A0A096LNN2_HUMAN Loading...

Cytochrome P450 family 26 subfamily A member 1

AlphaFold DB , UniProt , Accession A0A096LNN2, Species HUMAN (Homo sapiens, Human), Gene CYP26A1, Length 256 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	64.3	Low	86.3	Confident	168 Å²	168	128.5 Å²	128.5	83%	0.828	57%	0.568	S	S	*	*				0	106.8	0	-172.7	-166.9	-152.2	0	0	110.2	R3 R4	M1-R3 PolarHBondContact O-N 3.13Å; M1-R4 PolarHBondContact O-N 3.49Å; M1-R4 HydrophobicContact SD-CG 3.92Å
2	K	80.9	Confident	86.8	Confident	127 Å²	127	119.8 Å²	119.8	55%	0.552	53%	0.533	S	S	*	.	H	α-helix	trans	-57.6	-38.7	-165.4	-70.7	-176.6	178.8	179.4	0	115.3	R4 K5 Y6 Y10	K2-R4 PolarHBondContact O-N 3.05Å; K2-K5 PolarHBondContact O-N 3.45Å; K2-Y6 HydrophobicContact CB-CD2 4.34Å; K2-Y6 WeakPolarHBondContact O-CD2 3.27Å; K2-Y6 PolarHBondContact O-N 3.46Å; K2-Y6 VanDerWaalsContact O-N 3.11Å; K2-Y10 HydrophobicContact CB-CE2 4.22Å; K2-Y10 HydrophobicContact CD-CE2 4.49Å
3	R	85.4	Confident	87.2	Confident	133 Å²	133	121.7 Å²	121.7	50%	0.502	54%	0.544	S	S	.	.	H	α-helix	trans	-52.9	-37.1	174.2	-175.1	178.6	80	-173.2	4.8	113.5	M1 K5 G7 M23	M1-R3 PolarHBondContact O-N 3.13Å; R3-K5 VanDerWaalsContact C-N 3.32Å; R3-K5 PolarHBondContact O-N 3.09Å; R3-G7 WeakPolarHBondContact O-CA 3.35Å; R3-G7 PolarHBondContact O-N 2.88Å; R3-M23 HydrophobicContact CB-CE 4.03Å; R3-M23 HydrophobicContact CG-CE 3.66Å
4	R	86.4	Confident	87.1	Confident	219 Å²	219	117.3 Å²	117.3	83%	0.826	53%	0.527	S	S	*	.	H	α-helix	trans	-73.5	-18.8	-179.8	-75.3	-179.2	64.1	-167.3	-1.9	113.7	M1 K2	M1-R4 PolarHBondContact O-N 3.49Å; M1-R4 HydrophobicContact SD-CG 3.92Å; K2-R4 PolarHBondContact O-N 3.05Å
5	K	89.8	Confident	86.9	Confident	163 Å²	163	119.4 Å²	119.4	71%	0.709	54%	0.536	S	S	*	.	H	α-helix	trans	-100.2	-26.5	179.7	-174.7	168	-179.2	171.7	0	113.4	K2 R3	K2-K5 PolarHBondContact O-N 3.45Å; R3-K5 VanDerWaalsContact C-N 3.32Å; R3-K5 PolarHBondContact O-N 3.09Å
6	Y	88.9	Confident	87	Confident	124 Å²	124	117 Å²	117	49%	0.486	55%	0.554	S	S	.	*	H	α-helix	trans	-128.2	11.6	-173.2	-51.2	-74.8	0	0	0	114.1	K2	K2-Y6 HydrophobicContact CB-CD2 4.34Å; K2-Y6 WeakPolarHBondContact O-CD2 3.27Å; K2-Y6 PolarHBondContact O-N 3.46Å; K2-Y6 VanDerWaalsContact O-N 3.11Å
7	G	90.6	Very high	86.7	Confident	34 Å²	34	116.6 Å²	116.6	35%	0.351	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	-147.7	177	0	0	0	0	0	114.9	R3	R3-G7 WeakPolarHBondContact O-CA 3.35Å; R3-G7 PolarHBondContact O-N 2.88Å
8	F	89.6	Confident	87	Confident	125 Å²	125	116.2 Å²	116.2	55%	0.548	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86	-17.9	-172.2	-69.1	-74.9	0	0	0	114.9	V22 M23	F8-V22 CarbonylContact O-C 3.58Å; F8-M23 HydrophobicContact CB-CB 4.48Å; F8-M23 HydrophobicContact CD1-CB 4.05Å; F8-M23 PolarHBondContact O-N 2.98Å
9	I	91.4	Very high	87.2	Confident	89 Å²	89	111.2 Å²	111.2	46%	0.456	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	118	-179.6	-60.7	-178.6	0	0	0	108.3	V20 R21 V22 N27	I9-V20 HydrophobicContact CG2-CG1 3.71Å; I9-R21 WeakPolarHBondContact CA-O 3.46Å; I9-V22 HydrophobicContact CG1-CG1 4.22Å; I9-V22 HydrophobicContact CG1-CG2 4.35Å; I9-V22 HydrophobicContact CG2-CG2 4.29Å; I9-N27 HydrophobicContact CD1-CB 4.5Å
10	Y	90.5	Very high	87.5	Confident	37 Å²	37	109.6 Å²	109.6	15%	0.145	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	149.2	178.6	65.5	-98.4	0	0	0	114.4	K2 T12 R21 M23	K2-Y10 HydrophobicContact CB-CE2 4.22Å; K2-Y10 HydrophobicContact CD-CE2 4.49Å; Y10-T12 HydrophobicContact CE2-CG2 4.19Å; Y10-R21 HydrophobicContact CE2-CB 4.23Å; Y10-R21 PolarHBondContact N-O 3.49Å; Y10-R21 PolarHBondContact O-N 3.3Å; Y10-M23 HydrophobicContact CD1-CE 4.27Å; Y10-M23 HydrophobicContact CE1-CE 3.74Å
11	K	91.5	Very high	87.6	Confident	194 Å²	194	108.1 Å²	108.1	84%	0.843	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	137.2	173.9	-63	177.2	-177.8	175.3	0	110.1
12	T	92.7	Very high	88.8	Confident	25 Å²	25	101.9 Å²	101.9	15%	0.153	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	161.7	176.2	-168.8	0	0	0	0	110	Y10 L14 T19 R21	Y10-T12 HydrophobicContact CE2-CG2 4.19Å; T12-L14 HydrophobicContact CG2-CG 4.26Å; T12-T19 PolarHBondContact N-O 2.78Å; T12-T19 CarbonylContact O-C 3.54Å; T12-T19 WeakPolarHBondContact O-CA 3.45Å; T12-T19 WeakPolarHBondContact O-CB 3.3Å; T12-T19 PolarHBondContact O-N 3.18Å; T12-R21 HydrophobicContact CG2-CB 4.32Å
13	H	90.9	Very high	89.1	Confident	144 Å²	144	97.3 Å²	97.3	67%	0.667	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	132.3	171.8	-65.6	-179.4	0	0	0	109.9	R17	H13-R17 WeakPolarHBondContact CA-O 3.25Å
14	L	86.9	Confident	89.3	Confident	60 Å²	60	92.5 Å²	92.5	31%	0.314	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	135.4	174.1	-67.1	-179.8	0	0	0	108.9	T12 G16 R17 T19 L223	T12-L14 HydrophobicContact CG2-CG 4.26Å; L14-G16 VanDerWaalsContact C-N 3.26Å; L14-G16 PolarHBondContact O-N 2.94Å; L14-R17 PolarHBondContact N-O 3.49Å; L14-R17 PolarHBondContact O-N 3.47Å; L14-T19 HydrophobicContact CD1-CG2 4.2Å; L14-L223 HydrophobicContact CB-CD2 4.25Å; L14-L223 HydrophobicContact CD1-CD2 4.04Å
15	F	84.2	Confident	89.4	Confident	149 Å²	149	85.9 Å²	85.9	65%	0.654	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	46.2	-176.9	-52.3	-81.4	0	0	0	113.1	R17 P44 L223	F15-R17 PolarHBondContact O-N 3.07Å; F15-P44 HydrophobicContact CD1-CB 4.42Å; F15-P44 HydrophobicContact CD2-CB 4.46Å; F15-P44 HydrophobicContact CD2-CG 3.99Å; F15-P44 HydrophobicContact CE1-CB 4.43Å; F15-P44 HydrophobicContact CE1-CG 4.43Å; F15-P44 HydrophobicContact CE2-CB 4.46Å; F15-P44 HydrophobicContact CE2-CG 3.72Å; F15-P44 HydrophobicContact CG-CB 4.43Å; F15-P44 HydrophobicContact CG-CG 4.44Å; F15-P44 HydrophobicContact CZ-CB 4.45Å; F15-P44 HydrophobicContact CZ-CG 3.96Å; F15-L223 HydrophobicContact CD2-CD1 4.1Å
16	G	87.3	Confident	89.3	Confident	81 Å²	81	82.7 Å²	82.7	84%	0.835	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.5	12.2	-178.6	0	0	0	0	0	115.5	L14	L14-G16 VanDerWaalsContact C-N 3.26Å; L14-G16 PolarHBondContact O-N 2.94Å
17	R	83.1	Confident	89.2	Confident	110 Å²	110	79 Å²	79	42%	0.415	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	140.1	-173.4	-73	175.3	160	-174.3	-3.3	113.9	H13 L14 F15 T19 H42	H13-R17 WeakPolarHBondContact CA-O 3.25Å; L14-R17 PolarHBondContact N-O 3.49Å; L14-R17 PolarHBondContact O-N 3.47Å; F15-R17 PolarHBondContact O-N 3.07Å; R17-T19 PolarHBondContact O-N 3.27Å; R17-T19 PolarHBondContact O-OG1 3.36Å; R17-H42 PolarHBondContact NH1-CD2 3.1Å; R17-H42 PolarHBondContact NH1-NE2 3.32Å
18	P	92.2	Very high	89	Confident	110 Å²	110	80.1 Å²	80.1	71%	0.714	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.3	129.6	170.5	27.4	-34.1	0	0	0	110.2
19	T	90.3	Very high	88.9	Confident	21 Å²	21	81.9 Å²	81.9	13%	0.129	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	133.1	-172.7	-59	0	0	0	0	109.2	T12 L14 R17 L223	T12-T19 PolarHBondContact N-O 2.78Å; T12-T19 CarbonylContact O-C 3.54Å; T12-T19 WeakPolarHBondContact O-CA 3.45Å; T12-T19 WeakPolarHBondContact O-CB 3.3Å; T12-T19 PolarHBondContact O-N 3.18Å; L14-T19 HydrophobicContact CD1-CG2 4.2Å; R17-T19 PolarHBondContact O-N 3.27Å; R17-T19 PolarHBondContact O-OG1 3.36Å; T19-L223 HydrophobicContact CG2-CD2 3.73Å
20	V	92.1	Very high	88.6	Confident	79 Å²	79	86.3 Å²	86.3	48%	0.479	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	118.5	164.7	-174.4	0	0	0	0	107.7	I9 V22	I9-V20 HydrophobicContact CG2-CG1 3.71Å; V20-V22 HydrophobicContact CG1-CG2 3.94Å
21	R	90.5	Very high	88.4	Confident	78 Å²	78	85.8 Å²	85.8	29%	0.294	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	123.1	171.3	-174.1	169.9	176.5	92	1.6	108.6	I9 Y10 T12 T221	I9-R21 WeakPolarHBondContact CA-O 3.46Å; Y10-R21 HydrophobicContact CE2-CB 4.23Å; Y10-R21 PolarHBondContact N-O 3.49Å; Y10-R21 PolarHBondContact O-N 3.3Å; T12-R21 HydrophobicContact CG2-CB 4.32Å; R21-T221 PolarHBondContact NH1-OG1 2.71Å
22	V	90.4	Very high	88.1	Confident	37 Å²	37	80.9 Å²	80.9	22%	0.224	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	139.6	-178.3	177.7	0	0	0	0	109.9	F8 I9 V20 N27 I31	F8-V22 CarbonylContact O-C 3.58Å; I9-V22 HydrophobicContact CG1-CG1 4.22Å; I9-V22 HydrophobicContact CG1-CG2 4.35Å; I9-V22 HydrophobicContact CG2-CG2 4.29Å; V20-V22 HydrophobicContact CG1-CG2 3.94Å; V22-N27 HydrophobicContact CG1-CB 3.41Å; V22-N27 VanDerWaalsContact CG1-CB 3.41Å; V22-I31 HydrophobicContact CB-CD1 3.76Å; V22-I31 HydrophobicContact CG1-CD1 3.65Å; V22-I31 HydrophobicContact CG2-CD1 3.86Å
23	M	86.9	Confident	87.7	Confident	31 Å²	31	86.3 Å²	86.3	15%	0.153	46%	0.458	C	S	.	.			trans	-143.9	168.9	-178.4	-60.2	177.8	-63.9	0	0	109.7	R3 F8 Y10 N27	R3-M23 HydrophobicContact CB-CE 4.03Å; R3-M23 HydrophobicContact CG-CE 3.66Å; F8-M23 HydrophobicContact CB-CB 4.48Å; F8-M23 HydrophobicContact CD1-CB 4.05Å; F8-M23 PolarHBondContact O-N 2.98Å; Y10-M23 HydrophobicContact CD1-CE 4.27Å; Y10-M23 HydrophobicContact CE1-CE 3.74Å; M23-N27 PolarHBondContact O-ND2 2.89Å
24	G	89.8	Confident	87.3	Confident	33 Å²	33	79.7 Å²	79.7	34%	0.34	43%	0.429	S	S	.	.	S	Bend	trans	88.2	142.1	-171.9	0	0	0	0	0	111.7	D26 N27 V28	G24-D26 PolarHBondContact O-N 3.31Å; G24-N27 PolarHBondContact O-N 3.17Å; G24-V28 WeakPolarHBondContact O-CG2 3.35Å; G24-V28 PolarHBondContact O-N 3.35Å; G24-V28 VanDerWaalsContact O-N 3.14Å
