A0A5K4F5C7_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4F5C7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 280 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	49	Very low	34.6	Very low	188 Å²	188	120.4 Å²	120.4	93%	0.926	60%	0.604	S	S	*	*				0	-71.6	0	-139.7	168.3	91.4	0	0	112.4	L3 S4 I5	M1-L3 VanDerWaalsContact C-N 3.27Å; M1-L3 PolarHBondContact O-N 3.3Å; M1-L3 VanDerWaalsContact O-N 3.11Å; M1-S4 PolarHBondContact O-N 2.89Å; M1-S4 VanDerWaalsContact O-N 3.09Å; M1-I5 PolarHBondContact O-N 3.49Å
2	I	37.8	Very low	35.1	Very low	131 Å²	131	120.4 Å²	120.4	67%	0.672	61%	0.606	S	S	*	*	H	α-helix	trans	-53	-38.6	-174.6	-61.3	172.5	0	0	0	113.7	I5 K6	I2-I5 PolarHBondContact O-N 2.87Å; I2-K6 PolarHBondContact O-N 2.83Å
3	L	32.2	Very low	35.5	Very low	133 Å²	133	117.5 Å²	117.5	70%	0.696	59%	0.593	S	S	*	*	H	α-helix	trans	-66.2	-39.8	-179	-156.8	73	0	0	0	113.1	M1 K6 I7	M1-L3 VanDerWaalsContact C-N 3.27Å; M1-L3 PolarHBondContact O-N 3.3Å; M1-L3 VanDerWaalsContact O-N 3.11Å; L3-K6 PolarHBondContact O-N 3.17Å; L3-I7 HydrophobicContact CG-CD1 4.47Å; L3-I7 WeakPolarHBondContact O-CG1 3.37Å; L3-I7 PolarHBondContact O-N 2.87Å; L3-I7 VanDerWaalsContact O-N 3.12Å
4	S	31	Very low	36.1	Very low	67 Å²	67	115.9 Å²	115.9	47%	0.469	58%	0.577	S	S	.	*	H	α-helix	trans	-63.2	-44.3	177.9	-48.2	0	0	0	0	111.5	M1 K6 I7 E8	M1-S4 PolarHBondContact O-N 2.89Å; M1-S4 VanDerWaalsContact O-N 3.09Å; S4-K6 VanDerWaalsContact C-N 3.27Å; S4-K6 PolarHBondContact O-N 3.02Å; S4-I7 PolarHBondContact O-N 3.12Å; S4-E8 PolarHBondContact O-N 3.11Å
5	I	34.4	Very low	36.9	Very low	94 Å²	94	116.8 Å²	116.8	48%	0.482	58%	0.579	S	S	.	*	H	α-helix	trans	-60.1	-39.2	178	-60.5	169.6	0	0	0	110.6	M1 I2 F9	M1-I5 PolarHBondContact O-N 3.49Å; I2-I5 PolarHBondContact O-N 2.87Å; I5-F9 WeakPolarHBondContact O-CB 3.2Å; I5-F9 PolarHBondContact O-N 3.26Å; I5-F9 VanDerWaalsContact O-N 3.08Å
6	K	29.2	Very low	37.3	Very low	135 Å²	135	111.8 Å²	111.8	59%	0.587	57%	0.566	S	S	*	*	H	α-helix	trans	-63.1	-45	172.8	-76.4	-170.7	172.6	-172.6	0	112.2	I2 L3 S4 E8 F9 Y10	I2-K6 PolarHBondContact O-N 2.83Å; L3-K6 PolarHBondContact O-N 3.17Å; S4-K6 VanDerWaalsContact C-N 3.27Å; S4-K6 PolarHBondContact O-N 3.02Å; K6-E8 PolarHBondContact O-N 2.78Å; K6-F9 PolarHBondContact O-N 3.33Å; K6-Y10 WeakPolarHBondContact O-CD2 3.39Å; K6-Y10 PolarHBondContact O-N 3.5Å
7	I	35.8	Very low	37.9	Very low	112 Å²	112	109.5 Å²	109.5	57%	0.574	56%	0.555	S	S	*	*	H	α-helix	trans	-63.4	-42.2	-178.1	-67.4	164.1	0	0	0	111.4	L3 S4 Y10 A11	L3-I7 HydrophobicContact CG-CD1 4.47Å; L3-I7 WeakPolarHBondContact O-CG1 3.37Å; L3-I7 PolarHBondContact O-N 2.87Å; L3-I7 VanDerWaalsContact O-N 3.12Å; S4-I7 PolarHBondContact O-N 3.12Å; I7-Y10 WeakPolarHBondContact O-CB 3.39Å; I7-Y10 PolarHBondContact O-N 3.41Å; I7-A11 PolarHBondContact O-N 3.29Å
8	E	30.8	Very low	38.3	Very low	126 Å²	126	104.1 Å²	104.1	59%	0.589	53%	0.53	S	S	*	.	H	α-helix	trans	-63.7	-42.2	174.2	-70.3	175.1	171.9	0	0	111.8	S4 K6 Y10 A11 I12	S4-E8 PolarHBondContact O-N 3.11Å; K6-E8 PolarHBondContact O-N 2.78Å; E8-Y10 VanDerWaalsContact C-N 3.3Å; E8-Y10 PolarHBondContact O-N 3.09Å; E8-A11 PolarHBondContact O-N 3.19Å; E8-I12 WeakPolarHBondContact O-CG1 3.38Å; E8-I12 PolarHBondContact O-N 2.97Å
9	F	32.2	Very low	38.7	Very low	143 Å²	143	101.4 Å²	101.4	63%	0.627	52%	0.521	S	S	*	.	H	α-helix	trans	-62.8	-36.1	175.5	-131.1	-96.2	0	0	0	112.6	I5 K6 N13	I5-F9 WeakPolarHBondContact O-CB 3.2Å; I5-F9 PolarHBondContact O-N 3.26Å; I5-F9 VanDerWaalsContact O-N 3.08Å; K6-F9 PolarHBondContact O-N 3.33Å; F9-N13 VanDerWaalsContact CD1-ND2 3.35Å; F9-N13 WeakPolarHBondContact CD1-ND2 3.41Å; F9-N13 WeakPolarHBondContact O-CB 3.23Å; F9-N13 PolarHBondContact O-N 3.15Å; F9-N13 PolarHBondContact O-ND2 2.84Å
10	Y	32.2	Very low	39.3	Very low	135 Å²	135	101.4 Å²	101.4	53%	0.529	52%	0.521	S	S	.	.	H	α-helix	trans	-64.1	-52.5	172.1	-95.8	-104.7	0	0	0	111.1	K6 I7 E8 I12 N13 Y14	K6-Y10 WeakPolarHBondContact O-CD2 3.39Å; K6-Y10 PolarHBondContact O-N 3.5Å; I7-Y10 WeakPolarHBondContact O-CB 3.39Å; I7-Y10 PolarHBondContact O-N 3.41Å; E8-Y10 VanDerWaalsContact C-N 3.3Å; E8-Y10 PolarHBondContact O-N 3.09Å; Y10-I12 VanDerWaalsContact C-N 3.34Å; Y10-I12 PolarHBondContact O-N 2.94Å; Y10-N13 PolarHBondContact O-N 2.88Å; Y10-Y14 HydrophobicContact CD1-CD2 4.26Å; Y10-Y14 AromaticContact CD1-CE2 3.8Å; Y10-Y14 HydrophobicContact CD1-CE2 3.8Å; Y10-Y14 HydrophobicContact CE1-CE2 4.23Å; Y10-Y14 WeakPolarHBondContact O-CD2 3.46Å; Y10-Y14 PolarHBondContact O-N 3.1Å
11	A	36	Very low	39.6	Very low	60 Å²	60	98.8 Å²	98.8	50%	0.496	51%	0.505	S	S	.	.	H	α-helix	trans	-57.4	-44.2	-177.9	0	0	0	0	0	112.7	I7 E8 H15	I7-A11 PolarHBondContact O-N 3.29Å; E8-A11 PolarHBondContact O-N 3.19Å; A11-H15 WeakPolarHBondContact O-CB 3.43Å; A11-H15 PolarHBondContact O-N 3.32Å
12	I	40.2	Very low	39.6	Very low	121 Å²	121	92.5 Å²	92.5	62%	0.621	47%	0.473	S	S	*	.	H	α-helix	trans	-66.3	-43.6	-180	-66.2	166.7	0	0	0	111.5	E8 Y10 G16	E8-I12 WeakPolarHBondContact O-CG1 3.38Å; E8-I12 PolarHBondContact O-N 2.97Å; Y10-I12 VanDerWaalsContact C-N 3.34Å; Y10-I12 PolarHBondContact O-N 2.94Å; I12-G16 PolarHBondContact O-N 3.44Å
13	N	40.8	Very low	40.1	Very low	83 Å²	83	90.1 Å²	90.1	44%	0.444	46%	0.461	S	S	.	.	H	α-helix	trans	-67.6	-43.3	178.6	-81.1	-77.8	0	0	0	112.1	F9 Y10 H15 G16 L17	F9-N13 VanDerWaalsContact CD1-ND2 3.35Å; F9-N13 WeakPolarHBondContact CD1-ND2 3.41Å; F9-N13 WeakPolarHBondContact O-CB 3.23Å; F9-N13 PolarHBondContact O-N 3.15Å; F9-N13 PolarHBondContact O-ND2 2.84Å; Y10-N13 PolarHBondContact O-N 2.88Å; N13-H15 PolarHBondContact O-N 3.15Å; N13-G16 PolarHBondContact O-N 3.13Å; N13-L17 WeakPolarHBondContact O-CB 3.25Å; N13-L17 WeakPolarHBondContact O-CG 3.4Å; N13-L17 PolarHBondContact O-N 2.67Å
14	Y	44	Very low	40.7	Very low	95 Å²	95	87 Å²	87	37%	0.373	45%	0.445	S	S	.	.	H	α-helix	trans	-63.4	-41.5	176.7	-88.7	-101	0	0	0	111.8	Y10 L17 A18	Y10-Y14 HydrophobicContact CD1-CD2 4.26Å; Y10-Y14 AromaticContact CD1-CE2 3.8Å; Y10-Y14 HydrophobicContact CD1-CE2 3.8Å; Y10-Y14 HydrophobicContact CE1-CE2 4.23Å; Y10-Y14 WeakPolarHBondContact O-CD2 3.46Å; Y10-Y14 PolarHBondContact O-N 3.1Å; Y14-L17 PolarHBondContact O-N 2.88Å; Y14-A18 VanDerWaalsContact O-CB 3.31Å; Y14-A18 WeakPolarHBondContact O-CB 3.35Å; Y14-A18 PolarHBondContact O-N 2.82Å
15	H	47.2	Very low	41.4	Very low	129 Å²	129	85.2 Å²	85.2	60%	0.597	43%	0.429	S	S	*	.	H	α-helix	trans	-67.7	-37.4	175.8	-164.6	-47.1	0	0	0	112.5	A11 N13 A18 C19	A11-H15 WeakPolarHBondContact O-CB 3.43Å; A11-H15 PolarHBondContact O-N 3.32Å; N13-H15 PolarHBondContact O-N 3.15Å; H15-A18 WeakPolarHBondContact O-CB 3.29Å; H15-A18 PolarHBondContact O-N 3.29Å; H15-C19 VanDerWaalsContact CE1-SG 3.51Å; H15-C19 PolarHBondContact ND1-SG 3.36Å; H15-C19 VanDerWaalsContact ND1-SG 3.37Å; H15-C19 PolarHBondContact O-N 3.4Å; H15-C19 PolarHBondContact O-SG 2.88Å; H15-C19 VanDerWaalsContact O-SG 3.33Å
16	G	44.7	Very low	41.9	Very low	36 Å²	36	83.1 Å²	83.1	37%	0.371	42%	0.421	S	S	.	.	H	α-helix	trans	-62.6	-45	174	0	0	0	0	0	112.4	I12 N13 C19 L20	I12-G16 PolarHBondContact O-N 3.44Å; N13-G16 PolarHBondContact O-N 3.13Å; G16-C19 PolarHBondContact O-N 2.93Å; G16-L20 WeakPolarHBondContact O-CG 3.47Å; G16-L20 PolarHBondContact O-N 2.7Å
17	L	46.5	Very low	42.7	Very low	74 Å²	74	83.1 Å²	83.1	39%	0.387	42%	0.421	S	S	.	.	H	α-helix	trans	-66.7	-37.5	175.2	-71	168.6	0	0	0	112.2	N13 Y14 L20 Y21	N13-L17 WeakPolarHBondContact O-CB 3.25Å; N13-L17 WeakPolarHBondContact O-CG 3.4Å; N13-L17 PolarHBondContact O-N 2.67Å; Y14-L17 PolarHBondContact O-N 2.88Å; L17-L20 PolarHBondContact O-N 3.49Å; L17-Y21 PolarHBondContact O-N 3.25Å
18	A	45.1	Very low	43	Very low	12 Å²	12	80.9 Å²	80.9	10%	0.099	41%	0.405	C	S	.	.	H	α-helix	trans	-58	-49	172.3	0	0	0	0	0	111.4	Y14 H15 L20 Y21 F22 Y253	Y14-A18 VanDerWaalsContact O-CB 3.31Å; Y14-A18 WeakPolarHBondContact O-CB 3.35Å; Y14-A18 PolarHBondContact O-N 2.82Å; H15-A18 WeakPolarHBondContact O-CB 3.29Å; H15-A18 PolarHBondContact O-N 3.29Å; A18-L20 VanDerWaalsContact C-N 3.33Å; A18-L20 PolarHBondContact O-N 2.99Å; A18-Y21 WeakPolarHBondContact O-CB 3.36Å; A18-Y21 PolarHBondContact O-N 3.49Å; A18-F22 WeakPolarHBondContact O-CB 3.37Å; A18-F22 PolarHBondContact O-N 2.93Å; A18-Y253 HydrophobicContact CB-CE1 4.45Å; A18-Y253 WeakPolarHBondContact CB-OH 3.07Å
19	C	46.7	Very low	43.7	Very low	52 Å²	52	76.4 Å²	76.4	35%	0.351	39%	0.385	S	S	.	.	H	α-helix	trans	-64.6	-35.3	177.4	-69.6	0	0	0	0	112.4	H15 G16 N23	H15-C19 VanDerWaalsContact CE1-SG 3.51Å; H15-C19 PolarHBondContact ND1-SG 3.36Å; H15-C19 VanDerWaalsContact ND1-SG 3.37Å; H15-C19 PolarHBondContact O-N 3.4Å; H15-C19 PolarHBondContact O-SG 2.88Å; H15-C19 VanDerWaalsContact O-SG 3.33Å; G16-C19 PolarHBondContact O-N 2.93Å; C19-N23 VanDerWaalsContact O-CB 3.26Å; C19-N23 WeakPolarHBondContact O-CB 3.29Å; C19-N23 PolarHBondContact O-N 3.04Å; C19-N23 PolarHBondContact O-ND2 3.07Å
20	L	49.7	Very low	44.3	Very low	102 Å²	102	76 Å²	76	53%	0.534	38%	0.384	S	S	.	.	H	α-helix	trans	-68.7	-40.6	173.7	-76.8	168.1	0	0	0	112.2	G16 L17 A18 N24	G16-L20 WeakPolarHBondContact O-CG 3.47Å; G16-L20 PolarHBondContact O-N 2.7Å; L17-L20 PolarHBondContact O-N 3.49Å; A18-L20 VanDerWaalsContact C-N 3.33Å; A18-L20 PolarHBondContact O-N 2.99Å; L20-N24 WeakPolarHBondContact O-CB 3.25Å; L20-N24 PolarHBondContact O-N 3.48Å; L20-N24 PolarHBondContact O-ND2 3.22Å
21	Y	46.5	Very low	44.8	Very low	47 Å²	47	74.4 Å²	74.4	18%	0.184	38%	0.381	C	S	.	.	H	α-helix	trans	-57	-56.1	170.1	-110.7	-105.7	0	0	0	110.4	L17 A18 N23 N24 F25 L218 L232 L249	L17-Y21 PolarHBondContact O-N 3.25Å; A18-Y21 WeakPolarHBondContact O-CB 3.36Å; A18-Y21 PolarHBondContact O-N 3.49Å; Y21-N23 PolarHBondContact O-N 3.08Å; Y21-N24 PolarHBondContact O-N 3.38Å; Y21-F25 WeakPolarHBondContact O-CB 3.34Å; Y21-F25 PolarHBondContact O-N 3.28Å; Y21-L218 HydrophobicContact CE2-CD1 3.46Å; Y21-L218 VanDerWaalsContact CE2-CD1 3.46Å; Y21-L218 WeakPolarHBondContact OH-CD1 3.37Å; Y21-L218 WeakPolarHBondContact OH-CD2 3.49Å; Y21-L232 HydrophobicContact CD2-CD1 4.14Å; Y21-L232 HydrophobicContact CE1-CD2 4.09Å; Y21-L232 HydrophobicContact CE2-CD1 3.58Å; Y21-L232 HydrophobicContact CE2-CD2 3.94Å; Y21-L232 HydrophobicContact CE2-CG 3.71Å; Y21-L249 HydrophobicContact CD1-CD1 4.01Å; Y21-L249 HydrophobicContact CE1-CD1 4.37Å
22	F	48.6	Very low	45	Very low	55 Å²	55	73.1 Å²	73.1	24%	0.241	36%	0.364	C	S	.	.	H	α-helix	trans	-62.6	-41.1	-175.6	-164.4	-99.9	0	0	0	112.3	A18 T26 I275 F279	A18-F22 WeakPolarHBondContact O-CB 3.37Å; A18-F22 PolarHBondContact O-N 2.93Å; F22-T26 HydrophobicContact CD1-CG2 4.04Å; F22-T26 HydrophobicContact CE1-CG2 3.75Å; F22-T26 HydrophobicContact CE2-CG2 4.38Å; F22-T26 HydrophobicContact CG-CG2 4.49Å; F22-T26 HydrophobicContact CZ-CG2 3.94Å; F22-T26 WeakPolarHBondContact O-CB 3.49Å; F22-T26 VanDerWaalsContact O-CG2 3.28Å; F22-T26 WeakPolarHBondContact O-CG2 3.46Å; F22-T26 PolarHBondContact O-N 2.83Å; F22-T26 PolarHBondContact O-OG1 2.99Å; F22-I275 HydrophobicContact CE2-CG2 4.49Å; F22-F279 HydrophobicContact CD2-CB 3.91Å; F22-F279 AromaticContact CD2-CD2 3.79Å; F22-F279 HydrophobicContact CD2-CD2 3.79Å; F22-F279 AromaticContact CD2-CG 3.93Å; F22-F279 HydrophobicContact CD2-CG 3.93Å; F22-F279 HydrophobicContact CE2-CB 3.64Å; F22-F279 AromaticContact CE2-CD2 3.92Å; F22-F279 HydrophobicContact CE2-CD2 3.92Å; F22-F279 HydrophobicContact CE2-CG 4.07Å; F22-F279 HydrophobicContact CZ-CB 4.03Å
23	N	47.9	Very low	44.9	Very low	82 Å²	82	70 Å²	70	44%	0.439	36%	0.357	S	S	.	.	H	α-helix	trans	-67.6	-36.6	176.6	-86.1	-82.4	0	0	0	113.5	C19 Y21 T26 K27	C19-N23 VanDerWaalsContact O-CB 3.26Å; C19-N23 WeakPolarHBondContact O-CB 3.29Å; C19-N23 PolarHBondContact O-N 3.04Å; C19-N23 PolarHBondContact O-ND2 3.07Å; Y21-N23 PolarHBondContact O-N 3.08Å; N23-T26 WeakPolarHBondContact CA-OG1 3.48Å; N23-T26 PolarHBondContact O-OG1 3.33Å; N23-K27 WeakPolarHBondContact O-CB 3.44Å; N23-K27 WeakPolarHBondContact O-CD 3.46Å; N23-K27 WeakPolarHBondContact O-CG 3.3Å; N23-K27 PolarHBondContact O-N 2.92Å
24	N	45.3	Very low	45.1	Very low	66 Å²	66	69.5 Å²	69.5	35%	0.353	35%	0.352	S	S	.	.	H	α-helix	trans	-78.5	-38.8	178	-70.8	-41	0	0	0	111.5	L20 Y21 K27 W28	L20-N24 WeakPolarHBondContact O-CB 3.25Å; L20-N24 PolarHBondContact O-N 3.48Å; L20-N24 PolarHBondContact O-ND2 3.22Å; Y21-N24 PolarHBondContact O-N 3.38Å; N24-K27 PolarHBondContact O-N 2.75Å; N24-W28 VanDerWaalsContact O-CB 3.3Å; N24-W28 WeakPolarHBondContact O-CB 3.4Å; N24-W28 PolarHBondContact O-N 3.24Å
