A0A087WUK4_HUMAN Loading...

Nuclear receptor subfamily 2 group C member 1

AlphaFold DB , UniProt , Accession A0A087WUK4, Species HUMAN (Homo sapiens, Human), Gene NR2C1, Length 434 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	36.6	Very low	43	Very low	242 Å²	242	110.9 Å²	110.9	100%	1.192	58%	0.576	S	S	*	*				0	127.7	0	-69.4	169.3	175.1	0	0	105.5
2	A	32.9	Very low	43.2	Very low	62 Å²	62	105.8 Å²	105.8	51%	0.512	55%	0.549	S	S	.	.			trans	-71.9	149	175.4	0	0	0	0	0	109.9	E6 I7	A2-E6 WeakPolarHBondContact CA-OE2 3.47Å; A2-E6 HydrophobicContact CB-CB 4.14Å; A2-E6 WeakPolarHBondContact CB-OE2 3.11Å; A2-I7 HydrophobicContact CB-CD1 4.32Å; A2-I7 HydrophobicContact CB-CG1 3.98Å
3	T	39.9	Very low	43.4	Very low	66 Å²	66	110.2 Å²	110.2	41%	0.405	57%	0.565	S	S	.	*			trans	-73.6	164.2	172.4	71.4	0	0	0	0	110.7	E5 E6 I7	T3-E5 PolarHBondContact O-N 3.2Å; T3-E6 PolarHBondContact N-OE2 3.35Å; T3-E6 PolarHBondContact O-N 3.34Å; T3-E6 WeakPolarHBondContact OG1-CG 3.36Å; T3-E6 PolarHBondContact OG1-N 2.91Å; T3-I7 PolarHBondContact O-N 3.02Å; T3-I7 VanDerWaalsContact O-N 3.17Å
4	I	44	Very low	43.9	Very low	120 Å²	120	114.2 Å²	114.2	62%	0.615	58%	0.58	S	S	*	*	H	α-helix	trans	-61.7	-34.6	176.1	-61.7	176	0	0	0	110.2	I7 A8	I4-I7 PolarHBondContact O-N 3.17Å; I4-A8 WeakPolarHBondContact O-CB 3.29Å; I4-A8 PolarHBondContact O-N 3.47Å
5	E	44.5	Very low	43.8	Very low	147 Å²	147	114.3 Å²	114.3	69%	0.687	58%	0.578	S	S	*	*	H	α-helix	trans	-63.3	-47.2	174.9	-59	171.3	138.5	0	0	111.7	T3 I7 A8 H9	T3-E5 PolarHBondContact O-N 3.2Å; E5-I7 VanDerWaalsContact C-N 3.35Å; E5-I7 PolarHBondContact O-N 3.26Å; E5-A8 PolarHBondContact O-N 3.43Å; E5-H9 WeakPolarHBondContact O-CB 3.47Å; E5-H9 PolarHBondContact O-CD2 3.42Å; E5-H9 PolarHBondContact O-N 3.11Å
6	E	44.7	Very low	43.1	Very low	111 Å²	111	117.4 Å²	117.4	52%	0.519	59%	0.592	S	S	.	*	H	α-helix	trans	-60.5	-42.5	178.1	-72.8	174.2	139.2	0	0	111.9	A2 T3 H9 Q10	A2-E6 WeakPolarHBondContact CA-OE2 3.47Å; A2-E6 HydrophobicContact CB-CB 4.14Å; A2-E6 WeakPolarHBondContact CB-OE2 3.11Å; T3-E6 PolarHBondContact N-OE2 3.35Å; T3-E6 PolarHBondContact O-N 3.34Å; T3-E6 WeakPolarHBondContact OG1-CG 3.36Å; T3-E6 PolarHBondContact OG1-N 2.91Å; E6-H9 PolarHBondContact O-N 2.78Å; E6-Q10 WeakPolarHBondContact O-CB 3.44Å; E6-Q10 PolarHBondContact O-N 3.5Å
7	I	46.8	Very low	43.4	Very low	94 Å²	94	111.9 Å²	111.9	48%	0.482	57%	0.572	S	S	.	*	H	α-helix	trans	-68	-39.9	177.8	-62.7	173.6	0	0	0	111	A2 T3 I4 E5 Q10 I11	A2-I7 HydrophobicContact CB-CD1 4.32Å; A2-I7 HydrophobicContact CB-CG1 3.98Å; T3-I7 PolarHBondContact O-N 3.02Å; T3-I7 VanDerWaalsContact O-N 3.17Å; I4-I7 PolarHBondContact O-N 3.17Å; E5-I7 VanDerWaalsContact C-N 3.35Å; E5-I7 PolarHBondContact O-N 3.26Å; I7-Q10 PolarHBondContact O-N 3.49Å; I7-I11 HydrophobicContact CG2-CD1 4.09Å; I7-I11 WeakPolarHBondContact O-CG1 3.45Å; I7-I11 PolarHBondContact O-N 2.96Å
8	A	44.3	Very low	43.2	Very low	32 Å²	32	112.4 Å²	112.4	26%	0.264	57%	0.571	S	S	.	*	H	α-helix	trans	-62.9	-48.3	175.2	0	0	0	0	0	111.5	I4 E5 Q10 I11 I12	I4-A8 WeakPolarHBondContact O-CB 3.29Å; I4-A8 PolarHBondContact O-N 3.47Å; E5-A8 PolarHBondContact O-N 3.43Å; A8-Q10 PolarHBondContact O-N 2.86Å; A8-I11 PolarHBondContact O-N 3.26Å; A8-I12 WeakPolarHBondContact O-CB 3.21Å; A8-I12 WeakPolarHBondContact O-CD1 3.48Å; A8-I12 VanDerWaalsContact O-CG1 3.29Å; A8-I12 WeakPolarHBondContact O-CG1 3.24Å; A8-I12 PolarHBondContact O-N 3.1Å
9	H	46.4	Very low	43.2	Very low	123 Å²	123	109.9 Å²	109.9	57%	0.569	56%	0.559	S	S	*	*	H	α-helix	trans	-59.1	-42.9	176.2	-90.6	-94.8	0	0	0	112.4	E5 E6 I11 I12 E13	E5-H9 WeakPolarHBondContact O-CB 3.47Å; E5-H9 PolarHBondContact O-CD2 3.42Å; E5-H9 PolarHBondContact O-N 3.11Å; E6-H9 PolarHBondContact O-N 2.78Å; H9-I11 VanDerWaalsContact C-N 3.29Å; H9-I11 PolarHBondContact O-N 2.98Å; H9-I12 PolarHBondContact O-N 3.02Å; H9-I12 VanDerWaalsContact O-N 3.1Å; H9-E13 PolarHBondContact O-N 3.36Å
10	Q	48.1	Very low	43.1	Very low	127 Å²	127	108.6 Å²	108.6	59%	0.593	56%	0.556	S	S	*	*	H	α-helix	trans	-64.3	-32.5	179.2	-161.7	102.9	96.4	0	0	113	E6 I7 A8	E6-Q10 WeakPolarHBondContact O-CB 3.44Å; E6-Q10 PolarHBondContact O-N 3.5Å; I7-Q10 PolarHBondContact O-N 3.49Å; A8-Q10 PolarHBondContact O-N 2.86Å
11	I	44.4	Very low	43.2	Very low	96 Å²	96	107 Å²	107	49%	0.492	55%	0.551	S	S	.	*	H	α-helix	trans	-74.5	-34	173.9	-68.1	168.1	0	0	0	110.9	I7 A8 H9 Q15	I7-I11 HydrophobicContact CG2-CD1 4.09Å; I7-I11 WeakPolarHBondContact O-CG1 3.45Å; I7-I11 PolarHBondContact O-N 2.96Å; A8-I11 PolarHBondContact O-N 3.26Å; H9-I11 VanDerWaalsContact C-N 3.29Å; H9-I11 PolarHBondContact O-N 2.98Å; I11-Q15 PolarHBondContact O-N 3.28Å
12	I	45.2	Very low	43.6	Very low	49 Å²	49	100.2 Å²	100.2	25%	0.251	52%	0.517	S	S	.	.	H	α-helix	trans	-75.9	-39.4	-178.1	-74.2	164.9	0	0	0	112.8	A8 H9 Q14 Q15 G17 I19	A8-I12 WeakPolarHBondContact O-CB 3.21Å; A8-I12 WeakPolarHBondContact O-CD1 3.48Å; A8-I12 VanDerWaalsContact O-CG1 3.29Å; A8-I12 WeakPolarHBondContact O-CG1 3.24Å; A8-I12 PolarHBondContact O-N 3.1Å; H9-I12 PolarHBondContact O-N 3.02Å; H9-I12 VanDerWaalsContact O-N 3.1Å; I12-Q14 PolarHBondContact O-N 3.24Å; I12-Q14 VanDerWaalsContact O-N 3.11Å; I12-Q15 CarbonylContact O-C 3.21Å; I12-Q15 PolarHBondContact O-N 2.85Å; I12-G17 WeakPolarHBondContact CG2-O 3.38Å; I12-I19 HydrophobicContact CD1-CD1 3.5Å; I12-I19 VanDerWaalsContact CD1-CD1 3.5Å; I12-I19 HydrophobicContact CD1-CG1 3.56Å
13	E	46.4	Very low	44.1	Very low	163 Å²	163	103.7 Å²	103.7	76%	0.762	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-26.1	174.1	-78.6	-163.7	128.5	0	0	112.5	H9	H9-E13 PolarHBondContact O-N 3.36Å
14	Q	50.8	Low	44.5	Very low	167 Å²	167	107.1 Å²	107.1	78%	0.78	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-16.7	175.1	-61.7	-169.8	4.7	0	0	113.9	I12	I12-Q14 PolarHBondContact O-N 3.24Å; I12-Q14 VanDerWaalsContact O-N 3.11Å
15	Q	41.8	Very low	44.6	Very low	116 Å²	116	104.2 Å²	104.2	54%	0.542	52%	0.522	S	S	.	.	S	Bend	trans	-143.1	92.4	-177	-66.3	-168.3	-3.6	0	0	111.9	I11 I12 G17	I11-Q15 PolarHBondContact O-N 3.28Å; I12-Q15 CarbonylContact O-C 3.21Å; I12-Q15 PolarHBondContact O-N 2.85Å; Q15-G17 PolarHBondContact O-N 3.47Å
16	M	31.9	Very low	44.5	Very low	164 Å²	164	101.7 Å²	101.7	81%	0.808	54%	0.535	S	S	*	.			trans	-28.7	112.1	179	-60.9	-168.1	70.7	0	0	116
17	G	48.3	Very low	44.3	Very low	24 Å²	24	103.5 Å²	103.5	25%	0.247	54%	0.544	C	S	.	.			trans	173.5	155.1	167.1	0	0	0	0	0	112.9	I12 Q15 L35	I12-G17 WeakPolarHBondContact CG2-O 3.38Å; Q15-G17 PolarHBondContact O-N 3.47Å; G17-L35 VanDerWaalsContact CA-O 3.24Å; G17-L35 WeakPolarHBondContact CA-O 3.49Å
18	E	39.9	Very low	44.1	Very low	120 Å²	120	105.1 Å²	105.1	56%	0.561	55%	0.547	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.3	139.3	175.1	-167.6	176.9	174.3	0	0	110.2	V20 L35	E18-V20 PolarHBondContact O-N 3.04Å; E18-L35 PolarHBondContact N-O 2.89Å; E18-L35 PolarHBondContact O-N 2.98Å
19	I	44.7	Very low	44	Very low	66 Å²	66	107 Å²	107	34%	0.338	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.9	118.5	171.3	-60.4	170.2	0	0	0	108.2	I12 V32	I12-I19 HydrophobicContact CD1-CD1 3.5Å; I12-I19 VanDerWaalsContact CD1-CD1 3.5Å; I12-I19 HydrophobicContact CD1-CG1 3.56Å; I19-V32 HydrophobicContact CD1-CG1 4.2Å; I19-V32 HydrophobicContact CG1-CG1 4.09Å; I19-V32 HydrophobicContact CG2-CG1 3.98Å
20	V	40.7	Very low	43.7	Very low	83 Å²	83	102.5 Å²	102.5	50%	0.503	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-30.8	-179.1	-179	0	0	0	0	112.3	E18 T33 L35	E18-V20 PolarHBondContact O-N 3.04Å; V20-T33 PolarHBondContact N-O 2.78Å; V20-L35 HydrophobicContact CG2-CB 3.72Å; V20-L35 HydrophobicContact CG2-CD2 4.17Å
21	T	44.2	Very low	43.7	Very low	74 Å²	74	98.7 Å²	98.7	45%	0.454	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	137.1	173	49.6	0	0	0	0	112.4	T33	T21-T33 PolarHBondContact O-N 2.86Å; T21-T33 PolarHBondContact OG1-OG1 2.68Å; T21-T33 VanDerWaalsContact OG1-OG1 3.1Å
22	E	46.5	Very low	43.8	Very low	101 Å²	101	95.2 Å²	95.2	47%	0.472	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	136.3	152.3	176.1	177.6	140.6	0	0	108.7	Q24 Q30 I31	E22-Q24 WeakPolarHBondContact OE1-CG 3.44Å; E22-Q24 PolarHBondContact OE1-NE2 2.96Å; E22-Q30 HydrophobicContact CG-CG 3.87Å; E22-Q30 PolarHBondContact OE2-NE2 3.41Å; E22-I31 WeakPolarHBondContact CA-O 3.49Å
23	Q	42.6	Very low	43.8	Very low	135 Å²	135	93.5 Å²	93.5	63%	0.631	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.8	117	165.8	-165.1	170.3	18.8	0	0	111.1	I31	Q23-I31 PolarHBondContact N-O 3.19Å; Q23-I31 PolarHBondContact O-N 2.92Å
24	Q	47.6	Very low	43.8	Very low	138 Å²	138	86.7 Å²	86.7	65%	0.645	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	126	170.4	-62.5	179.5	12	0	0	109	E22	E22-Q24 WeakPolarHBondContact OE1-CG 3.44Å; E22-Q24 PolarHBondContact OE1-NE2 2.96Å
25	T	45.9	Very low	43.5	Very low	59 Å²	59	81.3 Å²	81.3	36%	0.362	44%	0.438	S	S	.	.			trans	-86	164.2	172.1	65.8	0	0	0	0	110	Q27 I29 I31	T25-Q27 PolarHBondContact O-N 3.06Å; T25-Q27 VanDerWaalsContact O-O 3.05Å; T25-Q27 PolarHBondContact OG1-O 2.97Å; T25-I29 PolarHBondContact N-O 3.1Å; T25-I29 PolarHBondContact OG1-O 2.93Å; T25-I31 HydrophobicContact CG2-CD1 4Å; T25-I31 HydrophobicContact CG2-CG1 4.34Å
26	G	44.3	Very low	43.6	Very low	93 Å²	93	77.4 Å²	77.4	96%	0.959	42%	0.42	S	S	*	.	S	Bend	trans	-70.3	20.5	172.9	0	0	0	0	0	114.7
27	Q	40.1	Very low	44.2	Very low	150 Å²	150	76.5 Å²	76.5	70%	0.701	41%	0.414	S	S	*	.	S	Bend	trans	-135.1	165.1	178.6	-62.9	-179.1	-2.5	0	0	107.2	T25 I29	T25-Q27 PolarHBondContact O-N 3.06Å; T25-Q27 VanDerWaalsContact O-O 3.05Å; T25-Q27 PolarHBondContact OG1-O 2.97Å; Q27-I29 PolarHBondContact O-N 3.06Å
28	K	42.4	Very low	44	Very low	127 Å²	127	82.2 Å²	82.2	55%	0.552	44%	0.439	S	S	*	.	S	Bend	trans	-69.8	38.9	-173.4	-79.5	-169.6	162.8	-126.2	0	115.4	H49 D50	K28-H49 HydrophobicContact CB-CB 4.04Å; K28-H49 HydrophobicContact CG-CB 4.41Å; K28-H49 WeakPolarHBondContact O-CB 3.36Å; K28-H49 PolarHBondContact O-N 3.37Å; K28-D50 IonicContact NZ-OD1 3.63Å; K28-D50 PolarHBondContact NZ-OD1 2.99Å; K28-D50 IonicContact NZ-OD2 3.57Å; K28-D50 PolarHBondContact NZ-OD2 3.08Å
29	I	41	Very low	44.1	Very low	72 Å²	72	80.2 Å²	80.2	37%	0.369	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	127	-174.2	-47.8	176.4	0	0	0	109.4	T25 Q27 L46	T25-I29 PolarHBondContact N-O 3.1Å; T25-I29 PolarHBondContact OG1-O 2.93Å; Q27-I29 PolarHBondContact O-N 3.06Å; I29-L46 HydrophobicContact CG2-CD2 4.37Å
30	Q	41.5	Very low	43.9	Very low	28 Å²	28	86.3 Å²	86.3	13%	0.131	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	135.3	176.1	179.4	-172.4	-1.7	0	0	108.4	E22 V32 T47	E22-Q30 HydrophobicContact CG-CG 3.87Å; E22-Q30 PolarHBondContact OE2-NE2 3.41Å; Q30-V32 HydrophobicContact CG-CG2 4.28Å; Q30-T47 PolarHBondContact N-O 2.97Å; Q30-T47 VanDerWaalsContact N-O 3.08Å; Q30-T47 PolarHBondContact O-N 2.9Å; Q30-T47 VanDerWaalsContact O-N 3.12Å
31	I	48.6	Very low	44.2	Very low	48 Å²	48	83.1 Å²	83.1	25%	0.246	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	118.2	178	-49	-177.3	0	0	0	107.9	E22 Q23 T25 F44 L46	E22-I31 WeakPolarHBondContact CA-O 3.49Å; Q23-I31 PolarHBondContact N-O 3.19Å; Q23-I31 PolarHBondContact O-N 2.92Å; T25-I31 HydrophobicContact CG2-CD1 4Å; T25-I31 HydrophobicContact CG2-CG1 4.34Å; I31-F44 HydrophobicContact CG2-CD1 4.22Å; I31-L46 HydrophobicContact CB-CD2 4.36Å; I31-L46 HydrophobicContact CD1-CD2 4.4Å; I31-L46 HydrophobicContact CG1-CD2 3.81Å; I31-L46 HydrophobicContact CG2-CD2 4.19Å
32	V	44.8	Very low	44.3	Very low	23 Å²	23	85.6 Å²	85.6	14%	0.139	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.7	177.7	-176.9	0	0	0	0	108.8	I19 Q30 F44 I45	I19-V32 HydrophobicContact CD1-CG1 4.2Å; I19-V32 HydrophobicContact CG1-CG1 4.09Å; I19-V32 HydrophobicContact CG2-CG1 3.98Å; Q30-V32 HydrophobicContact CG-CG2 4.28Å; V32-F44 WeakPolarHBondContact O-CA 3.48Å; V32-I45 PolarHBondContact N-O 3.3Å; V32-I45 PolarHBondContact O-N 3.1Å