25	A	88.6	Confident	86.8	Confident	80 Å²	80	80.3 Å²	80.3	66%	0.661	43%	0.431	S	S	*	.	H	α-helix	trans	-59.9	-48.3	-169.9	0	0	0	0	0	112.1	N27 V28 R29	A25-N27 PolarHBondContact O-N 3.22Å; A25-V28 PolarHBondContact O-N 3.31Å; A25-R29 VanDerWaalsContact O-CB 3.3Å; A25-R29 WeakPolarHBondContact O-CB 3.38Å; A25-R29 PolarHBondContact O-N 2.88Å
26	D	87.7	Confident	86.1	Confident	96 Å²	96	75.7 Å²	75.7	51%	0.513	41%	0.411	S	S	.	.	H	α-helix	trans	-67.9	-38.3	-175.7	-55.6	-81.4	0	0	0	113.2	G24 R29 R30	G24-D26 PolarHBondContact O-N 3.31Å; D26-R29 PolarHBondContact O-N 3.45Å; D26-R30 WeakPolarHBondContact O-CB 3.37Å; D26-R30 VanDerWaalsContact O-CG 3.25Å; D26-R30 WeakPolarHBondContact O-CG 3.37Å; D26-R30 PolarHBondContact O-N 3.16Å
27	N	86.6	Confident	85.4	Confident	47 Å²	47	82 Å²	82	25%	0.251	41%	0.41	S	S	.	.	H	α-helix	trans	-66.3	-41.1	176.4	-59.1	-42.1	0	0	0	111	I9 V22 M23 G24 A25 I31	I9-N27 HydrophobicContact CD1-CB 4.5Å; V22-N27 HydrophobicContact CG1-CB 3.41Å; V22-N27 VanDerWaalsContact CG1-CB 3.41Å; M23-N27 PolarHBondContact O-ND2 2.89Å; G24-N27 PolarHBondContact O-N 3.17Å; A25-N27 PolarHBondContact O-N 3.22Å; N27-I31 WeakPolarHBondContact O-CG1 3.39Å; N27-I31 PolarHBondContact O-N 2.87Å; N27-I31 VanDerWaalsContact O-N 3.16Å
28	V	86.9	Confident	85.1	Confident	56 Å²	56	81.9 Å²	81.9	34%	0.339	42%	0.416	S	S	.	.	H	α-helix	trans	-68.6	-41	174.7	173.9	0	0	0	0	110.9	G24 A25 R30 I31 L32	G24-V28 WeakPolarHBondContact O-CG2 3.35Å; G24-V28 PolarHBondContact O-N 3.35Å; G24-V28 VanDerWaalsContact O-N 3.14Å; A25-V28 PolarHBondContact O-N 3.31Å; V28-R30 PolarHBondContact O-N 3.16Å; V28-I31 PolarHBondContact O-N 3.17Å; V28-I31 VanDerWaalsContact O-N 3.16Å; V28-L32 HydrophobicContact CG1-CD1 3.8Å; V28-L32 HydrophobicContact CG1-CG 4.19Å; V28-L32 WeakPolarHBondContact O-CG 3.37Å; V28-L32 PolarHBondContact O-N 3.32Å
29	R	86.4	Confident	84.6	Confident	162 Å²	162	77.1 Å²	77.1	61%	0.611	39%	0.385	S	S	*	.	H	α-helix	trans	-58.5	-45.4	174.8	-177.3	-179	177.4	-158	0.2	111.4	A25 D26 I31 L32 L33	A25-R29 VanDerWaalsContact O-CB 3.3Å; A25-R29 WeakPolarHBondContact O-CB 3.38Å; A25-R29 PolarHBondContact O-N 2.88Å; D26-R29 PolarHBondContact O-N 3.45Å; R29-I31 VanDerWaalsContact C-N 3.33Å; R29-I31 PolarHBondContact O-N 2.91Å; R29-L32 PolarHBondContact O-N 2.85Å; R29-L33 HydrophobicContact CG-CD1 3.82Å; R29-L33 HydrophobicContact CG-CG 4.33Å; R29-L33 WeakPolarHBondContact O-CB 3.39Å; R29-L33 VanDerWaalsContact O-CG 3.27Å; R29-L33 WeakPolarHBondContact O-CG 3.45Å; R29-L33 PolarHBondContact O-N 3.02Å
30	R	84.4	Confident	83.9	Confident	182 Å²	182	76.9 Å²	76.9	69%	0.687	38%	0.384	S	S	*	.	H	α-helix	trans	-61.1	-38.5	175	-72	170.1	-173.7	-163.7	1.7	112.4	D26 V28 G34	D26-R30 WeakPolarHBondContact O-CB 3.37Å; D26-R30 VanDerWaalsContact O-CG 3.25Å; D26-R30 WeakPolarHBondContact O-CG 3.37Å; D26-R30 PolarHBondContact O-N 3.16Å; V28-R30 PolarHBondContact O-N 3.16Å; R30-G34 PolarHBondContact O-N 3.14Å; R30-G34 VanDerWaalsContact O-N 3.09Å
31	I	87.9	Confident	83.4	Confident	27 Å²	27	74.9 Å²	74.9	14%	0.138	37%	0.372	C	S	.	.	H	α-helix	trans	-68	-45.7	175.9	-73.4	173.1	0	0	0	111.6	V22 N27 V28 R29 G34 E35 V39 W224	V22-I31 HydrophobicContact CB-CD1 3.76Å; V22-I31 HydrophobicContact CG1-CD1 3.65Å; V22-I31 HydrophobicContact CG2-CD1 3.86Å; N27-I31 WeakPolarHBondContact O-CG1 3.39Å; N27-I31 PolarHBondContact O-N 2.87Å; N27-I31 VanDerWaalsContact O-N 3.16Å; V28-I31 PolarHBondContact O-N 3.17Å; V28-I31 VanDerWaalsContact O-N 3.16Å; R29-I31 VanDerWaalsContact C-N 3.33Å; R29-I31 PolarHBondContact O-N 2.91Å; I31-G34 CarbonylContact O-C 3.43Å; I31-G34 WeakPolarHBondContact O-CA 3.42Å; I31-G34 PolarHBondContact O-N 3Å; I31-G34 VanDerWaalsContact O-N 3.17Å; I31-E35 PolarHBondContact O-N 3.46Å; I31-V39 HydrophobicContact CG2-CG1 4.37Å; I31-V39 HydrophobicContact CG2-CG2 3.98Å; I31-V39 WeakPolarHBondContact O-CG2 3.41Å; I31-W224 HydrophobicContact CG2-CD2 3.61Å; I31-W224 HydrophobicContact CG2-CE3 4.01Å; I31-W224 HydrophobicContact CG2-CG 3.88Å; I31-W224 HydrophobicContact CG2-CZ2 4.2Å; I31-W224 HydrophobicContact CG2-CZ3 4.45Å
32	L	85.3	Confident	83	Confident	91 Å²	91	72.9 Å²	72.9	48%	0.476	37%	0.366	S	S	.	.	H	α-helix	trans	-69.7	-41.3	-179	-67.1	174.5	0	0	0	112.4	V28 R29 G34 E35 W224	V28-L32 HydrophobicContact CG1-CD1 3.8Å; V28-L32 HydrophobicContact CG1-CG 4.19Å; V28-L32 WeakPolarHBondContact O-CG 3.37Å; V28-L32 PolarHBondContact O-N 3.32Å; R29-L32 PolarHBondContact O-N 2.85Å; L32-G34 PolarHBondContact O-N 3.11Å; L32-E35 WeakPolarHBondContact O-CB 3.36Å; L32-E35 PolarHBondContact O-N 3.02Å; L32-W224 HydrophobicContact CD2-CH2 3.68Å; L32-W224 HydrophobicContact CD2-CZ2 3.84Å
33	L	84.3	Confident	82.6	Confident	138 Å²	138	73.1 Å²	73.1	72%	0.723	36%	0.363	S	S	*	.	H	α-helix	trans	-67.2	-19.8	171.4	-66	174.9	0	0	0	112.5	R29	R29-L33 HydrophobicContact CG-CD1 3.82Å; R29-L33 HydrophobicContact CG-CG 4.33Å; R29-L33 WeakPolarHBondContact O-CB 3.39Å; R29-L33 VanDerWaalsContact O-CG 3.27Å; R29-L33 WeakPolarHBondContact O-CG 3.45Å; R29-L33 PolarHBondContact O-N 3.02Å
34	G	80.8	Confident	82.5	Confident	6 Å²	6	72.5 Å²	72.5	6%	0.062	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	8.7	174.4	0	0	0	0	0	114.9	R30 I31 L32 R37 L38 V39	R30-G34 PolarHBondContact O-N 3.14Å; R30-G34 VanDerWaalsContact O-N 3.09Å; I31-G34 CarbonylContact O-C 3.43Å; I31-G34 WeakPolarHBondContact O-CA 3.42Å; I31-G34 PolarHBondContact O-N 3Å; I31-G34 VanDerWaalsContact O-N 3.17Å; L32-G34 PolarHBondContact O-N 3.11Å; G34-R37 PolarHBondContact O-N 3.28Å; G34-R37 VanDerWaalsContact O-N 3.17Å; G34-L38 PolarHBondContact O-N 3.32Å; G34-V39 PolarHBondContact O-N 2.98Å
35	E	76.3	Confident	82	Confident	73 Å²	73	74.4 Å²	74.4	34%	0.341	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-57.9	138.3	178.7	-166.3	179.1	-162.9	0	0	111.2	I31 L32 R37 V41	I31-E35 PolarHBondContact O-N 3.46Å; L32-E35 WeakPolarHBondContact O-CB 3.36Å; L32-E35 PolarHBondContact O-N 3.02Å; E35-R37 PolarHBondContact O-N 3.19Å; E35-V41 VanDerWaalsContact OE1-CG2 3.31Å; E35-V41 WeakPolarHBondContact OE1-CG2 3.31Å
36	H	70.3	Confident	81.7	Confident	51 Å²	51	73.9 Å²	73.9	24%	0.236	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	-16.4	-172.2	-55.9	-75.8	0	0	0	116.6	V39 D61 H64	H36-V39 PolarHBondContact N-O 3.04Å; H36-D61 IonicContact CE1-OD1 2.77Å; H36-D61 IonicContact CG-OD1 2.68Å; H36-D61 IonicContact ND1-OD1 4Å; H36-D61 PolarHBondContact ND1-OD1 3.32Å; H36-H64 AromaticContact NE2-ND1 3.66Å
37	R	73.8	Confident	81.3	Confident	215 Å²	215	71 Å²	71	81%	0.811	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-57.3	174.7	-175.3	177.7	178.6	-178.2	-0.1	112.9	G34 E35	G34-R37 PolarHBondContact O-N 3.28Å; G34-R37 VanDerWaalsContact O-N 3.17Å; E35-R37 PolarHBondContact O-N 3.19Å
38	L	74.9	Confident	81	Confident	106 Å²	106	74.8 Å²	74.8	56%	0.555	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-38.7	-176.2	-62.1	177.1	0	0	0	111.6	G34 T226 R227	G34-L38 PolarHBondContact O-N 3.32Å; L38-T226 WeakPolarHBondContact O-CA 3.26Å; L38-R227 PolarHBondContact O-N 2.66Å
39	V	81.8	Confident	80.7	Confident	10 Å²	10	76.9 Å²	76.9	6%	0.061	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	156.3	-177.1	-62.6	0	0	0	0	111.3	I31 G34 H36 W224 R225 T226	I31-V39 HydrophobicContact CG2-CG1 4.37Å; I31-V39 HydrophobicContact CG2-CG2 3.98Å; I31-V39 WeakPolarHBondContact O-CG2 3.41Å; G34-V39 PolarHBondContact O-N 2.98Å; H36-V39 PolarHBondContact N-O 3.04Å; V39-W224 HydrophobicContact CB-CB 4.42Å; V39-W224 HydrophobicContact CB-CE3 4.06Å; V39-W224 HydrophobicContact CG1-CB 4.22Å; V39-W224 HydrophobicContact CG2-CE3 3.73Å; V39-W224 HydrophobicContact CG2-CZ3 4.13Å; V39-R225 WeakPolarHBondContact CA-O 3.42Å; V39-T226 HydrophobicContact CG1-CG2 4.49Å
40	S	77.3	Confident	80.6	Confident	16 Å²	16	73.5 Å²	73.5	11%	0.112	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	149.8	164.3	69.5	0	0	0	0	111.3	H42 H60 R225	S40-H42 PolarHBondContact O-N 3.07Å; S40-H60 VanDerWaalsContact CB-NE2 3.26Å; S40-H60 WeakPolarHBondContact CB-NE2 3.45Å; S40-H60 PolarHBondContact OG-NE2 2.82Å; S40-H60 VanDerWaalsContact OG-NE2 3.09Å; S40-R225 PolarHBondContact N-O 2.84Å; S40-R225 VanDerWaalsContact N-O 3.1Å; S40-R225 PolarHBondContact O-N 2.86Å
41	V	81.4	Confident	80.3	Confident	37 Å²	37	66.2 Å²	66.2	22%	0.224	34%	0.343	C	S	.	.			trans	-65	128.7	179.9	178.4	0	0	0	0	109.7	E35 W43 H60 W224	E35-V41 VanDerWaalsContact OE1-CG2 3.31Å; E35-V41 WeakPolarHBondContact OE1-CG2 3.31Å; V41-W43 HydrophobicContact CG1-CZ2 4.45Å; V41-H60 PolarHBondContact O-CE1 3.47Å; V41-H60 VanDerWaalsContact O-CE1 3.29Å; V41-W224 HydrophobicContact CG2-CH2 4.47Å; V41-W224 HydrophobicContact CG2-CZ3 3.94Å
42	H	81.6	Confident	79.5	Confident	37 Å²	37	66.3 Å²	66.3	17%	0.171	35%	0.35	C	S	.	.			trans	-135.9	120.9	174.1	-159.6	76.8	0	0	0	112	R17 S40 L223	R17-H42 PolarHBondContact NH1-CD2 3.1Å; R17-H42 PolarHBondContact NH1-NE2 3.32Å; S40-H42 PolarHBondContact O-N 3.07Å; H42-L223 VanDerWaalsContact CB-O 3.29Å; H42-L223 WeakPolarHBondContact CB-O 3.27Å; H42-L223 PolarHBondContact N-O 3.46Å; H42-L223 PolarHBondContact O-N 2.84Å
