A0A087Y7U5_POEFO Loading...

Dynein light chain Tctex-type 1

Acts as one of several non-catalytic accessory components of the cytoplasmic dynein 1 complex that are thought to be involved in linking dynein to cargos and to adapter proteins that regulate dynein function. Cytoplasmic dynein 1 acts as a motor for the intracellular retrograde motility of vesicles and organelles along microtubules. Probably binds BUB3 as part of transport cargo. Required for the efficient progression through mitosis.

AlphaFold DB , UniProt , Accession A0A087Y7U5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 117 aa.

						>A0A087Y7U5_POEFO|A0A087Y7U5
MLTGMEEYTSGDDGNFNTDETSVLVKECIEGVIGGTDYNHNKVNQWTANIVEHSLTHLVKQGRPFKYIVNCTIMQKSGAGLHTANSCYWDTTTDGSCTVRWENRTIYCVVSVFAVAM
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.1	Very low	40	Very low	245 Å²	245	147.6 Å²	147.6	100%	1.207	81%	0.809	S	S	*	*				0	121.3	0	-71.1	179.8	-178.8	0	0	106.4
2	L	33.5	Very low	40.7	Very low	176 Å²	176	149 Å²	149	92%	0.921	82%	0.815	S	S	*	*			trans	-62.8	135.4	-177.8	-82.6	103.9	0	0	0	110.4	G4	L2-G4 PolarHBondContact O-N 3.18Å
3	T	38.6	Very low	41.7	Very low	135 Å²	135	147 Å²	147	83%	0.828	80%	0.803	S	S	*	*			trans	-55.6	114.3	162.3	39.2	0	0	0	0	109	M5	T3-M5 PolarHBondContact O-N 2.86Å; T3-M5 VanDerWaalsContact O-N 3.12Å
4	G	36.5	Very low	43.2	Very low	74 Å²	74	138.6 Å²	138.6	76%	0.763	77%	0.767	S	S	*	*			trans	-66.9	106.4	167.4	0	0	0	0	0	108.2	L2 E6	L2-G4 PolarHBondContact O-N 3.18Å; G4-E6 PolarHBondContact O-N 2.84Å
5	M	47.3	Very low	45.7	Very low	179 Å²	179	135.9 Å²	135.9	88%	0.882	75%	0.751	S	S	*	*			trans	-65.3	107.7	161.4	-167.8	152.6	110.9	0	0	105.4	T3 E7	T3-M5 PolarHBondContact O-N 2.86Å; T3-M5 VanDerWaalsContact O-N 3.12Å; M5-E7 PolarHBondContact O-N 2.8Å
6	E	44.2	Very low	48.6	Very low	189 Å²	189	128.8 Å²	128.8	88%	0.883	71%	0.71	S	S	*	*			trans	-60.2	110.1	169.4	-73.2	178.5	122.9	0	0	106.5	G4 Y8	G4-E6 PolarHBondContact O-N 2.84Å; E6-Y8 PolarHBondContact O-N 2.65Å
7	E	35.8	Very low	51.3	Low	178 Å²	178	125.1 Å²	125.1	83%	0.832	69%	0.689	S	S	*	*			trans	-57.6	109.2	173.2	-73.9	179	119.9	0	0	107.3	M5 T9	M5-E7 PolarHBondContact O-N 2.8Å; E7-T9 VanDerWaalsContact C-N 3.26Å; E7-T9 PolarHBondContact O-N 2.75Å
8	Y	46.5	Very low	53.8	Low	184 Å²	184	121.6 Å²	121.6	72%	0.722	67%	0.672	S	S	*	*			trans	-62.4	98	162.4	-179.4	-97.4	0	0	0	105.9	E6 S10	E6-Y8 PolarHBondContact O-N 2.65Å; Y8-S10 VanDerWaalsContact C-N 3.32Å; Y8-S10 PolarHBondContact O-N 3.32Å
9	T	36.7	Very low	56	Low	123 Å²	123	121.9 Å²	121.9	76%	0.755	67%	0.673	S	S	*	*			trans	-58.7	102.3	166.6	36	0	0	0	0	106.7	E7 G11	E7-T9 VanDerWaalsContact C-N 3.26Å; E7-T9 PolarHBondContact O-N 2.75Å; T9-G11 PolarHBondContact O-N 3.06Å
10	S	43.1	Very low	58	Low	104 Å²	104	119.8 Å²	119.8	73%	0.727	66%	0.657	S	S	*	*			trans	-65.2	74.3	162.9	-50.2	0	0	0	0	107.5	Y8	Y8-S10 VanDerWaalsContact C-N 3.32Å; Y8-S10 PolarHBondContact O-N 3.32Å
11	G	40.5	Very low	59.9	Low	37 Å²	37	114.2 Å²	114.2	38%	0.381	63%	0.627	S	S	.	*			trans	-59.6	149.6	156.6	0	0	0	0	0	107.4	T9 D13	T9-G11 PolarHBondContact O-N 3.06Å; G11-D13 PolarHBondContact O-N 2.86Å
12	D	48.7	Very low	62.8	Low	164 Å²	164	104.6 Å²	104.6	88%	0.877	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	19.1	172	-168	42.8	0	0	0	113.5
13	D	53.5	Low	65.9	Low	123 Å²	123	100.2 Å²	100.2	66%	0.658	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-9.1	-168.8	-72.3	-47	0	0	0	114.1	G11 R63	G11-D13 PolarHBondContact O-N 2.86Å; D13-R63 PolarHBondContact O-NH1 2.85Å; D13-R63 VanDerWaalsContact O-NH1 3.08Å
14	G	62.9	Low	68.7	Low	29 Å²	29	94.7 Å²	94.7	30%	0.299	53%	0.53	S	S	.	.	S	Bend	trans	-87	-14.4	-172.9	0	0	0	0	0	116.1	F65	G14-F65 VanDerWaalsContact O-CZ 3.28Å; G14-F65 WeakPolarHBondContact O-CZ 3.11Å
15	N	81.2	Confident	71.7	Confident	99 Å²	99	91.2 Å²	91.2	53%	0.529	49%	0.493	S	S	.	.	S	Bend	trans	-96.2	145.4	-174.5	-88.1	48.7	0	0	0	112.6	N17 T92	N15-N17 PolarHBondContact O-N 2.9Å; N15-T92 PolarHBondContact ND2-O 2.86Å
16	F	92.3	Very high	74.1	Confident	22 Å²	22	87.4 Å²	87.4	10%	0.096	47%	0.472	C	S	.	.			trans	-64.9	113.9	175.4	174.5	-105.9	0	0	0	110.9	T18 T21 F65 S96 C97 V112 A114	F16-T18 PolarHBondContact O-N 3.3Å; F16-T21 HydrophobicContact CE2-CG2 3.99Å; F16-T21 VanDerWaalsContact CE2-OG1 3.25Å; F16-T21 WeakPolarHBondContact CE2-OG1 3.39Å; F16-T21 HydrophobicContact CZ-CG2 3.68Å; F16-T21 WeakPolarHBondContact CZ-OG1 3.2Å; F16-F65 HydrophobicContact CB-CE1 4.46Å; F16-F65 HydrophobicContact CB-CZ 4.12Å; F16-S96 VanDerWaalsContact CE1-C 3.49Å; F16-C97 HydrophobicContact CE1-CB 4Å; F16-C97 HydrophobicContact CZ-CB 3.9Å; F16-V112 HydrophobicContact CE2-CG1 4.42Å; F16-V112 HydrophobicContact CZ-CG1 4.35Å; F16-A114 HydrophobicContact CB-CB 4.13Å; F16-A114 HydrophobicContact CD2-CB 3.23Å; F16-A114 HydrophobicContact CE2-CB 3.69Å; F16-A114 HydrophobicContact CG-CB 3.74Å
17	N	94.3	Very high	76.7	Confident	65 Å²	65	84.4 Å²	84.4	35%	0.348	46%	0.458	S	S	.	.			trans	-81	103.6	177.6	-171.2	-28.8	0	0	0	110.6	N15 D19 E20 T21	N15-N17 PolarHBondContact O-N 2.9Å; N17-D19 PolarHBondContact OD1-N 3.26Å; N17-D19 VanDerWaalsContact OD1-N 3.14Å; N17-E20 HydrophobicContact CB-CB 4.02Å; N17-E20 PolarHBondContact OD1-N 2.86Å; N17-T21 WeakPolarHBondContact O-CB 3.36Å; N17-T21 PolarHBondContact O-N 3.06Å; N17-T21 VanDerWaalsContact O-N 3.14Å; N17-T21 PolarHBondContact O-OG1 2.92Å
18	T	94.9	Very high	79.7	Confident	62 Å²	62	76.4 Å²	76.4	38%	0.38	42%	0.421	S	S	.	.	H	α-helix	trans	-69.5	-37.5	-176.7	-60.8	0	0	0	0	112.4	F16 T21 S22 C97	F16-T18 PolarHBondContact O-N 3.3Å; T18-T21 PolarHBondContact O-N 3.26Å; T18-S22 VanDerWaalsContact O-CB 3.27Å; T18-S22 WeakPolarHBondContact O-CB 3.4Å; T18-S22 PolarHBondContact O-N 3.3Å; T18-C97 HydrophobicContact CG2-CB 4.02Å
19	D	96	Very high	82.2	Confident	129 Å²	129	67.6 Å²	67.6	69%	0.69	39%	0.387	S	S	*	.	H	α-helix	trans	-70.7	-47.1	-177.3	-69.4	-28.2	0	0	0	111.1	N17 T21 S22 V23	N17-D19 PolarHBondContact OD1-N 3.26Å; N17-D19 VanDerWaalsContact OD1-N 3.14Å; D19-T21 VanDerWaalsContact C-N 3.3Å; D19-T21 PolarHBondContact O-N 3.37Å; D19-S22 WeakPolarHBondContact O-CB 3.33Å; D19-S22 PolarHBondContact O-N 3.14Å; D19-V23 WeakPolarHBondContact O-CG2 3.26Å; D19-V23 PolarHBondContact O-N 2.94Å; D19-V23 VanDerWaalsContact O-N 3.1Å
20	E	96.1	Very high	85.2	Confident	78 Å²	78	66 Å²	66	36%	0.364	37%	0.371	S	S	.	.	H	α-helix	trans	-58.2	-45.9	174.5	-173	-171.1	163	0	0	110.6	N17 S22 V23 L24 Q61 R63	N17-E20 HydrophobicContact CB-CB 4.02Å; N17-E20 PolarHBondContact OD1-N 2.86Å; E20-S22 VanDerWaalsContact C-N 3.34Å; E20-S22 PolarHBondContact O-N 2.91Å; E20-V23 PolarHBondContact O-N 3.16Å; E20-L24 WeakPolarHBondContact O-CB 3.49Å; E20-L24 PolarHBondContact O-N 3.05Å; E20-Q61 PolarHBondContact OE1-NE2 2.8Å; E20-R63 IonicContact OE2-NH2 3.26Å; E20-R63 PolarHBondContact OE2-NH2 3.38Å
21	T	97.6	Very high	87.8	Confident	3 Å²	3	64.4 Å²	64.4	2%	0.018	37%	0.371	C	S	.	.	H	α-helix	trans	-64.6	-38.3	178.6	-58	0	0	0	0	112	F16 N17 T18 D19 L24 V25 L58 C97 V112	F16-T21 HydrophobicContact CE2-CG2 3.99Å; F16-T21 VanDerWaalsContact CE2-OG1 3.25Å; F16-T21 WeakPolarHBondContact CE2-OG1 3.39Å; F16-T21 HydrophobicContact CZ-CG2 3.68Å; F16-T21 WeakPolarHBondContact CZ-OG1 3.2Å; N17-T21 WeakPolarHBondContact O-CB 3.36Å; N17-T21 PolarHBondContact O-N 3.06Å; N17-T21 VanDerWaalsContact O-N 3.14Å; N17-T21 PolarHBondContact O-OG1 2.92Å; T18-T21 PolarHBondContact O-N 3.26Å; D19-T21 VanDerWaalsContact C-N 3.3Å; D19-T21 PolarHBondContact O-N 3.37Å; T21-L24 PolarHBondContact O-N 2.84Å; T21-V25 HydrophobicContact CG2-CG2 4.07Å; T21-V25 WeakPolarHBondContact O-CB 3.31Å; T21-V25 WeakPolarHBondContact O-CG2 3.29Å; T21-V25 PolarHBondContact O-N 3.16Å; T21-L58 HydrophobicContact CG2-CD2 3.97Å; T21-C97 HydrophobicContact CG2-CB 3.95Å; T21-V112 HydrophobicContact CG2-CB 4.16Å; T21-V112 HydrophobicContact CG2-CG1 4.13Å; T21-V112 HydrophobicContact CG2-CG2 4.14Å
