A0A077ZDF2_TRITR Loading...

Orphan nuclear receptor E75C

AlphaFold DB , UniProt , Accession A0A077ZDF2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 207 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	94.3	Very high	97.3	Very high	155 Å²	155	56.9 Å²	56.9	76%	0.764	32%	0.322	S	S	*	.				0	150.7	0	-169	61.7	132.4	0	0	109.6	Q3 G6	M1-Q3 PolarHBondContact O-N 2.79Å; M1-G6 WeakPolarHBondContact CE-O 2.96Å; M1-G6 VanDerWaalsContact SD-C 3.55Å
2	C	98.5	Very high	97	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.02	32%	0.319	C	S	.	.			trans	-72.9	118.6	175.5	174.3	0	0	0	0	110.8	V4 C5 G6 D7 H17 C19	C2-V4 PolarHBondContact O-N 3.41Å; C2-C5 PolarHBondContact O-N 3.45Å; C2-G6 WeakPolarHBondContact O-CA 3.3Å; C2-G6 PolarHBondContact O-N 3.14Å; C2-D7 HydrophobicContact CB-CB 4.45Å; C2-D7 WeakPolarHBondContact CB-O 3.38Å; C2-D7 PolarHBondContact N-O 2.67Å; C2-H17 WeakPolarHBondContact CA-O 3.38Å; C2-C19 HydrophobicContact CB-CB 4Å; C2-C19 PolarHBondContact SG-N 3.06Å; C2-C19 VanDerWaalsContact SG-N 3.38Å
3	Q	97.6	Very high	96.8	Very high	106 Å²	106	55.1 Å²	55.1	50%	0.495	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-17.5	-176.5	-68.3	178.5	-68.8	0	0	113.8	M1 H17 V66	M1-Q3 PolarHBondContact O-N 2.79Å; Q3-H17 HydrophobicContact CG-CB 4.5Å; Q3-H17 PolarHBondContact N-O 3.48Å; Q3-V66 HydrophobicContact CB-CB 4.43Å; Q3-V66 HydrophobicContact CB-CG1 4.47Å
4	V	98.5	Very high	96.7	Very high	4 Å²	4	53 Å²	53	2%	0.024	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-47.3	179.7	-179	0	0	0	0	112.4	C2 C22 V47 K62 V66 M68	C2-V4 PolarHBondContact O-N 3.41Å; V4-C22 HydrophobicContact CB-CB 4.28Å; V4-C22 HydrophobicContact CG1-CB 4.43Å; V4-C22 HydrophobicContact CG2-CB 4.37Å; V4-V47 HydrophobicContact CG1-CG1 4.12Å; V4-K62 HydrophobicContact CG1-CB 4.46Å; V4-K62 HydrophobicContact CG1-CG 4.19Å; V4-V66 HydrophobicContact CG2-CG2 3.71Å; V4-M68 HydrophobicContact CG2-CE 3.86Å; V4-M68 HydrophobicContact CG2-SD 4.08Å
5	C	98.5	Very high	96.5	Very high	4 Å²	4	51.1 Å²	51.1	3%	0.027	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.4	0.7	-168	68.8	0	0	0	0	115.6	C2 D7 C19 C22 V47 L48 R49 R52	C2-C5 PolarHBondContact O-N 3.45Å; C5-D7 VanDerWaalsContact C-N 3.26Å; C5-D7 PolarHBondContact O-N 3.11Å; C5-D7 VanDerWaalsContact SG-CB 3.56Å; C5-C19 VanDerWaalsContact SG-SG 3.62Å; C5-C22 VanDerWaalsContact SG-SG 3.7Å; C5-V47 WeakPolarHBondContact CA-O 3.33Å; C5-V47 HydrophobicContact CB-CG1 4.08Å; C5-L48 CarbonylContact O-C 3.49Å; C5-L48 WeakPolarHBondContact O-CA 3.42Å; C5-R49 PolarHBondContact O-N 2.93Å; C5-R52 HydrophobicContact CB-CB 4.37Å; C5-R52 PolarHBondContact SG-NH1 3.5Å; C5-R52 VanDerWaalsContact SG-NH1 3.36Å
6	G	98	Very high	96.4	Very high	38 Å²	38	48.1 Å²	48.1	39%	0.392	27%	0.27	S	S	.	.	S	Bend	trans	69.8	18.6	-177.9	0	0	0	0	0	114.4	M1 C2	M1-G6 WeakPolarHBondContact CE-O 2.96Å; M1-G6 VanDerWaalsContact SD-C 3.55Å; C2-G6 WeakPolarHBondContact O-CA 3.3Å; C2-G6 PolarHBondContact O-N 3.14Å
7	D	98	Very high	96.4	Very high	18 Å²	18	50.8 Å²	50.8	10%	0.096	28%	0.28	C	S	.	.	S	Bend	trans	-84.7	168.2	172.7	-162.3	2.4	0	0	0	111.4	C2 C5 A9 C19 R49 R52	C2-D7 HydrophobicContact CB-CB 4.45Å; C2-D7 WeakPolarHBondContact CB-O 3.38Å; C2-D7 PolarHBondContact N-O 2.67Å; C5-D7 VanDerWaalsContact C-N 3.26Å; C5-D7 PolarHBondContact O-N 3.11Å; C5-D7 VanDerWaalsContact SG-CB 3.56Å; D7-A9 PolarHBondContact O-N 3.13Å; D7-A9 VanDerWaalsContact O-N 3.14Å; D7-C19 HydrophobicContact CB-CB 3.99Å; D7-R49 HydrophobicContact CB-CB 4.27Å; D7-R49 HydrophobicContact CB-CG 4.24Å; D7-R49 WeakPolarHBondContact OD1-CD 3.48Å; D7-R49 IonicContact OD1-CZ 3.46Å; D7-R49 IonicContact OD1-NE 3.53Å; D7-R49 IonicContact OD1-NH1 2.79Å; D7-R49 PolarHBondContact OD1-NH1 3.45Å; D7-R52 IonicContact OD2-CZ 3.54Å; D7-R52 IonicContact OD2-NH1 3.55Å; D7-R52 PolarHBondContact OD2-NH1 3.24Å; D7-R52 IonicContact OD2-NH2 3.85Å; D7-R52 PolarHBondContact OD2-NH2 2.98Å
8	K	98	Very high	96.4	Very high	180 Å²	180	47.9 Å²	47.9	78%	0.783	26%	0.264	S	S	*	.	P	Polyproline II helix	trans	-58.5	119.5	174.1	-171.9	175.8	-179.4	179.3	0	109.4	C19	K8-C19 WeakPolarHBondContact O-CB 3.16Å
9	A	97.8	Very high	96.5	Very high	27 Å²	27	45.5 Å²	45.5	22%	0.223	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-73.7	137.3	175.6	0	0	0	0	0	109.5	D7 H17 A18	D7-A9 PolarHBondContact O-N 3.13Å; D7-A9 VanDerWaalsContact O-N 3.14Å; A9-H17 HydrophobicContact CB-CB 4.38Å; A9-A18 WeakPolarHBondContact CA-O 2.94Å
10	S	96.8	Very high	96.6	Very high	65 Å²	65	48.2 Å²	48.2	46%	0.455	26%	0.261	S	S	.	.			trans	-92	-16.1	174.5	53.6	0	0	0	0	112.4	H13 A18 E20	S10-H13 PolarHBondContact OG-NE2 3.1Å; S10-A18 PolarHBondContact N-O 3.27Å; S10-A18 PolarHBondContact OG-O 3.45Å; S10-E20 WeakPolarHBondContact CB-OE1 3.19Å; S10-E20 PolarHBondContact OG-OE1 2.68Å
11	G	94.1	Very high	96.7	Very high	26 Å²	26	47.2 Å²	47.2	27%	0.268	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	166.2	-160.2	-179.6	0	0	0	0	0	112.2	H17 A18	G11-H17 WeakPolarHBondContact O-CA 3.42Å; G11-A18 PolarHBondContact O-N 3.46Å; G11-A18 VanDerWaalsContact O-N 3.1Å
12	F	93.3	Very high	96.9	Very high	65 Å²	65	39.8 Å²	39.8	29%	0.285	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	112.3	176.8	-160.5	-94.8	0	0	0	109.2	G15 V16 N76	F12-G15 WeakPolarHBondContact CZ-O 3.44Å; F12-V16 CarbonylContact C-O 3.56Å; F12-V16 WeakPolarHBondContact CA-O 3.31Å; F12-N76 HydrophobicContact CD1-CB 3.73Å; F12-N76 VanDerWaalsContact CD1-CG 3.49Å; F12-N76 WeakPolarHBondContact CD1-ND2 3.36Å; F12-N76 HydrophobicContact CE1-CB 3.68Å
13	H	95.3	Very high	96.9	Very high	25 Å²	25	42.2 Å²	42.2	12%	0.116	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	125.9	-174.1	-57.6	-70.9	0	0	0	109.2	S10 G15 V16 A18 E20 K23	S10-H13 PolarHBondContact OG-NE2 3.1Å; H13-G15 VanDerWaalsContact C-N 3.27Å; H13-G15 PolarHBondContact O-N 2.89Å; H13-V16 PolarHBondContact N-O 3.01Å; H13-V16 PolarHBondContact O-N 2.87Å; H13-A18 HydrophobicContact CB-CB 4.22Å; H13-E20 IonicContact CE1-OE1 3.74Å; H13-E20 IonicContact NE2-OE1 2.69Å; H13-K23 HydrophobicContact CB-CB 4.16Å; H13-K23 HydrophobicContact CB-CG 4Å; H13-K23 WeakPolarHBondContact ND1-CD 3.37Å; H13-K23 WeakPolarHBondContact ND1-CE 3.29Å
14	Y	95.3	Very high	96.9	Very high	26 Å²	26	37.7 Å²	37.7	10%	0.102	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	34.6	177.3	-53.3	-75.3	0	0	0	114.3	K23 F26 R27 M68 S69 M73	Y14-K23 HydrophobicContact CE2-CG 3.95Å; Y14-F26 AromaticContact CD1-CD1 3.92Å; Y14-F26 HydrophobicContact CD1-CD1 3.92Å; Y14-F26 AromaticContact CD1-CE1 3.88Å; Y14-F26 HydrophobicContact CD1-CE1 3.88Å; Y14-F26 AromaticContact CD2-CD1 3.64Å; Y14-F26 HydrophobicContact CD2-CD1 3.64Å; Y14-F26 HydrophobicContact CD2-CE1 4.31Å; Y14-F26 HydrophobicContact CE1-CD1 4.35Å; Y14-F26 HydrophobicContact CE2-CD1 4.1Å; Y14-F26 AromaticContact CG-CD1 3.55Å; Y14-F26 HydrophobicContact CG-CD1 3.55Å; Y14-F26 AromaticContact CG-CE1 3.75Å; Y14-F26 HydrophobicContact CG-CE1 3.75Å; Y14-R27 HydrophobicContact CE2-CB 4.4Å; Y14-R27 VanDerWaalsContact OH-CB 3.27Å; Y14-R27 WeakPolarHBondContact OH-CB 3.48Å; Y14-R27 VanDerWaalsContact OH-CG 3.31Å; Y14-R27 WeakPolarHBondContact OH-CG 3.15Å; Y14-M68 CarbonylContact O-C 3.55Å; Y14-M68 VanDerWaalsContact O-CA 3.24Å; Y14-M68 WeakPolarHBondContact O-CA 3.27Å; Y14-S69 WeakPolarHBondContact CB-O 3.29Å; Y14-S69 PolarHBondContact O-N 3.24Å; Y14-M73 HydrophobicContact CD1-CE 3.52Å; Y14-M73 HydrophobicContact CD1-CG 3.88Å; Y14-M73 HydrophobicContact CD1-SD 3.79Å; Y14-M73 HydrophobicContact CD2-CE 4.11Å; Y14-M73 HydrophobicContact CE1-CE 3.17Å; Y14-M73 HydrophobicContact CE1-CG 4.28Å; Y14-M73 HydrophobicContact CE1-SD 3.56Å; Y14-M73 VanDerWaalsContact CE1-SD 3.56Å; Y14-M73 HydrophobicContact CE2-CE 3.81Å; Y14-M73 HydrophobicContact CG-CE 3.97Å; Y14-M73 HydrophobicContact CG-CG 4.49Å
15	G	92.9	Very high	96.9	Very high	25 Å²	25	37.7 Å²	37.7	26%	0.258	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.2	-1.7	178.3	0	0	0	0	0	115.7	F12 H13	F12-G15 WeakPolarHBondContact CZ-O 3.44Å; H13-G15 VanDerWaalsContact C-N 3.27Å; H13-G15 PolarHBondContact O-N 2.89Å
16	V	94.8	Very high	96.9	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.018	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	162.6	-177.3	-50.8	0	0	0	0	113.1	F12 H13 A18 V66 M68	F12-V16 CarbonylContact C-O 3.56Å; F12-V16 WeakPolarHBondContact CA-O 3.31Å; H13-V16 PolarHBondContact N-O 3.01Å; H13-V16 PolarHBondContact O-N 2.87Å; V16-A18 HydrophobicContact CG2-CB 4.3Å; V16-A18 PolarHBondContact O-N 2.94Å; V16-V66 HydrophobicContact CG1-CG2 4.21Å; V16-V66 WeakPolarHBondContact CG1-O 3.15Å; V16-V66 HydrophobicContact CG2-CG2 4.34Å; V16-M68 HydrophobicContact CB-CG 4.46Å; V16-M68 HydrophobicContact CG1-CG 4.22Å; V16-M68 HydrophobicContact CG2-CE 3.34Å; V16-M68 HydrophobicContact CG2-CG 3.38Å; V16-M68 HydrophobicContact CG2-SD 4.21Å
17	H	96.2	Very high	96.8	Very high	93 Å²	93	41.3 Å²	41.3	43%	0.431	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	116.4	168.8	-74.8	-69.7	0	0	0	111.1	C2 Q3 A9 G11	C2-H17 WeakPolarHBondContact CA-O 3.38Å; Q3-H17 HydrophobicContact CG-CB 4.5Å; Q3-H17 PolarHBondContact N-O 3.48Å; A9-H17 HydrophobicContact CB-CB 4.38Å; G11-H17 WeakPolarHBondContact O-CA 3.42Å
18	A	97.7	Very high	96.8	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	154.9	-173.7	0	0	0	0	0	113.7	A9 S10 G11 H13 V16 M68	A9-A18 WeakPolarHBondContact CA-O 2.94Å; S10-A18 PolarHBondContact N-O 3.27Å; S10-A18 PolarHBondContact OG-O 3.45Å; G11-A18 PolarHBondContact O-N 3.46Å; G11-A18 VanDerWaalsContact O-N 3.1Å; H13-A18 HydrophobicContact CB-CB 4.22Å; V16-A18 HydrophobicContact CG2-CB 4.3Å; V16-A18 PolarHBondContact O-N 2.94Å; A18-M68 HydrophobicContact CB-CE 3.28Å
19	C	98.7	Very high	96.8	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.014	20%	0.2	C	C	.	.			trans	-83.7	161.8	167.8	66.1	0	0	0	0	110.8	C2 C5 D7 K8 G21 C22 K23 R52	C2-C19 HydrophobicContact CB-CB 4Å; C2-C19 PolarHBondContact SG-N 3.06Å; C2-C19 VanDerWaalsContact SG-N 3.38Å; C5-C19 VanDerWaalsContact SG-SG 3.62Å; D7-C19 HydrophobicContact CB-CB 3.99Å; K8-C19 WeakPolarHBondContact O-CB 3.16Å; C19-G21 PolarHBondContact O-N 3.11Å; C19-C22 PolarHBondContact O-N 3.07Å; C19-C22 VanDerWaalsContact O-N 3.14Å; C19-C22 PolarHBondContact SG-N 3.34Å; C19-C22 VanDerWaalsContact SG-N 3.44Å; C19-K23 WeakPolarHBondContact O-CB 3.36Å; C19-K23 PolarHBondContact O-N 2.87Å; C19-R52 PolarHBondContact SG-NH1 2.87Å
20	E	98.2	Very high	96.7	Very high	98 Å²	98	38.4 Å²	38.4	46%	0.458	20%	0.2	S	C	.	.	H	α-helix	trans	-56.6	-35.3	177.8	-69.7	-55.7	122.3	0	0	112.7	S10 H13 C22 K23 G24	S10-E20 WeakPolarHBondContact CB-OE1 3.19Å; S10-E20 PolarHBondContact OG-OE1 2.68Å; H13-E20 IonicContact CE1-OE1 3.74Å; H13-E20 IonicContact NE2-OE1 2.69Å; E20-C22 PolarHBondContact O-N 3.06Å; E20-K23 PolarHBondContact O-N 3.14Å; E20-K23 IonicContact OE1-NZ 3.24Å; E20-K23 PolarHBondContact OE1-NZ 3.38Å; E20-K23 VanDerWaalsContact OE2-CD 3.24Å; E20-K23 WeakPolarHBondContact OE2-CD 3.48Å; E20-K23 IonicContact OE2-NZ 2.82Å; E20-K23 PolarHBondContact OE2-NZ 2.93Å; E20-G24 PolarHBondContact O-N 3.29Å
21	G	98.2	Very high	96.6	Very high	28 Å²	28	41.6 Å²	41.6	29%	0.289	21%	0.207	S	C	.	.	H	α-helix	trans	-61.8	-45.5	177.4	0	0	0	0	0	113.1	C19 F25 R59	C19-G21 PolarHBondContact O-N 3.11Å; G21-F25 VanDerWaalsContact O-CB 3.24Å; G21-F25 WeakPolarHBondContact O-CB 3.26Å; G21-F25 PolarHBondContact O-N 3.45Å; G21-F25 VanDerWaalsContact O-N 3.08Å; G21-R59 PolarHBondContact O-NH2 2.87Å
