YM034_YEAST Loading...

Putative uncharacterized protein YML034C-A

AlphaFold DB , UniProt , Accession A0A023PXP7, Species YEAST (Saccharomyces cerevisiae (strain ATCC 204508 / S288c), Baker's yeast), Gene n/a, Length 132 aa.

						>YM034_YEAST|A0A023PXP7
MGEADFSLRARLLLRGEAIDGEDEGRSIFTIPSSLGRTFRYIFRNCGICGLTFSSNSPTSAFFLALDGKSTLFSTNILLKVATFIEFGSKPSSKYSKSLFIAALTEYCYRSTVCCSGLYVHSVWSQSTINND
					

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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	34.5	Very low	28.8	Very low	167 Å²	167	98.2 Å²	98.2	82%	0.823	51%	0.507	S	S	*	.				0	116.8	0	-75.3	178.5	131.3	0	0	107
2	G	28.5	Very low	28.5	Very low	45 Å²	45	98.4 Å²	98.4	46%	0.464	51%	0.509	S	S	.	.			trans	-71.1	157.5	-178.2	0	0	0	0	0	111.9	A4 D5 F6	G2-A4 PolarHBondContact O-N 3.02Å; G2-D5 PolarHBondContact O-N 3.36Å; G2-F6 PolarHBondContact O-N 2.82Å
3	E	30.2	Very low	28.6	Very low	185 Å²	185	93.9 Å²	93.9	86%	0.864	49%	0.486	S	S	*	.	H	α-helix	trans	-51.3	-31.2	176	-77.2	-177.5	138.4	0	0	112.8	F6 S7	E3-F6 PolarHBondContact O-N 3.17Å; E3-S7 WeakPolarHBondContact O-CB 3.37Å; E3-S7 PolarHBondContact O-N 3.48Å
4	A	27	Very low	28.8	Very low	76 Å²	76	90.1 Å²	90.1	63%	0.628	47%	0.466	S	S	*	.	H	α-helix	trans	-66.6	-40.4	177.9	0	0	0	0	0	113.4	G2 F6 L8	G2-A4 PolarHBondContact O-N 3.02Å; A4-F6 VanDerWaalsContact C-N 3.31Å; A4-L8 PolarHBondContact O-N 2.99Å; A4-L8 VanDerWaalsContact O-N 3.08Å
5	D	27.6	Very low	28.7	Very low	93 Å²	93	96.7 Å²	96.7	50%	0.497	48%	0.483	S	S	.	.	H	α-helix	trans	-69.4	-32.5	175.7	-84.3	-26.7	0	0	0	111.7	G2 L8 R9	G2-D5 PolarHBondContact O-N 3.36Å; D5-L8 PolarHBondContact O-N 3.31Å; D5-R9 WeakPolarHBondContact O-CB 3.46Å; D5-R9 PolarHBondContact O-N 2.76Å
6	F	27.8	Very low	29	Very low	73 Å²	73	92.5 Å²	92.5	32%	0.32	47%	0.471	S	S	.	.	H	α-helix	trans	-74	-40.6	179.5	-148	-90.4	0	0	0	111.6	G2 E3 A4 L8 R9 A10 L79	G2-F6 PolarHBondContact O-N 2.82Å; E3-F6 PolarHBondContact O-N 3.17Å; A4-F6 VanDerWaalsContact C-N 3.31Å; F6-L8 VanDerWaalsContact C-N 3.32Å; F6-L8 PolarHBondContact O-N 3.36Å; F6-R9 PolarHBondContact O-N 3.12Å; F6-A10 WeakPolarHBondContact O-CB 3.41Å; F6-A10 PolarHBondContact O-N 3.32Å; F6-L79 HydrophobicContact CD1-CD2 4.47Å
7	S	28.2	Very low	29.1	Very low	39 Å²	39	96.8 Å²	96.8	27%	0.273	49%	0.489	S	S	.	.	H	α-helix	trans	-59.3	-41.1	169.6	171.7	0	0	0	0	111.9	E3 R11	E3-S7 WeakPolarHBondContact O-CB 3.37Å; E3-S7 PolarHBondContact O-N 3.48Å; S7-R11 WeakPolarHBondContact O-CB 3.26Å; S7-R11 WeakPolarHBondContact O-CG 3.39Å; S7-R11 PolarHBondContact O-N 2.85Å
8	L	26.8	Very low	29.3	Very low	105 Å²	105	93.1 Å²	93.1	55%	0.55	48%	0.476	S	S	.	.	H	α-helix	trans	-66.6	-43.4	176.4	-138.5	91.6	0	0	0	111.9	A4 D5 F6 R11 L12	A4-L8 PolarHBondContact O-N 2.99Å; A4-L8 VanDerWaalsContact O-N 3.08Å; D5-L8 PolarHBondContact O-N 3.31Å; F6-L8 VanDerWaalsContact C-N 3.32Å; F6-L8 PolarHBondContact O-N 3.36Å; L8-R11 PolarHBondContact O-N 3.06Å; L8-L12 PolarHBondContact O-N 2.77Å
9	R	27.2	Very low	29.6	Very low	136 Å²	136	93.2 Å²	93.2	51%	0.513	48%	0.476	S	S	.	.	H	α-helix	trans	-65.8	-39.9	176.5	-88.5	-178.2	163.8	-163.3	-4	112.9	D5 F6 R11 L12 L13	D5-R9 WeakPolarHBondContact O-CB 3.46Å; D5-R9 PolarHBondContact O-N 2.76Å; F6-R9 PolarHBondContact O-N 3.12Å; R9-R11 VanDerWaalsContact C-N 3.35Å; R9-L12 CarbonylContact O-C 3.5Å; R9-L12 WeakPolarHBondContact O-CB 3.17Å; R9-L12 PolarHBondContact O-N 3.11Å; R9-L12 VanDerWaalsContact O-N 3.16Å; R9-L13 WeakPolarHBondContact O-CB 3.37Å; R9-L13 WeakPolarHBondContact O-CD1 3.49Å; R9-L13 WeakPolarHBondContact O-CG 3.44Å; R9-L13 PolarHBondContact O-N 3.01Å
10	A	29.6	Very low	30.1	Very low	9 Å²	9	94.7 Å²	94.7	7%	0.074	49%	0.485	C	S	.	.	H	α-helix	trans	-67.1	-35.1	174.4	0	0	0	0	0	112.4	F6 L12 L13 L14 L79	F6-A10 WeakPolarHBondContact O-CB 3.41Å; F6-A10 PolarHBondContact O-N 3.32Å; A10-L12 VanDerWaalsContact C-N 3.32Å; A10-L13 PolarHBondContact O-N 2.75Å; A10-L14 WeakPolarHBondContact O-CD1 3.19Å; A10-L14 VanDerWaalsContact O-CG 3.25Å; A10-L14 WeakPolarHBondContact O-CG 2.87Å; A10-L79 HydrophobicContact CB-CD2 3.15Å; A10-L79 HydrophobicContact CB-CG 4.27Å
11	R	29	Very low	30.3	Very low	152 Å²	152	91.8 Å²	91.8	57%	0.574	48%	0.479	S	S	*	.	H	α-helix	trans	-65.1	-34.9	169.1	-78	178.7	-177.3	-168.3	0.7	112.3	S7 L8 R9	S7-R11 WeakPolarHBondContact O-CB 3.26Å; S7-R11 WeakPolarHBondContact O-CG 3.39Å; S7-R11 PolarHBondContact O-N 2.85Å; L8-R11 PolarHBondContact O-N 3.06Å; R9-R11 VanDerWaalsContact C-N 3.35Å
12	L	25.6	Very low	30.4	Very low	101 Å²	101	93 Å²	93	53%	0.529	48%	0.483	S	S	.	.	H	α-helix	trans	-72.3	-33.8	175.2	-87.8	151.4	0	0	0	113.2	L8 R9 A10 L14	L8-L12 PolarHBondContact O-N 2.77Å; R9-L12 CarbonylContact O-C 3.5Å; R9-L12 WeakPolarHBondContact O-CB 3.17Å; R9-L12 PolarHBondContact O-N 3.11Å; R9-L12 VanDerWaalsContact O-N 3.16Å; A10-L12 VanDerWaalsContact C-N 3.32Å; L12-L14 PolarHBondContact O-N 2.77Å
13	L	29.3	Very low	31	Very low	40 Å²	40	96.6 Å²	96.6	21%	0.209	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-13.9	176	-81	156.4	0	0	0	113.6	R9 A10 P32	R9-L13 WeakPolarHBondContact O-CB 3.37Å; R9-L13 WeakPolarHBondContact O-CD1 3.49Å; R9-L13 WeakPolarHBondContact O-CG 3.44Å; R9-L13 PolarHBondContact O-N 3.01Å; A10-L13 PolarHBondContact O-N 2.75Å; L13-P32 HydrophobicContact CD2-CG 4.27Å; L13-P32 WeakPolarHBondContact CD2-O 3.21Å; L13-P32 WeakPolarHBondContact O-CD 3.42Å
14	L	31.3	Very low	31.8	Very low	40 Å²	40	94.2 Å²	94.2	21%	0.209	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	15	-175.8	-66.6	172.2	0	0	0	113.5	A10 L12 G16 F62	A10-L14 WeakPolarHBondContact O-CD1 3.19Å; A10-L14 VanDerWaalsContact O-CG 3.25Å; A10-L14 WeakPolarHBondContact O-CG 2.87Å; L12-L14 PolarHBondContact O-N 2.77Å; L14-G16 PolarHBondContact O-N 2.79Å; L14-F62 HydrophobicContact CB-CE2 4.37Å; L14-F62 HydrophobicContact CD1-CE2 3.66Å; L14-F62 HydrophobicContact CD2-CE2 3.41Å; L14-F62 VanDerWaalsContact CD2-CE2 3.41Å; L14-F62 HydrophobicContact CD2-CZ 3.43Å; L14-F62 VanDerWaalsContact CD2-CZ 3.43Å; L14-F62 HydrophobicContact CG-CE2 3.97Å; L14-F62 HydrophobicContact CG-CZ 4.42Å
15	R	28	Very low	32.8	Very low	190 Å²	190	92.4 Å²	92.4	72%	0.717	47%	0.469	S	S	*	.			trans	-80.3	22.3	170	-81.6	-171.5	163.9	-168.9	-4.3	114	E17	R15-E17 PolarHBondContact O-N 2.82Å
16	G	33.4	Very low	33.7	Very low	29 Å²	29	92.8 Å²	92.8	30%	0.299	46%	0.463	S	S	.	.			trans	-67.9	105.5	169.5	0	0	0	0	0	109.1	L14 A18 T30	L14-G16 PolarHBondContact O-N 2.79Å; G16-A18 PolarHBondContact O-N 2.86Å; G16-T30 WeakPolarHBondContact CA-O 3.43Å
17	E	31.4	Very low	34.7	Very low	165 Å²	165	90 Å²	90	77%	0.771	45%	0.453	S	S	*	.			trans	-46.9	115.3	165	-64.3	173.6	168.5	0	0	107.1	R15 I19	R15-E17 PolarHBondContact O-N 2.82Å; E17-I19 PolarHBondContact O-N 2.7Å; E17-I19 VanDerWaalsContact O-N 3.11Å
18	A	33	Very low	35.7	Very low	30 Å²	30	90 Å²	90	25%	0.248	45%	0.449	C	S	.	.			trans	-70.9	116.9	166.7	0	0	0	0	0	105.4	G16 D20 S55	G16-A18 PolarHBondContact O-N 2.86Å; A18-D20 PolarHBondContact O-N 2.56Å; A18-S55 WeakPolarHBondContact CB-OG 3.39Å
19	I	34.5	Very low	36.8	Very low	95 Å²	95	86.3 Å²	86.3	49%	0.487	43%	0.429	S	S	.	.			trans	-74.1	108.2	172.2	-60.1	170.6	0	0	0	103.3	E17 G21	E17-I19 PolarHBondContact O-N 2.7Å; E17-I19 VanDerWaalsContact O-N 3.11Å; I19-G21 PolarHBondContact O-N 3.17Å
20	D	39	Very low	37.9	Very low	123 Å²	123	81.3 Å²	81.3	66%	0.658	41%	0.414	S	S	*	.			trans	-57	90.7	164.2	-91.5	-24.9	0	0	0	107.4	A18	A18-D20 PolarHBondContact O-N 2.56Å
