZ-CG 3.57Å; F203-F215 HydrophobicContact CZ-CG 3.57Å; F203-F215 PolarHBondContact N-O 2.85Å; F203-F215 PolarHBondContact O-N 2.98Å; T205-F215 HydrophobicContact CG2-CD2 3.96Å; T205-F215 HydrophobicContact CG2-CE2 3.62Å; K213-F215 HydrophobicContact CB-CD2 4.23Å; K213-F215 HydrophobicContact CB-CE2 3.36Å; K213-F215 HydrophobicContact CB-CZ 3.8Å; K213-F215 HydrophobicContact CD-CZ 4.14Å; F215-L220 WeakPolarHBondContact CD1-O 3.21Å; F215-E221 VanDerWaalsContact CA-O 3.28Å; F215-E221 WeakPolarHBondContact CA-O 3.38Å; F215-H222 HydrophobicContact CD1-CB 4.3Å; F215-H222 HydrophobicContact CE1-CB 4.04Å
216	D	97.4	Very high	97.5	Very high	48 Å²	48	34.8 Å²	34.8	26%	0.257	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	133.2	160	-178.8	-74.1	0	0	0	110.2	F203 T218 T219 L220 E221	F203-D216 WeakPolarHBondContact CE1-O 3.42Å; D216-T218 VanDerWaalsContact C-N 3.33Å; D216-T218 PolarHBondContact O-N 2.85Å; D216-T218 WeakPolarHBondContact OD1-CA 3.4Å; D216-T218 WeakPolarHBondContact OD1-CB 3.32Å; D216-T218 PolarHBondContact OD1-N 3.42Å; D216-T219 WeakPolarHBondContact CB-OG1 3.27Å; D216-T219 PolarHBondContact OD1-N 2.84Å; D216-T219 PolarHBondContact OD1-OG1 3.32Å; D216-L220 VanDerWaalsContact O-CA 3.27Å; D216-L220 WeakPolarHBondContact O-CA 3.45Å; D216-L220 PolarHBondContact O-N 2.99Å; D216-E221 HydrophobicContact CB-CB 4.49Å; D216-E221 PolarHBondContact N-O 2.59Å
217	S	96.2	Very high	97.4	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.007	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-19.9	-175.5	69.5	0	0	0	0	114.8	Q172 M200 T201	Q172-S217 PolarHBondContact NE2-O 3.28Å; M200-S217 WeakPolarHBondContact O-CB 3.32Å; M200-S217 PolarHBondContact O-OG 3.29Å; T201-S217 WeakPolarHBondContact O-CB 3.44Å; T201-S217 PolarHBondContact O-N 3.23Å; T201-S217 PolarHBondContact O-OG 3.21Å; T201-S217 VanDerWaalsContact O-OG 3.07Å
218	T	94.7	Very high	97.3	Very high	86 Å²	86	44.3 Å²	44.3	53%	0.528	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-42.2	-175.6	-57.4	0	0	0	0	110.9	Q172 D216	Q172-T218 PolarHBondContact NE2-O 3.37Å; Q172-T218 VanDerWaalsContact NE2-O 3.16Å; Q172-T218 PolarHBondContact OE1-O 2.9Å; D216-T218 VanDerWaalsContact C-N 3.33Å; D216-T218 PolarHBondContact O-N 2.85Å; D216-T218 WeakPolarHBondContact OD1-CA 3.4Å; D216-T218 WeakPolarHBondContact OD1-CB 3.32Å; D216-T218 PolarHBondContact OD1-N 3.42Å
219	T	95.3	Very high	97	Very high	69 Å²	69	45 Å²	45	42%	0.423	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-14	-176.4	65.9	0	0	0	0	114.4	D216 E221	D216-T219 WeakPolarHBondContact CB-OG1 3.27Å; D216-T219 PolarHBondContact OD1-N 2.84Å; D216-T219 PolarHBondContact OD1-OG1 3.32Å; T219-E221 PolarHBondContact O-N 2.83Å; T219-E221 WeakPolarHBondContact OG1-CB 3.23Å; T219-E221 PolarHBondContact OG1-N 2.79Å; T219-E221 VanDerWaalsContact OG1-N 3.12Å
220	L	96.2	Very high	96.8	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	23%	0.229	C	C	.	.			trans	56.1	22.4	-165	-50.3	-169.4	0	0	0	113.7	I162 L170 Q172 V182 V184 F203 F215 D216 H222	I162-L220 HydrophobicContact CD1-CD2 4.42Å; I162-L220 HydrophobicContact CG1-CD2 4.42Å; I162-L220 HydrophobicContact CG2-CD2 4.1Å; L170-L220 HydrophobicContact CB-CD1 4.2Å; Q172-L220 HydrophobicContact CB-CD1 3.97Å; Q172-L220 HydrophobicContact CB-CD2 4.43Å; Q172-L220 HydrophobicContact CB-CG 4.28Å; V182-L220 HydrophobicContact CB-CD1 3.99Å; V182-L220 HydrophobicContact CB-CG 4.22Å; V182-L220 HydrophobicContact CG1-CB 4.12Å; V182-L220 HydrophobicContact CG1-CD1 3.9Å; V182-L220 HydrophobicContact CG1-CG 4.04Å; V184-L220 HydrophobicContact CG2-CB 3.82Å; V184-L220 HydrophobicContact CG2-CD1 4.33Å; F203-L220 HydrophobicContact CE1-CD2 3.65Å; F203-L220 HydrophobicContact CZ-CD2 3.76Å; F215-L220 WeakPolarHBondContact CD1-O 3.21Å; D216-L220 VanDerWaalsContact O-CA 3.27Å; D216-L220 WeakPolarHBondContact O-CA 3.45Å; D216-L220 PolarHBondContact O-N 2.99Å; L220-H222 PolarHBondContact O-N 2.88Å
221	E	97.4	Very high	96.7	Very high	122 Å²	122	46.5 Å²	46.5	57%	0.57	22%	0.221	S	C	*	.			trans	-69.2	129.5	176.9	-175.7	174.9	-169.3	0	0	110.9	F215 D216 T219 Q223	F215-E221 VanDerWaalsContact CA-O 3.28Å; F215-E221 WeakPolarHBondContact CA-O 3.38Å; D216-E221 HydrophobicContact CB-CB 4.49Å; D216-E221 PolarHBondContact N-O 2.59Å; T219-E221 PolarHBondContact O-N 2.83Å; T219-E221 WeakPolarHBondContact OG1-CB 3.23Å; T219-E221 PolarHBondContact OG1-N 2.79Å; T219-E221 VanDerWaalsContact OG1-N 3.12Å; E221-Q223 PolarHBondContact O-N 2.92Å
222	H	98.1	Very high	96.7	Very high	72 Å²	72	46.1 Å²	46.1	33%	0.333	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	124.7	177.2	172.3	-88.9	0	0	0	112	E186 K213 F215 L220 T225	E186-H222 HydrophobicContact CG-CB 4.02Å; E186-H222 IonicContact OE2-CD2 2.69Å; E186-H222 IonicContact OE2-CG 3.92Å; K213-H222 PolarHBondContact NZ-CD2 3.3Å; F215-H222 HydrophobicContact CD1-CB 4.3Å; F215-H222 HydrophobicContact CE1-CB 4.04Å; L220-H222 PolarHBondContact O-N 2.88Å; H222-T225 PolarHBondContact NE2-OG1 2.67Å; H222-T225 VanDerWaalsContact NE2-OG1 3.16Å
223	Q	97.6	Very high	96.6	Very high	74 Å²	74	47.6 Å²	47.6	35%	0.346	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-47.6	-177.7	-62.3	-62.3	-33.4	0	0	113.3	M202 L214 E221	M202-Q223 HydrophobicContact CE-CB 4.19Å; M202-Q223 HydrophobicContact CE-CG 3.88Å; L214-Q223 HydrophobicContact CB-CB 4.37Å; L214-Q223 HydrophobicContact CD2-CB 4.27Å; L214-Q223 HydrophobicContact CG-CB 4.36Å; L214-Q223 PolarHBondContact O-N 2.94Å; E221-Q223 PolarHBondContact O-N 2.92Å
224	K	98	Very high	96.6	Very high	60 Å²	60	46.7 Å²	46.7	26%	0.261	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	149.8	-171.8	-60	-71.5	168.7	171.4	0	113.1	K213 L214 F226 L272 A273 E275	K213-K224 CarbonylContact C-O 3.6Å; K213-K224 VanDerWaalsContact CA-O 3.28Å; K213-K224 WeakPolarHBondContact CA-O 3.23Å; L214-K224 HydrophobicContact CB-CB 3.85Å; L214-K224 HydrophobicContact CB-CG 4.45Å; L214-K224 HydrophobicContact CD2-CB 4.24Å; L214-K224 HydrophobicContact CD2-CG 3.97Å; L214-K224 PolarHBondContact N-O 3.07Å; L214-K224 PolarHBondContact O-N 2.86Å; K224-F226 HydrophobicContact CB-CE1 4.31Å; K224-F226 HydrophobicContact CB-CE2 4.12Å; K224-F226 HydrophobicContact CB-CZ 3.69Å; K224-F226 HydrophobicContact CG-CZ 4.39Å; K224-L272 WeakPolarHBondContact CD-O 3.42Å; K224-L272 WeakPolarHBondContact CG-O 3.22Å; K224-A273 PolarHBondContact NZ-O 2.71Å; K224-E275 WeakPolarHBondContact CA-OE1 3.19Å; K224-E275 HydrophobicContact CB-CG 4.31Å; K224-E275 WeakPolarHBondContact CB-OE1 3.06Å; K224-E275 HydrophobicContact CD-CG 3.75Å; K224-E275 VanDerWaalsContact CD-OE1 3.28Å; K224-E275 WeakPolarHBondContact CD-OE1 3.07Å
225	T	98.5	Very high	96.6	Very high	8 Å²	8	46.5 Å²	46.5	5%	0.049	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	106.6	175.5	-59.3	0	0	0	0	112.8	T211 K213 H222 R227 E275	T211-T225 HydrophobicContact CG2-CG2 3.89Å; K213-T225 HydrophobicContact CG-CG2 4.09Å; K213-T225 PolarHBondContact NZ-OG1 3.23Å; H222-T225 PolarHBondContact NE2-OG1 2.67Å; H222-T225 VanDerWaalsContact NE2-OG1 3.16Å; T225-R227 HydrophobicContact CG2-CG 3.96Å; T225-E275 PolarHBondContact N-OE1 3.45Å
226	F	98.3	Very high	96.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	115.2	174.4	-46.5	-72.3	0	0	0	110.2	T211 A212 L214 K224 V244 L246 F270 L272 E275	T211-F226 WeakPolarHBondContact CA-O 3.42Å; A212-F226 HydrophobicContact CB-CB 4.43Å; A212-F226 HydrophobicContact CB-CD2 4.3Å; A212-F226 PolarHBondContact N-O 2.98Å; A212-F226 PolarHBondContact O-N 3.24Å; L214-F226 HydrophobicContact CB-CE2 4.14Å; K224-F226 HydrophobicContact CB-CE1 4.31Å; K224-F226 HydrophobicContact CB-CE2 4.12Å; K224-F226 HydrophobicContact CB-CZ 3.69Å; K224-F226 HydrophobicContact CG-CZ 4.39Å; F226-V244 HydrophobicContact CD1-CG1 4.03Å; F226-V244 HydrophobicContact CD2-CG1 3.84Å; F226-V244 HydrophobicContact CE1-CG1 4.05Å; F226-V244 HydrophobicContact CE2-CG1 3.85Å; F226-V244 HydrophobicContact CG-CG1 3.93Å; F226-V244 HydrophobicContact CZ-CG1 3.98Å; F226-L246 HydrophobicContact CB-CD1 4.34Å; F226-L246 HydrophobicContact CB-CD2 4.05Å; F226-F270 HydrophobicContact CB-CD1 4.25Å; F226-F270 HydrophobicContact CB-CD2 4.33Å; F226-F270 HydrophobicContact CB-CE1 4.47Å; F226-F270 HydrophobicContact CB-CG 4.16Å; F226-F270 HydrophobicContact CD1-CB 3.63Å; F226-F270 HydrophobicContact CD1-CD1 4.16Å; F226-F270 HydrophobicContact CD1-CG 4.02Å; F226-F270 HydrophobicContact CE1-CB 4.22Å; F226-F270 HydrophobicContact CG-CB 4.27Å; F226-F270 HydrophobicContact CG-CG 4.39Å; F226-L272 HydrophobicContact CE1-CD2 4.27Å; F226-L272 HydrophobicContact CE2-CD2 3.94Å; F226-L272 HydrophobicContact CZ-CD2 3.44Å; F226-L272 VanDerWaalsContact CZ-CD2 3.44Å; F226-E275 HydrophobicContact CD1-CB 4.42Å; F226-E275 HydrophobicContact CE1-CB 4.45Å; F226-E275 HydrophobicContact CE1-CG 4.35Å
227	R	97.4	Very high	96.6	Very high	175 Å²	175	45.2 Å²	45.2	66%	0.66	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	135.5	-172.7	-62.7	-177.5	-179.9	-89.5	-1	112.3	T211 T225 F270	T211-R227 HydrophobicContact CG2-CG 4.2Å; T225-R227 HydrophobicContact CG2-CG 3.96Å; R227-F270 WeakPolarHBondContact O-CZ 3.49Å
228	T	94.9	Very high	96.7	Very high	26 Å²	26	45.8 Å²	45.8	16%	0.16	22%	0.219	C	C	.	.			trans	-129	174.7	175.8	70.3	0	0	0	0	111.5	N210 R230 V232 L246 F270	N210-T228 WeakPolarHBondContact CB-O 3.44Å; N210-T228 PolarHBondContact O-N 2.64Å; N210-T228 PolarHBondContact O-OG1 2.62Å; T228-R230 PolarHBondContact OG1-O 2.83Å; T228-V232 HydrophobicContact CG2-CG2 4.2Å; T228-V232 WeakPolarHBondContact OG1-CG2 3.22Å; T228-L246 HydrophobicContact CG2-CD2 3.54Å; T228-F270 HydrophobicContact CG2-CE2 4.18Å; T228-F270 HydrophobicContact CG2-CZ 4.09Å