25	F	46.1	Very low	45	Very low	30 Å²	30	67.8 Å²	67.8	13%	0.132	35%	0.347	C	S	.	.	H	α-helix	trans	-62.8	-45.3	174.2	-172.7	-112.4	0	0	0	111.7	Y21 W28 N29 L246 F272 I275	Y21-F25 WeakPolarHBondContact O-CB 3.34Å; Y21-F25 PolarHBondContact O-N 3.28Å; F25-W28 PolarHBondContact O-N 2.91Å; F25-N29 WeakPolarHBondContact CD1-ND2 3.38Å; F25-N29 WeakPolarHBondContact CE1-ND2 3.47Å; F25-N29 VanDerWaalsContact O-CB 3.3Å; F25-N29 WeakPolarHBondContact O-CB 3.46Å; F25-N29 PolarHBondContact O-N 3.4Å; F25-N29 PolarHBondContact O-ND2 3.39Å; F25-L246 HydrophobicContact CE2-CD2 4.34Å; F25-F272 AromaticContact CE1-CD1 3.85Å; F25-F272 HydrophobicContact CE1-CD1 3.85Å; F25-F272 HydrophobicContact CE1-CE1 4.03Å; F25-F272 HydrophobicContact CE2-CE1 4.02Å; F25-F272 AromaticContact CZ-CD1 3.61Å; F25-F272 HydrophobicContact CZ-CD1 3.61Å; F25-F272 AromaticContact CZ-CE1 3.41Å; F25-F272 HydrophobicContact CZ-CE1 3.41Å; F25-F272 VanDerWaalsContact CZ-CE1 3.41Å; F25-I275 HydrophobicContact CE1-CD1 4.18Å; F25-I275 HydrophobicContact CE1-CG2 4.14Å; F25-I275 HydrophobicContact CZ-CD1 4.06Å
26	T	44.7	Very low	44.6	Very low	50 Å²	50	67 Å²	67	31%	0.307	35%	0.346	S	S	.	.	H	α-helix	trans	-66.5	-38	175.5	50	0	0	0	0	112.7	F22 N23 F30	F22-T26 HydrophobicContact CD1-CG2 4.04Å; F22-T26 HydrophobicContact CE1-CG2 3.75Å; F22-T26 HydrophobicContact CE2-CG2 4.38Å; F22-T26 HydrophobicContact CG-CG2 4.49Å; F22-T26 HydrophobicContact CZ-CG2 3.94Å; F22-T26 WeakPolarHBondContact O-CB 3.49Å; F22-T26 VanDerWaalsContact O-CG2 3.28Å; F22-T26 WeakPolarHBondContact O-CG2 3.46Å; F22-T26 PolarHBondContact O-N 2.83Å; F22-T26 PolarHBondContact O-OG1 2.99Å; N23-T26 WeakPolarHBondContact CA-OG1 3.48Å; N23-T26 PolarHBondContact O-OG1 3.33Å; T26-F30 WeakPolarHBondContact O-CB 3.47Å; T26-F30 PolarHBondContact O-N 2.92Å
27	K	45.7	Very low	44.4	Very low	135 Å²	135	71.9 Å²	71.9	59%	0.587	36%	0.357	S	S	*	.	H	α-helix	trans	-63.8	-44.1	172.5	-76.3	170.8	-173.5	172.1	0	112.6	N23 N24 F30 H31	N23-K27 WeakPolarHBondContact O-CB 3.44Å; N23-K27 WeakPolarHBondContact O-CD 3.46Å; N23-K27 WeakPolarHBondContact O-CG 3.3Å; N23-K27 PolarHBondContact O-N 2.92Å; N24-K27 PolarHBondContact O-N 2.75Å; K27-F30 PolarHBondContact O-N 3.35Å; K27-H31 PolarHBondContact O-N 3.22Å
28	W	41.6	Very low	44.1	Very low	65 Å²	65	73.8 Å²	73.8	25%	0.246	36%	0.362	C	S	.	.	H	α-helix	trans	-63.3	-47.5	176.9	180	90.5	0	0	0	110.8	N24 F25 F30 H31 Q32 T236 L242	N24-W28 VanDerWaalsContact O-CB 3.3Å; N24-W28 WeakPolarHBondContact O-CB 3.4Å; N24-W28 PolarHBondContact O-N 3.24Å; F25-W28 PolarHBondContact O-N 2.91Å; W28-F30 PolarHBondContact O-N 3.03Å; W28-H31 WeakPolarHBondContact O-CB 3.35Å; W28-H31 PolarHBondContact O-N 3.46Å; W28-H31 VanDerWaalsContact O-N 3.17Å; W28-Q32 HydrophobicContact CD2-CG 4.21Å; W28-Q32 HydrophobicContact CE3-CG 4.3Å; W28-Q32 HydrophobicContact CH2-CG 4.27Å; W28-Q32 HydrophobicContact CZ2-CG 4.18Å; W28-Q32 HydrophobicContact CZ3-CG 4.32Å; W28-Q32 WeakPolarHBondContact O-CG 3.46Å; W28-Q32 PolarHBondContact O-N 3.04Å; W28-T236 WeakPolarHBondContact CZ2-O 3.43Å; W28-T236 PolarHBondContact NE1-O 3.03Å; W28-L242 HydrophobicContact CH2-CD2 4.15Å; W28-L242 HydrophobicContact CZ3-CD2 4.44Å
29	N	46	Very low	43.6	Very low	32 Å²	32	81 Å²	81	17%	0.171	39%	0.388	C	S	.	.	H	α-helix	trans	-64.1	-37.1	175.7	-78.1	-57.2	0	0	0	113.1	F25 H31 Q32 A33 F272	F25-N29 WeakPolarHBondContact CD1-ND2 3.38Å; F25-N29 WeakPolarHBondContact CE1-ND2 3.47Å; F25-N29 VanDerWaalsContact O-CB 3.3Å; F25-N29 WeakPolarHBondContact O-CB 3.46Å; F25-N29 PolarHBondContact O-N 3.4Å; F25-N29 PolarHBondContact O-ND2 3.39Å; N29-H31 VanDerWaalsContact C-N 3.35Å; N29-Q32 PolarHBondContact O-N 2.86Å; N29-A33 WeakPolarHBondContact O-CB 3.47Å; N29-A33 PolarHBondContact O-N 2.77Å; N29-F272 WeakPolarHBondContact OD1-CE1 3.42Å; N29-F272 WeakPolarHBondContact OD1-CZ 3.44Å
30	F	45.4	Very low	43.2	Very low	135 Å²	135	85.2 Å²	85.2	59%	0.592	40%	0.401	S	S	*	.	H	α-helix	trans	-62.7	-42.6	172.8	-177.2	-95.8	0	0	0	111.2	T26 K27 W28 A33 Q34	T26-F30 WeakPolarHBondContact O-CB 3.47Å; T26-F30 PolarHBondContact O-N 2.92Å; K27-F30 PolarHBondContact O-N 3.35Å; W28-F30 PolarHBondContact O-N 3.03Å; F30-A33 PolarHBondContact O-N 2.85Å; F30-Q34 HydrophobicContact CD1-CG 4.24Å; F30-Q34 HydrophobicContact CE1-CG 3.94Å; F30-Q34 HydrophobicContact CZ-CG 4.19Å; F30-Q34 VanDerWaalsContact CZ-NE2 3.32Å; F30-Q34 VanDerWaalsContact O-CG 3.22Å; F30-Q34 WeakPolarHBondContact O-CG 3.43Å; F30-Q34 PolarHBondContact O-N 3.11Å
31	H	42	Very low	42.8	Very low	101 Å²	101	83.7 Å²	83.7	47%	0.468	40%	0.396	S	S	.	.	H	α-helix	trans	-62.5	-44.4	173.9	-179.4	-103.1	0	0	0	111.7	K27 W28 N29 Q34 Q35	K27-H31 PolarHBondContact O-N 3.22Å; W28-H31 WeakPolarHBondContact O-CB 3.35Å; W28-H31 PolarHBondContact O-N 3.46Å; W28-H31 VanDerWaalsContact O-N 3.17Å; N29-H31 VanDerWaalsContact C-N 3.35Å; H31-Q34 WeakPolarHBondContact O-CB 3.49Å; H31-Q34 PolarHBondContact O-N 3.4Å; H31-Q35 PolarHBondContact CE1-NE2 3.01Å; H31-Q35 PolarHBondContact NE2-NE2 2.93Å; H31-Q35 WeakPolarHBondContact O-CG 3.47Å; H31-Q35 PolarHBondContact O-N 2.74Å
32	Q	39.9	Very low	42.5	Very low	33 Å²	33	90 Å²	90	15%	0.154	42%	0.419	C	S	.	.	H	α-helix	trans	-63	-45.6	176.5	-65.5	-60.9	8.5	0	0	112.5	W28 N29 Q34 Q35 I36 N237	W28-Q32 HydrophobicContact CD2-CG 4.21Å; W28-Q32 HydrophobicContact CE3-CG 4.3Å; W28-Q32 HydrophobicContact CH2-CG 4.27Å; W28-Q32 HydrophobicContact CZ2-CG 4.18Å; W28-Q32 HydrophobicContact CZ3-CG 4.32Å; W28-Q32 WeakPolarHBondContact O-CG 3.46Å; W28-Q32 PolarHBondContact O-N 3.04Å; N29-Q32 PolarHBondContact O-N 2.86Å; Q32-Q34 PolarHBondContact O-N 3.23Å; Q32-Q35 CarbonylContact O-C 3.6Å; Q32-Q35 PolarHBondContact O-N 2.97Å; Q32-I36 WeakPolarHBondContact O-CB 3.31Å; Q32-I36 WeakPolarHBondContact O-CG1 3.31Å; Q32-I36 PolarHBondContact O-N 3.31Å; Q32-N237 PolarHBondContact NE2-OD1 3.25Å
33	A	37.8	Very low	41.9	Very low	56 Å²	56	93.6 Å²	93.6	46%	0.463	44%	0.435	S	S	.	.	H	α-helix	trans	-56.9	-38.1	175	0	0	0	0	0	112	N29 F30 K37	N29-A33 WeakPolarHBondContact O-CB 3.47Å; N29-A33 PolarHBondContact O-N 2.77Å; F30-A33 PolarHBondContact O-N 2.85Å; A33-K37 WeakPolarHBondContact O-CB 3.32Å; A33-K37 PolarHBondContact O-N 2.79Å
34	Q	46.6	Very low	41.5	Very low	73 Å²	73	93 Å²	93	34%	0.341	43%	0.431	S	S	.	.	H	α-helix	trans	-68.6	-36.6	173.8	-67.6	-70.7	-11.2	0	0	113	F30 H31 Q32 K38	F30-Q34 HydrophobicContact CD1-CG 4.24Å; F30-Q34 HydrophobicContact CE1-CG 3.94Å; F30-Q34 HydrophobicContact CZ-CG 4.19Å; F30-Q34 VanDerWaalsContact CZ-NE2 3.32Å; F30-Q34 VanDerWaalsContact O-CG 3.22Å; F30-Q34 WeakPolarHBondContact O-CG 3.43Å; F30-Q34 PolarHBondContact O-N 3.11Å; H31-Q34 WeakPolarHBondContact O-CB 3.49Å; H31-Q34 PolarHBondContact O-N 3.4Å; Q32-Q34 PolarHBondContact O-N 3.23Å; Q34-K38 WeakPolarHBondContact O-CD 3.49Å; Q34-K38 VanDerWaalsContact O-CG 3.26Å; Q34-K38 WeakPolarHBondContact O-CG 3.37Å; Q34-K38 PolarHBondContact O-N 2.92Å; Q34-K38 VanDerWaalsContact O-N 3.16Å
35	Q	40.2	Very low	41.4	Very low	59 Å²	59	95.6 Å²	95.6	28%	0.276	44%	0.441	S	S	.	.	H	α-helix	trans	-72.6	-46.3	175.9	-61.3	-63.4	6.2	0	0	111.7	H31 Q32 K37 K38 Y39	H31-Q35 PolarHBondContact CE1-NE2 3.01Å; H31-Q35 PolarHBondContact NE2-NE2 2.93Å; H31-Q35 WeakPolarHBondContact O-CG 3.47Å; H31-Q35 PolarHBondContact O-N 2.74Å; Q32-Q35 CarbonylContact O-C 3.6Å; Q32-Q35 PolarHBondContact O-N 2.97Å; Q35-K37 VanDerWaalsContact C-N 3.31Å; Q35-K37 PolarHBondContact O-N 3.46Å; Q35-K38 WeakPolarHBondContact O-CB 3.34Å; Q35-K38 PolarHBondContact O-N 3Å; Q35-Y39 VanDerWaalsContact O-CD2 3.29Å; Q35-Y39 WeakPolarHBondContact O-CD2 3.47Å; Q35-Y39 PolarHBondContact O-N 2.78Å
36	I	39.5	Very low	41.3	Very low	111 Å²	111	100.6 Å²	100.6	57%	0.569	46%	0.463	S	S	*	.	H	α-helix	trans	-56.7	-45.2	174.6	-66.4	166.8	0	0	0	110.1	Q32 K38 Y39 F40	Q32-I36 WeakPolarHBondContact O-CB 3.31Å; Q32-I36 WeakPolarHBondContact O-CG1 3.31Å; Q32-I36 PolarHBondContact O-N 3.31Å; I36-K38 VanDerWaalsContact C-N 3.34Å; I36-K38 PolarHBondContact O-N 3.49Å; I36-Y39 PolarHBondContact O-N 3.38Å; I36-F40 WeakPolarHBondContact O-CB 3.15Å; I36-F40 PolarHBondContact O-N 2.82Å
37	K	41.4	Very low	41.1	Very low	139 Å²	139	103.7 Å²	103.7	60%	0.604	47%	0.474	S	S	*	.	H	α-helix	trans	-59.5	-39.8	175	-173.4	172.9	-175.7	174.5	0	113	A33 Q35 T41	A33-K37 WeakPolarHBondContact O-CB 3.32Å; A33-K37 PolarHBondContact O-N 2.79Å; Q35-K37 VanDerWaalsContact C-N 3.31Å; Q35-K37 PolarHBondContact O-N 3.46Å; K37-T41 VanDerWaalsContact O-CB 3.32Å; K37-T41 WeakPolarHBondContact O-CB 3.4Å; K37-T41 PolarHBondContact O-N 3.16Å; K37-T41 PolarHBondContact O-OG1 3.48Å
38	K	39.5	Very low	41	Very low	114 Å²	114	102.1 Å²	102.1	50%	0.496	47%	0.472	S	S	.	.	H	α-helix	trans	-66.7	-42.4	173.9	-73.1	165.7	-175.5	172.8	0	112.3	Q34 Q35 I36 R42	Q34-K38 WeakPolarHBondContact O-CD 3.49Å; Q34-K38 VanDerWaalsContact O-CG 3.26Å; Q34-K38 WeakPolarHBondContact O-CG 3.37Å; Q34-K38 PolarHBondContact O-N 2.92Å; Q34-K38 VanDerWaalsContact O-N 3.16Å; Q35-K38 WeakPolarHBondContact O-CB 3.34Å; Q35-K38 PolarHBondContact O-N 3Å; I36-K38 VanDerWaalsContact C-N 3.34Å; I36-K38 PolarHBondContact O-N 3.49Å; K38-R42 WeakPolarHBondContact O-CB 3.41Å; K38-R42 WeakPolarHBondContact O-CG 3.49Å; K38-R42 PolarHBondContact O-N 2.83Å
39	Y	35.3	Very low	41.2	Very low	165 Å²	165	102.6 Å²	102.6	65%	0.647	48%	0.482	S	S	*	.	H	α-helix	trans	-62.4	-47.3	175.1	-84.9	-73.2	0	0	0	111.5	Q35 I36 T41 R42 F43	Q35-Y39 VanDerWaalsContact O-CD2 3.29Å; Q35-Y39 WeakPolarHBondContact O-CD2 3.47Å; Q35-Y39 PolarHBondContact O-N 2.78Å; I36-Y39 PolarHBondContact O-N 3.38Å; Y39-T41 PolarHBondContact O-N 2.97Å; Y39-R42 PolarHBondContact O-N 2.98Å; Y39-F43 WeakPolarHBondContact O-CB 3.49Å; Y39-F43 PolarHBondContact O-N 2.94Å
40	F	38	Very low	41.1	Very low	140 Å²	140	104.1 Å²	104.1	61%	0.614	49%	0.49	S	S	*	.	H	α-helix	trans	-64.5	-40.1	179.5	-157.6	-110.3	0	0	0	112.1	I36 F43 I44	I36-F40 WeakPolarHBondContact O-CB 3.15Å; I36-F40 PolarHBondContact O-N 2.82Å; F40-F43 PolarHBondContact O-N 3.27Å; F40-I44 HydrophobicContact CD1-CD1 3.73Å; F40-I44 HydrophobicContact CE1-CD1 3.55Å; F40-I44 HydrophobicContact CE1-CG1 4.48Å; F40-I44 HydrophobicContact CZ-CD1 4.27Å; F40-I44 WeakPolarHBondContact O-CG1 3.44Å; F40-I44 PolarHBondContact O-N 3.01Å
41	T	41.8	Very low	41	Very low	69 Å²	69	99.6 Å²	99.6	42%	0.423	48%	0.478	S	S	.	.	H	α-helix	trans	-64.2	-41.3	174.8	-58.5	0	0	0	0	111.5	K37 Y39 Q45	K37-T41 VanDerWaalsContact O-CB 3.32Å; K37-T41 WeakPolarHBondContact O-CB 3.4Å; K37-T41 PolarHBondContact O-N 3.16Å; K37-T41 PolarHBondContact O-OG1 3.48Å; Y39-T41 PolarHBondContact O-N 2.97Å; T41-Q45 WeakPolarHBondContact O-CB 3.31Å; T41-Q45 WeakPolarHBondContact O-CG 3.03Å; T41-Q45 PolarHBondContact O-N 3.2Å
42	R	39.3	Very low	41.1	Very low	180 Å²	180	97.1 Å²	97.1	68%	0.679	48%	0.475	S	S	*	.	H	α-helix	trans	-66.2	-36.3	173	-80.2	-178.4	173	176.5	-1.8	112.7	K38 Y39 K46	K38-R42 WeakPolarHBondContact O-CB 3.41Å; K38-R42 WeakPolarHBondContact O-CG 3.49Å; K38-R42 PolarHBondContact O-N 2.83Å; Y39-R42 PolarHBondContact O-N 2.98Å; R42-K46 WeakPolarHBondContact O-CB 3.43Å; R42-K46 PolarHBondContact O-N 2.83Å
43	F	35.1	Very low	41.5	Very low	130 Å²	130	102.2 Å²	102.2	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-64.2	-52.1	178.1	-163.4	-83.2	0	0	0	110.3	Y39 F40 Q45 K46 E47	Y39-F43 WeakPolarHBondContact O-CB 3.49Å; Y39-F43 PolarHBondContact O-N 2.94Å; F40-F43 PolarHBondContact O-N 3.27Å; F43-Q45 PolarHBondContact O-N 3.23Å; F43-K46 PolarHBondContact O-N 3.33Å; F43-K46 VanDerWaalsContact O-N 3.09Å; F43-E47 WeakPolarHBondContact O-CB 3.45Å; F43-E47 PolarHBondContact O-N 3.44Å
44	I	41.1	Very low	41.9	Very low	69 Å²	69	106.5 Å²	106.5	35%	0.354	50%	0.504	S	S	.	.	H	α-helix	trans	-60.3	-41.9	176.1	-67.7	171.3	0	0	0	111.6	F40 K46 E47 N48	F40-I44 HydrophobicContact CD1-CD1 3.73Å; F40-I44 HydrophobicContact CE1-CD1 3.55Å; F40-I44 HydrophobicContact CE1-CG1 4.48Å; F40-I44 HydrophobicContact CZ-CD1 4.27Å; F40-I44 WeakPolarHBondContact O-CG1 3.44Å; F40-I44 PolarHBondContact O-N 3.01Å; I44-K46 VanDerWaalsContact C-N 3.33Å; I44-K46 PolarHBondContact O-N 2.63Å; I44-E47 PolarHBondContact O-N 3.48Å; I44-N48 VanDerWaalsContact O-CB 3.32Å; I44-N48 WeakPolarHBondContact O-CB 3.47Å; I44-N48 PolarHBondContact O-N 2.99Å; I44-N48 PolarHBondContact O-ND2 3.27Å