22	C	98.7	Very high	96.7	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-77.4	-34.6	179.1	-69.7	0	0	0	0	112.5	V4 C5 C19 E20 F25 F26 R59 M68	V4-C22 HydrophobicContact CB-CB 4.28Å; V4-C22 HydrophobicContact CG1-CB 4.43Å; V4-C22 HydrophobicContact CG2-CB 4.37Å; C5-C22 VanDerWaalsContact SG-SG 3.7Å; C19-C22 PolarHBondContact O-N 3.07Å; C19-C22 VanDerWaalsContact O-N 3.14Å; C19-C22 PolarHBondContact SG-N 3.34Å; C19-C22 VanDerWaalsContact SG-N 3.44Å; E20-C22 PolarHBondContact O-N 3.06Å; C22-F25 PolarHBondContact O-N 3.32Å; C22-F26 VanDerWaalsContact O-CB 3.32Å; C22-F26 WeakPolarHBondContact O-CB 3.4Å; C22-F26 PolarHBondContact O-N 3.29Å; C22-R59 PolarHBondContact SG-NH2 3.42Å; C22-M68 HydrophobicContact CB-CE 4.41Å
23	K	97.8	Very high	96.8	Very high	53 Å²	53	51.7 Å²	51.7	23%	0.23	25%	0.246	C	C	.	.	H	α-helix	trans	-55.9	-53.2	170.5	173.2	-161.1	-176.9	-176.5	0	111.3	H13 Y14 C19 E20 R27	H13-K23 HydrophobicContact CB-CB 4.16Å; H13-K23 HydrophobicContact CB-CG 4Å; H13-K23 WeakPolarHBondContact ND1-CD 3.37Å; H13-K23 WeakPolarHBondContact ND1-CE 3.29Å; Y14-K23 HydrophobicContact CE2-CG 3.95Å; C19-K23 WeakPolarHBondContact O-CB 3.36Å; C19-K23 PolarHBondContact O-N 2.87Å; E20-K23 PolarHBondContact O-N 3.14Å; E20-K23 IonicContact OE1-NZ 3.24Å; E20-K23 PolarHBondContact OE1-NZ 3.38Å; E20-K23 VanDerWaalsContact OE2-CD 3.24Å; E20-K23 WeakPolarHBondContact OE2-CD 3.48Å; E20-K23 IonicContact OE2-NZ 2.82Å; E20-K23 PolarHBondContact OE2-NZ 2.93Å; K23-R27 WeakPolarHBondContact O-CB 3.17Å; K23-R27 PolarHBondContact O-N 2.78Å
24	G	97.9	Very high	96.9	Very high	11 Å²	11	53.2 Å²	53.2	11%	0.113	25%	0.254	C	S	.	.	H	α-helix	trans	-67.1	-38.5	-179.6	0	0	0	0	0	112.9	E20 R28	E20-G24 PolarHBondContact O-N 3.29Å; G24-R28 WeakPolarHBondContact O-CG 3.25Å; G24-R28 PolarHBondContact O-N 2.91Å; G24-R28 VanDerWaalsContact O-N 3.16Å; G24-R28 PolarHBondContact O-NH1 3.42Å
25	F	98.6	Very high	96.9	Very high	5 Å²	5	60.9 Å²	60.9	2%	0.022	29%	0.291	C	S	.	.	H	α-helix	trans	-59.9	-56.3	174.2	173.7	-99.7	0	0	0	111.3	G21 C22 R27 R28 S29 Y36 Q56 R59 L60	G21-F25 VanDerWaalsContact O-CB 3.24Å; G21-F25 WeakPolarHBondContact O-CB 3.26Å; G21-F25 PolarHBondContact O-N 3.45Å; G21-F25 VanDerWaalsContact O-N 3.08Å; C22-F25 PolarHBondContact O-N 3.32Å; F25-R27 VanDerWaalsContact C-N 3.33Å; F25-R27 PolarHBondContact O-N 2.97Å; F25-R28 PolarHBondContact O-N 2.91Å; F25-S29 PolarHBondContact O-N 3.42Å; F25-S29 PolarHBondContact O-OG 2.97Å; F25-Y36 AromaticContact CE2-CE2 3.87Å; F25-Y36 HydrophobicContact CE2-CE2 3.87Å; F25-Y36 AromaticContact CE2-CZ 3.66Å; F25-Y36 VanDerWaalsContact CE2-OH 3.25Å; F25-Y36 WeakPolarHBondContact CE2-OH 3.45Å; F25-Y36 HydrophobicContact CZ-CD2 4.43Å; F25-Y36 AromaticContact CZ-CE2 3.58Å; F25-Y36 HydrophobicContact CZ-CE2 3.58Å; F25-Y36 AromaticContact CZ-CZ 3.89Å; F25-Q56 HydrophobicContact CE2-CB 4.1Å; F25-Q56 HydrophobicContact CE2-CG 4.17Å; F25-Q56 HydrophobicContact CZ-CB 4.23Å; F25-Q56 WeakPolarHBondContact CZ-O 3.35Å; F25-R59 HydrophobicContact CD1-CG 3.81Å; F25-R59 HydrophobicContact CE1-CB 3.85Å; F25-R59 HydrophobicContact CE1-CG 3.56Å; F25-R59 HydrophobicContact CG-CG 4.48Å; F25-R59 HydrophobicContact CZ-CB 3.95Å; F25-R59 HydrophobicContact CZ-CG 4.05Å; F25-L60 HydrophobicContact CE1-CB 3.87Å; F25-L60 HydrophobicContact CE1-CD1 4.36Å; F25-L60 HydrophobicContact CZ-CB 4.01Å
26	F	98.2	Very high	97.1	Very high	4 Å²	4	61.3 Å²	61.3	2%	0.018	29%	0.285	C	S	.	.	H	α-helix	trans	-57.5	-45.1	-179.5	-175.5	-100.1	0	0	0	111.9	Y14 C22 R28 S29 I30 L60 C63 I64 M68	Y14-F26 AromaticContact CD1-CD1 3.92Å; Y14-F26 HydrophobicContact CD1-CD1 3.92Å; Y14-F26 AromaticContact CD1-CE1 3.88Å; Y14-F26 HydrophobicContact CD1-CE1 3.88Å; Y14-F26 AromaticContact CD2-CD1 3.64Å; Y14-F26 HydrophobicContact CD2-CD1 3.64Å; Y14-F26 HydrophobicContact CD2-CE1 4.31Å; Y14-F26 HydrophobicContact CE1-CD1 4.35Å; Y14-F26 HydrophobicContact CE2-CD1 4.1Å; Y14-F26 AromaticContact CG-CD1 3.55Å; Y14-F26 HydrophobicContact CG-CD1 3.55Å; Y14-F26 AromaticContact CG-CE1 3.75Å; Y14-F26 HydrophobicContact CG-CE1 3.75Å; C22-F26 VanDerWaalsContact O-CB 3.32Å; C22-F26 WeakPolarHBondContact O-CB 3.4Å; C22-F26 PolarHBondContact O-N 3.29Å; F26-R28 PolarHBondContact O-N 2.83Å; F26-S29 PolarHBondContact O-N 2.94Å; F26-I30 HydrophobicContact CD1-CG1 4.19Å; F26-I30 HydrophobicContact CD2-CG1 4.12Å; F26-I30 HydrophobicContact CE1-CG1 3.87Å; F26-I30 HydrophobicContact CE2-CD1 4.11Å; F26-I30 HydrophobicContact CE2-CG1 3.79Å; F26-I30 HydrophobicContact CG-CG1 4.32Å; F26-I30 HydrophobicContact CZ-CD1 4.19Å; F26-I30 HydrophobicContact CZ-CG1 3.66Å; F26-I30 WeakPolarHBondContact O-CB 3.43Å; F26-I30 WeakPolarHBondContact O-CG1 3.32Å; F26-I30 PolarHBondContact O-N 3.48Å; F26-L60 HydrophobicContact CD2-CD1 4.07Å; F26-L60 HydrophobicContact CE2-CD1 4.42Å; F26-C63 HydrophobicContact CD2-CB 3.68Å; F26-C63 HydrophobicContact CE2-CB 4.23Å; F26-I64 HydrophobicContact CE2-CG1 4.33Å; F26-M68 HydrophobicContact CB-SD 3.92Å; F26-M68 HydrophobicContact CD1-CB 4.31Å; F26-M68 HydrophobicContact CD1-SD 4.49Å; F26-M68 HydrophobicContact CD2-CB 3.82Å; F26-M68 HydrophobicContact CD2-SD 3.99Å; F26-M68 HydrophobicContact CE1-CB 4.06Å; F26-M68 HydrophobicContact CE2-CB 3.54Å; F26-M68 HydrophobicContact CG-CB 4.2Å; F26-M68 HydrophobicContact CG-SD 3.88Å; F26-M68 HydrophobicContact CZ-CB 3.66Å; F26-M68 VanDerWaalsContact CZ-O 3.25Å; F26-M68 WeakPolarHBondContact CZ-O 3.34Å
27	R	97.3	Very high	97.2	Very high	114 Å²	114	71.2 Å²	71.2	43%	0.43	32%	0.322	S	S	.	.	H	α-helix	trans	-52.5	-53.2	176	-172	179.4	64.6	-173.9	0.9	112	Y14 K23 F25 I30 Q31	Y14-R27 HydrophobicContact CE2-CB 4.4Å; Y14-R27 VanDerWaalsContact OH-CB 3.27Å; Y14-R27 WeakPolarHBondContact OH-CB 3.48Å; Y14-R27 VanDerWaalsContact OH-CG 3.31Å; Y14-R27 WeakPolarHBondContact OH-CG 3.15Å; K23-R27 WeakPolarHBondContact O-CB 3.17Å; K23-R27 PolarHBondContact O-N 2.78Å; F25-R27 VanDerWaalsContact C-N 3.33Å; F25-R27 PolarHBondContact O-N 2.97Å; R27-I30 PolarHBondContact O-N 3.39Å; R27-Q31 HydrophobicContact CG-CG 4.24Å; R27-Q31 VanDerWaalsContact O-CB 3.27Å; R27-Q31 WeakPolarHBondContact O-CB 3.19Å; R27-Q31 VanDerWaalsContact O-CG 3.27Å; R27-Q31 WeakPolarHBondContact O-CG 3.31Å; R27-Q31 PolarHBondContact O-N 3.12Å
28	R	97.9	Very high	97.2	Very high	117 Å²	117	71.3 Å²	71.3	44%	0.442	33%	0.331	S	S	.	.	H	α-helix	trans	-63.4	-47.2	-178.7	-72.2	-172.1	-60.2	-90.3	0.5	111.5	G24 F25 F26 I30 Q31 Q32	G24-R28 WeakPolarHBondContact O-CG 3.25Å; G24-R28 PolarHBondContact O-N 2.91Å; G24-R28 VanDerWaalsContact O-N 3.16Å; G24-R28 PolarHBondContact O-NH1 3.42Å; F25-R28 PolarHBondContact O-N 2.91Å; F26-R28 PolarHBondContact O-N 2.83Å; R28-I30 VanDerWaalsContact C-N 3.27Å; R28-I30 PolarHBondContact O-N 2.96Å; R28-Q31 PolarHBondContact O-N 3.39Å; R28-Q32 WeakPolarHBondContact O-CB 3.5Å; R28-Q32 PolarHBondContact O-N 3.47Å
29	S	97.8	Very high	97.2	Very high	3 Å²	3	72 Å²	72	2%	0.021	34%	0.336	C	S	.	.	H	α-helix	trans	-54.9	-44.3	179.7	-50.9	0	0	0	0	112	F25 F26 K33 I34 Y36	F25-S29 PolarHBondContact O-N 3.42Å; F25-S29 PolarHBondContact O-OG 2.97Å; F26-S29 PolarHBondContact O-N 2.94Å; S29-K33 WeakPolarHBondContact O-CA 3.33Å; S29-K33 PolarHBondContact O-N 3.19Å; S29-I34 PolarHBondContact O-N 2.77Å; S29-Y36 WeakPolarHBondContact OG-CE2 3.29Å; S29-Y36 PolarHBondContact OG-OH 3.42Å
30	I	95.6	Very high	97	Very high	44 Å²	44	77 Å²	77	23%	0.226	37%	0.37	C	S	.	.	H	α-helix	trans	-82	-38.6	-175.9	-62.2	-57.5	0	0	0	112.8	F26 R27 R28 R70	F26-I30 HydrophobicContact CD1-CG1 4.19Å; F26-I30 HydrophobicContact CD2-CG1 4.12Å; F26-I30 HydrophobicContact CE1-CG1 3.87Å; F26-I30 HydrophobicContact CE2-CD1 4.11Å; F26-I30 HydrophobicContact CE2-CG1 3.79Å; F26-I30 HydrophobicContact CG-CG1 4.32Å; F26-I30 HydrophobicContact CZ-CD1 4.19Å; F26-I30 HydrophobicContact CZ-CG1 3.66Å; F26-I30 WeakPolarHBondContact O-CB 3.43Å; F26-I30 WeakPolarHBondContact O-CG1 3.32Å; F26-I30 PolarHBondContact O-N 3.48Å; R27-I30 PolarHBondContact O-N 3.39Å; R28-I30 VanDerWaalsContact C-N 3.27Å; R28-I30 PolarHBondContact O-N 2.96Å; I30-R70 VanDerWaalsContact CG2-NH2 3.26Å; I30-R70 PolarHBondContact O-NH2 2.8Å; I30-R70 VanDerWaalsContact O-NH2 3.15Å
31	Q	94.9	Very high	96.8	Very high	131 Å²	131	79 Å²	79	61%	0.612	38%	0.377	S	S	*	.	H	α-helix	trans	-68.7	-44.5	179.5	-76.2	179.6	-23.3	0	0	111.6	R27 R28 K33	R27-Q31 HydrophobicContact CG-CG 4.24Å; R27-Q31 VanDerWaalsContact O-CB 3.27Å; R27-Q31 WeakPolarHBondContact O-CB 3.19Å; R27-Q31 VanDerWaalsContact O-CG 3.27Å; R27-Q31 WeakPolarHBondContact O-CG 3.31Å; R27-Q31 PolarHBondContact O-N 3.12Å; R28-Q31 PolarHBondContact O-N 3.39Å; Q31-K33 VanDerWaalsContact C-N 3.28Å; Q31-K33 PolarHBondContact O-N 2.88Å
32	Q	96.1	Very high	96.7	Very high	135 Å²	135	84 Å²	84	63%	0.631	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	1.4	-179.1	-63.6	175.7	-24.7	0	0	112.7	R28 I34	R28-Q32 WeakPolarHBondContact O-CB 3.5Å; R28-Q32 PolarHBondContact O-N 3.47Å; Q32-I34 HydrophobicContact CB-CD1 4.18Å; Q32-I34 HydrophobicContact CB-CG1 3.63Å; Q32-I34 PolarHBondContact O-N 3.42Å
33	K	95	Very high	96.5	Very high	169 Å²	169	87.9 Å²	87.9	74%	0.735	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	43.2	-176.2	-57.9	-178.9	-179.7	179.7	0	112.2	S29 Q31 Q35	S29-K33 WeakPolarHBondContact O-CA 3.33Å; S29-K33 PolarHBondContact O-N 3.19Å; Q31-K33 VanDerWaalsContact C-N 3.28Å; Q31-K33 PolarHBondContact O-N 2.88Å; K33-Q35 PolarHBondContact O-N 2.94Å
34	I	96.7	Very high	96.4	Very high	56 Å²	56	93.1 Å²	93.1	29%	0.287	44%	0.441	S	S	.	.			trans	-68.2	122.9	-172.8	-49.9	178.7	0	0	0	109.8	S29 Q32 Y36	S29-I34 PolarHBondContact O-N 2.77Å; Q32-I34 HydrophobicContact CB-CD1 4.18Å; Q32-I34 HydrophobicContact CB-CG1 3.63Å; Q32-I34 PolarHBondContact O-N 3.42Å; I34-Y36 HydrophobicContact CB-CE1 4.38Å; I34-Y36 HydrophobicContact CG2-CD1 3.88Å; I34-Y36 HydrophobicContact CG2-CE1 3.6Å; I34-Y36 HydrophobicContact CG2-CG 4.44Å
35	Q	96.3	Very high	96.4	Very high	188 Å²	188	94 Å²	94	88%	0.879	45%	0.445	S	S	*	.			trans	-91.4	105.2	167.8	-62.3	-174	10	0	0	109.1	K33	K33-Q35 PolarHBondContact O-N 2.94Å
36	Y	97.1	Very high	96.3	Very high	34 Å²	34	97.3 Å²	97.3	13%	0.133	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-74.6	146.5	176	-66.1	-60.8	0	0	0	111.3	F25 S29 I34 Q56 L60	F25-Y36 AromaticContact CE2-CE2 3.87Å; F25-Y36 HydrophobicContact CE2-CE2 3.87Å; F25-Y36 AromaticContact CE2-CZ 3.66Å; F25-Y36 VanDerWaalsContact CE2-OH 3.25Å; F25-Y36 WeakPolarHBondContact CE2-OH 3.45Å; F25-Y36 HydrophobicContact CZ-CD2 4.43Å; F25-Y36 AromaticContact CZ-CE2 3.58Å; F25-Y36 HydrophobicContact CZ-CE2 3.58Å; F25-Y36 AromaticContact CZ-CZ 3.89Å; S29-Y36 WeakPolarHBondContact OG-CE2 3.29Å; S29-Y36 PolarHBondContact OG-OH 3.42Å; I34-Y36 HydrophobicContact CB-CE1 4.38Å; I34-Y36 HydrophobicContact CG2-CD1 3.88Å; I34-Y36 HydrophobicContact CG2-CE1 3.6Å; I34-Y36 HydrophobicContact CG2-CG 4.44Å; Y36-Q56 HydrophobicContact CD1-CB 3.46Å; Y36-Q56 VanDerWaalsContact CD1-CB 3.46Å; Y36-Q56 HydrophobicContact CD1-CG 4.2Å; Y36-Q56 VanDerWaalsContact CD1-OE1 3.22Å; Y36-Q56 HydrophobicContact CD2-CB 3.98Å; Y36-Q56 HydrophobicContact CE1-CB 3.67Å; Y36-Q56 VanDerWaalsContact CE1-CD 3.45Å; Y36-Q56 HydrophobicContact CE1-CG 4.08Å; Y36-Q56 HydrophobicContact CE2-CB 4.14Å; Y36-Q56 HydrophobicContact CG-CB 3.64Å; Y36-L60 HydrophobicContact CD2-CB 4.19Å; Y36-L60 HydrophobicContact CD2-CD2 3.91Å; Y36-L60 HydrophobicContact CE2-CB 4.19Å; Y36-L60 HydrophobicContact CE2-CD2 3.94Å
37	R	96.7	Very high	96.3	Very high	211 Å²	211	98 Å²	98	80%	0.796	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-51.7	136.7	171.4	-174.8	-179.1	177.1	177	1.1	110.2	Y57	R37-Y57 WeakPolarHBondContact O-CB 3.38Å
38	P	96	Very high	96.3	Very high	94 Å²	94	96.8 Å²	96.8	61%	0.61	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-52	143.9	174.9	-27.8	35.2	0	0	0	112.4	S40	P38-S40 PolarHBondContact O-N 3.35Å