229	E	90.8	Very high	96.8	Very high	96 Å²	96	43.2 Å²	43.2	45%	0.449	20%	0.204	S	C	.	.	S	Bend	trans	-89.8	-9.3	-177.8	-61.7	179.2	-118.2	0	0	113.7	K264	E229-K264 IonicContact OE1-NZ 2.81Å; E229-K264 PolarHBondContact OE1-NZ 2.81Å; E229-K264 IonicContact OE2-NZ 2.65Å; E229-K264 PolarHBondContact OE2-NZ 3.02Å
230	R	92.3	Very high	96.7	Very high	92 Å²	92	43.5 Å²	43.5	35%	0.347	20%	0.203	S	C	.	.	S	Bend	trans	-143	161.5	-169.8	-64.9	-60.6	-172.9	-162	4.2	109.6	N210 T228 V232	N210-R230 VanDerWaalsContact CA-O 3.29Å; N210-R230 WeakPolarHBondContact CA-O 3.37Å; N210-R230 VanDerWaalsContact CB-O 3.28Å; N210-R230 WeakPolarHBondContact CB-O 3.19Å; N210-R230 VanDerWaalsContact CG-C 3.42Å; T228-R230 PolarHBondContact OG1-O 2.83Å; R230-V232 PolarHBondContact O-N 2.9Å
231	P	95.4	Very high	96.6	Very high	13 Å²	13	47.2 Å²	47.2	8%	0.084	22%	0.218	C	C	.	.			trans	-51.1	137.4	175.8	-35.1	42.5	0	0	0	113	N210 G248 G249	N210-P231 VanDerWaalsContact OD1-CD 3.31Å; N210-P231 WeakPolarHBondContact OD1-CD 3.34Å; P231-G248 WeakPolarHBondContact O-CA 3.14Å; P231-G249 PolarHBondContact O-N 2.91Å
232	V	97.3	Very high	96.5	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.012	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	119.7	171	-167.8	0	0	0	0	106.7	N192 A206 S207 A212 T228 R230 S234 L246	N192-V232 PolarHBondContact ND2-O 2.96Å; A206-V232 CarbonylContact C-O 3.56Å; A206-V232 HydrophobicContact CB-CB 4.11Å; A206-V232 HydrophobicContact CB-CG1 3.69Å; S207-V232 CarbonylContact C-O 3.59Å; S207-V232 PolarHBondContact N-O 2.89Å; S207-V232 PolarHBondContact O-N 2.99Å; A212-V232 HydrophobicContact CB-CG1 4.47Å; T228-V232 HydrophobicContact CG2-CG2 4.2Å; T228-V232 WeakPolarHBondContact OG1-CG2 3.22Å; R230-V232 PolarHBondContact O-N 2.9Å; V232-S234 WeakPolarHBondContact CG1-O 3.3Å; V232-L246 HydrophobicContact CG1-CB 4.04Å; V232-L246 HydrophobicContact CG1-CD2 4.15Å; V232-L246 HydrophobicContact CG1-CG 3.89Å; V232-L246 HydrophobicContact CG2-CD2 3.99Å
233	N	97.4	Very high	96.4	Very high	30 Å²	30	43 Å²	43	16%	0.16	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-34.9	-179.2	-66.1	-26.9	0	0	0	111.2	N192 D193 G247 I288 N289	N192-N233 WeakPolarHBondContact CB-O 3.38Å; D193-N233 WeakPolarHBondContact CB-O 3.16Å; N233-G247 PolarHBondContact N-O 3.17Å; N233-I288 WeakPolarHBondContact CB-O 3.41Å; N233-I288 PolarHBondContact ND2-O 2.95Å; N233-N289 PolarHBondContact ND2-OD1 3.48Å
234	S	98.4	Very high	96.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	148.7	-179	177	0	0	0	0	110.7	D193 Q195 V232 G247 N289 V291	D193-S234 VanDerWaalsContact OD2-CB 3.27Å; D193-S234 WeakPolarHBondContact OD2-CB 3.35Å; D193-S234 PolarHBondContact OD2-OG 2.86Å; Q195-S234 PolarHBondContact NE2-OG 2.78Å; V232-S234 WeakPolarHBondContact CG1-O 3.3Å; S234-G247 PolarHBondContact N-O 2.83Å; S234-G247 VanDerWaalsContact N-O 3.09Å; S234-G247 PolarHBondContact O-N 2.83Å; S234-G247 VanDerWaalsContact O-O 3.12Å; S234-N289 WeakPolarHBondContact CB-O 3.41Å; S234-V291 WeakPolarHBondContact OG-CG2 3.44Å; S234-V291 PolarHBondContact OG-N 3.48Å; S234-V291 PolarHBondContact OG-O 2.88Å
235	A	98.6	Very high	96.5	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.008	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	143.3	176.7	0	0	0	0	0	109.3	Q195 V204 A206 A212 V245 L246	Q195-A235 VanDerWaalsContact CD-O 3.29Å; Q195-A235 WeakPolarHBondContact CG-O 3.41Å; Q195-A235 PolarHBondContact NE2-O 3.1Å; V204-A235 HydrophobicContact CG1-CB 4.04Å; V204-A235 WeakPolarHBondContact CG1-O 3.47Å; V204-A235 HydrophobicContact CG2-CB 3.8Å; A206-A235 HydrophobicContact CB-CB 4.16Å; A212-A235 HydrophobicContact CB-CB 3.98Å; A235-V245 CarbonylContact C-O 3.53Å; A235-V245 VanDerWaalsContact CA-O 3.25Å; A235-V245 WeakPolarHBondContact CA-O 3.39Å; A235-L246 HydrophobicContact CB-CD1 4.3Å; A235-L246 HydrophobicContact CB-CG 4.27Å
236	A	98.6	Very high	96.4	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.008	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	145.6	-178.7	0	0	0	0	0	110.9	Q195 V244 V245 V291 F293	Q195-A236 VanDerWaalsContact OE1-CB 3.25Å; A236-V244 WeakPolarHBondContact O-CA 3.46Å; A236-V244 VanDerWaalsContact O-CG2 3.26Å; A236-V244 WeakPolarHBondContact O-CG2 3.42Å; A236-V245 HydrophobicContact CB-CG1 3.99Å; A236-V245 PolarHBondContact N-O 3.41Å; A236-V245 PolarHBondContact O-N 2.76Å; A236-V291 HydrophobicContact CB-CG2 4.2Å; A236-F293 HydrophobicContact CB-CD2 3.91Å; A236-F293 WeakPolarHBondContact O-CE2 3.41Å
237	L	98.2	Very high	96.4	Very high	20 Å²	20	36.5 Å²	36.5	11%	0.105	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	139.9	178.5	-63.5	170.2	0	0	0	110.6	V204 L214 V244 L272 F293	V204-L237 HydrophobicContact CB-CD1 4.28Å; V204-L237 HydrophobicContact CB-CD2 4.12Å; V204-L237 HydrophobicContact CB-CG 4.04Å; V204-L237 HydrophobicContact CG1-CD1 4.35Å; V204-L237 HydrophobicContact CG1-CD2 4.32Å; V204-L237 HydrophobicContact CG1-CG 3.85Å; L214-L237 HydrophobicContact CD1-CD1 3.93Å; L214-L237 HydrophobicContact CD1-CD2 3.75Å; L214-L237 HydrophobicContact CD1-CG 4.48Å; L237-V244 HydrophobicContact CD2-CB 4.09Å; L237-V244 HydrophobicContact CD2-CG2 3.97Å; L237-L272 HydrophobicContact CD2-CD1 4.08Å; L237-L272 HydrophobicContact CD2-CD2 3.73Å; L237-F293 WeakPolarHBondContact O-CD2 3.37Å
238	S	97.4	Very high	96.2	Very high	14 Å²	14	28.6 Å²	28.6	10%	0.098	14%	0.144	C	C	.	.			trans	-69	135.1	173.2	175.2	0	0	0	0	110	N240 Y241 H243	S238-N240 VanDerWaalsContact C-N 3.25Å; S238-N240 PolarHBondContact O-N 2.88Å; S238-N240 PolarHBondContact OG-N 2.98Å; S238-Y241 WeakPolarHBondContact CB-O 3.3Å; S238-Y241 PolarHBondContact OG-N 3.12Å; S238-H243 WeakPolarHBondContact CB-O 3.3Å; S238-H243 PolarHBondContact N-O 2.6Å
239	P	96.2	Very high	95.9	Very high	32 Å²	32	27.5 Å²	27.5	21%	0.208	14%	0.139	C	C	.	.	S	Bend	trans	-78.4	-6.3	178.1	31.3	-35.8	0	0	0	114	R198 G297	R198-P239 HydrophobicContact CB-CB 4.22Å; P239-G297 VanDerWaalsContact CG-CA 3.42Å
240	N	94.1	Very high	95.3	Very high	75 Å²	75	26.1 Å²	26.1	40%	0.401	13%	0.132	S	C	.	.	S	Bend	trans	-126.1	-15.8	-170.7	-65	-3.2	0	0	0	114.5	S238 D296 G297	S238-N240 VanDerWaalsContact C-N 3.25Å; S238-N240 PolarHBondContact O-N 2.88Å; S238-N240 PolarHBondContact OG-N 2.98Å; N240-D296 PolarHBondContact ND2-O 2.74Å; N240-G297 WeakPolarHBondContact ND2-CA 3.42Å
241	Y	94.3	Very high	94.1	Very high	79 Å²	79	25.4 Å²	25.4	31%	0.31	13%	0.132	S	C	.	.	S	Bend	trans	-144.8	159.6	-171.3	-65.5	-84.5	0	0	0	110.2	S238 H243 Y318 F319	S238-Y241 WeakPolarHBondContact CB-O 3.3Å; S238-Y241 PolarHBondContact OG-N 3.12Å; Y241-H243 WeakPolarHBondContact CB-ND1 3.39Å; Y241-H243 AromaticContact CG-ND1 3.92Å; Y241-H243 PolarHBondContact O-N 2.93Å; Y241-Y318 HydrophobicContact CD2-CE1 4.3Å; Y241-Y318 HydrophobicContact CE2-CE1 4.5Å; Y241-F319 AromaticContact CE2-CD1 3.85Å; Y241-F319 HydrophobicContact CE2-CD1 3.85Å; Y241-F319 HydrophobicContact CE2-CE1 4.45Å
242	D	94.8	Very high	92.2	Very high	101 Å²	101	27.5 Å²	27.5	54%	0.54	15%	0.151	S	C	.	.	S	Bend	trans	-73.8	53.7	173.2	-75.5	-15	0	0	0	112	H271 L272	D242-H271 CarbonylContact O-C 3.55Å; D242-H271 WeakPolarHBondContact O-CA 3.47Å; D242-L272 HydrophobicContact CB-CB 4.17Å; D242-L272 HydrophobicContact CB-CD1 4.46Å; D242-L272 PolarHBondContact O-N 2.8Å
243	H	96.6	Very high	90.2	Very high	5 Å²	5	35.7 Å²	35.7	2%	0.023	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	143.8	-176.3	-59.2	156.8	0	0	0	111.6	S238 Y241 F270 F278 Y318 F321	S238-H243 WeakPolarHBondContact CB-O 3.3Å; S238-H243 PolarHBondContact N-O 2.6Å; Y241-H243 WeakPolarHBondContact CB-ND1 3.39Å; Y241-H243 AromaticContact CG-ND1 3.92Å; Y241-H243 PolarHBondContact O-N 2.93Å; H243-F270 WeakPolarHBondContact CA-O 3.49Å; H243-F278 HydrophobicContact CB-CE1 4.34Å; H243-F278 HydrophobicContact CB-CZ 4.15Å; H243-F278 AromaticContact CD2-CE1 3.49Å; H243-F278 VanDerWaalsContact CD2-CE1 3.49Å; H243-F278 WeakPolarHBondContact CD2-CE1 3.17Å; H243-F278 AromaticContact CD2-CZ 3.53Å; H243-F278 AromaticContact CE1-CZ 3.84Å; H243-F278 AromaticContact CG-CE1 3.89Å; H243-F278 AromaticContact CG-CZ 3.57Å; H243-F278 AromaticContact ND1-CZ 3.75Å; H243-F278 AromaticContact NE2-CE1 3.92Å; H243-F278 AromaticContact NE2-CZ 3.7Å; H243-Y318 AromaticContact ND1-CE2 3.83Å; H243-Y318 AromaticContact ND1-CZ 3.42Å; H243-Y318 PolarHBondContact ND1-OH 2.67Å; H243-F321 AromaticContact NE2-CD1 3.82Å
244	V	98.1	Very high	87.9	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	140.5	170.2	64.6	0	0	0	0	110.3	V204 F226 A236 L237 L246 F269 F270 L272	V204-V244 HydrophobicContact CG2-CG2 4.06Å; F226-V244 HydrophobicContact CD1-CG1 4.03Å; F226-V244 HydrophobicContact CD2-CG1 3.84Å; F226-V244 HydrophobicContact CE1-CG1 4.05Å; F226-V244 HydrophobicContact CE2-CG1 3.85Å; F226-V244 HydrophobicContact CG-CG1 3.93Å; F226-V244 HydrophobicContact CZ-CG1 3.98Å; A236-V244 WeakPolarHBondContact O-CA 3.46Å; A236-V244 VanDerWaalsContact O-CG2 3.26Å; A236-V244 WeakPolarHBondContact O-CG2 3.42Å; L237-V244 HydrophobicContact CD2-CB 4.09Å; L237-V244 HydrophobicContact CD2-CG2 3.97Å; V244-L246 HydrophobicContact CB-CD1 4.36Å; V244-L246 HydrophobicContact CG1-CD1 3.82Å; V244-L246 HydrophobicContact CG2-CD1 3.76Å; V244-F269 WeakPolarHBondContact O-CA 3.49Å; V244-F270 HydrophobicContact CG1-CB 3.75Å; V244-F270 PolarHBondContact N-O 2.7Å; V244-F270 PolarHBondContact O-N 2.72Å; V244-L272 HydrophobicContact CB-CD2 3.73Å; V244-L272 HydrophobicContact CG1-CD2 3.92Å