21	G	34.2	Very low	38.9	Very low	35 Å²	35	82.7 Å²	82.7	36%	0.361	42%	0.42	S	S	.	.			trans	-94.7	99	157.6	0	0	0	0	0	105.8	I19 D23	I19-G21 PolarHBondContact O-N 3.17Å; G21-D23 PolarHBondContact O-N 3.49Å
22	E	37.4	Very low	39.7	Very low	193 Å²	193	78.1 Å²	78.1	90%	0.902	41%	0.409	S	S	*	.			trans	-65.9	40.9	168.8	-67.9	-166	142.6	0	0	112.3
23	D	40.7	Very low	40.7	Very low	119 Å²	119	74.4 Å²	74.4	64%	0.636	39%	0.392	S	S	*	.	S	Bend	trans	-104.2	100.4	173.9	-86.3	-27.3	0	0	0	109.2	G21 G25 R26	G21-D23 PolarHBondContact O-N 3.49Å; D23-G25 PolarHBondContact O-N 3.19Å; D23-R26 WeakPolarHBondContact O-CB 3.45Å; D23-R26 WeakPolarHBondContact O-CG 3.36Å; D23-R26 PolarHBondContact O-N 3.03Å
24	E	46.7	Very low	41.6	Very low	136 Å²	136	76.1 Å²	76.1	64%	0.636	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	39.2	157.9	-52.2	-174.8	151.9	0	0	117.5	R26	E24-R26 VanDerWaalsContact C-N 3.3Å; E24-R26 PolarHBondContact O-N 3.33Å; E24-R26 IonicContact OE2-CZ 3.42Å; E24-R26 IonicContact OE2-NE 3.58Å; E24-R26 IonicContact OE2-NH2 2.7Å; E24-R26 PolarHBondContact OE2-NH2 2.98Å
25	G	47.6	Very low	42.4	Very low	37 Å²	37	80 Å²	80	38%	0.381	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	36.9	175.9	0	0	0	0	0	112.5	D23 N45	D23-G25 PolarHBondContact O-N 3.19Å; G25-N45 VanDerWaalsContact O-CB 3.3Å; G25-N45 WeakPolarHBondContact O-CB 3.42Å; G25-N45 PolarHBondContact O-N 3.38Å
26	R	46.5	Very low	43.5	Very low	102 Å²	102	73 Å²	73	39%	0.385	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	141.4	176	-58.9	175.7	-170	-169.3	4.1	109.8	D23 E24 I42 F43	D23-R26 WeakPolarHBondContact O-CB 3.45Å; D23-R26 WeakPolarHBondContact O-CG 3.36Å; D23-R26 PolarHBondContact O-N 3.03Å; E24-R26 VanDerWaalsContact C-N 3.3Å; E24-R26 PolarHBondContact O-N 3.33Å; E24-R26 IonicContact OE2-CZ 3.42Å; E24-R26 IonicContact OE2-NE 3.58Å; E24-R26 IonicContact OE2-NH2 2.7Å; E24-R26 PolarHBondContact OE2-NH2 2.98Å; R26-I42 HydrophobicContact CB-CG2 4.34Å; R26-F43 CarbonylContact C-O 3.54Å; R26-F43 WeakPolarHBondContact CA-O 3.48Å
27	S	49.7	Very low	44.2	Very low	15 Å²	15	76 Å²	76	11%	0.105	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	123.9	174.6	-55.6	0	0	0	0	108.9	F43 F53	S27-F43 PolarHBondContact N-O 3.25Å; S27-F43 PolarHBondContact O-N 3.27Å; S27-F53 WeakPolarHBondContact OG-CB 3.48Å
28	I	48.1	Very low	45	Very low	37 Å²	37	70 Å²	70	19%	0.19	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125	-176.7	-53.3	-179.4	0	0	0	108.5	Y41 I42	I28-Y41 CarbonylContact C-O 3.25Å; I28-Y41 WeakPolarHBondContact CA-O 3.34Å; I28-I42 HydrophobicContact CG1-CG1 4.25Å; I28-I42 HydrophobicContact CG1-CG2 4.47Å; I28-I42 HydrophobicContact CG2-CG1 4.45Å
29	F	51.5	Low	45.7	Very low	28 Å²	28	69.4 Å²	69.4	12%	0.123	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	142.5	176.5	-60.9	-94.1	0	0	0	110.3	R40 Y41 F43 F53 F62	F29-R40 CarbonylContact O-C 3.56Å; F29-R40 VanDerWaalsContact O-CA 3.26Å; F29-R40 WeakPolarHBondContact O-CA 3.35Å; F29-Y41 PolarHBondContact N-O 3.03Å; F29-Y41 PolarHBondContact O-N 2.85Å; F29-F43 AromaticContact CD2-CD2 3.28Å; F29-F43 HydrophobicContact CD2-CD2 3.28Å; F29-F43 AromaticContact CD2-CE2 3.28Å; F29-F43 HydrophobicContact CD2-CE2 3.28Å; F29-F43 AromaticContact CE2-CD2 3.37Å; F29-F43 HydrophobicContact CE2-CD2 3.37Å; F29-F43 AromaticContact CE2-CE2 3.67Å; F29-F43 HydrophobicContact CE2-CE2 3.67Å; F29-F43 HydrophobicContact CE2-CG 4.29Å; F29-F43 HydrophobicContact CG-CD2 4.49Å; F29-F43 HydrophobicContact CG-CE2 4.16Å; F29-F53 HydrophobicContact CE2-CB 4.26Å; F29-F53 HydrophobicContact CE2-CD1 4.03Å; F29-F53 HydrophobicContact CE2-CD2 4.4Å; F29-F53 HydrophobicContact CE2-CE1 4.46Å; F29-F53 AromaticContact CE2-CG 3.99Å; F29-F53 HydrophobicContact CE2-CG 3.99Å; F29-F53 HydrophobicContact CZ-CB 3.66Å; F29-F53 AromaticContact CZ-CD1 3.47Å; F29-F53 HydrophobicContact CZ-CD1 3.47Å; F29-F53 VanDerWaalsContact CZ-CD1 3.47Å; F29-F53 HydrophobicContact CZ-CD2 4.47Å; F29-F53 HydrophobicContact CZ-CE1 4.2Å; F29-F53 AromaticContact CZ-CG 3.63Å; F29-F53 HydrophobicContact CZ-CG 3.63Å; F29-F62 AromaticContact CD1-CE1 3.82Å; F29-F62 HydrophobicContact CD1-CE1 3.82Å; F29-F62 AromaticContact CE1-CD1 3.97Å; F29-F62 HydrophobicContact CE1-CD1 3.97Å; F29-F62 AromaticContact CE1-CE1 3.52Å; F29-F62 HydrophobicContact CE1-CE1 3.52Å; F29-F62 HydrophobicContact CZ-CE1 4.36Å
30	T	49.5	Very low	46.4	Very low	32 Å²	32	68 Å²	68	20%	0.196	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	110.4	179.1	-58	0	0	0	0	107.7	G16 T38 F39 R40	G16-T30 WeakPolarHBondContact CA-O 3.43Å; T30-T38 HydrophobicContact CG2-CG2 3.06Å; T30-F39 CarbonylContact C-O 3.5Å; T30-F39 WeakPolarHBondContact CA-O 3.47Å; T30-R40 HydrophobicContact CG2-CG 4.18Å
31	I	50.8	Low	46.9	Very low	38 Å²	38	62.6 Å²	62.6	20%	0.195	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	112.5	179.3	-55.3	-177.9	0	0	0	108	F39 Y41	I31-F39 PolarHBondContact N-O 3.49Å; I31-F39 PolarHBondContact O-N 3.32Å; I31-Y41 HydrophobicContact CB-CE2 4.07Å; I31-Y41 HydrophobicContact CD1-CD2 3.89Å; I31-Y41 HydrophobicContact CD1-CE2 3.57Å; I31-Y41 HydrophobicContact CG1-CD2 4.02Å; I31-Y41 HydrophobicContact CG1-CE2 3.86Å
32	P	45.2	Very low	47.6	Very low	55 Å²	55	61.9 Å²	61.9	36%	0.357	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	153.6	168.6	27.2	-28.9	0	0	0	109.4	L13 R37	L13-P32 HydrophobicContact CD2-CG 4.27Å; L13-P32 WeakPolarHBondContact CD2-O 3.21Å; L13-P32 WeakPolarHBondContact O-CD 3.42Å; P32-R37 CarbonylContact C-O 3.57Å
33	S	48	Very low	48.2	Very low	23 Å²	23	53.6 Å²	53.6	16%	0.161	29%	0.291	C	S	.	.			trans	-119.5	154.2	175.6	65.7	0	0	0	0	111	L35 G36 R37	S33-L35 PolarHBondContact O-N 3.16Å; S33-G36 PolarHBondContact O-N 3.06Å; S33-R37 WeakPolarHBondContact CB-O 3.43Å; S33-R37 PolarHBondContact N-O 3.44Å; S33-R37 WeakPolarHBondContact OG-CA 3.19Å; S33-R37 WeakPolarHBondContact OG-CB 3.4Å; S33-R37 PolarHBondContact OG-N 2.86Å; S33-R37 VanDerWaalsContact OG-N 3.12Å; S33-R37 PolarHBondContact OG-O 2.8Å
34	S	47.3	Very low	48.3	Very low	77 Å²	77	56 Å²	56	54%	0.538	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-15.4	173.4	55.2	0	0	0	0	113.7	G36 E86	S34-G36 VanDerWaalsContact C-N 3.33Å; S34-E86 WeakPolarHBondContact CB-OE1 3.5Å; S34-E86 PolarHBondContact OG-OE1 2.97Å
35	L	48.4	Very low	48.2	Very low	121 Å²	121	51.7 Å²	51.7	63%	0.634	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	11.1	176	-60.1	177.1	0	0	0	113.9	S33 R37	S33-L35 PolarHBondContact O-N 3.16Å; L35-R37 PolarHBondContact O-N 2.88Å
36	G	50.8	Low	47.9	Very low	44 Å²	44	50.6 Å²	50.6	45%	0.454	26%	0.259	S	S	.	.	S	Bend	trans	68.8	21.6	-178.8	0	0	0	0	0	113.6	S33 S34 T128	S33-G36 PolarHBondContact O-N 3.06Å; S34-G36 VanDerWaalsContact C-N 3.33Å; G36-T128 PolarHBondContact O-OG1 3.11Å
37	R	47	Very low	47.4	Very low	92 Å²	92	49.4 Å²	49.4	35%	0.347	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	149.5	175.1	-54.6	177	-179.6	178.2	-2	110	P32 S33 L35	P32-R37 CarbonylContact C-O 3.57Å; S33-R37 WeakPolarHBondContact CB-O 3.43Å; S33-R37 PolarHBondContact N-O 3.44Å; S33-R37 WeakPolarHBondContact OG-CA 3.19Å; S33-R37 WeakPolarHBondContact OG-CB 3.4Å; S33-R37 PolarHBondContact OG-N 2.86Å; S33-R37 VanDerWaalsContact OG-N 3.12Å; S33-R37 PolarHBondContact OG-O 2.8Å; L35-R37 PolarHBondContact O-N 2.88Å