22	S	98.3	Very high	90.6	Very high	44 Å²	44	63.7 Å²	63.7	31%	0.308	36%	0.359	S	S	.	.	H	α-helix	trans	-60.9	-46	177.7	-179.4	0	0	0	0	111.7	T18 D19 E20 K26 C97	T18-S22 VanDerWaalsContact O-CB 3.27Å; T18-S22 WeakPolarHBondContact O-CB 3.4Å; T18-S22 PolarHBondContact O-N 3.3Å; D19-S22 WeakPolarHBondContact O-CB 3.33Å; D19-S22 PolarHBondContact O-N 3.14Å; E20-S22 VanDerWaalsContact C-N 3.34Å; E20-S22 PolarHBondContact O-N 2.91Å; S22-K26 WeakPolarHBondContact O-CB 3.31Å; S22-K26 PolarHBondContact O-N 3.26Å; S22-C97 VanDerWaalsContact CA-SG 3.51Å; S22-C97 VanDerWaalsContact CB-SG 3.59Å
23	V	98.4	Very high	92.9	Very high	83 Å²	83	55.9 Å²	55.9	50%	0.503	32%	0.317	S	S	.	.	H	α-helix	trans	-62.7	-50.9	177.6	175.1	0	0	0	0	110.6	D19 E20 V25 K26 E27	D19-V23 WeakPolarHBondContact O-CG2 3.26Å; D19-V23 PolarHBondContact O-N 2.94Å; D19-V23 VanDerWaalsContact O-N 3.1Å; E20-V23 PolarHBondContact O-N 3.16Å; V23-V25 PolarHBondContact O-N 2.83Å; V23-K26 WeakPolarHBondContact O-CB 3.15Å; V23-K26 PolarHBondContact O-N 3.16Å; V23-K26 VanDerWaalsContact O-N 3.16Å; V23-E27 WeakPolarHBondContact O-CG 3.3Å; V23-E27 PolarHBondContact O-N 2.84Å
24	L	98.3	Very high	95.1	Very high	20 Å²	20	51.8 Å²	51.8	11%	0.105	30%	0.304	C	S	.	.	H	α-helix	trans	-56.2	-46.9	178.8	175	167	0	0	0	112.1	E20 T21 K26 E27 C28 H57	E20-L24 WeakPolarHBondContact O-CB 3.49Å; E20-L24 PolarHBondContact O-N 3.05Å; T21-L24 PolarHBondContact O-N 2.84Å; L24-K26 VanDerWaalsContact C-N 3.35Å; L24-E27 PolarHBondContact O-N 2.8Å; L24-C28 PolarHBondContact O-N 2.84Å; L24-C28 PolarHBondContact O-SG 2.77Å; L24-H57 HydrophobicContact CD1-CB 3.62Å; L24-H57 HydrophobicContact CD2-CB 3.88Å; L24-H57 HydrophobicContact CG-CB 3.86Å
25	V	98.8	Very high	96.7	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-66.3	-40	179.8	169.6	0	0	0	0	110.6	T21 V23 E27 C28 I29 V99 V110 V112	T21-V25 HydrophobicContact CG2-CG2 4.07Å; T21-V25 WeakPolarHBondContact O-CB 3.31Å; T21-V25 WeakPolarHBondContact O-CG2 3.29Å; T21-V25 PolarHBondContact O-N 3.16Å; V23-V25 PolarHBondContact O-N 2.83Å; V25-E27 PolarHBondContact O-N 3.4Å; V25-C28 WeakPolarHBondContact O-CB 3.44Å; V25-C28 PolarHBondContact O-N 2.78Å; V25-I29 HydrophobicContact CG1-CD1 4.01Å; V25-I29 HydrophobicContact CG1-CG1 4.49Å; V25-I29 VanDerWaalsContact O-CG1 3.29Å; V25-I29 WeakPolarHBondContact O-CG1 3.47Å; V25-I29 PolarHBondContact O-N 2.81Å; V25-V99 HydrophobicContact CB-CG2 3.87Å; V25-V99 HydrophobicContact CG1-CB 3.86Å; V25-V99 HydrophobicContact CG1-CG1 4.45Å; V25-V99 HydrophobicContact CG1-CG2 3.73Å; V25-V110 HydrophobicContact CG1-CB 3.67Å; V25-V110 HydrophobicContact CG1-CG1 3.6Å; V25-V110 HydrophobicContact CG1-CG2 4.3Å; V25-V112 HydrophobicContact CG2-CG2 3.56Å
26	K	98.7	Very high	97.4	Very high	100 Å²	100	51.9 Å²	51.9	44%	0.435	32%	0.319	S	S	.	.	H	α-helix	trans	-60.9	-43.7	175.7	-174	179.3	173.1	-173.2	0	111.6	S22 V23 L24 C28 I29 E30 V99	S22-K26 WeakPolarHBondContact O-CB 3.31Å; S22-K26 PolarHBondContact O-N 3.26Å; V23-K26 WeakPolarHBondContact O-CB 3.15Å; V23-K26 PolarHBondContact O-N 3.16Å; V23-K26 VanDerWaalsContact O-N 3.16Å; L24-K26 VanDerWaalsContact C-N 3.35Å; K26-C28 VanDerWaalsContact C-N 3.33Å; K26-C28 PolarHBondContact O-N 3.23Å; K26-I29 PolarHBondContact O-N 2.9Å; K26-E30 WeakPolarHBondContact CE-OE1 3.34Å; K26-E30 IonicContact NZ-OE1 3.97Å; K26-E30 WeakPolarHBondContact O-CG 3.42Å; K26-E30 PolarHBondContact O-N 3.45Å; K26-V99 HydrophobicContact CB-CG1 4.21Å
27	E	98.6	Very high	97.7	Very high	126 Å²	126	54.7 Å²	54.7	59%	0.589	34%	0.336	S	S	*	.	H	α-helix	trans	-61.4	-40.5	175.1	-70.7	178.2	167.3	0	0	111.9	V23 L24 V25 I29 E30 G31	V23-E27 WeakPolarHBondContact O-CG 3.3Å; V23-E27 PolarHBondContact O-N 2.84Å; L24-E27 PolarHBondContact O-N 2.8Å; V25-E27 PolarHBondContact O-N 3.4Å; E27-I29 PolarHBondContact O-N 3.48Å; E27-E30 PolarHBondContact O-N 3.05Å; E27-G31 PolarHBondContact O-N 2.82Å
28	C	98.8	Very high	97.9	Very high	9 Å²	9	54.1 Å²	54.1	6%	0.061	33%	0.329	C	S	.	.	H	α-helix	trans	-61.9	-42.3	174.8	-67.9	0	0	0	0	112	L24 V25 K26 V32 H53	L24-C28 PolarHBondContact O-N 2.84Å; L24-C28 PolarHBondContact O-SG 2.77Å; V25-C28 WeakPolarHBondContact O-CB 3.44Å; V25-C28 PolarHBondContact O-N 2.78Å; K26-C28 VanDerWaalsContact C-N 3.33Å; K26-C28 PolarHBondContact O-N 3.23Å; C28-V32 WeakPolarHBondContact O-CG2 3.33Å; C28-V32 PolarHBondContact O-N 3.05Å; C28-H53 HydrophobicContact CB-CB 4.21Å
29	I	98.8	Very high	98.1	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-64	-50.6	176.2	-62.9	163	0	0	0	110.2	V25 K26 E27 G31 V32 I33 I50 V99 W101 C108 V110	V25-I29 HydrophobicContact CG1-CD1 4.01Å; V25-I29 HydrophobicContact CG1-CG1 4.49Å; V25-I29 VanDerWaalsContact O-CG1 3.29Å; V25-I29 WeakPolarHBondContact O-CG1 3.47Å; V25-I29 PolarHBondContact O-N 2.81Å; K26-I29 PolarHBondContact O-N 2.9Å; E27-I29 PolarHBondContact O-N 3.48Å; I29-G31 VanDerWaalsContact C-N 3.32Å; I29-G31 PolarHBondContact O-N 2.87Å; I29-V32 PolarHBondContact O-N 3.34Å; I29-V32 VanDerWaalsContact O-N 3.14Å; I29-I33 HydrophobicContact CG2-CD1 3.8Å; I29-I33 HydrophobicContact CG2-CG1 3.74Å; I29-I33 VanDerWaalsContact O-CG1 3.3Å; I29-I33 WeakPolarHBondContact O-CG1 3.49Å; I29-I33 PolarHBondContact O-N 2.89Å; I29-I50 HydrophobicContact CG1-CD1 4.48Å; I29-I50 HydrophobicContact CG1-CG2 4.05Å; I29-V99 HydrophobicContact CD1-CB 4.37Å; I29-V99 HydrophobicContact CD1-CG1 3.89Å; I29-W101 HydrophobicContact CD1-CB 4.09Å; I29-W101 HydrophobicContact CG2-CB 3.86Å; I29-W101 HydrophobicContact CG2-CD2 3.63Å; I29-W101 HydrophobicContact CG2-CE3 3.92Å; I29-W101 HydrophobicContact CG2-CG 3.59Å; I29-C108 HydrophobicContact CG2-CB 4.3Å; I29-V110 HydrophobicContact CD1-CB 4.22Å; I29-V110 HydrophobicContact CD1-CG2 3.64Å; I29-V110 HydrophobicContact CG1-CG2 3.84Å
30	E	98.6	Very high	98.2	Very high	89 Å²	89	54.7 Å²	54.7	42%	0.416	33%	0.325	S	S	.	.	H	α-helix	trans	-62.1	-38.7	-178.4	-73.6	-179.8	176.6	0	0	112.2	K26 E27 V32 G34	K26-E30 WeakPolarHBondContact CE-OE1 3.34Å; K26-E30 IonicContact NZ-OE1 3.97Å; K26-E30 WeakPolarHBondContact O-CG 3.42Å; K26-E30 PolarHBondContact O-N 3.45Å; E27-E30 PolarHBondContact O-N 3.05Å; E30-V32 VanDerWaalsContact C-N 3.26Å; E30-V32 PolarHBondContact O-N 2.58Å; E30-G34 WeakPolarHBondContact O-CA 3.44Å; E30-G34 PolarHBondContact O-N 2.88Å
31	G	98.5	Very high	98.3	Very high	71 Å²	71	57.7 Å²	57.7	73%	0.732	34%	0.344	S	S	*	.	H	α-helix	trans	-65.4	-24.9	176.4	0	0	0	0	0	114.4	E27 I29	E27-G31 PolarHBondContact O-N 2.82Å; I29-G31 VanDerWaalsContact C-N 3.32Å; I29-G31 PolarHBondContact O-N 2.87Å
32	V	98.7	Very high	98.3	Very high	22 Å²	22	61.9 Å²	61.9	13%	0.133	36%	0.361	C	S	.	.	H	α-helix	trans	-98.7	-43.3	-178.3	-179.4	0	0	0	0	112.4	C28 I29 E30 W46 N49 I50	C28-V32 WeakPolarHBondContact O-CG2 3.33Å; C28-V32 PolarHBondContact O-N 3.05Å; I29-V32 PolarHBondContact O-N 3.34Å; I29-V32 VanDerWaalsContact O-N 3.14Å; E30-V32 VanDerWaalsContact C-N 3.26Å; E30-V32 PolarHBondContact O-N 2.58Å; V32-W46 HydrophobicContact CG1-CB 4Å; V32-W46 HydrophobicContact CG1-CG 4.14Å; V32-N49 HydrophobicContact CG1-CB 4.1Å; V32-N49 HydrophobicContact CG2-CB 4.06Å; V32-I50 HydrophobicContact CB-CD1 4.33Å; V32-I50 HydrophobicContact CB-CG1 3.78Å; V32-I50 HydrophobicContact CG1-CD1 4.4Å; V32-I50 HydrophobicContact CG1-CG1 4.02Å; V32-I50 HydrophobicContact CG2-CG1 3.9Å