245	V	98.2	Very high	85.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.9	170.7	69.2	0	0	0	0	110	A235 A236 A267 R268 F269 V291 F293 Y300	A235-V245 CarbonylContact C-O 3.53Å; A235-V245 VanDerWaalsContact CA-O 3.25Å; A235-V245 WeakPolarHBondContact CA-O 3.39Å; A236-V245 HydrophobicContact CB-CG1 3.99Å; A236-V245 PolarHBondContact N-O 3.41Å; A236-V245 PolarHBondContact O-N 2.76Å; V245-A267 HydrophobicContact CG2-CB 4.04Å; V245-R268 CarbonylContact C-O 3.56Å; V245-R268 WeakPolarHBondContact CA-O 3.19Å; V245-F269 HydrophobicContact CB-CD1 4.09Å; V245-F269 HydrophobicContact CB-CE1 3.67Å; V245-F269 HydrophobicContact CB-CZ 3.93Å; V245-F269 HydrophobicContact CG2-CD1 4.25Å; V245-F269 HydrophobicContact CG2-CD2 4.29Å; V245-F269 HydrophobicContact CG2-CE1 3.73Å; V245-F269 HydrophobicContact CG2-CE2 3.75Å; V245-F269 HydrophobicContact CG2-CZ 3.43Å; V245-F269 VanDerWaalsContact CG2-CZ 3.43Å; V245-V291 HydrophobicContact CG1-CB 4.22Å; V245-V291 HydrophobicContact CG1-CG2 4.07Å; V245-F293 HydrophobicContact CB-CE2 3.86Å; V245-F293 HydrophobicContact CB-CZ 4.18Å; V245-F293 HydrophobicContact CG1-CD2 3.86Å; V245-F293 HydrophobicContact CG1-CE2 3.43Å; V245-F293 VanDerWaalsContact CG1-CE2 3.43Å; V245-F293 HydrophobicContact CG1-CZ 4.14Å; V245-Y300 HydrophobicContact CG1-CD2 4.43Å; V245-Y300 HydrophobicContact CG2-CD2 4.23Å; V245-Y300 HydrophobicContact CG2-CE2 4.18Å
246	L	98.2	Very high	82.9	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.021	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.7	176.8	-83.9	64.7	0	0	0	109.6	A212 F226 T228 V232 A235 V244 A267 R268 F270	A212-L246 HydrophobicContact CB-CD1 3.94Å; A212-L246 HydrophobicContact CB-CD2 3.7Å; A212-L246 HydrophobicContact CB-CG 3.75Å; F226-L246 HydrophobicContact CB-CD1 4.34Å; F226-L246 HydrophobicContact CB-CD2 4.05Å; T228-L246 HydrophobicContact CG2-CD2 3.54Å; V232-L246 HydrophobicContact CG1-CB 4.04Å; V232-L246 HydrophobicContact CG1-CD2 4.15Å; V232-L246 HydrophobicContact CG1-CG 3.89Å; V232-L246 HydrophobicContact CG2-CD2 3.99Å; A235-L246 HydrophobicContact CB-CD1 4.3Å; A235-L246 HydrophobicContact CB-CG 4.27Å; V244-L246 HydrophobicContact CB-CD1 4.36Å; V244-L246 HydrophobicContact CG1-CD1 3.82Å; V244-L246 HydrophobicContact CG2-CD1 3.76Å; L246-A267 WeakPolarHBondContact O-CA 3.48Å; L246-R268 HydrophobicContact CB-CB 4.5Å; L246-R268 PolarHBondContact N-O 3.08Å; L246-R268 PolarHBondContact O-N 3.27Å; L246-F270 HydrophobicContact CD1-CD2 4.09Å; L246-F270 HydrophobicContact CD1-CE2 4.48Å; L246-F270 HydrophobicContact CD2-CD2 4.32Å; L246-F270 HydrophobicContact CD2-CE2 3.92Å
247	G	96.8	Very high	80.4	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.01	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	136.2	170.2	0	0	0	0	0	111.3	N233 S234	N233-G247 PolarHBondContact N-O 3.17Å; S234-G247 PolarHBondContact N-O 2.83Å; S234-G247 VanDerWaalsContact N-O 3.09Å; S234-G247 PolarHBondContact O-N 2.83Å; S234-G247 VanDerWaalsContact O-O 3.12Å
248	G	93.9	Very high	77.9	Confident	8 Å²	8	58.5 Å²	58.5	8%	0.082	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.7	-153.6	179.8	0	0	0	0	0	114	P231 I288	P231-G248 WeakPolarHBondContact O-CA 3.14Å; G248-I288 WeakPolarHBondContact CA-O 3.07Å; G248-I288 PolarHBondContact N-O 3.43Å; G248-I288 PolarHBondContact O-N 2.95Å
249	G	87.9	Confident	75.7	Confident	4 Å²	4	60.3 Å²	60.3	4%	0.041	34%	0.341	C	S	.	.			trans	130.5	173.4	-176.8	0	0	0	0	0	112.5	P231	P231-G249 PolarHBondContact O-N 2.91Å
250	Q	79.6	Confident	73.6	Confident	66 Å²	66	62.5 Å²	62.5	31%	0.308	35%	0.354	S	S	.	.			trans	-116.9	136.2	174.6	-168.4	66.5	32.1	0	0	109.7	D254 F265	Q250-D254 HydrophobicContact CG-CB 4.2Å; Q250-D254 PolarHBondContact NE2-OD2 3.02Å; Q250-F265 WeakPolarHBondContact O-CE1 3.46Å
251	E	66.6	Low	71.6	Confident	77 Å²	77	69.4 Å²	69.4	36%	0.36	38%	0.375	S	S	.	.			trans	-61.6	152	177.1	-74.3	-173.5	-164	0	0	112.6	K30 M253 D254 P287	K30-E251 IonicContact NZ-OE1 2.84Å; E251-M253 PolarHBondContact O-N 2.95Å; E251-M253 VanDerWaalsContact O-N 3.17Å; E251-D254 PolarHBondContact O-N 2.99Å; E251-P287 HydrophobicContact CG-CG 3.98Å
252	A	55.5	Low	69.8	Low	58 Å²	58	68.7 Å²	68.7	48%	0.479	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-69.7	-10.4	-176	0	0	0	0	0	114.5	D254 V255	A252-D254 PolarHBondContact O-N 3.22Å; A252-V255 HydrophobicContact CB-CG2 4.43Å; A252-V255 CarbonylContact O-C 3.47Å; A252-V255 PolarHBondContact O-N 3.22Å
253	M	54.4	Low	68.1	Low	174 Å²	174	64.1 Å²	64.1	86%	0.857	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-62.8	-23.1	174	-70.1	-172.4	67.3	0	0	112.6	E251	E251-M253 PolarHBondContact O-N 2.95Å; E251-M253 VanDerWaalsContact O-N 3.17Å
254	D	48.7	Very low	66.9	Low	113 Å²	113	67.5 Å²	67.5	60%	0.604	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-92.1	-4	173.6	-63.9	-45.6	0	0	0	113.9	Q250 E251 A252	Q250-D254 HydrophobicContact CG-CB 4.2Å; Q250-D254 PolarHBondContact NE2-OD2 3.02Å; E251-D254 PolarHBondContact O-N 2.99Å; A252-D254 PolarHBondContact O-N 3.22Å
255	V	43.1	Very low	66.2	Low	38 Å²	38	68.5 Å²	68.5	23%	0.23	37%	0.371	C	S	.	.	S	Bend	trans	-136.4	104.5	179.1	-74.4	0	0	0	0	111.7	A252 T257 I262	A252-V255 HydrophobicContact CB-CG2 4.43Å; A252-V255 CarbonylContact O-C 3.47Å; A252-V255 PolarHBondContact O-N 3.22Å; V255-T257 PolarHBondContact O-N 2.76Å; V255-I262 HydrophobicContact CB-CG2 4.27Å; V255-I262 HydrophobicContact CG1-CG2 4.28Å; V255-I262 HydrophobicContact CG2-CG2 4.28Å
256	T	48.7	Very low	65.8	Low	146 Å²	146	69.7 Å²	69.7	90%	0.896	38%	0.377	S	S	*	.	S	Bend	trans	-65.6	17.5	-171.6	48.7	0	0	0	0	116.8
257	T	47.8	Very low	65.7	Low	79 Å²	79	69.6 Å²	69.6	49%	0.485	38%	0.376	S	S	.	.	S	Bend	trans	-134.9	118.6	-179	48.8	0	0	0	0	112.6	V255 S259 I262	V255-T257 PolarHBondContact O-N 2.76Å; T257-S259 PolarHBondContact O-N 3.45Å; T257-I262 WeakPolarHBondContact OG1-CD1 3.41Å
258	T	45.9	Very low	65.7	Low	154 Å²	154	71.2 Å²	71.2	95%	0.945	38%	0.382	S	S	*	.			trans	-75.9	48.6	-170.3	43.4	0	0	0	0	114.6
259	S	50.2	Low	65.8	Low	52 Å²	52	71.1 Å²	71.1	36%	0.364	38%	0.38	S	S	.	.			trans	-111.5	126.1	171.2	84.2	0	0	0	0	111.9	T257 R261 I262	T257-S259 PolarHBondContact O-N 3.45Å; S259-R261 PolarHBondContact O-N 3Å; S259-I262 PolarHBondContact O-N 3.44Å; S259-I262 VanDerWaalsContact OG-CD1 3.32Å; S259-I262 WeakPolarHBondContact OG-CD1 3.43Å; S259-I262 WeakPolarHBondContact OG-CG1 3.25Å
260	T	52.3	Low	66.3	Low	79 Å²	79	71.3 Å²	71.3	49%	0.485	38%	0.379	S	S	.	.	H	α-helix	trans	-55.4	-23.4	173.6	49.6	0	0	0	0	112.9	I262 F285	T260-I262 VanDerWaalsContact C-N 3.3Å; T260-I262 PolarHBondContact O-N 2.94Å; T260-F285 HydrophobicContact CG2-CD1 3.71Å; T260-F285 HydrophobicContact CG2-CE1 4.08Å
261	R	52.7	Low	67.1	Low	220 Å²	220	69.2 Å²	69.2	83%	0.83	37%	0.369	S	S	*	.	H	α-helix	trans	-64.9	-25.8	174.4	-66.3	-171.8	179.4	-160.4	0.6	114.1	S259	S259-R261 PolarHBondContact O-N 3Å
262	I	55	Low	68.5	Low	64 Å²	64	66.5 Å²	66.5	33%	0.328	36%	0.357	S	S	.	.	H	α-helix	trans	-87.5	-32.6	-177.2	-69.3	169	0	0	0	111.9	V255 T257 S259 T260 K264	V255-I262 HydrophobicContact CB-CG2 4.27Å; V255-I262 HydrophobicContact CG1-CG2 4.28Å; V255-I262 HydrophobicContact CG2-CG2 4.28Å; T257-I262 WeakPolarHBondContact OG1-CD1 3.41Å; S259-I262 PolarHBondContact O-N 3.44Å; S259-I262 VanDerWaalsContact OG-CD1 3.32Å; S259-I262 WeakPolarHBondContact OG-CD1 3.43Å; S259-I262 WeakPolarHBondContact OG-CG1 3.25Å; T260-I262 VanDerWaalsContact C-N 3.3Å; T260-I262 PolarHBondContact O-N 2.94Å; I262-K264 VanDerWaalsContact C-N 3.31Å; I262-K264 PolarHBondContact O-N 2.84Å
263	G	59.6	Low	70.3	Confident	5 Å²	5	65.8 Å²	65.8	5%	0.052	35%	0.351	C	S	.	.	H	α-helix	trans	-68.1	-24.6	-177.5	0	0	0	0	0	115.2	F265	G263-F265 VanDerWaalsContact C-N 3.32Å; G263-F265 WeakPolarHBondContact O-CD1 3.21Å; G263-F265 WeakPolarHBondContact O-CE1 3.35Å; G263-F265 PolarHBondContact O-N 3.44Å
264	K	71.9	Confident	72.2	Confident	76 Å²	76	62 Å²	62	33%	0.33	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	46.8	-176.8	-64.6	-171.3	172.4	-175.2	0	113	E229 I262 E266	E229-K264 IonicContact OE1-NZ 2.81Å; E229-K264 PolarHBondContact OE1-NZ 2.81Å; E229-K264 IonicContact OE2-NZ 2.65Å; E229-K264 PolarHBondContact OE2-NZ 3.02Å; I262-K264 VanDerWaalsContact C-N 3.31Å; I262-K264 PolarHBondContact O-N 2.84Å; K264-E266 PolarHBondContact O-N 3.45Å
265	F	82.8	Confident	74.5	Confident	21 Å²	21	59.9 Å²	59.9	9%	0.092	32%	0.317	C	S	.	.			trans	-76.8	56.2	179.5	-51.4	-41	0	0	0	112.7	Q250 G263 G286 P287	Q250-F265 WeakPolarHBondContact O-CE1 3.46Å; G263-F265 VanDerWaalsContact C-N 3.32Å; G263-F265 WeakPolarHBondContact O-CD1 3.21Å; G263-F265 WeakPolarHBondContact O-CE1 3.35Å; G263-F265 PolarHBondContact O-N 3.44Å; F265-G286 VanDerWaalsContact CB-O 3.25Å; F265-G286 WeakPolarHBondContact CB-O 3.44Å; F265-G286 VanDerWaalsContact CD2-N 3.32Å; F265-G286 WeakPolarHBondContact CG-O 3.28Å; F265-P287 HydrophobicContact CD1-CG 4.24Å; F265-P287 VanDerWaalsContact CE1-CD 3.49Å; F265-P287 HydrophobicContact CE1-CG 3.81Å
266	E	91	Very high	77	Confident	25 Å²	25	63.7 Å²	63.7	12%	0.117	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.9	-169.6	-52.8	-177.5	-167.7	0	0	108.9	K264 R280 V281 K282	K264-E266 PolarHBondContact O-N 3.45Å; E266-R280 VanDerWaalsContact OE2-CD 3.32Å; E266-R280 WeakPolarHBondContact OE2-CD 3.35Å; E266-V281 CarbonylContact C-O 3.55Å; E266-V281 WeakPolarHBondContact CA-O 3.36Å; E266-K282 HydrophobicContact CG-CB 4.44Å; E266-K282 HydrophobicContact CG-CD 4.07Å; E266-K282 HydrophobicContact CG-CG 3.87Å; E266-K282 WeakPolarHBondContact OE1-CD 3.44Å; E266-K282 VanDerWaalsContact OE1-CE 3.27Å; E266-K282 WeakPolarHBondContact OE1-CE 3.27Å; E266-K282 IonicContact OE1-NZ 2.71Å; E266-K282 PolarHBondContact OE1-NZ 3.05Å; E266-K282 WeakPolarHBondContact OE2-CE 3.44Å; E266-K282 IonicContact OE2-NZ 3.51Å; E266-K282 PolarHBondContact OE2-NZ 2.9Å; E266-K282 VanDerWaalsContact OE2-NZ 3.16Å