39	C	97.6	Very high	96.3	Very high	16 Å²	16	98.7 Å²	98.7	11%	0.108	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-63.5	128.3	-179.9	179.8	0	0	0	0	111.7	K41 Q43 C45 C55 Y57 C58	C39-K41 PolarHBondContact O-N 2.78Å; C39-K41 PolarHBondContact SG-N 2.8Å; C39-Q43 HydrophobicContact CB-CB 4.32Å; C39-Q43 HydrophobicContact CB-CG 4.11Å; C39-Q43 PolarHBondContact SG-N 2.97Å; C39-C45 PolarHBondContact SG-SG 3.28Å; C39-C55 VanDerWaalsContact SG-SG 3.61Å; C39-Y57 HydrophobicContact CB-CD1 3.76Å; C39-Y57 HydrophobicContact CB-CE1 4.44Å; C39-Y57 HydrophobicContact CB-CG 4.33Å; C39-C58 PolarHBondContact SG-SG 3.25Å
40	S	95.4	Very high	96.3	Very high	105 Å²	105	106 Å²	106	73%	0.734	52%	0.519	S	S	*	.	S	Bend	trans	-72.4	-8.6	176	-45.7	0	0	0	0	114.8	P38	P38-S40 PolarHBondContact O-N 3.35Å
41	K	94	Very high	96.3	Very high	140 Å²	140	104.9 Å²	104.9	61%	0.609	51%	0.514	S	S	*	.	S	Bend	trans	-121.6	56	-177	-58.6	-170.4	179.3	-163.3	0	111.1	C39 Q43 Q44	C39-K41 PolarHBondContact O-N 2.78Å; C39-K41 PolarHBondContact SG-N 2.8Å; K41-Q43 PolarHBondContact O-N 2.87Å; K41-Q44 PolarHBondContact O-N 3.43Å
42	N	94.4	Very high	96.5	Very high	133 Å²	133	100.7 Å²	100.7	71%	0.711	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	27.1	174.7	-60.9	-17.6	0	0	0	115.5	Q44	N42-Q44 WeakPolarHBondContact O-CG 3.23Å; N42-Q44 PolarHBondContact O-N 3.37Å
43	Q	94.7	Very high	96.5	Very high	82 Å²	82	100.1 Å²	100.1	38%	0.383	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	24.9	-177	-44.5	177.6	17.8	0	0	114.8	C39 K41 Y57 C58	C39-Q43 HydrophobicContact CB-CB 4.32Å; C39-Q43 HydrophobicContact CB-CG 4.11Å; C39-Q43 PolarHBondContact SG-N 2.97Å; K41-Q43 PolarHBondContact O-N 2.87Å; Q43-Y57 HydrophobicContact CB-CE1 3.93Å; Q43-Y57 HydrophobicContact CG-CD1 4.28Å; Q43-Y57 HydrophobicContact CG-CE1 3.54Å; Q43-Y57 PolarHBondContact NE2-OH 3.23Å; Q43-Y57 PolarHBondContact OE1-OH 3.41Å; Q43-C58 VanDerWaalsContact C-SG 3.56Å
44	Q	96	Very high	96.6	Very high	163 Å²	163	101 Å²	101	76%	0.762	49%	0.493	S	S	*	.			trans	-114.9	20.1	-176.1	-69.2	171.9	24.8	0	0	113	K41 N42 S46	K41-Q44 PolarHBondContact O-N 3.43Å; N42-Q44 WeakPolarHBondContact O-CG 3.23Å; N42-Q44 PolarHBondContact O-N 3.37Å; Q44-S46 PolarHBondContact O-N 3.38Å
45	C	97.4	Very high	96.7	Very high	30 Å²	30	99.3 Å²	99.3	20%	0.203	49%	0.486	C	S	.	.			trans	-62.3	128.5	177.5	-68	0	0	0	0	110.8	C39 C55 C58	C39-C45 PolarHBondContact SG-SG 3.28Å; C45-C55 HydrophobicContact CB-CB 3.92Å; C45-C58 HydrophobicContact CB-CB 3.79Å
46	S	97.1	Very high	96.8	Very high	74 Å²	74	95.2 Å²	95.2	52%	0.517	47%	0.466	S	S	.	.			trans	-63.8	135.3	169.2	60.9	0	0	0	0	110.5	Q44 N51	Q44-S46 PolarHBondContact O-N 3.38Å; S46-N51 PolarHBondContact O-ND2 2.82Å; S46-N51 PolarHBondContact O-OD1 2.84Å; S46-N51 VanDerWaalsContact O-OD1 3.08Å; S46-N51 PolarHBondContact OG-ND2 3.35Å; S46-N51 VanDerWaalsContact OG-ND2 3.11Å
47	V	98	Very high	96.8	Very high	20 Å²	20	96.9 Å²	96.9	12%	0.121	47%	0.473	C	S	.	.			trans	-111.1	95.6	179.1	-177.5	0	0	0	0	107.5	V4 C5 R52 C58 R59 K62	V4-V47 HydrophobicContact CG1-CG1 4.12Å; C5-V47 WeakPolarHBondContact CA-O 3.33Å; C5-V47 HydrophobicContact CB-CG1 4.08Å; V47-R52 HydrophobicContact CG1-CB 3.9Å; V47-C58 HydrophobicContact CG2-CB 4.44Å; V47-R59 HydrophobicContact CG1-CB 4.45Å; V47-R59 HydrophobicContact CG1-CG 4.1Å; V47-K62 HydrophobicContact CG2-CB 4.27Å
48	L	98.1	Very high	96.9	Very high	87 Å²	87	87.1 Å²	87.1	46%	0.455	44%	0.437	S	S	.	.			trans	-120	160.7	179	-58.7	173.9	0	0	0	109.5	C5 I50 N51 R52	C5-L48 CarbonylContact O-C 3.49Å; C5-L48 WeakPolarHBondContact O-CA 3.42Å; L48-I50 HydrophobicContact CB-CG1 4.24Å; L48-I50 PolarHBondContact O-N 3.35Å; L48-N51 WeakPolarHBondContact CA-OD1 3.46Å; L48-N51 WeakPolarHBondContact CB-OD1 3.47Å; L48-N51 PolarHBondContact N-OD1 3.43Å; L48-N51 PolarHBondContact O-N 3.46Å; L48-N51 PolarHBondContact O-OD1 2.94Å; L48-R52 WeakPolarHBondContact O-CA 3.29Å; L48-R52 VanDerWaalsContact O-CB 3.25Å; L48-R52 WeakPolarHBondContact O-CB 3.44Å; L48-R52 PolarHBondContact O-N 3.28Å
49	R	97.6	Very high	97	Very high	157 Å²	157	83.1 Å²	83.1	59%	0.592	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.3	-44	178.5	179.2	-178.8	167.8	142.2	-11.4	112.9	C5 D7	C5-R49 PolarHBondContact O-N 2.93Å; D7-R49 HydrophobicContact CB-CB 4.27Å; D7-R49 HydrophobicContact CB-CG 4.24Å; D7-R49 WeakPolarHBondContact OD1-CD 3.48Å; D7-R49 IonicContact OD1-CZ 3.46Å; D7-R49 IonicContact OD1-NE 3.53Å; D7-R49 IonicContact OD1-NH1 2.79Å; D7-R49 PolarHBondContact OD1-NH1 3.45Å
50	I	97.6	Very high	97.1	Very high	156 Å²	156	83.6 Å²	83.6	80%	0.8	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-29.5	-176.5	58.6	172	0	0	0	114.6	L48	L48-I50 HydrophobicContact CB-CG1 4.24Å; L48-I50 PolarHBondContact O-N 3.35Å
51	N	96.7	Very high	97.2	Very high	22 Å²	22	83.3 Å²	83.3	12%	0.118	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124	4	-169.9	71.9	4.5	0	0	0	113.7	S46 L48 N53 R54	S46-N51 PolarHBondContact O-ND2 2.82Å; S46-N51 PolarHBondContact O-OD1 2.84Å; S46-N51 VanDerWaalsContact O-OD1 3.08Å; S46-N51 PolarHBondContact OG-ND2 3.35Å; S46-N51 VanDerWaalsContact OG-ND2 3.11Å; L48-N51 WeakPolarHBondContact CA-OD1 3.46Å; L48-N51 WeakPolarHBondContact CB-OD1 3.47Å; L48-N51 PolarHBondContact N-OD1 3.43Å; L48-N51 PolarHBondContact O-N 3.46Å; L48-N51 PolarHBondContact O-OD1 2.94Å; N51-N53 PolarHBondContact O-N 3.32Å; N51-R54 WeakPolarHBondContact O-CB 3.47Å; N51-R54 PolarHBondContact O-N 3.47Å
52	R	97.5	Very high	97.4	Very high	43 Å²	43	81.2 Å²	81.2	16%	0.162	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-21.9	-176.8	62.4	-174.2	-176.4	-161.4	-4.7	114.4	C5 D7 C19 V47 L48 R59	C5-R52 HydrophobicContact CB-CB 4.37Å; C5-R52 PolarHBondContact SG-NH1 3.5Å; C5-R52 VanDerWaalsContact SG-NH1 3.36Å; D7-R52 IonicContact OD2-CZ 3.54Å; D7-R52 IonicContact OD2-NH1 3.55Å; D7-R52 PolarHBondContact OD2-NH1 3.24Å; D7-R52 IonicContact OD2-NH2 3.85Å; D7-R52 PolarHBondContact OD2-NH2 2.98Å; C19-R52 PolarHBondContact SG-NH1 2.87Å; V47-R52 HydrophobicContact CG1-CB 3.9Å; L48-R52 WeakPolarHBondContact O-CA 3.29Å; L48-R52 VanDerWaalsContact O-CB 3.25Å; L48-R52 WeakPolarHBondContact O-CB 3.44Å; L48-R52 PolarHBondContact O-N 3.28Å; R52-R59 WeakPolarHBondContact O-CD 3.31Å
53	N	97.3	Very high	97.6	Very high	122 Å²	122	74.9 Å²	74.9	65%	0.652	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-10	177.9	-64.8	-18.4	0	0	0	113.5	N51 C55 R59	N51-N53 PolarHBondContact O-N 3.32Å; N53-C55 PolarHBondContact O-N 2.89Å; N53-R59 PolarHBondContact OD1-NH1 3Å
54	R	97	Very high	97.7	Very high	188 Å²	188	75.7 Å²	75.7	71%	0.709	36%	0.359	S	S	*	.	S	Bend	trans	-68.3	-32.5	-175.2	-174.3	176.8	-73.7	163	-5.2	113.4	N51	N51-R54 WeakPolarHBondContact O-CB 3.47Å; N51-R54 PolarHBondContact O-N 3.47Å
55	C	98.2	Very high	97.7	Very high	21 Å²	21	71.7 Å²	71.7	14%	0.142	36%	0.355	C	S	.	.			trans	-142.3	99.8	178.9	-176.5	0	0	0	0	110.5	C39 C45 N53 Y57 C58 R59	C39-C55 VanDerWaalsContact SG-SG 3.61Å; C45-C55 HydrophobicContact CB-CB 3.92Å; N53-C55 PolarHBondContact O-N 2.89Å; C55-Y57 VanDerWaalsContact C-N 3.3Å; C55-Y57 PolarHBondContact O-N 3.05Å; C55-C58 HydrophobicContact CB-CB 4.21Å; C55-C58 PolarHBondContact O-N 2.82Å; C55-C58 PolarHBondContact SG-N 2.83Å; C55-R59 PolarHBondContact O-N 3.24Å
56	Q	98.3	Very high	97.7	Very high	101 Å²	101	72 Å²	72	47%	0.472	36%	0.355	S	S	.	.	H	α-helix	trans	-63.6	-37.1	-179.8	-64.8	174.2	-46.9	0	0	111.8	F25 Y36 R59 L60	F25-Q56 HydrophobicContact CE2-CB 4.1Å; F25-Q56 HydrophobicContact CE2-CG 4.17Å; F25-Q56 HydrophobicContact CZ-CB 4.23Å; F25-Q56 WeakPolarHBondContact CZ-O 3.35Å; Y36-Q56 HydrophobicContact CD1-CB 3.46Å; Y36-Q56 VanDerWaalsContact CD1-CB 3.46Å; Y36-Q56 HydrophobicContact CD1-CG 4.2Å; Y36-Q56 VanDerWaalsContact CD1-OE1 3.22Å; Y36-Q56 HydrophobicContact CD2-CB 3.98Å; Y36-Q56 HydrophobicContact CE1-CB 3.67Å; Y36-Q56 VanDerWaalsContact CE1-CD 3.45Å; Y36-Q56 HydrophobicContact CE1-CG 4.08Å; Y36-Q56 HydrophobicContact CE2-CB 4.14Å; Y36-Q56 HydrophobicContact CG-CB 3.64Å; Q56-R59 PolarHBondContact O-N 3.12Å; Q56-L60 PolarHBondContact O-N 3.4Å
57	Y	98.3	Very high	97.6	Very high	69 Å²	69	70.4 Å²	70.4	27%	0.271	35%	0.35	S	S	.	.	H	α-helix	trans	-56.2	-54	175	-179.3	-84	0	0	0	111.9	R37 C39 Q43 C55 R59 L60 K61	R37-Y57 WeakPolarHBondContact O-CB 3.38Å; C39-Y57 HydrophobicContact CB-CD1 3.76Å; C39-Y57 HydrophobicContact CB-CE1 4.44Å; C39-Y57 HydrophobicContact CB-CG 4.33Å; Q43-Y57 HydrophobicContact CB-CE1 3.93Å; Q43-Y57 HydrophobicContact CG-CD1 4.28Å; Q43-Y57 HydrophobicContact CG-CE1 3.54Å; Q43-Y57 PolarHBondContact NE2-OH 3.23Å; Q43-Y57 PolarHBondContact OE1-OH 3.41Å; C55-Y57 VanDerWaalsContact C-N 3.3Å; C55-Y57 PolarHBondContact O-N 3.05Å; Y57-R59 VanDerWaalsContact C-N 3.3Å; Y57-R59 PolarHBondContact O-N 3.17Å; Y57-L60 PolarHBondContact O-N 2.97Å; Y57-K61 HydrophobicContact CE1-CD 4.21Å; Y57-K61 WeakPolarHBondContact O-CB 3.23Å; Y57-K61 PolarHBondContact O-N 2.9Å
58	C	98.5	Very high	97.5	Very high	7 Å²	7	69.7 Å²	69.7	5%	0.047	35%	0.346	C	S	.	.	H	α-helix	trans	-66.6	-34	179.8	-68	0	0	0	0	112	C39 Q43 C45 V47 C55 K62	C39-C58 PolarHBondContact SG-SG 3.25Å; Q43-C58 VanDerWaalsContact C-SG 3.56Å; C45-C58 HydrophobicContact CB-CB 3.79Å; V47-C58 HydrophobicContact CG2-CB 4.44Å; C55-C58 HydrophobicContact CB-CB 4.21Å; C55-C58 PolarHBondContact O-N 2.82Å; C55-C58 PolarHBondContact SG-N 2.83Å; C58-K62 WeakPolarHBondContact O-CB 3.48Å; C58-K62 PolarHBondContact O-N 3.24Å
59	R	98.6	Very high	97.2	Very high	10 Å²	10	67.6 Å²	67.6	4%	0.038	34%	0.339	C	S	.	.	H	α-helix	trans	-63.2	-46.4	175.1	-171.3	-174.4	-173.6	165.8	-1.9	111.8	G21 C22 F25 V47 R52 N53 C55 Q56 Y57 K62 C63	G21-R59 PolarHBondContact O-NH2 2.87Å; C22-R59 PolarHBondContact SG-NH2 3.42Å; F25-R59 HydrophobicContact CD1-CG 3.81Å; F25-R59 HydrophobicContact CE1-CB 3.85Å; F25-R59 HydrophobicContact CE1-CG 3.56Å; F25-R59 HydrophobicContact CG-CG 4.48Å; F25-R59 HydrophobicContact CZ-CB 3.95Å; F25-R59 HydrophobicContact CZ-CG 4.05Å; V47-R59 HydrophobicContact CG1-CB 4.45Å; V47-R59 HydrophobicContact CG1-CG 4.1Å; R52-R59 WeakPolarHBondContact O-CD 3.31Å; N53-R59 PolarHBondContact OD1-NH1 3Å; C55-R59 PolarHBondContact O-N 3.24Å; Q56-R59 PolarHBondContact O-N 3.12Å; Y57-R59 VanDerWaalsContact C-N 3.3Å; Y57-R59 PolarHBondContact O-N 3.17Å; R59-K62 PolarHBondContact O-N 2.82Å; R59-C63 PolarHBondContact O-N 3.37Å; R59-C63 PolarHBondContact O-SG 2.86Å; R59-C63 VanDerWaalsContact O-SG 3.32Å
60	L	98.3	Very high	96.7	Very high	26 Å²	26	67.1 Å²	67.1	14%	0.136	34%	0.337	C	S	.	.	H	α-helix	trans	-66.4	-43.7	177.8	-177.5	61.1	0	0	0	111.2	F25 F26 Y36 Q56 Y57 K62 C63 I64	F25-L60 HydrophobicContact CE1-CB 3.87Å; F25-L60 HydrophobicContact CE1-CD1 4.36Å; F25-L60 HydrophobicContact CZ-CB 4.01Å; F26-L60 HydrophobicContact CD2-CD1 4.07Å; F26-L60 HydrophobicContact CE2-CD1 4.42Å; Y36-L60 HydrophobicContact CD2-CB 4.19Å; Y36-L60 HydrophobicContact CD2-CD2 3.91Å; Y36-L60 HydrophobicContact CE2-CB 4.19Å; Y36-L60 HydrophobicContact CE2-CD2 3.94Å; Q56-L60 PolarHBondContact O-N 3.4Å; Y57-L60 PolarHBondContact O-N 2.97Å; L60-K62 VanDerWaalsContact C-N 3.28Å; L60-K62 PolarHBondContact O-N 2.51Å; L60-C63 WeakPolarHBondContact O-CB 3.17Å; L60-C63 PolarHBondContact O-N 2.96Å; L60-C63 VanDerWaalsContact O-N 3.14Å; L60-I64 HydrophobicContact CD1-CD1 4.46Å; L60-I64 HydrophobicContact CG-CD1 4.23Å; L60-I64 PolarHBondContact O-N 3.04Å
61	K	97.5	Very high	95.9	Very high	99 Å²	99	64.4 Å²	64.4	43%	0.43	32%	0.324	S	S	.	.	H	α-helix	trans	-55.1	-44.9	173.4	-174.2	177.8	-179	178.7	0	111.3	Y57 I64 A65	Y57-K61 HydrophobicContact CE1-CD 4.21Å; Y57-K61 WeakPolarHBondContact O-CB 3.23Å; Y57-K61 PolarHBondContact O-N 2.9Å; K61-I64 PolarHBondContact O-N 2.8Å; K61-A65 VanDerWaalsContact O-CB 3.28Å; K61-A65 WeakPolarHBondContact O-CB 3.48Å; K61-A65 PolarHBondContact O-N 3.37Å