38	T	49.4	Very low	46.6	Very low	38 Å²	38	54.9 Å²	54.9	23%	0.233	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	124.7	174	-58.8	0	0	0	0	109.4	T30 Q126	T30-T38 HydrophobicContact CG2-CG2 3.06Å; T38-Q126 PolarHBondContact N-O 3.24Å; T38-Q126 PolarHBondContact O-N 3.14Å
39	F	47.7	Very low	45.9	Very low	18 Å²	18	53.6 Å²	53.6	8%	0.079	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	124.8	177.8	-65.3	-83.7	0	0	0	109.9	T30 I31 Y41 I85 P91 V123	T30-F39 CarbonylContact C-O 3.5Å; T30-F39 WeakPolarHBondContact CA-O 3.47Å; I31-F39 PolarHBondContact N-O 3.49Å; I31-F39 PolarHBondContact O-N 3.32Å; F39-Y41 HydrophobicContact CB-CD2 4.34Å; F39-Y41 HydrophobicContact CB-CE2 3.49Å; F39-Y41 VanDerWaalsContact CB-CE2 3.49Å; F39-I85 HydrophobicContact CE2-CG2 4.48Å; F39-P91 HydrophobicContact CD1-CB 4.47Å; F39-P91 HydrophobicContact CE1-CB 3.7Å; F39-P91 HydrophobicContact CE1-CG 3.6Å; F39-P91 HydrophobicContact CZ-CG 4.08Å; F39-V123 HydrophobicContact CD1-CG1 3.9Å
40	R	48.8	Very low	45	Very low	65 Å²	65	53.4 Å²	53.4	25%	0.245	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	127.2	172.8	-71.8	-179.6	61.6	-177.9	4.9	110.5	F29 T30 W124	F29-R40 CarbonylContact O-C 3.56Å; F29-R40 VanDerWaalsContact O-CA 3.26Å; F29-R40 WeakPolarHBondContact O-CA 3.35Å; T30-R40 HydrophobicContact CG2-CG 4.18Å; R40-W124 HydrophobicContact CB-CD2 4.23Å; R40-W124 HydrophobicContact CB-CZ2 3.8Å; R40-W124 VanDerWaalsContact CD-NE1 3.33Å; R40-W124 HydrophobicContact CG-CZ2 4.22Å; R40-W124 VanDerWaalsContact CZ-CZ2 3.48Å; R40-W124 VanDerWaalsContact NE-CZ2 3.33Å
41	Y	49.7	Very low	44.4	Very low	10 Å²	10	52.4 Å²	52.4	4%	0.039	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	126.4	177.5	-61.3	-95.3	0	0	0	108.6	I28 F29 I31 F39 F43 I85 F100 V123	I28-Y41 CarbonylContact C-O 3.25Å; I28-Y41 WeakPolarHBondContact CA-O 3.34Å; F29-Y41 PolarHBondContact N-O 3.03Å; F29-Y41 PolarHBondContact O-N 2.85Å; I31-Y41 HydrophobicContact CB-CE2 4.07Å; I31-Y41 HydrophobicContact CD1-CD2 3.89Å; I31-Y41 HydrophobicContact CD1-CE2 3.57Å; I31-Y41 HydrophobicContact CG1-CD2 4.02Å; I31-Y41 HydrophobicContact CG1-CE2 3.86Å; F39-Y41 HydrophobicContact CB-CD2 4.34Å; F39-Y41 HydrophobicContact CB-CE2 3.49Å; F39-Y41 VanDerWaalsContact CB-CE2 3.49Å; Y41-F43 VanDerWaalsContact CB-CE2 3.49Å; Y41-F43 HydrophobicContact CG-CE2 4.44Å; Y41-I85 HydrophobicContact CE1-CD1 4.42Å; Y41-I85 WeakPolarHBondContact OH-CD1 3.18Å; Y41-I85 WeakPolarHBondContact OH-CG2 3.31Å; Y41-F100 HydrophobicContact CD1-CE1 4.26Å; Y41-F100 HydrophobicContact CD1-CE2 4.43Å; Y41-F100 HydrophobicContact CD1-CZ 4.11Å; Y41-F100 HydrophobicContact CE1-CD2 4.36Å; Y41-F100 HydrophobicContact CE1-CE2 4.16Å; Y41-F100 HydrophobicContact CE1-CZ 4.3Å; Y41-V123 HydrophobicContact CE1-CG2 4.42Å
42	I	48.3	Very low	43.8	Very low	20 Å²	20	54.2 Å²	54.2	10%	0.103	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	118.4	175.1	-54.1	176.6	0	0	0	107	R26 I28 H121 W124	R26-I42 HydrophobicContact CB-CG2 4.34Å; I28-I42 HydrophobicContact CG1-CG1 4.25Å; I28-I42 HydrophobicContact CG1-CG2 4.47Å; I28-I42 HydrophobicContact CG2-CG1 4.45Å; I42-H121 HydrophobicContact CB-CB 4.4Å; I42-W124 HydrophobicContact CD1-CH2 4.04Å; I42-W124 HydrophobicContact CD1-CZ3 3.98Å
43	F	50.3	Low	43.7	Very low	18 Å²	18	53.9 Å²	53.9	8%	0.079	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	142.3	172.9	-59.9	-96.4	0	0	0	108.8	R26 S27 F29 Y41 F53 F100 L104 L118	R26-F43 CarbonylContact C-O 3.54Å; R26-F43 WeakPolarHBondContact CA-O 3.48Å; S27-F43 PolarHBondContact N-O 3.25Å; S27-F43 PolarHBondContact O-N 3.27Å; F29-F43 AromaticContact CD2-CD2 3.28Å; F29-F43 HydrophobicContact CD2-CD2 3.28Å; F29-F43 AromaticContact CD2-CE2 3.28Å; F29-F43 HydrophobicContact CD2-CE2 3.28Å; F29-F43 AromaticContact CE2-CD2 3.37Å; F29-F43 HydrophobicContact CE2-CD2 3.37Å; F29-F43 AromaticContact CE2-CE2 3.67Å; F29-F43 HydrophobicContact CE2-CE2 3.67Å; F29-F43 HydrophobicContact CE2-CG 4.29Å; F29-F43 HydrophobicContact CG-CD2 4.49Å; F29-F43 HydrophobicContact CG-CE2 4.16Å; Y41-F43 VanDerWaalsContact CB-CE2 3.49Å; Y41-F43 HydrophobicContact CG-CE2 4.44Å; F43-F53 HydrophobicContact CB-CD2 4.38Å; F43-F53 HydrophobicContact CB-CE2 3.85Å; F43-F53 HydrophobicContact CB-CZ 4.44Å; F43-F53 HydrophobicContact CD1-CZ 4.33Å; F43-F53 HydrophobicContact CG-CE2 4.2Å; F43-F53 HydrophobicContact CG-CZ 4.32Å; F43-F100 AromaticContact CE1-CE1 3.66Å; F43-F100 HydrophobicContact CE1-CE1 3.66Å; F43-F100 AromaticContact CE1-CZ 3.91Å; F43-F100 HydrophobicContact CE1-CZ 3.91Å; F43-F100 AromaticContact CZ-CE1 3.76Å; F43-F100 HydrophobicContact CZ-CE1 3.76Å; F43-F100 AromaticContact CZ-CZ 3.63Å; F43-F100 HydrophobicContact CZ-CZ 3.63Å; F43-L104 HydrophobicContact CE1-CD1 3.9Å; F43-L118 HydrophobicContact CD1-CD1 4.48Å; F43-L118 HydrophobicContact CD1-CD2 4.16Å; F43-L118 HydrophobicContact CD1-CG 4.42Å; F43-L118 HydrophobicContact CE1-CD2 4.24Å
44	R	43.5	Very low	43.2	Very low	169 Å²	169	55.6 Å²	55.6	64%	0.638	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	129	165.7	-167	177.3	-174.9	-168.7	1.4	107.8	C46	R44-C46 PolarHBondContact O-N 3.38Å
45	N	45	Very low	42.7	Very low	46 Å²	46	54.2 Å²	54.2	25%	0.246	31%	0.307	C	S	.	.			trans	-58.9	120.5	173.4	-71.2	-15.6	0	0	0	108.3	G25 G47 L51	G25-N45 VanDerWaalsContact O-CB 3.3Å; G25-N45 WeakPolarHBondContact O-CB 3.42Å; G25-N45 PolarHBondContact O-N 3.38Å; N45-G47 PolarHBondContact O-N 3.45Å; N45-L51 VanDerWaalsContact CB-O 3.22Å; N45-L51 WeakPolarHBondContact CB-O 3.41Å; N45-L51 PolarHBondContact OD1-O 3.12Å; N45-L51 VanDerWaalsContact OD1-O 3.11Å
46	C	40.8	Very low	42.1	Very low	15 Å²	15	54.7 Å²	54.7	10%	0.101	31%	0.311	C	S	.	.			trans	-82.7	102.6	170.9	-168.7	0	0	0	0	107.5	R44 I48 C49 G50 L51	R44-C46 PolarHBondContact O-N 3.38Å; C46-I48 PolarHBondContact O-N 3.4Å; C46-C49 HydrophobicContact CB-CB 4.25Å; C46-C49 PolarHBondContact O-N 2.89Å; C46-C49 PolarHBondContact SG-SG 3.25Å; C46-G50 PolarHBondContact O-N 3.05Å; C46-L51 HydrophobicContact CB-CD1 4.11Å
47	G	35.4	Very low	41.2	Very low	77 Å²	77	54.9 Å²	54.9	79%	0.794	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-18.5	179.2	0	0	0	0	0	114.2	N45	N45-G47 PolarHBondContact O-N 3.45Å
48	I	32.2	Very low	40.5	Very low	130 Å²	130	56.9 Å²	56.9	67%	0.667	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-26.7	176.5	-63.5	170.5	0	0	0	111.6	C46	C46-I48 PolarHBondContact O-N 3.4Å
49	C	34.7	Very low	39.5	Very low	10 Å²	10	59.5 Å²	59.5	7%	0.068	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105	-0.6	-174.3	-42.4	0	0	0	0	112.4	C46 L51 L66 V113 C114	C46-C49 HydrophobicContact CB-CB 4.25Å; C46-C49 PolarHBondContact O-N 2.89Å; C46-C49 PolarHBondContact SG-SG 3.25Å; C49-L51 HydrophobicContact CB-CD1 3.9Å; C49-L51 HydrophobicContact CB-CG 3.7Å; C49-L51 PolarHBondContact O-N 3.25Å; C49-L51 VanDerWaalsContact O-N 3.11Å; C49-L66 WeakPolarHBondContact O-CD2 3.48Å; C49-V113 HydrophobicContact CB-CG1 4.05Å; C49-C114 PolarHBondContact SG-O 3.31Å
50	G	32.9	Very low	38.6	Very low	24 Å²	24	61.5 Å²	61.5	25%	0.247	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	9.1	-174.2	0	0	0	0	0	114.7	C46 T52 A65	C46-G50 PolarHBondContact O-N 3.05Å; G50-T52 PolarHBondContact O-N 3.49Å; G50-T52 PolarHBondContact O-OG1 3.49Å; G50-T52 VanDerWaalsContact O-OG1 3.13Å; G50-A65 CarbonylContact C-O 3.52Å; G50-A65 VanDerWaalsContact C-O 3.25Å
