A0A096NPZ8_PAPAN Loading...

Poly(A) binding protein cytoplasmic 1 like 2A

AlphaFold DB (Q5JQF8), UniProt , Accession A0A096NPZ8, Species PAPAN (Papio anubis, Olive baboon), Gene PABPC1L2A, Length 200 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	73.5	Confident	94.9	Very high	138 Å²	138	34.5 Å²	34.5	68%	0.68	19%	0.187	S	C	*	.				0	131.6	0	-160.7	172	-143.1	0	0	107.3	W77 S78	M1-W77 HydrophobicContact CB-CE3 4.46Å; M1-W77 WeakPolarHBondContact O-CZ3 3.25Å; M1-S78 WeakPolarHBondContact CE-O 3.35Å; M1-S78 VanDerWaalsContact SD-O 3.41Å
2	A	91.8	Very high	95.1	Very high	20 Å²	20	41.7 Å²	41.7	17%	0.165	22%	0.218	C	C	.	.			trans	-114.3	19	-178.2	0	0	0	0	0	112.8	N49 Y50 P53	A2-N49 WeakPolarHBondContact O-CA 3.01Å; A2-Y50 WeakPolarHBondContact CB-O 3.43Å; A2-Y50 PolarHBondContact O-N 2.96Å; A2-P53 HydrophobicContact CB-CG 4.23Å
3	S	97.5	Very high	95.3	Very high	32 Å²	32	38.5 Å²	38.5	22%	0.224	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.3	-174.9	-58	0	0	0	0	110.6	N49 S78	S3-N49 WeakPolarHBondContact CB-OD1 3.42Å; S3-N49 PolarHBondContact OG-OD1 3.39Å; S3-S78 VanDerWaalsContact O-CB 3.22Å; S3-S78 WeakPolarHBondContact O-CB 3.41Å; S3-S78 PolarHBondContact O-N 3.47Å
4	L	98.4	Very high	95.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	138.7	177.2	-58.3	179	0	0	0	110.4	V6 F22 Y47 V48 Y50 A56 A59 L60 I75 M76 W77	L4-V6 HydrophobicContact CB-CG2 4.5Å; L4-F22 HydrophobicContact CD1-CE1 4.47Å; L4-Y47 VanDerWaalsContact O-CA 3.3Å; L4-Y47 WeakPolarHBondContact O-CA 3.15Å; L4-V48 PolarHBondContact N-O 3.13Å; L4-V48 PolarHBondContact O-N 2.99Å; L4-Y50 HydrophobicContact CD1-CD2 4.39Å; L4-Y50 HydrophobicContact CD1-CE2 3.93Å; L4-A56 HydrophobicContact CD1-CB 4.37Å; L4-A56 WeakPolarHBondContact CD1-O 3.27Å; L4-A56 HydrophobicContact CD2-CB 4.19Å; L4-A56 HydrophobicContact CG-CB 4.13Å; L4-A59 HydrophobicContact CD1-CB 3.88Å; L4-L60 HydrophobicContact CD2-CB 4.2Å; L4-L60 HydrophobicContact CD2-CD1 4.09Å; L4-I75 HydrophobicContact CB-CG2 4.21Å; L4-I75 HydrophobicContact CD1-CG2 3.96Å; L4-I75 HydrophobicContact CD2-CG2 4.32Å; L4-I75 HydrophobicContact CG-CG2 4.4Å; L4-M76 CarbonylContact C-O 3.59Å; L4-M76 WeakPolarHBondContact CA-O 3.41Å; L4-W77 HydrophobicContact CD2-CD2 4.23Å; L4-W77 HydrophobicContact CD2-CE3 3.64Å; L4-W77 HydrophobicContact CD2-CH2 4.38Å; L4-W77 HydrophobicContact CD2-CZ3 3.72Å
5	Y	98.2	Very high	95.7	Very high	44 Å²	44	41.3 Å²	41.3	17%	0.173	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	130.4	159.4	170.8	-82.5	0	0	0	108.1	G7 Y45 Y47 I75 M76	Y5-G7 VanDerWaalsContact CE1-CA 3.41Å; Y5-Y45 AromaticContact CD2-CD2 3.82Å; Y5-Y45 HydrophobicContact CD2-CD2 3.82Å; Y5-Y45 HydrophobicContact CD2-CG 4.43Å; Y5-Y45 HydrophobicContact CE2-CD1 4.47Å; Y5-Y45 AromaticContact CE2-CD2 3.34Å; Y5-Y45 HydrophobicContact CE2-CD2 3.34Å; Y5-Y45 HydrophobicContact CE2-CE2 4.1Å; Y5-Y45 AromaticContact CE2-CG 3.56Å; Y5-Y45 HydrophobicContact CE2-CG 3.56Å; Y5-Y45 WeakPolarHBondContact OH-CB 3.4Å; Y5-Y47 HydrophobicContact CD2-CE1 4.23Å; Y5-I75 WeakPolarHBondContact O-CA 3.37Å; Y5-M76 HydrophobicContact CD1-CB 4.48Å; Y5-M76 HydrophobicContact CD1-CE 3.14Å; Y5-M76 HydrophobicContact CE1-CE 3.26Å; Y5-M76 HydrophobicContact CG-CE 3.92Å; Y5-M76 PolarHBondContact N-O 3.3Å; Y5-M76 PolarHBondContact O-N 2.79Å
6	V	98.5	Very high	95.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	102.1	175.9	-171.3	0	0	0	0	107.9	L4 L9 F22 Y45 A46 V48 V73 I75	L4-V6 HydrophobicContact CB-CG2 4.5Å; V6-L9 HydrophobicContact CG1-CD2 3.87Å; V6-F22 HydrophobicContact CB-CZ 4.37Å; V6-F22 HydrophobicContact CG1-CE2 4.19Å; V6-F22 HydrophobicContact CG1-CZ 3.8Å; V6-F22 HydrophobicContact CG2-CE1 3.94Å; V6-F22 HydrophobicContact CG2-CE2 4.37Å; V6-F22 HydrophobicContact CG2-CZ 3.61Å; V6-Y45 CarbonylContact O-C 3.55Å; V6-Y45 WeakPolarHBondContact O-CA 3.3Å; V6-Y45 WeakPolarHBondContact O-CB 3.47Å; V6-A46 PolarHBondContact N-O 3.01Å; V6-A46 PolarHBondContact O-N 3.37Å; V6-V48 HydrophobicContact CG2-CB 4.39Å; V6-V48 HydrophobicContact CG2-CG2 3.76Å; V6-V73 HydrophobicContact CG1-CB 4.01Å; V6-V73 HydrophobicContact CG1-CG1 4.39Å; V6-V73 HydrophobicContact CG1-CG2 4.4Å; V6-I75 HydrophobicContact CG1-CG1 4.36Å
7	G	97.9	Very high	96	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-176.1	-177	0	0	0	0	0	113.8	Y5 L9 G44 R74	Y5-G7 VanDerWaalsContact CE1-CA 3.41Å; G7-L9 PolarHBondContact O-N 2.89Å; G7-G44 CarbonylContact C-O 3.47Å; G7-R74 PolarHBondContact N-O 2.9Å; G7-R74 PolarHBondContact O-N 2.76Å
8	D	96.8	Very high	96.2	Very high	37 Å²	37	41.2 Å²	41.2	20%	0.198	23%	0.225	C	C	.	.	S	Bend	trans	59.1	26.9	-177.7	-58.1	-21.8	0	0	0	113.2	G44 R74 K120	D8-G44 PolarHBondContact N-O 3.14Å; D8-G44 VanDerWaalsContact N-O 3.1Å; D8-R74 HydrophobicContact CB-CB 4.38Å; D8-R74 IonicContact OD1-CZ 2.85Å; D8-R74 IonicContact OD1-NE 3.68Å; D8-R74 IonicContact OD1-NH2 2.61Å; D8-R74 PolarHBondContact OD1-NH2 2.96Å; D8-R74 IonicContact OD2-CZ 3.35Å; D8-R74 IonicContact OD2-NE 3.62Å; D8-R74 PolarHBondContact OD2-NE 3.08Å; D8-R74 IonicContact OD2-NH2 2.71Å; D8-R74 PolarHBondContact OD2-NH2 2.8Å; D8-K120 IonicContact OD1-NZ 3.44Å; D8-K120 PolarHBondContact OD1-NZ 3.3Å; D8-K120 WeakPolarHBondContact OD2-CD 3.49Å; D8-K120 WeakPolarHBondContact OD2-CE 3.47Å; D8-K120 IonicContact OD2-NZ 3Å; D8-K120 PolarHBondContact OD2-NZ 2.75Å
9	L	97.9	Very high	96.3	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.016	24%	0.241	C	C	.	.			trans	-65.8	144.7	179.9	-60.5	-179.1	0	0	0	111.5	V6 G7 V13 L18 G44 A46 V73	V6-L9 HydrophobicContact CG1-CD2 3.87Å; G7-L9 PolarHBondContact O-N 2.89Å; L9-V13 HydrophobicContact CB-CB 4.4Å; L9-V13 HydrophobicContact CB-CG2 4.36Å; L9-V13 HydrophobicContact CD1-CG1 4.46Å; L9-V13 HydrophobicContact CD2-CG1 4.42Å; L9-L18 HydrophobicContact CD1-CD1 4.31Å; L9-L18 HydrophobicContact CD2-CD2 4.16Å; L9-G44 PolarHBondContact N-O 3.06Å; L9-A46 HydrophobicContact CD1-CB 3.76Å; L9-V73 HydrophobicContact CD2-CB 4.48Å; L9-V73 HydrophobicContact CD2-CG1 3.73Å
10	H	97.3	Very high	96.4	Very high	46 Å²	46	50.6 Å²	50.6	21%	0.213	26%	0.261	C	S	.	.			trans	-63.5	141.7	165.1	-174.2	-85.8	0	0	0	110	E12 V13 K69 R71	H10-E12 IonicContact CE1-OE2 3.59Å; H10-E12 PolarHBondContact ND1-N 3.16Å; H10-E12 PolarHBondContact O-N 3.26Å; H10-V13 HydrophobicContact CB-CG2 3.9Å; H10-V13 WeakPolarHBondContact O-CB 3.34Å; H10-V13 WeakPolarHBondContact O-CG2 3.35Å; H10-V13 PolarHBondContact O-N 2.96Å; H10-K69 HydrophobicContact CB-CB 3.8Å; H10-K69 PolarHBondContact CD2-O 3.08Å; H10-R71 HydrophobicContact CB-CB 4.49Å; H10-R71 HydrophobicContact CB-CG 4.26Å
11	P	96.3	Very high	96.5	Very high	60 Å²	60	51.4 Å²	51.4	39%	0.39	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-27.4	-175.5	-29	36.1	0	0	0	115.2	S42	P11-S42 WeakPolarHBondContact O-CB 3.39Å
12	E	96.8	Very high	97.7	Very high	120 Å²	120	44.9 Å²	44.9	56%	0.561	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.7	5.2	179.6	-58.5	-177.1	167.1	0	0	114.7	H10 T14 K69	H10-E12 IonicContact CE1-OE2 3.59Å; H10-E12 PolarHBondContact ND1-N 3.16Å; H10-E12 PolarHBondContact O-N 3.26Å; E12-T14 PolarHBondContact O-N 3.22Å; E12-K69 HydrophobicContact CB-CD 4.05Å; E12-K69 VanDerWaalsContact OE2-CE 3.29Å; E12-K69 WeakPolarHBondContact OE2-CE 3.33Å; E12-K69 IonicContact OE2-NZ 2.92Å; E12-K69 PolarHBondContact OE2-NZ 3.03Å
13	V	98.3	Very high	98	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.006	24%	0.236	C	C	.	.			trans	-62.3	135.1	171.7	174.1	0	0	0	0	108.8	L9 H10 L18 I33 I68 K69	L9-V13 HydrophobicContact CB-CB 4.4Å; L9-V13 HydrophobicContact CB-CG2 4.36Å; L9-V13 HydrophobicContact CD1-CG1 4.46Å; L9-V13 HydrophobicContact CD2-CG1 4.42Å; H10-V13 HydrophobicContact CB-CG2 3.9Å; H10-V13 WeakPolarHBondContact O-CB 3.34Å; H10-V13 WeakPolarHBondContact O-CG2 3.35Å; H10-V13 PolarHBondContact O-N 2.96Å; V13-L18 HydrophobicContact CG1-CD1 4.27Å; V13-L18 HydrophobicContact CG1-CD2 3.87Å; V13-L18 HydrophobicContact CG1-CG 3.75Å; V13-I33 HydrophobicContact CG1-CD1 4.28Å; V13-I33 WeakPolarHBondContact O-CD1 3.31Å; V13-I68 HydrophobicContact CG1-CG2 4.31Å; V13-I68 HydrophobicContact CG2-CB 4.43Å; V13-I68 HydrophobicContact CG2-CG2 3.8Å; V13-K69 HydrophobicContact CG2-CB 4.45Å; V13-K69 HydrophobicContact CG2-CG 4.42Å
14	T	98	Very high	98	Very high	53 Å²	53	49.4 Å²	49.4	33%	0.325	26%	0.258	S	S	.	.			trans	-110.3	161.1	177.2	67.6	0	0	0	0	111.2	E12 A16 M17 L18 I33	E12-T14 PolarHBondContact O-N 3.22Å; T14-A16 PolarHBondContact O-N 3.35Å; T14-M17 PolarHBondContact O-N 2.88Å; T14-M17 WeakPolarHBondContact OG1-CG 3.32Å; T14-M17 PolarHBondContact OG1-N 3.38Å; T14-L18 PolarHBondContact O-N 3.19Å; T14-L18 VanDerWaalsContact O-N 3.11Å; T14-I33 VanDerWaalsContact C-CD1 3.43Å
15	E	98.2	Very high	98	Very high	66 Å²	66	49.6 Å²	49.6	31%	0.308	26%	0.26	S	S	.	.	H	α-helix	trans	-57.1	-34.5	174.1	-71.5	80.3	171.4	0	0	111.9	L18 Y19 I31 I33 R35	E15-L18 PolarHBondContact O-N 2.81Å; E15-Y19 PolarHBondContact O-N 3.43Å; E15-I31 HydrophobicContact CB-CG2 4.38Å; E15-I31 HydrophobicContact CG-CG2 4.27Å; E15-I33 HydrophobicContact CG-CD1 4.32Å; E15-I33 HydrophobicContact CG-CG1 4Å; E15-I33 WeakPolarHBondContact OE1-CB 3.33Å; E15-I33 PolarHBondContact OE1-N 3.22Å; E15-R35 IonicContact OE1-NE 3.05Å; E15-R35 IonicContact OE1-NH2 3.46Å; E15-R35 IonicContact OE2-CZ 3.58Å; E15-R35 IonicContact OE2-NH2 3.9Å; E15-R35 PolarHBondContact OE2-NH2 2.95Å
16	A	98.3	Very high	98	Very high	59 Å²	59	48 Å²	48	49%	0.488	26%	0.257	S	S	.	.	H	α-helix	trans	-64.9	-46.2	175.8	0	0	0	0	0	112.3	T14 L18 Y19 E20	T14-A16 PolarHBondContact O-N 3.35Å; A16-L18 VanDerWaalsContact C-N 3.27Å; A16-L18 PolarHBondContact O-N 2.96Å; A16-Y19 WeakPolarHBondContact O-CB 3.46Å; A16-Y19 PolarHBondContact O-N 2.81Å; A16-Y19 VanDerWaalsContact O-N 3.08Å; A16-E20 PolarHBondContact O-N 3.25Å
17	M	98.6	Very high	97.9	Very high	63 Å²	63	51.3 Å²	51.3	31%	0.31	28%	0.279	S	S	.	.	H	α-helix	trans	-61.2	-38.2	175.8	-66.9	169.8	-176.8	0	0	111.8	T14 K21 K69	T14-M17 PolarHBondContact O-N 2.88Å; T14-M17 WeakPolarHBondContact OG1-CG 3.32Å; T14-M17 PolarHBondContact OG1-N 3.38Å; M17-K21 WeakPolarHBondContact O-CB 3.44Å; M17-K21 PolarHBondContact O-N 3.13Å; M17-K21 VanDerWaalsContact O-N 3.08Å; M17-K69 HydrophobicContact CE-CD 4.11Å; M17-K69 HydrophobicContact SD-CD 3.79Å; M17-K69 HydrophobicContact SD-CG 4.13Å
18	L	98.7	Very high	98	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-66.8	-41	173.9	-67.9	176.1	0	0	0	111.2	L9 V13 T14 E15 A16 K21 F22 I31 I33 A46 I68	L9-L18 HydrophobicContact CD1-CD1 4.31Å; L9-L18 HydrophobicContact CD2-CD2 4.16Å; V13-L18 HydrophobicContact CG1-CD1 4.27Å; V13-L18 HydrophobicContact CG1-CD2 3.87Å; V13-L18 HydrophobicContact CG1-CG 3.75Å; T14-L18 PolarHBondContact O-N 3.19Å; T14-L18 VanDerWaalsContact O-N 3.11Å; E15-L18 PolarHBondContact O-N 2.81Å; A16-L18 VanDerWaalsContact C-N 3.27Å; A16-L18 PolarHBondContact O-N 2.96Å; L18-K21 PolarHBondContact O-N 2.9Å; L18-F22 HydrophobicContact CD2-CD2 4.37Å; L18-F22 HydrophobicContact CD2-CE2 3.99Å; L18-F22 VanDerWaalsContact O-CB 3.29Å; L18-F22 WeakPolarHBondContact O-CB 3.28Å; L18-F22 VanDerWaalsContact O-CD2 3.25Å; L18-F22 WeakPolarHBondContact O-CD2 3.35Å; L18-F22 PolarHBondContact O-N 2.86Å; L18-I31 HydrophobicContact CB-CD1 3.98Å; L18-I31 HydrophobicContact CB-CG2 3.97Å; L18-I31 HydrophobicContact CD1-CG2 3.79Å; L18-I33 HydrophobicContact CD1-CD1 3.91Å; L18-I33 HydrophobicContact CD1-CG1 3.71Å; L18-A46 HydrophobicContact CD1-CB 3.55Å; L18-I68 HydrophobicContact CD2-CD1 3.89Å
19	Y	98.6	Very high	98	Very high	131 Å²	131	56.6 Å²	56.6	51%	0.514	31%	0.306	S	S	.	.	H	α-helix	trans	-60.9	-49.3	177.1	-176.2	-91.1	0	0	0	111.9	E15 A16 K21 F22 S23 I28 I31	E15-Y19 PolarHBondContact O-N 3.43Å; A16-Y19 WeakPolarHBondContact O-CB 3.46Å; A16-Y19 PolarHBondContact O-N 2.81Å; A16-Y19 VanDerWaalsContact O-N 3.08Å; Y19-K21 VanDerWaalsContact C-N 3.29Å; Y19-K21 PolarHBondContact O-N 3.08Å; Y19-F22 PolarHBondContact O-N 3.23Å; Y19-S23 WeakPolarHBondContact O-CB 3.44Å; Y19-S23 PolarHBondContact O-N 3.32Å; Y19-S23 PolarHBondContact O-OG 2.92Å; Y19-I28 HydrophobicContact CD2-CB 4.48Å; Y19-I28 HydrophobicContact CD2-CD1 4.07Å; Y19-I28 HydrophobicContact CE2-CB 4.32Å; Y19-I28 HydrophobicContact CE2-CD1 4.45Å; Y19-I31 VanDerWaalsContact CA-CD1 3.44Å; Y19-I31 HydrophobicContact CD2-CD1 4.27Å
20	E	98.3	Very high	98	Very high	139 Å²	139	59 Å²	59	65%	0.65	32%	0.323	S	S	*	.	H	α-helix	trans	-56	-44.5	175.6	-71.7	174.5	-177.4	0	0	111.6	A16 P24	A16-E20 PolarHBondContact O-N 3.25Å; E20-P24 WeakPolarHBondContact O-CD 3.48Å
21	K	98.4	Very high	98.1	Very high	68 Å²	68	58.3 Å²	58.3	30%	0.296	32%	0.321	S	S	.	.	H	α-helix	trans	-69.9	-38.7	-178.3	-174	60.3	175.6	175.2	0	113.7	M17 L18 Y19 L63 D66 I68	M17-K21 WeakPolarHBondContact O-CB 3.44Å; M17-K21 PolarHBondContact O-N 3.13Å; M17-K21 VanDerWaalsContact O-N 3.08Å; L18-K21 PolarHBondContact O-N 2.9Å; Y19-K21 VanDerWaalsContact C-N 3.29Å; Y19-K21 PolarHBondContact O-N 3.08Å; K21-L63 WeakPolarHBondContact O-CD1 3.4Å; K21-D66 VanDerWaalsContact CE-CB 3.47Å; K21-D66 WeakPolarHBondContact CE-OD2 3.14Å; K21-D66 IonicContact NZ-OD2 2.83Å; K21-D66 PolarHBondContact NZ-OD2 3.08Å; K21-I68 HydrophobicContact CB-CD1 4.14Å; K21-I68 HydrophobicContact CG-CD1 3.84Å; K21-I68 HydrophobicContact CG-CG1 4.27Å