45	Q	42.7	Very low	41.7	Very low	121 Å²	121	108 Å²	108	57%	0.565	52%	0.515	S	S	*	.	H	α-helix	trans	-64.4	-35.8	175.4	-78.5	-177.7	-23.4	0	0	112.8	T41 F43 T49	T41-Q45 WeakPolarHBondContact O-CB 3.31Å; T41-Q45 WeakPolarHBondContact O-CG 3.03Å; T41-Q45 PolarHBondContact O-N 3.2Å; F43-Q45 PolarHBondContact O-N 3.23Å; Q45-T49 WeakPolarHBondContact O-CB 3.39Å; Q45-T49 WeakPolarHBondContact O-CG2 3.45Å; Q45-T49 PolarHBondContact O-N 3.32Å; Q45-T49 PolarHBondContact O-OG1 2.9Å
46	K	43.1	Very low	41.7	Very low	136 Å²	136	113.2 Å²	113.2	59%	0.591	54%	0.539	S	S	*	.	H	α-helix	trans	-71.4	-45.6	175.4	-172.3	179.5	175.8	-170.9	0	111.2	R42 F43 I44 N48 T49 D50	R42-K46 WeakPolarHBondContact O-CB 3.43Å; R42-K46 PolarHBondContact O-N 2.83Å; F43-K46 PolarHBondContact O-N 3.33Å; F43-K46 VanDerWaalsContact O-N 3.09Å; I44-K46 VanDerWaalsContact C-N 3.33Å; I44-K46 PolarHBondContact O-N 2.63Å; K46-N48 PolarHBondContact O-N 2.86Å; K46-T49 WeakPolarHBondContact CA-OG1 3.44Å; K46-T49 CarbonylContact O-C 3.51Å; K46-T49 PolarHBondContact O-N 2.76Å; K46-T49 VanDerWaalsContact O-N 3.08Å; K46-T49 PolarHBondContact O-OG1 3.42Å; K46-D50 WeakPolarHBondContact CE-OD2 3.2Å; K46-D50 WeakPolarHBondContact O-CB 3.37Å; K46-D50 PolarHBondContact O-N 2.83Å
47	E	41.7	Very low	41.8	Very low	115 Å²	115	114.8 Å²	114.8	54%	0.537	55%	0.548	S	S	.	.	H	α-helix	trans	-59	-47.2	177.7	-170.5	162	-149.8	0	0	111.1	F43 I44 T49 D50 A51	F43-E47 WeakPolarHBondContact O-CB 3.45Å; F43-E47 PolarHBondContact O-N 3.44Å; I44-E47 PolarHBondContact O-N 3.48Å; E47-T49 VanDerWaalsContact C-N 3.28Å; E47-T49 PolarHBondContact O-N 2.94Å; E47-D50 PolarHBondContact O-N 3Å; E47-A51 VanDerWaalsContact O-CB 3.24Å; E47-A51 WeakPolarHBondContact O-CB 3.46Å; E47-A51 PolarHBondContact O-N 3.1Å
48	N	42.3	Very low	41.6	Very low	102 Å²	102	116 Å²	116	55%	0.545	55%	0.553	S	S	.	*	H	α-helix	trans	-62.1	-30.4	174.1	-70.4	-16.3	0	0	0	113.6	I44 K46 A52	I44-N48 VanDerWaalsContact O-CB 3.32Å; I44-N48 WeakPolarHBondContact O-CB 3.47Å; I44-N48 PolarHBondContact O-N 2.99Å; I44-N48 PolarHBondContact O-ND2 3.27Å; K46-N48 PolarHBondContact O-N 2.86Å; N48-A52 VanDerWaalsContact O-CB 3.32Å; N48-A52 WeakPolarHBondContact O-CB 3.29Å; N48-A52 PolarHBondContact O-N 3.16Å
49	T	46.5	Very low	41.7	Very low	75 Å²	75	117.5 Å²	117.5	46%	0.46	57%	0.566	S	S	.	*	H	α-helix	trans	-92.9	-11.5	179.6	52.5	0	0	0	0	114.5	Q45 K46 E47 K53	Q45-T49 WeakPolarHBondContact O-CB 3.39Å; Q45-T49 WeakPolarHBondContact O-CG2 3.45Å; Q45-T49 PolarHBondContact O-N 3.32Å; Q45-T49 PolarHBondContact O-OG1 2.9Å; K46-T49 WeakPolarHBondContact CA-OG1 3.44Å; K46-T49 CarbonylContact O-C 3.51Å; K46-T49 PolarHBondContact O-N 2.76Å; K46-T49 VanDerWaalsContact O-N 3.08Å; K46-T49 PolarHBondContact O-OG1 3.42Å; E47-T49 VanDerWaalsContact C-N 3.28Å; E47-T49 PolarHBondContact O-N 2.94Å; T49-K53 VanDerWaalsContact O-CD 3.28Å; T49-K53 WeakPolarHBondContact O-CD 3.15Å; T49-K53 WeakPolarHBondContact O-CE 3.3Å; T49-K53 VanDerWaalsContact O-CG 3.28Å; T49-K53 WeakPolarHBondContact O-CG 3.3Å; T49-K53 PolarHBondContact O-NZ 2.85Å; T49-K53 VanDerWaalsContact O-NZ 3.08Å
50	D	44.6	Very low	42	Very low	64 Å²	64	119.5 Å²	119.5	34%	0.342	58%	0.579	S	S	.	*	H	α-helix	trans	-98.4	-19.7	169.2	-71.4	-20.7	0	0	0	111.8	K46 E47 K53	K46-D50 WeakPolarHBondContact CE-OD2 3.2Å; K46-D50 WeakPolarHBondContact O-CB 3.37Å; K46-D50 PolarHBondContact O-N 2.83Å; E47-D50 PolarHBondContact O-N 3Å; D50-K53 IonicContact OD1-NZ 3.03Å; D50-K53 PolarHBondContact OD1-NZ 3.15Å
51	A	42.8	Very low	41.9	Very low	40 Å²	40	121.6 Å²	121.6	33%	0.331	59%	0.59	S	S	.	*	H	α-helix	trans	-69.6	-56	163.5	0	0	0	0	0	111.1	E47 K53 K54 D55	E47-A51 VanDerWaalsContact O-CB 3.24Å; E47-A51 WeakPolarHBondContact O-CB 3.46Å; E47-A51 PolarHBondContact O-N 3.1Å; A51-K53 PolarHBondContact O-N 2.69Å; A51-K54 WeakPolarHBondContact O-CA 3.3Å; A51-K54 PolarHBondContact O-N 3.26Å; A51-D55 VanDerWaalsContact C-OD2 3.29Å; A51-D55 VanDerWaalsContact O-CG 3.23Å; A51-D55 PolarHBondContact O-N 3.46Å; A51-D55 VanDerWaalsContact O-N 3.07Å; A51-D55 VanDerWaalsContact O-OD2 3.14Å
52	A	44.5	Very low	41.6	Very low	49 Å²	49	124.3 Å²	124.3	41%	0.405	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.7	-13.1	-179.8	0	0	0	0	0	115	N48 H56	N48-A52 VanDerWaalsContact O-CB 3.32Å; N48-A52 WeakPolarHBondContact O-CB 3.29Å; N48-A52 PolarHBondContact O-N 3.16Å; A52-H56 PolarHBondContact O-CD2 3.5Å
53	K	48	Very low	41.5	Very low	140 Å²	140	121.3 Å²	121.3	61%	0.609	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-14.5	171.8	-70.6	174.8	-158.1	138.2	0	114.3	T49 D50 A51	T49-K53 VanDerWaalsContact O-CD 3.28Å; T49-K53 WeakPolarHBondContact O-CD 3.15Å; T49-K53 WeakPolarHBondContact O-CE 3.3Å; T49-K53 VanDerWaalsContact O-CG 3.28Å; T49-K53 WeakPolarHBondContact O-CG 3.3Å; T49-K53 PolarHBondContact O-NZ 2.85Å; T49-K53 VanDerWaalsContact O-NZ 3.08Å; D50-K53 IonicContact OD1-NZ 3.03Å; D50-K53 PolarHBondContact OD1-NZ 3.15Å; A51-K53 PolarHBondContact O-N 2.69Å
54	K	45.5	Very low	41.6	Very low	145 Å²	145	123.5 Å²	123.5	63%	0.63	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-35.4	174.5	-70.3	176.4	179.3	178.4	0	111.7	A51 H56 L57	A51-K54 WeakPolarHBondContact O-CA 3.3Å; A51-K54 PolarHBondContact O-N 3.26Å; K54-H56 VanDerWaalsContact C-N 3.26Å; K54-H56 PolarHBondContact O-N 3.27Å; K54-L57 PolarHBondContact O-N 3.43Å
55	D	42	Very low	41.3	Very low	106 Å²	106	127.7 Å²	127.7	57%	0.567	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-59.9	-37	-177.3	-56.3	-30.1	0	0	0	111.7	A51 L57 F58	A51-D55 VanDerWaalsContact C-OD2 3.29Å; A51-D55 VanDerWaalsContact O-CG 3.23Å; A51-D55 PolarHBondContact O-N 3.46Å; A51-D55 VanDerWaalsContact O-N 3.07Å; A51-D55 VanDerWaalsContact O-OD2 3.14Å; D55-L57 PolarHBondContact O-N 3Å; D55-L57 VanDerWaalsContact O-N 3.09Å; D55-F58 PolarHBondContact O-N 3.38Å
56	H	40.4	Very low	40.7	Very low	167 Å²	167	130.4 Å²	130.4	77%	0.773	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-69.4	2.1	174.3	-72.8	-48.3	0	0	0	115.9	A52 K54	A52-H56 PolarHBondContact O-CD2 3.5Å; K54-H56 VanDerWaalsContact C-N 3.26Å; K54-H56 PolarHBondContact O-N 3.27Å
57	L	41.6	Very low	40.3	Very low	144 Å²	144	133.6 Å²	133.6	75%	0.754	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-114.5	-9.3	-179.9	-157.8	125.6	0	0	0	114.1	K54 D55	K54-L57 PolarHBondContact O-N 3.43Å; D55-L57 PolarHBondContact O-N 3Å; D55-L57 VanDerWaalsContact O-N 3.09Å
58	F	37.5	Very low	39.8	Very low	166 Å²	166	136 Å²	136	73%	0.728	68%	0.682	S	S	*	*	S	Bend	trans	-105	-1.8	-178	-87.2	-85.7	0	0	0	115	D55 K60	D55-F58 PolarHBondContact O-N 3.38Å; F58-K60 PolarHBondContact O-N 3.21Å
59	D	41.4	Very low	39.2	Very low	144 Å²	144	138.5 Å²	138.5	77%	0.77	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	32.2	-166.3	-152.2	18.9	0	0	0	115.1
60	K	42.8	Very low	38.6	Very low	208 Å²	208	139.6 Å²	139.6	90%	0.904	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.1	1.1	-169.3	-115.3	177.3	-172.3	178.8	0	118.9	F58	F58-K60 PolarHBondContact O-N 3.21Å
61	Q	36.2	Very low	37.9	Very low	183 Å²	183	146.2 Å²	146.2	86%	0.855	72%	0.722	S	S	*	*	S	Bend	trans	-137.1	-19.2	-169	-153.1	164.3	5.7	0	0	119.5
62	V	34.8	Very low	37.3	Very low	126 Å²	126	153.7 Å²	153.7	76%	0.764	75%	0.747	S	S	*	*			trans	-134.6	74.1	-178	-165.7	0	0	0	0	112.8	Q64	V62-Q64 VanDerWaalsContact C-N 3.26Å; V62-Q64 PolarHBondContact O-N 3.13Å
63	S	36.4	Very low	36.8	Very low	117 Å²	117	155.1 Å²	155.1	82%	0.818	75%	0.751	S	S	*	*			trans	-88	20.5	173.9	-172.1	0	0	0	0	113.3
64	Q	38.3	Very low	36.1	Very low	176 Å²	176	154 Å²	154	82%	0.822	76%	0.758	S	S	*	*			trans	-142.5	39	-159.1	-153.9	177.7	-4.4	0	0	115.5	V62	V62-Q64 VanDerWaalsContact C-N 3.26Å; V62-Q64 PolarHBondContact O-N 3.13Å
65	E	35.1	Very low	35.4	Very low	158 Å²	158	155.6 Å²	155.6	74%	0.738	77%	0.772	S	S	*	*			trans	-145.4	60.1	166.3	-127.8	168.1	-116.4	0	0	113.7	K67	E65-K67 PolarHBondContact O-N 3.17Å
66	H	30	Very low	34.8	Very low	178 Å²	178	157.9 Å²	157.9	82%	0.824	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	85.5	172.2	-83.9	-103.2	0	0	0	112.2
67	K	34.9	Very low	34.5	Very low	203 Å²	203	158.7 Å²	158.7	88%	0.883	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-174	0.9	143.8	-107.1	160.2	-173.6	177.2	0	118.6	E65 L69	E65-K67 PolarHBondContact O-N 3.17Å; K67-L69 VanDerWaalsContact C-N 3.28Å; K67-L69 PolarHBondContact O-N 2.72Å
68	M	30.6	Very low	33.7	Very low	164 Å²	164	158.2 Å²	158.2	81%	0.808	79%	0.789	S	S	*	*			trans	-71.5	82.2	173.4	-73.9	-154.1	178.3	0	0	112.3	T70	M68-T70 PolarHBondContact O-N 2.78Å
69	L	29.7	Very low	33.3	Very low	155 Å²	155	158.2 Å²	158.2	81%	0.812	79%	0.791	S	S	*	*			trans	-75.3	56.8	174.3	-170.1	67.9	0	0	0	110.9	K67 R71	K67-L69 VanDerWaalsContact C-N 3.28Å; K67-L69 PolarHBondContact O-N 2.72Å; L69-R71 PolarHBondContact O-N 2.98Å
70	T	32.7	Very low	32.8	Very low	98 Å²	98	157 Å²	157	60%	0.601	78%	0.784	S	S	*	*			trans	-76.1	69.6	176.5	-48.7	0	0	0	0	109.5	M68 F72	M68-T70 PolarHBondContact O-N 2.78Å; T70-F72 VanDerWaalsContact C-N 3.33Å; T70-F72 HydrophobicContact CG2-CD2 4.14Å; T70-F72 HydrophobicContact CG2-CE2 3.8Å; T70-F72 PolarHBondContact O-N 3.05Å
71	R	31.4	Very low	32	Very low	203 Å²	203	154.7 Å²	154.7	77%	0.766	78%	0.78	S	S	*	*			trans	-75.3	80.9	-171.5	-165.1	-167.4	-164.9	-172.3	6.7	110.6	L69 T73	L69-R71 PolarHBondContact O-N 2.98Å; R71-T73 VanDerWaalsContact C-N 3.3Å; R71-T73 PolarHBondContact O-N 2.84Å; R71-T73 PolarHBondContact O-OG1 3.39Å
72	F	29.6	Very low	31.7	Very low	197 Å²	197	154 Å²	154	86%	0.864	77%	0.771	S	S	*	*			trans	-55.6	94.7	167.4	-83.4	-84.2	0	0	0	109.6	T70	T70-F72 VanDerWaalsContact C-N 3.33Å; T70-F72 HydrophobicContact CG2-CD2 4.14Å; T70-F72 HydrophobicContact CG2-CE2 3.8Å; T70-F72 PolarHBondContact O-N 3.05Å
73	T	34	Very low	31.5	Very low	80 Å²	80	155.3 Å²	155.3	49%	0.491	77%	0.769	S	S	.	*			trans	-99	133.4	-175.3	-56.4	0	0	0	0	107.5	R71 I75	R71-T73 VanDerWaalsContact C-N 3.3Å; R71-T73 PolarHBondContact O-N 2.84Å; R71-T73 PolarHBondContact O-OG1 3.39Å; T73-I75 PolarHBondContact O-N 2.94Å
74	P	33.7	Very low	31.4	Very low	116 Å²	116	156.2 Å²	156.2	75%	0.753	76%	0.764	S	S	*	*			trans	-54.7	128.5	178.1	-26.1	34.7	0	0	0	110.9	N76	P74-N76 VanDerWaalsContact C-N 3.27Å; P74-N76 PolarHBondContact O-N 3.37Å
75	I	29.3	Very low	30.9	Very low	178 Å²	178	156.2 Å²	156.2	91%	0.913	76%	0.762	S	S	*	*	S	Bend	trans	-70.6	84.5	-174.4	-57	174.9	0	0	0	109.2	T73	T73-I75 PolarHBondContact O-N 2.94Å
76	N	31.1	Very low	30.9	Very low	155 Å²	155	154.5 Å²	154.5	83%	0.829	77%	0.767	S	S	*	*			trans	-160.4	50.2	176.1	-134	-13.1	0	0	0	111.6	P74	P74-N76 VanDerWaalsContact C-N 3.27Å; P74-N76 PolarHBondContact O-N 3.37Å
77	K	32.4	Very low	31	Very low	183 Å²	183	153.1 Å²	153.1	80%	0.796	77%	0.766	S	S	*	*			trans	-153.8	133.2	170.3	-106.8	172.7	-174.9	-177.3	0	110.8	E79	K77-E79 PolarHBondContact O-N 3.33Å
78	T	24.6	Very low	30.9	Very low	135 Å²	135	148.1 Å²	148.1	83%	0.828	75%	0.749	S	S	*	*			trans	-88.4	78.5	-177.7	-43.3	0	0	0	0	110.7	I80	T78-I80 HydrophobicContact CG2-CG1 4.27Å; T78-I80 PolarHBondContact O-N 2.74Å
79	E	30	Very low	30.9	Very low	165 Å²	165	150.3 Å²	150.3	77%	0.771	75%	0.748	S	S	*	*			trans	-84.2	102.2	172.7	-81.9	178.5	-174.6	0	0	110.7	K77 L81	K77-E79 PolarHBondContact O-N 3.33Å; E79-L81 PolarHBondContact O-N 3.19Å; E79-L81 VanDerWaalsContact O-N 3.13Å
80	I	30.4	Very low	31.2	Very low	120 Å²	120	147 Å²	147	62%	0.615	74%	0.738	S	S	*	*			trans	-79.9	90.3	176.2	-54.3	175.8	0	0	0	108.4	T78 Y82	T78-I80 HydrophobicContact CG2-CG1 4.27Å; T78-I80 PolarHBondContact O-N 2.74Å; I80-Y82 HydrophobicContact CG2-CD2 3.87Å; I80-Y82 HydrophobicContact CG2-CE2 3.92Å; I80-Y82 PolarHBondContact O-N 3.17Å; I80-Y82 VanDerWaalsContact O-N 3.07Å
81	L	27.3	Very low	31.5	Very low	159 Å²	159	151.2 Å²	151.2	83%	0.832	75%	0.748	S	S	*	*			trans	-67	100.2	170.7	-92.7	155.9	0	0	0	110.4	E79 E83	E79-L81 PolarHBondContact O-N 3.19Å; E79-L81 VanDerWaalsContact O-N 3.13Å; L81-E83 PolarHBondContact O-N 3.42Å
82	Y	29.1	Very low	31.5	Very low	168 Å²	168	152.4 Å²	152.4	66%	0.659	75%	0.752	S	S	*	*			trans	-80.2	91.7	166.6	-100.2	-84.1	0	0	0	109.9	I80 N84	I80-Y82 HydrophobicContact CG2-CD2 3.87Å; I80-Y82 HydrophobicContact CG2-CE2 3.92Å; I80-Y82 PolarHBondContact O-N 3.17Å; I80-Y82 VanDerWaalsContact O-N 3.07Å; Y82-N84 PolarHBondContact O-N 3.42Å; Y82-N84 VanDerWaalsContact O-N 3.07Å
83	E	29.9	Very low	31.9	Very low	154 Å²	154	150.8 Å²	150.8	72%	0.72	75%	0.753	S	S	*	*			trans	-78.8	81.4	173.1	-171.3	169.6	-153.8	0	0	110.6	L81 F85	L81-E83 PolarHBondContact O-N 3.42Å; E83-F85 HydrophobicContact CG-CD2 4.06Å; E83-F85 HydrophobicContact CG-CE2 3.8Å; E83-F85 WeakPolarHBondContact OE1-CE2 3.1Å