33	T	45.8	Very low	44.3	Very low	12 Å²	12	83.5 Å²	83.5	7%	0.074	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	112.6	178.3	-48.4	0	0	0	0	110.2	V20 T21 F44	V20-T33 PolarHBondContact N-O 2.78Å; T21-T33 PolarHBondContact O-N 2.86Å; T21-T33 PolarHBondContact OG1-OG1 2.68Å; T21-T33 VanDerWaalsContact OG1-OG1 3.1Å; T33-F44 HydrophobicContact CG2-CD1 3.91Å; T33-F44 HydrophobicContact CG2-CE1 3.62Å; T33-F44 HydrophobicContact CG2-CZ 4.07Å; T33-F44 WeakPolarHBondContact OG1-CD1 3.4Å; T33-F44 WeakPolarHBondContact OG1-CE1 3.42Å
34	A	46.6	Very low	44.4	Very low	21 Å²	21	80.2 Å²	80.2	17%	0.174	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	131.9	174.5	0	0	0	0	0	110.4	Q43	A34-Q43 PolarHBondContact N-O 3.32Å; A34-Q43 PolarHBondContact O-N 3.46Å
35	L	44.1	Very low	44.5	Very low	54 Å²	54	75.8 Å²	75.8	28%	0.283	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	110.6	174.2	-165.5	72.8	0	0	0	109.4	G17 E18 V20 K42	G17-L35 VanDerWaalsContact CA-O 3.24Å; G17-L35 WeakPolarHBondContact CA-O 3.49Å; E18-L35 PolarHBondContact N-O 2.89Å; E18-L35 PolarHBondContact O-N 2.98Å; V20-L35 HydrophobicContact CG2-CB 3.72Å; V20-L35 HydrophobicContact CG2-CD2 4.17Å; L35-K42 HydrophobicContact CD1-CG 3.97Å
36	D	44.9	Very low	44.5	Very low	33 Å²	33	76.4 Å²	76.4	18%	0.176	41%	0.405	C	S	.	.			trans	-79.3	131.2	166.7	168.5	25	0	0	0	108.7	N38 T39	D36-N38 VanDerWaalsContact C-N 3.33Å; D36-N38 WeakPolarHBondContact OD1-CB 3.48Å; D36-N38 PolarHBondContact OD1-N 2.96Å; D36-T39 WeakPolarHBondContact OD2-CB 3.36Å; D36-T39 WeakPolarHBondContact OD2-CG2 3.49Å; D36-T39 PolarHBondContact OD2-N 2.98Å; D36-T39 PolarHBondContact OD2-OG1 2.88Å
37	H	44.7	Very low	44.5	Very low	146 Å²	146	73.6 Å²	73.6	68%	0.676	37%	0.369	S	S	*	.	S	Bend	trans	-79.2	-14	178.6	-79	-80	0	0	0	113.8
38	N	42.2	Very low	44.6	Very low	144 Å²	144	69.9 Å²	69.9	77%	0.77	35%	0.354	S	S	*	.	S	Bend	trans	-100.4	-4.7	-173.9	-151.8	17.4	0	0	0	113.6	D36	D36-N38 VanDerWaalsContact C-N 3.33Å; D36-N38 WeakPolarHBondContact OD1-CB 3.48Å; D36-N38 PolarHBondContact OD1-N 2.96Å
39	T	42.3	Very low	44.6	Very low	77 Å²	77	69.2 Å²	69.2	47%	0.472	35%	0.353	S	S	.	.	S	Bend	trans	-135.5	145.7	173.6	61.2	0	0	0	0	111.2	D36 G41	D36-T39 WeakPolarHBondContact OD2-CB 3.36Å; D36-T39 WeakPolarHBondContact OD2-CG2 3.49Å; D36-T39 PolarHBondContact OD2-N 2.98Å; D36-T39 PolarHBondContact OD2-OG1 2.88Å; T39-G41 PolarHBondContact O-N 3.39Å
40	Q	41.8	Very low	44.6	Very low	195 Å²	195	70.4 Å²	70.4	91%	0.911	36%	0.36	S	S	*	.	S	Bend	trans	-76.6	21	-179.4	-65.5	-171.8	-11.6	0	0	113.7
41	G	46.7	Very low	44.9	Very low	16 Å²	16	72.1 Å²	72.1	17%	0.165	39%	0.385	C	S	.	.			trans	-110.7	128.1	-175.5	0	0	0	0	0	113	T39	T39-G41 PolarHBondContact O-N 3.39Å
42	K	45.4	Very low	44.7	Very low	125 Å²	125	73.3 Å²	73.3	54%	0.543	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	125.9	169	-62.6	-170.4	176.4	-168.1	0	110	L35 F44	L35-K42 HydrophobicContact CD1-CG 3.97Å; K42-F44 HydrophobicContact CB-CE2 3.8Å; K42-F44 HydrophobicContact CB-CZ 4.16Å
43	Q	46.5	Very low	44.5	Very low	58 Å²	58	77.1 Å²	77.1	27%	0.271	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	144	173.4	-61	-170.4	26.6	0	0	110.2	A34	A34-Q43 PolarHBondContact N-O 3.32Å; A34-Q43 PolarHBondContact O-N 3.46Å
44	F	46.3	Very low	44.4	Very low	66 Å²	66	80.9 Å²	80.9	29%	0.289	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	118	-179.2	-62	-96.5	0	0	0	109.2	I31 V32 T33 K42 L59	I31-F44 HydrophobicContact CG2-CD1 4.22Å; V32-F44 WeakPolarHBondContact O-CA 3.48Å; T33-F44 HydrophobicContact CG2-CD1 3.91Å; T33-F44 HydrophobicContact CG2-CE1 3.62Å; T33-F44 HydrophobicContact CG2-CZ 4.07Å; T33-F44 WeakPolarHBondContact OG1-CD1 3.4Å; T33-F44 WeakPolarHBondContact OG1-CE1 3.42Å; K42-F44 HydrophobicContact CB-CE2 3.8Å; K42-F44 HydrophobicContact CB-CZ 4.16Å; F44-L59 HydrophobicContact CB-CD1 3.79Å; F44-L59 HydrophobicContact CB-CG 4.12Å; F44-L59 HydrophobicContact CD2-CB 4.18Å; F44-L59 HydrophobicContact CD2-CD1 3.87Å; F44-L59 HydrophobicContact CD2-CG 4.41Å; F44-L59 HydrophobicContact CG-CD1 4.08Å
45	I	48.4	Very low	44.1	Very low	45 Å²	45	83.2 Å²	83.2	23%	0.231	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	133.8	177.9	-57.6	173.7	0	0	0	107.8	V32 T47	V32-I45 PolarHBondContact N-O 3.3Å; V32-I45 PolarHBondContact O-N 3.1Å; I45-T47 HydrophobicContact CG2-CG2 4.34Å
46	L	45.8	Very low	44	Very low	72 Å²	72	83.4 Å²	83.4	38%	0.377	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	120.4	175.5	-63.3	177	0	0	0	109	I29 I31	I29-L46 HydrophobicContact CG2-CD2 4.37Å; I31-L46 HydrophobicContact CB-CD2 4.36Å; I31-L46 HydrophobicContact CD1-CD2 4.4Å; I31-L46 HydrophobicContact CG1-CD2 3.81Å; I31-L46 HydrophobicContact CG2-CD2 4.19Å
47	T	45.3	Very low	43.8	Very low	33 Å²	33	82.8 Å²	82.8	20%	0.202	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	141.8	175.7	46.5	0	0	0	0	111.1	Q30 I45	Q30-T47 PolarHBondContact N-O 2.97Å; Q30-T47 VanDerWaalsContact N-O 3.08Å; Q30-T47 PolarHBondContact O-N 2.9Å; Q30-T47 VanDerWaalsContact O-N 3.12Å; I45-T47 HydrophobicContact CG2-CG2 4.34Å
48	N	42.4	Very low	43.6	Very low	73 Å²	73	78.4 Å²	78.4	39%	0.39	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	134.2	164.5	-70.4	-38	0	0	0	108.6	D50 G51 S52	N48-D50 PolarHBondContact O-N 3.07Å; N48-D50 VanDerWaalsContact O-N 3.07Å; N48-G51 PolarHBondContact O-N 2.96Å; N48-S52 PolarHBondContact ND2-O 3.12Å
49	H	40.8	Very low	43.5	Very low	113 Å²	113	73.2 Å²	73.2	52%	0.523	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-32.1	175.3	173.1	-79.6	0	0	0	113.2	K28 G51	K28-H49 HydrophobicContact CB-CB 4.04Å; K28-H49 HydrophobicContact CG-CB 4.41Å; K28-H49 WeakPolarHBondContact O-CB 3.36Å; K28-H49 PolarHBondContact O-N 3.37Å; H49-G51 VanDerWaalsContact C-N 3.32Å; H49-G51 PolarHBondContact O-N 3.04Å
50	D	42.5	Very low	43.4	Very low	96 Å²	96	72 Å²	72	51%	0.513	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	12.6	-175.2	-50.6	-28.6	0	0	0	113.1	K28 N48 S52	K28-D50 IonicContact NZ-OD1 3.63Å; K28-D50 PolarHBondContact NZ-OD1 2.99Å; K28-D50 IonicContact NZ-OD2 3.57Å; K28-D50 PolarHBondContact NZ-OD2 3.08Å; N48-D50 PolarHBondContact O-N 3.07Å; N48-D50 VanDerWaalsContact O-N 3.07Å; D50-S52 PolarHBondContact O-N 2.85Å
51	G	48.1	Very low	43.3	Very low	64 Å²	64	71.3 Å²	71.3	66%	0.66	40%	0.397	S	S	*	.			trans	72	-12.4	170.1	0	0	0	0	0	117.1	N48 H49 T53	N48-G51 PolarHBondContact O-N 2.96Å; H49-G51 VanDerWaalsContact C-N 3.32Å; H49-G51 PolarHBondContact O-N 3.04Å; G51-T53 PolarHBondContact O-N 3.12Å
52	S	43	Very low	42.8	Very low	74 Å²	74	77.5 Å²	77.5	52%	0.517	42%	0.421	S	S	.	.			trans	-72	121	179	51.3	0	0	0	0	112.2	N48 D50	N48-S52 PolarHBondContact ND2-O 3.12Å; D50-S52 PolarHBondContact O-N 2.85Å
53	T	41.7	Very low	42.5	Very low	102 Å²	102	76 Å²	76	63%	0.626	42%	0.419	S	S	*	.			trans	54.5	104.3	179	53	0	0	0	0	115.4	G51 S55	G51-T53 PolarHBondContact O-N 3.12Å; T53-S55 PolarHBondContact O-N 3.38Å
54	P	43.1	Very low	42.2	Very low	92 Å²	92	78.2 Å²	78.2	60%	0.597	44%	0.441	S	S	*	.			trans	-75.1	94.5	171.6	30.8	-33.1	0	0	0	110.3	K56	P54-K56 VanDerWaalsContact C-N 3.28Å; P54-K56 PolarHBondContact O-N 2.85Å
55	S	40.7	Very low	41.7	Very low	69 Å²	69	78.8 Å²	78.8	48%	0.483	45%	0.45	S	S	.	.			trans	-66	85.8	170	-67.4	0	0	0	0	110.2	T53 V57	T53-S55 PolarHBondContact O-N 3.38Å; S55-V57 PolarHBondContact O-N 2.63Å
56	K	40.8	Very low	41.1	Very low	59 Å²	59	83 Å²	83	26%	0.257	48%	0.481	S	S	.	.			trans	-61.9	107.8	178.3	-170.1	175.7	-173.6	179.4	0	109.4	P54 I58 P74	P54-K56 VanDerWaalsContact C-N 3.28Å; P54-K56 PolarHBondContact O-N 2.85Å; K56-I58 HydrophobicContact CG-CG1 4.26Å; K56-P74 HydrophobicContact CB-CG 4.12Å
57	V	40.8	Very low	40.8	Very low	19 Å²	19	81.5 Å²	81.5	12%	0.115	48%	0.482	C	S	.	.			trans	-100.9	129	173.4	166.7	0	0	0	0	107.7	S55 L59 L71	S55-V57 PolarHBondContact O-N 2.63Å; V57-L59 HydrophobicContact CG1-CD2 3.39Å; V57-L59 HydrophobicContact CG1-CG 4.06Å; V57-L71 HydrophobicContact CG1-CB 4.45Å; V57-L71 HydrophobicContact CG1-CD2 3.64Å
58	I	41.1	Very low	40.3	Very low	55 Å²	55	85.2 Å²	85.2	28%	0.282	50%	0.495	S	S	.	.			trans	-112	90.2	-178.7	-52.4	-179.7	0	0	0	109.5	K56 A60 F70	K56-I58 HydrophobicContact CG-CG1 4.26Å; I58-A60 PolarHBondContact O-N 3.18Å; I58-F70 VanDerWaalsContact O-O 3.08Å
59	L	41.1	Very low	40.1	Very low	34 Å²	34	83.1 Å²	83.1	18%	0.178	49%	0.485	C	S	.	.			trans	-73.1	71.7	177	-56.3	-163.8	0	0	0	112	F44 V57 R61 V69 L71	F44-L59 HydrophobicContact CB-CD1 3.79Å; F44-L59 HydrophobicContact CB-CG 4.12Å; F44-L59 HydrophobicContact CD2-CB 4.18Å; F44-L59 HydrophobicContact CD2-CD1 3.87Å; F44-L59 HydrophobicContact CD2-CG 4.41Å; F44-L59 HydrophobicContact CG-CD1 4.08Å; V57-L59 HydrophobicContact CG1-CD2 3.39Å; V57-L59 HydrophobicContact CG1-CG 4.06Å; L59-R61 PolarHBondContact O-N 2.73Å; L59-R61 VanDerWaalsContact O-N 3.12Å; L59-V69 HydrophobicContact CB-CG1 3.94Å; L59-V69 HydrophobicContact CD1-CG1 4.49Å; L59-V69 HydrophobicContact CD2-CG1 3.75Å; L59-V69 HydrophobicContact CG-CG1 4.26Å; L59-L71 HydrophobicContact CD2-CD2 3.32Å
60	A	39.1	Very low	39.9	Very low	51 Å²	51	80.7 Å²	80.7	42%	0.421	47%	0.473	S	S	.	.			trans	-71.9	103.3	176.2	0	0	0	0	0	111.4	I58 Q62	I58-A60 PolarHBondContact O-N 3.18Å; A60-Q62 PolarHBondContact O-N 2.95Å
61	R	39.8	Very low	39.7	Very low	182 Å²	182	77.6 Å²	77.6	69%	0.687	46%	0.457	S	S	*	.			trans	-78.2	105	164.5	179.4	-173.9	175.6	122.1	-1.2	108.9	L59 D63	L59-R61 PolarHBondContact O-N 2.73Å; L59-R61 VanDerWaalsContact O-N 3.12Å; R61-D63 IonicContact CZ-OD1 3.92Å; R61-D63 IonicContact NE-OD1 3.1Å; R61-D63 PolarHBondContact NE-OD1 3.48Å; R61-D63 VanDerWaalsContact NE-OD1 3.1Å; R61-D63 IonicContact NH2-OD1 2.69Å
62	Q	36.8	Very low	39.2	Very low	146 Å²	146	77 Å²	77	68%	0.682	44%	0.441	S	S	*	.			trans	-87.8	115.1	171.3	-169.3	176.6	38.9	0	0	109.7	A60 S64	A60-Q62 PolarHBondContact O-N 2.95Å; Q62-S64 PolarHBondContact O-N 3.4Å
63	D	39.2	Very low	39	Very low	93 Å²	93	76.1 Å²	76.1	50%	0.497	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	113.1	-177.6	-73.3	-53.4	0	0	0	112.1	R61	R61-D63 IonicContact CZ-OD1 3.92Å; R61-D63 IonicContact NE-OD1 3.1Å; R61-D63 PolarHBondContact NE-OD1 3.48Å; R61-D63 VanDerWaalsContact NE-OD1 3.1Å; R61-D63 IonicContact NH2-OD1 2.69Å
64	S	40	Very low	38.7	Very low	105 Å²	105	76.1 Å²	76.1	73%	0.734	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	166.2	-21.9	159	42.4	0	0	0	0	111.7	Q62	Q62-S64 PolarHBondContact O-N 3.4Å
65	T	34.7	Very low	38.6	Very low	78 Å²	78	77.4 Å²	77.4	48%	0.479	44%	0.436	S	S	.	.	S	Bend	trans	-123.3	128.3	178	65.3	0	0	0	0	112.5
66	P	36.7	Very low	38.6	Very low	134 Å²	134	78.9 Å²	78.9	87%	0.87	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	133.2	177.8	29.4	-33.3	0	0	0	111.6
67	G	39.8	Very low	38.5	Very low	40 Å²	40	80.5 Å²	80.5	41%	0.412	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.3	-12.7	162.9	0	0	0	0	0	117.4	F83	G67-F83 WeakPolarHBondContact O-CD1 3.16Å
68	K	34.6	Very low	38.4	Very low	110 Å²	110	81 Å²	81	48%	0.478	49%	0.486	S	S	.	.			trans	-84.7	126.4	176.8	-72.5	-178.2	177.9	-179.7	0	111.6	F70 F83	K68-F70 HydrophobicContact CB-CE2 4.35Å; K68-F83 HydrophobicContact CG-CE1 3.72Å; K68-F83 HydrophobicContact CG-CZ 3.98Å
69	V	38.6	Very low	38.2	Very low	30 Å²	30	82.7 Å²	82.7	18%	0.182	50%	0.498	C	S	.	.			trans	-134.9	132.9	169	-169.2	0	0	0	0	108.2	L59	L59-V69 HydrophobicContact CB-CG1 3.94Å; L59-V69 HydrophobicContact CD1-CG1 4.49Å; L59-V69 HydrophobicContact CD2-CG1 3.75Å; L59-V69 HydrophobicContact CG-CG1 4.26Å
70	F	36.7	Very low	38.1	Very low	62 Å²	62	85.5 Å²	85.5	27%	0.272	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	144.8	-178.6	-60.2	-94.6	0	0	0	109.9	I58 K68 V79 Q81	I58-F70 VanDerWaalsContact O-O 3.08Å; K68-F70 HydrophobicContact CB-CE2 4.35Å; F70-V79 HydrophobicContact CD1-CG1 4.38Å; F70-Q81 HydrophobicContact CD1-CG 3.83Å; F70-Q81 HydrophobicContact CE1-CG 4.25Å
71	L	38.2	Very low	37.9	Very low	30 Å²	30	86.3 Å²	86.3	16%	0.157	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	116.5	163.3	-36.6	173.3	0	0	0	107.4	V57 L59 N80 L82	V57-L71 HydrophobicContact CG1-CB 4.45Å; V57-L71 HydrophobicContact CG1-CD2 3.64Å; L59-L71 HydrophobicContact CD2-CD2 3.32Å; L71-N80 WeakPolarHBondContact CA-O 3.3Å; L71-N80 WeakPolarHBondContact CB-O 3.09Å; L71-N80 HydrophobicContact CD1-CB 4.41Å; L71-N80 WeakPolarHBondContact CG-O 3.41Å; L71-N80 PolarHBondContact N-O 3.42Å; L71-N80 PolarHBondContact O-N 3.03Å; L71-L82 HydrophobicContact CD1-CB 4.24Å; L71-L82 HydrophobicContact CD1-CD1 3.84Å; L71-L82 HydrophobicContact CD1-CG 3.78Å
