A0A087XRJ4_POEFO Loading...

Dual specificity protein phosphatase

Dual specificity phosphatase able to dephosphorylate phosphotyrosine, phosphoserine and phosphothreonine residues within the same substrate, with a preference for phosphotyrosine as a substrate. Involved in the modulation of AMPK and MAPK1/2 signaling pathways. Dual specificity phosphatase able to dephosphorylate phosphotyrosine, phosphoserine and phosphothreonine residues, with a preference for phosphotyrosine as a substrate.

AlphaFold DB , UniProt , Accession A0A087XRJ4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 213 aa.

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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	37.9	Very low	45	Very low	245 Å²	245	136.7 Å²	136.7	100%	1.207	79%	0.786	S	S	*	*				0	98.6	0	-67.8	-175.4	-152.1	0	0	107.8
2	T	34.8	Very low	48.2	Very low	139 Å²	139	127.8 Å²	127.8	85%	0.853	74%	0.737	S	S	*	*			trans	-143.9	92.7	169.7	-32.9	0	0	0	0	106.4	C4	T2-C4 PolarHBondContact O-N 3.49Å
3	S	31.7	Very low	51.4	Low	116 Å²	116	127.7 Å²	127.7	81%	0.811	72%	0.718	S	S	*	*			trans	-70.9	105	174.3	176.5	0	0	0	0	107.6	A5	S3-A5 VanDerWaalsContact C-N 3.29Å; S3-A5 PolarHBondContact O-N 3.3Å
4	C	33.8	Very low	54.4	Low	119 Å²	119	121.4 Å²	121.4	80%	0.804	69%	0.691	S	S	*	*			trans	-65.5	95.5	160.3	-78.5	0	0	0	0	107.1	T2 V6	T2-C4 PolarHBondContact O-N 3.49Å; C4-V6 PolarHBondContact O-N 2.96Å
5	A	34.9	Very low	57.2	Low	84 Å²	84	117.2 Å²	117.2	69%	0.694	68%	0.676	S	S	*	*			trans	-62.8	105.4	169.5	0	0	0	0	0	108.2	S3 K7	S3-A5 VanDerWaalsContact C-N 3.29Å; S3-A5 PolarHBondContact O-N 3.3Å; A5-K7 PolarHBondContact O-N 3.04Å
6	V	35.1	Very low	59.6	Low	132 Å²	132	112.3 Å²	112.3	80%	0.8	65%	0.649	S	S	*	*			trans	-57.1	102.9	163.6	177.7	0	0	0	0	106	C4 S8	C4-V6 PolarHBondContact O-N 2.96Å; V6-S8 PolarHBondContact O-N 3.19Å
7	K	42.4	Very low	61.8	Low	193 Å²	193	110.6 Å²	110.6	84%	0.839	63%	0.634	S	S	*	*			trans	-53.5	116.1	169.1	-74.5	-175.7	178.3	-175.9	0	106.5	A5 K9	A5-K7 PolarHBondContact O-N 3.04Å; K7-K9 PolarHBondContact O-N 3.36Å
8	S	41.6	Very low	63.7	Low	108 Å²	108	106 Å²	106	76%	0.755	61%	0.608	S	S	*	*			trans	-42.6	122.9	175.3	170.5	0	0	0	0	109.1	V6 S10	V6-S8 PolarHBondContact O-N 3.19Å; S8-S10 PolarHBondContact O-N 3.47Å
9	K	48.8	Very low	65.3	Low	202 Å²	202	101.4 Å²	101.4	88%	0.878	58%	0.581	S	S	*	*			trans	-65.1	89.3	174.3	-73.5	-179.1	179.7	176.7	0	107.1	K7 N11	K7-K9 PolarHBondContact O-N 3.36Å; K9-N11 PolarHBondContact O-N 3.48Å
10	S	68.4	Low	66.7	Low	74 Å²	74	101.7 Å²	101.7	52%	0.517	59%	0.587	S	S	.	*			trans	-54.5	128.9	177.7	70.2	0	0	0	0	108.7	S8 P12	S8-S10 PolarHBondContact O-N 3.47Å; S10-P12 WeakPolarHBondContact O-CD 3.36Å; S10-P12 VanDerWaalsContact O-N 3.1Å
11	N	85.8	Confident	68	Low	92 Å²	92	103.2 Å²	103.2	49%	0.492	59%	0.593	S	S	.	*			trans	-53	116.3	175.3	177.5	0.7	0	0	0	109.4	K9 Y13 A14	K9-N11 PolarHBondContact O-N 3.48Å; N11-Y13 PolarHBondContact O-N 3.36Å; N11-Y13 VanDerWaalsContact O-N 3.12Å; N11-Y13 WeakPolarHBondContact OD1-CB 3.46Å; N11-Y13 VanDerWaalsContact OD1-CD2 3.29Å; N11-Y13 WeakPolarHBondContact OD1-CD2 3.49Å; N11-Y13 PolarHBondContact OD1-N 3.08Å; N11-A14 HydrophobicContact CB-CB 4.09Å; N11-A14 PolarHBondContact O-N 3.41Å
12	P	83.8	Confident	70.6	Confident	29 Å²	29	93.2 Å²	93.2	19%	0.188	55%	0.547	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-12.3	-176.7	29	-35.6	0	0	0	113	S10 T29 K184	S10-P12 WeakPolarHBondContact O-CD 3.36Å; S10-P12 VanDerWaalsContact O-N 3.1Å; P12-T29 WeakPolarHBondContact O-CB 3.5Å; P12-T29 PolarHBondContact O-N 2.92Å; P12-T29 PolarHBondContact O-OG1 3.27Å; P12-K184 HydrophobicContact CB-CD 4.27Å; P12-K184 HydrophobicContact CB-CG 4.43Å
13	Y	89.5	Confident	73.4	Confident	127 Å²	127	94.9 Å²	94.9	50%	0.498	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.7	-9.9	179	-53	-71.8	0	0	0	113.4	N11 G28 L30 H180	N11-Y13 PolarHBondContact O-N 3.36Å; N11-Y13 VanDerWaalsContact O-N 3.12Å; N11-Y13 WeakPolarHBondContact OD1-CB 3.46Å; N11-Y13 VanDerWaalsContact OD1-CD2 3.29Å; N11-Y13 WeakPolarHBondContact OD1-CD2 3.49Å; N11-Y13 PolarHBondContact OD1-N 3.08Å; Y13-G28 WeakPolarHBondContact O-CA 3.31Å; Y13-L30 HydrophobicContact CD1-CB 4.15Å; Y13-H180 AromaticContact CE1-CE1 3.8Å
14	A	93.8	Very high	76.5	Confident	40 Å²	40	91.6 Å²	91.6	33%	0.331	52%	0.521	S	S	.	.	S	Bend	trans	-83.4	141.2	177.4	0	0	0	0	0	110.7	N11 R187	N11-A14 HydrophobicContact CB-CB 4.09Å; N11-A14 PolarHBondContact O-N 3.41Å; A14-R187 PolarHBondContact O-NH2 3.05Å
15	A	95.3	Very high	79.5	Confident	58 Å²	58	89.6 Å²	89.6	48%	0.479	50%	0.502	S	S	.	.			trans	-63.7	151.1	165.7	0	0	0	0	0	110.5	I25 T26	A15-I25 HydrophobicContact CB-CG2 3.44Å; A15-I25 VanDerWaalsContact CB-CG2 3.44Å; A15-T26 CarbonylContact C-O 3.46Å; A15-T26 VanDerWaalsContact CA-O 3.3Å; A15-T26 WeakPolarHBondContact CA-O 3.47Å
16	V	96.6	Very high	82.5	Confident	39 Å²	39	85.7 Å²	85.7	24%	0.236	47%	0.469	C	S	.	.	B	Isolated β-bridge	trans	-130.4	115.7	-179.2	178	0	0	0	0	109.7	V18 T26 R187 I191	V16-V18 HydrophobicContact CG1-CG2 3.93Å; V16-T26 PolarHBondContact N-O 3.09Å; V16-T26 PolarHBondContact O-N 3.04Å; V16-R187 VanDerWaalsContact CG2-NH2 3.32Å; V16-I191 HydrophobicContact CB-CD1 4.23Å; V16-I191 HydrophobicContact CB-CG1 4.42Å; V16-I191 HydrophobicContact CG1-CD1 4.39Å; V16-I191 HydrophobicContact CG1-CG1 4.41Å; V16-I191 HydrophobicContact CG2-CD1 4.06Å
17	Q	96.4	Very high	85.5	Confident	84 Å²	84	80.6 Å²	80.6	39%	0.393	44%	0.438	S	S	.	.			trans	-85	118.1	165.9	-173.8	77.9	53.6	0	0	108.3	D19 S22 Y24	Q17-D19 PolarHBondContact NE2-O 3.32Å; Q17-S22 PolarHBondContact NE2-O 3.41Å; Q17-Y24 PolarHBondContact NE2-O 3.33Å
18	V	95.4	Very high	88.1	Confident	27 Å²	27	71.4 Å²	71.4	16%	0.164	40%	0.399	C	S	.	.			trans	-95.8	-51.4	179.4	176.9	0	0	0	0	111.8	V16 I191 Q194 E195 L198	V16-V18 HydrophobicContact CG1-CG2 3.93Å; V18-I191 HydrophobicContact CG2-CG2 4.13Å; V18-Q194 HydrophobicContact CB-CB 3.86Å; V18-Q194 HydrophobicContact CG1-CB 3.95Å; V18-Q194 HydrophobicContact CG2-CB 3.97Å; V18-E195 HydrophobicContact CG1-CB 4.23Å; V18-E195 HydrophobicContact CG1-CG 3.66Å; V18-L198 HydrophobicContact CG1-CD2 4.38Å; V18-L198 WeakPolarHBondContact O-CD2 3.4Å
19	D	94.1	Very high	90.6	Very high	19 Å²	19	66.2 Å²	66.2	10%	0.102	36%	0.363	C	S	.	.	S	Bend	trans	-99.4	112.2	174	-178.7	-3.7	0	0	0	108.7	Q17 D21 S22 L198 K201	Q17-D19 PolarHBondContact NE2-O 3.32Å; D19-D21 PolarHBondContact O-N 3.3Å; D19-D21 VanDerWaalsContact O-N 3.13Å; D19-D21 PolarHBondContact OD1-N 3.24Å; D19-S22 WeakPolarHBondContact O-CB 3.47Å; D19-S22 PolarHBondContact O-N 3.08Å; D19-L198 HydrophobicContact CB-CD1 4.08Å; D19-L198 HydrophobicContact CB-CD2 4.24Å; D19-L198 HydrophobicContact CB-CG 4.48Å; D19-K201 IonicContact OD1-NZ 3.93Å; D19-K201 IonicContact OD2-NZ 3.19Å; D19-K201 PolarHBondContact OD2-NZ 2.82Å
20	P	93.4	Very high	92.8	Very high	107 Å²	107	60 Å²	60	70%	0.695	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-22.2	178.4	-23.6	34.5	0	0	0	114.5
21	D	94.1	Very high	94	Very high	133 Å²	133	59.8 Å²	59.8	71%	0.711	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	0.8	-179.3	-53.8	-38.8	0	0	0	112.7	D19 K201	D19-D21 PolarHBondContact O-N 3.3Å; D19-D21 VanDerWaalsContact O-N 3.13Å; D19-D21 PolarHBondContact OD1-N 3.24Å; D21-K201 IonicContact OD2-NZ 3.8Å
22	S	93.3	Very high	94.5	Very high	36 Å²	36	55.4 Å²	55.4	25%	0.252	31%	0.308	S	S	.	.			trans	-97.8	138.5	178.6	179.9	0	0	0	0	111.3	Q17 D19 Y24	Q17-S22 PolarHBondContact NE2-O 3.41Å; D19-S22 WeakPolarHBondContact O-CB 3.47Å; D19-S22 PolarHBondContact O-N 3.08Å; S22-Y24 PolarHBondContact O-N 3.1Å; S22-Y24 PolarHBondContact OG-N 3.08Å
23	D	94.1	Very high	95	Very high	173 Å²	173	56.3 Å²	56.3	93%	0.925	31%	0.31	S	S	*	.	S	Bend	trans	-71.5	-13	172.9	-64	-37.1	0	0	0	112.9
24	Y	96.2	Very high	95.2	Very high	47 Å²	47	54 Å²	54	18%	0.184	30%	0.303	C	S	.	.			trans	-86.8	126.3	-178.2	178.5	-104.5	0	0	0	112.7	Q17 S22 T162 V164 D190 Q194	Q17-Y24 PolarHBondContact NE2-O 3.33Å; S22-Y24 PolarHBondContact O-N 3.1Å; S22-Y24 PolarHBondContact OG-N 3.08Å; Y24-T162 HydrophobicContact CD1-CG2 3.88Å; Y24-T162 HydrophobicContact CD2-CG2 3.77Å; Y24-T162 HydrophobicContact CE1-CG2 3.66Å; Y24-T162 HydrophobicContact CE2-CG2 3.55Å; Y24-T162 HydrophobicContact CG-CG2 3.93Å; Y24-T162 VanDerWaalsContact CZ-CB 3.47Å; Y24-T162 VanDerWaalsContact CZ-CG2 3.49Å; Y24-T162 WeakPolarHBondContact OH-CB 3.44Å; Y24-V164 HydrophobicContact CE2-CG2 4.43Å; Y24-D190 VanDerWaalsContact CE1-OD2 3.3Å; Y24-D190 WeakPolarHBondContact CE1-OD2 3.46Å; Y24-D190 PolarHBondContact OH-OD2 3.13Å; Y24-Q194 HydrophobicContact CD1-CG 4.21Å; Y24-Q194 HydrophobicContact CE1-CG 4.06Å
25	I	97.2	Very high	95.1	Very high	78 Å²	78	54.1 Å²	54.1	40%	0.4	30%	0.299	S	S	.	.			trans	-113.3	125.1	172.3	-65.2	164.7	0	0	0	108.2	A15 P27	A15-I25 HydrophobicContact CB-CG2 3.44Å; A15-I25 VanDerWaalsContact CB-CG2 3.44Å; I25-P27 WeakPolarHBondContact O-CD 3.27Å
26	T	97.5	Very high	94.9	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.006	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-66.5	118.9	172	-61.1	0	0	0	0	109.3	A15 V16 R187 D190 I191	A15-T26 CarbonylContact C-O 3.46Å; A15-T26 VanDerWaalsContact CA-O 3.3Å; A15-T26 WeakPolarHBondContact CA-O 3.47Å; V16-T26 PolarHBondContact N-O 3.09Å; V16-T26 PolarHBondContact O-N 3.04Å; T26-R187 HydrophobicContact CG2-CG 3.73Å; T26-D190 WeakPolarHBondContact CB-OD2 3.1Å; T26-D190 HydrophobicContact CG2-CB 4.18Å; T26-D190 WeakPolarHBondContact CG2-OD2 3.41Å; T26-D190 PolarHBondContact OG1-OD2 2.95Å; T26-I191 HydrophobicContact CG2-CD1 4.46Å; T26-I191 HydrophobicContact CG2-CG1 3.86Å
27	P	97.4	Very high	94.3	Very high	25 Å²	25	58.7 Å²	58.7	16%	0.162	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-67.3	165.5	-174.2	-21.5	33.6	0	0	0	114	I25 D31 L32 V164 R187	I25-P27 WeakPolarHBondContact O-CD 3.27Å; P27-D31 HydrophobicContact CB-CB 3.82Å; P27-L32 HydrophobicContact CB-CD2 4.06Å; P27-L32 HydrophobicContact CB-CG 4.31Å; P27-L32 HydrophobicContact CG-CD2 4Å; P27-V164 HydrophobicContact CG-CG2 3.56Å; P27-R187 WeakPolarHBondContact O-CD 3.12Å; P27-R187 PolarHBondContact O-NE 3.21Å
28	G	96.7	Very high	93.3	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-66.4	156.8	166.7	0	0	0	0	0	111.2	Y13 L30 D31 L32	Y13-G28 WeakPolarHBondContact O-CA 3.31Å; G28-L30 PolarHBondContact O-N 3.19Å; G28-D31 PolarHBondContact N-OD2 2.94Å; G28-D31 VanDerWaalsContact N-OD2 3.09Å; G28-D31 WeakPolarHBondContact O-CB 3.34Å; G28-D31 PolarHBondContact O-N 3.07Å; G28-D31 VanDerWaalsContact O-N 3.13Å; G28-L32 PolarHBondContact O-N 3.48Å; G28-L32 VanDerWaalsContact O-N 3.1Å
29	T	94.8	Very high	91.9	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61.4	-34	179.4	-49.2	0	0	0	0	111.9	P12 L32 E33 H180 L183 K184	P12-T29 WeakPolarHBondContact O-CB 3.5Å; P12-T29 PolarHBondContact O-N 2.92Å; P12-T29 PolarHBondContact O-OG1 3.27Å; T29-L32 PolarHBondContact O-N 3.48Å; T29-E33 PolarHBondContact O-N 2.88Å; T29-H180 WeakPolarHBondContact CG2-CE1 3.47Å; T29-L183 HydrophobicContact CG2-CB 4.06Å; T29-K184 HydrophobicContact CG2-CB 4.18Å
30	L	94.2	Very high	91	Very high	72 Å²	72	62.7 Å²	62.7	38%	0.377	34%	0.34	S	S	.	.	H	α-helix	trans	-64.4	-44.5	175.6	-176.7	65.6	0	0	0	110.9	Y13 G28 L32 E33 Q34 W37	Y13-L30 HydrophobicContact CD1-CB 4.15Å; G28-L30 PolarHBondContact O-N 3.19Å; L30-L32 VanDerWaalsContact C-N 3.27Å; L30-L32 PolarHBondContact O-N 3.14Å; L30-E33 WeakPolarHBondContact O-CA 3.46Å; L30-E33 VanDerWaalsContact O-CB 3.31Å; L30-E33 WeakPolarHBondContact O-CB 3.49Å; L30-E33 PolarHBondContact O-N 3.24Å; L30-Q34 WeakPolarHBondContact O-CG 3.32Å; L30-Q34 PolarHBondContact O-N 3.3Å; L30-W37 HydrophobicContact CD1-CH2 4.36Å
31	D	95.3	Very high	90.2	Very high	68 Å²	68	64.4 Å²	64.4	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-59.4	-40.3	178.2	-53.5	-37.4	0	0	0	111.3	P27 G28 E33 Q34 L35	P27-D31 HydrophobicContact CB-CB 3.82Å; G28-D31 PolarHBondContact N-OD2 2.94Å; G28-D31 VanDerWaalsContact N-OD2 3.09Å; G28-D31 WeakPolarHBondContact O-CB 3.34Å; G28-D31 PolarHBondContact O-N 3.07Å; G28-D31 VanDerWaalsContact O-N 3.13Å; D31-E33 VanDerWaalsContact C-N 3.29Å; D31-E33 PolarHBondContact O-N 3.2Å; D31-Q34 WeakPolarHBondContact O-CB 3.46Å; D31-Q34 PolarHBondContact O-N 2.78Å; D31-Q34 VanDerWaalsContact O-N 3.09Å; D31-L35 PolarHBondContact O-N 3.06Å
32	L	95.8	Very high	89.7	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-61.7	-35.2	173.5	-63.9	179.5	0	0	0	112.6	P27 G28 T29 L30 Q34 L35 F36 V163 V164 I167 R187	P27-L32 HydrophobicContact CB-CD2 4.06Å; P27-L32 HydrophobicContact CB-CG 4.31Å; P27-L32 HydrophobicContact CG-CD2 4Å; G28-L32 PolarHBondContact O-N 3.48Å; G28-L32 VanDerWaalsContact O-N 3.1Å; T29-L32 PolarHBondContact O-N 3.48Å; L30-L32 VanDerWaalsContact C-N 3.27Å; L30-L32 PolarHBondContact O-N 3.14Å; L32-Q34 VanDerWaalsContact C-N 3.33Å; L32-L35 HydrophobicContact CD2-CD1 4.12Å; L32-L35 WeakPolarHBondContact O-CB 3.39Å; L32-F36 WeakPolarHBondContact O-CD2 3.46Å; L32-F36 VanDerWaalsContact O-CE2 3.32Å; L32-F36 WeakPolarHBondContact O-CE2 3.49Å; L32-V163 HydrophobicContact CD1-CG1 4.3Å; L32-V163 HydrophobicContact CD1-CG2 4.17Å; L32-V163 HydrophobicContact CD2-CG1 3.89Å; L32-V163 HydrophobicContact CD2-CG2 4.35Å; L32-V164 HydrophobicContact CD2-CG2 4.14Å; L32-I167 HydrophobicContact CD2-CD1 4.3Å; L32-R187 HydrophobicContact CD1-CB 3.92Å; L32-R187 HydrophobicContact CD1-CG 4.38Å
33	E	94.1	Very high	89	Confident	48 Å²	48	60.8 Å²	60.8	22%	0.224	33%	0.333	C	S	.	.	H	α-helix	trans	-67.5	-35.6	173.5	-69.3	-178.4	157.6	0	0	112.1	T29 L30 D31 L35 F36 H180 L183	T29-E33 PolarHBondContact O-N 2.88Å; L30-E33 WeakPolarHBondContact O-CA 3.46Å; L30-E33 VanDerWaalsContact O-CB 3.31Å; L30-E33 WeakPolarHBondContact O-CB 3.49Å; L30-E33 PolarHBondContact O-N 3.24Å; D31-E33 VanDerWaalsContact C-N 3.29Å; D31-E33 PolarHBondContact O-N 3.2Å; E33-L35 PolarHBondContact O-N 2.95Å; E33-F36 PolarHBondContact O-N 3.37Å; E33-F36 VanDerWaalsContact O-N 3.07Å; E33-H180 VanDerWaalsContact CD-ND1 3.34Å; E33-H180 WeakPolarHBondContact OE1-CB 3.38Å; E33-H180 IonicContact OE1-CE1 3.18Å; E33-H180 IonicContact OE1-CG 3.54Å; E33-H180 VanDerWaalsContact OE1-CG 3.25Å; E33-H180 IonicContact OE1-ND1 2.74Å; E33-H180 PolarHBondContact OE1-ND1 2.81Å; E33-H180 IonicContact OE2-ND1 3.99Å; E33-L183 HydrophobicContact CB-CD1 4.47Å; E33-L183 HydrophobicContact CG-CD1 3.5Å; E33-L183 VanDerWaalsContact CG-CD1 3.5Å
34	Q	93.8	Very high	88.4	Confident	78 Å²	78	59.2 Å²	59.2	36%	0.364	32%	0.315	S	S	.	.	H	α-helix	trans	-64.9	-26.7	-179.1	-46	-162.5	-16.2	0	0	112.5	L30 D31 L32 F36 W37	L30-Q34 WeakPolarHBondContact O-CG 3.32Å; L30-Q34 PolarHBondContact O-N 3.3Å; D31-Q34 WeakPolarHBondContact O-CB 3.46Å; D31-Q34 PolarHBondContact O-N 2.78Å; D31-Q34 VanDerWaalsContact O-N 3.09Å; L32-Q34 VanDerWaalsContact C-N 3.33Å; Q34-F36 PolarHBondContact O-N 2.98Å; Q34-F36 VanDerWaalsContact O-N 3.09Å; Q34-W37 HydrophobicContact CB-CD2 4.09Å; Q34-W37 HydrophobicContact CB-CE3 3.61Å; Q34-W37 HydrophobicContact CB-CH2 4.38Å; Q34-W37 HydrophobicContact CB-CZ3 3.8Å; Q34-W37 HydrophobicContact CG-CD2 4.29Å; Q34-W37 HydrophobicContact CG-CE3 3.65Å; Q34-W37 HydrophobicContact CG-CH2 3.56Å; Q34-W37 HydrophobicContact CG-CZ2 4.17Å; Q34-W37 HydrophobicContact CG-CZ3 3.26Å; Q34-W37 WeakPolarHBondContact O-CB 3.44Å; Q34-W37 PolarHBondContact O-N 3.4Å
35	L	92.3	Very high	88.3	Confident	44 Å²	44	59.8 Å²	59.8	23%	0.23	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-25.9	173.9	-61.4	178.3	0	0	0	112.5	D31 L32 E33 T38 V164 I167 Q171	D31-L35 PolarHBondContact O-N 3.06Å; L32-L35 HydrophobicContact CD2-CD1 4.12Å; L32-L35 WeakPolarHBondContact O-CB 3.39Å; E33-L35 PolarHBondContact O-N 2.95Å; L35-T38 PolarHBondContact O-OG1 3.43Å; L35-V164 HydrophobicContact CD1-CG1 4.24Å; L35-V164 HydrophobicContact CD1-CG2 4.48Å; L35-I167 HydrophobicContact CB-CG2 4.33Å; L35-I167 HydrophobicContact CD1-CB 4.49Å; L35-I167 HydrophobicContact CD1-CD1 4.32Å; L35-I167 HydrophobicContact CD1-CG2 4.12Å; L35-Q171 PolarHBondContact O-NE2 3.37Å; L35-Q171 PolarHBondContact O-OE1 3.02Å
36	F	90.4	Very high	88.3	Confident	23 Å²	23	59.7 Å²	59.7	10%	0.101	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-11.2	178.2	-55.8	-75.1	0	0	0	113.9	L32 E33 Q34 I167 I176 L177 L183	L32-F36 WeakPolarHBondContact O-CD2 3.46Å; L32-F36 VanDerWaalsContact O-CE2 3.32Å; L32-F36 WeakPolarHBondContact O-CE2 3.49Å; E33-F36 PolarHBondContact O-N 3.37Å; E33-F36 VanDerWaalsContact O-N 3.07Å; Q34-F36 PolarHBondContact O-N 2.98Å; Q34-F36 VanDerWaalsContact O-N 3.09Å; F36-I167 HydrophobicContact CE1-CG2 3.68Å; F36-I167 HydrophobicContact CE2-CD1 4.44Å; F36-I167 HydrophobicContact CE2-CG2 4.31Å; F36-I167 HydrophobicContact CZ-CB 4.49Å; F36-I167 HydrophobicContact CZ-CD1 4.14Å; F36-I167 HydrophobicContact CZ-CG1 4.18Å; F36-I167 HydrophobicContact CZ-CG2 3.51Å; F36-I176 WeakPolarHBondContact CD1-O 3.4Å; F36-I176 HydrophobicContact CE1-CD1 4.18Å; F36-I176 HydrophobicContact CE1-CG1 4.05Å; F36-L177 HydrophobicContact CB-CD1 3.58Å; F36-L177 HydrophobicContact CD1-CD1 4.13Å; F36-L177 HydrophobicContact CD2-CD1 3.73Å; F36-L177 HydrophobicContact CE2-CD1 4.47Å; F36-L177 HydrophobicContact CG-CD1 3.53Å; F36-L183 HydrophobicContact CE2-CD1 4.06Å; F36-L183 HydrophobicContact CE2-CD2 3.91Å; F36-L183 HydrophobicContact CZ-CD2 4.28Å
