A0A096MNL1_PAPAN Loading...

Small ribosomal subunit protein uS8

Component of the small ribosomal subunit. Part of the small subunit (SSU) processome, first precursor of the small eukaryotic ribosomal subunit. During the assembly of the SSU processome in the nucleolus, many ribosome biogenesis factors, an RNA chaperone and ribosomal proteins associate with the nascent pre-rRNA and work in concert to generate RNA folding, modifications, rearrangements and cleavage as well as targeted degradation of pre-ribosomal RNA by the RNA exosome. Required for proper erythropoiesis.

AlphaFold DB (P62244), UniProt , Accession A0A096MNL1, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 130 aa.

						>A0A096MNL1_PAPAN|A0A096MNL1
MVRMNVLADALKSINNAEKRGKRQVLIRPCSKVIVRFLTVMMKHGYIGEFEIIDDHRAGKIVVNLTGRLNKCGVISPRFDVQLKDLEKWQNNLLPSRQFGFIVLTTSAGIMDHEEARRKHTGGKILGFFF
					

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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	55.8	Low	86.2	Confident	237 Å²	237	80.5 Å²	80.5	100%	1.167	42%	0.415	S	S	*	.				0	122.6	0	-167.3	-179.2	-74.6	0	0	108.3
2	V	80.8	Confident	87	Confident	132 Å²	132	85.5 Å²	85.5	80%	0.8	43%	0.431	S	S	*	.			trans	-81.6	133	-175.6	-180	0	0	0	0	109.8	M4	V2-M4 PolarHBondContact O-N 3.36Å
3	R	76.9	Confident	87.6	Confident	141 Å²	141	83 Å²	83	53%	0.532	43%	0.427	S	S	.	.			trans	-81.2	106.2	175.9	-78.1	-173.2	-74.3	-168.2	-1.3	110	R28	R3-R28 PolarHBondContact NH1-O 3.08Å
4	M	84.6	Confident	88.2	Confident	182 Å²	182	77.1 Å²	77.1	90%	0.897	40%	0.396	S	S	*	.			trans	-83.6	-44.9	179.2	-75.3	-177.2	50	0	0	113.5	V2	V2-M4 PolarHBondContact O-N 3.36Å
5	N	87.2	Confident	88.7	Confident	35 Å²	35	72.9 Å²	72.9	19%	0.187	38%	0.375	C	S	.	.			trans	-132.2	91.9	-174.3	-169.2	-8.5	0	0	0	111.4	L7 A8 D9	N5-L7 PolarHBondContact O-N 3Å; N5-L7 PolarHBondContact OD1-N 3.17Å; N5-A8 HydrophobicContact CB-CB 4.03Å; N5-A8 WeakPolarHBondContact O-CB 3.3Å; N5-A8 PolarHBondContact O-N 3.22Å; N5-A8 PolarHBondContact OD1-N 2.85Å; N5-D9 PolarHBondContact O-N 3.28Å
6	V	92	Very high	89.2	Confident	40 Å²	40	73.5 Å²	73.5	24%	0.242	38%	0.379	C	S	.	.	H	α-helix	trans	-58.9	-33.4	-178	-163.8	0	0	0	0	112.7	A8 D9 A10 P29 I34	V6-A8 VanDerWaalsContact C-N 3.35Å; V6-D9 PolarHBondContact O-N 3.43Å; V6-A10 WeakPolarHBondContact O-CB 3.34Å; V6-A10 PolarHBondContact O-N 3.46Å; V6-P29 HydrophobicContact CG1-CG 3.52Å; V6-P29 HydrophobicContact CG2-CG 4.48Å; V6-I34 HydrophobicContact CB-CD1 4.28Å; V6-I34 HydrophobicContact CG1-CD1 3.71Å
7	L	93.8	Very high	89.6	Confident	6 Å²	6	69.6 Å²	69.6	3%	0.031	36%	0.36	C	S	.	.	H	α-helix	trans	-67.4	-37.4	177.5	-176.2	67.2	0	0	0	111.3	N5 A10 L11 V33 I34 F37 V74 L126	N5-L7 PolarHBondContact O-N 3Å; N5-L7 PolarHBondContact OD1-N 3.17Å; L7-A10 PolarHBondContact O-N 3.05Å; L7-L11 HydrophobicContact CD1-CG 4.33Å; L7-L11 HydrophobicContact CG-CD1 4.44Å; L7-L11 HydrophobicContact CG-CG 4.46Å; L7-L11 WeakPolarHBondContact O-CG 3.38Å; L7-L11 PolarHBondContact O-N 3.33Å; L7-V33 HydrophobicContact CD2-CG1 4.19Å; L7-I34 HydrophobicContact CB-CG1 4.39Å; L7-I34 HydrophobicContact CD1-CB 4.39Å; L7-I34 HydrophobicContact CD1-CG1 3.76Å; L7-F37 HydrophobicContact CD1-CB 4.2Å; L7-F37 HydrophobicContact CD1-CD2 4.36Å; L7-F37 HydrophobicContact CD1-CG 4.24Å; L7-F37 HydrophobicContact CD2-CD2 4.28Å; L7-V74 HydrophobicContact CB-CG2 4.07Å; L7-V74 HydrophobicContact CD2-CG1 4.45Å; L7-V74 HydrophobicContact CD2-CG2 3.77Å; L7-V74 HydrophobicContact CG-CG2 3.54Å; L7-L126 HydrophobicContact CD2-CD2 4.31Å
8	A	94.1	Very high	89.8	Confident	34 Å²	34	66.8 Å²	66.8	28%	0.281	35%	0.345	S	S	.	.	H	α-helix	trans	-66.1	-42.6	179	0	0	0	0	0	111	N5 V6 A10 K12 V74	N5-A8 HydrophobicContact CB-CB 4.03Å; N5-A8 WeakPolarHBondContact O-CB 3.3Å; N5-A8 PolarHBondContact O-N 3.22Å; N5-A8 PolarHBondContact OD1-N 2.85Å; V6-A8 VanDerWaalsContact C-N 3.35Å; A8-A10 VanDerWaalsContact C-N 3.34Å; A8-A10 PolarHBondContact O-N 3Å; A8-K12 WeakPolarHBondContact O-CB 3.38Å; A8-K12 PolarHBondContact O-N 3.48Å; A8-V74 HydrophobicContact CB-CB 4.18Å; A8-V74 HydrophobicContact CB-CG2 4.1Å
9	D	93.7	Very high	90.1	Very high	73 Å²	73	71.4 Å²	71.4	39%	0.39	36%	0.362	S	S	.	.	H	α-helix	trans	-63.2	-41.8	176.7	-64.7	-22.1	0	0	0	111.3	N5 V6 S13	N5-D9 PolarHBondContact O-N 3.28Å; V6-D9 PolarHBondContact O-N 3.43Å; D9-S13 WeakPolarHBondContact O-CB 3.19Å; D9-S13 PolarHBondContact O-N 3.14Å; D9-S13 PolarHBondContact O-OG 3Å
10	A	94.4	Very high	90.3	Very high	3 Å²	3	78 Å²	78	3%	0.025	38%	0.383	C	S	.	.	H	α-helix	trans	-62.2	-54.9	176.8	0	0	0	0	0	112.1	V6 L7 A8 K12 S13 I14 I27 I34	V6-A10 WeakPolarHBondContact O-CB 3.34Å; V6-A10 PolarHBondContact O-N 3.46Å; L7-A10 PolarHBondContact O-N 3.05Å; A8-A10 VanDerWaalsContact C-N 3.34Å; A8-A10 PolarHBondContact O-N 3Å; A10-K12 VanDerWaalsContact C-N 3.32Å; A10-K12 PolarHBondContact O-N 2.9Å; A10-S13 WeakPolarHBondContact O-CB 3.33Å; A10-S13 PolarHBondContact O-N 3.12Å; A10-S13 VanDerWaalsContact O-N 3.14Å; A10-I14 WeakPolarHBondContact O-CG1 3.44Å; A10-I14 PolarHBondContact O-N 3.45Å; A10-I27 HydrophobicContact CB-CD1 4.29Å; A10-I27 HydrophobicContact CB-CG2 3.55Å; A10-I34 HydrophobicContact CB-CD1 3.97Å; A10-I34 HydrophobicContact CB-CG1 4.35Å; A10-I34 HydrophobicContact CB-CG2 4.23Å
11	L	95.5	Very high	90.4	Very high	3 Å²	3	77.2 Å²	77.2	2%	0.016	40%	0.395	C	S	.	.	H	α-helix	trans	-63.9	-37.4	-179.7	-65.3	-169.9	0	0	0	111.9	L7 S13 I14 N15 F37 M41 C72 V74	L7-L11 HydrophobicContact CD1-CG 4.33Å; L7-L11 HydrophobicContact CG-CD1 4.44Å; L7-L11 HydrophobicContact CG-CG 4.46Å; L7-L11 WeakPolarHBondContact O-CG 3.38Å; L7-L11 PolarHBondContact O-N 3.33Å; L11-S13 VanDerWaalsContact C-N 3.31Å; L11-S13 PolarHBondContact O-N 3.48Å; L11-I14 HydrophobicContact CD2-CD1 4.04Å; L11-I14 PolarHBondContact O-N 3.07Å; L11-N15 WeakPolarHBondContact O-CB 3.32Å; L11-N15 PolarHBondContact O-N 3.42Å; L11-F37 HydrophobicContact CD1-CD1 4.49Å; L11-F37 HydrophobicContact CD1-CE1 3.86Å; L11-F37 HydrophobicContact CD1-CE2 4.35Å; L11-F37 HydrophobicContact CD1-CZ 3.78Å; L11-F37 HydrophobicContact CD2-CD1 4.01Å; L11-F37 HydrophobicContact CD2-CE1 3.86Å; L11-M41 HydrophobicContact CD2-SD 4.37Å; L11-C72 HydrophobicContact CB-CB 4.49Å; L11-C72 HydrophobicContact CD2-CB 4.33Å; L11-C72 PolarHBondContact O-SG 2.93Å; L11-V74 HydrophobicContact CD1-CG2 3.58Å; L11-V74 HydrophobicContact CG-CG2 4.18Å
12	K	95.3	Very high	92.3	Very high	140 Å²	140	71.9 Å²	71.9	61%	0.609	37%	0.365	S	S	*	.	H	α-helix	trans	-63.5	-39	175	-169.6	171.3	-175.7	178.3	0	111.7	A8 A10 N15 N16	A8-K12 WeakPolarHBondContact O-CB 3.38Å; A8-K12 PolarHBondContact O-N 3.48Å; A10-K12 VanDerWaalsContact C-N 3.32Å; A10-K12 PolarHBondContact O-N 2.9Å; K12-N15 PolarHBondContact O-N 3.02Å; K12-N16 WeakPolarHBondContact O-CB 3.49Å; K12-N16 PolarHBondContact O-N 2.73Å; K12-N16 PolarHBondContact O-ND2 3.18Å
13	S	95.3	Very high	92.9	Very high	53 Å²	53	76 Å²	76	37%	0.371	37%	0.366	S	S	.	.	H	α-helix	trans	-65	-41.8	176.4	-59.3	0	0	0	0	111.8	D9 A10 L11 A17	D9-S13 WeakPolarHBondContact O-CB 3.19Å; D9-S13 PolarHBondContact O-N 3.14Å; D9-S13 PolarHBondContact O-OG 3Å; A10-S13 WeakPolarHBondContact O-CB 3.33Å; A10-S13 PolarHBondContact O-N 3.12Å; A10-S13 VanDerWaalsContact O-N 3.14Å; L11-S13 VanDerWaalsContact C-N 3.31Å; L11-S13 PolarHBondContact O-N 3.48Å; S13-A17 WeakPolarHBondContact O-CB 3.25Å; S13-A17 PolarHBondContact O-N 3.43Å
14	I	96	Very high	93.8	Very high	0 Å²	0	75.1 Å²	75.1	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-60.9	-51.2	174.3	-65.8	166.2	0	0	0	110.5	A10 L11 N16 A17 E18 V25 I27 L38 L65 L69	A10-I14 WeakPolarHBondContact O-CG1 3.44Å; A10-I14 PolarHBondContact O-N 3.45Å; L11-I14 HydrophobicContact CD2-CD1 4.04Å; L11-I14 PolarHBondContact O-N 3.07Å; I14-N16 VanDerWaalsContact C-N 3.3Å; I14-N16 PolarHBondContact O-N 2.85Å; I14-A17 WeakPolarHBondContact O-CB 3.39Å; I14-A17 PolarHBondContact O-N 3.49Å; I14-E18 HydrophobicContact CG2-CG 4.49Å; I14-E18 PolarHBondContact O-N 2.85Å; I14-V25 HydrophobicContact CG1-CG1 3.88Å; I14-I27 HydrophobicContact CD1-CD1 3.72Å; I14-I27 HydrophobicContact CG1-CD1 3.76Å; I14-L38 HydrophobicContact CD1-CD2 3.8Å; I14-L65 HydrophobicContact CG2-CD2 3.97Å; I14-L69 HydrophobicContact CG2-CD2 3.51Å
15	N	95.8	Very high	94.4	Very high	15 Å²	15	67.1 Å²	67.1	8%	0.08	33%	0.33	C	S	.	.	H	α-helix	trans	-60.4	-40.5	-178.1	-161.8	-21.6	0	0	0	112	L11 K12 K19 K71 C72	L11-N15 WeakPolarHBondContact O-CB 3.32Å; L11-N15 PolarHBondContact O-N 3.42Å; K12-N15 PolarHBondContact O-N 3.02Å; N15-K19 WeakPolarHBondContact O-CB 3.47Å; N15-K19 VanDerWaalsContact O-CG 3.32Å; N15-K19 WeakPolarHBondContact O-CG 3.4Å; N15-K19 PolarHBondContact O-N 2.86Å; N15-K19 VanDerWaalsContact OD1-CE 3.3Å; N15-K19 WeakPolarHBondContact OD1-CE 3.27Å; N15-K71 WeakPolarHBondContact ND2-CG 3.48Å; N15-C72 PolarHBondContact ND2-O 3.44Å; N15-C72 VanDerWaalsContact ND2-O 3.12Å
16	N	96.1	Very high	94.8	Very high	82 Å²	82	70.5 Å²	70.5	44%	0.439	35%	0.347	S	S	.	.	H	α-helix	trans	-68.8	-33.1	175.3	-71.2	-19.8	0	0	0	113.1	K12 I14 R20	K12-N16 WeakPolarHBondContact O-CB 3.49Å; K12-N16 PolarHBondContact O-N 2.73Å; K12-N16 PolarHBondContact O-ND2 3.18Å; I14-N16 VanDerWaalsContact C-N 3.3Å; I14-N16 PolarHBondContact O-N 2.85Å; N16-R20 WeakPolarHBondContact O-CG 3.48Å; N16-R20 PolarHBondContact O-N 3.23Å
17	A	95.9	Very high	94.9	Very high	7 Å²	7	68.8 Å²	68.8	6%	0.058	34%	0.337	C	S	.	.	H	α-helix	trans	-72.5	-44.7	178.1	0	0	0	0	0	111.4	S13 I14 R20 G21 K22 V25 L65	S13-A17 WeakPolarHBondContact O-CB 3.25Å; S13-A17 PolarHBondContact O-N 3.43Å; I14-A17 WeakPolarHBondContact O-CB 3.39Å; I14-A17 PolarHBondContact O-N 3.49Å; A17-R20 CarbonylContact O-C 3.57Å; A17-R20 PolarHBondContact O-N 3.28Å; A17-R20 VanDerWaalsContact O-N 3.17Å; A17-G21 PolarHBondContact O-N 3.06Å; A17-K22 HydrophobicContact CB-CB 4.19Å; A17-K22 HydrophobicContact CB-CD 4.29Å; A17-K22 PolarHBondContact O-N 3.39Å; A17-V25 HydrophobicContact CB-CB 3.9Å; A17-V25 HydrophobicContact CB-CG2 3.97Å; A17-L65 HydrophobicContact CB-CD1 3.65Å