51	L	37	Very low	37.7	Very low	11 Å²	11	60.2 Å²	60.2	6%	0.058	37%	0.365	C	S	.	.			trans	-60.8	101.9	-177.5	-67.4	172	0	0	0	109.2	N45 C46 C49 L64 L66 L118	N45-L51 VanDerWaalsContact CB-O 3.22Å; N45-L51 WeakPolarHBondContact CB-O 3.41Å; N45-L51 PolarHBondContact OD1-O 3.12Å; N45-L51 VanDerWaalsContact OD1-O 3.11Å; C46-L51 HydrophobicContact CB-CD1 4.11Å; C49-L51 HydrophobicContact CB-CD1 3.9Å; C49-L51 HydrophobicContact CB-CG 3.7Å; C49-L51 PolarHBondContact O-N 3.25Å; C49-L51 VanDerWaalsContact O-N 3.11Å; L51-L64 HydrophobicContact CD2-CD1 3.09Å; L51-L64 HydrophobicContact CD2-CD2 4.25Å; L51-L64 HydrophobicContact CD2-CG 3.79Å; L51-L66 HydrophobicContact CD2-CD2 4.17Å; L51-L118 HydrophobicContact CD1-CD1 4.45Å
52	T	37.8	Very low	37	Very low	76 Å²	76	62.1 Å²	62.1	47%	0.466	37%	0.374	S	S	.	.			trans	-119.9	114.2	173.8	-47.4	0	0	0	0	106.3	G50	G50-T52 PolarHBondContact O-N 3.49Å; G50-T52 PolarHBondContact O-OG1 3.49Å; G50-T52 VanDerWaalsContact O-OG1 3.13Å
53	F	42.9	Very low	36.3	Very low	48 Å²	48	65.1 Å²	65.1	21%	0.211	39%	0.386	C	S	.	.			trans	-89.7	117.7	169.2	-54.1	-91.1	0	0	0	107.9	S27 F29 F43	S27-F53 WeakPolarHBondContact OG-CB 3.48Å; F29-F53 HydrophobicContact CE2-CB 4.26Å; F29-F53 HydrophobicContact CE2-CD1 4.03Å; F29-F53 HydrophobicContact CE2-CD2 4.4Å; F29-F53 HydrophobicContact CE2-CE1 4.46Å; F29-F53 AromaticContact CE2-CG 3.99Å; F29-F53 HydrophobicContact CE2-CG 3.99Å; F29-F53 HydrophobicContact CZ-CB 3.66Å; F29-F53 AromaticContact CZ-CD1 3.47Å; F29-F53 HydrophobicContact CZ-CD1 3.47Å; F29-F53 VanDerWaalsContact CZ-CD1 3.47Å; F29-F53 HydrophobicContact CZ-CD2 4.47Å; F29-F53 HydrophobicContact CZ-CE1 4.2Å; F29-F53 AromaticContact CZ-CG 3.63Å; F29-F53 HydrophobicContact CZ-CG 3.63Å; F43-F53 HydrophobicContact CB-CD2 4.38Å; F43-F53 HydrophobicContact CB-CE2 3.85Å; F43-F53 HydrophobicContact CB-CZ 4.44Å; F43-F53 HydrophobicContact CD1-CZ 4.33Å; F43-F53 HydrophobicContact CG-CE2 4.2Å; F43-F53 HydrophobicContact CG-CZ 4.32Å
54	S	37.3	Very low	35.6	Very low	59 Å²	59	65 Å²	65	41%	0.413	39%	0.387	S	S	.	.			trans	-118.2	136.7	173.5	174.8	0	0	0	0	109.3
55	S	37.3	Very low	35.1	Very low	47 Å²	47	58.4 Å²	58.4	33%	0.329	37%	0.368	S	S	.	.			trans	-109.9	43.4	176.5	62.4	0	0	0	0	112.1	A18 S57	A18-S55 WeakPolarHBondContact CB-OG 3.39Å; S55-S57 VanDerWaalsContact C-N 3.27Å; S55-S57 PolarHBondContact O-N 3.45Å
56	N	34.9	Very low	34.4	Very low	132 Å²	132	58 Å²	58	71%	0.706	37%	0.365	S	S	*	.			trans	-91.2	25.6	-178.9	-78.3	-4.9	0	0	0	113.8
57	S	32.6	Very low	33.9	Very low	47 Å²	47	64.8 Å²	64.8	33%	0.329	40%	0.401	S	S	.	.			trans	-131.7	127.8	176.4	-174.7	0	0	0	0	112.5	S55 T59	S55-S57 VanDerWaalsContact C-N 3.27Å; S55-S57 PolarHBondContact O-N 3.45Å; S57-T59 PolarHBondContact O-N 3.24Å; S57-T59 VanDerWaalsContact O-N 3.1Å; S57-T59 PolarHBondContact OG-N 3.16Å; S57-T59 PolarHBondContact OG-O 3.34Å; S57-T59 PolarHBondContact OG-OG1 3.42Å
58	P	32.8	Very low	33.8	Very low	135 Å²	135	65 Å²	65	88%	0.877	40%	0.403	S	S	*	.	S	Bend	trans	-65.2	-8.6	172.4	27.2	-33.4	0	0	0	112.9
59	T	28.5	Very low	33.8	Very low	93 Å²	93	66.5 Å²	66.5	57%	0.571	40%	0.404	S	S	*	.	S	Bend	trans	-96.3	118.8	169	61.1	0	0	0	0	109.2	S57 A61	S57-T59 PolarHBondContact O-N 3.24Å; S57-T59 VanDerWaalsContact O-N 3.1Å; S57-T59 PolarHBondContact OG-N 3.16Å; S57-T59 PolarHBondContact OG-O 3.34Å; S57-T59 PolarHBondContact OG-OG1 3.42Å; T59-A61 PolarHBondContact O-N 3.11Å
60	S	28.6	Very low	33.9	Very low	60 Å²	60	70.2 Å²	70.2	42%	0.42	43%	0.431	S	S	.	.			trans	-54.5	68.1	-179.5	-43.9	0	0	0	0	114.4
61	A	28.9	Very low	33.9	Very low	38 Å²	38	72.1 Å²	72.1	31%	0.314	44%	0.437	S	S	.	.			trans	-121.6	122.3	-178.6	0	0	0	0	0	109.5	T59 F63	T59-A61 PolarHBondContact O-N 3.11Å; A61-F63 HydrophobicContact CB-CE2 3.95Å; A61-F63 HydrophobicContact CB-CZ 4.24Å
62	F	35.8	Very low	33.9	Very low	50 Å²	50	77.8 Å²	77.8	22%	0.219	47%	0.467	C	S	.	.			trans	-77.5	126.5	169.1	-64.4	-91.9	0	0	0	108.8	L14 F29 L78	L14-F62 HydrophobicContact CB-CE2 4.37Å; L14-F62 HydrophobicContact CD1-CE2 3.66Å; L14-F62 HydrophobicContact CD2-CE2 3.41Å; L14-F62 VanDerWaalsContact CD2-CE2 3.41Å; L14-F62 HydrophobicContact CD2-CZ 3.43Å; L14-F62 VanDerWaalsContact CD2-CZ 3.43Å; L14-F62 HydrophobicContact CG-CE2 3.97Å; L14-F62 HydrophobicContact CG-CZ 4.42Å; F29-F62 AromaticContact CD1-CE1 3.82Å; F29-F62 HydrophobicContact CD1-CE1 3.82Å; F29-F62 AromaticContact CE1-CD1 3.97Å; F29-F62 HydrophobicContact CE1-CD1 3.97Å; F29-F62 AromaticContact CE1-CE1 3.52Å; F29-F62 HydrophobicContact CE1-CE1 3.52Å; F29-F62 HydrophobicContact CZ-CE1 4.36Å; F62-L78 HydrophobicContact CB-CD1 4.36Å; F62-L78 HydrophobicContact CD2-CD1 3.29Å; F62-L78 HydrophobicContact CD2-CD2 4.1Å; F62-L78 HydrophobicContact CD2-CG 4.32Å; F62-L78 HydrophobicContact CE2-CD1 3.73Å; F62-L78 HydrophobicContact CE2-CD2 4.03Å; F62-L78 HydrophobicContact CE2-CG 4.46Å; F62-L78 HydrophobicContact CG-CD1 4.06Å; F62-L78 HydrophobicContact CG-CD2 4.47Å; F62-L78 HydrophobicContact CZ-CD2 4.39Å
63	F	33.1	Very low	34	Very low	83 Å²	83	76 Å²	76	36%	0.364	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	115.6	167.7	-66.5	-86.6	0	0	0	108.3	A61	A61-F63 HydrophobicContact CB-CE2 3.95Å; A61-F63 HydrophobicContact CB-CZ 4.24Å
64	L	35.9	Very low	33.6	Very low	16 Å²	16	76.9 Å²	76.9	8%	0.084	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	102.4	157.7	-158.1	81.8	0	0	0	106.5	L51 L66 T71 F73	L51-L64 HydrophobicContact CD2-CD1 3.09Å; L51-L64 HydrophobicContact CD2-CD2 4.25Å; L51-L64 HydrophobicContact CD2-CG 3.79Å; L64-L66 HydrophobicContact CD2-CD1 3.57Å; L64-L66 HydrophobicContact CD2-CD2 3.76Å; L64-L66 HydrophobicContact CD2-CG 3.43Å; L64-L66 VanDerWaalsContact CD2-CG 3.43Å; L64-L66 HydrophobicContact CG-CD2 4.32Å; L64-L66 HydrophobicContact CG-CG 4.09Å; L64-L66 PolarHBondContact O-N 2.79Å; L64-T71 PolarHBondContact O-N 2.69Å; L64-F73 HydrophobicContact CB-CD2 3.96Å; L64-F73 HydrophobicContact CB-CE1 4.25Å; L64-F73 HydrophobicContact CB-CE2 3.35Å; L64-F73 HydrophobicContact CB-CZ 3.53Å; L64-F73 HydrophobicContact CD1-CE2 3.58Å; L64-F73 HydrophobicContact CD1-CZ 3.47Å; L64-F73 VanDerWaalsContact CD1-CZ 3.47Å; L64-F73 HydrophobicContact CD2-CE1 3.79Å; L64-F73 HydrophobicContact CD2-CE2 4.1Å; L64-F73 HydrophobicContact CD2-CZ 3.34Å; L64-F73 HydrophobicContact CG-CE1 4.41Å; L64-F73 HydrophobicContact CG-CE2 3.83Å; L64-F73 HydrophobicContact CG-CZ 3.59Å
65	A	32.2	Very low	33.6	Very low	30 Å²	30	76.6 Å²	76.6	25%	0.248	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	116	159.2	0	0	0	0	0	106.7	G50	G50-A65 CarbonylContact C-O 3.52Å; G50-A65 VanDerWaalsContact C-O 3.25Å
66	L	31.6	Very low	33.6	Very low	36 Å²	36	79.4 Å²	79.4	19%	0.188	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	116	160.1	-68.9	171.5	0	0	0	105.2	C49 L51 L64 G68 K69 V113	C49-L66 WeakPolarHBondContact O-CD2 3.48Å; L51-L66 HydrophobicContact CD2-CD2 4.17Å; L64-L66 HydrophobicContact CD2-CD1 3.57Å; L64-L66 HydrophobicContact CD2-CD2 3.76Å; L64-L66 HydrophobicContact CD2-CG 3.43Å; L64-L66 VanDerWaalsContact CD2-CG 3.43Å; L64-L66 HydrophobicContact CG-CD2 4.32Å; L64-L66 HydrophobicContact CG-CG 4.09Å; L64-L66 PolarHBondContact O-N 2.79Å; L66-G68 VanDerWaalsContact C-N 3.31Å; L66-G68 PolarHBondContact O-N 3.44Å; L66-G68 VanDerWaalsContact O-N 3.17Å; L66-K69 PolarHBondContact N-O 3.35Å; L66-K69 WeakPolarHBondContact O-CA 3.49Å; L66-K69 WeakPolarHBondContact O-CB 3.38Å; L66-K69 PolarHBondContact O-N 3.28Å; L66-V113 HydrophobicContact CD1-CG2 3.97Å; L66-V113 HydrophobicContact CD2-CG1 4.1Å; L66-V113 HydrophobicContact CD2-CG2 4.36Å