22	F	98.6	Very high	98.2	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-96.7	-22.7	-170.4	-80.2	-99.2	0	0	0	113.6	L4 V6 L18 Y19 A25 I28 V48 Y50 A59 L63 I68 I75	L4-F22 HydrophobicContact CD1-CE1 4.47Å; V6-F22 HydrophobicContact CB-CZ 4.37Å; V6-F22 HydrophobicContact CG1-CE2 4.19Å; V6-F22 HydrophobicContact CG1-CZ 3.8Å; V6-F22 HydrophobicContact CG2-CE1 3.94Å; V6-F22 HydrophobicContact CG2-CE2 4.37Å; V6-F22 HydrophobicContact CG2-CZ 3.61Å; L18-F22 HydrophobicContact CD2-CD2 4.37Å; L18-F22 HydrophobicContact CD2-CE2 3.99Å; L18-F22 VanDerWaalsContact O-CB 3.29Å; L18-F22 WeakPolarHBondContact O-CB 3.28Å; L18-F22 VanDerWaalsContact O-CD2 3.25Å; L18-F22 WeakPolarHBondContact O-CD2 3.35Å; L18-F22 PolarHBondContact O-N 2.86Å; Y19-F22 PolarHBondContact O-N 3.23Å; F22-A25 PolarHBondContact O-N 2.92Å; F22-A25 VanDerWaalsContact O-N 3.14Å; F22-I28 HydrophobicContact CB-CD1 3.72Å; F22-V48 HydrophobicContact CB-CG1 4.28Å; F22-V48 HydrophobicContact CD1-CB 4.48Å; F22-V48 HydrophobicContact CD1-CG1 4.11Å; F22-V48 HydrophobicContact CD1-CG2 4.31Å; F22-V48 HydrophobicContact CE1-CG2 4.46Å; F22-V48 HydrophobicContact CG-CG1 4.31Å; F22-V48 HydrophobicContact CG-CG2 4.34Å; F22-Y50 VanDerWaalsContact CB-OH 3.32Å; F22-Y50 WeakPolarHBondContact CB-OH 3.4Å; F22-Y50 HydrophobicContact CD1-CE2 4.38Å; F22-Y50 WeakPolarHBondContact CD1-OH 3.37Å; F22-Y50 PolarHBondContact O-OH 3.01Å; F22-A59 HydrophobicContact CD1-CB 4.21Å; F22-L63 HydrophobicContact CD1-CD1 3.88Å; F22-L63 HydrophobicContact CE1-CD1 4.2Å; F22-L63 HydrophobicContact CG-CD1 4.13Å; F22-I68 HydrophobicContact CE2-CD1 4.49Å; F22-I75 HydrophobicContact CE1-CD1 3.71Å; F22-I75 HydrophobicContact CE1-CG1 4.45Å; F22-I75 HydrophobicContact CZ-CD1 3.66Å; F22-I75 HydrophobicContact CZ-CG1 4.19Å
23	S	98	Very high	98.3	Very high	41 Å²	41	58.4 Å²	58.4	29%	0.287	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-60.7	-31.9	-178.2	58.8	0	0	0	0	115.1	Y19 A25 G26	Y19-S23 WeakPolarHBondContact O-CB 3.44Å; Y19-S23 PolarHBondContact O-N 3.32Å; Y19-S23 PolarHBondContact O-OG 2.92Å; S23-A25 PolarHBondContact O-N 3.22Å; S23-A25 VanDerWaalsContact O-N 3.14Å; S23-G26 PolarHBondContact O-N 2.97Å
24	P	98.1	Very high	98.2	Very high	106 Å²	106	59.2 Å²	59.2	69%	0.688	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-62.4	-22.8	175.8	-24.7	36.2	0	0	0	113.7	E20 G26	E20-P24 WeakPolarHBondContact O-CD 3.48Å; P24-G26 VanDerWaalsContact C-N 3.29Å
25	A	98	Very high	98.2	Very high	5 Å²	5	60 Å²	60	4%	0.041	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-81.8	-3.7	176.6	0	0	0	0	0	113.5	F22 S23 Y50 D55 R58 A59 L63	F22-A25 PolarHBondContact O-N 2.92Å; F22-A25 VanDerWaalsContact O-N 3.14Å; S23-A25 PolarHBondContact O-N 3.22Å; S23-A25 VanDerWaalsContact O-N 3.14Å; A25-Y50 HydrophobicContact CB-CE1 4.3Å; A25-D55 WeakPolarHBondContact O-CA 3.41Å; A25-D55 VanDerWaalsContact O-CB 3.27Å; A25-D55 WeakPolarHBondContact O-CB 3.47Å; A25-R58 VanDerWaalsContact C-NH2 3.33Å; A25-R58 HydrophobicContact CB-CG 4.35Å; A25-R58 PolarHBondContact O-NE 3.35Å; A25-R58 PolarHBondContact O-NH2 2.85Å; A25-A59 HydrophobicContact CB-CB 3.66Å; A25-L63 HydrophobicContact CB-CD1 4.39Å
26	G	97.8	Very high	98.1	Very high	11 Å²	11	59.6 Å²	59.6	11%	0.113	31%	0.311	C	S	.	.	S	Bend	trans	138.1	175.4	172.1	0	0	0	0	0	114.4	S23 P24 I28 Y50	S23-G26 PolarHBondContact O-N 2.97Å; P24-G26 VanDerWaalsContact C-N 3.29Å; G26-I28 PolarHBondContact O-N 3.11Å; G26-Y50 WeakPolarHBondContact O-CE1 3.41Å
27	P	98	Very high	98	Very high	69 Å²	69	66 Å²	66	45%	0.448	33%	0.328	S	S	.	.			trans	-61.5	123.1	-177.6	-23.8	35	0	0	0	113	Q51 D55	P27-Q51 HydrophobicContact CB-CB 4.28Å; P27-Q51 HydrophobicContact CB-CG 3.98Å; P27-Q51 PolarHBondContact O-N 2.96Å; P27-D55 WeakPolarHBondContact CD-OD2 3.27Å
28	I	98.5	Very high	97.9	Very high	24 Å²	24	70.4 Å²	70.4	12%	0.123	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	129.4	179.7	-62.1	178.6	0	0	0	109.6	Y19 F22 G26 I31 V48 N49 Y50	Y19-I28 HydrophobicContact CD2-CB 4.48Å; Y19-I28 HydrophobicContact CD2-CD1 4.07Å; Y19-I28 HydrophobicContact CE2-CB 4.32Å; Y19-I28 HydrophobicContact CE2-CD1 4.45Å; F22-I28 HydrophobicContact CB-CD1 3.72Å; G26-I28 PolarHBondContact O-N 3.11Å; I28-I31 HydrophobicContact CD1-CD1 3.99Å; I28-I31 HydrophobicContact CG2-CD1 4.21Å; I28-I31 HydrophobicContact CG2-CG1 3.69Å; I28-V48 HydrophobicContact CD1-CG1 4.33Å; I28-V48 HydrophobicContact CG2-CG1 4.42Å; I28-N49 WeakPolarHBondContact CG2-O 3.45Å; I28-Y50 HydrophobicContact CG1-CD1 4.16Å; I28-Y50 HydrophobicContact CG1-CE1 3.84Å
29	L	98	Very high	97.8	Very high	123 Å²	123	74.8 Å²	74.8	64%	0.644	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	-44	173.8	-179.2	63.5	0	0	0	111.8	N49 Q51	L29-N49 WeakPolarHBondContact CA-O 3.44Å; L29-N49 HydrophobicContact CB-CB 4.3Å; L29-N49 WeakPolarHBondContact CB-O 3.27Å; L29-N49 PolarHBondContact N-O 2.99Å; L29-Q51 HydrophobicContact CB-CG 4.3Å
30	S	98.3	Very high	97.6	Very high	54 Å²	54	76.5 Å²	76.5	38%	0.378	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	153.3	175.7	55	0	0	0	0	112.6	N49	S30-N49 PolarHBondContact N-O 2.77Å; S30-N49 PolarHBondContact O-N 3.22Å; S30-N49 PolarHBondContact OG-ND2 3.04Å
31	I	98.5	Very high	97.4	Very high	32 Å²	32	78.3 Å²	78.3	16%	0.164	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	138	169.5	-56.4	-175.7	0	0	0	108.5	E15 L18 Y19 I28 Y47 V48	E15-I31 HydrophobicContact CB-CG2 4.38Å; E15-I31 HydrophobicContact CG-CG2 4.27Å; L18-I31 HydrophobicContact CB-CD1 3.98Å; L18-I31 HydrophobicContact CB-CG2 3.97Å; L18-I31 HydrophobicContact CD1-CG2 3.79Å; Y19-I31 VanDerWaalsContact CA-CD1 3.44Å; Y19-I31 HydrophobicContact CD2-CD1 4.27Å; I28-I31 HydrophobicContact CD1-CD1 3.99Å; I28-I31 HydrophobicContact CG2-CD1 4.21Å; I28-I31 HydrophobicContact CG2-CG1 3.69Å; I31-Y47 WeakPolarHBondContact CA-O 3.44Å; I31-V48 HydrophobicContact CG1-CG1 4.38Å; I31-V48 HydrophobicContact CG1-CG2 4.36Å; I31-V48 HydrophobicContact CG2-CG2 4.35Å
32	R	98.1	Very high	97.4	Very high	174 Å²	174	75.8 Å²	75.8	66%	0.657	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.8	114.1	175.1	-177.2	-175.2	-61.7	-98.9	-0.6	110.4	A46 Y47	R32-A46 CarbonylContact O-C 3.41Å; R32-A46 WeakPolarHBondContact O-CA 3.35Å; R32-A46 WeakPolarHBondContact O-CB 3.41Å; R32-Y47 PolarHBondContact N-O 2.93Å; R32-Y47 PolarHBondContact O-N 2.91Å
33	I	98.4	Very high	97.3	Very high	7 Å²	7	80.2 Å²	80.2	4%	0.036	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	128.4	165.8	-61.9	-177.4	0	0	0	108.1	V13 T14 E15 L18 R35 A46	V13-I33 HydrophobicContact CG1-CD1 4.28Å; V13-I33 WeakPolarHBondContact O-CD1 3.31Å; T14-I33 VanDerWaalsContact C-CD1 3.43Å; E15-I33 HydrophobicContact CG-CD1 4.32Å; E15-I33 HydrophobicContact CG-CG1 4Å; E15-I33 WeakPolarHBondContact OE1-CB 3.33Å; E15-I33 PolarHBondContact OE1-N 3.22Å; L18-I33 HydrophobicContact CD1-CD1 3.91Å; L18-I33 HydrophobicContact CD1-CG1 3.71Å; I33-R35 HydrophobicContact CG2-CG 4.1Å; I33-R35 PolarHBondContact O-N 3.35Å; I33-A46 HydrophobicContact CB-CB 4.47Å; I33-A46 HydrophobicContact CG1-CB 3.93Å
34	C	97.4	Very high	97.3	Very high	19 Å²	19	79.1 Å²	79.1	13%	0.128	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	124	173.9	-72.3	0	0	0	0	108.9	L43 Y45	C34-L43 HydrophobicContact CB-CD1 4.29Å; C34-L43 WeakPolarHBondContact O-CB 3.37Å; C34-L43 PolarHBondContact O-N 2.87Å; C34-Y45 HydrophobicContact CB-CD1 4.22Å; C34-Y45 HydrophobicContact CB-CD2 4.02Å; C34-Y45 HydrophobicContact CB-CE1 3.71Å; C34-Y45 HydrophobicContact CB-CE2 3.51Å; C34-Y45 HydrophobicContact CB-CG 4.35Å; C34-Y45 PolarHBondContact N-O 2.87Å; C34-Y45 WeakPolarHBondContact SG-CE2 3.37Å
35	R	98	Very high	97.3	Very high	70 Å²	70	77 Å²	77	26%	0.264	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	148.6	-175.7	-64.1	172.6	-174	-84.3	-0.5	109.2	E15 I33 R40 R41	E15-R35 IonicContact OE1-NE 3.05Å; E15-R35 IonicContact OE1-NH2 3.46Å; E15-R35 IonicContact OE2-CZ 3.58Å; E15-R35 IonicContact OE2-NH2 3.9Å; E15-R35 PolarHBondContact OE2-NH2 2.95Å; I33-R35 HydrophobicContact CG2-CG 4.1Å; I33-R35 PolarHBondContact O-N 3.35Å; R35-R40 WeakPolarHBondContact CD-O 3.12Å; R35-R41 CarbonylContact C-O 3.59Å; R35-R41 VanDerWaalsContact CA-O 3.22Å; R35-R41 WeakPolarHBondContact CA-O 3.04Å
36	D	96.5	Very high	97.3	Very high	56 Å²	56	76.8 Å²	76.8	30%	0.299	37%	0.371	S	S	.	.			trans	-56.1	137.7	168.7	177.1	-109.5	0	0	0	109.8	I38 T39 R40 R41 L43	D36-I38 VanDerWaalsContact C-N 3.29Å; D36-I38 PolarHBondContact O-N 3.32Å; D36-I38 PolarHBondContact OD1-N 3.01Å; D36-T39 WeakPolarHBondContact CB-OG1 3.27Å; D36-T39 WeakPolarHBondContact OD1-CB 3.44Å; D36-T39 PolarHBondContact OD1-N 2.89Å; D36-T39 PolarHBondContact OD1-OG1 3.05Å; D36-R40 VanDerWaalsContact O-CA 3.27Å; D36-R40 WeakPolarHBondContact O-CA 3.22Å; D36-R40 PolarHBondContact O-N 3.15Å; D36-R40 VanDerWaalsContact O-N 3.1Å; D36-R41 PolarHBondContact N-O 2.88Å; D36-L43 HydrophobicContact CB-CD2 4.1Å
37	K	95.6	Very high	97.3	Very high	194 Å²	194	79.2 Å²	79.2	84%	0.843	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-32.6	-171.1	-70.2	-175.5	179.9	-179.8	0	112.3
38	I	96.1	Very high	97.4	Very high	155 Å²	155	76 Å²	76	80%	0.795	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-58.5	-173.3	-58.4	175.1	0	0	0	109.7	D36 R40	D36-I38 VanDerWaalsContact C-N 3.29Å; D36-I38 PolarHBondContact O-N 3.32Å; D36-I38 PolarHBondContact OD1-N 3.01Å; I38-R40 VanDerWaalsContact C-N 3.33Å; I38-R40 PolarHBondContact O-N 3.15Å
39	T	96.6	Very high	97.4	Very high	93 Å²	93	76.5 Å²	76.5	57%	0.571	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-11.9	-173.7	64.8	0	0	0	0	113.9	D36 R41	D36-T39 WeakPolarHBondContact CB-OG1 3.27Å; D36-T39 WeakPolarHBondContact OD1-CB 3.44Å; D36-T39 PolarHBondContact OD1-N 2.89Å; D36-T39 PolarHBondContact OD1-OG1 3.05Å; T39-R41 PolarHBondContact O-N 3.35Å; T39-R41 PolarHBondContact OG1-N 2.88Å
40	R	94.2	Very high	97.4	Very high	166 Å²	166	70.8 Å²	70.8	63%	0.626	33%	0.329	S	S	*	.			trans	59	7.8	-174.4	-56.2	-65.1	-64.5	-179.8	-3.8	114.9	R35 D36 I38	R35-R40 WeakPolarHBondContact CD-O 3.12Å; D36-R40 VanDerWaalsContact O-CA 3.27Å; D36-R40 WeakPolarHBondContact O-CA 3.22Å; D36-R40 PolarHBondContact O-N 3.15Å; D36-R40 VanDerWaalsContact O-N 3.1Å; I38-R40 VanDerWaalsContact C-N 3.33Å; I38-R40 PolarHBondContact O-N 3.15Å
41	R	95.2	Very high	97.4	Very high	178 Å²	178	73.5 Å²	73.5	67%	0.672	34%	0.336	S	S	*	.			trans	-65.5	140.4	175.4	-173.1	-178.9	-68.5	-106.8	0.8	110	R35 D36 T39 L43	R35-R41 CarbonylContact C-O 3.59Å; R35-R41 VanDerWaalsContact CA-O 3.22Å; R35-R41 WeakPolarHBondContact CA-O 3.04Å; D36-R41 PolarHBondContact N-O 2.88Å; T39-R41 PolarHBondContact O-N 3.35Å; T39-R41 PolarHBondContact OG1-N 2.88Å; R41-L43 PolarHBondContact O-N 3.15Å
42	S	97.2	Very high	97.3	Very high	15 Å²	15	77.2 Å²	77.2	11%	0.105	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	135.8	173.8	179.3	0	0	0	0	111.3	P11 G44	P11-S42 WeakPolarHBondContact O-CB 3.39Å; S42-G44 PolarHBondContact O-N 3.45Å; S42-G44 PolarHBondContact OG-N 2.89Å; S42-G44 VanDerWaalsContact OG-N 3.07Å
43	L	97.3	Very high	97.3	Very high	92 Å²	92	71.8 Å²	71.8	48%	0.482	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	7.3	170.4	-60.9	178.1	0	0	0	112.1	C34 D36 R41 Y45	C34-L43 HydrophobicContact CB-CD1 4.29Å; C34-L43 WeakPolarHBondContact O-CB 3.37Å; C34-L43 PolarHBondContact O-N 2.87Å; D36-L43 HydrophobicContact CB-CD2 4.1Å; R41-L43 PolarHBondContact O-N 3.15Å; L43-Y45 HydrophobicContact CB-CD1 3.89Å; L43-Y45 HydrophobicContact CB-CE1 3.62Å; L43-Y45 HydrophobicContact CD1-CE1 4.11Å
44	G	97.4	Very high	97.3	Very high	19 Å²	19	76.1 Å²	76.1	20%	0.196	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	79.3	15.2	177.2	0	0	0	0	0	114.3	G7 D8 L9 S42	G7-G44 CarbonylContact C-O 3.47Å; D8-G44 PolarHBondContact N-O 3.14Å; D8-G44 VanDerWaalsContact N-O 3.1Å; L9-G44 PolarHBondContact N-O 3.06Å; S42-G44 PolarHBondContact O-N 3.45Å; S42-G44 PolarHBondContact OG-N 2.89Å; S42-G44 VanDerWaalsContact OG-N 3.07Å
45	Y	98.2	Very high	97.3	Very high	61 Å²	61	75.8 Å²	75.8	24%	0.239	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	160.6	174.3	74.1	-81.4	0	0	0	113.2	Y5 V6 C34 L43 Y47	Y5-Y45 AromaticContact CD2-CD2 3.82Å; Y5-Y45 HydrophobicContact CD2-CD2 3.82Å; Y5-Y45 HydrophobicContact CD2-CG 4.43Å; Y5-Y45 HydrophobicContact CE2-CD1 4.47Å; Y5-Y45 AromaticContact CE2-CD2 3.34Å; Y5-Y45 HydrophobicContact CE2-CD2 3.34Å; Y5-Y45 HydrophobicContact CE2-CE2 4.1Å; Y5-Y45 AromaticContact CE2-CG 3.56Å; Y5-Y45 HydrophobicContact CE2-CG 3.56Å; Y5-Y45 WeakPolarHBondContact OH-CB 3.4Å; V6-Y45 CarbonylContact O-C 3.55Å; V6-Y45 WeakPolarHBondContact O-CA 3.3Å; V6-Y45 WeakPolarHBondContact O-CB 3.47Å; C34-Y45 HydrophobicContact CB-CD1 4.22Å; C34-Y45 HydrophobicContact CB-CD2 4.02Å; C34-Y45 HydrophobicContact CB-CE1 3.71Å; C34-Y45 HydrophobicContact CB-CE2 3.51Å; C34-Y45 HydrophobicContact CB-CG 4.35Å; C34-Y45 PolarHBondContact N-O 2.87Å; C34-Y45 WeakPolarHBondContact SG-CE2 3.37Å; L43-Y45 HydrophobicContact CB-CD1 3.89Å; L43-Y45 HydrophobicContact CB-CE1 3.62Å; L43-Y45 HydrophobicContact CD1-CE1 4.11Å; Y45-Y47 HydrophobicContact CD2-CE2 4.26Å; Y45-Y47 AromaticContact CE2-CE2 3.69Å; Y45-Y47 HydrophobicContact CE2-CE2 3.69Å; Y45-Y47 AromaticContact CE2-CZ 3.99Å
46	A	98.6	Very high	97.3	Very high	0 Å²	0	72.5 Å²	72.5	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	166.7	179.2	0	0	0	0	0	111.5	V6 L9 L18 R32 I33	V6-A46 PolarHBondContact N-O 3.01Å; V6-A46 PolarHBondContact O-N 3.37Å; L9-A46 HydrophobicContact CD1-CB 3.76Å; L18-A46 HydrophobicContact CD1-CB 3.55Å; R32-A46 CarbonylContact O-C 3.41Å; R32-A46 WeakPolarHBondContact O-CA 3.35Å; R32-A46 WeakPolarHBondContact O-CB 3.41Å; I33-A46 HydrophobicContact CB-CB 4.47Å; I33-A46 HydrophobicContact CG1-CB 3.93Å
47	Y	98.5	Very high	97.4	Very high	63 Å²	63	75 Å²	75	25%	0.247	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	131.6	165.3	-65.3	-77.8	0	0	0	110	L4 Y5 I31 R32 Y45	L4-Y47 VanDerWaalsContact O-CA 3.3Å; L4-Y47 WeakPolarHBondContact O-CA 3.15Å; Y5-Y47 HydrophobicContact CD2-CE1 4.23Å; I31-Y47 WeakPolarHBondContact CA-O 3.44Å; R32-Y47 PolarHBondContact N-O 2.93Å; R32-Y47 PolarHBondContact O-N 2.91Å; Y45-Y47 HydrophobicContact CD2-CE2 4.26Å; Y45-Y47 AromaticContact CE2-CE2 3.69Å; Y45-Y47 HydrophobicContact CE2-CE2 3.69Å; Y45-Y47 AromaticContact CE2-CZ 3.99Å
48	V	98.6	Very high	97.5	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	119	173.2	-179.9	0	0	0	0	107.6	L4 V6 F22 I28 I31 Y50	L4-V48 PolarHBondContact N-O 3.13Å; L4-V48 PolarHBondContact O-N 2.99Å; V6-V48 HydrophobicContact CG2-CB 4.39Å; V6-V48 HydrophobicContact CG2-CG2 3.76Å; F22-V48 HydrophobicContact CB-CG1 4.28Å; F22-V48 HydrophobicContact CD1-CB 4.48Å; F22-V48 HydrophobicContact CD1-CG1 4.11Å; F22-V48 HydrophobicContact CD1-CG2 4.31Å; F22-V48 HydrophobicContact CE1-CG2 4.46Å; F22-V48 HydrophobicContact CG-CG1 4.31Å; F22-V48 HydrophobicContact CG-CG2 4.34Å; I28-V48 HydrophobicContact CD1-CG1 4.33Å; I28-V48 HydrophobicContact CG2-CG1 4.42Å; I31-V48 HydrophobicContact CG1-CG1 4.38Å; I31-V48 HydrophobicContact CG1-CG2 4.36Å; I31-V48 HydrophobicContact CG2-CG2 4.35Å; V48-Y50 HydrophobicContact CG1-CD2 4.17Å; V48-Y50 HydrophobicContact CG1-CE2 3.71Å