267	A	95.5	Very high	79.2	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.008	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	124.8	167.7	0	0	0	0	0	107.8	V245 L246 F269 R280 V281 I288 Y300	V245-A267 HydrophobicContact CG2-CB 4.04Å; L246-A267 WeakPolarHBondContact O-CA 3.48Å; A267-F269 HydrophobicContact CB-CE2 4.42Å; A267-R280 CarbonylContact O-C 3.58Å; A267-R280 WeakPolarHBondContact O-CA 3.46Å; A267-V281 HydrophobicContact CB-CB 4.41Å; A267-V281 PolarHBondContact N-O 3.47Å; A267-V281 PolarHBondContact O-N 2.71Å; A267-I288 HydrophobicContact CB-CD1 3.92Å; A267-Y300 HydrophobicContact CB-CE2 3.99Å; A267-Y300 WeakPolarHBondContact CB-OH 3.46Å
268	R	96.1	Very high	81.4	Confident	36 Å²	36	58.2 Å²	58.2	14%	0.136	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	132.3	-173.1	-60.8	178.9	69.2	175.5	-6.3	110	V245 L246 F270 E277 R280	V245-R268 CarbonylContact C-O 3.56Å; V245-R268 WeakPolarHBondContact CA-O 3.19Å; L246-R268 HydrophobicContact CB-CB 4.5Å; L246-R268 PolarHBondContact N-O 3.08Å; L246-R268 PolarHBondContact O-N 3.27Å; R268-F270 HydrophobicContact CB-CD2 4.38Å; R268-F270 HydrophobicContact CB-CE2 3.75Å; R268-E277 WeakPolarHBondContact CB-OE1 3.33Å; R268-E277 WeakPolarHBondContact CG-OE1 3.33Å; R268-E277 IonicContact CZ-OE1 3.76Å; R268-E277 IonicContact CZ-OE2 2.62Å; R268-E277 IonicContact NE-OE1 2.84Å; R268-E277 PolarHBondContact NE-OE1 3.31Å; R268-E277 IonicContact NE-OE2 2.7Å; R268-E277 VanDerWaalsContact NH2-CD 3.32Å; R268-E277 IonicContact NH2-OE1 3.87Å; R268-E277 PolarHBondContact NH2-OE1 2.79Å; R268-E277 IonicContact NH2-OE2 3.52Å; R268-E277 PolarHBondContact NH2-OE2 3.33Å; R268-R280 HydrophobicContact CG-CG 4.4Å
269	F	97.1	Very high	83.7	Confident	6 Å²	6	51.9 Å²	51.9	3%	0.026	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	124.9	-177	-72.7	-93.9	0	0	0	110.4	V244 V245 A267 E277 F278 G279 V281 F293 Y300 F314 Y318	V244-F269 WeakPolarHBondContact O-CA 3.49Å; V245-F269 HydrophobicContact CB-CD1 4.09Å; V245-F269 HydrophobicContact CB-CE1 3.67Å; V245-F269 HydrophobicContact CB-CZ 3.93Å; V245-F269 HydrophobicContact CG2-CD1 4.25Å; V245-F269 HydrophobicContact CG2-CD2 4.29Å; V245-F269 HydrophobicContact CG2-CE1 3.73Å; V245-F269 HydrophobicContact CG2-CE2 3.75Å; V245-F269 HydrophobicContact CG2-CZ 3.43Å; V245-F269 VanDerWaalsContact CG2-CZ 3.43Å; A267-F269 HydrophobicContact CB-CE2 4.42Å; F269-E277 CarbonylContact O-C 3.58Å; F269-E277 WeakPolarHBondContact O-CA 3.26Å; F269-F278 HydrophobicContact CB-CD1 4.44Å; F269-F278 HydrophobicContact CB-CD2 4.42Å; F269-F278 HydrophobicContact CB-CE1 4Å; F269-F278 HydrophobicContact CB-CE2 3.97Å; F269-F278 HydrophobicContact CB-CZ 3.75Å; F269-F278 HydrophobicContact CD1-CZ 4.45Å; F269-F278 PolarHBondContact O-N 2.85Å; F269-G279 PolarHBondContact N-O 3.48Å; F269-G279 PolarHBondContact O-N 2.76Å; F269-V281 HydrophobicContact CD2-CG2 4.48Å; F269-V281 HydrophobicContact CE2-CG2 3.85Å; F269-F293 HydrophobicContact CE1-CZ 4.01Å; F269-Y300 HydrophobicContact CE1-CD1 4.49Å; F269-Y300 HydrophobicContact CE2-CE1 4.04Å; F269-Y300 AromaticContact CZ-CD1 3.73Å; F269-Y300 HydrophobicContact CZ-CD1 3.73Å; F269-Y300 AromaticContact CZ-CE1 3.49Å; F269-Y300 HydrophobicContact CZ-CE1 3.49Å; F269-Y300 VanDerWaalsContact CZ-CE1 3.49Å; F269-Y300 HydrophobicContact CZ-CE2 4.4Å; F269-Y300 HydrophobicContact CZ-CG 4.27Å; F269-Y300 AromaticContact CZ-CZ 3.87Å; F269-F314 AromaticContact CE1-CE1 3.76Å; F269-F314 HydrophobicContact CE1-CE1 3.76Å; F269-F314 AromaticContact CE1-CZ 3.95Å; F269-F314 HydrophobicContact CE1-CZ 3.95Å; F269-F314 AromaticContact CZ-CE1 3.78Å; F269-F314 HydrophobicContact CZ-CE1 3.78Å; F269-F314 HydrophobicContact CZ-CZ 4.24Å; F269-Y318 HydrophobicContact CD1-CE2 4.35Å
270	F	97.7	Very high	85.7	Confident	7 Å²	7	55 Å²	55	3%	0.031	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	146.8	178.7	-66.2	-104.9	0	0	0	111.1	F226 R227 T228 H243 V244 L246 R268 E275 E276 E277 F278	F226-F270 HydrophobicContact CB-CD1 4.25Å; F226-F270 HydrophobicContact CB-CD2 4.33Å; F226-F270 HydrophobicContact CB-CE1 4.47Å; F226-F270 HydrophobicContact CB-CG 4.16Å; F226-F270 HydrophobicContact CD1-CB 3.63Å; F226-F270 HydrophobicContact CD1-CD1 4.16Å; F226-F270 HydrophobicContact CD1-CG 4.02Å; F226-F270 HydrophobicContact CE1-CB 4.22Å; F226-F270 HydrophobicContact CG-CB 4.27Å; F226-F270 HydrophobicContact CG-CG 4.39Å; R227-F270 WeakPolarHBondContact O-CZ 3.49Å; T228-F270 HydrophobicContact CG2-CE2 4.18Å; T228-F270 HydrophobicContact CG2-CZ 4.09Å; H243-F270 WeakPolarHBondContact CA-O 3.49Å; V244-F270 HydrophobicContact CG1-CB 3.75Å; V244-F270 PolarHBondContact N-O 2.7Å; V244-F270 PolarHBondContact O-N 2.72Å; L246-F270 HydrophobicContact CD1-CD2 4.09Å; L246-F270 HydrophobicContact CD1-CE2 4.48Å; L246-F270 HydrophobicContact CD2-CD2 4.32Å; L246-F270 HydrophobicContact CD2-CE2 3.92Å; R268-F270 HydrophobicContact CB-CD2 4.38Å; R268-F270 HydrophobicContact CB-CE2 3.75Å; F270-E275 WeakPolarHBondContact CD1-O 3.31Å; F270-E276 CarbonylContact C-O 3.41Å; F270-E276 WeakPolarHBondContact CA-O 3.45Å; F270-E277 HydrophobicContact CD1-CB 3.87Å; F270-E277 HydrophobicContact CE1-CB 3.69Å; F270-E277 HydrophobicContact CG-CB 4.4Å; F270-E277 HydrophobicContact CZ-CB 4.05Å; F270-E277 HydrophobicContact CZ-CG 4.44Å; F270-F278 VanDerWaalsContact C-CE1 3.46Å
271	H	96.4	Very high	87.7	Confident	22 Å²	22	53.5 Å²	53.5	10%	0.102	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	126.8	170.9	-165.7	-63.1	0	0	0	109.5	D242 A273 F274 E275 E276 F278 F323	D242-H271 CarbonylContact O-C 3.55Å; D242-H271 WeakPolarHBondContact O-CA 3.47Å; H271-A273 PolarHBondContact ND1-N 2.71Å; H271-A273 PolarHBondContact O-N 3.03Å; H271-F274 HydrophobicContact CB-CD2 4.36Å; H271-F274 AromaticContact CE1-CD2 3.68Å; H271-F274 AromaticContact CE1-CE2 3.72Å; H271-F274 AromaticContact CG-CD2 3.72Å; H271-F274 AromaticContact ND1-CD2 3.44Å; H271-F274 WeakPolarHBondContact ND1-CD2 3.32Å; H271-F274 AromaticContact ND1-CE2 3.99Å; H271-F274 AromaticContact NE2-CE2 3.98Å; H271-E275 WeakPolarHBondContact O-CA 3.28Å; H271-E275 PolarHBondContact O-N 2.64Å; H271-E276 PolarHBondContact N-O 3.42Å; H271-F278 HydrophobicContact CB-CD1 4.3Å; H271-F323 HydrophobicContact CB-CD2 4.04Å; H271-F323 HydrophobicContact CB-CE2 4.26Å; H271-F323 AromaticContact CD2-CD2 3.82Å; H271-F323 AromaticContact CD2-CG 3.8Å
272	L	94.8	Very high	89.5	Confident	20 Å²	20	49.9 Å²	49.9	11%	0.105	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-48.3	-174.1	-68.8	180	0	0	0	112.1	L214 K224 F226 L237 D242 V244	L214-L272 HydrophobicContact CD1-CD2 4.42Å; L214-L272 HydrophobicContact CD2-CD2 4.22Å; K224-L272 WeakPolarHBondContact CD-O 3.42Å; K224-L272 WeakPolarHBondContact CG-O 3.22Å; F226-L272 HydrophobicContact CE1-CD2 4.27Å; F226-L272 HydrophobicContact CE2-CD2 3.94Å; F226-L272 HydrophobicContact CZ-CD2 3.44Å; F226-L272 VanDerWaalsContact CZ-CD2 3.44Å; L237-L272 HydrophobicContact CD2-CD1 4.08Å; L237-L272 HydrophobicContact CD2-CD2 3.73Å; D242-L272 HydrophobicContact CB-CB 4.17Å; D242-L272 HydrophobicContact CB-CD1 4.46Å; D242-L272 PolarHBondContact O-N 2.8Å; V244-L272 HydrophobicContact CB-CD2 3.73Å; V244-L272 HydrophobicContact CG1-CD2 3.92Å
273	A	93.5	Very high	91.1	Very high	43 Å²	43	48.4 Å²	48.4	36%	0.355	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-44.8	-178.6	0	0	0	0	0	113.6	K224 H271	K224-A273 PolarHBondContact NZ-O 2.71Å; H271-A273 PolarHBondContact ND1-N 2.71Å; H271-A273 PolarHBondContact O-N 3.03Å
274	F	94.9	Very high	92.6	Very high	94 Å²	94	48.6 Å²	48.6	41%	0.412	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-11.7	-170.4	-56.2	-66.4	0	0	0	114.8	H271 E276 F323 A325	H271-F274 HydrophobicContact CB-CD2 4.36Å; H271-F274 AromaticContact CE1-CD2 3.68Å; H271-F274 AromaticContact CE1-CE2 3.72Å; H271-F274 AromaticContact CG-CD2 3.72Å; H271-F274 AromaticContact ND1-CD2 3.44Å; H271-F274 WeakPolarHBondContact ND1-CD2 3.32Å; H271-F274 AromaticContact ND1-CE2 3.99Å; H271-F274 AromaticContact NE2-CE2 3.98Å; F274-E276 HydrophobicContact CB-CG 4.21Å; F274-E276 PolarHBondContact O-N 3.16Å; F274-F323 HydrophobicContact CB-CE1 4.14Å; F274-F323 HydrophobicContact CB-CZ 4.27Å; F274-F323 HydrophobicContact CD2-CB 4.4Å; F274-F323 AromaticContact CD2-CD1 3.29Å; F274-F323 HydrophobicContact CD2-CD1 3.29Å; F274-F323 HydrophobicContact CD2-CD2 4.41Å; F274-F323 AromaticContact CD2-CE1 3.56Å; F274-F323 HydrophobicContact CD2-CE1 3.56Å; F274-F323 AromaticContact CD2-CG 3.78Å; F274-F323 HydrophobicContact CD2-CG 3.78Å; F274-F323 HydrophobicContact CD2-CZ 4.25Å; F274-F323 HydrophobicContact CE2-CB 4.19Å; F274-F323 AromaticContact CE2-CD1 3.44Å; F274-F323 HydrophobicContact CE2-CD1 3.44Å; F274-F323 VanDerWaalsContact CE2-CD1 3.44Å; F274-F323 HydrophobicContact CE2-CE1 4.1Å; F274-F323 AromaticContact CE2-CG 3.98Å; F274-F323 HydrophobicContact CE2-CG 3.98Å; F274-F323 HydrophobicContact CG-CD1 4.04Å; F274-F323 AromaticContact CG-CE1 3.84Å; F274-F323 HydrophobicContact CG-CE1 3.84Å; F274-F323 HydrophobicContact CG-CZ 4.45Å; F274-F323 HydrophobicContact CZ-CD1 4.28Å; F274-A325 HydrophobicContact CD1-CB 4.35Å; F274-A325 HydrophobicContact CE1-CB 3.76Å; F274-A325 HydrophobicContact CZ-CB 3.9Å