43	W	82.8	Confident	78.5	Confident	42 Å²	42	67.2 Å²	67.2	16%	0.159	36%	0.364	C	S	.	.			trans	-95.4	144.7	174.6	-63.7	106.1	0	0	0	111.4	V41 V47 R48 S57 R220 P222	V41-W43 HydrophobicContact CG1-CZ2 4.45Å; W43-V47 HydrophobicContact CB-CB 4.09Å; W43-V47 HydrophobicContact CB-CG1 3.91Å; W43-V47 HydrophobicContact CD2-CG1 4.2Å; W43-V47 HydrophobicContact CE3-CG1 4.15Å; W43-V47 HydrophobicContact CG-CG1 4.1Å; W43-R48 HydrophobicContact CB-CG 3.91Å; W43-R48 VanDerWaalsContact O-CD 3.24Å; W43-R48 WeakPolarHBondContact O-CD 3.42Å; W43-S57 PolarHBondContact NE1-O 3.06Å; W43-R220 HydrophobicContact CZ3-CB 4.42Å; W43-P222 HydrophobicContact CH2-CB 4.15Å; W43-P222 HydrophobicContact CZ2-CB 4.49Å; W43-P222 HydrophobicContact CZ3-CB 4.32Å
44	P	83.8	Confident	77.3	Confident	18 Å²	18	62.7 Å²	62.7	12%	0.117	35%	0.351	C	S	.	.			trans	-55.2	154.9	171.6	-25.8	35.4	0	0	0	112.6	F15 S46 V47 R48	F15-P44 HydrophobicContact CD1-CB 4.42Å; F15-P44 HydrophobicContact CD2-CB 4.46Å; F15-P44 HydrophobicContact CD2-CG 3.99Å; F15-P44 HydrophobicContact CE1-CB 4.43Å; F15-P44 HydrophobicContact CE1-CG 4.43Å; F15-P44 HydrophobicContact CE2-CB 4.46Å; F15-P44 HydrophobicContact CE2-CG 3.72Å; F15-P44 HydrophobicContact CG-CB 4.43Å; F15-P44 HydrophobicContact CG-CG 4.44Å; F15-P44 HydrophobicContact CZ-CB 4.45Å; F15-P44 HydrophobicContact CZ-CG 3.96Å; P44-S46 VanDerWaalsContact C-N 3.3Å; P44-S46 PolarHBondContact O-N 3.24Å; P44-V47 PolarHBondContact O-N 2.85Å; P44-R48 PolarHBondContact O-N 3.26Å
45	A	79	Confident	76.2	Confident	72 Å²	72	63.5 Å²	63.5	60%	0.595	36%	0.355	S	S	*	.	H	α-helix	trans	-54.3	-43.5	-175.5	0	0	0	0	0	113	V47 R48 T49	A45-V47 PolarHBondContact O-N 3.36Å; A45-R48 PolarHBondContact O-N 3.26Å; A45-R48 VanDerWaalsContact O-N 3.14Å; A45-T49 PolarHBondContact O-N 3.02Å; A45-T49 PolarHBondContact O-OG1 2.93Å; A45-T49 VanDerWaalsContact O-OG1 3.1Å
46	S	81.8	Confident	75.6	Confident	70 Å²	70	62 Å²	62	49%	0.49	35%	0.349	S	S	.	.	H	α-helix	trans	-56.1	-45.5	175.8	50.7	0	0	0	0	113.2	P44 T49 I50	P44-S46 VanDerWaalsContact C-N 3.3Å; P44-S46 PolarHBondContact O-N 3.24Å; S46-T49 PolarHBondContact O-N 3.09Å; S46-I50 VanDerWaalsContact O-CG1 3.28Å; S46-I50 WeakPolarHBondContact O-CG1 3.43Å; S46-I50 PolarHBondContact O-N 2.85Å
47	V	79.9	Confident	75.1	Confident	36 Å²	36	60.9 Å²	60.9	22%	0.218	35%	0.347	C	S	.	.	H	α-helix	trans	-66	-39	177.1	178.4	0	0	0	0	111	W43 P44 A45 I50 L51	W43-V47 HydrophobicContact CB-CB 4.09Å; W43-V47 HydrophobicContact CB-CG1 3.91Å; W43-V47 HydrophobicContact CD2-CG1 4.2Å; W43-V47 HydrophobicContact CE3-CG1 4.15Å; W43-V47 HydrophobicContact CG-CG1 4.1Å; P44-V47 PolarHBondContact O-N 2.85Å; A45-V47 PolarHBondContact O-N 3.36Å; V47-I50 PolarHBondContact O-N 2.81Å; V47-L51 HydrophobicContact CG1-CD1 3.78Å; V47-L51 HydrophobicContact CG1-CG 4.27Å; V47-L51 WeakPolarHBondContact O-CB 3.43Å; V47-L51 WeakPolarHBondContact O-CG 3.42Å; V47-L51 PolarHBondContact O-N 2.89Å
48	R	80.9	Confident	74.4	Confident	126 Å²	126	52 Å²	52	48%	0.475	32%	0.316	S	S	.	.	H	α-helix	trans	-66.3	-37.2	175.8	-65.5	179.6	66.5	-127.5	0.7	112.4	W43 P44 A45 G52	W43-R48 HydrophobicContact CB-CG 3.91Å; W43-R48 VanDerWaalsContact O-CD 3.24Å; W43-R48 WeakPolarHBondContact O-CD 3.42Å; P44-R48 PolarHBondContact O-N 3.26Å; A45-R48 PolarHBondContact O-N 3.26Å; A45-R48 VanDerWaalsContact O-N 3.14Å; R48-G52 WeakPolarHBondContact O-CA 3.4Å; R48-G52 PolarHBondContact O-N 3.18Å
49	T	80	Confident	73.8	Confident	99 Å²	99	48.7 Å²	48.7	61%	0.607	30%	0.299	S	S	*	.	H	α-helix	trans	-67.9	-41	174.3	-58.5	0	0	0	0	111.9	A45 S46	A45-T49 PolarHBondContact O-N 3.02Å; A45-T49 PolarHBondContact O-OG1 2.93Å; A45-T49 VanDerWaalsContact O-OG1 3.1Å; S46-T49 PolarHBondContact O-N 3.09Å
50	I	84.1	Confident	72.7	Confident	92 Å²	92	52.4 Å²	52.4	47%	0.472	32%	0.315	S	S	.	.	H	α-helix	trans	-72.2	-40.4	-179.1	-69	165.2	0	0	0	112.5	S46 V47 L191	S46-I50 VanDerWaalsContact O-CG1 3.28Å; S46-I50 WeakPolarHBondContact O-CG1 3.43Å; S46-I50 PolarHBondContact O-N 2.85Å; V47-I50 PolarHBondContact O-N 2.81Å; I50-L191 HydrophobicContact CG1-CD2 4.39Å; I50-L191 HydrophobicContact CG2-CD2 4.05Å; I50-L191 HydrophobicContact CG2-CG 4.4Å
51	L	78.3	Confident	71.6	Confident	29 Å²	29	54 Å²	54	15%	0.152	32%	0.323	C	S	.	.	H	α-helix	trans	-81.3	-21	177.7	-64.7	178.9	0	0	0	113.1	V47 C55 A195	V47-L51 HydrophobicContact CG1-CD1 3.78Å; V47-L51 HydrophobicContact CG1-CG 4.27Å; V47-L51 WeakPolarHBondContact O-CB 3.43Å; V47-L51 WeakPolarHBondContact O-CG 3.42Å; V47-L51 PolarHBondContact O-N 2.89Å; L51-C55 HydrophobicContact CB-CB 4.21Å; L51-C55 PolarHBondContact O-SG 2.92Å; L51-C55 VanDerWaalsContact O-SG 3.33Å; L51-A195 HydrophobicContact CD2-CB 4.07Å
52	G	72.3	Confident	70.1	Confident	28 Å²	28	56.1 Å²	56.1	29%	0.289	34%	0.339	S	S	.	.			trans	70.3	173.4	-172	0	0	0	0	0	113.5	R48 G54 N58	R48-G52 WeakPolarHBondContact O-CA 3.4Å; R48-G52 PolarHBondContact O-N 3.18Å; G52-G54 PolarHBondContact O-N 2.94Å; G52-N58 PolarHBondContact O-ND2 3.33Å
53	S	63.7	Low	68.8	Low	110 Å²	110	56.6 Å²	56.6	77%	0.769	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-8.6	-177.5	47.8	0	0	0	0	114.8
54	G	58.4	Low	67.4	Low	44 Å²	44	56.4 Å²	56.4	45%	0.454	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-16.1	-172.5	0	0	0	0	0	116.8	G52	G52-G54 PolarHBondContact O-N 2.94Å
55	C	59.1	Low	66	Low	22 Å²	22	62.4 Å²	62.4	15%	0.149	37%	0.371	C	S	.	.	S	Bend	trans	-68.4	146.5	-179.8	-80.7	0	0	0	0	112.3	L51 S57 N58	L51-C55 HydrophobicContact CB-CB 4.21Å; L51-C55 PolarHBondContact O-SG 2.92Å; L51-C55 VanDerWaalsContact O-SG 3.33Å; C55-S57 PolarHBondContact O-N 2.76Å; C55-N58 PolarHBondContact O-N 3.4Å
56	L	62.1	Low	64.6	Low	41 Å²	41	66 Å²	66	22%	0.215	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-50.7	-43.7	177.8	-71.5	170.7	0	0	0	112	N58 L59 R67 V203	L56-N58 PolarHBondContact O-N 3.38Å; L56-L59 PolarHBondContact O-N 3.45Å; L56-L59 VanDerWaalsContact O-N 3.16Å; L56-R67 HydrophobicContact CD2-CB 3.47Å; L56-R67 VanDerWaalsContact CD2-CB 3.47Å; L56-V203 HydrophobicContact CD1-CG2 4.26Å
57	S	60.7	Low	63.3	Low	29 Å²	29	69.7 Å²	69.7	20%	0.203	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-57.8	-17.1	178	-65.1	0	0	0	0	115.3	W43 C55	W43-S57 PolarHBondContact NE1-O 3.06Å; C55-S57 PolarHBondContact O-N 2.76Å
58	N	58.1	Low	62	Low	27 Å²	27	75.4 Å²	75.4	14%	0.144	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-113.3	2	-177.5	-73.8	-26.9	0	0	0	113.7	G52 C55 L56	G52-N58 PolarHBondContact O-ND2 3.33Å; C55-N58 PolarHBondContact O-N 3.4Å; L56-N58 PolarHBondContact O-N 3.38Å
59	L	62.1	Low	60.3	Low	38 Å²	38	77.2 Å²	77.2	20%	0.199	41%	0.412	C	S	.	.			trans	-97.2	124.5	-179.5	-68.5	172.6	0	0	0	111	L56	L56-L59 PolarHBondContact O-N 3.45Å; L56-L59 VanDerWaalsContact O-N 3.16Å
60	H	59.8	Low	58.6	Low	88 Å²	88	77.7 Å²	77.7	41%	0.407	42%	0.417	S	S	.	.			trans	-85.1	151.8	178.4	-95	69.4	0	0	0	113.7	S40 V41 S62 S63	S40-H60 VanDerWaalsContact CB-NE2 3.26Å; S40-H60 WeakPolarHBondContact CB-NE2 3.45Å; S40-H60 PolarHBondContact OG-NE2 2.82Å; S40-H60 VanDerWaalsContact OG-NE2 3.09Å; V41-H60 PolarHBondContact O-CE1 3.47Å; V41-H60 VanDerWaalsContact O-CE1 3.29Å; H60-S62 PolarHBondContact O-N 2.78Å; H60-S63 PolarHBondContact O-N 3.43Å
61	D	53.3	Low	56.9	Low	50 Å²	50	83.7 Å²	83.7	27%	0.267	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	-73.8	160.4	-58	-13	0	0	0	118.3	H36 R227	H36-D61 IonicContact CE1-OD1 2.77Å; H36-D61 IonicContact CG-OD1 2.68Å; H36-D61 IonicContact ND1-OD1 4Å; H36-D61 PolarHBondContact ND1-OD1 3.32Å; D61-R227 IonicContact OD2-CZ 3.71Å; D61-R227 IonicContact OD2-NH1 2.82Å; D61-R227 PolarHBondContact OD2-NH1 3.28Å
62	S	50.9	Low	55.1	Low	80 Å²	80	85.8 Å²	85.8	56%	0.559	46%	0.463	S	S	*	.	H	α-helix	trans	-93.7	-46.6	-175.8	55.1	0	0	0	0	113.2	H60 H64 K65 Q66	H60-S62 PolarHBondContact O-N 2.78Å; S62-H64 PolarHBondContact O-N 3.32Å; S62-K65 PolarHBondContact O-N 2.84Å; S62-K65 VanDerWaalsContact O-N 3.17Å; S62-Q66 PolarHBondContact O-N 3.43Å; S62-Q66 VanDerWaalsContact O-N 3.11Å
63	S	53.1	Low	53.6	Low	47 Å²	47	89.6 Å²	89.6	33%	0.329	48%	0.48	S	S	.	.	H	α-helix	trans	-63.1	-30.2	-177.9	-65.4	0	0	0	0	112.9	H60 R67	H60-S63 PolarHBondContact O-N 3.43Å; S63-R67 PolarHBondContact O-N 3.28Å; S63-R67 VanDerWaalsContact O-N 3.11Å
64	H	54.4	Low	52.6	Low	39 Å²	39	94.4 Å²	94.4	18%	0.181	48%	0.482	C	S	.	.	H	α-helix	trans	-64.2	-49.8	173.7	-174.2	-144.5	0	0	0	111.2	H36 S62 Q66 R67 K68	H36-H64 AromaticContact NE2-ND1 3.66Å; S62-H64 PolarHBondContact O-N 3.32Å; H64-Q66 PolarHBondContact O-N 3.11Å; H64-R67 PolarHBondContact O-N 3.11Å; H64-K68 VanDerWaalsContact O-CB 3.27Å; H64-K68 WeakPolarHBondContact O-CB 3.48Å; H64-K68 PolarHBondContact O-N 3.17Å
65	K	53.4	Low	51.8	Low	143 Å²	143	100 Å²	100	62%	0.622	50%	0.498	S	S	*	.	H	α-helix	trans	-62.7	-40.8	178.8	-64.3	-176.6	-178.6	-177.1	0	112.2	S62 K69	S62-K65 PolarHBondContact O-N 2.84Å; S62-K65 VanDerWaalsContact O-N 3.17Å; K65-K69 PolarHBondContact O-N 3.28Å
66	Q	50.9	Low	51	Low	148 Å²	148	104.9 Å²	104.9	69%	0.692	52%	0.522	S	S	*	.	H	α-helix	trans	-68.8	-30.4	178	-72.8	-172.3	-11.2	0	0	114	S62 H64	S62-Q66 PolarHBondContact O-N 3.43Å; S62-Q66 VanDerWaalsContact O-N 3.11Å; H64-Q66 PolarHBondContact O-N 3.11Å
67	R	54.3	Low	49.9	Very low	148 Å²	148	114.6 Å²	114.6	56%	0.558	56%	0.556	S	S	*	*	H	α-helix	trans	-92.1	-17.4	175.6	-67.8	-166.6	177.4	-140.8	-1.4	114.5	L56 S63 H64	L56-R67 HydrophobicContact CD2-CB 3.47Å; L56-R67 VanDerWaalsContact CD2-CB 3.47Å; S63-R67 PolarHBondContact O-N 3.28Å; S63-R67 VanDerWaalsContact O-N 3.11Å; H64-R67 PolarHBondContact O-N 3.11Å