49	N	98.4	Very high	97.6	Very high	35 Å²	35	63.5 Å²	63.5	19%	0.187	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	119.6	178.9	-57.4	-67.6	0	0	0	108.7	A2 S3 I28 L29 S30	A2-N49 WeakPolarHBondContact O-CA 3.01Å; S3-N49 WeakPolarHBondContact CB-OD1 3.42Å; S3-N49 PolarHBondContact OG-OD1 3.39Å; I28-N49 WeakPolarHBondContact CG2-O 3.45Å; L29-N49 WeakPolarHBondContact CA-O 3.44Å; L29-N49 HydrophobicContact CB-CB 4.3Å; L29-N49 WeakPolarHBondContact CB-O 3.27Å; L29-N49 PolarHBondContact N-O 2.99Å; S30-N49 PolarHBondContact N-O 2.77Å; S30-N49 PolarHBondContact O-N 3.22Å; S30-N49 PolarHBondContact OG-ND2 3.04Å
50	Y	98.6	Very high	97.7	Very high	4 Å²	4	60.3 Å²	60.3	2%	0.016	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	158.2	172.2	-76	-90.4	0	0	0	111	A2 L4 F22 A25 G26 I28 V48 Q52 D55 A56 A59	A2-Y50 WeakPolarHBondContact CB-O 3.43Å; A2-Y50 PolarHBondContact O-N 2.96Å; L4-Y50 HydrophobicContact CD1-CD2 4.39Å; L4-Y50 HydrophobicContact CD1-CE2 3.93Å; F22-Y50 VanDerWaalsContact CB-OH 3.32Å; F22-Y50 WeakPolarHBondContact CB-OH 3.4Å; F22-Y50 HydrophobicContact CD1-CE2 4.38Å; F22-Y50 WeakPolarHBondContact CD1-OH 3.37Å; F22-Y50 PolarHBondContact O-OH 3.01Å; A25-Y50 HydrophobicContact CB-CE1 4.3Å; G26-Y50 WeakPolarHBondContact O-CE1 3.41Å; I28-Y50 HydrophobicContact CG1-CD1 4.16Å; I28-Y50 HydrophobicContact CG1-CE1 3.84Å; V48-Y50 HydrophobicContact CG1-CD2 4.17Å; V48-Y50 HydrophobicContact CG1-CE2 3.71Å; Y50-Q52 WeakPolarHBondContact CB-O 3.32Å; Y50-D55 HydrophobicContact CD1-CB 3.43Å; Y50-D55 VanDerWaalsContact CD1-CB 3.43Å; Y50-D55 HydrophobicContact CE1-CB 4.05Å; Y50-D55 HydrophobicContact CG-CB 3.87Å; Y50-A56 VanDerWaalsContact CD2-CA 3.49Å; Y50-A56 HydrophobicContact CD2-CB 3.69Å; Y50-A56 HydrophobicContact CE2-CB 4.48Å; Y50-A56 HydrophobicContact CG-CB 4.19Å; Y50-A59 HydrophobicContact CE2-CB 3.69Å; Y50-A59 WeakPolarHBondContact OH-CB 3.36Å
51	Q	97.9	Very high	97.7	Very high	111 Å²	111	58.3 Å²	58.3	52%	0.519	28%	0.277	S	S	.	.	S	Bend	trans	-67.9	-38.2	170.3	-66	-175.4	13.9	0	0	111.3	P27 L29	P27-Q51 HydrophobicContact CB-CB 4.28Å; P27-Q51 HydrophobicContact CB-CG 3.98Å; P27-Q51 PolarHBondContact O-N 2.96Å; L29-Q51 HydrophobicContact CB-CG 4.3Å
52	Q	97.8	Very high	97.8	Very high	109 Å²	109	53.9 Å²	53.9	51%	0.509	27%	0.27	S	S	.	.	S	Bend	trans	-116.3	140.5	-180	-57.4	-64.1	-27.2	0	0	112.3	Y50 V54 D55 A56	Y50-Q52 WeakPolarHBondContact CB-O 3.32Å; Q52-V54 HydrophobicContact CB-CG1 3.96Å; Q52-V54 PolarHBondContact O-N 2.89Å; Q52-D55 WeakPolarHBondContact CB-OD2 3.43Å; Q52-D55 PolarHBondContact O-N 3.42Å; Q52-A56 PolarHBondContact O-N 3.1Å
53	P	97.4	Very high	97.9	Very high	61 Å²	61	54.1 Å²	54.1	40%	0.396	27%	0.27	S	S	.	.	H	α-helix	trans	-59.9	-30.9	174.7	-25.2	34.3	0	0	0	114.4	A2 D55 A56 K57	A2-P53 HydrophobicContact CB-CG 4.23Å; P53-D55 VanDerWaalsContact C-N 3.33Å; P53-A56 PolarHBondContact O-N 3.36Å; P53-K57 PolarHBondContact O-N 3.37Å
54	V	97.7	Very high	97.9	Very high	97 Å²	97	50.9 Å²	50.9	59%	0.588	25%	0.253	S	S	*	.	H	α-helix	trans	-65.4	-36.7	178.7	65.3	0	0	0	0	111.8	Q52 K57 R58	Q52-V54 HydrophobicContact CB-CG1 3.96Å; Q52-V54 PolarHBondContact O-N 2.89Å; V54-K57 PolarHBondContact O-N 3.03Å; V54-R58 WeakPolarHBondContact O-CB 3.27Å; V54-R58 PolarHBondContact O-N 3.44Å
55	D	98.3	Very high	97.9	Very high	13 Å²	13	51 Å²	51	7%	0.07	25%	0.248	C	C	.	.	H	α-helix	trans	-68.6	-41.4	176.8	-61.2	-33.2	0	0	0	111.1	A25 P27 Y50 Q52 P53 K57 R58 A59	A25-D55 WeakPolarHBondContact O-CA 3.41Å; A25-D55 VanDerWaalsContact O-CB 3.27Å; A25-D55 WeakPolarHBondContact O-CB 3.47Å; P27-D55 WeakPolarHBondContact CD-OD2 3.27Å; Y50-D55 HydrophobicContact CD1-CB 3.43Å; Y50-D55 VanDerWaalsContact CD1-CB 3.43Å; Y50-D55 HydrophobicContact CE1-CB 4.05Å; Y50-D55 HydrophobicContact CG-CB 3.87Å; Q52-D55 WeakPolarHBondContact CB-OD2 3.43Å; Q52-D55 PolarHBondContact O-N 3.42Å; P53-D55 VanDerWaalsContact C-N 3.33Å; D55-K57 VanDerWaalsContact C-N 3.34Å; D55-K57 PolarHBondContact O-N 3Å; D55-R58 PolarHBondContact O-N 3.31Å; D55-R58 IonicContact OD1-CZ 2.81Å; D55-R58 IonicContact OD1-NH2 3.83Å; D55-R58 PolarHBondContact OD1-NH2 3.49Å; D55-A59 WeakPolarHBondContact O-CB 3.21Å; D55-A59 PolarHBondContact O-N 3.36Å
56	A	98.3	Very high	97.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.1	-41.3	173.8	0	0	0	0	0	111.9	L4 Y50 Q52 P53 A59 L60 W77	L4-A56 HydrophobicContact CD1-CB 4.37Å; L4-A56 WeakPolarHBondContact CD1-O 3.27Å; L4-A56 HydrophobicContact CD2-CB 4.19Å; L4-A56 HydrophobicContact CG-CB 4.13Å; Y50-A56 VanDerWaalsContact CD2-CA 3.49Å; Y50-A56 HydrophobicContact CD2-CB 3.69Å; Y50-A56 HydrophobicContact CE2-CB 4.48Å; Y50-A56 HydrophobicContact CG-CB 4.19Å; Q52-A56 PolarHBondContact O-N 3.1Å; P53-A56 PolarHBondContact O-N 3.36Å; A56-A59 PolarHBondContact O-N 2.93Å; A56-L60 WeakPolarHBondContact O-CB 3.33Å; A56-L60 PolarHBondContact O-N 3.42Å; A56-W77 HydrophobicContact CB-CH2 3.89Å; A56-W77 HydrophobicContact CB-CZ3 3.7Å
57	K	97.6	Very high	97.8	Very high	108 Å²	108	54.8 Å²	54.8	47%	0.47	28%	0.276	S	S	.	.	H	α-helix	trans	-63.2	-47.8	175.4	-178.2	178.7	172.6	-176.8	0	110.9	P53 V54 D55 A59 L60 E61 W77	P53-K57 PolarHBondContact O-N 3.37Å; V54-K57 PolarHBondContact O-N 3.03Å; D55-K57 VanDerWaalsContact C-N 3.34Å; D55-K57 PolarHBondContact O-N 3Å; K57-A59 VanDerWaalsContact C-N 3.33Å; K57-A59 PolarHBondContact O-N 3.43Å; K57-L60 PolarHBondContact O-N 3.22Å; K57-E61 WeakPolarHBondContact CE-OE1 3.41Å; K57-E61 IonicContact NZ-OE1 2.75Å; K57-E61 WeakPolarHBondContact O-CG 3.4Å; K57-E61 PolarHBondContact O-N 3.43Å; K57-W77 HydrophobicContact CB-CH2 4.04Å; K57-W77 HydrophobicContact CB-CZ2 3.99Å; K57-W77 HydrophobicContact CG-CZ2 4.42Å
58	R	98	Very high	97.8	Very high	108 Å²	108	52.5 Å²	52.5	41%	0.408	27%	0.268	S	S	.	.	H	α-helix	trans	-55.1	-49	175.5	176.3	167.9	59	-160.1	-2.3	111.1	A25 V54 D55 L60 E61 T62	A25-R58 VanDerWaalsContact C-NH2 3.33Å; A25-R58 HydrophobicContact CB-CG 4.35Å; A25-R58 PolarHBondContact O-NE 3.35Å; A25-R58 PolarHBondContact O-NH2 2.85Å; V54-R58 WeakPolarHBondContact O-CB 3.27Å; V54-R58 PolarHBondContact O-N 3.44Å; D55-R58 PolarHBondContact O-N 3.31Å; D55-R58 IonicContact OD1-CZ 2.81Å; D55-R58 IonicContact OD1-NH2 3.83Å; D55-R58 PolarHBondContact OD1-NH2 3.49Å; R58-L60 VanDerWaalsContact C-N 3.34Å; R58-L60 PolarHBondContact O-N 3.04Å; R58-E61 PolarHBondContact O-N 2.97Å; R58-E61 VanDerWaalsContact O-N 3.17Å; R58-T62 HydrophobicContact CG-CG2 4.36Å; R58-T62 WeakPolarHBondContact O-CG2 3.39Å; R58-T62 PolarHBondContact O-N 3.25Å; R58-T62 PolarHBondContact O-OG1 3Å
59	A	98.5	Very high	97.7	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.5	-41.3	178	0	0	0	0	0	112.8	L4 F22 A25 Y50 D55 A56 K57 E61 L63	L4-A59 HydrophobicContact CD1-CB 3.88Å; F22-A59 HydrophobicContact CD1-CB 4.21Å; A25-A59 HydrophobicContact CB-CB 3.66Å; Y50-A59 HydrophobicContact CE2-CB 3.69Å; Y50-A59 WeakPolarHBondContact OH-CB 3.36Å; D55-A59 WeakPolarHBondContact O-CB 3.21Å; D55-A59 PolarHBondContact O-N 3.36Å; A56-A59 PolarHBondContact O-N 2.93Å; K57-A59 VanDerWaalsContact C-N 3.33Å; K57-A59 PolarHBondContact O-N 3.43Å; A59-E61 VanDerWaalsContact C-N 3.33Å; A59-L63 HydrophobicContact CB-CD1 4.13Å; A59-L63 VanDerWaalsContact O-CB 3.23Å; A59-L63 WeakPolarHBondContact O-CB 3.48Å; A59-L63 PolarHBondContact O-N 3.5Å
60	L	97.6	Very high	97.5	Very high	26 Å²	26	58.1 Å²	58.1	14%	0.136	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-39.1	175.2	-177.3	153.4	0	0	0	111.9	L4 A56 K57 R58 N64 I75 W77	L4-L60 HydrophobicContact CD2-CB 4.2Å; L4-L60 HydrophobicContact CD2-CD1 4.09Å; A56-L60 WeakPolarHBondContact O-CB 3.33Å; A56-L60 PolarHBondContact O-N 3.42Å; K57-L60 PolarHBondContact O-N 3.22Å; R58-L60 VanDerWaalsContact C-N 3.34Å; R58-L60 PolarHBondContact O-N 3.04Å; L60-N64 VanDerWaalsContact O-CB 3.23Å; L60-N64 WeakPolarHBondContact O-CB 3.4Å; L60-I75 HydrophobicContact CB-CG2 4.1Å; L60-I75 HydrophobicContact CD1-CG2 4.41Å; L60-I75 HydrophobicContact CG-CG2 4.11Å; L60-W77 HydrophobicContact CD1-CD2 4.16Å; L60-W77 HydrophobicContact CD1-CG 4.15Å
61	E	95.7	Very high	97.3	Very high	125 Å²	125	63.8 Å²	63.8	58%	0.584	33%	0.331	S	S	*	.	H	α-helix	trans	-78.1	-34.6	-177.6	-71	172	169.1	0	0	112.8	K57 R58 A59	K57-E61 WeakPolarHBondContact CE-OE1 3.41Å; K57-E61 IonicContact NZ-OE1 2.75Å; K57-E61 WeakPolarHBondContact O-CG 3.4Å; K57-E61 PolarHBondContact O-N 3.43Å; R58-E61 PolarHBondContact O-N 2.97Å; R58-E61 VanDerWaalsContact O-N 3.17Å; A59-E61 VanDerWaalsContact C-N 3.33Å
62	T	97.1	Very high	97.3	Very high	85 Å²	85	60.7 Å²	60.7	52%	0.521	32%	0.32	S	S	.	.	H	α-helix	trans	-99.8	-26.4	-172.3	63.4	0	0	0	0	114.5	R58	R58-T62 HydrophobicContact CG-CG2 4.36Å; R58-T62 WeakPolarHBondContact O-CG2 3.39Å; R58-T62 PolarHBondContact O-N 3.25Å; R58-T62 PolarHBondContact O-OG1 3Å
63	L	98.1	Very high	97.3	Very high	20 Å²	20	55.6 Å²	55.6	11%	0.105	30%	0.296	C	S	.	.	H	α-helix	trans	-108.5	-4.2	-173.3	-51.2	177.5	0	0	0	113.4	K21 F22 A25 A59 F65 D66 I75	K21-L63 WeakPolarHBondContact O-CD1 3.4Å; F22-L63 HydrophobicContact CD1-CD1 3.88Å; F22-L63 HydrophobicContact CE1-CD1 4.2Å; F22-L63 HydrophobicContact CG-CD1 4.13Å; A25-L63 HydrophobicContact CB-CD1 4.39Å; A59-L63 HydrophobicContact CB-CD1 4.13Å; A59-L63 VanDerWaalsContact O-CB 3.23Å; A59-L63 WeakPolarHBondContact O-CB 3.48Å; A59-L63 PolarHBondContact O-N 3.5Å; L63-F65 PolarHBondContact O-N 2.71Å; L63-D66 WeakPolarHBondContact O-CB 3.34Å; L63-D66 PolarHBondContact O-N 2.61Å; L63-D66 VanDerWaalsContact O-N 3.14Å; L63-I75 HydrophobicContact CB-CD1 3.82Å; L63-I75 WeakPolarHBondContact O-CD1 3.27Å
64	N	97.9	Very high	97.3	Very high	23 Å²	23	54.4 Å²	54.4	12%	0.123	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	134.3	179.6	-162	14.2	0	0	0	109.9	L60 D66 I75	L60-N64 VanDerWaalsContact O-CB 3.23Å; L60-N64 WeakPolarHBondContact O-CB 3.4Å; N64-D66 PolarHBondContact O-N 3.3Å; N64-I75 HydrophobicContact CB-CB 4.24Å; N64-I75 HydrophobicContact CB-CD1 4.36Å; N64-I75 HydrophobicContact CB-CG1 4.47Å; N64-I75 PolarHBondContact OD1-N 2.88Å
65	F	97.5	Very high	97.3	Very high	23 Å²	23	50 Å²	50	10%	0.101	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	2.5	-173.7	-37.5	-56.7	0	0	0	116	L63 P72 V73 N103 K104 Y107 C119	L63-F65 PolarHBondContact O-N 2.71Å; F65-P72 VanDerWaalsContact O-CB 3.27Å; F65-P72 WeakPolarHBondContact O-CB 3.47Å; F65-V73 WeakPolarHBondContact CA-O 3.44Å; F65-V73 PolarHBondContact N-O 3.44Å; F65-N103 HydrophobicContact CB-CB 4.04Å; F65-N103 HydrophobicContact CD1-CB 3.28Å; F65-N103 HydrophobicContact CD2-CB 4.22Å; F65-N103 HydrophobicContact CE1-CB 3.7Å; F65-N103 HydrophobicContact CG-CB 3.56Å; F65-N103 HydrophobicContact CZ-CB 4.33Å; F65-K104 HydrophobicContact CD2-CB 4.12Å; F65-Y107 HydrophobicContact CE2-CD1 4.47Å; F65-Y107 AromaticContact CE2-CD2 3.98Å; F65-Y107 HydrophobicContact CE2-CD2 3.98Å; F65-Y107 AromaticContact CE2-CG 3.77Å; F65-Y107 HydrophobicContact CE2-CG 3.77Å; F65-Y107 AromaticContact CZ-CD2 3.91Å; F65-Y107 HydrophobicContact CZ-CD2 3.91Å; F65-Y107 HydrophobicContact CZ-CG 4.11Å; F65-C119 HydrophobicContact CE1-CB 4.47Å; F65-C119 HydrophobicContact CZ-CB 4.04Å
66	D	97.8	Very high	97.3	Very high	47 Å²	47	50.2 Å²	50.2	25%	0.251	26%	0.258	S	S	.	.			trans	-62	146.6	172.6	-84.8	0.6	0	0	0	111.5	K21 L63 N64 P72 V73	K21-D66 VanDerWaalsContact CE-CB 3.47Å; K21-D66 WeakPolarHBondContact CE-OD2 3.14Å; K21-D66 IonicContact NZ-OD2 2.83Å; K21-D66 PolarHBondContact NZ-OD2 3.08Å; L63-D66 WeakPolarHBondContact O-CB 3.34Å; L63-D66 PolarHBondContact O-N 2.61Å; L63-D66 VanDerWaalsContact O-N 3.14Å; N64-D66 PolarHBondContact O-N 3.3Å; D66-P72 CarbonylContact O-C 3.56Å; D66-P72 WeakPolarHBondContact O-CA 3.27Å; D66-V73 WeakPolarHBondContact O-CG2 3.28Å; D66-V73 PolarHBondContact O-N 3.26Å
67	V	96.7	Very high	97.2	Very high	92 Å²	92	54.7 Å²	54.7	56%	0.558	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	126.1	-175.3	178.6	0	0	0	0	110.6	G70 R71	V67-G70 VanDerWaalsContact CG1-CA 3.49Å; V67-R71 WeakPolarHBondContact CA-O 3.37Å
68	I	97.8	Very high	97.2	Very high	15 Å²	15	49.9 Å²	49.9	8%	0.077	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	122.4	168.3	-51.3	-179.6	0	0	0	107.8	V13 L18 K21 F22 G70 R71 V73	V13-I68 HydrophobicContact CG1-CG2 4.31Å; V13-I68 HydrophobicContact CG2-CB 4.43Å; V13-I68 HydrophobicContact CG2-CG2 3.8Å; L18-I68 HydrophobicContact CD2-CD1 3.89Å; K21-I68 HydrophobicContact CB-CD1 4.14Å; K21-I68 HydrophobicContact CG-CD1 3.84Å; K21-I68 HydrophobicContact CG-CG1 4.27Å; F22-I68 HydrophobicContact CE2-CD1 4.49Å; I68-G70 VanDerWaalsContact C-N 3.28Å; I68-G70 PolarHBondContact O-N 3.42Å; I68-R71 PolarHBondContact N-O 3.43Å; I68-R71 PolarHBondContact O-N 2.88Å; I68-R71 VanDerWaalsContact O-N 3.16Å; I68-V73 HydrophobicContact CB-CG1 4.17Å; I68-V73 HydrophobicContact CD1-CG1 3.64Å; I68-V73 HydrophobicContact CG1-CG1 3.77Å
69	K	97	Very high	96.8	Very high	88 Å²	88	49.8 Å²	49.8	38%	0.383	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	48.1	-175.1	-64.7	-159.9	62.8	136.8	0	113	H10 E12 V13 M17 R71	H10-K69 HydrophobicContact CB-CB 3.8Å; H10-K69 PolarHBondContact CD2-O 3.08Å; E12-K69 HydrophobicContact CB-CD 4.05Å; E12-K69 VanDerWaalsContact OE2-CE 3.29Å; E12-K69 WeakPolarHBondContact OE2-CE 3.33Å; E12-K69 IonicContact OE2-NZ 2.92Å; E12-K69 PolarHBondContact OE2-NZ 3.03Å; V13-K69 HydrophobicContact CG2-CB 4.45Å; V13-K69 HydrophobicContact CG2-CG 4.42Å; M17-K69 HydrophobicContact CE-CD 4.11Å; M17-K69 HydrophobicContact SD-CD 3.79Å; M17-K69 HydrophobicContact SD-CG 4.13Å; K69-R71 VanDerWaalsContact C-N 3.25Å; K69-R71 PolarHBondContact O-N 3.16Å
70	G	94.4	Very high	96.3	Very high	66 Å²	66	60.2 Å²	60.2	68%	0.68	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	2.5	175.9	0	0	0	0	0	115.7	V67 I68	V67-G70 VanDerWaalsContact CG1-CA 3.49Å; I68-G70 VanDerWaalsContact C-N 3.28Å; I68-G70 PolarHBondContact O-N 3.42Å