33	I	98.6	Very high	98.3	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-126.4	3.3	-172.9	61.9	172.6	0	0	0	114.6	I29 G35 T36 W46 I50 I73 W101 I106 C108	I29-I33 HydrophobicContact CG2-CD1 3.8Å; I29-I33 HydrophobicContact CG2-CG1 3.74Å; I29-I33 VanDerWaalsContact O-CG1 3.3Å; I29-I33 WeakPolarHBondContact O-CG1 3.49Å; I29-I33 PolarHBondContact O-N 2.89Å; I33-G35 VanDerWaalsContact C-N 3.32Å; I33-G35 PolarHBondContact O-N 3.1Å; I33-T36 WeakPolarHBondContact CA-OG1 3.27Å; I33-T36 PolarHBondContact O-N 3.34Å; I33-T36 PolarHBondContact O-OG1 2.92Å; I33-W46 HydrophobicContact CG2-CB 3.8Å; I33-W46 HydrophobicContact CG2-CD2 3.66Å; I33-W46 HydrophobicContact CG2-CE3 4.02Å; I33-W46 HydrophobicContact CG2-CG 3.58Å; I33-I50 HydrophobicContact CD1-CD1 4.22Å; I33-I50 HydrophobicContact CG1-CD1 4.38Å; I33-I73 HydrophobicContact CD1-CD1 4.48Å; I33-W101 HydrophobicContact CD1-CE3 3.75Å; I33-W101 HydrophobicContact CD1-CH2 4.18Å; I33-W101 HydrophobicContact CD1-CZ3 3.46Å; I33-W101 VanDerWaalsContact CD1-CZ3 3.46Å; I33-W101 HydrophobicContact CG1-CE3 4.23Å; I33-W101 HydrophobicContact CG1-CH2 3.96Å; I33-W101 HydrophobicContact CG1-CZ3 3.75Å; I33-W101 WeakPolarHBondContact O-CH2 3.49Å; I33-I106 HydrophobicContact CD1-CG2 4.16Å; I33-C108 HydrophobicContact CD1-CB 3.83Å
34	G	98.1	Very high	98.3	Very high	36 Å²	36	63.3 Å²	63.3	37%	0.371	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-38.9	-174.3	0	0	0	0	0	114.6	E30	E30-G34 WeakPolarHBondContact O-CA 3.44Å; E30-G34 PolarHBondContact O-N 2.88Å
35	G	96.6	Very high	98.4	Very high	86 Å²	86	66.8 Å²	66.8	89%	0.887	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	13.7	-179.8	0	0	0	0	0	114.9	I33	I33-G35 VanDerWaalsContact C-N 3.32Å; I33-G35 PolarHBondContact O-N 3.1Å
36	T	97.1	Very high	98.4	Very high	44 Å²	44	68 Å²	68	27%	0.27	38%	0.384	S	S	.	.			trans	-112.7	146.1	-172.2	68.2	0	0	0	0	112.3	I33 N103	I33-T36 WeakPolarHBondContact CA-OG1 3.27Å; I33-T36 PolarHBondContact O-N 3.34Å; I33-T36 PolarHBondContact O-OG1 2.92Å; T36-N103 PolarHBondContact O-ND2 2.84Å
37	D	98.3	Very high	98.4	Very high	82 Å²	82	64.8 Å²	64.8	44%	0.439	37%	0.373	S	S	.	.			trans	-88.4	153.5	164.8	-81.8	-43	0	0	0	110.4	N39 W46 R104 T105	D37-N39 PolarHBondContact O-N 2.85Å; D37-W46 WeakPolarHBondContact O-CH2 3.34Å; D37-R104 IonicContact OD1-CZ 2.86Å; D37-R104 IonicContact OD1-NE 3.4Å; D37-R104 IonicContact OD1-NH2 3.95Å; D37-R104 PolarHBondContact OD1-NH2 3.49Å; D37-R104 IonicContact OD2-NH2 2.65Å; D37-R104 PolarHBondContact OD2-NH2 3.22Å; D37-T105 VanDerWaalsContact CA-OG1 3.31Å; D37-T105 WeakPolarHBondContact CA-OG1 3.48Å; D37-T105 HydrophobicContact CB-CG2 4.47Å; D37-T105 VanDerWaalsContact OD1-CG2 3.3Å; D37-T105 WeakPolarHBondContact OD1-CG2 3.44Å; D37-T105 PolarHBondContact OD1-OG1 3.49Å; D37-T105 VanDerWaalsContact OD1-OG1 3.06Å
38	Y	98.5	Very high	98.4	Very high	53 Å²	53	61.4 Å²	61.4	21%	0.208	37%	0.366	C	S	.	.			trans	-52.8	129.2	-179.6	-178.2	-90.4	0	0	0	112	H40 V43 I73 Q75 T105 I106	Y38-H40 HydrophobicContact CE1-CB 4.06Å; Y38-V43 HydrophobicContact CD2-CG2 4.36Å; Y38-V43 HydrophobicContact CE2-CG2 3.56Å; Y38-I73 HydrophobicContact CE2-CG2 4.49Å; Y38-Q75 HydrophobicContact CD1-CB 3.9Å; Y38-Q75 HydrophobicContact CD1-CG 3.62Å; Y38-Q75 HydrophobicContact CD2-CB 3.78Å; Y38-Q75 HydrophobicContact CD2-CG 4.17Å; Y38-Q75 HydrophobicContact CE1-CB 3.79Å; Y38-Q75 HydrophobicContact CE1-CG 3.92Å; Y38-Q75 HydrophobicContact CE2-CB 3.68Å; Y38-Q75 HydrophobicContact CE2-CG 4.45Å; Y38-Q75 HydrophobicContact CG-CB 3.9Å; Y38-Q75 HydrophobicContact CG-CG 3.76Å; Y38-T105 PolarHBondContact N-OG1 3.3Å; Y38-I106 HydrophobicContact CD2-CG1 4.11Å; Y38-I106 HydrophobicContact CG-CG1 4.43Å
39	N	98.3	Very high	98.4	Very high	69 Å²	69	63.2 Å²	63.2	37%	0.369	38%	0.375	S	S	.	.			trans	-139.4	111.6	173.3	-177.6	-25.1	0	0	0	109.1	D37 N41 K42 V43 W46	D37-N39 PolarHBondContact O-N 2.85Å; N39-N41 PolarHBondContact O-N 2.99Å; N39-N41 VanDerWaalsContact O-N 3.16Å; N39-N41 WeakPolarHBondContact OD1-CB 3.25Å; N39-N41 PolarHBondContact OD1-N 3.16Å; N39-K42 HydrophobicContact CB-CB 4.26Å; N39-K42 HydrophobicContact CB-CG 4.21Å; N39-K42 PolarHBondContact O-N 2.88Å; N39-V43 PolarHBondContact O-N 2.81Å; N39-W46 HydrophobicContact CB-CH2 3.75Å; N39-W46 HydrophobicContact CB-CZ2 4.4Å; N39-W46 HydrophobicContact CB-CZ3 4.47Å
40	H	98.1	Very high	98.4	Very high	134 Å²	134	63.2 Å²	63.2	62%	0.62	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-51.3	-41.5	-177.5	-177.8	76.4	0	0	0	113.1	Y38 K42 V43	Y38-H40 HydrophobicContact CE1-CB 4.06Å; H40-K42 PolarHBondContact O-N 2.77Å; H40-K42 VanDerWaalsContact O-N 3.14Å; H40-V43 PolarHBondContact O-N 2.81Å
41	N	98.5	Very high	98.4	Very high	141 Å²	141	60.7 Å²	60.7	75%	0.754	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-68.7	-14.8	-177.2	-62	-29.8	0	0	0	113.3	N39	N39-N41 PolarHBondContact O-N 2.99Å; N39-N41 VanDerWaalsContact O-N 3.16Å; N39-N41 WeakPolarHBondContact OD1-CB 3.25Å; N39-N41 PolarHBondContact OD1-N 3.16Å
42	K	98.4	Very high	98.4	Very high	90 Å²	90	63 Å²	63	39%	0.391	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-103.8	-13.5	-178.7	-67	-67.1	-170.8	177.3	0	113.5	N39 H40 N44 Q45 W46	N39-K42 HydrophobicContact CB-CB 4.26Å; N39-K42 HydrophobicContact CB-CG 4.21Å; N39-K42 PolarHBondContact O-N 2.88Å; H40-K42 PolarHBondContact O-N 2.77Å; H40-K42 VanDerWaalsContact O-N 3.14Å; K42-N44 VanDerWaalsContact C-N 3.33Å; K42-N44 PolarHBondContact O-N 2.97Å; K42-Q45 WeakPolarHBondContact O-CB 3.42Å; K42-Q45 PolarHBondContact O-N 2.95Å; K42-W46 HydrophobicContact CB-CD2 3.77Å; K42-W46 HydrophobicContact CB-CE3 4.11Å; K42-W46 HydrophobicContact CB-CG 4.47Å; K42-W46 HydrophobicContact CB-CH2 3.79Å; K42-W46 HydrophobicContact CB-CZ2 3.41Å; K42-W46 VanDerWaalsContact CB-CZ2 3.41Å; K42-W46 HydrophobicContact CB-CZ3 4.11Å; K42-W46 HydrophobicContact CG-CZ2 4.03Å; K42-W46 PolarHBondContact O-N 2.9Å
43	V	98.5	Very high	98.4	Very high	18 Å²	18	65.8 Å²	65.8	11%	0.109	37%	0.369	C	S	.	.	H	α-helix	trans	-56.2	-44.3	-173.4	173.9	0	0	0	0	112.6	Y38 N39 H40 Q45 W46 T47 I73	Y38-V43 HydrophobicContact CD2-CG2 4.36Å; Y38-V43 HydrophobicContact CE2-CG2 3.56Å; N39-V43 PolarHBondContact O-N 2.81Å; H40-V43 PolarHBondContact O-N 2.81Å; V43-Q45 VanDerWaalsContact C-N 3.34Å; V43-Q45 PolarHBondContact O-N 3.23Å; V43-W46 HydrophobicContact CG2-CE3 4.27Å; V43-W46 HydrophobicContact CG2-CZ3 4.32Å; V43-W46 PolarHBondContact O-N 3.4Å; V43-T47 WeakPolarHBondContact O-CB 3.3Å; V43-T47 PolarHBondContact O-N 3.22Å; V43-T47 PolarHBondContact O-OG1 3.46Å; V43-I73 HydrophobicContact CG1-CB 4.06Å; V43-I73 HydrophobicContact CG1-CG2 4.16Å; V43-I73 HydrophobicContact CG2-CG2 4.39Å
44	N	98.4	Very high	98.4	Very high	139 Å²	139	65.8 Å²	65.8	74%	0.743	37%	0.369	S	S	*	.	H	α-helix	trans	-63.1	-41.4	179	-69.1	-16.1	0	0	0	111.8	K42 A48	K42-N44 VanDerWaalsContact C-N 3.33Å; K42-N44 PolarHBondContact O-N 2.97Å; N44-A48 WeakPolarHBondContact O-CB 3.43Å; N44-A48 PolarHBondContact O-N 2.89Å
45	Q	98.7	Very high	98.4	Very high	94 Å²	94	66.7 Å²	66.7	44%	0.439	37%	0.365	S	S	.	.	H	α-helix	trans	-65.2	-46.2	176.7	-176.3	-177.3	9.6	0	0	111.1	K42 V43 T47 A48 N49	K42-Q45 WeakPolarHBondContact O-CB 3.42Å; K42-Q45 PolarHBondContact O-N 2.95Å; V43-Q45 VanDerWaalsContact C-N 3.34Å; V43-Q45 PolarHBondContact O-N 3.23Å; Q45-T47 PolarHBondContact O-N 3.48Å; Q45-A48 PolarHBondContact O-N 3.39Å; Q45-N49 WeakPolarHBondContact O-CB 3.37Å; Q45-N49 PolarHBondContact O-N 2.86Å; Q45-N49 PolarHBondContact O-OD1 2.88Å