18	E	94.2	Very high	94.8	Very high	19 Å²	19	74.7 Å²	74.7	9%	0.089	36%	0.358	C	S	.	.	H	α-helix	trans	-58.9	-49.7	174.4	-81.4	-71.7	-179.4	0	0	111.6	I14 R20 G21 L65 G67 L69	I14-E18 HydrophobicContact CG2-CG 4.49Å; I14-E18 PolarHBondContact O-N 2.85Å; E18-R20 PolarHBondContact O-N 2.93Å; E18-R20 VanDerWaalsContact O-N 3.08Å; E18-G21 PolarHBondContact O-N 2.99Å; E18-L65 HydrophobicContact CG-CD1 3.92Å; E18-L65 HydrophobicContact CG-CD2 3.97Å; E18-L65 HydrophobicContact CG-CG 4.33Å; E18-L65 WeakPolarHBondContact OE1-CB 3.18Å; E18-L65 WeakPolarHBondContact OE1-CD2 3.4Å; E18-G67 PolarHBondContact OE1-N 2.73Å; E18-G67 VanDerWaalsContact OE2-CA 3.25Å; E18-G67 WeakPolarHBondContact OE2-CA 3.49Å; E18-G67 PolarHBondContact OE2-N 3.49Å; E18-L69 HydrophobicContact CG-CB 4.06Å; E18-L69 HydrophobicContact CG-CD2 4.04Å
19	K	93.8	Very high	94.7	Very high	154 Å²	154	74 Å²	74	67%	0.67	35%	0.351	S	S	*	.	H	α-helix	trans	-59.9	-24.4	176.7	-75.5	-179.7	177	-174.6	0	114.4	N15	N15-K19 WeakPolarHBondContact O-CB 3.47Å; N15-K19 VanDerWaalsContact O-CG 3.32Å; N15-K19 WeakPolarHBondContact O-CG 3.4Å; N15-K19 PolarHBondContact O-N 2.86Å; N15-K19 VanDerWaalsContact OD1-CE 3.3Å; N15-K19 WeakPolarHBondContact OD1-CE 3.27Å
20	R	94.8	Very high	94.6	Very high	204 Å²	204	72 Å²	72	77%	0.77	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-0.8	175.8	-73.8	-177.8	179.6	-108.5	3.9	112.9	N16 A17 E18 K22	N16-R20 WeakPolarHBondContact O-CG 3.48Å; N16-R20 PolarHBondContact O-N 3.23Å; A17-R20 CarbonylContact O-C 3.57Å; A17-R20 PolarHBondContact O-N 3.28Å; A17-R20 VanDerWaalsContact O-N 3.17Å; E18-R20 PolarHBondContact O-N 2.93Å; E18-R20 VanDerWaalsContact O-N 3.08Å; R20-K22 VanDerWaalsContact C-N 3.32Å; R20-K22 HydrophobicContact CB-CG 4.36Å; R20-K22 PolarHBondContact O-N 2.8Å
21	G	92.8	Very high	94.5	Very high	62 Å²	62	74.1 Å²	74.1	64%	0.639	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	26.9	-177.4	0	0	0	0	0	113.9	A17 E18	A17-G21 PolarHBondContact O-N 3.06Å; E18-G21 PolarHBondContact O-N 2.99Å
22	K	95	Very high	94.3	Very high	124 Å²	124	82.7 Å²	82.7	54%	0.539	39%	0.394	S	S	.	.			trans	-73.9	139.5	175.6	-67.9	-170	175.1	-172.8	0	110.1	A17 R20 L65	A17-K22 HydrophobicContact CB-CB 4.19Å; A17-K22 HydrophobicContact CB-CD 4.29Å; A17-K22 PolarHBondContact O-N 3.39Å; R20-K22 VanDerWaalsContact C-N 3.32Å; R20-K22 HydrophobicContact CB-CG 4.36Å; R20-K22 PolarHBondContact O-N 2.8Å; K22-L65 WeakPolarHBondContact O-CB 3.4Å; K22-L65 WeakPolarHBondContact O-CD1 3.23Å
23	R	94.2	Very high	94.3	Very high	220 Å²	220	78 Å²	78	83%	0.83	38%	0.377	S	S	*	.	S	Bend	trans	-75.3	-25.4	177.8	-64	-175.8	179.9	-174.8	-1.9	114.2	L65	R23-L65 PolarHBondContact O-N 3.4Å
24	Q	95.5	Very high	94.3	Very high	121 Å²	121	75.6 Å²	75.6	57%	0.565	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.7	152.7	-177.8	65.2	-175.8	13.5	0	0	111.1	V62 V63	Q24-V62 HydrophobicContact CB-CG1 4.45Å; Q24-V63 CarbonylContact C-O 3.56Å; Q24-V63 VanDerWaalsContact CA-O 3.27Å; Q24-V63 WeakPolarHBondContact CA-O 3.46Å
25	V	96.5	Very high	94.2	Very high	15 Å²	15	76.9 Å²	76.9	9%	0.091	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	134.5	175.9	63	0	0	0	0	110.8	I14 A17 I27 V62 V63 L65	I14-V25 HydrophobicContact CG1-CG1 3.88Å; A17-V25 HydrophobicContact CB-CB 3.9Å; A17-V25 HydrophobicContact CB-CG2 3.97Å; V25-I27 HydrophobicContact CG1-CG1 4.48Å; V25-I27 HydrophobicContact CG2-CG1 4.47Å; V25-V62 WeakPolarHBondContact O-CA 2.94Å; V25-V63 HydrophobicContact CG1-CB 3.8Å; V25-V63 HydrophobicContact CG1-CG2 4.47Å; V25-V63 PolarHBondContact N-O 3.17Å; V25-V63 PolarHBondContact O-N 2.92Å; V25-L65 HydrophobicContact CB-CD1 4.26Å; V25-L65 HydrophobicContact CG1-CD1 4.18Å; V25-L65 HydrophobicContact CG1-CD2 4.22Å; V25-L65 HydrophobicContact CG1-CG 4.32Å
26	L	95.4	Very high	94.2	Very high	105 Å²	105	84 Å²	84	55%	0.55	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	123.3	173.2	-176	73.6	0	0	0	109.3	K60 I61 V62	L26-K60 HydrophobicContact CD1-CB 3.93Å; L26-K60 HydrophobicContact CD1-CD 4.24Å; L26-K60 HydrophobicContact CD2-CD 4.46Å; L26-I61 WeakPolarHBondContact CA-O 2.99Å; L26-V62 HydrophobicContact CD1-CG2 3.74Å
27	I	94.9	Very high	94.2	Very high	5 Å²	5	80.2 Å²	80.2	3%	0.026	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	132.7	179.1	-57.5	172.5	0	0	0	109.2	A10 I14 V25 K60 I61 V63	A10-I27 HydrophobicContact CB-CD1 4.29Å; A10-I27 HydrophobicContact CB-CG2 3.55Å; I14-I27 HydrophobicContact CD1-CD1 3.72Å; I14-I27 HydrophobicContact CG1-CD1 3.76Å; V25-I27 HydrophobicContact CG1-CG1 4.48Å; V25-I27 HydrophobicContact CG2-CG1 4.47Å; I27-K60 WeakPolarHBondContact O-CA 3.34Å; I27-I61 HydrophobicContact CB-CB 4.34Å; I27-I61 PolarHBondContact N-O 3.3Å; I27-I61 PolarHBondContact O-N 2.95Å; I27-V63 HydrophobicContact CD1-CG2 3.79Å
28	R	90.9	Very high	94.2	Very high	130 Å²	130	79.9 Å²	79.9	49%	0.491	37%	0.37	S	S	.	.	S	Bend	trans	-143.6	130.6	175	-174.7	-176.9	-176	-144.1	0.8	109.7	R3 D55 K60	R3-R28 PolarHBondContact NH1-O 3.08Å; R28-D55 IonicContact NE-OD2 3.9Å; R28-K60 HydrophobicContact CB-CG 4.39Å; R28-K60 HydrophobicContact CG-CG 4.31Å
29	P	93.1	Very high	94.2	Very high	18 Å²	18	81.8 Å²	81.8	12%	0.117	38%	0.383	C	S	.	.	S	Bend	cis	-85.2	161.9	3.1	24.1	-6.3	0	0	0	113.7	V6 A58	V6-P29 HydrophobicContact CG1-CG 3.52Å; V6-P29 HydrophobicContact CG2-CG 4.48Å; P29-A58 HydrophobicContact CB-CB 3.64Å
30	C	90.7	Very high	94.3	Very high	33 Å²	33	75.1 Å²	75.1	22%	0.223	36%	0.355	C	S	.	.			trans	-76	142.5	169.2	-176	0	0	0	0	110.6	A58 G59 I61	C30-A58 WeakPolarHBondContact CA-O 3.44Å; C30-A58 WeakPolarHBondContact CB-O 3.33Å; C30-A58 PolarHBondContact N-O 3.02Å; C30-G59 PolarHBondContact N-O 2.92Å; C30-I61 HydrophobicContact CB-CD1 4.19Å; C30-I61 HydrophobicContact CB-CG1 3.93Å
31	S	92	Very high	94.3	Very high	46 Å²	46	65.4 Å²	65.4	32%	0.322	32%	0.319	S	S	.	.			trans	-143.6	146.3	173.1	176.7	0	0	0	0	109.7	V33 I34 V35	S31-V33 PolarHBondContact O-N 2.98Å; S31-V33 VanDerWaalsContact O-N 3.16Å; S31-I34 WeakPolarHBondContact O-CB 3.15Å; S31-I34 PolarHBondContact O-N 2.9Å; S31-V35 WeakPolarHBondContact O-CG2 3.37Å; S31-V35 PolarHBondContact O-N 3.36Å
32	K	93.1	Very high	94.4	Very high	184 Å²	184	66.1 Å²	66.1	80%	0.8	31%	0.306	S	S	*	.	H	α-helix	trans	-54	-36.3	177.2	-67.2	-178.3	-178.8	178.6	0	112.4	R36	K32-R36 WeakPolarHBondContact O-CB 3.43Å; K32-R36 VanDerWaalsContact O-CG 3.23Å; K32-R36 WeakPolarHBondContact O-CG 3.34Å; K32-R36 PolarHBondContact O-N 2.94Å
33	V	94.3	Very high	94.4	Very high	40 Å²	40	66.3 Å²	66.3	24%	0.242	31%	0.307	C	S	.	.	H	α-helix	trans	-66.9	-41.2	177.7	-179.8	0	0	0	0	111.1	L7 S31 F37 I110 L126	L7-V33 HydrophobicContact CD2-CG1 4.19Å; S31-V33 PolarHBondContact O-N 2.98Å; S31-V33 VanDerWaalsContact O-N 3.16Å; V33-F37 VanDerWaalsContact O-CB 3.29Å; V33-F37 WeakPolarHBondContact O-CB 3.43Å; V33-F37 PolarHBondContact O-N 2.91Å; V33-I110 HydrophobicContact CB-CD1 4.45Å; V33-I110 HydrophobicContact CG1-CD1 4.03Å; V33-L126 HydrophobicContact CG1-CD1 4.4Å; V33-L126 HydrophobicContact CG1-CD2 4.14Å
34	I	94.8	Very high	94.4	Very high	3 Å²	3	58 Å²	58	2%	0.015	28%	0.278	C	S	.	.	H	α-helix	trans	-65.7	-47.6	178	-62.2	168.4	0	0	0	109.6	V6 L7 A10 S31 R36 F37 L38 I61	V6-I34 HydrophobicContact CB-CD1 4.28Å; V6-I34 HydrophobicContact CG1-CD1 3.71Å; L7-I34 HydrophobicContact CB-CG1 4.39Å; L7-I34 HydrophobicContact CD1-CB 4.39Å; L7-I34 HydrophobicContact CD1-CG1 3.76Å; A10-I34 HydrophobicContact CB-CD1 3.97Å; A10-I34 HydrophobicContact CB-CG1 4.35Å; A10-I34 HydrophobicContact CB-CG2 4.23Å; S31-I34 WeakPolarHBondContact O-CB 3.15Å; S31-I34 PolarHBondContact O-N 2.9Å; I34-R36 PolarHBondContact O-N 3.13Å; I34-F37 PolarHBondContact O-N 3.43Å; I34-L38 HydrophobicContact CG2-CD1 3.83Å; I34-L38 HydrophobicContact CG2-CG 4.23Å; I34-L38 WeakPolarHBondContact O-CB 3.44Å; I34-L38 VanDerWaalsContact O-CG 3.29Å; I34-L38 WeakPolarHBondContact O-CG 3.42Å; I34-L38 PolarHBondContact O-N 3.34Å; I34-I61 HydrophobicContact CB-CD1 4.38Å; I34-I61 HydrophobicContact CG2-CD1 3.76Å
35	V	95	Very high	94.3	Very high	28 Å²	28	53.7 Å²	53.7	17%	0.17	27%	0.266	C	S	.	.	H	α-helix	trans	-56.7	-49.9	177.9	174.2	0	0	0	0	110.6	S31 F37 L38 T39 F50 I52 I61	S31-V35 WeakPolarHBondContact O-CG2 3.37Å; S31-V35 PolarHBondContact O-N 3.36Å; V35-F37 PolarHBondContact O-N 2.99Å; V35-L38 PolarHBondContact O-N 2.85Å; V35-T39 PolarHBondContact O-N 3.07Å; V35-T39 PolarHBondContact O-OG1 3.37Å; V35-F50 HydrophobicContact CG1-CE2 4.04Å; V35-F50 HydrophobicContact CG1-CZ 4.15Å; V35-I52 HydrophobicContact CG1-CD1 3.99Å; V35-I52 HydrophobicContact CG2-CD1 3.81Å; V35-I52 HydrophobicContact CG2-CG1 4.46Å; V35-I61 HydrophobicContact CG2-CD1 3.9Å
36	R	95.5	Very high	94.2	Very high	165 Å²	165	53.2 Å²	53.2	62%	0.623	26%	0.263	S	S	*	.	H	α-helix	trans	-62.3	-39.8	177.7	-70.8	-77.1	-178	174.8	-1.8	112.6	K32 I34 T39 V40 I110	K32-R36 WeakPolarHBondContact O-CB 3.43Å; K32-R36 VanDerWaalsContact O-CG 3.23Å; K32-R36 WeakPolarHBondContact O-CG 3.34Å; K32-R36 PolarHBondContact O-N 2.94Å; I34-R36 PolarHBondContact O-N 3.13Å; R36-T39 WeakPolarHBondContact O-CB 3.43Å; R36-T39 PolarHBondContact O-N 3.18Å; R36-V40 WeakPolarHBondContact O-CG2 3.44Å; R36-V40 PolarHBondContact O-N 3.25Å; R36-V40 VanDerWaalsContact O-N 3.14Å; R36-I110 HydrophobicContact CB-CB 4.17Å; R36-I110 HydrophobicContact CB-CD1 3.71Å; R36-I110 HydrophobicContact CB-CG1 4.46Å; R36-I110 HydrophobicContact CG-CD1 4.34Å