71	R	94.7	Very high	95.9	Very high	123 Å²	123	63 Å²	63	46%	0.464	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	131.2	175.8	-66.9	-168.4	173.6	-171.6	-5.7	112.2	H10 V67 I68 K69 V73	H10-R71 HydrophobicContact CB-CB 4.49Å; H10-R71 HydrophobicContact CB-CG 4.26Å; V67-R71 WeakPolarHBondContact CA-O 3.37Å; I68-R71 PolarHBondContact N-O 3.43Å; I68-R71 PolarHBondContact O-N 2.88Å; I68-R71 VanDerWaalsContact O-N 3.16Å; K69-R71 VanDerWaalsContact C-N 3.25Å; K69-R71 PolarHBondContact O-N 3.16Å; R71-V73 PolarHBondContact O-N 2.93Å
72	P	96.7	Very high	95.6	Very high	46 Å²	46	59.2 Å²	59.2	30%	0.299	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	126.3	172.6	28.8	-33	0	0	0	109.7	F65 D66 N103	F65-P72 VanDerWaalsContact O-CB 3.27Å; F65-P72 WeakPolarHBondContact O-CB 3.47Å; D66-P72 CarbonylContact O-C 3.56Å; D66-P72 WeakPolarHBondContact O-CA 3.27Å; P72-N103 WeakPolarHBondContact CG-ND2 3.33Å
73	V	98.1	Very high	95.3	Very high	2 Å²	2	58.3 Å²	58.3	1%	0.012	30%	0.297	C	S	.	.			trans	-77.7	146.9	178.6	-57.8	0	0	0	0	111	V6 L9 F65 D66 I68 R71 I75	V6-V73 HydrophobicContact CG1-CB 4.01Å; V6-V73 HydrophobicContact CG1-CG1 4.39Å; V6-V73 HydrophobicContact CG1-CG2 4.4Å; L9-V73 HydrophobicContact CD2-CB 4.48Å; L9-V73 HydrophobicContact CD2-CG1 3.73Å; F65-V73 WeakPolarHBondContact CA-O 3.44Å; F65-V73 PolarHBondContact N-O 3.44Å; D66-V73 WeakPolarHBondContact O-CG2 3.28Å; D66-V73 PolarHBondContact O-N 3.26Å; I68-V73 HydrophobicContact CB-CG1 4.17Å; I68-V73 HydrophobicContact CD1-CG1 3.64Å; I68-V73 HydrophobicContact CG1-CG1 3.77Å; R71-V73 PolarHBondContact O-N 2.93Å; V73-I75 HydrophobicContact CG2-CD1 4.23Å; V73-I75 HydrophobicContact CG2-CG1 4.06Å
74	R	98.2	Very high	94.8	Very high	36 Å²	36	60.4 Å²	60.4	14%	0.136	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	109.1	175	-175.6	163.1	52.1	81.1	13.9	110.4	G7 D8 S118 C119	G7-R74 PolarHBondContact N-O 2.9Å; G7-R74 PolarHBondContact O-N 2.76Å; D8-R74 HydrophobicContact CB-CB 4.38Å; D8-R74 IonicContact OD1-CZ 2.85Å; D8-R74 IonicContact OD1-NE 3.68Å; D8-R74 IonicContact OD1-NH2 2.61Å; D8-R74 PolarHBondContact OD1-NH2 2.96Å; D8-R74 IonicContact OD2-CZ 3.35Å; D8-R74 IonicContact OD2-NE 3.62Å; D8-R74 PolarHBondContact OD2-NE 3.08Å; D8-R74 IonicContact OD2-NH2 2.71Å; D8-R74 PolarHBondContact OD2-NH2 2.8Å; R74-S118 PolarHBondContact NH1-OG 2.8Å; R74-C119 WeakPolarHBondContact CD-O 3.32Å
75	I	98.3	Very high	94.4	Very high	3 Å²	3	65.1 Å²	65.1	2%	0.015	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	136.7	-177.5	-54.2	175.7	0	0	0	109.6	L4 Y5 V6 F22 L60 L63 N64 V73	L4-I75 HydrophobicContact CB-CG2 4.21Å; L4-I75 HydrophobicContact CD1-CG2 3.96Å; L4-I75 HydrophobicContact CD2-CG2 4.32Å; L4-I75 HydrophobicContact CG-CG2 4.4Å; Y5-I75 WeakPolarHBondContact O-CA 3.37Å; V6-I75 HydrophobicContact CG1-CG1 4.36Å; F22-I75 HydrophobicContact CE1-CD1 3.71Å; F22-I75 HydrophobicContact CE1-CG1 4.45Å; F22-I75 HydrophobicContact CZ-CD1 3.66Å; F22-I75 HydrophobicContact CZ-CG1 4.19Å; L60-I75 HydrophobicContact CB-CG2 4.1Å; L60-I75 HydrophobicContact CD1-CG2 4.41Å; L60-I75 HydrophobicContact CG-CG2 4.11Å; L63-I75 HydrophobicContact CB-CD1 3.82Å; L63-I75 WeakPolarHBondContact O-CD1 3.27Å; N64-I75 HydrophobicContact CB-CB 4.24Å; N64-I75 HydrophobicContact CB-CD1 4.36Å; N64-I75 HydrophobicContact CB-CG1 4.47Å; N64-I75 PolarHBondContact OD1-N 2.88Å; V73-I75 HydrophobicContact CG2-CD1 4.23Å; V73-I75 HydrophobicContact CG2-CG1 4.06Å
76	M	97.3	Very high	93.9	Very high	18 Å²	18	72.1 Å²	72.1	9%	0.089	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	159.4	173.8	-55.6	-177.6	-75.7	0	0	109.4	L4 Y5 S78 L117 S118	L4-M76 CarbonylContact C-O 3.59Å; L4-M76 WeakPolarHBondContact CA-O 3.41Å; Y5-M76 HydrophobicContact CD1-CB 4.48Å; Y5-M76 HydrophobicContact CD1-CE 3.14Å; Y5-M76 HydrophobicContact CE1-CE 3.26Å; Y5-M76 HydrophobicContact CG-CE 3.92Å; Y5-M76 PolarHBondContact N-O 3.3Å; Y5-M76 PolarHBondContact O-N 2.79Å; M76-S78 PolarHBondContact O-N 3.36Å; M76-L117 VanDerWaalsContact CG-O 3.24Å; M76-L117 WeakPolarHBondContact CG-O 3.48Å; M76-S118 WeakPolarHBondContact SD-CB 3.16Å; M76-S118 PolarHBondContact SD-OG 3.4Å
77	W	96.7	Very high	93.6	Very high	94 Å²	94	73.2 Å²	73.2	36%	0.356	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	136.5	161.9	-69.9	112.3	0	0	0	110	M1 L4 A56 K57 L60 Q79	M1-W77 HydrophobicContact CB-CE3 4.46Å; M1-W77 WeakPolarHBondContact O-CZ3 3.25Å; L4-W77 HydrophobicContact CD2-CD2 4.23Å; L4-W77 HydrophobicContact CD2-CE3 3.64Å; L4-W77 HydrophobicContact CD2-CH2 4.38Å; L4-W77 HydrophobicContact CD2-CZ3 3.72Å; A56-W77 HydrophobicContact CB-CH2 3.89Å; A56-W77 HydrophobicContact CB-CZ3 3.7Å; K57-W77 HydrophobicContact CB-CH2 4.04Å; K57-W77 HydrophobicContact CB-CZ2 3.99Å; K57-W77 HydrophobicContact CG-CZ2 4.42Å; L60-W77 HydrophobicContact CD1-CD2 4.16Å; L60-W77 HydrophobicContact CD1-CG 4.15Å; W77-Q79 PolarHBondContact O-N 3.12Å
78	S	96.3	Very high	93.3	Very high	7 Å²	7	69.3 Å²	69.3	5%	0.049	34%	0.344	C	S	.	.			trans	-65	102.3	177.9	169.1	0	0	0	0	110.4	M1 S3 M76	M1-S78 WeakPolarHBondContact CE-O 3.35Å; M1-S78 VanDerWaalsContact SD-O 3.41Å; S3-S78 VanDerWaalsContact O-CB 3.22Å; S3-S78 WeakPolarHBondContact O-CB 3.41Å; S3-S78 PolarHBondContact O-N 3.47Å; M76-S78 PolarHBondContact O-N 3.36Å
79	Q	90.9	Very high	93.1	Very high	106 Å²	106	72 Å²	72	50%	0.495	36%	0.361	S	S	.	.			trans	-106.9	108.5	172.8	-179	57	-77	0	0	110.1	W77 D81 R85	W77-Q79 PolarHBondContact O-N 3.12Å; Q79-D81 WeakPolarHBondContact CG-O 3.42Å; Q79-R85 PolarHBondContact O-NH1 3.15Å
80	R	86.8	Confident	93.1	Very high	220 Å²	220	67.8 Å²	67.8	83%	0.83	34%	0.343	S	S	*	.			trans	-71.8	-36.8	-178.7	-69.8	-171.9	179.8	-168.1	2.2	111.6	P82	R80-P82 VanDerWaalsContact O-CD 3.28Å; R80-P82 WeakPolarHBondContact O-CD 3.45Å
81	D	89.9	Confident	93.2	Very high	85 Å²	85	65.7 Å²	65.7	46%	0.455	32%	0.316	S	S	.	.			trans	-71.8	115.2	177.2	-174.6	-7.4	0	0	0	110.3	Q79 S83	Q79-D81 WeakPolarHBondContact CG-O 3.42Å; D81-S83 PolarHBondContact O-N 2.97Å; D81-S83 WeakPolarHBondContact OD1-CB 3.24Å; D81-S83 PolarHBondContact OD1-N 3.49Å; D81-S83 PolarHBondContact OD1-OG 3.04Å
82	P	89.5	Confident	93.4	Very high	44 Å²	44	59.8 Å²	59.8	29%	0.286	29%	0.294	S	S	.	.			trans	-77.1	-6.2	179.5	34.9	-37	0	0	0	113.3	R80 L84 R85 K86	R80-P82 VanDerWaalsContact O-CD 3.28Å; R80-P82 WeakPolarHBondContact O-CD 3.45Å; P82-L84 PolarHBondContact O-N 3.35Å; P82-R85 PolarHBondContact O-N 2.92Å; P82-K86 HydrophobicContact CB-CD 4.21Å; P82-K86 HydrophobicContact CB-CG 4.27Å; P82-K86 HydrophobicContact CG-CD 4.27Å; P82-K86 WeakPolarHBondContact O-CG 3.44Å; P82-K86 PolarHBondContact O-N 2.8Å
83	S	91.3	Very high	93.4	Very high	67 Å²	67	59.3 Å²	59.3	47%	0.469	29%	0.287	S	S	.	.	H	α-helix	trans	-54	-46.8	-169.3	-61	0	0	0	0	113	D81 R85 K86 S87	D81-S83 PolarHBondContact O-N 2.97Å; D81-S83 WeakPolarHBondContact OD1-CB 3.24Å; D81-S83 PolarHBondContact OD1-N 3.49Å; D81-S83 PolarHBondContact OD1-OG 3.04Å; S83-R85 PolarHBondContact O-N 2.98Å; S83-K86 PolarHBondContact O-N 3.27Å; S83-S87 WeakPolarHBondContact O-CB 3.26Å; S83-S87 PolarHBondContact O-N 3.08Å; S83-S87 PolarHBondContact O-OG 3.13Å
84	L	88.2	Confident	93.4	Very high	64 Å²	64	59.2 Å²	59.2	34%	0.335	29%	0.287	S	S	.	.	H	α-helix	trans	-63.9	-39.1	178.1	-175.7	61.9	0	0	0	112.5	P82 S87 G88 L117 H135	P82-L84 PolarHBondContact O-N 3.35Å; L84-S87 PolarHBondContact O-OG 3.27Å; L84-G88 PolarHBondContact O-N 3.41Å; L84-L117 HydrophobicContact CD2-CD1 3.39Å; L84-H135 PolarHBondContact O-CE1 3.42Å
85	R	88	Confident	93.4	Very high	122 Å²	122	63.4 Å²	63.4	46%	0.46	31%	0.306	S	S	.	.	H	α-helix	trans	-70	-36.1	176.5	-66.3	-165.8	-59.2	-88.2	-1.6	111.8	Q79 P82 S83	Q79-R85 PolarHBondContact O-NH1 3.15Å; P82-R85 PolarHBondContact O-N 2.92Å; S83-R85 PolarHBondContact O-N 2.98Å
86	K	87.5	Confident	93.3	Very high	169 Å²	169	66.7 Å²	66.7	74%	0.735	32%	0.323	S	S	*	.	H	α-helix	trans	-73.3	-37.8	180	-75.7	-177.3	175.2	-176.3	0	112.3	P82 S83 G88	P82-K86 HydrophobicContact CB-CD 4.21Å; P82-K86 HydrophobicContact CB-CG 4.27Å; P82-K86 HydrophobicContact CG-CD 4.27Å; P82-K86 WeakPolarHBondContact O-CG 3.44Å; P82-K86 PolarHBondContact O-N 2.8Å; S83-K86 PolarHBondContact O-N 3.27Å; K86-G88 VanDerWaalsContact C-N 3.31Å
87	S	91.4	Very high	93.2	Very high	70 Å²	70	66 Å²	66	49%	0.49	32%	0.32	S	S	.	.	H	α-helix	trans	-71.2	-27.9	179.6	69.4	0	0	0	0	112.6	S83 L84 V89	S83-S87 WeakPolarHBondContact O-CB 3.26Å; S83-S87 PolarHBondContact O-N 3.08Å; S83-S87 PolarHBondContact O-OG 3.13Å; L84-S87 PolarHBondContact O-OG 3.27Å; S87-V89 PolarHBondContact O-N 3.32Å; S87-V89 PolarHBondContact OG-N 3.03Å
88	G	90	Very high	93	Very high	11 Å²	11	61.7 Å²	61.7	11%	0.113	31%	0.305	C	S	.	.			trans	70	5.5	-176.1	0	0	0	0	0	113.9	L84 K86 G90 N91	L84-G88 PolarHBondContact O-N 3.41Å; K86-G88 VanDerWaalsContact C-N 3.31Å; G88-G90 PolarHBondContact O-N 3.05Å; G88-N91 WeakPolarHBondContact O-CB 3.38Å; G88-N91 PolarHBondContact O-N 3.34Å
89	V	93.7	Very high	92.9	Very high	70 Å²	70	69.3 Å²	69.3	42%	0.424	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	127.6	175.9	175.2	0	0	0	0	109	S87 N91 H135 Q139	S87-V89 PolarHBondContact O-N 3.32Å; S87-V89 PolarHBondContact OG-N 3.03Å; V89-N91 VanDerWaalsContact C-N 3.27Å; V89-H135 PolarHBondContact O-CD2 2.85Å; V89-H135 PolarHBondContact O-NE2 3.23Å; V89-Q139 HydrophobicContact CG1-CB 3.99Å; V89-Q139 HydrophobicContact CG1-CG 4.32Å
90	G	96.6	Very high	92.9	Very high	1 Å²	1	69.3 Å²	69.3	1%	0.01	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	1	-173.8	0	0	0	0	0	114.4	G88 F136	G88-G90 PolarHBondContact O-N 3.05Å; G90-F136 PolarHBondContact O-N 3.28Å
91	N	97.8	Very high	93.3	Very high	21 Å²	21	59.3 Å²	59.3	11%	0.112	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130.8	-179.1	-163.4	11.9	0	0	0	111.5	G88 V89 V134 H135 F164	G88-N91 WeakPolarHBondContact O-CB 3.38Å; G88-N91 PolarHBondContact O-N 3.34Å; V89-N91 VanDerWaalsContact C-N 3.27Å; N91-V134 PolarHBondContact OD1-O 3.3Å; N91-H135 HydrophobicContact CB-CB 4.31Å; N91-F164 HydrophobicContact CB-CB 3.69Å; N91-F164 HydrophobicContact CB-CD1 4.47Å; N91-F164 HydrophobicContact CB-CG 4.18Å; N91-F164 WeakPolarHBondContact ND2-CG 3.11Å; N91-F164 WeakPolarHBondContact O-CB 3.3Å; N91-F164 PolarHBondContact O-N 2.77Å
92	V	98	Very high	93.5	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	135.2	-176.2	178.9	0	0	0	0	108.9	I94 F133 V134 F136 A142 I146 V161 G162	V92-I94 HydrophobicContact CG1-CD1 4.11Å; V92-I94 HydrophobicContact CG1-CG1 4.33Å; V92-F133 VanDerWaalsContact O-CA 3.27Å; V92-F133 WeakPolarHBondContact O-CA 3.46Å; V92-V134 PolarHBondContact N-O 3.22Å; V92-V134 PolarHBondContact O-N 3.11Å; V92-F136 HydrophobicContact CG2-CD2 4.09Å; V92-F136 HydrophobicContact CG2-CE2 4.06Å; V92-A142 HydrophobicContact CG2-CB 3.52Å; V92-I146 HydrophobicContact CG1-CG1 4.14Å; V92-I146 HydrophobicContact CG2-CD1 4.3Å; V92-I146 HydrophobicContact CG2-CG1 4.28Å; V92-V161 HydrophobicContact CG1-CG1 3.26Å; V92-G162 CarbonylContact C-O 3.5Å; V92-G162 WeakPolarHBondContact CA-O 3.39Å; V92-G162 WeakPolarHBondContact CG1-O 3.38Å
93	F	97.8	Very high	93.9	Very high	36 Å²	36	58 Å²	58	16%	0.158	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.2	171.9	173.3	-113	0	0	0	109.9	K95 Y131 F133 F160 V161 G162	F93-K95 HydrophobicContact CE1-CB 3.71Å; F93-K95 HydrophobicContact CE1-CD 4.16Å; F93-K95 HydrophobicContact CE1-CG 4.31Å; F93-K95 HydrophobicContact CZ-CB 3.89Å; F93-K95 HydrophobicContact CZ-CD 4.33Å; F93-K95 HydrophobicContact CZ-CG 4.24Å; F93-Y131 AromaticContact CE2-CD2 3.68Å; F93-Y131 HydrophobicContact CE2-CD2 3.68Å; F93-Y131 AromaticContact CE2-CG 3.98Å; F93-Y131 HydrophobicContact CE2-CG 3.98Å; F93-Y131 HydrophobicContact CZ-CG 4.45Å; F93-F133 HydrophobicContact CB-CD1 4.42Å; F93-F133 HydrophobicContact CB-CE1 4.46Å; F93-F133 AromaticContact CD2-CD1 3.92Å; F93-F133 HydrophobicContact CD2-CD1 3.92Å; F93-F133 AromaticContact CD2-CE1 3.43Å; F93-F133 HydrophobicContact CD2-CE1 3.43Å; F93-F133 VanDerWaalsContact CD2-CE1 3.43Å; F93-F133 HydrophobicContact CD2-CZ 4.01Å; F93-F133 HydrophobicContact CE2-CE1 4.11Å; F93-F133 HydrophobicContact CE2-CZ 4.25Å; F93-F133 HydrophobicContact CG-CE1 4.36Å; F93-F160 HydrophobicContact CD1-CD1 4.36Å; F93-F160 HydrophobicContact CD1-CE1 4.22Å; F93-V161 WeakPolarHBondContact O-CA 3.3Å; F93-G162 PolarHBondContact N-O 3.39Å; F93-G162 PolarHBondContact O-N 3.43Å
94	I	97.9	Very high	94.1	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	128.2	178.6	-52.7	88.3	0	0	0	108.8	V92 L97 F110 Y131 G132 V134 I159 F160 V161	V92-I94 HydrophobicContact CG1-CD1 4.11Å; V92-I94 HydrophobicContact CG1-CG1 4.33Å; I94-L97 HydrophobicContact CG2-CD1 4.3Å; I94-L97 HydrophobicContact CG2-CD2 3.56Å; I94-L97 HydrophobicContact CG2-CG 3.92Å; I94-F110 HydrophobicContact CD1-CE1 4.44Å; I94-F110 HydrophobicContact CD1-CZ 4.29Å; I94-F110 HydrophobicContact CG1-CE1 4.12Å; I94-F110 HydrophobicContact CG1-CE2 4.15Å; I94-F110 HydrophobicContact CG1-CZ 3.63Å; I94-Y131 CarbonylContact O-C 3.56Å; I94-Y131 WeakPolarHBondContact O-CA 3.41Å; I94-Y131 VanDerWaalsContact O-CB 3.22Å; I94-Y131 WeakPolarHBondContact O-CB 3.09Å; I94-G132 PolarHBondContact N-O 2.65Å; I94-G132 PolarHBondContact O-N 3.07Å; I94-V134 HydrophobicContact CD1-CB 4.19Å; I94-V134 HydrophobicContact CD1-CG2 3.76Å; I94-I159 HydrophobicContact CG2-CB 4.42Å; I94-I159 HydrophobicContact CG2-CD1 4.23Å; I94-F160 CarbonylContact C-O 3.45Å; I94-F160 VanDerWaalsContact CA-O 3.3Å; I94-F160 WeakPolarHBondContact CA-O 3.29Å; I94-V161 HydrophobicContact CG1-CG1 4.41Å; I94-V161 HydrophobicContact CG1-CG2 4.37Å; I94-V161 HydrophobicContact CG2-CG2 4.26Å
95	K	97.1	Very high	94.5	Very high	124 Å²	124	59 Å²	59	54%	0.539	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	158.7	-179.3	-170.6	-178.1	175.4	-169.4	0	110.9	F93 L97 I159 F160	F93-K95 HydrophobicContact CE1-CB 3.71Å; F93-K95 HydrophobicContact CE1-CD 4.16Å; F93-K95 HydrophobicContact CE1-CG 4.31Å; F93-K95 HydrophobicContact CZ-CB 3.89Å; F93-K95 HydrophobicContact CZ-CD 4.33Å; F93-K95 HydrophobicContact CZ-CG 4.24Å; K95-L97 VanDerWaalsContact C-N 3.33Å; K95-I159 WeakPolarHBondContact O-CA 3.43Å; K95-F160 HydrophobicContact CB-CB 4.26Å; K95-F160 HydrophobicContact CB-CD1 4.3Å; K95-F160 PolarHBondContact N-O 3.27Å; K95-F160 PolarHBondContact O-N 3.04Å