46	W	98.8	Very high	98.5	Very high	24 Å²	24	65.3 Å²	65.3	9%	0.091	34%	0.34	C	S	.	.	H	α-helix	trans	-62.3	-43.6	178.6	-63.9	-31.2	0	0	0	112.3	V32 I33 D37 N39 K42 V43 N49 I50 I73 I106	V32-W46 HydrophobicContact CG1-CB 4Å; V32-W46 HydrophobicContact CG1-CG 4.14Å; I33-W46 HydrophobicContact CG2-CB 3.8Å; I33-W46 HydrophobicContact CG2-CD2 3.66Å; I33-W46 HydrophobicContact CG2-CE3 4.02Å; I33-W46 HydrophobicContact CG2-CG 3.58Å; D37-W46 WeakPolarHBondContact O-CH2 3.34Å; N39-W46 HydrophobicContact CB-CH2 3.75Å; N39-W46 HydrophobicContact CB-CZ2 4.4Å; N39-W46 HydrophobicContact CB-CZ3 4.47Å; K42-W46 HydrophobicContact CB-CD2 3.77Å; K42-W46 HydrophobicContact CB-CE3 4.11Å; K42-W46 HydrophobicContact CB-CG 4.47Å; K42-W46 HydrophobicContact CB-CH2 3.79Å; K42-W46 HydrophobicContact CB-CZ2 3.41Å; K42-W46 VanDerWaalsContact CB-CZ2 3.41Å; K42-W46 HydrophobicContact CB-CZ3 4.11Å; K42-W46 HydrophobicContact CG-CZ2 4.03Å; K42-W46 PolarHBondContact O-N 2.9Å; V43-W46 HydrophobicContact CG2-CE3 4.27Å; V43-W46 HydrophobicContact CG2-CZ3 4.32Å; V43-W46 PolarHBondContact O-N 3.4Å; W46-N49 PolarHBondContact O-N 3.32Å; W46-I50 WeakPolarHBondContact O-CB 3.42Å; W46-I50 VanDerWaalsContact O-CG1 3.26Å; W46-I50 WeakPolarHBondContact O-CG1 3.42Å; W46-I50 PolarHBondContact O-N 2.69Å; W46-I73 HydrophobicContact CB-CD1 3.79Å; W46-I106 HydrophobicContact CZ3-CD1 4.4Å
47	T	98.7	Very high	98.5	Very high	34 Å²	34	67.6 Å²	67.6	21%	0.209	35%	0.347	C	S	.	.	H	α-helix	trans	-60.7	-47.8	178	-55.7	0	0	0	0	110.7	V43 Q45 I50 V51 C71	V43-T47 WeakPolarHBondContact O-CB 3.3Å; V43-T47 PolarHBondContact O-N 3.22Å; V43-T47 PolarHBondContact O-OG1 3.46Å; Q45-T47 PolarHBondContact O-N 3.48Å; T47-I50 PolarHBondContact O-N 3.41Å; T47-V51 WeakPolarHBondContact O-CG2 3.36Å; T47-V51 PolarHBondContact O-N 3.12Å; T47-V51 VanDerWaalsContact O-N 3.12Å; T47-C71 HydrophobicContact CG2-CB 3.9Å
48	A	98.8	Very high	98.5	Very high	54 Å²	54	63.8 Å²	63.8	45%	0.446	33%	0.326	S	S	.	.	H	α-helix	trans	-60.2	-47.9	177.1	0	0	0	0	0	111.8	N44 Q45 I50 V51 E52	N44-A48 WeakPolarHBondContact O-CB 3.43Å; N44-A48 PolarHBondContact O-N 2.89Å; Q45-A48 PolarHBondContact O-N 3.39Å; A48-I50 PolarHBondContact O-N 2.92Å; A48-V51 PolarHBondContact O-N 3.49Å; A48-E52 WeakPolarHBondContact O-CB 3.33Å; A48-E52 PolarHBondContact O-N 3.47Å
49	N	98.8	Very high	98.4	Very high	48 Å²	48	65.9 Å²	65.9	26%	0.257	35%	0.345	S	S	.	.	H	α-helix	trans	-62.6	-43.2	-179.5	-70.3	6.7	0	0	0	112.4	V32 Q45 W46 V51 E52 H53	V32-N49 HydrophobicContact CG1-CB 4.1Å; V32-N49 HydrophobicContact CG2-CB 4.06Å; Q45-N49 WeakPolarHBondContact O-CB 3.37Å; Q45-N49 PolarHBondContact O-N 2.86Å; Q45-N49 PolarHBondContact O-OD1 2.88Å; W46-N49 PolarHBondContact O-N 3.32Å; N49-V51 VanDerWaalsContact C-N 3.35Å; N49-V51 PolarHBondContact O-N 3.03Å; N49-E52 PolarHBondContact O-N 3.36Å; N49-H53 VanDerWaalsContact O-CB 3.3Å; N49-H53 WeakPolarHBondContact O-CB 3.23Å; N49-H53 PolarHBondContact O-CD2 3.14Å; N49-H53 PolarHBondContact O-N 2.91Å
50	I	98.9	Very high	98.3	Very high	0 Å²	0	70 Å²	70	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-62.5	-44.3	178.6	-70.4	167.5	0	0	0	110.5	I29 V32 I33 W46 T47 A48 S54 C71 I73 V110	I29-I50 HydrophobicContact CG1-CD1 4.48Å; I29-I50 HydrophobicContact CG1-CG2 4.05Å; V32-I50 HydrophobicContact CB-CD1 4.33Å; V32-I50 HydrophobicContact CB-CG1 3.78Å; V32-I50 HydrophobicContact CG1-CD1 4.4Å; V32-I50 HydrophobicContact CG1-CG1 4.02Å; V32-I50 HydrophobicContact CG2-CG1 3.9Å; I33-I50 HydrophobicContact CD1-CD1 4.22Å; I33-I50 HydrophobicContact CG1-CD1 4.38Å; W46-I50 WeakPolarHBondContact O-CB 3.42Å; W46-I50 VanDerWaalsContact O-CG1 3.26Å; W46-I50 WeakPolarHBondContact O-CG1 3.42Å; W46-I50 PolarHBondContact O-N 2.69Å; T47-I50 PolarHBondContact O-N 3.41Å; A48-I50 PolarHBondContact O-N 2.92Å; I50-S54 VanDerWaalsContact O-CB 3.3Å; I50-S54 WeakPolarHBondContact O-CB 3.49Å; I50-S54 PolarHBondContact O-N 3.31Å; I50-S54 PolarHBondContact O-OG 3.36Å; I50-C71 HydrophobicContact CG2-CB 4.47Å; I50-I73 HydrophobicContact CD1-CD1 4.19Å; I50-V110 HydrophobicContact CG2-CG2 3.76Å
51	V	98.8	Very high	98.1	Very high	35 Å²	35	66.2 Å²	66.2	21%	0.212	34%	0.342	C	S	.	.	H	α-helix	trans	-63.2	-48.4	177.2	168.2	0	0	0	0	110.8	T47 A48 N49 S54 L55 V69 C71	T47-V51 WeakPolarHBondContact O-CG2 3.36Å; T47-V51 PolarHBondContact O-N 3.12Å; T47-V51 VanDerWaalsContact O-N 3.12Å; A48-V51 PolarHBondContact O-N 3.49Å; N49-V51 VanDerWaalsContact C-N 3.35Å; N49-V51 PolarHBondContact O-N 3.03Å; V51-S54 PolarHBondContact O-N 2.93Å; V51-L55 HydrophobicContact CG1-CD1 3.79Å; V51-L55 HydrophobicContact CG1-CG 4.49Å; V51-L55 WeakPolarHBondContact O-CB 3.25Å; V51-L55 WeakPolarHBondContact O-CG 3.46Å; V51-L55 PolarHBondContact O-N 3.46Å; V51-V69 HydrophobicContact CG1-CB 4.34Å; V51-V69 HydrophobicContact CG2-CG1 4.18Å; V51-C71 HydrophobicContact CG2-CB 3.67Å
52	E	98.6	Very high	97.9	Very high	120 Å²	120	62.7 Å²	62.7	56%	0.561	34%	0.339	S	S	*	.	H	α-helix	trans	-64.1	-45.6	-178.4	-175.8	175.3	-174.6	0	0	112.2	A48 N49 T56	A48-E52 WeakPolarHBondContact O-CB 3.33Å; A48-E52 PolarHBondContact O-N 3.47Å; N49-E52 PolarHBondContact O-N 3.36Å; E52-T56 VanDerWaalsContact O-CB 3.23Å; E52-T56 WeakPolarHBondContact O-CB 3.42Å; E52-T56 PolarHBondContact O-N 3.21Å; E52-T56 PolarHBondContact O-OG1 2.87Å
53	H	98.7	Very high	97.7	Very high	81 Å²	81	61.4 Å²	61.4	38%	0.375	33%	0.331	S	S	.	.	H	α-helix	trans	-60.7	-50	176.1	-68.2	-178.3	0	0	0	110.5	C28 N49 L55 T56 H57	C28-H53 HydrophobicContact CB-CB 4.21Å; N49-H53 VanDerWaalsContact O-CB 3.3Å; N49-H53 WeakPolarHBondContact O-CB 3.23Å; N49-H53 PolarHBondContact O-CD2 3.14Å; N49-H53 PolarHBondContact O-N 2.91Å; H53-L55 PolarHBondContact O-N 2.95Å; H53-T56 PolarHBondContact O-N 3.42Å; H53-H57 PolarHBondContact O-CD2 3.21Å; H53-H57 PolarHBondContact O-N 3.41Å
54	S	98.7	Very high	97.5	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-58.2	-49.6	-179.9	-56.2	0	0	0	0	111.5	I50 V51 T56 H57 L58	I50-S54 VanDerWaalsContact O-CB 3.3Å; I50-S54 WeakPolarHBondContact O-CB 3.49Å; I50-S54 PolarHBondContact O-N 3.31Å; I50-S54 PolarHBondContact O-OG 3.36Å; V51-S54 PolarHBondContact O-N 2.93Å; S54-T56 VanDerWaalsContact C-N 3.34Å; S54-T56 PolarHBondContact O-N 3.1Å; S54-H57 PolarHBondContact O-N 3.34Å; S54-L58 WeakPolarHBondContact O-CB 3.46Å; S54-L58 WeakPolarHBondContact O-CD1 3.49Å; S54-L58 VanDerWaalsContact O-CG 3.25Å; S54-L58 WeakPolarHBondContact O-CG 3.44Å; S54-L58 PolarHBondContact O-N 2.87Å
55	L	98.6	Very high	97.4	Very high	54 Å²	54	57.9 Å²	57.9	28%	0.283	32%	0.316	S	S	.	.	H	α-helix	trans	-61.1	-42.8	177.5	-79.1	171	0	0	0	112	V51 H53 H57 L58 V59 V69	V51-L55 HydrophobicContact CG1-CD1 3.79Å; V51-L55 HydrophobicContact CG1-CG 4.49Å; V51-L55 WeakPolarHBondContact O-CB 3.25Å; V51-L55 WeakPolarHBondContact O-CG 3.46Å; V51-L55 PolarHBondContact O-N 3.46Å; H53-L55 PolarHBondContact O-N 2.95Å; L55-H57 VanDerWaalsContact C-N 3.33Å; L55-H57 PolarHBondContact O-N 2.93Å; L55-L58 PolarHBondContact O-N 3Å; L55-V59 WeakPolarHBondContact O-CB 3.08Å; L55-V59 VanDerWaalsContact O-CG2 3.3Å; L55-V59 WeakPolarHBondContact O-CG2 3.43Å; L55-V59 PolarHBondContact O-N 3.14Å; L55-V69 HydrophobicContact CD2-CB 4.45Å; L55-V69 HydrophobicContact CD2-CG2 3.65Å; L55-V69 HydrophobicContact CG-CB 4.25Å; L55-V69 HydrophobicContact CG-CG2 3.73Å
56	T	98.4	Very high	97.3	Very high	58 Å²	58	60 Å²	60	36%	0.356	32%	0.323	S	S	.	.	H	α-helix	trans	-60	-44.7	179.2	-64.2	0	0	0	0	111.3	E52 H53 S54 K60	E52-T56 VanDerWaalsContact O-CB 3.23Å; E52-T56 WeakPolarHBondContact O-CB 3.42Å; E52-T56 PolarHBondContact O-N 3.21Å; E52-T56 PolarHBondContact O-OG1 2.87Å; H53-T56 PolarHBondContact O-N 3.42Å; S54-T56 VanDerWaalsContact C-N 3.34Å; S54-T56 PolarHBondContact O-N 3.1Å; T56-K60 HydrophobicContact CG2-CD 4.09Å; T56-K60 WeakPolarHBondContact O-CB 3.27Å; T56-K60 WeakPolarHBondContact O-CD 3.04Å; T56-K60 WeakPolarHBondContact O-CG 3.34Å; T56-K60 PolarHBondContact O-N 2.93Å; T56-K60 VanDerWaalsContact O-N 3.14Å
57	H	97.8	Very high	97.3	Very high	92 Å²	92	60.4 Å²	60.4	43%	0.426	33%	0.325	S	S	.	.	H	α-helix	trans	-67.9	-43.9	177.9	-77.5	-82.8	0	0	0	112.2	L24 H53 S54 L55 K60 Q61	L24-H57 HydrophobicContact CD1-CB 3.62Å; L24-H57 HydrophobicContact CD2-CB 3.88Å; L24-H57 HydrophobicContact CG-CB 3.86Å; H53-H57 PolarHBondContact O-CD2 3.21Å; H53-H57 PolarHBondContact O-N 3.41Å; S54-H57 PolarHBondContact O-N 3.34Å; L55-H57 VanDerWaalsContact C-N 3.33Å; L55-H57 PolarHBondContact O-N 2.93Å; H57-K60 PolarHBondContact O-N 3.46Å; H57-Q61 PolarHBondContact O-N 3.25Å