84	N	36	Very low	31.7	Very low	135 Å²	135	154.2 Å²	154.2	72%	0.722	77%	0.768	S	S	*	*			trans	-97.4	97.9	175.6	-80.6	-16	0	0	0	111.1	Y82 S86	Y82-N84 PolarHBondContact O-N 3.42Å; Y82-N84 VanDerWaalsContact O-N 3.07Å; N84-S86 PolarHBondContact O-N 2.95Å
85	F	27.2	Very low	31.8	Very low	177 Å²	177	156.7 Å²	156.7	78%	0.776	77%	0.774	S	S	*	*			trans	-71	107.6	165.4	-79.1	-99.7	0	0	0	110.9	E83	E83-F85 HydrophobicContact CG-CD2 4.06Å; E83-F85 HydrophobicContact CG-CE2 3.8Å; E83-F85 WeakPolarHBondContact OE1-CE2 3.1Å
86	S	35.6	Very low	31.8	Very low	121 Å²	121	158.8 Å²	158.8	85%	0.846	77%	0.77	S	S	*	*			trans	-177.2	147.2	152.7	-74.7	0	0	0	0	108.8	N84	N84-S86 PolarHBondContact O-N 2.95Å
87	D	30.9	Very low	31.7	Very low	150 Å²	150	156.7 Å²	156.7	80%	0.802	76%	0.763	S	S	*	*			cis	176.5	163.3	-23.4	-174.5	15.8	0	0	0	104
88	D	33.6	Very low	31.8	Very low	97 Å²	97	155.8 Å²	155.8	52%	0.519	76%	0.764	S	S	.	*			trans	68.4	129.7	161.2	-139.4	6.4	0	0	0	121.3
89	R	30.9	Very low	32.2	Very low	211 Å²	211	153.2 Å²	153.2	80%	0.796	75%	0.752	S	S	*	*			trans	60	112.7	148.1	-90.1	162.8	-122.9	-173.7	14.3	122.9
90	S	35.4	Very low	32.5	Very low	85 Å²	85	151.7 Å²	151.7	59%	0.594	75%	0.749	S	S	*	*				126.8	110.1	94.9	177	0	0	0	0	118.6
91	K	38.9	Very low	32.9	Very low	187 Å²	187	153.3 Å²	153.3	81%	0.813	76%	0.759	S	S	*	*			trans	64.4	113.2	146.8	-58.7	167.2	-164.7	170.6	0	117
92	R	30.8	Very low	33.6	Very low	227 Å²	227	154 Å²	154	86%	0.857	76%	0.757	S	S	*	*				56.5	116.7	83.9	-78.9	-169.9	176.9	172.1	-0.2	114.8
93	N	37.8	Very low	34.3	Very low	163 Å²	163	153.2 Å²	153.2	87%	0.872	77%	0.765	S	S	*	*				-171.5	135.1	117.1	-90.7	-11.6	0	0	0	111
94	D	30.9	Very low	34.9	Very low	153 Å²	153	152.3 Å²	152.3	82%	0.818	77%	0.765	S	S	*	*			trans	-99.1	141.1	175.7	-51.3	-87.6	0	0	0	111.5
95	L	34.6	Very low	35	Very low	167 Å²	167	152.7 Å²	152.7	87%	0.874	77%	0.765	S	S	*	*			trans	-170.8	110.2	157.9	-92.9	133.9	0	0	0	107.7
96	R	29.4	Very low	35.5	Very low	222 Å²	222	151.8 Å²	151.8	84%	0.838	77%	0.765	S	S	*	*				84.7	100.6	77.7	-101.1	-166.1	174.9	-147.9	-0.8	116.4
97	T	29.1	Very low	35.6	Very low	111 Å²	111	150 Å²	150	68%	0.681	75%	0.753	S	S	*	*			trans	36.6	123.1	130.3	56	0	0	0	0	122
98	M	35.2	Very low	35.6	Very low	165 Å²	165	150.2 Å²	150.2	81%	0.813	75%	0.753	S	S	*	*				-143.3	144.3	120.4	-60	-56.3	-62	0	0	106
99	S	32.3	Very low	35.5	Very low	81 Å²	81	150.9 Å²	150.9	57%	0.566	76%	0.761	S	S	*	*				69	129.8	55.1	129.7	0	0	0	0	112.5
100	N	36.4	Very low	35.9	Very low	133 Å²	133	147 Å²	147	71%	0.711	76%	0.76	S	S	*	*			cis	-126.3	-158.9	-0.9	-66.1	-30.8	0	0	0	109.4
101	D	40.7	Very low	36.2	Very low	154 Å²	154	148.4 Å²	148.4	82%	0.824	77%	0.768	S	S	*	*			cis	-146	168.4	27.9	-73.1	-60.2	0	0	0	113.3
102	E	40.4	Very low	36.2	Very low	172 Å²	172	148.2 Å²	148.2	80%	0.804	77%	0.767	S	S	*	*			trans	-89	162.8	-177.2	-58.3	-80.3	160	0	0	112.9
103	D	45.4	Very low	36.7	Very low	153 Å²	153	142.5 Å²	142.5	82%	0.818	75%	0.753	S	S	*	*				165.5	146.1	119.3	-84.2	-18.4	0	0	0	115.1
104	D	42.2	Very low	36.8	Very low	135 Å²	135	143 Å²	143	72%	0.722	75%	0.748	S	S	*	*			trans	67.4	89	155.5	-78	9.8	0	0	0	125.9
105	I	37.6	Very low	37.3	Very low	142 Å²	142	143.9 Å²	143.9	73%	0.728	75%	0.752	S	S	*	*				74.1	99.7	107.1	-68.6	173.7	0	0	0	121.5
106	M	38.4	Very low	37.4	Very low	158 Å²	158	144.9 Å²	144.9	78%	0.778	75%	0.753	S	S	*	*				62.8	105.9	121	-61.7	-75.5	-84.2	0	0	124.6
107	S	36	Very low	37.8	Very low	83 Å²	83	140.7 Å²	140.7	58%	0.58	75%	0.751	S	S	*	*				75.7	135.2	107	-63.6	0	0	0	0	125.6
108	L	31	Very low	38	Very low	156 Å²	156	142 Å²	142	82%	0.817	75%	0.754	S	S	*	*			trans	71.8	151.2	147.2	-92	84.8	0	0	0	119.5
109	T	31.8	Very low	38.4	Very low	110 Å²	110	141.3 Å²	141.3	68%	0.675	75%	0.752	S	S	*	*			cis	-164.9	143.7	-17.4	-134.5	0	0	0	0	115.4
110	V	40.3	Very low	38.5	Very low	129 Å²	129	143.4 Å²	143.4	78%	0.782	76%	0.757	S	S	*	*			trans	64.3	147.1	150.6	177.2	0	0	0	0	121.7
111	P	41.2	Very low	38.4	Very low	115 Å²	115	147.9 Å²	147.9	75%	0.747	76%	0.764	S	S	*	*			trans	-121.3	-178.9	-167.4	44.1	-30.1	0	0	0	116.6
112	K	39.4	Very low	38	Very low	184 Å²	184	146.8 Å²	146.8	80%	0.8	76%	0.763	S	S	*	*			trans	-155.3	153.4	169.2	-104.2	178.9	169.4	-79.3	0	108.8
113	D	40.1	Very low	37.8	Very low	107 Å²	107	144.4 Å²	144.4	57%	0.572	77%	0.765	S	S	*	*			cis	-153.1	-169.8	-6.9	-145	-24.3	0	0	0	111.4
114	K	40.4	Very low	37.3	Very low	173 Å²	173	140.6 Å²	140.6	75%	0.752	76%	0.762	S	S	*	*			trans	-68.9	162	178.6	-60.6	153.8	178.8	-171.3	0	117.3
115	D	40.5	Very low	37	Very low	171 Å²	171	142.4 Å²	142.4	91%	0.914	77%	0.771	S	S	*	*				-163.4	155.6	113.4	-101.9	-16.3	0	0	0	112.4
116	E	37.7	Very low	37	Very low	189 Å²	189	141 Å²	141	88%	0.883	77%	0.771	S	S	*	*			trans	-117.8	137.1	-175.9	-59.4	177.8	113.3	0	0	112.6
117	V	37.6	Very low	37	Very low	134 Å²	134	137.2 Å²	137.2	81%	0.812	77%	0.772	S	S	*	*			trans	-148	132.2	147.3	176.1	0	0	0	0	110.1	I119	V117-I119 HydrophobicContact CG1-CD1 4.07Å; V117-I119 HydrophobicContact CG1-CG1 3.84Å
118	N	32.8	Very low	37	Very low	137 Å²	137	143 Å²	143	73%	0.733	79%	0.787	S	S	*	*			trans	-136.8	122.5	170.1	173.9	10.2	0	0	0	109.5
119	I	44.4	Very low	37.4	Very low	152 Å²	152	141.6 Å²	141.6	78%	0.779	79%	0.79	S	S	*	*			trans	-140.5	139.9	175.7	-37.2	178.9	0	0	0	110.8	V117	V117-I119 HydrophobicContact CG1-CD1 4.07Å; V117-I119 HydrophobicContact CG1-CG1 3.84Å
120	N	34	Very low	37.6	Very low	125 Å²	125	141.5 Å²	141.5	67%	0.668	79%	0.794	S	S	*	*			trans	-104.9	151.7	-169	-54.9	-91.8	0	0	0	113.1
121	R	34.5	Very low	37.4	Very low	226 Å²	226	139.7 Å²	139.7	85%	0.853	79%	0.793	S	S	*	*			trans	150.4	127.2	136.5	-82.9	166.5	171.1	130.9	-0.7	111.8
122	T	31.6	Very low	37	Very low	132 Å²	132	143.9 Å²	143.9	81%	0.81	80%	0.795	S	S	*	*				62.2	122.1	89.2	-33.1	0	0	0	0	111.6
123	S	36.8	Very low	36.8	Very low	121 Å²	121	141.8 Å²	141.8	85%	0.846	79%	0.793	S	S	*	*			cis	-161.7	169.9	45.8	56.6	0	0	0	0	112.6
124	G	35	Very low	36.4	Very low	73 Å²	73	145 Å²	145	75%	0.753	80%	0.802	S	S	*	*			trans	154.3	78.5	165.3	0	0	0	0	0	118.9
125	L	35.8	Very low	36.3	Very low	173 Å²	173	145.3 Å²	145.3	91%	0.906	80%	0.803	S	S	*	*			trans	-135	168.2	162	-77.1	179.2	0	0	0	107.5
126	P	37.8	Very low	35.9	Very low	113 Å²	113	145.1 Å²	145.1	73%	0.734	80%	0.797	S	S	*	*			cis	-136.4	-177.9	11.8	42.8	-25.9	0	0	0	116
127	G	38.8	Very low	35.6	Very low	78 Å²	78	143.4 Å²	143.4	80%	0.804	79%	0.789	S	S	*	*			trans	-143.6	135.9	160.7	0	0	0	0	0	111.3
128	K	36.4	Very low	35.5	Very low	205 Å²	205	144.4 Å²	144.4	89%	0.891	79%	0.788	S	S	*	*			trans	-126.2	138.8	-175.8	-64.9	178.4	179.6	176.3	0	111.7
129	S	38.9	Very low	35.5	Very low	126 Å²	126	144.1 Å²	144.1	88%	0.881	79%	0.785	S	S	*	*			trans	-151.7	160.1	161.6	-170.5	0	0	0	0	109.5
130	S	36.5	Very low	35.1	Very low	109 Å²	109	140.2 Å²	140.2	76%	0.762	78%	0.782	S	S	*	*			trans	-159.2	120.4	-166.7	55.7	0	0	0	0	116.4
131	A	35.9	Very low	35	Very low	91 Å²	91	142.9 Å²	142.9	75%	0.752	79%	0.788	S	S	*	*			trans	-156.5	123.1	162.7	0	0	0	0	0	109.6
132	Y	31.5	Very low	35.1	Very low	202 Å²	202	138.9 Å²	138.9	79%	0.792	79%	0.788	S	S	*	*				60	123.9	74.6	-75.6	-73.5	0	0	0	112.4
133	N	36.4	Very low	35.2	Very low	141 Å²	141	138.5 Å²	138.5	75%	0.754	78%	0.781	S	S	*	*			cis	-142	157	23.6	-66.8	-74.1	0	0	0	110.1
134	K	32.2	Very low	34.8	Very low	174 Å²	174	138.3 Å²	138.3	76%	0.757	78%	0.775	S	S	*	*			cis	90.6	125.7	36.7	-160.6	-178.4	-177.5	173.5	0	114.9
135	K	36.7	Very low	34.8	Very low	179 Å²	179	142.5 Å²	142.5	78%	0.778	78%	0.78	S	S	*	*			trans	79.6	149	-177.8	-52	-174.2	-177.8	179.8	0	114.4
136	Q	33.8	Very low	34.5	Very low	168 Å²	168	141 Å²	141	79%	0.785	78%	0.779	S	S	*	*			cis	-146.4	152.5	1.8	-145.5	157.1	-14.8	0	0	111.9
137	E	30.2	Very low	34.4	Very low	153 Å²	153	141.3 Å²	141.3	72%	0.715	78%	0.783	S	S	*	*			trans	-110.8	136.2	176.8	175.3	-177.9	-164.4	0	0	109.6	I139	E137-I139 HydrophobicContact CG-CG1 4.38Å; E137-I139 WeakPolarHBondContact OE1-CD1 3.26Å
138	I	36.5	Very low	34.3	Very low	154 Å²	154	147.2 Å²	147.2	79%	0.79	79%	0.787	S	S	*	*			trans	-138.9	107.1	168.5	-59.3	-177.6	0	0	0	108.8
139	I	31.5	Very low	34.2	Very low	132 Å²	132	146.5 Å²	146.5	68%	0.677	79%	0.786	S	S	*	*			trans	-86.3	107.3	171.2	-64.3	173.4	0	0	0	108.6	E137	E137-I139 HydrophobicContact CG-CG1 4.38Å; E137-I139 WeakPolarHBondContact OE1-CD1 3.26Å
140	G	35.7	Very low	33.9	Very low	69 Å²	69	147.7 Å²	147.7	71%	0.711	78%	0.783	S	S	*	*			trans	-93.2	95.8	173.4	0	0	0	0	0	112
141	K	33.4	Very low	33.9	Very low	182 Å²	182	146.1 Å²	146.1	79%	0.791	78%	0.783	S	S	*	*			trans	-73.5	127.3	165.8	-75.1	-178.1	176.3	178.3	0	109.7
142	V	34.9	Very low	33.7	Very low	142 Å²	142	148.8 Å²	148.8	86%	0.861	79%	0.785	S	S	*	*			trans	-122.7	119.3	159.3	-179.4	0	0	0	0	107.2
143	N	33.8	Very low	34.1	Very low	123 Å²	123	148.1 Å²	148.1	66%	0.658	79%	0.789	S	S	*	*			trans	-90.6	147	-180	-64.6	-19.1	0	0	0	110.4
144	T	29.7	Very low	34	Very low	118 Å²	118	149.2 Å²	149.2	72%	0.724	80%	0.795	S	S	*	*			trans	32.9	121.3	143.1	59.7	0	0	0	0	119.1
145	N	34.3	Very low	34.6	Very low	161 Å²	161	149 Å²	149	86%	0.861	80%	0.801	S	S	*	*				-165.8	151.6	99.2	-91.3	-25.6	0	0	0	112.3
146	T	29.4	Very low	34.5	Very low	142 Å²	142	150.4 Å²	150.4	87%	0.871	80%	0.801	S	S	*	*			trans	-94.6	134.4	175.3	50.1	0	0	0	0	111.3
147	S	36.4	Very low	34.7	Very low	118 Å²	118	145.6 Å²	145.6	83%	0.825	80%	0.797	S	S	*	*			trans	-131.1	132.6	147.1	53.5	0	0	0	0	109.2
148	K	35.2	Very low	35.1	Very low	203 Å²	203	146 Å²	146	88%	0.883	80%	0.796	S	S	*	*			trans	-90.8	133.9	158.5	-73.2	-180	176.1	-179.9	0	106.5
149	E	34.9	Very low	35.2	Very low	190 Å²	190	144.6 Å²	144.6	89%	0.888	80%	0.8	S	S	*	*			trans	-141.3	148.1	156.2	-164.3	147.9	-139.2	0	0	108.6
150	N	32.6	Very low	35.3	Very low	151 Å²	151	143.1 Å²	143.1	81%	0.807	80%	0.797	S	S	*	*			trans	-102	130.3	-168.7	-52.7	-47.2	0	0	0	109.6
151	G	35.9	Very low	35.1	Very low	75 Å²	75	145.6 Å²	145.6	77%	0.773	80%	0.803	S	S	*	*			trans	-145.5	119.4	175	0	0	0	0	0	110.6
152	N	32.6	Very low	35.2	Very low	147 Å²	147	145.7 Å²	145.7	79%	0.786	80%	0.804	S	S	*	*			trans	-122.3	67.4	-159.2	55.4	-87.2	0	0	0	113.7
153	E	40.1	Very low	35.4	Very low	188 Å²	188	148.6 Å²	148.6	88%	0.879	80%	0.799	S	S	*	*			trans	-116.5	140.9	-176.7	-65	-166.4	-155.1	0	0	114.4	I155	E153-I155 PolarHBondContact O-N 3.25Å
154	N	33.5	Very low	35.6	Very low	164 Å²	164	148.4 Å²	148.4	88%	0.877	81%	0.805	S	S	*	*			trans	-82.1	114	-169.3	-82	-73.1	0	0	0	112.5
155	I	45.7	Very low	35.7	Very low	170 Å²	170	150.5 Å²	150.5	87%	0.872	81%	0.811	S	S	*	*			trans	-106.5	95.7	162	-56.8	-176	0	0	0	109.4	E153 G157	E153-I155 PolarHBondContact O-N 3.25Å; I155-G157 VanDerWaalsContact C-N 3.35Å; I155-G157 PolarHBondContact O-N 2.89Å
156	R	34.5	Very low	35.7	Very low	209 Å²	209	151.4 Å²	151.4	79%	0.789	81%	0.811	S	S	*	*			trans	-75	80.1	179.5	-176.6	-167.7	174.3	-164.2	3.6	110.9	K158	R156-K158 PolarHBondContact O-N 3.39Å
157	G	37.2	Very low	36.2	Very low	67 Å²	67	153.3 Å²	153.3	69%	0.691	81%	0.81	S	S	*	*			trans	-58.8	116	172.8	0	0	0	0	0	111.9	I155	I155-G157 VanDerWaalsContact C-N 3.35Å; I155-G157 PolarHBondContact O-N 2.89Å
158	K	39.4	Very low	36.1	Very low	161 Å²	161	156.3 Å²	156.3	70%	0.7	81%	0.808	S	S	*	*			trans	-91.2	95.2	168.5	-73.7	-177.3	179	178.1	0	109	R156 V160	R156-K158 PolarHBondContact O-N 3.39Å; K158-V160 PolarHBondContact O-N 3.46Å
159	S	38	Very low	36	Very low	124 Å²	124	152.8 Å²	152.8	87%	0.867	80%	0.803	S	S	*	*			trans	-67.3	121.8	166	35	0	0	0	0	109.8
160	V	33.2	Very low	35.9	Very low	102 Å²	102	149.4 Å²	149.4	62%	0.618	80%	0.799	S	S	*	*			trans	-104.6	107.3	177.4	-178.6	0	0	0	0	108.4	K158 F162	K158-V160 PolarHBondContact O-N 3.46Å; V160-F162 HydrophobicContact CB-CE2 4.28Å; V160-F162 HydrophobicContact CG1-CD2 4.08Å; V160-F162 HydrophobicContact CG1-CE2 3.55Å; V160-F162 HydrophobicContact CG1-CZ 3.82Å
161	S	32.4	Very low	36.1	Very low	121 Å²	121	149.1 Å²	149.1	85%	0.846	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-83.9	117.1	175.2	50.1	0	0	0	0	110.9
162	F	35.9	Very low	36.1	Very low	183 Å²	183	149.7 Å²	149.7	80%	0.803	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-94.4	121.4	169.9	-72.2	-82.8	0	0	0	110	V160	V160-F162 HydrophobicContact CB-CE2 4.28Å; V160-F162 HydrophobicContact CG1-CD2 4.08Å; V160-F162 HydrophobicContact CG1-CE2 3.55Å; V160-F162 HydrophobicContact CG1-CZ 3.82Å