96	N	96.8	Very high	94.9	Very high	71 Å²	71	53.2 Å²	53.2	38%	0.38	28%	0.275	S	S	.	.	S	Bend	trans	67	32.6	-177.8	-161.4	33	0	0	0	113.3	G130 K158	N96-G130 PolarHBondContact N-O 3.17Å; N96-K158 PolarHBondContact ND2-O 3.44Å
97	L	95.7	Very high	95.4	Very high	3 Å²	3	47.8 Å²	47.8	2%	0.016	25%	0.25	C	S	.	.			trans	-65.5	136.1	170.6	-65.5	177.3	0	0	0	109.8	I94 K95 I101 L106 V121 G130 I159	I94-L97 HydrophobicContact CG2-CD1 4.3Å; I94-L97 HydrophobicContact CG2-CD2 3.56Å; I94-L97 HydrophobicContact CG2-CG 3.92Å; K95-L97 VanDerWaalsContact C-N 3.33Å; L97-I101 HydrophobicContact CD2-CG2 4.29Å; L97-L106 HydrophobicContact CD1-CD1 4.32Å; L97-L106 HydrophobicContact CD1-CD2 4.36Å; L97-L106 HydrophobicContact CD2-CD1 4.38Å; L97-V121 HydrophobicContact CD1-CG2 4.31Å; L97-G130 PolarHBondContact N-O 2.84Å; L97-G130 WeakPolarHBondContact O-CA 3.46Å; L97-I159 HydrophobicContact CD2-CG2 4.22Å
98	G	92.7	Very high	95.6	Very high	5 Å²	5	48.9 Å²	48.9	5%	0.052	25%	0.25	C	S	.	.			trans	-64.3	153.3	168.9	0	0	0	0	0	111.3	T100 I101	G98-T100 PolarHBondContact O-N 2.76Å; G98-T100 VanDerWaalsContact O-N 3.08Å; G98-I101 PolarHBondContact O-N 2.65Å; G98-I101 VanDerWaalsContact O-N 3.08Å
99	K	92.4	Very high	95.9	Very high	167 Å²	167	50.8 Å²	50.8	73%	0.726	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-15	177.5	-66.6	-174.2	176.7	-175.9	0	113.6
100	T	92.8	Very high	96.1	Very high	106 Å²	106	47.5 Å²	47.5	65%	0.65	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-10	177.7	55.1	0	0	0	0	113.6	G98 N155	G98-T100 PolarHBondContact O-N 2.76Å; G98-T100 VanDerWaalsContact O-N 3.08Å; T100-N155 PolarHBondContact OG1-ND2 2.97Å
101	I	94	Very high	96.2	Very high	9 Å²	9	49.7 Å²	49.7	5%	0.046	25%	0.252	C	S	.	.			trans	-88.5	111.1	177.4	-57.6	-62.7	0	0	0	109.2	L97 G98 A105 L106 N155	L97-I101 HydrophobicContact CD2-CG2 4.29Å; G98-I101 PolarHBondContact O-N 2.65Å; G98-I101 VanDerWaalsContact O-N 3.08Å; I101-A105 HydrophobicContact CG2-CB 4.3Å; I101-L106 HydrophobicContact CG2-CB 4.17Å; I101-N155 WeakPolarHBondContact CD1-ND2 3.35Å
102	D	95.2	Very high	96.2	Very high	86 Å²	86	52.8 Å²	52.8	46%	0.46	28%	0.281	S	S	.	.			trans	-96.4	-176.6	174	73.2	4.8	0	0	0	112.2	K104 A105 L106	D102-K104 VanDerWaalsContact C-N 3.29Å; D102-K104 PolarHBondContact O-N 3Å; D102-K104 PolarHBondContact OD1-N 3.28Å; D102-A105 WeakPolarHBondContact OD1-CB 3.37Å; D102-A105 PolarHBondContact OD1-N 2.83Å; D102-L106 WeakPolarHBondContact O-CB 3.2Å; D102-L106 PolarHBondContact O-N 3.05Å
103	N	96.8	Very high	96.2	Very high	15 Å²	15	54.2 Å²	54.2	8%	0.08	29%	0.287	C	S	.	.	H	α-helix	trans	-61.3	-37.3	179.9	-59	-72.8	0	0	0	112.8	F65 P72 Y107 K120 V121	F65-N103 HydrophobicContact CB-CB 4.04Å; F65-N103 HydrophobicContact CD1-CB 3.28Å; F65-N103 HydrophobicContact CD2-CB 4.22Å; F65-N103 HydrophobicContact CE1-CB 3.7Å; F65-N103 HydrophobicContact CG-CB 3.56Å; F65-N103 HydrophobicContact CZ-CB 4.33Å; P72-N103 WeakPolarHBondContact CG-ND2 3.33Å; N103-Y107 VanDerWaalsContact O-CB 3.25Å; N103-Y107 WeakPolarHBondContact O-CB 3.45Å; N103-Y107 PolarHBondContact O-N 3.1Å; N103-K120 WeakPolarHBondContact OD1-CA 3.23Å; N103-V121 PolarHBondContact OD1-N 3.4Å
104	K	96.3	Very high	96.1	Very high	125 Å²	125	53.5 Å²	53.5	54%	0.543	29%	0.29	S	S	.	.	H	α-helix	trans	-72.5	-44.7	-176.7	-172.5	172.3	-176.6	171.4	0	110.7	F65 D102 Y107 N108	F65-K104 HydrophobicContact CD2-CB 4.12Å; D102-K104 VanDerWaalsContact C-N 3.29Å; D102-K104 PolarHBondContact O-N 3Å; D102-K104 PolarHBondContact OD1-N 3.28Å; K104-Y107 PolarHBondContact O-N 2.86Å; K104-N108 WeakPolarHBondContact O-CB 3.37Å; K104-N108 PolarHBondContact O-N 2.98Å; K104-N108 PolarHBondContact O-ND2 2.88Å; K104-N108 PolarHBondContact O-OD1 2.98Å
105	A	95.8	Very high	96.1	Very high	28 Å²	28	57.7 Å²	57.7	23%	0.231	31%	0.312	C	S	.	.	H	α-helix	trans	-60.3	-46.8	173.1	0	0	0	0	0	111.2	I101 D102 Y107 N108 I109	I101-A105 HydrophobicContact CG2-CB 4.3Å; D102-A105 WeakPolarHBondContact OD1-CB 3.37Å; D102-A105 PolarHBondContact OD1-N 2.83Å; A105-Y107 PolarHBondContact O-N 2.95Å; A105-N108 PolarHBondContact O-N 3.46Å; A105-I109 WeakPolarHBondContact O-CD1 3.46Å; A105-I109 VanDerWaalsContact O-CG1 3.27Å; A105-I109 WeakPolarHBondContact O-CG1 3.21Å; A105-I109 PolarHBondContact O-N 3.06Å; A105-I109 VanDerWaalsContact O-N 3.1Å
106	L	96.8	Very high	96.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.5	-44	177.3	-173.8	66.3	0	0	0	111.7	L97 I101 D102 F110 V121 V134	L97-L106 HydrophobicContact CD1-CD1 4.32Å; L97-L106 HydrophobicContact CD1-CD2 4.36Å; L97-L106 HydrophobicContact CD2-CD1 4.38Å; I101-L106 HydrophobicContact CG2-CB 4.17Å; D102-L106 WeakPolarHBondContact O-CB 3.2Å; D102-L106 PolarHBondContact O-N 3.05Å; L106-F110 HydrophobicContact CD1-CD2 3.65Å; L106-F110 HydrophobicContact CD1-CE2 3.56Å; L106-F110 HydrophobicContact CG-CD2 4.34Å; L106-F110 WeakPolarHBondContact O-CD2 3.15Å; L106-F110 PolarHBondContact O-N 2.81Å; L106-F110 VanDerWaalsContact O-N 3.12Å; L106-V121 HydrophobicContact CB-CG2 4.08Å; L106-V121 HydrophobicContact CD2-CG2 3.71Å; L106-V134 HydrophobicContact CD2-CG2 4.1Å; L106-V134 HydrophobicContact CG-CG2 4.04Å
107	Y	97.8	Very high	96	Very high	56 Å²	56	51.5 Å²	51.5	22%	0.22	29%	0.285	C	S	.	.	H	α-helix	trans	-59.9	-49.5	176.3	-178.4	-88.5	0	0	0	111.7	F65 N103 K104 A105 I109 F110 S111 I116 C119	F65-Y107 HydrophobicContact CE2-CD1 4.47Å; F65-Y107 AromaticContact CE2-CD2 3.98Å; F65-Y107 HydrophobicContact CE2-CD2 3.98Å; F65-Y107 AromaticContact CE2-CG 3.77Å; F65-Y107 HydrophobicContact CE2-CG 3.77Å; F65-Y107 AromaticContact CZ-CD2 3.91Å; F65-Y107 HydrophobicContact CZ-CD2 3.91Å; F65-Y107 HydrophobicContact CZ-CG 4.11Å; N103-Y107 VanDerWaalsContact O-CB 3.25Å; N103-Y107 WeakPolarHBondContact O-CB 3.45Å; N103-Y107 PolarHBondContact O-N 3.1Å; K104-Y107 PolarHBondContact O-N 2.86Å; A105-Y107 PolarHBondContact O-N 2.95Å; Y107-I109 VanDerWaalsContact C-N 3.32Å; Y107-I109 PolarHBondContact O-N 2.79Å; Y107-F110 PolarHBondContact O-N 2.8Å; Y107-S111 VanDerWaalsContact O-CB 3.24Å; Y107-S111 WeakPolarHBondContact O-CB 3.3Å; Y107-S111 PolarHBondContact O-N 3.24Å; Y107-S111 PolarHBondContact O-OG 2.91Å; Y107-I116 HydrophobicContact CD2-CB 4.19Å; Y107-I116 HydrophobicContact CD2-CD1 3.88Å; Y107-I116 HydrophobicContact CD2-CG2 3.98Å; Y107-I116 HydrophobicContact CE2-CB 3.73Å; Y107-I116 HydrophobicContact CE2-CD1 4.1Å; Y107-I116 HydrophobicContact CE2-CG1 4.46Å; Y107-I116 HydrophobicContact CE2-CG2 3.87Å; Y107-I116 HydrophobicContact CG-CD1 4.4Å; Y107-C119 HydrophobicContact CD2-CB 4.03Å
108	N	96.6	Very high	96.1	Very high	93 Å²	93	52.3 Å²	52.3	50%	0.497	29%	0.291	S	S	.	.	H	α-helix	trans	-60.2	-40.7	-178.2	-70.3	-11.6	0	0	0	112.6	K104 A105 S111	K104-N108 WeakPolarHBondContact O-CB 3.37Å; K104-N108 PolarHBondContact O-N 2.98Å; K104-N108 PolarHBondContact O-ND2 2.88Å; K104-N108 PolarHBondContact O-OD1 2.98Å; A105-N108 PolarHBondContact O-N 3.46Å; N108-S111 PolarHBondContact O-OG 2.82Å
109	I	95.9	Very high	96.3	Very high	51 Å²	51	52.1 Å²	52.1	26%	0.262	29%	0.289	S	S	.	.	H	α-helix	trans	-65.3	-49.6	178.1	-67.3	164.1	0	0	0	110.2	A105 Y107 M149 L154	A105-I109 WeakPolarHBondContact O-CD1 3.46Å; A105-I109 VanDerWaalsContact O-CG1 3.27Å; A105-I109 WeakPolarHBondContact O-CG1 3.21Å; A105-I109 PolarHBondContact O-N 3.06Å; A105-I109 VanDerWaalsContact O-N 3.1Å; Y107-I109 VanDerWaalsContact C-N 3.32Å; Y107-I109 PolarHBondContact O-N 2.79Å; I109-M149 HydrophobicContact CG2-CE 3.58Å; I109-L154 HydrophobicContact CD1-CD1 3.94Å; I109-L154 HydrophobicContact CD1-CD2 4.11Å
110	F	97.7	Very high	96.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-82.4	-18.1	-172.5	-79.7	-98.9	0	0	0	113.4	I94 L106 Y107 A112 F113 I116 V134 F136 A145 M149 V161	I94-F110 HydrophobicContact CD1-CE1 4.44Å; I94-F110 HydrophobicContact CD1-CZ 4.29Å; I94-F110 HydrophobicContact CG1-CE1 4.12Å; I94-F110 HydrophobicContact CG1-CE2 4.15Å; I94-F110 HydrophobicContact CG1-CZ 3.63Å; L106-F110 HydrophobicContact CD1-CD2 3.65Å; L106-F110 HydrophobicContact CD1-CE2 3.56Å; L106-F110 HydrophobicContact CG-CD2 4.34Å; L106-F110 WeakPolarHBondContact O-CD2 3.15Å; L106-F110 PolarHBondContact O-N 2.81Å; L106-F110 VanDerWaalsContact O-N 3.12Å; Y107-F110 PolarHBondContact O-N 2.8Å; F110-A112 PolarHBondContact O-N 3.35Å; F110-A112 VanDerWaalsContact O-N 3.13Å; F110-F113 HydrophobicContact CD1-CD2 4.29Å; F110-F113 HydrophobicContact CD1-CE2 4.5Å; F110-F113 WeakPolarHBondContact O-CD2 3.5Å; F110-F113 PolarHBondContact O-N 2.71Å; F110-F113 VanDerWaalsContact O-N 3.08Å; F110-I116 HydrophobicContact CB-CD1 3.99Å; F110-V134 HydrophobicContact CB-CG1 4.02Å; F110-V134 HydrophobicContact CB-CG2 4.08Å; F110-V134 HydrophobicContact CD1-CG2 4.35Å; F110-V134 HydrophobicContact CD2-CG2 4.35Å; F110-V134 HydrophobicContact CG-CG2 4Å; F110-F136 HydrophobicContact CB-CZ 4Å; F110-F136 HydrophobicContact CD1-CE2 4.3Å; F110-F136 HydrophobicContact CD1-CZ 4.05Å; F110-F136 VanDerWaalsContact O-CE1 3.26Å; F110-F136 WeakPolarHBondContact O-CE1 3.15Å; F110-F136 WeakPolarHBondContact O-CZ 3.35Å; F110-A145 HydrophobicContact CD1-CB 4.07Å; F110-A145 HydrophobicContact CE1-CB 4.2Å; F110-M149 HydrophobicContact CE1-CB 4.41Å; F110-M149 HydrophobicContact CE1-CG 4.32Å; F110-M149 HydrophobicContact CZ-CB 4.27Å; F110-M149 HydrophobicContact CZ-CG 4.34Å; F110-V161 HydrophobicContact CE1-CG1 4.06Å; F110-V161 HydrophobicContact CZ-CG1 4.37Å; F110-V161 HydrophobicContact CZ-CG2 4.11Å
111	S	97.5	Very high	96.7	Very high	47 Å²	47	42.8 Å²	42.8	33%	0.329	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-62.9	-20	178.3	56	0	0	0	0	113.1	Y107 N108 F113 G114	Y107-S111 VanDerWaalsContact O-CB 3.24Å; Y107-S111 WeakPolarHBondContact O-CB 3.3Å; Y107-S111 PolarHBondContact O-N 3.24Å; Y107-S111 PolarHBondContact O-OG 2.91Å; N108-S111 PolarHBondContact O-OG 2.82Å; S111-F113 PolarHBondContact O-N 3.39Å; S111-G114 PolarHBondContact O-N 2.86Å
112	A	97.8	Very high	96.8	Very high	86 Å²	86	42.9 Å²	42.9	71%	0.711	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-63.5	-25.1	174.6	0	0	0	0	0	113.4	F110	F110-A112 PolarHBondContact O-N 3.35Å; F110-A112 VanDerWaalsContact O-N 3.13Å
113	F	98	Very high	96.7	Very high	30 Å²	30	42.2 Å²	42.2	13%	0.132	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-85.7	-20.4	-177.4	-60.8	-75.9	0	0	0	113.5	F110 S111 F136 S141 R144 A145 V148 M149	F110-F113 HydrophobicContact CD1-CD2 4.29Å; F110-F113 HydrophobicContact CD1-CE2 4.5Å; F110-F113 WeakPolarHBondContact O-CD2 3.5Å; F110-F113 PolarHBondContact O-N 2.71Å; F110-F113 VanDerWaalsContact O-N 3.08Å; S111-F113 PolarHBondContact O-N 3.39Å; F113-F136 HydrophobicContact CB-CE1 3.96Å; F113-F136 HydrophobicContact CB-CZ 3.93Å; F113-F136 HydrophobicContact CD2-CZ 4.49Å; F113-S141 WeakPolarHBondContact O-CB 3.5Å; F113-S141 PolarHBondContact O-OG 2.86Å; F113-R144 HydrophobicContact CD1-CB 4.28Å; F113-R144 PolarHBondContact O-NH2 2.88Å; F113-A145 HydrophobicContact CB-CB 3.97Å; F113-A145 HydrophobicContact CD1-CB 4.12Å; F113-A145 HydrophobicContact CD2-CB 3.7Å; F113-A145 HydrophobicContact CE2-CB 4.27Å; F113-A145 HydrophobicContact CG-CB 3.64Å; F113-V148 HydrophobicContact CE1-CB 3.71Å; F113-V148 HydrophobicContact CE1-CG1 3.9Å; F113-V148 HydrophobicContact CE1-CG2 4.06Å; F113-V148 HydrophobicContact CZ-CB 4.05Å; F113-V148 HydrophobicContact CZ-CG1 3.95Å; F113-M149 HydrophobicContact CE1-CG 4.45Å; F113-M149 HydrophobicContact CE2-CG 3.5Å; F113-M149 VanDerWaalsContact CE2-CG 3.5Å; F113-M149 HydrophobicContact CE2-SD 4.02Å; F113-M149 HydrophobicContact CZ-CG 3.38Å; F113-M149 HydrophobicContact CZ-SD 3.76Å
114	G	97.5	Very high	96.2	Very high	21 Å²	21	45.4 Å²	45.4	22%	0.216	26%	0.26	C	S	.	.	S	Bend	trans	158.7	178.7	179.9	0	0	0	0	0	113	S111 I116	S111-G114 PolarHBondContact O-N 2.86Å; G114-I116 PolarHBondContact O-N 3.37Å
115	N	96.5	Very high	95.7	Very high	88 Å²	88	49.3 Å²	49.3	47%	0.471	28%	0.28	S	S	.	.			trans	-65.1	126	-179.8	-173.2	33.5	0	0	0	111.5	F136 Q137	N115-F136 WeakPolarHBondContact O-CA 3.43Å; N115-Q137 HydrophobicContact CB-CB 4.27Å; N115-Q137 PolarHBondContact ND2-OE1 2.64Å; N115-Q137 PolarHBondContact O-N 3.39Å
116	I	97.5	Very high	95.3	Very high	12 Å²	12	57.5 Å²	57.5	6%	0.062	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	122.7	-179.7	-66.8	174.2	0	0	0	109.2	Y107 F110 G114 S118 C119 V134 F136	Y107-I116 HydrophobicContact CD2-CB 4.19Å; Y107-I116 HydrophobicContact CD2-CD1 3.88Å; Y107-I116 HydrophobicContact CD2-CG2 3.98Å; Y107-I116 HydrophobicContact CE2-CB 3.73Å; Y107-I116 HydrophobicContact CE2-CD1 4.1Å; Y107-I116 HydrophobicContact CE2-CG1 4.46Å; Y107-I116 HydrophobicContact CE2-CG2 3.87Å; Y107-I116 HydrophobicContact CG-CD1 4.4Å; F110-I116 HydrophobicContact CB-CD1 3.99Å; G114-I116 PolarHBondContact O-N 3.37Å; I116-S118 VanDerWaalsContact CG2-C 3.49Å; I116-S118 VanDerWaalsContact CG2-O 3.3Å; I116-S118 WeakPolarHBondContact CG2-O 3.02Å; I116-C119 HydrophobicContact CG2-CB 4.01Å; I116-V134 HydrophobicContact CD1-CG1 3.7Å; I116-V134 HydrophobicContact CG1-CG1 3.78Å; I116-V134 HydrophobicContact CG2-CG1 4.1Å; I116-F136 HydrophobicContact CD1-CE1 4.3Å; I116-F136 HydrophobicContact CG1-CD1 3.92Å; I116-F136 HydrophobicContact CG1-CE1 3.7Å; I116-F136 HydrophobicContact CG1-CZ 4.45Å
117	L	95.9	Very high	94.9	Very high	53 Å²	53	58.6 Å²	58.6	28%	0.277	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	-35.5	172.4	-60.6	-179.4	0	0	0	112.2	M76 L84 H135 Q137	M76-L117 VanDerWaalsContact CG-O 3.24Å; M76-L117 WeakPolarHBondContact CG-O 3.48Å; L84-L117 HydrophobicContact CD2-CD1 3.39Å; L117-H135 WeakPolarHBondContact CB-O 3.44Å; L117-H135 PolarHBondContact N-O 3.42Å; L117-Q137 HydrophobicContact CD1-CB 4.33Å; L117-Q137 HydrophobicContact CD2-CB 3.93Å; L117-Q137 HydrophobicContact CD2-CG 4.18Å; L117-Q137 HydrophobicContact CG-CB 3.97Å