62	K	98.2	Very high	94.6	Very high	96 Å²	96	63.5 Å²	63.5	42%	0.417	32%	0.32	S	S	.	.	H	α-helix	trans	-66.2	-40.1	176.9	-172.3	63.3	174.7	-179.7	0	112.3	V4 V47 C58 R59 L60 I64 A65 V66	V4-K62 HydrophobicContact CG1-CB 4.46Å; V4-K62 HydrophobicContact CG1-CG 4.19Å; V47-K62 HydrophobicContact CG2-CB 4.27Å; C58-K62 WeakPolarHBondContact O-CB 3.48Å; C58-K62 PolarHBondContact O-N 3.24Å; R59-K62 PolarHBondContact O-N 2.82Å; L60-K62 VanDerWaalsContact C-N 3.28Å; L60-K62 PolarHBondContact O-N 2.51Å; K62-I64 PolarHBondContact O-N 3.37Å; K62-A65 PolarHBondContact O-N 3Å; K62-V66 HydrophobicContact CD-CG1 4.21Å; K62-V66 HydrophobicContact CG-CG1 4.46Å; K62-V66 WeakPolarHBondContact O-CG1 3.31Å; K62-V66 WeakPolarHBondContact O-CG2 3.4Å; K62-V66 PolarHBondContact O-N 2.94Å
63	C	98.2	Very high	92.9	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-54.5	-51.2	173.6	-74.3	0	0	0	0	111.4	F26 R59 L60 V66 M68	F26-C63 HydrophobicContact CD2-CB 3.68Å; F26-C63 HydrophobicContact CE2-CB 4.23Å; R59-C63 PolarHBondContact O-N 3.37Å; R59-C63 PolarHBondContact O-SG 2.86Å; R59-C63 VanDerWaalsContact O-SG 3.32Å; L60-C63 WeakPolarHBondContact O-CB 3.17Å; L60-C63 PolarHBondContact O-N 2.96Å; L60-C63 VanDerWaalsContact O-N 3.14Å; C63-V66 WeakPolarHBondContact O-CG2 3.31Å; C63-V66 PolarHBondContact O-N 2.84Å; C63-M68 HydrophobicContact CB-CB 4.2Å; C63-M68 HydrophobicContact CB-CG 4.23Å; C63-M68 HydrophobicContact CB-SD 3.59Å; C63-M68 VanDerWaalsContact CB-SD 3.59Å; C63-M68 WeakPolarHBondContact O-CB 3.47Å; C63-M68 WeakPolarHBondContact O-CG 2.94Å; C63-M68 PolarHBondContact O-N 3.3Å
64	I	96.7	Very high	91.2	Very high	98 Å²	98	63.9 Å²	63.9	50%	0.503	32%	0.323	S	S	.	.	H	α-helix	trans	-64.6	-44.9	179.5	-62.5	166.1	0	0	0	110.3	F26 L60 K61 K62 V66 G67	F26-I64 HydrophobicContact CE2-CG1 4.33Å; L60-I64 HydrophobicContact CD1-CD1 4.46Å; L60-I64 HydrophobicContact CG-CD1 4.23Å; L60-I64 PolarHBondContact O-N 3.04Å; K61-I64 PolarHBondContact O-N 2.8Å; K62-I64 PolarHBondContact O-N 3.37Å; I64-V66 VanDerWaalsContact C-N 3.27Å; I64-V66 PolarHBondContact O-N 2.94Å; I64-G67 WeakPolarHBondContact O-CA 3.24Å; I64-G67 PolarHBondContact O-N 3.1Å
65	A	96.8	Very high	89.4	Confident	80 Å²	80	59.9 Å²	59.9	66%	0.661	31%	0.314	S	S	*	.	H	α-helix	trans	-62.7	-28.3	-178.9	0	0	0	0	0	114.2	K61 K62 G67	K61-A65 VanDerWaalsContact O-CB 3.28Å; K61-A65 WeakPolarHBondContact O-CB 3.48Å; K61-A65 PolarHBondContact O-N 3.37Å; K62-A65 PolarHBondContact O-N 3Å; A65-G67 VanDerWaalsContact C-N 3.27Å
66	V	96.7	Very high	87.5	Confident	36 Å²	36	60.4 Å²	60.4	22%	0.218	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-2.6	173.9	-59.7	0	0	0	0	113.2	Q3 V4 V16 K62 C63 I64 M68	Q3-V66 HydrophobicContact CB-CB 4.43Å; Q3-V66 HydrophobicContact CB-CG1 4.47Å; V4-V66 HydrophobicContact CG2-CG2 3.71Å; V16-V66 HydrophobicContact CG1-CG2 4.21Å; V16-V66 WeakPolarHBondContact CG1-O 3.15Å; V16-V66 HydrophobicContact CG2-CG2 4.34Å; K62-V66 HydrophobicContact CD-CG1 4.21Å; K62-V66 HydrophobicContact CG-CG1 4.46Å; K62-V66 WeakPolarHBondContact O-CG1 3.31Å; K62-V66 WeakPolarHBondContact O-CG2 3.4Å; K62-V66 PolarHBondContact O-N 2.94Å; C63-V66 WeakPolarHBondContact O-CG2 3.31Å; C63-V66 PolarHBondContact O-N 2.84Å; I64-V66 VanDerWaalsContact C-N 3.27Å; I64-V66 PolarHBondContact O-N 2.94Å; V66-M68 HydrophobicContact CG2-CG 4.3Å
67	G	95.4	Very high	85.6	Confident	40 Å²	40	60 Å²	60	41%	0.412	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.2	17.2	179.4	0	0	0	0	0	115.1	I64 A65 S69	I64-G67 WeakPolarHBondContact O-CA 3.24Å; I64-G67 PolarHBondContact O-N 3.1Å; A65-G67 VanDerWaalsContact C-N 3.27Å; G67-S69 PolarHBondContact O-N 3.42Å
68	M	96.1	Very high	83.7	Confident	6 Å²	6	60.3 Å²	60.3	3%	0.03	33%	0.326	C	S	.	.			trans	-67.9	120.9	171.6	-70	-171.8	156.7	0	0	110.7	V4 Y14 V16 A18 C22 F26 C63 V66	V4-M68 HydrophobicContact CG2-CE 3.86Å; V4-M68 HydrophobicContact CG2-SD 4.08Å; Y14-M68 CarbonylContact O-C 3.55Å; Y14-M68 VanDerWaalsContact O-CA 3.24Å; Y14-M68 WeakPolarHBondContact O-CA 3.27Å; V16-M68 HydrophobicContact CB-CG 4.46Å; V16-M68 HydrophobicContact CG1-CG 4.22Å; V16-M68 HydrophobicContact CG2-CE 3.34Å; V16-M68 HydrophobicContact CG2-CG 3.38Å; V16-M68 HydrophobicContact CG2-SD 4.21Å; A18-M68 HydrophobicContact CB-CE 3.28Å; C22-M68 HydrophobicContact CB-CE 4.41Å; F26-M68 HydrophobicContact CB-SD 3.92Å; F26-M68 HydrophobicContact CD1-CB 4.31Å; F26-M68 HydrophobicContact CD1-SD 4.49Å; F26-M68 HydrophobicContact CD2-CB 3.82Å; F26-M68 HydrophobicContact CD2-SD 3.99Å; F26-M68 HydrophobicContact CE1-CB 4.06Å; F26-M68 HydrophobicContact CE2-CB 3.54Å; F26-M68 HydrophobicContact CG-CB 4.2Å; F26-M68 HydrophobicContact CG-SD 3.88Å; F26-M68 HydrophobicContact CZ-CB 3.66Å; F26-M68 VanDerWaalsContact CZ-O 3.25Å; F26-M68 WeakPolarHBondContact CZ-O 3.34Å; C63-M68 HydrophobicContact CB-CB 4.2Å; C63-M68 HydrophobicContact CB-CG 4.23Å; C63-M68 HydrophobicContact CB-SD 3.59Å; C63-M68 VanDerWaalsContact CB-SD 3.59Å; C63-M68 WeakPolarHBondContact O-CB 3.47Å; C63-M68 WeakPolarHBondContact O-CG 2.94Å; C63-M68 PolarHBondContact O-N 3.3Å; V66-M68 HydrophobicContact CG2-CG 4.3Å
69	S	92.9	Very high	81.7	Confident	43 Å²	43	64.3 Å²	64.3	30%	0.301	35%	0.346	S	S	.	.			trans	-138.6	155.6	177.7	66.7	0	0	0	0	111.6	Y14 G67 D71 G72	Y14-S69 WeakPolarHBondContact CB-O 3.29Å; Y14-S69 PolarHBondContact O-N 3.24Å; G67-S69 PolarHBondContact O-N 3.42Å; S69-D71 PolarHBondContact O-N 3.44Å; S69-G72 PolarHBondContact O-N 3.49Å; S69-G72 VanDerWaalsContact OG-CA 3.31Å; S69-G72 WeakPolarHBondContact OG-CA 3.2Å; S69-G72 PolarHBondContact OG-N 3.4Å
70	R	87.1	Confident	79.7	Confident	147 Å²	147	70.4 Å²	70.4	56%	0.555	37%	0.369	S	S	*	.	S	Bend	trans	-61.7	-39	174.2	-170.9	-178	-68.4	-179.9	-3.1	110.3	I30 G72	I30-R70 VanDerWaalsContact CG2-NH2 3.26Å; I30-R70 PolarHBondContact O-NH2 2.8Å; I30-R70 VanDerWaalsContact O-NH2 3.15Å; R70-G72 VanDerWaalsContact C-N 3.34Å
71	D	80.6	Confident	77.5	Confident	98 Å²	98	72.7 Å²	72.7	52%	0.524	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-17.2	-178.4	-47.6	-48.4	0	0	0	112.8	S69 M73 I74 I75	S69-D71 PolarHBondContact O-N 3.44Å; D71-M73 PolarHBondContact O-N 2.84Å; D71-M73 VanDerWaalsContact O-N 3.12Å; D71-I74 WeakPolarHBondContact O-CA 3.43Å; D71-I74 VanDerWaalsContact O-CB 3.32Å; D71-I74 WeakPolarHBondContact O-CB 3.46Å; D71-I74 PolarHBondContact O-N 3.35Å; D71-I75 PolarHBondContact O-N 2.98Å
72	G	67.6	Low	75.3	Confident	4 Å²	4	75.2 Å²	75.2	4%	0.041	39%	0.394	C	S	.	.	H	α-helix	trans	-62.4	-20	177.7	0	0	0	0	0	113.5	S69 R70 N76	S69-G72 PolarHBondContact O-N 3.49Å; S69-G72 VanDerWaalsContact OG-CA 3.31Å; S69-G72 WeakPolarHBondContact OG-CA 3.2Å; S69-G72 PolarHBondContact OG-N 3.4Å; R70-G72 VanDerWaalsContact C-N 3.34Å; G72-N76 PolarHBondContact O-N 3.05Å
73	M	61.7	Low	73.2	Confident	76 Å²	76	74.5 Å²	74.5	37%	0.374	40%	0.398	S	S	.	.	H	α-helix	trans	-67.7	-41.6	167.4	-74.7	-172.4	160.9	0	0	111.8	Y14 D71 N76 T77	Y14-M73 HydrophobicContact CD1-CE 3.52Å; Y14-M73 HydrophobicContact CD1-CG 3.88Å; Y14-M73 HydrophobicContact CD1-SD 3.79Å; Y14-M73 HydrophobicContact CD2-CE 4.11Å; Y14-M73 HydrophobicContact CE1-CE 3.17Å; Y14-M73 HydrophobicContact CE1-CG 4.28Å; Y14-M73 HydrophobicContact CE1-SD 3.56Å; Y14-M73 VanDerWaalsContact CE1-SD 3.56Å; Y14-M73 HydrophobicContact CE2-CE 3.81Å; Y14-M73 HydrophobicContact CG-CE 3.97Å; Y14-M73 HydrophobicContact CG-CG 4.49Å; D71-M73 PolarHBondContact O-N 2.84Å; D71-M73 VanDerWaalsContact O-N 3.12Å; M73-N76 PolarHBondContact O-N 3.35Å; M73-T77 PolarHBondContact O-N 3.47Å; M73-T77 PolarHBondContact O-OG1 3.47Å
74	I	61.7	Low	70.9	Confident	97 Å²	97	81.2 Å²	81.2	50%	0.497	43%	0.434	S	S	.	.	H	α-helix	trans	-65.8	-44	-179.2	-58.5	173.5	0	0	0	109.8	D71 N76 T77 I78	D71-I74 WeakPolarHBondContact O-CA 3.43Å; D71-I74 VanDerWaalsContact O-CB 3.32Å; D71-I74 WeakPolarHBondContact O-CB 3.46Å; D71-I74 PolarHBondContact O-N 3.35Å; I74-N76 PolarHBondContact O-N 3.46Å; I74-T77 PolarHBondContact O-N 2.94Å; I74-I78 HydrophobicContact CG2-CD1 3.6Å; I74-I78 HydrophobicContact CG2-CG1 4.22Å; I74-I78 VanDerWaalsContact O-CG1 3.31Å; I74-I78 WeakPolarHBondContact O-CG1 3.21Å; I74-I78 PolarHBondContact O-N 3.45Å
75	I	59.3	Low	68.7	Low	103 Å²	103	80 Å²	80	53%	0.528	44%	0.438	S	S	.	.	H	α-helix	trans	-59	-47.9	178.3	-62.7	173.5	0	0	0	110.4	D71 T77 I78 L79	D71-I75 PolarHBondContact O-N 2.98Å; I75-T77 PolarHBondContact O-N 3.33Å; I75-I78 PolarHBondContact O-N 2.9Å; I75-L79 HydrophobicContact CG2-CD1 3.64Å; I75-L79 HydrophobicContact CG2-CG 4.11Å; I75-L79 VanDerWaalsContact O-CB 3.25Å; I75-L79 WeakPolarHBondContact O-CB 3.45Å; I75-L79 WeakPolarHBondContact O-CG 3.12Å; I75-L79 PolarHBondContact O-N 3.45Å
76	N	58.1	Low	66.4	Low	32 Å²	32	78.2 Å²	78.2	17%	0.171	42%	0.418	C	S	.	.	H	α-helix	trans	-69.8	-31.6	179	179.3	50.5	0	0	0	112.8	F12 G72 M73 I74 R80	F12-N76 HydrophobicContact CD1-CB 3.73Å; F12-N76 VanDerWaalsContact CD1-CG 3.49Å; F12-N76 WeakPolarHBondContact CD1-ND2 3.36Å; F12-N76 HydrophobicContact CE1-CB 3.68Å; G72-N76 PolarHBondContact O-N 3.05Å; M73-N76 PolarHBondContact O-N 3.35Å; I74-N76 PolarHBondContact O-N 3.46Å; N76-R80 PolarHBondContact ND2-NE 3.25Å; N76-R80 VanDerWaalsContact ND2-NE 3.12Å; N76-R80 WeakPolarHBondContact O-CB 3.37Å; N76-R80 WeakPolarHBondContact O-CG 3.28Å; N76-R80 PolarHBondContact O-N 3.26Å; N76-R80 WeakPolarHBondContact OD1-CD 3.28Å; N76-R80 PolarHBondContact OD1-NE 2.93Å
77	T	58.5	Low	64.1	Low	93 Å²	93	81.5 Å²	81.5	57%	0.571	44%	0.44	S	S	*	.	H	α-helix	trans	-65.6	-45.8	173.4	-59.9	0	0	0	0	111.2	M73 I74 I75 R80 S81	M73-T77 PolarHBondContact O-N 3.47Å; M73-T77 PolarHBondContact O-OG1 3.47Å; I74-T77 PolarHBondContact O-N 2.94Å; I75-T77 PolarHBondContact O-N 3.33Å; T77-R80 PolarHBondContact O-N 3.27Å; T77-S81 WeakPolarHBondContact O-CB 3.31Å; T77-S81 PolarHBondContact O-N 3.15Å
78	I	58.2	Low	61.7	Low	76 Å²	76	87 Å²	87	39%	0.39	45%	0.454	S	S	.	.	H	α-helix	trans	-66.7	-42.2	176.7	-64.5	170.5	0	0	0	110.5	I74 I75 R80 S81 R82	I74-I78 HydrophobicContact CG2-CD1 3.6Å; I74-I78 HydrophobicContact CG2-CG1 4.22Å; I74-I78 VanDerWaalsContact O-CG1 3.31Å; I74-I78 WeakPolarHBondContact O-CG1 3.21Å; I74-I78 PolarHBondContact O-N 3.45Å; I75-I78 PolarHBondContact O-N 2.9Å; I78-R80 VanDerWaalsContact C-N 3.34Å; I78-S81 PolarHBondContact O-OG 2.84Å; I78-S81 VanDerWaalsContact O-OG 3.07Å; I78-R82 HydrophobicContact CG2-CG 4.41Å; I78-R82 WeakPolarHBondContact O-CB 3.33Å; I78-R82 WeakPolarHBondContact O-CG 3.27Å; I78-R82 PolarHBondContact O-N 3.45Å
79	L	58.2	Low	59.3	Low	91 Å²	91	91.6 Å²	91.6	48%	0.476	48%	0.479	S	S	.	.	H	α-helix	trans	-67.7	-34.2	176.4	-70.9	177.5	0	0	0	111.4	I75 R82 T83	I75-L79 HydrophobicContact CG2-CD1 3.64Å; I75-L79 HydrophobicContact CG2-CG 4.11Å; I75-L79 VanDerWaalsContact O-CB 3.25Å; I75-L79 WeakPolarHBondContact O-CB 3.45Å; I75-L79 WeakPolarHBondContact O-CG 3.12Å; I75-L79 PolarHBondContact O-N 3.45Å; L79-R82 CarbonylContact O-C 3.56Å; L79-T83 WeakPolarHBondContact O-CB 3.26Å; L79-T83 WeakPolarHBondContact O-CG2 3.38Å; L79-T83 PolarHBondContact O-N 2.91Å; L79-T83 PolarHBondContact O-OG1 3.42Å; L79-T83 VanDerWaalsContact O-OG1 3.14Å
80	R	56.6	Low	57	Low	138 Å²	138	94.1 Å²	94.1	52%	0.521	50%	0.502	S	S	.	.	H	α-helix	trans	-72.6	-42.3	175.8	-79.2	174.4	180	-111	-2.5	112.8	N76 T77 I78 R82 T83 N84	N76-R80 PolarHBondContact ND2-NE 3.25Å; N76-R80 VanDerWaalsContact ND2-NE 3.12Å; N76-R80 WeakPolarHBondContact O-CB 3.37Å; N76-R80 WeakPolarHBondContact O-CG 3.28Å; N76-R80 PolarHBondContact O-N 3.26Å; N76-R80 WeakPolarHBondContact OD1-CD 3.28Å; N76-R80 PolarHBondContact OD1-NE 2.93Å; T77-R80 PolarHBondContact O-N 3.27Å; I78-R80 VanDerWaalsContact C-N 3.34Å; R80-R82 PolarHBondContact O-N 3.19Å; R80-T83 VanDerWaalsContact CA-OG1 3.27Å; R80-T83 WeakPolarHBondContact CA-OG1 3.33Å; R80-T83 PolarHBondContact O-N 3.31Å; R80-T83 PolarHBondContact O-OG1 2.88Å; R80-T83 VanDerWaalsContact O-OG1 3.06Å; R80-N84 PolarHBondContact O-N 3.4Å; R80-N84 VanDerWaalsContact O-N 3.11Å; R80-N84 PolarHBondContact O-ND2 3.5Å