68	K	52.2	Low	48.9	Very low	156 Å²	156	118.5 Å²	118.5	68%	0.678	59%	0.59	S	S	*	*	H	α-helix	trans	-78.2	-17.8	171	-171.7	169	179.9	176.2	0	112.8	H64 P70	H64-K68 VanDerWaalsContact O-CB 3.27Å; H64-K68 WeakPolarHBondContact O-CB 3.48Å; H64-K68 PolarHBondContact O-N 3.17Å; K68-P70 WeakPolarHBondContact O-CD 3.27Å
69	K	44.5	Very low	47.9	Very low	163 Å²	163	120.5 Å²	120.5	71%	0.709	62%	0.617	S	S	*	*	S	Bend	trans	-59.1	122.9	160	-87.7	-166.1	172.6	-171	0	108.7	K65 R71	K65-K69 PolarHBondContact O-N 3.28Å; K69-R71 PolarHBondContact O-N 3.35Å; K69-R71 VanDerWaalsContact O-N 3.14Å
70	P	44.2	Very low	46.6	Very low	110 Å²	110	126 Å²	126	71%	0.714	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-65.2	117.8	178.4	26.2	-33.2	0	0	0	109.5	K68 G72	K68-P70 WeakPolarHBondContact O-CD 3.27Å; P70-G72 PolarHBondContact O-N 2.93Å
71	R	48.4	Very low	45.6	Very low	217 Å²	217	130.3 Å²	130.3	82%	0.819	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-67.8	125.5	159	-63.2	-175.4	-176.8	-134.9	-3.1	106.2	K69 T73	K69-R71 PolarHBondContact O-N 3.35Å; K69-R71 VanDerWaalsContact O-N 3.14Å; R71-T73 PolarHBondContact O-N 3.29Å
72	G	41.3	Very low	44.7	Very low	74 Å²	74	139.6 Å²	139.6	76%	0.763	70%	0.698	S	S	*	*			trans	-37.4	121.6	-164.4	0	0	0	0	0	114.1	P70 R74	P70-G72 PolarHBondContact O-N 2.93Å; G72-R74 PolarHBondContact O-N 3.45Å
73	T	41.6	Very low	43.8	Very low	107 Å²	107	139.6 Å²	139.6	66%	0.656	71%	0.711	S	S	*	*			trans	-66	89.8	-163.3	-49.8	0	0	0	0	112.7	R71 M75	R71-T73 PolarHBondContact O-N 3.29Å; T73-M75 HydrophobicContact CG2-CB 4.06Å; T73-M75 HydrophobicContact CG2-CG 3.81Å; T73-M75 HydrophobicContact CG2-SD 4.16Å; T73-M75 PolarHBondContact O-N 3.26Å
74	R	41.8	Very low	43	Very low	212 Å²	212	143.5 Å²	143.5	80%	0.8	74%	0.738	S	S	*	*			trans	-75.2	59.5	166.6	-165.2	171.8	-179.1	171.6	1.1	111.1	G72 L76	G72-R74 PolarHBondContact O-N 3.45Å; R74-L76 HydrophobicContact CG-CD1 4.47Å; R74-L76 HydrophobicContact CG-CG 4.03Å; R74-L76 PolarHBondContact O-N 2.88Å
75	M	41.5	Very low	41.8	Very low	162 Å²	162	145.1 Å²	145.1	80%	0.798	77%	0.765	S	S	*	*			trans	-73.2	78.2	157.1	-88.2	-178.7	61	0	0	108.3	T73 R77	T73-M75 HydrophobicContact CG2-CB 4.06Å; T73-M75 HydrophobicContact CG2-CG 3.81Å; T73-M75 HydrophobicContact CG2-SD 4.16Å; T73-M75 PolarHBondContact O-N 3.26Å; M75-R77 PolarHBondContact O-N 3.21Å
76	L	43.4	Very low	40.7	Very low	124 Å²	124	147.2 Å²	147.2	65%	0.649	78%	0.777	S	S	*	*			trans	-61.6	126.7	156.1	-73.9	175	0	0	0	107.5	R74 A78	R74-L76 HydrophobicContact CG-CD1 4.47Å; R74-L76 HydrophobicContact CG-CG 4.03Å; R74-L76 PolarHBondContact O-N 2.88Å; L76-A78 PolarHBondContact O-N 3.38Å
77	R	38.8	Very low	39.9	Very low	244 Å²	244	148.7 Å²	148.7	92%	0.921	78%	0.784	S	S	*	*			trans	-62.8	117.7	166.6	-70.5	-177.1	176.5	-172.4	0	107.5	M75	M75-R77 PolarHBondContact O-N 3.21Å
78	A	39.6	Very low	39.3	Very low	111 Å²	111	147.4 Å²	147.4	92%	0.917	79%	0.794	S	S	*	*			trans	-89	110.8	167.9	0	0	0	0	0	108.1	L76	L76-A78 PolarHBondContact O-N 3.38Å
79	G	35.8	Very low	38.1	Very low	69 Å²	69	143.8 Å²	143.8	71%	0.711	80%	0.801	S	S	*	*			trans	143.9	104.7	-173.8	0	0	0	0	0	108.1
80	D	34.3	Very low	37.4	Very low	153 Å²	153	140.9 Å²	140.9	82%	0.818	81%	0.808	S	S	*	*				-132.2	172.8	54.1	-141	-47.3	0	0	0	115.2
81	H	39.8	Very low	36.8	Very low	179 Å²	179	143 Å²	143	83%	0.829	82%	0.818	S	S	*	*			trans	-129.2	86.5	172	-95.2	-64.4	0	0	0	110.8
82	R	34.2	Very low	36	Very low	245 Å²	245	137.3 Å²	137.3	93%	0.925	82%	0.818	S	S	*	*			trans	-165.9	140.8	154.6	-116.4	168.4	-71.6	-168.5	1.2	110
83	G	31.2	Very low	35.4	Very low	81 Å²	81	140.6 Å²	140.6	84%	0.835	81%	0.813	S	S	*	*			trans	139.8	80.7	-177.4	0	0	0	0	0	112.8
84	S	37	Very low	35	Very low	129 Å²	129	143.8 Å²	143.8	90%	0.902	83%	0.826	S	S	*	*			trans	-76.9	129.9	168.4	47.4	0	0	0	0	110.7
85	G	29.7	Very low	34.4	Very low	72 Å²	72	141.7 Å²	141.7	74%	0.742	82%	0.818	S	S	*	*			trans	-177.4	141.8	175.7	0	0	0	0	0	113.7
86	Q	31.1	Very low	33.9	Very low	188 Å²	188	144.7 Å²	144.7	88%	0.879	82%	0.82	S	S	*	*			trans	-32.2	142.1	-171.5	-91.3	87	11.3	0	0	119.9
87	Q	32.4	Very low	33.4	Very low	179 Å²	179	143.9 Å²	143.9	84%	0.836	83%	0.831	S	S	*	*			trans	-104.4	172.7	131.5	-99.2	-160.7	14.4	0	0	108.9
88	P	42	Very low	33.1	Very low	120 Å²	120	142.7 Å²	142.7	78%	0.779	83%	0.827	S	S	*	*			cis	-125	178	-10.9	36.2	-20.2	0	0	0	113
89	G	27.9	Very low	33.5	Very low	80 Å²	80	143.1 Å²	143.1	83%	0.825	82%	0.82	S	S	*	*			trans	149	89.5	157	0	0	0	0	0	117.4
90	A	28.7	Very low	33.9	Very low	103 Å²	103	145.3 Å²	145.3	85%	0.851	82%	0.822	S	S	*	*			trans	-163.9	108.4	153	0	0	0	0	0	109.8
91	V	31.9	Very low	33.9	Very low	153 Å²	153	141.7 Å²	141.7	93%	0.927	82%	0.821	S	S	*	*			trans	-83	139.9	166.2	-73.7	0	0	0	0	109.6
92	A	31.9	Very low	34	Very low	99 Å²	99	141 Å²	141	82%	0.818	82%	0.822	S	S	*	*			trans	-140.9	61	178.5	0	0	0	0	0	110.8	L94	A92-L94 PolarHBondContact O-N 2.99Å
93	E	29.3	Very low	34.6	Very low	142 Å²	142	134.8 Å²	134.8	66%	0.664	81%	0.814	S	S	*	*			trans	-69.4	110.2	164.4	-179.1	-175.3	161.3	0	0	108.6	R95	E93-R95 HydrophobicContact CG-CG 4.21Å; E93-R95 WeakPolarHBondContact OE1-CD 3.29Å; E93-R95 VanDerWaalsContact OE1-CG 3.27Å; E93-R95 WeakPolarHBondContact OE1-CG 3.22Å; E93-R95 IonicContact OE1-CZ 3.46Å; E93-R95 IonicContact OE1-NE 3.77Å; E93-R95 PolarHBondContact OE1-NE 2.96Å; E93-R95 IonicContact OE1-NH2 3.41Å; E93-R95 PolarHBondContact OE1-NH2 3.15Å
94	L	31.9	Very low	34.7	Very low	174 Å²	174	142.6 Å²	142.6	91%	0.911	82%	0.818	S	S	*	*			trans	-109.4	108.1	168.5	-162.4	68.4	0	0	0	110.5	A92	A92-L94 PolarHBondContact O-N 2.99Å
95	R	30.3	Very low	34.5	Very low	168 Å²	168	139.4 Å²	139.4	63%	0.634	81%	0.806	S	S	*	*			trans	-80.8	144.7	-176.6	-79.8	-176.4	171.6	-172.3	-1.3	113.1	E93	E93-R95 HydrophobicContact CG-CG 4.21Å; E93-R95 WeakPolarHBondContact OE1-CD 3.29Å; E93-R95 VanDerWaalsContact OE1-CG 3.27Å; E93-R95 WeakPolarHBondContact OE1-CG 3.22Å; E93-R95 IonicContact OE1-CZ 3.46Å; E93-R95 IonicContact OE1-NE 3.77Å; E93-R95 PolarHBondContact OE1-NE 2.96Å; E93-R95 IonicContact OE1-NH2 3.41Å; E93-R95 PolarHBondContact OE1-NH2 3.15Å
96	R	30.9	Very low	34.5	Very low	225 Å²	225	145.3 Å²	145.3	85%	0.849	81%	0.814	S	S	*	*			trans	57	123	145.9	-65.5	172.2	-179.7	-176	-0.5	118.9
97	A	32.3	Very low	34.9	Very low	107 Å²	107	141 Å²	141	88%	0.884	81%	0.811	S	S	*	*				-137.1	146.7	124.9	0	0	0	0	0	109.3
98	R	33.6	Very low	35.6	Very low	220 Å²	220	138.8 Å²	138.8	83%	0.83	81%	0.812	S	S	*	*			trans	-141.9	120.3	-179.6	173.8	-164.3	178.1	-162.2	3.3	109.3
99	P	46.8	Very low	35.3	Very low	119 Å²	119	140.9 Å²	140.9	77%	0.773	81%	0.811	S	S	*	*			trans	-82.8	137.3	164	32.3	-30.9	0	0	0	111
100	P	45.2	Very low	35.9	Very low	115 Å²	115	142.6 Å²	142.6	75%	0.747	81%	0.805	S	S	*	*			trans	-96.4	162.7	165.9	37.3	-32.3	0	0	0	111.7
101	G	33.8	Very low	37.2	Very low	78 Å²	78	142.6 Å²	142.6	80%	0.804	80%	0.796	S	S	*	*			trans	155.9	107.2	167.7	0	0	0	0	0	115.1
102	L	40.8	Very low	37.5	Very low	163 Å²	163	141.1 Å²	141.1	85%	0.853	78%	0.783	S	S	*	*			trans	-138.9	139	161.9	-90.3	171.7	0	0	0	107.6
103	P	46.8	Very low	37.6	Very low	116 Å²	116	145.6 Å²	145.6	75%	0.753	78%	0.779	S	S	*	*				-124.3	150.4	116.9	37.3	-32.2	0	0	0	109.9
104	R	33.8	Very low	37.9	Very low	245 Å²	245	146.7 Å²	146.7	93%	0.925	78%	0.784	S	S	*	*			cis	70.1	136.7	42.2	-79.6	-164	171.4	-165.9	-1.3	114.5
105	G	32.5	Very low	37.8	Very low	62 Å²	62	142.4 Å²	142.4	64%	0.639	77%	0.774	S	S	*	*			trans	96.9	134.4	-169.5	0	0	0	0	0	111.9
106	E	31.5	Very low	38.1	Very low	196 Å²	196	143.1 Å²	143.1	92%	0.916	78%	0.784	S	S	*	*			cis	-164.7	159	-22.7	-130.1	159.2	117.6	0	0	108.3
107	A	39.4	Very low	38.9	Very low	98 Å²	98	138.1 Å²	138.1	81%	0.81	78%	0.78	S	S	*	*			trans	-140.2	128.4	177.9	0	0	0	0	0	111.3
108	P	46.7	Very low	39	Very low	131 Å²	131	139.6 Å²	139.6	85%	0.851	78%	0.778	S	S	*	*			trans	-115.5	172	170	37.9	-28.9	0	0	0	114.4
109	H	34.5	Very low	38.8	Very low	164 Å²	164	132.2 Å²	132.2	76%	0.759	77%	0.771	S	S	*	*			trans	-143.9	-179.8	-172.8	-143.1	17.3	0	0	0	108.4
110	V	42.3	Very low	38.1	Very low	116 Å²	116	134.9 Å²	134.9	70%	0.703	78%	0.778	S	S	*	*			cis	-123.4	-129.1	26.2	-145.2	0	0	0	0	111
111	P	55.5	Low	37.3	Very low	103 Å²	103	140.1 Å²	140.1	67%	0.669	78%	0.783	S	S	*	*			trans	-128.9	-164.6	-171.1	37.3	-13.3	0	0	0	115.2
112	N	37.7	Very low	37.4	Very low	123 Å²	123	142.9 Å²	142.9	66%	0.658	78%	0.784	S	S	*	*				128.1	154.1	119.1	-144.1	-5.9	0	0	0	118.2
113	R	33.9	Very low	38.2	Very low	193 Å²	193	140.5 Å²	140.5	73%	0.728	78%	0.779	S	S	*	*			trans	69.5	148.1	161.4	-67.1	169.3	-170.9	-162	-0.9	116.6
114	H	35.1	Very low	37.6	Very low	164 Å²	164	142.4 Å²	142.4	76%	0.759	79%	0.788	S	S	*	*			cis	-158.7	168.8	-2.2	-105	-39.3	0	0	0	107.4
115	A	31.3	Very low	37.4	Very low	85 Å²	85	134 Å²	134	70%	0.702	78%	0.778	S	S	*	*			cis	-163.9	-179.3	-10.4	0	0	0	0	0	109.7
116	H	34.9	Very low	37.3	Very low	182 Å²	182	134.7 Å²	134.7	84%	0.843	79%	0.785	S	S	*	*			trans	-87	153.2	163.2	-82.8	-82.2	0	0	0	111
117	P	49.5	Very low	37.4	Very low	120 Å²	120	136.6 Å²	136.6	78%	0.779	78%	0.784	S	S	*	*				-143.9	-173.3	85.7	23.1	1.1	0	0	0	113.2
118	T	33.9	Very low	37.2	Very low	138 Å²	138	143.7 Å²	143.7	85%	0.847	79%	0.79	S	S	*	*			cis	-172.6	147.2	-35.2	-82.3	0	0	0	0	108.3