37	F	95.6	Very high	94.1	Very high	1 Å²	1	48.5 Å²	48.5	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-64.2	-43.9	176.8	-164	-74.1	0	0	0	111.3	L7 L11 V33 I34 V35 T39 V40 M41 V103 L126 F129	L7-F37 HydrophobicContact CD1-CB 4.2Å; L7-F37 HydrophobicContact CD1-CD2 4.36Å; L7-F37 HydrophobicContact CD1-CG 4.24Å; L7-F37 HydrophobicContact CD2-CD2 4.28Å; L11-F37 HydrophobicContact CD1-CD1 4.49Å; L11-F37 HydrophobicContact CD1-CE1 3.86Å; L11-F37 HydrophobicContact CD1-CE2 4.35Å; L11-F37 HydrophobicContact CD1-CZ 3.78Å; L11-F37 HydrophobicContact CD2-CD1 4.01Å; L11-F37 HydrophobicContact CD2-CE1 3.86Å; V33-F37 VanDerWaalsContact O-CB 3.29Å; V33-F37 WeakPolarHBondContact O-CB 3.43Å; V33-F37 PolarHBondContact O-N 2.91Å; I34-F37 PolarHBondContact O-N 3.43Å; V35-F37 PolarHBondContact O-N 2.99Å; F37-T39 VanDerWaalsContact C-N 3.34Å; F37-V40 PolarHBondContact O-N 2.92Å; F37-M41 HydrophobicContact CD1-CG 4Å; F37-M41 HydrophobicContact CD1-SD 3.76Å; F37-M41 HydrophobicContact CE1-CG 3.94Å; F37-M41 HydrophobicContact CE1-SD 3.65Å; F37-M41 PolarHBondContact O-N 3.36Å; F37-V103 HydrophobicContact CD2-CB 3.98Å; F37-V103 HydrophobicContact CD2-CG1 3.74Å; F37-V103 HydrophobicContact CD2-CG2 4.11Å; F37-V103 HydrophobicContact CE1-CG2 4.27Å; F37-V103 HydrophobicContact CE2-CB 3.5Å; F37-V103 HydrophobicContact CE2-CG1 3.82Å; F37-V103 HydrophobicContact CE2-CG2 3.59Å; F37-V103 HydrophobicContact CZ-CB 4.09Å; F37-V103 HydrophobicContact CZ-CG2 3.67Å; F37-L126 HydrophobicContact CD2-CB 4.45Å; F37-L126 HydrophobicContact CE2-CB 4.3Å; F37-F129 AromaticContact CE1-CD1 3.91Å; F37-F129 HydrophobicContact CE1-CD1 3.91Å; F37-F129 HydrophobicContact CZ-CD1 4.09Å
38	L	95.5	Very high	94.1	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-63.4	-39.6	175	-68.1	172.6	0	0	0	111.4	I14 I34 V35 V40 M41 M42 I47 F50 I61 V63	I14-L38 HydrophobicContact CD1-CD2 3.8Å; I34-L38 HydrophobicContact CG2-CD1 3.83Å; I34-L38 HydrophobicContact CG2-CG 4.23Å; I34-L38 WeakPolarHBondContact O-CB 3.44Å; I34-L38 VanDerWaalsContact O-CG 3.29Å; I34-L38 WeakPolarHBondContact O-CG 3.42Å; I34-L38 PolarHBondContact O-N 3.34Å; V35-L38 PolarHBondContact O-N 2.85Å; L38-V40 VanDerWaalsContact C-N 3.28Å; L38-V40 PolarHBondContact O-N 2.99Å; L38-M41 HydrophobicContact CD2-SD 4.3Å; L38-M41 PolarHBondContact O-N 3.35Å; L38-M41 VanDerWaalsContact O-N 3.14Å; L38-M42 WeakPolarHBondContact O-CB 3.48Å; L38-M42 PolarHBondContact O-N 3.3Å; L38-I47 HydrophobicContact CB-CD1 3.93Å; L38-I47 HydrophobicContact CD2-CD1 3.7Å; L38-I47 HydrophobicContact CG-CD1 4.41Å; L38-I47 WeakPolarHBondContact O-CD1 3.49Å; L38-F50 HydrophobicContact CB-CD1 4.13Å; L38-F50 HydrophobicContact CB-CE1 4.07Å; L38-F50 HydrophobicContact CB-CZ 4.42Å; L38-I61 HydrophobicContact CD1-CD1 4.12Å; L38-I61 HydrophobicContact CD1-CG2 3.92Å; L38-V63 HydrophobicContact CD1-CG2 3.75Å; L38-V63 HydrophobicContact CD2-CG1 4.48Å; L38-V63 HydrophobicContact CD2-CG2 4.14Å
39	T	95.5	Very high	94.3	Very high	59 Å²	59	50 Å²	50	36%	0.362	26%	0.255	S	S	.	.	H	α-helix	trans	-57.6	-40.7	173.3	-51.3	0	0	0	0	112	V35 R36 F37 M42 K43	V35-T39 PolarHBondContact O-N 3.07Å; V35-T39 PolarHBondContact O-OG1 3.37Å; R36-T39 WeakPolarHBondContact O-CB 3.43Å; R36-T39 PolarHBondContact O-N 3.18Å; F37-T39 VanDerWaalsContact C-N 3.34Å; T39-M42 PolarHBondContact O-N 3.02Å; T39-K43 WeakPolarHBondContact O-CB 3.41Å; T39-K43 PolarHBondContact O-N 3.22Å
40	V	95.4	Very high	94.4	Very high	13 Å²	13	51 Å²	51	8%	0.079	26%	0.257	C	S	.	.	H	α-helix	trans	-66.2	-43.9	175.5	177.5	0	0	0	0	110.9	R36 F37 L38 M42 K43 H44 V103 I110 D112 F129	R36-V40 WeakPolarHBondContact O-CG2 3.44Å; R36-V40 PolarHBondContact O-N 3.25Å; R36-V40 VanDerWaalsContact O-N 3.14Å; F37-V40 PolarHBondContact O-N 2.92Å; L38-V40 VanDerWaalsContact C-N 3.28Å; L38-V40 PolarHBondContact O-N 2.99Å; V40-M42 VanDerWaalsContact C-N 3.29Å; V40-M42 PolarHBondContact O-N 3.07Å; V40-K43 PolarHBondContact O-N 3.27Å; V40-H44 PolarHBondContact O-CD2 2.89Å; V40-H44 VanDerWaalsContact O-CD2 3.24Å; V40-H44 PolarHBondContact O-N 3.33Å; V40-V103 HydrophobicContact CG1-CG2 4.25Å; V40-I110 HydrophobicContact CG2-CG2 4.43Å; V40-D112 HydrophobicContact CG1-CB 4.22Å; V40-F129 HydrophobicContact CG1-CE1 4.09Å; V40-F129 HydrophobicContact CG1-CZ 4.1Å
41	M	95.4	Very high	94.7	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.7	-38.8	175.7	-69.5	-179	75.6	0	0	112.6	L11 F37 L38 H44 G45 Y46 I47 L69 C72 F129	L11-M41 HydrophobicContact CD2-SD 4.37Å; F37-M41 HydrophobicContact CD1-CG 4Å; F37-M41 HydrophobicContact CD1-SD 3.76Å; F37-M41 HydrophobicContact CE1-CG 3.94Å; F37-M41 HydrophobicContact CE1-SD 3.65Å; F37-M41 PolarHBondContact O-N 3.36Å; L38-M41 HydrophobicContact CD2-SD 4.3Å; L38-M41 PolarHBondContact O-N 3.35Å; L38-M41 VanDerWaalsContact O-N 3.14Å; M41-H44 PolarHBondContact O-N 3.39Å; M41-G45 PolarHBondContact O-N 3.48Å; M41-Y46 PolarHBondContact O-N 2.83Å; M41-Y46 VanDerWaalsContact O-N 3.07Å; M41-I47 HydrophobicContact CB-CD1 3.87Å; M41-I47 HydrophobicContact CB-CG1 3.86Å; M41-I47 HydrophobicContact CB-CG2 4.4Å; M41-I47 HydrophobicContact CE-CG2 3.86Å; M41-L69 HydrophobicContact CE-CD1 3.71Å; M41-L69 HydrophobicContact CE-CD2 4Å; M41-L69 HydrophobicContact CE-CG 4.49Å; M41-C72 HydrophobicContact CE-CB 4.26Å; M41-F129 HydrophobicContact CE-CB 4.04Å; M41-F129 HydrophobicContact CE-CG 4.29Å; M41-F129 HydrophobicContact CG-CD1 3.63Å; M41-F129 HydrophobicContact CG-CD2 4.23Å; M41-F129 HydrophobicContact CG-CE1 3.73Å; M41-F129 HydrophobicContact CG-CE2 4.33Å; M41-F129 HydrophobicContact CG-CG 3.88Å; M41-F129 HydrophobicContact CG-CZ 4.09Å; M41-F129 HydrophobicContact SD-CD1 4.47Å
42	M	95.1	Very high	94.8	Very high	77 Å²	77	57.6 Å²	57.6	38%	0.379	28%	0.282	S	S	.	.	H	α-helix	trans	-67.9	-42.9	177.5	-170.6	-176.3	76.4	0	0	111.2	L38 T39 V40 H44 G45 I47 F50	L38-M42 WeakPolarHBondContact O-CB 3.48Å; L38-M42 PolarHBondContact O-N 3.3Å; T39-M42 PolarHBondContact O-N 3.02Å; V40-M42 VanDerWaalsContact C-N 3.29Å; V40-M42 PolarHBondContact O-N 3.07Å; M42-H44 PolarHBondContact O-N 2.86Å; M42-G45 PolarHBondContact O-N 3.24Å; M42-I47 HydrophobicContact CB-CD1 4.26Å; M42-I47 HydrophobicContact CB-CG1 3.94Å; M42-F50 HydrophobicContact SD-CD1 4.16Å; M42-F50 HydrophobicContact SD-CE1 4.13Å
43	K	94.8	Very high	94.8	Very high	129 Å²	129	52.5 Å²	52.5	56%	0.561	26%	0.263	S	S	*	.	H	α-helix	trans	-56.1	-36	175.7	-176.7	-172.3	174.7	-160.6	0	112.3	T39 V40 D112 E115	T39-K43 WeakPolarHBondContact O-CB 3.41Å; T39-K43 PolarHBondContact O-N 3.22Å; V40-K43 PolarHBondContact O-N 3.27Å; K43-D112 IonicContact NZ-OD1 2.67Å; K43-E115 IonicContact NZ-OE2 3.91Å; K43-E115 PolarHBondContact NZ-OE2 3.36Å
44	H	93.8	Very high	94.6	Very high	44 Å²	44	56.1 Å²	56.1	20%	0.204	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-0.4	176.4	-68.8	-75	0	0	0	114.1	V40 M41 M42 Y46 F101 D112 F129	V40-H44 PolarHBondContact O-CD2 2.89Å; V40-H44 VanDerWaalsContact O-CD2 3.24Å; V40-H44 PolarHBondContact O-N 3.33Å; M41-H44 PolarHBondContact O-N 3.39Å; M42-H44 PolarHBondContact O-N 2.86Å; H44-Y46 HydrophobicContact CB-CD2 3.86Å; H44-Y46 HydrophobicContact CB-CE2 4.06Å; H44-F101 HydrophobicContact CB-CD2 4.2Å; H44-F101 HydrophobicContact CB-CE2 3.98Å; H44-F101 AromaticContact CE1-CD1 3.56Å; H44-F101 AromaticContact CE1-CE1 3.26Å; H44-F101 WeakPolarHBondContact CE1-CE1 3.45Å; H44-F101 AromaticContact CE1-CE2 3.99Å; H44-F101 AromaticContact CE1-CZ 3.5Å; H44-F101 VanDerWaalsContact CE1-CZ 3.5Å; H44-F101 WeakPolarHBondContact CE1-CZ 3.43Å; H44-F101 AromaticContact CG-CD2 3.86Å; H44-F101 AromaticContact CG-CE2 3.7Å; H44-F101 AromaticContact CG-CZ 3.96Å; H44-F101 AromaticContact ND1-CD2 3.95Å; H44-F101 AromaticContact ND1-CE1 3.52Å; H44-F101 AromaticContact ND1-CE2 3.43Å; H44-F101 WeakPolarHBondContact ND1-CE2 3.48Å; H44-F101 AromaticContact ND1-CZ 3.21Å; H44-F101 WeakPolarHBondContact ND1-CZ 3.48Å; H44-F101 AromaticContact NE2-CD1 3.79Å; H44-F101 AromaticContact NE2-CE1 3.97Å; H44-D112 IonicContact NE2-OD1 3.77Å; H44-F129 HydrophobicContact CB-CE2 4.23Å; H44-F129 HydrophobicContact CB-CZ 4.5Å; H44-F129 AromaticContact CD2-CZ 3.9Å
45	G	93.2	Very high	94.4	Very high	31 Å²	31	57.8 Å²	57.8	32%	0.32	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	27.2	175.5	0	0	0	0	0	115.4	M41 M42 R68	M41-G45 PolarHBondContact O-N 3.48Å; M42-G45 PolarHBondContact O-N 3.24Å; G45-R68 WeakPolarHBondContact O-CD 3.43Å
46	Y	93.5	Very high	94.1	Very high	6 Å²	6	64.8 Å²	64.8	2%	0.024	32%	0.32	C	S	.	.	S	Bend	trans	-85.3	-27.2	173.3	-78.5	-91.5	0	0	0	113.3	M41 H44 T66 R68 L69 F99 F101 F129	M41-Y46 PolarHBondContact O-N 2.83Å; M41-Y46 VanDerWaalsContact O-N 3.07Å; H44-Y46 HydrophobicContact CB-CD2 3.86Å; H44-Y46 HydrophobicContact CB-CE2 4.06Å; Y46-T66 PolarHBondContact O-OG1 3.02Å; Y46-R68 HydrophobicContact CD1-CG 4.43Å; Y46-L69 HydrophobicContact CD1-CD1 4.02Å; Y46-F99 HydrophobicContact CE1-CE2 4.44Å; Y46-F99 HydrophobicContact CE1-CZ 4.28Å; Y46-F101 AromaticContact CE2-CD2 3.82Å; Y46-F101 HydrophobicContact CE2-CD2 3.82Å; Y46-F101 AromaticContact CE2-CE2 3.87Å; Y46-F101 HydrophobicContact CE2-CE2 3.87Å; Y46-F129 HydrophobicContact CD1-CD2 4.37Å; Y46-F129 AromaticContact CD2-CD2 3.61Å; Y46-F129 HydrophobicContact CD2-CD2 3.61Å; Y46-F129 AromaticContact CD2-CE2 3.41Å; Y46-F129 HydrophobicContact CD2-CE2 3.41Å; Y46-F129 VanDerWaalsContact CD2-CE2 3.41Å; Y46-F129 AromaticContact CE2-CD2 3.8Å; Y46-F129 HydrophobicContact CE2-CD2 3.8Å; Y46-F129 AromaticContact CE2-CE2 3.59Å; Y46-F129 HydrophobicContact CE2-CE2 3.59Å; Y46-F129 AromaticContact CG-CD2 3.9Å; Y46-F129 HydrophobicContact CG-CD2 3.9Å; Y46-F129 HydrophobicContact CG-CE2 4.13Å
47	I	94.9	Very high	93.8	Very high	6 Å²	6	67 Å²	67	3%	0.031	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	156.2	175.3	62.9	172.3	0	0	0	108.9	L38 M41 M42 F50 V63	L38-I47 HydrophobicContact CB-CD1 3.93Å; L38-I47 HydrophobicContact CD2-CD1 3.7Å; L38-I47 HydrophobicContact CG-CD1 4.41Å; L38-I47 WeakPolarHBondContact O-CD1 3.49Å; M41-I47 HydrophobicContact CB-CD1 3.87Å; M41-I47 HydrophobicContact CB-CG1 3.86Å; M41-I47 HydrophobicContact CB-CG2 4.4Å; M41-I47 HydrophobicContact CE-CG2 3.86Å; M42-I47 HydrophobicContact CB-CD1 4.26Å; M42-I47 HydrophobicContact CB-CG1 3.94Å; I47-F50 HydrophobicContact CD1-CD1 4.49Å; I47-V63 HydrophobicContact CB-CG1 4.14Å; I47-V63 HydrophobicContact CD1-CG1 4.04Å; I47-V63 HydrophobicContact CG2-CG1 4.23Å