37	W	84.9	Confident	88.3	Confident	169 Å²	169	60.7 Å²	60.7	64%	0.64	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-25.3	-176.2	-64	-15.3	0	0	0	114	L30 Q34 G39	L30-W37 HydrophobicContact CD1-CH2 4.36Å; Q34-W37 HydrophobicContact CB-CD2 4.09Å; Q34-W37 HydrophobicContact CB-CE3 3.61Å; Q34-W37 HydrophobicContact CB-CH2 4.38Å; Q34-W37 HydrophobicContact CB-CZ3 3.8Å; Q34-W37 HydrophobicContact CG-CD2 4.29Å; Q34-W37 HydrophobicContact CG-CE3 3.65Å; Q34-W37 HydrophobicContact CG-CH2 3.56Å; Q34-W37 HydrophobicContact CG-CZ2 4.17Å; Q34-W37 HydrophobicContact CG-CZ3 3.26Å; Q34-W37 WeakPolarHBondContact O-CB 3.44Å; Q34-W37 PolarHBondContact O-N 3.4Å; W37-G39 PolarHBondContact O-N 3.48Å; W37-G39 VanDerWaalsContact O-N 3.1Å
38	T	75.1	Confident	88.3	Confident	126 Å²	126	60.5 Å²	60.5	77%	0.773	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-5.4	176.8	52.3	0	0	0	0	112.8	L35	L35-T38 PolarHBondContact O-OG1 3.43Å
39	G	66.1	Low	88.4	Confident	45 Å²	45	64.9 Å²	64.9	46%	0.464	35%	0.345	S	S	.	.			trans	75.4	153.5	-177.1	0	0	0	0	0	111.5	W37	W37-G39 PolarHBondContact O-N 3.48Å; W37-G39 VanDerWaalsContact O-N 3.1Å
40	T	74.6	Confident	88.5	Confident	44 Å²	44	65 Å²	65	27%	0.27	35%	0.345	S	S	.	.			trans	-100.2	143.6	169.3	-179.5	0	0	0	0	109.9	A42 Q171 C175	T40-A42 VanDerWaalsContact C-N 3.27Å; T40-A42 HydrophobicContact CG2-CB 4.34Å; T40-A42 WeakPolarHBondContact OG1-CB 3.3Å; T40-A42 PolarHBondContact OG1-N 2.96Å; T40-Q171 PolarHBondContact OG1-O 3.37Å; T40-C175 HydrophobicContact CG2-CB 3.55Å; T40-C175 VanDerWaalsContact CG2-SG 3.59Å
41	T	77.3	Confident	88.7	Confident	142 Å²	142	64.1 Å²	64.1	87%	0.871	34%	0.337	S	S	*	.			trans	-84.9	-5.1	167.3	55.7	0	0	0	0	112.2
42	A	82.5	Confident	88.9	Confident	12 Å²	12	64.7 Å²	64.7	10%	0.099	35%	0.345	C	S	.	.	S	Bend	trans	-64.8	136.7	-179.4	0	0	0	0	0	111	T40	T40-A42 VanDerWaalsContact C-N 3.27Å; T40-A42 HydrophobicContact CG2-CB 4.34Å; T40-A42 WeakPolarHBondContact OG1-CB 3.3Å; T40-A42 PolarHBondContact OG1-N 2.96Å
43	P	78.6	Confident	89	Confident	82 Å²	82	68 Å²	68	53%	0.532	36%	0.357	S	S	.	.			trans	-64.6	140.3	178.1	28.5	-34.6	0	0	0	110.5	T45	P43-T45 HydrophobicContact CB-CG2 4.26Å; P43-T45 PolarHBondContact O-N 3.13Å; P43-T45 VanDerWaalsContact O-N 3.15Å
44	Y	81.6	Confident	89.2	Confident	140 Å²	140	65.7 Å²	65.7	55%	0.549	35%	0.347	S	S	.	.			trans	-82	91.6	174.4	-166.6	-92.1	0	0	0	109.8	M142 C175	Y44-M142 VanDerWaalsContact OH-CE 3.29Å; Y44-M142 WeakPolarHBondContact OH-CE 3.34Å; Y44-C175 HydrophobicContact CD2-CB 4.22Å
45	T	93.9	Very high	89.5	Confident	58 Å²	58	63 Å²	63	36%	0.356	33%	0.333	S	S	.	.			trans	-117.6	163.2	177	56.7	0	0	0	0	111.1	P43 V47 N48 R174	P43-T45 HydrophobicContact CB-CG2 4.26Å; P43-T45 PolarHBondContact O-N 3.13Å; P43-T45 VanDerWaalsContact O-N 3.15Å; T45-V47 VanDerWaalsContact C-N 3.26Å; T45-V47 PolarHBondContact O-N 3.11Å; T45-V47 PolarHBondContact OG1-O 2.64Å; T45-N48 VanDerWaalsContact OG1-CG 3.25Å; T45-N48 PolarHBondContact OG1-ND2 3.25Å; T45-N48 PolarHBondContact OG1-OD1 3.11Å; T45-R174 PolarHBondContact O-NH1 3.18Å
46	H	97.1	Very high	89.8	Confident	77 Å²	77	61 Å²	61	36%	0.356	32%	0.322	S	S	.	.	S	Bend	trans	-57.9	-41	177.9	-67.9	-58.9	0	0	0	111.8	G57 D58 K60 T61 R174	H46-G57 CarbonylContact O-C 3.59Å; H46-G57 VanDerWaalsContact O-CA 3.31Å; H46-G57 WeakPolarHBondContact O-CA 3.34Å; H46-D58 IonicContact CE1-OD2 3.42Å; H46-D58 IonicContact CG-OD1 3.25Å; H46-D58 IonicContact CG-OD2 2.63Å; H46-D58 IonicContact ND1-OD1 3.79Å; H46-D58 IonicContact ND1-OD2 3.79Å; H46-D58 PolarHBondContact ND1-OD2 3.5Å; H46-D58 PolarHBondContact O-N 2.98Å; H46-K60 WeakPolarHBondContact CE1-CD 3.38Å; H46-K60 WeakPolarHBondContact NE2-CD 3.42Å; H46-K60 PolarHBondContact NE2-NZ 3.13Å; H46-T61 VanDerWaalsContact C-OG1 3.29Å; H46-T61 WeakPolarHBondContact CB-OG1 3.39Å; H46-T61 PolarHBondContact O-OG1 3.18Å; H46-R174 PolarHBondContact O-NH1 3.2Å; H46-R174 PolarHBondContact O-NH2 3.2Å; H46-R174 VanDerWaalsContact O-NH2 3.08Å
47	V	97.9	Very high	90.1	Very high	22 Å²	22	59.9 Å²	59.9	13%	0.133	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	147.5	178.7	63.6	0	0	0	0	112	T45 Y55 I56 T61 L71 L137	T45-V47 VanDerWaalsContact C-N 3.26Å; T45-V47 PolarHBondContact O-N 3.11Å; T45-V47 PolarHBondContact OG1-O 2.64Å; V47-Y55 HydrophobicContact CG2-CD1 4.12Å; V47-Y55 HydrophobicContact CG2-CG 4.44Å; V47-I56 WeakPolarHBondContact CA-O 3.3Å; V47-T61 HydrophobicContact CB-CG2 3.64Å; V47-T61 HydrophobicContact CG1-CG2 4.03Å; V47-T61 HydrophobicContact CG2-CG2 3.97Å; V47-L71 HydrophobicContact CG1-CD1 4.21Å; V47-L137 HydrophobicContact CG2-CD1 4.16Å
48	N	97.8	Very high	90.8	Very high	21 Å²	21	52.7 Å²	52.7	11%	0.112	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	143.6	169.8	-57.6	94.4	0	0	0	110.4	T45 V50 Y55 I56 K173 R174	T45-N48 VanDerWaalsContact OG1-CG 3.25Å; T45-N48 PolarHBondContact OG1-ND2 3.25Å; T45-N48 PolarHBondContact OG1-OD1 3.11Å; N48-V50 HydrophobicContact CB-CG1 4.35Å; N48-V50 PolarHBondContact O-N 3.01Å; N48-Y55 CarbonylContact O-C 3.58Å; N48-Y55 VanDerWaalsContact O-CA 3.29Å; N48-Y55 WeakPolarHBondContact O-CA 3.18Å; N48-I56 PolarHBondContact N-O 2.71Å; N48-I56 PolarHBondContact O-N 3.4Å; N48-K173 WeakPolarHBondContact CB-O 3.4Å; N48-K173 VanDerWaalsContact CG-O 3.28Å; N48-K173 PolarHBondContact ND2-O 2.82Å; N48-R174 HydrophobicContact CB-CB 4.06Å; N48-R174 HydrophobicContact CB-CG 4.45Å; N48-R174 WeakPolarHBondContact OD1-CG 3.35Å; N48-R174 PolarHBondContact OD1-NH1 2.87Å
49	Q	97.9	Very high	91.8	Very high	91 Å²	91	50 Å²	50	43%	0.425	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	116.8	164.2	-168.6	179.2	-14.6	0	0	109.1	W51 R53 I54 Y55	Q49-W51 WeakPolarHBondContact CG-O 3.43Å; Q49-W51 PolarHBondContact NE2-O 3Å; Q49-R53 VanDerWaalsContact NE2-N 3.1Å; Q49-I54 WeakPolarHBondContact CA-O 3.32Å; Q49-Y55 HydrophobicContact CB-CD1 3.8Å; Q49-Y55 HydrophobicContact CB-CE1 3.57Å; Q49-Y55 HydrophobicContact CG-CD1 4.32Å; Q49-Y55 HydrophobicContact CG-CE1 3.99Å; Q49-Y55 HydrophobicContact CG-CE2 4.45Å; Q49-Y55 PolarHBondContact OE1-OH 3Å
50	V	97.9	Very high	93.3	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.012	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-14.3	-175.8	-58.8	0	0	0	0	113.2	N48 I54 I56 V151 H169 V170 K173 R174	N48-V50 HydrophobicContact CB-CG1 4.35Å; N48-V50 PolarHBondContact O-N 3.01Å; V50-I54 HydrophobicContact CG2-CG2 4.41Å; V50-I54 PolarHBondContact N-O 3.21Å; V50-I56 HydrophobicContact CB-CD1 4.42Å; V50-I56 HydrophobicContact CG1-CB 4.25Å; V50-I56 HydrophobicContact CG1-CD1 4.04Å; V50-I56 HydrophobicContact CG1-CG1 4.16Å; V50-I56 HydrophobicContact CG2-CD1 3.78Å; V50-I56 HydrophobicContact CG2-CG1 3.73Å; V50-V151 HydrophobicContact CG2-CG1 3.98Å; V50-H169 PolarHBondContact O-CD2 2.78Å; V50-H169 VanDerWaalsContact O-CD2 3.25Å; V50-H169 PolarHBondContact O-NE2 3.27Å; V50-V170 HydrophobicContact CB-CG1 4.13Å; V50-V170 HydrophobicContact CB-CG2 4.5Å; V50-V170 HydrophobicContact CG1-CG1 4.1Å; V50-K173 HydrophobicContact CB-CB 4.28Å; V50-K173 HydrophobicContact CG1-CB 4.05Å; V50-R174 HydrophobicContact CG1-CB 3.87Å
51	W	98.4	Very high	94.4	Very high	54 Å²	54	50.6 Å²	50.6	21%	0.205	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	158.5	172.9	-172.3	-97	0	0	0	108.1	Q49 R53 I54 L155 H159 H169	Q49-W51 WeakPolarHBondContact CG-O 3.43Å; Q49-W51 PolarHBondContact NE2-O 3Å; W51-R53 PolarHBondContact O-N 2.63Å; W51-I54 HydrophobicContact CB-CB 3.99Å; W51-I54 HydrophobicContact CB-CD1 3.95Å; W51-I54 HydrophobicContact CB-CG1 4.14Å; W51-I54 HydrophobicContact CG-CD1 4.04Å; W51-I54 PolarHBondContact N-O 3.34Å; W51-I54 PolarHBondContact O-N 2.8Å; W51-L155 HydrophobicContact CB-CD2 4.36Å; W51-L155 HydrophobicContact CD2-CD2 3.52Å; W51-L155 HydrophobicContact CE3-CD1 4.35Å; W51-L155 HydrophobicContact CE3-CD2 3.6Å; W51-L155 HydrophobicContact CG-CD2 3.86Å; W51-L155 HydrophobicContact CZ2-CD2 4.49Å; W51-L155 HydrophobicContact CZ3-CD2 4.13Å; W51-H159 AromaticContact CE2-CE1 4Å; W51-H159 HydrophobicContact CH2-CB 4.46Å; W51-H159 HydrophobicContact CZ2-CB 4.37Å; W51-H159 AromaticContact CZ2-CE1 3.81Å; W51-H159 AromaticContact CZ2-CG 3.72Å; W51-H159 AromaticContact CZ2-ND1 3.44Å; W51-H159 WeakPolarHBondContact CZ2-ND1 3.27Å; W51-H159 AromaticContact NE1-CE1 3.74Å; W51-H159 AromaticContact NE1-NE2 3.8Å; W51-H169 AromaticContact CE3-CD2 3.74Å; W51-H169 AromaticContact CE3-CE1 3.73Å; W51-H169 AromaticContact CE3-NE2 3.3Å; W51-H169 VanDerWaalsContact CE3-NE2 3.3Å; W51-H169 AromaticContact CZ3-CE1 3.55Å; W51-H169 AromaticContact CZ3-ND1 3.95Å; W51-H169 AromaticContact CZ3-NE2 3.63Å
52	P	98.3	Very high	95.4	Very high	80 Å²	80	43.9 Å²	43.9	52%	0.519	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.3	114.4	172.9	-34.2	37.6	0	0	0	113	I54	P52-I54 PolarHBondContact O-N 2.76Å
53	R	98.5	Very high	96	Very high	70 Å²	70	46.2 Å²	46.2	26%	0.264	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	14	179.8	-52	178.6	-66.2	139.4	-8.9	115.9	Q49 W51 L129 Q131 P132 N134 K135 V136	Q49-R53 VanDerWaalsContact NE2-N 3.1Å; W51-R53 PolarHBondContact O-N 2.63Å; R53-L129 HydrophobicContact CB-CD2 3.73Å; R53-L129 PolarHBondContact NH2-O 3.42Å; R53-Q131 PolarHBondContact NH1-O 3.39Å; R53-P132 WeakPolarHBondContact CD-O 3.49Å; R53-P132 PolarHBondContact NH1-O 3.31Å; R53-P132 VanDerWaalsContact NH1-O 3.13Å; R53-N134 WeakPolarHBondContact CD-O 3.45Å; R53-N134 PolarHBondContact NH1-O 3.2Å; R53-K135 HydrophobicContact CB-CG 4.22Å; R53-K135 HydrophobicContact CG-CG 4.44Å; R53-K135 WeakPolarHBondContact O-CA 3.2Å; R53-V136 PolarHBondContact O-N 3.31Å
54	I	98.8	Very high	96.9	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	125.7	172.8	-49.5	179.6	0	0	0	109.5	Q49 V50 W51 P52 I125 L129 V136 V138 V151 Y154	Q49-I54 WeakPolarHBondContact CA-O 3.32Å; V50-I54 HydrophobicContact CG2-CG2 4.41Å; V50-I54 PolarHBondContact N-O 3.21Å; W51-I54 HydrophobicContact CB-CB 3.99Å; W51-I54 HydrophobicContact CB-CD1 3.95Å; W51-I54 HydrophobicContact CB-CG1 4.14Å; W51-I54 HydrophobicContact CG-CD1 4.04Å; W51-I54 PolarHBondContact N-O 3.34Å; W51-I54 PolarHBondContact O-N 2.8Å; P52-I54 PolarHBondContact O-N 2.76Å; I54-I125 HydrophobicContact CD1-CG2 3.82Å; I54-I125 HydrophobicContact CG1-CG2 4.42Å; I54-L129 HydrophobicContact CD1-CD1 3.7Å; I54-L129 HydrophobicContact CG1-CD1 3.76Å; I54-V136 WeakPolarHBondContact CA-O 3.44Å; I54-V138 HydrophobicContact CG2-CG2 4.37Å; I54-V151 HydrophobicContact CG2-CG1 4.42Å; I54-V151 HydrophobicContact CG2-CG2 4.21Å; I54-Y154 HydrophobicContact CD1-CD1 3.82Å; I54-Y154 HydrophobicContact CD1-CE1 3.3Å
55	Y	98.8	Very high	97.6	Very high	22 Å²	22	43.1 Å²	43.1	9%	0.086	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	138.8	179.8	-61.4	-98.9	0	0	0	109.6	V47 N48 Q49 L71 K135 V136 V138	V47-Y55 HydrophobicContact CG2-CD1 4.12Å; V47-Y55 HydrophobicContact CG2-CG 4.44Å; N48-Y55 CarbonylContact O-C 3.58Å; N48-Y55 VanDerWaalsContact O-CA 3.29Å; N48-Y55 WeakPolarHBondContact O-CA 3.18Å; Q49-Y55 HydrophobicContact CB-CD1 3.8Å; Q49-Y55 HydrophobicContact CB-CE1 3.57Å; Q49-Y55 HydrophobicContact CG-CD1 4.32Å; Q49-Y55 HydrophobicContact CG-CE1 3.99Å; Q49-Y55 HydrophobicContact CG-CE2 4.45Å; Q49-Y55 PolarHBondContact OE1-OH 3Å; Y55-L71 HydrophobicContact CE1-CD2 4.37Å; Y55-K135 HydrophobicContact CE2-CB 4.11Å; Y55-K135 HydrophobicContact CE2-CD 4Å; Y55-K135 HydrophobicContact CE2-CG 4.34Å; Y55-V136 PolarHBondContact N-O 2.98Å; Y55-V138 PolarHBondContact O-N 3.23Å
56	I	98.8	Very high	97.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126.1	163.6	-63.3	175.1	0	0	0	108.1	V47 N48 V50 V138 G143 A148 V151 V170	V47-I56 WeakPolarHBondContact CA-O 3.3Å; N48-I56 PolarHBondContact N-O 2.71Å; N48-I56 PolarHBondContact O-N 3.4Å; V50-I56 HydrophobicContact CB-CD1 4.42Å; V50-I56 HydrophobicContact CG1-CB 4.25Å; V50-I56 HydrophobicContact CG1-CD1 4.04Å; V50-I56 HydrophobicContact CG1-CG1 4.16Å; V50-I56 HydrophobicContact CG2-CD1 3.78Å; V50-I56 HydrophobicContact CG2-CG1 3.73Å; I56-V138 VanDerWaalsContact CA-O 3.3Å; I56-V138 WeakPolarHBondContact CA-O 3.32Å; I56-G143 VanDerWaalsContact CG2-O 3.23Å; I56-G143 WeakPolarHBondContact CG2-O 3.34Å; I56-A148 HydrophobicContact CD1-CB 4.37Å; I56-V151 HydrophobicContact CD1-CB 3.97Å; I56-V151 HydrophobicContact CD1-CG1 4.18Å; I56-V151 HydrophobicContact CD1-CG2 3.92Å; I56-V151 HydrophobicContact CG1-CB 4.39Å; I56-V151 HydrophobicContact CG1-CG2 3.8Å; I56-V170 HydrophobicContact CD1-CG1 3.84Å
57	G	98.1	Very high	97.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	172.5	179.1	0	0	0	0	0	113.7	H46 V138 H139 G143	H46-G57 CarbonylContact O-C 3.59Å; H46-G57 VanDerWaalsContact O-CA 3.31Å; H46-G57 WeakPolarHBondContact O-CA 3.34Å; G57-V138 PolarHBondContact N-O 3.12Å; G57-H139 VanDerWaalsContact O-CA 3.31Å; G57-H139 WeakPolarHBondContact O-CA 3.38Å; G57-H139 WeakPolarHBondContact O-CB 3.34Å; G57-G143 WeakPolarHBondContact O-CA 3.32Å
58	D	97.9	Very high	97.7	Very high	18 Å²	18	42.5 Å²	42.5	10%	0.096	21%	0.205	C	C	.	.			trans	-99.6	-179	171.9	66.4	4.4	0	0	0	112.1	H46 K60 T61 A62 C140 V141	H46-D58 IonicContact CE1-OD2 3.42Å; H46-D58 IonicContact CG-OD1 3.25Å; H46-D58 IonicContact CG-OD2 2.63Å; H46-D58 IonicContact ND1-OD1 3.79Å; H46-D58 IonicContact ND1-OD2 3.79Å; H46-D58 PolarHBondContact ND1-OD2 3.5Å; H46-D58 PolarHBondContact O-N 2.98Å; D58-K60 VanDerWaalsContact C-N 3.29Å; D58-K60 PolarHBondContact O-N 2.87Å; D58-K60 PolarHBondContact OD1-N 3.37Å; D58-T61 WeakPolarHBondContact O-CB 3.21Å; D58-T61 PolarHBondContact O-N 2.82Å; D58-T61 PolarHBondContact OD1-N 3.44Å; D58-T61 PolarHBondContact OD1-OG1 2.89Å; D58-A62 PolarHBondContact O-N 3.28Å; D58-C140 CarbonylContact C-O 3.46Å; D58-V141 WeakPolarHBondContact CB-O 3.38Å
59	E	97.7	Very high	97.6	Very high	71 Å²	71	48.6 Å²	48.6	33%	0.332	23%	0.23	S	C	.	.	H	α-helix	trans	-58.2	-41	178.4	174.3	172.2	-146.1	0	0	112.1	T61 A62 L63 V87 C140 V141	E59-T61 VanDerWaalsContact C-N 3.33Å; E59-T61 PolarHBondContact O-N 2.94Å; E59-A62 PolarHBondContact O-N 3.36Å; E59-A62 VanDerWaalsContact O-N 3.11Å; E59-L63 HydrophobicContact CG-CD1 3.7Å; E59-L63 HydrophobicContact CG-CG 4.24Å; E59-L63 WeakPolarHBondContact O-CG 3.42Å; E59-L63 PolarHBondContact O-N 3.3Å; E59-V87 HydrophobicContact CB-CG2 3.79Å; E59-V87 HydrophobicContact CG-CG1 3.99Å; E59-V87 HydrophobicContact CG-CG2 3.76Å; E59-C140 PolarHBondContact N-O 2.93Å; E59-V141 PolarHBondContact N-O 2.88Å
60	K	97.2	Very high	97.5	Very high	101 Å²	101	51.1 Å²	51.1	44%	0.439	25%	0.247	S	C	.	.	H	α-helix	trans	-58.5	-48.5	179.1	-176.1	-174.6	171.5	-176.5	0	110.5	H46 D58 A62 L63 E64	H46-K60 WeakPolarHBondContact CE1-CD 3.38Å; H46-K60 WeakPolarHBondContact NE2-CD 3.42Å; H46-K60 PolarHBondContact NE2-NZ 3.13Å; D58-K60 VanDerWaalsContact C-N 3.29Å; D58-K60 PolarHBondContact O-N 2.87Å; D58-K60 PolarHBondContact OD1-N 3.37Å; K60-A62 VanDerWaalsContact C-N 3.26Å; K60-A62 PolarHBondContact O-N 3.43Å; K60-L63 PolarHBondContact O-N 2.92Å; K60-L63 VanDerWaalsContact O-N 3.14Å; K60-E64 HydrophobicContact CG-CG 4.25Å; K60-E64 WeakPolarHBondContact O-CG 3.36Å; K60-E64 PolarHBondContact O-N 3.25Å
61	T	97.4	Very high	97.5	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-55.4	-43.4	176.5	-47.4	0	0	0	0	111.5	H46 V47 D58 E59 L63 E64 L68 L137	H46-T61 VanDerWaalsContact C-OG1 3.29Å; H46-T61 WeakPolarHBondContact CB-OG1 3.39Å; H46-T61 PolarHBondContact O-OG1 3.18Å; V47-T61 HydrophobicContact CB-CG2 3.64Å; V47-T61 HydrophobicContact CG1-CG2 4.03Å; V47-T61 HydrophobicContact CG2-CG2 3.97Å; D58-T61 WeakPolarHBondContact O-CB 3.21Å; D58-T61 PolarHBondContact O-N 2.82Å; D58-T61 PolarHBondContact OD1-N 3.44Å; D58-T61 PolarHBondContact OD1-OG1 2.89Å; E59-T61 VanDerWaalsContact C-N 3.33Å; E59-T61 PolarHBondContact O-N 2.94Å; T61-L63 VanDerWaalsContact C-N 3.32Å; T61-L63 PolarHBondContact O-N 3.23Å; T61-E64 PolarHBondContact O-N 2.72Å; T61-L68 HydrophobicContact CG2-CD2 4.38Å; T61-L68 WeakPolarHBondContact O-CD2 3.22Å; T61-L137 HydrophobicContact CG2-CD1 4.41Å; T61-L137 HydrophobicContact CG2-CD2 4.19Å
62	A	97.3	Very high	97.4	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-68.4	-30.2	-178.5	0	0	0	0	0	113.3	D58 E59 K60 Y94 H139	D58-A62 PolarHBondContact O-N 3.28Å; E59-A62 PolarHBondContact O-N 3.36Å; E59-A62 VanDerWaalsContact O-N 3.11Å; K60-A62 VanDerWaalsContact C-N 3.26Å; K60-A62 PolarHBondContact O-N 3.43Å; A62-Y94 WeakPolarHBondContact O-CE1 3.49Å; A62-Y94 PolarHBondContact O-OH 2.86Å; A62-H139 HydrophobicContact CB-CB 4.47Å; A62-H139 VanDerWaalsContact CB-CE1 3.44Å; A62-H139 WeakPolarHBondContact CB-CE1 3.37Å
63	L	96.8	Very high	97.4	Very high	61 Å²	61	48.5 Å²	48.5	32%	0.319	24%	0.239	S	C	.	.	H	α-helix	trans	-85.8	-19.6	178.2	-64	175.1	0	0	0	113	E59 K60 T61 R65 T89 Y93	E59-L63 HydrophobicContact CG-CD1 3.7Å; E59-L63 HydrophobicContact CG-CG 4.24Å; E59-L63 WeakPolarHBondContact O-CG 3.42Å; E59-L63 PolarHBondContact O-N 3.3Å; K60-L63 PolarHBondContact O-N 2.92Å; K60-L63 VanDerWaalsContact O-N 3.14Å; T61-L63 VanDerWaalsContact C-N 3.32Å; T61-L63 PolarHBondContact O-N 3.23Å; L63-R65 VanDerWaalsContact C-N 3.34Å; L63-R65 PolarHBondContact O-N 3.22Å; L63-T89 HydrophobicContact CD2-CG2 3.63Å; L63-Y93 WeakPolarHBondContact CA-OH 3.21Å; L63-Y93 HydrophobicContact CD2-CE1 4.23Å; L63-Y93 HydrophobicContact CD2-CE2 4.23Å; L63-Y93 PolarHBondContact O-OH 2.97Å