72	T	36.5	Very low	37.7	Very low	53 Å²	53	81.1 Å²	81.1	33%	0.325	49%	0.494	S	S	.	.			trans	-110.6	130	168.4	46.6	0	0	0	0	108.1	V79	T72-V79 HydrophobicContact CG2-CG1 4.39Å; T72-V79 HydrophobicContact CG2-CG2 4.26Å
73	T	39.4	Very low	37.5	Very low	55 Å²	55	77.1 Å²	77.1	34%	0.337	47%	0.474	S	S	.	.			trans	-89.8	160	165.4	69	0	0	0	0	109.7	D75	T73-D75 WeakPolarHBondContact CB-OD1 3.18Å; T73-D75 PolarHBondContact O-N 2.8Å; T73-D75 VanDerWaalsContact O-N 3.17Å; T73-D75 PolarHBondContact OG1-OD1 3.09Å
74	P	36.1	Very low	37.1	Very low	101 Å²	101	79.4 Å²	79.4	66%	0.656	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-23.9	-178.9	-24	35.2	0	0	0	114.4	K56 A76	K56-P74 HydrophobicContact CB-CG 4.12Å; P74-A76 PolarHBondContact O-N 2.88Å
75	D	40	Very low	36.5	Very low	120 Å²	120	79.5 Å²	79.5	64%	0.642	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-9	-168.9	-34.5	72.9	0	0	0	114.2	T73 A77	T73-D75 WeakPolarHBondContact CB-OD1 3.18Å; T73-D75 PolarHBondContact O-N 2.8Å; T73-D75 VanDerWaalsContact O-N 3.17Å; T73-D75 PolarHBondContact OG1-OD1 3.09Å; D75-A77 HydrophobicContact CB-CB 4.23Å; D75-A77 PolarHBondContact O-N 2.85Å
76	A	40.2	Very low	36.5	Very low	99 Å²	99	81.3 Å²	81.3	82%	0.818	49%	0.487	S	S	*	.	S	Bend	trans	56.2	4.3	-170.6	0	0	0	0	0	116.1	P74 G78	P74-A76 PolarHBondContact O-N 2.88Å; A76-G78 PolarHBondContact O-N 3.4Å
77	A	39.3	Very low	36.3	Very low	93 Å²	93	81.4 Å²	81.4	77%	0.769	49%	0.488	S	S	*	.	S	Bend	trans	-85.2	-0.7	-170.7	0	0	0	0	0	115.7	D75	D75-A77 HydrophobicContact CB-CB 4.23Å; D75-A77 PolarHBondContact O-N 2.85Å
78	G	38.3	Very low	36	Very low	31 Å²	31	85.1 Å²	85.1	32%	0.32	50%	0.499	S	S	.	.			trans	178.5	116	175.4	0	0	0	0	0	115.3	A76 N80	A76-G78 PolarHBondContact O-N 3.4Å; G78-N80 PolarHBondContact O-N 3.03Å; G78-N80 PolarHBondContact O-ND2 2.84Å
79	V	36.6	Very low	36.3	Very low	90 Å²	90	86.3 Å²	86.3	55%	0.545	51%	0.509	S	S	.	.			trans	-87.1	96	174	-175.6	0	0	0	0	109.6	F70 T72	F70-V79 HydrophobicContact CD1-CG1 4.38Å; T72-V79 HydrophobicContact CG2-CG1 4.39Å; T72-V79 HydrophobicContact CG2-CG2 4.26Å
80	N	40.2	Very low	36.4	Very low	92 Å²	92	88.2 Å²	88.2	49%	0.492	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	119.1	175.8	-73.1	-86.8	0	0	0	109.1	L71 G78	L71-N80 WeakPolarHBondContact CA-O 3.3Å; L71-N80 WeakPolarHBondContact CB-O 3.09Å; L71-N80 HydrophobicContact CD1-CB 4.41Å; L71-N80 WeakPolarHBondContact CG-O 3.41Å; L71-N80 PolarHBondContact N-O 3.42Å; L71-N80 PolarHBondContact O-N 3.03Å; G78-N80 PolarHBondContact O-N 3.03Å; G78-N80 PolarHBondContact O-ND2 2.84Å
81	Q	35.4	Very low	36.7	Very low	69 Å²	69	89.3 Å²	89.3	32%	0.322	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	125.3	174.7	-69	177.5	36.4	0	0	110	F70 F83	F70-Q81 HydrophobicContact CD1-CG 3.83Å; F70-Q81 HydrophobicContact CE1-CG 4.25Å; Q81-F83 HydrophobicContact CB-CE2 4.14Å
82	L	35.2	Very low	37	Very low	72 Å²	72	91 Å²	91	38%	0.377	55%	0.552	S	S	.	*			trans	-114.5	118.5	169.4	-73.2	-173.2	0	0	0	110	L71 F84	L71-L82 HydrophobicContact CD1-CB 4.24Å; L71-L82 HydrophobicContact CD1-CD1 3.84Å; L71-L82 HydrophobicContact CD1-CG 3.78Å; L82-F84 HydrophobicContact CB-CE2 4.35Å
83	F	31.5	Very low	37.1	Very low	63 Å²	63	93.5 Å²	93.5	28%	0.276	56%	0.56	S	S	.	*			trans	-86.9	108.5	176.4	-74.6	-103	0	0	0	109.8	G67 K68 Q81	G67-F83 WeakPolarHBondContact O-CD1 3.16Å; K68-F83 HydrophobicContact CG-CE1 3.72Å; K68-F83 HydrophobicContact CG-CZ 3.98Å; Q81-F83 HydrophobicContact CB-CE2 4.14Å
84	F	31.4	Very low	37.3	Very low	141 Å²	141	95 Å²	95	62%	0.618	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-83	126.4	172.3	-75.8	-83.1	0	0	0	110.9	L82 T86	L82-F84 HydrophobicContact CB-CE2 4.35Å; F84-T86 PolarHBondContact O-N 3Å
85	T	28.2	Very low	37.4	Very low	107 Å²	107	91.5 Å²	91.5	66%	0.656	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-78.9	117.8	-176.7	50.9	0	0	0	0	112.2
86	T	33.3	Very low	37.4	Very low	115 Å²	115	89.8 Å²	89.8	71%	0.706	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-66.4	157.9	152.4	42	0	0	0	0	110.2	F84 D88	F84-T86 PolarHBondContact O-N 3Å; T86-D88 PolarHBondContact O-N 3.26Å
87	P	34.1	Very low	37.3	Very low	136 Å²	136	89.6 Å²	89.6	88%	0.883	52%	0.515	S	S	*	.	S	Bend	trans	-80.7	28.9	-163.7	33.6	-38.5	0	0	0	115.6
88	D	32.1	Very low	37.1	Very low	119 Å²	119	90.7 Å²	90.7	64%	0.636	51%	0.512	S	S	*	.			trans	-98.1	134.2	173.8	-171	17.8	0	0	0	111.6	T86 S90	T86-D88 PolarHBondContact O-N 3.26Å; D88-S90 PolarHBondContact O-N 3.36Å; D88-S90 PolarHBondContact OD2-OG 3.39Å
89	L	42.1	Very low	36.8	Very low	134 Å²	134	93.9 Å²	93.9	70%	0.702	52%	0.522	S	S	*	.	S	Bend	trans	-93.2	10.9	-158.6	-78.9	160.5	0	0	0	114.3
90	S	40.2	Very low	36.7	Very low	70 Å²	70	97.7 Å²	97.7	49%	0.49	54%	0.539	S	S	.	.	S	Bend	trans	-91.7	-38	-164.2	56.9	0	0	0	0	115.2	D88 R123	D88-S90 PolarHBondContact O-N 3.36Å; D88-S90 PolarHBondContact OD2-OG 3.39Å; S90-R123 PolarHBondContact O-NH2 3Å
91	A	43.8	Very low	36.2	Very low	86 Å²	86	97.6 Å²	97.6	71%	0.711	55%	0.546	S	S	*	.			trans	-140.3	73.5	-168.5	0	0	0	0	0	114.4	H93	A91-H93 PolarHBondContact O-N 3.35Å
92	Q	43.5	Very low	36.4	Very low	65 Å²	65	101 Å²	101	30%	0.304	57%	0.574	S	S	.	*			trans	-83.8	92	172.5	-68.6	179	-5	0	0	111.4
93	H	39.5	Very low	36.5	Very low	106 Å²	106	104.3 Å²	104.3	49%	0.491	59%	0.592	S	S	.	*			trans	-104.2	95.2	170.5	-163.8	102.7	0	0	0	110.1	A91 Q95 D111	A91-H93 PolarHBondContact O-N 3.35Å; H93-Q95 PolarHBondContact NE2-OE1 3.44Å; H93-Q95 PolarHBondContact O-N 3.07Å; H93-D111 IonicContact CE1-OD1 2.69Å; H93-D111 PolarHBondContact CE1-OD1 3.17Å; H93-D111 VanDerWaalsContact CE1-OD1 3.31Å; H93-D111 IonicContact NE2-OD1 2.7Å
94	L	43.2	Very low	37	Very low	86 Å²	86	110 Å²	110	45%	0.45	62%	0.619	S	S	.	*			trans	-93.6	93.1	175.5	-95.2	166.3	0	0	0	110.1
95	Q	38.3	Very low	37.4	Very low	27 Å²	27	106.3 Å²	106.3	13%	0.126	62%	0.622	C	S	.	*			trans	-87.5	111.9	176.9	-164.9	59.2	62.9	0	0	111.5	H93 L97 V109	H93-Q95 PolarHBondContact NE2-OE1 3.44Å; H93-Q95 PolarHBondContact O-N 3.07Å; Q95-L97 HydrophobicContact CG-CD1 3.89Å; Q95-V109 HydrophobicContact CG-CG2 4.34Å
96	L	39.5	Very low	38.1	Very low	84 Å²	84	106.8 Å²	106.8	44%	0.44	63%	0.626	S	S	.	*	B	Isolated β-bridge	trans	-93.6	132.4	158.1	-63.7	177.2	0	0	0	108.8	L112	L96-L112 HydrophobicContact CD1-CD1 4Å
97	L	38.3	Very low	38.7	Very low	95 Å²	95	105.7 Å²	105.7	50%	0.497	62%	0.616	S	S	.	*			trans	-101.9	147.3	153.5	-72	88.4	0	0	0	106.7	Q95	Q95-L97 HydrophobicContact CG-CD1 3.89Å
98	T	35.5	Very low	39.5	Very low	117 Å²	117	106.9 Å²	106.9	72%	0.718	61%	0.608	S	S	*	*			trans	-146.3	83.3	178.2	-51.9	0	0	0	0	108.3
99	D	31.3	Very low	40.9	Very low	98 Å²	98	105.1 Å²	105.1	52%	0.524	60%	0.601	S	S	.	*			trans	-72.8	127	167.1	-82.7	-62	0	0	0	109.8	N107	D99-N107 PolarHBondContact OD1-ND2 3.43Å; D99-N107 PolarHBondContact OD2-ND2 3.38Å
100	N	34.5	Very low	42.5	Very low	169 Å²	169	103.4 Å²	103.4	90%	0.904	59%	0.588	S	S	*	*			trans	-177.3	65.5	151.3	-100.2	-45.8	0	0	0	111.7
101	S	30.3	Very low	44.6	Very low	91 Å²	91	102.5 Å²	102.5	64%	0.636	58%	0.578	S	S	*	*			trans	-165.2	129.5	150.9	-173.5	0	0	0	0	109.1	D103	S101-D103 VanDerWaalsContact C-N 3.26Å; S101-D103 PolarHBondContact O-N 2.91Å; S101-D103 VanDerWaalsContact O-N 3.11Å
102	P	38.2	Very low	46.9	Very low	140 Å²	140	101.5 Å²	101.5	91%	0.909	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	11.3	-166.3	31.5	-36.9	0	0	0	116.1
103	D	38.8	Very low	49.4	Very low	141 Å²	141	98.5 Å²	98.5	75%	0.754	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.8	36.7	-165.9	-163.3	31.6	0	0	0	116.3	S101	S101-D103 VanDerWaalsContact C-N 3.26Å; S101-D103 PolarHBondContact O-N 2.91Å; S101-D103 VanDerWaalsContact O-N 3.11Å
104	Q	40	Very low	52	Low	182 Å²	182	94.7 Å²	94.7	85%	0.85	53%	0.531	S	S	*	.	S	Bend	trans	-141.2	64.5	172.7	-72.7	-159.9	12.2	0	0	116.4
105	G	41.2	Very low	54.6	Low	65 Å²	65	90.6 Å²	90.6	67%	0.67	51%	0.509	S	S	*	.			trans	65.6	-163.9	155.5	0	0	0	0	0	116.8	N107	G105-N107 PolarHBondContact O-N 2.86Å
106	P	43.4	Very low	57.3	Low	116 Å²	116	89.7 Å²	89.7	75%	0.753	51%	0.505	S	S	*	.	S	Bend	trans	-73.5	118.6	-176.5	28.3	-33.3	0	0	0	111.5	K108	P106-K108 PolarHBondContact O-N 3.26Å
107	N	45.3	Very low	59.8	Low	93 Å²	93	88 Å²	88	50%	0.497	51%	0.509	S	S	.	.			trans	-46.3	108.2	-178.4	-97.4	-44.5	0	0	0	113.4	D99 G105 V109	D99-N107 PolarHBondContact OD1-ND2 3.43Å; D99-N107 PolarHBondContact OD2-ND2 3.38Å; G105-N107 PolarHBondContact O-N 2.86Å; N107-V109 PolarHBondContact O-N 3.45Å
108	K	51.3	Low	62.5	Low	160 Å²	160	84.7 Å²	84.7	70%	0.696	49%	0.492	S	S	*	.			trans	-81.6	90.6	179.7	-73.8	-176	177.9	170.1	0	111.4	P106 F110	P106-K108 PolarHBondContact O-N 3.26Å; K108-F110 HydrophobicContact CB-CE1 3.82Å; K108-F110 HydrophobicContact CB-CE2 3.84Å; K108-F110 HydrophobicContact CB-CZ 3.38Å; K108-F110 HydrophobicContact CD-CE1 4.45Å; K108-F110 HydrophobicContact CD-CZ 4.09Å; K108-F110 HydrophobicContact CG-CZ 4.34Å; K108-F110 WeakPolarHBondContact O-CD2 3.37Å; K108-F110 WeakPolarHBondContact O-CE2 3.31Å; K108-F110 WeakPolarHBondContact O-CG 3.47Å; K108-F110 PolarHBondContact O-N 2.93Å
109	V	61.5	Low	65.3	Low	82 Å²	82	84.2 Å²	84.2	50%	0.497	48%	0.479	S	S	.	.			trans	-34	124.8	151.3	151.7	0	0	0	0	111.3	Q95 N107	Q95-V109 HydrophobicContact CG-CG2 4.34Å; N107-V109 PolarHBondContact O-N 3.45Å
110	F	74.1	Confident	68.4	Low	99 Å²	99	80.3 Å²	80.3	43%	0.434	46%	0.461	S	S	.	.	B	Isolated β-bridge	trans	-135.7	137.7	172.9	-61.2	-55.7	0	0	0	111.1	K108 K119	K108-F110 HydrophobicContact CB-CE1 3.82Å; K108-F110 HydrophobicContact CB-CE2 3.84Å; K108-F110 HydrophobicContact CB-CZ 3.38Å; K108-F110 HydrophobicContact CD-CE1 4.45Å; K108-F110 HydrophobicContact CD-CZ 4.09Å; K108-F110 HydrophobicContact CG-CZ 4.34Å; K108-F110 WeakPolarHBondContact O-CD2 3.37Å; K108-F110 WeakPolarHBondContact O-CE2 3.31Å; K108-F110 WeakPolarHBondContact O-CG 3.47Å; K108-F110 PolarHBondContact O-N 2.93Å; F110-K119 VanDerWaalsContact CD1-NZ 3.3Å; F110-K119 VanDerWaalsContact CD2-NZ 3.33Å; F110-K119 HydrophobicContact CG-CD 4.42Å; F110-K119 VanDerWaalsContact CG-CE 3.44Å
111	D	85.8	Confident	71.3	Confident	50 Å²	50	75 Å²	75	27%	0.267	44%	0.437	S	S	.	.			trans	-77.1	153.3	173.8	-60.6	-37.7	0	0	0	112.4	H93 A120 V128	H93-D111 IonicContact CE1-OD1 2.69Å; H93-D111 PolarHBondContact CE1-OD1 3.17Å; H93-D111 VanDerWaalsContact CE1-OD1 3.31Å; H93-D111 IonicContact NE2-OD1 2.7Å; D111-A120 HydrophobicContact CB-CB 3.94Å; D111-A120 WeakPolarHBondContact O-CB 3.3Å; D111-A120 PolarHBondContact O-N 3.26Å; D111-V128 HydrophobicContact CB-CG1 3.72Å
112	L	92.3	Very high	74.2	Confident	65 Å²	65	71.9 Å²	71.9	34%	0.34	42%	0.419	S	S	.	.	B	Isolated β-bridge	trans	-103.8	145	173.5	-62	-175.6	0	0	0	112.7	L96 V114	L96-L112 HydrophobicContact CD1-CD1 4Å; L112-V114 PolarHBondContact O-N 3.22Å
113	C	95.8	Very high	77	Confident	2 Å²	2	73 Å²	73	1%	0.014	41%	0.405	C	S	.	.			trans	-73.3	108.9	177.3	176.6	0	0	0	0	111	V115 C116 G117 D118 C130	C113-V115 PolarHBondContact O-N 2.74Å; C113-C116 PolarHBondContact O-N 3.5Å; C113-G117 PolarHBondContact O-N 3.15Å; C113-D118 WeakPolarHBondContact CB-O 3.45Å; C113-D118 PolarHBondContact N-O 3.25Å; C113-C130 HydrophobicContact CB-CB 3.94Å; C113-C130 PolarHBondContact SG-N 3.33Å
114	V	94.4	Very high	79.8	Confident	27 Å²	27	67.7 Å²	67.7	16%	0.164	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-26.5	-176.9	-58.5	0	0	0	0	114	L112 A127 V128 T129 F176	L112-V114 PolarHBondContact O-N 3.22Å; V114-A127 HydrophobicContact CG2-CB 4.25Å; V114-V128 PolarHBondContact N-O 3.45Å; V114-V128 VanDerWaalsContact N-O 3.15Å; V114-T129 HydrophobicContact CG2-CG2 4.28Å; V114-F176 HydrophobicContact CB-CB 4.33Å; V114-F176 HydrophobicContact CB-CD1 4.03Å; V114-F176 HydrophobicContact CB-CG 4.36Å; V114-F176 HydrophobicContact CG2-CB 3.67Å; V114-F176 HydrophobicContact CG2-CD1 4.29Å; V114-F176 HydrophobicContact CG2-CG 4.22Å