48	G	94.1	Very high	93.3	Very high	18 Å²	18	69.1 Å²	69.1	19%	0.186	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-162.4	169.6	0	0	0	0	0	111.7	N64	G48-N64 PolarHBondContact N-O 3.45Å
49	E	95.1	Very high	93.1	Very high	149 Å²	149	69.4 Å²	69.4	70%	0.696	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.6	147.3	172.7	-64.5	-178.9	173.1	0	0	111	N64	E49-N64 WeakPolarHBondContact O-CB 3.34Å; E49-N64 PolarHBondContact O-N 2.86Å; E49-N64 VanDerWaalsContact O-N 3.13Å; E49-N64 PolarHBondContact O-ND2 3.2Å
50	F	95.6	Very high	93.1	Very high	37 Å²	37	70 Å²	70	16%	0.162	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	143.1	173.9	69.5	-90.4	0	0	0	110	V35 L38 M42 I47 I52 I61 V62 V63	V35-F50 HydrophobicContact CG1-CE2 4.04Å; V35-F50 HydrophobicContact CG1-CZ 4.15Å; L38-F50 HydrophobicContact CB-CD1 4.13Å; L38-F50 HydrophobicContact CB-CE1 4.07Å; L38-F50 HydrophobicContact CB-CZ 4.42Å; M42-F50 HydrophobicContact SD-CD1 4.16Å; M42-F50 HydrophobicContact SD-CE1 4.13Å; I47-F50 HydrophobicContact CD1-CD1 4.49Å; F50-I52 HydrophobicContact CD2-CG1 4.33Å; F50-I52 HydrophobicContact CE2-CD1 4.26Å; F50-I52 HydrophobicContact CE2-CG1 4.17Å; F50-I61 HydrophobicContact CB-CG2 4.2Å; F50-I61 HydrophobicContact CD2-CG2 3.88Å; F50-I61 HydrophobicContact CG-CG2 4.43Å; F50-V62 CarbonylContact C-O 3.55Å; F50-V62 WeakPolarHBondContact CA-O 3.28Å; F50-V62 WeakPolarHBondContact CB-O 3.42Å; F50-V63 HydrophobicContact CB-CB 4.4Å; F50-V63 HydrophobicContact CB-CG2 4.04Å
51	E	95.6	Very high	93.1	Very high	125 Å²	125	69.3 Å²	69.3	58%	0.584	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	139.1	-179.8	-67.2	-178.1	175.8	0	0	110.2	I61 V62	E51-I61 CarbonylContact O-C 3.54Å; E51-I61 VanDerWaalsContact O-CA 3.3Å; E51-I61 WeakPolarHBondContact O-CA 3.35Å; E51-V62 PolarHBondContact N-O 3.4Å; E51-V62 PolarHBondContact O-N 2.89Å
52	I	95.1	Very high	93.1	Very high	94 Å²	94	70.6 Å²	70.6	48%	0.482	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	118.5	174.7	-54.9	173.3	0	0	0	107.5	V35 F50	V35-I52 HydrophobicContact CG1-CD1 3.99Å; V35-I52 HydrophobicContact CG2-CD1 3.81Å; V35-I52 HydrophobicContact CG2-CG1 4.46Å; F50-I52 HydrophobicContact CD2-CG1 4.33Å; F50-I52 HydrophobicContact CE2-CD1 4.26Å; F50-I52 HydrophobicContact CE2-CG1 4.17Å
53	I	93.6	Very high	93.2	Very high	77 Å²	77	66.9 Å²	66.9	40%	0.395	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121.5	176.9	-55.5	173.5	0	0	0	107.9	G59 K60 V62	I53-G59 CarbonylContact O-C 3.6Å; I53-G59 VanDerWaalsContact O-CA 3.3Å; I53-G59 WeakPolarHBondContact O-CA 3.48Å; I53-K60 HydrophobicContact CB-CB 4.38Å; I53-K60 PolarHBondContact N-O 3.18Å; I53-K60 PolarHBondContact O-N 2.85Å; I53-V62 HydrophobicContact CD1-CG2 3.62Å; I53-V62 HydrophobicContact CG1-CG2 4.48Å
54	D	90.2	Very high	93.2	Very high	116 Å²	116	63.8 Å²	63.8	62%	0.62	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-84.1	118	175.4	-164.7	-6.4	0	0	0	110.9	H56	D54-H56 WeakPolarHBondContact OD1-CA 3.41Å; D54-H56 PolarHBondContact OD1-N 2.93Å
55	D	90.4	Very high	93.3	Very high	37 Å²	37	62.6 Å²	62.6	20%	0.198	32%	0.317	C	S	.	.			trans	-101.3	13.3	175.5	73.4	-13	0	0	0	112.7	R28 R57 A58 G59	R28-D55 IonicContact NE-OD2 3.9Å; D55-R57 PolarHBondContact O-N 3.1Å; D55-R57 WeakPolarHBondContact OD1-CA 3.31Å; D55-R57 WeakPolarHBondContact OD1-CB 3.15Å; D55-R57 PolarHBondContact OD1-N 3.1Å; D55-A58 PolarHBondContact OD1-N 3.42Å; D55-G59 WeakPolarHBondContact OD1-CA 3.43Å; D55-G59 PolarHBondContact OD1-N 2.84Å
56	H	88.7	Confident	93.2	Very high	175 Å²	175	65.2 Å²	65.2	81%	0.81	33%	0.327	S	S	*	.	S	Bend	trans	53.9	18.9	-173	-65	67.3	0	0	0	113.5	D54	D54-H56 WeakPolarHBondContact OD1-CA 3.41Å; D54-H56 PolarHBondContact OD1-N 2.93Å
57	R	88	Confident	93.1	Very high	212 Å²	212	67.7 Å²	67.7	80%	0.8	35%	0.354	S	S	*	.	S	Bend	trans	-124.6	-78.7	176.6	-63.1	-180	-175.8	-171.2	4.6	110.5	D55	D55-R57 PolarHBondContact O-N 3.1Å; D55-R57 WeakPolarHBondContact OD1-CA 3.31Å; D55-R57 WeakPolarHBondContact OD1-CB 3.15Å; D55-R57 PolarHBondContact OD1-N 3.1Å
58	A	85.7	Confident	93	Very high	45 Å²	45	74.1 Å²	74.1	37%	0.372	38%	0.378	S	S	.	.	S	Bend	trans	-134.8	3.9	-175.1	0	0	0	0	0	113	P29 C30 D55	P29-A58 HydrophobicContact CB-CB 3.64Å; C30-A58 WeakPolarHBondContact CA-O 3.44Å; C30-A58 WeakPolarHBondContact CB-O 3.33Å; C30-A58 PolarHBondContact N-O 3.02Å; D55-A58 PolarHBondContact OD1-N 3.42Å
59	G	91.1	Very high	93	Very high	7 Å²	7	73.7 Å²	73.7	7%	0.072	37%	0.372	C	S	.	.			trans	67.2	163.5	-176.6	0	0	0	0	0	113.7	C30 I53 D55	C30-G59 PolarHBondContact N-O 2.92Å; I53-G59 CarbonylContact O-C 3.6Å; I53-G59 VanDerWaalsContact O-CA 3.3Å; I53-G59 WeakPolarHBondContact O-CA 3.48Å; D55-G59 WeakPolarHBondContact OD1-CA 3.43Å; D55-G59 PolarHBondContact OD1-N 2.84Å
60	K	94.8	Very high	92.8	Very high	71 Å²	71	71.2 Å²	71.2	31%	0.309	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	153	169.8	-58.1	173.4	-172.7	168.4	0	108.5	L26 I27 R28 I53	L26-K60 HydrophobicContact CD1-CB 3.93Å; L26-K60 HydrophobicContact CD1-CD 4.24Å; L26-K60 HydrophobicContact CD2-CD 4.46Å; I27-K60 WeakPolarHBondContact O-CA 3.34Å; R28-K60 HydrophobicContact CB-CG 4.39Å; R28-K60 HydrophobicContact CG-CG 4.31Å; I53-K60 HydrophobicContact CB-CB 4.38Å; I53-K60 PolarHBondContact N-O 3.18Å; I53-K60 PolarHBondContact O-N 2.85Å
61	I	95.9	Very high	92.8	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127.1	174.5	-50.5	173.9	0	0	0	107.6	L26 I27 C30 I34 V35 L38 F50 E51 V63	L26-I61 WeakPolarHBondContact CA-O 2.99Å; I27-I61 HydrophobicContact CB-CB 4.34Å; I27-I61 PolarHBondContact N-O 3.3Å; I27-I61 PolarHBondContact O-N 2.95Å; C30-I61 HydrophobicContact CB-CD1 4.19Å; C30-I61 HydrophobicContact CB-CG1 3.93Å; I34-I61 HydrophobicContact CB-CD1 4.38Å; I34-I61 HydrophobicContact CG2-CD1 3.76Å; V35-I61 HydrophobicContact CG2-CD1 3.9Å; L38-I61 HydrophobicContact CD1-CD1 4.12Å; L38-I61 HydrophobicContact CD1-CG2 3.92Å; F50-I61 HydrophobicContact CB-CG2 4.2Å; F50-I61 HydrophobicContact CD2-CG2 3.88Å; F50-I61 HydrophobicContact CG-CG2 4.43Å; E51-I61 CarbonylContact O-C 3.54Å; E51-I61 VanDerWaalsContact O-CA 3.3Å; E51-I61 WeakPolarHBondContact O-CA 3.35Å; I61-V63 HydrophobicContact CG2-CG2 3.8Å
62	V	96.1	Very high	92.8	Very high	26 Å²	26	68.5 Å²	68.5	16%	0.158	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	119.7	168.1	-178.6	0	0	0	0	107	Q24 V25 L26 F50 E51 I53	Q24-V62 HydrophobicContact CB-CG1 4.45Å; V25-V62 WeakPolarHBondContact O-CA 2.94Å; L26-V62 HydrophobicContact CD1-CG2 3.74Å; F50-V62 CarbonylContact C-O 3.55Å; F50-V62 WeakPolarHBondContact CA-O 3.28Å; F50-V62 WeakPolarHBondContact CB-O 3.42Å; E51-V62 PolarHBondContact N-O 3.4Å; E51-V62 PolarHBondContact O-N 2.89Å; I53-V62 HydrophobicContact CD1-CG2 3.62Å; I53-V62 HydrophobicContact CG1-CG2 4.48Å
63	V	96	Very high	92.8	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.3	179	-177.9	0	0	0	0	108.8	Q24 V25 I27 L38 I47 F50 I61 L65	Q24-V63 CarbonylContact C-O 3.56Å; Q24-V63 VanDerWaalsContact CA-O 3.27Å; Q24-V63 WeakPolarHBondContact CA-O 3.46Å; V25-V63 HydrophobicContact CG1-CB 3.8Å; V25-V63 HydrophobicContact CG1-CG2 4.47Å; V25-V63 PolarHBondContact N-O 3.17Å; V25-V63 PolarHBondContact O-N 2.92Å; I27-V63 HydrophobicContact CD1-CG2 3.79Å; L38-V63 HydrophobicContact CD1-CG2 3.75Å; L38-V63 HydrophobicContact CD2-CG1 4.48Å; L38-V63 HydrophobicContact CD2-CG2 4.14Å; I47-V63 HydrophobicContact CB-CG1 4.14Å; I47-V63 HydrophobicContact CD1-CG1 4.04Å; I47-V63 HydrophobicContact CG2-CG1 4.23Å; F50-V63 HydrophobicContact CB-CB 4.4Å; F50-V63 HydrophobicContact CB-CG2 4.04Å; I61-V63 HydrophobicContact CG2-CG2 3.8Å; V63-L65 HydrophobicContact CG1-CD2 4.23Å
64	N	95.9	Very high	92.9	Very high	64 Å²	64	62.5 Å²	62.5	34%	0.342	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	131.1	172.2	-67.8	-31.7	0	0	0	110.6	G48 E49	G48-N64 PolarHBondContact N-O 3.45Å; E49-N64 WeakPolarHBondContact O-CB 3.34Å; E49-N64 PolarHBondContact O-N 2.86Å; E49-N64 VanDerWaalsContact O-N 3.13Å; E49-N64 PolarHBondContact O-ND2 3.2Å
65	L	95.5	Very high	93.2	Very high	19 Å²	19	58 Å²	58	10%	0.099	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	130	-174.2	-66	-177.7	0	0	0	109.3	I14 A17 E18 K22 R23 V25 V63	I14-L65 HydrophobicContact CG2-CD2 3.97Å; A17-L65 HydrophobicContact CB-CD1 3.65Å; E18-L65 HydrophobicContact CG-CD1 3.92Å; E18-L65 HydrophobicContact CG-CD2 3.97Å; E18-L65 HydrophobicContact CG-CG 4.33Å; E18-L65 WeakPolarHBondContact OE1-CB 3.18Å; E18-L65 WeakPolarHBondContact OE1-CD2 3.4Å; K22-L65 WeakPolarHBondContact O-CB 3.4Å; K22-L65 WeakPolarHBondContact O-CD1 3.23Å; R23-L65 PolarHBondContact O-N 3.4Å; V25-L65 HydrophobicContact CB-CD1 4.26Å; V25-L65 HydrophobicContact CG1-CD1 4.18Å; V25-L65 HydrophobicContact CG1-CD2 4.22Å; V25-L65 HydrophobicContact CG1-CG 4.32Å; V63-L65 HydrophobicContact CG1-CD2 4.23Å
66	T	91.8	Very high	93.2	Very high	86 Å²	86	60.7 Å²	60.7	53%	0.528	32%	0.321	S	S	.	.			trans	-99.5	-8.5	-176.8	58	0	0	0	0	112.9	Y46 R68	Y46-T66 PolarHBondContact O-OG1 3.02Å; T66-R68 VanDerWaalsContact C-N 3.33Å
67	G	91.2	Very high	93.4	Very high	58 Å²	58	56.2 Å²	56.2	60%	0.598	31%	0.308	S	S	*	.	S	Bend	trans	84	4.3	-176	0	0	0	0	0	114.5	E18	E18-G67 PolarHBondContact OE1-N 2.73Å; E18-G67 VanDerWaalsContact OE2-CA 3.25Å; E18-G67 WeakPolarHBondContact OE2-CA 3.49Å; E18-G67 PolarHBondContact OE2-N 3.49Å
68	R	91.9	Very high	93.7	Very high	141 Å²	141	51.2 Å²	51.2	53%	0.532	29%	0.289	S	S	.	.			trans	-86.2	-20.9	-178.6	-169.3	175.7	-178.8	177.5	1.8	113.5	G45 Y46 T66	G45-R68 WeakPolarHBondContact O-CD 3.43Å; Y46-R68 HydrophobicContact CD1-CG 4.43Å; T66-R68 VanDerWaalsContact C-N 3.33Å
69	L	93.9	Very high	94.1	Very high	9 Å²	9	53.3 Å²	53.3	5%	0.047	29%	0.29	C	S	.	.			trans	-80.3	120.8	-174	-176	73.8	0	0	0	111.4	I14 E18 M41 Y46 C72 F129 F130	I14-L69 HydrophobicContact CG2-CD2 3.51Å; E18-L69 HydrophobicContact CG-CB 4.06Å; E18-L69 HydrophobicContact CG-CD2 4.04Å; M41-L69 HydrophobicContact CE-CD1 3.71Å; M41-L69 HydrophobicContact CE-CD2 4Å; M41-L69 HydrophobicContact CE-CG 4.49Å; Y46-L69 HydrophobicContact CD1-CD1 4.02Å; L69-C72 HydrophobicContact CD1-CB 4.17Å; L69-C72 HydrophobicContact CD2-CB 4.09Å; L69-F129 HydrophobicContact CD1-CB 4.07Å; L69-F130 WeakPolarHBondContact CD1-O 3.17Å