64	E	96.6	Very high	97.4	Very high	86 Å²	86	46.8 Å²	46.8	40%	0.402	24%	0.236	S	C	.	.			trans	-83.1	76	178.4	-70.5	-60	152.4	0	0	111.7	K60 T61 P66 E67 L68	K60-E64 HydrophobicContact CG-CG 4.25Å; K60-E64 WeakPolarHBondContact O-CG 3.36Å; K60-E64 PolarHBondContact O-N 3.25Å; T61-E64 PolarHBondContact O-N 2.72Å; E64-P66 VanDerWaalsContact C-CD 3.4Å; E64-P66 VanDerWaalsContact C-N 3.31Å; E64-E67 HydrophobicContact CB-CB 3.81Å; E64-E67 WeakPolarHBondContact O-CA 3.11Å; E64-E67 WeakPolarHBondContact O-CB 3.22Å; E64-E67 PolarHBondContact O-N 3.25Å; E64-L68 PolarHBondContact O-N 3.13Å
65	R	96.6	Very high	97.4	Very high	72 Å²	72	47.1 Å²	47.1	27%	0.272	24%	0.238	S	C	.	.	H	α-helix	trans	-49.1	-40.7	177.9	-69.5	179.3	62.3	-175.6	0.3	114.7	L63 L68 K69 Y93 D96 L97	L63-R65 VanDerWaalsContact C-N 3.34Å; L63-R65 PolarHBondContact O-N 3.22Å; R65-L68 PolarHBondContact O-N 2.9Å; R65-K69 PolarHBondContact O-N 3.38Å; R65-K69 VanDerWaalsContact O-N 3.16Å; R65-Y93 HydrophobicContact CG-CD1 4.43Å; R65-Y93 HydrophobicContact CG-CE1 3.71Å; R65-D96 IonicContact CZ-OD2 3.76Å; R65-D96 IonicContact NH1-OD2 3.55Å; R65-D96 PolarHBondContact NH1-OD2 3.3Å; R65-D96 VanDerWaalsContact NH2-CB 3.33Å; R65-D96 IonicContact NH2-OD2 3.92Å; R65-D96 PolarHBondContact NH2-OD2 2.93Å; R65-L97 HydrophobicContact CB-CD1 3.95Å; R65-L97 HydrophobicContact CG-CD1 4.08Å
66	P	96.8	Very high	97.4	Very high	81 Å²	81	46 Å²	46	53%	0.526	23%	0.234	S	C	.	.	H	α-helix	trans	-61.6	-43.6	173.5	-23.2	35.7	0	0	0	112.7	E64 L68 K69 D70	E64-P66 VanDerWaalsContact C-CD 3.4Å; E64-P66 VanDerWaalsContact C-N 3.31Å; P66-L68 VanDerWaalsContact C-N 3.35Å; P66-L68 PolarHBondContact O-N 3.24Å; P66-K69 WeakPolarHBondContact O-CB 3.33Å; P66-K69 PolarHBondContact O-N 2.89Å; P66-K69 VanDerWaalsContact O-N 3.15Å; P66-D70 PolarHBondContact O-N 2.97Å
67	E	96	Very high	97.4	Very high	62 Å²	62	46 Å²	46	29%	0.29	23%	0.234	S	C	.	.	H	α-helix	trans	-62.4	-41.4	178.1	-173.7	178.2	178.3	0	0	111.3	E64 K69 D70 L71	E64-E67 HydrophobicContact CB-CB 3.81Å; E64-E67 WeakPolarHBondContact O-CA 3.11Å; E64-E67 WeakPolarHBondContact O-CB 3.22Å; E64-E67 PolarHBondContact O-N 3.25Å; E67-K69 VanDerWaalsContact C-N 3.29Å; E67-K69 PolarHBondContact O-N 3.32Å; E67-D70 PolarHBondContact O-N 3.17Å; E67-L71 HydrophobicContact CG-CD1 4.07Å; E67-L71 HydrophobicContact CG-CG 4.47Å; E67-L71 WeakPolarHBondContact O-CB 3.39Å; E67-L71 VanDerWaalsContact O-CG 3.31Å; E67-L71 WeakPolarHBondContact O-CG 3.44Å; E67-L71 PolarHBondContact O-N 3.11Å
68	L	97.5	Very high	97.4	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-60.2	-40.1	175	-63.5	-179.5	0	0	0	112.4	T61 E64 R65 P66 G72 V73 Y94 L97 I99 L137	T61-L68 HydrophobicContact CG2-CD2 4.38Å; T61-L68 WeakPolarHBondContact O-CD2 3.22Å; E64-L68 PolarHBondContact O-N 3.13Å; R65-L68 PolarHBondContact O-N 2.9Å; P66-L68 VanDerWaalsContact C-N 3.35Å; P66-L68 PolarHBondContact O-N 3.24Å; L68-G72 PolarHBondContact O-N 2.87Å; L68-G72 VanDerWaalsContact O-N 3.11Å; L68-V73 HydrophobicContact CB-CB 4.41Å; L68-V73 HydrophobicContact CD2-CB 4.39Å; L68-V73 HydrophobicContact CD2-CG2 4.15Å; L68-V73 PolarHBondContact O-N 3.47Å; L68-Y94 HydrophobicContact CD1-CD1 3.9Å; L68-Y94 HydrophobicContact CD1-CE1 3.49Å; L68-Y94 VanDerWaalsContact CD1-CE1 3.49Å; L68-L97 HydrophobicContact CB-CD1 4.46Å; L68-I99 HydrophobicContact CB-CD1 4.42Å; L68-I99 HydrophobicContact CD1-CD1 4.31Å; L68-L137 HydrophobicContact CD2-CD2 3.43Å; L68-L137 VanDerWaalsContact CD2-CD2 3.43Å
69	K	96.7	Very high	97.4	Very high	150 Å²	150	45.2 Å²	45.2	65%	0.652	23%	0.229	S	C	*	.	H	α-helix	trans	-66.7	-44.7	177	-171	-176.7	177.6	-176.8	0	111.2	R65 P66 E67 L71 G72 L97	R65-K69 PolarHBondContact O-N 3.38Å; R65-K69 VanDerWaalsContact O-N 3.16Å; P66-K69 WeakPolarHBondContact O-CB 3.33Å; P66-K69 PolarHBondContact O-N 2.89Å; P66-K69 VanDerWaalsContact O-N 3.15Å; E67-K69 VanDerWaalsContact C-N 3.29Å; E67-K69 PolarHBondContact O-N 3.32Å; K69-L71 VanDerWaalsContact C-N 3.35Å; K69-G72 WeakPolarHBondContact O-CA 3.36Å; K69-G72 PolarHBondContact O-N 3.14Å; K69-L97 HydrophobicContact CB-CD2 4.25Å; K69-L97 HydrophobicContact CD-CD2 4.46Å
70	D	96.4	Very high	97.4	Very high	143 Å²	143	41.8 Å²	41.8	77%	0.765	21%	0.214	S	C	*	.	H	α-helix	trans	-66.5	-37.3	179.6	-69.2	-14.6	0	0	0	111.8	P66 E67 G72	P66-D70 PolarHBondContact O-N 2.97Å; E67-D70 PolarHBondContact O-N 3.17Å; D70-G72 PolarHBondContact O-N 3.4Å
71	L	96.1	Very high	97.3	Very high	43 Å²	43	38.1 Å²	38.1	23%	0.225	20%	0.198	C	C	.	.	H	α-helix	trans	-67.7	-20	170.9	-72.8	171.6	0	0	0	112.5	V47 Y55 E67 K69 V73 K135	V47-L71 HydrophobicContact CG1-CD1 4.21Å; Y55-L71 HydrophobicContact CE1-CD2 4.37Å; E67-L71 HydrophobicContact CG-CD1 4.07Å; E67-L71 HydrophobicContact CG-CG 4.47Å; E67-L71 WeakPolarHBondContact O-CB 3.39Å; E67-L71 VanDerWaalsContact O-CG 3.31Å; E67-L71 WeakPolarHBondContact O-CG 3.44Å; E67-L71 PolarHBondContact O-N 3.11Å; K69-L71 VanDerWaalsContact C-N 3.35Å; L71-V73 HydrophobicContact CB-CG2 3.98Å; L71-K135 VanDerWaalsContact O-CD 3.23Å; L71-K135 WeakPolarHBondContact O-CD 3.37Å; L71-K135 PolarHBondContact O-NZ 3.08Å
72	G	97.5	Very high	97	Very high	29 Å²	29	38.7 Å²	38.7	30%	0.299	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	34	-174.8	0	0	0	0	0	112.7	L68 K69 D70 T74	L68-G72 PolarHBondContact O-N 2.87Å; L68-G72 VanDerWaalsContact O-N 3.11Å; K69-G72 WeakPolarHBondContact O-CA 3.36Å; K69-G72 PolarHBondContact O-N 3.14Å; D70-G72 PolarHBondContact O-N 3.4Å; G72-T74 PolarHBondContact O-N 2.95Å
73	V	98.3	Very high	95.9	Very high	9 Å²	9	46.3 Å²	46.3	6%	0.055	24%	0.237	C	C	.	.			trans	-65.5	128.8	175.1	173.2	0	0	0	0	109	L68 L71 Q75 V76 I99 L137	L68-V73 HydrophobicContact CB-CB 4.41Å; L68-V73 HydrophobicContact CD2-CB 4.39Å; L68-V73 HydrophobicContact CD2-CG2 4.15Å; L68-V73 PolarHBondContact O-N 3.47Å; L71-V73 HydrophobicContact CB-CG2 3.98Å; V73-Q75 WeakPolarHBondContact CG1-O 3.43Å; V73-V76 HydrophobicContact CG1-CG2 3.85Å; V73-I99 HydrophobicContact CG1-CD1 4.4Å; V73-I99 WeakPolarHBondContact O-CG1 3.21Å; V73-L137 HydrophobicContact CG1-CB 3.83Å; V73-L137 HydrophobicContact CG2-CB 4.21Å
74	T	98.4	Very high	95.1	Very high	34 Å²	34	53.6 Å²	53.6	21%	0.209	26%	0.26	C	S	.	.			trans	-112.2	-20.5	177.1	59.4	0	0	0	0	112.4	G72 I99 Q100 N134 K135	G72-T74 PolarHBondContact O-N 2.95Å; T74-I99 CarbonylContact O-C 3.56Å; T74-I99 VanDerWaalsContact O-CA 3.23Å; T74-I99 WeakPolarHBondContact O-CA 3.46Å; T74-Q100 PolarHBondContact O-N 3.17Å; T74-N134 WeakPolarHBondContact OG1-CA 3.23Å; T74-N134 WeakPolarHBondContact OG1-CB 3.21Å; T74-N134 VanDerWaalsContact OG1-CG 3.25Å; T74-N134 PolarHBondContact OG1-OD1 2.71Å; T74-K135 PolarHBondContact N-O 2.88Å; T74-K135 PolarHBondContact OG1-N 3.17Å; T74-K135 VanDerWaalsContact OG1-N 3.13Å; T74-K135 PolarHBondContact OG1-O 3.2Å
75	Q	98.6	Very high	94.1	Very high	7 Å²	7	56.9 Å²	56.9	3%	0.033	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	132.8	-177.5	-50.5	-75.6	106.2	0	0	109.6	V73 Q100 F124 A128 K135 V136 L137	V73-Q75 WeakPolarHBondContact CG1-O 3.43Å; Q75-Q100 CarbonylContact C-O 3.54Å; Q75-Q100 WeakPolarHBondContact CA-O 3.09Å; Q75-Q100 VanDerWaalsContact OE1-CD 3.23Å; Q75-F124 HydrophobicContact CB-CE1 4.04Å; Q75-F124 HydrophobicContact CB-CZ 3.92Å; Q75-A128 HydrophobicContact CB-CB 4.3Å; Q75-A128 HydrophobicContact CG-CB 3.61Å; Q75-K135 PolarHBondContact N-O 3.04Å; Q75-K135 VanDerWaalsContact N-O 3.11Å; Q75-V136 HydrophobicContact CB-CB 4.45Å; Q75-V136 HydrophobicContact CB-CG1 4.26Å; Q75-V136 HydrophobicContact CB-CG2 4.11Å; Q75-V136 HydrophobicContact CG-CG2 4.41Å; Q75-V136 WeakPolarHBondContact O-CA 3.41Å; Q75-L137 PolarHBondContact O-N 3.32Å
76	V	98.8	Very high	93.7	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	121.6	176.4	171.9	0	0	0	0	109.5	V73 Y94 I99 Q100 Y101 L102 L137	V73-V76 HydrophobicContact CG1-CG2 3.85Å; V76-Y94 HydrophobicContact CG1-CE2 4.21Å; V76-Y94 HydrophobicContact CG2-CE1 4.33Å; V76-I99 HydrophobicContact CB-CG2 3.87Å; V76-I99 HydrophobicContact CG2-CD1 4.33Å; V76-I99 HydrophobicContact CG2-CG2 3.54Å; V76-Q100 PolarHBondContact N-O 2.91Å; V76-Y101 HydrophobicContact CB-CD2 4.09Å; V76-Y101 HydrophobicContact CG1-CD2 3.9Å; V76-Y101 HydrophobicContact CG1-CE2 3.93Å; V76-Y101 WeakPolarHBondContact O-CA 3.25Å; V76-L102 PolarHBondContact O-N 3.42Å; V76-L137 CarbonylContact C-O 3.59Å; V76-L137 WeakPolarHBondContact CA-O 3.19Å; V76-L137 HydrophobicContact CG2-CB 4.34Å; V76-L137 HydrophobicContact CG2-CD2 4.48Å
77	L	98.8	Very high	93.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	109	166.8	-165.7	171.9	0	0	0	108.5	A79 L102 V104 A121 F124 I125 L137 V138 H139 L150	L77-A79 HydrophobicContact CD2-CB 4.2Å; L77-L102 CarbonylContact C-O 3.48Å; L77-L102 WeakPolarHBondContact CA-O 3.49Å; L77-L102 HydrophobicContact CD1-CD2 4.12Å; L77-L102 HydrophobicContact CG-CB 4.38Å; L77-L102 HydrophobicContact CG-CD2 4.05Å; L77-L102 HydrophobicContact CG-CG 4.31Å; L77-V104 HydrophobicContact CD2-CG2 4.25Å; L77-A121 HydrophobicContact CD1-CB 3.69Å; L77-F124 HydrophobicContact CB-CD1 4.09Å; L77-F124 HydrophobicContact CB-CE1 3.92Å; L77-F124 HydrophobicContact CD1-CD1 4.1Å; L77-F124 HydrophobicContact CG-CD1 4.34Å; L77-I125 HydrophobicContact CD1-CD1 4.21Å; L77-I125 HydrophobicContact CD1-CG1 4.22Å; L77-L137 PolarHBondContact N-O 3.07Å; L77-V138 HydrophobicContact CB-CG1 4.23Å; L77-V138 HydrophobicContact CB-CG2 4.24Å; L77-V138 HydrophobicContact CD1-CG1 4.38Å; L77-V138 HydrophobicContact CD2-CG1 4.09Å; L77-V138 HydrophobicContact CG-CG1 4.45Å; L77-V138 WeakPolarHBondContact O-CA 3.46Å; L77-H139 PolarHBondContact O-N 3.35Å; L77-L150 HydrophobicContact CD1-CD1 4.48Å; L77-L150 HydrophobicContact CD2-CD1 3.71Å
78	N	98.7	Very high	93.1	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	104.1	174.2	-177.6	0.1	0	0	0	110.2	A80 E81 V87 Y101 L102 V104 H139	N78-A80 PolarHBondContact O-N 3.46Å; N78-A80 WeakPolarHBondContact OD1-CA 3.16Å; N78-A80 PolarHBondContact OD1-N 3.41Å; N78-E81 PolarHBondContact OD1-N 3.31Å; N78-V87 PolarHBondContact ND2-O 3.03Å; N78-Y101 HydrophobicContact CB-CE2 3.82Å; N78-Y101 WeakPolarHBondContact CB-OH 3.36Å; N78-Y101 PolarHBondContact ND2-OH 3.49Å; N78-L102 PolarHBondContact N-O 3.39Å; N78-V104 PolarHBondContact O-N 3.21Å; N78-H139 VanDerWaalsContact CB-NE2 3.28Å; N78-H139 WeakPolarHBondContact CB-NE2 3.31Å; N78-H139 VanDerWaalsContact CG-NE2 3.34Å; N78-H139 PolarHBondContact OD1-CE1 2.66Å
79	A	98.5	Very high	92.8	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	13.8	176.9	0	0	0	0	0	113.4	L77 V104 H139 C140 R146 L150	L77-A79 HydrophobicContact CD2-CB 4.2Å; A79-V104 CarbonylContact C-O 3.43Å; A79-H139 WeakPolarHBondContact CB-O 3.41Å; A79-H139 PolarHBondContact N-O 3.12Å; A79-C140 HydrophobicContact CB-CB 4.26Å; A79-R146 HydrophobicContact CB-CB 4.06Å; A79-R146 WeakPolarHBondContact O-CD 3.45Å; A79-L150 HydrophobicContact CB-CD1 3.69Å
80	A	97.3	Very high	92.6	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.3	41.5	178.7	0	0	0	0	0	110.2	N78 N86 V87 V104 C140 V141 R146	N78-A80 PolarHBondContact O-N 3.46Å; N78-A80 WeakPolarHBondContact OD1-CA 3.16Å; N78-A80 PolarHBondContact OD1-N 3.41Å; A80-N86 CarbonylContact O-C 3.6Å; A80-N86 WeakPolarHBondContact O-CA 3.5Å; A80-N86 WeakPolarHBondContact O-CB 3.25Å; A80-V87 HydrophobicContact CB-CG2 4.34Å; A80-V87 PolarHBondContact O-N 2.98Å; A80-V104 PolarHBondContact N-O 2.9Å; A80-C140 HydrophobicContact CB-CB 3.97Å; A80-V141 HydrophobicContact CB-CG2 4.19Å; A80-R146 VanDerWaalsContact CB-NH1 3.34Å
81	E	95.3	Very high	92.5	Very high	24 Å²	24	43.2 Å²	43.2	11%	0.112	23%	0.229	C	C	.	.			trans	-62	146.6	176.6	178.2	63.4	-108.6	0	0	111.2	N78 N86 Y101 V104 E105	N78-E81 PolarHBondContact OD1-N 3.31Å; E81-N86 PolarHBondContact O-ND2 3.31Å; E81-Y101 VanDerWaalsContact OE2-CE1 3.25Å; E81-Y101 WeakPolarHBondContact OE2-CE1 3.41Å; E81-Y101 VanDerWaalsContact OE2-CZ 3.23Å; E81-Y101 PolarHBondContact OE2-OH 3.07Å; E81-V104 PolarHBondContact N-O 3.18Å; E81-E105 HydrophobicContact CB-CG 3.98Å; E81-E105 HydrophobicContact CG-CG 3.89Å
82	G	89.9	Confident	92.4	Very high	11 Å²	11	47.8 Å²	47.8	11%	0.113	25%	0.254	C	S	.	.	S	Bend	trans	115.7	179.8	176.1	0	0	0	0	0	115	N86	G82-N86 CarbonylContact O-C 3.53Å; G82-N86 WeakPolarHBondContact O-CB 3.5Å
83	K	75.1	Confident	92.3	Very high	160 Å²	160	49.9 Å²	49.9	70%	0.696	25%	0.253	S	S	*	.	S	Bend	trans	-92.2	-24.4	-164.7	-61.3	-172.5	177.3	177.8	0	115.9	L88	K83-L88 HydrophobicContact CG-CD1 4.18Å; K83-L88 HydrophobicContact CG-CD2 4.05Å
84	W	79.4	Confident	92.2	Very high	215 Å²	215	49.5 Å²	49.5	81%	0.814	25%	0.251	S	S	*	.	S	Bend	trans	-116.2	112	-167.2	-56.2	114.3	0	0	0	111.2	N86	W84-N86 PolarHBondContact O-N 2.58Å
85	N	75.1	Confident	91.9	Very high	155 Å²	155	54.9 Å²	54.9	83%	0.829	27%	0.271	S	S	*	.	S	Bend	trans	54.5	29.6	-174.2	-58.2	-42.7	0	0	0	113.5	V141	N85-V141 WeakPolarHBondContact O-CG2 3.29Å
86	N	88.3	Confident	91.6	Very high	26 Å²	26	59.9 Å²	59.9	14%	0.139	30%	0.298	C	S	.	.	S	Bend	trans	-136.4	165.7	-171.4	-80.5	0.7	0	0	0	108.7	A80 E81 G82 W84 R146	A80-N86 CarbonylContact O-C 3.6Å; A80-N86 WeakPolarHBondContact O-CA 3.5Å; A80-N86 WeakPolarHBondContact O-CB 3.25Å; E81-N86 PolarHBondContact O-ND2 3.31Å; G82-N86 CarbonylContact O-C 3.53Å; G82-N86 WeakPolarHBondContact O-CB 3.5Å; W84-N86 PolarHBondContact O-N 2.58Å; N86-R146 PolarHBondContact OD1-NH1 2.82Å
87	V	89.7	Confident	91.4	Very high	1 Å²	1	62 Å²	62	1%	0.006	31%	0.309	C	S	.	.			trans	-102.7	102.9	-176.6	-174.3	0	0	0	0	108.6	E59 N78 A80 T89 V141	E59-V87 HydrophobicContact CB-CG2 3.79Å; E59-V87 HydrophobicContact CG-CG1 3.99Å; E59-V87 HydrophobicContact CG-CG2 3.76Å; N78-V87 PolarHBondContact ND2-O 3.03Å; A80-V87 HydrophobicContact CB-CG2 4.34Å; A80-V87 PolarHBondContact O-N 2.98Å; V87-T89 HydrophobicContact CG1-CG2 3.98Å; V87-T89 PolarHBondContact O-N 2.95Å; V87-V141 HydrophobicContact CG2-CG2 3.97Å
88	L	90.4	Very high	91.1	Very high	106 Å²	106	69 Å²	69	56%	0.555	35%	0.347	S	S	*	.			trans	-88	85.6	179.4	-171.9	74.3	0	0	0	110.7	K83	K83-L88 HydrophobicContact CG-CD1 4.18Å; K83-L88 HydrophobicContact CG-CD2 4.05Å
89	T	90.9	Very high	91	Very high	16 Å²	16	69.8 Å²	69.8	10%	0.098	35%	0.351	C	S	.	.			trans	-102.9	-60.6	171.4	48.4	0	0	0	0	110.3	L63 V87 Y93 Y94 Y101	L63-T89 HydrophobicContact CD2-CG2 3.63Å; V87-T89 HydrophobicContact CG1-CG2 3.98Å; V87-T89 PolarHBondContact O-N 2.95Å; T89-Y93 HydrophobicContact CG2-CD1 3.82Å; T89-Y93 HydrophobicContact CG2-CD2 4.42Å; T89-Y93 HydrophobicContact CG2-CE1 4.15Å; T89-Y93 HydrophobicContact CG2-CG 3.97Å; T89-Y93 WeakPolarHBondContact O-CB 3.49Å; T89-Y94 HydrophobicContact CG2-CE2 4.42Å; T89-Y94 PolarHBondContact OG1-OH 3.16Å; T89-Y101 PolarHBondContact OG1-OH 2.7Å
90	G	92.6	Very high	91	Very high	17 Å²	17	75.5 Å²	75.5	18%	0.175	38%	0.378	C	S	.	.			trans	67.9	168.8	-172.7	0	0	0	0	0	112.4	N92 Y93 Y94 Y101	G90-N92 VanDerWaalsContact C-N 3.26Å; G90-N92 PolarHBondContact O-N 3.47Å; G90-Y93 WeakPolarHBondContact O-CB 3.27Å; G90-Y93 PolarHBondContact O-N 3.01Å; G90-Y94 WeakPolarHBondContact O-CD2 3.44Å; G90-Y101 PolarHBondContact N-OH 2.86Å
91	A	94	Very high	91	Very high	55 Å²	55	77.5 Å²	77.5	46%	0.455	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-58.3	-36.9	-176.8	0	0	0	0	0	113.3	Y93 Y94 Y101	A91-Y93 PolarHBondContact O-N 3.34Å; A91-Y94 PolarHBondContact O-N 3.07Å; A91-Y94 VanDerWaalsContact O-N 3.12Å; A91-Y101 HydrophobicContact CB-CD1 4.14Å; A91-Y101 HydrophobicContact CB-CG 4.25Å
92	N	94.9	Very high	91.2	Very high	138 Å²	138	77.7 Å²	77.7	74%	0.738	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-62.9	-25.9	-177.4	-76.1	-22.3	0	0	0	113.7	G90 Y94 K95	G90-N92 VanDerWaalsContact C-N 3.26Å; G90-N92 PolarHBondContact O-N 3.47Å; N92-Y94 PolarHBondContact O-N 3.46Å; N92-K95 WeakPolarHBondContact O-CG 3.3Å; N92-K95 PolarHBondContact O-N 2.96Å
93	Y	96.1	Very high	91.6	Very high	74 Å²	74	78.6 Å²	78.6	29%	0.29	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-63.7	-32.2	177.6	-174	-97.3	0	0	0	112.2	L63 R65 T89 G90 A91	L63-Y93 WeakPolarHBondContact CA-OH 3.21Å; L63-Y93 HydrophobicContact CD2-CE1 4.23Å; L63-Y93 HydrophobicContact CD2-CE2 4.23Å; L63-Y93 PolarHBondContact O-OH 2.97Å; R65-Y93 HydrophobicContact CG-CD1 4.43Å; R65-Y93 HydrophobicContact CG-CE1 3.71Å; T89-Y93 HydrophobicContact CG2-CD1 3.82Å; T89-Y93 HydrophobicContact CG2-CD2 4.42Å; T89-Y93 HydrophobicContact CG2-CE1 4.15Å; T89-Y93 HydrophobicContact CG2-CG 3.97Å; T89-Y93 WeakPolarHBondContact O-CB 3.49Å; G90-Y93 WeakPolarHBondContact O-CB 3.27Å; G90-Y93 PolarHBondContact O-N 3.01Å; A91-Y93 PolarHBondContact O-N 3.34Å
94	Y	96	Very high	92.6	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-103	8.1	-175.4	-50.3	-82.3	0	0	0	114.3	A62 L68 V76 T89 G90 A91 N92 D96 L97 I99 Y101	A62-Y94 WeakPolarHBondContact O-CE1 3.49Å; A62-Y94 PolarHBondContact O-OH 2.86Å; L68-Y94 HydrophobicContact CD1-CD1 3.9Å; L68-Y94 HydrophobicContact CD1-CE1 3.49Å; L68-Y94 VanDerWaalsContact CD1-CE1 3.49Å; V76-Y94 HydrophobicContact CG1-CE2 4.21Å; V76-Y94 HydrophobicContact CG2-CE1 4.33Å; T89-Y94 HydrophobicContact CG2-CE2 4.42Å; T89-Y94 PolarHBondContact OG1-OH 3.16Å; G90-Y94 WeakPolarHBondContact O-CD2 3.44Å; A91-Y94 PolarHBondContact O-N 3.07Å; A91-Y94 VanDerWaalsContact O-N 3.12Å; N92-Y94 PolarHBondContact O-N 3.46Å; Y94-D96 VanDerWaalsContact C-N 3.28Å; Y94-D96 PolarHBondContact O-N 2.67Å; Y94-D96 VanDerWaalsContact O-N 3.12Å; Y94-L97 WeakPolarHBondContact O-CB 3.2Å; Y94-L97 PolarHBondContact O-N 3.13Å; Y94-I99 HydrophobicContact CD1-CD1 4.03Å; Y94-I99 HydrophobicContact CG-CB 4.42Å; Y94-I99 HydrophobicContact CG-CD1 4.47Å; Y94-I99 HydrophobicContact CG-CG2 4.2Å; Y94-Y101 AromaticContact CD2-CD2 3.74Å; Y94-Y101 HydrophobicContact CD2-CD2 3.74Å; Y94-Y101 HydrophobicContact CD2-CE2 4.24Å; Y94-Y101 HydrophobicContact CD2-CG 4.5Å; Y94-Y101 AromaticContact CE2-CD2 3.49Å; Y94-Y101 HydrophobicContact CE2-CD2 3.49Å; Y94-Y101 VanDerWaalsContact CE2-CD2 3.49Å; Y94-Y101 AromaticContact CE2-CE2 3.54Å; Y94-Y101 HydrophobicContact CE2-CE2 3.54Å