58	L	97.3	Very high	97.3	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-62.2	-44.1	178.5	-71.4	166.5	0	0	0	112.6	T21 S54 L55 K60 Q61 Y67 V69 V112	T21-L58 HydrophobicContact CG2-CD2 3.97Å; S54-L58 WeakPolarHBondContact O-CB 3.46Å; S54-L58 WeakPolarHBondContact O-CD1 3.49Å; S54-L58 VanDerWaalsContact O-CG 3.25Å; S54-L58 WeakPolarHBondContact O-CG 3.44Å; S54-L58 PolarHBondContact O-N 2.87Å; L55-L58 PolarHBondContact O-N 3Å; L58-K60 VanDerWaalsContact C-N 3.34Å; L58-K60 PolarHBondContact O-N 2.78Å; L58-Q61 WeakPolarHBondContact O-CB 3.48Å; L58-Q61 PolarHBondContact O-N 3.14Å; L58-Y67 HydrophobicContact CB-CD1 4.22Å; L58-Y67 HydrophobicContact CB-CD2 3.92Å; L58-Y67 HydrophobicContact CB-CE1 4.2Å; L58-Y67 HydrophobicContact CB-CE2 3.88Å; L58-Y67 HydrophobicContact CB-CG 4.06Å; L58-Y67 HydrophobicContact CD1-CD1 4.15Å; L58-Y67 HydrophobicContact CD1-CG 4.32Å; L58-Y67 HydrophobicContact CD2-CD1 4.44Å; L58-Y67 HydrophobicContact CD2-CE1 4.1Å; L58-Y67 WeakPolarHBondContact O-CE2 3.44Å; L58-V69 HydrophobicContact CD1-CG2 4.14Å; L58-V112 HydrophobicContact CD1-CG1 3.61Å; L58-V112 HydrophobicContact CD1-CG2 4.35Å
59	V	96.4	Very high	97.3	Very high	98 Å²	98	61.8 Å²	61.8	59%	0.594	32%	0.323	S	S	*	.	H	α-helix	trans	-67.6	-35.8	178.4	171.7	0	0	0	0	111.3	L55 Q61 G62 Y67	L55-V59 WeakPolarHBondContact O-CB 3.08Å; L55-V59 VanDerWaalsContact O-CG2 3.3Å; L55-V59 WeakPolarHBondContact O-CG2 3.43Å; L55-V59 PolarHBondContact O-N 3.14Å; V59-Q61 PolarHBondContact O-N 3.17Å; V59-G62 PolarHBondContact O-N 3.44Å; V59-Y67 HydrophobicContact CG2-CD2 4.17Å
60	K	96.6	Very high	97.3	Very high	155 Å²	155	63.8 Å²	63.8	67%	0.674	33%	0.334	S	S	*	.	H	α-helix	trans	-63	-21.7	176.6	-80.6	172.2	-178.9	175.3	0	113.8	T56 H57 L58 G62	T56-K60 HydrophobicContact CG2-CD 4.09Å; T56-K60 WeakPolarHBondContact O-CB 3.27Å; T56-K60 WeakPolarHBondContact O-CD 3.04Å; T56-K60 WeakPolarHBondContact O-CG 3.34Å; T56-K60 PolarHBondContact O-N 2.93Å; T56-K60 VanDerWaalsContact O-N 3.14Å; H57-K60 PolarHBondContact O-N 3.46Å; L58-K60 VanDerWaalsContact C-N 3.34Å; L58-K60 PolarHBondContact O-N 2.78Å; K60-G62 PolarHBondContact O-N 3.07Å
61	Q	94.3	Very high	97.3	Very high	55 Å²	55	64.3 Å²	64.3	26%	0.257	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-16.2	174.2	-66.4	172.5	-19.2	0	0	112.6	E20 H57 L58 V59 R63	E20-Q61 PolarHBondContact OE1-NE2 2.8Å; H57-Q61 PolarHBondContact O-N 3.25Å; L58-Q61 WeakPolarHBondContact O-CB 3.48Å; L58-Q61 PolarHBondContact O-N 3.14Å; V59-Q61 PolarHBondContact O-N 3.17Å; Q61-R63 HydrophobicContact CB-CG 4.28Å; Q61-R63 PolarHBondContact O-N 3.38Å; Q61-R63 VanDerWaalsContact O-N 3.15Å
62	G	93.4	Very high	97.2	Very high	67 Å²	67	64.9 Å²	64.9	69%	0.691	34%	0.341	S	S	*	.			trans	68.1	12.2	175.1	0	0	0	0	0	114.9	V59 K60	V59-G62 PolarHBondContact O-N 3.44Å; K60-G62 PolarHBondContact O-N 3.07Å
63	R	94.1	Very high	97.2	Very high	62 Å²	62	60.3 Å²	60.3	23%	0.234	32%	0.32	C	S	.	.			trans	-75	146.6	177.1	-62.2	-177.5	-172.4	-116.3	10.9	110.8	D13 E20 Q61 F65	D13-R63 PolarHBondContact O-NH1 2.85Å; D13-R63 VanDerWaalsContact O-NH1 3.08Å; E20-R63 IonicContact OE2-NH2 3.26Å; E20-R63 PolarHBondContact OE2-NH2 3.38Å; Q61-R63 HydrophobicContact CB-CG 4.28Å; Q61-R63 PolarHBondContact O-N 3.38Å; Q61-R63 VanDerWaalsContact O-N 3.15Å; R63-F65 HydrophobicContact CB-CD2 3.61Å; R63-F65 HydrophobicContact CB-CE2 3.85Å; R63-F65 PolarHBondContact O-N 2.95Å
64	P	95	Very high	97.2	Very high	71 Å²	71	58.3 Å²	58.3	46%	0.461	31%	0.311	S	S	.	.	S	Bend	trans	-79.3	61.8	-173.4	34.7	-37.6	0	0	0	112.4	M117	P64-M117 VanDerWaalsContact C-CE 3.49Å; P64-M117 HydrophobicContact CB-CE 4.22Å; P64-M117 WeakPolarHBondContact O-CB 3.43Å; P64-M117 PolarHBondContact O-N 3.27Å
65	F	96.6	Very high	97.2	Very high	13 Å²	13	62.8 Å²	62.8	6%	0.057	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	148	177.4	-65.6	-70	0	0	0	112.1	G14 F16 R63 Y67 T93 A114 V115 A116	G14-F65 VanDerWaalsContact O-CZ 3.28Å; G14-F65 WeakPolarHBondContact O-CZ 3.11Å; F16-F65 HydrophobicContact CB-CE1 4.46Å; F16-F65 HydrophobicContact CB-CZ 4.12Å; R63-F65 HydrophobicContact CB-CD2 3.61Å; R63-F65 HydrophobicContact CB-CE2 3.85Å; R63-F65 PolarHBondContact O-N 2.95Å; F65-Y67 HydrophobicContact CB-CD1 4.18Å; F65-Y67 HydrophobicContact CB-CD2 4.42Å; F65-Y67 HydrophobicContact CB-CE1 3.69Å; F65-Y67 HydrophobicContact CB-CE2 3.98Å; F65-Y67 HydrophobicContact CD2-CE1 4.18Å; F65-Y67 AromaticContact CD2-CZ 3.96Å; F65-Y67 WeakPolarHBondContact CD2-OH 3.41Å; F65-Y67 HydrophobicContact CG-CE1 4.19Å; F65-T93 WeakPolarHBondContact CE1-O 3.43Å; F65-A114 HydrophobicContact CB-CB 4.16Å; F65-A114 HydrophobicContact CD1-CB 3.9Å; F65-A114 HydrophobicContact CE1-CB 4.45Å; F65-A114 HydrophobicContact CG-CB 3.95Å; F65-V115 CarbonylContact C-O 3.53Å; F65-V115 WeakPolarHBondContact CA-O 3.38Å; F65-A116 HydrophobicContact CD1-CB 4.22Å; F65-A116 HydrophobicContact CE1-CB 4.01Å
66	K	97.3	Very high	97.1	Very high	139 Å²	139	63 Å²	63	60%	0.604	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	121.3	155.7	-67.6	174.7	-173.8	166.2	0	108.1	V115 M117	K66-V115 PolarHBondContact N-O 3.19Å; K66-V115 PolarHBondContact O-N 3.12Å; K66-M117 HydrophobicContact CD-CG 4.49Å; K66-M117 HydrophobicContact CG-CG 3.92Å; K66-M117 HydrophobicContact CG-SD 3.93Å
67	Y	98.1	Very high	96.9	Very high	31 Å²	31	64.5 Å²	64.5	12%	0.122	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	139	179.9	-62.8	-69.5	0	0	0	112.2	L58 V59 F65 F113 A114	L58-Y67 HydrophobicContact CB-CD1 4.22Å; L58-Y67 HydrophobicContact CB-CD2 3.92Å; L58-Y67 HydrophobicContact CB-CE1 4.2Å; L58-Y67 HydrophobicContact CB-CE2 3.88Å; L58-Y67 HydrophobicContact CB-CG 4.06Å; L58-Y67 HydrophobicContact CD1-CD1 4.15Å; L58-Y67 HydrophobicContact CD1-CG 4.32Å; L58-Y67 HydrophobicContact CD2-CD1 4.44Å; L58-Y67 HydrophobicContact CD2-CE1 4.1Å; L58-Y67 WeakPolarHBondContact O-CE2 3.44Å; V59-Y67 HydrophobicContact CG2-CD2 4.17Å; F65-Y67 HydrophobicContact CB-CD1 4.18Å; F65-Y67 HydrophobicContact CB-CD2 4.42Å; F65-Y67 HydrophobicContact CB-CE1 3.69Å; F65-Y67 HydrophobicContact CB-CE2 3.98Å; F65-Y67 HydrophobicContact CD2-CE1 4.18Å; F65-Y67 AromaticContact CD2-CZ 3.96Å; F65-Y67 WeakPolarHBondContact CD2-OH 3.41Å; F65-Y67 HydrophobicContact CG-CE1 4.19Å; Y67-F113 CarbonylContact C-O 3.53Å; Y67-F113 WeakPolarHBondContact CA-O 3.17Å; Y67-A114 HydrophobicContact CD1-CB 3.83Å; Y67-A114 HydrophobicContact CE1-CB 3.71Å
68	I	98.5	Very high	96.7	Very high	98 Å²	98	64.1 Å²	64.1	50%	0.503	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	129.4	171.2	-57.2	163.2	0	0	0	107.1	V112 F113	I68-V112 CarbonylContact O-C 3.58Å; I68-V112 VanDerWaalsContact O-CA 3.31Å; I68-V112 WeakPolarHBondContact O-CA 3.48Å; I68-F113 HydrophobicContact CB-CB 4.22Å; I68-F113 HydrophobicContact CB-CD2 4.24Å; I68-F113 HydrophobicContact CG2-CD2 4.25Å; I68-F113 PolarHBondContact N-O 2.99Å; I68-F113 PolarHBondContact O-N 3Å
69	V	98.6	Very high	96.5	Very high	20 Å²	20	66.6 Å²	66.6	12%	0.121	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	124	177.1	-176.1	0	0	0	0	109.2	V51 L55 L58 V110 S111 V112	V51-V69 HydrophobicContact CG1-CB 4.34Å; V51-V69 HydrophobicContact CG2-CG1 4.18Å; L55-V69 HydrophobicContact CD2-CB 4.45Å; L55-V69 HydrophobicContact CD2-CG2 3.65Å; L55-V69 HydrophobicContact CG-CB 4.25Å; L55-V69 HydrophobicContact CG-CG2 3.73Å; L58-V69 HydrophobicContact CD1-CG2 4.14Å; V69-V110 HydrophobicContact CG1-CG1 3.72Å; V69-S111 WeakPolarHBondContact CA-O 3.4Å; V69-V112 HydrophobicContact CG1-CG2 4.36Å; V69-V112 HydrophobicContact CG2-CG1 4.36Å; V69-V112 HydrophobicContact CG2-CG2 4.09Å