81	S	51.3	Low	55	Low	74 Å²	74	90.5 Å²	90.5	52%	0.517	50%	0.504	S	S	.	.	H	α-helix	trans	-63.2	-38.2	174.2	79.3	0	0	0	0	110.2	T77 I78 A85	T77-S81 WeakPolarHBondContact O-CB 3.31Å; T77-S81 PolarHBondContact O-N 3.15Å; I78-S81 PolarHBondContact O-OG 2.84Å; I78-S81 VanDerWaalsContact O-OG 3.07Å; S81-A85 PolarHBondContact O-N 3.49Å
82	R	52	Low	53.3	Low	151 Å²	151	89 Å²	89	57%	0.57	50%	0.498	S	S	*	.	H	α-helix	trans	-69.6	-47.4	172	-70.1	-179	-180	-166.5	0.2	110.9	I78 L79 R80 N84 A85 L86	I78-R82 HydrophobicContact CG2-CG 4.41Å; I78-R82 WeakPolarHBondContact O-CB 3.33Å; I78-R82 WeakPolarHBondContact O-CG 3.27Å; I78-R82 PolarHBondContact O-N 3.45Å; L79-R82 CarbonylContact O-C 3.56Å; R80-R82 PolarHBondContact O-N 3.19Å; R82-N84 PolarHBondContact O-N 2.83Å; R82-N84 VanDerWaalsContact O-N 3.14Å; R82-A85 CarbonylContact O-C 3.2Å; R82-A85 VanDerWaalsContact O-CA 3.3Å; R82-A85 WeakPolarHBondContact O-CA 3.24Å; R82-A85 PolarHBondContact O-N 2.93Å; R82-L86 VanDerWaalsContact C-CD1 3.41Å; R82-L86 HydrophobicContact CB-CD1 3.4Å; R82-L86 VanDerWaalsContact CB-CD1 3.4Å; R82-L86 HydrophobicContact CB-CG 3.83Å; R82-L86 WeakPolarHBondContact O-CA 3.38Å; R82-L86 WeakPolarHBondContact O-CB 3.27Å; R82-L86 WeakPolarHBondContact O-CD1 3.47Å; R82-L86 WeakPolarHBondContact O-CG 3.27Å; R82-L86 PolarHBondContact O-N 3.49Å
83	T	52.9	Low	52.2	Low	81 Å²	81	95.6 Å²	95.6	50%	0.497	53%	0.532	S	S	.	.	H	α-helix	trans	-59.1	-32.6	-176.7	52.4	0	0	0	0	112.8	L79 R80 A85 L86	L79-T83 WeakPolarHBondContact O-CB 3.26Å; L79-T83 WeakPolarHBondContact O-CG2 3.38Å; L79-T83 PolarHBondContact O-N 2.91Å; L79-T83 PolarHBondContact O-OG1 3.42Å; L79-T83 VanDerWaalsContact O-OG1 3.14Å; R80-T83 VanDerWaalsContact CA-OG1 3.27Å; R80-T83 WeakPolarHBondContact CA-OG1 3.33Å; R80-T83 PolarHBondContact O-N 3.31Å; R80-T83 PolarHBondContact O-OG1 2.88Å; R80-T83 VanDerWaalsContact O-OG1 3.06Å; T83-A85 VanDerWaalsContact C-N 3.34Å; T83-L86 PolarHBondContact O-N 3.03Å
84	N	50	Low	51.6	Low	141 Å²	141	97.1 Å²	97.1	75%	0.754	54%	0.537	S	S	*	.	H	α-helix	trans	-77.2	-18.7	174.2	-65	-19.4	0	0	0	113.3	R80 R82	R80-N84 PolarHBondContact O-N 3.4Å; R80-N84 VanDerWaalsContact O-N 3.11Å; R80-N84 PolarHBondContact O-ND2 3.5Å; R82-N84 PolarHBondContact O-N 2.83Å; R82-N84 VanDerWaalsContact O-N 3.14Å
85	A	50	Low	50.8	Low	72 Å²	72	97.8 Å²	97.8	60%	0.595	54%	0.541	S	S	*	.	H	α-helix	trans	-103.1	-1.2	170.8	0	0	0	0	0	113.5	S81 R82 T83	S81-A85 PolarHBondContact O-N 3.49Å; R82-A85 CarbonylContact O-C 3.2Å; R82-A85 VanDerWaalsContact O-CA 3.3Å; R82-A85 WeakPolarHBondContact O-CA 3.24Å; R82-A85 PolarHBondContact O-N 2.93Å; T83-A85 VanDerWaalsContact C-N 3.34Å
86	L	50.5	Low	50.3	Low	43 Å²	43	97.3 Å²	97.3	23%	0.225	55%	0.546	C	S	.	.			trans	-106.8	11.6	-170.2	-83.7	175.1	0	0	0	116.2	R82 T83 H88 L89 A90	R82-L86 VanDerWaalsContact C-CD1 3.41Å; R82-L86 HydrophobicContact CB-CD1 3.4Å; R82-L86 VanDerWaalsContact CB-CD1 3.4Å; R82-L86 HydrophobicContact CB-CG 3.83Å; R82-L86 WeakPolarHBondContact O-CA 3.38Å; R82-L86 WeakPolarHBondContact O-CB 3.27Å; R82-L86 WeakPolarHBondContact O-CD1 3.47Å; R82-L86 WeakPolarHBondContact O-CG 3.27Å; R82-L86 PolarHBondContact O-N 3.49Å; T83-L86 PolarHBondContact O-N 3.03Å; L86-H88 PolarHBondContact O-N 3.44Å; L86-H88 VanDerWaalsContact O-N 3.1Å; L86-L89 HydrophobicContact CD2-CB 3.2Å; L86-L89 HydrophobicContact CD2-CD1 3.15Å; L86-L89 HydrophobicContact CD2-CG 3.4Å; L86-L89 VanDerWaalsContact CD2-CG 3.4Å; L86-L89 HydrophobicContact CG-CD1 4.29Å; L86-L89 PolarHBondContact O-N 3.32Å; L86-A90 PolarHBondContact O-N 2.84Å; L86-A90 VanDerWaalsContact O-N 3.13Å
87	P	47.1	Very low	50.3	Low	106 Å²	106	99.6 Å²	99.6	69%	0.688	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-19.1	163.2	25.7	-28.5	0	0	0	110.6
88	H	46.1	Very low	50.1	Low	154 Å²	154	99.8 Å²	99.8	71%	0.713	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-22.3	176.6	-128.5	-65.5	0	0	0	116	L86	L86-H88 PolarHBondContact O-N 3.44Å; L86-H88 VanDerWaalsContact O-N 3.1Å
89	L	45	Very low	50	Low	104 Å²	104	99.1 Å²	99.1	55%	0.545	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.2	-6.3	174.1	-34.9	162	0	0	0	114.1	L86 A91 V92	L86-L89 HydrophobicContact CD2-CB 3.2Å; L86-L89 HydrophobicContact CD2-CD1 3.15Å; L86-L89 HydrophobicContact CD2-CG 3.4Å; L86-L89 VanDerWaalsContact CD2-CG 3.4Å; L86-L89 HydrophobicContact CG-CD1 4.29Å; L86-L89 PolarHBondContact O-N 3.32Å; L89-A91 PolarHBondContact O-N 3.19Å; L89-V92 HydrophobicContact CB-CG1 4.46Å; L89-V92 HydrophobicContact CB-CG2 3.71Å; L89-V92 HydrophobicContact CD2-CG1 3.74Å; L89-V92 HydrophobicContact CD2-CG2 4.06Å; L89-V92 VanDerWaalsContact O-CG2 3.31Å; L89-V92 WeakPolarHBondContact O-CG2 3.47Å
90	A	45.2	Very low	50	Low	95 Å²	95	99.2 Å²	99.2	79%	0.785	56%	0.558	S	S	*	*	S	Bend	trans	-68.9	-19.1	159.3	0	0	0	0	0	111.6	L86	L86-A90 PolarHBondContact O-N 2.84Å; L86-A90 VanDerWaalsContact O-N 3.13Å
91	A	45.4	Very low	49.9	Very low	72 Å²	72	96.1 Å²	96.1	60%	0.595	56%	0.557	S	S	*	*	S	Bend	trans	-103.7	0.5	176.4	0	0	0	0	0	114.1	L89 N93	L89-A91 PolarHBondContact O-N 3.19Å; A91-N93 PolarHBondContact O-N 2.97Å; A91-N93 VanDerWaalsContact O-N 3.11Å
92	V	44.7	Very low	50.4	Low	65 Å²	65	98.7 Å²	98.7	39%	0.394	56%	0.559	S	S	.	*			trans	-74.9	107.9	168.9	-67.8	0	0	0	0	108.3	L89 F94	L89-V92 HydrophobicContact CB-CG1 4.46Å; L89-V92 HydrophobicContact CB-CG2 3.71Å; L89-V92 HydrophobicContact CD2-CG1 3.74Å; L89-V92 HydrophobicContact CD2-CG2 4.06Å; L89-V92 VanDerWaalsContact O-CG2 3.31Å; L89-V92 WeakPolarHBondContact O-CG2 3.47Å; V92-F94 HydrophobicContact CG2-CD2 4.35Å; V92-F94 PolarHBondContact O-N 3.14Å
93	N	44.1	Very low	51	Low	143 Å²	143	94 Å²	94	77%	0.765	55%	0.545	S	S	*	.			trans	-54.5	111.9	156.1	-76.2	-35	0	0	0	106.6	A91 D95	A91-N93 PolarHBondContact O-N 2.97Å; A91-N93 VanDerWaalsContact O-N 3.11Å; N93-D95 PolarHBondContact O-N 3.38Å
94	F	48.1	Very low	51.7	Low	109 Å²	109	97.4 Å²	97.4	48%	0.478	55%	0.55	S	S	.	.			trans	-70.7	85.3	168.4	-116.9	-92.5	0	0	0	106.2	V92 M98 L99 F102	V92-F94 HydrophobicContact CG2-CD2 4.35Å; V92-F94 PolarHBondContact O-N 3.14Å; F94-M98 HydrophobicContact CD1-CB 3.8Å; F94-M98 HydrophobicContact CE1-CB 3.86Å; F94-L99 HydrophobicContact CD1-CB 4.25Å; F94-L99 HydrophobicContact CD1-CD1 3.6Å; F94-L99 HydrophobicContact CE1-CD1 4Å; F94-L99 HydrophobicContact CG-CD1 4.42Å; F94-F102 AromaticContact CE1-CD2 3.79Å; F94-F102 HydrophobicContact CE1-CD2 3.79Å; F94-F102 HydrophobicContact CE1-CE2 4.12Å; F94-F102 AromaticContact CZ-CD2 3.89Å; F94-F102 HydrophobicContact CZ-CD2 3.89Å; F94-F102 AromaticContact CZ-CE2 3.75Å; F94-F102 HydrophobicContact CZ-CE2 3.75Å
95	D	44.7	Very low	52.4	Low	111 Å²	111	93.5 Å²	93.5	59%	0.594	53%	0.533	S	S	*	.			trans	-59.9	149.2	169	-93	-47.1	0	0	0	109.4	N93 S97 M98 L99	N93-D95 PolarHBondContact O-N 3.38Å; D95-S97 PolarHBondContact O-N 3.28Å; D95-M98 PolarHBondContact O-N 3.27Å; D95-L99 PolarHBondContact O-N 2.92Å
96	C	49.6	Very low	53.1	Low	92 Å²	92	91.9 Å²	91.9	62%	0.622	52%	0.52	S	S	*	.	H	α-helix	trans	-50	-29.3	-176.4	-170.6	0	0	0	0	112.7	L99 N100	C96-L99 PolarHBondContact O-N 2.88Å; C96-N100 WeakPolarHBondContact O-CB 3.47Å; C96-N100 PolarHBondContact O-N 3.14Å
97	S	57.3	Low	53.9	Low	80 Å²	80	94.7 Å²	94.7	56%	0.559	54%	0.535	S	S	*	.	H	α-helix	trans	-62.6	-42.4	175.4	56	0	0	0	0	113.7	D95 N100 C101	D95-S97 PolarHBondContact O-N 3.28Å; S97-N100 PolarHBondContact O-N 3.29Å; S97-C101 WeakPolarHBondContact O-CB 3.24Å; S97-C101 PolarHBondContact O-N 3.07Å
98	M	55.7	Low	54.8	Low	98 Å²	98	93.8 Å²	93.8	48%	0.483	52%	0.521	S	S	.	.	H	α-helix	trans	-72.5	-37.9	178.5	-80.6	-73.6	103.4	0	0	111.5	F94 D95 N100 C101 F102	F94-M98 HydrophobicContact CD1-CB 3.8Å; F94-M98 HydrophobicContact CE1-CB 3.86Å; D95-M98 PolarHBondContact O-N 3.27Å; M98-N100 VanDerWaalsContact C-N 3.34Å; M98-C101 HydrophobicContact CE-CB 4.21Å; M98-C101 PolarHBondContact O-N 3.38Å; M98-F102 WeakPolarHBondContact O-CD2 3.34Å; M98-F102 PolarHBondContact O-N 2.89Å
99	L	56	Low	55.5	Low	61 Å²	61	90.5 Å²	90.5	32%	0.319	51%	0.512	S	S	.	.	H	α-helix	trans	-64.6	-41	174.2	-146.3	79.8	0	0	0	111.2	F94 D95 C96 F102 L103	F94-L99 HydrophobicContact CD1-CB 4.25Å; F94-L99 HydrophobicContact CD1-CD1 3.6Å; F94-L99 HydrophobicContact CE1-CD1 4Å; F94-L99 HydrophobicContact CG-CD1 4.42Å; D95-L99 PolarHBondContact O-N 2.92Å; C96-L99 PolarHBondContact O-N 2.88Å; L99-F102 PolarHBondContact O-N 2.94Å; L99-L103 WeakPolarHBondContact O-CB 3.36Å; L99-L103 WeakPolarHBondContact O-CG 3.4Å; L99-L103 PolarHBondContact O-N 2.98Å
100	N	58.3	Low	56.3	Low	93 Å²	93	88.9 Å²	88.9	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-64.1	-39.3	173	-90.4	-21.8	0	0	0	112.7	C96 S97 M98 L103 Y104	C96-N100 WeakPolarHBondContact O-CB 3.47Å; C96-N100 PolarHBondContact O-N 3.14Å; S97-N100 PolarHBondContact O-N 3.29Å; M98-N100 VanDerWaalsContact C-N 3.34Å; N100-L103 PolarHBondContact O-N 3.32Å; N100-Y104 VanDerWaalsContact O-CB 3.29Å; N100-Y104 WeakPolarHBondContact O-CB 3.39Å; N100-Y104 PolarHBondContact O-N 2.94Å
101	C	54.2	Low	57.2	Low	74 Å²	74	91 Å²	91	50%	0.5	50%	0.498	S	S	.	.	H	α-helix	trans	-64.3	-43.8	176.2	-165.8	0	0	0	0	111.5	S97 M98 Y104 S105	S97-C101 WeakPolarHBondContact O-CB 3.24Å; S97-C101 PolarHBondContact O-N 3.07Å; M98-C101 HydrophobicContact CE-CB 4.21Å; M98-C101 PolarHBondContact O-N 3.38Å; C101-Y104 PolarHBondContact O-N 3.35Å; C101-S105 WeakPolarHBondContact O-CB 3.16Å; C101-S105 PolarHBondContact O-N 2.88Å; C101-S105 PolarHBondContact O-OG 3.04Å
102	F	61.6	Low	57.8	Low	128 Å²	128	93 Å²	93	56%	0.561	49%	0.494	S	S	*	.	H	α-helix	trans	-61.2	-48.2	174	-96.6	-84.6	0	0	0	112	F94 M98 L99 Y104 S105 A106	F94-F102 AromaticContact CE1-CD2 3.79Å; F94-F102 HydrophobicContact CE1-CD2 3.79Å; F94-F102 HydrophobicContact CE1-CE2 4.12Å; F94-F102 AromaticContact CZ-CD2 3.89Å; F94-F102 HydrophobicContact CZ-CD2 3.89Å; F94-F102 AromaticContact CZ-CE2 3.75Å; F94-F102 HydrophobicContact CZ-CE2 3.75Å; M98-F102 WeakPolarHBondContact O-CD2 3.34Å; M98-F102 PolarHBondContact O-N 2.89Å; L99-F102 PolarHBondContact O-N 2.94Å; F102-Y104 PolarHBondContact O-N 2.79Å; F102-S105 PolarHBondContact O-N 3.18Å; F102-S105 PolarHBondContact O-OG 2.94Å; F102-A106 WeakPolarHBondContact O-CB 3.17Å; F102-A106 PolarHBondContact O-N 3.01Å
103	L	65.1	Low	58.2	Low	53 Å²	53	95.3 Å²	95.3	28%	0.277	50%	0.5	S	S	.	.	H	α-helix	trans	-59	-44.1	175.8	-81.5	169.5	0	0	0	112.3	L99 N100 A106 L107 L158	L99-L103 WeakPolarHBondContact O-CB 3.36Å; L99-L103 WeakPolarHBondContact O-CG 3.4Å; L99-L103 PolarHBondContact O-N 2.98Å; N100-L103 PolarHBondContact O-N 3.32Å; L103-A106 PolarHBondContact O-N 2.99Å; L103-L107 WeakPolarHBondContact O-CB 3.48Å; L103-L107 VanDerWaalsContact O-CG 3.23Å; L103-L107 WeakPolarHBondContact O-CG 3.34Å; L103-L107 PolarHBondContact O-N 2.93Å; L103-L158 HydrophobicContact CD1-CD2 4.35Å; L103-L158 HydrophobicContact CD2-CD1 4.05Å; L103-L158 HydrophobicContact CD2-CD2 3.54Å; L103-L158 HydrophobicContact CD2-CG 4.41Å; L103-L158 HydrophobicContact CG-CD2 4.25Å