95	K	90.9	Very high	93.5	Very high	148 Å²	148	67.2 Å²	67.2	64%	0.643	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-53.5	-38.3	-170.7	70.7	-177.1	-175.7	174.2	0	114.4	N92 L97	N92-K95 WeakPolarHBondContact O-CG 3.3Å; N92-K95 PolarHBondContact O-N 2.96Å; K95-L97 VanDerWaalsContact C-N 3.26Å; K95-L97 PolarHBondContact O-N 2.85Å
96	D	93.2	Very high	94.5	Very high	111 Å²	111	59.9 Å²	59.9	59%	0.594	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-83	-3.2	-177.6	-33.9	-61.4	0	0	0	113.1	R65 Y94	R65-D96 IonicContact CZ-OD2 3.76Å; R65-D96 IonicContact NH1-OD2 3.55Å; R65-D96 PolarHBondContact NH1-OD2 3.3Å; R65-D96 VanDerWaalsContact NH2-CB 3.33Å; R65-D96 IonicContact NH2-OD2 3.92Å; R65-D96 PolarHBondContact NH2-OD2 2.93Å; Y94-D96 VanDerWaalsContact C-N 3.28Å; Y94-D96 PolarHBondContact O-N 2.67Å; Y94-D96 VanDerWaalsContact O-N 3.12Å
97	L	93.4	Very high	94.8	Very high	44 Å²	44	61.2 Å²	61.2	23%	0.23	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-99.8	-3.4	176.5	-60.7	178.6	0	0	0	112.7	R65 L68 K69 Y94 K95 I99	R65-L97 HydrophobicContact CB-CD1 3.95Å; R65-L97 HydrophobicContact CG-CD1 4.08Å; L68-L97 HydrophobicContact CB-CD1 4.46Å; K69-L97 HydrophobicContact CB-CD2 4.25Å; K69-L97 HydrophobicContact CD-CD2 4.46Å; Y94-L97 WeakPolarHBondContact O-CB 3.2Å; Y94-L97 PolarHBondContact O-N 3.13Å; K95-L97 VanDerWaalsContact C-N 3.26Å; K95-L97 PolarHBondContact O-N 2.85Å; L97-I99 HydrophobicContact CB-CD1 3.77Å; L97-I99 HydrophobicContact CB-CG1 3.84Å; L97-I99 HydrophobicContact CD1-CD1 3.76Å; L97-I99 HydrophobicContact CG-CD1 4.44Å; L97-I99 PolarHBondContact O-N 3.31Å
98	N	92.7	Very high	95.2	Very high	149 Å²	149	64.5 Å²	64.5	80%	0.797	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	37.1	-173.3	-165.8	45.6	0	0	0	112.8
99	I	97.6	Very high	95.5	Very high	16 Å²	16	64.6 Å²	64.6	8%	0.082	34%	0.337	C	S	.	.			trans	-87.1	130.1	176.9	-73.7	173	0	0	0	108.9	L68 V73 T74 V76 Y94 L97	L68-I99 HydrophobicContact CB-CD1 4.42Å; L68-I99 HydrophobicContact CD1-CD1 4.31Å; V73-I99 HydrophobicContact CG1-CD1 4.4Å; V73-I99 WeakPolarHBondContact O-CG1 3.21Å; T74-I99 CarbonylContact O-C 3.56Å; T74-I99 VanDerWaalsContact O-CA 3.23Å; T74-I99 WeakPolarHBondContact O-CA 3.46Å; V76-I99 HydrophobicContact CB-CG2 3.87Å; V76-I99 HydrophobicContact CG2-CD1 4.33Å; V76-I99 HydrophobicContact CG2-CG2 3.54Å; Y94-I99 HydrophobicContact CD1-CD1 4.03Å; Y94-I99 HydrophobicContact CG-CB 4.42Å; Y94-I99 HydrophobicContact CG-CD1 4.47Å; Y94-I99 HydrophobicContact CG-CG2 4.2Å; L97-I99 HydrophobicContact CB-CD1 3.77Å; L97-I99 HydrophobicContact CB-CG1 3.84Å; L97-I99 HydrophobicContact CD1-CD1 3.76Å; L97-I99 HydrophobicContact CG-CD1 4.44Å; L97-I99 PolarHBondContact O-N 3.31Å
100	Q	97.9	Very high	95.9	Very high	120 Å²	120	67.6 Å²	67.6	56%	0.561	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	142.5	166.3	-54.5	-178.7	9.6	0	0	110.2	T74 Q75 V76	T74-Q100 PolarHBondContact O-N 3.17Å; Q75-Q100 CarbonylContact C-O 3.54Å; Q75-Q100 WeakPolarHBondContact CA-O 3.09Å; Q75-Q100 VanDerWaalsContact OE1-CD 3.23Å; V76-Q100 PolarHBondContact N-O 2.91Å
101	Y	98.4	Very high	96.1	Very high	41 Å²	41	73 Å²	73	16%	0.161	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	134.1	-169.2	-177.3	-95.8	0	0	0	111.8	V76 N78 E81 T89 G90 A91 Y94	V76-Y101 HydrophobicContact CB-CD2 4.09Å; V76-Y101 HydrophobicContact CG1-CD2 3.9Å; V76-Y101 HydrophobicContact CG1-CE2 3.93Å; V76-Y101 WeakPolarHBondContact O-CA 3.25Å; N78-Y101 HydrophobicContact CB-CE2 3.82Å; N78-Y101 WeakPolarHBondContact CB-OH 3.36Å; N78-Y101 PolarHBondContact ND2-OH 3.49Å; E81-Y101 VanDerWaalsContact OE2-CE1 3.25Å; E81-Y101 WeakPolarHBondContact OE2-CE1 3.41Å; E81-Y101 VanDerWaalsContact OE2-CZ 3.23Å; E81-Y101 PolarHBondContact OE2-OH 3.07Å; T89-Y101 PolarHBondContact OG1-OH 2.7Å; G90-Y101 PolarHBondContact N-OH 2.86Å; A91-Y101 HydrophobicContact CB-CD1 4.14Å; A91-Y101 HydrophobicContact CB-CG 4.25Å; Y94-Y101 AromaticContact CD2-CD2 3.74Å; Y94-Y101 HydrophobicContact CD2-CD2 3.74Å; Y94-Y101 HydrophobicContact CD2-CE2 4.24Å; Y94-Y101 HydrophobicContact CD2-CG 4.5Å; Y94-Y101 AromaticContact CE2-CD2 3.49Å; Y94-Y101 HydrophobicContact CE2-CD2 3.49Å; Y94-Y101 VanDerWaalsContact CE2-CD2 3.49Å; Y94-Y101 AromaticContact CE2-CE2 3.54Å; Y94-Y101 HydrophobicContact CE2-CE2 3.54Å
102	L	98.5	Very high	96.3	Very high	28 Å²	28	72.3 Å²	72.3	15%	0.147	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	117.3	166.7	175.6	61.9	0	0	0	109.5	V76 L77 N78 V104 L120 F124	V76-L102 PolarHBondContact O-N 3.42Å; L77-L102 CarbonylContact C-O 3.48Å; L77-L102 WeakPolarHBondContact CA-O 3.49Å; L77-L102 HydrophobicContact CD1-CD2 4.12Å; L77-L102 HydrophobicContact CG-CB 4.38Å; L77-L102 HydrophobicContact CG-CD2 4.05Å; L77-L102 HydrophobicContact CG-CG 4.31Å; N78-L102 PolarHBondContact N-O 3.39Å; L102-V104 HydrophobicContact CG-CG2 4.43Å; L102-L120 HydrophobicContact CD1-CD2 4.24Å; L102-L120 HydrophobicContact CD1-CG 4.44Å; L102-L120 HydrophobicContact CD2-CG 4.17Å; L102-F124 HydrophobicContact CB-CD1 4.17Å; L102-F124 HydrophobicContact CB-CD2 3.74Å; L102-F124 HydrophobicContact CB-CE1 4.12Å; L102-F124 HydrophobicContact CB-CE2 3.69Å; L102-F124 HydrophobicContact CB-CG 3.98Å; L102-F124 HydrophobicContact CB-CZ 3.87Å; L102-F124 HydrophobicContact CD2-CB 3.54Å; L102-F124 HydrophobicContact CD2-CD1 4.09Å; L102-F124 HydrophobicContact CD2-CD2 4Å; L102-F124 HydrophobicContact CD2-CG 3.61Å; L102-F124 HydrophobicContact CG-CD2 4.46Å; L102-F124 HydrophobicContact CG-CG 4.44Å
103	G	98.2	Very high	96.4	Very high	31 Å²	31	69.3 Å²	69.3	32%	0.32	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	128.6	172.8	0	0	0	0	0	111.2
104	V	97.1	Very high	96.6	Very high	2 Å²	2	65.8 Å²	65.8	1%	0.012	34%	0.343	C	S	.	.			trans	-117.1	114.7	172.7	172.9	0	0	0	0	108.4	L77 N78 A79 A80 E81 L102 A106 Y117	L77-V104 HydrophobicContact CD2-CG2 4.25Å; N78-V104 PolarHBondContact O-N 3.21Å; A79-V104 CarbonylContact C-O 3.43Å; A80-V104 PolarHBondContact N-O 2.9Å; E81-V104 PolarHBondContact N-O 3.18Å; L102-V104 HydrophobicContact CG-CG2 4.43Å; V104-A106 HydrophobicContact CG1-CB 4.05Å; V104-A106 PolarHBondContact O-N 2.81Å; V104-Y117 HydrophobicContact CG1-CD1 3.84Å; V104-Y117 HydrophobicContact CG1-CD2 3.35Å; V104-Y117 HydrophobicContact CG1-CE1 4.02Å; V104-Y117 HydrophobicContact CG1-CE2 3.49Å; V104-Y117 VanDerWaalsContact CG1-CE2 3.49Å; V104-Y117 HydrophobicContact CG1-CG 3.5Å; V104-Y117 VanDerWaalsContact CG1-CG 3.5Å; V104-Y117 HydrophobicContact CG2-CD1 4.39Å; V104-Y117 HydrophobicContact CG2-CG 4.46Å
105	E	96.6	Very high	96.7	Very high	133 Å²	133	68 Å²	68	62%	0.621	36%	0.359	S	S	*	.			trans	-76.7	92.2	175	-65.4	-174	-146.5	0	0	108.9	E81 F112 Y117	E81-E105 HydrophobicContact CB-CG 3.98Å; E81-E105 HydrophobicContact CG-CG 3.89Å; E105-F112 VanDerWaalsContact O-CZ 3.27Å; E105-F112 WeakPolarHBondContact O-CZ 3.17Å; E105-Y117 PolarHBondContact O-OH 3.43Å; E105-Y117 VanDerWaalsContact O-OH 3.13Å
106	A	96.2	Very high	97.1	Very high	1 Å²	1	66 Å²	66	1%	0.008	35%	0.352	C	S	.	.			trans	-127.6	128.3	179.6	0	0	0	0	0	113.1	V104 F112 R146	V104-A106 HydrophobicContact CG1-CB 4.05Å; V104-A106 PolarHBondContact O-N 2.81Å; A106-F112 HydrophobicContact CB-CD1 4.11Å; A106-F112 HydrophobicContact CB-CE1 3.49Å; A106-F112 VanDerWaalsContact CB-CE1 3.49Å; A106-F112 HydrophobicContact CB-CZ 3.91Å; A106-R146 WeakPolarHBondContact O-CD 3.3Å; A106-R146 PolarHBondContact O-NH1 2.94Å
107	D	96.4	Very high	97.3	Very high	55 Å²	55	63.1 Å²	63.1	29%	0.294	33%	0.333	S	S	.	.			trans	-82.3	138.4	170.9	-84.8	6.7	0	0	0	110.4	K109 F112 F182	D107-K109 HydrophobicContact CB-CB 4.48Å; D107-K109 HydrophobicContact CB-CD 4.19Å; D107-K109 HydrophobicContact CB-CG 4.25Å; D107-K109 PolarHBondContact O-N 3.12Å; D107-K109 IonicContact OD2-NZ 2.79Å; D107-K109 PolarHBondContact OD2-NZ 3.02Å; D107-F112 HydrophobicContact CB-CB 4.28Å; D107-F112 HydrophobicContact CB-CD2 3.83Å; D107-F112 HydrophobicContact CB-CG 4.16Å; D107-F112 WeakPolarHBondContact O-CB 3.39Å; D107-F182 WeakPolarHBondContact O-CZ 3.13Å
108	D	97.3	Very high	97.6	Very high	70 Å²	70	61.5 Å²	61.5	37%	0.374	32%	0.324	S	S	.	.	S	Bend	trans	-81.4	60.3	173	-154.8	-3.9	0	0	0	111.7	S145 R146 N179	D108-S145 VanDerWaalsContact OD1-CB 3.31Å; D108-S145 WeakPolarHBondContact OD1-CB 3.39Å; D108-S145 PolarHBondContact OD1-OG 3.34Å; D108-S145 VanDerWaalsContact OD2-CB 3.24Å; D108-S145 WeakPolarHBondContact OD2-CB 3.46Å; D108-S145 PolarHBondContact OD2-OG 3.4Å; D108-R146 HydrophobicContact CB-CG 4.09Å; D108-N179 PolarHBondContact OD1-ND2 3.33Å
109	K	97.4	Very high	97.9	Very high	108 Å²	108	59 Å²	59	47%	0.47	31%	0.31	S	S	.	.	S	Bend	trans	-122.6	140.8	-180	-67.6	173.7	-173.7	150	0	109.5	D107 T111 F112	D107-K109 HydrophobicContact CB-CB 4.48Å; D107-K109 HydrophobicContact CB-CD 4.19Å; D107-K109 HydrophobicContact CB-CG 4.25Å; D107-K109 PolarHBondContact O-N 3.12Å; D107-K109 IonicContact OD2-NZ 2.79Å; D107-K109 PolarHBondContact OD2-NZ 3.02Å; K109-T111 PolarHBondContact O-N 3Å; K109-F112 HydrophobicContact CB-CB 4.48Å; K109-F112 WeakPolarHBondContact O-CB 3.42Å; K109-F112 PolarHBondContact O-N 2.94Å
110	P	97.4	Very high	97.9	Very high	78 Å²	78	62.1 Å²	62.1	51%	0.506	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-21.7	173.7	-26.2	34.9	0	0	0	114.7	N179 G181	P110-N179 WeakPolarHBondContact CA-OD1 3.42Å; P110-N179 HydrophobicContact CG-CB 4.35Å; P110-G181 WeakPolarHBondContact O-CA 3.28Å
111	T	97.6	Very high	97.9	Very high	130 Å²	130	56.4 Å²	56.4	80%	0.798	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-11.8	177.3	52.2	0	0	0	0	113.7	K109	K109-T111 PolarHBondContact O-N 3Å
112	F	97.9	Very high	98	Very high	41 Å²	41	54.5 Å²	54.5	18%	0.18	29%	0.292	C	S	.	.	S	Bend	trans	-77.1	132.4	-178.7	-171.9	-92.9	0	0	0	111.2	E105 A106 D107 K109 I114 Y117 F182 Q185	E105-F112 VanDerWaalsContact O-CZ 3.27Å; E105-F112 WeakPolarHBondContact O-CZ 3.17Å; A106-F112 HydrophobicContact CB-CD1 4.11Å; A106-F112 HydrophobicContact CB-CE1 3.49Å; A106-F112 VanDerWaalsContact CB-CE1 3.49Å; A106-F112 HydrophobicContact CB-CZ 3.91Å; D107-F112 HydrophobicContact CB-CB 4.28Å; D107-F112 HydrophobicContact CB-CD2 3.83Å; D107-F112 HydrophobicContact CB-CG 4.16Å; D107-F112 WeakPolarHBondContact O-CB 3.39Å; K109-F112 HydrophobicContact CB-CB 4.48Å; K109-F112 WeakPolarHBondContact O-CB 3.42Å; K109-F112 PolarHBondContact O-N 2.94Å; F112-I114 HydrophobicContact CD1-CB 4.07Å; F112-I114 HydrophobicContact CE1-CB 4.32Å; F112-I114 PolarHBondContact O-N 2.97Å; F112-I114 VanDerWaalsContact O-N 3.13Å; F112-Y117 HydrophobicContact CE1-CD2 4.27Å; F112-Y117 AromaticContact CE1-CE2 3.77Å; F112-Y117 HydrophobicContact CE1-CE2 3.77Å; F112-Y117 AromaticContact CZ-CE2 3.72Å; F112-Y117 HydrophobicContact CZ-CE2 3.72Å; F112-F182 HydrophobicContact CB-CE1 4.2Å; F112-F182 HydrophobicContact CD1-CE1 4.27Å; F112-F182 HydrophobicContact CD1-CZ 4.44Å; F112-Q185 PolarHBondContact O-NE2 3.06Å
113	N	98.4	Very high	98	Very high	75 Å²	75	57 Å²	57	40%	0.401	30%	0.303	S	S	.	.			trans	-83.7	82.4	176.1	-177.4	19.6	0	0	0	110.5	S115 Q116 Q185	N113-S115 VanDerWaalsContact C-N 3.28Å; N113-S115 PolarHBondContact OD1-N 3.18Å; N113-S115 PolarHBondContact OD1-OG 3.43Å; N113-Q116 VanDerWaalsContact O-CD 3.32Å; N113-Q116 VanDerWaalsContact O-CG 3.24Å; N113-Q116 WeakPolarHBondContact O-CG 3.3Å; N113-Q116 PolarHBondContact O-NE2 2.76Å; N113-Q185 PolarHBondContact OD1-OE1 3.28Å
114	I	98.6	Very high	98	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-73.1	-22.1	176.1	-164.6	162.9	0	0	0	112.5	F112 Q116 Y117 F118 R146 T149 L150 F182	F112-I114 HydrophobicContact CD1-CB 4.07Å; F112-I114 HydrophobicContact CE1-CB 4.32Å; F112-I114 PolarHBondContact O-N 2.97Å; F112-I114 VanDerWaalsContact O-N 3.13Å; I114-Q116 PolarHBondContact O-N 3Å; I114-Y117 PolarHBondContact O-N 2.95Å; I114-F118 HydrophobicContact CG1-CE1 4.44Å; I114-F118 HydrophobicContact CG2-CE1 3.93Å; I114-F118 HydrophobicContact CG2-CZ 4.16Å; I114-R146 HydrophobicContact CD1-CB 4.38Å; I114-T149 HydrophobicContact CD1-CG2 4.27Å; I114-T149 HydrophobicContact CG2-CG2 3.94Å; I114-L150 HydrophobicContact CD1-CD2 4.21Å; I114-L150 HydrophobicContact CD1-CG 4.35Å; I114-L150 HydrophobicContact CG1-CD2 3.94Å; I114-F182 HydrophobicContact CB-CD1 3.94Å; I114-F182 HydrophobicContact CB-CE1 3.64Å; I114-F182 HydrophobicContact CB-CZ 4.05Å; I114-F182 HydrophobicContact CD1-CD2 4.18Å; I114-F182 HydrophobicContact CD1-CE1 4.23Å; I114-F182 HydrophobicContact CD1-CE2 3.78Å; I114-F182 HydrophobicContact CD1-CZ 3.8Å; I114-F182 HydrophobicContact CG2-CB 4.35Å; I114-F182 HydrophobicContact CG2-CD1 3.29Å; I114-F182 HydrophobicContact CG2-CD2 4.45Å; I114-F182 HydrophobicContact CG2-CE1 3.57Å; I114-F182 HydrophobicContact CG2-CG 3.79Å; I114-F182 HydrophobicContact CG2-CZ 4.25Å
115	S	98.6	Very high	98.1	Very high	48 Å²	48	56.8 Å²	56.8	34%	0.336	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-62.1	-26.2	-177.4	74.7	0	0	0	0	113.7	N113 Y117 F118	N113-S115 VanDerWaalsContact C-N 3.28Å; N113-S115 PolarHBondContact OD1-N 3.18Å; N113-S115 PolarHBondContact OD1-OG 3.43Å; S115-Y117 PolarHBondContact O-N 3.47Å; S115-Y117 VanDerWaalsContact O-N 3.08Å; S115-F118 WeakPolarHBondContact O-CB 3.24Å; S115-F118 PolarHBondContact O-N 3.11Å
116	Q	98.5	Very high	98.2	Very high	106 Å²	106	54.5 Å²	54.5	50%	0.495	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-59.8	-19.9	174	75.5	-168.1	-8.5	0	0	113.1	N113 I114	N113-Q116 VanDerWaalsContact O-CD 3.32Å; N113-Q116 VanDerWaalsContact O-CG 3.24Å; N113-Q116 WeakPolarHBondContact O-CG 3.3Å; N113-Q116 PolarHBondContact O-NE2 2.76Å; I114-Q116 PolarHBondContact O-N 3Å
117	Y	98.8	Very high	98.3	Very high	49 Å²	49	60.7 Å²	60.7	19%	0.192	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-101.3	-1.8	178.4	-57	-64.4	0	0	0	113.9	V104 E105 F112 I114 S115 L119 L120 A121	V104-Y117 HydrophobicContact CG1-CD1 3.84Å; V104-Y117 HydrophobicContact CG1-CD2 3.35Å; V104-Y117 HydrophobicContact CG1-CE1 4.02Å; V104-Y117 HydrophobicContact CG1-CE2 3.49Å; V104-Y117 VanDerWaalsContact CG1-CE2 3.49Å; V104-Y117 HydrophobicContact CG1-CG 3.5Å; V104-Y117 VanDerWaalsContact CG1-CG 3.5Å; V104-Y117 HydrophobicContact CG2-CD1 4.39Å; V104-Y117 HydrophobicContact CG2-CG 4.46Å; E105-Y117 PolarHBondContact O-OH 3.43Å; E105-Y117 VanDerWaalsContact O-OH 3.13Å; F112-Y117 HydrophobicContact CE1-CD2 4.27Å; F112-Y117 AromaticContact CE1-CE2 3.77Å; F112-Y117 HydrophobicContact CE1-CE2 3.77Å; F112-Y117 AromaticContact CZ-CE2 3.72Å; F112-Y117 HydrophobicContact CZ-CE2 3.72Å; I114-Y117 PolarHBondContact O-N 2.95Å; S115-Y117 PolarHBondContact O-N 3.47Å; S115-Y117 VanDerWaalsContact O-N 3.08Å; Y117-L119 PolarHBondContact O-N 2.99Å; Y117-L120 HydrophobicContact CD1-CD2 4.31Å; Y117-L120 PolarHBondContact O-N 3.42Å; Y117-A121 WeakPolarHBondContact O-CB 3.23Å; Y117-A121 PolarHBondContact O-N 3.42Å
118	F	98.8	Very high	98.4	Very high	11 Å²	11	58.3 Å²	58.3	5%	0.048	30%	0.299	C	S	.	.	H	α-helix	trans	-59.7	-46.9	-177.2	-71.8	-8.8	0	0	0	112.1	I114 S115 T122 T149 L150 A153 M157 Q185 L186 L189	I114-F118 HydrophobicContact CG1-CE1 4.44Å; I114-F118 HydrophobicContact CG2-CE1 3.93Å; I114-F118 HydrophobicContact CG2-CZ 4.16Å; S115-F118 WeakPolarHBondContact O-CB 3.24Å; S115-F118 PolarHBondContact O-N 3.11Å; F118-T122 WeakPolarHBondContact O-CB 3.44Å; F118-T122 PolarHBondContact O-N 3.13Å; F118-T122 PolarHBondContact O-OG1 3.36Å; F118-T149 HydrophobicContact CE1-CG2 3.78Å; F118-T149 HydrophobicContact CZ-CG2 3.96Å; F118-L150 HydrophobicContact CD1-CD2 3.97Å; F118-L150 HydrophobicContact CE1-CD2 4.31Å; F118-A153 HydrophobicContact CB-CB 4.2Å; F118-A153 HydrophobicContact CD1-CB 3.69Å; F118-A153 HydrophobicContact CD2-CB 4.09Å; F118-A153 HydrophobicContact CE1-CB 4Å; F118-A153 HydrophobicContact CE2-CB 4.37Å; F118-A153 HydrophobicContact CG-CB 3.73Å; F118-A153 HydrophobicContact CZ-CB 4.32Å; F118-M157 HydrophobicContact CB-SD 4.21Å; F118-Q185 HydrophobicContact CE2-CB 4.48Å; F118-Q185 HydrophobicContact CZ-CB 4.26Å; F118-L186 HydrophobicContact CE2-CD2 4.35Å; F118-L186 HydrophobicContact CZ-CD2 3.98Å; F118-L186 HydrophobicContact CZ-CG 4.37Å; F118-L189 HydrophobicContact CD2-CB 4.4Å; F118-L189 HydrophobicContact CD2-CD2 3.84Å; F118-L189 HydrophobicContact CE2-CB 4.22Å; F118-L189 HydrophobicContact CE2-CD2 4.07Å
119	L	98.6	Very high	98.4	Very high	97 Å²	97	55.9 Å²	55.9	51%	0.508	29%	0.286	S	S	.	.	H	α-helix	trans	-63.6	-52.5	178.3	-176.8	62.4	0	0	0	111.2	Y117 A121 T122 E123 M157	Y117-L119 PolarHBondContact O-N 2.99Å; L119-A121 PolarHBondContact O-N 2.95Å; L119-T122 PolarHBondContact O-N 3.3Å; L119-T122 VanDerWaalsContact O-N 3.16Å; L119-E123 HydrophobicContact CD1-CG 4.12Å; L119-E123 WeakPolarHBondContact CD1-OE1 3.4Å; L119-E123 HydrophobicContact CG-CG 4.45Å; L119-E123 WeakPolarHBondContact O-CG 3.46Å; L119-E123 PolarHBondContact O-N 2.95Å; L119-M157 HydrophobicContact CD1-CE 4.09Å