70	N	98.2	Very high	96.2	Very high	90 Å²	90	65.5 Å²	65.5	48%	0.481	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	130.4	173.5	-177.9	31.1	0	0	0	109.4	V110 S111	N70-V110 CarbonylContact O-C 3.5Å; N70-V110 VanDerWaalsContact O-CA 3.25Å; N70-V110 WeakPolarHBondContact O-CA 3.28Å; N70-S111 PolarHBondContact N-O 3.28Å; N70-S111 PolarHBondContact O-N 2.77Å
71	C	98.5	Very high	96	Very high	11 Å²	11	61.5 Å²	61.5	7%	0.074	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	128.3	179.2	175.3	0	0	0	0	109.9	T47 I50 V51 V110	T47-C71 HydrophobicContact CG2-CB 3.9Å; I50-C71 HydrophobicContact CG2-CB 4.47Å; V51-C71 HydrophobicContact CG2-CB 3.67Å; C71-V110 HydrophobicContact CB-CG2 4.09Å
72	T	98.3	Very high	96	Very high	47 Å²	47	67.1 Å²	67.1	29%	0.288	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.2	176.3	-61.6	0	0	0	0	109.4	C108 V109	T72-C108 CarbonylContact O-C 3.51Å; T72-C108 VanDerWaalsContact O-CA 3.29Å; T72-C108 WeakPolarHBondContact O-CA 3.23Å; T72-V109 PolarHBondContact N-O 2.72Å; T72-V109 PolarHBondContact O-N 2.88Å
73	I	98.4	Very high	96	Very high	23 Å²	23	66 Å²	66	12%	0.118	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.5	174.2	-64.2	178.3	0	0	0	108.9	I33 Y38 V43 W46 I50 I106 Y107 C108	I33-I73 HydrophobicContact CD1-CD1 4.48Å; Y38-I73 HydrophobicContact CE2-CG2 4.49Å; V43-I73 HydrophobicContact CG1-CB 4.06Å; V43-I73 HydrophobicContact CG1-CG2 4.16Å; V43-I73 HydrophobicContact CG2-CG2 4.39Å; W46-I73 HydrophobicContact CB-CD1 3.79Å; I50-I73 HydrophobicContact CD1-CD1 4.19Å; I73-I106 HydrophobicContact CG2-CG2 3.83Å; I73-Y107 CarbonylContact C-O 3.54Å; I73-Y107 WeakPolarHBondContact CA-O 3.4Å; I73-C108 HydrophobicContact CG1-CB 4.48Å
74	M	98	Very high	96	Very high	39 Å²	39	67.2 Å²	67.2	19%	0.192	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	139.6	178.7	-171.3	179.7	78.7	0	0	110.9	L81 Y107	M74-L81 HydrophobicContact CE-CB 3.66Å; M74-L81 HydrophobicContact SD-CB 4.06Å; M74-L81 HydrophobicContact SD-CD1 4.24Å; M74-Y107 HydrophobicContact CE-CD2 3.38Å; M74-Y107 HydrophobicContact CE-CE2 3.82Å; M74-Y107 HydrophobicContact CE-CG 4.35Å; M74-Y107 PolarHBondContact N-O 3.4Å; M74-Y107 PolarHBondContact O-N 3.36Å
75	Q	98.2	Very high	95.9	Very high	95 Å²	95	67.6 Å²	67.6	44%	0.444	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	137.5	170.9	-171.2	178	9.7	0	0	110.8	Y38 S77	Y38-Q75 HydrophobicContact CD1-CB 3.9Å; Y38-Q75 HydrophobicContact CD1-CG 3.62Å; Y38-Q75 HydrophobicContact CD2-CB 3.78Å; Y38-Q75 HydrophobicContact CD2-CG 4.17Å; Y38-Q75 HydrophobicContact CE1-CB 3.79Å; Y38-Q75 HydrophobicContact CE1-CG 3.92Å; Y38-Q75 HydrophobicContact CE2-CB 3.68Å; Y38-Q75 HydrophobicContact CE2-CG 4.45Å; Y38-Q75 HydrophobicContact CG-CB 3.9Å; Y38-Q75 HydrophobicContact CG-CG 3.76Å; Q75-S77 PolarHBondContact O-N 3.49Å
76	K	96.8	Very high	95.8	Very high	59 Å²	59	72.8 Å²	72.8	26%	0.257	45%	0.445	S	S	.	.			trans	-78	97.1	168.4	-73.7	-174.6	167.4	-169.9	0	110.8	E102 N103 R104 T105 I106 Y107	K76-E102 WeakPolarHBondContact CE-OE2 3.29Å; K76-E102 IonicContact NZ-OE2 3.79Å; K76-E102 PolarHBondContact NZ-OE2 3.08Å; K76-N103 VanDerWaalsContact CD-O 3.26Å; K76-N103 WeakPolarHBondContact CD-O 3.31Å; K76-N103 WeakPolarHBondContact CE-O 3.21Å; K76-N103 PolarHBondContact NZ-O 2.9Å; K76-R104 WeakPolarHBondContact CD-O 3.45Å; K76-T105 PolarHBondContact N-O 3.29Å; K76-I106 WeakPolarHBondContact CE-O 3.34Å; K76-Y107 HydrophobicContact CB-CE2 4.47Å; K76-Y107 HydrophobicContact CD-CD2 4.42Å; K76-Y107 HydrophobicContact CD-CE1 4.43Å; K76-Y107 HydrophobicContact CD-CE2 4.24Å; K76-Y107 VanDerWaalsContact CE-CD1 3.47Å; K76-Y107 VanDerWaalsContact CE-CZ 3.48Å; K76-Y107 HydrophobicContact CG-CD2 3.53Å; K76-Y107 HydrophobicContact CG-CE1 4.47Å; K76-Y107 HydrophobicContact CG-CE2 3.51Å; K76-Y107 HydrophobicContact CG-CG 4.09Å
77	S	95.5	Very high	95.6	Very high	88 Å²	88	68.6 Å²	68.6	62%	0.615	43%	0.433	S	S	*	.	S	Bend	trans	-125.5	15.3	178.3	57.2	0	0	0	0	113.5	Q75	Q75-S77 PolarHBondContact O-N 3.49Å
78	G	92.3	Very high	95.6	Very high	85 Å²	85	78.6 Å²	78.6	88%	0.876	47%	0.472	S	S	*	.	S	Bend	trans	92.6	-3.8	-177.5	0	0	0	0	0	114.8
79	A	93.3	Very high	95.4	Very high	52 Å²	52	77.7 Å²	77.7	43%	0.43	46%	0.462	S	S	.	.			trans	-77.2	148.7	171.3	0	0	0	0	0	112.1
80	G	90.7	Very high	95.2	Very high	75 Å²	75	80.4 Å²	80.4	77%	0.773	48%	0.476	S	S	*	.			trans	-84.7	157.1	171.8	0	0	0	0	0	112.7
81	L	92	Very high	94.9	Very high	72 Å²	72	81.9 Å²	81.9	38%	0.377	49%	0.488	S	S	.	.			trans	-128.8	123.6	175.2	177.5	62.6	0	0	0	109.7	M74 T83 V109	M74-L81 HydrophobicContact CE-CB 3.66Å; M74-L81 HydrophobicContact SD-CB 4.06Å; M74-L81 HydrophobicContact SD-CD1 4.24Å; L81-T83 HydrophobicContact CD1-CG2 4.08Å; L81-T83 HydrophobicContact CD2-CG2 4.45Å; L81-T83 HydrophobicContact CG-CG2 4.12Å; L81-V109 HydrophobicContact CD2-CG2 3.97Å
82	H	94.3	Very high	94.5	Very high	172 Å²	172	85.9 Å²	85.9	80%	0.796	51%	0.513	S	S	*	.			trans	-117.6	117.3	172.8	-175.7	-91.2	0	0	0	109.6
83	T	93.9	Very high	94.3	Very high	45 Å²	45	86.1 Å²	86.1	28%	0.276	51%	0.514	S	S	.	.			trans	-118.5	134.9	175.5	56.4	0	0	0	0	109.6	L81	L81-T83 HydrophobicContact CD1-CG2 4.08Å; L81-T83 HydrophobicContact CD2-CG2 4.45Å; L81-T83 HydrophobicContact CG-CG2 4.12Å
84	A	94.1	Very high	94.1	Very high	87 Å²	87	86.2 Å²	86.2	72%	0.719	52%	0.515	S	S	*	.			trans	-138	150.4	175.5	0	0	0	0	0	109.3
85	N	92.4	Very high	94	Very high	78 Å²	78	84.9 Å²	84.9	42%	0.417	51%	0.511	S	S	.	.			trans	-124.4	147.6	176.4	36.1	34.3	0	0	0	109.3	T98 F113	N85-T98 PolarHBondContact ND2-OG1 3.43Å; N85-T98 VanDerWaalsContact ND2-OG1 3.16Å; N85-F113 HydrophobicContact CB-CE1 3.95Å; N85-F113 HydrophobicContact CB-CZ 3.76Å
86	S	94.8	Very high	94	Very high	122 Å²	122	82 Å²	82	85%	0.853	50%	0.501	S	S	*	.			trans	-139.3	130.8	177.7	-176.8	0	0	0	0	107.8
87	C	93.9	Very high	93.9	Very high	52 Å²	52	79.4 Å²	79.4	35%	0.351	49%	0.491	S	S	.	.			trans	-131.8	142.5	-175	-59.8	0	0	0	0	109.5	W89 F113	C87-W89 HydrophobicContact CB-CD2 3.46Å; C87-W89 VanDerWaalsContact CB-CD2 3.46Å; C87-W89 HydrophobicContact CB-CE3 3.83Å; C87-W89 HydrophobicContact CB-CG 3.8Å; C87-W89 HydrophobicContact CB-CH2 4.28Å; C87-W89 HydrophobicContact CB-CZ2 3.97Å; C87-W89 HydrophobicContact CB-CZ3 4.23Å; C87-F113 WeakPolarHBondContact SG-CE1 3.3Å
88	Y	96.3	Very high	94.1	Very high	241 Å²	241	77.7 Å²	77.7	95%	0.945	48%	0.477	S	S	*	.			trans	-118.4	103.1	167.5	-177.7	-106.5	0	0	0	107.1
89	W	95.7	Very high	94.4	Very high	79 Å²	79	74.1 Å²	74.1	30%	0.299	44%	0.438	S	S	.	.	S	Bend	trans	-161.5	174.1	-160.7	66.7	-0.8	0	0	0	111.5	C87 D94 G95 F113	C87-W89 HydrophobicContact CB-CD2 3.46Å; C87-W89 VanDerWaalsContact CB-CD2 3.46Å; C87-W89 HydrophobicContact CB-CE3 3.83Å; C87-W89 HydrophobicContact CB-CG 3.8Å; C87-W89 HydrophobicContact CB-CH2 4.28Å; C87-W89 HydrophobicContact CB-CZ2 3.97Å; C87-W89 HydrophobicContact CB-CZ3 4.23Å; W89-D94 HydrophobicContact CB-CB 4.13Å; W89-D94 WeakPolarHBondContact CB-OD2 3.42Å; W89-D94 HydrophobicContact CD2-CB 3.83Å; W89-D94 HydrophobicContact CE3-CB 3.62Å; W89-D94 HydrophobicContact CG-CB 4.08Å; W89-D94 HydrophobicContact CZ3-CB 4.29Å; W89-G95 VanDerWaalsContact CZ3-O 3.27Å; W89-G95 WeakPolarHBondContact CZ3-O 3.38Å; W89-F113 HydrophobicContact CH2-CD1 4.27Å; W89-F113 HydrophobicContact CZ3-CB 4.46Å; W89-F113 HydrophobicContact CZ3-CD1 4Å
90	D	94.2	Very high	94.6	Very high	76 Å²	76	80.7 Å²	80.7	41%	0.406	45%	0.451	S	S	.	.			trans	-85.5	112.3	175.9	-173.8	-29.9	0	0	0	109.9	T92 T93 D94	D90-T92 PolarHBondContact O-N 3.02Å; D90-T92 VanDerWaalsContact O-N 3.1Å; D90-T92 WeakPolarHBondContact OD1-CA 3.34Å; D90-T92 VanDerWaalsContact OD1-CB 3.25Å; D90-T92 WeakPolarHBondContact OD1-CB 3.42Å; D90-T92 PolarHBondContact OD1-N 3.02Å; D90-T92 PolarHBondContact OD1-OG1 2.83Å; D90-T93 WeakPolarHBondContact CB-OG1 3.26Å; D90-T93 PolarHBondContact O-N 3.24Å; D90-D94 PolarHBondContact N-OD2 3.2Å; D90-D94 WeakPolarHBondContact O-CA 3.48Å; D90-D94 VanDerWaalsContact O-CB 3.23Å; D90-D94 WeakPolarHBondContact O-CB 3.33Å; D90-D94 PolarHBondContact O-N 3.44Å