118	S	96.6	Very high	94.7	Very high	20 Å²	20	57.7 Å²	57.7	14%	0.14	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	141.1	178.7	-150.5	0	0	0	0	111	R74 M76 I116 H135	R74-S118 PolarHBondContact NH1-OG 2.8Å; M76-S118 WeakPolarHBondContact SD-CB 3.16Å; M76-S118 PolarHBondContact SD-OG 3.4Å; I116-S118 VanDerWaalsContact CG2-C 3.49Å; I116-S118 VanDerWaalsContact CG2-O 3.3Å; I116-S118 WeakPolarHBondContact CG2-O 3.02Å; S118-H135 PolarHBondContact N-O 2.8Å; S118-H135 PolarHBondContact O-N 3.14Å
119	C	97.1	Very high	94.6	Very high	2 Å²	2	58.3 Å²	58.3	1%	0.014	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	138.5	172.4	177	0	0	0	0	108.7	F65 R74 Y107 I116 F133 V134	F65-C119 HydrophobicContact CE1-CB 4.47Å; F65-C119 HydrophobicContact CZ-CB 4.04Å; R74-C119 WeakPolarHBondContact CD-O 3.32Å; Y107-C119 HydrophobicContact CD2-CB 4.03Å; I116-C119 HydrophobicContact CG2-CB 4.01Å; C119-F133 CarbonylContact C-O 3.58Å; C119-F133 WeakPolarHBondContact CA-O 3.16Å; C119-V134 HydrophobicContact CB-CG2 4.49Å
120	K	97.3	Very high	94.6	Very high	72 Å²	72	56.6 Å²	56.6	31%	0.313	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	126.4	177.3	-175.1	173	-174.2	164.8	0	112.2	D8 N103 G132 F133	D8-K120 IonicContact OD1-NZ 3.44Å; D8-K120 PolarHBondContact OD1-NZ 3.3Å; D8-K120 WeakPolarHBondContact OD2-CD 3.49Å; D8-K120 WeakPolarHBondContact OD2-CE 3.47Å; D8-K120 IonicContact OD2-NZ 3Å; D8-K120 PolarHBondContact OD2-NZ 2.75Å; N103-K120 WeakPolarHBondContact OD1-CA 3.23Å; K120-G132 CarbonylContact O-C 3.5Å; K120-G132 WeakPolarHBondContact O-CA 3.47Å; K120-F133 PolarHBondContact N-O 3.32Å; K120-F133 PolarHBondContact O-N 3.42Å
121	V	97.2	Very high	94.5	Very high	4 Å²	4	59.6 Å²	59.6	2%	0.024	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	129.3	158.5	176.9	0	0	0	0	108.2	L97 N103 L106 C123 P128	L97-V121 HydrophobicContact CD1-CG2 4.31Å; N103-V121 PolarHBondContact OD1-N 3.4Å; L106-V121 HydrophobicContact CB-CG2 4.08Å; L106-V121 HydrophobicContact CD2-CG2 3.71Å; V121-C123 PolarHBondContact O-N 3.01Å; V121-P128 HydrophobicContact CG1-CB 4.07Å
122	A	95.4	Very high	94.5	Very high	11 Å²	11	57.3 Å²	57.3	9%	0.091	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	124.1	176.6	0	0	0	0	0	109.8	K129 Y131	A122-K129 HydrophobicContact CB-CB 4.44Å; A122-K129 HydrophobicContact CB-CD 4.36Å; A122-K129 WeakPolarHBondContact O-CB 3.32Å; A122-K129 PolarHBondContact O-N 3.07Å; A122-Y131 HydrophobicContact CB-CD1 4.36Å; A122-Y131 HydrophobicContact CB-CD2 3.73Å; A122-Y131 HydrophobicContact CB-CE1 3.97Å; A122-Y131 HydrophobicContact CB-CE2 3.28Å; A122-Y131 HydrophobicContact CB-CG 4.26Å; A122-Y131 PolarHBondContact N-O 3.11Å
123	C	92	Very high	94.5	Very high	72 Å²	72	55.6 Å²	55.6	49%	0.486	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	148.8	175.4	-59.7	0	0	0	0	110.7	V121 G127	V121-C123 PolarHBondContact O-N 3.01Å; C123-G127 CarbonylContact C-O 3.6Å; C123-G127 VanDerWaalsContact CA-O 3.27Å; C123-G127 WeakPolarHBondContact CA-O 3.48Å
124	D	87.7	Confident	94.6	Very high	83 Å²	83	54.1 Å²	54.1	44%	0.444	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-170.5	162.6	61.9	29.5	0	0	0	109.8	K126 G127 K129	D124-K126 PolarHBondContact O-N 2.91Å; D124-K126 WeakPolarHBondContact OD1-CA 3.46Å; D124-K126 WeakPolarHBondContact OD1-CB 3.35Å; D124-K126 PolarHBondContact OD1-N 3.34Å; D124-G127 PolarHBondContact N-O 3.39Å; D124-G127 PolarHBondContact O-N 3.28Å; D124-G127 VanDerWaalsContact O-N 3.15Å; D124-G127 PolarHBondContact OD1-N 2.97Å; D124-G127 VanDerWaalsContact OD1-N 3.13Å; D124-K129 HydrophobicContact CB-CD 4.21Å; D124-K129 HydrophobicContact CB-CG 4.15Å
125	E	86.2	Confident	94.6	Very high	206 Å²	206	53.8 Å²	53.8	96%	0.963	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-23	178.6	-62.8	178	172.6	0	0	113.4
126	K	87.2	Confident	94.7	Very high	201 Å²	201	49.6 Å²	49.6	87%	0.874	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-5.4	179	-58.1	-179	-179.5	179.9	0	112.7	D124	D124-K126 PolarHBondContact O-N 2.91Å; D124-K126 WeakPolarHBondContact OD1-CA 3.46Å; D124-K126 WeakPolarHBondContact OD1-CB 3.35Å; D124-K126 PolarHBondContact OD1-N 3.34Å
127	G	88.1	Confident	94.5	Very high	22 Å²	22	54.1 Å²	54.1	23%	0.227	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	117.4	-155	178.1	0	0	0	0	0	113.8	C123 D124 K129	C123-G127 CarbonylContact C-O 3.6Å; C123-G127 VanDerWaalsContact CA-O 3.27Å; C123-G127 WeakPolarHBondContact CA-O 3.48Å; D124-G127 PolarHBondContact N-O 3.39Å; D124-G127 PolarHBondContact O-N 3.28Å; D124-G127 VanDerWaalsContact O-N 3.15Å; D124-G127 PolarHBondContact OD1-N 2.97Å; D124-G127 VanDerWaalsContact OD1-N 3.13Å; G127-K129 PolarHBondContact O-N 2.78Å
128	P	92.7	Very high	94.5	Very high	38 Å²	38	57.8 Å²	57.8	25%	0.247	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	131.3	-176	-25.6	36.3	0	0	0	113.2	V121 G130	V121-P128 HydrophobicContact CG1-CB 4.07Å; P128-G130 PolarHBondContact O-N 3.43Å
129	K	94.9	Very high	94.6	Very high	105 Å²	105	58.8 Å²	58.8	46%	0.457	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	1	179.2	-60.1	-176.6	70.8	-173.7	0	113.8	A122 D124 G127 Y131	A122-K129 HydrophobicContact CB-CB 4.44Å; A122-K129 HydrophobicContact CB-CD 4.36Å; A122-K129 WeakPolarHBondContact O-CB 3.32Å; A122-K129 PolarHBondContact O-N 3.07Å; D124-K129 HydrophobicContact CB-CD 4.21Å; D124-K129 HydrophobicContact CB-CG 4.15Å; G127-K129 PolarHBondContact O-N 2.78Å; K129-Y131 HydrophobicContact CB-CD1 3.84Å; K129-Y131 HydrophobicContact CB-CE1 3.54Å; K129-Y131 HydrophobicContact CD-CE1 3.97Å; K129-Y131 HydrophobicContact CG-CE1 4.4Å; K129-Y131 PolarHBondContact NZ-OH 3.4Å; K129-Y131 VanDerWaalsContact NZ-OH 3.15Å
130	G	95.1	Very high	94.6	Very high	15 Å²	15	63.6 Å²	63.6	16%	0.155	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	77.9	18.5	179.9	0	0	0	0	0	115.2	N96 L97 P128	N96-G130 PolarHBondContact N-O 3.17Å; L97-G130 PolarHBondContact N-O 2.84Å; L97-G130 WeakPolarHBondContact O-CA 3.46Å; P128-G130 PolarHBondContact O-N 3.43Å
131	Y	97	Very high	94.6	Very high	63 Å²	63	60.4 Å²	60.4	25%	0.247	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	160.6	171.4	69.7	-90.4	0	0	0	111.9	F93 I94 A122 K129 F133	F93-Y131 AromaticContact CE2-CD2 3.68Å; F93-Y131 HydrophobicContact CE2-CD2 3.68Å; F93-Y131 AromaticContact CE2-CG 3.98Å; F93-Y131 HydrophobicContact CE2-CG 3.98Å; F93-Y131 HydrophobicContact CZ-CG 4.45Å; I94-Y131 CarbonylContact O-C 3.56Å; I94-Y131 WeakPolarHBondContact O-CA 3.41Å; I94-Y131 VanDerWaalsContact O-CB 3.22Å; I94-Y131 WeakPolarHBondContact O-CB 3.09Å; A122-Y131 HydrophobicContact CB-CD1 4.36Å; A122-Y131 HydrophobicContact CB-CD2 3.73Å; A122-Y131 HydrophobicContact CB-CE1 3.97Å; A122-Y131 HydrophobicContact CB-CE2 3.28Å; A122-Y131 HydrophobicContact CB-CG 4.26Å; A122-Y131 PolarHBondContact N-O 3.11Å; K129-Y131 HydrophobicContact CB-CD1 3.84Å; K129-Y131 HydrophobicContact CB-CE1 3.54Å; K129-Y131 HydrophobicContact CD-CE1 3.97Å; K129-Y131 HydrophobicContact CG-CE1 4.4Å; K129-Y131 PolarHBondContact NZ-OH 3.4Å; K129-Y131 VanDerWaalsContact NZ-OH 3.15Å; Y131-F133 AromaticContact CD2-CE2 3.93Å; Y131-F133 HydrophobicContact CD2-CE2 3.93Å; Y131-F133 HydrophobicContact CD2-CZ 4.02Å; Y131-F133 AromaticContact CE2-CE2 3.72Å; Y131-F133 HydrophobicContact CE2-CE2 3.72Å; Y131-F133 AromaticContact CE2-CZ 3.87Å; Y131-F133 HydrophobicContact CE2-CZ 3.87Å
132	G	97.6	Very high	94.7	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	178.7	179.7	0	0	0	0	0	112.7	I94 K120	I94-G132 PolarHBondContact N-O 2.65Å; I94-G132 PolarHBondContact O-N 3.07Å; K120-G132 CarbonylContact O-C 3.5Å; K120-G132 WeakPolarHBondContact O-CA 3.47Å
133	F	97.8	Very high	94.8	Very high	49 Å²	49	62.7 Å²	62.7	22%	0.215	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	139.5	-179.2	-53.6	-84.6	0	0	0	109.9	V92 F93 C119 K120 Y131 F164	V92-F133 VanDerWaalsContact O-CA 3.27Å; V92-F133 WeakPolarHBondContact O-CA 3.46Å; F93-F133 HydrophobicContact CB-CD1 4.42Å; F93-F133 HydrophobicContact CB-CE1 4.46Å; F93-F133 AromaticContact CD2-CD1 3.92Å; F93-F133 HydrophobicContact CD2-CD1 3.92Å; F93-F133 AromaticContact CD2-CE1 3.43Å; F93-F133 HydrophobicContact CD2-CE1 3.43Å; F93-F133 VanDerWaalsContact CD2-CE1 3.43Å; F93-F133 HydrophobicContact CD2-CZ 4.01Å; F93-F133 HydrophobicContact CE2-CE1 4.11Å; F93-F133 HydrophobicContact CE2-CZ 4.25Å; F93-F133 HydrophobicContact CG-CE1 4.36Å; C119-F133 CarbonylContact C-O 3.58Å; C119-F133 WeakPolarHBondContact CA-O 3.16Å; K120-F133 PolarHBondContact N-O 3.32Å; K120-F133 PolarHBondContact O-N 3.42Å; Y131-F133 AromaticContact CD2-CE2 3.93Å; Y131-F133 HydrophobicContact CD2-CE2 3.93Å; Y131-F133 HydrophobicContact CD2-CZ 4.02Å; Y131-F133 AromaticContact CE2-CE2 3.72Å; Y131-F133 HydrophobicContact CE2-CE2 3.72Å; Y131-F133 AromaticContact CE2-CZ 3.87Å; Y131-F133 HydrophobicContact CE2-CZ 3.87Å; F133-F164 AromaticContact CD1-CD2 3.61Å; F133-F164 HydrophobicContact CD1-CD2 3.61Å; F133-F164 AromaticContact CD1-CE2 3.93Å; F133-F164 HydrophobicContact CD1-CE2 3.93Å; F133-F164 AromaticContact CE1-CD2 3.59Å; F133-F164 HydrophobicContact CE1-CD2 3.59Å; F133-F164 AromaticContact CE1-CE2 3.61Å; F133-F164 HydrophobicContact CE1-CE2 3.61Å; F133-F164 HydrophobicContact CZ-CE2 4.47Å
134	V	98.3	Very high	95.1	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	117.7	171.9	179.1	0	0	0	0	108.3	N91 V92 I94 L106 F110 I116 C119 F136	N91-V134 PolarHBondContact OD1-O 3.3Å; V92-V134 PolarHBondContact N-O 3.22Å; V92-V134 PolarHBondContact O-N 3.11Å; I94-V134 HydrophobicContact CD1-CB 4.19Å; I94-V134 HydrophobicContact CD1-CG2 3.76Å; L106-V134 HydrophobicContact CD2-CG2 4.1Å; L106-V134 HydrophobicContact CG-CG2 4.04Å; F110-V134 HydrophobicContact CB-CG1 4.02Å; F110-V134 HydrophobicContact CB-CG2 4.08Å; F110-V134 HydrophobicContact CD1-CG2 4.35Å; F110-V134 HydrophobicContact CD2-CG2 4.35Å; F110-V134 HydrophobicContact CG-CG2 4Å; I116-V134 HydrophobicContact CD1-CG1 3.7Å; I116-V134 HydrophobicContact CG1-CG1 3.78Å; I116-V134 HydrophobicContact CG2-CG1 4.1Å; C119-V134 HydrophobicContact CB-CG2 4.49Å; V134-F136 HydrophobicContact CB-CE2 4.33Å; V134-F136 HydrophobicContact CG1-CD2 4.08Å; V134-F136 HydrophobicContact CG1-CE1 4.21Å; V134-F136 HydrophobicContact CG1-CE2 3.64Å; V134-F136 HydrophobicContact CG1-CZ 3.73Å
135	H	97.9	Very high	95.6	Very high	13 Å²	13	60.8 Å²	60.8	6%	0.06	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	105.4	178.1	-163.8	170.3	0	0	0	109.7	L84 V89 N91 L117 S118	L84-H135 PolarHBondContact O-CE1 3.42Å; V89-H135 PolarHBondContact O-CD2 2.85Å; V89-H135 PolarHBondContact O-NE2 3.23Å; N91-H135 HydrophobicContact CB-CB 4.31Å; L117-H135 WeakPolarHBondContact CB-O 3.44Å; L117-H135 PolarHBondContact N-O 3.42Å; S118-H135 PolarHBondContact N-O 2.8Å; S118-H135 PolarHBondContact O-N 3.14Å
136	F	98.1	Very high	96.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	153	174.4	-68.3	-79.4	0	0	0	111.9	G90 V92 F110 F113 N115 I116 V134 K138 A142 A145	G90-F136 PolarHBondContact O-N 3.28Å; V92-F136 HydrophobicContact CG2-CD2 4.09Å; V92-F136 HydrophobicContact CG2-CE2 4.06Å; F110-F136 HydrophobicContact CB-CZ 4Å; F110-F136 HydrophobicContact CD1-CE2 4.3Å; F110-F136 HydrophobicContact CD1-CZ 4.05Å; F110-F136 VanDerWaalsContact O-CE1 3.26Å; F110-F136 WeakPolarHBondContact O-CE1 3.15Å; F110-F136 WeakPolarHBondContact O-CZ 3.35Å; F113-F136 HydrophobicContact CB-CE1 3.96Å; F113-F136 HydrophobicContact CB-CZ 3.93Å; F113-F136 HydrophobicContact CD2-CZ 4.49Å; N115-F136 WeakPolarHBondContact O-CA 3.43Å; I116-F136 HydrophobicContact CD1-CE1 4.3Å; I116-F136 HydrophobicContact CG1-CD1 3.92Å; I116-F136 HydrophobicContact CG1-CE1 3.7Å; I116-F136 HydrophobicContact CG1-CZ 4.45Å; V134-F136 HydrophobicContact CB-CE2 4.33Å; V134-F136 HydrophobicContact CG1-CD2 4.08Å; V134-F136 HydrophobicContact CG1-CE1 4.21Å; V134-F136 HydrophobicContact CG1-CE2 3.64Å; V134-F136 HydrophobicContact CG1-CZ 3.73Å; F136-K138 PolarHBondContact O-N 3.35Å; F136-A142 HydrophobicContact CD2-CB 3.88Å; F136-A145 HydrophobicContact CE2-CB 3.79Å; F136-A145 HydrophobicContact CZ-CB 3.96Å
137	Q	95.1	Very high	96.7	Very high	108 Å²	108	48.7 Å²	48.7	51%	0.505	24%	0.235	S	C	.	.	S	Bend	trans	-65.8	-30.2	172.4	-174.9	177.3	3.5	0	0	112.4	N115 L117	N115-Q137 HydrophobicContact CB-CB 4.27Å; N115-Q137 PolarHBondContact ND2-OE1 2.64Å; N115-Q137 PolarHBondContact O-N 3.39Å; L117-Q137 HydrophobicContact CD1-CB 4.33Å; L117-Q137 HydrophobicContact CD2-CB 3.93Å; L117-Q137 HydrophobicContact CD2-CG 4.18Å; L117-Q137 HydrophobicContact CG-CB 3.97Å
138	K	96.1	Very high	97.2	Very high	129 Å²	129	51.7 Å²	51.7	56%	0.561	25%	0.249	S	C	*	.	S	Bend	trans	-121.6	134.6	-173.5	-77.3	-169.7	-177.6	-172.4	0	110.5	F136 E140 S141 A142	F136-K138 PolarHBondContact O-N 3.35Å; K138-E140 VanDerWaalsContact C-N 3.27Å; K138-E140 WeakPolarHBondContact CB-OE2 3.36Å; K138-E140 PolarHBondContact O-N 3.19Å; K138-S141 WeakPolarHBondContact O-CB 3.24Å; K138-S141 PolarHBondContact O-N 3.15Å; K138-S141 VanDerWaalsContact O-N 3.14Å; K138-A142 PolarHBondContact O-N 2.94Å
139	Q	96.7	Very high	97.4	Very high	42 Å²	42	50.9 Å²	50.9	20%	0.196	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-37.8	178.7	177.6	55.4	45.9	0	0	111.6	V89 S141 A142 E143	V89-Q139 HydrophobicContact CG1-CB 3.99Å; V89-Q139 HydrophobicContact CG1-CG 4.32Å; Q139-S141 PolarHBondContact O-N 3.34Å; Q139-A142 WeakPolarHBondContact O-CB 3.37Å; Q139-A142 PolarHBondContact O-N 3.08Å; Q139-A142 VanDerWaalsContact O-N 3.11Å; Q139-E143 WeakPolarHBondContact CG-OE1 3.29Å; Q139-E143 PolarHBondContact NE2-OE1 3.36Å; Q139-E143 PolarHBondContact O-N 3.39Å
140	E	98	Very high	97.5	Very high	102 Å²	102	49.4 Å²	49.4	48%	0.477	24%	0.239	S	C	.	.	H	α-helix	trans	-64.9	-29.5	179.1	-52.3	81.2	178.8	0	0	111.6	K138 R144	K138-E140 VanDerWaalsContact C-N 3.27Å; K138-E140 WeakPolarHBondContact CB-OE2 3.36Å; K138-E140 PolarHBondContact O-N 3.19Å; E140-R144 WeakPolarHBondContact O-CG 3.25Å; E140-R144 PolarHBondContact O-N 2.85Å; E140-R144 PolarHBondContact O-NH1 2.83Å; E140-R144 VanDerWaalsContact O-NH1 3.17Å