120	L	98.7	Very high	98.4	Very high	81 Å²	81	54.7 Å²	54.7	42%	0.424	29%	0.291	S	S	.	.	H	α-helix	trans	-56.7	-48.2	-179.1	177.9	66.8	0	0	0	112.5	L102 Y117 F124	L102-L120 HydrophobicContact CD1-CD2 4.24Å; L102-L120 HydrophobicContact CD1-CG 4.44Å; L102-L120 HydrophobicContact CD2-CG 4.17Å; Y117-L120 HydrophobicContact CD1-CD2 4.31Å; Y117-L120 PolarHBondContact O-N 3.42Å; L120-F124 WeakPolarHBondContact O-CB 3.5Å; L120-F124 PolarHBondContact O-N 3.11Å
121	A	98.8	Very high	98.4	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.9	-42.2	178.1	0	0	0	0	0	111.6	L77 Y117 L119 F124 I125 L150	L77-A121 HydrophobicContact CD1-CB 3.69Å; Y117-A121 WeakPolarHBondContact O-CB 3.23Å; Y117-A121 PolarHBondContact O-N 3.42Å; L119-A121 PolarHBondContact O-N 2.95Å; A121-F124 PolarHBondContact O-N 3.48Å; A121-I125 WeakPolarHBondContact O-CD1 3.42Å; A121-I125 WeakPolarHBondContact O-CG1 3.48Å; A121-I125 PolarHBondContact O-N 3.27Å; A121-L150 HydrophobicContact CB-CB 4.16Å; A121-L150 HydrophobicContact CB-CD1 4.02Å; A121-L150 HydrophobicContact CB-CD2 4.01Å; A121-L150 HydrophobicContact CB-CG 4.29Å
122	T	98.8	Very high	98.4	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.3	-44.8	179.6	-66.6	0	0	0	0	111.4	F118 L119 I125 H126 Y154 M157 K158	F118-T122 WeakPolarHBondContact O-CB 3.44Å; F118-T122 PolarHBondContact O-N 3.13Å; F118-T122 PolarHBondContact O-OG1 3.36Å; L119-T122 PolarHBondContact O-N 3.3Å; L119-T122 VanDerWaalsContact O-N 3.16Å; T122-I125 PolarHBondContact O-N 2.97Å; T122-H126 WeakPolarHBondContact O-CB 3.41Å; T122-H126 PolarHBondContact O-N 2.86Å; T122-Y154 HydrophobicContact CG2-CD2 3.91Å; T122-Y154 WeakPolarHBondContact OG1-CA 3.46Å; T122-M157 HydrophobicContact CG2-CB 3.99Å; T122-M157 HydrophobicContact CG2-CE 4.41Å; T122-M157 HydrophobicContact CG2-SD 4.31Å; T122-K158 HydrophobicContact CG2-CD 4.08Å; T122-K158 HydrophobicContact CG2-CG 3.44Å; T122-K158 VanDerWaalsContact CG2-CG 3.44Å
123	E	98.7	Very high	98.3	Very high	81 Å²	81	58 Å²	58	38%	0.379	30%	0.3	S	S	.	.	H	α-helix	trans	-63.5	-47.8	177.7	-73.4	174.8	164.3	0	0	110.9	L119 I125 H126 E127	L119-E123 HydrophobicContact CD1-CG 4.12Å; L119-E123 WeakPolarHBondContact CD1-OE1 3.4Å; L119-E123 HydrophobicContact CG-CG 4.45Å; L119-E123 WeakPolarHBondContact O-CG 3.46Å; L119-E123 PolarHBondContact O-N 2.95Å; E123-I125 VanDerWaalsContact C-N 3.35Å; E123-I125 PolarHBondContact O-N 3.11Å; E123-H126 PolarHBondContact O-N 2.83Å; E123-H126 VanDerWaalsContact O-N 3.14Å; E123-E127 WeakPolarHBondContact O-CB 3.1Å; E123-E127 VanDerWaalsContact O-CG 3.32Å; E123-E127 WeakPolarHBondContact O-CG 3.44Å; E123-E127 PolarHBondContact O-N 2.9Å
124	F	98.8	Very high	98.3	Very high	28 Å²	28	55.4 Å²	55.4	12%	0.123	29%	0.286	C	S	.	.	H	α-helix	trans	-55.8	-46.9	176.1	178.4	-95.9	0	0	0	112.8	Q75 L77 L102 L120 A121 A128 V136	Q75-F124 HydrophobicContact CB-CE1 4.04Å; Q75-F124 HydrophobicContact CB-CZ 3.92Å; L77-F124 HydrophobicContact CB-CD1 4.09Å; L77-F124 HydrophobicContact CB-CE1 3.92Å; L77-F124 HydrophobicContact CD1-CD1 4.1Å; L77-F124 HydrophobicContact CG-CD1 4.34Å; L102-F124 HydrophobicContact CB-CD1 4.17Å; L102-F124 HydrophobicContact CB-CD2 3.74Å; L102-F124 HydrophobicContact CB-CE1 4.12Å; L102-F124 HydrophobicContact CB-CE2 3.69Å; L102-F124 HydrophobicContact CB-CG 3.98Å; L102-F124 HydrophobicContact CB-CZ 3.87Å; L102-F124 HydrophobicContact CD2-CB 3.54Å; L102-F124 HydrophobicContact CD2-CD1 4.09Å; L102-F124 HydrophobicContact CD2-CD2 4Å; L102-F124 HydrophobicContact CD2-CG 3.61Å; L102-F124 HydrophobicContact CG-CD2 4.46Å; L102-F124 HydrophobicContact CG-CG 4.44Å; L120-F124 WeakPolarHBondContact O-CB 3.5Å; L120-F124 PolarHBondContact O-N 3.11Å; A121-F124 PolarHBondContact O-N 3.48Å; F124-A128 WeakPolarHBondContact O-CB 3.23Å; F124-A128 PolarHBondContact O-N 3.14Å; F124-A128 VanDerWaalsContact O-N 3.11Å; F124-V136 HydrophobicContact CE1-CG1 4.38Å
125	I	98.8	Very high	98.3	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-65.9	-43.2	177.9	-64	163.6	0	0	0	110.5	I54 L77 A121 T122 E123 A128 L129 V136 V138 Y154	I54-I125 HydrophobicContact CD1-CG2 3.82Å; I54-I125 HydrophobicContact CG1-CG2 4.42Å; L77-I125 HydrophobicContact CD1-CD1 4.21Å; L77-I125 HydrophobicContact CD1-CG1 4.22Å; A121-I125 WeakPolarHBondContact O-CD1 3.42Å; A121-I125 WeakPolarHBondContact O-CG1 3.48Å; A121-I125 PolarHBondContact O-N 3.27Å; T122-I125 PolarHBondContact O-N 2.97Å; E123-I125 VanDerWaalsContact C-N 3.35Å; E123-I125 PolarHBondContact O-N 3.11Å; I125-A128 WeakPolarHBondContact O-CB 3.38Å; I125-L129 HydrophobicContact CG2-CD1 3.78Å; I125-L129 WeakPolarHBondContact O-CB 3.42Å; I125-L129 VanDerWaalsContact O-CG 3.22Å; I125-L129 WeakPolarHBondContact O-CG 3.2Å; I125-L129 PolarHBondContact O-N 2.98Å; I125-L129 VanDerWaalsContact O-N 3.12Å; I125-V136 HydrophobicContact CG1-CG1 4.22Å; I125-V138 HydrophobicContact CD1-CG2 4.01Å; I125-V138 HydrophobicContact CG1-CG2 4.31Å; I125-Y154 HydrophobicContact CB-CD2 3.8Å; I125-Y154 HydrophobicContact CB-CE2 4.01Å; I125-Y154 HydrophobicContact CB-CG 4.25Å; I125-Y154 HydrophobicContact CD1-CD2 4.45Å; I125-Y154 HydrophobicContact CD1-CG 4.15Å; I125-Y154 HydrophobicContact CG2-CD1 4.01Å; I125-Y154 HydrophobicContact CG2-CD2 3.66Å; I125-Y154 HydrophobicContact CG2-CE1 3.91Å; I125-Y154 HydrophobicContact CG2-CE2 3.55Å; I125-Y154 HydrophobicContact CG2-CG 3.9Å
126	H	98.5	Very high	98.3	Very high	86 Å²	86	56.2 Å²	56.2	40%	0.398	28%	0.284	S	S	.	.	H	α-helix	trans	-68.9	-45.8	-175.9	-167.2	63.6	0	0	0	112.4	T122 E123 L129 S130 Y154 K158	T122-H126 WeakPolarHBondContact O-CB 3.41Å; T122-H126 PolarHBondContact O-N 2.86Å; E123-H126 PolarHBondContact O-N 2.83Å; E123-H126 VanDerWaalsContact O-N 3.14Å; H126-L129 PolarHBondContact O-N 2.87Å; H126-S130 PolarHBondContact O-N 3.48Å; H126-Y154 HydrophobicContact CB-CE2 3.97Å; H126-K158 HydrophobicContact CB-CD 4.48Å; H126-K158 HydrophobicContact CB-CG 4.4Å
127	E	98.4	Very high	98.3	Very high	131 Å²	131	51.2 Å²	51.2	61%	0.612	26%	0.26	S	S	*	.	H	α-helix	trans	-62.2	-44.2	176.7	-72.3	177.6	-176.3	0	0	111.1	E123 L129 S130	E123-E127 WeakPolarHBondContact O-CB 3.1Å; E123-E127 VanDerWaalsContact O-CG 3.32Å; E123-E127 WeakPolarHBondContact O-CG 3.44Å; E123-E127 PolarHBondContact O-N 2.9Å; E127-L129 VanDerWaalsContact C-N 3.3Å; E127-L129 PolarHBondContact O-N 2.83Å; E127-S130 VanDerWaalsContact O-CB 3.3Å; E127-S130 WeakPolarHBondContact O-CB 3.45Å; E127-S130 PolarHBondContact O-N 3.18Å; E127-S130 PolarHBondContact O-OG 2.96Å
128	A	98.3	Very high	98.4	Very high	4 Å²	4	48.9 Å²	48.9	3%	0.033	25%	0.251	C	S	.	.	H	α-helix	trans	-52.3	-49.1	173	0	0	0	0	0	112	Q75 F124 I125 S130 Q131 N134 V136	Q75-A128 HydrophobicContact CB-CB 4.3Å; Q75-A128 HydrophobicContact CG-CB 3.61Å; F124-A128 WeakPolarHBondContact O-CB 3.23Å; F124-A128 PolarHBondContact O-N 3.14Å; F124-A128 VanDerWaalsContact O-N 3.11Å; I125-A128 WeakPolarHBondContact O-CB 3.38Å; A128-S130 PolarHBondContact O-N 3.07Å; A128-Q131 PolarHBondContact O-N 3.09Å; A128-N134 WeakPolarHBondContact O-CB 3.45Å; A128-N134 PolarHBondContact O-ND2 3.05Å; A128-V136 HydrophobicContact CB-CG2 3.58Å
129	L	98.3	Very high	98.3	Very high	19 Å²	19	48.3 Å²	48.3	10%	0.099	25%	0.249	C	C	.	.	H	α-helix	trans	-76	-8.1	-174.4	-67.4	171.5	0	0	0	114.2	R53 I54 I125 H126 E127 Q131 V136 Y154	R53-L129 HydrophobicContact CB-CD2 3.73Å; R53-L129 PolarHBondContact NH2-O 3.42Å; I54-L129 HydrophobicContact CD1-CD1 3.7Å; I54-L129 HydrophobicContact CG1-CD1 3.76Å; I125-L129 HydrophobicContact CG2-CD1 3.78Å; I125-L129 WeakPolarHBondContact O-CB 3.42Å; I125-L129 VanDerWaalsContact O-CG 3.22Å; I125-L129 WeakPolarHBondContact O-CG 3.2Å; I125-L129 PolarHBondContact O-N 2.98Å; I125-L129 VanDerWaalsContact O-N 3.12Å; H126-L129 PolarHBondContact O-N 2.87Å; E127-L129 VanDerWaalsContact C-N 3.3Å; E127-L129 PolarHBondContact O-N 2.83Å; L129-Q131 PolarHBondContact O-N 2.84Å; L129-V136 HydrophobicContact CD2-CG2 4.12Å; L129-V136 HydrophobicContact CG-CG2 4.15Å; L129-Y154 WeakPolarHBondContact CD1-OH 3.19Å
130	S	97.4	Very high	98.3	Very high	83 Å²	83	43.8 Å²	43.8	58%	0.58	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-27.1	170.5	72.7	0	0	0	0	112.6	H126 E127 A128	H126-S130 PolarHBondContact O-N 3.48Å; E127-S130 VanDerWaalsContact O-CB 3.3Å; E127-S130 WeakPolarHBondContact O-CB 3.45Å; E127-S130 PolarHBondContact O-N 3.18Å; E127-S130 PolarHBondContact O-OG 2.96Å; A128-S130 PolarHBondContact O-N 3.07Å
131	Q	97.7	Very high	98.3	Very high	93 Å²	93	41.6 Å²	41.6	44%	0.435	22%	0.215	S	C	.	.	S	Bend	trans	-93.7	122.3	175.7	-61.2	-58.8	-46.1	0	0	109.9	R53 A128 L129 Q133 N134	R53-Q131 PolarHBondContact NH1-O 3.39Å; A128-Q131 PolarHBondContact O-N 3.09Å; L129-Q131 PolarHBondContact O-N 2.84Å; Q131-Q133 VanDerWaalsContact C-N 3.26Å; Q131-Q133 PolarHBondContact O-N 2.9Å; Q131-N134 HydrophobicContact CB-CB 4.24Å; Q131-N134 PolarHBondContact O-N 3.14Å; Q131-N134 VanDerWaalsContact O-N 3.11Å
132	P	96.6	Very high	98.2	Very high	102 Å²	102	46.2 Å²	46.2	66%	0.662	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-32.4	-175	-27.3	35.2	0	0	0	115	R53 N134	R53-P132 WeakPolarHBondContact CD-O 3.49Å; R53-P132 PolarHBondContact NH1-O 3.31Å; R53-P132 VanDerWaalsContact NH1-O 3.13Å; P132-N134 VanDerWaalsContact C-N 3.31Å; P132-N134 PolarHBondContact O-N 2.86Å
133	Q	96.4	Very high	98.1	Very high	123 Å²	123	46.2 Å²	46.2	58%	0.575	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76	-17.5	-179.2	70.8	-79.8	13.1	0	0	113.7	Q131	Q131-Q133 VanDerWaalsContact C-N 3.26Å; Q131-Q133 PolarHBondContact O-N 2.9Å
134	N	98.4	Very high	98	Very high	21 Å²	21	45.9 Å²	45.9	11%	0.112	23%	0.233	C	C	.	.			trans	-76.1	142.1	-174.2	-81.3	-10.4	0	0	0	112.2	R53 T74 A128 Q131 P132	R53-N134 WeakPolarHBondContact CD-O 3.45Å; R53-N134 PolarHBondContact NH1-O 3.2Å; T74-N134 WeakPolarHBondContact OG1-CA 3.23Å; T74-N134 WeakPolarHBondContact OG1-CB 3.21Å; T74-N134 VanDerWaalsContact OG1-CG 3.25Å; T74-N134 PolarHBondContact OG1-OD1 2.71Å; A128-N134 WeakPolarHBondContact O-CB 3.45Å; A128-N134 PolarHBondContact O-ND2 3.05Å; Q131-N134 HydrophobicContact CB-CB 4.24Å; Q131-N134 PolarHBondContact O-N 3.14Å; Q131-N134 VanDerWaalsContact O-N 3.11Å; P132-N134 VanDerWaalsContact C-N 3.31Å; P132-N134 PolarHBondContact O-N 2.86Å
135	K	98.8	Very high	98	Very high	65 Å²	65	44.8 Å²	44.8	28%	0.283	23%	0.229	S	C	.	.			trans	-130.9	135.3	171.9	-62.3	-178.6	-170.1	179	0	109.1	R53 Y55 L71 T74 Q75	R53-K135 HydrophobicContact CB-CG 4.22Å; R53-K135 HydrophobicContact CG-CG 4.44Å; R53-K135 WeakPolarHBondContact O-CA 3.2Å; Y55-K135 HydrophobicContact CE2-CB 4.11Å; Y55-K135 HydrophobicContact CE2-CD 4Å; Y55-K135 HydrophobicContact CE2-CG 4.34Å; L71-K135 VanDerWaalsContact O-CD 3.23Å; L71-K135 WeakPolarHBondContact O-CD 3.37Å; L71-K135 PolarHBondContact O-NZ 3.08Å; T74-K135 PolarHBondContact N-O 2.88Å; T74-K135 PolarHBondContact OG1-N 3.17Å; T74-K135 VanDerWaalsContact OG1-N 3.13Å; T74-K135 PolarHBondContact OG1-O 3.2Å; Q75-K135 PolarHBondContact N-O 3.04Å; Q75-K135 VanDerWaalsContact N-O 3.11Å
136	V	98.9	Very high	98	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	125	-174.7	-171.1	0	0	0	0	109.7	R53 I54 Y55 Q75 F124 I125 A128 L129 V138	R53-V136 PolarHBondContact O-N 3.31Å; I54-V136 WeakPolarHBondContact CA-O 3.44Å; Y55-V136 PolarHBondContact N-O 2.98Å; Q75-V136 HydrophobicContact CB-CB 4.45Å; Q75-V136 HydrophobicContact CB-CG1 4.26Å; Q75-V136 HydrophobicContact CB-CG2 4.11Å; Q75-V136 HydrophobicContact CG-CG2 4.41Å; Q75-V136 WeakPolarHBondContact O-CA 3.41Å; F124-V136 HydrophobicContact CE1-CG1 4.38Å; I125-V136 HydrophobicContact CG1-CG1 4.22Å; A128-V136 HydrophobicContact CB-CG2 3.58Å; L129-V136 HydrophobicContact CD2-CG2 4.12Å; L129-V136 HydrophobicContact CG-CG2 4.15Å; V136-V138 HydrophobicContact CG1-CG2 4.03Å
137	L	98.9	Very high	98	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	123.3	164.3	174.8	64	0	0	0	109.1	V47 T61 L68 V73 Q75 V76 L77 H139	V47-L137 HydrophobicContact CG2-CD1 4.16Å; T61-L137 HydrophobicContact CG2-CD1 4.41Å; T61-L137 HydrophobicContact CG2-CD2 4.19Å; L68-L137 HydrophobicContact CD2-CD2 3.43Å; L68-L137 VanDerWaalsContact CD2-CD2 3.43Å; V73-L137 HydrophobicContact CG1-CB 3.83Å; V73-L137 HydrophobicContact CG2-CB 4.21Å; Q75-L137 PolarHBondContact O-N 3.32Å; V76-L137 CarbonylContact C-O 3.59Å; V76-L137 WeakPolarHBondContact CA-O 3.19Å; V76-L137 HydrophobicContact CG2-CB 4.34Å; V76-L137 HydrophobicContact CG2-CD2 4.48Å; L77-L137 PolarHBondContact N-O 3.07Å; L137-H139 HydrophobicContact CD1-CB 4.47Å; L137-H139 HydrophobicContact CG-CB 4.32Å
138	V	98.9	Very high	98	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	110.1	169.2	-168.8	0	0	0	0	107.9	I54 Y55 I56 G57 L77 I125 V136 V151	I54-V138 HydrophobicContact CG2-CG2 4.37Å; Y55-V138 PolarHBondContact O-N 3.23Å; I56-V138 VanDerWaalsContact CA-O 3.3Å; I56-V138 WeakPolarHBondContact CA-O 3.32Å; G57-V138 PolarHBondContact N-O 3.12Å; L77-V138 HydrophobicContact CB-CG1 4.23Å; L77-V138 HydrophobicContact CB-CG2 4.24Å; L77-V138 HydrophobicContact CD1-CG1 4.38Å; L77-V138 HydrophobicContact CD2-CG1 4.09Å; L77-V138 HydrophobicContact CG-CG1 4.45Å; L77-V138 WeakPolarHBondContact O-CA 3.46Å; I125-V138 HydrophobicContact CD1-CG2 4.01Å; I125-V138 HydrophobicContact CG1-CG2 4.31Å; V136-V138 HydrophobicContact CG1-CG2 4.03Å; V138-V151 HydrophobicContact CB-CG2 3.76Å; V138-V151 HydrophobicContact CG1-CG2 3.98Å; V138-V151 HydrophobicContact CG2-CG2 3.74Å
139	H	98.8	Very high	98.1	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	161.2	-176.8	81.7	92.5	0	0	0	112.1	G57 A62 L77 N78 A79 L137 S147	G57-H139 VanDerWaalsContact O-CA 3.31Å; G57-H139 WeakPolarHBondContact O-CA 3.38Å; G57-H139 WeakPolarHBondContact O-CB 3.34Å; A62-H139 HydrophobicContact CB-CB 4.47Å; A62-H139 VanDerWaalsContact CB-CE1 3.44Å; A62-H139 WeakPolarHBondContact CB-CE1 3.37Å; L77-H139 PolarHBondContact O-N 3.35Å; N78-H139 VanDerWaalsContact CB-NE2 3.28Å; N78-H139 WeakPolarHBondContact CB-NE2 3.31Å; N78-H139 VanDerWaalsContact CG-NE2 3.34Å; N78-H139 PolarHBondContact OD1-CE1 2.66Å; A79-H139 WeakPolarHBondContact CB-O 3.41Å; A79-H139 PolarHBondContact N-O 3.12Å; L137-H139 HydrophobicContact CD1-CB 4.47Å; L137-H139 HydrophobicContact CG-CB 4.32Å; H139-S147 VanDerWaalsContact C-CB 3.5Å
140	C	98	Very high	98.1	Very high	1 Å²	1	34 Å²	34	1%	0.007	18%	0.177	C	C	.	.			trans	-135.8	-150.1	161.4	66.5	0	0	0	0	107.3	D58 E59 A79 A80 G143 R146 S147	D58-C140 CarbonylContact C-O 3.46Å; E59-C140 PolarHBondContact N-O 2.93Å; A79-C140 HydrophobicContact CB-CB 4.26Å; A80-C140 HydrophobicContact CB-CB 3.97Å; C140-G143 VanDerWaalsContact SG-CA 3.58Å; C140-G143 PolarHBondContact SG-N 3.26Å; C140-R146 HydrophobicContact CB-CB 3.85Å; C140-S147 PolarHBondContact SG-OG 3.16Å; C140-S147 VanDerWaalsContact SG-OG 3.38Å
141	V	97.5	Very high	98.2	Very high	35 Å²	35	30.1 Å²	30.1	21%	0.212	15%	0.15	C	C	.	.	S	Bend	trans	-67.8	-52.7	175.2	178	0	0	0	0	111.2	D58 E59 A80 N85 V87	D58-V141 WeakPolarHBondContact CB-O 3.38Å; E59-V141 PolarHBondContact N-O 2.88Å; A80-V141 HydrophobicContact CB-CG2 4.19Å; N85-V141 WeakPolarHBondContact O-CG2 3.29Å; V87-V141 HydrophobicContact CG2-CG2 3.97Å
142	M	97.1	Very high	98.2	Very high	97 Å²	97	25.7 Å²	25.7	48%	0.478	13%	0.129	S	C	.	.	S	Bend	trans	-104.7	-11.1	-177	-61.8	-62.8	-68.8	0	0	113.7	Y44 R144 R174	Y44-M142 VanDerWaalsContact OH-CE 3.29Å; Y44-M142 WeakPolarHBondContact OH-CE 3.34Å; M142-R144 VanDerWaalsContact C-N 3.3Å; M142-R144 HydrophobicContact CB-CB 4.45Å; M142-R144 HydrophobicContact CB-CG 4.08Å; M142-R144 WeakPolarHBondContact O-CG 3.11Å; M142-R144 PolarHBondContact O-N 2.79Å; M142-R174 PolarHBondContact O-NH2 3.02Å; M142-R174 VanDerWaalsContact O-NH2 3.16Å
143	G	97.7	Very high	98.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	65.4	28.2	-172.7	0	0	0	0	0	114.5	I56 G57 C140 S147 R174	I56-G143 VanDerWaalsContact CG2-O 3.23Å; I56-G143 WeakPolarHBondContact CG2-O 3.34Å; G57-G143 WeakPolarHBondContact O-CA 3.32Å; C140-G143 VanDerWaalsContact SG-CA 3.58Å; C140-G143 PolarHBondContact SG-N 3.26Å; G143-S147 WeakPolarHBondContact CA-OG 3.35Å; G143-R174 PolarHBondContact O-NE 2.89Å
144	R	96.9	Very high	98.4	Very high	74 Å²	74	15.2 Å²	15.2	28%	0.279	7%	0.071	S	C	.	.	S	Bend	trans	-117	-36.4	-173.6	-61.1	-168.9	69.4	-155.8	-6.1	115.3	M142 A148 C175 I176 L177	M142-R144 VanDerWaalsContact C-N 3.3Å; M142-R144 HydrophobicContact CB-CB 4.45Å; M142-R144 HydrophobicContact CB-CG 4.08Å; M142-R144 WeakPolarHBondContact O-CG 3.11Å; M142-R144 PolarHBondContact O-N 2.79Å; R144-A148 VanDerWaalsContact O-CB 3.28Å; R144-A148 WeakPolarHBondContact O-CB 3.23Å; R144-C175 WeakPolarHBondContact CG-O 3.48Å; R144-C175 PolarHBondContact NE-O 3.43Å; R144-C175 PolarHBondContact NH2-SG 3.13Å; R144-I176 WeakPolarHBondContact O-CA 3.48Å; R144-L177 CarbonylContact O-C 3.51Å; R144-L177 PolarHBondContact O-N 3.2Å
145	S	98.2	Very high	98.5	Very high	6 Å²	6	14.2 Å²	14.2	4%	0.042	7%	0.066	C	C	.	.	S	Bend	trans	-113.9	-81	-173.6	173.8	0	0	0	0	111.3	D108 S147 A148 T149 N179 F182	D108-S145 VanDerWaalsContact OD1-CB 3.31Å; D108-S145 WeakPolarHBondContact OD1-CB 3.39Å; D108-S145 PolarHBondContact OD1-OG 3.34Å; D108-S145 VanDerWaalsContact OD2-CB 3.24Å; D108-S145 WeakPolarHBondContact OD2-CB 3.46Å; D108-S145 PolarHBondContact OD2-OG 3.4Å; S145-S147 PolarHBondContact O-N 3.28Å; S145-A148 WeakPolarHBondContact O-CB 3.46Å; S145-A148 PolarHBondContact O-N 3.39Å; S145-T149 PolarHBondContact O-N 2.93Å; S145-T149 PolarHBondContact O-OG1 3.18Å; S145-N179 PolarHBondContact OG-N 3.01Å; S145-F182 WeakPolarHBondContact OG-CD2 3.41Å