275	E	96.3	Very high	93.4	Very high	70 Å²	70	52.1 Å²	52.1	33%	0.327	26%	0.256	S	S	.	.			trans	61.8	11.1	-173.4	-49.9	-170.1	157.5	0	0	115.1	K224 T225 F226 F270 H271	K224-E275 WeakPolarHBondContact CA-OE1 3.19Å; K224-E275 HydrophobicContact CB-CG 4.31Å; K224-E275 WeakPolarHBondContact CB-OE1 3.06Å; K224-E275 HydrophobicContact CD-CG 3.75Å; K224-E275 VanDerWaalsContact CD-OE1 3.28Å; K224-E275 WeakPolarHBondContact CD-OE1 3.07Å; T225-E275 PolarHBondContact N-OE1 3.45Å; F226-E275 HydrophobicContact CD1-CB 4.42Å; F226-E275 HydrophobicContact CE1-CB 4.45Å; F226-E275 HydrophobicContact CE1-CG 4.35Å; F270-E275 WeakPolarHBondContact CD1-O 3.31Å; H271-E275 WeakPolarHBondContact O-CA 3.28Å; H271-E275 PolarHBondContact O-N 2.64Å
276	E	95.8	Very high	93.8	Very high	117 Å²	117	51.4 Å²	51.4	55%	0.547	26%	0.255	S	S	.	.			trans	-90.9	143.7	-177.1	-61.9	-147.4	168.5	0	0	113.3	F270 H271 F274 F323	F270-E276 CarbonylContact C-O 3.41Å; F270-E276 WeakPolarHBondContact CA-O 3.45Å; H271-E276 PolarHBondContact N-O 3.42Å; F274-E276 HydrophobicContact CB-CG 4.21Å; F274-E276 PolarHBondContact O-N 3.16Å; E276-F323 HydrophobicContact CB-CE2 4.02Å; E276-F323 HydrophobicContact CB-CZ 3.76Å; E276-F323 HydrophobicContact CG-CZ 4.13Å
277	E	95.3	Very high	93.9	Very high	57 Å²	57	50.5 Å²	50.5	27%	0.266	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	120.9	176.5	180	177.9	-147.5	0	0	111.1	R268 F269 F270 R280	R268-E277 WeakPolarHBondContact CB-OE1 3.33Å; R268-E277 WeakPolarHBondContact CG-OE1 3.33Å; R268-E277 IonicContact CZ-OE1 3.76Å; R268-E277 IonicContact CZ-OE2 2.62Å; R268-E277 IonicContact NE-OE1 2.84Å; R268-E277 PolarHBondContact NE-OE1 3.31Å; R268-E277 IonicContact NE-OE2 2.7Å; R268-E277 VanDerWaalsContact NH2-CD 3.32Å; R268-E277 IonicContact NH2-OE1 3.87Å; R268-E277 PolarHBondContact NH2-OE1 2.79Å; R268-E277 IonicContact NH2-OE2 3.52Å; R268-E277 PolarHBondContact NH2-OE2 3.33Å; F269-E277 CarbonylContact O-C 3.58Å; F269-E277 WeakPolarHBondContact O-CA 3.26Å; F270-E277 HydrophobicContact CD1-CB 3.87Å; F270-E277 HydrophobicContact CE1-CB 3.69Å; F270-E277 HydrophobicContact CG-CB 4.4Å; F270-E277 HydrophobicContact CZ-CB 4.05Å; F270-E277 HydrophobicContact CZ-CG 4.44Å; E277-R280 VanDerWaalsContact CD-NE 3.27Å; E277-R280 WeakPolarHBondContact OE1-CD 3.34Å; E277-R280 WeakPolarHBondContact OE1-CG 3.22Å; E277-R280 IonicContact OE1-CZ 3.75Å; E277-R280 IonicContact OE1-NE 3.41Å; E277-R280 PolarHBondContact OE1-NE 3.29Å; E277-R280 IonicContact OE1-NH2 2.75Å; E277-R280 IonicContact OE2-CZ 3.75Å; E277-R280 IonicContact OE2-NE 2.94Å; E277-R280 PolarHBondContact OE2-NE 3.05Å; E277-R280 IonicContact OE2-NH2 3.3Å; E277-R280 PolarHBondContact OE2-NH2 2.87Å
278	F	94.7	Very high	94	Very high	53 Å²	53	50.5 Å²	50.5	23%	0.232	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	-11.5	179.8	68.9	-94	0	0	0	114.2	H243 F269 F270 H271 Y318 F321	H243-F278 HydrophobicContact CB-CE1 4.34Å; H243-F278 HydrophobicContact CB-CZ 4.15Å; H243-F278 AromaticContact CD2-CE1 3.49Å; H243-F278 VanDerWaalsContact CD2-CE1 3.49Å; H243-F278 WeakPolarHBondContact CD2-CE1 3.17Å; H243-F278 AromaticContact CD2-CZ 3.53Å; H243-F278 AromaticContact CE1-CZ 3.84Å; H243-F278 AromaticContact CG-CE1 3.89Å; H243-F278 AromaticContact CG-CZ 3.57Å; H243-F278 AromaticContact ND1-CZ 3.75Å; H243-F278 AromaticContact NE2-CE1 3.92Å; H243-F278 AromaticContact NE2-CZ 3.7Å; F269-F278 HydrophobicContact CB-CD1 4.44Å; F269-F278 HydrophobicContact CB-CD2 4.42Å; F269-F278 HydrophobicContact CB-CE1 4Å; F269-F278 HydrophobicContact CB-CE2 3.97Å; F269-F278 HydrophobicContact CB-CZ 3.75Å; F269-F278 HydrophobicContact CD1-CZ 4.45Å; F269-F278 PolarHBondContact O-N 2.85Å; F270-F278 VanDerWaalsContact C-CE1 3.46Å; H271-F278 HydrophobicContact CB-CD1 4.3Å; F278-Y318 HydrophobicContact CE2-CD2 4.27Å; F278-Y318 AromaticContact CE2-CE2 3.94Å; F278-Y318 HydrophobicContact CE2-CE2 3.94Å; F278-Y318 HydrophobicContact CZ-CE2 4.08Å; F278-F321 HydrophobicContact CB-CE1 4.08Å; F278-F321 HydrophobicContact CB-CE2 4.29Å; F278-F321 HydrophobicContact CB-CZ 3.56Å; F278-F321 HydrophobicContact CD1-CE1 4.13Å; F278-F321 HydrophobicContact CD1-CZ 4.47Å; F278-F321 HydrophobicContact CD2-CD1 4.19Å; F278-F321 AromaticContact CD2-CE1 3.77Å; F278-F321 HydrophobicContact CD2-CE1 3.77Å; F278-F321 HydrophobicContact CD2-CE2 4.39Å; F278-F321 AromaticContact CD2-CZ 3.89Å; F278-F321 HydrophobicContact CD2-CZ 3.89Å; F278-F321 HydrophobicContact CE1-CE1 4.49Å; F278-F321 HydrophobicContact CE2-CD1 4.25Å; F278-F321 HydrophobicContact CE2-CE1 4.18Å; F278-F321 AromaticContact CG-CE1 3.75Å; F278-F321 HydrophobicContact CG-CE1 3.75Å; F278-F321 AromaticContact CG-CZ 3.75Å; F278-F321 HydrophobicContact CG-CZ 3.75Å
279	G	93.3	Very high	94	Very high	22 Å²	22	50.1 Å²	50.1	23%	0.227	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	149.7	-175.1	0	0	0	0	0	115.3	F269	F269-G279 PolarHBondContact N-O 3.48Å; F269-G279 PolarHBondContact O-N 2.76Å
280	R	93.5	Very high	94.1	Very high	117 Å²	117	50 Å²	50	44%	0.442	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	132.7	172.7	-63.4	-170.3	-173.9	172.1	6.8	111.7	E266 A267 R268 E277	E266-R280 VanDerWaalsContact OE2-CD 3.32Å; E266-R280 WeakPolarHBondContact OE2-CD 3.35Å; A267-R280 CarbonylContact O-C 3.58Å; A267-R280 WeakPolarHBondContact O-CA 3.46Å; R268-R280 HydrophobicContact CG-CG 4.4Å; E277-R280 VanDerWaalsContact CD-NE 3.27Å; E277-R280 WeakPolarHBondContact OE1-CD 3.34Å; E277-R280 WeakPolarHBondContact OE1-CG 3.22Å; E277-R280 IonicContact OE1-CZ 3.75Å; E277-R280 IonicContact OE1-NE 3.41Å; E277-R280 PolarHBondContact OE1-NE 3.29Å; E277-R280 IonicContact OE1-NH2 2.75Å; E277-R280 IonicContact OE2-CZ 3.75Å; E277-R280 IonicContact OE2-NE 2.94Å; E277-R280 PolarHBondContact OE2-NE 3.05Å; E277-R280 IonicContact OE2-NH2 3.3Å; E277-R280 PolarHBondContact OE2-NH2 2.87Å
281	V	93.9	Very high	94.1	Very high	47 Å²	47	49.6 Å²	49.6	29%	0.285	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	126.7	175.2	-178.2	0	0	0	0	109.5	E266 A267 F269 Y300	E266-V281 CarbonylContact C-O 3.55Å; E266-V281 WeakPolarHBondContact CA-O 3.36Å; A267-V281 HydrophobicContact CB-CB 4.41Å; A267-V281 PolarHBondContact N-O 3.47Å; A267-V281 PolarHBondContact O-N 2.71Å; F269-V281 HydrophobicContact CD2-CG2 4.48Å; F269-V281 HydrophobicContact CE2-CG2 3.85Å; V281-Y300 VanDerWaalsContact CB-OH 3.3Å; V281-Y300 WeakPolarHBondContact CB-OH 3.48Å; V281-Y300 WeakPolarHBondContact CG1-OH 3.35Å
282	K	91	Very high	94.2	Very high	144 Å²	144	49 Å²	49	63%	0.626	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	144.6	-179.7	-38.5	-163.4	-174.8	-147.6	0	109.6	E266	E266-K282 HydrophobicContact CG-CB 4.44Å; E266-K282 HydrophobicContact CG-CD 4.07Å; E266-K282 HydrophobicContact CG-CG 3.87Å; E266-K282 WeakPolarHBondContact OE1-CD 3.44Å; E266-K282 VanDerWaalsContact OE1-CE 3.27Å; E266-K282 WeakPolarHBondContact OE1-CE 3.27Å; E266-K282 IonicContact OE1-NZ 2.71Å; E266-K282 PolarHBondContact OE1-NZ 3.05Å; E266-K282 WeakPolarHBondContact OE2-CE 3.44Å; E266-K282 IonicContact OE2-NZ 3.51Å; E266-K282 PolarHBondContact OE2-NZ 2.9Å; E266-K282 VanDerWaalsContact OE2-NZ 3.16Å
283	G	87.4	Confident	94.4	Very high	33 Å²	33	48.9 Å²	48.9	34%	0.34	25%	0.247	S	C	.	.			trans	179	-27.8	173.5	0	0	0	0	0	116.7	R310	G283-R310 PolarHBondContact O-NE 3.45Å; G283-R310 PolarHBondContact O-NH2 2.7Å
284	H	91	Very high	94.6	Very high	10 Å²	10	47.8 Å²	47.8	5%	0.046	23%	0.234	C	C	.	.			trans	-80.2	148	-179.7	-74.7	-95	0	0	0	113	I288 S302 G304 D306 Y308 R310	H284-I288 HydrophobicContact CB-CG1 4.21Å; H284-S302 PolarHBondContact CE1-O 2.82Å; H284-S302 VanDerWaalsContact CE1-O 3.28Å; H284-S302 PolarHBondContact NE2-O 2.98Å; H284-S302 PolarHBondContact NE2-OG 2.63Å; H284-G304 PolarHBondContact CE1-N 3.21Å; H284-G304 VanDerWaalsContact CE1-N 3.28Å; H284-G304 WeakPolarHBondContact ND1-CA 3.43Å; H284-G304 PolarHBondContact ND1-N 3.45Å; H284-D306 WeakPolarHBondContact CA-OD2 3.48Å; H284-D306 IonicContact CE1-OD1 2.7Å; H284-D306 IonicContact CG-OD1 3.56Å; H284-D306 IonicContact ND1-OD1 3.5Å; H284-D306 PolarHBondContact ND1-OD1 3.37Å; H284-D306 IonicContact ND1-OD2 2.72Å; H284-Y308 PolarHBondContact CE1-O 3.16Å; H284-R310 PolarHBondContact CE1-NH1 3.19Å; H284-R310 PolarHBondContact ND1-NH1 3.3Å
285	F	88.9	Confident	94.7	Very high	150 Å²	150	44.8 Å²	44.8	66%	0.658	22%	0.224	S	C	*	.	S	Bend	trans	-100.2	51.1	175.3	-68.5	-88.1	0	0	0	112.1	T260 D306	T260-F285 HydrophobicContact CG2-CD1 3.71Å; T260-F285 HydrophobicContact CG2-CE1 4.08Å; F285-D306 HydrophobicContact CB-CB 4.03Å; F285-D306 PolarHBondContact N-OD2 3.23Å
286	G	91.3	Very high	94.6	Very high	6 Å²	6	43.9 Å²	43.9	6%	0.062	22%	0.221	C	C	.	.	S	Bend	trans	155.7	172.8	-175.2	0	0	0	0	0	109.5	F265	F265-G286 VanDerWaalsContact CB-O 3.25Å; F265-G286 WeakPolarHBondContact CB-O 3.44Å; F265-G286 VanDerWaalsContact CD2-N 3.32Å; F265-G286 WeakPolarHBondContact CG-O 3.28Å
287	P	93.9	Very high	94.6	Very high	5 Å²	5	38.3 Å²	38.3	3%	0.032	20%	0.195	C	C	.	.			trans	-49.3	142.4	177.6	-28.1	35.2	0	0	0	112.7	E251 F265 G304 E305	E251-P287 HydrophobicContact CG-CG 3.98Å; F265-P287 HydrophobicContact CD1-CG 4.24Å; F265-P287 VanDerWaalsContact CE1-CD 3.49Å; F265-P287 HydrophobicContact CE1-CG 3.81Å; P287-G304 CarbonylContact O-C 3.53Å; P287-G304 VanDerWaalsContact O-CA 3.3Å; P287-G304 WeakPolarHBondContact O-CA 3.43Å; P287-E305 PolarHBondContact O-N 3.22Å