141	S	98.2	Very high	97.6	Very high	5 Å²	5	49.8 Å²	49.8	4%	0.035	24%	0.243	C	C	.	.	H	α-helix	trans	-73.1	-36.6	176.6	-51.1	0	0	0	0	111.3	F113 K138 Q139 R144 A145	F113-S141 WeakPolarHBondContact O-CB 3.5Å; F113-S141 PolarHBondContact O-OG 2.86Å; K138-S141 WeakPolarHBondContact O-CB 3.24Å; K138-S141 PolarHBondContact O-N 3.15Å; K138-S141 VanDerWaalsContact O-N 3.14Å; Q139-S141 PolarHBondContact O-N 3.34Å; S141-R144 PolarHBondContact OG-NH2 2.93Å; S141-A145 WeakPolarHBondContact O-CB 3.23Å; S141-A145 PolarHBondContact O-N 2.74Å
142	A	98.3	Very high	97.5	Very high	2 Å²	2	51.4 Å²	51.4	2%	0.017	25%	0.254	C	S	.	.	H	α-helix	trans	-65.2	-41.9	173	0	0	0	0	0	111.8	V92 F136 K138 Q139 A145 I146	V92-A142 HydrophobicContact CG2-CB 3.52Å; F136-A142 HydrophobicContact CD2-CB 3.88Å; K138-A142 PolarHBondContact O-N 2.94Å; Q139-A142 WeakPolarHBondContact O-CB 3.37Å; Q139-A142 PolarHBondContact O-N 3.08Å; Q139-A142 VanDerWaalsContact O-N 3.11Å; A142-A145 PolarHBondContact O-N 3.36Å; A142-I146 WeakPolarHBondContact O-CD1 3.4Å; A142-I146 VanDerWaalsContact O-CG1 3.28Å; A142-I146 WeakPolarHBondContact O-CG1 3.21Å; A142-I146 PolarHBondContact O-N 3.47Å
143	E	98.2	Very high	97.3	Very high	61 Å²	61	57.8 Å²	57.8	29%	0.285	28%	0.282	S	S	.	.	H	α-helix	trans	-62.5	-51.3	176.8	-76.3	161.8	-173.8	0	0	111.8	Q139 A145 I146 D147 R163	Q139-E143 WeakPolarHBondContact CG-OE1 3.29Å; Q139-E143 PolarHBondContact NE2-OE1 3.36Å; Q139-E143 PolarHBondContact O-N 3.39Å; E143-A145 VanDerWaalsContact C-N 3.27Å; E143-A145 PolarHBondContact O-N 3.08Å; E143-I146 WeakPolarHBondContact O-CB 3.43Å; E143-I146 PolarHBondContact O-N 2.9Å; E143-D147 VanDerWaalsContact O-CG 3.3Å; E143-D147 PolarHBondContact O-N 3.35Å; E143-R163 VanDerWaalsContact CD-NH2 3.35Å; E143-R163 VanDerWaalsContact CG-NH2 3.31Å; E143-R163 IonicContact OE1-CZ 2.65Å; E143-R163 IonicContact OE1-NH1 2.98Å; E143-R163 PolarHBondContact OE1-NH1 2.74Å; E143-R163 IonicContact OE1-NH2 3.88Å; E143-R163 PolarHBondContact OE1-NH2 3.46Å
144	R	98.4	Very high	96.9	Very high	116 Å²	116	56.7 Å²	56.7	44%	0.438	28%	0.278	S	S	.	.	H	α-helix	trans	-56.6	-41.2	174.3	-71.6	-169.3	-54.8	-81.3	-1	112.6	F113 E140 S141 I146 D147 V148	F113-R144 HydrophobicContact CD1-CB 4.28Å; F113-R144 PolarHBondContact O-NH2 2.88Å; E140-R144 WeakPolarHBondContact O-CG 3.25Å; E140-R144 PolarHBondContact O-N 2.85Å; E140-R144 PolarHBondContact O-NH1 2.83Å; E140-R144 VanDerWaalsContact O-NH1 3.17Å; S141-R144 PolarHBondContact OG-NH2 2.93Å; R144-I146 VanDerWaalsContact C-N 3.33Å; R144-I146 PolarHBondContact O-N 3.35Å; R144-D147 PolarHBondContact O-N 2.87Å; R144-V148 WeakPolarHBondContact O-CB 3.45Å; R144-V148 VanDerWaalsContact O-CG2 3.32Å; R144-V148 WeakPolarHBondContact O-CG2 3.45Å; R144-V148 PolarHBondContact O-N 3.43Å
145	A	98.4	Very high	96.5	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63.2	-39.8	177.3	0	0	0	0	0	111.9	F110 F113 F136 S141 A142 E143 M149	F110-A145 HydrophobicContact CD1-CB 4.07Å; F110-A145 HydrophobicContact CE1-CB 4.2Å; F113-A145 HydrophobicContact CB-CB 3.97Å; F113-A145 HydrophobicContact CD1-CB 4.12Å; F113-A145 HydrophobicContact CD2-CB 3.7Å; F113-A145 HydrophobicContact CE2-CB 4.27Å; F113-A145 HydrophobicContact CG-CB 3.64Å; F136-A145 HydrophobicContact CE2-CB 3.79Å; F136-A145 HydrophobicContact CZ-CB 3.96Å; S141-A145 WeakPolarHBondContact O-CB 3.23Å; S141-A145 PolarHBondContact O-N 2.74Å; A142-A145 PolarHBondContact O-N 3.36Å; E143-A145 VanDerWaalsContact C-N 3.27Å; E143-A145 PolarHBondContact O-N 3.08Å; A145-M149 WeakPolarHBondContact O-CB 3.43Å; A145-M149 WeakPolarHBondContact O-CG 3.39Å; A145-M149 PolarHBondContact O-N 3.14Å
146	I	98.3	Very high	96.1	Very high	24 Å²	24	70.9 Å²	70.9	12%	0.123	34%	0.339	C	S	.	.	H	α-helix	trans	-64.3	-51.3	175.2	-69.7	161.6	0	0	0	110.1	V92 A142 E143 R144 V148 N150 V161 R163	V92-I146 HydrophobicContact CG1-CG1 4.14Å; V92-I146 HydrophobicContact CG2-CD1 4.3Å; V92-I146 HydrophobicContact CG2-CG1 4.28Å; A142-I146 WeakPolarHBondContact O-CD1 3.4Å; A142-I146 VanDerWaalsContact O-CG1 3.28Å; A142-I146 WeakPolarHBondContact O-CG1 3.21Å; A142-I146 PolarHBondContact O-N 3.47Å; E143-I146 WeakPolarHBondContact O-CB 3.43Å; E143-I146 PolarHBondContact O-N 2.9Å; R144-I146 VanDerWaalsContact C-N 3.33Å; R144-I146 PolarHBondContact O-N 3.35Å; I146-V148 VanDerWaalsContact C-N 3.29Å; I146-V148 PolarHBondContact O-N 3.31Å; I146-N150 WeakPolarHBondContact O-CB 3.35Å; I146-N150 PolarHBondContact O-N 3.14Å; I146-V161 HydrophobicContact CG1-CG1 3.98Å; I146-R163 HydrophobicContact CD1-CG 3.71Å
147	D	97.9	Very high	95.8	Very high	129 Å²	129	76.7 Å²	76.7	69%	0.69	36%	0.361	S	S	*	.	H	α-helix	trans	-61	-39	-175.1	-64.4	-20.4	0	0	0	112.2	E143 R144	E143-D147 VanDerWaalsContact O-CG 3.3Å; E143-D147 PolarHBondContact O-N 3.35Å; R144-D147 PolarHBondContact O-N 2.87Å
148	V	97.5	Very high	95.9	Very high	85 Å²	85	77.5 Å²	77.5	52%	0.515	36%	0.363	S	S	.	.	H	α-helix	trans	-85.2	-40.1	-177.4	176.7	0	0	0	0	112.6	F113 R144 I146 M152	F113-V148 HydrophobicContact CE1-CB 3.71Å; F113-V148 HydrophobicContact CE1-CG1 3.9Å; F113-V148 HydrophobicContact CE1-CG2 4.06Å; F113-V148 HydrophobicContact CZ-CB 4.05Å; F113-V148 HydrophobicContact CZ-CG1 3.95Å; R144-V148 WeakPolarHBondContact O-CB 3.45Å; R144-V148 VanDerWaalsContact O-CG2 3.32Å; R144-V148 WeakPolarHBondContact O-CG2 3.45Å; R144-V148 PolarHBondContact O-N 3.43Å; I146-V148 VanDerWaalsContact C-N 3.29Å; I146-V148 PolarHBondContact O-N 3.31Å; V148-M152 WeakPolarHBondContact O-CG 2.82Å
149	M	97.4	Very high	95.9	Very high	20 Å²	20	71.5 Å²	71.5	10%	0.099	34%	0.337	C	S	.	.	H	α-helix	trans	-97.8	-17.9	-169.6	-61.1	-65.3	-65	0	0	114	I109 F110 F113 A145 G151 M152 L154 I159 V161	I109-M149 HydrophobicContact CG2-CE 3.58Å; F110-M149 HydrophobicContact CE1-CB 4.41Å; F110-M149 HydrophobicContact CE1-CG 4.32Å; F110-M149 HydrophobicContact CZ-CB 4.27Å; F110-M149 HydrophobicContact CZ-CG 4.34Å; F113-M149 HydrophobicContact CE1-CG 4.45Å; F113-M149 HydrophobicContact CE2-CG 3.5Å; F113-M149 VanDerWaalsContact CE2-CG 3.5Å; F113-M149 HydrophobicContact CE2-SD 4.02Å; F113-M149 HydrophobicContact CZ-CG 3.38Å; F113-M149 HydrophobicContact CZ-SD 3.76Å; A145-M149 WeakPolarHBondContact O-CB 3.43Å; A145-M149 WeakPolarHBondContact O-CG 3.39Å; A145-M149 PolarHBondContact O-N 3.14Å; M149-G151 PolarHBondContact O-N 3.17Å; M149-M152 WeakPolarHBondContact O-CB 3.45Å; M149-M152 PolarHBondContact O-N 2.96Å; M149-M152 VanDerWaalsContact O-N 3.11Å; M149-L154 HydrophobicContact CE-CD1 4.37Å; M149-L154 HydrophobicContact CE-CD2 4.11Å; M149-L154 HydrophobicContact CE-CG 4.44Å; M149-I159 HydrophobicContact CB-CD1 4.39Å; M149-I159 HydrophobicContact CE-CD1 4.21Å; M149-I159 WeakPolarHBondContact O-CG1 3.36Å; M149-V161 HydrophobicContact CB-CB 4.47Å; M149-V161 HydrophobicContact CB-CG2 3.82Å
150	N	97.8	Very high	96	Very high	75 Å²	75	74.4 Å²	74.4	40%	0.401	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	122.7	-179.8	-175	38.8	0	0	0	110.6	I146 M152 F160 V161	I146-N150 WeakPolarHBondContact O-CB 3.35Å; I146-N150 PolarHBondContact O-N 3.14Å; N150-M152 VanDerWaalsContact C-N 3.3Å; N150-F160 WeakPolarHBondContact OD1-CD2 3.18Å; N150-V161 HydrophobicContact CB-CB 4.03Å; N150-V161 WeakPolarHBondContact CB-O 3.15Å; N150-V161 VanDerWaalsContact CG-O 3.23Å; N150-V161 PolarHBondContact OD1-N 3.14Å; N150-V161 PolarHBondContact OD1-O 2.92Å
151	G	96.4	Very high	96	Very high	23 Å²	23	69.6 Å²	69.6	24%	0.237	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	2.5	-177.2	0	0	0	0	0	115	M149 K158 I159	M149-G151 PolarHBondContact O-N 3.17Å; G151-K158 VanDerWaalsContact O-CE 3.27Å; G151-K158 WeakPolarHBondContact O-CE 3.22Å; G151-K158 WeakPolarHBondContact O-CG 3.27Å; G151-I159 VanDerWaalsContact CA-O 3.28Å; G151-I159 WeakPolarHBondContact CA-O 3.48Å; G151-I159 PolarHBondContact N-O 2.98Å
152	M	95.4	Very high	96	Very high	97 Å²	97	69.7 Å²	69.7	48%	0.478	33%	0.329	S	S	.	.			trans	-73.5	158.3	172.8	-71.3	-57.6	-55.3	0	0	112	V148 M149 N150 K158 I159	V148-M152 WeakPolarHBondContact O-CG 2.82Å; M149-M152 WeakPolarHBondContact O-CB 3.45Å; M149-M152 PolarHBondContact O-N 2.96Å; M149-M152 VanDerWaalsContact O-N 3.11Å; N150-M152 VanDerWaalsContact C-N 3.3Å; M152-K158 CarbonylContact O-C 3.59Å; M152-K158 WeakPolarHBondContact O-CA 3.45Å; M152-I159 WeakPolarHBondContact O-CG1 3.39Å; M152-I159 PolarHBondContact O-N 2.87Å
153	F	92.5	Very high	95.9	Very high	133 Å²	133	76.1 Å²	76.1	58%	0.583	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	121.5	174.5	-73.2	-95.7	0	0	0	110.9	R157 K158	F153-R157 CarbonylContact C-O 3.59Å; F153-R157 WeakPolarHBondContact CA-O 3.42Å; F153-K158 HydrophobicContact CD1-CB 4.28Å; F153-K158 HydrophobicContact CE1-CB 3.95Å; F153-K158 HydrophobicContact CZ-CB 4.11Å
154	L	90.1	Very high	95.8	Very high	26 Å²	26	76.1 Å²	76.1	14%	0.136	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	120.7	165.7	-67.8	-174.6	0	0	0	108.7	I109 M149 Y156 R157 I159	I109-L154 HydrophobicContact CD1-CD1 3.94Å; I109-L154 HydrophobicContact CD1-CD2 4.11Å; M149-L154 HydrophobicContact CE-CD1 4.37Å; M149-L154 HydrophobicContact CE-CD2 4.11Å; M149-L154 HydrophobicContact CE-CG 4.44Å; L154-Y156 VanDerWaalsContact C-N 3.34Å; L154-Y156 PolarHBondContact O-N 2.97Å; L154-R157 PolarHBondContact N-O 3.41Å; L154-R157 PolarHBondContact O-N 3.42Å; L154-R157 VanDerWaalsContact O-N 3.08Å; L154-I159 HydrophobicContact CB-CG2 3.96Å; L154-I159 HydrophobicContact CD1-CD1 3.68Å; L154-I159 HydrophobicContact CD1-CG2 4.12Å; L154-I159 HydrophobicContact CG-CD1 3.99Å; L154-I159 HydrophobicContact CG-CG2 4.11Å
155	N	88.8	Confident	95.5	Very high	89 Å²	89	74.3 Å²	74.3	48%	0.476	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	52.7	-176.4	-64.8	-9.7	0	0	0	112.6	T100 I101 R157	T100-N155 PolarHBondContact OG1-ND2 2.97Å; I101-N155 WeakPolarHBondContact CD1-ND2 3.35Å; N155-R157 PolarHBondContact O-N 3.17Å; N155-R157 VanDerWaalsContact O-N 3.14Å
156	Y	89.7	Confident	95.1	Very high	222 Å²	222	76.1 Å²	76.1	87%	0.871	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	15	179.5	-46.8	-79.9	0	0	0	115.2	L154	L154-Y156 VanDerWaalsContact C-N 3.34Å; L154-Y156 PolarHBondContact O-N 2.97Å
157	R	93.4	Very high	94.5	Very high	122 Å²	122	80.5 Å²	80.5	46%	0.46	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128.1	174.5	-67.1	-172.4	172.1	-143.5	-5.3	111	F153 L154 N155 I159	F153-R157 CarbonylContact C-O 3.59Å; F153-R157 WeakPolarHBondContact CA-O 3.42Å; L154-R157 PolarHBondContact N-O 3.41Å; L154-R157 PolarHBondContact O-N 3.42Å; L154-R157 VanDerWaalsContact O-N 3.08Å; N155-R157 PolarHBondContact O-N 3.17Å; N155-R157 VanDerWaalsContact O-N 3.14Å; R157-I159 PolarHBondContact O-N 2.79Å
158	K	95.7	Very high	94.1	Very high	125 Å²	125	82.4 Å²	82.4	54%	0.543	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	110.8	173.5	-169.6	172.4	-173.4	175.7	0	109.6	N96 G151 M152 F153	N96-K158 PolarHBondContact ND2-O 3.44Å; G151-K158 VanDerWaalsContact O-CE 3.27Å; G151-K158 WeakPolarHBondContact O-CE 3.22Å; G151-K158 WeakPolarHBondContact O-CG 3.27Å; M152-K158 CarbonylContact O-C 3.59Å; M152-K158 WeakPolarHBondContact O-CA 3.45Å; F153-K158 HydrophobicContact CD1-CB 4.28Å; F153-K158 HydrophobicContact CE1-CB 3.95Å; F153-K158 HydrophobicContact CZ-CB 4.11Å
159	I	97.7	Very high	93.7	Very high	4 Å²	4	83.1 Å²	83.1	2%	0.021	38%	0.379	C	S	.	.			trans	-84	152.6	179	68	169.8	0	0	0	110.6	I94 K95 L97 M149 G151 M152 L154 R157 V161	I94-I159 HydrophobicContact CG2-CB 4.42Å; I94-I159 HydrophobicContact CG2-CD1 4.23Å; K95-I159 WeakPolarHBondContact O-CA 3.43Å; L97-I159 HydrophobicContact CD2-CG2 4.22Å; M149-I159 HydrophobicContact CB-CD1 4.39Å; M149-I159 HydrophobicContact CE-CD1 4.21Å; M149-I159 WeakPolarHBondContact O-CG1 3.36Å; G151-I159 VanDerWaalsContact CA-O 3.28Å; G151-I159 WeakPolarHBondContact CA-O 3.48Å; G151-I159 PolarHBondContact N-O 2.98Å; M152-I159 WeakPolarHBondContact O-CG1 3.39Å; M152-I159 PolarHBondContact O-N 2.87Å; L154-I159 HydrophobicContact CB-CG2 3.96Å; L154-I159 HydrophobicContact CD1-CD1 3.68Å; L154-I159 HydrophobicContact CD1-CG2 4.12Å; L154-I159 HydrophobicContact CG-CD1 3.99Å; L154-I159 HydrophobicContact CG-CG2 4.11Å; R157-I159 PolarHBondContact O-N 2.79Å; I159-V161 HydrophobicContact CD1-CG2 3.52Å; I159-V161 HydrophobicContact CG1-CG2 3.96Å
160	F	97.9	Very high	93.3	Very high	102 Å²	102	86.8 Å²	86.8	45%	0.447	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	133.4	164.9	169.7	-90.3	0	0	0	108.4	F93 I94 K95 N150	F93-F160 HydrophobicContact CD1-CD1 4.36Å; F93-F160 HydrophobicContact CD1-CE1 4.22Å; I94-F160 CarbonylContact C-O 3.45Å; I94-F160 VanDerWaalsContact CA-O 3.3Å; I94-F160 WeakPolarHBondContact CA-O 3.29Å; K95-F160 HydrophobicContact CB-CB 4.26Å; K95-F160 HydrophobicContact CB-CD1 4.3Å; K95-F160 PolarHBondContact N-O 3.27Å; K95-F160 PolarHBondContact O-N 3.04Å; N150-F160 WeakPolarHBondContact OD1-CD2 3.18Å
161	V	98.1	Very high	92.7	Very high	1 Å²	1	88.6 Å²	88.6	1%	0.006	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	124.6	177.4	-173.4	0	0	0	0	107.3	V92 F93 I94 F110 I146 M149 N150 I159	V92-V161 HydrophobicContact CG1-CG1 3.26Å; F93-V161 WeakPolarHBondContact O-CA 3.3Å; I94-V161 HydrophobicContact CG1-CG1 4.41Å; I94-V161 HydrophobicContact CG1-CG2 4.37Å; I94-V161 HydrophobicContact CG2-CG2 4.26Å; F110-V161 HydrophobicContact CE1-CG1 4.06Å; F110-V161 HydrophobicContact CZ-CG1 4.37Å; F110-V161 HydrophobicContact CZ-CG2 4.11Å; I146-V161 HydrophobicContact CG1-CG1 3.98Å; M149-V161 HydrophobicContact CB-CB 4.47Å; M149-V161 HydrophobicContact CB-CG2 3.82Å; N150-V161 HydrophobicContact CB-CB 4.03Å; N150-V161 WeakPolarHBondContact CB-O 3.15Å; N150-V161 VanDerWaalsContact CG-O 3.23Å; N150-V161 PolarHBondContact OD1-N 3.14Å; N150-V161 PolarHBondContact OD1-O 2.92Å; I159-V161 HydrophobicContact CD1-CG2 3.52Å; I159-V161 HydrophobicContact CG1-CG2 3.96Å
162	G	97.6	Very high	92.4	Very high	8 Å²	8	90.5 Å²	90.5	8%	0.082	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	170.7	-178.2	0	0	0	0	0	112.1	V92 F93 F164	V92-G162 CarbonylContact C-O 3.5Å; V92-G162 WeakPolarHBondContact CA-O 3.39Å; V92-G162 WeakPolarHBondContact CG1-O 3.38Å; F93-G162 PolarHBondContact N-O 3.39Å; F93-G162 PolarHBondContact O-N 3.43Å; G162-F164 PolarHBondContact O-N 3.2Å