163	R	37.7	Very low	36	Very low	203 Å²	203	151.5 Å²	151.5	77%	0.766	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-84.8	129.4	160.7	-76.6	-167.7	174.6	-148.1	1.1	108.9
164	P	38.6	Very low	35.9	Very low	119 Å²	119	149.9 Å²	149.9	77%	0.773	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-62.4	140	163.9	-17.3	31.1	0	0	0	109.8
165	N	32.5	Very low	35.9	Very low	162 Å²	162	151.8 Å²	151.8	87%	0.866	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-75.8	134.4	168.9	-112.7	2.1	0	0	0	109.3	E167	N165-E167 PolarHBondContact O-N 3.34Å
166	E	34.8	Very low	35.3	Very low	181 Å²	181	147.1 Å²	147.1	85%	0.846	79%	0.792	S	S	*	*			trans	-79.5	65.7	-178.8	-66.9	178.1	-150	0	0	112	K168	E166-K168 PolarHBondContact O-N 2.74Å
167	E	39.4	Very low	35.2	Very low	181 Å²	181	144.1 Å²	144.1	85%	0.846	80%	0.797	S	S	*	*			trans	-75.1	115.7	173.1	-168	158	-138.9	0	0	110.4	N165 V169	N165-E167 PolarHBondContact O-N 3.34Å; E167-V169 PolarHBondContact O-N 2.66Å
168	K	35	Very low	35.2	Very low	181 Å²	181	145.6 Å²	145.6	79%	0.787	80%	0.796	S	S	*	*			trans	-76.5	104.7	-166.7	-65.8	179	-179.5	177.3	0	111.8	E166 C170	E166-K168 PolarHBondContact O-N 2.74Å; K168-C170 PolarHBondContact O-N 3.31Å
169	V	33.2	Very low	34.9	Very low	130 Å²	130	147.1 Å²	147.1	79%	0.788	81%	0.806	S	S	*	*			trans	-71.6	95.1	169.7	-177.6	0	0	0	0	109.9	E167 I171	E167-V169 PolarHBondContact O-N 2.66Å; V169-I171 HydrophobicContact CG1-CG1 4.35Å; V169-I171 PolarHBondContact O-N 3.42Å; V169-I171 VanDerWaalsContact O-N 3.12Å
170	C	31.9	Very low	34.7	Very low	119 Å²	119	152.2 Å²	152.2	80%	0.804	81%	0.806	S	S	*	*			trans	-71.8	98.8	174	-68.5	0	0	0	0	111	K168 A172	K168-C170 PolarHBondContact O-N 3.31Å; C170-A172 PolarHBondContact O-N 2.87Å
171	I	35.9	Very low	34.8	Very low	145 Å²	145	151.4 Å²	151.4	74%	0.744	81%	0.805	S	S	*	*			trans	-78	103.8	170.1	-57.9	178	0	0	0	108.5	V169 Q173	V169-I171 HydrophobicContact CG1-CG1 4.35Å; V169-I171 PolarHBondContact O-N 3.42Å; V169-I171 VanDerWaalsContact O-N 3.12Å; I171-Q173 PolarHBondContact O-N 3.23Å
172	A	36.5	Very low	35.2	Very low	86 Å²	86	152 Å²	152	71%	0.711	81%	0.806	S	S	*	*			trans	-67.6	118	174.3	0	0	0	0	0	110.6	C170	C170-A172 PolarHBondContact O-N 2.87Å
173	Q	30.8	Very low	35	Very low	185 Å²	185	153.7 Å²	153.7	86%	0.864	81%	0.807	S	S	*	*			trans	-85.5	116.8	171.1	-65.6	179.8	-7.4	0	0	108.9	I171	I171-Q173 PolarHBondContact O-N 3.23Å
174	N	38.2	Very low	34.8	Very low	155 Å²	155	150.3 Å²	150.3	83%	0.829	80%	0.8	S	S	*	*			trans	-111.6	118.6	168.9	-74.4	-20.1	0	0	0	108.7
175	E	33.4	Very low	35	Very low	203 Å²	203	152 Å²	152	95%	0.949	80%	0.802	S	S	*	*			trans	-72.3	144.6	174.2	-57.5	178.5	120.2	0	0	110.5
176	G	33.3	Very low	35.2	Very low	72 Å²	72	153.8 Å²	153.8	74%	0.742	80%	0.796	S	S	*	*			trans	172.3	65.9	-176.8	0	0	0	0	0	117.7
177	V	31.3	Very low	35.6	Very low	147 Å²	147	153.4 Å²	153.4	89%	0.891	79%	0.792	S	S	*	*			trans	35.1	113.7	147.6	-170.4	0	0	0	0	119.1
178	S	38.7	Very low	35.6	Very low	98 Å²	98	149.9 Å²	149.9	69%	0.685	79%	0.787	S	S	*	*				153.2	124.7	126.6	-172.1	0	0	0	0	111.9	R180	S178-R180 PolarHBondContact O-N 3.39Å
179	E	32.8	Very low	35.9	Very low	193 Å²	193	149.1 Å²	149.1	90%	0.902	79%	0.792	S	S	*	*			trans	-70.5	123.8	174.6	-61.6	177.8	107.8	0	0	111.7
180	R	34.1	Very low	36	Very low	230 Å²	230	151.1 Å²	151.1	87%	0.868	79%	0.793	S	S	*	*			trans	-136.5	108.2	161.8	-107.5	-177.3	172.1	96.9	-2.5	112	S178	S178-R180 PolarHBondContact O-N 3.39Å
181	S	34.5	Very low	36.4	Very low	85 Å²	85	150.1 Å²	150.1	59%	0.594	79%	0.792	S	S	*	*			trans	-19.9	132.4	169.1	176	0	0	0	0	115.6	R183	S181-R183 VanDerWaalsContact C-N 3.25Å; S181-R183 PolarHBondContact O-N 2.99Å
182	P	39.9	Very low	36.6	Very low	133 Å²	133	154.6 Å²	154.6	86%	0.864	80%	0.8	S	S	*	*			trans	-72.8	72.3	-176.4	31.7	-37.1	0	0	0	112.5	H184	P182-H184 PolarHBondContact O-N 3.37Å
183	R	32.9	Very low	37	Very low	219 Å²	219	159 Å²	159	83%	0.826	81%	0.806	S	S	*	*			trans	-76.3	88.6	178.2	-64.6	-169.6	-169.9	-167.4	4.8	111.2	S181	S181-R183 VanDerWaalsContact C-N 3.25Å; S181-R183 PolarHBondContact O-N 2.99Å
184	H	34	Very low	37.7	Very low	132 Å²	132	156.1 Å²	156.1	61%	0.611	80%	0.803	S	S	*	*			trans	46.8	85.6	137.5	-167.1	-9.2	0	0	0	114.9	P182 R186	P182-H184 PolarHBondContact O-N 3.37Å; H184-R186 PolarHBondContact O-N 2.86Å
185	L	42.7	Very low	38	Very low	156 Å²	156	154.3 Å²	154.3	82%	0.817	80%	0.803	S	S	*	*			trans	-56.3	101.2	164.7	-71.9	172.2	0	0	0	109.4
186	R	36.1	Very low	38.5	Very low	199 Å²	199	154.5 Å²	154.5	75%	0.751	80%	0.795	S	S	*	*			trans	-91.4	110.4	165	-78	-164.5	173.2	-150.5	2.1	108.1	H184 S188	H184-R186 PolarHBondContact O-N 2.86Å; R186-S188 PolarHBondContact O-N 2.85Å
187	F	43.1	Very low	38.8	Very low	173 Å²	173	158.1 Å²	158.1	76%	0.759	79%	0.794	S	S	*	*			trans	-70.4	121.6	159.5	-62.9	-82.8	0	0	0	107.4	D189	F187-D189 PolarHBondContact O-N 3.4Å
188	S	38.4	Very low	39.2	Very low	106 Å²	106	157.6 Å²	157.6	74%	0.741	78%	0.782	S	S	*	*			trans	-82.8	107.3	174.6	-65.3	0	0	0	0	108.8	R186 Q190	R186-S188 PolarHBondContact O-N 2.85Å; S188-Q190 PolarHBondContact O-N 2.87Å
189	D	41.3	Very low	39.4	Very low	166 Å²	166	159.5 Å²	159.5	89%	0.888	78%	0.78	S	S	*	*	S	Bend	trans	-70.7	49.9	178.8	-70	-47.4	0	0	0	113.1	F187	F187-D189 PolarHBondContact O-N 3.4Å
190	Q	35.7	Very low	39.5	Very low	172 Å²	172	156.2 Å²	156.2	80%	0.804	78%	0.778	S	S	*	*			trans	-143	38.7	-177.8	-148.4	173.6	27.9	0	0	113.5	S188 R192	S188-Q190 PolarHBondContact O-N 2.87Å; Q190-R192 PolarHBondContact O-N 2.8Å
191	A	41	Very low	40	Very low	97 Å²	97	151.1 Å²	151.1	80%	0.802	77%	0.767	S	S	*	*			trans	-63.4	104.9	158.1	0	0	0	0	0	108.7	Q193	A191-Q193 PolarHBondContact O-N 3.4Å
192	R	39.8	Very low	40.1	Very low	239 Å²	239	152.9 Å²	152.9	90%	0.902	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-53.9	124.3	172.3	-74.9	-179	173.1	177.2	-2.7	108.6	Q190	Q190-R192 PolarHBondContact O-N 2.8Å
193	Q	44.8	Very low	40.1	Very low	179 Å²	179	152.5 Å²	152.5	84%	0.836	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-61.1	140.4	170.6	-71.1	-169.2	-15.5	0	0	109.5	A191 S195	A191-Q193 PolarHBondContact O-N 3.4Å; Q193-S195 PolarHBondContact O-N 2.88Å
194	P	46.7	Very low	40.3	Very low	124 Å²	124	145.5 Å²	145.5	81%	0.805	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-62.8	135.4	173.6	27.2	-33.7	0	0	0	109.6	R196	P194-R196 PolarHBondContact O-N 3.23Å
195	S	44.4	Very low	40.6	Very low	118 Å²	118	144.2 Å²	144.2	83%	0.825	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-59.1	120.3	-177.5	-62.6	0	0	0	0	111.7	Q193 M197	Q193-S195 PolarHBondContact O-N 2.88Å; S195-M197 PolarHBondContact O-N 3.39Å; S195-M197 VanDerWaalsContact O-N 3.08Å
196	R	43.8	Very low	40.5	Very low	207 Å²	207	143.3 Å²	143.3	78%	0.781	75%	0.751	S	S	*	*			trans	6.9	88.1	156.8	-176.1	176.4	174.2	149.5	-6.9	114.4	P194 E198	P194-R196 PolarHBondContact O-N 3.23Å; R196-E198 HydrophobicContact CG-CG 3.91Å; R196-E198 IonicContact CZ-OE1 3.01Å; R196-E198 IonicContact NE-OE1 2.74Å; R196-E198 PolarHBondContact NE-OE1 2.9Å; R196-E198 IonicContact NH2-OE1 3.95Å; R196-E198 PolarHBondContact NH2-OE1 3.06Å; R196-E198 PolarHBondContact O-N 2.82Å
197	M	38.4	Very low	40.7	Very low	148 Å²	148	138.5 Å²	138.5	73%	0.729	74%	0.741	S	S	*	*			trans	-79.7	100.1	170.5	-160	173.8	-57.7	0	0	108.2	S195 H199	S195-M197 PolarHBondContact O-N 3.39Å; S195-M197 VanDerWaalsContact O-N 3.08Å; M197-H199 PolarHBondContact O-CD2 2.69Å; M197-H199 VanDerWaalsContact O-CD2 3.31Å; M197-H199 PolarHBondContact O-N 3.43Å; M197-H199 PolarHBondContact SD-CE1 3.18Å
198	E	40.3	Very low	40.5	Very low	136 Å²	136	140.3 Å²	140.3	64%	0.636	74%	0.742	S	S	*	*			trans	-74.7	91.3	177.6	-63	-151.8	139.6	0	0	110.3	R196 S200	R196-E198 HydrophobicContact CG-CG 3.91Å; R196-E198 IonicContact CZ-OE1 3.01Å; R196-E198 IonicContact NE-OE1 2.74Å; R196-E198 PolarHBondContact NE-OE1 2.9Å; R196-E198 IonicContact NH2-OE1 3.95Å; R196-E198 PolarHBondContact NH2-OE1 3.06Å; R196-E198 PolarHBondContact O-N 2.82Å; E198-S200 PolarHBondContact O-N 3.03Å; E198-S200 VanDerWaalsContact O-N 3.15Å
199	H	42.6	Very low	40.6	Very low	138 Å²	138	143.3 Å²	143.3	64%	0.639	75%	0.749	S	S	*	*			trans	-72.5	105.8	172.2	-65.4	-74.5	0	0	0	109.7	M197 I201	M197-H199 PolarHBondContact O-CD2 2.69Å; M197-H199 VanDerWaalsContact O-CD2 3.31Å; M197-H199 PolarHBondContact O-N 3.43Å; M197-H199 PolarHBondContact SD-CE1 3.18Å; H199-I201 HydrophobicContact CB-CG1 4.42Å; H199-I201 PolarHBondContact O-N 2.88Å
200	S	35.7	Very low	40.5	Very low	123 Å²	123	139.5 Å²	139.5	86%	0.86	73%	0.728	S	S	*	*			trans	-70.7	67	177.1	40.5	0	0	0	0	112.3	E198 S202	E198-S200 PolarHBondContact O-N 3.03Å; E198-S200 VanDerWaalsContact O-N 3.15Å; S200-S202 PolarHBondContact O-N 3.08Å
201	I	43.5	Very low	40.5	Very low	123 Å²	123	137 Å²	137	63%	0.631	73%	0.725	S	S	*	*			trans	-76.5	104.7	170	-52.2	-178.9	0	0	0	108.2	H199 M203	H199-I201 HydrophobicContact CB-CG1 4.42Å; H199-I201 PolarHBondContact O-N 2.88Å; I201-M203 VanDerWaalsContact C-N 3.28Å; I201-M203 HydrophobicContact CB-CG 4.46Å; I201-M203 HydrophobicContact CG2-CE 3.83Å; I201-M203 HydrophobicContact CG2-CG 3.87Å; I201-M203 HydrophobicContact CG2-SD 3.77Å; I201-M203 PolarHBondContact O-N 3.01Å
202	S	37.3	Very low	40.3	Very low	122 Å²	122	142.4 Å²	142.4	85%	0.853	73%	0.73	S	S	*	*			trans	-70	80	174.1	173.3	0	0	0	0	110.8	S200	S200-S202 PolarHBondContact O-N 3.08Å
203	M	38.9	Very low	40.5	Very low	125 Å²	125	134.5 Å²	134.5	62%	0.616	71%	0.712	S	S	*	*			trans	-73.3	137.9	178.4	-59.3	-88	54.9	0	0	111.6	I201	I201-M203 VanDerWaalsContact C-N 3.28Å; I201-M203 HydrophobicContact CB-CG 4.46Å; I201-M203 HydrophobicContact CG2-CE 3.83Å; I201-M203 HydrophobicContact CG2-CG 3.87Å; I201-M203 HydrophobicContact CG2-SD 3.77Å; I201-M203 PolarHBondContact O-N 3.01Å
204	S	38.5	Very low	40.3	Very low	73 Å²	73	131.8 Å²	131.8	51%	0.51	70%	0.703	S	S	.	*			trans	-67.7	152.9	176	-168.6	0	0	0	0	110.4	N206	S204-N206 PolarHBondContact O-N 3.36Å
205	P	39.6	Very low	40	Very low	104 Å²	104	127.1 Å²	127.1	68%	0.675	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-4.8	-171.1	-27	36.8	0	0	0	117.5
206	N	41.4	Very low	40.1	Very low	138 Å²	138	125.6 Å²	125.6	74%	0.738	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-20.6	-167.3	-64.3	-10.5	0	0	0	114.6	S204 R208	S204-N206 PolarHBondContact O-N 3.36Å; N206-R208 PolarHBondContact O-N 2.9Å
207	D	40.3	Very low	40.2	Very low	98 Å²	98	121 Å²	121	52%	0.524	65%	0.646	S	S	.	*			trans	-78.8	32.5	-171.3	-61.1	-46.2	0	0	0	114.5	L209	D207-L209 VanDerWaalsContact C-N 3.26Å; D207-L209 PolarHBondContact O-N 2.85Å; D207-L209 VanDerWaalsContact O-N 3.15Å
208	R	37.3	Very low	40.5	Very low	210 Å²	210	115.4 Å²	115.4	79%	0.792	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-0.7	-170	-75.3	-172.6	168.6	-143.3	-4.2	116.1	N206	N206-R208 PolarHBondContact O-N 2.9Å
209	L	40.4	Very low	40.7	Very low	169 Å²	169	112.1 Å²	112.1	89%	0.885	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	-13.2	-174.9	-76.6	168.7	0	0	0	115.3	D207 T211	D207-L209 VanDerWaalsContact C-N 3.26Å; D207-L209 PolarHBondContact O-N 2.85Å; D207-L209 VanDerWaalsContact O-N 3.15Å; L209-T211 PolarHBondContact O-N 3.46Å
210	L	40.9	Very low	40.7	Very low	86 Å²	86	108.3 Å²	108.3	45%	0.45	60%	0.601	S	S	.	*			trans	-82.5	60.4	178.4	-77.8	165.1	0	0	0	112.6	L217	L210-L217 HydrophobicContact CD1-CD1 3.55Å; L210-L217 HydrophobicContact CD1-CD2 4.1Å; L210-L217 HydrophobicContact CD1-CG 3.83Å
211	T	34.6	Very low	41	Very low	119 Å²	119	107.1 Å²	107.1	73%	0.73	59%	0.589	S	S	*	*	S	Bend	trans	-128.5	37.4	-175.5	48.1	0	0	0	0	114.3	L209	L209-T211 PolarHBondContact O-N 3.46Å
212	K	38	Very low	40.8	Very low	211 Å²	211	104 Å²	104	92%	0.917	58%	0.578	S	S	*	*	S	Bend	trans	-156.5	-12.6	163	-129.1	168.4	-173.8	173.3	0	119
213	S	42.7	Very low	40.9	Very low	73 Å²	73	106.3 Å²	106.3	51%	0.51	58%	0.581	S	S	.	*	S	Bend	trans	-98.8	140.6	177.1	44.3	0	0	0	0	111.8	S215	S213-S215 WeakPolarHBondContact CB-OG 3.5Å; S213-S215 PolarHBondContact O-N 2.94Å; S213-S215 PolarHBondContact O-OG 2.98Å; S213-S215 PolarHBondContact OG-OG 3.45Å
214	N	41.8	Very low	40.9	Very low	123 Å²	123	106 Å²	106	66%	0.658	59%	0.585	S	S	*	*			trans	-76.4	70.5	165.7	-71.1	-21.1	0	0	0	108.7	L234 Y235	N214-L234 HydrophobicContact CB-CD1 4.45Å; N214-L234 WeakPolarHBondContact O-CB 3.46Å; N214-L234 WeakPolarHBondContact O-CD1 3.3Å; N214-Y235 HydrophobicContact CB-CE2 4.38Å
215	S	39.9	Very low	41	Very low	26 Å²	26	107.1 Å²	107.1	18%	0.182	60%	0.599	C	S	.	*			trans	-119.8	106.8	-171.5	47.4	0	0	0	0	109.7	S213 L217	S213-S215 WeakPolarHBondContact CB-OG 3.5Å; S213-S215 PolarHBondContact O-N 2.94Å; S213-S215 PolarHBondContact O-OG 2.98Å; S213-S215 PolarHBondContact OG-OG 3.45Å; S215-L217 PolarHBondContact O-N 3.44Å