104	Y	66.4	Low	58.7	Low	151 Å²	151	92.1 Å²	92.1	59%	0.592	49%	0.486	S	S	*	.	H	α-helix	trans	-63.9	-44.2	177.6	-172.5	-96.8	0	0	0	111.6	N100 C101 F102 A106 L107 Q108	N100-Y104 VanDerWaalsContact O-CB 3.29Å; N100-Y104 WeakPolarHBondContact O-CB 3.39Å; N100-Y104 PolarHBondContact O-N 2.94Å; C101-Y104 PolarHBondContact O-N 3.35Å; F102-Y104 PolarHBondContact O-N 2.79Å; Y104-A106 VanDerWaalsContact C-N 3.33Å; Y104-A106 PolarHBondContact O-N 3.43Å; Y104-L107 PolarHBondContact O-N 3.46Å; Y104-Q108 HydrophobicContact CD1-CG 3.91Å; Y104-Q108 HydrophobicContact CE1-CG 3.62Å; Y104-Q108 VanDerWaalsContact CZ-NE2 3.32Å; Y104-Q108 WeakPolarHBondContact O-CB 3.4Å; Y104-Q108 VanDerWaalsContact O-CG 3.26Å; Y104-Q108 WeakPolarHBondContact O-CG 3.28Å; Y104-Q108 PolarHBondContact O-N 3.32Å; Y104-Q108 PolarHBondContact OH-NE2 3.13Å
105	S	65.1	Low	59	Low	59 Å²	59	89 Å²	89	41%	0.413	48%	0.478	S	S	.	.	H	α-helix	trans	-64	-38	176.5	72.8	0	0	0	0	112.6	C101 F102 T109	C101-S105 WeakPolarHBondContact O-CB 3.16Å; C101-S105 PolarHBondContact O-N 2.88Å; C101-S105 PolarHBondContact O-OG 3.04Å; F102-S105 PolarHBondContact O-N 3.18Å; F102-S105 PolarHBondContact O-OG 2.94Å; S105-T109 WeakPolarHBondContact O-CB 3.43Å; S105-T109 PolarHBondContact O-N 3.27Å; S105-T109 PolarHBondContact O-OG1 3.19Å
106	A	64.7	Low	59.4	Low	38 Å²	38	91.2 Å²	91.2	31%	0.314	48%	0.478	S	S	.	.	H	α-helix	trans	-67.4	-45.3	175.7	0	0	0	0	0	111	F102 L103 Y104 T109 V110	F102-A106 WeakPolarHBondContact O-CB 3.17Å; F102-A106 PolarHBondContact O-N 3.01Å; L103-A106 PolarHBondContact O-N 2.99Å; Y104-A106 VanDerWaalsContact C-N 3.33Å; Y104-A106 PolarHBondContact O-N 3.43Å; A106-T109 PolarHBondContact O-N 3.46Å; A106-V110 VanDerWaalsContact O-CG2 3.24Å; A106-V110 WeakPolarHBondContact O-CG2 3.39Å; A106-V110 PolarHBondContact O-N 3.03Å
107	L	67.5	Low	59.5	Low	102 Å²	102	92.1 Å²	92.1	53%	0.534	47%	0.471	S	S	.	.	H	α-helix	trans	-62.3	-41.3	174.9	-74.4	168.7	0	0	0	112.2	L103 Y104 V110 F111	L103-L107 WeakPolarHBondContact O-CB 3.48Å; L103-L107 VanDerWaalsContact O-CG 3.23Å; L103-L107 WeakPolarHBondContact O-CG 3.34Å; L103-L107 PolarHBondContact O-N 2.93Å; Y104-L107 PolarHBondContact O-N 3.46Å; L107-V110 PolarHBondContact O-N 3Å; L107-F111 VanDerWaalsContact O-CB 3.29Å; L107-F111 WeakPolarHBondContact O-CB 3.44Å; L107-F111 PolarHBondContact O-N 3.49Å
108	Q	66.9	Low	59.1	Low	87 Å²	87	91.8 Å²	91.8	41%	0.407	47%	0.469	S	S	.	.	H	α-helix	trans	-62.7	-42.1	174.7	-78.4	-72.2	-7.1	0	0	111.8	Y104 F111 F112	Y104-Q108 HydrophobicContact CD1-CG 3.91Å; Y104-Q108 HydrophobicContact CE1-CG 3.62Å; Y104-Q108 VanDerWaalsContact CZ-NE2 3.32Å; Y104-Q108 WeakPolarHBondContact O-CB 3.4Å; Y104-Q108 VanDerWaalsContact O-CG 3.26Å; Y104-Q108 WeakPolarHBondContact O-CG 3.28Å; Y104-Q108 PolarHBondContact O-N 3.32Å; Y104-Q108 PolarHBondContact OH-NE2 3.13Å; Q108-F111 PolarHBondContact O-N 2.76Å; Q108-F112 WeakPolarHBondContact O-CB 3.47Å; Q108-F112 PolarHBondContact O-N 3.23Å
109	T	60.4	Low	59	Low	85 Å²	85	91.1 Å²	91.1	52%	0.521	47%	0.471	S	S	.	.	H	α-helix	trans	-63.7	-45.4	176.3	-54.8	0	0	0	0	110.9	S105 A106 F112 Q113	S105-T109 WeakPolarHBondContact O-CB 3.43Å; S105-T109 PolarHBondContact O-N 3.27Å; S105-T109 PolarHBondContact O-OG1 3.19Å; A106-T109 PolarHBondContact O-N 3.46Å; T109-F112 PolarHBondContact O-N 3.48Å; T109-Q113 VanDerWaalsContact O-CG 3.23Å; T109-Q113 WeakPolarHBondContact O-CG 3.48Å; T109-Q113 PolarHBondContact O-N 3.21Å
110	V	60.6	Low	58.1	Low	71 Å²	71	91.8 Å²	91.8	43%	0.43	48%	0.48	S	S	.	.	H	α-helix	trans	-61.9	-46.2	176.2	173.9	0	0	0	0	110.6	A106 L107 F112 Q113 V114	A106-V110 VanDerWaalsContact O-CG2 3.24Å; A106-V110 WeakPolarHBondContact O-CG2 3.39Å; A106-V110 PolarHBondContact O-N 3.03Å; L107-V110 PolarHBondContact O-N 3Å; V110-F112 VanDerWaalsContact C-N 3.34Å; V110-F112 PolarHBondContact O-N 2.87Å; V110-Q113 PolarHBondContact O-N 3.16Å; V110-V114 HydrophobicContact CG1-CG2 4.38Å; V110-V114 VanDerWaalsContact O-CG2 3.31Å; V110-V114 WeakPolarHBondContact O-CG2 3.38Å; V110-V114 PolarHBondContact O-N 3.35Å
111	F	66	Low	57.5	Low	138 Å²	138	90 Å²	90	61%	0.605	47%	0.472	S	S	*	.	H	α-helix	trans	-57.8	-46.9	176.9	-174.9	-93.8	0	0	0	111.2	L107 Q108 Q113 V114 S115	L107-F111 VanDerWaalsContact O-CB 3.29Å; L107-F111 WeakPolarHBondContact O-CB 3.44Å; L107-F111 PolarHBondContact O-N 3.49Å; Q108-F111 PolarHBondContact O-N 2.76Å; F111-Q113 VanDerWaalsContact C-N 3.34Å; F111-Q113 PolarHBondContact O-N 3.39Å; F111-V114 PolarHBondContact O-N 3.01Å; F111-S115 WeakPolarHBondContact O-CB 3.24Å; F111-S115 PolarHBondContact O-N 3.44Å; F111-S115 PolarHBondContact O-OG 3.29Å
112	F	57.2	Low	56.9	Low	114 Å²	114	88.3 Å²	88.3	50%	0.5	47%	0.467	S	S	.	.	H	α-helix	trans	-63.5	-37.9	179.1	-162.3	-100.8	0	0	0	112.8	Q108 T109 V110 R116	Q108-F112 WeakPolarHBondContact O-CB 3.47Å; Q108-F112 PolarHBondContact O-N 3.23Å; T109-F112 PolarHBondContact O-N 3.48Å; V110-F112 VanDerWaalsContact C-N 3.34Å; V110-F112 PolarHBondContact O-N 2.87Å; F112-R116 HydrophobicContact CD1-CG 4.49Å; F112-R116 HydrophobicContact CE1-CG 4.34Å; F112-R116 VanDerWaalsContact CE1-NE 3.32Å; F112-R116 WeakPolarHBondContact O-CB 3.25Å; F112-R116 PolarHBondContact O-N 3.41Å
113	Q	52.7	Low	56.2	Low	115 Å²	115	87.2 Å²	87.2	54%	0.537	47%	0.467	S	S	.	.	H	α-helix	trans	-68.1	-41.8	174.9	-66.6	-68.1	-7.3	0	0	111.7	T109 V110 F111 R116 F117	T109-Q113 VanDerWaalsContact O-CG 3.23Å; T109-Q113 WeakPolarHBondContact O-CG 3.48Å; T109-Q113 PolarHBondContact O-N 3.21Å; V110-Q113 PolarHBondContact O-N 3.16Å; F111-Q113 VanDerWaalsContact C-N 3.34Å; F111-Q113 PolarHBondContact O-N 3.39Å; Q113-R116 PolarHBondContact O-N 2.89Å; Q113-F117 VanDerWaalsContact O-CB 3.31Å; Q113-F117 WeakPolarHBondContact O-CB 3.33Å; Q113-F117 PolarHBondContact O-N 3.32Å
114	V	55.3	Low	55.1	Low	75 Å²	75	88.5 Å²	88.5	46%	0.455	48%	0.477	S	S	.	.	H	α-helix	trans	-64.3	-41.8	175.2	172.7	0	0	0	0	111.1	V110 F111 F117 S118	V110-V114 HydrophobicContact CG1-CG2 4.38Å; V110-V114 VanDerWaalsContact O-CG2 3.31Å; V110-V114 WeakPolarHBondContact O-CG2 3.38Å; V110-V114 PolarHBondContact O-N 3.35Å; F111-V114 PolarHBondContact O-N 3.01Å; V114-F117 PolarHBondContact O-N 3.04Å; V114-S118 WeakPolarHBondContact O-CB 3.25Å; V114-S118 PolarHBondContact O-N 2.88Å
115	S	53.8	Low	53.9	Low	45 Å²	45	86 Å²	86	32%	0.315	48%	0.477	S	S	.	.	H	α-helix	trans	-62.5	-46.7	175.7	-61.7	0	0	0	0	111.5	F111 F117 S118 T119	F111-S115 WeakPolarHBondContact O-CB 3.24Å; F111-S115 PolarHBondContact O-N 3.44Å; F111-S115 PolarHBondContact O-OG 3.29Å; S115-F117 VanDerWaalsContact C-N 3.3Å; S115-F117 PolarHBondContact O-N 3.08Å; S115-S118 WeakPolarHBondContact O-CB 3.32Å; S115-S118 PolarHBondContact O-N 2.9Å; S115-T119 PolarHBondContact O-N 3.45Å; S115-T119 PolarHBondContact O-OG1 3.28Å; S115-T119 VanDerWaalsContact O-OG1 3.05Å
116	R	53.1	Low	53	Low	157 Å²	157	87 Å²	87	59%	0.592	49%	0.488	S	S	*	.	H	α-helix	trans	-61.2	-39.7	175	-82.9	-173	165.5	-177.6	-1.6	112.4	F112 Q113 T119 C120	F112-R116 HydrophobicContact CD1-CG 4.49Å; F112-R116 HydrophobicContact CE1-CG 4.34Å; F112-R116 VanDerWaalsContact CE1-NE 3.32Å; F112-R116 WeakPolarHBondContact O-CB 3.25Å; F112-R116 PolarHBondContact O-N 3.41Å; Q113-R116 PolarHBondContact O-N 2.89Å; R116-T119 PolarHBondContact O-N 3.45Å; R116-C120 VanDerWaalsContact O-CB 3.29Å; R116-C120 WeakPolarHBondContact O-CB 3.2Å; R116-C120 PolarHBondContact O-N 3.02Å
117	F	52.3	Low	52.3	Low	110 Å²	110	89.1 Å²	89.1	48%	0.482	50%	0.501	S	S	.	.	H	α-helix	trans	-64.2	-44.8	175.9	-171.3	-91.7	0	0	0	111.2	Q113 V114 S115 T119 C120 V121 L141	Q113-F117 VanDerWaalsContact O-CB 3.31Å; Q113-F117 WeakPolarHBondContact O-CB 3.33Å; Q113-F117 PolarHBondContact O-N 3.32Å; V114-F117 PolarHBondContact O-N 3.04Å; S115-F117 VanDerWaalsContact C-N 3.3Å; S115-F117 PolarHBondContact O-N 3.08Å; F117-T119 PolarHBondContact O-N 3.46Å; F117-C120 WeakPolarHBondContact O-CB 3.19Å; F117-C120 PolarHBondContact O-N 2.79Å; F117-V121 HydrophobicContact CD1-CG2 3.88Å; F117-V121 HydrophobicContact CE1-CG2 3.44Å; F117-V121 VanDerWaalsContact CE1-CG2 3.44Å; F117-V121 HydrophobicContact CZ-CG2 3.82Å; F117-V121 WeakPolarHBondContact O-CG2 3.44Å; F117-V121 PolarHBondContact O-N 3.5Å; F117-L141 HydrophobicContact CD1-CD2 4.38Å; F117-L141 HydrophobicContact CE1-CD1 3.86Å; F117-L141 HydrophobicContact CE1-CD2 3.27Å; F117-L141 HydrophobicContact CE1-CG 4.2Å; F117-L141 HydrophobicContact CZ-CD2 3.5Å; F117-L141 VanDerWaalsContact CZ-CD2 3.5Å
118	S	49	Very low	50.8	Low	73 Å²	73	90 Å²	90	51%	0.51	50%	0.503	S	S	.	.	H	α-helix	trans	-60.4	-44.1	175.6	-173	0	0	0	0	112.3	V114 S115 V121 G122	V114-S118 WeakPolarHBondContact O-CB 3.25Å; V114-S118 PolarHBondContact O-N 2.88Å; S115-S118 WeakPolarHBondContact O-CB 3.32Å; S115-S118 PolarHBondContact O-N 2.9Å; S118-V121 PolarHBondContact O-N 3.32Å; S118-G122 PolarHBondContact O-N 2.95Å
119	T	52.3	Low	49.6	Very low	85 Å²	85	90.8 Å²	90.8	52%	0.521	52%	0.516	S	S	.	.	H	α-helix	trans	-63.7	-40.9	174.1	-52.7	0	0	0	0	111.7	S115 R116 F117 G122 N123	S115-T119 PolarHBondContact O-N 3.45Å; S115-T119 PolarHBondContact O-OG1 3.28Å; S115-T119 VanDerWaalsContact O-OG1 3.05Å; R116-T119 PolarHBondContact O-N 3.45Å; F117-T119 PolarHBondContact O-N 3.46Å; T119-G122 PolarHBondContact O-N 2.91Å; T119-N123 WeakPolarHBondContact O-CB 3.17Å; T119-N123 PolarHBondContact O-N 3.42Å; T119-N123 PolarHBondContact O-ND2 3.32Å
120	C	37.5	Very low	49	Very low	75 Å²	75	94.2 Å²	94.2	51%	0.507	53%	0.531	S	S	.	.	H	α-helix	trans	-63.6	-47.1	177.7	-162.5	0	0	0	0	111.1	R116 F117 N123 V124	R116-C120 VanDerWaalsContact O-CB 3.29Å; R116-C120 WeakPolarHBondContact O-CB 3.2Å; R116-C120 PolarHBondContact O-N 3.02Å; F117-C120 WeakPolarHBondContact O-CB 3.19Å; F117-C120 PolarHBondContact O-N 2.79Å; C120-N123 PolarHBondContact O-N 3.36Å; C120-V124 VanDerWaalsContact O-CG2 3.26Å; C120-V124 WeakPolarHBondContact O-CG2 3.33Å; C120-V124 PolarHBondContact O-N 3.44Å
121	V	46.5	Very low	48	Very low	55 Å²	55	93.5 Å²	93.5	33%	0.333	53%	0.532	S	S	.	.	H	α-helix	trans	-62.9	-43.2	175.7	173.9	0	0	0	0	111.1	F117 S118 N123 V124 V125	F117-V121 HydrophobicContact CD1-CG2 3.88Å; F117-V121 HydrophobicContact CE1-CG2 3.44Å; F117-V121 VanDerWaalsContact CE1-CG2 3.44Å; F117-V121 HydrophobicContact CZ-CG2 3.82Å; F117-V121 WeakPolarHBondContact O-CG2 3.44Å; F117-V121 PolarHBondContact O-N 3.5Å; S118-V121 PolarHBondContact O-N 3.32Å; V121-N123 VanDerWaalsContact C-N 3.35Å; V121-N123 PolarHBondContact O-N 3.45Å; V121-V124 PolarHBondContact O-N 3.44Å; V121-V125 HydrophobicContact CG1-CG2 4.21Å; V121-V125 WeakPolarHBondContact O-CB 3.41Å; V121-V125 VanDerWaalsContact O-CG2 3.25Å; V121-V125 WeakPolarHBondContact O-CG2 3.1Å; V121-V125 PolarHBondContact O-N 2.69Å
122	G	40.5	Very low	46.4	Very low	38 Å²	38	93.4 Å²	93.4	39%	0.392	54%	0.537	S	S	.	.	H	α-helix	trans	-60.7	-41.7	176.3	0	0	0	0	0	112.9	S118 T119 A126	S118-G122 PolarHBondContact O-N 2.95Å; T119-G122 PolarHBondContact O-N 2.91Å; G122-A126 VanDerWaalsContact O-CB 3.28Å; G122-A126 WeakPolarHBondContact O-CB 3.49Å; G122-A126 PolarHBondContact O-N 3.25Å
123	N	47.2	Very low	45.3	Very low	106 Å²	106	93.4 Å²	93.4	57%	0.567	55%	0.549	S	S	*	.	H	α-helix	trans	-67.7	-39.5	175.9	-70.7	-19.2	0	0	0	112.1	T119 C120 V121 A126 S127	T119-N123 WeakPolarHBondContact O-CB 3.17Å; T119-N123 PolarHBondContact O-N 3.42Å; T119-N123 PolarHBondContact O-ND2 3.32Å; C120-N123 PolarHBondContact O-N 3.36Å; V121-N123 VanDerWaalsContact C-N 3.35Å; V121-N123 PolarHBondContact O-N 3.45Å; N123-A126 PolarHBondContact O-N 3.47Å; N123-S127 WeakPolarHBondContact O-CB 3.4Å; N123-S127 PolarHBondContact O-N 3.36Å; N123-S127 PolarHBondContact O-OG 3.41Å; N123-S127 VanDerWaalsContact O-OG 3.13Å
124	V	41.3	Very low	44.5	Very low	80 Å²	80	97.4 Å²	97.4	49%	0.485	56%	0.564	S	S	.	*	H	α-helix	trans	-64.4	-46.5	175.9	171	0	0	0	0	110.7	C120 V121 A126 S127 Q128	C120-V124 VanDerWaalsContact O-CG2 3.26Å; C120-V124 WeakPolarHBondContact O-CG2 3.33Å; C120-V124 PolarHBondContact O-N 3.44Å; V121-V124 PolarHBondContact O-N 3.44Å; V124-A126 PolarHBondContact O-N 2.78Å; V124-S127 WeakPolarHBondContact CA-OG 3.43Å; V124-S127 PolarHBondContact O-N 2.9Å; V124-S127 PolarHBondContact O-OG 3.49Å; V124-Q128 PolarHBondContact O-N 3.01Å