163	R	96.8	Very high	91.9	Very high	137 Å²	137	90.3 Å²	90.3	52%	0.517	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	137.5	175	-65	179.7	-177.5	-101.4	-5.4	109.8	E143 I146 K165	E143-R163 VanDerWaalsContact CD-NH2 3.35Å; E143-R163 VanDerWaalsContact CG-NH2 3.31Å; E143-R163 IonicContact OE1-CZ 2.65Å; E143-R163 IonicContact OE1-NH1 2.98Å; E143-R163 PolarHBondContact OE1-NH1 2.74Å; E143-R163 IonicContact OE1-NH2 3.88Å; E143-R163 PolarHBondContact OE1-NH2 3.46Å; I146-R163 HydrophobicContact CD1-CG 3.71Å; R163-K165 PolarHBondContact O-N 3.1Å
164	F	95.7	Very high	91.5	Very high	60 Å²	60	93.2 Å²	93.2	26%	0.263	42%	0.417	S	S	.	.			trans	-60.3	134.9	170.7	172.5	-98.3	0	0	0	109.6	N91 F133 G162	N91-F164 HydrophobicContact CB-CB 3.69Å; N91-F164 HydrophobicContact CB-CD1 4.47Å; N91-F164 HydrophobicContact CB-CG 4.18Å; N91-F164 WeakPolarHBondContact ND2-CG 3.11Å; N91-F164 WeakPolarHBondContact O-CB 3.3Å; N91-F164 PolarHBondContact O-N 2.77Å; F133-F164 AromaticContact CD1-CD2 3.61Å; F133-F164 HydrophobicContact CD1-CD2 3.61Å; F133-F164 AromaticContact CD1-CE2 3.93Å; F133-F164 HydrophobicContact CD1-CE2 3.93Å; F133-F164 AromaticContact CE1-CD2 3.59Å; F133-F164 HydrophobicContact CE1-CD2 3.59Å; F133-F164 AromaticContact CE1-CE2 3.61Å; F133-F164 HydrophobicContact CE1-CE2 3.61Å; F133-F164 HydrophobicContact CZ-CE2 4.47Å; G162-F164 PolarHBondContact O-N 3.2Å
165	K	92.3	Very high	91	Very high	79 Å²	79	93.2 Å²	93.2	34%	0.343	42%	0.422	S	S	.	.			trans	-121.3	131.1	170	-62.6	-175.3	-173.4	-172.8	0	108.1	R163 E169 R170 E173	R163-K165 PolarHBondContact O-N 3.1Å; K165-E169 HydrophobicContact CB-CB 4.21Å; K165-R170 HydrophobicContact CB-CG 3.67Å; K165-E173 WeakPolarHBondContact CD-OE1 3.2Å; K165-E173 VanDerWaalsContact CD-OE2 3.27Å; K165-E173 WeakPolarHBondContact CD-OE2 3.22Å; K165-E173 WeakPolarHBondContact CE-OE1 3.1Å; K165-E173 IonicContact NZ-OE1 3.98Å; K165-E173 PolarHBondContact NZ-OE1 3.42Å; K165-E173 IonicContact NZ-OE2 3.81Å; K165-E173 PolarHBondContact NZ-OE2 2.94Å
166	S	89.6	Confident	90.6	Very high	37 Å²	37	90.6 Å²	90.6	26%	0.259	41%	0.413	S	S	.	.			trans	-60	165	175.1	68.7	0	0	0	0	111.1	K168 E169 R170	S166-K168 VanDerWaalsContact C-N 3.29Å; S166-K168 PolarHBondContact O-N 3.48Å; S166-E169 WeakPolarHBondContact CB-OE2 3.42Å; S166-E169 PolarHBondContact N-OE2 3.4Å; S166-E169 PolarHBondContact O-N 2.92Å; S166-E169 WeakPolarHBondContact OG-CG 3.32Å; S166-E169 PolarHBondContact OG-N 3.47Å; S166-E169 PolarHBondContact OG-OE2 2.94Å; S166-R170 WeakPolarHBondContact O-CG 3.35Å; S166-R170 PolarHBondContact O-N 2.86Å
167	H	86.8	Confident	89.7	Confident	116 Å²	116	88.5 Å²	88.5	54%	0.537	40%	0.404	S	S	.	.	H	α-helix	trans	-55	-47.8	175.7	-168.2	-89.3	0	0	0	111.7	E169 R170 E171	H167-E169 PolarHBondContact O-N 2.81Å; H167-R170 PolarHBondContact O-N 3.05Å; H167-E171 IonicContact CE1-OE1 3.48Å; H167-E171 PolarHBondContact CE1-OE1 3.03Å; H167-E171 IonicContact CE1-OE2 3.39Å; H167-E171 PolarHBondContact CE1-OE2 2.82Å; H167-E171 IonicContact ND1-OE1 2.71Å; H167-E171 PolarHBondContact ND1-OE1 2.88Å; H167-E171 IonicContact ND1-OE2 2.64Å; H167-E171 PolarHBondContact ND1-OE2 2.93Å; H167-E171 WeakPolarHBondContact O-CG 3.27Å; H167-E171 PolarHBondContact O-N 3.01Å
168	K	88.8	Confident	88.8	Confident	169 Å²	169	85.1 Å²	85.1	74%	0.735	40%	0.402	S	S	*	.	H	α-helix	trans	-59.6	-43.5	180	-173.3	179.2	178.5	-178	0	112.5	S166 E171 A172	S166-K168 VanDerWaalsContact C-N 3.29Å; S166-K168 PolarHBondContact O-N 3.48Å; K168-E171 PolarHBondContact O-N 3.43Å; K168-A172 WeakPolarHBondContact O-CB 3.08Å; K168-A172 PolarHBondContact O-N 2.92Å
169	E	89	Confident	87.7	Confident	100 Å²	100	87.7 Å²	87.7	47%	0.467	41%	0.408	S	S	.	.	H	α-helix	trans	-65	-43.8	176.9	-72.2	164.7	120.9	0	0	111.6	K165 S166 H167 E171 A172 E173	K165-E169 HydrophobicContact CB-CB 4.21Å; S166-E169 WeakPolarHBondContact CB-OE2 3.42Å; S166-E169 PolarHBondContact N-OE2 3.4Å; S166-E169 PolarHBondContact O-N 2.92Å; S166-E169 WeakPolarHBondContact OG-CG 3.32Å; S166-E169 PolarHBondContact OG-N 3.47Å; S166-E169 PolarHBondContact OG-OE2 2.94Å; H167-E169 PolarHBondContact O-N 2.81Å; E169-E171 VanDerWaalsContact C-N 3.32Å; E169-E171 PolarHBondContact O-N 3.28Å; E169-A172 PolarHBondContact O-N 2.86Å; E169-E173 WeakPolarHBondContact O-CG 3.45Å; E169-E173 PolarHBondContact O-N 2.88Å
170	R	88.8	Confident	86.3	Confident	98 Å²	98	93.6 Å²	93.6	37%	0.37	44%	0.436	S	S	.	.	H	α-helix	trans	-63.8	-36.9	177.3	-68.5	-175	-61.1	166.5	5.5	112.5	K165 S166 H167 R174	K165-R170 HydrophobicContact CB-CG 3.67Å; S166-R170 WeakPolarHBondContact O-CG 3.35Å; S166-R170 PolarHBondContact O-N 2.86Å; H167-R170 PolarHBondContact O-N 3.05Å; R170-R174 WeakPolarHBondContact O-CB 3.49Å; R170-R174 VanDerWaalsContact O-CG 3.27Å; R170-R174 WeakPolarHBondContact O-CG 3.43Å; R170-R174 PolarHBondContact O-N 3.29Å
171	E	86.6	Confident	84.6	Confident	112 Å²	112	90.7 Å²	90.7	52%	0.523	43%	0.429	S	S	.	.	H	α-helix	trans	-66.8	-42.7	174.5	-74.2	178	132.4	0	0	111.8	H167 K168 E169 E173 R174 G175	H167-E171 IonicContact CE1-OE1 3.48Å; H167-E171 PolarHBondContact CE1-OE1 3.03Å; H167-E171 IonicContact CE1-OE2 3.39Å; H167-E171 PolarHBondContact CE1-OE2 2.82Å; H167-E171 IonicContact ND1-OE1 2.71Å; H167-E171 PolarHBondContact ND1-OE1 2.88Å; H167-E171 IonicContact ND1-OE2 2.64Å; H167-E171 PolarHBondContact ND1-OE2 2.93Å; H167-E171 WeakPolarHBondContact O-CG 3.27Å; H167-E171 PolarHBondContact O-N 3.01Å; K168-E171 PolarHBondContact O-N 3.43Å; E169-E171 VanDerWaalsContact C-N 3.32Å; E169-E171 PolarHBondContact O-N 3.28Å; E171-E173 PolarHBondContact O-N 3.37Å; E171-R174 PolarHBondContact O-N 2.83Å; E171-G175 PolarHBondContact O-N 2.68Å
172	A	89	Confident	82.9	Confident	63 Å²	63	95.2 Å²	95.2	52%	0.521	46%	0.456	S	S	.	.	H	α-helix	trans	-61.4	-43.8	176.6	0	0	0	0	0	112	K168 E169 G175 A176	K168-A172 WeakPolarHBondContact O-CB 3.08Å; K168-A172 PolarHBondContact O-N 2.92Å; E169-A172 PolarHBondContact O-N 2.86Å; A172-G175 PolarHBondContact O-N 3.47Å; A172-A176 WeakPolarHBondContact O-CB 3.46Å; A172-A176 PolarHBondContact O-N 2.97Å
173	E	85.9	Confident	81	Confident	93 Å²	93	98.2 Å²	98.2	44%	0.435	48%	0.476	S	S	.	.	H	α-helix	trans	-65.8	-40.7	177.1	-72.7	178.7	177	0	0	112.5	K165 E169 E171 G175 A176 W177	K165-E173 WeakPolarHBondContact CD-OE1 3.2Å; K165-E173 VanDerWaalsContact CD-OE2 3.27Å; K165-E173 WeakPolarHBondContact CD-OE2 3.22Å; K165-E173 WeakPolarHBondContact CE-OE1 3.1Å; K165-E173 IonicContact NZ-OE1 3.98Å; K165-E173 PolarHBondContact NZ-OE1 3.42Å; K165-E173 IonicContact NZ-OE2 3.81Å; K165-E173 PolarHBondContact NZ-OE2 2.94Å; E169-E173 WeakPolarHBondContact O-CG 3.45Å; E169-E173 PolarHBondContact O-N 2.88Å; E171-E173 PolarHBondContact O-N 3.37Å; E173-G175 VanDerWaalsContact C-N 3.35Å; E173-A176 PolarHBondContact O-N 3.35Å; E173-W177 WeakPolarHBondContact O-CB 3.28Å; E173-W177 PolarHBondContact O-N 2.85Å
174	R	82.7	Confident	79.1	Confident	195 Å²	195	94.5 Å²	94.5	74%	0.736	48%	0.475	S	S	*	.	H	α-helix	trans	-62.9	-42.4	174.3	-77.3	175.7	174.7	-156.6	-4.1	111.8	R170 E171 A178	R170-R174 WeakPolarHBondContact O-CB 3.49Å; R170-R174 VanDerWaalsContact O-CG 3.27Å; R170-R174 WeakPolarHBondContact O-CG 3.43Å; R170-R174 PolarHBondContact O-N 3.29Å; E171-R174 PolarHBondContact O-N 2.83Å; R174-A178 WeakPolarHBondContact O-CB 3.47Å; R174-A178 PolarHBondContact O-N 3Å
175	G	80.5	Confident	77.1	Confident	25 Å²	25	98.4 Å²	98.4	26%	0.258	50%	0.498	S	S	.	.	H	α-helix	trans	-66	-38.6	176.2	0	0	0	0	0	112.7	E171 A172 E173 R179	E171-G175 PolarHBondContact O-N 2.68Å; A172-G175 PolarHBondContact O-N 3.47Å; E173-G175 VanDerWaalsContact C-N 3.35Å; G175-R179 WeakPolarHBondContact O-CG 3.39Å; G175-R179 PolarHBondContact O-N 3.33Å; G175-R179 VanDerWaalsContact O-N 3.15Å
176	A	79.1	Confident	75.2	Confident	34 Å²	34	100.2 Å²	100.2	28%	0.281	52%	0.515	S	S	.	.	H	α-helix	trans	-66.9	-45	175.5	0	0	0	0	0	111.9	A172 E173 R179 Q180	A172-A176 WeakPolarHBondContact O-CB 3.46Å; A172-A176 PolarHBondContact O-N 2.97Å; E173-A176 PolarHBondContact O-N 3.35Å; A176-R179 PolarHBondContact O-N 2.75Å; A176-Q180 WeakPolarHBondContact O-CG 3.48Å; A176-Q180 PolarHBondContact O-N 2.66Å
177	W	72.5	Confident	73.3	Confident	178 Å²	178	106.8 Å²	106.8	67%	0.674	54%	0.539	S	S	*	.	H	α-helix	trans	-60.1	-46	175.2	-177.6	-89.5	0	0	0	111.6	E173 R179 Q180 S181	E173-W177 WeakPolarHBondContact O-CB 3.28Å; E173-W177 PolarHBondContact O-N 2.85Å; W177-R179 VanDerWaalsContact C-N 3.33Å; W177-R179 PolarHBondContact O-N 3.38Å; W177-Q180 PolarHBondContact O-N 3.38Å; W177-S181 PolarHBondContact NE1-OG 3.37Å; W177-S181 PolarHBondContact O-N 2.86Å; W177-S181 PolarHBondContact O-OG 2.9Å
178	A	74.2	Confident	71.6	Confident	52 Å²	52	108.4 Å²	108.4	43%	0.43	55%	0.552	S	S	.	*	H	α-helix	trans	-59.1	-42.6	177.9	0	0	0	0	0	112.3	R174 T182	R174-A178 WeakPolarHBondContact O-CB 3.47Å; R174-A178 PolarHBondContact O-N 3Å; A178-T182 WeakPolarHBondContact O-CG2 3.45Å; A178-T182 PolarHBondContact O-N 2.61Å; A178-T182 PolarHBondContact O-OG1 2.93Å; A178-T182 VanDerWaalsContact O-OG1 3.06Å
179	R	71.5	Confident	69.6	Low	178 Å²	178	110.2 Å²	110.2	67%	0.672	56%	0.56	S	S	*	*	H	α-helix	trans	-66.5	-37.3	176.4	-71.5	-177	-131.4	125.1	0.1	113.2	G175 A176 W177 T182 S183	G175-R179 WeakPolarHBondContact O-CG 3.39Å; G175-R179 PolarHBondContact O-N 3.33Å; G175-R179 VanDerWaalsContact O-N 3.15Å; A176-R179 PolarHBondContact O-N 2.75Å; W177-R179 VanDerWaalsContact C-N 3.33Å; W177-R179 PolarHBondContact O-N 3.38Å; R179-T182 WeakPolarHBondContact CA-OG1 3.41Å; R179-T182 PolarHBondContact O-OG1 2.87Å; R179-S183 VanDerWaalsContact O-CB 3.31Å; R179-S183 WeakPolarHBondContact O-CB 3.42Å; R179-S183 PolarHBondContact O-N 2.66Å; R179-S183 VanDerWaalsContact O-N 3.08Å
180	Q	68	Low	67.8	Low	128 Å²	128	114.5 Å²	114.5	60%	0.598	58%	0.581	S	S	*	*	H	α-helix	trans	-69.4	-44.1	177.4	-74.6	175.8	0.7	0	0	111.3	A176 W177 S183 A184	A176-Q180 WeakPolarHBondContact O-CG 3.48Å; A176-Q180 PolarHBondContact O-N 2.66Å; W177-Q180 PolarHBondContact O-N 3.38Å; Q180-S183 PolarHBondContact O-N 2.89Å; Q180-S183 VanDerWaalsContact O-N 3.16Å; Q180-A184 PolarHBondContact O-N 2.74Å
181	S	63.3	Low	65.6	Low	42 Å²	42	118.4 Å²	118.4	29%	0.294	60%	0.603	S	S	.	*	H	α-helix	trans	-61.5	-45	175.4	-61.5	0	0	0	0	111.6	W177 S183 A184 D185	W177-S181 PolarHBondContact NE1-OG 3.37Å; W177-S181 PolarHBondContact O-N 2.86Å; W177-S181 PolarHBondContact O-OG 2.9Å; S181-S183 PolarHBondContact O-N 3.25Å; S181-A184 PolarHBondContact O-N 2.91Å; S181-D185 PolarHBondContact O-N 3.29Å
182	T	61.8	Low	63.4	Low	95 Å²	95	121 Å²	121	58%	0.583	62%	0.62	S	S	*	*	H	α-helix	trans	-66.7	-23.2	176.1	54.7	0	0	0	0	113.9	A178 R179	A178-T182 WeakPolarHBondContact O-CG2 3.45Å; A178-T182 PolarHBondContact O-N 2.61Å; A178-T182 PolarHBondContact O-OG1 2.93Å; A178-T182 VanDerWaalsContact O-OG1 3.06Å; R179-T182 WeakPolarHBondContact CA-OG1 3.41Å; R179-T182 PolarHBondContact O-OG1 2.87Å
183	S	59.1	Low	61.5	Low	72 Å²	72	123.8 Å²	123.8	50%	0.503	63%	0.631	S	S	.	*	H	α-helix	trans	-85.9	-23.4	176.8	179.9	0	0	0	0	112.9	R179 Q180 S181	R179-S183 VanDerWaalsContact O-CB 3.31Å; R179-S183 WeakPolarHBondContact O-CB 3.42Å; R179-S183 PolarHBondContact O-N 2.66Å; R179-S183 VanDerWaalsContact O-N 3.08Å; Q180-S183 PolarHBondContact O-N 2.89Å; Q180-S183 VanDerWaalsContact O-N 3.16Å; S181-S183 PolarHBondContact O-N 3.25Å
184	A	56.2	Low	59.6	Low	59 Å²	59	126.8 Å²	126.8	49%	0.488	65%	0.65	S	S	.	*	H	α-helix	trans	-78.3	-33.6	177.9	0	0	0	0	0	111	Q180 S181 V186	Q180-A184 PolarHBondContact O-N 2.74Å; S181-A184 PolarHBondContact O-N 2.91Å; A184-V186 PolarHBondContact O-N 3.25Å; A184-V186 VanDerWaalsContact O-N 3.13Å
185	D	53	Low	57.7	Low	141 Å²	141	126.8 Å²	126.8	75%	0.754	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	4	179.8	-63.4	-35.2	0	0	0	114.4	S181	S181-D185 PolarHBondContact O-N 3.29Å
186	V	53	Low	55.9	Low	117 Å²	117	134.8 Å²	134.8	71%	0.709	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	4.9	-177.6	-176.7	0	0	0	0	112.8	A184	A184-V186 PolarHBondContact O-N 3.25Å; A184-V186 VanDerWaalsContact O-N 3.13Å
187	K	50.5	Low	53.9	Low	175 Å²	175	137.3 Å²	137.3	76%	0.761	71%	0.71	S	S	*	*	S	Bend	trans	-117.9	7.9	-177.6	-83.1	-170.4	172.6	-170.6	0	116.8
188	D	49.3	Very low	52.2	Low	150 Å²	150	135 Å²	135	80%	0.802	72%	0.716	S	S	*	*	S	Bend	trans	-110.6	28	177.2	-69.9	-29.4	0	0	0	113.2
189	F	47.4	Very low	50.3	Low	208 Å²	208	140.1 Å²	140.1	91%	0.912	74%	0.735	S	S	*	*			trans	-139.7	56.2	176.3	-101.9	-88.1	0	0	0	111.1
190	E	51.1	Low	48.7	Very low	190 Å²	190	146.7 Å²	146.7	89%	0.888	76%	0.76	S	S	*	*	S	Bend	trans	-129.4	99.8	163	-76.9	-175.1	161.1	0	0	108.6
191	E	42.1	Very low	47.8	Very low	180 Å²	180	147.7 Å²	147.7	84%	0.841	77%	0.768	S	S	*	*			trans	29.6	92.4	150.5	-66.2	177.5	159.5	0	0	118.9
192	D	41.8	Very low	46.9	Very low	165 Å²	165	153.2 Å²	153.2	88%	0.882	79%	0.793	S	S	*	*			trans	-101.2	96.4	141.8	-91.5	-28.7	0	0	0	107.4
193	T	49.5	Very low	46.1	Very low	123 Å²	123	156.4 Å²	156.4	76%	0.755	81%	0.805	S	S	*	*			trans	-123.7	91	160.1	49.1	0	0	0	0	109.1
194	D	45.8	Very low	45.4	Very low	156 Å²	156	161.4 Å²	161.4	83%	0.834	82%	0.822	S	S	*	*			trans	16.4	113.9	148.4	-57.8	-25.2	0	0	0	119
195	E	43.1	Very low	44.7	Very low	194 Å²	194	167.8 Å²	167.8	91%	0.907	84%	0.843	S	S	*	*			trans	-67.2	124.2	145.8	-65.9	-177.4	144	0	0	109.6
196	E	41.7	Very low	44.1	Very low	193 Å²	193	169.6 Å²	169.6	90%	0.902	85%	0.849	S	S	*	*			trans	-178	145.8	131.1	-111.6	-171.5	149.5	0	0	114.1
197	A	38.2	Very low	43.5	Very low	87 Å²	87	173.4 Å²	173.4	72%	0.719	86%	0.859	S	S	*	*			trans	83.2	84.5	151.5	0	0	0	0	0	120
198	T	34.9	Very low	43	Very low	131 Å²	131	173.2 Å²	173.2	80%	0.804	87%	0.867	S	S	*	*				3.5	128.1	120.8	-28.5	0	0	0	0	117.8
199	L	34.7	Very low	42.4	Very low	158 Å²	158	175.2 Å²	175.2	83%	0.827	87%	0.872	S	S	*	*			trans	143.1	89	136.4	-83.7	150	0	0	0	112.9
200	R	39	Very low	42	Very low	317 Å²	317	172.2 Å²	172.2	100%	1.196	87%	0.869	S	S	*	*				162.5	0	122.7	-89.9	179.2	179	-178.1	1.2	111.1

Retrieved 200 of 200 residues in 35.9 ms (Link to these results)

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