119	G	29.5	Very low	36.3	Very low	66 Å²	66	141.2 Å²	141.2	68%	0.68	79%	0.789	S	S	*	*			trans	102.4	156.3	162.7	0	0	0	0	0	116.2
120	L	32.3	Very low	36.4	Very low	174 Å²	174	141.4 Å²	141.4	91%	0.911	79%	0.794	S	S	*	*			cis	-154.8	175.3	-11.4	-119.6	170.5	0	0	0	110
121	R	28.3	Very low	35.8	Very low	226 Å²	226	147.7 Å²	147.7	85%	0.853	81%	0.805	S	S	*	*			trans	-76.8	166.3	177.8	-67.3	171.5	155.8	-158.6	-4.8	110.7
122	T	35.5	Very low	34.5	Very low	135 Å²	135	147.1 Å²	147.1	83%	0.828	81%	0.809	S	S	*	*				-164.2	175.1	53.9	27.8	0	0	0	0	113.4
123	P	57.7	Low	34.7	Very low	114 Å²	114	145.9 Å²	145.9	74%	0.74	82%	0.816	S	S	*	*			trans	-112.1	157.4	-168.1	40.1	-32.3	0	0	0	117.4
124	T	33.1	Very low	34.5	Very low	155 Å²	155	141.3 Å²	141.3	95%	0.951	82%	0.819	S	S	*	*			trans	-179.9	162.6	155	15.7	0	0	0	0	107.1
125	G	29.9	Very low	34.6	Very low	69 Å²	69	139.5 Å²	139.5	71%	0.711	82%	0.824	S	S	*	*			cis	171.2	153	-4.3	0	0	0	0	0	110.2
126	G	30.6	Very low	34.6	Very low	77 Å²	77	138.7 Å²	138.7	79%	0.794	82%	0.823	S	S	*	*			trans	80.6	135.1	179.5	0	0	0	0	0	114.4
127	R	33.3	Very low	34.6	Very low	236 Å²	236	133.3 Å²	133.3	89%	0.891	82%	0.818	S	S	*	*			cis	81.7	102.6	42.7	-73.5	-166.8	171	-161.5	0.3	115.7
128	R	34.9	Very low	34.1	Very low	246 Å²	246	136.3 Å²	136.3	93%	0.928	83%	0.826	S	S	*	*			trans	51.1	107.8	145.1	-56.6	-175.7	-176.1	-160.2	0.9	118.4
129	G	29.7	Very low	34.7	Very low	80 Å²	80	141.7 Å²	141.7	83%	0.825	83%	0.831	S	S	*	*			trans	-144.8	143.8	160.5	0	0	0	0	0	110.8
130	L	35.9	Very low	35.1	Very low	167 Å²	167	141 Å²	141	87%	0.874	82%	0.823	S	S	*	*			trans	-104.2	165	178.1	-77.4	165.8	0	0	0	111
131	R	29.7	Very low	35.9	Very low	249 Å²	249	140.5 Å²	140.5	94%	0.94	82%	0.822	S	S	*	*			trans	75.6	156.4	178.4	-47	171.6	-177	-104.7	-0	112.9
132	A	28.4	Very low	36.9	Very low	90 Å²	90	134.1 Å²	134.1	74%	0.744	81%	0.805	S	S	*	*			cis	-130.9	163.2	1.8	0	0	0	0	0	111.9	A134	A132-A134 PolarHBondContact O-N 3.25Å; A132-A134 VanDerWaalsContact O-N 3.07Å
133	A	40.5	Very low	37.8	Very low	98 Å²	98	132.8 Å²	132.8	81%	0.81	80%	0.798	S	S	*	*			trans	-72.8	96.4	170	0	0	0	0	0	110	C135	A133-C135 PolarHBondContact O-N 3.26Å
134	A	30.4	Very low	37.6	Very low	96 Å²	96	135.3 Å²	135.3	79%	0.793	80%	0.8	S	S	*	*			trans	-77.2	104.9	173.7	0	0	0	0	0	110.1	A132 G136	A132-A134 PolarHBondContact O-N 3.25Å; A132-A134 VanDerWaalsContact O-N 3.07Å; A134-G136 PolarHBondContact O-N 3.03Å
135	C	36.7	Very low	38.4	Very low	127 Å²	127	131.4 Å²	131.4	86%	0.858	78%	0.779	S	S	*	*			trans	-70.8	74.5	169.3	-68.1	0	0	0	0	110.6	A133 G137	A133-C135 PolarHBondContact O-N 3.26Å; C135-G137 PolarHBondContact O-N 3.47Å
136	G	32.7	Very low	39.6	Very low	67 Å²	67	133.9 Å²	133.9	69%	0.691	78%	0.775	S	S	*	*			trans	-62.2	112.7	174.6	0	0	0	0	0	110.8	A134	A134-G136 PolarHBondContact O-N 3.03Å
137	G	33.4	Very low	40.9	Very low	70 Å²	70	135.3 Å²	135.3	72%	0.722	76%	0.764	S	S	*	*			trans	-65	135.2	-169.7	0	0	0	0	0	114	C135 R139	C135-G137 PolarHBondContact O-N 3.47Å; G137-R139 PolarHBondContact O-N 3.46Å
138	L	39.8	Very low	41.9	Very low	182 Å²	182	126.5 Å²	126.5	95%	0.953	74%	0.742	S	S	*	*			trans	-69.6	99.4	171	-66.8	171.7	0	0	0	110.3
139	R	46.4	Very low	42.9	Very low	251 Å²	251	117.6 Å²	117.6	95%	0.947	72%	0.721	S	S	*	*			trans	-122	116.9	160.4	-74.2	-168.5	175.8	-145	0.6	108.9	G137	G137-R139 PolarHBondContact O-N 3.46Å
140	G	38.3	Very low	44.2	Very low	51 Å²	51	119.3 Å²	119.3	53%	0.526	71%	0.707	S	S	.	*			trans	143.6	88.9	-174.9	0	0	0	0	0	110.6	D142	G140-D142 PolarHBondContact O-N 3.22Å
141	N	48.8	Very low	45.1	Very low	165 Å²	165	119 Å²	119	88%	0.882	69%	0.694	S	S	*	*			trans	-80.5	47.4	176.7	-90.4	-24.1	0	0	0	111.3	P143	N141-P143 WeakPolarHBondContact O-CD 3.33Å
142	D	48.3	Very low	46.3	Very low	92 Å²	92	115.8 Å²	115.8	49%	0.492	68%	0.682	S	S	.	*			trans	-91.3	112.8	-176.2	-71.2	-77	0	0	0	110.8	G140 Q144 S145 L146	G140-D142 PolarHBondContact O-N 3.22Å; D142-Q144 PolarHBondContact O-N 3.48Å; D142-S145 WeakPolarHBondContact CB-OG 3.44Å; D142-S145 WeakPolarHBondContact O-CB 3.35Å; D142-S145 PolarHBondContact O-N 3.05Å; D142-L146 PolarHBondContact O-N 2.99Å
143	P	54.7	Low	47.5	Very low	106 Å²	106	114.4 Å²	114.4	69%	0.688	67%	0.671	S	S	*	*	H	α-helix	trans	-65.1	-24.8	-175	24.5	-33.5	0	0	0	113	N141 L147	N141-P143 WeakPolarHBondContact O-CD 3.33Å; P143-L147 PolarHBondContact O-N 3.09Å
144	Q	53.4	Low	48.1	Very low	168 Å²	168	115.2 Å²	115.2	79%	0.785	66%	0.661	S	S	*	*	H	α-helix	trans	-69.3	-38.5	172.5	-67.6	-168.3	-0.4	0	0	112.4	D142 L147 A148	D142-Q144 PolarHBondContact O-N 3.48Å; Q144-L147 PolarHBondContact O-N 3.26Å; Q144-A148 WeakPolarHBondContact O-CB 3.49Å; Q144-A148 PolarHBondContact O-N 3.26Å
145	S	50.8	Low	49.2	Very low	72 Å²	72	117.3 Å²	117.3	50%	0.503	65%	0.654	S	S	.	*	H	α-helix	trans	-65.6	-41.7	-179.3	-59.9	0	0	0	0	111.7	D142 A148 A149	D142-S145 WeakPolarHBondContact CB-OG 3.44Å; D142-S145 WeakPolarHBondContact O-CB 3.35Å; D142-S145 PolarHBondContact O-N 3.05Å; S145-A148 PolarHBondContact O-N 2.93Å; S145-A149 WeakPolarHBondContact O-CB 3.45Å; S145-A149 PolarHBondContact O-N 3.43Å
146	L	55.7	Low	49.4	Very low	121 Å²	121	122.1 Å²	122.1	63%	0.634	65%	0.654	S	S	*	*	H	α-helix	trans	-62.7	-42.8	172.7	-76.7	165.3	0	0	0	112.2	D142 A149 H150	D142-L146 PolarHBondContact O-N 2.99Å; L146-A149 PolarHBondContact O-N 3.49Å; L146-H150 WeakPolarHBondContact O-CB 3.45Å; L146-H150 PolarHBondContact O-N 2.87Å
147	L	56.6	Low	49.8	Very low	108 Å²	108	122.5 Å²	122.5	57%	0.565	65%	0.651	S	S	*	*	H	α-helix	trans	-66.2	-37.9	177.6	-168.2	68.7	0	0	0	112.1	P143 Q144 R151	P143-L147 PolarHBondContact O-N 3.09Å; Q144-L147 PolarHBondContact O-N 3.26Å; L147-R151 WeakPolarHBondContact O-CB 3.24Å; L147-R151 WeakPolarHBondContact O-CG 3.48Å; L147-R151 PolarHBondContact O-N 3.05Å
148	A	54.6	Low	50.4	Low	50 Å²	50	124.9 Å²	124.9	41%	0.413	65%	0.651	S	S	.	*	H	α-helix	trans	-66.8	-42.3	174.8	0	0	0	0	0	112.2	Q144 S145 R151 R152	Q144-A148 WeakPolarHBondContact O-CB 3.49Å; Q144-A148 PolarHBondContact O-N 3.26Å; S145-A148 PolarHBondContact O-N 2.93Å; A148-R151 PolarHBondContact O-N 3.29Å; A148-R152 WeakPolarHBondContact O-CG 3.4Å; A148-R152 PolarHBondContact O-N 2.85Å
149	A	56.4	Low	50.5	Low	60 Å²	60	122 Å²	122	50%	0.496	64%	0.644	S	S	.	*	H	α-helix	trans	-62.2	-45.6	174.3	0	0	0	0	0	111.7	S145 L146 R151 R152 A153	S145-A149 WeakPolarHBondContact O-CB 3.45Å; S145-A149 PolarHBondContact O-N 3.43Å; L146-A149 PolarHBondContact O-N 3.49Å; A149-R151 PolarHBondContact O-N 3.25Å; A149-R152 PolarHBondContact O-N 2.93Å; A149-A153 PolarHBondContact O-N 3.16Å
150	H	56.4	Low	50.2	Low	115 Å²	115	113.6 Å²	113.6	53%	0.532	63%	0.634	S	S	.	*	H	α-helix	trans	-63.3	-41.8	178.1	-169.4	67.6	0	0	0	112.2	L146 R152 A153 L154	L146-H150 WeakPolarHBondContact O-CB 3.45Å; L146-H150 PolarHBondContact O-N 2.87Å; H150-R152 PolarHBondContact O-N 2.76Å; H150-A153 PolarHBondContact O-N 3.14Å; H150-L154 WeakPolarHBondContact O-CG 3.48Å; H150-L154 PolarHBondContact O-N 3.36Å
151	R	55.5	Low	49.9	Very low	160 Å²	160	120.2 Å²	120.2	60%	0.604	65%	0.651	S	S	*	*	H	α-helix	trans	-62.2	-39.6	173.5	-74.3	179.6	68.9	151.3	1.3	112.6	L147 A148 A149 L154 Q155	L147-R151 WeakPolarHBondContact O-CB 3.24Å; L147-R151 WeakPolarHBondContact O-CG 3.48Å; L147-R151 PolarHBondContact O-N 3.05Å; A148-R151 PolarHBondContact O-N 3.29Å; A149-R151 PolarHBondContact O-N 3.25Å; R151-L154 PolarHBondContact O-N 3.23Å; R151-Q155 VanDerWaalsContact O-CG 3.28Å; R151-Q155 WeakPolarHBondContact O-CG 3.28Å; R151-Q155 PolarHBondContact O-N 3.41Å; R151-Q155 VanDerWaalsContact O-N 3.13Å
152	R	54.6	Low	49.4	Very low	183 Å²	183	121.3 Å²	121.3	69%	0.691	65%	0.651	S	S	*	*	H	α-helix	trans	-68.7	-32.3	175.4	-75.6	178.3	173.4	-177.8	-0.9	113.2	A148 A149 H150 Q155 R156	A148-R152 WeakPolarHBondContact O-CG 3.4Å; A148-R152 PolarHBondContact O-N 2.85Å; A149-R152 PolarHBondContact O-N 2.93Å; H150-R152 PolarHBondContact O-N 2.76Å; R152-Q155 PolarHBondContact O-N 2.82Å; R152-R156 PolarHBondContact O-N 3.18Å
153	A	53.5	Low	49	Very low	61 Å²	61	121 Å²	121	50%	0.504	67%	0.669	S	S	.	*	H	α-helix	trans	-66.1	-48.2	173.2	0	0	0	0	0	111.4	A149 H150 Q155 R156	A149-A153 PolarHBondContact O-N 3.16Å; H150-A153 PolarHBondContact O-N 3.14Å; A153-Q155 PolarHBondContact O-N 3.05Å; A153-R156 PolarHBondContact O-N 2.93Å; A153-R156 VanDerWaalsContact O-N 3.09Å
154	L	54.1	Low	47.9	Very low	114 Å²	114	120.6 Å²	120.6	60%	0.597	68%	0.675	S	S	*	*	H	α-helix	trans	-60.9	-29.6	176.4	-68.4	169.6	0	0	0	113	H150 R151	H150-L154 WeakPolarHBondContact O-CG 3.48Å; H150-L154 PolarHBondContact O-N 3.36Å; R151-L154 PolarHBondContact O-N 3.23Å
155	Q	52.1	Low	47.1	Very low	141 Å²	141	119.5 Å²	119.5	66%	0.659	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-11.2	177	-75	172.1	-26.9	0	0	114.8	R151 R152 A153	R151-Q155 VanDerWaalsContact O-CG 3.28Å; R151-Q155 WeakPolarHBondContact O-CG 3.28Å; R151-Q155 PolarHBondContact O-N 3.41Å; R151-Q155 VanDerWaalsContact O-N 3.13Å; R152-Q155 PolarHBondContact O-N 2.82Å; A153-Q155 PolarHBondContact O-N 3.05Å
156	R	42.2	Very low	46.5	Very low	228 Å²	228	120.2 Å²	120.2	86%	0.86	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	-6.1	177.9	-76.8	-176.3	168.4	-176.5	-4.5	114	R152 A153 V158	R152-R156 PolarHBondContact O-N 3.18Å; A153-R156 PolarHBondContact O-N 2.93Å; A153-R156 VanDerWaalsContact O-N 3.09Å; R156-V158 PolarHBondContact O-N 2.82Å