115	V	96.5	Very high	82.5	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-29.8	178.7	-179.5	0	0	0	0	113.1	C113 T129 C133 I157 R169 R172 M178	C113-V115 PolarHBondContact O-N 2.74Å; V115-T129 HydrophobicContact CG2-CG2 3.92Å; V115-C133 HydrophobicContact CB-CB 4.39Å; V115-C133 HydrophobicContact CG1-CB 4.45Å; V115-I157 HydrophobicContact CG1-CG2 4.37Å; V115-I157 VanDerWaalsContact O-CG2 3.23Å; V115-I157 WeakPolarHBondContact O-CG2 3.22Å; V115-R169 HydrophobicContact CG1-CG 4.39Å; V115-R172 HydrophobicContact CG1-CB 4.46Å; V115-R172 HydrophobicContact CG1-CG 4.37Å; V115-R172 VanDerWaalsContact O-CD 3.3Å; V115-R172 WeakPolarHBondContact O-CD 3.5Å; V115-R172 PolarHBondContact O-NE 3.41Å; V115-M178 HydrophobicContact CG2-SD 4.12Å
116	C	95.3	Very high	85	Confident	7 Å²	7	59.4 Å²	59.4	5%	0.047	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-153.5	5.7	-169.1	69.8	0	0	0	0	117.9	C113 D118 C133 I157 N158 K159 R162	C113-C116 PolarHBondContact O-N 3.5Å; C116-D118 PolarHBondContact O-N 3.45Å; C116-D118 VanDerWaalsContact O-N 3.09Å; C116-C133 VanDerWaalsContact SG-SG 3.61Å; C116-I157 HydrophobicContact CB-CG2 3.9Å; C116-N158 CarbonylContact O-C 3.57Å; C116-N158 VanDerWaalsContact O-C 3.3Å; C116-N158 WeakPolarHBondContact O-CA 3.49Å; C116-K159 PolarHBondContact O-N 3.23Å; C116-R162 HydrophobicContact CB-CB 4.38Å; C116-R162 PolarHBondContact SG-NH1 3.22Å
117	G	92.7	Very high	87.4	Confident	50 Å²	50	54.1 Å²	54.1	52%	0.515	29%	0.291	S	S	.	.	S	Bend	trans	70	-1.1	178.8	0	0	0	0	0	116.1	C113	C113-G117 PolarHBondContact O-N 3.15Å
118	D	95.3	Very high	89.7	Confident	25 Å²	25	51.2 Å²	51.2	13%	0.134	28%	0.276	C	S	.	.	S	Bend	trans	-72.6	157	173.2	-165.8	21.2	0	0	0	111.3	C113 C116 A120 C130 K159 R162	C113-D118 WeakPolarHBondContact CB-O 3.45Å; C113-D118 PolarHBondContact N-O 3.25Å; C116-D118 PolarHBondContact O-N 3.45Å; C116-D118 VanDerWaalsContact O-N 3.09Å; D118-A120 PolarHBondContact O-N 3.24Å; D118-C130 HydrophobicContact CB-CB 4.38Å; D118-K159 HydrophobicContact CB-CB 4.05Å; D118-K159 HydrophobicContact CB-CD 4.37Å; D118-K159 HydrophobicContact CB-CG 3.98Å; D118-K159 VanDerWaalsContact OD1-CD 3.31Å; D118-K159 WeakPolarHBondContact OD1-CD 3.1Å; D118-K159 WeakPolarHBondContact OD1-CE 3.46Å; D118-K159 IonicContact OD1-NZ 3.8Å; D118-R162 IonicContact OD2-CZ 3.36Å; D118-R162 IonicContact OD2-NH1 3.25Å; D118-R162 PolarHBondContact OD2-NH1 3.35Å; D118-R162 IonicContact OD2-NH2 2.68Å; D118-R162 PolarHBondContact OD2-NH2 3.23Å
119	K	94.2	Very high	91.9	Very high	106 Å²	106	43.6 Å²	43.6	46%	0.461	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-57.2	123.9	-178.3	-178.5	170.6	-178.4	164.6	0	111.1	F110 C130	F110-K119 VanDerWaalsContact CD1-NZ 3.3Å; F110-K119 VanDerWaalsContact CD2-NZ 3.33Å; F110-K119 HydrophobicContact CG-CD 4.42Å; F110-K119 VanDerWaalsContact CG-CE 3.44Å; K119-C130 WeakPolarHBondContact O-CB 3.11Å
120	A	95.2	Very high	93.6	Very high	16 Å²	16	39.9 Å²	39.9	13%	0.132	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-75.2	157.3	178.9	0	0	0	0	0	111.8	D111 D118 V128 T129	D111-A120 HydrophobicContact CB-CB 3.94Å; D111-A120 WeakPolarHBondContact O-CB 3.3Å; D111-A120 PolarHBondContact O-N 3.26Å; D118-A120 PolarHBondContact O-N 3.24Å; A120-V128 HydrophobicContact CB-CG1 3.76Å; A120-T129 WeakPolarHBondContact CA-O 3.3Å
121	S	95.3	Very high	94.8	Very high	57 Å²	57	39.9 Å²	39.9	40%	0.399	22%	0.222	S	C	.	.			trans	-114.4	21.5	173	52.8	0	0	0	0	111.6	H124 T129 E131	S121-H124 PolarHBondContact O-NE2 3.21Å; S121-H124 PolarHBondContact OG-NE2 3.24Å; S121-T129 PolarHBondContact N-O 3.06Å; S121-T129 PolarHBondContact OG-O 2.78Å; S121-E131 WeakPolarHBondContact CB-OE1 3.23Å; S121-E131 PolarHBondContact OG-N 3.46Å; S121-E131 PolarHBondContact OG-OE1 3.28Å
122	G	92.7	Very high	95.4	Very high	26 Å²	26	39 Å²	39	27%	0.268	23%	0.225	S	C	.	.	S	Bend	trans	105.9	-162.5	-176	0	0	0	0	0	114	H124 T129	G122-H124 PolarHBondContact O-CD2 3.22Å; G122-T129 PolarHBondContact O-N 2.99Å
123	R	95.7	Very high	95.7	Very high	163 Å²	163	35.9 Å²	35.9	62%	0.615	21%	0.209	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	114.5	-174.4	-155.1	178.3	-151.7	-113.4	3.9	110.8	S90 G126 A127	S90-R123 PolarHBondContact O-NH2 3Å; R123-G126 PolarHBondContact NE-O 3.21Å; R123-G126 PolarHBondContact NH1-O 2.87Å; R123-G126 PolarHBondContact NH2-O 3.08Å; R123-A127 WeakPolarHBondContact CA-O 3.19Å
124	H	97.3	Very high	95.8	Very high	30 Å²	30	38.3 Å²	38.3	14%	0.139	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	131.2	179	-52.5	-73.7	0	0	0	110.5	S121 G122 G126 A127 T129 E131 K134	S121-H124 PolarHBondContact O-NE2 3.21Å; S121-H124 PolarHBondContact OG-NE2 3.24Å; G122-H124 PolarHBondContact O-CD2 3.22Å; H124-G126 PolarHBondContact O-N 3.36Å; H124-A127 PolarHBondContact N-O 2.96Å; H124-A127 PolarHBondContact O-N 3.03Å; H124-T129 PolarHBondContact CD2-O 3.05Å; H124-T129 PolarHBondContact CD2-OG1 3.22Å; H124-E131 IonicContact CE1-OE1 2.85Å; H124-E131 IonicContact NE2-OE1 2.63Å; H124-K134 HydrophobicContact CB-CB 4Å; H124-K134 HydrophobicContact CB-CD 4.37Å; H124-K134 HydrophobicContact CB-CG 3.83Å; H124-K134 PolarHBondContact CE1-NZ 3.32Å; H124-K134 WeakPolarHBondContact ND1-CD 3.18Å; H124-K134 WeakPolarHBondContact ND1-CE 3.42Å
125	Y	97.5	Very high	96	Very high	48 Å²	48	37.9 Å²	37.9	19%	0.188	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	23	179.8	-50.5	-68.6	0	0	0	114.8	K134 F137 K138 M178 K179 V183	Y125-K134 HydrophobicContact CE2-CG 3.95Å; Y125-F137 AromaticContact CD2-CD1 3.72Å; Y125-F137 HydrophobicContact CD2-CD1 3.72Å; Y125-F137 HydrophobicContact CD2-CE1 4.38Å; Y125-F137 HydrophobicContact CE2-CD1 4.36Å; Y125-F137 AromaticContact CG-CD1 3.86Å; Y125-F137 HydrophobicContact CG-CD1 3.86Å; Y125-F137 HydrophobicContact CG-CE1 4.06Å; Y125-K138 HydrophobicContact CE2-CB 4.22Å; Y125-K138 WeakPolarHBondContact OH-CG 3.41Å; Y125-M178 HydrophobicContact CD2-CE 3.78Å; Y125-M178 CarbonylContact O-C 3.3Å; Y125-M178 WeakPolarHBondContact O-CA 3.24Å; Y125-K179 PolarHBondContact O-N 3.31Å; Y125-V183 HydrophobicContact CD1-CG2 3.73Å; Y125-V183 HydrophobicContact CE1-CB 4.47Å; Y125-V183 HydrophobicContact CE1-CG2 3.86Å; Y125-V183 HydrophobicContact CG-CG2 4.29Å
126	G	93.6	Very high	96.1	Very high	25 Å²	25	38.4 Å²	38.4	26%	0.258	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	108.2	-15.1	-178.5	0	0	0	0	0	115.7	R123 H124	R123-G126 PolarHBondContact NE-O 3.21Å; R123-G126 PolarHBondContact NH1-O 2.87Å; R123-G126 PolarHBondContact NH2-O 3.08Å; H124-G126 PolarHBondContact O-N 3.36Å
127	A	93.7	Very high	96.3	Very high	6 Å²	6	38 Å²	38	5%	0.05	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	147.3	-174.6	0	0	0	0	0	113.9	V114 R123 H124 T129 F176 M178	V114-A127 HydrophobicContact CG2-CB 4.25Å; R123-A127 WeakPolarHBondContact CA-O 3.19Å; H124-A127 PolarHBondContact N-O 2.96Å; H124-A127 PolarHBondContact O-N 3.03Å; A127-T129 HydrophobicContact CB-CG2 4.17Å; A127-T129 PolarHBondContact O-N 3.24Å; A127-T129 PolarHBondContact O-OG1 3.41Å; A127-F176 WeakPolarHBondContact CB-O 3.43Å; A127-M178 HydrophobicContact CB-CG 3.7Å
128	V	94.1	Very high	96.5	Very high	31 Å²	31	40.1 Å²	40.1	19%	0.188	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	108.7	176.7	179.3	0	0	0	0	109.4	D111 V114 A120	D111-V128 HydrophobicContact CB-CG1 3.72Å; V114-V128 PolarHBondContact N-O 3.45Å; V114-V128 VanDerWaalsContact N-O 3.15Å; A120-V128 HydrophobicContact CB-CG1 3.76Å
129	T	96.9	Very high	96.6	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.235	C	C	.	.			trans	-145.6	161.6	-168.6	50.3	0	0	0	0	113.4	V114 V115 A120 S121 G122 H124 A127 M178	V114-T129 HydrophobicContact CG2-CG2 4.28Å; V115-T129 HydrophobicContact CG2-CG2 3.92Å; A120-T129 WeakPolarHBondContact CA-O 3.3Å; S121-T129 PolarHBondContact N-O 3.06Å; S121-T129 PolarHBondContact OG-O 2.78Å; G122-T129 PolarHBondContact O-N 2.99Å; H124-T129 PolarHBondContact CD2-O 3.05Å; H124-T129 PolarHBondContact CD2-OG1 3.22Å; A127-T129 HydrophobicContact CB-CG2 4.17Å; A127-T129 PolarHBondContact O-N 3.24Å; A127-T129 PolarHBondContact O-OG1 3.41Å; T129-M178 HydrophobicContact CG2-CE 4.36Å; T129-M178 HydrophobicContact CG2-CG 4.47Å; T129-M178 HydrophobicContact CG2-SD 3.93Å
130	C	98.3	Very high	96.8	Very high	4 Å²	4	41 Å²	41	3%	0.027	21%	0.214	C	C	.	.			trans	-87.3	158.4	173.1	68.3	0	0	0	0	111.7	C113 D118 K119 G132 C133 K134 R162	C113-C130 HydrophobicContact CB-CB 3.94Å; C113-C130 PolarHBondContact SG-N 3.33Å; D118-C130 HydrophobicContact CB-CB 4.38Å; K119-C130 WeakPolarHBondContact O-CB 3.11Å; C130-G132 PolarHBondContact O-N 2.86Å; C130-G132 VanDerWaalsContact O-N 3.08Å; C130-C133 PolarHBondContact O-N 3.15Å; C130-K134 WeakPolarHBondContact O-CB 3.37Å; C130-K134 PolarHBondContact O-N 2.93Å; C130-R162 PolarHBondContact SG-NH1 2.73Å
131	E	98.3	Very high	96.9	Very high	99 Å²	99	41.6 Å²	41.6	46%	0.463	21%	0.214	S	C	.	.	H	α-helix	trans	-50.2	-36.1	176.2	-67.1	-56.9	116.4	0	0	113.1	S121 H124 C133 K134 G135	S121-E131 WeakPolarHBondContact CB-OE1 3.23Å; S121-E131 PolarHBondContact OG-N 3.46Å; S121-E131 PolarHBondContact OG-OE1 3.28Å; H124-E131 IonicContact CE1-OE1 2.85Å; H124-E131 IonicContact NE2-OE1 2.63Å; E131-C133 PolarHBondContact O-N 3.08Å; E131-K134 VanDerWaalsContact OE1-CD 3.29Å; E131-K134 WeakPolarHBondContact OE1-CD 3.41Å; E131-K134 IonicContact OE1-NZ 3.19Å; E131-K134 PolarHBondContact OE1-NZ 3.31Å; E131-K134 VanDerWaalsContact OE2-CD 3.24Å; E131-K134 WeakPolarHBondContact OE2-CD 3.19Å; E131-K134 WeakPolarHBondContact OE2-CE 3.46Å; E131-K134 IonicContact OE2-NZ 3.62Å; E131-K134 PolarHBondContact OE2-NZ 3.09Å; E131-G135 PolarHBondContact O-N 2.89Å
132	G	98.4	Very high	96.9	Very high	31 Å²	31	42.6 Å²	42.6	32%	0.32	21%	0.209	S	C	.	.	H	α-helix	trans	-63.3	-36.9	177.7	0	0	0	0	0	114	C130 F136 R169	C130-G132 PolarHBondContact O-N 2.86Å; C130-G132 VanDerWaalsContact O-N 3.08Å; G132-F136 VanDerWaalsContact O-CB 3.3Å; G132-F136 WeakPolarHBondContact O-CB 3.03Å; G132-F136 PolarHBondContact O-N 2.82Å; G132-R169 PolarHBondContact O-NH2 2.96Å
133	C	98.6	Very high	97.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-86.3	-39.4	177.6	-72.3	0	0	0	0	112.2	V115 C116 C130 E131 G135 F136 F137	V115-C133 HydrophobicContact CB-CB 4.39Å; V115-C133 HydrophobicContact CG1-CB 4.45Å; C116-C133 VanDerWaalsContact SG-SG 3.61Å; C130-C133 PolarHBondContact O-N 3.15Å; E131-C133 PolarHBondContact O-N 3.08Å; C133-G135 PolarHBondContact O-N 3.4Å; C133-F136 PolarHBondContact O-N 2.93Å; C133-F137 WeakPolarHBondContact O-CB 3.32Å; C133-F137 PolarHBondContact O-N 3.41Å
134	K	98.3	Very high	97.1	Very high	54 Å²	54	47.5 Å²	47.5	24%	0.235	23%	0.234	C	C	.	.	H	α-helix	trans	-49.4	-54.6	167	171.7	-161.1	-168.3	-179.5	0	111.9	H124 Y125 C130 E131 F137 K138	H124-K134 HydrophobicContact CB-CB 4Å; H124-K134 HydrophobicContact CB-CD 4.37Å; H124-K134 HydrophobicContact CB-CG 3.83Å; H124-K134 PolarHBondContact CE1-NZ 3.32Å; H124-K134 WeakPolarHBondContact ND1-CD 3.18Å; H124-K134 WeakPolarHBondContact ND1-CE 3.42Å; Y125-K134 HydrophobicContact CE2-CG 3.95Å; C130-K134 WeakPolarHBondContact O-CB 3.37Å; C130-K134 PolarHBondContact O-N 2.93Å; E131-K134 VanDerWaalsContact OE1-CD 3.29Å; E131-K134 WeakPolarHBondContact OE1-CD 3.41Å; E131-K134 IonicContact OE1-NZ 3.19Å; E131-K134 PolarHBondContact OE1-NZ 3.31Å; E131-K134 VanDerWaalsContact OE2-CD 3.24Å; E131-K134 WeakPolarHBondContact OE2-CD 3.19Å; E131-K134 WeakPolarHBondContact OE2-CE 3.46Å; E131-K134 IonicContact OE2-NZ 3.62Å; E131-K134 PolarHBondContact OE2-NZ 3.09Å; K134-F137 PolarHBondContact O-N 3.38Å; K134-K138 WeakPolarHBondContact O-CB 3.16Å; K134-K138 PolarHBondContact O-N 2.9Å
135	G	98.3	Very high	97	Very high	18 Å²	18	49.3 Å²	49.3	19%	0.186	25%	0.245	C	C	.	.	H	α-helix	trans	-68.7	-34	-178.7	0	0	0	0	0	113.6	E131 C133 R139	E131-G135 PolarHBondContact O-N 2.89Å; C133-G135 PolarHBondContact O-N 3.4Å; G135-R139 WeakPolarHBondContact O-CG 3.45Å; G135-R139 VanDerWaalsContact O-CZ 3.3Å; G135-R139 PolarHBondContact O-N 2.92Å; G135-R139 PolarHBondContact O-NH1 3.32Å