67	D	29.7	Very low	33.8	Very low	158 Å²	158	75.8 Å²	75.8	85%	0.845	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	41.3	165.4	-136.2	15.6	0	0	0	114	K69	D67-K69 PolarHBondContact O-N 3.1Å
68	G	32.3	Very low	34.3	Very low	81 Å²	81	75.8 Å²	75.8	84%	0.835	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	0.7	-177.6	0	0	0	0	0	115.3	L66	L66-G68 VanDerWaalsContact C-N 3.31Å; L66-G68 PolarHBondContact O-N 3.44Å; L66-G68 VanDerWaalsContact O-N 3.17Å
69	K	32.8	Very low	34.6	Very low	162 Å²	162	70.8 Å²	70.8	70%	0.704	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.5	112	171.7	-65.2	-179.5	-178.7	174.5	0	109.5	L66 D67 T71	L66-K69 PolarHBondContact N-O 3.35Å; L66-K69 WeakPolarHBondContact O-CA 3.49Å; L66-K69 WeakPolarHBondContact O-CB 3.38Å; L66-K69 PolarHBondContact O-N 3.28Å; D67-K69 PolarHBondContact O-N 3.1Å; K69-T71 PolarHBondContact O-N 3.32Å
70	S	36.1	Very low	35.2	Very low	88 Å²	88	73.4 Å²	73.4	62%	0.615	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	109.9	169.3	56.8	0	0	0	0	108.9
71	T	34.4	Very low	36	Very low	64 Å²	64	72 Å²	72	39%	0.393	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	114.6	170.6	-52.9	0	0	0	0	107.7	L64 K69 F73	L64-T71 PolarHBondContact O-N 2.69Å; K69-T71 PolarHBondContact O-N 3.32Å; T71-F73 PolarHBondContact O-N 2.87Å; T71-F73 VanDerWaalsContact O-N 3.15Å
72	L	36.9	Very low	36.6	Very low	130 Å²	130	71.5 Å²	71.5	68%	0.681	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	111.8	171.5	-170.6	81.3	0	0	0	107.4	S74	L72-S74 PolarHBondContact O-N 2.98Å
73	F	39.1	Very low	36.9	Very low	39 Å²	39	71.2 Å²	71.2	17%	0.171	41%	0.405	C	S	.	.			trans	-65.5	130.6	170.4	-70.9	-60.6	0	0	0	109.8	L64 T71 T75 Y107	L64-F73 HydrophobicContact CB-CD2 3.96Å; L64-F73 HydrophobicContact CB-CE1 4.25Å; L64-F73 HydrophobicContact CB-CE2 3.35Å; L64-F73 HydrophobicContact CB-CZ 3.53Å; L64-F73 HydrophobicContact CD1-CE2 3.58Å; L64-F73 HydrophobicContact CD1-CZ 3.47Å; L64-F73 VanDerWaalsContact CD1-CZ 3.47Å; L64-F73 HydrophobicContact CD2-CE1 3.79Å; L64-F73 HydrophobicContact CD2-CE2 4.1Å; L64-F73 HydrophobicContact CD2-CZ 3.34Å; L64-F73 HydrophobicContact CG-CE1 4.41Å; L64-F73 HydrophobicContact CG-CE2 3.83Å; L64-F73 HydrophobicContact CG-CZ 3.59Å; T71-F73 PolarHBondContact O-N 2.87Å; T71-F73 VanDerWaalsContact O-N 3.15Å; F73-T75 PolarHBondContact O-N 3.49Å; F73-Y107 HydrophobicContact CD1-CE1 4.44Å; F73-Y107 AromaticContact CE1-CE1 3.49Å; F73-Y107 HydrophobicContact CE1-CE1 3.49Å; F73-Y107 VanDerWaalsContact CE1-CE1 3.49Å; F73-Y107 AromaticContact CE1-CZ 3.67Å; F73-Y107 WeakPolarHBondContact CE1-OH 2.9Å; F73-Y107 HydrophobicContact CZ-CE1 4.14Å
74	S	34.1	Very low	37.3	Very low	66 Å²	66	74.6 Å²	74.6	46%	0.462	42%	0.42	S	S	.	.			trans	-59	128.2	164.3	77.6	0	0	0	0	108	L72 N76 I77	L72-S74 PolarHBondContact O-N 2.98Å; S74-N76 PolarHBondContact O-N 3.34Å; S74-I77 PolarHBondContact O-N 2.96Å; S74-I77 VanDerWaalsContact O-N 3.13Å
75	T	37.8	Very low	37.7	Very low	54 Å²	54	75.7 Å²	75.7	33%	0.331	43%	0.425	S	S	.	.	H	α-helix	trans	-44	-25.3	177.6	-31.5	0	0	0	0	113	F73 I77 L78 L79	F73-T75 PolarHBondContact O-N 3.49Å; T75-I77 VanDerWaalsContact C-N 3.34Å; T75-I77 PolarHBondContact O-N 3.47Å; T75-L78 PolarHBondContact O-N 3.08Å; T75-L79 HydrophobicContact CG2-CD1 4.05Å; T75-L79 HydrophobicContact CG2-CG 4.29Å; T75-L79 VanDerWaalsContact O-CB 3.29Å; T75-L79 WeakPolarHBondContact O-CB 3.33Å; T75-L79 WeakPolarHBondContact O-CD1 3.26Å; T75-L79 WeakPolarHBondContact O-CG 3.4Å; T75-L79 PolarHBondContact O-N 2.93Å
76	N	37.1	Very low	38.1	Very low	106 Å²	106	77.4 Å²	77.4	57%	0.567	43%	0.428	S	S	*	.	H	α-helix	trans	-58.2	-32.7	179.4	-71.3	-10.5	0	0	0	115.3	S74 K80	S74-N76 PolarHBondContact O-N 3.34Å; N76-K80 WeakPolarHBondContact O-CG 3.41Å; N76-K80 PolarHBondContact O-N 3.04Å
77	I	39.6	Very low	38.6	Very low	56 Å²	56	83 Å²	83	29%	0.287	45%	0.451	S	S	.	.	H	α-helix	trans	-77.3	-43.9	-180	-68.8	155.8	0	0	0	110.2	S74 T75 L79 K80 V81 Y107	S74-I77 PolarHBondContact O-N 2.96Å; S74-I77 VanDerWaalsContact O-N 3.13Å; T75-I77 VanDerWaalsContact C-N 3.34Å; T75-I77 PolarHBondContact O-N 3.47Å; I77-L79 VanDerWaalsContact C-N 3.3Å; I77-L79 PolarHBondContact O-N 3.38Å; I77-K80 PolarHBondContact O-N 3.07Å; I77-V81 WeakPolarHBondContact O-CG2 3.25Å; I77-V81 PolarHBondContact O-N 2.99Å; I77-V81 VanDerWaalsContact O-N 3.08Å; I77-Y107 HydrophobicContact CD1-CD2 4.14Å; I77-Y107 HydrophobicContact CD1-CE2 3.38Å; I77-Y107 HydrophobicContact CG1-CE2 4.35Å
78	L	42.2	Very low	39	Very low	47 Å²	47	76.8 Å²	76.8	25%	0.246	43%	0.425	C	S	.	.	H	α-helix	trans	-64.3	-37.2	175.3	-66.9	164.5	0	0	0	111.5	F62 T75 V81 A82	F62-L78 HydrophobicContact CB-CD1 4.36Å; F62-L78 HydrophobicContact CD2-CD1 3.29Å; F62-L78 HydrophobicContact CD2-CD2 4.1Å; F62-L78 HydrophobicContact CD2-CG 4.32Å; F62-L78 HydrophobicContact CE2-CD1 3.73Å; F62-L78 HydrophobicContact CE2-CD2 4.03Å; F62-L78 HydrophobicContact CE2-CG 4.46Å; F62-L78 HydrophobicContact CG-CD1 4.06Å; F62-L78 HydrophobicContact CG-CD2 4.47Å; F62-L78 HydrophobicContact CZ-CD2 4.39Å; T75-L78 PolarHBondContact O-N 3.08Å; L78-V81 PolarHBondContact O-N 2.87Å; L78-A82 WeakPolarHBondContact O-CB 3.41Å; L78-A82 PolarHBondContact O-N 3.08Å
79	L	40.5	Very low	39.3	Very low	29 Å²	29	76.1 Å²	76.1	15%	0.152	41%	0.407	C	S	.	.	H	α-helix	trans	-60.2	-44	173.6	-80.2	165.3	0	0	0	112	F6 A10 T75 I77 T83	F6-L79 HydrophobicContact CD1-CD2 4.47Å; A10-L79 HydrophobicContact CB-CD2 3.15Å; A10-L79 HydrophobicContact CB-CG 4.27Å; T75-L79 HydrophobicContact CG2-CD1 4.05Å; T75-L79 HydrophobicContact CG2-CG 4.29Å; T75-L79 VanDerWaalsContact O-CB 3.29Å; T75-L79 WeakPolarHBondContact O-CB 3.33Å; T75-L79 WeakPolarHBondContact O-CD1 3.26Å; T75-L79 WeakPolarHBondContact O-CG 3.4Å; T75-L79 PolarHBondContact O-N 2.93Å; I77-L79 VanDerWaalsContact C-N 3.3Å; I77-L79 PolarHBondContact O-N 3.38Å; L79-T83 VanDerWaalsContact O-CB 3.26Å; L79-T83 WeakPolarHBondContact O-CB 3.43Å; L79-T83 PolarHBondContact O-N 3.2Å; L79-T83 PolarHBondContact O-OG1 3.32Å
80	K	40.6	Very low	39.6	Very low	149 Å²	149	76 Å²	76	65%	0.648	41%	0.406	S	S	*	.	H	α-helix	trans	-64.8	-41.1	176	-74.9	177.9	179.9	-175	0	111.6	N76 I77 F84	N76-K80 WeakPolarHBondContact O-CG 3.41Å; N76-K80 PolarHBondContact O-N 3.04Å; I77-K80 PolarHBondContact O-N 3.07Å; K80-F84 WeakPolarHBondContact O-CB 3.29Å; K80-F84 WeakPolarHBondContact O-CD2 3.3Å; K80-F84 PolarHBondContact O-N 3.11Å
81	V	44.4	Very low	39.8	Very low	30 Å²	30	72.6 Å²	72.6	18%	0.182	38%	0.382	C	S	.	.	H	α-helix	trans	-65.7	-46.8	178.6	173.7	0	0	0	0	111.6	I77 L78 F84 I85 F100	I77-V81 WeakPolarHBondContact O-CG2 3.25Å; I77-V81 PolarHBondContact O-N 2.99Å; I77-V81 VanDerWaalsContact O-N 3.08Å; L78-V81 PolarHBondContact O-N 2.87Å; V81-F84 PolarHBondContact O-N 3.28Å; V81-I85 HydrophobicContact CG1-CD1 3.88Å; V81-I85 WeakPolarHBondContact O-CD1 3.13Å; V81-I85 VanDerWaalsContact O-CG1 3.31Å; V81-I85 WeakPolarHBondContact O-CG1 3.38Å; V81-I85 PolarHBondContact O-N 3.35Å; V81-I85 VanDerWaalsContact O-N 3.12Å; V81-F100 HydrophobicContact CG1-CD2 3.87Å; V81-F100 HydrophobicContact CG1-CE2 3.45Å; V81-F100 VanDerWaalsContact CG1-CE2 3.45Å