70	N	92.7	Very high	94.3	Very high	97 Å²	97	58.5 Å²	58.5	52%	0.519	32%	0.316	S	S	.	.	S	Bend	trans	-86.3	-46.4	174.8	-63.6	-59.3	0	0	0	111.9	F99 F130	N70-F99 WeakPolarHBondContact ND2-CE1 3.38Å; N70-F99 VanDerWaalsContact ND2-CZ 3.34Å; N70-F99 WeakPolarHBondContact ND2-CZ 3.35Å; N70-F130 CarbonylContact C-O 3.56Å; N70-F130 WeakPolarHBondContact CA-O 3.21Å; N70-F130 HydrophobicContact CB-CD2 4.15Å; N70-F130 WeakPolarHBondContact CB-OXT 3.13Å; N70-F130 PolarHBondContact N-O 2.96Å; N70-F130 PolarHBondContact N-OXT 3.28Å; N70-F130 PolarHBondContact ND2-OXT 2.67Å
71	K	94.9	Very high	94.2	Very high	101 Å²	101	55.4 Å²	55.4	44%	0.439	30%	0.303	S	S	.	.			trans	-157.8	123.9	-177.5	-165.8	177.6	-176.2	179.3	0	110.9	N15 F128 F129 F130	N15-K71 WeakPolarHBondContact ND2-CG 3.48Å; K71-F128 HydrophobicContact CD-CE2 4.23Å; K71-F128 HydrophobicContact CG-CE2 4.26Å; K71-F129 WeakPolarHBondContact O-CA 3.29Å; K71-F130 CarbonylContact C-O 3.48Å; K71-F130 HydrophobicContact CB-CD2 4.23Å; K71-F130 HydrophobicContact CB-CE2 3.71Å; K71-F130 HydrophobicContact CB-CZ 3.9Å; K71-F130 HydrophobicContact CD-CE2 4.46Å; K71-F130 HydrophobicContact CD-CZ 3.99Å; K71-F130 HydrophobicContact CG-CZ 4.43Å; K71-F130 PolarHBondContact N-O 3.28Å; K71-F130 PolarHBondContact O-N 2.86Å; K71-F130 VanDerWaalsContact O-O 3.09Å
72	C	95.6	Very high	94	Very high	4 Å²	4	60.6 Å²	60.6	3%	0.027	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	148.9	160.6	62.3	0	0	0	0	110.8	L11 N15 M41 L69 F128 F129	L11-C72 HydrophobicContact CB-CB 4.49Å; L11-C72 HydrophobicContact CD2-CB 4.33Å; L11-C72 PolarHBondContact O-SG 2.93Å; N15-C72 PolarHBondContact ND2-O 3.44Å; N15-C72 VanDerWaalsContact ND2-O 3.12Å; M41-C72 HydrophobicContact CE-CB 4.26Å; L69-C72 HydrophobicContact CD1-CB 4.17Å; L69-C72 HydrophobicContact CD2-CB 4.09Å; C72-F128 WeakPolarHBondContact CA-O 3.33Å; C72-F129 HydrophobicContact CB-CB 3.99Å
73	G	95.6	Very high	93.8	Very high	15 Å²	15	62.3 Å²	62.3	16%	0.155	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	154.7	-178.2	0	0	0	0	0	113.3	G127 F128	G73-G127 CarbonylContact O-C 3.58Å; G73-G127 WeakPolarHBondContact O-CA 3.46Å; G73-F128 PolarHBondContact N-O 3.14Å; G73-F128 PolarHBondContact O-N 3.13Å
74	V	95.9	Very high	93.6	Very high	29 Å²	29	69.6 Å²	69.6	18%	0.176	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	139.5	173.9	176.8	0	0	0	0	109	L7 A8 L11 L126	L7-V74 HydrophobicContact CB-CG2 4.07Å; L7-V74 HydrophobicContact CD2-CG1 4.45Å; L7-V74 HydrophobicContact CD2-CG2 3.77Å; L7-V74 HydrophobicContact CG-CG2 3.54Å; A8-V74 HydrophobicContact CB-CB 4.18Å; A8-V74 HydrophobicContact CB-CG2 4.1Å; L11-V74 HydrophobicContact CD1-CG2 3.58Å; L11-V74 HydrophobicContact CG-CG2 4.18Å; V74-L126 WeakPolarHBondContact CG1-O 3.42Å
75	I	94.7	Very high	93.4	Very high	21 Å²	21	69.1 Å²	69.1	11%	0.108	36%	0.364	C	S	.	.			trans	-88.8	126.3	169.7	-59.8	-71.6	0	0	0	108.1	F79 L93 I125 L126 F128	I75-F79 HydrophobicContact CG2-CD2 3.84Å; I75-F79 HydrophobicContact CG2-CE2 4.07Å; I75-L93 HydrophobicContact CD1-CD1 3.85Å; I75-L93 HydrophobicContact CD1-CD2 3.57Å; I75-L93 HydrophobicContact CD1-CG 4.39Å; I75-L93 HydrophobicContact CG1-CD1 4.18Å; I75-I125 HydrophobicContact CB-CG1 4.34Å; I75-I125 HydrophobicContact CB-CG2 3.97Å; I75-I125 HydrophobicContact CG1-CD1 3.96Å; I75-I125 HydrophobicContact CG1-CG1 4.07Å; I75-I125 HydrophobicContact CG2-CG2 3.67Å; I75-L126 PolarHBondContact N-O 2.93Å; I75-L126 VanDerWaalsContact N-O 3.1Å; I75-F128 HydrophobicContact CD1-CD1 3.83Å; I75-F128 HydrophobicContact CD1-CE1 3.89Å; I75-F128 HydrophobicContact CG1-CD1 4.12Å
76	S	90.8	Very high	93.2	Very high	94 Å²	94	68.4 Å²	68.4	66%	0.657	36%	0.361	S	S	*	.	S	Bend	trans	-135.1	127.5	179.2	-165.2	0	0	0	0	109.8
77	P	93.6	Very high	93.2	Very high	82 Å²	82	67.8 Å²	67.8	53%	0.532	35%	0.352	S	S	.	.	S	Bend	cis	-66.9	164.6	-3.9	28.9	-34.3	0	0	0	113.1	F79	P77-F79 HydrophobicContact CG-CD1 4.49Å; P77-F79 HydrophobicContact CG-CE1 3.81Å; P77-F79 HydrophobicContact CG-CE2 4.2Å; P77-F79 HydrophobicContact CG-CZ 3.65Å; P77-F79 VanDerWaalsContact O-CD2 3.23Å; P77-F79 WeakPolarHBondContact O-CD2 3.35Å; P77-F79 WeakPolarHBondContact O-CE2 3.38Å; P77-F79 PolarHBondContact O-N 3.38Å; P77-F79 VanDerWaalsContact O-N 3.1Å
78	R	93.5	Very high	93.3	Very high	106 Å²	106	71.8 Å²	71.8	40%	0.4	35%	0.353	S	S	.	.			trans	-78.8	93.2	177.9	-64.3	-178.9	-172.8	167.4	3.2	109.6	I125	R78-I125 WeakPolarHBondContact CB-O 3.44Å; R78-I125 WeakPolarHBondContact CG-O 3.43Å
79	F	94.4	Very high	93.4	Very high	90 Å²	90	67.7 Å²	67.7	40%	0.395	34%	0.337	S	S	.	.			trans	-67.1	143.8	179.6	-60.4	-75.8	0	0	0	112.3	I75 P77 W89 K124 I125	I75-F79 HydrophobicContact CG2-CD2 3.84Å; I75-F79 HydrophobicContact CG2-CE2 4.07Å; P77-F79 HydrophobicContact CG-CD1 4.49Å; P77-F79 HydrophobicContact CG-CE1 3.81Å; P77-F79 HydrophobicContact CG-CE2 4.2Å; P77-F79 HydrophobicContact CG-CZ 3.65Å; P77-F79 VanDerWaalsContact O-CD2 3.23Å; P77-F79 WeakPolarHBondContact O-CD2 3.35Å; P77-F79 WeakPolarHBondContact O-CE2 3.38Å; P77-F79 PolarHBondContact O-N 3.38Å; P77-F79 VanDerWaalsContact O-N 3.1Å; F79-W89 HydrophobicContact CB-CH2 4.29Å; F79-W89 HydrophobicContact CB-CZ2 3.94Å; F79-W89 AromaticContact CD2-CH2 3.5Å; F79-W89 HydrophobicContact CD2-CH2 3.5Å; F79-W89 VanDerWaalsContact CD2-CH2 3.5Å; F79-W89 HydrophobicContact CD2-CZ2 4.03Å; F79-W89 HydrophobicContact CD2-CZ3 4.42Å; F79-W89 HydrophobicContact CE2-CH2 4.03Å; F79-W89 HydrophobicContact CG-CH2 4Å; F79-W89 HydrophobicContact CG-CZ2 4.06Å; F79-K124 CarbonylContact O-C 3.56Å; F79-K124 VanDerWaalsContact O-CA 3.32Å; F79-K124 WeakPolarHBondContact O-CA 3.3Å; F79-I125 HydrophobicContact CB-CG2 4.01Å; F79-I125 HydrophobicContact CD2-CG2 4.32Å; F79-I125 PolarHBondContact O-N 3.29Å
80	D	94.8	Very high	93.4	Very high	115 Å²	115	68.3 Å²	68.3	62%	0.615	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	131	166.3	-68.9	-68.9	0	0	0	109.8	K124	D80-K124 VanDerWaalsContact CG-CE 3.48Å; D80-K124 WeakPolarHBondContact OD1-CE 3.15Å; D80-K124 WeakPolarHBondContact OD1-CG 3.45Å; D80-K124 IonicContact OD1-NZ 3.57Å; D80-K124 IonicContact OD2-NZ 3.79Å
81	V	93.4	Very high	93.4	Very high	7 Å²	7	68 Å²	68	4%	0.042	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	116.4	-175.5	-177.1	0	0	0	0	108.7	D85 L86 L104 G122 G123 I125	V81-D85 HydrophobicContact CG1-CB 4.32Å; V81-L86 HydrophobicContact CG1-CG 4.16Å; V81-L104 HydrophobicContact CB-CD2 4.1Å; V81-L104 HydrophobicContact CG1-CD2 4.46Å; V81-L104 HydrophobicContact CG2-CD2 4.27Å; V81-G122 WeakPolarHBondContact O-CA 3.41Å; V81-G123 PolarHBondContact N-O 3.11Å; V81-G123 PolarHBondContact O-N 2.87Å; V81-I125 HydrophobicContact CG2-CB 4Å; V81-I125 HydrophobicContact CG2-CG2 4.42Å
82	Q	92.7	Very high	93.3	Very high	109 Å²	109	68.5 Å²	68.5	51%	0.509	35%	0.346	S	S	.	.			trans	-81.6	160.3	170.2	-61	-171.8	-15.7	0	0	110.6	K84 D85 L86	Q82-K84 HydrophobicContact CB-CG 4.14Å; Q82-K84 PolarHBondContact O-N 3.5Å; Q82-K84 VanDerWaalsContact O-N 3.13Å; Q82-D85 PolarHBondContact O-N 3.12Å; Q82-L86 PolarHBondContact O-N 3.18Å
83	L	90.5	Very high	93.2	Very high	62 Å²	62	70 Å²	70	33%	0.325	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-32.8	179.5	-173.5	65.9	0	0	0	113	L86 R117 H120	L83-L86 HydrophobicContact CD1-CD1 3.97Å; L83-R117 HydrophobicContact CD1-CB 4.4Å; L83-R117 HydrophobicContact CD1-CG 4.1Å; L83-H120 HydrophobicContact CD2-CB 4.49Å
84	K	92.2	Very high	93.1	Very high	153 Å²	153	70.1 Å²	70.1	67%	0.665	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-29.7	177.3	73.4	-168	-167.8	-161.6	0	113.4	Q82	Q82-K84 HydrophobicContact CB-CG 4.14Å; Q82-K84 PolarHBondContact O-N 3.5Å; Q82-K84 VanDerWaalsContact O-N 3.13Å
85	D	92.6	Very high	92.9	Very high	53 Å²	53	72.7 Å²	72.7	28%	0.283	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-12.4	-175	-59.7	-43.8	0	0	0	112.1	V81 Q82 E87 K88 W89	V81-D85 HydrophobicContact CG1-CB 4.32Å; Q82-D85 PolarHBondContact O-N 3.12Å; D85-E87 VanDerWaalsContact C-N 3.27Å; D85-E87 PolarHBondContact O-N 3.27Å; D85-K88 WeakPolarHBondContact O-CB 3.43Å; D85-K88 PolarHBondContact O-N 2.91Å; D85-K88 VanDerWaalsContact O-N 3.12Å; D85-W89 PolarHBondContact O-N 3.24Å; D85-W89 VanDerWaalsContact O-N 3.11Å
86	L	91.3	Very high	92.8	Very high	5 Å²	5	74.3 Å²	74.3	3%	0.026	38%	0.381	C	S	.	.	H	α-helix	trans	-54.6	-40.7	-178.9	-108.1	164.4	0	0	0	113.1	V81 Q82 L83 W89 Q90 L104 H113	V81-L86 HydrophobicContact CG1-CG 4.16Å; Q82-L86 PolarHBondContact O-N 3.18Å; L83-L86 HydrophobicContact CD1-CD1 3.97Å; L86-W89 PolarHBondContact O-N 3.25Å; L86-Q90 WeakPolarHBondContact O-CG 3.34Å; L86-Q90 PolarHBondContact O-N 2.93Å; L86-L104 HydrophobicContact CD1-CD1 4.5Å; L86-L104 HydrophobicContact CD2-CD1 3.96Å; L86-H113 HydrophobicContact CD2-CB 3.55Å
87	E	91.2	Very high	92.7	Very high	73 Å²	73	77.5 Å²	77.5	34%	0.341	38%	0.379	S	S	.	.	H	α-helix	trans	-67.6	-37.4	179.8	-174.9	156.7	-155.6	0	0	112.1	D85 W89 Q90 N91 R97	D85-E87 VanDerWaalsContact C-N 3.27Å; D85-E87 PolarHBondContact O-N 3.27Å; E87-W89 PolarHBondContact O-N 3.29Å; E87-Q90 PolarHBondContact O-N 2.83Å; E87-N91 VanDerWaalsContact O-CG 3.31Å; E87-N91 PolarHBondContact O-N 3.41Å; E87-N91 PolarHBondContact O-ND2 3.21Å; E87-R97 IonicContact OE1-CZ 3.34Å; E87-R97 IonicContact OE1-NH1 2.89Å; E87-R97 PolarHBondContact OE1-NH1 2.75Å; E87-R97 IonicContact OE1-NH2 2.81Å; E87-R97 PolarHBondContact OE1-NH2 2.97Å
88	K	93.7	Very high	92.4	Very high	142 Å²	142	82.8 Å²	82.8	62%	0.617	40%	0.396	S	S	*	.	H	α-helix	trans	-62.4	-43.7	173.3	-177.1	-179.4	179.1	179.9	0	111.1	D85 N92	D85-K88 WeakPolarHBondContact O-CB 3.43Å; D85-K88 PolarHBondContact O-N 2.91Å; D85-K88 VanDerWaalsContact O-N 3.12Å; K88-N92 WeakPolarHBondContact O-CB 3.26Å; K88-N92 PolarHBondContact O-N 3.45Å; K88-N92 PolarHBondContact O-ND2 3.07Å