136	F	98.8	Very high	97	Very high	10 Å²	10	53.9 Å²	53.9	4%	0.044	28%	0.277	C	S	.	.	H	α-helix	trans	-63.2	-55.9	172	172	-100.2	0	0	0	110.9	G132 C133 K138 R139 S140 Y147 Q166 R169 L170	G132-F136 VanDerWaalsContact O-CB 3.3Å; G132-F136 WeakPolarHBondContact O-CB 3.03Å; G132-F136 PolarHBondContact O-N 2.82Å; C133-F136 PolarHBondContact O-N 2.93Å; F136-K138 PolarHBondContact O-N 3.23Å; F136-R139 PolarHBondContact O-N 2.81Å; F136-R139 VanDerWaalsContact O-N 3.1Å; F136-S140 PolarHBondContact O-N 2.91Å; F136-S140 PolarHBondContact O-OG 3.19Å; F136-Y147 AromaticContact CE2-CE2 3.87Å; F136-Y147 HydrophobicContact CE2-CE2 3.87Å; F136-Y147 AromaticContact CE2-CZ 3.97Å; F136-Y147 HydrophobicContact CZ-CD2 4.25Å; F136-Y147 AromaticContact CZ-CE2 3.52Å; F136-Y147 HydrophobicContact CZ-CE2 3.52Å; F136-Q166 HydrophobicContact CE2-CB 4.16Å; F136-Q166 HydrophobicContact CE2-CG 4.18Å; F136-Q166 HydrophobicContact CZ-CB 4.2Å; F136-Q166 WeakPolarHBondContact CZ-O 3.21Å; F136-R169 HydrophobicContact CD1-CG 3.91Å; F136-R169 HydrophobicContact CE1-CB 3.96Å; F136-R169 HydrophobicContact CE1-CG 3.7Å; F136-R169 HydrophobicContact CZ-CB 4.18Å; F136-R169 HydrophobicContact CZ-CG 4.29Å; F136-L170 HydrophobicContact CE1-CB 3.88Å; F136-L170 HydrophobicContact CE1-CD1 4.25Å; F136-L170 HydrophobicContact CZ-CB 4.11Å
137	F	98.6	Very high	97.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-56.5	-47.4	179.6	-171.9	-102.3	0	0	0	112.2	Y125 C133 K134 R139 S140 I141 L170 C173 I174 M178 K179 Q180 V183	Y125-F137 AromaticContact CD2-CD1 3.72Å; Y125-F137 HydrophobicContact CD2-CD1 3.72Å; Y125-F137 HydrophobicContact CD2-CE1 4.38Å; Y125-F137 HydrophobicContact CE2-CD1 4.36Å; Y125-F137 AromaticContact CG-CD1 3.86Å; Y125-F137 HydrophobicContact CG-CD1 3.86Å; Y125-F137 HydrophobicContact CG-CE1 4.06Å; C133-F137 WeakPolarHBondContact O-CB 3.32Å; C133-F137 PolarHBondContact O-N 3.41Å; K134-F137 PolarHBondContact O-N 3.38Å; F137-R139 VanDerWaalsContact C-N 3.27Å; F137-R139 PolarHBondContact O-N 2.95Å; F137-S140 PolarHBondContact O-N 2.92Å; F137-I141 HydrophobicContact CD1-CG1 4.24Å; F137-I141 HydrophobicContact CD2-CG1 4.25Å; F137-I141 HydrophobicContact CE1-CG1 3.91Å; F137-I141 HydrophobicContact CE2-CD1 4.07Å; F137-I141 HydrophobicContact CE2-CG1 3.93Å; F137-I141 HydrophobicContact CG-CG1 4.4Å; F137-I141 HydrophobicContact CZ-CD1 4.14Å; F137-I141 HydrophobicContact CZ-CG1 3.74Å; F137-I141 WeakPolarHBondContact O-CG1 3.38Å; F137-I141 PolarHBondContact O-N 2.86Å; F137-L170 HydrophobicContact CD2-CD1 3.89Å; F137-L170 HydrophobicContact CE2-CD1 4.25Å; F137-C173 HydrophobicContact CD2-CB 3.59Å; F137-C173 HydrophobicContact CE2-CB 4.1Å; F137-C173 HydrophobicContact CG-CB 4.49Å; F137-I174 HydrophobicContact CE2-CG1 3.98Å; F137-M178 HydrophobicContact CB-CE 3.61Å; F137-M178 HydrophobicContact CB-SD 4.18Å; F137-M178 HydrophobicContact CD1-CB 4.19Å; F137-M178 HydrophobicContact CD1-CE 3.88Å; F137-M178 HydrophobicContact CD2-CB 4Å; F137-M178 HydrophobicContact CD2-CE 4.45Å; F137-M178 HydrophobicContact CD2-SD 4.3Å; F137-M178 HydrophobicContact CE1-CB 3.93Å; F137-M178 HydrophobicContact CE2-CB 3.74Å; F137-M178 HydrophobicContact CG-CB 4.22Å; F137-M178 HydrophobicContact CG-CE 3.73Å; F137-M178 HydrophobicContact CG-SD 4.16Å; F137-M178 HydrophobicContact CZ-CB 3.71Å; F137-M178 WeakPolarHBondContact CZ-O 3.39Å; F137-K179 WeakPolarHBondContact CE1-O 3.31Å; F137-Q180 HydrophobicContact CZ-CB 4.49Å; F137-V183 HydrophobicContact CD1-CG2 3.85Å; F137-V183 HydrophobicContact CE1-CG2 3.53Å
138	K	97.9	Very high	97.4	Very high	93 Å²	93	59.3 Å²	59.3	40%	0.404	31%	0.305	S	S	.	.	H	α-helix	trans	-52.4	-42.9	176.1	-175.2	-173.9	177.8	-175.6	0	112.6	Y125 K134 F136 R142	Y125-K138 HydrophobicContact CE2-CB 4.22Å; Y125-K138 WeakPolarHBondContact OH-CG 3.41Å; K134-K138 WeakPolarHBondContact O-CB 3.16Å; K134-K138 PolarHBondContact O-N 2.9Å; F136-K138 PolarHBondContact O-N 3.23Å; K138-R142 VanDerWaalsContact O-CB 3.31Å; K138-R142 WeakPolarHBondContact O-CB 3.49Å; K138-R142 WeakPolarHBondContact O-CG 3.41Å; K138-R142 PolarHBondContact O-N 3.38Å
139	R	98	Very high	97.6	Very high	148 Å²	148	58.7 Å²	58.7	56%	0.558	30%	0.302	S	S	*	.	H	α-helix	trans	-74.7	-41.4	179.9	-72.2	-173.9	-59.7	-98.5	3.3	112.1	G135 F136 F137 K143	G135-R139 WeakPolarHBondContact O-CG 3.45Å; G135-R139 VanDerWaalsContact O-CZ 3.3Å; G135-R139 PolarHBondContact O-N 2.92Å; G135-R139 PolarHBondContact O-NH1 3.32Å; F136-R139 PolarHBondContact O-N 2.81Å; F136-R139 VanDerWaalsContact O-N 3.1Å; F137-R139 VanDerWaalsContact C-N 3.27Å; F137-R139 PolarHBondContact O-N 2.95Å; R139-K143 PolarHBondContact O-N 3.33Å
140	S	98.2	Very high	97.6	Very high	2 Å²	2	71.3 Å²	71.3	1%	0.014	35%	0.35	C	S	.	.	H	α-helix	trans	-61.8	-48.1	-180	-54.3	0	0	0	0	111.7	F136 F137 N144 L145 Y147	F136-S140 PolarHBondContact O-N 2.91Å; F136-S140 PolarHBondContact O-OG 3.19Å; F137-S140 PolarHBondContact O-N 2.92Å; S140-N144 PolarHBondContact O-N 3.42Å; S140-L145 PolarHBondContact O-N 3.11Å; S140-Y147 WeakPolarHBondContact OG-CE2 3.38Å; S140-Y147 PolarHBondContact OG-OH 3.18Å
141	I	97.6	Very high	97.5	Very high	28 Å²	28	73.2 Å²	73.2	14%	0.144	37%	0.37	C	S	.	.	H	α-helix	trans	-70.8	-48.1	179.7	-56.1	-56.5	0	0	0	111.5	F137 K143 N144 Q180 V183	F137-I141 HydrophobicContact CD1-CG1 4.24Å; F137-I141 HydrophobicContact CD2-CG1 4.25Å; F137-I141 HydrophobicContact CE1-CG1 3.91Å; F137-I141 HydrophobicContact CE2-CD1 4.07Å; F137-I141 HydrophobicContact CE2-CG1 3.93Å; F137-I141 HydrophobicContact CG-CG1 4.4Å; F137-I141 HydrophobicContact CZ-CD1 4.14Å; F137-I141 HydrophobicContact CZ-CG1 3.74Å; F137-I141 WeakPolarHBondContact O-CG1 3.38Å; F137-I141 PolarHBondContact O-N 2.86Å; I141-K143 PolarHBondContact O-N 3Å; I141-K143 VanDerWaalsContact O-N 3.16Å; I141-N144 PolarHBondContact O-N 2.97Å; I141-N144 PolarHBondContact O-OD1 2.86Å; I141-Q180 HydrophobicContact CD1-CB 3.93Å; I141-Q180 HydrophobicContact CG1-CB 4.24Å; I141-Q180 HydrophobicContact CG2-CB 4.03Å; I141-V183 HydrophobicContact CB-CB 4.12Å; I141-V183 HydrophobicContact CB-CG1 4.09Å; I141-V183 HydrophobicContact CB-CG2 4Å; I141-V183 HydrophobicContact CG1-CG2 4.15Å; I141-V183 HydrophobicContact CG2-CB 3.79Å; I141-V183 HydrophobicContact CG2-CG1 4.11Å; I141-V183 HydrophobicContact CG2-CG2 4.04Å
142	R	95.1	Very high	97.4	Very high	78 Å²	78	72.8 Å²	72.8	29%	0.294	38%	0.378	S	S	.	.	H	α-helix	trans	-55.8	-36.7	-179.5	-91.9	-179.4	161.6	54.8	8.2	114.4	K138 V183 Q184 C185	K138-R142 VanDerWaalsContact O-CB 3.31Å; K138-R142 WeakPolarHBondContact O-CB 3.49Å; K138-R142 WeakPolarHBondContact O-CG 3.41Å; K138-R142 PolarHBondContact O-N 3.38Å; R142-V183 HydrophobicContact CG-CG1 4.02Å; R142-V183 VanDerWaalsContact NH1-CG1 3.27Å; R142-Q184 PolarHBondContact NH1-O 3.11Å; R142-Q184 PolarHBondContact NH2-O 3.04Å; R142-C185 PolarHBondContact NH2-O 3.06Å; R142-C185 VanDerWaalsContact NH2-O 3.15Å
143	K	95.6	Very high	97.3	Very high	158 Å²	158	78 Å²	78	69%	0.687	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	8.9	-178.8	-66.6	-168.7	175.3	-161.7	0	113	R139 I141 L145	R139-K143 PolarHBondContact O-N 3.33Å; I141-K143 PolarHBondContact O-N 3Å; I141-K143 VanDerWaalsContact O-N 3.16Å; K143-L145 HydrophobicContact CB-CD1 4.26Å; K143-L145 HydrophobicContact CB-CD2 3.74Å; K143-L145 HydrophobicContact CB-CG 3.72Å; K143-L145 PolarHBondContact O-N 2.76Å
144	N	95.3	Very high	97.1	Very high	135 Å²	135	83.2 Å²	83.2	72%	0.722	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.9	46.1	-175.1	-69.9	-45	0	0	0	113.1	S140 I141 V146	S140-N144 PolarHBondContact O-N 3.42Å; I141-N144 PolarHBondContact O-N 2.97Å; I141-N144 PolarHBondContact O-OD1 2.86Å; N144-V146 PolarHBondContact O-N 3.31Å; N144-V146 VanDerWaalsContact O-N 3.15Å
145	L	96.8	Very high	97	Very high	68 Å²	68	82.7 Å²	82.7	36%	0.356	42%	0.423	S	S	.	.			trans	-74.2	107.3	-172.7	-61.2	-179.7	0	0	0	111.4	S140 K143 Y147	S140-L145 PolarHBondContact O-N 3.11Å; K143-L145 HydrophobicContact CB-CD1 4.26Å; K143-L145 HydrophobicContact CB-CD2 3.74Å; K143-L145 HydrophobicContact CB-CG 3.72Å; K143-L145 PolarHBondContact O-N 2.76Å; L145-Y147 HydrophobicContact CB-CE1 4Å; L145-Y147 HydrophobicContact CB-CE2 4.4Å; L145-Y147 HydrophobicContact CD1-CE1 4.28Å; L145-Y147 WeakPolarHBondContact CD1-OH 3.47Å; L145-Y147 PolarHBondContact O-N 2.88Å
146	V	96.9	Very high	96.8	Very high	143 Å²	143	88.3 Å²	88.3	87%	0.867	45%	0.447	S	S	*	.			trans	-79.6	110.5	169	-175.7	0	0	0	0	108.9	N144	N144-V146 PolarHBondContact O-N 3.31Å; N144-V146 VanDerWaalsContact O-N 3.15Å
147	Y	98.3	Very high	96.7	Very high	38 Å²	38	88.3 Å²	88.3	15%	0.149	45%	0.447	C	S	.	.			trans	-91.4	155.1	171.4	-57	-57.2	0	0	0	111	F136 S140 L145 Q166 Y167 L170	F136-Y147 AromaticContact CE2-CE2 3.87Å; F136-Y147 HydrophobicContact CE2-CE2 3.87Å; F136-Y147 AromaticContact CE2-CZ 3.97Å; F136-Y147 HydrophobicContact CZ-CD2 4.25Å; F136-Y147 AromaticContact CZ-CE2 3.52Å; F136-Y147 HydrophobicContact CZ-CE2 3.52Å; S140-Y147 WeakPolarHBondContact OG-CE2 3.38Å; S140-Y147 PolarHBondContact OG-OH 3.18Å; L145-Y147 HydrophobicContact CB-CE1 4Å; L145-Y147 HydrophobicContact CB-CE2 4.4Å; L145-Y147 HydrophobicContact CD1-CE1 4.28Å; L145-Y147 WeakPolarHBondContact CD1-OH 3.47Å; L145-Y147 PolarHBondContact O-N 2.88Å; Y147-Q166 HydrophobicContact CD1-CB 3.67Å; Y147-Q166 HydrophobicContact CD1-CG 4.49Å; Y147-Q166 VanDerWaalsContact CD1-OE1 3.24Å; Y147-Q166 HydrophobicContact CD2-CB 3.8Å; Y147-Q166 HydrophobicContact CE1-CB 3.89Å; Y147-Q166 HydrophobicContact CE1-CG 4.38Å; Y147-Q166 HydrophobicContact CE2-CB 4.01Å; Y147-Q166 HydrophobicContact CG-CB 3.63Å; Y147-Y167 VanDerWaalsContact O-CD2 3.3Å; Y147-Y167 WeakPolarHBondContact O-CD2 3.47Å; Y147-L170 HydrophobicContact CD2-CB 4.06Å; Y147-L170 HydrophobicContact CD2-CD2 3.78Å; Y147-L170 HydrophobicContact CE2-CB 4.27Å; Y147-L170 HydrophobicContact CE2-CD2 3.9Å
148	S	98.1	Very high	96.5	Very high	108 Å²	108	91 Å²	91	76%	0.755	46%	0.462	S	S	*	.			trans	-114.6	151.7	166.4	-169.5	0	0	0	0	110.9
149	C	98.3	Very high	96.4	Very high	18 Å²	18	91.7 Å²	91.7	12%	0.122	47%	0.465	C	S	.	.			trans	-88.6	144.1	170.2	-164.6	0	0	0	0	109.8	G151 K153 C155 C165 Y167 C168	C149-G151 VanDerWaalsContact C-N 3.33Å; C149-G151 PolarHBondContact SG-N 3.46Å; C149-G151 VanDerWaalsContact SG-N 3.45Å; C149-G151 PolarHBondContact SG-O 3.02Å; C149-G151 VanDerWaalsContact SG-O 3.4Å; C149-K153 HydrophobicContact CB-CG 3.86Å; C149-C155 VanDerWaalsContact SG-SG 3.67Å; C149-C165 VanDerWaalsContact SG-SG 3.63Å; C149-Y167 HydrophobicContact CB-CD1 3.74Å; C149-Y167 HydrophobicContact CB-CE1 4.42Å; C149-Y167 HydrophobicContact CB-CG 4.14Å; C149-C168 VanDerWaalsContact SG-SG 3.66Å
150	R	97.2	Very high	96.2	Very high	264 Å²	264	91.9 Å²	91.9	100%	0.996	47%	0.472	S	S	*	.	S	Bend	trans	-94	12.4	172.3	-62.8	-174.1	-179.7	-176.9	-0.5	112.9
151	G	95.1	Very high	96	Very high	45 Å²	45	95.7 Å²	95.7	46%	0.464	49%	0.489	S	S	.	.	S	Bend	trans	-157.2	-157.6	-178	0	0	0	0	0	111.1	C149 K153	C149-G151 VanDerWaalsContact C-N 3.33Å; C149-G151 PolarHBondContact SG-N 3.46Å; C149-G151 VanDerWaalsContact SG-N 3.45Å; C149-G151 PolarHBondContact SG-O 3.02Å; C149-G151 VanDerWaalsContact SG-O 3.4Å; G151-K153 PolarHBondContact O-N 3.1Å
152	S	95.6	Very high	96	Very high	90 Å²	90	96.1 Å²	96.1	63%	0.629	49%	0.489	S	S	*	.	S	Bend	trans	-68.6	17.4	-169.5	33.4	0	0	0	0	117	D154	S152-D154 VanDerWaalsContact CB-OD2 3.3Å; S152-D154 WeakPolarHBondContact CB-OD2 3.34Å; S152-D154 PolarHBondContact O-N 2.97Å; S152-D154 VanDerWaalsContact O-N 3.09Å; S152-D154 PolarHBondContact OG-OD1 3.03Å; S152-D154 PolarHBondContact OG-OD2 2.98Å
153	K	96.3	Very high	96.1	Very high	140 Å²	140	98 Å²	98	61%	0.609	51%	0.505	S	S	*	.	S	Bend	trans	61.7	9.4	177.6	-65.9	178.2	178.6	173.9	0	115.9	C149 G151 Y167 C168	C149-K153 HydrophobicContact CB-CG 3.86Å; G151-K153 PolarHBondContact O-N 3.1Å; K153-Y167 HydrophobicContact CB-CD1 4.48Å; K153-Y167 HydrophobicContact CB-CE1 3.79Å; K153-Y167 HydrophobicContact CD-CE1 4.03Å; K153-Y167 HydrophobicContact CG-CD1 4.29Å; K153-Y167 HydrophobicContact CG-CE1 3.65Å; K153-C168 PolarHBondContact O-SG 3.44Å
154	D	94.9	Very high	96.2	Very high	109 Å²	109	101.5 Å²	101.5	58%	0.583	51%	0.514	S	S	*	.			trans	-109.9	-4.9	-171.7	56.4	-0.7	0	0	0	114	S152 I156	S152-D154 VanDerWaalsContact CB-OD2 3.3Å; S152-D154 WeakPolarHBondContact CB-OD2 3.34Å; S152-D154 PolarHBondContact O-N 2.97Å; S152-D154 VanDerWaalsContact O-N 3.09Å; S152-D154 PolarHBondContact OG-OD1 3.03Å; S152-D154 PolarHBondContact OG-OD2 2.98Å; D154-I156 PolarHBondContact O-N 3.38Å