157	A	40.8	Very low	45.7	Very low	74 Å²	74	122.1 Å²	122.1	61%	0.612	68%	0.678	S	S	*	*			trans	-89.4	63.4	-179.3	0	0	0	0	0	112.3
158	V	45.8	Very low	44.8	Very low	121 Å²	121	121 Å²	121	73%	0.733	68%	0.68	S	S	*	*			trans	-132.3	91.9	172.5	-175.2	0	0	0	0	110.7	R156	R156-V158 PolarHBondContact O-N 2.82Å
159	P	41.9	Very low	44	Very low	122 Å²	122	129.7 Å²	129.7	79%	0.792	70%	0.701	S	S	*	*			trans	-76.5	129.2	147.3	32.3	-28.1	0	0	0	108.3
160	G	38.9	Very low	43.1	Very low	73 Å²	73	129.4 Å²	129.4	75%	0.753	70%	0.699	S	S	*	*			trans	-71.3	140.6	173.8	0	0	0	0	0	111.3
161	H	33.3	Very low	42.2	Very low	190 Å²	190	130.4 Å²	130.4	88%	0.88	70%	0.704	S	S	*	*			trans	-137.5	118.2	159.6	-147.7	-64.5	0	0	0	107.6
162	E	38.9	Very low	41.3	Very low	189 Å²	189	133 Å²	133	88%	0.883	71%	0.714	S	S	*	*			trans	-80.2	161.4	-177.2	-61.1	-176	105.7	0	0	111.4
163	G	39	Very low	40.4	Very low	84 Å²	84	126.3 Å²	126.3	87%	0.866	70%	0.698	S	S	*	*			trans	82.4	61.6	161	0	0	0	0	0	117.7
164	A	31.5	Very low	39.6	Very low	98 Å²	98	127.1 Å²	127.1	81%	0.81	69%	0.691	S	S	*	*			trans	-145.4	106.9	161	0	0	0	0	0	111.9
165	E	36.4	Very low	38.7	Very low	146 Å²	146	126.8 Å²	126.8	68%	0.682	69%	0.686	S	S	*	*			trans	-60.8	134.4	-179.2	-104.7	-68.3	105.9	0	0	112.4	H167	E165-H167 VanDerWaalsContact C-N 3.32Å; E165-H167 PolarHBondContact O-N 3.04Å
166	P	37.6	Very low	38.2	Very low	87 Å²	87	122.6 Å²	122.6	57%	0.565	67%	0.672	S	S	*	*			trans	-82.6	75.4	-175.6	35.2	-34.3	0	0	0	110.5	S168	P166-S168 WeakPolarHBondContact O-CA 3.43Å; P166-S168 VanDerWaalsContact O-CB 3.24Å; P166-S168 WeakPolarHBondContact O-CB 3.38Å; P166-S168 PolarHBondContact O-N 3.24Å; P166-S168 PolarHBondContact O-OG 3.13Å
167	H	40.2	Very low	37.9	Very low	161 Å²	161	118.9 Å²	118.9	75%	0.745	66%	0.658	S	S	*	*			trans	-62.6	73.8	174.5	-68.8	-59.7	0	0	0	112.5	E165	E165-H167 VanDerWaalsContact C-N 3.32Å; E165-H167 PolarHBondContact O-N 3.04Å
168	S	38.2	Very low	37.9	Very low	85 Å²	85	121 Å²	121	59%	0.594	66%	0.655	S	S	*	*			trans	-98	116	-155.6	-69.7	0	0	0	0	112.4	P166 A170	P166-S168 WeakPolarHBondContact O-CA 3.43Å; P166-S168 VanDerWaalsContact O-CB 3.24Å; P166-S168 WeakPolarHBondContact O-CB 3.38Å; P166-S168 PolarHBondContact O-N 3.24Å; P166-S168 PolarHBondContact O-OG 3.13Å; S168-A170 PolarHBondContact O-N 3.19Å
169	R	37	Very low	37.5	Very low	231 Å²	231	120.4 Å²	120.4	87%	0.872	65%	0.648	S	S	*	*	S	Bend	trans	68.6	-35.1	155.5	-156.2	174.5	-174.6	169.7	-0.3	116.6	A173	R169-A173 PolarHBondContact O-N 3.49Å
170	A	37	Very low	37.6	Very low	55 Å²	55	118.8 Å²	118.8	46%	0.455	63%	0.632	S	S	.	*	H	α-helix	trans	-62.8	-53.4	177.4	0	0	0	0	0	111.9	S168 R172 A173 E174	S168-A170 PolarHBondContact O-N 3.19Å; A170-R172 PolarHBondContact O-N 3.01Å; A170-A173 CarbonylContact O-C 3.52Å; A170-A173 WeakPolarHBondContact O-CA 3.35Å; A170-A173 WeakPolarHBondContact O-CB 3.41Å; A170-A173 PolarHBondContact O-N 3.35Å; A170-E174 PolarHBondContact O-N 2.85Å
171	H	37.6	Very low	37.6	Very low	135 Å²	135	125.5 Å²	125.5	63%	0.625	64%	0.635	S	S	*	*	H	α-helix	trans	-52.9	-33	179.5	-121.5	-88.9	0	0	0	114	H175	H171-H175 PolarHBondContact O-CD2 3.47Å; H171-H175 PolarHBondContact O-N 3Å; H171-H175 VanDerWaalsContact O-N 3.14Å
172	R	36.8	Very low	37.9	Very low	216 Å²	216	120.8 Å²	120.8	82%	0.815	63%	0.629	S	S	*	*	H	α-helix	trans	-76.6	-28	175.7	-172.4	174.5	-71.1	167.1	-0.2	112.9	A170 S176	A170-R172 PolarHBondContact O-N 3.01Å; R172-S176 PolarHBondContact O-N 3.02Å
173	A	36.8	Very low	38.1	Very low	42 Å²	42	114.9 Å²	114.9	35%	0.347	61%	0.612	S	S	.	*	H	α-helix	trans	-77.1	-37.6	170.7	0	0	0	0	0	111.8	R169 A170 S176 R177	R169-A173 PolarHBondContact O-N 3.49Å; A170-A173 CarbonylContact O-C 3.52Å; A170-A173 WeakPolarHBondContact O-CA 3.35Å; A170-A173 WeakPolarHBondContact O-CB 3.41Å; A170-A173 PolarHBondContact O-N 3.35Å; A173-S176 PolarHBondContact O-N 3.18Å; A173-R177 WeakPolarHBondContact O-CB 3.48Å; A173-R177 WeakPolarHBondContact O-CD 3.46Å; A173-R177 VanDerWaalsContact O-CG 3.27Å; A173-R177 WeakPolarHBondContact O-CG 3.27Å; A173-R177 PolarHBondContact O-N 3.41Å
174	E	35.4	Very low	37.8	Very low	78 Å²	78	113.6 Å²	113.6	36%	0.364	60%	0.6	S	S	.	*	H	α-helix	trans	-61.3	-49.9	174.6	-103.4	54.6	-100.2	0	0	112.2	A170 S176 R177 Q178	A170-E174 PolarHBondContact O-N 2.85Å; E174-S176 VanDerWaalsContact C-N 3.34Å; E174-S176 PolarHBondContact O-N 3.11Å; E174-R177 CarbonylContact O-C 3.57Å; E174-R177 WeakPolarHBondContact O-CA 3.28Å; E174-R177 WeakPolarHBondContact O-CB 3.42Å; E174-R177 PolarHBondContact O-N 3.33Å; E174-R177 WeakPolarHBondContact OE1-CD 3.35Å; E174-R177 IonicContact OE1-CZ 3.84Å; E174-R177 IonicContact OE1-NE 2.93Å; E174-R177 IonicContact OE1-NH1 3.96Å; E174-R177 PolarHBondContact OE1-NH1 2.8Å; E174-Q178 PolarHBondContact O-N 2.96Å
175	H	34.6	Very low	38.5	Very low	107 Å²	107	113.9 Å²	113.9	50%	0.495	59%	0.586	S	S	.	*	H	α-helix	trans	-55.5	-48.6	173	-94.1	-80.1	0	0	0	111.8	H171 R177 Q178 D179	H171-H175 PolarHBondContact O-CD2 3.47Å; H171-H175 PolarHBondContact O-N 3Å; H171-H175 VanDerWaalsContact O-N 3.14Å; H175-R177 PolarHBondContact O-N 3.31Å; H175-R177 VanDerWaalsContact O-N 3.11Å; H175-Q178 PolarHBondContact O-N 3.23Å; H175-Q178 VanDerWaalsContact O-N 3.07Å; H175-D179 PolarHBondContact O-N 3.06Å
176	S	41.4	Very low	38.8	Very low	52 Å²	52	118.6 Å²	118.6	36%	0.364	60%	0.598	S	S	.	*	H	α-helix	trans	-64.5	-17	177.8	-172.9	0	0	0	0	113.7	R172 A173 E174 L180	R172-S176 PolarHBondContact O-N 3.02Å; A173-S176 PolarHBondContact O-N 3.18Å; E174-S176 VanDerWaalsContact C-N 3.34Å; E174-S176 PolarHBondContact O-N 3.11Å; S176-L180 VanDerWaalsContact O-CD1 3.31Å; S176-L180 WeakPolarHBondContact O-CD1 3.49Å; S176-L180 VanDerWaalsContact O-CG 3.27Å; S176-L180 WeakPolarHBondContact O-CG 3.27Å
177	R	36.6	Very low	38.8	Very low	150 Å²	150	117.9 Å²	117.9	57%	0.566	61%	0.606	S	S	*	*	H	α-helix	trans	-88.2	-35	172.2	-76.3	163.8	162.6	174.5	-5.5	112.1	A173 E174 H175 L180 R181	A173-R177 WeakPolarHBondContact O-CB 3.48Å; A173-R177 WeakPolarHBondContact O-CD 3.46Å; A173-R177 VanDerWaalsContact O-CG 3.27Å; A173-R177 WeakPolarHBondContact O-CG 3.27Å; A173-R177 PolarHBondContact O-N 3.41Å; E174-R177 CarbonylContact O-C 3.57Å; E174-R177 WeakPolarHBondContact O-CA 3.28Å; E174-R177 WeakPolarHBondContact O-CB 3.42Å; E174-R177 PolarHBondContact O-N 3.33Å; E174-R177 WeakPolarHBondContact OE1-CD 3.35Å; E174-R177 IonicContact OE1-CZ 3.84Å; E174-R177 IonicContact OE1-NE 2.93Å; E174-R177 IonicContact OE1-NH1 3.96Å; E174-R177 PolarHBondContact OE1-NH1 2.8Å; H175-R177 PolarHBondContact O-N 3.31Å; H175-R177 VanDerWaalsContact O-N 3.11Å; R177-L180 PolarHBondContact O-N 3.05Å; R177-R181 WeakPolarHBondContact O-CG 3.31Å; R177-R181 PolarHBondContact O-N 3.06Å; R177-R181 VanDerWaalsContact O-N 3.13Å
178	Q	40.9	Very low	38.6	Very low	119 Å²	119	112 Å²	112	56%	0.556	59%	0.589	S	S	*	*	H	α-helix	trans	-64.6	-45.8	172.4	-73.5	172.4	-41.5	0	0	110.7	E174 H175 L180 R181 A182	E174-Q178 PolarHBondContact O-N 2.96Å; H175-Q178 PolarHBondContact O-N 3.23Å; H175-Q178 VanDerWaalsContact O-N 3.07Å; Q178-L180 VanDerWaalsContact C-N 3.29Å; Q178-L180 PolarHBondContact O-N 3.4Å; Q178-R181 PolarHBondContact O-N 2.98Å; Q178-R181 VanDerWaalsContact O-N 3.08Å; Q178-A182 PolarHBondContact O-N 2.97Å
179	D	38.6	Very low	38.8	Very low	108 Å²	108	112.3 Å²	112.3	58%	0.578	59%	0.589	S	S	*	*	H	α-helix	trans	-55.2	-42.4	174.7	-68.5	-26.9	0	0	0	112.4	H175 A182 A183	H175-D179 PolarHBondContact O-N 3.06Å; D179-A182 PolarHBondContact O-N 3.4Å; D179-A183 WeakPolarHBondContact O-CB 3.49Å; D179-A183 PolarHBondContact O-N 3.14Å
180	L	43.6	Very low	38.7	Very low	89 Å²	89	103.4 Å²	103.4	47%	0.466	57%	0.569	S	S	.	*	H	α-helix	trans	-70.3	-30.9	179	-74	171.6	0	0	0	113.1	S176 R177 Q178 I185	S176-L180 VanDerWaalsContact O-CD1 3.31Å; S176-L180 WeakPolarHBondContact O-CD1 3.49Å; S176-L180 VanDerWaalsContact O-CG 3.27Å; S176-L180 WeakPolarHBondContact O-CG 3.27Å; R177-L180 PolarHBondContact O-N 3.05Å; Q178-L180 VanDerWaalsContact C-N 3.29Å; Q178-L180 PolarHBondContact O-N 3.4Å; L180-I185 PolarHBondContact O-N 3.22Å
181	R	39.3	Very low	39.1	Very low	213 Å²	213	104.3 Å²	104.3	80%	0.804	57%	0.566	S	S	*	*	H	α-helix	trans	-72.5	-42.9	172.3	-71.3	178.4	-171	-112	7.3	111.2	R177 Q178 A183 G184	R177-R181 WeakPolarHBondContact O-CG 3.31Å; R177-R181 PolarHBondContact O-N 3.06Å; R177-R181 VanDerWaalsContact O-N 3.13Å; Q178-R181 PolarHBondContact O-N 2.98Å; Q178-R181 VanDerWaalsContact O-N 3.08Å; R181-A183 PolarHBondContact O-N 3.35Å; R181-G184 PolarHBondContact O-N 2.87Å
182	A	39.6	Very low	39.4	Very low	92 Å²	92	105 Å²	105	76%	0.76	57%	0.569	S	S	*	*	H	α-helix	trans	-61	-32.9	175.4	0	0	0	0	0	112.5	Q178 D179 G184	Q178-A182 PolarHBondContact O-N 2.97Å; D179-A182 PolarHBondContact O-N 3.4Å; A182-G184 VanDerWaalsContact C-N 3.28Å; A182-G184 PolarHBondContact O-N 3.1Å
183	A	42.2	Very low	39.3	Very low	64 Å²	64	103.8 Å²	103.8	53%	0.529	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.7	-2.7	173.3	0	0	0	0	0	114.8	D179 R181 I185	D179-A183 WeakPolarHBondContact O-CB 3.49Å; D179-A183 PolarHBondContact O-N 3.14Å; R181-A183 PolarHBondContact O-N 3.35Å; A183-I185 HydrophobicContact CB-CG1 4.26Å; A183-I185 WeakPolarHBondContact O-CG1 3.38Å; A183-I185 PolarHBondContact O-N 3.07Å; A183-I185 VanDerWaalsContact O-N 3.14Å