216	L	46.6	Very low	41.4	Very low	86 Å²	86	105.7 Å²	105.7	45%	0.45	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.4	118.3	167.5	-72	173.8	0	0	0	108	L218 L232 L234	L216-L218 PolarHBondContact O-N 3.22Å; L216-L232 HydrophobicContact CB-CB 3.88Å; L216-L232 HydrophobicContact CB-CD1 4.08Å; L216-L232 HydrophobicContact CD1-CD1 4.06Å; L216-L232 WeakPolarHBondContact O-CB 2.99Å; L216-L232 PolarHBondContact O-N 2.99Å; L216-L234 HydrophobicContact CD1-CD1 4.38Å; L216-L234 HydrophobicContact CD1-CD2 4.34Å; L216-L234 HydrophobicContact CG-CD1 4.21Å
217	L	46.3	Very low	41.9	Very low	111 Å²	111	107.1 Å²	107.1	58%	0.581	59%	0.588	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-62.2	130.4	172.6	-84	178	0	0	0	109.8	L210 S215 S230	L210-L217 HydrophobicContact CD1-CD1 3.55Å; L210-L217 HydrophobicContact CD1-CD2 4.1Å; L210-L217 HydrophobicContact CD1-CG 3.83Å; S215-L217 PolarHBondContact O-N 3.44Å; L217-S230 CarbonylContact C-O 3.6Å; L217-S230 WeakPolarHBondContact CA-O 3.49Å
218	L	45.1	Very low	42.5	Very low	30 Å²	30	110.1 Å²	110.1	16%	0.157	60%	0.597	C	S	.	*			trans	-89.7	108.7	174.2	-168.1	62	0	0	0	109.3	Y21 L216 V220 V229 S230 L248	Y21-L218 HydrophobicContact CE2-CD1 3.46Å; Y21-L218 VanDerWaalsContact CE2-CD1 3.46Å; Y21-L218 WeakPolarHBondContact OH-CD1 3.37Å; Y21-L218 WeakPolarHBondContact OH-CD2 3.49Å; L216-L218 PolarHBondContact O-N 3.22Å; L218-V220 HydrophobicContact CD2-CG2 3.74Å; L218-V220 HydrophobicContact CG-CG2 3.65Å; L218-V220 PolarHBondContact O-N 3.29Å; L218-V229 WeakPolarHBondContact CB-O 3.42Å; L218-V229 HydrophobicContact CD2-CG1 4.12Å; L218-V229 VanDerWaalsContact CD2-O 3.23Å; L218-V229 WeakPolarHBondContact CD2-O 3.27Å; L218-S230 PolarHBondContact N-O 2.9Å; L218-L248 HydrophobicContact CD2-CD2 3.53Å
219	A	44.5	Very low	43.1	Very low	67 Å²	67	101.1 Å²	101.1	55%	0.554	57%	0.565	S	S	*	*			trans	-75.1	63.1	179.8	0	0	0	0	0	112.2
220	V	41.6	Very low	43.5	Very low	58 Å²	58	95.1 Å²	95.1	35%	0.352	54%	0.537	S	S	.	.			trans	-91.2	111	175.3	164.5	0	0	0	0	109.2	L218 S222 L248	L218-V220 HydrophobicContact CD2-CG2 3.74Å; L218-V220 HydrophobicContact CG-CG2 3.65Å; L218-V220 PolarHBondContact O-N 3.29Å; V220-S222 WeakPolarHBondContact CG1-OG 3.45Å; V220-L248 HydrophobicContact CG1-CD1 4.32Å; V220-L248 HydrophobicContact CG1-CD2 4.5Å; V220-L248 HydrophobicContact CG2-CD1 4.46Å; V220-L248 HydrophobicContact CG2-CD2 3.5Å; V220-L248 VanDerWaalsContact CG2-CD2 3.5Å
221	T	42.5	Very low	44	Very low	97 Å²	97	93.4 Å²	93.4	60%	0.595	53%	0.53	S	S	*	.			trans	-100.2	38.3	177.6	64.8	0	0	0	0	111.7
222	S	39	Very low	44.9	Very low	57 Å²	57	89.2 Å²	89.2	40%	0.399	50%	0.503	S	S	.	.	S	Bend	trans	-92.7	146.5	163.7	61.7	0	0	0	0	109.1	V220 V224	V220-S222 WeakPolarHBondContact CG1-OG 3.45Å; S222-V224 PolarHBondContact O-N 2.99Å
223	D	39.5	Very low	45.7	Very low	172 Å²	172	80.4 Å²	80.4	92%	0.92	47%	0.467	S	S	*	.	S	Bend	trans	-67.6	5.4	-176.6	-64.5	-57	0	0	0	114.4	A225	D223-A225 VanDerWaalsContact C-N 3.34Å; D223-A225 PolarHBondContact O-N 3.28Å
224	V	39.4	Very low	46	Very low	117 Å²	117	79.9 Å²	79.9	71%	0.709	46%	0.458	S	S	*	.			trans	-94.6	67.5	171.5	-169.2	0	0	0	0	108.9	S222 N226	S222-V224 PolarHBondContact O-N 2.99Å; V224-N226 PolarHBondContact O-N 3.4Å
225	A	39.2	Very low	46.4	Very low	98 Å²	98	82.8 Å²	82.8	81%	0.81	46%	0.462	S	S	*	.			trans	-71.2	63	178.6	0	0	0	0	0	112.4	D223 E227	D223-A225 VanDerWaalsContact C-N 3.34Å; D223-A225 PolarHBondContact O-N 3.28Å; A225-E227 PolarHBondContact O-N 3.19Å
226	N	47.8	Very low	47	Very low	74 Å²	74	83.5 Å²	83.5	40%	0.396	47%	0.465	S	S	.	.			trans	-76	109.6	173.4	177.9	1.3	0	0	0	109.2	V224 K228 V229	V224-N226 PolarHBondContact O-N 3.4Å; N226-K228 PolarHBondContact O-N 3.29Å; N226-K228 WeakPolarHBondContact OD1-CB 3.28Å; N226-K228 PolarHBondContact OD1-N 3.08Å; N226-V229 HydrophobicContact CB-CG2 3.89Å; N226-V229 PolarHBondContact O-N 3.07Å
227	E	51.7	Low	47.4	Very low	167 Å²	167	84.4 Å²	84.4	78%	0.78	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-48.8	-34	-179.5	-169.8	177.9	-167.4	0	0	112.9	A225 V229 S230	A225-E227 PolarHBondContact O-N 3.19Å; E227-V229 PolarHBondContact O-N 3.41Å; E227-V229 VanDerWaalsContact O-N 3.15Å; E227-S230 WeakPolarHBondContact O-CB 3.33Å; E227-S230 PolarHBondContact O-N 2.82Å; E227-S230 VanDerWaalsContact O-N 3.13Å; E227-S230 PolarHBondContact O-OG 3.49Å
228	K	53.2	Low	48.1	Very low	161 Å²	161	84.4 Å²	84.4	70%	0.7	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-65.6	-13.4	177.7	-58.5	-177.3	179.5	-178.4	0	114.8	N226 H245	N226-K228 PolarHBondContact O-N 3.29Å; N226-K228 WeakPolarHBondContact OD1-CB 3.28Å; N226-K228 PolarHBondContact OD1-N 3.08Å; K228-H245 PolarHBondContact O-CE1 3.3Å
229	V	51.2	Low	49	Very low	21 Å²	21	84.7 Å²	84.7	13%	0.127	47%	0.472	C	S	.	.	G	3₁₀ helix	trans	-109.2	-5.1	178.5	-147.6	0	0	0	0	112	L218 N226 E227 V231 P244 H245 L248	L218-V229 WeakPolarHBondContact CB-O 3.42Å; L218-V229 HydrophobicContact CD2-CG1 4.12Å; L218-V229 VanDerWaalsContact CD2-O 3.23Å; L218-V229 WeakPolarHBondContact CD2-O 3.27Å; N226-V229 HydrophobicContact CB-CG2 3.89Å; N226-V229 PolarHBondContact O-N 3.07Å; E227-V229 PolarHBondContact O-N 3.41Å; E227-V229 VanDerWaalsContact O-N 3.15Å; V229-V231 PolarHBondContact O-N 3.46Å; V229-P244 HydrophobicContact CG2-CB 4.2Å; V229-H245 WeakPolarHBondContact CA-NE2 3.48Å; V229-L248 HydrophobicContact CG1-CB 4.19Å; V229-L248 HydrophobicContact CG1-CD2 3.61Å
230	S	48.3	Very low	50	Low	44 Å²	44	87.4 Å²	87.4	31%	0.308	47%	0.473	S	S	.	.	S	Bend	trans	-70.9	-13.6	-178.7	69.8	0	0	0	0	113.9	L217 L218 E227	L217-S230 CarbonylContact C-O 3.6Å; L217-S230 WeakPolarHBondContact CA-O 3.49Å; L218-S230 PolarHBondContact N-O 2.9Å; E227-S230 WeakPolarHBondContact O-CB 3.33Å; E227-S230 PolarHBondContact O-N 2.82Å; E227-S230 VanDerWaalsContact O-N 3.13Å; E227-S230 PolarHBondContact O-OG 3.49Å
231	V	50.7	Low	51.1	Low	49 Å²	49	87.2 Å²	87.2	30%	0.297	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	113.9	-173.8	165.5	0	0	0	0	110.2	V229 P233 H245	V229-V231 PolarHBondContact O-N 3.46Å; V231-P233 WeakPolarHBondContact O-CD 3.33Å; V231-H245 PolarHBondContact O-CE1 3.25Å; V231-H245 PolarHBondContact O-NE2 3.05Å
232	L	54.8	Low	52.2	Low	32 Å²	32	83.9 Å²	83.9	17%	0.168	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	121.7	171.7	-121.1	175.9	0	0	0	109.9	Y21 L216 L234	Y21-L232 HydrophobicContact CD2-CD1 4.14Å; Y21-L232 HydrophobicContact CE1-CD2 4.09Å; Y21-L232 HydrophobicContact CE2-CD1 3.58Å; Y21-L232 HydrophobicContact CE2-CD2 3.94Å; Y21-L232 HydrophobicContact CE2-CG 3.71Å; L216-L232 HydrophobicContact CB-CB 3.88Å; L216-L232 HydrophobicContact CB-CD1 4.08Å; L216-L232 HydrophobicContact CD1-CD1 4.06Å; L216-L232 WeakPolarHBondContact O-CB 2.99Å; L216-L232 PolarHBondContact O-N 2.99Å; L232-L234 PolarHBondContact O-N 3.43Å
233	P	53.4	Low	53.5	Low	25 Å²	25	82.9 Å²	82.9	16%	0.162	44%	0.438	C	S	.	.			trans	-71.4	85	-176.8	-22.3	35.7	0	0	0	112.6	V231 Y235 T236 H245	V231-P233 WeakPolarHBondContact O-CD 3.33Å; P233-Y235 PolarHBondContact O-N 2.84Å; P233-T236 HydrophobicContact CB-CG2 3.91Å; P233-T236 WeakPolarHBondContact CB-OG1 3.36Å; P233-T236 PolarHBondContact O-OG1 3.22Å; P233-H245 WeakPolarHBondContact CG-CE1 3.29Å; P233-H245 WeakPolarHBondContact CG-ND1 3.41Å
234	L	48.8	Very low	54.7	Low	62 Å²	62	76.2 Å²	76.2	33%	0.325	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	125.5	171.3	-57.8	-167.1	0	0	0	109.3	N214 L216 L232 T236	N214-L234 HydrophobicContact CB-CD1 4.45Å; N214-L234 WeakPolarHBondContact O-CB 3.46Å; N214-L234 WeakPolarHBondContact O-CD1 3.3Å; L216-L234 HydrophobicContact CD1-CD1 4.38Å; L216-L234 HydrophobicContact CD1-CD2 4.34Å; L216-L234 HydrophobicContact CG-CD1 4.21Å; L232-L234 PolarHBondContact O-N 3.43Å; L234-T236 VanDerWaalsContact C-N 3.35Å; L234-T236 PolarHBondContact O-N 3.17Å
235	Y	51.9	Low	55.9	Low	185 Å²	185	71.1 Å²	71.1	73%	0.725	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	9.1	175.8	-44.4	-78.8	0	0	0	117.5	N214 P233	N214-Y235 HydrophobicContact CB-CE2 4.38Å; P233-Y235 PolarHBondContact O-N 2.84Å
236	T	51.2	Low	57.2	Low	40 Å²	40	66.9 Å²	66.9	25%	0.245	34%	0.337	C	S	.	.			trans	-78.4	140.7	169.1	56	0	0	0	0	111.4	W28 P233 L234 T241	W28-T236 WeakPolarHBondContact CZ2-O 3.43Å; W28-T236 PolarHBondContact NE1-O 3.03Å; P233-T236 HydrophobicContact CB-CG2 3.91Å; P233-T236 WeakPolarHBondContact CB-OG1 3.36Å; P233-T236 PolarHBondContact O-OG1 3.22Å; L234-T236 VanDerWaalsContact C-N 3.35Å; L234-T236 PolarHBondContact O-N 3.17Å; T236-T241 VanDerWaalsContact CB-OG1 3.31Å; T236-T241 WeakPolarHBondContact CB-OG1 3.49Å; T236-T241 PolarHBondContact OG1-OG1 2.99Å
237	N	55.7	Low	58.1	Low	105 Å²	105	66 Å²	66	56%	0.561	33%	0.331	S	S	*	.			trans	-114.2	-6.3	174.6	-63	-14.4	0	0	0	113.3	Q32	Q32-N237 PolarHBondContact NE2-OD1 3.25Å
238	D	60.3	Low	58.7	Low	111 Å²	111	59.3 Å²	59.3	59%	0.594	30%	0.301	S	S	*	.			trans	-85.1	118.1	-175.3	-54.6	-37.9	0	0	0	109.9	E240 T241 L242	D238-E240 PolarHBondContact O-N 3.36Å; D238-E240 VanDerWaalsContact O-N 3.1Å; D238-T241 HydrophobicContact CB-CG2 4.19Å; D238-T241 PolarHBondContact O-N 3.21Å; D238-T241 PolarHBondContact O-OG1 3.13Å; D238-L242 PolarHBondContact O-N 3.24Å
239	L	65	Low	59.3	Low	37 Å²	37	52.6 Å²	52.6	19%	0.194	27%	0.273	C	S	.	.	H	α-helix	trans	-50.1	-39.6	-179.3	-176.8	68.3	0	0	0	111.9	T241 L242 R243 L246 I262	L239-T241 VanDerWaalsContact C-N 3.25Å; L239-T241 PolarHBondContact O-N 3.46Å; L239-L242 CarbonylContact O-C 3.49Å; L239-L242 WeakPolarHBondContact O-CA 3.42Å; L239-L242 PolarHBondContact O-N 2.84Å; L239-R243 HydrophobicContact CG-CG 4.35Å; L239-R243 WeakPolarHBondContact O-CG 3.33Å; L239-R243 PolarHBondContact O-N 3.25Å; L239-L246 HydrophobicContact CD1-CD1 4.38Å; L239-I262 HydrophobicContact CD2-CG2 3.77Å
240	E	65.5	Low	60	Low	123 Å²	123	52 Å²	52	58%	0.575	27%	0.269	S	S	*	.	H	α-helix	trans	-58.9	-29.8	178.5	-56.3	-50.1	132.9	0	0	114.3	D238 R243	D238-E240 PolarHBondContact O-N 3.36Å; D238-E240 VanDerWaalsContact O-N 3.1Å; E240-R243 VanDerWaalsContact CD-NE 3.25Å; E240-R243 IonicContact OE1-CZ 2.86Å; E240-R243 VanDerWaalsContact OE1-CZ 3.3Å; E240-R243 IonicContact OE1-NE 3.11Å; E240-R243 PolarHBondContact OE1-NE 3.07Å; E240-R243 IonicContact OE1-NH2 3.84Å; E240-R243 PolarHBondContact OE1-NH2 2.92Å; E240-R243 WeakPolarHBondContact OE2-CD 3.33Å; E240-R243 IonicContact OE2-CZ 2.66Å; E240-R243 IonicContact OE2-NE 2.74Å; E240-R243 PolarHBondContact OE2-NE 2.79Å; E240-R243 IonicContact OE2-NH2 3.3Å
241	T	62.9	Low	60.9	Low	54 Å²	54	56.6 Å²	56.6	33%	0.331	29%	0.286	S	S	.	.	H	α-helix	trans	-79.8	-24.6	174.1	64.9	0	0	0	0	112.5	T236 D238 L239 H245	T236-T241 VanDerWaalsContact CB-OG1 3.31Å; T236-T241 WeakPolarHBondContact CB-OG1 3.49Å; T236-T241 PolarHBondContact OG1-OG1 2.99Å; D238-T241 HydrophobicContact CB-CG2 4.19Å; D238-T241 PolarHBondContact O-N 3.21Å; D238-T241 PolarHBondContact O-OG1 3.13Å; L239-T241 VanDerWaalsContact C-N 3.25Å; L239-T241 PolarHBondContact O-N 3.46Å; T241-H245 PolarHBondContact O-ND1 3Å
242	L	66.2	Low	61.5	Low	28 Å²	28	57.6 Å²	57.6	15%	0.147	29%	0.292	C	S	.	.	H	α-helix	trans	-92	-29.5	-178.1	-162.1	62.7	0	0	0	112.3	W28 D238 L239 H245 L246	W28-L242 HydrophobicContact CH2-CD2 4.15Å; W28-L242 HydrophobicContact CZ3-CD2 4.44Å; D238-L242 PolarHBondContact O-N 3.24Å; L239-L242 CarbonylContact O-C 3.49Å; L239-L242 WeakPolarHBondContact O-CA 3.42Å; L239-L242 PolarHBondContact O-N 2.84Å; L242-H245 HydrophobicContact CD1-CB 4.49Å; L242-H245 WeakPolarHBondContact O-CA 3.48Å; L242-H245 WeakPolarHBondContact O-CB 3.37Å; L242-H245 PolarHBondContact O-N 3.19Å; L242-L246 HydrophobicContact CB-CD1 4.37Å; L242-L246 HydrophobicContact CD2-CD1 4.11Å; L242-L246 HydrophobicContact CG-CD1 3.88Å; L242-L246 HydrophobicContact CG-CD2 4.49Å; L242-L246 HydrophobicContact CG-CG 3.98Å; L242-L246 WeakPolarHBondContact O-CG 3.35Å; L242-L246 PolarHBondContact O-N 2.87Å