155	C	96.3	Very high	96.4	Very high	44 Å²	44	95.7 Å²	95.7	30%	0.297	48%	0.483	S	S	.	.			trans	-47.5	128.5	-166.9	-49.2	0	0	0	0	114.6	C149 I157 C165 C168	C149-C155 VanDerWaalsContact SG-SG 3.67Å; C155-I157 WeakPolarHBondContact O-CG1 3.01Å; C155-C165 HydrophobicContact CB-CB 4.07Å; C155-C168 HydrophobicContact CB-CB 4.02Å; C155-C168 VanDerWaalsContact SG-SG 3.67Å
156	I	93.9	Very high	96.5	Very high	135 Å²	135	97.4 Å²	97.4	69%	0.692	49%	0.49	S	S	*	.			trans	-58	136.3	179	-58.1	173	0	0	0	111	D154 H161	D154-I156 PolarHBondContact O-N 3.38Å; I156-H161 PolarHBondContact O-CD2 3.16Å
157	I	97.1	Very high	96.5	Very high	10 Å²	10	93.1 Å²	93.1	5%	0.051	46%	0.458	C	S	.	.			trans	-120.3	105.3	-178.8	-55.4	-59.9	0	0	0	109	V115 C116 C155 R162 C168 R169	V115-I157 HydrophobicContact CG1-CG2 4.37Å; V115-I157 VanDerWaalsContact O-CG2 3.23Å; V115-I157 WeakPolarHBondContact O-CG2 3.22Å; C116-I157 HydrophobicContact CB-CG2 3.9Å; C155-I157 WeakPolarHBondContact O-CG1 3.01Å; I157-R162 HydrophobicContact CG2-CB 3.74Å; I157-C168 HydrophobicContact CD1-CB 4.11Å; I157-R169 HydrophobicContact CD1-CB 4.03Å; I157-R169 HydrophobicContact CG2-CG 4.31Å
158	N	94.6	Very high	96.6	Very high	56 Å²	56	91.6 Å²	91.6	30%	0.299	45%	0.453	S	S	.	.			trans	-123.2	174.8	171.9	90	-1.2	0	0	0	112.1	C116 H160 H161 R162	C116-N158 CarbonylContact O-C 3.57Å; C116-N158 VanDerWaalsContact O-C 3.3Å; C116-N158 WeakPolarHBondContact O-CA 3.49Å; N158-H160 PolarHBondContact O-N 2.9Å; N158-H160 VanDerWaalsContact O-N 3.08Å; N158-H160 WeakPolarHBondContact OD1-CA 3.29Å; N158-H160 PolarHBondContact OD1-N 3.18Å; N158-H161 PolarHBondContact ND2-CE1 3.23Å; N158-H161 PolarHBondContact OD1-CD2 3.23Å; N158-H161 PolarHBondContact OD1-CE1 3.29Å; N158-H161 PolarHBondContact OD1-N 3Å; N158-H161 PolarHBondContact OD1-ND1 3.18Å; N158-H161 PolarHBondContact OD1-NE2 3.28Å; N158-R162 WeakPolarHBondContact O-CB 3.3Å; N158-R162 VanDerWaalsContact O-CG 3.29Å; N158-R162 WeakPolarHBondContact O-CG 3.36Å; N158-R162 PolarHBondContact O-N 3.02Å
159	K	94.9	Very high	96.6	Very high	108 Å²	108	87 Å²	87	47%	0.47	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.9	-40.8	178.8	178.2	177.3	-177.4	180	0	114.6	C116 D118 R162	C116-K159 PolarHBondContact O-N 3.23Å; D118-K159 HydrophobicContact CB-CB 4.05Å; D118-K159 HydrophobicContact CB-CD 4.37Å; D118-K159 HydrophobicContact CB-CG 3.98Å; D118-K159 VanDerWaalsContact OD1-CD 3.31Å; D118-K159 WeakPolarHBondContact OD1-CD 3.1Å; D118-K159 WeakPolarHBondContact OD1-CE 3.46Å; D118-K159 IonicContact OD1-NZ 3.8Å; K159-R162 WeakPolarHBondContact O-CD 3.36Å; K159-R162 PolarHBondContact O-NE 3.46Å
160	H	95.1	Very high	96.6	Very high	152 Å²	152	86.9 Å²	86.9	70%	0.704	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-55.7	-173.8	-56.7	-101.5	0	0	0	111.1	N158	N158-H160 PolarHBondContact O-N 2.9Å; N158-H160 VanDerWaalsContact O-N 3.08Å; N158-H160 WeakPolarHBondContact OD1-CA 3.29Å; N158-H160 PolarHBondContact OD1-N 3.18Å
161	H	93.4	Very high	96.7	Very high	83 Å²	83	78.4 Å²	78.4	38%	0.384	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-95.7	6.9	-172.5	51.7	-122	0	0	0	115.5	I156 N158 N163 R164	I156-H161 PolarHBondContact O-CD2 3.16Å; N158-H161 PolarHBondContact ND2-CE1 3.23Å; N158-H161 PolarHBondContact OD1-CD2 3.23Å; N158-H161 PolarHBondContact OD1-CE1 3.29Å; N158-H161 PolarHBondContact OD1-N 3Å; N158-H161 PolarHBondContact OD1-ND1 3.18Å; N158-H161 PolarHBondContact OD1-NE2 3.28Å; H161-N163 PolarHBondContact O-N 3.18Å; H161-R164 HydrophobicContact CB-CB 4.5Å; H161-R164 WeakPolarHBondContact O-CB 3.35Å; H161-R164 PolarHBondContact O-N 3.24Å
162	R	97.3	Very high	96.8	Very high	37 Å²	37	80.7 Å²	80.7	14%	0.14	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-52.1	-16.4	170.4	57.7	-171.4	176.2	-173.3	-7	115.9	C116 D118 C130 I157 N158 K159 R169	C116-R162 HydrophobicContact CB-CB 4.38Å; C116-R162 PolarHBondContact SG-NH1 3.22Å; D118-R162 IonicContact OD2-CZ 3.36Å; D118-R162 IonicContact OD2-NH1 3.25Å; D118-R162 PolarHBondContact OD2-NH1 3.35Å; D118-R162 IonicContact OD2-NH2 2.68Å; D118-R162 PolarHBondContact OD2-NH2 3.23Å; C130-R162 PolarHBondContact SG-NH1 2.73Å; I157-R162 HydrophobicContact CG2-CB 3.74Å; N158-R162 WeakPolarHBondContact O-CB 3.3Å; N158-R162 VanDerWaalsContact O-CG 3.29Å; N158-R162 WeakPolarHBondContact O-CG 3.36Å; N158-R162 PolarHBondContact O-N 3.02Å; K159-R162 WeakPolarHBondContact O-CD 3.36Å; K159-R162 PolarHBondContact O-NE 3.46Å; R162-R169 WeakPolarHBondContact O-CD 3.31Å; R162-R169 PolarHBondContact O-NH1 2.79Å; R162-R169 VanDerWaalsContact O-NH1 3.11Å
163	N	97.6	Very high	96.9	Very high	117 Å²	117	76.4 Å²	76.4	63%	0.626	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-87	-13.8	175.2	-66.7	-12.9	0	0	0	113.1	H161 R169	H161-N163 PolarHBondContact O-N 3.18Å; N163-R169 PolarHBondContact OD1-NH1 2.69Å
164	R	97.6	Very high	97	Very high	231 Å²	231	73.3 Å²	73.3	87%	0.872	34%	0.343	S	S	*	.	S	Bend	trans	-68.1	-34.1	-174.4	-177.6	61.1	171	-174.7	-3.1	113.8	H161	H161-R164 HydrophobicContact CB-CB 4.5Å; H161-R164 WeakPolarHBondContact O-CB 3.35Å; H161-R164 PolarHBondContact O-N 3.24Å
165	C	98.5	Very high	97	Very high	13 Å²	13	71.4 Å²	71.4	9%	0.088	34%	0.343	C	S	.	.			trans	-135.8	107.9	174.5	-168.7	0	0	0	0	111.7	C149 C155 C168 R169	C149-C165 VanDerWaalsContact SG-SG 3.63Å; C155-C165 HydrophobicContact CB-CB 4.07Å; C165-C168 HydrophobicContact CB-CB 4.23Å; C165-R169 WeakPolarHBondContact O-CB 3.19Å; C165-R169 PolarHBondContact O-N 3.37Å
166	Q	98.6	Very high	96.9	Very high	104 Å²	104	72.5 Å²	72.5	49%	0.486	34%	0.342	S	S	.	.	H	α-helix	trans	-68.2	-35.6	178.3	-64.9	172.6	-17.8	0	0	112.1	F136 Y147 L170	F136-Q166 HydrophobicContact CE2-CB 4.16Å; F136-Q166 HydrophobicContact CE2-CG 4.18Å; F136-Q166 HydrophobicContact CZ-CB 4.2Å; F136-Q166 WeakPolarHBondContact CZ-O 3.21Å; Y147-Q166 HydrophobicContact CD1-CB 3.67Å; Y147-Q166 HydrophobicContact CD1-CG 4.49Å; Y147-Q166 VanDerWaalsContact CD1-OE1 3.24Å; Y147-Q166 HydrophobicContact CD2-CB 3.8Å; Y147-Q166 HydrophobicContact CE1-CB 3.89Å; Y147-Q166 HydrophobicContact CE1-CG 4.38Å; Y147-Q166 HydrophobicContact CE2-CB 4.01Å; Y147-Q166 HydrophobicContact CG-CB 3.63Å; Q166-L170 WeakPolarHBondContact O-CB 3.09Å; Q166-L170 PolarHBondContact O-N 3.25Å
167	Y	98.8	Very high	96.8	Very high	53 Å²	53	67.8 Å²	67.8	21%	0.208	33%	0.327	C	S	.	.	H	α-helix	trans	-60.2	-59	175.8	175.6	-92.7	0	0	0	111.8	Y147 C149 K153 R169 L170 Q171	Y147-Y167 VanDerWaalsContact O-CD2 3.3Å; Y147-Y167 WeakPolarHBondContact O-CD2 3.47Å; C149-Y167 HydrophobicContact CB-CD1 3.74Å; C149-Y167 HydrophobicContact CB-CE1 4.42Å; C149-Y167 HydrophobicContact CB-CG 4.14Å; K153-Y167 HydrophobicContact CB-CD1 4.48Å; K153-Y167 HydrophobicContact CB-CE1 3.79Å; K153-Y167 HydrophobicContact CD-CE1 4.03Å; K153-Y167 HydrophobicContact CG-CD1 4.29Å; K153-Y167 HydrophobicContact CG-CE1 3.65Å; Y167-R169 PolarHBondContact O-N 2.91Å; Y167-L170 PolarHBondContact O-N 2.95Å; Y167-Q171 HydrophobicContact CD1-CG 4.18Å; Y167-Q171 HydrophobicContact CD2-CG 4.31Å; Y167-Q171 HydrophobicContact CE1-CG 3.76Å; Y167-Q171 HydrophobicContact CE2-CG 3.92Å; Y167-Q171 HydrophobicContact CG-CG 4.45Å; Y167-Q171 WeakPolarHBondContact O-CG 3.48Å; Y167-Q171 PolarHBondContact O-N 3.39Å
168	C	98.5	Very high	96.9	Very high	7 Å²	7	67.5 Å²	67.5	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-61.6	-34.6	-177.5	-56.7	0	0	0	0	111.6	C149 K153 C155 I157 C165 R172	C149-C168 VanDerWaalsContact SG-SG 3.66Å; K153-C168 PolarHBondContact O-SG 3.44Å; C155-C168 HydrophobicContact CB-CB 4.02Å; C155-C168 VanDerWaalsContact SG-SG 3.67Å; I157-C168 HydrophobicContact CD1-CB 4.11Å; C165-C168 HydrophobicContact CB-CB 4.23Å; C168-R172 WeakPolarHBondContact O-CB 3.42Å; C168-R172 PolarHBondContact O-N 3.34Å
169	R	98.7	Very high	97	Very high	11 Å²	11	70.6 Å²	70.6	4%	0.042	34%	0.336	C	S	.	.	H	α-helix	trans	-63.4	-44.6	172.5	-169.6	-172.4	-169	158.2	-5.9	112.9	V115 G132 F136 I157 R162 N163 C165 Y167 R172 C173	V115-R169 HydrophobicContact CG1-CG 4.39Å; G132-R169 PolarHBondContact O-NH2 2.96Å; F136-R169 HydrophobicContact CD1-CG 3.91Å; F136-R169 HydrophobicContact CE1-CB 3.96Å; F136-R169 HydrophobicContact CE1-CG 3.7Å; F136-R169 HydrophobicContact CZ-CB 4.18Å; F136-R169 HydrophobicContact CZ-CG 4.29Å; I157-R169 HydrophobicContact CD1-CB 4.03Å; I157-R169 HydrophobicContact CG2-CG 4.31Å; R162-R169 WeakPolarHBondContact O-CD 3.31Å; R162-R169 PolarHBondContact O-NH1 2.79Å; R162-R169 VanDerWaalsContact O-NH1 3.11Å; N163-R169 PolarHBondContact OD1-NH1 2.69Å; C165-R169 WeakPolarHBondContact O-CB 3.19Å; C165-R169 PolarHBondContact O-N 3.37Å; Y167-R169 PolarHBondContact O-N 2.91Å; R169-R172 PolarHBondContact O-N 3.41Å; R169-C173 PolarHBondContact O-N 2.59Å; R169-C173 PolarHBondContact O-SG 3.29Å; R169-C173 VanDerWaalsContact O-SG 3.36Å
170	L	98.7	Very high	97	Very high	16 Å²	16	71.6 Å²	71.6	8%	0.084	34%	0.343	C	S	.	.	H	α-helix	trans	-68.8	-43.1	-179.8	-176.2	61.4	0	0	0	111.5	F136 F137 Y147 Q166 Y167 R172 C173 I174	F136-L170 HydrophobicContact CE1-CB 3.88Å; F136-L170 HydrophobicContact CE1-CD1 4.25Å; F136-L170 HydrophobicContact CZ-CB 4.11Å; F137-L170 HydrophobicContact CD2-CD1 3.89Å; F137-L170 HydrophobicContact CE2-CD1 4.25Å; Y147-L170 HydrophobicContact CD2-CB 4.06Å; Y147-L170 HydrophobicContact CD2-CD2 3.78Å; Y147-L170 HydrophobicContact CE2-CB 4.27Å; Y147-L170 HydrophobicContact CE2-CD2 3.9Å; Q166-L170 WeakPolarHBondContact O-CB 3.09Å; Q166-L170 PolarHBondContact O-N 3.25Å; Y167-L170 PolarHBondContact O-N 2.95Å; L170-R172 VanDerWaalsContact C-N 3.3Å; L170-R172 PolarHBondContact O-N 2.93Å; L170-C173 WeakPolarHBondContact O-CB 3.35Å; L170-C173 PolarHBondContact O-N 3.48Å; L170-I174 HydrophobicContact CG-CD1 4.25Å; L170-I174 WeakPolarHBondContact O-CG1 3.05Å; L170-I174 PolarHBondContact O-N 3.08Å; L170-I174 VanDerWaalsContact O-N 3.08Å
171	Q	98.4	Very high	96.9	Very high	85 Å²	85	69.9 Å²	69.9	40%	0.397	34%	0.339	S	S	.	.	H	α-helix	trans	-59.8	-42.3	173.2	-63	-54.7	-35.3	0	0	110.9	Y167 I174 A175	Y167-Q171 HydrophobicContact CD1-CG 4.18Å; Y167-Q171 HydrophobicContact CD2-CG 4.31Å; Y167-Q171 HydrophobicContact CE1-CG 3.76Å; Y167-Q171 HydrophobicContact CE2-CG 3.92Å; Y167-Q171 HydrophobicContact CG-CG 4.45Å; Y167-Q171 WeakPolarHBondContact O-CG 3.48Å; Y167-Q171 PolarHBondContact O-N 3.39Å; Q171-I174 PolarHBondContact O-N 2.96Å; Q171-A175 VanDerWaalsContact O-CB 3.31Å; Q171-A175 WeakPolarHBondContact O-CB 3.22Å; Q171-A175 PolarHBondContact O-N 2.99Å
172	R	97.7	Very high	96.9	Very high	94 Å²	94	68.5 Å²	68.5	36%	0.355	34%	0.338	S	S	.	.	H	α-helix	trans	-65.7	-36.8	175.2	-164.7	172.9	-178.2	113.2	3.4	113	V115 C168 R169 L170 F176	V115-R172 HydrophobicContact CG1-CB 4.46Å; V115-R172 HydrophobicContact CG1-CG 4.37Å; V115-R172 VanDerWaalsContact O-CD 3.3Å; V115-R172 WeakPolarHBondContact O-CD 3.5Å; V115-R172 PolarHBondContact O-NE 3.41Å; C168-R172 WeakPolarHBondContact O-CB 3.42Å; C168-R172 PolarHBondContact O-N 3.34Å; R169-R172 PolarHBondContact O-N 3.41Å; L170-R172 VanDerWaalsContact C-N 3.3Å; L170-R172 PolarHBondContact O-N 2.93Å; R172-F176 HydrophobicContact CG-CD2 3.6Å; R172-F176 HydrophobicContact CG-CE2 3.75Å; R172-F176 WeakPolarHBondContact O-CD2 3.46Å; R172-F176 PolarHBondContact O-N 3.45Å; R172-F176 VanDerWaalsContact O-N 3.07Å
173	C	98.3	Very high	96.7	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-56.5	-49.8	170.4	-76.6	0	0	0	0	111.5	F137 R169 L170 M178	F137-C173 HydrophobicContact CD2-CB 3.59Å; F137-C173 HydrophobicContact CE2-CB 4.1Å; F137-C173 HydrophobicContact CG-CB 4.49Å; R169-C173 PolarHBondContact O-N 2.59Å; R169-C173 PolarHBondContact O-SG 3.29Å; R169-C173 VanDerWaalsContact O-SG 3.36Å; L170-C173 WeakPolarHBondContact O-CB 3.35Å; L170-C173 PolarHBondContact O-N 3.48Å; C173-M178 HydrophobicContact CB-CB 4.25Å; C173-M178 HydrophobicContact CB-CG 4.24Å; C173-M178 HydrophobicContact CB-SD 3.58Å; C173-M178 VanDerWaalsContact CB-SD 3.58Å; C173-M178 WeakPolarHBondContact O-CB 3.35Å; C173-M178 VanDerWaalsContact O-CG 3.32Å; C173-M178 WeakPolarHBondContact O-CG 3.45Å; C173-M178 PolarHBondContact O-N 3.37Å