184	G	32.8	Very low	39.3	Very low	58 Å²	58	111 Å²	111	60%	0.598	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.5	3.7	178.2	0	0	0	0	0	116.2	R181 A182 R186	R181-G184 PolarHBondContact O-N 2.87Å; A182-G184 VanDerWaalsContact C-N 3.28Å; A182-G184 PolarHBondContact O-N 3.1Å; G184-R186 PolarHBondContact O-N 3.47Å; G184-R186 VanDerWaalsContact O-N 3.08Å
185	I	45.8	Very low	39.2	Very low	103 Å²	103	108 Å²	108	53%	0.528	57%	0.572	S	S	.	*			trans	-82.3	94.2	-170.9	-53.9	-172.3	0	0	0	111	L180 A183 G187	L180-I185 PolarHBondContact O-N 3.22Å; A183-I185 HydrophobicContact CB-CG1 4.26Å; A183-I185 WeakPolarHBondContact O-CG1 3.38Å; A183-I185 PolarHBondContact O-N 3.07Å; A183-I185 VanDerWaalsContact O-N 3.14Å; I185-G187 PolarHBondContact O-N 3.41Å
186	R	42.9	Very low	39.3	Very low	246 Å²	246	105.8 Å²	105.8	93%	0.928	57%	0.572	S	S	*	*			trans	-65.2	103.3	167.1	-64.4	-170.5	-175.6	-160.5	2.8	110	G184 G188	G184-R186 PolarHBondContact O-N 3.47Å; G184-R186 VanDerWaalsContact O-N 3.08Å; R186-G188 PolarHBondContact O-N 3.01Å
187	G	37.5	Very low	39	Very low	72 Å²	72	106.2 Å²	106.2	74%	0.742	58%	0.578	S	S	*	*			trans	-71.8	84.9	-176.7	0	0	0	0	0	114.1	I185	I185-G187 PolarHBondContact O-N 3.41Å
188	G	35.8	Very low	39.3	Very low	38 Å²	38	101 Å²	101	39%	0.392	56%	0.563	S	S	.	*			trans	-92.4	162.8	174.5	0	0	0	0	0	114.8	R186 G190 L191	R186-G188 PolarHBondContact O-N 3.01Å; G188-G190 PolarHBondContact O-N 3.22Å; G188-L191 PolarHBondContact O-N 2.94Å
189	P	41.7	Very low	39.2	Very low	91 Å²	91	97.2 Å²	97.2	59%	0.591	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-3.7	-176.8	25.9	-35.2	0	0	0	115.4	L191	P189-L191 VanDerWaalsContact C-N 3.27Å
190	G	36.5	Very low	39.2	Very low	43 Å²	43	102.2 Å²	102.2	44%	0.443	56%	0.557	S	S	.	*	H	α-helix	trans	-67.2	-25.3	167.1	0	0	0	0	0	113.6	G188 R193 R194	G188-G190 PolarHBondContact O-N 3.22Å; G190-R193 PolarHBondContact O-N 3.47Å; G190-R194 PolarHBondContact O-N 3.31Å; G190-R194 VanDerWaalsContact O-N 3.13Å
191	L	44.2	Very low	39	Very low	75 Å²	75	101.8 Å²	101.8	39%	0.393	57%	0.567	S	S	.	*	H	α-helix	trans	-67.2	-39.7	-176.6	-154.8	76.5	0	0	0	112.2	I50 G188 P189 R194 A195	I50-L191 HydrophobicContact CG1-CD2 4.39Å; I50-L191 HydrophobicContact CG2-CD2 4.05Å; I50-L191 HydrophobicContact CG2-CG 4.4Å; G188-L191 PolarHBondContact O-N 2.94Å; P189-L191 VanDerWaalsContact C-N 3.27Å; L191-R194 PolarHBondContact O-N 3.13Å; L191-A195 PolarHBondContact O-N 3.39Å
192	Q	43.2	Very low	39	Very low	149 Å²	149	96.9 Å²	96.9	70%	0.696	56%	0.556	S	S	*	*	H	α-helix	trans	-66.8	-40	178.3	-69	168.1	-15.2	0	0	111.9	R194 A195 A196	Q192-R194 VanDerWaalsContact C-N 3.33Å; Q192-R194 PolarHBondContact O-N 3.35Å; Q192-A195 PolarHBondContact O-N 3.44Å; Q192-A196 PolarHBondContact O-N 3.37Å
193	R	35.6	Very low	39.2	Very low	190 Å²	190	97.2 Å²	97.2	72%	0.717	55%	0.548	S	S	*	.	H	α-helix	trans	-63.9	-39	174.6	-57.9	-173.9	-138.7	-142.4	6.7	111.5	G190 A196 A197	G190-R193 PolarHBondContact O-N 3.47Å; R193-A196 PolarHBondContact O-N 3.49Å; R193-A197 PolarHBondContact O-N 2.72Å
194	R	36	Very low	38.6	Very low	194 Å²	194	97 Å²	97	73%	0.732	55%	0.553	S	S	*	*	H	α-helix	trans	-65.3	-38.1	172.4	-81.1	-179.5	151.7	-172.9	-6.5	112.9	G190 L191 Q192 A197 V198	G190-R194 PolarHBondContact O-N 3.31Å; G190-R194 VanDerWaalsContact O-N 3.13Å; L191-R194 PolarHBondContact O-N 3.13Å; Q192-R194 VanDerWaalsContact C-N 3.33Å; Q192-R194 PolarHBondContact O-N 3.35Å; R194-A197 PolarHBondContact O-N 2.91Å; R194-V198 WeakPolarHBondContact O-CG2 3.43Å; R194-V198 PolarHBondContact O-N 3.44Å; R194-V198 VanDerWaalsContact O-N 3.11Å
195	A	34	Very low	38.8	Very low	16 Å²	16	103.6 Å²	103.6	13%	0.132	57%	0.568	C	S	.	*	H	α-helix	trans	-63.2	-45.6	174.6	0	0	0	0	0	111.9	L51 L191 Q192 A197 V198 D199	L51-A195 HydrophobicContact CD2-CB 4.07Å; L191-A195 PolarHBondContact O-N 3.39Å; Q192-A195 PolarHBondContact O-N 3.44Å; A195-A197 VanDerWaalsContact C-N 3.33Å; A195-A197 PolarHBondContact O-N 3Å; A195-V198 WeakPolarHBondContact O-CB 3.45Å; A195-V198 PolarHBondContact O-N 2.96Å; A195-D199 PolarHBondContact O-N 3.04Å
196	A	36.2	Very low	38.5	Very low	60 Å²	60	102.6 Å²	102.6	50%	0.496	58%	0.584	S	S	.	*	H	α-helix	trans	-63.6	-34.7	176.4	0	0	0	0	0	113.3	Q192 R193 D199 R200	Q192-A196 PolarHBondContact O-N 3.37Å; R193-A196 PolarHBondContact O-N 3.49Å; A196-D199 PolarHBondContact O-N 3.05Å; A196-R200 PolarHBondContact O-N 3.45Å
197	A	36.5	Very low	37.8	Very low	60 Å²	60	102.6 Å²	102.6	50%	0.496	58%	0.584	S	S	.	*	H	α-helix	trans	-66	-38.1	173.5	0	0	0	0	0	112.5	R193 R194 A195 A201	R193-A197 PolarHBondContact O-N 2.72Å; R194-A197 PolarHBondContact O-N 2.91Å; A195-A197 VanDerWaalsContact C-N 3.33Å; A195-A197 PolarHBondContact O-N 3Å; A197-A201 WeakPolarHBondContact O-CB 3.34Å; A197-A201 PolarHBondContact O-N 3.14Å
198	V	42.9	Very low	38	Very low	40 Å²	40	104.5 Å²	104.5	24%	0.242	59%	0.592	C	S	.	*	H	α-helix	trans	-65.9	-42.8	174.4	166.7	0	0	0	0	111.6	R194 A195 R200 A201 L202	R194-V198 WeakPolarHBondContact O-CG2 3.43Å; R194-V198 PolarHBondContact O-N 3.44Å; R194-V198 VanDerWaalsContact O-N 3.11Å; A195-V198 WeakPolarHBondContact O-CB 3.45Å; A195-V198 PolarHBondContact O-N 2.96Å; V198-R200 VanDerWaalsContact C-N 3.34Å; V198-A201 PolarHBondContact O-N 3.08Å; V198-L202 HydrophobicContact CG1-CD1 4.4Å; V198-L202 WeakPolarHBondContact O-CG 3.32Å; V198-L202 PolarHBondContact O-N 3.13Å
199	D	37.3	Very low	37.7	Very low	40 Å²	40	107.5 Å²	107.5	21%	0.214	61%	0.613	C	S	.	*	H	α-helix	trans	-65.7	-38	178.9	-142.1	48	0	0	0	110.8	A195 A196 L202 V203	A195-D199 PolarHBondContact O-N 3.04Å; A196-D199 PolarHBondContact O-N 3.05Å; D199-L202 PolarHBondContact O-N 3.43Å; D199-V203 WeakPolarHBondContact O-CG2 3.24Å
200	R	39.1	Very low	37.1	Very low	213 Å²	213	106.3 Å²	106.3	80%	0.804	62%	0.618	S	S	*	*	H	α-helix	trans	-62.4	-43.1	169.8	-84	-175.3	170.8	174	-2.5	113.2	A196 V198 L202 V203 G204	A196-R200 PolarHBondContact O-N 3.45Å; V198-R200 VanDerWaalsContact C-N 3.34Å; R200-L202 PolarHBondContact O-N 3.02Å; R200-V203 PolarHBondContact O-N 3.43Å; R200-G204 PolarHBondContact O-N 2.97Å
201	A	39.9	Very low	37.1	Very low	81 Å²	81	114.4 Å²	114.4	67%	0.669	64%	0.644	S	S	*	*	H	α-helix	trans	-65.3	-21.5	-179.2	0	0	0	0	0	113.5	A197 V198	A197-A201 WeakPolarHBondContact O-CB 3.34Å; A197-A201 PolarHBondContact O-N 3.14Å; V198-A201 PolarHBondContact O-N 3.08Å
202	L	39.4	Very low	36.3	Very low	109 Å²	109	114.7 Å²	114.7	57%	0.571	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-6.3	174.3	-68	169.2	0	0	0	113.9	V198 D199 R200	V198-L202 HydrophobicContact CG1-CD1 4.4Å; V198-L202 WeakPolarHBondContact O-CG 3.32Å; V198-L202 PolarHBondContact O-N 3.13Å; D199-L202 PolarHBondContact O-N 3.43Å; R200-L202 PolarHBondContact O-N 3.02Å
203	V	42.8	Very low	35.7	Very low	99 Å²	99	111.5 Å²	111.5	60%	0.6	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	-9.2	-178.8	177	0	0	0	0	112	L56 D199 R200 E205	L56-V203 HydrophobicContact CD1-CG2 4.26Å; D199-V203 WeakPolarHBondContact O-CG2 3.24Å; R200-V203 PolarHBondContact O-N 3.43Å; V203-E205 PolarHBondContact O-N 3.34Å
204	G	31	Very low	35.3	Very low	61 Å²	61	108.2 Å²	108.2	63%	0.629	67%	0.665	S	S	*	*			trans	-73.2	112.9	177.2	0	0	0	0	0	112.8	R200	R200-G204 PolarHBondContact O-N 2.97Å
205	E	36.6	Very low	34.9	Very low	195 Å²	195	108.3 Å²	108.3	91%	0.911	67%	0.671	S	S	*	*			trans	-67	156.7	166.4	-70	-175.4	107	0	0	111.7	V203	V203-E205 PolarHBondContact O-N 3.34Å
206	G	38.7	Very low	34.5	Very low	83 Å²	83	110.4 Å²	110.4	86%	0.856	69%	0.688	S	S	*	*			trans	-70.3	146.1	-170	0	0	0	0	0	114.1
207	R	29.3	Very low	34.1	Very low	246 Å²	246	115 Å²	115	93%	0.928	70%	0.703	S	S	*	*			trans	-130.3	133.6	159.5	-139.9	173.3	-171.5	175.3	1.4	108.5
208	A	40.6	Very low	33.6	Very low	111 Å²	111	120 Å²	120	92%	0.917	71%	0.713	S	S	*	*			trans	-68.9	132.2	-175.8	0	0	0	0	0	111.2
209	A	31.3	Very low	32.9	Very low	101 Å²	101	125.1 Å²	125.1	84%	0.835	74%	0.74	S	S	*	*			trans	-142.2	131.7	165.3	0	0	0	0	0	107.4
210	G	27.7	Very low	32.8	Very low	67 Å²	67	129.3 Å²	129.3	69%	0.691	75%	0.752	S	S	*	*			trans	-80.4	164.6	-170.8	0	0	0	0	0	114.5	A212	G210-A212 PolarHBondContact O-N 3.11Å
211	H	37.1	Very low	32.8	Very low	213 Å²	213	122.4 Å²	122.4	99%	0.986	73%	0.734	S	S	*	*			trans	24.4	68.8	153	-77.9	97	0	0	0	118.2
212	A	26.4	Very low	33	Very low	80 Å²	80	119.9 Å²	119.9	66%	0.661	71%	0.711	S	S	*	*			trans	-140.2	134.4	156.1	0	0	0	0	0	110	G210 T214	G210-A212 PolarHBondContact O-N 3.11Å; A212-T214 VanDerWaalsContact C-N 3.28Å; A212-T214 PolarHBondContact O-N 2.96Å; A212-T214 PolarHBondContact O-OG1 2.98Å
213	G	32.3	Very low	33.5	Very low	83 Å²	83	115.4 Å²	115.4	86%	0.856	69%	0.688	S	S	*	*			trans	-69.8	70.7	-169.8	0	0	0	0	0	114.8	K215	G213-K215 PolarHBondContact O-N 3.07Å
214	T	25.8	Very low	33.6	Very low	121 Å²	121	114.2 Å²	114.2	74%	0.742	67%	0.672	S	S	*	*			trans	-70.8	90	179.7	-55.9	0	0	0	0	110.3	A212 A216	A212-T214 VanDerWaalsContact C-N 3.28Å; A212-T214 PolarHBondContact O-N 2.96Å; A212-T214 PolarHBondContact O-OG1 2.98Å; T214-A216 HydrophobicContact CG2-CB 4.32Å; T214-A216 PolarHBondContact O-N 2.93Å
215	K	28.5	Very low	34.3	Very low	195 Å²	195	117.7 Å²	117.7	85%	0.848	67%	0.667	S	S	*	*			trans	-67.6	71.6	166.1	-73.2	-176.6	-175.7	175.3	0	109.8	G213 I217	G213-K215 PolarHBondContact O-N 3.07Å; K215-I217 PolarHBondContact O-N 3.29Å