146	R	98.6	Very high	98.5	Very high	14 Å²	14	11.2 Å²	11.2	5%	0.053	5%	0.053	C	C	.	.	H	α-helix	trans	-48.9	-57	-177.4	-69.5	169.4	-77.6	-173.6	-8.4	114.8	A79 A80 N86 A106 D108 I114 C140 T149 L150 F182	A79-R146 HydrophobicContact CB-CB 4.06Å; A79-R146 WeakPolarHBondContact O-CD 3.45Å; A80-R146 VanDerWaalsContact CB-NH1 3.34Å; N86-R146 PolarHBondContact OD1-NH1 2.82Å; A106-R146 WeakPolarHBondContact O-CD 3.3Å; A106-R146 PolarHBondContact O-NH1 2.94Å; D108-R146 HydrophobicContact CB-CG 4.09Å; I114-R146 HydrophobicContact CD1-CB 4.38Å; C140-R146 HydrophobicContact CB-CB 3.85Å; R146-T149 PolarHBondContact O-N 2.99Å; R146-L150 PolarHBondContact O-N 2.87Å; R146-F182 HydrophobicContact CB-CE2 4.39Å; R146-F182 HydrophobicContact CG-CE2 3.66Å; R146-F182 HydrophobicContact CG-CZ 4.08Å
147	S	98.8	Very high	98.5	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-66.1	-39.1	-179.6	52.4	0	0	0	0	112.8	H139 C140 G143 S145 T149 L150 V151	H139-S147 VanDerWaalsContact C-CB 3.5Å; C140-S147 PolarHBondContact SG-OG 3.16Å; C140-S147 VanDerWaalsContact SG-OG 3.38Å; G143-S147 WeakPolarHBondContact CA-OG 3.35Å; S145-S147 PolarHBondContact O-N 3.28Å; S147-T149 PolarHBondContact O-N 2.9Å; S147-L150 PolarHBondContact O-N 3.15Å; S147-V151 PolarHBondContact O-N 3.35Å; S147-V151 VanDerWaalsContact O-N 3.07Å
148	A	98.6	Very high	98.4	Very high	0 Å²	0	18 Å²	18	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-59.3	-46.6	174.8	0	0	0	0	0	111.1	I56 R144 S145 L150 V151 L152 I176 P178	I56-A148 HydrophobicContact CD1-CB 4.37Å; R144-A148 VanDerWaalsContact O-CB 3.28Å; R144-A148 WeakPolarHBondContact O-CB 3.23Å; S145-A148 WeakPolarHBondContact O-CB 3.46Å; S145-A148 PolarHBondContact O-N 3.39Å; A148-L150 VanDerWaalsContact C-N 3.32Å; A148-L150 PolarHBondContact O-N 2.87Å; A148-V151 PolarHBondContact O-N 2.98Å; A148-L152 WeakPolarHBondContact O-CB 3.5Å; A148-L152 WeakPolarHBondContact O-CG 3.43Å; A148-L152 PolarHBondContact O-N 2.66Å; A148-I176 HydrophobicContact CB-CB 3.77Å; A148-I176 HydrophobicContact CB-CD1 4.35Å; A148-I176 HydrophobicContact CB-CG2 3.5Å; A148-I176 VanDerWaalsContact CB-CG2 3.5Å; A148-P178 HydrophobicContact CB-CG 4.43Å
149	T	98.9	Very high	98.4	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-56.2	-44	177	-52.2	0	0	0	0	112.4	I114 F118 S145 R146 S147 L152 A153 F182 L186	I114-T149 HydrophobicContact CD1-CG2 4.27Å; I114-T149 HydrophobicContact CG2-CG2 3.94Å; F118-T149 HydrophobicContact CE1-CG2 3.78Å; F118-T149 HydrophobicContact CZ-CG2 3.96Å; S145-T149 PolarHBondContact O-N 2.93Å; S145-T149 PolarHBondContact O-OG1 3.18Å; R146-T149 PolarHBondContact O-N 2.99Å; S147-T149 PolarHBondContact O-N 2.9Å; T149-L152 PolarHBondContact O-N 2.83Å; T149-A153 WeakPolarHBondContact O-CB 3.38Å; T149-A153 PolarHBondContact O-N 3.4Å; T149-F182 HydrophobicContact CG2-CB 3.91Å; T149-F182 HydrophobicContact CG2-CD2 4.48Å; T149-F182 HydrophobicContact CG2-CG 4.3Å; T149-F182 VanDerWaalsContact OG1-CD2 3.32Å; T149-F182 WeakPolarHBondContact OG1-CD2 3.46Å; T149-L186 HydrophobicContact CG2-CD1 3.94Å; T149-L186 HydrophobicContact CG2-CD2 4.09Å; T149-L186 HydrophobicContact CG2-CG 3.9Å
150	L	98.9	Very high	98.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-67.4	-38.5	179.2	-63.8	-176.5	0	0	0	112.3	L77 A79 I114 F118 A121 R146 S147 A148 Y154	L77-L150 HydrophobicContact CD1-CD1 4.48Å; L77-L150 HydrophobicContact CD2-CD1 3.71Å; A79-L150 HydrophobicContact CB-CD1 3.69Å; I114-L150 HydrophobicContact CD1-CD2 4.21Å; I114-L150 HydrophobicContact CD1-CG 4.35Å; I114-L150 HydrophobicContact CG1-CD2 3.94Å; F118-L150 HydrophobicContact CD1-CD2 3.97Å; F118-L150 HydrophobicContact CE1-CD2 4.31Å; A121-L150 HydrophobicContact CB-CB 4.16Å; A121-L150 HydrophobicContact CB-CD1 4.02Å; A121-L150 HydrophobicContact CB-CD2 4.01Å; A121-L150 HydrophobicContact CB-CG 4.29Å; R146-L150 PolarHBondContact O-N 2.87Å; S147-L150 PolarHBondContact O-N 3.15Å; A148-L150 VanDerWaalsContact C-N 3.32Å; A148-L150 PolarHBondContact O-N 2.87Å; L150-Y154 PolarHBondContact O-N 3.02Å
151	V	98.9	Very high	98.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-67.1	-43	174.5	173.4	0	0	0	0	111.3	V50 I54 I56 V138 S147 A148 A153 Y154 L155 V170	V50-V151 HydrophobicContact CG2-CG1 3.98Å; I54-V151 HydrophobicContact CG2-CG1 4.42Å; I54-V151 HydrophobicContact CG2-CG2 4.21Å; I56-V151 HydrophobicContact CD1-CB 3.97Å; I56-V151 HydrophobicContact CD1-CG1 4.18Å; I56-V151 HydrophobicContact CD1-CG2 3.92Å; I56-V151 HydrophobicContact CG1-CB 4.39Å; I56-V151 HydrophobicContact CG1-CG2 3.8Å; V138-V151 HydrophobicContact CB-CG2 3.76Å; V138-V151 HydrophobicContact CG1-CG2 3.98Å; V138-V151 HydrophobicContact CG2-CG2 3.74Å; S147-V151 PolarHBondContact O-N 3.35Å; S147-V151 VanDerWaalsContact O-N 3.07Å; A148-V151 PolarHBondContact O-N 2.98Å; V151-A153 PolarHBondContact O-N 3.33Å; V151-Y154 WeakPolarHBondContact O-CB 3.28Å; V151-Y154 PolarHBondContact O-N 3.37Å; V151-L155 HydrophobicContact CG1-CD1 4.36Å; V151-L155 HydrophobicContact CG1-CG 4.42Å; V151-L155 WeakPolarHBondContact O-CG 3.32Å; V151-L155 PolarHBondContact O-N 3.37Å; V151-V170 HydrophobicContact CG1-CG2 4.35Å
152	L	98.9	Very high	98.3	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-58.2	-47.8	175.9	-68.9	170.8	0	0	0	110.9	A148 T149 Y154 L155 M156 A166 I167 V170 I176 P178 L186	A148-L152 WeakPolarHBondContact O-CB 3.5Å; A148-L152 WeakPolarHBondContact O-CG 3.43Å; A148-L152 PolarHBondContact O-N 2.66Å; T149-L152 PolarHBondContact O-N 2.83Å; L152-Y154 VanDerWaalsContact C-N 3.33Å; L152-Y154 PolarHBondContact O-N 3.26Å; L152-L155 PolarHBondContact O-N 3.38Å; L152-M156 VanDerWaalsContact O-CG 3.25Å; L152-M156 WeakPolarHBondContact O-CG 3.45Å; L152-M156 PolarHBondContact O-N 3.12Å; L152-A166 HydrophobicContact CD2-CB 3.8Å; L152-A166 WeakPolarHBondContact CD2-O 3.48Å; L152-I167 HydrophobicContact CD1-CG1 4.03Å; L152-I167 HydrophobicContact CD2-CG1 4.15Å; L152-V170 HydrophobicContact CD2-CB 4.1Å; L152-V170 HydrophobicContact CD2-CG2 3.83Å; L152-I176 HydrophobicContact CD1-CD1 4.05Å; L152-I176 HydrophobicContact CD2-CD1 4.3Å; L152-I176 HydrophobicContact CG-CD1 4.49Å; L152-P178 HydrophobicContact CD1-CG 3.92Å; L152-L186 HydrophobicContact CB-CD1 4.09Å; L152-L186 HydrophobicContact CB-CD2 4.09Å; L152-L186 HydrophobicContact CD1-CD1 3.72Å
153	A	98.9	Very high	98.4	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-58.8	-43.6	175.9	0	0	0	0	0	112	F118 T149 V151 L155 M156 M157 L186 L189	F118-A153 HydrophobicContact CB-CB 4.2Å; F118-A153 HydrophobicContact CD1-CB 3.69Å; F118-A153 HydrophobicContact CD2-CB 4.09Å; F118-A153 HydrophobicContact CE1-CB 4Å; F118-A153 HydrophobicContact CE2-CB 4.37Å; F118-A153 HydrophobicContact CG-CB 3.73Å; F118-A153 HydrophobicContact CZ-CB 4.32Å; T149-A153 WeakPolarHBondContact O-CB 3.38Å; T149-A153 PolarHBondContact O-N 3.4Å; V151-A153 PolarHBondContact O-N 3.33Å; A153-L155 PolarHBondContact O-N 2.92Å; A153-M156 PolarHBondContact O-N 3.5Å; A153-M157 WeakPolarHBondContact O-CB 3.35Å; A153-M157 VanDerWaalsContact O-CG 3.25Å; A153-M157 WeakPolarHBondContact O-CG 3.44Å; A153-M157 PolarHBondContact O-N 2.81Å; A153-L186 HydrophobicContact CB-CD2 4.02Å; A153-L189 HydrophobicContact CB-CD2 3.84Å
154	Y	98.9	Very high	98.4	Very high	5 Å²	5	21.9 Å²	21.9	2%	0.02	11%	0.11	C	C	.	.	H	α-helix	trans	-58.7	-46.3	174.9	163.3	-94.8	0	0	0	112.2	I54 T122 I125 H126 L129 L150 V151 L152 M156 M157 K158 H159	I54-Y154 HydrophobicContact CD1-CD1 3.82Å; I54-Y154 HydrophobicContact CD1-CE1 3.3Å; T122-Y154 HydrophobicContact CG2-CD2 3.91Å; T122-Y154 WeakPolarHBondContact OG1-CA 3.46Å; I125-Y154 HydrophobicContact CB-CD2 3.8Å; I125-Y154 HydrophobicContact CB-CE2 4.01Å; I125-Y154 HydrophobicContact CB-CG 4.25Å; I125-Y154 HydrophobicContact CD1-CD2 4.45Å; I125-Y154 HydrophobicContact CD1-CG 4.15Å; I125-Y154 HydrophobicContact CG2-CD1 4.01Å; I125-Y154 HydrophobicContact CG2-CD2 3.66Å; I125-Y154 HydrophobicContact CG2-CE1 3.91Å; I125-Y154 HydrophobicContact CG2-CE2 3.55Å; I125-Y154 HydrophobicContact CG2-CG 3.9Å; H126-Y154 HydrophobicContact CB-CE2 3.97Å; L129-Y154 WeakPolarHBondContact CD1-OH 3.19Å; L150-Y154 PolarHBondContact O-N 3.02Å; V151-Y154 WeakPolarHBondContact O-CB 3.28Å; V151-Y154 PolarHBondContact O-N 3.37Å; L152-Y154 VanDerWaalsContact C-N 3.33Å; L152-Y154 PolarHBondContact O-N 3.26Å; Y154-M156 VanDerWaalsContact C-N 3.33Å; Y154-M156 PolarHBondContact O-N 2.82Å; Y154-M157 PolarHBondContact O-N 3.28Å; Y154-K158 HydrophobicContact CD2-CB 4.22Å; Y154-K158 HydrophobicContact CD2-CG 3.95Å; Y154-K158 HydrophobicContact CE2-CB 3.86Å; Y154-K158 HydrophobicContact CE2-CG 3.81Å; Y154-K158 WeakPolarHBondContact O-CB 3.49Å; Y154-K158 PolarHBondContact O-N 2.94Å; Y154-H159 AromaticContact CE1-CD2 3.69Å; Y154-H159 AromaticContact CE1-NE2 3.52Å; Y154-H159 AromaticContact CZ-CD2 3.92Å; Y154-H159 AromaticContact CZ-NE2 3.42Å; Y154-H159 PolarHBondContact OH-NE2 3.35Å
155	L	98.9	Very high	98.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.7	-41.4	178.8	-66.4	179.4	0	0	0	111.6	W51 V151 L152 A153 H159 S160 L161 A166 V170	W51-L155 HydrophobicContact CB-CD2 4.36Å; W51-L155 HydrophobicContact CD2-CD2 3.52Å; W51-L155 HydrophobicContact CE3-CD1 4.35Å; W51-L155 HydrophobicContact CE3-CD2 3.6Å; W51-L155 HydrophobicContact CG-CD2 3.86Å; W51-L155 HydrophobicContact CZ2-CD2 4.49Å; W51-L155 HydrophobicContact CZ3-CD2 4.13Å; V151-L155 HydrophobicContact CG1-CD1 4.36Å; V151-L155 HydrophobicContact CG1-CG 4.42Å; V151-L155 WeakPolarHBondContact O-CG 3.32Å; V151-L155 PolarHBondContact O-N 3.37Å; L152-L155 PolarHBondContact O-N 3.38Å; A153-L155 PolarHBondContact O-N 2.92Å; L155-H159 CarbonylContact O-C 3.55Å; L155-H159 VanDerWaalsContact O-CA 3.32Å; L155-H159 WeakPolarHBondContact O-CA 3.32Å; L155-H159 VanDerWaalsContact O-CB 3.3Å; L155-H159 WeakPolarHBondContact O-CB 3.49Å; L155-H159 PolarHBondContact O-N 3.49Å; L155-S160 PolarHBondContact O-N 3.33Å; L155-L161 HydrophobicContact CB-CD1 4.08Å; L155-L161 HydrophobicContact CD1-CD1 4.49Å; L155-A166 HydrophobicContact CB-CB 4.3Å; L155-V170 HydrophobicContact CD1-CG2 3.65Å
156	M	98.8	Very high	98.5	Very high	3 Å²	3	22.4 Å²	22.4	2%	0.015	12%	0.115	C	C	.	.	H	α-helix	trans	-64	-46.7	176.3	-64.1	164.3	63.4	0	0	111.9	L152 A153 Y154 S160 L161 V163 A166 L186 L189 D190 L193	L152-M156 VanDerWaalsContact O-CG 3.25Å; L152-M156 WeakPolarHBondContact O-CG 3.45Å; L152-M156 PolarHBondContact O-N 3.12Å; A153-M156 PolarHBondContact O-N 3.5Å; Y154-M156 VanDerWaalsContact C-N 3.33Å; Y154-M156 PolarHBondContact O-N 2.82Å; M156-S160 WeakPolarHBondContact O-CA 3.41Å; M156-S160 PolarHBondContact O-N 3.17Å; M156-L161 VanDerWaalsContact CA-O 3.27Å; M156-L161 WeakPolarHBondContact CA-O 3.49Å; M156-L161 WeakPolarHBondContact CB-O 3.31Å; M156-L161 WeakPolarHBondContact CG-O 3.25Å; M156-V163 HydrophobicContact CE-CB 3.91Å; M156-V163 HydrophobicContact SD-CB 4.11Å; M156-V163 HydrophobicContact SD-CG2 4.31Å; M156-A166 HydrophobicContact CG-CB 3.91Å; M156-L186 WeakPolarHBondContact CE-O 3.4Å; M156-L186 HydrophobicContact SD-CD2 3.94Å; M156-L189 HydrophobicContact CB-CD2 4.41Å; M156-L189 HydrophobicContact CE-CB 4.16Å; M156-L189 HydrophobicContact CE-CD2 3.9Å; M156-L189 HydrophobicContact CE-CG 3.91Å; M156-L189 HydrophobicContact SD-CD2 4.16Å; M156-D190 HydrophobicContact CE-CB 3.63Å; M156-L193 HydrophobicContact CB-CD1 3.83Å; M156-L193 HydrophobicContact CE-CD1 4.38Å
157	M	98.8	Very high	98.5	Very high	57 Å²	57	21.8 Å²	21.8	28%	0.281	11%	0.113	S	C	.	.	H	α-helix	trans	-75.1	-33.6	-174.9	-68.9	176.6	71.5	0	0	113.9	F118 L119 T122 A153 Y154 L189 L193	F118-M157 HydrophobicContact CB-SD 4.21Å; L119-M157 HydrophobicContact CD1-CE 4.09Å; T122-M157 HydrophobicContact CG2-CB 3.99Å; T122-M157 HydrophobicContact CG2-CE 4.41Å; T122-M157 HydrophobicContact CG2-SD 4.31Å; A153-M157 WeakPolarHBondContact O-CB 3.35Å; A153-M157 VanDerWaalsContact O-CG 3.25Å; A153-M157 WeakPolarHBondContact O-CG 3.44Å; A153-M157 PolarHBondContact O-N 2.81Å; Y154-M157 PolarHBondContact O-N 3.28Å; M157-L189 HydrophobicContact CG-CD1 4.11Å; M157-L189 HydrophobicContact CG-CD2 4.11Å; M157-L189 HydrophobicContact SD-CD1 4.27Å; M157-L189 HydrophobicContact SD-CD2 4.33Å; M157-L193 HydrophobicContact CG-CD1 4.36Å
158	K	98.3	Very high	98.3	Very high	85 Å²	85	26 Å²	26	37%	0.37	13%	0.133	S	C	.	.	H	α-helix	trans	-111.4	-18.3	-172.7	-64.3	-64.4	-177.3	-179.3	0	114.9	T122 H126 Y154	T122-K158 HydrophobicContact CG2-CD 4.08Å; T122-K158 HydrophobicContact CG2-CG 3.44Å; T122-K158 VanDerWaalsContact CG2-CG 3.44Å; H126-K158 HydrophobicContact CB-CD 4.48Å; H126-K158 HydrophobicContact CB-CG 4.4Å; Y154-K158 HydrophobicContact CD2-CB 4.22Å; Y154-K158 HydrophobicContact CD2-CG 3.95Å; Y154-K158 HydrophobicContact CE2-CB 3.86Å; Y154-K158 HydrophobicContact CE2-CG 3.81Å; Y154-K158 WeakPolarHBondContact O-CB 3.49Å; Y154-K158 PolarHBondContact O-N 2.94Å
159	H	97.8	Very high	98.2	Very high	67 Å²	67	28.8 Å²	28.8	31%	0.31	15%	0.146	S	C	.	.	H	α-helix	trans	-117.9	10.6	177.8	-61.2	-82.4	0	0	0	112.4	W51 Y154 L155 L161	W51-H159 AromaticContact CE2-CE1 4Å; W51-H159 HydrophobicContact CH2-CB 4.46Å; W51-H159 HydrophobicContact CZ2-CB 4.37Å; W51-H159 AromaticContact CZ2-CE1 3.81Å; W51-H159 AromaticContact CZ2-CG 3.72Å; W51-H159 AromaticContact CZ2-ND1 3.44Å; W51-H159 WeakPolarHBondContact CZ2-ND1 3.27Å; W51-H159 AromaticContact NE1-CE1 3.74Å; W51-H159 AromaticContact NE1-NE2 3.8Å; Y154-H159 AromaticContact CE1-CD2 3.69Å; Y154-H159 AromaticContact CE1-NE2 3.52Å; Y154-H159 AromaticContact CZ-CD2 3.92Å; Y154-H159 AromaticContact CZ-NE2 3.42Å; Y154-H159 PolarHBondContact OH-NE2 3.35Å; L155-H159 CarbonylContact O-C 3.55Å; L155-H159 VanDerWaalsContact O-CA 3.32Å; L155-H159 WeakPolarHBondContact O-CA 3.32Å; L155-H159 VanDerWaalsContact O-CB 3.3Å; L155-H159 WeakPolarHBondContact O-CB 3.49Å; L155-H159 PolarHBondContact O-N 3.49Å; H159-L161 HydrophobicContact CB-CG 4.3Å; H159-L161 PolarHBondContact O-N 2.87Å
160	S	96.1	Very high	98.1	Very high	76 Å²	76	28.8 Å²	28.8	53%	0.531	15%	0.146	S	C	.	.			trans	58.4	15.2	175	-57.8	0	0	0	0	115.4	L155 M156 K197	L155-S160 PolarHBondContact O-N 3.33Å; M156-S160 WeakPolarHBondContact O-CA 3.41Å; M156-S160 PolarHBondContact O-N 3.17Å; S160-K197 PolarHBondContact O-NZ 3.23Å
161	L	98.5	Very high	98	Very high	33 Å²	33	29.7 Å²	29.7	17%	0.173	15%	0.15	C	C	.	.			trans	-65.8	144.9	175.8	-59.1	-168.6	0	0	0	110.5	L155 M156 H159 E165 A166	L155-L161 HydrophobicContact CB-CD1 4.08Å; L155-L161 HydrophobicContact CD1-CD1 4.49Å; M156-L161 VanDerWaalsContact CA-O 3.27Å; M156-L161 WeakPolarHBondContact CA-O 3.49Å; M156-L161 WeakPolarHBondContact CB-O 3.31Å; M156-L161 WeakPolarHBondContact CG-O 3.25Å; H159-L161 HydrophobicContact CB-CG 4.3Å; H159-L161 PolarHBondContact O-N 2.87Å; L161-E165 HydrophobicContact CB-CB 4.13Å; L161-E165 HydrophobicContact CD2-CB 4.35Å; L161-A166 HydrophobicContact CB-CB 4.29Å; L161-A166 HydrophobicContact CD1-CB 4.43Å
162	T	98.6	Very high	97.7	Very high	12 Å²	12	35.6 Å²	35.6	7%	0.074	18%	0.177	C	C	.	.			trans	-68.9	164.4	163.8	62.3	0	0	0	0	110.5	Y24 V164 E165 A166 D190	Y24-T162 HydrophobicContact CD1-CG2 3.88Å; Y24-T162 HydrophobicContact CD2-CG2 3.77Å; Y24-T162 HydrophobicContact CE1-CG2 3.66Å; Y24-T162 HydrophobicContact CE2-CG2 3.55Å; Y24-T162 HydrophobicContact CG-CG2 3.93Å; Y24-T162 VanDerWaalsContact CZ-CB 3.47Å; Y24-T162 VanDerWaalsContact CZ-CG2 3.49Å; Y24-T162 WeakPolarHBondContact OH-CB 3.44Å; T162-V164 PolarHBondContact O-N 3.3Å; T162-E165 WeakPolarHBondContact CB-OE2 3.4Å; T162-E165 WeakPolarHBondContact CG2-OE2 3.24Å; T162-E165 PolarHBondContact N-OE2 3.39Å; T162-E165 PolarHBondContact O-N 3.36Å; T162-E165 WeakPolarHBondContact OG1-CB 3.32Å; T162-E165 VanDerWaalsContact OG1-CD 3.29Å; T162-E165 WeakPolarHBondContact OG1-CG 3.29Å; T162-E165 PolarHBondContact OG1-N 2.95Å; T162-E165 PolarHBondContact OG1-OE2 3.18Å; T162-A166 WeakPolarHBondContact O-CB 3.37Å; T162-A166 PolarHBondContact O-N 2.98Å; T162-D190 WeakPolarHBondContact CA-OD1 3.07Å
163	V	98.6	Very high	97.6	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-58.8	-35.8	174.3	63.8	0	0	0	0	112.4	L32 M156 I167 L186 D190	L32-V163 HydrophobicContact CD1-CG1 4.3Å; L32-V163 HydrophobicContact CD1-CG2 4.17Å; L32-V163 HydrophobicContact CD2-CG1 3.89Å; L32-V163 HydrophobicContact CD2-CG2 4.35Å; M156-V163 HydrophobicContact CE-CB 3.91Å; M156-V163 HydrophobicContact SD-CB 4.11Å; M156-V163 HydrophobicContact SD-CG2 4.31Å; V163-I167 HydrophobicContact CG2-CD1 3.89Å; V163-I167 HydrophobicContact CG2-CG1 4.5Å; V163-I167 WeakPolarHBondContact O-CB 3.36Å; V163-I167 WeakPolarHBondContact O-CD1 3.43Å; V163-I167 VanDerWaalsContact O-CG1 3.23Å; V163-I167 WeakPolarHBondContact O-CG1 3.31Å; V163-I167 PolarHBondContact O-N 3.36Å; V163-L186 HydrophobicContact CG2-CB 3.93Å; V163-D190 HydrophobicContact CB-CB 3.97Å; V163-D190 HydrophobicContact CG1-CB 3.94Å; V163-D190 PolarHBondContact N-OD1 2.94Å
164	V	98	Very high	97.4	Very high	27 Å²	27	40.7 Å²	40.7	16%	0.164	20%	0.199	C	C	.	.	H	α-helix	trans	-67.2	-52.9	178.5	179.4	0	0	0	0	110.4	Y24 P27 L32 L35 T162 A166 I167 E168	Y24-V164 HydrophobicContact CE2-CG2 4.43Å; P27-V164 HydrophobicContact CG-CG2 3.56Å; L32-V164 HydrophobicContact CD2-CG2 4.14Å; L35-V164 HydrophobicContact CD1-CG1 4.24Å; L35-V164 HydrophobicContact CD1-CG2 4.48Å; T162-V164 PolarHBondContact O-N 3.3Å; V164-A166 VanDerWaalsContact C-N 3.29Å; V164-A166 PolarHBondContact O-N 3.41Å; V164-I167 PolarHBondContact O-N 3.1Å; V164-I167 VanDerWaalsContact O-N 3.14Å; V164-E168 HydrophobicContact CG1-CG 4.31Å; V164-E168 WeakPolarHBondContact O-CG 3.46Å; V164-E168 PolarHBondContact O-N 3.13Å