174	I	97.6	Very high	96.2	Very high	74 Å²	74	68.2 Å²	68.2	38%	0.379	34%	0.336	S	S	.	.	H	α-helix	trans	-67.2	-46.7	-177.7	-62.4	164.6	0	0	0	110.7	F137 L170 Q171 F176 G177	F137-I174 HydrophobicContact CE2-CG1 3.98Å; L170-I174 HydrophobicContact CG-CD1 4.25Å; L170-I174 WeakPolarHBondContact O-CG1 3.05Å; L170-I174 PolarHBondContact O-N 3.08Å; L170-I174 VanDerWaalsContact O-N 3.08Å; Q171-I174 PolarHBondContact O-N 2.96Å; I174-F176 VanDerWaalsContact C-N 3.31Å; I174-F176 PolarHBondContact O-N 2.84Å; I174-G177 PolarHBondContact O-N 2.96Å
175	A	96.1	Very high	95	Very high	70 Å²	70	62.4 Å²	62.4	58%	0.579	33%	0.33	S	S	*	.	H	α-helix	trans	-61.6	-35.1	-179.5	0	0	0	0	0	113.2	Q171 G177	Q171-A175 VanDerWaalsContact O-CB 3.31Å; Q171-A175 WeakPolarHBondContact O-CB 3.22Å; Q171-A175 PolarHBondContact O-N 2.99Å; A175-G177 VanDerWaalsContact C-N 3.25Å; A175-G177 PolarHBondContact O-N 3.49Å
176	F	93.8	Very high	93.8	Very high	66 Å²	66	69 Å²	69	29%	0.289	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	29.1	172.9	-73.9	-87.5	0	0	0	113.1	V114 A127 R172 I174	V114-F176 HydrophobicContact CB-CB 4.33Å; V114-F176 HydrophobicContact CB-CD1 4.03Å; V114-F176 HydrophobicContact CB-CG 4.36Å; V114-F176 HydrophobicContact CG2-CB 3.67Å; V114-F176 HydrophobicContact CG2-CD1 4.29Å; V114-F176 HydrophobicContact CG2-CG 4.22Å; A127-F176 WeakPolarHBondContact CB-O 3.43Å; R172-F176 HydrophobicContact CG-CD2 3.6Å; R172-F176 HydrophobicContact CG-CE2 3.75Å; R172-F176 WeakPolarHBondContact O-CD2 3.46Å; R172-F176 PolarHBondContact O-N 3.45Å; R172-F176 VanDerWaalsContact O-N 3.07Å; I174-F176 VanDerWaalsContact C-N 3.31Å; I174-F176 PolarHBondContact O-N 2.84Å
177	G	92.4	Very high	92.6	Very high	36 Å²	36	74.5 Å²	74.5	37%	0.371	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	13.5	164	0	0	0	0	0	116.7	I174 A175 K179	I174-G177 PolarHBondContact O-N 2.96Å; A175-G177 VanDerWaalsContact C-N 3.25Å; A175-G177 PolarHBondContact O-N 3.49Å; G177-K179 PolarHBondContact O-N 3.15Å
178	M	97.9	Very high	91	Very high	4 Å²	4	80.1 Å²	80.1	2%	0.02	40%	0.401	C	S	.	.			trans	-73.6	109.3	168.1	-58.8	-173.7	78.9	0	0	109.5	V115 Y125 A127 T129 F137 C173	V115-M178 HydrophobicContact CG2-SD 4.12Å; Y125-M178 HydrophobicContact CD2-CE 3.78Å; Y125-M178 CarbonylContact O-C 3.3Å; Y125-M178 WeakPolarHBondContact O-CA 3.24Å; A127-M178 HydrophobicContact CB-CG 3.7Å; T129-M178 HydrophobicContact CG2-CE 4.36Å; T129-M178 HydrophobicContact CG2-CG 4.47Å; T129-M178 HydrophobicContact CG2-SD 3.93Å; F137-M178 HydrophobicContact CB-CE 3.61Å; F137-M178 HydrophobicContact CB-SD 4.18Å; F137-M178 HydrophobicContact CD1-CB 4.19Å; F137-M178 HydrophobicContact CD1-CE 3.88Å; F137-M178 HydrophobicContact CD2-CB 4Å; F137-M178 HydrophobicContact CD2-CE 4.45Å; F137-M178 HydrophobicContact CD2-SD 4.3Å; F137-M178 HydrophobicContact CE1-CB 3.93Å; F137-M178 HydrophobicContact CE2-CB 3.74Å; F137-M178 HydrophobicContact CG-CB 4.22Å; F137-M178 HydrophobicContact CG-CE 3.73Å; F137-M178 HydrophobicContact CG-SD 4.16Å; F137-M178 HydrophobicContact CZ-CB 3.71Å; F137-M178 WeakPolarHBondContact CZ-O 3.39Å; C173-M178 HydrophobicContact CB-CB 4.25Å; C173-M178 HydrophobicContact CB-CG 4.24Å; C173-M178 HydrophobicContact CB-SD 3.58Å; C173-M178 VanDerWaalsContact CB-SD 3.58Å; C173-M178 WeakPolarHBondContact O-CB 3.35Å; C173-M178 VanDerWaalsContact O-CG 3.32Å; C173-M178 WeakPolarHBondContact O-CG 3.45Å; C173-M178 PolarHBondContact O-N 3.37Å
179	K	96.2	Very high	89.5	Confident	121 Å²	121	85.2 Å²	85.2	53%	0.526	43%	0.434	S	S	.	.			trans	-84.6	131.5	-176.6	-53.5	-171.8	174.3	-167.5	0	112.2	Y125 F137 G177 D181	Y125-K179 PolarHBondContact O-N 3.31Å; F137-K179 WeakPolarHBondContact CE1-O 3.31Å; G177-K179 PolarHBondContact O-N 3.15Å; K179-D181 WeakPolarHBondContact CB-OD1 3.5Å
180	Q	95.8	Very high	87.9	Confident	130 Å²	130	92 Å²	92	61%	0.607	47%	0.469	S	S	*	.	S	Bend	trans	-70.9	-31.4	177.8	62.2	-171.6	-2.2	0	0	113.3	F137 I141 S182 V183	F137-Q180 HydrophobicContact CZ-CB 4.49Å; I141-Q180 HydrophobicContact CD1-CB 3.93Å; I141-Q180 HydrophobicContact CG1-CB 4.24Å; I141-Q180 HydrophobicContact CG2-CB 4.03Å; Q180-S182 PolarHBondContact O-N 3.34Å; Q180-V183 WeakPolarHBondContact O-CB 3.29Å; Q180-V183 PolarHBondContact O-N 2.72Å
181	D	93.8	Very high	86	Confident	116 Å²	116	99.4 Å²	99.4	62%	0.62	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-35	175.8	57.5	19.8	0	0	0	113.2	K179 V183	K179-D181 WeakPolarHBondContact CB-OD1 3.5Å; D181-V183 PolarHBondContact O-N 3.14Å
182	S	92.8	Very high	84.1	Confident	53 Å²	53	101 Å²	101	37%	0.371	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-7.1	-175.9	-60.2	0	0	0	0	111.8	Q180 Q184	Q180-S182 PolarHBondContact O-N 3.34Å; S182-Q184 VanDerWaalsContact C-N 3.34Å; S182-Q184 PolarHBondContact O-N 2.89Å
183	V	92.6	Very high	81.9	Confident	13 Å²	13	101.8 Å²	101.8	8%	0.079	54%	0.539	C	S	.	.	S	Bend	trans	-89.6	74.5	172.4	-168.8	0	0	0	0	108.6	Y125 F137 I141 R142 Q180 D181 C185	Y125-V183 HydrophobicContact CD1-CG2 3.73Å; Y125-V183 HydrophobicContact CE1-CB 4.47Å; Y125-V183 HydrophobicContact CE1-CG2 3.86Å; Y125-V183 HydrophobicContact CG-CG2 4.29Å; F137-V183 HydrophobicContact CD1-CG2 3.85Å; F137-V183 HydrophobicContact CE1-CG2 3.53Å; I141-V183 HydrophobicContact CB-CB 4.12Å; I141-V183 HydrophobicContact CB-CG1 4.09Å; I141-V183 HydrophobicContact CB-CG2 4Å; I141-V183 HydrophobicContact CG1-CG2 4.15Å; I141-V183 HydrophobicContact CG2-CB 3.79Å; I141-V183 HydrophobicContact CG2-CG1 4.11Å; I141-V183 HydrophobicContact CG2-CG2 4.04Å; R142-V183 HydrophobicContact CG-CG1 4.02Å; R142-V183 VanDerWaalsContact NH1-CG1 3.27Å; Q180-V183 WeakPolarHBondContact O-CB 3.29Å; Q180-V183 PolarHBondContact O-N 2.72Å; D181-V183 PolarHBondContact O-N 3.14Å; V183-C185 PolarHBondContact O-N 3.31Å
184	Q	86.9	Confident	79.8	Confident	135 Å²	135	109.7 Å²	109.7	63%	0.631	57%	0.568	S	S	*	*			trans	-41.3	140.3	173.3	-67.7	-179.9	-9	0	0	111.4	R142 S182	R142-Q184 PolarHBondContact NH1-O 3.11Å; R142-Q184 PolarHBondContact NH2-O 3.04Å; S182-Q184 VanDerWaalsContact C-N 3.34Å; S182-Q184 PolarHBondContact O-N 2.89Å
185	C	74	Confident	77.7	Confident	110 Å²	110	114.4 Å²	114.4	74%	0.743	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-54.6	170.7	172.8	-65.8	0	0	0	0	112.4	R142 V183 R187	R142-C185 PolarHBondContact NH2-O 3.06Å; R142-C185 VanDerWaalsContact NH2-O 3.15Å; V183-C185 PolarHBondContact O-N 3.31Å; C185-R187 PolarHBondContact O-N 2.7Å
186	E	72.3	Confident	75.5	Confident	150 Å²	150	119.8 Å²	119.8	70%	0.701	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-64.7	129.1	169.7	-55.6	-160.6	151.4	0	0	109	K188	E186-K188 PolarHBondContact O-N 2.69Å; E186-K188 VanDerWaalsContact O-N 3.14Å
187	R	74.5	Confident	73.5	Confident	220 Å²	220	120.3 Å²	120.3	83%	0.83	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-62.4	119.4	166.7	-63.9	180	-171.2	164	0.9	105.1	C185	C185-R187 PolarHBondContact O-N 2.7Å
188	K	64.4	Low	71.7	Confident	171 Å²	171	123.8 Å²	123.8	74%	0.743	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-49.3	141	162.3	-65.5	-172.3	176.7	-170.9	0	107.3	E186 I190	E186-K188 PolarHBondContact O-N 2.69Å; E186-K188 VanDerWaalsContact O-N 3.14Å; K188-I190 PolarHBondContact O-N 3.42Å
189	P	66.4	Low	69.6	Low	115 Å²	115	130.5 Å²	130.5	75%	0.747	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-47.1	142.5	160.6	-23.8	34.2	0	0	0	108.2	E191	P189-E191 VanDerWaalsContact C-N 3.25Å; P189-E191 PolarHBondContact O-N 2.79Å
190	I	65.1	Low	67.1	Low	152 Å²	152	128.4 Å²	128.4	78%	0.779	67%	0.665	S	S	*	*			trans	-67.8	97.6	174.4	-61.6	172.9	0	0	0	105.9	K188 V192	K188-I190 PolarHBondContact O-N 3.42Å; I190-V192 HydrophobicContact CG2-CG1 4.05Å; I190-V192 PolarHBondContact O-N 2.81Å
191	E	59.5	Low	64.7	Low	172 Å²	172	127.2 Å²	127.2	80%	0.804	68%	0.678	S	S	*	*			trans	-61	86.5	156.4	-75.5	175.3	-179.1	0	0	105.8	P189 S193	P189-E191 VanDerWaalsContact C-N 3.25Å; P189-E191 PolarHBondContact O-N 2.79Å; E191-S193 PolarHBondContact O-N 2.79Å
192	V	58.5	Low	62.4	Low	120 Å²	120	124.6 Å²	124.6	73%	0.727	67%	0.672	S	S	*	*			trans	-61.4	90.7	160.9	-95.3	0	0	0	0	105.7	I190 R194	I190-V192 HydrophobicContact CG2-CG1 4.05Å; I190-V192 PolarHBondContact O-N 2.81Å; V192-R194 PolarHBondContact O-N 2.81Å
193	S	51.9	Low	60.4	Low	109 Å²	109	126.7 Å²	126.7	76%	0.762	69%	0.687	S	S	*	*			trans	-51.5	99	154.3	-178.5	0	0	0	0	105.5	E191 E195	E191-S193 PolarHBondContact O-N 2.79Å; S193-E195 PolarHBondContact O-N 2.8Å
194	R	54.1	Low	58.6	Low	166 Å²	166	132.6 Å²	132.6	63%	0.626	72%	0.723	S	S	*	*			trans	-76.3	71.7	179.3	-176.6	-176.5	163.6	-175.2	-4.7	106.8	V192 K196	V192-R194 PolarHBondContact O-N 2.81Å; R194-K196 PolarHBondContact O-N 3.27Å; R194-K196 VanDerWaalsContact O-N 3.08Å
195	E	53.6	Low	56.8	Low	173 Å²	173	133.8 Å²	133.8	81%	0.808	73%	0.729	S	S	*	*			trans	-50.4	117.6	166.3	-171.4	165.7	-125.9	0	0	106.6	S193 S197	S193-E195 PolarHBondContact O-N 2.8Å; E195-S197 VanDerWaalsContact C-N 3.26Å; E195-S197 PolarHBondContact O-N 3.09Å
196	K	50	Low	55.4	Low	183 Å²	183	136.3 Å²	136.3	80%	0.796	73%	0.727	S	S	*	*			trans	-81.4	76.7	-156.5	-171.6	-175.5	174.4	-174.9	0	109.9	R194 S198	R194-K196 PolarHBondContact O-N 3.27Å; R194-K196 VanDerWaalsContact O-N 3.08Å; K196-S198 PolarHBondContact O-N 2.8Å; K196-S198 VanDerWaalsContact O-N 3.17Å
197	S	50.4	Low	54.4	Low	78 Å²	78	136.4 Å²	136.4	55%	0.545	73%	0.731	S	S	.	*			trans	-49.7	123	164.6	57.2	0	0	0	0	108.5	E195 N199	E195-S197 VanDerWaalsContact C-N 3.26Å; E195-S197 PolarHBondContact O-N 3.09Å; S197-N199 PolarHBondContact O-N 3.08Å
198	S	55.6	Low	53.1	Low	108 Å²	108	135.2 Å²	135.2	76%	0.755	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-11.1	-161.7	48.9	0	0	0	0	114.7	K196	K196-S198 PolarHBondContact O-N 2.8Å; K196-S198 VanDerWaalsContact O-N 3.17Å
199	N	53.8	Low	52.5	Low	146 Å²	146	134.2 Å²	134.2	78%	0.781	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.1	3.3	-161.7	-57	-4.3	0	0	0	113.4	S197 A201	S197-N199 PolarHBondContact O-N 3.08Å; N199-A201 PolarHBondContact O-N 3.17Å
200	C	42.7	Very low	51.7	Low	76 Å²	76	139.4 Å²	139.4	51%	0.514	73%	0.734	S	S	.	*			trans	-90.3	95.7	173	-67.8	0	0	0	0	110.9	A202	C200-A202 PolarHBondContact O-N 3.39Å
201	A	46.2	Very low	50.9	Low	105 Å²	105	141.8 Å²	141.8	87%	0.868	74%	0.739	S	S	*	*			trans	-60.2	96.6	176.1	0	0	0	0	0	111.7	N199 S203	N199-A201 PolarHBondContact O-N 3.17Å; A201-S203 PolarHBondContact O-N 3.28Å; A201-S203 VanDerWaalsContact O-N 3.16Å
202	A	44.4	Very low	50.1	Low	61 Å²	61	139.6 Å²	139.6	50%	0.504	73%	0.732	S	S	.	*			trans	-81.7	86.6	171.9	0	0	0	0	0	109	C200 T204	C200-A202 PolarHBondContact O-N 3.39Å; A202-T204 PolarHBondContact O-N 2.73Å
203	S	52.3	Low	49.9	Very low	98 Å²	98	140.3 Å²	140.3	69%	0.685	73%	0.731	S	S	*	*			trans	-62.7	117.8	166.9	-178.2	0	0	0	0	108.8	A201	A201-S203 PolarHBondContact O-N 3.28Å; A201-S203 VanDerWaalsContact O-N 3.16Å
204	T	53.1	Low	49.8	Very low	136 Å²	136	145.3 Å²	145.3	83%	0.834	73%	0.734	S	S	*	*			trans	-98.7	10.5	177.1	48.1	0	0	0	0	112.2	A202	A202-T204 PolarHBondContact O-N 2.73Å
205	E	49.3	Very low	49.4	Very low	161 Å²	161	141.4 Å²	141.4	75%	0.752	73%	0.732	S	S	*	*	S	Bend	trans	-76.1	144.5	178.4	-61.2	-163.9	135	0	0	111.7	I207	E205-I207 PolarHBondContact O-N 3.4Å; E205-I207 VanDerWaalsContact O-N 3.11Å
206	K	44.5	Very low	49.2	Very low	162 Å²	162	139.3 Å²	139.3	70%	0.704	73%	0.733	S	S	*	*			trans	-68.6	110.9	-173.4	-68.3	173	179.7	172.8	0	110.1	Y208	K206-Y208 HydrophobicContact CB-CD2 4.38Å; K206-Y208 HydrophobicContact CB-CE2 3.98Å; K206-Y208 WeakPolarHBondContact O-CD2 3.35Å; K206-Y208 PolarHBondContact O-N 3.41Å
207	I	51.7	Low	48.9	Very low	153 Å²	153	137.3 Å²	137.3	79%	0.785	73%	0.73	S	S	*	*			trans	-66.8	96.1	171.9	-55.9	177	0	0	0	108.8	E205 I209	E205-I207 PolarHBondContact O-N 3.4Å; E205-I207 VanDerWaalsContact O-N 3.11Å; I207-I209 VanDerWaalsContact C-N 3.33Å; I207-I209 HydrophobicContact CG2-CG1 4.14Å; I207-I209 PolarHBondContact O-N 3.39Å
208	Y	46.6	Very low	48.6	Very low	195 Å²	195	139.7 Å²	139.7	77%	0.765	74%	0.742	S	S	*	*			trans	-73.8	84	174.8	-72.4	-80.8	0	0	0	110.7	K206 R210	K206-Y208 HydrophobicContact CB-CD2 4.38Å; K206-Y208 HydrophobicContact CB-CE2 3.98Å; K206-Y208 WeakPolarHBondContact O-CD2 3.35Å; K206-Y208 PolarHBondContact O-N 3.41Å; Y208-R210 PolarHBondContact O-N 2.93Å