82	A	42.6	Very low	40.1	Very low	28 Å²	28	74.6 Å²	74.6	23%	0.231	40%	0.399	C	S	.	.	H	α-helix	trans	-63.5	-43	177.8	0	0	0	0	0	112.2	L78 F84 I85 E86	L78-A82 WeakPolarHBondContact O-CB 3.41Å; L78-A82 PolarHBondContact O-N 3.08Å; A82-F84 PolarHBondContact O-N 2.63Å; A82-I85 PolarHBondContact O-N 3.29Å; A82-E86 WeakPolarHBondContact O-CB 3.49Å; A82-E86 PolarHBondContact O-N 2.79Å
83	T	41.9	Very low	40.2	Very low	44 Å²	44	69.9 Å²	69.9	27%	0.27	38%	0.377	S	S	.	.	H	α-helix	trans	-61.9	-43.9	176.3	-54.6	0	0	0	0	110.9	L79 I85 E86 F87	L79-T83 VanDerWaalsContact O-CB 3.26Å; L79-T83 WeakPolarHBondContact O-CB 3.43Å; L79-T83 PolarHBondContact O-N 3.2Å; L79-T83 PolarHBondContact O-OG1 3.32Å; T83-I85 VanDerWaalsContact C-N 3.33Å; T83-I85 PolarHBondContact O-N 2.98Å; T83-E86 PolarHBondContact O-N 3.26Å; T83-F87 HydrophobicContact CG2-CD2 3.66Å; T83-F87 HydrophobicContact CG2-CE2 3.84Å; T83-F87 WeakPolarHBondContact O-CD2 3.29Å; T83-F87 PolarHBondContact O-N 3.49Å
84	F	42	Very low	40.1	Very low	154 Å²	154	76.7 Å²	76.7	68%	0.675	41%	0.406	S	S	*	.	H	α-helix	trans	-66.9	-31.7	179.4	-101.1	-86.6	0	0	0	113.6	K80 V81 A82 G88	K80-F84 WeakPolarHBondContact O-CB 3.29Å; K80-F84 WeakPolarHBondContact O-CD2 3.3Å; K80-F84 PolarHBondContact O-N 3.11Å; V81-F84 PolarHBondContact O-N 3.28Å; A82-F84 PolarHBondContact O-N 2.63Å; F84-G88 WeakPolarHBondContact O-CA 3.37Å; F84-G88 PolarHBondContact O-N 3.36Å
85	I	44.7	Very low	39.9	Very low	38 Å²	38	82 Å²	82	20%	0.195	42%	0.417	C	S	.	.	H	α-helix	trans	-71.8	-38.2	174.1	-67.5	158.4	0	0	0	111.1	F39 Y41 V81 A82 T83 F100	F39-I85 HydrophobicContact CE2-CG2 4.48Å; Y41-I85 HydrophobicContact CE1-CD1 4.42Å; Y41-I85 WeakPolarHBondContact OH-CD1 3.18Å; Y41-I85 WeakPolarHBondContact OH-CG2 3.31Å; V81-I85 HydrophobicContact CG1-CD1 3.88Å; V81-I85 WeakPolarHBondContact O-CD1 3.13Å; V81-I85 VanDerWaalsContact O-CG1 3.31Å; V81-I85 WeakPolarHBondContact O-CG1 3.38Å; V81-I85 PolarHBondContact O-N 3.35Å; V81-I85 VanDerWaalsContact O-N 3.12Å; A82-I85 PolarHBondContact O-N 3.29Å; T83-I85 VanDerWaalsContact C-N 3.33Å; T83-I85 PolarHBondContact O-N 2.98Å; I85-F100 HydrophobicContact CD1-CD2 3.9Å; I85-F100 HydrophobicContact CD1-CE2 3.97Å; I85-F100 HydrophobicContact CG1-CD2 4.42Å
86	E	40.1	Very low	39.9	Very low	66 Å²	66	80.7 Å²	80.7	31%	0.308	41%	0.411	S	S	.	.	H	α-helix	trans	-70.3	-39.2	-178.5	-170.4	172.4	-170.3	0	0	112.5	S34 A82 T83	S34-E86 WeakPolarHBondContact CB-OE1 3.5Å; S34-E86 PolarHBondContact OG-OE1 2.97Å; A82-E86 WeakPolarHBondContact O-CB 3.49Å; A82-E86 PolarHBondContact O-N 2.79Å; T83-E86 PolarHBondContact O-N 3.26Å
87	F	41.1	Very low	39.9	Very low	154 Å²	154	79.5 Å²	79.5	68%	0.675	40%	0.4	S	S	*	.	H	α-helix	trans	-97.1	-17.3	-179.2	-65.3	-73.9	0	0	0	113.7	T83	T83-F87 HydrophobicContact CG2-CD2 3.66Å; T83-F87 HydrophobicContact CG2-CE2 3.84Å; T83-F87 WeakPolarHBondContact O-CD2 3.29Å; T83-F87 PolarHBondContact O-N 3.49Å
88	G	39.7	Very low	39.4	Very low	28 Å²	28	80.5 Å²	80.5	29%	0.289	41%	0.412	S	S	.	.	S	Bend	trans	-101	88.3	-177.9	0	0	0	0	0	112.9	F84	F84-G88 WeakPolarHBondContact O-CA 3.37Å; F84-G88 PolarHBondContact O-N 3.36Å
89	S	37.2	Very low	39.1	Very low	66 Å²	66	83.4 Å²	83.4	46%	0.462	43%	0.428	S	S	.	.			trans	73.4	144.9	146.3	73.2	0	0	0	0	119	S96	S89-S96 WeakPolarHBondContact OG-CB 3.38Å
90	K	39.9	Very low	39.5	Very low	160 Å²	160	83.2 Å²	83.2	70%	0.696	43%	0.426	S	S	*	.			trans	-44.6	132.1	176.8	-69.9	174.4	177.6	175.9	0	111.2	S92 S93	K90-S92 PolarHBondContact O-N 3.4Å; K90-S93 PolarHBondContact O-N 2.93Å; K90-S93 PolarHBondContact O-OG 3.19Å
91	P	40.2	Very low	39.6	Very low	16 Å²	16	78.3 Å²	78.3	10%	0.104	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-19.9	176.5	-9.9	-0.1	0	0	0	115.6	F39	F39-P91 HydrophobicContact CD1-CB 4.47Å; F39-P91 HydrophobicContact CE1-CB 3.7Å; F39-P91 HydrophobicContact CE1-CG 3.6Å; F39-P91 HydrophobicContact CZ-CG 4.08Å
92	S	40.8	Very low	39.3	Very low	106 Å²	106	79.3 Å²	79.3	74%	0.741	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-8.5	-175.9	58.2	0	0	0	0	114.7	K90	K90-S92 PolarHBondContact O-N 3.4Å
93	S	39.1	Very low	39.5	Very low	31 Å²	31	80.2 Å²	80.2	22%	0.217	43%	0.425	C	S	.	.	S	Bend	trans	-82.7	134.7	179.8	82	0	0	0	0	110.5	K90 Y95 S96	K90-S93 PolarHBondContact O-N 2.93Å; K90-S93 PolarHBondContact O-OG 3.19Å; S93-Y95 PolarHBondContact O-N 2.96Å; S93-S96 PolarHBondContact O-N 2.88Å; S93-S96 PolarHBondContact O-OG 3.13Å
94	K	36.6	Very low	39.9	Very low	183 Å²	183	80.2 Å²	80.2	80%	0.796	42%	0.423	S	S	*	.	H	α-helix	trans	-52	-23	170.8	-72.5	-179.6	177.1	179.4	0	112.3	S98	K94-S98 PolarHBondContact O-N 3.11Å; K94-S98 PolarHBondContact O-OG 2.97Å
95	Y	30.5	Very low	40	Very low	176 Å²	176	75.8 Å²	75.8	69%	0.69	41%	0.409	S	S	*	.	H	α-helix	trans	-69.5	-40.9	-176.9	-68	-84	0	0	0	114.2	S93 K97 S98 L99	S93-Y95 PolarHBondContact O-N 2.96Å; Y95-K97 VanDerWaalsContact C-N 3.34Å; Y95-K97 PolarHBondContact O-N 2.86Å; Y95-S98 PolarHBondContact O-N 3.35Å; Y95-L99 WeakPolarHBondContact O-CB 3.2Å; Y95-L99 WeakPolarHBondContact O-CD1 3.22Å; Y95-L99 PolarHBondContact O-N 3.32Å; Y95-L99 VanDerWaalsContact O-N 3.11Å
96	S	36.7	Very low	39.8	Very low	28 Å²	28	78.8 Å²	78.8	20%	0.196	42%	0.422	C	S	.	.	H	α-helix	trans	-67.6	-34.7	-179.6	56.8	0	0	0	0	112.7	S89 S93 F100	S89-S96 WeakPolarHBondContact OG-CB 3.38Å; S93-S96 PolarHBondContact O-N 2.88Å; S93-S96 PolarHBondContact O-OG 3.13Å; S96-F100 PolarHBondContact O-N 3.35Å
97	K	36.6	Very low	40.2	Very low	80 Å²	80	79.4 Å²	79.4	35%	0.348	42%	0.422	S	S	.	.	H	α-helix	trans	-66.9	-46.3	175.7	-65.1	-177.5	179.8	179.5	0	111.9	Y95 L99 F100 I101 V123	Y95-K97 VanDerWaalsContact C-N 3.34Å; Y95-K97 PolarHBondContact O-N 2.86Å; K97-L99 PolarHBondContact O-N 3.24Å; K97-F100 PolarHBondContact O-N 3.2Å; K97-I101 WeakPolarHBondContact O-CG1 3.37Å; K97-I101 PolarHBondContact O-N 3.45Å; K97-V123 HydrophobicContact CG-CG2 4.21Å
98	S	29.9	Very low	40.3	Very low	77 Å²	77	72.7 Å²	72.7	54%	0.538	39%	0.394	S	S	.	.	H	α-helix	trans	-65.5	-37.7	179.9	-60.5	0	0	0	0	112.5	K94 Y95 A102	K94-S98 PolarHBondContact O-N 3.11Å; K94-S98 PolarHBondContact O-OG 2.97Å; Y95-S98 PolarHBondContact O-N 3.35Å; S98-A102 VanDerWaalsContact O-CB 3.29Å; S98-A102 WeakPolarHBondContact O-CB 2.95Å; S98-A102 PolarHBondContact O-N 3.32Å
99	L	36.7	Very low	40.3	Very low	108 Å²	108	81 Å²	81	57%	0.565	42%	0.418	S	S	*	.	H	α-helix	trans	-71	-35.8	179.8	-80.7	156.9	0	0	0	112.9	Y95 K97 A102 A103	Y95-L99 WeakPolarHBondContact O-CB 3.2Å; Y95-L99 WeakPolarHBondContact O-CD1 3.22Å; Y95-L99 PolarHBondContact O-N 3.32Å; Y95-L99 VanDerWaalsContact O-N 3.11Å; K97-L99 PolarHBondContact O-N 3.24Å; L99-A102 PolarHBondContact O-N 2.67Å; L99-A103 PolarHBondContact O-N 3.07Å