243	R	66.9	Low	61.9	Low	35 Å²	35	59.2 Å²	59.2	13%	0.132	30%	0.297	C	S	.	.	H	α-helix	trans	-40.8	-56.4	174.6	-77.9	-166.8	-158.6	-81.3	-7.2	113.6	L239 E240 H245 L246 I247 I259 I262	L239-R243 HydrophobicContact CG-CG 4.35Å; L239-R243 WeakPolarHBondContact O-CG 3.33Å; L239-R243 PolarHBondContact O-N 3.25Å; E240-R243 VanDerWaalsContact CD-NE 3.25Å; E240-R243 IonicContact OE1-CZ 2.86Å; E240-R243 VanDerWaalsContact OE1-CZ 3.3Å; E240-R243 IonicContact OE1-NE 3.11Å; E240-R243 PolarHBondContact OE1-NE 3.07Å; E240-R243 IonicContact OE1-NH2 3.84Å; E240-R243 PolarHBondContact OE1-NH2 2.92Å; E240-R243 WeakPolarHBondContact OE2-CD 3.33Å; E240-R243 IonicContact OE2-CZ 2.66Å; E240-R243 IonicContact OE2-NE 2.74Å; E240-R243 PolarHBondContact OE2-NE 2.79Å; E240-R243 IonicContact OE2-NH2 3.3Å; R243-H245 PolarHBondContact O-N 3.38Å; R243-L246 PolarHBondContact O-N 2.95Å; R243-L246 VanDerWaalsContact O-N 3.11Å; R243-I247 VanDerWaalsContact O-CG1 3.3Å; R243-I247 WeakPolarHBondContact O-CG1 3.49Å; R243-I247 PolarHBondContact O-N 3.37Å; R243-I259 HydrophobicContact CB-CG2 4.33Å; R243-I259 HydrophobicContact CG-CG2 4.13Å; R243-I259 PolarHBondContact NH1-O 2.75Å; R243-I262 PolarHBondContact NH1-O 2.84Å; R243-I262 PolarHBondContact NH2-O 3.07Å
244	P	63.8	Low	62.5	Low	33 Å²	33	63.6 Å²	63.6	21%	0.214	32%	0.318	C	S	.	.	H	α-helix	trans	-63.4	-29.2	-177.1	24.9	-35.3	0	0	0	113.5	V229 L248	V229-P244 HydrophobicContact CG2-CB 4.2Å; P244-L248 PolarHBondContact O-N 3Å
245	H	65.4	Low	63.4	Low	9 Å²	9	61 Å²	61	4%	0.042	31%	0.305	C	S	.	.	H	α-helix	trans	-77	-35.8	175.3	-65.3	91.6	0	0	0	112.3	K228 V229 V231 P233 T241 L242 R243 L249	K228-H245 PolarHBondContact O-CE1 3.3Å; V229-H245 WeakPolarHBondContact CA-NE2 3.48Å; V231-H245 PolarHBondContact O-CE1 3.25Å; V231-H245 PolarHBondContact O-NE2 3.05Å; P233-H245 WeakPolarHBondContact CG-CE1 3.29Å; P233-H245 WeakPolarHBondContact CG-ND1 3.41Å; T241-H245 PolarHBondContact O-ND1 3Å; L242-H245 HydrophobicContact CD1-CB 4.49Å; L242-H245 WeakPolarHBondContact O-CA 3.48Å; L242-H245 WeakPolarHBondContact O-CB 3.37Å; L242-H245 PolarHBondContact O-N 3.19Å; R243-H245 PolarHBondContact O-N 3.38Å; H245-L249 WeakPolarHBondContact O-CB 3.19Å; H245-L249 PolarHBondContact O-N 3.16Å
246	L	66.8	Low	64.1	Low	9 Å²	9	61 Å²	61	5%	0.047	31%	0.311	C	S	.	.	H	α-helix	trans	-69.9	-38.6	174.1	-65.4	168.9	0	0	0	111.5	F25 L239 L242 R243 L249 C250 I259 L271	F25-L246 HydrophobicContact CE2-CD2 4.34Å; L239-L246 HydrophobicContact CD1-CD1 4.38Å; L242-L246 HydrophobicContact CB-CD1 4.37Å; L242-L246 HydrophobicContact CD2-CD1 4.11Å; L242-L246 HydrophobicContact CG-CD1 3.88Å; L242-L246 HydrophobicContact CG-CD2 4.49Å; L242-L246 HydrophobicContact CG-CG 3.98Å; L242-L246 WeakPolarHBondContact O-CG 3.35Å; L242-L246 PolarHBondContact O-N 2.87Å; R243-L246 PolarHBondContact O-N 2.95Å; R243-L246 VanDerWaalsContact O-N 3.11Å; L246-L249 HydrophobicContact CD2-CD2 4.46Å; L246-L249 WeakPolarHBondContact O-CB 3.48Å; L246-L249 PolarHBondContact O-N 2.99Å; L246-L249 VanDerWaalsContact O-N 3.16Å; L246-C250 WeakPolarHBondContact O-CB 3.4Å; L246-C250 PolarHBondContact O-N 3.09Å; L246-I259 HydrophobicContact CB-CD1 3.77Å; L246-I259 VanDerWaalsContact O-CD1 3.32Å; L246-I259 WeakPolarHBondContact O-CD1 3.34Å; L246-L271 HydrophobicContact CD1-CD2 3.84Å; L246-L271 HydrophobicContact CD2-CD2 4.17Å; L246-L271 HydrophobicContact CG-CD2 4.42Å
247	I	67.1	Low	64.8	Low	55 Å²	55	60.7 Å²	60.7	28%	0.282	31%	0.308	S	S	.	.	H	α-helix	trans	-60.2	-49.5	177.1	-71.5	164.4	0	0	0	109.6	R243 L249 C250 Q251 I259	R243-I247 VanDerWaalsContact O-CG1 3.3Å; R243-I247 WeakPolarHBondContact O-CG1 3.49Å; R243-I247 PolarHBondContact O-N 3.37Å; I247-L249 VanDerWaalsContact C-N 3.34Å; I247-L249 PolarHBondContact O-N 2.78Å; I247-C250 PolarHBondContact O-N 3.22Å; I247-Q251 WeakPolarHBondContact O-CB 3.5Å; I247-Q251 VanDerWaalsContact O-CG 3.25Å; I247-Q251 WeakPolarHBondContact O-CG 3.42Å; I247-Q251 PolarHBondContact O-N 3.35Å; I247-I259 HydrophobicContact CB-CD1 4.43Å; I247-I259 HydrophobicContact CD1-CG2 4.27Å; I247-I259 HydrophobicContact CG1-CB 3.92Å; I247-I259 HydrophobicContact CG1-CD1 3.93Å; I247-I259 HydrophobicContact CG1-CG2 3.8Å
248	L	64.5	Low	65.5	Low	28 Å²	28	60.2 Å²	60.2	15%	0.147	31%	0.305	C	S	.	.	H	α-helix	trans	-59.3	-43	173.8	176.9	70.8	0	0	0	112.1	L218 V220 V229 P244 Q251 T252	L218-L248 HydrophobicContact CD2-CD2 3.53Å; V220-L248 HydrophobicContact CG1-CD1 4.32Å; V220-L248 HydrophobicContact CG1-CD2 4.5Å; V220-L248 HydrophobicContact CG2-CD1 4.46Å; V220-L248 HydrophobicContact CG2-CD2 3.5Å; V220-L248 VanDerWaalsContact CG2-CD2 3.5Å; V229-L248 HydrophobicContact CG1-CB 4.19Å; V229-L248 HydrophobicContact CG1-CD2 3.61Å; P244-L248 PolarHBondContact O-N 3Å; L248-Q251 PolarHBondContact O-N 3.17Å; L248-T252 VanDerWaalsContact O-CB 3.29Å; L248-T252 WeakPolarHBondContact O-CB 3.15Å; L248-T252 PolarHBondContact O-N 3.05Å; L248-T252 PolarHBondContact O-OG1 2.9Å
249	L	64	Low	65.9	Low	20 Å²	20	55.4 Å²	55.4	11%	0.105	28%	0.279	C	S	.	.	H	α-helix	trans	-60.4	-49.7	177.9	-170.3	77.5	0	0	0	110.9	Y21 H245 L246 I247 Q251 T252 Y253 I275	Y21-L249 HydrophobicContact CD1-CD1 4.01Å; Y21-L249 HydrophobicContact CE1-CD1 4.37Å; H245-L249 WeakPolarHBondContact O-CB 3.19Å; H245-L249 PolarHBondContact O-N 3.16Å; L246-L249 HydrophobicContact CD2-CD2 4.46Å; L246-L249 WeakPolarHBondContact O-CB 3.48Å; L246-L249 PolarHBondContact O-N 2.99Å; L246-L249 VanDerWaalsContact O-N 3.16Å; I247-L249 VanDerWaalsContact C-N 3.34Å; I247-L249 PolarHBondContact O-N 2.78Å; L249-Q251 PolarHBondContact O-N 3.44Å; L249-T252 PolarHBondContact O-N 2.81Å; L249-Y253 HydrophobicContact CD1-CD2 3.75Å; L249-Y253 HydrophobicContact CD1-CE2 3.62Å; L249-Y253 HydrophobicContact CG-CD2 4.08Å; L249-Y253 HydrophobicContact CG-CE2 4.45Å; L249-Y253 VanDerWaalsContact O-CD2 3.31Å; L249-Y253 WeakPolarHBondContact O-CD2 3.22Å; L249-Y253 PolarHBondContact O-N 2.97Å; L249-I275 HydrophobicContact CD2-CD1 3.94Å
250	C	66.4	Low	66.2	Low	7 Å²	7	59.2 Å²	59.2	5%	0.047	30%	0.3	C	S	.	.	H	α-helix	trans	-66.6	-37.8	-178.9	-74.6	0	0	0	0	112.5	L246 I247 N254 I255 I259	L246-C250 WeakPolarHBondContact O-CB 3.4Å; L246-C250 PolarHBondContact O-N 3.09Å; I247-C250 PolarHBondContact O-N 3.22Å; C250-N254 PolarHBondContact O-N 3.4Å; C250-N254 VanDerWaalsContact O-N 3.16Å; C250-I255 HydrophobicContact CB-CB 3.92Å; C250-I255 HydrophobicContact CB-CG2 4.38Å; C250-I255 PolarHBondContact O-N 3.23Å; C250-I259 HydrophobicContact CB-CD1 3.94Å
251	Q	67.3	Low	66.5	Low	142 Å²	142	56 Å²	56	66%	0.664	29%	0.291	S	S	*	.	H	α-helix	trans	-61.5	-45.6	170.3	-72.4	171.5	-4.3	0	0	111.7	I247 L248 L249 N254	I247-Q251 WeakPolarHBondContact O-CB 3.5Å; I247-Q251 VanDerWaalsContact O-CG 3.25Å; I247-Q251 WeakPolarHBondContact O-CG 3.42Å; I247-Q251 PolarHBondContact O-N 3.35Å; L248-Q251 PolarHBondContact O-N 3.17Å; L249-Q251 PolarHBondContact O-N 3.44Å; Q251-N254 PolarHBondContact O-N 2.83Å
252	T	63.2	Low	66.8	Low	70 Å²	70	53.4 Å²	53.4	43%	0.429	28%	0.275	S	S	.	.	H	α-helix	trans	-66.3	-40.4	-177.2	-57.2	0	0	0	0	112.7	L248 L249	L248-T252 VanDerWaalsContact O-CB 3.29Å; L248-T252 WeakPolarHBondContact O-CB 3.15Å; L248-T252 PolarHBondContact O-N 3.05Å; L248-T252 PolarHBondContact O-OG1 2.9Å; L249-T252 PolarHBondContact O-N 2.81Å
253	Y	63.6	Low	67	Low	66 Å²	66	62.5 Å²	62.5	26%	0.259	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	12.6	-177.6	-66.7	-77.3	0	0	0	114.2	A18 L249 I255 K278 F279	A18-Y253 HydrophobicContact CB-CE1 4.45Å; A18-Y253 WeakPolarHBondContact CB-OH 3.07Å; L249-Y253 HydrophobicContact CD1-CD2 3.75Å; L249-Y253 HydrophobicContact CD1-CE2 3.62Å; L249-Y253 HydrophobicContact CG-CD2 4.08Å; L249-Y253 HydrophobicContact CG-CE2 4.45Å; L249-Y253 VanDerWaalsContact O-CD2 3.31Å; L249-Y253 WeakPolarHBondContact O-CD2 3.22Å; L249-Y253 PolarHBondContact O-N 2.97Å; Y253-I255 VanDerWaalsContact C-N 3.29Å; Y253-I255 PolarHBondContact O-N 3.24Å; Y253-K278 PolarHBondContact O-NZ 3.42Å; Y253-F279 AromaticContact CD1-CE1 3.9Å; Y253-F279 HydrophobicContact CD1-CE1 3.9Å; Y253-F279 AromaticContact CD1-CZ 3.63Å; Y253-F279 HydrophobicContact CD1-CZ 3.63Å; Y253-F279 AromaticContact CD2-CZ 3.91Å; Y253-F279 HydrophobicContact CD2-CZ 3.91Å; Y253-F279 AromaticContact CE1-CE1 3.79Å; Y253-F279 HydrophobicContact CE1-CE1 3.79Å; Y253-F279 AromaticContact CE1-CZ 3.77Å; Y253-F279 HydrophobicContact CE1-CZ 3.77Å; Y253-F279 HydrophobicContact CE2-CZ 4.06Å; Y253-F279 HydrophobicContact CG-CE1 4.45Å; Y253-F279 AromaticContact CG-CZ 3.73Å; Y253-F279 HydrophobicContact CG-CZ 3.73Å
254	N	66.4	Low	66.9	Low	116 Å²	116	63.2 Å²	63.2	62%	0.62	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.5	54.7	-176.4	-169.6	5.7	0	0	0	111.5	C250 Q251 K278	C250-N254 PolarHBondContact O-N 3.4Å; C250-N254 VanDerWaalsContact O-N 3.16Å; Q251-N254 PolarHBondContact O-N 2.83Å; N254-K278 PolarHBondContact O-NZ 2.97Å
255	I	67.1	Low	66.9	Low	9 Å²	9	67.8 Å²	67.8	5%	0.046	34%	0.339	C	S	.	.			trans	-94.6	113.7	176.6	-61.2	178	0	0	0	107.1	C250 Y253 M257 V274 I275 K278	C250-I255 HydrophobicContact CB-CB 3.92Å; C250-I255 HydrophobicContact CB-CG2 4.38Å; C250-I255 PolarHBondContact O-N 3.23Å; Y253-I255 VanDerWaalsContact C-N 3.29Å; Y253-I255 PolarHBondContact O-N 3.24Å; I255-M257 VanDerWaalsContact C-N 3.29Å; I255-M257 HydrophobicContact CG2-CB 3.95Å; I255-M257 PolarHBondContact O-N 2.98Å; I255-V274 HydrophobicContact CG2-CG1 3.5Å; I255-I275 HydrophobicContact CD1-CG1 4.03Å; I255-K278 HydrophobicContact CD1-CG 4.46Å; I255-K278 HydrophobicContact CG1-CD 4.47Å; I255-K278 HydrophobicContact CG1-CG 4.2Å
256	Q	67	Low	67	Low	184 Å²	184	70.5 Å²	70.5	86%	0.86	36%	0.363	S	S	*	.			trans	-78.6	81.4	175.5	-64.1	178.1	19.4	0	0	109
257	M	66.1	Low	67.1	Low	34 Å²	34	71.9 Å²	71.9	17%	0.167	37%	0.371	C	S	.	.			trans	-138.2	130.1	174.5	-167.3	67.9	176	0	0	108.9	I255 I259 E270 L271	I255-M257 VanDerWaalsContact C-N 3.29Å; I255-M257 HydrophobicContact CG2-CB 3.95Å; I255-M257 PolarHBondContact O-N 2.98Å; M257-I259 PolarHBondContact O-N 2.97Å; M257-E270 HydrophobicContact CE-CB 3.97Å; M257-E270 HydrophobicContact CE-CG 3.83Å; M257-E270 HydrophobicContact SD-CG 4.45Å; M257-L271 HydrophobicContact CB-CD1 4.32Å; M257-L271 HydrophobicContact CE-CB 4.36Å; M257-L271 HydrophobicContact CG-CD1 3.92Å
258	D	69.4	Low	67.1	Low	95 Å²	95	72 Å²	72	51%	0.508	37%	0.37	S	S	.	.			trans	-84.3	108.8	174	179.1	-5.7	0	0	0	109.2	D260 S261	D258-D260 WeakPolarHBondContact OD1-CA 3.47Å; D258-D260 PolarHBondContact OD1-N 2.78Å; D258-S261 WeakPolarHBondContact O-CB 3.47Å; D258-S261 PolarHBondContact O-N 2.81Å; D258-S261 PolarHBondContact O-OG 2.89Å; D258-S261 PolarHBondContact OD1-N 3.47Å
259	I	69.6	Low	67.1	Low	9 Å²	9	76.1 Å²	76.1	5%	0.046	39%	0.39	C	S	.	.	S	Bend	trans	-80.9	-17.3	-178.5	-71.8	157.9	0	0	0	112.4	R243 L246 I247 C250 M257 S261 I262	R243-I259 HydrophobicContact CB-CG2 4.33Å; R243-I259 HydrophobicContact CG-CG2 4.13Å; R243-I259 PolarHBondContact NH1-O 2.75Å; L246-I259 HydrophobicContact CB-CD1 3.77Å; L246-I259 VanDerWaalsContact O-CD1 3.32Å; L246-I259 WeakPolarHBondContact O-CD1 3.34Å; I247-I259 HydrophobicContact CB-CD1 4.43Å; I247-I259 HydrophobicContact CD1-CG2 4.27Å; I247-I259 HydrophobicContact CG1-CB 3.92Å; I247-I259 HydrophobicContact CG1-CD1 3.93Å; I247-I259 HydrophobicContact CG1-CG2 3.8Å; C250-I259 HydrophobicContact CB-CD1 3.94Å; M257-I259 PolarHBondContact O-N 2.97Å; I259-S261 VanDerWaalsContact C-N 3.33Å; I259-I262 HydrophobicContact CB-CD1 4.31Å; I259-I262 HydrophobicContact CG1-CD1 3.96Å; I259-I262 HydrophobicContact CG2-CD1 4.42Å; I259-I262 PolarHBondContact O-N 2.89Å
260	D	70.4	Confident	67.4	Low	117 Å²	117	80.7 Å²	80.7	63%	0.626	41%	0.41	S	S	*	.	S	Bend	trans	-79.6	-22.4	172.4	-62.8	-36.5	0	0	0	111	D258 I262	D258-D260 WeakPolarHBondContact OD1-CA 3.47Å; D258-D260 PolarHBondContact OD1-N 2.78Å; D260-I262 VanDerWaalsContact C-N 3.28Å; D260-I262 PolarHBondContact O-N 3.24Å
261	S	72.3	Confident	67.5	Low	55 Å²	55	80.6 Å²	80.6	39%	0.385	41%	0.409	S	S	.	.	S	Bend	trans	-67.7	-22.7	167.5	83.5	0	0	0	0	114.1	D258 I259 R263	D258-S261 WeakPolarHBondContact O-CB 3.47Å; D258-S261 PolarHBondContact O-N 2.81Å; D258-S261 PolarHBondContact O-OG 2.89Å; D258-S261 PolarHBondContact OD1-N 3.47Å; I259-S261 VanDerWaalsContact C-N 3.33Å; S261-R263 WeakPolarHBondContact O-CG 3.47Å; S261-R263 PolarHBondContact O-N 3.12Å
262	I	70.1	Confident	67.4	Low	0 Å²	0	75.6 Å²	75.6	0%	0	39%	0.386	C	S	.	.			trans	-70.2	105.7	-176.5	-59.4	177.1	0	0	0	110.1	L239 R243 I259 D260 D267 E268 L271	L239-I262 HydrophobicContact CD2-CG2 3.77Å; R243-I262 PolarHBondContact NH1-O 2.84Å; R243-I262 PolarHBondContact NH2-O 3.07Å; I259-I262 HydrophobicContact CB-CD1 4.31Å; I259-I262 HydrophobicContact CG1-CD1 3.96Å; I259-I262 HydrophobicContact CG2-CD1 4.42Å; I259-I262 PolarHBondContact O-N 2.89Å; D260-I262 VanDerWaalsContact C-N 3.28Å; D260-I262 PolarHBondContact O-N 3.24Å; I262-D267 HydrophobicContact CB-CB 4.22Å; I262-D267 HydrophobicContact CG1-CB 4.07Å; I262-D267 HydrophobicContact CG2-CB 4.11Å; I262-E268 HydrophobicContact CG2-CG 3.8Å; I262-L271 HydrophobicContact CD1-CB 4.03Å; I262-L271 HydrophobicContact CD1-CD2 3.65Å; I262-L271 HydrophobicContact CD1-CG 4.29Å