89	W	93.7	Very high	92.3	Very high	54 Å²	54	80.8 Å²	80.8	21%	0.205	39%	0.391	C	S	.	.	H	α-helix	trans	-67.1	-38.5	177.9	-75.6	105.3	0	0	0	112.8	F79 D85 L86 E87 N92 L93 I102 I125	F79-W89 HydrophobicContact CB-CH2 4.29Å; F79-W89 HydrophobicContact CB-CZ2 3.94Å; F79-W89 AromaticContact CD2-CH2 3.5Å; F79-W89 HydrophobicContact CD2-CH2 3.5Å; F79-W89 VanDerWaalsContact CD2-CH2 3.5Å; F79-W89 HydrophobicContact CD2-CZ2 4.03Å; F79-W89 HydrophobicContact CD2-CZ3 4.42Å; F79-W89 HydrophobicContact CE2-CH2 4.03Å; F79-W89 HydrophobicContact CG-CH2 4Å; F79-W89 HydrophobicContact CG-CZ2 4.06Å; D85-W89 PolarHBondContact O-N 3.24Å; D85-W89 VanDerWaalsContact O-N 3.11Å; L86-W89 PolarHBondContact O-N 3.25Å; E87-W89 PolarHBondContact O-N 3.29Å; W89-N92 PolarHBondContact O-N 3.14Å; W89-L93 HydrophobicContact CE3-CD1 3.79Å; W89-L93 HydrophobicContact CE3-CG 4.21Å; W89-L93 HydrophobicContact CZ3-CD1 4.43Å; W89-L93 WeakPolarHBondContact O-CB 3.38Å; W89-L93 WeakPolarHBondContact O-CG 3.5Å; W89-L93 PolarHBondContact O-N 3.38Å; W89-I102 HydrophobicContact CB-CD1 4.06Å; W89-I125 HydrophobicContact CD2-CD1 4.26Å; W89-I125 HydrophobicContact CE3-CD1 4.03Å
90	Q	92.8	Very high	92.3	Very high	22 Å²	22	76.8 Å²	76.8	10%	0.103	38%	0.375	C	S	.	.	H	α-helix	trans	-59.3	-51.2	174.4	-74.7	167.8	25.1	0	0	111.4	L86 E87 N92 L93 L94 I102 H113	L86-Q90 WeakPolarHBondContact O-CG 3.34Å; L86-Q90 PolarHBondContact O-N 2.93Å; E87-Q90 PolarHBondContact O-N 2.83Å; Q90-N92 PolarHBondContact O-N 3.33Å; Q90-L93 PolarHBondContact O-N 2.91Å; Q90-L94 HydrophobicContact CB-CD1 4.33Å; Q90-L94 HydrophobicContact CG-CD1 4.17Å; Q90-L94 WeakPolarHBondContact O-CB 3.21Å; Q90-L94 PolarHBondContact O-N 3.24Å; Q90-I102 HydrophobicContact CB-CD1 4.46Å; Q90-I102 HydrophobicContact CG-CD1 3.95Å; Q90-H113 PolarHBondContact NE2-CD2 3.34Å
91	N	93.4	Very high	92.3	Very high	91 Å²	91	72.7 Å²	72.7	49%	0.487	35%	0.352	S	S	.	.	H	α-helix	trans	-62	-31.4	-179.3	-67.5	-21.4	0	0	0	112.8	E87	E87-N91 VanDerWaalsContact O-CG 3.31Å; E87-N91 PolarHBondContact O-N 3.41Å; E87-N91 PolarHBondContact O-ND2 3.21Å
92	N	92.9	Very high	92.4	Very high	111 Å²	111	72.4 Å²	72.4	59%	0.594	35%	0.35	S	S	*	.	H	α-helix	trans	-83.5	-32.4	-178.5	-70.2	-13.1	0	0	0	113.7	K88 W89 Q90	K88-N92 WeakPolarHBondContact O-CB 3.26Å; K88-N92 PolarHBondContact O-N 3.45Å; K88-N92 PolarHBondContact O-ND2 3.07Å; W89-N92 PolarHBondContact O-N 3.14Å; Q90-N92 PolarHBondContact O-N 3.33Å
93	L	92.8	Very high	92.6	Very high	37 Å²	37	67.2 Å²	67.2	19%	0.194	33%	0.326	C	S	.	.	H	α-helix	trans	-103.7	-33.6	-171.1	-66.9	178	0	0	0	113.8	I75 W89 Q90 I102 I125 F128 F130	I75-L93 HydrophobicContact CD1-CD1 3.85Å; I75-L93 HydrophobicContact CD1-CD2 3.57Å; I75-L93 HydrophobicContact CD1-CG 4.39Å; I75-L93 HydrophobicContact CG1-CD1 4.18Å; W89-L93 HydrophobicContact CE3-CD1 3.79Å; W89-L93 HydrophobicContact CE3-CG 4.21Å; W89-L93 HydrophobicContact CZ3-CD1 4.43Å; W89-L93 WeakPolarHBondContact O-CB 3.38Å; W89-L93 WeakPolarHBondContact O-CG 3.5Å; W89-L93 PolarHBondContact O-N 3.38Å; Q90-L93 PolarHBondContact O-N 2.91Å; L93-I102 HydrophobicContact CB-CD1 4.34Å; L93-I102 HydrophobicContact CD1-CD1 4.05Å; L93-I102 HydrophobicContact CD1-CG1 4.3Å; L93-I125 HydrophobicContact CD1-CD1 3.54Å; L93-F128 HydrophobicContact CD2-CD1 4.44Å; L93-F130 WeakPolarHBondContact O-CE1 3.38Å
94	L	93.4	Very high	92.8	Very high	16 Å²	16	64.3 Å²	64.3	8%	0.084	31%	0.31	C	S	.	.			trans	-95.6	140.8	-175.1	-57.1	-178.4	0	0	0	110.1	Q90 S96 I102 F130	Q90-L94 HydrophobicContact CB-CD1 4.33Å; Q90-L94 HydrophobicContact CG-CD1 4.17Å; Q90-L94 WeakPolarHBondContact O-CB 3.21Å; Q90-L94 PolarHBondContact O-N 3.24Å; L94-S96 VanDerWaalsContact C-N 3.28Å; L94-S96 PolarHBondContact O-N 2.81Å; L94-I102 HydrophobicContact CD1-CD1 4.48Å; L94-I102 HydrophobicContact CD1-CG1 4.29Å; L94-I102 HydrophobicContact CD2-CG1 4.11Å; L94-I102 HydrophobicContact CG-CD1 4.37Å; L94-I102 HydrophobicContact CG-CG1 4.16Å; L94-F130 HydrophobicContact CD2-CD1 4.27Å
95	P	93.6	Very high	93	Very high	83 Å²	83	59.5 Å²	59.5	54%	0.539	29%	0.294	S	S	.	.	S	Bend	trans	-71	-24	-179.7	30.4	-37.2	0	0	0	112.8	F99 F130	P95-F99 HydrophobicContact CG-CD1 3.7Å; P95-F99 HydrophobicContact CG-CE1 4.43Å; P95-F130 HydrophobicContact CG-CD2 4.01Å; P95-F130 HydrophobicContact CG-CE2 4.27Å; P95-F130 HydrophobicContact CG-CG 4.18Å
96	S	92.1	Very high	93.1	Very high	56 Å²	56	57.6 Å²	57.6	39%	0.392	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-151.1	161.9	174.2	84.3	0	0	0	0	111.4	L94 Q98 F99	L94-S96 VanDerWaalsContact C-N 3.28Å; L94-S96 PolarHBondContact O-N 2.81Å; S96-Q98 PolarHBondContact O-N 2.86Å; S96-Q98 PolarHBondContact OG-N 3.03Å; S96-F99 PolarHBondContact O-N 3.06Å; S96-F99 VanDerWaalsContact O-O 3.13Å; S96-F99 WeakPolarHBondContact OG-CB 3.43Å; S96-F99 PolarHBondContact OG-N 2.86Å
97	R	87.8	Confident	93.1	Very high	160 Å²	160	63.3 Å²	63.3	60%	0.604	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-20.6	178.1	-68.5	179.4	77.6	96.8	-8.3	113.6	E87	E87-R97 IonicContact OE1-CZ 3.34Å; E87-R97 IonicContact OE1-NH1 2.89Å; E87-R97 PolarHBondContact OE1-NH1 2.75Å; E87-R97 IonicContact OE1-NH2 2.81Å; E87-R97 PolarHBondContact OE1-NH2 2.97Å
98	Q	88.5	Confident	93.1	Very high	194 Å²	194	63.1 Å²	63.1	91%	0.907	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-2.8	-178	-68	-179.1	-28.7	0	0	112.6	S96	S96-Q98 PolarHBondContact O-N 2.86Å; S96-Q98 PolarHBondContact OG-N 3.03Å
99	F	90.6	Very high	93.1	Very high	64 Å²	64	57.8 Å²	57.8	28%	0.281	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-132.3	125.1	-171.5	-168.4	-107.9	0	0	0	112.6	Y46 N70 P95 S96 F130	Y46-F99 HydrophobicContact CE1-CE2 4.44Å; Y46-F99 HydrophobicContact CE1-CZ 4.28Å; N70-F99 WeakPolarHBondContact ND2-CE1 3.38Å; N70-F99 VanDerWaalsContact ND2-CZ 3.34Å; N70-F99 WeakPolarHBondContact ND2-CZ 3.35Å; P95-F99 HydrophobicContact CG-CD1 3.7Å; P95-F99 HydrophobicContact CG-CE1 4.43Å; S96-F99 PolarHBondContact O-N 3.06Å; S96-F99 VanDerWaalsContact O-O 3.13Å; S96-F99 WeakPolarHBondContact OG-CB 3.43Å; S96-F99 PolarHBondContact OG-N 2.86Å; F99-F130 HydrophobicContact CD1-CB 3.86Å; F99-F130 HydrophobicContact CE1-CB 3.62Å; F99-F130 HydrophobicContact CE1-CD2 4.21Å; F99-F130 HydrophobicContact CE1-CG 4.38Å; F99-F130 WeakPolarHBondContact CE1-OXT 3.46Å; F99-F130 HydrophobicContact CZ-CB 4.39Å; F99-F130 WeakPolarHBondContact CZ-OXT 3.49Å
100	G	93.8	Very high	93.2	Very high	6 Å²	6	57 Å²	57	6%	0.062	32%	0.321	C	S	.	.			trans	95.1	161.9	178.6	0	0	0	0	0	114.1	F129	G100-F129 CarbonylContact C-O 3.51Å; G100-F129 VanDerWaalsContact CA-O 3.28Å; G100-F129 WeakPolarHBondContact CA-O 2.79Å
101	F	95.6	Very high	93.3	Very high	29 Å²	29	56.2 Å²	56.2	13%	0.127	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135.5	-178.6	-61.9	-87.2	0	0	0	111.2	H44 Y46 D112 H113 E114 F128 F129	H44-F101 HydrophobicContact CB-CD2 4.2Å; H44-F101 HydrophobicContact CB-CE2 3.98Å; H44-F101 AromaticContact CE1-CD1 3.56Å; H44-F101 AromaticContact CE1-CE1 3.26Å; H44-F101 WeakPolarHBondContact CE1-CE1 3.45Å; H44-F101 AromaticContact CE1-CE2 3.99Å; H44-F101 AromaticContact CE1-CZ 3.5Å; H44-F101 VanDerWaalsContact CE1-CZ 3.5Å; H44-F101 WeakPolarHBondContact CE1-CZ 3.43Å; H44-F101 AromaticContact CG-CD2 3.86Å; H44-F101 AromaticContact CG-CE2 3.7Å; H44-F101 AromaticContact CG-CZ 3.96Å; H44-F101 AromaticContact ND1-CD2 3.95Å; H44-F101 AromaticContact ND1-CE1 3.52Å; H44-F101 AromaticContact ND1-CE2 3.43Å; H44-F101 WeakPolarHBondContact ND1-CE2 3.48Å; H44-F101 AromaticContact ND1-CZ 3.21Å; H44-F101 WeakPolarHBondContact ND1-CZ 3.48Å; H44-F101 AromaticContact NE2-CD1 3.79Å; H44-F101 AromaticContact NE2-CE1 3.97Å; Y46-F101 AromaticContact CE2-CD2 3.82Å; Y46-F101 HydrophobicContact CE2-CD2 3.82Å; Y46-F101 AromaticContact CE2-CE2 3.87Å; Y46-F101 HydrophobicContact CE2-CE2 3.87Å; F101-D112 HydrophobicContact CD1-CB 4.31Å; F101-H113 AromaticContact CD1-CE1 3.55Å; F101-H113 AromaticContact CD1-ND1 3.93Å; F101-E114 HydrophobicContact CE1-CG 4.37Å; F101-F128 VanDerWaalsContact O-CA 3.31Å; F101-F128 WeakPolarHBondContact O-CA 3.42Å; F101-F129 HydrophobicContact CB-CD2 4.45Å; F101-F129 HydrophobicContact CB-CE1 4Å; F101-F129 HydrophobicContact CB-CE2 3.81Å; F101-F129 HydrophobicContact CB-CZ 3.56Å; F101-F129 HydrophobicContact CD2-CD2 4.44Å; F101-F129 AromaticContact CD2-CE2 3.62Å; F101-F129 HydrophobicContact CD2-CE2 3.62Å; F101-F129 HydrophobicContact CD2-CZ 4.05Å; F101-F129 HydrophobicContact CG-CE2 4.1Å; F101-F129 HydrophobicContact CG-CZ 4.09Å; F101-F129 PolarHBondContact N-O 3.47Å; F101-F129 PolarHBondContact O-N 3.45Å
102	I	95.4	Very high	93.3	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	133.7	165.6	-60.8	170.2	0	0	0	108.2	W89 Q90 L93 L94 L104 D112 H113 I125	W89-I102 HydrophobicContact CB-CD1 4.06Å; Q90-I102 HydrophobicContact CB-CD1 4.46Å; Q90-I102 HydrophobicContact CG-CD1 3.95Å; L93-I102 HydrophobicContact CB-CD1 4.34Å; L93-I102 HydrophobicContact CD1-CD1 4.05Å; L93-I102 HydrophobicContact CD1-CG1 4.3Å; L94-I102 HydrophobicContact CD1-CD1 4.48Å; L94-I102 HydrophobicContact CD1-CG1 4.29Å; L94-I102 HydrophobicContact CD2-CG1 4.11Å; L94-I102 HydrophobicContact CG-CD1 4.37Å; L94-I102 HydrophobicContact CG-CG1 4.16Å; I102-L104 HydrophobicContact CG2-CG 4.38Å; I102-D112 CarbonylContact O-C 3.53Å; I102-D112 WeakPolarHBondContact O-CA 3.42Å; I102-H113 HydrophobicContact CB-CB 4.15Å; I102-H113 PolarHBondContact N-ND1 2.91Å; I102-H113 VanDerWaalsContact N-ND1 3.18Å; I102-H113 PolarHBondContact O-N 3.16Å; I102-I125 HydrophobicContact CG2-CD1 3.58Å; I102-I125 HydrophobicContact CG2-CG1 3.73Å