100	F	47.7	Very low	40.5	Very low	25 Å²	25	86.8 Å²	86.8	11%	0.11	43%	0.43	C	S	.	.	H	α-helix	trans	-65.5	-45	174.8	-177.5	-93.2	0	0	0	112.2	Y41 F43 V81 I85 S96 K97 A102 A103 L104 V120	Y41-F100 HydrophobicContact CD1-CE1 4.26Å; Y41-F100 HydrophobicContact CD1-CE2 4.43Å; Y41-F100 HydrophobicContact CD1-CZ 4.11Å; Y41-F100 HydrophobicContact CE1-CD2 4.36Å; Y41-F100 HydrophobicContact CE1-CE2 4.16Å; Y41-F100 HydrophobicContact CE1-CZ 4.3Å; F43-F100 AromaticContact CE1-CE1 3.66Å; F43-F100 HydrophobicContact CE1-CE1 3.66Å; F43-F100 AromaticContact CE1-CZ 3.91Å; F43-F100 HydrophobicContact CE1-CZ 3.91Å; F43-F100 AromaticContact CZ-CE1 3.76Å; F43-F100 HydrophobicContact CZ-CE1 3.76Å; F43-F100 AromaticContact CZ-CZ 3.63Å; F43-F100 HydrophobicContact CZ-CZ 3.63Å; V81-F100 HydrophobicContact CG1-CD2 3.87Å; V81-F100 HydrophobicContact CG1-CE2 3.45Å; V81-F100 VanDerWaalsContact CG1-CE2 3.45Å; I85-F100 HydrophobicContact CD1-CD2 3.9Å; I85-F100 HydrophobicContact CD1-CE2 3.97Å; I85-F100 HydrophobicContact CG1-CD2 4.42Å; S96-F100 PolarHBondContact O-N 3.35Å; K97-F100 PolarHBondContact O-N 3.2Å; F100-A102 VanDerWaalsContact C-N 3.31Å; F100-A102 PolarHBondContact O-N 3.36Å; F100-A103 PolarHBondContact O-N 3.39Å; F100-L104 HydrophobicContact CD1-CD1 3.87Å; F100-L104 HydrophobicContact CE1-CD1 3.27Å; F100-L104 HydrophobicContact CE1-CG 4.5Å; F100-L104 HydrophobicContact CE2-CD1 4.42Å; F100-L104 HydrophobicContact CZ-CD1 3.58Å; F100-L104 PolarHBondContact O-N 3.34Å; F100-V120 HydrophobicContact CD1-CG2 3.57Å; F100-V120 HydrophobicContact CE1-CG2 3.79Å
101	I	43.7	Very low	40.7	Very low	47 Å²	47	81 Å²	81	24%	0.241	41%	0.41	C	S	.	.	H	α-helix	trans	-64.2	-38.8	174.7	-65.1	168.3	0	0	0	110.2	K97 L104 T105 V120	K97-I101 WeakPolarHBondContact O-CG1 3.37Å; K97-I101 PolarHBondContact O-N 3.45Å; I101-L104 PolarHBondContact O-N 3.02Å; I101-T105 WeakPolarHBondContact O-CB 3.35Å; I101-T105 PolarHBondContact O-N 2.78Å; I101-T105 PolarHBondContact O-OG1 3.06Å; I101-V120 HydrophobicContact CD1-CB 4.09Å; I101-V120 HydrophobicContact CD1-CG2 4.14Å; I101-V120 HydrophobicContact CG1-CB 4.19Å; I101-V120 HydrophobicContact CG1-CG2 3.67Å
102	A	37.2	Very low	40.7	Very low	51 Å²	51	87.1 Å²	87.1	42%	0.421	45%	0.447	S	S	.	.	H	α-helix	trans	-63.8	-42.7	177	0	0	0	0	0	112.4	S98 L99 F100 L104 T105 E106	S98-A102 VanDerWaalsContact O-CB 3.29Å; S98-A102 WeakPolarHBondContact O-CB 2.95Å; S98-A102 PolarHBondContact O-N 3.32Å; L99-A102 PolarHBondContact O-N 2.67Å; F100-A102 VanDerWaalsContact C-N 3.31Å; F100-A102 PolarHBondContact O-N 3.36Å; A102-L104 PolarHBondContact O-N 3.43Å; A102-T105 PolarHBondContact O-N 3.2Å; A102-E106 VanDerWaalsContact O-CB 3.29Å; A102-E106 WeakPolarHBondContact O-CB 3.29Å; A102-E106 PolarHBondContact O-N 2.83Å
103	A	47.9	Very low	40.6	Very low	46 Å²	46	83.8 Å²	83.8	38%	0.38	42%	0.422	S	S	.	.	H	α-helix	trans	-64.9	-39.8	178.3	0	0	0	0	0	112.6	L99 F100 Y107	L99-A103 PolarHBondContact O-N 3.07Å; F100-A103 PolarHBondContact O-N 3.39Å; A103-Y107 WeakPolarHBondContact O-CB 3.47Å; A103-Y107 PolarHBondContact O-N 3.36Å
104	L	50.3	Low	40.4	Very low	44 Å²	44	87.1 Å²	87.1	23%	0.23	44%	0.444	C	S	.	.	H	α-helix	trans	-71.6	-39.2	174.9	-76.7	167.8	0	0	0	112.2	F43 F100 I101 A102 Y107 C108 L118	F43-L104 HydrophobicContact CE1-CD1 3.9Å; F100-L104 HydrophobicContact CD1-CD1 3.87Å; F100-L104 HydrophobicContact CE1-CD1 3.27Å; F100-L104 HydrophobicContact CE1-CG 4.5Å; F100-L104 HydrophobicContact CE2-CD1 4.42Å; F100-L104 HydrophobicContact CZ-CD1 3.58Å; F100-L104 PolarHBondContact O-N 3.34Å; I101-L104 PolarHBondContact O-N 3.02Å; A102-L104 PolarHBondContact O-N 3.43Å; L104-Y107 PolarHBondContact O-N 3.5Å; L104-C108 PolarHBondContact O-N 3.46Å; L104-C108 PolarHBondContact O-SG 3.18Å; L104-C108 VanDerWaalsContact O-SG 3.36Å; L104-L118 HydrophobicContact CB-CD1 4.39Å; L104-L118 HydrophobicContact CB-CD2 4.07Å; L104-L118 HydrophobicContact CD1-CD1 4.2Å; L104-L118 HydrophobicContact CD1-CD2 3.44Å; L104-L118 VanDerWaalsContact CD1-CD2 3.44Å; L104-L118 HydrophobicContact CD1-CG 4.47Å; L104-L118 HydrophobicContact CG-CD2 4.38Å
105	T	43.5	Very low	40.7	Very low	62 Å²	62	79.6 Å²	79.6	38%	0.38	41%	0.414	S	S	.	.	H	α-helix	trans	-66.3	-44	176.1	-57.8	0	0	0	0	111.7	I101 A102 Y107 C108 Y109	I101-T105 WeakPolarHBondContact O-CB 3.35Å; I101-T105 PolarHBondContact O-N 2.78Å; I101-T105 PolarHBondContact O-OG1 3.06Å; A102-T105 PolarHBondContact O-N 3.2Å; T105-Y107 VanDerWaalsContact C-N 3.28Å; T105-Y107 PolarHBondContact O-N 2.97Å; T105-C108 PolarHBondContact O-N 3.18Å; T105-Y109 WeakPolarHBondContact O-CB 3.32Å; T105-Y109 PolarHBondContact O-N 3.41Å
106	E	41.4	Very low	40.8	Very low	101 Å²	101	75.8 Å²	75.8	47%	0.472	41%	0.414	S	S	.	.	H	α-helix	trans	-62.3	-39.5	177	-172.3	-175.5	174	0	0	110.8	A102 Y109 R110	A102-E106 VanDerWaalsContact O-CB 3.29Å; A102-E106 WeakPolarHBondContact O-CB 3.29Å; A102-E106 PolarHBondContact O-N 2.83Å; E106-Y109 PolarHBondContact O-N 2.97Å; E106-R110 WeakPolarHBondContact O-CG 3.13Å; E106-R110 PolarHBondContact O-N 3.45Å; E106-R110 IonicContact OE1-CZ 3.34Å; E106-R110 IonicContact OE1-NE 3.14Å; E106-R110 PolarHBondContact OE1-NE 3.15Å; E106-R110 VanDerWaalsContact OE1-NE 3.14Å; E106-R110 IonicContact OE1-NH2 2.75Å; E106-R110 PolarHBondContact OE1-NH2 3.34Å
107	Y	48	Very low	40.6	Very low	78 Å²	78	76.1 Å²	76.1	31%	0.306	42%	0.421	S	S	.	.	H	α-helix	trans	-63.1	-47.7	175.9	-175.5	-96.8	0	0	0	111.7	F73 I77 A103 L104 T105 Y109 R110 S111	F73-Y107 HydrophobicContact CD1-CE1 4.44Å; F73-Y107 AromaticContact CE1-CE1 3.49Å; F73-Y107 HydrophobicContact CE1-CE1 3.49Å; F73-Y107 VanDerWaalsContact CE1-CE1 3.49Å; F73-Y107 AromaticContact CE1-CZ 3.67Å; F73-Y107 WeakPolarHBondContact CE1-OH 2.9Å; F73-Y107 HydrophobicContact CZ-CE1 4.14Å; I77-Y107 HydrophobicContact CD1-CD2 4.14Å; I77-Y107 HydrophobicContact CD1-CE2 3.38Å; I77-Y107 HydrophobicContact CG1-CE2 4.35Å; A103-Y107 WeakPolarHBondContact O-CB 3.47Å; A103-Y107 PolarHBondContact O-N 3.36Å; L104-Y107 PolarHBondContact O-N 3.5Å; T105-Y107 VanDerWaalsContact C-N 3.28Å; T105-Y107 PolarHBondContact O-N 2.97Å; Y107-Y109 VanDerWaalsContact C-N 3.31Å; Y107-Y109 PolarHBondContact O-N 3.23Å; Y107-R110 PolarHBondContact O-N 3.13Å; Y107-S111 WeakPolarHBondContact O-CB 3.43Å; Y107-S111 PolarHBondContact O-N 2.82Å; Y107-S111 PolarHBondContact O-OG 3.17Å
108	C	43.1	Very low	40.7	Very low	14 Å²	14	73.6 Å²	73.6	10%	0.095	41%	0.411	C	S	.	.	H	α-helix	trans	-59.4	-40.8	174.2	-74.3	0	0	0	0	113	L104 T105 R110 S111 V113 C115	L104-C108 PolarHBondContact O-N 3.46Å; L104-C108 PolarHBondContact O-SG 3.18Å; L104-C108 VanDerWaalsContact O-SG 3.36Å; T105-C108 PolarHBondContact O-N 3.18Å; C108-R110 VanDerWaalsContact C-N 3.35Å; C108-R110 PolarHBondContact O-N 2.97Å; C108-S111 WeakPolarHBondContact CA-OG 3.41Å; C108-S111 PolarHBondContact O-N 2.02Å; C108-S111 PolarHBondContact O-OG 2.83Å; C108-S111 VanDerWaalsContact O-OG 3.11Å; C108-V113 CarbonylContact C-O 3.52Å; C108-V113 PolarHBondContact O-N 3.24Å; C108-C115 HydrophobicContact CB-CB 3.24Å; C108-C115 WeakPolarHBondContact CB-SG 3.47Å; C108-C115 WeakPolarHBondContact SG-CB 3.49Å; C108-C115 CovalentContact SG-SG 2.02Å; C108-C115 PolarHBondContact SG-SG 3.24Å
109	Y	38.4	Very low	41	Very low	201 Å²	201	77.3 Å²	77.3	79%	0.788	42%	0.415	S	S	*	.	H	α-helix	trans	-62.9	-41.5	177.4	-169.9	-96.3	0	0	0	111.5	T105 E106 Y107	T105-Y109 WeakPolarHBondContact O-CB 3.32Å; T105-Y109 PolarHBondContact O-N 3.41Å; E106-Y109 PolarHBondContact O-N 2.97Å; Y107-Y109 VanDerWaalsContact C-N 3.31Å; Y107-Y109 PolarHBondContact O-N 3.23Å
110	R	41.5	Very low	41.2	Very low	188 Å²	188	72.7 Å²	72.7	71%	0.709	39%	0.391	S	S	*	.	H	α-helix	trans	-74.2	-24.2	176.8	-71.2	-176.1	-173.9	-136.5	6	113.6	E106 Y107 C108 T112	E106-R110 WeakPolarHBondContact O-CG 3.13Å; E106-R110 PolarHBondContact O-N 3.45Å; E106-R110 IonicContact OE1-CZ 3.34Å; E106-R110 IonicContact OE1-NE 3.14Å; E106-R110 PolarHBondContact OE1-NE 3.15Å; E106-R110 VanDerWaalsContact OE1-NE 3.14Å; E106-R110 IonicContact OE1-NH2 2.75Å; E106-R110 PolarHBondContact OE1-NH2 3.34Å; Y107-R110 PolarHBondContact O-N 3.13Å; C108-R110 VanDerWaalsContact C-N 3.35Å; C108-R110 PolarHBondContact O-N 2.97Å; R110-T112 VanDerWaalsContact C-N 3.33Å; R110-T112 PolarHBondContact O-N 3.34Å