263	R	70.5	Confident	67.5	Low	219 Å²	219	75.1 Å²	75.1	83%	0.826	39%	0.389	S	S	*	.			trans	-136.1	-5.9	-175.4	-65.4	-179.3	64.8	172.8	0.6	113	S261 D267	S261-R263 WeakPolarHBondContact O-CG 3.47Å; S261-R263 PolarHBondContact O-N 3.12Å; R263-D267 PolarHBondContact N-OD2 3.02Å
264	S	64.3	Low	67.6	Low	50 Å²	50	74 Å²	74	35%	0.35	39%	0.389	S	S	.	.	S	Bend	trans	-137.8	159.2	-177.7	93.4	0	0	0	0	111.7	A266 D267 E268	S264-A266 PolarHBondContact O-N 3.03Å; S264-A266 WeakPolarHBondContact OG-CB 3.41Å; S264-A266 PolarHBondContact OG-N 2.75Å; S264-A266 VanDerWaalsContact OG-N 3.17Å; S264-D267 WeakPolarHBondContact CA-OD2 3.26Å; S264-D267 WeakPolarHBondContact CB-OD2 3.47Å; S264-D267 PolarHBondContact N-OD2 2.77Å; S264-D267 PolarHBondContact O-N 3.08Å; S264-D267 VanDerWaalsContact O-N 3.13Å; S264-D267 PolarHBondContact OG-N 3.41Å; S264-D267 PolarHBondContact OG-OD1 3.07Å; S264-D267 PolarHBondContact OG-OD2 2.83Å; S264-E268 PolarHBondContact O-N 3.18Å; S264-E268 VanDerWaalsContact O-N 3.17Å
265	I	64.2	Low	67.5	Low	130 Å²	130	68.5 Å²	68.5	67%	0.667	36%	0.359	S	S	*	.	H	α-helix	trans	-62.2	-23.7	175.6	-58.9	170.7	0	0	0	111.2	M269	I265-M269 WeakPolarHBondContact O-CB 3.33Å; I265-M269 VanDerWaalsContact O-CG 3.27Å; I265-M269 WeakPolarHBondContact O-CG 3.39Å; I265-M269 PolarHBondContact O-N 3.31Å
266	A	65.8	Low	67.5	Low	66 Å²	66	70.9 Å²	70.9	55%	0.545	37%	0.372	S	S	.	.	H	α-helix	trans	-69.4	-42.5	175.3	0	0	0	0	0	111.4	S264 M269 E270	S264-A266 PolarHBondContact O-N 3.03Å; S264-A266 WeakPolarHBondContact OG-CB 3.41Å; S264-A266 PolarHBondContact OG-N 2.75Å; S264-A266 VanDerWaalsContact OG-N 3.17Å; A266-M269 CarbonylContact O-C 3.6Å; A266-M269 WeakPolarHBondContact O-CB 3.37Å; A266-M269 PolarHBondContact O-N 2.82Å; A266-E270 PolarHBondContact O-N 3.44Å
267	D	69.8	Low	67.5	Low	38 Å²	38	72.1 Å²	72.1	20%	0.203	37%	0.369	C	S	.	.	H	α-helix	trans	-69.8	-35.9	-179.9	-24.9	-34.4	0	0	0	110.7	I262 R263 S264 E270 L271	I262-D267 HydrophobicContact CB-CB 4.22Å; I262-D267 HydrophobicContact CG1-CB 4.07Å; I262-D267 HydrophobicContact CG2-CB 4.11Å; R263-D267 PolarHBondContact N-OD2 3.02Å; S264-D267 WeakPolarHBondContact CA-OD2 3.26Å; S264-D267 WeakPolarHBondContact CB-OD2 3.47Å; S264-D267 PolarHBondContact N-OD2 2.77Å; S264-D267 PolarHBondContact O-N 3.08Å; S264-D267 VanDerWaalsContact O-N 3.13Å; S264-D267 PolarHBondContact OG-N 3.41Å; S264-D267 PolarHBondContact OG-OD1 3.07Å; S264-D267 PolarHBondContact OG-OD2 2.83Å; D267-E270 PolarHBondContact O-N 2.77Å; D267-L271 PolarHBondContact O-N 2.89Å
268	E	67	Low	67.4	Low	58 Å²	58	75.2 Å²	75.2	27%	0.271	38%	0.382	S	S	.	.	H	α-helix	trans	-59.9	-46.7	168.5	-68.3	179.4	-176.2	0	0	111.3	I262 S264 E270 L271 F272	I262-E268 HydrophobicContact CG2-CG 3.8Å; S264-E268 PolarHBondContact O-N 3.18Å; S264-E268 VanDerWaalsContact O-N 3.17Å; E268-E270 VanDerWaalsContact C-N 3.34Å; E268-E270 PolarHBondContact O-N 3.29Å; E268-L271 PolarHBondContact O-N 3.18Å; E268-F272 HydrophobicContact CB-CE2 4.08Å; E268-F272 WeakPolarHBondContact O-CD2 3.49Å; E268-F272 WeakPolarHBondContact O-CG 3.28Å; E268-F272 PolarHBondContact O-N 2.91Å
269	M	64.6	Low	67.1	Low	114 Å²	114	73.9 Å²	73.9	56%	0.562	37%	0.371	S	S	*	.	H	α-helix	trans	-64.1	-35.2	177.3	-76.8	-59.1	-47.8	0	0	113.3	I265 A266 F272 A273	I265-M269 WeakPolarHBondContact O-CB 3.33Å; I265-M269 VanDerWaalsContact O-CG 3.27Å; I265-M269 WeakPolarHBondContact O-CG 3.39Å; I265-M269 PolarHBondContact O-N 3.31Å; A266-M269 CarbonylContact O-C 3.6Å; A266-M269 WeakPolarHBondContact O-CB 3.37Å; A266-M269 PolarHBondContact O-N 2.82Å; M269-F272 HydrophobicContact SD-CD2 4.11Å; M269-A273 WeakPolarHBondContact O-CB 3.32Å; M269-A273 PolarHBondContact O-N 2.86Å
270	E	70.5	Confident	66.2	Low	115 Å²	115	83.9 Å²	83.9	54%	0.537	42%	0.418	S	S	.	.	H	α-helix	trans	-66.4	-46.3	171.4	-175.5	167	-150.2	0	0	111.2	M257 A266 D267 E268 F272 A273 V274	M257-E270 HydrophobicContact CE-CB 3.97Å; M257-E270 HydrophobicContact CE-CG 3.83Å; M257-E270 HydrophobicContact SD-CG 4.45Å; A266-E270 PolarHBondContact O-N 3.44Å; D267-E270 PolarHBondContact O-N 2.77Å; E268-E270 VanDerWaalsContact C-N 3.34Å; E268-E270 PolarHBondContact O-N 3.29Å; E270-F272 VanDerWaalsContact C-N 3.32Å; E270-F272 PolarHBondContact O-N 3.45Å; E270-A273 WeakPolarHBondContact O-CB 3.49Å; E270-A273 PolarHBondContact O-N 2.8Å; E270-A273 VanDerWaalsContact O-N 3.08Å; E270-V274 HydrophobicContact CG-CG2 4.21Å; E270-V274 WeakPolarHBondContact O-CG2 3.07Å; E270-V274 PolarHBondContact O-N 3.08Å
271	L	67.7	Low	66	Low	5 Å²	5	82.3 Å²	82.3	3%	0.026	41%	0.408	C	S	.	.	H	α-helix	trans	-56.7	-45	174.6	176.6	68.5	0	0	0	111.5	L246 M257 I262 D267 E268 A273 V274 I275	L246-L271 HydrophobicContact CD1-CD2 3.84Å; L246-L271 HydrophobicContact CD2-CD2 4.17Å; L246-L271 HydrophobicContact CG-CD2 4.42Å; M257-L271 HydrophobicContact CB-CD1 4.32Å; M257-L271 HydrophobicContact CE-CB 4.36Å; M257-L271 HydrophobicContact CG-CD1 3.92Å; I262-L271 HydrophobicContact CD1-CB 4.03Å; I262-L271 HydrophobicContact CD1-CD2 3.65Å; I262-L271 HydrophobicContact CD1-CG 4.29Å; D267-L271 PolarHBondContact O-N 2.89Å; E268-L271 PolarHBondContact O-N 3.18Å; L271-A273 VanDerWaalsContact C-N 3.35Å; L271-A273 PolarHBondContact O-N 3.23Å; L271-V274 PolarHBondContact O-N 3.47Å; L271-I275 HydrophobicContact CD1-CD1 3.81Å; L271-I275 HydrophobicContact CD1-CG1 4.12Å; L271-I275 HydrophobicContact CD2-CD1 4.4Å; L271-I275 HydrophobicContact CG-CD1 3.79Å; L271-I275 HydrophobicContact CG-CG1 4.43Å; L271-I275 WeakPolarHBondContact O-CB 3.46Å; L271-I275 VanDerWaalsContact O-CG1 3.29Å; L271-I275 WeakPolarHBondContact O-CG1 3.48Å; L271-I275 PolarHBondContact O-N 2.97Å
272	F	64.8	Low	65.6	Low	37 Å²	37	83.7 Å²	83.7	16%	0.162	41%	0.409	C	S	.	.	H	α-helix	trans	-61.4	-40.9	175.4	-66.6	-53.4	0	0	0	112.1	F25 N29 E268 M269 E270 N276	F25-F272 AromaticContact CE1-CD1 3.85Å; F25-F272 HydrophobicContact CE1-CD1 3.85Å; F25-F272 HydrophobicContact CE1-CE1 4.03Å; F25-F272 HydrophobicContact CE2-CE1 4.02Å; F25-F272 AromaticContact CZ-CD1 3.61Å; F25-F272 HydrophobicContact CZ-CD1 3.61Å; F25-F272 AromaticContact CZ-CE1 3.41Å; F25-F272 HydrophobicContact CZ-CE1 3.41Å; F25-F272 VanDerWaalsContact CZ-CE1 3.41Å; N29-F272 WeakPolarHBondContact OD1-CE1 3.42Å; N29-F272 WeakPolarHBondContact OD1-CZ 3.44Å; E268-F272 HydrophobicContact CB-CE2 4.08Å; E268-F272 WeakPolarHBondContact O-CD2 3.49Å; E268-F272 WeakPolarHBondContact O-CG 3.28Å; E268-F272 PolarHBondContact O-N 2.91Å; M269-F272 HydrophobicContact SD-CD2 4.11Å; E270-F272 VanDerWaalsContact C-N 3.32Å; E270-F272 PolarHBondContact O-N 3.45Å; F272-N276 VanDerWaalsContact O-CB 3.3Å; F272-N276 WeakPolarHBondContact O-CB 3.32Å; F272-N276 PolarHBondContact O-N 3.33Å; F272-N276 PolarHBondContact O-ND2 3.39Å
273	A	65.8	Low	65.4	Low	60 Å²	60	88.3 Å²	88.3	50%	0.496	43%	0.432	S	S	.	.	H	α-helix	trans	-65.6	-43.8	177.1	0	0	0	0	0	112.3	M269 E270 L271 N276 R277	M269-A273 WeakPolarHBondContact O-CB 3.32Å; M269-A273 PolarHBondContact O-N 2.86Å; E270-A273 WeakPolarHBondContact O-CB 3.49Å; E270-A273 PolarHBondContact O-N 2.8Å; E270-A273 VanDerWaalsContact O-N 3.08Å; L271-A273 VanDerWaalsContact C-N 3.35Å; L271-A273 PolarHBondContact O-N 3.23Å; A273-N276 PolarHBondContact O-N 2.86Å; A273-R277 WeakPolarHBondContact O-CB 3.24Å; A273-R277 PolarHBondContact O-N 3.3Å
274	V	66.6	Low	65.1	Low	43 Å²	43	80.6 Å²	80.6	26%	0.261	41%	0.408	S	S	.	.	H	α-helix	trans	-66.3	-42.3	178.5	174.6	0	0	0	0	111.5	I255 E270 L271 K278	I255-V274 HydrophobicContact CG2-CG1 3.5Å; E270-V274 HydrophobicContact CG-CG2 4.21Å; E270-V274 WeakPolarHBondContact O-CG2 3.07Å; E270-V274 PolarHBondContact O-N 3.08Å; L271-V274 PolarHBondContact O-N 3.47Å; V274-K278 WeakPolarHBondContact O-CG 3.28Å; V274-K278 PolarHBondContact O-N 3.26Å
275	I	64.7	Low	65.1	Low	1 Å²	1	82.6 Å²	82.6	1%	0.005	41%	0.412	C	S	.	.	H	α-helix	trans	-61.7	-51.9	173.2	-72.1	171.3	0	0	0	110.2	F22 F25 L249 I255 L271 R277 K278 F279	F22-I275 HydrophobicContact CE2-CG2 4.49Å; F25-I275 HydrophobicContact CE1-CD1 4.18Å; F25-I275 HydrophobicContact CE1-CG2 4.14Å; F25-I275 HydrophobicContact CZ-CD1 4.06Å; L249-I275 HydrophobicContact CD2-CD1 3.94Å; I255-I275 HydrophobicContact CD1-CG1 4.03Å; L271-I275 HydrophobicContact CD1-CD1 3.81Å; L271-I275 HydrophobicContact CD1-CG1 4.12Å; L271-I275 HydrophobicContact CD2-CD1 4.4Å; L271-I275 HydrophobicContact CG-CD1 3.79Å; L271-I275 HydrophobicContact CG-CG1 4.43Å; L271-I275 WeakPolarHBondContact O-CB 3.46Å; L271-I275 VanDerWaalsContact O-CG1 3.29Å; L271-I275 WeakPolarHBondContact O-CG1 3.48Å; L271-I275 PolarHBondContact O-N 2.97Å; I275-R277 VanDerWaalsContact C-N 3.28Å; I275-R277 PolarHBondContact O-N 3.09Å; I275-K278 WeakPolarHBondContact O-CB 3.47Å; I275-K278 PolarHBondContact O-N 3.28Å; I275-F279 HydrophobicContact CG2-CD2 3.98Å; I275-F279 HydrophobicContact CG2-CE2 4.1Å; I275-F279 VanDerWaalsContact O-CD2 3.3Å; I275-F279 WeakPolarHBondContact O-CD2 3.39Å; I275-F279 PolarHBondContact O-N 2.76Å
276	N	66.5	Low	65.2	Low	59 Å²	59	79.4 Å²	79.4	32%	0.316	40%	0.395	S	S	.	.	H	α-helix	trans	-60	-38.5	-177.8	-74.2	-35.3	0	0	0	112.1	F272 A273 K278 F279 Q280	F272-N276 VanDerWaalsContact O-CB 3.3Å; F272-N276 WeakPolarHBondContact O-CB 3.32Å; F272-N276 PolarHBondContact O-N 3.33Å; F272-N276 PolarHBondContact O-ND2 3.39Å; A273-N276 PolarHBondContact O-N 2.86Å; N276-K278 PolarHBondContact O-N 3.49Å; N276-F279 PolarHBondContact O-N 3.43Å; N276-Q280 WeakPolarHBondContact O-CG 3.32Å; N276-Q280 PolarHBondContact O-N 2.78Å
277	R	67.5	Low	65.1	Low	209 Å²	209	80.4 Å²	80.4	79%	0.789	38%	0.384	S	S	*	.	H	α-helix	trans	-67.3	-17.5	176.3	-171.2	174.5	-178.8	-174.1	1.9	114.1	A273 I275	A273-R277 WeakPolarHBondContact O-CB 3.24Å; A273-R277 PolarHBondContact O-N 3.3Å; I275-R277 VanDerWaalsContact C-N 3.28Å; I275-R277 PolarHBondContact O-N 3.09Å
278	K	62.7	Low	64.8	Low	100 Å²	100	83.6 Å²	83.6	44%	0.435	40%	0.398	S	S	.	.	H	α-helix	trans	-89.8	-10.9	176.1	-79	-87.4	-163	148.4	0	113.8	Y253 N254 I255 V274 I275 N276	Y253-K278 PolarHBondContact O-NZ 3.42Å; N254-K278 PolarHBondContact O-NZ 2.97Å; I255-K278 HydrophobicContact CD1-CG 4.46Å; I255-K278 HydrophobicContact CG1-CD 4.47Å; I255-K278 HydrophobicContact CG1-CG 4.2Å; V274-K278 WeakPolarHBondContact O-CG 3.28Å; V274-K278 PolarHBondContact O-N 3.26Å; I275-K278 WeakPolarHBondContact O-CB 3.47Å; I275-K278 PolarHBondContact O-N 3.28Å; N276-K278 PolarHBondContact O-N 3.49Å
279	F	63	Low	64.6	Low	66 Å²	66	85.8 Å²	85.8	29%	0.289	41%	0.409	S	S	.	.			trans	-125.6	25.7	-178.3	-64.3	-71.3	0	0	0	112.5	F22 Y253 I275 N276	F22-F279 HydrophobicContact CD2-CB 3.91Å; F22-F279 AromaticContact CD2-CD2 3.79Å; F22-F279 HydrophobicContact CD2-CD2 3.79Å; F22-F279 AromaticContact CD2-CG 3.93Å; F22-F279 HydrophobicContact CD2-CG 3.93Å; F22-F279 HydrophobicContact CE2-CB 3.64Å; F22-F279 AromaticContact CE2-CD2 3.92Å; F22-F279 HydrophobicContact CE2-CD2 3.92Å; F22-F279 HydrophobicContact CE2-CG 4.07Å; F22-F279 HydrophobicContact CZ-CB 4.03Å; Y253-F279 AromaticContact CD1-CE1 3.9Å; Y253-F279 HydrophobicContact CD1-CE1 3.9Å; Y253-F279 AromaticContact CD1-CZ 3.63Å; Y253-F279 HydrophobicContact CD1-CZ 3.63Å; Y253-F279 AromaticContact CD2-CZ 3.91Å; Y253-F279 HydrophobicContact CD2-CZ 3.91Å; Y253-F279 AromaticContact CE1-CE1 3.79Å; Y253-F279 HydrophobicContact CE1-CE1 3.79Å; Y253-F279 AromaticContact CE1-CZ 3.77Å; Y253-F279 HydrophobicContact CE1-CZ 3.77Å; Y253-F279 HydrophobicContact CE2-CZ 4.06Å; Y253-F279 HydrophobicContact CG-CE1 4.45Å; Y253-F279 AromaticContact CG-CZ 3.73Å; Y253-F279 HydrophobicContact CG-CZ 3.73Å; I275-F279 HydrophobicContact CG2-CD2 3.98Å; I275-F279 HydrophobicContact CG2-CE2 4.1Å; I275-F279 VanDerWaalsContact O-CD2 3.3Å; I275-F279 WeakPolarHBondContact O-CD2 3.39Å; I275-F279 PolarHBondContact O-N 2.76Å; N276-F279 PolarHBondContact O-N 3.43Å
280	Q	50.5	Low	64.6	Low	220 Å²	220	83.2 Å²	83.2	100%	1.028	40%	0.395	S	S	*	.			trans	-105.3	0	167	-78.8	174.5	-5.5	0	0	109.6	N276	N276-Q280 WeakPolarHBondContact O-CG 3.32Å; N276-Q280 PolarHBondContact O-N 2.78Å

Retrieved 280 of 280 residues in 564.1 ms (Link to these results)

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