288	I	96.4	Very high	94.7	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	125.4	166.2	-57.7	177.1	0	0	0	106.1	N233 G248 A267 H284 V291	N233-I288 WeakPolarHBondContact CB-O 3.41Å; N233-I288 PolarHBondContact ND2-O 2.95Å; G248-I288 WeakPolarHBondContact CA-O 3.07Å; G248-I288 PolarHBondContact N-O 3.43Å; G248-I288 PolarHBondContact O-N 2.95Å; A267-I288 HydrophobicContact CB-CD1 3.92Å; H284-I288 HydrophobicContact CB-CG1 4.21Å; I288-V291 HydrophobicContact CG2-CG1 3.6Å
289	N	97.1	Very high	94.8	Very high	27 Å²	27	38.4 Å²	38.4	14%	0.144	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-34.5	-173.8	-70.6	-14.3	0	0	0	111.9	I13 N233 S234 G303 E305	I13-N289 WeakPolarHBondContact O-CB 3.36Å; I13-N289 PolarHBondContact O-ND2 2.74Å; N233-N289 PolarHBondContact ND2-OD1 3.48Å; S234-N289 WeakPolarHBondContact CB-O 3.41Å; N289-G303 PolarHBondContact N-O 3.33Å; N289-E305 PolarHBondContact ND2-OE2 3.45Å
290	S	98.2	Very high	95	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.021	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	138.3	179.4	-171.1	0	0	0	0	110.6	I16 S302 G303	I16-S290 PolarHBondContact N-OG 3.28Å; I16-S290 VanDerWaalsContact N-OG 3.11Å; S290-S302 CarbonylContact O-C 3.55Å; S290-S302 WeakPolarHBondContact O-CA 3.38Å; S290-G303 PolarHBondContact N-O 3.37Å; S290-G303 VanDerWaalsContact N-O 3.15Å; S290-G303 PolarHBondContact O-N 3.19Å
291	V	98.4	Very high	95.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	148.6	172.4	-66.9	0	0	0	0	109.7	Q195 S234 A236 V245 I288 S301	Q195-V291 PolarHBondContact NE2-O 2.95Å; S234-V291 WeakPolarHBondContact OG-CG2 3.44Å; S234-V291 PolarHBondContact OG-N 3.48Å; S234-V291 PolarHBondContact OG-O 2.88Å; A236-V291 HydrophobicContact CB-CG2 4.2Å; V245-V291 HydrophobicContact CG1-CB 4.22Å; V245-V291 HydrophobicContact CG1-CG2 4.07Å; I288-V291 HydrophobicContact CG2-CG1 3.6Å; V291-S301 WeakPolarHBondContact CA-O 3.45Å
292	A	98.5	Very high	95.4	Very high	8 Å²	8	29.6 Å²	29.6	7%	0.066	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	132.7	173.3	0	0	0	0	0	109.7	I16 Y18 Y300 S301	I16-A292 HydrophobicContact CD1-CB 4.17Å; I16-A292 HydrophobicContact CG1-CB 4.18Å; Y18-A292 HydrophobicContact CD2-CB 4.06Å; Y18-A292 HydrophobicContact CE2-CB 4.19Å; A292-Y300 CarbonylContact O-C 3.41Å; A292-Y300 WeakPolarHBondContact O-CA 3.39Å; A292-S301 PolarHBondContact N-O 3.18Å; A292-S301 PolarHBondContact O-N 2.77Å
293	F	98.4	Very high	95.7	Very high	18 Å²	18	22.8 Å²	22.8	8%	0.079	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	144.2	165.2	-84.8	-89.6	0	0	0	109.8	Y18 A236 L237 V245 F269 F314	Y18-F293 VanDerWaalsContact CD2-O 3.27Å; Y18-F293 WeakPolarHBondContact CD2-O 3.49Å; A236-F293 HydrophobicContact CB-CD2 3.91Å; A236-F293 WeakPolarHBondContact O-CE2 3.41Å; L237-F293 WeakPolarHBondContact O-CD2 3.37Å; V245-F293 HydrophobicContact CB-CE2 3.86Å; V245-F293 HydrophobicContact CB-CZ 4.18Å; V245-F293 HydrophobicContact CG1-CD2 3.86Å; V245-F293 HydrophobicContact CG1-CE2 3.43Å; V245-F293 VanDerWaalsContact CG1-CE2 3.43Å; V245-F293 HydrophobicContact CG1-CZ 4.14Å; F269-F293 HydrophobicContact CE1-CZ 4.01Å; F293-F314 HydrophobicContact CD1-CE2 4.06Å; F293-F314 HydrophobicContact CD1-CZ 4.12Å; F293-F314 AromaticContact CE1-CE2 3.69Å; F293-F314 HydrophobicContact CE1-CE2 3.69Å; F293-F314 AromaticContact CE1-CZ 3.49Å; F293-F314 HydrophobicContact CE1-CZ 3.49Å; F293-F314 VanDerWaalsContact CE1-CZ 3.49Å; F293-F314 HydrophobicContact CZ-CZ 4.33Å
294	H	97.9	Very high	96.1	Very high	20 Å²	20	21.2 Å²	21.2	9%	0.093	10%	0.104	C	C	.	.			trans	-69.8	142.2	167.1	-179.7	-95	0	0	0	109.1	Y18 G22 D296 G297 S299	Y18-H294 AromaticContact CD1-CD2 3.95Å; Y18-H294 HydrophobicContact CE1-CB 4.49Å; Y18-H294 AromaticContact CE1-CD2 3.62Å; Y18-H294 HydrophobicContact CE2-CB 4.01Å; Y18-H294 AromaticContact CZ-CD2 3.93Å; G22-H294 PolarHBondContact O-CD2 2.89Å; G22-H294 PolarHBondContact O-NE2 2.87Å; H294-D296 IonicContact CE1-OD1 2.71Å; H294-D296 IonicContact CG-OD1 3.27Å; H294-D296 PolarHBondContact ND1-N 3.34Å; H294-D296 IonicContact ND1-OD1 3.6Å; H294-D296 PolarHBondContact ND1-OD1 2.88Å; H294-D296 PolarHBondContact O-N 3.3Å; H294-G297 PolarHBondContact O-N 2.54Å; H294-S299 WeakPolarHBondContact CB-O 3.28Å; H294-S299 WeakPolarHBondContact CB-OG 3.41Å; H294-S299 PolarHBondContact N-O 3.44Å
295	P	96.9	Very high	96.3	Very high	31 Å²	31	22.7 Å²	22.7	20%	0.201	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-23.3	-174.3	-30.1	37	0	0	0	116.1	R198	R198-P295 PolarHBondContact NH1-O 2.8Å
296	D	95.9	Very high	96.5	Very high	51 Å²	51	17.1 Å²	17.1	27%	0.273	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-4.7	175.6	91.8	-24.6	0	0	0	114.6	N240 H294 K298	N240-D296 PolarHBondContact ND2-O 2.74Å; H294-D296 IonicContact CE1-OD1 2.71Å; H294-D296 IonicContact CG-OD1 3.27Å; H294-D296 PolarHBondContact ND1-N 3.34Å; H294-D296 IonicContact ND1-OD1 3.6Å; H294-D296 PolarHBondContact ND1-OD1 2.88Å; H294-D296 PolarHBondContact O-N 3.3Å; D296-K298 PolarHBondContact O-N 2.97Å; D296-K298 WeakPolarHBondContact OD1-CB 3.48Å; D296-K298 PolarHBondContact OD1-N 2.92Å; D296-K298 WeakPolarHBondContact OD2-CD 3.27Å; D296-K298 WeakPolarHBondContact OD2-CE 3.2Å; D296-K298 WeakPolarHBondContact OD2-CG 3.16Å; D296-K298 IonicContact OD2-NZ 3.8Å; D296-K298 PolarHBondContact OD2-NZ 3.05Å
297	G	95.7	Very high	96.6	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.087	C	C	.	.	S	Bend	trans	67.8	7.7	179.5	0	0	0	0	0	116.6	P239 N240 H294	P239-G297 VanDerWaalsContact CG-CA 3.42Å; N240-G297 WeakPolarHBondContact ND2-CA 3.42Å; H294-G297 PolarHBondContact O-N 2.54Å
298	K	95.7	Very high	96.8	Very high	112 Å²	112	20.1 Å²	20.1	49%	0.487	10%	0.098	S	C	.	.	S	Bend	trans	-88.8	-10.1	179.4	-57.4	-168.3	-160.8	98.6	0	114.1	D296 F314 F319	D296-K298 PolarHBondContact O-N 2.97Å; D296-K298 WeakPolarHBondContact OD1-CB 3.48Å; D296-K298 PolarHBondContact OD1-N 2.92Å; D296-K298 WeakPolarHBondContact OD2-CD 3.27Å; D296-K298 WeakPolarHBondContact OD2-CE 3.2Å; D296-K298 WeakPolarHBondContact OD2-CG 3.16Å; D296-K298 IonicContact OD2-NZ 3.8Å; D296-K298 PolarHBondContact OD2-NZ 3.05Å; K298-F314 VanDerWaalsContact O-CD2 3.28Å; K298-F314 WeakPolarHBondContact O-CD2 3.41Å; K298-F314 PolarHBondContact O-N 2.83Å; K298-F319 HydrophobicContact CB-CZ 4.09Å; K298-F319 HydrophobicContact CG-CE1 4.45Å; K298-F319 HydrophobicContact CG-CZ 4.26Å
299	S	96.8	Very high	96.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	167.5	176.9	66.9	0	0	0	0	111.4	H294 H312	H294-S299 WeakPolarHBondContact CB-O 3.28Å; H294-S299 WeakPolarHBondContact CB-OG 3.41Å; H294-S299 PolarHBondContact N-O 3.44Å; S299-H312 CarbonylContact C-O 3.57Å; S299-H312 WeakPolarHBondContact CA-O 3.28Å; S299-H312 WeakPolarHBondContact CB-O 3.14Å
300	Y	97.7	Very high	96.9	Very high	2 Å²	2	19.7 Å²	19.7	1%	0.008	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	153.7	164.5	80.8	-75	0	0	0	109.5	V245 A267 F269 V281 A292 H312 F314	V245-Y300 HydrophobicContact CG1-CD2 4.43Å; V245-Y300 HydrophobicContact CG2-CD2 4.23Å; V245-Y300 HydrophobicContact CG2-CE2 4.18Å; A267-Y300 HydrophobicContact CB-CE2 3.99Å; A267-Y300 WeakPolarHBondContact CB-OH 3.46Å; F269-Y300 HydrophobicContact CE1-CD1 4.49Å; F269-Y300 HydrophobicContact CE2-CE1 4.04Å; F269-Y300 AromaticContact CZ-CD1 3.73Å; F269-Y300 HydrophobicContact CZ-CD1 3.73Å; F269-Y300 AromaticContact CZ-CE1 3.49Å; F269-Y300 HydrophobicContact CZ-CE1 3.49Å; F269-Y300 VanDerWaalsContact CZ-CE1 3.49Å; F269-Y300 HydrophobicContact CZ-CE2 4.4Å; F269-Y300 HydrophobicContact CZ-CG 4.27Å; F269-Y300 AromaticContact CZ-CZ 3.87Å; V281-Y300 VanDerWaalsContact CB-OH 3.3Å; V281-Y300 WeakPolarHBondContact CB-OH 3.48Å; V281-Y300 WeakPolarHBondContact CG1-OH 3.35Å; A292-Y300 CarbonylContact O-C 3.41Å; A292-Y300 WeakPolarHBondContact O-CA 3.39Å; Y300-H312 HydrophobicContact CD1-CB 3.74Å; Y300-H312 HydrophobicContact CE1-CB 3.3Å; Y300-H312 AromaticContact CE1-CG 3.73Å; Y300-H312 AromaticContact CE1-ND1 4Å; Y300-H312 AromaticContact CE2-ND1 3.92Å; Y300-H312 AromaticContact CZ-CG 3.71Å; Y300-H312 AromaticContact CZ-ND1 3.57Å; Y300-H312 PolarHBondContact N-O 3.28Å; Y300-H312 PolarHBondContact O-N 3.45Å; Y300-F314 AromaticContact CD1-CE1 3.56Å; Y300-F314 HydrophobicContact CD1-CE1 3.56Å; Y300-F314 AromaticContact CD1-CZ 3.58Å; Y300-F314 HydrophobicContact CD1-CZ 3.58Å; Y300-F314 HydrophobicContact CE1-CE1 4.02Å; Y300-F314 HydrophobicContact CE1-CZ 4.47Å; Y300-F314 HydrophobicContact CG-CZ 4.27Å
301	S	98.4	Very high	96.8	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	151	171.2	-81.2	0	0	0	0	111.2	I16 Y18 V291 A292 R310 I311	I16-S301 VanDerWaalsContact CD1-C 3.49Å; I16-S301 VanDerWaalsContact CD1-CB 3.49Å; I16-S301 WeakPolarHBondContact CD1-O 3.33Å; Y18-S301 WeakPolarHBondContact OH-CB 3.33Å; Y18-S301 PolarHBondContact OH-OG 2.95Å; V291-S301 WeakPolarHBondContact CA-O 3.45Å; A292-S301 PolarHBondContact N-O 3.18Å; A292-S301 PolarHBondContact O-N 2.77Å; S301-R310 VanDerWaalsContact CA-O 3.3Å; S301-R310 WeakPolarHBondContact CA-O 3.15Å; S301-I311 WeakPolarHBondContact OG-CG1 3.21Å
302	S	98.1	Very high	96.7	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	132.6	171.6	60.2	0	0	0	0	111.3	H284 S290 V309 R310 H312	H284-S302 PolarHBondContact CE1-O 2.82Å; H284-S302 VanDerWaalsContact CE1-O 3.28Å; H284-S302 PolarHBondContact NE2-O 2.98Å; H284-S302 PolarHBondContact NE2-OG 2.63Å; S290-S302 CarbonylContact O-C 3.55Å; S290-S302 WeakPolarHBondContact O-CA 3.38Å; S302-V309 CarbonylContact O-C 3.56Å; S302-V309 VanDerWaalsContact O-CA 3.32Å; S302-V309 WeakPolarHBondContact O-CA 3.15Å; S302-R310 PolarHBondContact N-O 3.17Å; S302-R310 PolarHBondContact O-N 2.83Å; S302-H312 PolarHBondContact OG-CE1 3.49Å