91	T	91.4	Very high	94.9	Very high	122 Å²	122	78.5 Å²	78.5	75%	0.748	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-8.5	-177.2	53.4	0	0	0	0	114.5
92	T	91.1	Very high	95.2	Very high	95 Å²	95	80.4 Å²	80.4	58%	0.583	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-35.9	179.9	-10.1	0	0	0	0	111.5	N15 D90	N15-T92 PolarHBondContact ND2-O 2.86Å; D90-T92 PolarHBondContact O-N 3.02Å; D90-T92 VanDerWaalsContact O-N 3.1Å; D90-T92 WeakPolarHBondContact OD1-CA 3.34Å; D90-T92 VanDerWaalsContact OD1-CB 3.25Å; D90-T92 WeakPolarHBondContact OD1-CB 3.42Å; D90-T92 PolarHBondContact OD1-N 3.02Å; D90-T92 PolarHBondContact OD1-OG1 2.83Å
93	T	92.3	Very high	95.3	Very high	52 Å²	52	73.9 Å²	73.9	32%	0.319	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-29.5	-173	60.3	0	0	0	0	113.4	F65 D90	F65-T93 WeakPolarHBondContact CE1-O 3.43Å; D90-T93 WeakPolarHBondContact CB-OG1 3.26Å; D90-T93 PolarHBondContact O-N 3.24Å
94	D	95.4	Very high	95.5	Very high	24 Å²	24	80.9 Å²	80.9	13%	0.128	42%	0.419	C	S	.	.			trans	-94.6	156.1	-177	-52.5	-30.9	0	0	0	110.8	W89 D90 A114 V115 A116	W89-D94 HydrophobicContact CB-CB 4.13Å; W89-D94 WeakPolarHBondContact CB-OD2 3.42Å; W89-D94 HydrophobicContact CD2-CB 3.83Å; W89-D94 HydrophobicContact CE3-CB 3.62Å; W89-D94 HydrophobicContact CG-CB 4.08Å; W89-D94 HydrophobicContact CZ3-CB 4.29Å; D90-D94 PolarHBondContact N-OD2 3.2Å; D90-D94 WeakPolarHBondContact O-CA 3.48Å; D90-D94 VanDerWaalsContact O-CB 3.23Å; D90-D94 WeakPolarHBondContact O-CB 3.33Å; D90-D94 PolarHBondContact O-N 3.44Å; D94-A114 WeakPolarHBondContact CA-O 3.46Å; D94-V115 WeakPolarHBondContact OD1-CA 3.46Å; D94-A116 WeakPolarHBondContact OD1-CB 3.33Å; D94-A116 PolarHBondContact OD1-N 2.88Å
95	G	95.8	Very high	95.7	Very high	11 Å²	11	78.3 Å²	78.3	11%	0.113	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	163.5	-177.3	0	0	0	0	0	114.1	W89 F113 A114	W89-G95 VanDerWaalsContact CZ3-O 3.27Å; W89-G95 WeakPolarHBondContact CZ3-O 3.38Å; G95-F113 CarbonylContact O-C 3.58Å; G95-F113 WeakPolarHBondContact O-CA 3.25Å; G95-A114 PolarHBondContact N-O 2.9Å; G95-A114 PolarHBondContact O-N 2.89Å
96	S	97	Very high	96	Very high	35 Å²	35	74.6 Å²	74.6	25%	0.245	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	153.8	172.1	62.6	0	0	0	0	111.7	F16 V112	F16-S96 VanDerWaalsContact CE1-C 3.49Å; S96-V112 CarbonylContact C-O 3.58Å; S96-V112 WeakPolarHBondContact CA-O 3.21Å; S96-V112 WeakPolarHBondContact CB-O 3.38Å
97	C	96.6	Very high	96.1	Very high	5 Å²	5	72.5 Å²	72.5	3%	0.034	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	130.8	172.8	177.8	0	0	0	0	108.3	F16 T18 T21 S22 S111 V112	F16-C97 HydrophobicContact CE1-CB 4Å; F16-C97 HydrophobicContact CZ-CB 3.9Å; T18-C97 HydrophobicContact CG2-CB 4.02Å; T21-C97 HydrophobicContact CG2-CB 3.95Å; S22-C97 VanDerWaalsContact CA-SG 3.51Å; S22-C97 VanDerWaalsContact CB-SG 3.59Å; C97-S111 CarbonylContact O-C 3.59Å; C97-S111 WeakPolarHBondContact O-CA 3.44Å; C97-V112 PolarHBondContact N-O 3.34Å; C97-V112 PolarHBondContact O-N 3.43Å
98	T	98.2	Very high	96.3	Very high	52 Å²	52	70.1 Å²	70.1	32%	0.319	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	116.1	172.2	-65.3	0	0	0	0	109.8	N85 V109 V110 S111	N85-T98 PolarHBondContact ND2-OG1 3.43Å; N85-T98 VanDerWaalsContact ND2-OG1 3.16Å; T98-V109 HydrophobicContact CG2-CG1 3.81Å; T98-V110 CarbonylContact C-O 3.48Å; T98-V110 WeakPolarHBondContact CA-O 3.43Å; T98-S111 PolarHBondContact OG1-OG 2.99Å
99	V	98.6	Very high	96.5	Very high	9 Å²	9	59.1 Å²	59.1	6%	0.055	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	126	176.6	-179.1	0	0	0	0	108.9	V25 K26 I29 V109 V110	V25-V99 HydrophobicContact CB-CG2 3.87Å; V25-V99 HydrophobicContact CG1-CB 3.86Å; V25-V99 HydrophobicContact CG1-CG1 4.45Å; V25-V99 HydrophobicContact CG1-CG2 3.73Å; K26-V99 HydrophobicContact CB-CG1 4.21Å; I29-V99 HydrophobicContact CD1-CB 4.37Å; I29-V99 HydrophobicContact CD1-CG1 3.89Å; V99-V109 WeakPolarHBondContact O-CA 3.45Å; V99-V110 PolarHBondContact N-O 3.34Å; V99-V110 PolarHBondContact O-N 3.16Å
100	R	97.8	Very high	96.6	Very high	190 Å²	190	55.4 Å²	55.4	72%	0.717	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	127.6	170.2	-61.5	-175.6	-179.7	114.6	-0.8	108.2	V109	R100-V109 HydrophobicContact CG-CG1 4.36Å; R100-V109 HydrophobicContact CG-CG2 4.28Å
101	W	98.4	Very high	96.8	Very high	29 Å²	29	52.3 Å²	52.3	11%	0.11	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	147.2	177.9	-179.1	95.4	0	0	0	109.5	I29 I33 N103 I106 C108	I29-W101 HydrophobicContact CD1-CB 4.09Å; I29-W101 HydrophobicContact CG2-CB 3.86Å; I29-W101 HydrophobicContact CG2-CD2 3.63Å; I29-W101 HydrophobicContact CG2-CE3 3.92Å; I29-W101 HydrophobicContact CG2-CG 3.59Å; I33-W101 HydrophobicContact CD1-CE3 3.75Å; I33-W101 HydrophobicContact CD1-CH2 4.18Å; I33-W101 HydrophobicContact CD1-CZ3 3.46Å; I33-W101 VanDerWaalsContact CD1-CZ3 3.46Å; I33-W101 HydrophobicContact CG1-CE3 4.23Å; I33-W101 HydrophobicContact CG1-CH2 3.96Å; I33-W101 HydrophobicContact CG1-CZ3 3.75Å; I33-W101 WeakPolarHBondContact O-CH2 3.49Å; W101-N103 HydrophobicContact CH2-CB 3.5Å; W101-N103 WeakPolarHBondContact CH2-ND2 3.25Å; W101-N103 HydrophobicContact CZ2-CB 3.94Å; W101-N103 HydrophobicContact CZ3-CB 4.08Å; W101-I106 HydrophobicContact CZ3-CB 4.19Å; W101-I106 HydrophobicContact CZ3-CG2 4.16Å; W101-C108 HydrophobicContact CB-CB 4.34Å; W101-C108 HydrophobicContact CE3-CB 3.85Å; W101-C108 PolarHBondContact N-O 2.99Å; W101-C108 PolarHBondContact O-N 2.73Å
102	E	97.4	Very high	97.2	Very high	113 Å²	113	46.5 Å²	46.5	53%	0.528	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	153.3	175.9	62.7	175.9	178.7	0	0	111.6	K76 I106 Y107	K76-E102 WeakPolarHBondContact CE-OE2 3.29Å; K76-E102 IonicContact NZ-OE2 3.79Å; K76-E102 PolarHBondContact NZ-OE2 3.08Å; E102-I106 VanDerWaalsContact CA-O 3.31Å; E102-I106 WeakPolarHBondContact CA-O 3.38Å; E102-Y107 HydrophobicContact CB-CD1 4.04Å; E102-Y107 WeakPolarHBondContact OE2-CE1 3.3Å
103	N	97.1	Very high	97.5	Very high	34 Å²	34	43.4 Å²	43.4	18%	0.182	20%	0.203	C	C	.	.			trans	-128.2	-160.9	163.1	72.8	9.3	0	0	0	109.7	T36 K76 W101 T105 I106	T36-N103 PolarHBondContact O-ND2 2.84Å; K76-N103 VanDerWaalsContact CD-O 3.26Å; K76-N103 WeakPolarHBondContact CD-O 3.31Å; K76-N103 WeakPolarHBondContact CE-O 3.21Å; K76-N103 PolarHBondContact NZ-O 2.9Å; W101-N103 HydrophobicContact CH2-CB 3.5Å; W101-N103 WeakPolarHBondContact CH2-ND2 3.25Å; W101-N103 HydrophobicContact CZ2-CB 3.94Å; W101-N103 HydrophobicContact CZ3-CB 4.08Å; N103-T105 VanDerWaalsContact C-N 3.28Å; N103-T105 PolarHBondContact O-N 3.15Å; N103-T105 PolarHBondContact OD1-N 3.05Å; N103-I106 PolarHBondContact N-O 3.4Å; N103-I106 WeakPolarHBondContact OD1-CB 3.3Å; N103-I106 PolarHBondContact OD1-N 3.14Å
104	R	97.2	Very high	97.8	Very high	192 Å²	192	40.9 Å²	40.9	73%	0.725	19%	0.188	S	C	*	.	S	Bend	trans	-59.6	-35	-179.6	-175.9	178.1	61.8	-174.4	-1.6	113.5	D37 K76	D37-R104 IonicContact OD1-CZ 2.86Å; D37-R104 IonicContact OD1-NE 3.4Å; D37-R104 IonicContact OD1-NH2 3.95Å; D37-R104 PolarHBondContact OD1-NH2 3.49Å; D37-R104 IonicContact OD2-NH2 2.65Å; D37-R104 PolarHBondContact OD2-NH2 3.22Å; K76-R104 WeakPolarHBondContact CD-O 3.45Å
105	T	98	Very high	97.8	Very high	33 Å²	33	42.1 Å²	42.1	20%	0.202	20%	0.196	C	C	.	.	S	Bend	trans	-121.1	-7.9	-168.8	56.2	0	0	0	0	114.3	D37 Y38 K76 N103	D37-T105 VanDerWaalsContact CA-OG1 3.31Å; D37-T105 WeakPolarHBondContact CA-OG1 3.48Å; D37-T105 HydrophobicContact CB-CG2 4.47Å; D37-T105 VanDerWaalsContact OD1-CG2 3.3Å; D37-T105 WeakPolarHBondContact OD1-CG2 3.44Å; D37-T105 PolarHBondContact OD1-OG1 3.49Å; D37-T105 VanDerWaalsContact OD1-OG1 3.06Å; Y38-T105 PolarHBondContact N-OG1 3.3Å; K76-T105 PolarHBondContact N-O 3.29Å; N103-T105 VanDerWaalsContact C-N 3.28Å; N103-T105 PolarHBondContact O-N 3.15Å; N103-T105 PolarHBondContact OD1-N 3.05Å