103	V	96.1	Very high	93.3	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	130.7	176.7	-176.6	0	0	0	0	109.5	F37 V40 I110 L126 G127 F129	F37-V103 HydrophobicContact CD2-CB 3.98Å; F37-V103 HydrophobicContact CD2-CG1 3.74Å; F37-V103 HydrophobicContact CD2-CG2 4.11Å; F37-V103 HydrophobicContact CE1-CG2 4.27Å; F37-V103 HydrophobicContact CE2-CB 3.5Å; F37-V103 HydrophobicContact CE2-CG1 3.82Å; F37-V103 HydrophobicContact CE2-CG2 3.59Å; F37-V103 HydrophobicContact CZ-CB 4.09Å; F37-V103 HydrophobicContact CZ-CG2 3.67Å; V40-V103 HydrophobicContact CG1-CG2 4.25Å; V103-I110 HydrophobicContact CG1-CG2 3.41Å; V103-I110 VanDerWaalsContact CG1-CG2 3.41Å; V103-L126 HydrophobicContact CG1-CB 4.38Å; V103-L126 HydrophobicContact CG1-CD1 4.09Å; V103-L126 PolarHBondContact O-N 3.3Å; V103-G127 PolarHBondContact N-O 3.28Å; V103-G127 PolarHBondContact O-N 2.93Å; V103-F129 HydrophobicContact CG2-CD1 3.82Å; V103-F129 HydrophobicContact CG2-CE1 3.41Å; V103-F129 VanDerWaalsContact CG2-CE1 3.41Å
104	L	95.6	Very high	93.3	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	144.1	-177.8	-63.7	148.1	0	0	0	109.9	V81 L86 I102 T106 I110 M111 H113 A116 K124 I125	V81-L104 HydrophobicContact CB-CD2 4.1Å; V81-L104 HydrophobicContact CG1-CD2 4.46Å; V81-L104 HydrophobicContact CG2-CD2 4.27Å; L86-L104 HydrophobicContact CD1-CD1 4.5Å; L86-L104 HydrophobicContact CD2-CD1 3.96Å; I102-L104 HydrophobicContact CG2-CG 4.38Å; L104-T106 HydrophobicContact CB-CG2 4.33Å; L104-I110 WeakPolarHBondContact O-CA 3.3Å; L104-M111 PolarHBondContact N-O 2.97Å; L104-M111 PolarHBondContact O-N 2.99Å; L104-H113 HydrophobicContact CD1-CB 4.09Å; L104-A116 HydrophobicContact CD1-CB 3.88Å; L104-K124 CarbonylContact C-O 3.55Å; L104-K124 WeakPolarHBondContact CA-O 3.48Å; L104-I125 HydrophobicContact CD2-CB 4.24Å
105	T	95.6	Very high	93.3	Very high	52 Å²	52	50.9 Å²	50.9	32%	0.319	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	114.6	161.1	-80.5	0	0	0	0	108.1	G123 K124 L126	T105-G123 CarbonylContact O-C 3.47Å; T105-G123 WeakPolarHBondContact O-CA 3.47Å; T105-K124 PolarHBondContact N-O 3.13Å; T105-K124 PolarHBondContact O-N 3.2Å; T105-L126 WeakPolarHBondContact OG1-CD1 3.22Å
106	T	94.6	Very high	93.3	Very high	12 Å²	12	46.9 Å²	46.9	7%	0.074	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	172.9	170.6	75.8	0	0	0	0	109.6	L104 A108 G109 M111 G122	L104-T106 HydrophobicContact CB-CG2 4.33Å; T106-A108 PolarHBondContact O-N 2.75Å; T106-A108 PolarHBondContact OG1-N 2.93Å; T106-G109 PolarHBondContact N-O 2.83Å; T106-G109 PolarHBondContact O-N 2.81Å; T106-G109 VanDerWaalsContact O-N 3.13Å; T106-G109 PolarHBondContact OG1-O 3.03Å; T106-M111 HydrophobicContact CG2-CE 4.43Å; T106-M111 HydrophobicContact CG2-CG 4.08Å; T106-M111 HydrophobicContact CG2-SD 3.92Å; T106-M111 WeakPolarHBondContact OG1-CE 3.21Å; T106-G122 WeakPolarHBondContact CB-O 3.18Å; T106-G122 WeakPolarHBondContact CG2-O 3.38Å
107	S	91.9	Very high	93.3	Very high	126 Å²	126	50.7 Å²	50.7	88%	0.881	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.3	173.9	49.7	0	0	0	0	113	G109	S107-G109 VanDerWaalsContact C-N 3.33Å
108	A	90.9	Very high	93.6	Very high	68 Å²	68	52.1 Å²	52.1	56%	0.562	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-1	177.8	0	0	0	0	0	113.6	T106 M111	T106-A108 PolarHBondContact O-N 2.75Å; T106-A108 PolarHBondContact OG1-N 2.93Å; A108-M111 HydrophobicContact CB-CE 3.91Å
109	G	93.5	Very high	93.8	Very high	31 Å²	31	47.9 Å²	47.9	32%	0.32	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	127.1	-168.8	176.7	0	0	0	0	0	114	T106 S107	T106-G109 PolarHBondContact N-O 2.83Å; T106-G109 PolarHBondContact O-N 2.81Å; T106-G109 VanDerWaalsContact O-N 3.13Å; T106-G109 PolarHBondContact OG1-O 3.03Å; S107-G109 VanDerWaalsContact C-N 3.33Å
110	I	95.6	Very high	93.9	Very high	38 Å²	38	52 Å²	52	20%	0.195	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	124.1	174.8	-65.1	170.1	0	0	0	108.1	V33 R36 V40 V103 L104 L126	V33-I110 HydrophobicContact CB-CD1 4.45Å; V33-I110 HydrophobicContact CG1-CD1 4.03Å; R36-I110 HydrophobicContact CB-CB 4.17Å; R36-I110 HydrophobicContact CB-CD1 3.71Å; R36-I110 HydrophobicContact CB-CG1 4.46Å; R36-I110 HydrophobicContact CG-CD1 4.34Å; V40-I110 HydrophobicContact CG2-CG2 4.43Å; V103-I110 HydrophobicContact CG1-CG2 3.41Å; V103-I110 VanDerWaalsContact CG1-CG2 3.41Å; L104-I110 WeakPolarHBondContact O-CA 3.3Å; I110-L126 HydrophobicContact CB-CD1 4.46Å; I110-L126 HydrophobicContact CD1-CD1 3.86Å; I110-L126 HydrophobicContact CG1-CD1 3.82Å; I110-L126 HydrophobicContact CG2-CD1 3.82Å
111	M	95	Very high	93.9	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.02	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	166.1	-176.6	63.1	-169.8	61.9	0	0	111.4	L104 T106 A108 E115 A116 K119	L104-M111 PolarHBondContact N-O 2.97Å; L104-M111 PolarHBondContact O-N 2.99Å; T106-M111 HydrophobicContact CG2-CE 4.43Å; T106-M111 HydrophobicContact CG2-CG 4.08Å; T106-M111 HydrophobicContact CG2-SD 3.92Å; T106-M111 WeakPolarHBondContact OG1-CE 3.21Å; A108-M111 HydrophobicContact CB-CE 3.91Å; M111-E115 HydrophobicContact CB-CB 4.22Å; M111-E115 HydrophobicContact CB-CG 4.27Å; M111-E115 HydrophobicContact SD-CG 4.31Å; M111-A116 HydrophobicContact CG-CB 4.26Å; M111-A116 HydrophobicContact SD-CB 4.16Å; M111-K119 HydrophobicContact CE-CD 4.08Å; M111-K119 HydrophobicContact SD-CD 4.09Å
112	D	94.4	Very high	93.7	Very high	5 Å²	5	53.2 Å²	53.2	3%	0.027	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	162.3	171.6	62.9	-76.9	0	0	0	111.7	V40 K43 H44 F101 I102 E114 E115 A116	V40-D112 HydrophobicContact CG1-CB 4.22Å; K43-D112 IonicContact NZ-OD1 2.67Å; H44-D112 IonicContact NE2-OD1 3.77Å; F101-D112 HydrophobicContact CD1-CB 4.31Å; I102-D112 CarbonylContact O-C 3.53Å; I102-D112 WeakPolarHBondContact O-CA 3.42Å; D112-E114 VanDerWaalsContact C-N 3.29Å; D112-E114 PolarHBondContact O-N 2.87Å; D112-E114 WeakPolarHBondContact OD2-CB 3.19Å; D112-E114 PolarHBondContact OD2-N 2.93Å; D112-E114 VanDerWaalsContact OD2-N 3.12Å; D112-E115 PolarHBondContact O-N 3.43Å; D112-E115 VanDerWaalsContact OD1-CB 3.22Å; D112-E115 WeakPolarHBondContact OD1-CB 3.49Å; D112-E115 PolarHBondContact OD2-N 2.96Å; D112-A116 WeakPolarHBondContact O-CB 3.23Å; D112-A116 PolarHBondContact O-N 3.14Å
113	H	93	Very high	93.6	Very high	11 Å²	11	54 Å²	54	5%	0.051	29%	0.291	C	S	.	.	H	α-helix	trans	-64.7	-26.9	-179.5	69.5	-78.9	0	0	0	114.8	L86 Q90 F101 I102 L104 R117	L86-H113 HydrophobicContact CD2-CB 3.55Å; Q90-H113 PolarHBondContact NE2-CD2 3.34Å; F101-H113 AromaticContact CD1-CE1 3.55Å; F101-H113 AromaticContact CD1-ND1 3.93Å; I102-H113 HydrophobicContact CB-CB 4.15Å; I102-H113 PolarHBondContact N-ND1 2.91Å; I102-H113 VanDerWaalsContact N-ND1 3.18Å; I102-H113 PolarHBondContact O-N 3.16Å; L104-H113 HydrophobicContact CD1-CB 4.09Å; H113-R117 PolarHBondContact O-N 2.92Å; H113-R117 VanDerWaalsContact O-N 3.13Å
114	E	92.6	Very high	93.6	Very high	81 Å²	81	58.6 Å²	58.6	38%	0.379	31%	0.311	S	S	.	.	H	α-helix	trans	-73.7	-44.5	175.3	-58.3	-171.5	172.9	0	0	110.2	F101 D112 A116 R117 R118	F101-E114 HydrophobicContact CE1-CG 4.37Å; D112-E114 VanDerWaalsContact C-N 3.29Å; D112-E114 PolarHBondContact O-N 2.87Å; D112-E114 WeakPolarHBondContact OD2-CB 3.19Å; D112-E114 PolarHBondContact OD2-N 2.93Å; D112-E114 VanDerWaalsContact OD2-N 3.12Å; E114-A116 VanDerWaalsContact C-N 3.31Å; E114-A116 PolarHBondContact O-N 3.13Å; E114-R117 WeakPolarHBondContact O-CB 3.42Å; E114-R117 PolarHBondContact O-N 3.34Å; E114-R117 VanDerWaalsContact O-N 3.12Å; E114-R118 WeakPolarHBondContact O-CG 3.29Å; E114-R118 PolarHBondContact O-N 2.89Å; E114-R118 IonicContact OE2-NH2 2.76Å
115	E	93.1	Very high	93.6	Very high	46 Å²	46	58.5 Å²	58.5	22%	0.215	31%	0.311	C	S	.	.	H	α-helix	trans	-61.9	-40.2	175	-170.5	174.5	157.5	0	0	111.5	K43 M111 D112 R117 R118 K119	K43-E115 IonicContact NZ-OE2 3.91Å; K43-E115 PolarHBondContact NZ-OE2 3.36Å; M111-E115 HydrophobicContact CB-CB 4.22Å; M111-E115 HydrophobicContact CB-CG 4.27Å; M111-E115 HydrophobicContact SD-CG 4.31Å; D112-E115 PolarHBondContact O-N 3.43Å; D112-E115 VanDerWaalsContact OD1-CB 3.22Å; D112-E115 WeakPolarHBondContact OD1-CB 3.49Å; D112-E115 PolarHBondContact OD2-N 2.96Å; E115-R117 VanDerWaalsContact C-N 3.29Å; E115-R117 PolarHBondContact O-N 3.38Å; E115-R118 PolarHBondContact O-N 3.13Å; E115-K119 HydrophobicContact CG-CD 4.22Å; E115-K119 WeakPolarHBondContact O-CB 3.32Å; E115-K119 PolarHBondContact O-N 3.39Å; E115-K119 WeakPolarHBondContact OE1-CE 3.33Å; E115-K119 IonicContact OE1-NZ 3.98Å; E115-K119 PolarHBondContact OE1-NZ 3.46Å
116	A	93.9	Very high	93.6	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.2	-40.2	173.1	0	0	0	0	0	111.9	L104 M111 D112 E114 H120 T121	L104-A116 HydrophobicContact CD1-CB 3.88Å; M111-A116 HydrophobicContact CG-CB 4.26Å; M111-A116 HydrophobicContact SD-CB 4.16Å; D112-A116 WeakPolarHBondContact O-CB 3.23Å; D112-A116 PolarHBondContact O-N 3.14Å; E114-A116 VanDerWaalsContact C-N 3.31Å; E114-A116 PolarHBondContact O-N 3.13Å; A116-H120 PolarHBondContact O-N 2.88Å; A116-H120 VanDerWaalsContact O-N 3.14Å; A116-T121 PolarHBondContact O-N 2.76Å
117	R	92.5	Very high	93.6	Very high	135 Å²	135	55.5 Å²	55.5	51%	0.509	29%	0.292	S	S	.	.	H	α-helix	trans	-66.8	-43.8	176.6	-158.2	179.8	-156.5	179	8	112	L83 H113 E114 E115 K119 H120	L83-R117 HydrophobicContact CD1-CB 4.4Å; L83-R117 HydrophobicContact CD1-CG 4.1Å; H113-R117 PolarHBondContact O-N 2.92Å; H113-R117 VanDerWaalsContact O-N 3.13Å; E114-R117 WeakPolarHBondContact O-CB 3.42Å; E114-R117 PolarHBondContact O-N 3.34Å; E114-R117 VanDerWaalsContact O-N 3.12Å; E115-R117 VanDerWaalsContact C-N 3.29Å; E115-R117 PolarHBondContact O-N 3.38Å; R117-K119 VanDerWaalsContact C-N 3.33Å; R117-K119 PolarHBondContact O-N 3.12Å; R117-H120 PolarHBondContact O-N 2.94Å; R117-H120 VanDerWaalsContact O-N 3.13Å
118	R	93.4	Very high	93.8	Very high	191 Å²	191	50.6 Å²	50.6	72%	0.721	26%	0.255	S	S	*	.	H	α-helix	trans	-62.9	-39	177.3	-67.9	177.8	-161.9	-177	7.6	112.2	E114 E115 H120	E114-R118 WeakPolarHBondContact O-CG 3.29Å; E114-R118 PolarHBondContact O-N 2.89Å; E114-R118 IonicContact OE2-NH2 2.76Å; E115-R118 PolarHBondContact O-N 3.13Å; R118-H120 PolarHBondContact O-N 3.12Å