303	G	97.7	Very high	96.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	136.6	172.1	0	0	0	0	0	110.7	N289 S290	N289-G303 PolarHBondContact N-O 3.33Å; S290-G303 PolarHBondContact N-O 3.37Å; S290-G303 VanDerWaalsContact N-O 3.15Å; S290-G303 PolarHBondContact O-N 3.19Å
304	G	95.2	Very high	96.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	175.5	-174.4	0	0	0	0	0	115.3	I13 H284 P287 D306 G307 Y308	I13-G304 PolarHBondContact N-O 2.68Å; H284-G304 PolarHBondContact CE1-N 3.21Å; H284-G304 VanDerWaalsContact CE1-N 3.28Å; H284-G304 WeakPolarHBondContact ND1-CA 3.43Å; H284-G304 PolarHBondContact ND1-N 3.45Å; P287-G304 CarbonylContact O-C 3.53Å; P287-G304 VanDerWaalsContact O-CA 3.3Å; P287-G304 WeakPolarHBondContact O-CA 3.43Å; G304-D306 PolarHBondContact O-N 3.22Å; G304-G307 PolarHBondContact O-N 3Å; G304-G307 VanDerWaalsContact O-N 3.07Å; G304-Y308 PolarHBondContact N-O 2.87Å
305	E	94.5	Very high	96.1	Very high	42 Å²	42	26 Å²	26	20%	0.196	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-18.8	176.2	-164.1	59.1	-143	0	0	112.5	S12 K30 P287 N289 G307	S12-E305 VanDerWaalsContact CB-CD 3.41Å; S12-E305 WeakPolarHBondContact CB-OE1 3.21Å; S12-E305 VanDerWaalsContact CB-OE2 3.29Å; S12-E305 WeakPolarHBondContact CB-OE2 3.23Å; S12-E305 PolarHBondContact OG-OE1 3.14Å; K30-E305 IonicContact NZ-OE1 2.71Å; K30-E305 PolarHBondContact NZ-OE1 3.21Å; K30-E305 IonicContact NZ-OE2 3.45Å; K30-E305 PolarHBondContact NZ-OE2 2.92Å; P287-E305 PolarHBondContact O-N 3.22Å; N289-E305 PolarHBondContact ND2-OE2 3.45Å; E305-G307 PolarHBondContact O-N 3.12Å
306	D	92.8	Very high	95.8	Very high	32 Å²	32	28.3 Å²	28.3	17%	0.171	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-0.8	173.8	62.9	-13.3	0	0	0	114.6	H284 F285 G304 Y308 R310	H284-D306 WeakPolarHBondContact CA-OD2 3.48Å; H284-D306 IonicContact CE1-OD1 2.7Å; H284-D306 IonicContact CG-OD1 3.56Å; H284-D306 IonicContact ND1-OD1 3.5Å; H284-D306 PolarHBondContact ND1-OD1 3.37Å; H284-D306 IonicContact ND1-OD2 2.72Å; F285-D306 HydrophobicContact CB-CB 4.03Å; F285-D306 PolarHBondContact N-OD2 3.23Å; G304-D306 PolarHBondContact O-N 3.22Å; D306-Y308 HydrophobicContact CB-CD2 4.06Å; D306-Y308 WeakPolarHBondContact O-CD2 3.29Å; D306-Y308 WeakPolarHBondContact O-CE2 3.48Å; D306-Y308 PolarHBondContact O-N 3.15Å; D306-R310 IonicContact OD1-NH1 3.23Å; D306-R310 PolarHBondContact OD1-NH1 3.18Å; D306-R310 IonicContact OD2-CZ 3.03Å; D306-R310 VanDerWaalsContact OD2-CZ 3.3Å; D306-R310 IonicContact OD2-NH1 3.65Å; D306-R310 PolarHBondContact OD2-NH1 2.62Å; D306-R310 IonicContact OD2-NH2 3.36Å; D306-R310 PolarHBondContact OD2-NH2 3.12Å
307	G	95	Very high	95.6	Very high	4 Å²	4	33.3 Å²	33.3	4%	0.041	16%	0.159	C	C	.	.	S	Bend	trans	76	4	177.3	0	0	0	0	0	114.9	R11 I13 G304 E305	R11-G307 WeakPolarHBondContact O-CA 3.33Å; I13-G307 WeakPolarHBondContact CD1-O 3.3Å; G304-G307 PolarHBondContact O-N 3Å; G304-G307 VanDerWaalsContact O-N 3.07Å; E305-G307 PolarHBondContact O-N 3.12Å
308	Y	96.8	Very high	95.4	Very high	70 Å²	70	34.6 Å²	34.6	28%	0.275	16%	0.164	S	C	.	.			trans	-99.7	147.9	176.4	-66.6	-83.6	0	0	0	111.2	L5 Q7 H284 G304 D306	L5-Y308 HydrophobicContact CD1-CD1 3.64Å; L5-Y308 HydrophobicContact CD1-CE1 4.48Å; L5-Y308 HydrophobicContact CD1-CG 3.91Å; L5-Y308 HydrophobicContact CD2-CD1 3.96Å; L5-Y308 HydrophobicContact CD2-CE1 4.01Å; L5-Y308 HydrophobicContact CG-CD1 3.82Å; L5-Y308 HydrophobicContact CG-CE1 4.35Å; Q7-Y308 HydrophobicContact CB-CD1 4.03Å; Q7-Y308 HydrophobicContact CB-CE1 3.83Å; Q7-Y308 HydrophobicContact CG-CD1 4.2Å; Q7-Y308 HydrophobicContact CG-CE1 3.64Å; H284-Y308 PolarHBondContact CE1-O 3.16Å; G304-Y308 PolarHBondContact N-O 2.87Å; D306-Y308 HydrophobicContact CB-CD2 4.06Å; D306-Y308 WeakPolarHBondContact O-CD2 3.29Å; D306-Y308 WeakPolarHBondContact O-CE2 3.48Å; D306-Y308 PolarHBondContact O-N 3.15Å
309	V	98	Very high	95.1	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.018	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	141.8	162.8	179.5	0	0	0	0	108.9	L6 I13 I16 L25 T27 S302	L6-V309 HydrophobicContact CB-CB 4.12Å; L6-V309 HydrophobicContact CD1-CB 4.05Å; L6-V309 HydrophobicContact CD1-CG1 3.92Å; L6-V309 HydrophobicContact CG-CB 4.31Å; L6-V309 HydrophobicContact CG-CG1 4.49Å; L6-V309 PolarHBondContact N-O 2.8Å; L6-V309 PolarHBondContact O-N 3.15Å; I13-V309 HydrophobicContact CD1-CG2 3.79Å; I13-V309 HydrophobicContact CG1-CG2 3.74Å; I13-V309 HydrophobicContact CG2-CG2 4.11Å; I16-V309 HydrophobicContact CG2-CG1 4.11Å; I16-V309 HydrophobicContact CG2-CG2 3.69Å; L25-V309 HydrophobicContact CD2-CG1 4.2Å; T27-V309 HydrophobicContact CG2-CB 4.33Å; T27-V309 HydrophobicContact CG2-CG1 4.35Å; T27-V309 HydrophobicContact CG2-CG2 3.76Å; S302-V309 CarbonylContact O-C 3.56Å; S302-V309 VanDerWaalsContact O-CA 3.32Å; S302-V309 WeakPolarHBondContact O-CA 3.15Å
310	R	97.6	Very high	94.7	Very high	18 Å²	18	39.7 Å²	39.7	7%	0.068	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	119.5	-177.7	-70.2	173.1	-179.1	72.6	-7.1	110.1	P3 I4 L5 G283 H284 S301 S302 D306 H312	P3-R310 HydrophobicContact CB-CB 4.22Å; I4-R310 CarbonylContact O-C 3.59Å; I4-R310 WeakPolarHBondContact O-CA 3.45Å; L5-R310 HydrophobicContact CD1-CG 3.72Å; G283-R310 PolarHBondContact O-NE 3.45Å; G283-R310 PolarHBondContact O-NH2 2.7Å; H284-R310 PolarHBondContact CE1-NH1 3.19Å; H284-R310 PolarHBondContact ND1-NH1 3.3Å; S301-R310 VanDerWaalsContact CA-O 3.3Å; S301-R310 WeakPolarHBondContact CA-O 3.15Å; S302-R310 PolarHBondContact N-O 3.17Å; S302-R310 PolarHBondContact O-N 2.83Å; D306-R310 IonicContact OD1-NH1 3.23Å; D306-R310 PolarHBondContact OD1-NH1 3.18Å; D306-R310 IonicContact OD2-CZ 3.03Å; D306-R310 VanDerWaalsContact OD2-CZ 3.3Å; D306-R310 IonicContact OD2-NH1 3.65Å; D306-R310 PolarHBondContact OD2-NH1 2.62Å; D306-R310 IonicContact OD2-NH2 3.36Å; D306-R310 PolarHBondContact OD2-NH2 3.12Å; R310-H312 WeakPolarHBondContact CB-CE1 3.39Å; R310-H312 PolarHBondContact O-ND1 2.83Å; R310-H312 VanDerWaalsContact O-ND1 3.14Å
311	I	97.6	Very high	94	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	117	173.1	-40.6	-174.4	0	0	0	108.4	P3 I4 L6 L25 S39 S301 Y313	P3-I311 CarbonylContact C-O 3.56Å; P3-I311 WeakPolarHBondContact CA-O 3.09Å; P3-I311 VanDerWaalsContact CB-O 3.22Å; P3-I311 WeakPolarHBondContact CB-O 3.37Å; I4-I311 HydrophobicContact CB-CB 4.13Å; I4-I311 HydrophobicContact CB-CG1 4.34Å; I4-I311 PolarHBondContact N-O 3.05Å; I4-I311 PolarHBondContact O-N 3.26Å; L6-I311 HydrophobicContact CD1-CD1 4.17Å; L6-I311 HydrophobicContact CD1-CG1 4.17Å; L6-I311 HydrophobicContact CD2-CD1 4.19Å; L6-I311 HydrophobicContact CD2-CG1 4.41Å; L6-I311 HydrophobicContact CG-CG1 4.34Å; L25-I311 HydrophobicContact CD2-CD1 4.26Å; L25-I311 HydrophobicContact CD2-CG1 4.34Å; S39-I311 WeakPolarHBondContact O-CD1 3.35Å; S301-I311 WeakPolarHBondContact OG-CG1 3.21Å; I311-Y313 HydrophobicContact CG2-CE2 4Å
312	H	96.4	Very high	93.2	Very high	17 Å²	17	51 Å²	51	8%	0.079	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	107.4	-177.2	-61.5	88.7	0	0	0	110	S299 Y300 S302 R310	S299-H312 CarbonylContact C-O 3.57Å; S299-H312 WeakPolarHBondContact CA-O 3.28Å; S299-H312 WeakPolarHBondContact CB-O 3.14Å; Y300-H312 HydrophobicContact CD1-CB 3.74Å; Y300-H312 HydrophobicContact CE1-CB 3.3Å; Y300-H312 AromaticContact CE1-CG 3.73Å; Y300-H312 AromaticContact CE1-ND1 4Å; Y300-H312 AromaticContact CE2-ND1 3.92Å; Y300-H312 AromaticContact CZ-CG 3.71Å; Y300-H312 AromaticContact CZ-ND1 3.57Å; Y300-H312 PolarHBondContact N-O 3.28Å; Y300-H312 PolarHBondContact O-N 3.45Å; S302-H312 PolarHBondContact OG-CE1 3.49Å; R310-H312 WeakPolarHBondContact CB-CE1 3.39Å; R310-H312 PolarHBondContact O-ND1 2.83Å; R310-H312 VanDerWaalsContact O-ND1 3.14Å
313	Y	95.4	Very high	92.1	Very high	71 Å²	71	53.3 Å²	53.3	28%	0.278	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	134.2	169.4	-70.8	-88.9	0	0	0	110.5	I4 S39 I311	I4-Y313 HydrophobicContact CD1-CE2 3.81Å; I4-Y313 HydrophobicContact CG1-CE2 4.29Å; S39-Y313 PolarHBondContact O-OH 3.46Å; I311-Y313 HydrophobicContact CG2-CE2 4Å
314	F	94.9	Very high	91	Very high	20 Å²	20	62.2 Å²	62.2	9%	0.088	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-71.3	138.8	175.9	-60.3	-56.7	0	0	0	110.7	F269 F293 K298 Y300 Y318 F319	F269-F314 AromaticContact CE1-CE1 3.76Å; F269-F314 HydrophobicContact CE1-CE1 3.76Å; F269-F314 AromaticContact CE1-CZ 3.95Å; F269-F314 HydrophobicContact CE1-CZ 3.95Å; F269-F314 AromaticContact CZ-CE1 3.78Å; F269-F314 HydrophobicContact CZ-CE1 3.78Å; F269-F314 HydrophobicContact CZ-CZ 4.24Å; F293-F314 HydrophobicContact CD1-CE2 4.06Å; F293-F314 HydrophobicContact CD1-CZ 4.12Å; F293-F314 AromaticContact CE1-CE2 3.69Å; F293-F314 HydrophobicContact CE1-CE2 3.69Å; F293-F314 AromaticContact CE1-CZ 3.49Å; F293-F314 HydrophobicContact CE1-CZ 3.49Å; F293-F314 VanDerWaalsContact CE1-CZ 3.49Å; F293-F314 HydrophobicContact CZ-CZ 4.33Å; K298-F314 VanDerWaalsContact O-CD2 3.28Å; K298-F314 WeakPolarHBondContact O-CD2 3.41Å; K298-F314 PolarHBondContact O-N 2.83Å; Y300-F314 AromaticContact CD1-CE1 3.56Å; Y300-F314 HydrophobicContact CD1-CE1 3.56Å; Y300-F314 AromaticContact CD1-CZ 3.58Å; Y300-F314 HydrophobicContact CD1-CZ 3.58Å; Y300-F314 HydrophobicContact CE1-CE1 4.02Å; Y300-F314 HydrophobicContact CE1-CZ 4.47Å; Y300-F314 HydrophobicContact CG-CZ 4.27Å; F314-Y318 HydrophobicContact CB-CD1 3.66Å; F314-Y318 HydrophobicContact CB-CE1 4.42Å; F314-Y318 HydrophobicContact CB-CG 3.82Å; F314-Y318 HydrophobicContact CD1-CD1 4.04Å; F314-Y318 AromaticContact CD1-CD2 3.99Å; F314-Y318 HydrophobicContact CD1-CD2 3.99Å; F314-Y318 HydrophobicContact CD1-CE1 4.2Å; F314-Y318 HydrophobicContact CD1-CE2 4.15Å; F314-Y318 AromaticContact CD1-CG 3.93Å; F314-Y318 HydrophobicContact CD1-CG 3.93Å; F314-Y318 AromaticContact CD2-CD1 3.69Å; F314-Y318 HydrophobicContact CD2-CD1 3.69Å; F314-Y318 AromaticContact CD2-CE1 3.57Å; F314-Y318 HydrophobicContact CD2-CE1 3.57Å; F314-Y318 HydrophobicContact CD2-CG 4.41Å; F314-Y318 HydrophobicContact CE1-CD2 4.4Å; F314-Y318 HydrophobicContact CE1-CE1 4.4Å; F314-Y318 HydrophobicContact CE1-CE2 4.11Å; F314-Y318 HydrophobicContact CE2-CD1 4.39Å; F314-Y318 AromaticContact CE2-CE1 3.82Å; F314-Y318 HydrophobicContact CE2-CE1 3.82Å; F314-Y318 AromaticContact CG-CD1 3.52Å; F314-Y318 HydrophobicContact CG-CD1 3.52Å; F314-Y318 HydrophobicContact CG-CD2 4.32Å; F314-Y318 AromaticContact CG-CE1 3.81Å; F314-Y318 HydrophobicContact CG-CE1 3.81Å; F314-Y318 AromaticContact CG-CG 3.81Å; F314-Y318 HydrophobicContact CG-CG 3.81Å; F314-Y318 HydrophobicContact CZ-CE1 4.24Å; F314-Y318 HydrophobicContact CZ-CE2 4.47Å; F314-F319 HydrophobicContact CB-CE1 4.39Å; F314-F319 HydrophobicContact CB-CE2 4.01Å; F314-F319 HydrophobicContact CB-CZ 3.72Å; F314-F319 HydrophobicContact CD2-CE1 4.41Å; F314-F319 HydrophobicContact CD2-CZ 4.31Å