165	E	98.3	Very high	97.2	Very high	91 Å²	91	41.9 Å²	41.9	43%	0.425	21%	0.208	S	C	.	.	H	α-helix	trans	-59.2	-41.1	179.4	-70.7	164.6	138.8	0	0	111.9	L161 T162 H169	L161-E165 HydrophobicContact CB-CB 4.13Å; L161-E165 HydrophobicContact CD2-CB 4.35Å; T162-E165 WeakPolarHBondContact CB-OE2 3.4Å; T162-E165 WeakPolarHBondContact CG2-OE2 3.24Å; T162-E165 PolarHBondContact N-OE2 3.39Å; T162-E165 PolarHBondContact O-N 3.36Å; T162-E165 WeakPolarHBondContact OG1-CB 3.32Å; T162-E165 VanDerWaalsContact OG1-CD 3.29Å; T162-E165 WeakPolarHBondContact OG1-CG 3.29Å; T162-E165 PolarHBondContact OG1-N 2.95Å; T162-E165 PolarHBondContact OG1-OE2 3.18Å; E165-H169 WeakPolarHBondContact O-CB 3.33Å; E165-H169 PolarHBondContact O-N 2.88Å
166	A	98.6	Very high	97	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.1	-45.6	177	0	0	0	0	0	111.6	L152 L155 M156 L161 T162 V164 V170	L152-A166 HydrophobicContact CD2-CB 3.8Å; L152-A166 WeakPolarHBondContact CD2-O 3.48Å; L155-A166 HydrophobicContact CB-CB 4.3Å; M156-A166 HydrophobicContact CG-CB 3.91Å; L161-A166 HydrophobicContact CB-CB 4.29Å; L161-A166 HydrophobicContact CD1-CB 4.43Å; T162-A166 WeakPolarHBondContact O-CB 3.37Å; T162-A166 PolarHBondContact O-N 2.98Å; V164-A166 VanDerWaalsContact C-N 3.29Å; V164-A166 PolarHBondContact O-N 3.41Å; A166-V170 WeakPolarHBondContact O-CG2 3.31Å; A166-V170 PolarHBondContact O-N 3.27Å; A166-V170 VanDerWaalsContact O-N 3.13Å
167	I	97.8	Very high	96.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.9	-53.4	177.7	-74.6	168.8	0	0	0	110.1	L32 L35 F36 L152 V163 V164 H169 V170 Q171 L183	L32-I167 HydrophobicContact CD2-CD1 4.3Å; L35-I167 HydrophobicContact CB-CG2 4.33Å; L35-I167 HydrophobicContact CD1-CB 4.49Å; L35-I167 HydrophobicContact CD1-CD1 4.32Å; L35-I167 HydrophobicContact CD1-CG2 4.12Å; F36-I167 HydrophobicContact CE1-CG2 3.68Å; F36-I167 HydrophobicContact CE2-CD1 4.44Å; F36-I167 HydrophobicContact CE2-CG2 4.31Å; F36-I167 HydrophobicContact CZ-CB 4.49Å; F36-I167 HydrophobicContact CZ-CD1 4.14Å; F36-I167 HydrophobicContact CZ-CG1 4.18Å; F36-I167 HydrophobicContact CZ-CG2 3.51Å; L152-I167 HydrophobicContact CD1-CG1 4.03Å; L152-I167 HydrophobicContact CD2-CG1 4.15Å; V163-I167 HydrophobicContact CG2-CD1 3.89Å; V163-I167 HydrophobicContact CG2-CG1 4.5Å; V163-I167 WeakPolarHBondContact O-CB 3.36Å; V163-I167 WeakPolarHBondContact O-CD1 3.43Å; V163-I167 VanDerWaalsContact O-CG1 3.23Å; V163-I167 WeakPolarHBondContact O-CG1 3.31Å; V163-I167 PolarHBondContact O-N 3.36Å; V164-I167 PolarHBondContact O-N 3.1Å; V164-I167 VanDerWaalsContact O-N 3.14Å; I167-H169 VanDerWaalsContact C-N 3.31Å; I167-H169 PolarHBondContact O-N 2.84Å; I167-V170 PolarHBondContact O-N 3.45Å; I167-Q171 WeakPolarHBondContact O-CB 3.04Å; I167-Q171 PolarHBondContact O-N 2.98Å; I167-L183 HydrophobicContact CD1-CD2 4.13Å
168	E	96	Very high	96.9	Very high	90 Å²	90	43.3 Å²	43.3	42%	0.421	22%	0.216	S	C	.	.	H	α-helix	trans	-58.8	-44	-178	-71.2	-179.3	156.5	0	0	111.4	V164 Q171 Q172	V164-E168 HydrophobicContact CG1-CG 4.31Å; V164-E168 WeakPolarHBondContact O-CG 3.46Å; V164-E168 PolarHBondContact O-N 3.13Å; E168-Q171 PolarHBondContact O-N 3.27Å; E168-Q172 VanDerWaalsContact O-CG 3.24Å; E168-Q172 WeakPolarHBondContact O-CG 3.49Å; E168-Q172 PolarHBondContact O-N 3.2Å; E168-Q172 VanDerWaalsContact O-N 3.11Å
169	H	96.5	Very high	96.8	Very high	58 Å²	58	40.4 Å²	40.4	27%	0.269	21%	0.205	S	C	.	.	H	α-helix	trans	-59.5	-51.5	178.9	-170.3	97.2	0	0	0	111.9	V50 W51 E165 I167	V50-H169 PolarHBondContact O-CD2 2.78Å; V50-H169 VanDerWaalsContact O-CD2 3.25Å; V50-H169 PolarHBondContact O-NE2 3.27Å; W51-H169 AromaticContact CE3-CD2 3.74Å; W51-H169 AromaticContact CE3-CE1 3.73Å; W51-H169 AromaticContact CE3-NE2 3.3Å; W51-H169 VanDerWaalsContact CE3-NE2 3.3Å; W51-H169 AromaticContact CZ3-CE1 3.55Å; W51-H169 AromaticContact CZ3-ND1 3.95Å; W51-H169 AromaticContact CZ3-NE2 3.63Å; E165-H169 WeakPolarHBondContact O-CB 3.33Å; E165-H169 PolarHBondContact O-N 2.88Å; I167-H169 VanDerWaalsContact C-N 3.31Å; I167-H169 PolarHBondContact O-N 2.84Å
170	V	97.1	Very high	96.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-70.6	-39.5	-177.3	177.3	0	0	0	0	110.8	V50 I56 V151 L152 L155 A166 I167 Q172 K173 R174 I176	V50-V170 HydrophobicContact CB-CG1 4.13Å; V50-V170 HydrophobicContact CB-CG2 4.5Å; V50-V170 HydrophobicContact CG1-CG1 4.1Å; I56-V170 HydrophobicContact CD1-CG1 3.84Å; V151-V170 HydrophobicContact CG1-CG2 4.35Å; L152-V170 HydrophobicContact CD2-CB 4.1Å; L152-V170 HydrophobicContact CD2-CG2 3.83Å; L155-V170 HydrophobicContact CD1-CG2 3.65Å; A166-V170 WeakPolarHBondContact O-CG2 3.31Å; A166-V170 PolarHBondContact O-N 3.27Å; A166-V170 VanDerWaalsContact O-N 3.13Å; I167-V170 PolarHBondContact O-N 3.45Å; V170-Q172 VanDerWaalsContact C-N 3.27Å; V170-Q172 PolarHBondContact O-N 3.1Å; V170-K173 PolarHBondContact O-N 3.46Å; V170-R174 PolarHBondContact O-N 2.94Å; V170-I176 HydrophobicContact CB-CD1 3.9Å; V170-I176 HydrophobicContact CG1-CD1 3.68Å; V170-I176 HydrophobicContact CG1-CG1 4.14Å; V170-I176 HydrophobicContact CG1-CG2 3.82Å
171	Q	94.9	Very high	96.9	Very high	19 Å²	19	36.4 Å²	36.4	9%	0.089	18%	0.179	C	C	.	.	H	α-helix	trans	-63	-31.5	-179.2	-175.1	-179.7	4	0	0	112.6	L35 T40 I167 E168 K173 R174 I176	L35-Q171 PolarHBondContact O-NE2 3.37Å; L35-Q171 PolarHBondContact O-OE1 3.02Å; T40-Q171 PolarHBondContact OG1-O 3.37Å; I167-Q171 WeakPolarHBondContact O-CB 3.04Å; I167-Q171 PolarHBondContact O-N 2.98Å; E168-Q171 PolarHBondContact O-N 3.27Å; Q171-K173 PolarHBondContact O-N 3.02Å; Q171-R174 WeakPolarHBondContact CA-O 3.36Å; Q171-I176 HydrophobicContact CB-CG1 4.26Å
172	Q	94.3	Very high	96.9	Very high	124 Å²	124	34.8 Å²	34.8	58%	0.579	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-21.2	173.3	-74.2	172	20.8	0	0	113.4	E168 V170	E168-Q172 VanDerWaalsContact O-CG 3.24Å; E168-Q172 WeakPolarHBondContact O-CG 3.49Å; E168-Q172 PolarHBondContact O-N 3.2Å; E168-Q172 VanDerWaalsContact O-N 3.11Å; V170-Q172 VanDerWaalsContact C-N 3.27Å; V170-Q172 PolarHBondContact O-N 3.1Å
173	K	95.7	Very high	96.9	Very high	101 Å²	101	34.3 Å²	34.3	44%	0.439	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-25.8	-176.4	-57.1	-60	-178.6	-176.4	0	113.1	N48 V50 V170 Q171	N48-K173 WeakPolarHBondContact CB-O 3.4Å; N48-K173 VanDerWaalsContact CG-O 3.28Å; N48-K173 PolarHBondContact ND2-O 2.82Å; V50-K173 HydrophobicContact CB-CB 4.28Å; V50-K173 HydrophobicContact CG1-CB 4.05Å; V170-K173 PolarHBondContact O-N 3.46Å; Q171-K173 PolarHBondContact O-N 3.02Å
174	R	95.4	Very high	96.9	Very high	6 Å²	6	39.2 Å²	39.2	2%	0.023	19%	0.189	C	C	.	.	S	Bend	trans	-151	143.6	-179.8	-175.2	170.2	-178.9	83.9	-6	111.6	T45 H46 N48 V50 M142 G143 V170 Q171 I176	T45-R174 PolarHBondContact O-NH1 3.18Å; H46-R174 PolarHBondContact O-NH1 3.2Å; H46-R174 PolarHBondContact O-NH2 3.2Å; H46-R174 VanDerWaalsContact O-NH2 3.08Å; N48-R174 HydrophobicContact CB-CB 4.06Å; N48-R174 HydrophobicContact CB-CG 4.45Å; N48-R174 WeakPolarHBondContact OD1-CG 3.35Å; N48-R174 PolarHBondContact OD1-NH1 2.87Å; V50-R174 HydrophobicContact CG1-CB 3.87Å; M142-R174 PolarHBondContact O-NH2 3.02Å; M142-R174 VanDerWaalsContact O-NH2 3.16Å; G143-R174 PolarHBondContact O-NE 2.89Å; V170-R174 PolarHBondContact O-N 2.94Å; Q171-R174 WeakPolarHBondContact CA-O 3.36Å; R174-I176 VanDerWaalsContact C-N 3.32Å; R174-I176 HydrophobicContact CB-CG2 4.32Å; R174-I176 HydrophobicContact CG-CG2 4.21Å; R174-I176 PolarHBondContact O-N 2.71Å
175	C	94.2	Very high	96.9	Very high	29 Å²	29	39.3 Å²	39.3	20%	0.196	19%	0.188	C	C	.	.			trans	-70.4	83.3	172.1	-170.3	0	0	0	0	112.5	T40 Y44 R144	T40-C175 HydrophobicContact CG2-CB 3.55Å; T40-C175 VanDerWaalsContact CG2-SG 3.59Å; Y44-C175 HydrophobicContact CD2-CB 4.22Å; R144-C175 WeakPolarHBondContact CG-O 3.48Å; R144-C175 PolarHBondContact NE-O 3.43Å; R144-C175 PolarHBondContact NH2-SG 3.13Å
176	I	95.6	Very high	96.9	Very high	4 Å²	4	35 Å²	35	2%	0.021	17%	0.168	C	C	.	.			trans	-92.9	152.4	174.2	59.7	156.1	0	0	0	111.3	F36 R144 A148 L152 V170 Q171 R174	F36-I176 WeakPolarHBondContact CD1-O 3.4Å; F36-I176 HydrophobicContact CE1-CD1 4.18Å; F36-I176 HydrophobicContact CE1-CG1 4.05Å; R144-I176 WeakPolarHBondContact O-CA 3.48Å; A148-I176 HydrophobicContact CB-CB 3.77Å; A148-I176 HydrophobicContact CB-CD1 4.35Å; A148-I176 HydrophobicContact CB-CG2 3.5Å; A148-I176 VanDerWaalsContact CB-CG2 3.5Å; L152-I176 HydrophobicContact CD1-CD1 4.05Å; L152-I176 HydrophobicContact CD2-CD1 4.3Å; L152-I176 HydrophobicContact CG-CD1 4.49Å; V170-I176 HydrophobicContact CB-CD1 3.9Å; V170-I176 HydrophobicContact CG1-CD1 3.68Å; V170-I176 HydrophobicContact CG1-CG1 4.14Å; V170-I176 HydrophobicContact CG1-CG2 3.82Å; Q171-I176 HydrophobicContact CB-CG1 4.26Å; R174-I176 VanDerWaalsContact C-N 3.32Å; R174-I176 HydrophobicContact CB-CG2 4.32Å; R174-I176 HydrophobicContact CG-CG2 4.21Å; R174-I176 PolarHBondContact O-N 2.71Å
177	L	95.9	Very high	96.9	Very high	83 Å²	83	35.4 Å²	35.4	44%	0.435	17%	0.169	S	C	.	.			trans	-158.5	79.4	172.5	-177.1	63.1	0	0	0	108.1	F36 R144	F36-L177 HydrophobicContact CB-CD1 3.58Å; F36-L177 HydrophobicContact CD1-CD1 4.13Å; F36-L177 HydrophobicContact CD2-CD1 3.73Å; F36-L177 HydrophobicContact CE2-CD1 4.47Å; F36-L177 HydrophobicContact CG-CD1 3.53Å; R144-L177 CarbonylContact O-C 3.51Å; R144-L177 PolarHBondContact O-N 3.2Å
178	P	98	Very high	97	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.019	19%	0.189	C	C	.	.			trans	-53.9	142.3	169.9	-24.1	35.3	0	0	0	111.1	A148 L152 F182 L183	A148-P178 HydrophobicContact CB-CG 4.43Å; L152-P178 HydrophobicContact CD1-CG 3.92Å; P178-F182 HydrophobicContact CB-CB 4.17Å; P178-L183 HydrophobicContact CB-CD2 3.92Å; P178-L183 HydrophobicContact CB-CG 4.16Å; P178-L183 HydrophobicContact CG-CD2 4.19Å
179	N	97.9	Very high	97.1	Very high	25 Å²	25	34.6 Å²	34.6	13%	0.134	18%	0.175	C	C	.	.			trans	-65.4	159.1	175.6	73.9	61.3	0	0	0	111.5	D108 P110 S145 G181 F182 L183	D108-N179 PolarHBondContact OD1-ND2 3.33Å; P110-N179 WeakPolarHBondContact CA-OD1 3.42Å; P110-N179 HydrophobicContact CG-CB 4.35Å; S145-N179 PolarHBondContact OG-N 3.01Å; N179-G181 PolarHBondContact O-N 3.14Å; N179-G181 VanDerWaalsContact O-N 3.13Å; N179-G181 WeakPolarHBondContact OD1-CA 3.17Å; N179-G181 PolarHBondContact OD1-N 3.15Å; N179-F182 WeakPolarHBondContact ND2-CD2 3.44Å; N179-F182 WeakPolarHBondContact ND2-CE2 3.37Å; N179-F182 WeakPolarHBondContact ND2-CG 3.24Å; N179-F182 VanDerWaalsContact ND2-CZ 3.34Å; N179-F182 WeakPolarHBondContact ND2-CZ 3.42Å; N179-F182 WeakPolarHBondContact O-CA 3.44Å; N179-F182 WeakPolarHBondContact O-CB 3.33Å; N179-F182 PolarHBondContact O-N 2.95Å; N179-F182 PolarHBondContact OD1-N 3.44Å; N179-L183 PolarHBondContact O-N 2.95Å
180	H	97.1	Very high	97.2	Very high	52 Å²	52	31.9 Å²	31.9	24%	0.241	16%	0.162	C	C	.	.	H	α-helix	trans	-50.7	-40.7	-178.2	-176.4	78.1	0	0	0	114.1	Y13 T29 E33 F182 L183 K184	Y13-H180 AromaticContact CE1-CE1 3.8Å; T29-H180 WeakPolarHBondContact CG2-CE1 3.47Å; E33-H180 VanDerWaalsContact CD-ND1 3.34Å; E33-H180 WeakPolarHBondContact OE1-CB 3.38Å; E33-H180 IonicContact OE1-CE1 3.18Å; E33-H180 IonicContact OE1-CG 3.54Å; E33-H180 VanDerWaalsContact OE1-CG 3.25Å; E33-H180 IonicContact OE1-ND1 2.74Å; E33-H180 PolarHBondContact OE1-ND1 2.81Å; E33-H180 IonicContact OE2-ND1 3.99Å; H180-F182 VanDerWaalsContact C-N 3.32Å; H180-F182 PolarHBondContact O-N 3.03Å; H180-L183 PolarHBondContact O-N 3.23Å; H180-K184 PolarHBondContact O-N 2.79Å
181	G	98.1	Very high	97.3	Very high	6 Å²	6	33 Å²	33	6%	0.062	17%	0.168	C	C	.	.	H	α-helix	trans	-67.8	-32.7	180	0	0	0	0	0	112.9	P110 N179 Q185	P110-G181 WeakPolarHBondContact O-CA 3.28Å; N179-G181 PolarHBondContact O-N 3.14Å; N179-G181 VanDerWaalsContact O-N 3.13Å; N179-G181 WeakPolarHBondContact OD1-CA 3.17Å; N179-G181 PolarHBondContact OD1-N 3.15Å; G181-Q185 VanDerWaalsContact O-CG 3.32Å; G181-Q185 WeakPolarHBondContact O-CG 3.13Å; G181-Q185 PolarHBondContact O-N 3.08Å; G181-Q185 PolarHBondContact O-NE2 3.23Å
182	F	98.6	Very high	97.4	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-74.2	-39.3	174.2	-65.9	-7.1	0	0	0	111.8	D107 F112 I114 S145 R146 T149 P178 N179 H180 K184 Q185 L186	D107-F182 WeakPolarHBondContact O-CZ 3.13Å; F112-F182 HydrophobicContact CB-CE1 4.2Å; F112-F182 HydrophobicContact CD1-CE1 4.27Å; F112-F182 HydrophobicContact CD1-CZ 4.44Å; I114-F182 HydrophobicContact CB-CD1 3.94Å; I114-F182 HydrophobicContact CB-CE1 3.64Å; I114-F182 HydrophobicContact CB-CZ 4.05Å; I114-F182 HydrophobicContact CD1-CD2 4.18Å; I114-F182 HydrophobicContact CD1-CE1 4.23Å; I114-F182 HydrophobicContact CD1-CE2 3.78Å; I114-F182 HydrophobicContact CD1-CZ 3.8Å; I114-F182 HydrophobicContact CG2-CB 4.35Å; I114-F182 HydrophobicContact CG2-CD1 3.29Å; I114-F182 HydrophobicContact CG2-CD2 4.45Å; I114-F182 HydrophobicContact CG2-CE1 3.57Å; I114-F182 HydrophobicContact CG2-CG 3.79Å; I114-F182 HydrophobicContact CG2-CZ 4.25Å; S145-F182 WeakPolarHBondContact OG-CD2 3.41Å; R146-F182 HydrophobicContact CB-CE2 4.39Å; R146-F182 HydrophobicContact CG-CE2 3.66Å; R146-F182 HydrophobicContact CG-CZ 4.08Å; T149-F182 HydrophobicContact CG2-CB 3.91Å; T149-F182 HydrophobicContact CG2-CD2 4.48Å; T149-F182 HydrophobicContact CG2-CG 4.3Å; T149-F182 VanDerWaalsContact OG1-CD2 3.32Å; T149-F182 WeakPolarHBondContact OG1-CD2 3.46Å; P178-F182 HydrophobicContact CB-CB 4.17Å; N179-F182 WeakPolarHBondContact ND2-CD2 3.44Å; N179-F182 WeakPolarHBondContact ND2-CE2 3.37Å; N179-F182 WeakPolarHBondContact ND2-CG 3.24Å; N179-F182 VanDerWaalsContact ND2-CZ 3.34Å; N179-F182 WeakPolarHBondContact ND2-CZ 3.42Å; N179-F182 WeakPolarHBondContact O-CA 3.44Å; N179-F182 WeakPolarHBondContact O-CB 3.33Å; N179-F182 PolarHBondContact O-N 2.95Å; N179-F182 PolarHBondContact OD1-N 3.44Å; H180-F182 VanDerWaalsContact C-N 3.32Å; H180-F182 PolarHBondContact O-N 3.03Å; F182-K184 VanDerWaalsContact C-N 3.31Å; F182-K184 PolarHBondContact O-N 3.34Å; F182-Q185 WeakPolarHBondContact O-CB 3.31Å; F182-Q185 PolarHBondContact O-N 3.47Å; F182-Q185 VanDerWaalsContact O-N 3.1Å; F182-L186 PolarHBondContact O-N 3.1Å
183	L	98.5	Very high	97.6	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-60.6	-41.8	172.8	-66.3	175.6	0	0	0	111.5	T29 E33 F36 I167 P178 N179 H180 Q185 L186 R187	T29-L183 HydrophobicContact CG2-CB 4.06Å; E33-L183 HydrophobicContact CB-CD1 4.47Å; E33-L183 HydrophobicContact CG-CD1 3.5Å; E33-L183 VanDerWaalsContact CG-CD1 3.5Å; F36-L183 HydrophobicContact CE2-CD1 4.06Å; F36-L183 HydrophobicContact CE2-CD2 3.91Å; F36-L183 HydrophobicContact CZ-CD2 4.28Å; I167-L183 HydrophobicContact CD1-CD2 4.13Å; P178-L183 HydrophobicContact CB-CD2 3.92Å; P178-L183 HydrophobicContact CB-CG 4.16Å; P178-L183 HydrophobicContact CG-CD2 4.19Å; N179-L183 PolarHBondContact O-N 2.95Å; H180-L183 PolarHBondContact O-N 3.23Å; L183-Q185 VanDerWaalsContact C-N 3.28Å; L183-Q185 PolarHBondContact O-N 2.81Å; L183-L186 PolarHBondContact O-N 2.74Å; L183-R187 WeakPolarHBondContact O-CB 3.38Å; L183-R187 PolarHBondContact O-N 3.45Å
184	K	98.3	Very high	97.7	Very high	103 Å²	103	26.9 Å²	26.9	45%	0.448	15%	0.146	S	C	.	.	H	α-helix	trans	-59.4	-39.1	173	-177.2	179.3	176.1	-179.7	0	112.4	P12 T29 H180 F182 A188	P12-K184 HydrophobicContact CB-CD 4.27Å; P12-K184 HydrophobicContact CB-CG 4.43Å; T29-K184 HydrophobicContact CG2-CB 4.18Å; H180-K184 PolarHBondContact O-N 2.79Å; F182-K184 VanDerWaalsContact C-N 3.31Å; F182-K184 PolarHBondContact O-N 3.34Å; K184-A188 PolarHBondContact O-N 3.3Å
185	Q	98.7	Very high	97.8	Very high	30 Å²	30	30.4 Å²	30.4	14%	0.14	16%	0.163	C	C	.	.	H	α-helix	trans	-71.5	-39.8	178.2	-74.7	170.9	70.8	0	0	112.2	F112 N113 F118 G181 F182 L183 A188 L189	F112-Q185 PolarHBondContact O-NE2 3.06Å; N113-Q185 PolarHBondContact OD1-OE1 3.28Å; F118-Q185 HydrophobicContact CE2-CB 4.48Å; F118-Q185 HydrophobicContact CZ-CB 4.26Å; G181-Q185 VanDerWaalsContact O-CG 3.32Å; G181-Q185 WeakPolarHBondContact O-CG 3.13Å; G181-Q185 PolarHBondContact O-N 3.08Å; G181-Q185 PolarHBondContact O-NE2 3.23Å; F182-Q185 WeakPolarHBondContact O-CB 3.31Å; F182-Q185 PolarHBondContact O-N 3.47Å; F182-Q185 VanDerWaalsContact O-N 3.1Å; L183-Q185 VanDerWaalsContact C-N 3.28Å; L183-Q185 PolarHBondContact O-N 2.81Å; Q185-A188 PolarHBondContact O-N 3.11Å; Q185-L189 PolarHBondContact O-N 2.76Å
186	L	98.8	Very high	98	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.9	-41.6	171.8	-72.4	169.7	0	0	0	111.7	F118 T149 L152 A153 M156 V163 F182 L183 A188 L189 D190	F118-L186 HydrophobicContact CE2-CD2 4.35Å; F118-L186 HydrophobicContact CZ-CD2 3.98Å; F118-L186 HydrophobicContact CZ-CG 4.37Å; T149-L186 HydrophobicContact CG2-CD1 3.94Å; T149-L186 HydrophobicContact CG2-CD2 4.09Å; T149-L186 HydrophobicContact CG2-CG 3.9Å; L152-L186 HydrophobicContact CB-CD1 4.09Å; L152-L186 HydrophobicContact CB-CD2 4.09Å; L152-L186 HydrophobicContact CD1-CD1 3.72Å; A153-L186 HydrophobicContact CB-CD2 4.02Å; M156-L186 WeakPolarHBondContact CE-O 3.4Å; M156-L186 HydrophobicContact SD-CD2 3.94Å; V163-L186 HydrophobicContact CG2-CB 3.93Å; F182-L186 PolarHBondContact O-N 3.1Å; L183-L186 PolarHBondContact O-N 2.74Å; L186-A188 VanDerWaalsContact C-N 3.3Å; L186-A188 PolarHBondContact O-N 2.99Å; L186-L189 WeakPolarHBondContact O-CB 3.34Å; L186-L189 PolarHBondContact O-N 3.41Å; L186-L189 VanDerWaalsContact O-N 3.14Å; L186-D190 PolarHBondContact O-N 2.8Å