111	S	44.4	Very low	40.6	Very low	39 Å²	39	77.1 Å²	77.1	27%	0.273	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	9.8	-178.9	65	0	0	0	0	114.4	Y107 C108 V113	Y107-S111 WeakPolarHBondContact O-CB 3.43Å; Y107-S111 PolarHBondContact O-N 2.82Å; Y107-S111 PolarHBondContact O-OG 3.17Å; C108-S111 WeakPolarHBondContact CA-OG 3.41Å; C108-S111 PolarHBondContact O-N 2.02Å; C108-S111 PolarHBondContact O-OG 2.83Å; C108-S111 VanDerWaalsContact O-OG 3.11Å; S111-V113 WeakPolarHBondContact O-CG2 3.47Å; S111-V113 PolarHBondContact O-N 2.8Å; S111-V113 VanDerWaalsContact O-N 3.11Å
112	T	39.9	Very low	40.2	Very low	145 Å²	145	76.2 Å²	76.2	89%	0.89	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	23.6	-173.3	47.5	0	0	0	0	113.7	R110	R110-T112 VanDerWaalsContact C-N 3.33Å; R110-T112 PolarHBondContact O-N 3.34Å
113	V	39.7	Very low	40.3	Very low	35 Å²	35	75 Å²	75	21%	0.212	40%	0.397	C	S	.	.			trans	-104.6	115.9	178.5	178.9	0	0	0	0	107.6	C49 L66 C108 S111 C115	C49-V113 HydrophobicContact CB-CG1 4.05Å; L66-V113 HydrophobicContact CD1-CG2 3.97Å; L66-V113 HydrophobicContact CD2-CG1 4.1Å; L66-V113 HydrophobicContact CD2-CG2 4.36Å; C108-V113 CarbonylContact C-O 3.52Å; C108-V113 PolarHBondContact O-N 3.24Å; S111-V113 WeakPolarHBondContact O-CG2 3.47Å; S111-V113 PolarHBondContact O-N 2.8Å; S111-V113 VanDerWaalsContact O-N 3.11Å; V113-C115 VanDerWaalsContact C-N 3.31Å; V113-C115 PolarHBondContact O-N 3.5Å
114	C	35.3	Very low	40	Very low	102 Å²	102	77.2 Å²	77.2	69%	0.689	40%	0.396	S	S	*	.			trans	-62.4	88.2	172.3	-94	0	0	0	0	110.5	C49 S116	C49-C114 PolarHBondContact SG-O 3.31Å; C114-S116 PolarHBondContact O-N 3.28Å
115	C	41.8	Very low	39.4	Very low	24 Å²	24	77.7 Å²	77.7	16%	0.162	40%	0.403	C	S	.	.			trans	-89.3	78.5	166.8	-64.1	0	0	0	0	109.6	C108 V113 G117	C108-C115 HydrophobicContact CB-CB 3.24Å; C108-C115 WeakPolarHBondContact CB-SG 3.47Å; C108-C115 WeakPolarHBondContact SG-CB 3.49Å; C108-C115 CovalentContact SG-SG 2.02Å; C108-C115 PolarHBondContact SG-SG 3.24Å; V113-C115 VanDerWaalsContact C-N 3.31Å; V113-C115 PolarHBondContact O-N 3.5Å; C115-G117 PolarHBondContact O-N 3.42Å
116	S	33.4	Very low	39	Very low	97 Å²	97	80.5 Å²	80.5	68%	0.678	41%	0.411	S	S	*	.			trans	-80	10.4	174.4	50.3	0	0	0	0	113.8	C114	C114-S116 PolarHBondContact O-N 3.28Å
117	G	33.1	Very low	38.7	Very low	35 Å²	35	79.3 Å²	79.3	36%	0.361	42%	0.415	S	S	.	.			trans	-159.1	28.6	-164.6	0	0	0	0	0	118.4	C115 Y119	C115-G117 PolarHBondContact O-N 3.42Å; G117-Y119 PolarHBondContact O-N 2.93Å
118	L	38.5	Very low	38.1	Very low	26 Å²	26	80.6 Å²	80.6	14%	0.136	43%	0.43	C	S	.	.			trans	-83.7	101.1	172.5	-156.4	136.9	0	0	0	110.3	F43 L51 L104	F43-L118 HydrophobicContact CD1-CD1 4.48Å; F43-L118 HydrophobicContact CD1-CD2 4.16Å; F43-L118 HydrophobicContact CD1-CG 4.42Å; F43-L118 HydrophobicContact CE1-CD2 4.24Å; L51-L118 HydrophobicContact CD1-CD1 4.45Å; L104-L118 HydrophobicContact CB-CD1 4.39Å; L104-L118 HydrophobicContact CB-CD2 4.07Å; L104-L118 HydrophobicContact CD1-CD1 4.2Å; L104-L118 HydrophobicContact CD1-CD2 3.44Å; L104-L118 VanDerWaalsContact CD1-CD2 3.44Å; L104-L118 HydrophobicContact CD1-CG 4.47Å; L104-L118 HydrophobicContact CG-CD2 4.38Å
119	Y	35.8	Very low	37.5	Very low	155 Å²	155	86.3 Å²	86.3	61%	0.608	46%	0.459	S	S	*	.			trans	-110.1	117.2	-178.8	-169.8	-101.2	0	0	0	110.5	G117 H121	G117-Y119 PolarHBondContact O-N 2.93Å; Y119-H121 HydrophobicContact CD1-CB 4.19Å; Y119-H121 HydrophobicContact CE1-CB 4.29Å; Y119-H121 AromaticContact CE1-CD2 3.9Å; Y119-H121 PolarHBondContact O-N 2.75Å
120	V	40.9	Very low	37.1	Very low	12 Å²	12	84.2 Å²	84.2	7%	0.073	46%	0.461	C	S	.	.			trans	-81.3	104.5	169.4	178.3	0	0	0	0	108	F100 I101 V123	F100-V120 HydrophobicContact CD1-CG2 3.57Å; F100-V120 HydrophobicContact CE1-CG2 3.79Å; I101-V120 HydrophobicContact CD1-CB 4.09Å; I101-V120 HydrophobicContact CD1-CG2 4.14Å; I101-V120 HydrophobicContact CG1-CB 4.19Å; I101-V120 HydrophobicContact CG1-CG2 3.67Å; V120-V123 HydrophobicContact CG1-CG2 3.91Å
121	H	35.4	Very low	36.7	Very low	117 Å²	117	82.4 Å²	82.4	54%	0.542	47%	0.465	S	S	.	.			trans	-70.2	-33.8	-173	-169.6	-93.7	0	0	0	113.1	I42 Y119	I42-H121 HydrophobicContact CB-CB 4.4Å; Y119-H121 HydrophobicContact CD1-CB 4.19Å; Y119-H121 HydrophobicContact CE1-CB 4.29Å; Y119-H121 AromaticContact CE1-CD2 3.9Å; Y119-H121 PolarHBondContact O-N 2.75Å
122	S	34.3	Very low	35.9	Very low	29 Å²	29	91.8 Å²	91.8	20%	0.203	51%	0.513	C	S	.	.			trans	-166.8	147.4	176.3	52	0	0	0	0	110.8	W124	S122-W124 WeakPolarHBondContact OG-CZ3 3.41Å
123	V	39.2	Very low	35.6	Very low	25 Å²	25	89.1 Å²	89.1	15%	0.152	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	120.9	164.3	-179.9	0	0	0	0	105.4	F39 Y41 K97 V120	F39-V123 HydrophobicContact CD1-CG1 3.9Å; Y41-V123 HydrophobicContact CE1-CG2 4.42Å; K97-V123 HydrophobicContact CG-CG2 4.21Å; V120-V123 HydrophobicContact CG1-CG2 3.91Å
124	W	41.4	Very low	35.4	Very low	93 Å²	93	91.9 Å²	91.9	35%	0.352	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140.1	168	62.7	74.7	0	0	0	109	R40 I42 S122	R40-W124 HydrophobicContact CB-CD2 4.23Å; R40-W124 HydrophobicContact CB-CZ2 3.8Å; R40-W124 VanDerWaalsContact CD-NE1 3.33Å; R40-W124 HydrophobicContact CG-CZ2 4.22Å; R40-W124 VanDerWaalsContact CZ-CZ2 3.48Å; R40-W124 VanDerWaalsContact NE-CZ2 3.33Å; I42-W124 HydrophobicContact CD1-CH2 4.04Å; I42-W124 HydrophobicContact CD1-CZ3 3.98Å; S122-W124 WeakPolarHBondContact OG-CZ3 3.41Å
125	S	37.7	Very low	35.4	Very low	54 Å²	54	91.4 Å²	91.4	38%	0.378	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	116.2	167.3	64.7	0	0	0	0	107.8
126	Q	36.4	Very low	35.1	Very low	120 Å²	120	95.4 Å²	95.4	56%	0.561	52%	0.518	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	118.1	158.5	-87.4	171.6	-34.5	0	0	107	T38 T128	T38-Q126 PolarHBondContact N-O 3.24Å; T38-Q126 PolarHBondContact O-N 3.14Å; Q126-T128 PolarHBondContact O-N 2.87Å
127	S	35.1	Very low	35.2	Very low	77 Å²	77	95.3 Å²	95.3	54%	0.538	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	121.7	155	48.3	0	0	0	0	106.1	I129	S127-I129 PolarHBondContact O-N 3.11Å
128	T	34.3	Very low	35.3	Very low	104 Å²	104	99.3 Å²	99.3	64%	0.638	52%	0.518	S	S	*	.			trans	-59.7	95.7	161.3	34.3	0	0	0	0	107.1	G36 Q126 N130	G36-T128 PolarHBondContact O-OG1 3.11Å; Q126-T128 PolarHBondContact O-N 2.87Å; T128-N130 PolarHBondContact O-N 3.28Å
129	I	31.5	Very low	35.1	Very low	134 Å²	134	104.5 Å²	104.5	69%	0.687	55%	0.545	S	S	*	.			trans	-66.6	117	158.1	-68.3	168.4	0	0	0	103.9	S127 N131	S127-I129 PolarHBondContact O-N 3.11Å; I129-N131 PolarHBondContact O-N 3.5Å
130	N	30	Very low	35	Very low	157 Å²	157	100.6 Å²	100.6	84%	0.84	54%	0.541	S	S	*	.			trans	-48.3	109.8	161.8	-81.1	-18.4	0	0	0	107.4	T128	T128-N130 PolarHBondContact O-N 3.28Å
131	N	32.8	Very low	34.6	Very low	150 Å²	150	108 Å²	108	80%	0.802	58%	0.58	S	S	*	*			trans	-86.8	114.8	152.6	-87	-2.9	0	0	0	105.4	I129	I129-N131 PolarHBondContact O-N 3.5Å
132	D	26.7	Very low	34.5	Very low	236 Å²	236	107.2 Å²	107.2	100%	1.262	58%	0.583	S	S	*	*			trans	-40.5	0	141.2	-91.5	-29.6	0	0	0	111

Retrieved 132 of 132 residues in 134.2 ms (Link to these results)

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