106	I	98.4	Very high	97.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	137.2	-172.3	-58.8	164.1	0	0	0	110.9	I33 Y38 W46 I73 K76 W101 E102 N103	I33-I106 HydrophobicContact CD1-CG2 4.16Å; Y38-I106 HydrophobicContact CD2-CG1 4.11Å; Y38-I106 HydrophobicContact CG-CG1 4.43Å; W46-I106 HydrophobicContact CZ3-CD1 4.4Å; I73-I106 HydrophobicContact CG2-CG2 3.83Å; K76-I106 WeakPolarHBondContact CE-O 3.34Å; W101-I106 HydrophobicContact CZ3-CB 4.19Å; W101-I106 HydrophobicContact CZ3-CG2 4.16Å; E102-I106 VanDerWaalsContact CA-O 3.31Å; E102-I106 WeakPolarHBondContact CA-O 3.38Å; N103-I106 PolarHBondContact N-O 3.4Å; N103-I106 WeakPolarHBondContact OD1-CB 3.3Å; N103-I106 PolarHBondContact OD1-N 3.14Å
107	Y	98.1	Very high	97.3	Very high	79 Å²	79	49.9 Å²	49.9	31%	0.31	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	136.5	153.3	-68.4	-69.4	0	0	0	109.2	I73 M74 K76 E102	I73-Y107 CarbonylContact C-O 3.54Å; I73-Y107 WeakPolarHBondContact CA-O 3.4Å; M74-Y107 HydrophobicContact CE-CD2 3.38Å; M74-Y107 HydrophobicContact CE-CE2 3.82Å; M74-Y107 HydrophobicContact CE-CG 4.35Å; M74-Y107 PolarHBondContact N-O 3.4Å; M74-Y107 PolarHBondContact O-N 3.36Å; K76-Y107 HydrophobicContact CB-CE2 4.47Å; K76-Y107 HydrophobicContact CD-CD2 4.42Å; K76-Y107 HydrophobicContact CD-CE1 4.43Å; K76-Y107 HydrophobicContact CD-CE2 4.24Å; K76-Y107 VanDerWaalsContact CE-CD1 3.47Å; K76-Y107 VanDerWaalsContact CE-CZ 3.48Å; K76-Y107 HydrophobicContact CG-CD2 3.53Å; K76-Y107 HydrophobicContact CG-CE1 4.47Å; K76-Y107 HydrophobicContact CG-CE2 3.51Å; K76-Y107 HydrophobicContact CG-CG 4.09Å; E102-Y107 HydrophobicContact CB-CD1 4.04Å; E102-Y107 WeakPolarHBondContact OE2-CE1 3.3Å
108	C	98.5	Very high	97.3	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.007	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	129.9	172.7	-173.8	0	0	0	0	109.5	I29 I33 T72 I73 W101	I29-C108 HydrophobicContact CG2-CB 4.3Å; I33-C108 HydrophobicContact CD1-CB 3.83Å; T72-C108 CarbonylContact O-C 3.51Å; T72-C108 VanDerWaalsContact O-CA 3.29Å; T72-C108 WeakPolarHBondContact O-CA 3.23Å; I73-C108 HydrophobicContact CG1-CB 4.48Å; W101-C108 HydrophobicContact CB-CB 4.34Å; W101-C108 HydrophobicContact CE3-CB 3.85Å; W101-C108 PolarHBondContact N-O 2.99Å; W101-C108 PolarHBondContact O-N 2.73Å
109	V	98.6	Very high	97.3	Very high	11 Å²	11	52.1 Å²	52.1	7%	0.067	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	122.8	174	-175.9	0	0	0	0	108.2	T72 L81 T98 V99 R100	T72-V109 PolarHBondContact N-O 2.72Å; T72-V109 PolarHBondContact O-N 2.88Å; L81-V109 HydrophobicContact CD2-CG2 3.97Å; T98-V109 HydrophobicContact CG2-CG1 3.81Å; V99-V109 WeakPolarHBondContact O-CA 3.45Å; R100-V109 HydrophobicContact CG-CG1 4.36Å; R100-V109 HydrophobicContact CG-CG2 4.28Å
110	V	98.8	Very high	97.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	126.3	175.8	-177	0	0	0	0	108.9	V25 I29 I50 V69 N70 C71 T98 V99	V25-V110 HydrophobicContact CG1-CB 3.67Å; V25-V110 HydrophobicContact CG1-CG1 3.6Å; V25-V110 HydrophobicContact CG1-CG2 4.3Å; I29-V110 HydrophobicContact CD1-CB 4.22Å; I29-V110 HydrophobicContact CD1-CG2 3.64Å; I29-V110 HydrophobicContact CG1-CG2 3.84Å; I50-V110 HydrophobicContact CG2-CG2 3.76Å; V69-V110 HydrophobicContact CG1-CG1 3.72Å; N70-V110 CarbonylContact O-C 3.5Å; N70-V110 VanDerWaalsContact O-CA 3.25Å; N70-V110 WeakPolarHBondContact O-CA 3.28Å; C71-V110 HydrophobicContact CB-CG2 4.09Å; T98-V110 CarbonylContact C-O 3.48Å; T98-V110 WeakPolarHBondContact CA-O 3.43Å; V99-V110 PolarHBondContact N-O 3.34Å; V99-V110 PolarHBondContact O-N 3.16Å
111	S	98.6	Very high	97.2	Very high	11 Å²	11	46.5 Å²	46.5	8%	0.077	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	124.4	173	-65.9	0	0	0	0	109.5	V69 N70 C97 T98	V69-S111 WeakPolarHBondContact CA-O 3.4Å; N70-S111 PolarHBondContact N-O 3.28Å; N70-S111 PolarHBondContact O-N 2.77Å; C97-S111 CarbonylContact O-C 3.59Å; C97-S111 WeakPolarHBondContact O-CA 3.44Å; T98-S111 PolarHBondContact OG1-OG 2.99Å
112	V	98.6	Very high	97.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	138	172.1	-178.4	0	0	0	0	108.6	F16 T21 V25 L58 I68 V69 S96 C97	F16-V112 HydrophobicContact CE2-CG1 4.42Å; F16-V112 HydrophobicContact CZ-CG1 4.35Å; T21-V112 HydrophobicContact CG2-CB 4.16Å; T21-V112 HydrophobicContact CG2-CG1 4.13Å; T21-V112 HydrophobicContact CG2-CG2 4.14Å; V25-V112 HydrophobicContact CG2-CG2 3.56Å; L58-V112 HydrophobicContact CD1-CG1 3.61Å; L58-V112 HydrophobicContact CD1-CG2 4.35Å; I68-V112 CarbonylContact O-C 3.58Å; I68-V112 VanDerWaalsContact O-CA 3.31Å; I68-V112 WeakPolarHBondContact O-CA 3.48Å; V69-V112 HydrophobicContact CG1-CG2 4.36Å; V69-V112 HydrophobicContact CG2-CG1 4.36Å; V69-V112 HydrophobicContact CG2-CG2 4.09Å; S96-V112 CarbonylContact C-O 3.58Å; S96-V112 WeakPolarHBondContact CA-O 3.21Å; S96-V112 WeakPolarHBondContact CB-O 3.38Å; C97-V112 PolarHBondContact N-O 3.34Å; C97-V112 PolarHBondContact O-N 3.43Å
113	F	98.3	Very high	97.1	Very high	30 Å²	30	43.3 Å²	43.3	13%	0.132	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	135.5	169	-51.5	-95.5	0	0	0	108.4	Y67 I68 N85 C87 W89 G95	Y67-F113 CarbonylContact C-O 3.53Å; Y67-F113 WeakPolarHBondContact CA-O 3.17Å; I68-F113 HydrophobicContact CB-CB 4.22Å; I68-F113 HydrophobicContact CB-CD2 4.24Å; I68-F113 HydrophobicContact CG2-CD2 4.25Å; I68-F113 PolarHBondContact N-O 2.99Å; I68-F113 PolarHBondContact O-N 3Å; N85-F113 HydrophobicContact CB-CE1 3.95Å; N85-F113 HydrophobicContact CB-CZ 3.76Å; C87-F113 WeakPolarHBondContact SG-CE1 3.3Å; W89-F113 HydrophobicContact CH2-CD1 4.27Å; W89-F113 HydrophobicContact CZ3-CB 4.46Å; W89-F113 HydrophobicContact CZ3-CD1 4Å; G95-F113 CarbonylContact O-C 3.58Å; G95-F113 WeakPolarHBondContact O-CA 3.25Å
114	A	97.9	Very high	97.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	119.3	174.1	0	0	0	0	0	107.8	F16 F65 Y67 D94 G95	F16-A114 HydrophobicContact CB-CB 4.13Å; F16-A114 HydrophobicContact CD2-CB 3.23Å; F16-A114 HydrophobicContact CE2-CB 3.69Å; F16-A114 HydrophobicContact CG-CB 3.74Å; F65-A114 HydrophobicContact CB-CB 4.16Å; F65-A114 HydrophobicContact CD1-CB 3.9Å; F65-A114 HydrophobicContact CE1-CB 4.45Å; F65-A114 HydrophobicContact CG-CB 3.95Å; Y67-A114 HydrophobicContact CD1-CB 3.83Å; Y67-A114 HydrophobicContact CE1-CB 3.71Å; D94-A114 WeakPolarHBondContact CA-O 3.46Å; G95-A114 PolarHBondContact N-O 2.9Å; G95-A114 PolarHBondContact O-N 2.89Å
115	V	97.1	Very high	97.1	Very high	50 Å²	50	32.5 Å²	32.5	30%	0.303	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	120	178.1	-176.2	0	0	0	0	107.6	F65 K66 D94	F65-V115 CarbonylContact C-O 3.53Å; F65-V115 WeakPolarHBondContact CA-O 3.38Å; K66-V115 PolarHBondContact N-O 3.19Å; K66-V115 PolarHBondContact O-N 3.12Å; D94-V115 WeakPolarHBondContact OD1-CA 3.46Å
116	A	95	Very high	97	Very high	35 Å²	35	32.5 Å²	32.5	29%	0.289	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	147	-178.4	0	0	0	0	0	110.7	F65 D94	F65-A116 HydrophobicContact CD1-CB 4.22Å; F65-A116 HydrophobicContact CE1-CB 4.01Å; D94-A116 WeakPolarHBondContact OD1-CB 3.33Å; D94-A116 PolarHBondContact OD1-N 2.88Å
117	M	86.3	Confident	96.9	Very high	173 Å²	173	35.5 Å²	35.5	85%	0.852	19%	0.185	S	C	*	.			trans	-100.5	0	179.5	-69.5	-164.7	-71.9	0	0	113.1	P64 K66	P64-M117 VanDerWaalsContact C-CE 3.49Å; P64-M117 HydrophobicContact CB-CE 4.22Å; P64-M117 WeakPolarHBondContact O-CB 3.43Å; P64-M117 PolarHBondContact O-N 3.27Å; K66-M117 HydrophobicContact CD-CG 4.49Å; K66-M117 HydrophobicContact CG-CG 3.92Å; K66-M117 HydrophobicContact CG-SD 3.93Å

Retrieved 117 of 117 residues in 957.7 ms (Link to these results)

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