315	D	91.5	Very high	89.3	Confident	73 Å²	73	68.6 Å²	68.6	39%	0.39	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-77.3	155.4	172.7	-66.1	-53.5	0	0	0	109.7	M1 Q317 Y318	M1-D315 WeakPolarHBondContact CE-OD1 3.33Å; M1-D315 WeakPolarHBondContact CG-OD1 3.28Å; M1-D315 PolarHBondContact N-OD1 3.16Å; M1-D315 PolarHBondContact N-OD2 3.22Å; D315-Q317 PolarHBondContact O-N 2.76Å; D315-Y318 WeakPolarHBondContact O-CB 3.42Å; D315-Y318 PolarHBondContact O-N 3.21Å
316	P	91	Very high	89	Confident	80 Å²	80	70 Å²	70	52%	0.519	35%	0.353	S	S	.	.	H	α-helix	trans	-48.4	-37.6	-174.1	-32.5	37.3	0	0	0	115.5	Y318 F319 E320	P316-Y318 PolarHBondContact O-N 3.2Å; P316-Y318 VanDerWaalsContact O-N 3.09Å; P316-F319 PolarHBondContact O-N 2.81Å; P316-E320 PolarHBondContact O-N 2.84Å
317	Q	89.9	Confident	88.8	Confident	156 Å²	156	71.9 Å²	71.9	73%	0.729	36%	0.363	S	S	*	.	H	α-helix	trans	-56.5	-24.4	177.7	-66.5	174.7	-9.5	0	0	114.3	D315 F321	D315-Q317 PolarHBondContact O-N 2.76Å; Q317-F321 PolarHBondContact O-N 3.4Å
318	Y	91.6	Very high	88.4	Confident	26 Å²	26	75.7 Å²	75.7	10%	0.102	38%	0.381	C	S	.	.	H	α-helix	trans	-72	-32.7	175.2	178.1	-94	0	0	0	112.4	Y241 H243 F269 F278 F314 D315 P316 F321	Y241-Y318 HydrophobicContact CD2-CE1 4.3Å; Y241-Y318 HydrophobicContact CE2-CE1 4.5Å; H243-Y318 AromaticContact ND1-CE2 3.83Å; H243-Y318 AromaticContact ND1-CZ 3.42Å; H243-Y318 PolarHBondContact ND1-OH 2.67Å; F269-Y318 HydrophobicContact CD1-CE2 4.35Å; F278-Y318 HydrophobicContact CE2-CD2 4.27Å; F278-Y318 AromaticContact CE2-CE2 3.94Å; F278-Y318 HydrophobicContact CE2-CE2 3.94Å; F278-Y318 HydrophobicContact CZ-CE2 4.08Å; F314-Y318 HydrophobicContact CB-CD1 3.66Å; F314-Y318 HydrophobicContact CB-CE1 4.42Å; F314-Y318 HydrophobicContact CB-CG 3.82Å; F314-Y318 HydrophobicContact CD1-CD1 4.04Å; F314-Y318 AromaticContact CD1-CD2 3.99Å; F314-Y318 HydrophobicContact CD1-CD2 3.99Å; F314-Y318 HydrophobicContact CD1-CE1 4.2Å; F314-Y318 HydrophobicContact CD1-CE2 4.15Å; F314-Y318 AromaticContact CD1-CG 3.93Å; F314-Y318 HydrophobicContact CD1-CG 3.93Å; F314-Y318 AromaticContact CD2-CD1 3.69Å; F314-Y318 HydrophobicContact CD2-CD1 3.69Å; F314-Y318 AromaticContact CD2-CE1 3.57Å; F314-Y318 HydrophobicContact CD2-CE1 3.57Å; F314-Y318 HydrophobicContact CD2-CG 4.41Å; F314-Y318 HydrophobicContact CE1-CD2 4.4Å; F314-Y318 HydrophobicContact CE1-CE1 4.4Å; F314-Y318 HydrophobicContact CE1-CE2 4.11Å; F314-Y318 HydrophobicContact CE2-CD1 4.39Å; F314-Y318 AromaticContact CE2-CE1 3.82Å; F314-Y318 HydrophobicContact CE2-CE1 3.82Å; F314-Y318 AromaticContact CG-CD1 3.52Å; F314-Y318 HydrophobicContact CG-CD1 3.52Å; F314-Y318 HydrophobicContact CG-CD2 4.32Å; F314-Y318 AromaticContact CG-CE1 3.81Å; F314-Y318 HydrophobicContact CG-CE1 3.81Å; F314-Y318 AromaticContact CG-CG 3.81Å; F314-Y318 HydrophobicContact CG-CG 3.81Å; F314-Y318 HydrophobicContact CZ-CE1 4.24Å; F314-Y318 HydrophobicContact CZ-CE2 4.47Å; D315-Y318 WeakPolarHBondContact O-CB 3.42Å; D315-Y318 PolarHBondContact O-N 3.21Å; P316-Y318 PolarHBondContact O-N 3.2Å; P316-Y318 VanDerWaalsContact O-N 3.09Å; Y318-F321 WeakPolarHBondContact O-CB 3.25Å
319	F	89.9	Confident	88	Confident	72 Å²	72	76.1 Å²	76.1	32%	0.316	39%	0.387	S	S	.	.	H	α-helix	trans	-84.5	-21.2	178.1	-52.1	-68.7	0	0	0	112.3	Y241 K298 F314 P316 F321	Y241-F319 AromaticContact CE2-CD1 3.85Å; Y241-F319 HydrophobicContact CE2-CD1 3.85Å; Y241-F319 HydrophobicContact CE2-CE1 4.45Å; K298-F319 HydrophobicContact CB-CZ 4.09Å; K298-F319 HydrophobicContact CG-CE1 4.45Å; K298-F319 HydrophobicContact CG-CZ 4.26Å; F314-F319 HydrophobicContact CB-CE1 4.39Å; F314-F319 HydrophobicContact CB-CE2 4.01Å; F314-F319 HydrophobicContact CB-CZ 3.72Å; F314-F319 HydrophobicContact CD2-CE1 4.41Å; F314-F319 HydrophobicContact CD2-CZ 4.31Å; P316-F319 PolarHBondContact O-N 2.81Å; F319-F321 VanDerWaalsContact C-N 3.34Å
320	E	88.1	Confident	87.3	Confident	148 Å²	148	80.6 Å²	80.6	69%	0.692	41%	0.41	S	S	*	.	S	Bend	trans	-89.2	2.5	172.1	-63.4	170.1	177	0	0	112.5	P316 E322	P316-E320 PolarHBondContact O-N 2.84Å; E320-E322 PolarHBondContact O-N 2.91Å
321	F	84.3	Confident	86.6	Confident	66 Å²	66	84.8 Å²	84.8	29%	0.289	43%	0.433	S	S	.	.			trans	-76.5	106.6	-177.6	-179.2	-105.5	0	0	0	111.3	H243 F278 Q317 Y318 F319 F323	H243-F321 AromaticContact NE2-CD1 3.82Å; F278-F321 HydrophobicContact CB-CE1 4.08Å; F278-F321 HydrophobicContact CB-CE2 4.29Å; F278-F321 HydrophobicContact CB-CZ 3.56Å; F278-F321 HydrophobicContact CD1-CE1 4.13Å; F278-F321 HydrophobicContact CD1-CZ 4.47Å; F278-F321 HydrophobicContact CD2-CD1 4.19Å; F278-F321 AromaticContact CD2-CE1 3.77Å; F278-F321 HydrophobicContact CD2-CE1 3.77Å; F278-F321 HydrophobicContact CD2-CE2 4.39Å; F278-F321 AromaticContact CD2-CZ 3.89Å; F278-F321 HydrophobicContact CD2-CZ 3.89Å; F278-F321 HydrophobicContact CE1-CE1 4.49Å; F278-F321 HydrophobicContact CE2-CD1 4.25Å; F278-F321 HydrophobicContact CE2-CE1 4.18Å; F278-F321 AromaticContact CG-CE1 3.75Å; F278-F321 HydrophobicContact CG-CE1 3.75Å; F278-F321 AromaticContact CG-CZ 3.75Å; F278-F321 HydrophobicContact CG-CZ 3.75Å; Q317-F321 PolarHBondContact O-N 3.4Å; Y318-F321 WeakPolarHBondContact O-CB 3.25Å; F319-F321 VanDerWaalsContact C-N 3.34Å; F321-F323 HydrophobicContact CE1-CB 4.15Å; F321-F323 AromaticContact CE1-CD2 3.96Å; F321-F323 HydrophobicContact CE1-CD2 3.96Å; F321-F323 HydrophobicContact CZ-CB 4.35Å; F321-F323 AromaticContact CZ-CD2 3.75Å; F321-F323 HydrophobicContact CZ-CD2 3.75Å; F321-F323 HydrophobicContact CZ-CG 4.48Å
322	E	80	Confident	85.8	Confident	172 Å²	172	90.9 Å²	90.9	80%	0.804	46%	0.464	S	S	*	.			trans	-99.8	132.2	164.2	-65.4	-174.4	169.2	0	0	109.3	E320 E324	E320-E322 PolarHBondContact O-N 2.91Å; E322-E324 PolarHBondContact O-N 3.32Å
323	F	76.9	Confident	85	Confident	49 Å²	49	96.5 Å²	96.5	22%	0.215	49%	0.493	C	S	.	.			trans	-87.5	103.4	178.3	-166	-75.3	0	0	0	109.8	H271 F274 E276 F321 A325	H271-F323 HydrophobicContact CB-CD2 4.04Å; H271-F323 HydrophobicContact CB-CE2 4.26Å; H271-F323 AromaticContact CD2-CD2 3.82Å; H271-F323 AromaticContact CD2-CG 3.8Å; F274-F323 HydrophobicContact CB-CE1 4.14Å; F274-F323 HydrophobicContact CB-CZ 4.27Å; F274-F323 HydrophobicContact CD2-CB 4.4Å; F274-F323 AromaticContact CD2-CD1 3.29Å; F274-F323 HydrophobicContact CD2-CD1 3.29Å; F274-F323 HydrophobicContact CD2-CD2 4.41Å; F274-F323 AromaticContact CD2-CE1 3.56Å; F274-F323 HydrophobicContact CD2-CE1 3.56Å; F274-F323 AromaticContact CD2-CG 3.78Å; F274-F323 HydrophobicContact CD2-CG 3.78Å; F274-F323 HydrophobicContact CD2-CZ 4.25Å; F274-F323 HydrophobicContact CE2-CB 4.19Å; F274-F323 AromaticContact CE2-CD1 3.44Å; F274-F323 HydrophobicContact CE2-CD1 3.44Å; F274-F323 VanDerWaalsContact CE2-CD1 3.44Å; F274-F323 HydrophobicContact CE2-CE1 4.1Å; F274-F323 AromaticContact CE2-CG 3.98Å; F274-F323 HydrophobicContact CE2-CG 3.98Å; F274-F323 HydrophobicContact CG-CD1 4.04Å; F274-F323 AromaticContact CG-CE1 3.84Å; F274-F323 HydrophobicContact CG-CE1 3.84Å; F274-F323 HydrophobicContact CG-CZ 4.45Å; F274-F323 HydrophobicContact CZ-CD1 4.28Å; E276-F323 HydrophobicContact CB-CE2 4.02Å; E276-F323 HydrophobicContact CB-CZ 3.76Å; E276-F323 HydrophobicContact CG-CZ 4.13Å; F321-F323 HydrophobicContact CE1-CB 4.15Å; F321-F323 AromaticContact CE1-CD2 3.96Å; F321-F323 HydrophobicContact CE1-CD2 3.96Å; F321-F323 HydrophobicContact CZ-CB 4.35Å; F321-F323 AromaticContact CZ-CD2 3.75Å; F321-F323 HydrophobicContact CZ-CD2 3.75Å; F321-F323 HydrophobicContact CZ-CG 4.48Å; F323-A325 HydrophobicContact CD1-CB 4.4Å; F323-A325 HydrophobicContact CE1-CB 4.39Å
324	E	73.9	Confident	84.2	Confident	187 Å²	187	98.7 Å²	98.7	87%	0.874	51%	0.511	S	S	*	.			trans	-76.1	122.9	168.1	-65.3	-173.6	161.6	0	0	109.6	E322	E322-E324 PolarHBondContact O-N 3.32Å
325	A	58.1	Low	83.2	Confident	135 Å²	135	105.8 Å²	105.8	100%	1.116	55%	0.55	S	S	*	.			trans	-102.8	0	-178.8	0	0	0	0	0	113	F274 F323	F274-A325 HydrophobicContact CD1-CB 4.35Å; F274-A325 HydrophobicContact CE1-CB 3.76Å; F274-A325 HydrophobicContact CZ-CB 3.9Å; F323-A325 HydrophobicContact CD1-CB 4.4Å; F323-A325 HydrophobicContact CE1-CB 4.39Å

Retrieved 325 of 325 residues in 1015 ms (Link to these results)

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