125	V	41.7	Very low	43.5	Very low	97 Å²	97	102.9 Å²	102.9	59%	0.588	59%	0.585	S	S	*	*	H	α-helix	trans	-64.1	-39	177.6	173.1	0	0	0	0	111.6	V121 S127 Q128	V121-V125 HydrophobicContact CG1-CG2 4.21Å; V121-V125 WeakPolarHBondContact O-CB 3.41Å; V121-V125 VanDerWaalsContact O-CG2 3.25Å; V121-V125 WeakPolarHBondContact O-CG2 3.1Å; V121-V125 PolarHBondContact O-N 2.69Å; V125-S127 VanDerWaalsContact C-N 3.3Å; V125-S127 PolarHBondContact O-N 3.17Å; V125-Q128 PolarHBondContact O-N 2.95Å
126	A	46.3	Very low	42.5	Very low	80 Å²	80	105.3 Å²	105.3	66%	0.661	60%	0.598	S	S	*	*	H	α-helix	trans	-68.1	-28.9	175.6	0	0	0	0	0	113.2	G122 N123 V124	G122-A126 VanDerWaalsContact O-CB 3.28Å; G122-A126 WeakPolarHBondContact O-CB 3.49Å; G122-A126 PolarHBondContact O-N 3.25Å; N123-A126 PolarHBondContact O-N 3.47Å; V124-A126 PolarHBondContact O-N 2.78Å
127	S	49.8	Very low	41.8	Very low	84 Å²	84	100.9 Å²	100.9	59%	0.587	59%	0.594	S	S	*	*	H	α-helix	trans	-82.8	-10.6	-179.9	64.1	0	0	0	0	114.6	N123 V124 V125	N123-S127 WeakPolarHBondContact O-CB 3.4Å; N123-S127 PolarHBondContact O-N 3.36Å; N123-S127 PolarHBondContact O-OG 3.41Å; N123-S127 VanDerWaalsContact O-OG 3.13Å; V124-S127 WeakPolarHBondContact CA-OG 3.43Å; V124-S127 PolarHBondContact O-N 2.9Å; V124-S127 PolarHBondContact O-OG 3.49Å; V125-S127 VanDerWaalsContact C-N 3.3Å; V125-S127 PolarHBondContact O-N 3.17Å
128	Q	36.6	Very low	41.3	Very low	120 Å²	120	103.5 Å²	103.5	56%	0.561	61%	0.61	S	S	*	*			trans	-142.2	74.6	-179.5	-64.7	-160.6	-47.3	0	0	112.1	V124 V125 D130 A131	V124-Q128 PolarHBondContact O-N 3.01Å; V125-Q128 PolarHBondContact O-N 2.95Å; Q128-D130 PolarHBondContact O-N 3.35Å; Q128-A131 HydrophobicContact CB-CB 4.07Å
129	P	42	Very low	40.8	Very low	104 Å²	104	102.9 Å²	102.9	68%	0.675	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-19.8	-176.9	25.6	-32.6	0	0	0	114
130	D	46.5	Very low	40.4	Very low	157 Å²	157	104 Å²	104	84%	0.84	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	6.2	-167.8	-47.9	-41.2	0	0	0	113.9	Q128	Q128-D130 PolarHBondContact O-N 3.35Å
131	A	41.4	Very low	40.7	Very low	56 Å²	56	104.2 Å²	104.2	46%	0.463	61%	0.605	S	S	.	*	S	Bend	trans	-105.9	-2.9	-167.6	0	0	0	0	0	116.3	Q128	Q128-A131 HydrophobicContact CB-CB 4.07Å
132	L	30.6	Very low	40.6	Very low	135 Å²	135	107 Å²	107	71%	0.707	62%	0.617	S	S	*	*			trans	-130.1	124.6	-177.5	-100	90.6	0	0	0	114.3	K134	L132-K134 PolarHBondContact O-N 2.88Å
133	P	34.3	Very low	41	Very low	114 Å²	114	111.7 Å²	111.7	74%	0.74	63%	0.628	S	S	*	*			trans	-55	135.5	167.2	-19.1	30	0	0	0	110.7	Q135	P133-Q135 PolarHBondContact O-N 3.21Å
134	K	37.5	Very low	40.8	Very low	200 Å²	200	115.2 Å²	115.2	87%	0.87	63%	0.634	S	S	*	*	S	Bend	trans	-43.6	129.9	165.4	-64.2	171.3	177.3	175.6	0	108.8	L132	L132-K134 PolarHBondContact O-N 2.88Å
135	Q	32.4	Very low	41	Very low	189 Å²	189	116.1 Å²	116.1	88%	0.883	64%	0.635	S	S	*	*			trans	105.1	37	168.7	-50.3	-165.3	15.5	0	0	120.3	P133	P133-Q135 PolarHBondContact O-N 3.21Å
136	V	34.1	Very low	41.3	Very low	97 Å²	97	114.9 Å²	114.9	59%	0.588	63%	0.629	S	S	*	*			trans	-97	92.2	152	-179.7	0	0	0	0	108.9	E140	V136-E140 VanDerWaalsContact CG1-OE2 3.28Å; V136-E140 WeakPolarHBondContact CG1-OE2 3.44Å
137	A	38.4	Very low	41.5	Very low	63 Å²	63	117.9 Å²	117.9	52%	0.521	63%	0.629	S	S	.	*			trans	-62.1	145.8	178.5	0	0	0	0	0	110.8	A139 E140	A137-A139 HydrophobicContact CB-CB 4.17Å; A137-A139 PolarHBondContact O-N 3.22Å; A137-E140 PolarHBondContact O-N 2.96Å
138	M	41.4	Very low	41.6	Very low	165 Å²	165	120.2 Å²	120.2	81%	0.813	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	-8.7	171.3	-53	-175.3	76.9	0	0	114
139	A	39.6	Very low	42.6	Very low	61 Å²	61	121.4 Å²	121.4	50%	0.504	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.5	-27.9	173.7	0	0	0	0	0	114.4	A137 I142	A137-A139 HydrophobicContact CB-CB 4.17Å; A137-A139 PolarHBondContact O-N 3.22Å; A139-I142 PolarHBondContact O-N 2.92Å
140	E	43.6	Very low	43.1	Very low	109 Å²	109	122.1 Å²	122.1	51%	0.509	63%	0.634	S	S	.	*	H	α-helix	trans	-76.4	-28.3	-179.5	-70.5	-167.2	148.7	0	0	112.8	V136 A137 I142 Q143	V136-E140 VanDerWaalsContact CG1-OE2 3.28Å; V136-E140 WeakPolarHBondContact CG1-OE2 3.44Å; A137-E140 PolarHBondContact O-N 2.96Å; E140-I142 PolarHBondContact O-N 2.76Å; E140-Q143 PolarHBondContact O-N 3.31Å
141	L	43.5	Very low	43.6	Very low	79 Å²	79	117.3 Å²	117.3	41%	0.414	61%	0.61	S	S	.	*	H	α-helix	trans	-68	-23.7	174.5	-91.3	159.4	0	0	0	113.3	F117 Q143 W144	F117-L141 HydrophobicContact CD1-CD2 4.38Å; F117-L141 HydrophobicContact CE1-CD1 3.86Å; F117-L141 HydrophobicContact CE1-CD2 3.27Å; F117-L141 HydrophobicContact CE1-CG 4.2Å; F117-L141 HydrophobicContact CZ-CD2 3.5Å; F117-L141 VanDerWaalsContact CZ-CD2 3.5Å; L141-Q143 VanDerWaalsContact C-N 3.34Å; L141-W144 PolarHBondContact O-N 3.28Å
142	I	44.7	Very low	44.2	Very low	114 Å²	114	119.1 Å²	119.1	59%	0.585	61%	0.609	S	S	*	*	H	α-helix	trans	-76.7	-23.1	176.2	-62.4	173.5	0	0	0	111.5	A139 E140 W144 P146	A139-I142 PolarHBondContact O-N 2.92Å; E140-I142 PolarHBondContact O-N 2.76Å; I142-W144 VanDerWaalsContact C-N 3.32Å; I142-P146 WeakPolarHBondContact O-CD 2.86Å
143	Q	48.7	Very low	45.2	Very low	135 Å²	135	117.2 Å²	117.2	63%	0.631	60%	0.597	S	S	*	*	H	α-helix	trans	-79	-15.1	175	-68.5	-178.8	-14.2	0	0	113.5	E140 L141 P146	E140-Q143 PolarHBondContact O-N 3.31Å; L141-Q143 VanDerWaalsContact C-N 3.34Å; Q143-P146 VanDerWaalsContact O-CD 3.29Å; Q143-P146 WeakPolarHBondContact O-CD 3.39Å
144	W	43.2	Very low	46.2	Very low	181 Å²	181	114.2 Å²	114.2	69%	0.686	58%	0.575	S	S	*	*	H	α-helix	trans	-90.6	-25.2	176.9	-84.6	84.8	0	0	0	114	L141 I142 Q147	L141-W144 PolarHBondContact O-N 3.28Å; I142-W144 VanDerWaalsContact C-N 3.32Å; W144-Q147 PolarHBondContact O-N 2.9Å
145	L	45	Very low	47.3	Very low	98 Å²	98	108.4 Å²	108.4	51%	0.513	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-63.2	-28.1	177.8	-78	162.2	0	0	0	116.1
146	P	48.3	Very low	48.4	Very low	71 Å²	71	105.5 Å²	105.5	46%	0.461	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-86.8	-4.3	179.7	1.1	17.7	0	0	0	114.4	I142 Q143	I142-P146 WeakPolarHBondContact O-CD 2.86Å; Q143-P146 VanDerWaalsContact O-CD 3.29Å; Q143-P146 WeakPolarHBondContact O-CD 3.39Å
147	Q	48.8	Very low	49.4	Very low	143 Å²	143	104.3 Å²	104.3	67%	0.668	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-91.9	-1.1	-175.9	-63	-166	23.5	0	0	114.2	W144	W144-Q147 PolarHBondContact O-N 2.9Å
148	H	53.3	Low	50.3	Low	134 Å²	134	103.8 Å²	103.8	62%	0.62	52%	0.52	S	S	*	.			trans	-83.2	122.3	173.2	-102.7	-82.9	0	0	0	110.3	F150 V151	H148-F150 HydrophobicContact CB-CB 4.42Å; H148-F150 PolarHBondContact O-N 2.77Å; H148-V151 HydrophobicContact CB-CG2 4.48Å; H148-V151 PolarHBondContact O-N 3.05Å
149	D	56.7	Low	50.8	Low	145 Å²	145	100 Å²	100	78%	0.775	50%	0.503	S	S	*	.	H	α-helix	trans	-44.3	-29.1	169.4	-72.4	-34.1	0	0	0	112.4	M153	D149-M153 WeakPolarHBondContact O-CB 3.41Å; D149-M153 PolarHBondContact O-N 2.95Å
150	F	52.8	Low	51.4	Low	119 Å²	119	100.9 Å²	100.9	52%	0.522	51%	0.505	S	S	.	.	H	α-helix	trans	-64.3	-40.1	177.4	-168.2	-105	0	0	0	114.2	H148 M153 I154	H148-F150 HydrophobicContact CB-CB 4.42Å; H148-F150 PolarHBondContact O-N 2.77Å; F150-M153 HydrophobicContact CD2-CE 3.56Å; F150-M153 HydrophobicContact CE2-CE 3.74Å; F150-M153 HydrophobicContact CG-CE 4.45Å; F150-I154 HydrophobicContact CD1-CD1 3.8Å; F150-I154 HydrophobicContact CE1-CD1 3.44Å; F150-I154 VanDerWaalsContact CE1-CD1 3.44Å; F150-I154 HydrophobicContact CZ-CD1 3.92Å; F150-I154 VanDerWaalsContact O-CG1 3.29Å; F150-I154 WeakPolarHBondContact O-CG1 3.37Å; F150-I154 PolarHBondContact O-N 3.36Å
151	V	57.3	Low	51.7	Low	56 Å²	56	101.6 Å²	101.6	34%	0.339	51%	0.507	S	S	.	.	H	α-helix	trans	-76.1	-38.7	-179.4	-179.9	0	0	0	0	110.5	H148 I154 L155	H148-V151 HydrophobicContact CB-CG2 4.48Å; H148-V151 PolarHBondContact O-N 3.05Å; V151-I154 PolarHBondContact O-N 3.35Å; V151-L155 HydrophobicContact CG1-CD1 4.2Å; V151-L155 WeakPolarHBondContact O-CB 3.49Å; V151-L155 PolarHBondContact O-N 3.14Å
152	Q	54.1	Low	51.8	Low	93 Å²	93	103 Å²	103	44%	0.435	52%	0.515	S	S	.	.	H	α-helix	trans	-63.9	-42.9	171.8	-75.3	-64.9	-17.3	0	0	111.6	I154 L155 E156	Q152-I154 VanDerWaalsContact C-N 3.32Å; Q152-I154 PolarHBondContact O-N 2.87Å; Q152-L155 PolarHBondContact O-N 2.92Å; Q152-E156 WeakPolarHBondContact O-CB 3.41Å; Q152-E156 WeakPolarHBondContact O-CG 3.28Å; Q152-E156 PolarHBondContact O-N 3.34Å
153	M	50.8	Low	51.6	Low	95 Å²	95	103.1 Å²	103.1	47%	0.468	52%	0.52	S	S	.	.	H	α-helix	trans	-58.3	-43.4	173.9	-179.3	-173	69.4	0	0	111.8	D149 F150 V157	D149-M153 WeakPolarHBondContact O-CB 3.41Å; D149-M153 PolarHBondContact O-N 2.95Å; F150-M153 HydrophobicContact CD2-CE 3.56Å; F150-M153 HydrophobicContact CE2-CE 3.74Å; F150-M153 HydrophobicContact CG-CE 4.45Å; M153-V157 WeakPolarHBondContact O-CB 3.25Å; M153-V157 WeakPolarHBondContact O-CG2 3.35Å; M153-V157 PolarHBondContact O-N 3.42Å
154	I	56.5	Low	51	Low	52 Å²	52	104.9 Å²	104.9	27%	0.267	53%	0.528	S	S	.	.	H	α-helix	trans	-64.2	-45.4	175.9	-70.2	169	0	0	0	110.8	F150 V151 Q152 V157 L158	F150-I154 HydrophobicContact CD1-CD1 3.8Å; F150-I154 HydrophobicContact CE1-CD1 3.44Å; F150-I154 VanDerWaalsContact CE1-CD1 3.44Å; F150-I154 HydrophobicContact CZ-CD1 3.92Å; F150-I154 VanDerWaalsContact O-CG1 3.29Å; F150-I154 WeakPolarHBondContact O-CG1 3.37Å; F150-I154 PolarHBondContact O-N 3.36Å; V151-I154 PolarHBondContact O-N 3.35Å; Q152-I154 VanDerWaalsContact C-N 3.32Å; Q152-I154 PolarHBondContact O-N 2.87Å; I154-V157 PolarHBondContact O-N 3.49Å; I154-L158 HydrophobicContact CG2-CD1 3.84Å; I154-L158 HydrophobicContact CG2-CG 4.4Å; I154-L158 WeakPolarHBondContact O-CB 3.25Å; I154-L158 WeakPolarHBondContact O-CG 3.44Å; I154-L158 PolarHBondContact O-N 3.05Å
155	L	59.7	Low	50.3	Low	77 Å²	77	100 Å²	100	40%	0.403	52%	0.521	S	S	.	.	H	α-helix	trans	-61.6	-41.8	176.9	-86.8	159	0	0	0	112.8	V151 Q152 L158 N159	V151-L155 HydrophobicContact CG1-CD1 4.2Å; V151-L155 WeakPolarHBondContact O-CB 3.49Å; V151-L155 PolarHBondContact O-N 3.14Å; Q152-L155 PolarHBondContact O-N 2.92Å; L155-L158 PolarHBondContact O-N 3.17Å; L155-N159 VanDerWaalsContact O-CB 3.28Å; L155-N159 WeakPolarHBondContact O-CB 3.45Å; L155-N159 VanDerWaalsContact O-CG 3.31Å; L155-N159 PolarHBondContact O-N 3Å; L155-N159 PolarHBondContact O-ND2 3.43Å
156	E	56	Low	49.5	Very low	128 Å²	128	107.5 Å²	107.5	60%	0.598	54%	0.542	S	S	*	.	H	α-helix	trans	-65.4	-42.3	176.7	-76.2	179.2	173.2	0	0	111.7	Q152 N159 S160	Q152-E156 WeakPolarHBondContact O-CB 3.41Å; Q152-E156 WeakPolarHBondContact O-CG 3.28Å; Q152-E156 PolarHBondContact O-N 3.34Å; E156-N159 PolarHBondContact O-N 3.22Å; E156-S160 WeakPolarHBondContact O-CB 3.38Å; E156-S160 PolarHBondContact O-N 3.34Å
157	V	55.3	Low	48.7	Very low	72 Å²	72	112.8 Å²	112.8	44%	0.436	56%	0.559	S	S	.	*	H	α-helix	trans	-64.9	-39.7	175.8	170.6	0	0	0	0	111.2	M153 I154 K161	M153-V157 WeakPolarHBondContact O-CB 3.25Å; M153-V157 WeakPolarHBondContact O-CG2 3.35Å; M153-V157 PolarHBondContact O-N 3.42Å; I154-V157 PolarHBondContact O-N 3.49Å; V157-K161 HydrophobicContact CG1-CD 4.26Å; V157-K161 WeakPolarHBondContact O-CB 3.49Å; V157-K161 WeakPolarHBondContact O-CG 3.19Å; V157-K161 PolarHBondContact O-N 3.04Å