187	R	98.4	Very high	98	Very high	8 Å²	8	35.2 Å²	35.2	3%	0.03	18%	0.183	C	C	.	.	H	α-helix	trans	-58.8	-42.2	173.7	-176	-176.4	165.5	-84.2	4.3	112	A14 V16 T26 P27 L32 L183 L189 D190 I191	A14-R187 PolarHBondContact O-NH2 3.05Å; V16-R187 VanDerWaalsContact CG2-NH2 3.32Å; T26-R187 HydrophobicContact CG2-CG 3.73Å; P27-R187 WeakPolarHBondContact O-CD 3.12Å; P27-R187 PolarHBondContact O-NE 3.21Å; L32-R187 HydrophobicContact CD1-CB 3.92Å; L32-R187 HydrophobicContact CD1-CG 4.38Å; L183-R187 WeakPolarHBondContact O-CB 3.38Å; L183-R187 PolarHBondContact O-N 3.45Å; R187-L189 VanDerWaalsContact C-N 3.33Å; R187-D190 PolarHBondContact O-N 3.4Å; R187-I191 HydrophobicContact CG-CD1 4.45Å; R187-I191 WeakPolarHBondContact O-CG1 3.37Å; R187-I191 PolarHBondContact O-N 3.09Å
188	A	98.4	Very high	98	Very high	50 Å²	50	32.1 Å²	32.1	41%	0.413	17%	0.167	S	C	.	.	H	α-helix	trans	-65.2	-38.2	176.1	0	0	0	0	0	112.1	K184 Q185 L186 T192	K184-A188 PolarHBondContact O-N 3.3Å; Q185-A188 PolarHBondContact O-N 3.11Å; L186-A188 VanDerWaalsContact C-N 3.3Å; L186-A188 PolarHBondContact O-N 2.99Å; A188-T192 PolarHBondContact O-N 3.07Å; A188-T192 VanDerWaalsContact O-N 3.12Å; A188-T192 PolarHBondContact O-OG1 3.07Å
189	L	98.7	Very high	97.9	Very high	24 Å²	24	36.8 Å²	36.8	13%	0.126	18%	0.184	C	C	.	.	H	α-helix	trans	-61.2	-46.1	171.7	175.4	65.6	0	0	0	111	F118 A153 M156 M157 Q185 L186 R187 I191 T192 L193	F118-L189 HydrophobicContact CD2-CB 4.4Å; F118-L189 HydrophobicContact CD2-CD2 3.84Å; F118-L189 HydrophobicContact CE2-CB 4.22Å; F118-L189 HydrophobicContact CE2-CD2 4.07Å; A153-L189 HydrophobicContact CB-CD2 3.84Å; M156-L189 HydrophobicContact CB-CD2 4.41Å; M156-L189 HydrophobicContact CE-CB 4.16Å; M156-L189 HydrophobicContact CE-CD2 3.9Å; M156-L189 HydrophobicContact CE-CG 3.91Å; M156-L189 HydrophobicContact SD-CD2 4.16Å; M157-L189 HydrophobicContact CG-CD1 4.11Å; M157-L189 HydrophobicContact CG-CD2 4.11Å; M157-L189 HydrophobicContact SD-CD1 4.27Å; M157-L189 HydrophobicContact SD-CD2 4.33Å; Q185-L189 PolarHBondContact O-N 2.76Å; L186-L189 WeakPolarHBondContact O-CB 3.34Å; L186-L189 PolarHBondContact O-N 3.41Å; L186-L189 VanDerWaalsContact O-N 3.14Å; R187-L189 VanDerWaalsContact C-N 3.33Å; L189-I191 PolarHBondContact O-N 3.3Å; L189-T192 WeakPolarHBondContact O-CB 3.44Å; L189-T192 PolarHBondContact O-N 3.4Å; L189-T192 VanDerWaalsContact O-N 3.17Å; L189-L193 HydrophobicContact CD1-CD1 4.06Å; L189-L193 HydrophobicContact CD1-CG 4.08Å; L189-L193 HydrophobicContact CG-CD1 3.91Å; L189-L193 HydrophobicContact CG-CG 4.33Å; L189-L193 WeakPolarHBondContact O-CG 3.4Å; L189-L193 PolarHBondContact O-N 3.16Å
190	D	98.6	Very high	97.8	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-58.1	-50.7	179.4	-169.7	55.4	0	0	0	111.8	Y24 T26 M156 T162 V163 L186 R187 T192 L193 Q194	Y24-D190 VanDerWaalsContact CE1-OD2 3.3Å; Y24-D190 WeakPolarHBondContact CE1-OD2 3.46Å; Y24-D190 PolarHBondContact OH-OD2 3.13Å; T26-D190 WeakPolarHBondContact CB-OD2 3.1Å; T26-D190 HydrophobicContact CG2-CB 4.18Å; T26-D190 WeakPolarHBondContact CG2-OD2 3.41Å; T26-D190 PolarHBondContact OG1-OD2 2.95Å; M156-D190 HydrophobicContact CE-CB 3.63Å; T162-D190 WeakPolarHBondContact CA-OD1 3.07Å; V163-D190 HydrophobicContact CB-CB 3.97Å; V163-D190 HydrophobicContact CG1-CB 3.94Å; V163-D190 PolarHBondContact N-OD1 2.94Å; L186-D190 PolarHBondContact O-N 2.8Å; R187-D190 PolarHBondContact O-N 3.4Å; D190-T192 VanDerWaalsContact C-N 3.28Å; D190-T192 PolarHBondContact O-N 3.19Å; D190-L193 PolarHBondContact O-N 2.88Å; D190-L193 VanDerWaalsContact O-N 3.13Å; D190-Q194 VanDerWaalsContact O-CG 3.32Å; D190-Q194 WeakPolarHBondContact O-CG 3.44Å; D190-Q194 PolarHBondContact O-N 3.12Å
191	I	98.3	Very high	97.6	Very high	22 Å²	22	42.8 Å²	42.8	11%	0.113	21%	0.21	C	C	.	.	H	α-helix	trans	-54.8	-46.7	175.6	-65.9	167.7	0	0	0	110.6	V16 V18 T26 R187 L189 L193 Q194 E195	V16-I191 HydrophobicContact CB-CD1 4.23Å; V16-I191 HydrophobicContact CB-CG1 4.42Å; V16-I191 HydrophobicContact CG1-CD1 4.39Å; V16-I191 HydrophobicContact CG1-CG1 4.41Å; V16-I191 HydrophobicContact CG2-CD1 4.06Å; V18-I191 HydrophobicContact CG2-CG2 4.13Å; T26-I191 HydrophobicContact CG2-CD1 4.46Å; T26-I191 HydrophobicContact CG2-CG1 3.86Å; R187-I191 HydrophobicContact CG-CD1 4.45Å; R187-I191 WeakPolarHBondContact O-CG1 3.37Å; R187-I191 PolarHBondContact O-N 3.09Å; L189-I191 PolarHBondContact O-N 3.3Å; I191-L193 VanDerWaalsContact C-N 3.35Å; I191-L193 PolarHBondContact O-N 3.42Å; I191-Q194 PolarHBondContact O-N 3.26Å; I191-E195 HydrophobicContact CG2-CG 4.48Å; I191-E195 WeakPolarHBondContact O-CG 3.33Å; I191-E195 PolarHBondContact O-N 3.17Å
192	T	98.4	Very high	97.4	Very high	65 Å²	65	48.7 Å²	48.7	40%	0.399	23%	0.231	S	C	.	.	H	α-helix	trans	-59.3	-45.5	179.2	-54.4	0	0	0	0	111.6	A188 L189 D190 E195 D196	A188-T192 PolarHBondContact O-N 3.07Å; A188-T192 VanDerWaalsContact O-N 3.12Å; A188-T192 PolarHBondContact O-OG1 3.07Å; L189-T192 WeakPolarHBondContact O-CB 3.44Å; L189-T192 PolarHBondContact O-N 3.4Å; L189-T192 VanDerWaalsContact O-N 3.17Å; D190-T192 VanDerWaalsContact C-N 3.28Å; D190-T192 PolarHBondContact O-N 3.19Å; T192-E195 PolarHBondContact O-N 3.09Å; T192-D196 PolarHBondContact O-N 2.78Å
193	L	98.3	Very high	97.2	Very high	33 Å²	33	54.6 Å²	54.6	17%	0.173	26%	0.258	C	S	.	.	H	α-helix	trans	-67.1	-37.8	179.2	-67.6	173.5	0	0	0	112.1	M156 M157 L189 D190 I191 D196 K197	M156-L193 HydrophobicContact CB-CD1 3.83Å; M156-L193 HydrophobicContact CE-CD1 4.38Å; M157-L193 HydrophobicContact CG-CD1 4.36Å; L189-L193 HydrophobicContact CD1-CD1 4.06Å; L189-L193 HydrophobicContact CD1-CG 4.08Å; L189-L193 HydrophobicContact CG-CD1 3.91Å; L189-L193 HydrophobicContact CG-CG 4.33Å; L189-L193 WeakPolarHBondContact O-CG 3.4Å; L189-L193 PolarHBondContact O-N 3.16Å; D190-L193 PolarHBondContact O-N 2.88Å; D190-L193 VanDerWaalsContact O-N 3.13Å; I191-L193 VanDerWaalsContact C-N 3.35Å; I191-L193 PolarHBondContact O-N 3.42Å; L193-D196 PolarHBondContact O-N 3.38Å; L193-K197 WeakPolarHBondContact O-CG 3.21Å; L193-K197 PolarHBondContact O-N 3.2Å
194	Q	97.9	Very high	96.8	Very high	19 Å²	19	58 Å²	58	9%	0.089	28%	0.279	C	S	.	.	H	α-helix	trans	-65.9	-39.4	174.3	-63.9	-55.4	-31.3	0	0	111.5	V18 Y24 D190 I191 D196 K197 L198	V18-Q194 HydrophobicContact CB-CB 3.86Å; V18-Q194 HydrophobicContact CG1-CB 3.95Å; V18-Q194 HydrophobicContact CG2-CB 3.97Å; Y24-Q194 HydrophobicContact CD1-CG 4.21Å; Y24-Q194 HydrophobicContact CE1-CG 4.06Å; D190-Q194 VanDerWaalsContact O-CG 3.32Å; D190-Q194 WeakPolarHBondContact O-CG 3.44Å; D190-Q194 PolarHBondContact O-N 3.12Å; I191-Q194 PolarHBondContact O-N 3.26Å; Q194-D196 VanDerWaalsContact C-N 3.33Å; Q194-D196 PolarHBondContact O-N 3.34Å; Q194-K197 PolarHBondContact O-N 3.21Å; Q194-L198 WeakPolarHBondContact O-CB 3.27Å; Q194-L198 PolarHBondContact O-N 2.45Å
195	E	97.7	Very high	96.4	Very high	79 Å²	79	57.7 Å²	57.7	37%	0.369	28%	0.279	S	S	.	.	H	α-helix	trans	-63.7	-40.5	175	-73.2	-178.6	-177	0	0	111.4	V18 I191 T192 L198 R199	V18-E195 HydrophobicContact CG1-CB 4.23Å; V18-E195 HydrophobicContact CG1-CG 3.66Å; I191-E195 HydrophobicContact CG2-CG 4.48Å; I191-E195 WeakPolarHBondContact O-CG 3.33Å; I191-E195 PolarHBondContact O-N 3.17Å; T192-E195 PolarHBondContact O-N 3.09Å; E195-L198 PolarHBondContact O-N 2.86Å; E195-R199 WeakPolarHBondContact O-CB 3.35Å; E195-R199 WeakPolarHBondContact O-CG 3.33Å; E195-R199 PolarHBondContact O-N 2.96Å; E195-R199 IonicContact OE2-CZ 3.26Å; E195-R199 IonicContact OE2-NH1 3.11Å; E195-R199 PolarHBondContact OE2-NH1 2.77Å; E195-R199 IonicContact OE2-NH2 3.68Å
196	D	97.1	Very high	95.8	Very high	60 Å²	60	61.4 Å²	61.4	32%	0.321	30%	0.3	S	S	.	.	H	α-helix	trans	-63.1	-45.2	175.3	-78.7	-31	0	0	0	112.2	T192 L193 Q194 L198 R199 Q200	T192-D196 PolarHBondContact O-N 2.78Å; L193-D196 PolarHBondContact O-N 3.38Å; Q194-D196 VanDerWaalsContact C-N 3.33Å; Q194-D196 PolarHBondContact O-N 3.34Å; D196-L198 VanDerWaalsContact C-N 3.33Å; D196-L198 PolarHBondContact O-N 3.39Å; D196-R199 WeakPolarHBondContact O-CB 3.43Å; D196-R199 PolarHBondContact O-N 2.74Å; D196-R199 IonicContact OD1-CZ 3.76Å; D196-R199 VanDerWaalsContact OD1-CZ 3.26Å; D196-R199 IonicContact OD1-NE 2.71Å; D196-R199 PolarHBondContact OD1-NE 3.38Å; D196-R199 VanDerWaalsContact OD1-NE 3.11Å; D196-R199 IonicContact OD1-NH2 2.64Å; D196-R199 PolarHBondContact OD1-NH2 3.45Å; D196-Q200 VanDerWaalsContact O-CG 3.31Å; D196-Q200 WeakPolarHBondContact O-CG 3.4Å; D196-Q200 PolarHBondContact O-N 2.94Å
197	K	95.8	Very high	94.9	Very high	75 Å²	75	67.5 Å²	67.5	33%	0.326	33%	0.329	S	S	.	.	H	α-helix	trans	-57.2	-46.4	174.5	-74.2	173.6	179.9	179	0	111.1	S160 L193 Q194 Q200 K201	S160-K197 PolarHBondContact O-NZ 3.23Å; L193-K197 WeakPolarHBondContact O-CG 3.21Å; L193-K197 PolarHBondContact O-N 3.2Å; Q194-K197 PolarHBondContact O-N 3.21Å; K197-Q200 PolarHBondContact O-N 3.39Å; K197-K201 PolarHBondContact O-N 2.98Å
198	L	96.3	Very high	94	Very high	18 Å²	18	72.9 Å²	72.9	9%	0.094	35%	0.354	C	S	.	.	H	α-helix	trans	-66.5	-37.6	178.2	178.7	59.6	0	0	0	112.7	V18 D19 Q194 E195 D196 Q200 R202	V18-L198 HydrophobicContact CG1-CD2 4.38Å; V18-L198 WeakPolarHBondContact O-CD2 3.4Å; D19-L198 HydrophobicContact CB-CD1 4.08Å; D19-L198 HydrophobicContact CB-CD2 4.24Å; D19-L198 HydrophobicContact CB-CG 4.48Å; Q194-L198 WeakPolarHBondContact O-CB 3.27Å; Q194-L198 PolarHBondContact O-N 2.45Å; E195-L198 PolarHBondContact O-N 2.86Å; D196-L198 VanDerWaalsContact C-N 3.33Å; D196-L198 PolarHBondContact O-N 3.39Å; L198-Q200 VanDerWaalsContact C-N 3.34Å; L198-R202 HydrophobicContact CD1-CG 4.39Å; L198-R202 VanDerWaalsContact CD2-NH2 3.26Å; L198-R202 WeakPolarHBondContact O-CG 3.44Å; L198-R202 PolarHBondContact O-N 3.05Å; L198-R202 VanDerWaalsContact O-N 3.14Å; L198-R202 PolarHBondContact O-NE 3.13Å
199	R	96.8	Very high	92.7	Very high	100 Å²	100	72.4 Å²	72.4	38%	0.377	35%	0.354	S	S	.	.	H	α-helix	trans	-60.1	-46.3	172.7	-78.5	-175.3	-79.6	-94.8	6	110.5	E195 D196 R202 H203	E195-R199 WeakPolarHBondContact O-CB 3.35Å; E195-R199 WeakPolarHBondContact O-CG 3.33Å; E195-R199 PolarHBondContact O-N 2.96Å; E195-R199 IonicContact OE2-CZ 3.26Å; E195-R199 IonicContact OE2-NH1 3.11Å; E195-R199 PolarHBondContact OE2-NH1 2.77Å; E195-R199 IonicContact OE2-NH2 3.68Å; D196-R199 WeakPolarHBondContact O-CB 3.43Å; D196-R199 PolarHBondContact O-N 2.74Å; D196-R199 IonicContact OD1-CZ 3.76Å; D196-R199 VanDerWaalsContact OD1-CZ 3.26Å; D196-R199 IonicContact OD1-NE 2.71Å; D196-R199 PolarHBondContact OD1-NE 3.38Å; D196-R199 VanDerWaalsContact OD1-NE 3.11Å; D196-R199 IonicContact OD1-NH2 2.64Å; D196-R199 PolarHBondContact OD1-NH2 3.45Å; R199-R202 PolarHBondContact O-N 2.88Å; R199-H203 PolarHBondContact O-CD2 2.93Å; R199-H203 PolarHBondContact O-N 2.91Å; R199-H203 VanDerWaalsContact O-N 3.09Å
200	Q	94.6	Very high	91	Very high	130 Å²	130	77.6 Å²	77.6	61%	0.607	38%	0.382	S	S	*	.	H	α-helix	trans	-63.8	-46.1	178.9	-70.1	171.3	8.2	0	0	112.3	D196 K197 L198 R202 H203 V204	D196-Q200 VanDerWaalsContact O-CG 3.31Å; D196-Q200 WeakPolarHBondContact O-CG 3.4Å; D196-Q200 PolarHBondContact O-N 2.94Å; K197-Q200 PolarHBondContact O-N 3.39Å; L198-Q200 VanDerWaalsContact C-N 3.34Å; Q200-R202 PolarHBondContact O-N 3.22Å; Q200-H203 WeakPolarHBondContact O-CB 3.43Å; Q200-H203 PolarHBondContact O-N 2.62Å; Q200-H203 VanDerWaalsContact O-N 3.1Å; Q200-V204 WeakPolarHBondContact O-CG2 3.39Å; Q200-V204 PolarHBondContact O-N 3.49Å; Q200-V204 VanDerWaalsContact O-N 3.08Å
201	K	93.6	Very high	89.1	Confident	73 Å²	73	86.1 Å²	86.1	32%	0.317	42%	0.419	S	S	.	.	H	α-helix	trans	-53.4	-50.8	175.7	179.1	179.6	166.8	-167.4	0	111.7	D19 D21 K197 H203 V204 E205	D19-K201 IonicContact OD1-NZ 3.93Å; D19-K201 IonicContact OD2-NZ 3.19Å; D19-K201 PolarHBondContact OD2-NZ 2.82Å; D21-K201 IonicContact OD2-NZ 3.8Å; K197-K201 PolarHBondContact O-N 2.98Å; K201-H203 VanDerWaalsContact C-N 3.3Å; K201-H203 PolarHBondContact O-N 3.13Å; K201-V204 PolarHBondContact O-N 2.63Å; K201-V204 VanDerWaalsContact O-N 3.13Å; K201-E205 VanDerWaalsContact CE-OE1 3.27Å; K201-E205 WeakPolarHBondContact CE-OE1 3.29Å; K201-E205 WeakPolarHBondContact CG-OE1 3.38Å; K201-E205 WeakPolarHBondContact O-CG 3.38Å; K201-E205 PolarHBondContact O-N 2.71Å; K201-E205 VanDerWaalsContact O-N 3.08Å
202	R	94.1	Very high	87.1	Confident	131 Å²	131	91.1 Å²	91.1	49%	0.494	45%	0.451	S	S	.	.	H	α-helix	trans	-62.5	-33.5	177.5	-73.8	-172.6	-87.7	-171.9	-9.2	113.6	L198 R199 Q200 N206	L198-R202 HydrophobicContact CD1-CG 4.39Å; L198-R202 VanDerWaalsContact CD2-NH2 3.26Å; L198-R202 WeakPolarHBondContact O-CG 3.44Å; L198-R202 PolarHBondContact O-N 3.05Å; L198-R202 VanDerWaalsContact O-N 3.14Å; L198-R202 PolarHBondContact O-NE 3.13Å; R199-R202 PolarHBondContact O-N 2.88Å; Q200-R202 PolarHBondContact O-N 3.22Å; R202-N206 WeakPolarHBondContact O-CB 3.46Å; R202-N206 VanDerWaalsContact O-CG 3.25Å; R202-N206 PolarHBondContact O-N 2.79Å; R202-N206 PolarHBondContact O-ND2 3.14Å
203	H	93.1	Very high	84.9	Confident	123 Å²	123	96.5 Å²	96.5	57%	0.569	48%	0.484	S	S	*	.	H	α-helix	trans	-67.3	-38.8	174.8	-82.3	-62.8	0	0	0	112.4	R199 Q200 K201 Q207	R199-H203 PolarHBondContact O-CD2 2.93Å; R199-H203 PolarHBondContact O-N 2.91Å; R199-H203 VanDerWaalsContact O-N 3.09Å; Q200-H203 WeakPolarHBondContact O-CB 3.43Å; Q200-H203 PolarHBondContact O-N 2.62Å; Q200-H203 VanDerWaalsContact O-N 3.1Å; K201-H203 VanDerWaalsContact C-N 3.3Å; K201-H203 PolarHBondContact O-N 3.13Å; H203-Q207 WeakPolarHBondContact O-CG 3.2Å; H203-Q207 PolarHBondContact O-N 3Å
204	V	91.5	Very high	84.2	Confident	75 Å²	75	99.7 Å²	99.7	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-67.1	-48.4	177.9	175.1	0	0	0	0	110.8	Q200 K201 N206 Q207 E208	Q200-V204 WeakPolarHBondContact O-CG2 3.39Å; Q200-V204 PolarHBondContact O-N 3.49Å; Q200-V204 VanDerWaalsContact O-N 3.08Å; K201-V204 PolarHBondContact O-N 2.63Å; K201-V204 VanDerWaalsContact O-N 3.13Å; V204-N206 VanDerWaalsContact C-N 3.32Å; V204-N206 PolarHBondContact O-N 3.04Å; V204-Q207 PolarHBondContact O-N 2.96Å; V204-E208 PolarHBondContact O-N 3.41Å; V204-E208 VanDerWaalsContact O-N 3.08Å
205	E	89.8	Confident	83.5	Confident	95 Å²	95	103.9 Å²	103.9	44%	0.444	52%	0.521	S	S	.	.	H	α-helix	trans	-57.4	-43	179.3	-69.7	166.6	174.5	0	0	112.3	K201 Q207 E208 G209	K201-E205 VanDerWaalsContact CE-OE1 3.27Å; K201-E205 WeakPolarHBondContact CE-OE1 3.29Å; K201-E205 WeakPolarHBondContact CG-OE1 3.38Å; K201-E205 WeakPolarHBondContact O-CG 3.38Å; K201-E205 PolarHBondContact O-N 2.71Å; K201-E205 VanDerWaalsContact O-N 3.08Å; E205-Q207 VanDerWaalsContact C-N 3.32Å; E205-Q207 PolarHBondContact O-N 3Å; E205-E208 PolarHBondContact O-N 2.93Å; E205-G209 PolarHBondContact O-N 3.2Å
206	N	85.5	Confident	82.7	Confident	109 Å²	109	105.3 Å²	105.3	58%	0.583	53%	0.529	S	S	*	.	H	α-helix	trans	-66.6	-30.7	177.6	-73.8	-29.3	0	0	0	113.2	R202 V204 N210	R202-N206 WeakPolarHBondContact O-CB 3.46Å; R202-N206 VanDerWaalsContact O-CG 3.25Å; R202-N206 PolarHBondContact O-N 2.79Å; R202-N206 PolarHBondContact O-ND2 3.14Å; V204-N206 VanDerWaalsContact C-N 3.32Å; V204-N206 PolarHBondContact O-N 3.04Å; N206-N210 PolarHBondContact O-N 3.21Å
207	Q	80.4	Confident	81.9	Confident	127 Å²	127	107.9 Å²	107.9	59%	0.593	54%	0.541	S	S	*	.	H	α-helix	trans	-76.6	-32.5	177.1	-73.5	-179.1	6.5	0	0	112.5	H203 V204 E205	H203-Q207 WeakPolarHBondContact O-CG 3.2Å; H203-Q207 PolarHBondContact O-N 3Å; V204-Q207 PolarHBondContact O-N 2.96Å; E205-Q207 VanDerWaalsContact C-N 3.32Å; E205-Q207 PolarHBondContact O-N 3Å
208	E	78.2	Confident	81	Confident	122 Å²	122	110 Å²	110	57%	0.57	56%	0.555	S	S	*	*	H	α-helix	trans	-75	-38.9	176.6	-68.9	-178.6	166.1	0	0	112.1	V204 E205 N210 K211 T212	V204-E208 PolarHBondContact O-N 3.41Å; V204-E208 VanDerWaalsContact O-N 3.08Å; E205-E208 PolarHBondContact O-N 2.93Å; E208-N210 VanDerWaalsContact C-N 3.3Å; E208-N210 PolarHBondContact O-N 3.32Å; E208-K211 PolarHBondContact O-N 2.9Å; E208-T212 PolarHBondContact O-OG1 3.19Å
209	G	71	Confident	80	Confident	40 Å²	40	116.1 Å²	116.1	41%	0.412	59%	0.586	S	S	.	*	H	α-helix	trans	-59.5	-38	174	0	0	0	0	0	113.4	E205 K211 T212 T213	E205-G209 PolarHBondContact O-N 3.2Å; G209-K211 PolarHBondContact O-N 2.88Å; G209-T212 PolarHBondContact O-N 2.92Å; G209-T213 PolarHBondContact O-OG1 2.79Å
210	N	63.1	Low	78.8	Confident	132 Å²	132	117.3 Å²	117.3	71%	0.706	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-13.2	178.4	-80.6	-11.5	0	0	0	114.8	N206 E208	N206-N210 PolarHBondContact O-N 3.21Å; E208-N210 VanDerWaalsContact C-N 3.3Å; E208-N210 PolarHBondContact O-N 3.32Å
211	K	60.5	Low	77.6	Confident	180 Å²	180	116.3 Å²	116.3	78%	0.783	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-14.9	174.9	-76.5	-179.6	-178.2	175.3	0	113.4	E208 G209	E208-K211 PolarHBondContact O-N 2.9Å; G209-K211 PolarHBondContact O-N 2.88Å
212	T	56.1	Low	76.3	Confident	127 Å²	127	119.9 Å²	119.9	78%	0.779	62%	0.623	S	S	*	*			trans	-101.5	2.7	-174.6	-37	0	0	0	0	112.1	E208 G209	E208-T212 PolarHBondContact O-OG1 3.19Å; G209-T212 PolarHBondContact O-N 2.92Å
213	T	51.9	Low	74.6	Confident	178 Å²	178	118.9 Å²	118.9	100%	1.092	64%	0.635	S	S	*	*			trans	-115.9	0	175.1	-43.2	0	0	0	0	109.2	G209	G209-T213 PolarHBondContact O-OG1 2.79Å

Retrieved 213 of 213 residues in 799.8 ms (Link to these results)

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