119	K	93.7	Very high	94	Very high	105 Å²	105	47.3 Å²	47.3	46%	0.457	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-2.4	177.2	-71.5	177	173.1	170.4	0	113.5	M111 E115 R117 T121	M111-K119 HydrophobicContact CE-CD 4.08Å; M111-K119 HydrophobicContact SD-CD 4.09Å; E115-K119 HydrophobicContact CG-CD 4.22Å; E115-K119 WeakPolarHBondContact O-CB 3.32Å; E115-K119 PolarHBondContact O-N 3.39Å; E115-K119 WeakPolarHBondContact OE1-CE 3.33Å; E115-K119 IonicContact OE1-NZ 3.98Å; E115-K119 PolarHBondContact OE1-NZ 3.46Å; R117-K119 VanDerWaalsContact C-N 3.33Å; R117-K119 PolarHBondContact O-N 3.12Å; K119-T121 HydrophobicContact CB-CG2 4.25Å; K119-T121 PolarHBondContact O-N 3.02Å
120	H	92.6	Very high	94.1	Very high	149 Å²	149	47.3 Å²	47.3	69%	0.69	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	39.2	-173.5	-70.3	-87.8	0	0	0	113.3	L83 A116 R117 R118	L83-H120 HydrophobicContact CD2-CB 4.49Å; A116-H120 PolarHBondContact O-N 2.88Å; A116-H120 VanDerWaalsContact O-N 3.14Å; R117-H120 PolarHBondContact O-N 2.94Å; R117-H120 VanDerWaalsContact O-N 3.13Å; R118-H120 PolarHBondContact O-N 3.12Å
121	T	92.9	Very high	94	Very high	31 Å²	31	47.8 Å²	47.8	19%	0.19	22%	0.221	C	C	.	.			trans	-115.6	138.1	-179.2	54.2	0	0	0	0	111.6	A116 K119	A116-T121 PolarHBondContact O-N 2.76Å; K119-T121 HydrophobicContact CB-CG2 4.25Å; K119-T121 PolarHBondContact O-N 3.02Å
122	G	91.2	Very high	94	Very high	31 Å²	31	50.1 Å²	50.1	32%	0.32	23%	0.231	S	C	.	.			trans	-95.4	-172.8	165	0	0	0	0	0	111.2	V81 T106	V81-G122 WeakPolarHBondContact O-CA 3.41Å; T106-G122 WeakPolarHBondContact CB-O 3.18Å; T106-G122 WeakPolarHBondContact CG2-O 3.38Å
123	G	94.4	Very high	93.9	Very high	18 Å²	18	52.6 Å²	52.6	19%	0.186	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.2	-153.4	179.1	0	0	0	0	0	113	V81 T105	V81-G123 PolarHBondContact N-O 3.11Å; V81-G123 PolarHBondContact O-N 2.87Å; T105-G123 CarbonylContact O-C 3.47Å; T105-G123 WeakPolarHBondContact O-CA 3.47Å
124	K	95.5	Very high	94	Very high	95 Å²	95	55.1 Å²	55.1	41%	0.413	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	135.5	175.9	-71.6	-174.2	171.7	-172.5	0	111.1	F79 D80 L104 T105 L126	F79-K124 CarbonylContact O-C 3.56Å; F79-K124 VanDerWaalsContact O-CA 3.32Å; F79-K124 WeakPolarHBondContact O-CA 3.3Å; D80-K124 VanDerWaalsContact CG-CE 3.48Å; D80-K124 WeakPolarHBondContact OD1-CE 3.15Å; D80-K124 WeakPolarHBondContact OD1-CG 3.45Å; D80-K124 IonicContact OD1-NZ 3.57Å; D80-K124 IonicContact OD2-NZ 3.79Å; L104-K124 CarbonylContact C-O 3.55Å; L104-K124 WeakPolarHBondContact CA-O 3.48Å; T105-K124 PolarHBondContact N-O 3.13Å; T105-K124 PolarHBondContact O-N 3.2Å; K124-L126 PolarHBondContact O-N 3.33Å
125	I	95.1	Very high	94.1	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	126.2	175.3	-163.2	163.3	0	0	0	110.4	I75 R78 F79 V81 W89 L93 I102 L104	I75-I125 HydrophobicContact CB-CG1 4.34Å; I75-I125 HydrophobicContact CB-CG2 3.97Å; I75-I125 HydrophobicContact CG1-CD1 3.96Å; I75-I125 HydrophobicContact CG1-CG1 4.07Å; I75-I125 HydrophobicContact CG2-CG2 3.67Å; R78-I125 WeakPolarHBondContact CB-O 3.44Å; R78-I125 WeakPolarHBondContact CG-O 3.43Å; F79-I125 HydrophobicContact CB-CG2 4.01Å; F79-I125 HydrophobicContact CD2-CG2 4.32Å; F79-I125 PolarHBondContact O-N 3.29Å; V81-I125 HydrophobicContact CG2-CB 4Å; V81-I125 HydrophobicContact CG2-CG2 4.42Å; W89-I125 HydrophobicContact CD2-CD1 4.26Å; W89-I125 HydrophobicContact CE3-CD1 4.03Å; L93-I125 HydrophobicContact CD1-CD1 3.54Å; I102-I125 HydrophobicContact CG2-CD1 3.58Å; I102-I125 HydrophobicContact CG2-CG1 3.73Å; L104-I125 HydrophobicContact CD2-CB 4.24Å
126	L	95.1	Very high	94.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-49.4	174.7	-81.2	171.7	0	0	0	110.6	L7 V33 F37 V74 I75 V103 T105 I110 K124	L7-L126 HydrophobicContact CD2-CD2 4.31Å; V33-L126 HydrophobicContact CG1-CD1 4.4Å; V33-L126 HydrophobicContact CG1-CD2 4.14Å; F37-L126 HydrophobicContact CD2-CB 4.45Å; F37-L126 HydrophobicContact CE2-CB 4.3Å; V74-L126 WeakPolarHBondContact CG1-O 3.42Å; I75-L126 PolarHBondContact N-O 2.93Å; I75-L126 VanDerWaalsContact N-O 3.1Å; V103-L126 HydrophobicContact CG1-CB 4.38Å; V103-L126 HydrophobicContact CG1-CD1 4.09Å; V103-L126 PolarHBondContact O-N 3.3Å; T105-L126 WeakPolarHBondContact OG1-CD1 3.22Å; I110-L126 HydrophobicContact CB-CD1 4.46Å; I110-L126 HydrophobicContact CD1-CD1 3.86Å; I110-L126 HydrophobicContact CG1-CD1 3.82Å; I110-L126 HydrophobicContact CG2-CD1 3.82Å; K124-L126 PolarHBondContact O-N 3.33Å
127	G	95.8	Very high	94.2	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.5	-173.4	-172	0	0	0	0	0	112.1	G73 V103	G73-G127 CarbonylContact O-C 3.58Å; G73-G127 WeakPolarHBondContact O-CA 3.46Å; V103-G127 PolarHBondContact N-O 3.28Å; V103-G127 PolarHBondContact O-N 2.93Å
128	F	95.9	Very high	94.3	Very high	23 Å²	23	51.8 Å²	51.8	10%	0.101	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	156.4	179.2	63.4	-88.7	0	0	0	109.9	K71 C72 G73 I75 L93 F101 F130	K71-F128 HydrophobicContact CD-CE2 4.23Å; K71-F128 HydrophobicContact CG-CE2 4.26Å; C72-F128 WeakPolarHBondContact CA-O 3.33Å; G73-F128 PolarHBondContact N-O 3.14Å; G73-F128 PolarHBondContact O-N 3.13Å; I75-F128 HydrophobicContact CD1-CD1 3.83Å; I75-F128 HydrophobicContact CD1-CE1 3.89Å; I75-F128 HydrophobicContact CG1-CD1 4.12Å; L93-F128 HydrophobicContact CD2-CD1 4.44Å; F101-F128 VanDerWaalsContact O-CA 3.31Å; F101-F128 WeakPolarHBondContact O-CA 3.42Å; F128-F130 AromaticContact CD2-CD1 3.75Å; F128-F130 HydrophobicContact CD2-CD1 3.75Å; F128-F130 AromaticContact CD2-CE1 3.45Å; F128-F130 HydrophobicContact CD2-CE1 3.45Å; F128-F130 VanDerWaalsContact CD2-CE1 3.45Å; F128-F130 HydrophobicContact CD2-CZ 4.5Å; F128-F130 HydrophobicContact CE2-CD1 4.22Å; F128-F130 AromaticContact CE2-CE1 3.51Å; F128-F130 HydrophobicContact CE2-CE1 3.51Å; F128-F130 HydrophobicContact CE2-CZ 4.18Å
129	F	95.7	Very high	94.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	143.7	169.2	60.3	-94	0	0	0	110.4	F37 V40 M41 H44 Y46 L69 K71 C72 G100 F101 V103	F37-F129 AromaticContact CE1-CD1 3.91Å; F37-F129 HydrophobicContact CE1-CD1 3.91Å; F37-F129 HydrophobicContact CZ-CD1 4.09Å; V40-F129 HydrophobicContact CG1-CE1 4.09Å; V40-F129 HydrophobicContact CG1-CZ 4.1Å; M41-F129 HydrophobicContact CE-CB 4.04Å; M41-F129 HydrophobicContact CE-CG 4.29Å; M41-F129 HydrophobicContact CG-CD1 3.63Å; M41-F129 HydrophobicContact CG-CD2 4.23Å; M41-F129 HydrophobicContact CG-CE1 3.73Å; M41-F129 HydrophobicContact CG-CE2 4.33Å; M41-F129 HydrophobicContact CG-CG 3.88Å; M41-F129 HydrophobicContact CG-CZ 4.09Å; M41-F129 HydrophobicContact SD-CD1 4.47Å; H44-F129 HydrophobicContact CB-CE2 4.23Å; H44-F129 HydrophobicContact CB-CZ 4.5Å; H44-F129 AromaticContact CD2-CZ 3.9Å; Y46-F129 HydrophobicContact CD1-CD2 4.37Å; Y46-F129 AromaticContact CD2-CD2 3.61Å; Y46-F129 HydrophobicContact CD2-CD2 3.61Å; Y46-F129 AromaticContact CD2-CE2 3.41Å; Y46-F129 HydrophobicContact CD2-CE2 3.41Å; Y46-F129 VanDerWaalsContact CD2-CE2 3.41Å; Y46-F129 AromaticContact CE2-CD2 3.8Å; Y46-F129 HydrophobicContact CE2-CD2 3.8Å; Y46-F129 AromaticContact CE2-CE2 3.59Å; Y46-F129 HydrophobicContact CE2-CE2 3.59Å; Y46-F129 AromaticContact CG-CD2 3.9Å; Y46-F129 HydrophobicContact CG-CD2 3.9Å; Y46-F129 HydrophobicContact CG-CE2 4.13Å; L69-F129 HydrophobicContact CD1-CB 4.07Å; K71-F129 WeakPolarHBondContact O-CA 3.29Å; C72-F129 HydrophobicContact CB-CB 3.99Å; G100-F129 CarbonylContact C-O 3.51Å; G100-F129 VanDerWaalsContact CA-O 3.28Å; G100-F129 WeakPolarHBondContact CA-O 2.79Å; F101-F129 HydrophobicContact CB-CD2 4.45Å; F101-F129 HydrophobicContact CB-CE1 4Å; F101-F129 HydrophobicContact CB-CE2 3.81Å; F101-F129 HydrophobicContact CB-CZ 3.56Å; F101-F129 HydrophobicContact CD2-CD2 4.44Å; F101-F129 AromaticContact CD2-CE2 3.62Å; F101-F129 HydrophobicContact CD2-CE2 3.62Å; F101-F129 HydrophobicContact CD2-CZ 4.05Å; F101-F129 HydrophobicContact CG-CE2 4.1Å; F101-F129 HydrophobicContact CG-CZ 4.09Å; F101-F129 PolarHBondContact N-O 3.47Å; F101-F129 PolarHBondContact O-N 3.45Å; V103-F129 HydrophobicContact CG2-CD1 3.82Å; V103-F129 HydrophobicContact CG2-CE1 3.41Å; V103-F129 VanDerWaalsContact CG2-CE1 3.41Å
130	F	94.5	Very high	94.4	Very high	31 Å²	31	34.4 Å²	34.4	14%	0.136	19%	0.185	C	C	.	.			trans	-160.4	0	174.2	57.2	-102.5	0	0	0	109	L69 N70 K71 L93 L94 P95 F99 F128	L69-F130 WeakPolarHBondContact CD1-O 3.17Å; N70-F130 CarbonylContact C-O 3.56Å; N70-F130 WeakPolarHBondContact CA-O 3.21Å; N70-F130 HydrophobicContact CB-CD2 4.15Å; N70-F130 WeakPolarHBondContact CB-OXT 3.13Å; N70-F130 PolarHBondContact N-O 2.96Å; N70-F130 PolarHBondContact N-OXT 3.28Å; N70-F130 PolarHBondContact ND2-OXT 2.67Å; K71-F130 CarbonylContact C-O 3.48Å; K71-F130 HydrophobicContact CB-CD2 4.23Å; K71-F130 HydrophobicContact CB-CE2 3.71Å; K71-F130 HydrophobicContact CB-CZ 3.9Å; K71-F130 HydrophobicContact CD-CE2 4.46Å; K71-F130 HydrophobicContact CD-CZ 3.99Å; K71-F130 HydrophobicContact CG-CZ 4.43Å; K71-F130 PolarHBondContact N-O 3.28Å; K71-F130 PolarHBondContact O-N 2.86Å; K71-F130 VanDerWaalsContact O-O 3.09Å; L93-F130 WeakPolarHBondContact O-CE1 3.38Å; L94-F130 HydrophobicContact CD2-CD1 4.27Å; P95-F130 HydrophobicContact CG-CD2 4.01Å; P95-F130 HydrophobicContact CG-CE2 4.27Å; P95-F130 HydrophobicContact CG-CG 4.18Å; F99-F130 HydrophobicContact CD1-CB 3.86Å; F99-F130 HydrophobicContact CE1-CB 3.62Å; F99-F130 HydrophobicContact CE1-CD2 4.21Å; F99-F130 HydrophobicContact CE1-CG 4.38Å; F99-F130 WeakPolarHBondContact CE1-OXT 3.46Å; F99-F130 HydrophobicContact CZ-CB 4.39Å; F99-F130 WeakPolarHBondContact CZ-OXT 3.49Å; F128-F130 AromaticContact CD2-CD1 3.75Å; F128-F130 HydrophobicContact CD2-CD1 3.75Å; F128-F130 AromaticContact CD2-CE1 3.45Å; F128-F130 HydrophobicContact CD2-CE1 3.45Å; F128-F130 VanDerWaalsContact CD2-CE1 3.45Å; F128-F130 HydrophobicContact CD2-CZ 4.5Å; F128-F130 HydrophobicContact CE2-CD1 4.22Å; F128-F130 AromaticContact CE2-CE1 3.51Å; F128-F130 HydrophobicContact CE2-CE1 3.51Å; F128-F130 HydrophobicContact CE2-CZ 4.18Å

Retrieved 130 of 130 residues in 61.8 ms (Link to these results)

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