158	L	56	Low	47.7	Very low	52 Å²	52	109.3 Å²	109.3	27%	0.272	56%	0.561	S	S	.	*	H	α-helix	trans	-67.3	-46.4	175.6	-68.7	171.7	0	0	0	111.5	L103 I154 L155 S160 K161 L162	L103-L158 HydrophobicContact CD1-CD2 4.35Å; L103-L158 HydrophobicContact CD2-CD1 4.05Å; L103-L158 HydrophobicContact CD2-CD2 3.54Å; L103-L158 HydrophobicContact CD2-CG 4.41Å; L103-L158 HydrophobicContact CG-CD2 4.25Å; I154-L158 HydrophobicContact CG2-CD1 3.84Å; I154-L158 HydrophobicContact CG2-CG 4.4Å; I154-L158 WeakPolarHBondContact O-CB 3.25Å; I154-L158 WeakPolarHBondContact O-CG 3.44Å; I154-L158 PolarHBondContact O-N 3.05Å; L155-L158 PolarHBondContact O-N 3.17Å; L158-S160 PolarHBondContact O-N 2.89Å; L158-K161 PolarHBondContact O-N 3.39Å; L158-L162 WeakPolarHBondContact O-CB 3.28Å; L158-L162 WeakPolarHBondContact O-CD1 3.44Å; L158-L162 VanDerWaalsContact O-CG 3.28Å; L158-L162 WeakPolarHBondContact O-CG 3.29Å; L158-L162 PolarHBondContact O-N 3.06Å
159	N	53.5	Low	46.4	Very low	86 Å²	86	113.5 Å²	113.5	46%	0.46	58%	0.577	S	S	.	*	H	α-helix	trans	-65.4	-37.8	177.8	-78.5	-30.3	0	0	0	112.5	L155 E156 K161 T163	L155-N159 VanDerWaalsContact O-CB 3.28Å; L155-N159 WeakPolarHBondContact O-CB 3.45Å; L155-N159 VanDerWaalsContact O-CG 3.31Å; L155-N159 PolarHBondContact O-N 3Å; L155-N159 PolarHBondContact O-ND2 3.43Å; E156-N159 PolarHBondContact O-N 3.22Å; N159-K161 VanDerWaalsContact C-N 3.3Å; N159-K161 PolarHBondContact O-N 3.44Å; N159-T163 WeakPolarHBondContact O-CG2 3.36Å; N159-T163 PolarHBondContact O-N 3.28Å; N159-T163 PolarHBondContact O-OG1 2.99Å
160	S	51.8	Low	45.1	Very low	79 Å²	79	110 Å²	110	55%	0.552	57%	0.568	S	S	*	*	H	α-helix	trans	-65.9	-29.5	176.7	160.2	0	0	0	0	113.3	E156 L158 T163	E156-S160 WeakPolarHBondContact O-CB 3.38Å; E156-S160 PolarHBondContact O-N 3.34Å; L158-S160 PolarHBondContact O-N 2.89Å; S160-T163 PolarHBondContact O-OG1 3.45Å; S160-T163 VanDerWaalsContact O-OG1 3.05Å
161	K	50.3	Low	43.8	Very low	124 Å²	124	114.5 Å²	114.5	54%	0.539	59%	0.588	S	S	.	*	H	α-helix	trans	-98.4	-23.1	-175.5	-70.7	-178.4	176.3	-78.3	0	112.9	V157 L158 N159	V157-K161 HydrophobicContact CG1-CD 4.26Å; V157-K161 WeakPolarHBondContact O-CB 3.49Å; V157-K161 WeakPolarHBondContact O-CG 3.19Å; V157-K161 PolarHBondContact O-N 3.04Å; L158-K161 PolarHBondContact O-N 3.39Å; N159-K161 VanDerWaalsContact C-N 3.3Å; N159-K161 PolarHBondContact O-N 3.44Å
162	L	44.5	Very low	42.5	Very low	110 Å²	110	119.3 Å²	119.3	58%	0.576	60%	0.604	S	S	*	*	H	α-helix	trans	-72.9	-27	171.8	-76.9	162.2	0	0	0	113.1	L158 H164 C165	L158-L162 WeakPolarHBondContact O-CB 3.28Å; L158-L162 WeakPolarHBondContact O-CD1 3.44Å; L158-L162 VanDerWaalsContact O-CG 3.28Å; L158-L162 WeakPolarHBondContact O-CG 3.29Å; L158-L162 PolarHBondContact O-N 3.06Å; L162-H164 PolarHBondContact O-N 3.4Å; L162-C165 PolarHBondContact O-N 2.93Å
163	T	42	Very low	41.2	Very low	115 Å²	115	126 Å²	126	71%	0.706	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-14	178.9	47	0	0	0	0	114.4	N159 S160	N159-T163 WeakPolarHBondContact O-CG2 3.36Å; N159-T163 PolarHBondContact O-N 3.28Å; N159-T163 PolarHBondContact O-OG1 2.99Å; S160-T163 PolarHBondContact O-OG1 3.45Å; S160-T163 VanDerWaalsContact O-OG1 3.05Å
164	H	34.7	Very low	40.3	Very low	173 Å²	173	131 Å²	131	80%	0.801	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-2.5	175.3	-102.3	-85.8	0	0	0	114.3	L162 R166	L162-H164 PolarHBondContact O-N 3.4Å; H164-R166 PolarHBondContact O-N 3.04Å
165	C	29.3	Very low	39.1	Very low	78 Å²	78	131.9 Å²	131.9	53%	0.527	66%	0.656	S	S	.	*			trans	-83	95.1	171.9	-95.5	0	0	0	0	110.1	L162 F167	L162-C165 PolarHBondContact O-N 2.93Å; C165-F167 HydrophobicContact CB-CD2 4.15Å; C165-F167 PolarHBondContact O-N 2.82Å
166	R	28.2	Very low	38.1	Very low	255 Å²	255	135.6 Å²	135.6	96%	0.962	68%	0.682	S	S	*	*			trans	-69.1	75.8	162.4	-87.7	-174.5	175.5	-177.7	0.2	109.6	H164	H164-R166 PolarHBondContact O-N 3.04Å
167	F	32.2	Very low	36.8	Very low	183 Å²	183	134 Å²	134	80%	0.803	68%	0.678	S	S	*	*			trans	-88.4	125.9	157.5	-86.9	-84.8	0	0	0	108.6	C165 K169	C165-F167 HydrophobicContact CB-CD2 4.15Å; C165-F167 PolarHBondContact O-N 2.82Å; F167-K169 PolarHBondContact O-N 3.08Å
168	G	27.5	Very low	36.1	Very low	69 Å²	69	141 Å²	141	71%	0.711	70%	0.696	S	S	*	*			trans	-53.3	134.5	-172.7	0	0	0	0	0	113.2	A170	G168-A170 PolarHBondContact O-N 2.77Å
169	K	24.7	Very low	35.1	Very low	223 Å²	223	142.2 Å²	142.2	97%	0.97	71%	0.709	S	S	*	*	S	Bend	trans	28.6	61.1	155.6	-60.8	-176	-179.2	176.1	0	116.4	F167	F167-K169 PolarHBondContact O-N 3.08Å
170	A	29.3	Very low	34.3	Very low	71 Å²	71	141.7 Å²	141.7	59%	0.587	71%	0.709	S	S	*	*			trans	-126	109.1	158.7	0	0	0	0	0	108.5	G168 F172	G168-A170 PolarHBondContact O-N 2.77Å; A170-F172 VanDerWaalsContact C-N 3.33Å; A170-F172 HydrophobicContact CB-CD2 4.33Å; A170-F172 HydrophobicContact CB-CE2 4.3Å; A170-F172 PolarHBondContact O-N 3.11Å
171	K	26.8	Very low	33.4	Very low	213 Å²	213	144.2 Å²	144.2	93%	0.926	72%	0.715	S	S	*	*			trans	-72.1	85.3	-178.7	-157.4	176.6	-170.1	175.7	0	108.2	R173	K171-R173 PolarHBondContact O-N 3.48Å
172	F	29.4	Very low	32.9	Very low	158 Å²	158	144.2 Å²	144.2	69%	0.693	72%	0.721	S	S	*	*			trans	-71.3	96.8	174.7	-93	-89.3	0	0	0	109.8	A170 F174	A170-F172 VanDerWaalsContact C-N 3.33Å; A170-F172 HydrophobicContact CB-CD2 4.33Å; A170-F172 HydrophobicContact CB-CE2 4.3Å; A170-F172 PolarHBondContact O-N 3.11Å; F172-F174 PolarHBondContact O-N 3.37Å
173	R	27.5	Very low	32.2	Very low	232 Å²	232	143.8 Å²	143.8	88%	0.875	73%	0.726	S	S	*	*			trans	-68.4	116.5	154.1	-102.6	-179.9	169.7	174.2	-3.6	106.5	K171 S175	K171-R173 PolarHBondContact O-N 3.48Å; R173-S175 PolarHBondContact O-N 3.38Å
174	F	32	Very low	31.9	Very low	200 Å²	200	142.8 Å²	142.8	88%	0.877	72%	0.722	S	S	*	*			trans	-57.6	100.9	167.1	-101.3	-96.2	0	0	0	108.4	F172	F172-F174 PolarHBondContact O-N 3.37Å
175	S	30.4	Very low	32.3	Very low	72 Å²	72	140.3 Å²	140.3	50%	0.503	71%	0.714	S	S	.	*			trans	-92.6	122.6	166.1	-173.2	0	0	0	0	106.6	R173 N177	R173-S175 PolarHBondContact O-N 3.38Å; S175-N177 PolarHBondContact O-N 3.47Å; S175-N177 WeakPolarHBondContact OG-CB 3.43Å
176	T	38.3	Very low	32.6	Very low	154 Å²	154	138.8 Å²	138.8	95%	0.945	71%	0.712	S	S	*	*			trans	-66.8	12.5	173.2	43.9	0	0	0	0	113.1	R178	T176-R178 PolarHBondContact O-N 3.24Å
177	N	30.2	Very low	33.1	Very low	95 Å²	95	132 Å²	132	51%	0.508	70%	0.704	S	S	.	*			trans	-82.5	112.8	-177	-143.3	-28.8	0	0	0	110.4	S175 S179 V180	S175-N177 PolarHBondContact O-N 3.47Å; S175-N177 WeakPolarHBondContact OG-CB 3.43Å; N177-S179 PolarHBondContact O-N 3.41Å; N177-S179 PolarHBondContact OD1-OG 3.04Å; N177-S179 VanDerWaalsContact OD1-OG 3.04Å; N177-V180 HydrophobicContact CB-CG2 4.49Å; N177-V180 PolarHBondContact O-N 3.47Å
178	R	39.4	Very low	33.4	Very low	218 Å²	218	127.5 Å²	127.5	82%	0.823	70%	0.7	S	S	*	*	H	α-helix	trans	-52	-20.5	-176.8	-149.6	175	-175.2	-166.6	1.1	113.8	T176	T176-R178 PolarHBondContact O-N 3.24Å
179	S	36.4	Very low	33.9	Very low	78 Å²	78	130.9 Å²	130.9	55%	0.545	71%	0.707	S	S	.	*	H	α-helix	trans	-80.6	-23.2	179.9	31.3	0	0	0	0	114.6	N177	N177-S179 PolarHBondContact O-N 3.41Å; N177-S179 PolarHBondContact OD1-OG 3.04Å; N177-S179 VanDerWaalsContact OD1-OG 3.04Å
180	V	35.4	Very low	34	Very low	76 Å²	76	125.8 Å²	125.8	46%	0.461	70%	0.699	S	S	.	*	H	α-helix	trans	-81.8	-30.2	179.5	-177.3	0	0	0	0	111.4	N177 L182 C183	N177-V180 HydrophobicContact CB-CG2 4.49Å; N177-V180 PolarHBondContact O-N 3.47Å; V180-L182 VanDerWaalsContact C-N 3.32Å; V180-L182 PolarHBondContact O-N 3.21Å; V180-C183 PolarHBondContact O-N 3.5Å
181	L	34.1	Very low	34.2	Very low	131 Å²	131	129.5 Å²	129.5	69%	0.686	71%	0.707	S	S	*	*	H	α-helix	trans	-70.8	-26.4	179.2	-153.7	73.8	0	0	0	112.7	L185	L181-L185 WeakPolarHBondContact O-CD1 3.45Å; L181-L185 WeakPolarHBondContact O-CG 3.43Å
182	L	38	Very low	34.3	Very low	124 Å²	124	127.6 Å²	127.6	65%	0.649	70%	0.701	S	S	*	*	H	α-helix	trans	-76.1	-24.4	175.7	-101.1	81.9	0	0	0	113.4	V180 L185 G186	V180-L182 VanDerWaalsContact C-N 3.32Å; V180-L182 PolarHBondContact O-N 3.21Å; L182-L185 PolarHBondContact O-N 2.95Å; L182-G186 PolarHBondContact O-N 3.29Å
183	C	31.7	Very low	34.3	Very low	102 Å²	102	127 Å²	127	69%	0.689	71%	0.711	S	S	*	*	H	α-helix	trans	-74.3	-33	-176.7	-158.3	0	0	0	0	112.1	V180 G186	V180-C183 PolarHBondContact O-N 3.5Å; C183-G186 PolarHBondContact O-N 3.28Å
184	C	35.1	Very low	34.5	Very low	93 Å²	93	127.7 Å²	127.7	63%	0.628	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-14.2	175.6	-64.2	0	0	0	0	113.9
185	L	42.8	Very low	34.6	Very low	121 Å²	121	126.6 Å²	126.6	63%	0.634	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-1.2	173.6	-64.1	170.2	0	0	0	112.3	L181 L182	L181-L185 WeakPolarHBondContact O-CD1 3.45Å; L181-L185 WeakPolarHBondContact O-CG 3.43Å; L182-L185 PolarHBondContact O-N 2.95Å
186	G	35.8	Very low	34.5	Very low	46 Å²	46	126.6 Å²	126.6	47%	0.474	73%	0.727	S	S	.	*			trans	-96.9	6.6	-169.3	0	0	0	0	0	117.1	L182 C183	L182-G186 PolarHBondContact O-N 3.29Å; C183-G186 PolarHBondContact O-N 3.28Å
187	S	38.2	Very low	34.6	Very low	114 Å²	114	128.8 Å²	128.8	80%	0.797	73%	0.727	S	S	*	*			trans	-99.1	16.4	-177.2	56.9	0	0	0	0	115.4
188	A	39.5	Very low	34.6	Very low	87 Å²	87	133.5 Å²	133.5	72%	0.719	74%	0.743	S	S	*	*			trans	-108.1	20.7	179.9	0	0	0	0	0	114.5	C190	A188-C190 PolarHBondContact O-N 3.28Å
189	T	36.5	Very low	34.3	Very low	140 Å²	140	130.8 Å²	130.8	86%	0.859	74%	0.739	S	S	*	*			trans	-77	27.1	176.5	41.9	0	0	0	0	114.6
190	C	28.2	Very low	34	Very low	117 Å²	117	133.1 Å²	133.1	79%	0.791	75%	0.745	S	S	*	*			trans	-127.5	57.2	177.5	-154.5	0	0	0	0	111.5	A188	A188-C190 PolarHBondContact O-N 3.28Å
191	I	33.5	Very low	33.8	Very low	149 Å²	149	134.5 Å²	134.5	76%	0.764	76%	0.759	S	S	*	*	S	Bend	trans	-151.2	102.9	155.8	-80.4	119	0	0	0	107.7
192	Q	29.2	Very low	33.6	Very low	173 Å²	173	134.4 Å²	134.4	81%	0.808	77%	0.767	S	S	*	*			trans	44.2	112.1	146.9	-64.2	-179.7	-42.1	0	0	120
193	T	28.7	Very low	33.3	Very low	146 Å²	146	138.2 Å²	138.2	90%	0.896	78%	0.782	S	S	*	*				147.3	96.6	123.2	36.8	0	0	0	0	110.3
194	R	30.8	Very low	33.4	Very low	246 Å²	246	136.8 Å²	136.8	93%	0.928	79%	0.785	S	S	*	*			trans	-124	120	156.8	-140.6	-179.1	-78.5	-147.3	1.5	107.9
195	L	34.6	Very low	33.3	Very low	176 Å²	176	138.2 Å²	138.2	92%	0.921	80%	0.795	S	S	*	*			trans	-47.2	143.3	173.6	-68.6	150.6	0	0	0	110.2
196	G	28.4	Very low	33	Very low	72 Å²	72	138.7 Å²	138.7	74%	0.742	81%	0.809	S	S	*	*			trans	-59.4	149.3	-161	0	0	0	0	0	116.3
197	Q	39.3	Very low	32.9	Very low	201 Å²	201	143.7 Å²	143.7	94%	0.939	86%	0.861	S	S	*	*			trans	-162.6	130.9	144.7	-106.4	170.9	-2.4	0	0	108.1
198	K	30.3	Very low	32.7	Very low	194 Å²	194	145.2 Å²	145.2	84%	0.843	86%	0.864	S	S	*	*			trans	-54.9	140.2	178	-75	171.4	165.6	-179.3	0	112.1
199	H	33.5	Very low	32.3	Very low	160 Å²	160	148.3 Å²	148.3	74%	0.741	87%	0.872	S	S	*	*				-176.7	115.8	109	-112	-83.7	0	0	0	110.9
200	D	30.6	Very low	32.1	Very low	127 Å²	127	148.7 Å²	148.7	68%	0.679	87%	0.872	S	S	*	*			trans	41.6	126.9	130.9	-61.9	-26.4	0	0	0	122
201	S	31.2	Very low	32.3	Very low	106 Å²	106	150.6 Å²	150.6	74%	0.741	88%	0.877	S	S	*	*			trans	82.4	107.2	134.2	-59.6	0	0	0	0	118.3
202	C	30.6	Very low	32.2	Very low	129 Å²	129	150.7 Å²	150.7	87%	0.872	88%	0.884	S	S	*	*				176.7	138.1	79.9	-101.2	0	0	0	0	110.7
203	E	31.3	Very low	32.4	Very low	203 Å²	203	149.2 Å²	149.2	95%	0.949	89%	0.889	S	S	*	*			trans	-68.3	162.1	179.6	-61.5	172.3	120.5	0	0	113.4
204	G	32.7	Very low	32.7	Very low	73 Å²	73	149.4 Å²	149.4	75%	0.753	89%	0.889	S	S	*	*			trans	159.8	71	164.8	0	0	0	0	0	113.6
205	S	34.3	Very low	32.8	Very low	122 Å²	122	142 Å²	142	85%	0.853	89%	0.886	S	S	*	*			trans	-128.8	108.5	157	-75.3	0	0	0	0	108.7
206	S	36.1	Very low	32.7	Very low	131 Å²	131	139.2 Å²	139.2	92%	0.916	88%	0.883	S	S	*	*			trans	-44.2	133.4	158.8	42.4	0	0	0	0	112.7
207	G	34.2	Very low	33.1	Very low	152 Å²	152	145.3 Å²	145.3	100%	1.567	90%	0.896	S	S	*	*			trans	159.9	0	174	0	0	0	0	0	110

Retrieved 207 of 207 residues in 221.6 ms (Link to these results)

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