216	A	25	Very low	34.5	Very low	61 Å²	61	113.4 Å²	113.4	50%	0.504	65%	0.654	S	S	.	*			trans	-66.7	97.2	172.9	0	0	0	0	0	108.9	T214 F218	T214-A216 HydrophobicContact CG2-CB 4.32Å; T214-A216 PolarHBondContact O-N 2.93Å; A216-F218 HydrophobicContact CB-CD2 3.94Å; A216-F218 HydrophobicContact CB-CE2 4.38Å; A216-F218 PolarHBondContact O-N 2.9Å
217	I	27.2	Very low	34.3	Very low	155 Å²	155	117.1 Å²	117.1	80%	0.795	64%	0.642	S	S	*	*			trans	-72.3	74.8	177	-54.4	-178.3	0	0	0	108.6	K215 N219	K215-I217 PolarHBondContact O-N 3.29Å; I217-N219 HydrophobicContact CG2-CB 4.37Å; I217-N219 PolarHBondContact O-N 3.46Å
218	F	26.8	Very low	34.4	Very low	165 Å²	165	112 Å²	112	72%	0.724	63%	0.633	S	S	*	*			trans	-73	63.7	174.4	-104.1	-84.8	0	0	0	110.5	A216 R220	A216-F218 HydrophobicContact CB-CD2 3.94Å; A216-F218 HydrophobicContact CB-CE2 4.38Å; A216-F218 PolarHBondContact O-N 2.9Å; F218-R220 PolarHBondContact O-N 2.88Å
219	N	28.8	Very low	34.2	Very low	148 Å²	148	116 Å²	116	79%	0.791	63%	0.632	S	S	*	*			trans	-76.1	51.3	169.7	-160.6	11.6	0	0	0	111	I217	I217-N219 HydrophobicContact CG2-CB 4.37Å; I217-N219 PolarHBondContact O-N 3.46Å
220	R	34.3	Very low	34.4	Very low	128 Å²	128	114.7 Å²	114.7	48%	0.483	63%	0.629	S	S	.	*			trans	-144.4	73.6	177.7	-73.9	-171.7	177	179.5	0.2	108.1	W43 F218 P222	W43-R220 HydrophobicContact CZ3-CB 4.42Å; F218-R220 PolarHBondContact O-N 2.88Å; R220-P222 VanDerWaalsContact O-CD 3.22Å; R220-P222 WeakPolarHBondContact O-CD 3.48Å
221	T	39.8	Very low	34.5	Very low	69 Å²	69	119 Å²	119	42%	0.423	63%	0.631	S	S	.	*			trans	-76.5	111.4	162.9	-49.6	0	0	0	0	107.4	R21	R21-T221 PolarHBondContact NH1-OG1 2.71Å
222	P	43.8	Very low	34.1	Very low	28 Å²	28	115.7 Å²	115.7	18%	0.182	63%	0.63	C	S	.	*			trans	-62.9	146	172.8	27.5	-34.4	0	0	0	109.9	W43 R220 W224	W43-P222 HydrophobicContact CH2-CB 4.15Å; W43-P222 HydrophobicContact CZ2-CB 4.49Å; W43-P222 HydrophobicContact CZ3-CB 4.32Å; R220-P222 VanDerWaalsContact O-CD 3.22Å; R220-P222 WeakPolarHBondContact O-CD 3.48Å; P222-W224 HydrophobicContact CG-CH2 4.38Å; P222-W224 HydrophobicContact CG-CZ2 3.65Å; P222-W224 PolarHBondContact O-N 3.14Å
223	L	49.9	Very low	34.3	Very low	15 Å²	15	115.4 Å²	115.4	8%	0.079	62%	0.624	C	S	.	*			trans	-85.7	101.9	176.4	-65	178.1	0	0	0	108.8	L14 F15 T19 H42 R225	L14-L223 HydrophobicContact CB-CD2 4.25Å; L14-L223 HydrophobicContact CD1-CD2 4.04Å; F15-L223 HydrophobicContact CD2-CD1 4.1Å; T19-L223 HydrophobicContact CG2-CD2 3.73Å; H42-L223 VanDerWaalsContact CB-O 3.29Å; H42-L223 WeakPolarHBondContact CB-O 3.27Å; H42-L223 PolarHBondContact N-O 3.46Å; H42-L223 PolarHBondContact O-N 2.84Å; L223-R225 PolarHBondContact O-N 2.77Å
224	W	45.5	Very low	34.4	Very low	74 Å²	74	119.3 Å²	119.3	28%	0.28	62%	0.619	S	S	.	*			trans	-71.1	114.2	174.6	-56.8	107.4	0	0	0	110.1	I31 L32 V39 V41 P222	I31-W224 HydrophobicContact CG2-CD2 3.61Å; I31-W224 HydrophobicContact CG2-CE3 4.01Å; I31-W224 HydrophobicContact CG2-CG 3.88Å; I31-W224 HydrophobicContact CG2-CZ2 4.2Å; I31-W224 HydrophobicContact CG2-CZ3 4.45Å; L32-W224 HydrophobicContact CD2-CH2 3.68Å; L32-W224 HydrophobicContact CD2-CZ2 3.84Å; V39-W224 HydrophobicContact CB-CB 4.42Å; V39-W224 HydrophobicContact CB-CE3 4.06Å; V39-W224 HydrophobicContact CG1-CB 4.22Å; V39-W224 HydrophobicContact CG2-CE3 3.73Å; V39-W224 HydrophobicContact CG2-CZ3 4.13Å; V41-W224 HydrophobicContact CG2-CH2 4.47Å; V41-W224 HydrophobicContact CG2-CZ3 3.94Å; P222-W224 HydrophobicContact CG-CH2 4.38Å; P222-W224 HydrophobicContact CG-CZ2 3.65Å; P222-W224 PolarHBondContact O-N 3.14Å
225	R	45.6	Very low	34.7	Very low	134 Å²	134	121.9 Å²	121.9	51%	0.506	63%	0.627	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.6	121.4	170	174.9	-179.6	-72.4	-143.2	-4.4	109.1	V39 S40 L223	V39-R225 WeakPolarHBondContact CA-O 3.42Å; S40-R225 PolarHBondContact N-O 2.84Å; S40-R225 VanDerWaalsContact N-O 3.1Å; S40-R225 PolarHBondContact O-N 2.86Å; L223-R225 PolarHBondContact O-N 2.77Å
226	T	41.1	Very low	35	Very low	104 Å²	104	116.2 Å²	116.2	64%	0.638	61%	0.612	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-69.5	138.6	166	44.7	0	0	0	0	110.6	L38 V39 N228	L38-T226 WeakPolarHBondContact O-CA 3.26Å; V39-T226 HydrophobicContact CG1-CG2 4.49Å; T226-N228 PolarHBondContact O-N 2.96Å
227	R	34	Very low	35.6	Very low	161 Å²	161	119.4 Å²	119.4	61%	0.608	62%	0.62	S	S	*	*			trans	-94.8	60.7	-175.7	-164.9	-169.3	-174.2	136.7	3.4	112.5	L38 D61	L38-R227 PolarHBondContact O-N 2.66Å; D61-R227 IonicContact OD2-CZ 3.71Å; D61-R227 IonicContact OD2-NH1 2.82Å; D61-R227 PolarHBondContact OD2-NH1 3.28Å
228	N	31.6	Very low	36	Very low	140 Å²	140	121 Å²	121	75%	0.749	62%	0.624	S	S	*	*			trans	-116.9	117.9	168.1	-80.5	2.7	0	0	0	110.7	T226	T226-N228 PolarHBondContact O-N 2.96Å
229	H	35.5	Very low	36.4	Very low	193 Å²	193	121.3 Å²	121.3	89%	0.894	63%	0.632	S	S	*	*			trans	-82.7	132.1	154.8	-89.5	-110.3	0	0	0	107.9	Q231	H229-Q231 PolarHBondContact O-N 3.08Å
230	G	35.4	Very low	36.7	Very low	75 Å²	75	120.4 Å²	120.4	77%	0.773	64%	0.635	S	S	*	*	S	Bend	trans	52.1	60.9	154.9	0	0	0	0	0	118.6
231	Q	29.6	Very low	36.7	Very low	156 Å²	156	118.2 Å²	118.2	73%	0.729	65%	0.651	S	S	*	*			trans	-166.5	123.5	140.9	-110.6	171.7	49.4	0	0	111.5	H229 S233	H229-Q231 PolarHBondContact O-N 3.08Å; Q231-S233 PolarHBondContact OE1-OG 2.77Å; Q231-S233 VanDerWaalsContact OE1-OG 3.05Å
232	C	29.2	Very low	36.2	Very low	144 Å²	144	119.6 Å²	119.6	97%	0.973	67%	0.67	S	S	*	*			trans	-97.2	76.4	163.2	-76.2	0	0	0	0	108
233	S	30.9	Very low	35.8	Very low	75 Å²	75	126.4 Å²	126.4	52%	0.524	70%	0.704	S	S	.	*			trans	-99.9	150.5	176.5	-52.3	0	0	0	0	109.6	Q231 I235	Q231-S233 PolarHBondContact OE1-OG 2.77Å; Q231-S233 VanDerWaalsContact OE1-OG 3.05Å; S233-I235 PolarHBondContact O-N 2.68Å
234	H	34.2	Very low	35.6	Very low	165 Å²	165	130.6 Å²	130.6	76%	0.764	73%	0.732	S	S	*	*			trans	-42.6	131.9	-171.4	-94.3	-131.1	0	0	0	115.2
235	I	32.4	Very low	35.1	Very low	174 Å²	174	133.3 Å²	133.3	89%	0.892	76%	0.757	S	S	*	*			trans	-129.7	67.4	148	-51.9	-179.1	0	0	0	107.1	S233	S233-I235 PolarHBondContact O-N 2.68Å
236	S	35.5	Very low	34.2	Very low	76 Å²	76	133.3 Å²	133.3	53%	0.531	78%	0.776	S	S	.	*			trans	-96.6	176.7	147.7	-68	0	0	0	0	107.7
237	D	37.5	Very low	33.7	Very low	129 Å²	129	133.2 Å²	133.2	69%	0.69	78%	0.779	S	S	*	*			trans	66.5	75.4	163.7	-44.6	-51.8	0	0	0	115.5
238	H	33.8	Very low	33.8	Very low	188 Å²	188	131.8 Å²	131.8	87%	0.87	79%	0.791	S	S	*	*				-176.8	86.2	116.4	-88.8	-56.6	0	0	0	111.4
239	L	35	Very low	34.1	Very low	171 Å²	171	133.4 Å²	133.4	90%	0.895	79%	0.794	S	S	*	*			trans	-138.7	119.4	152.7	-95.2	104.1	0	0	0	108.3
240	P	35.3	Very low	34.1	Very low	130 Å²	130	130.3 Å²	130.3	84%	0.844	79%	0.794	S	S	*	*			trans	-80.9	147.4	173.6	32.7	-33.2	0	0	0	111.4
241	G	35.4	Very low	34.2	Very low	81 Å²	81	131.6 Å²	131.6	84%	0.835	80%	0.797	S	S	*	*			trans	94.4	69.9	161	0	0	0	0	0	117.6
242	A	29.6	Very low	34.6	Very low	98 Å²	98	135.7 Å²	135.7	81%	0.81	81%	0.806	S	S	*	*			trans	-171.7	115.1	139	0	0	0	0	0	112.1
243	L	33.7	Very low	34.8	Very low	172 Å²	172	140.9 Å²	140.9	90%	0.901	81%	0.805	S	S	*	*			trans	-135.9	162.2	159.8	-79.5	-177.9	0	0	0	106.5
244	P	46	Very low	35	Very low	103 Å²	103	142.4 Å²	142.4	67%	0.669	82%	0.823	S	S	*	*			cis	-136.4	-166.9	19.9	43.1	-25.1	0	0	0	115.8
245	T	34.7	Very low	35.2	Very low	130 Å²	130	144 Å²	144	80%	0.798	83%	0.83	S	S	*	*			trans	58.4	110.8	159	54.8	0	0	0	0	120.1
246	C	28	Very low	35.3	Very low	134 Å²	134	148.4 Å²	148.4	91%	0.905	85%	0.847	S	S	*	*				-152.1	141.9	114.3	-142.9	0	0	0	0	109.9
247	S	29.5	Very low	35.3	Very low	102 Å²	102	152.1 Å²	152.1	71%	0.713	86%	0.863	S	S	*	*			trans	-90.4	145	-170.3	-158.1	0	0	0	0	112.6	E249	S247-E249 PolarHBondContact O-N 3.41Å; S247-E249 VanDerWaalsContact O-N 3.13Å
248	P	37.1	Very low	35.2	Very low	132 Å²	132	153.3 Å²	153.3	86%	0.857	87%	0.872	S	S	*	*			trans	-86.8	68.1	-178.3	36.1	-36.4	0	0	0	113.1
249	E	37.3	Very low	35.3	Very low	174 Å²	174	151.3 Å²	151.3	81%	0.813	87%	0.872	S	S	*	*			trans	-123.4	80.5	175	-165.8	-177.7	156.4	0	0	112.2	S247	S247-E249 PolarHBondContact O-N 3.41Å; S247-E249 VanDerWaalsContact O-N 3.13Å
250	S	35.3	Very low	35.3	Very low	128 Å²	128	150.2 Å²	150.2	90%	0.895	87%	0.871	S	S	*	*			trans	-174.1	70.3	164.6	-83.2	0	0	0	0	110.3
251	A	38	Very low	35.3	Very low	101 Å²	101	151.4 Å²	151.4	84%	0.835	87%	0.873	S	S	*	*			trans	-148	43.3	-177.9	0	0	0	0	0	113.8
252	R	38.3	Very low	35.3	Very low	242 Å²	242	156.1 Å²	156.1	91%	0.913	88%	0.875	S	S	*	*			trans	-141.9	150.3	167.9	-72.9	-168.7	173.4	-164.7	-2.3	110.4
253	R	33.8	Very low	35.7	Very low	253 Å²	253	160.3 Å²	160.3	96%	0.955	88%	0.88	S	S	*	*			trans	65.5	97.6	178.9	-64	-174.4	171.4	-166.1	-4	116.5
254	A	35	Very low	35.9	Very low	108 Å²	108	159.4 Å²	159.4	89%	0.893	88%	0.878	S	S	*	*			trans	-166	60.7	135.1	0	0	0	0	0	109.6
255	E	38.6	Very low	35	Very low	197 Å²	197	164.1 Å²	164.1	92%	0.921	90%	0.896	S	S	*	*			trans	-99.7	99.1	147.9	-82.7	-179	108.8	0	0	105.7
256	E	34.5	Very low	35	Very low	268 Å²	268	167.2 Å²	167.2	100%	1.252	91%	0.905	S	S	*	*			trans	-167.2	0	135.7	-139.5	170.6	124.2	0	0	108.3

Retrieved 256 of 256 residues in 53.4 ms (Link to these results)

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