209	I	51.8	Low	48.1	Very low	150 Å²	150	139.4 Å²	139.4	77%	0.769	75%	0.745	S	S	*	*			trans	-61.8	118.3	169	-56.7	178.1	0	0	0	108.2	I207	I207-I209 VanDerWaalsContact C-N 3.33Å; I207-I209 HydrophobicContact CG2-CG1 4.14Å; I207-I209 PolarHBondContact O-N 3.39Å
210	R	50	Low	47.5	Very low	223 Å²	223	138.1 Å²	138.1	84%	0.842	74%	0.743	S	S	*	*			trans	-64.5	139.7	177.6	-64.3	-175.3	-174.8	172.9	3.1	109.9	Y208 D212	Y208-R210 PolarHBondContact O-N 2.93Å; R210-D212 VanDerWaalsContact C-N 3.31Å; R210-D212 PolarHBondContact O-N 3.1Å
211	K	48.3	Very low	47.4	Very low	203 Å²	203	139.2 Å²	139.2	88%	0.883	75%	0.749	S	S	*	*	S	Bend	trans	-77.8	-9.1	-169.6	-160.1	169.8	-179.5	-179.8	0	114.8
212	D	44.2	Very low	47.1	Very low	125 Å²	125	140.2 Å²	140.2	67%	0.668	75%	0.745	S	S	*	*			trans	-102.2	112.3	179.4	-96.6	-64.9	0	0	0	112.8	R210 R214	R210-D212 VanDerWaalsContact C-N 3.31Å; R210-D212 PolarHBondContact O-N 3.1Å; D212-R214 VanDerWaalsContact C-N 3.27Å; D212-R214 PolarHBondContact O-N 3.12Å
213	L	52.5	Low	47	Very low	136 Å²	136	146 Å²	146	71%	0.712	76%	0.759	S	S	*	*			trans	-88.8	24.4	-178.8	-66.3	166.9	0	0	0	113.3
214	R	51.3	Low	46.2	Very low	214 Å²	214	146.4 Å²	146.4	81%	0.808	76%	0.757	S	S	*	*			trans	-110.4	6.1	-170	-75.3	-172.3	171.2	122.1	-4.7	115.9	D212	D212-R214 VanDerWaalsContact C-N 3.27Å; D212-R214 PolarHBondContact O-N 3.12Å
215	S	45.9	Very low	45.5	Very low	84 Å²	84	145.9 Å²	145.9	59%	0.587	75%	0.754	S	S	*	*			trans	-97.2	130.6	174.7	-175.3	0	0	0	0	111.1	L217	S215-L217 VanDerWaalsContact C-N 3.28Å; S215-L217 PolarHBondContact O-N 3.35Å
216	P	47.8	Very low	44.6	Very low	128 Å²	128	145.5 Å²	145.5	83%	0.831	76%	0.757	S	S	*	*			trans	-82.1	-0.7	177.7	34.5	-36.4	0	0	0	113.7
217	L	45.3	Very low	44.4	Very low	142 Å²	142	142.9 Å²	142.9	74%	0.743	76%	0.759	S	S	*	*	S	Bend	trans	-84.1	124.2	-179.4	-66	175.4	0	0	0	111	S215 A219	S215-L217 VanDerWaalsContact C-N 3.28Å; S215-L217 PolarHBondContact O-N 3.35Å; L217-A219 PolarHBondContact O-N 3.43Å
218	T	42.8	Very low	43.3	Very low	128 Å²	128	144.5 Å²	144.5	79%	0.785	76%	0.764	S	S	*	*			trans	-57.8	130.6	175.1	47.8	0	0	0	0	111.1	T220	T218-T220 PolarHBondContact O-N 3Å
219	A	45.2	Very low	42.4	Very low	101 Å²	101	139.7 Å²	139.7	84%	0.835	76%	0.758	S	S	*	*			trans	-67.7	101.6	-178.9	0	0	0	0	0	111.8	L217	L217-A219 PolarHBondContact O-N 3.43Å
220	T	41	Very low	41.4	Very low	119 Å²	119	138.1 Å²	138.1	73%	0.73	76%	0.756	S	S	*	*			trans	-73.8	128	165.6	34.6	0	0	0	0	110	T218 T222	T218-T220 PolarHBondContact O-N 3Å; T220-T222 PolarHBondContact O-N 2.95Å
221	P	40.4	Very low	40.5	Very low	99 Å²	99	138.3 Å²	138.3	64%	0.643	76%	0.757	S	S	*	*			trans	-75.7	110.5	174.4	29.5	-32.3	0	0	0	110.1	F223	P221-F223 HydrophobicContact CB-CD2 4.42Å; P221-F223 HydrophobicContact CB-CE2 3.99Å; P221-F223 HydrophobicContact CG-CD2 4.49Å; P221-F223 HydrophobicContact CG-CE2 3.91Å; P221-F223 PolarHBondContact O-N 3.1Å; P221-F223 VanDerWaalsContact O-N 3.09Å
222	T	40.5	Very low	39.6	Very low	126 Å²	126	134 Å²	134	77%	0.773	75%	0.752	S	S	*	*			trans	-74.1	97.3	171.5	-51.6	0	0	0	0	109.6	T220 V224	T220-T222 PolarHBondContact O-N 2.95Å; T222-V224 HydrophobicContact CG2-CG2 4.18Å; T222-V224 PolarHBondContact O-N 3.12Å
223	F	41.8	Very low	39	Very low	182 Å²	182	135 Å²	135	80%	0.798	76%	0.763	S	S	*	*			trans	-74.3	115.7	164.7	-69.2	-85.7	0	0	0	108.9	P221	P221-F223 HydrophobicContact CB-CD2 4.42Å; P221-F223 HydrophobicContact CB-CE2 3.99Å; P221-F223 HydrophobicContact CG-CD2 4.49Å; P221-F223 HydrophobicContact CG-CE2 3.91Å; P221-F223 PolarHBondContact O-N 3.1Å; P221-F223 VanDerWaalsContact O-N 3.09Å
224	V	35.7	Very low	37.9	Very low	108 Å²	108	132 Å²	132	66%	0.655	77%	0.765	S	S	*	*			trans	-95.2	123.4	168.4	-178.8	0	0	0	0	107.5	T222	T222-V224 HydrophobicContact CG2-CG2 4.18Å; T222-V224 PolarHBondContact O-N 3.12Å
225	T	38.9	Very low	37.2	Very low	124 Å²	124	129.4 Å²	129.4	76%	0.761	77%	0.766	S	S	*	*			trans	-106.5	94.3	171.5	53.2	0	0	0	0	108.7	S227	T225-S227 PolarHBondContact O-N 3.07Å
226	D	30.7	Very low	36.7	Very low	153 Å²	153	132.7 Å²	132.7	82%	0.818	78%	0.777	S	S	*	*			trans	-69.6	125.2	172.1	-68.6	-38.1	0	0	0	109.7
227	S	39.6	Very low	35.8	Very low	108 Å²	108	133.7 Å²	133.7	76%	0.755	78%	0.775	S	S	*	*			trans	-145.3	76.1	-178	70.6	0	0	0	0	113.6	T225	T225-S227 PolarHBondContact O-N 3.07Å
228	E	28.2	Very low	35.2	Very low	187 Å²	187	132.1 Å²	132.1	87%	0.874	78%	0.776	S	S	*	*			trans	-136.6	142.8	158.3	-75.5	-152.9	80.2	0	0	107.1
229	S	29	Very low	34.6	Very low	94 Å²	94	129.6 Å²	129.6	66%	0.657	78%	0.775	S	S	*	*			cis	-158.4	177.8	-1.4	-140.1	0	0	0	0	107.2
230	T	29.6	Very low	33.9	Very low	117 Å²	117	132.8 Å²	132.8	72%	0.718	78%	0.775	S	S	*	*			cis	-144.7	143.8	17.8	58.9	0	0	0	0	113.4
231	R	31.6	Very low	33.4	Very low	227 Å²	227	137 Å²	137	86%	0.857	78%	0.784	S	S	*	*			trans	43.1	143.7	136.5	-60.8	-176.2	176.8	177.6	-0.5	123
232	S	30.3	Very low	33	Very low	113 Å²	113	140 Å²	140	79%	0.79	79%	0.791	S	S	*	*			trans	78.4	140.7	162.8	83.4	0	0	0	0	115.7
233	T	30.6	Very low	32.6	Very low	145 Å²	145	140.3 Å²	140.3	89%	0.89	79%	0.788	S	S	*	*			cis	-150.8	150.2	-1.3	-28	0	0	0	0	110
234	G	30.8	Very low	32	Very low	74 Å²	74	139.8 Å²	139.8	76%	0.763	79%	0.792	S	S	*	*			trans	143.9	158.2	170.4	0	0	0	0	0	114.6
235	L	36	Very low	31.8	Very low	158 Å²	158	142.7 Å²	142.7	83%	0.827	80%	0.797	S	S	*	*			trans	-146.8	146	-176.3	-166.2	83.8	0	0	0	110.1
236	L	36	Very low	31.8	Very low	154 Å²	154	142.1 Å²	142.1	81%	0.806	80%	0.796	S	S	*	*			trans	69.2	157	179.1	-40.5	178.3	0	0	0	113.9
237	D	28.4	Very low	31.8	Very low	149 Å²	149	140.4 Å²	140.4	80%	0.797	80%	0.796	S	S	*	*			cis	-140.8	-178.2	0.3	-162.9	11.2	0	0	0	111.7
238	S	32.5	Very low	31.1	Very low	109 Å²	109	138.3 Å²	138.3	76%	0.762	79%	0.792	S	S	*	*			trans	-88.6	144.3	-171.4	-53	0	0	0	0	115.1
239	G	29.2	Very low	31	Very low	75 Å²	75	136.8 Å²	136.8	77%	0.773	79%	0.794	S	S	*	*			trans	89	140.4	144.2	0	0	0	0	0	118.1
240	M	30.5	Very low	31	Very low	168 Å²	168	140 Å²	140	83%	0.828	80%	0.797	S	S	*	*			trans	173.6	102.1	130.6	-94.5	-64	-176.9	0	0	110
241	F	30.1	Very low	30.8	Very low	208 Å²	208	141.4 Å²	141.4	91%	0.912	81%	0.805	S	S	*	*			trans	-134.2	126	154.3	-87.5	-73.9	0	0	0	107.2
242	M	32.3	Very low	30.6	Very low	162 Å²	162	137.7 Å²	137.7	80%	0.798	80%	0.798	S	S	*	*			trans	-139.2	153.1	-179.5	-93.2	-65.1	130.5	0	0	111.9
243	N	32.7	Very low	30.4	Very low	132 Å²	132	138.5 Å²	138.5	71%	0.706	80%	0.804	S	S	*	*			trans	-70.9	167.9	-175	-54.1	-75.7	0	0	0	113.5
244	I	28.7	Very low	30.3	Very low	171 Å²	171	135.9 Å²	135.9	88%	0.877	80%	0.796	S	S	*	*			trans	-145.6	139.8	140	-97	139.4	0	0	0	109.1
245	H	32.3	Very low	30.1	Very low	168 Å²	168	138.9 Å²	138.9	78%	0.778	80%	0.799	S	S	*	*			trans	-115.2	157.6	176.7	-105.4	-69.1	0	0	0	109.5
246	P	39.1	Very low	29.7	Very low	112 Å²	112	139.2 Å²	139.2	73%	0.727	80%	0.801	S	S	*	*				-140.5	158.3	98.1	32.1	-13.8	0	0	0	112
247	S	29.7	Very low	29.3	Very low	118 Å²	118	140.2 Å²	140.2	83%	0.825	80%	0.804	S	S	*	*			cis	69.3	128.2	47.2	-161.3	0	0	0	0	114.1
248	G	24.7	Very low	29.2	Very low	64 Å²	64	140.2 Å²	140.2	66%	0.66	81%	0.809	S	S	*	*			cis	154.4	139.2	-7.1	0	0	0	0	0	112.9
249	V	28	Very low	28.9	Very low	154 Å²	154	139.9 Å²	139.9	93%	0.933	81%	0.807	S	S	*	*			trans	-144.6	147.3	170.8	-173.8	0	0	0	0	110.4
250	K	28.6	Very low	28.7	Very low	162 Å²	162	142.7 Å²	142.7	70%	0.704	81%	0.805	S	S	*	*			trans	-96.1	162.1	-175.7	-63.1	-176.3	166.7	-155.9	0	114.3	E252	K250-E252 IonicContact NZ-OE1 2.79Å; K250-E252 PolarHBondContact NZ-OE1 3.07Å
251	T	24.9	Very low	28.4	Very low	147 Å²	147	143.6 Å²	143.6	90%	0.902	80%	0.804	S	S	*	*				-161.6	151.5	116.3	-72.2	0	0	0	0	109.1
252	E	27.5	Very low	28.5	Very low	149 Å²	149	138.7 Å²	138.7	70%	0.696	80%	0.802	S	S	*	*			trans	-106.6	147.6	-169.8	-65.9	161.7	-168.2	0	0	112.4	K250	K250-E252 IonicContact NZ-OE1 2.79Å; K250-E252 PolarHBondContact NZ-OE1 3.07Å
253	S	26.8	Very low	28.1	Very low	130 Å²	130	140 Å²	140	91%	0.909	81%	0.806	S	S	*	*			trans	-159.2	152.7	147.7	-149.1	0	0	0	0	110
254	A	27.1	Very low	27.9	Very low	89 Å²	89	138.7 Å²	138.7	74%	0.736	81%	0.807	S	S	*	*			trans	-134.2	155.9	-174.1	0	0	0	0	0	111.2
255	V	26.9	Very low	27.9	Very low	137 Å²	137	137 Å²	137	83%	0.83	81%	0.809	S	S	*	*			trans	-176.5	131	144.4	138.6	0	0	0	0	111.6
256	L	27.2	Very low	27.9	Very low	165 Å²	165	137.4 Å²	137.4	86%	0.864	81%	0.811	S	S	*	*			trans	42.1	161.6	159.4	-90.5	70.9	0	0	0	124.5
257	M	29.3	Very low	27.7	Very low	176 Å²	176	135.3 Å²	135.3	87%	0.867	81%	0.81	S	S	*	*			trans	-96.1	156.1	178.2	-55.3	-79.7	-171.3	0	0	112.2
258	T	24.8	Very low	27.9	Very low	148 Å²	148	135 Å²	135	91%	0.908	80%	0.799	S	S	*	*			trans	-155.4	157.2	132.3	26.4	0	0	0	0	110.1
259	S	27.3	Very low	28.8	Very low	102 Å²	102	138.4 Å²	138.4	71%	0.713	80%	0.802	S	S	*	*			trans	-81	140.1	168.6	-178.5	0	0	0	0	109.5
260	D	23.9	Very low	29.6	Very low	135 Å²	135	133.7 Å²	133.7	72%	0.722	78%	0.775	S	S	*	*				-175.4	152.8	105.4	-114.5	26.2	0	0	0	116.5
261	K	25.6	Very low	30.5	Very low	186 Å²	186	130.4 Å²	130.4	81%	0.809	77%	0.769	S	S	*	*			trans	53.5	121.3	137.4	-154.3	172.3	-171.2	177.3	0	119.9
262	A	30.6	Very low	31.4	Very low	105 Å²	105	129 Å²	129	87%	0.868	76%	0.755	S	S	*	*			trans	-66.3	134.5	169.2	0	0	0	0	0	112.2
263	E	24.2	Very low	32	Very low	190 Å²	190	124.4 Å²	124.4	89%	0.888	74%	0.743	S	S	*	*			trans	-108.2	130.5	178.4	-155.5	168.5	-138.1	0	0	110.3
264	S	28.1	Very low	32.7	Very low	105 Å²	105	123.3 Å²	123.3	73%	0.734	73%	0.727	S	S	*	*			trans	-95.8	113.7	179.6	57	0	0	0	0	110.4	Q266	S264-Q266 PolarHBondContact O-N 3.41Å
265	C	29.5	Very low	33.5	Very low	135 Å²	135	123.6 Å²	123.6	91%	0.912	72%	0.719	S	S	*	*			trans	-61.6	99.2	173.7	-60	0	0	0	0	110.9	G267	C265-G267 PolarHBondContact O-N 3.45Å; C265-G267 VanDerWaalsContact O-N 3.12Å
266	Q	32.6	Very low	34.4	Very low	176 Å²	176	121.6 Å²	121.6	82%	0.822	71%	0.707	S	S	*	*			trans	-74.2	99	179.6	-175.4	169.7	-12.2	0	0	109.6	S264 D268	S264-Q266 PolarHBondContact O-N 3.41Å; Q266-D268 PolarHBondContact O-N 3.07Å
267	G	34.3	Very low	35.4	Very low	69 Å²	69	117.4 Å²	117.4	71%	0.711	69%	0.689	S	S	*	*			trans	-67.3	114.9	177.6	0	0	0	0	0	111.4	C265 L269	C265-G267 PolarHBondContact O-N 3.45Å; C265-G267 VanDerWaalsContact O-N 3.12Å; G267-L269 PolarHBondContact O-N 3.45Å
268	D	33.7	Very low	35.9	Very low	111 Å²	111	112.8 Å²	112.8	59%	0.594	67%	0.673	S	S	*	*			trans	-77.3	113.6	-162.7	-156.1	14.7	0	0	0	113.4	Q266 S270 T271	Q266-D268 PolarHBondContact O-N 3.07Å; D268-S270 PolarHBondContact O-N 3.4Å; D268-S270 PolarHBondContact OD2-OG 2.93Å; D268-T271 PolarHBondContact O-N 3.26Å
269	L	44	Very low	36.8	Very low	136 Å²	136	112 Å²	112	71%	0.712	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-18.9	-174.8	-80	161.7	0	0	0	113.4	G267 T271 L272 A273	G267-L269 PolarHBondContact O-N 3.45Å; L269-T271 PolarHBondContact O-N 3.11Å; L269-L272 PolarHBondContact O-N 3.4Å; L269-L272 VanDerWaalsContact O-N 3.13Å; L269-A273 PolarHBondContact O-N 3.42Å
270	S	44.8	Very low	37.5	Very low	54 Å²	54	110.1 Å²	110.1	38%	0.378	65%	0.654	S	S	.	*	H	α-helix	trans	-49	-38.4	172	60.5	0	0	0	0	112.8	D268 N274	D268-S270 PolarHBondContact O-N 3.4Å; D268-S270 PolarHBondContact OD2-OG 2.93Å; S270-N274 PolarHBondContact O-N 3.37Å; S270-N274 PolarHBondContact O-ND2 3.32Å
271	T	47.9	Very low	38.3	Very low	94 Å²	94	108.5 Å²	108.5	58%	0.577	65%	0.645	S	S	*	*	H	α-helix	trans	-68.5	-39.1	-178.3	-57.8	0	0	0	0	112	D268 L269 V275	D268-T271 PolarHBondContact O-N 3.26Å; L269-T271 PolarHBondContact O-N 3.11Å; T271-V275 WeakPolarHBondContact O-CG2 3.49Å; T271-V275 PolarHBondContact O-N 3.23Å
272	L	43.1	Very low	39.1	Very low	116 Å²	116	106.1 Å²	106.1	61%	0.607	64%	0.64	S	S	*	*	H	α-helix	trans	-71.5	-40.3	178.3	-97.7	164.7	0	0	0	112	L269 N274 V275 V276	L269-L272 PolarHBondContact O-N 3.4Å; L269-L272 VanDerWaalsContact O-N 3.13Å; L272-N274 VanDerWaalsContact C-N 3.33Å; L272-N274 PolarHBondContact O-N 2.95Å; L272-V275 PolarHBondContact O-N 3.39Å; L272-V276 WeakPolarHBondContact O-CG2 3.48Å; L272-V276 PolarHBondContact O-N 2.76Å; L272-V276 VanDerWaalsContact O-N 3.11Å
273	A	41.2	Very low	39.6	Very low	54 Å²	54	104.3 Å²	104.3	45%	0.446	63%	0.632	S	S	.	*	H	α-helix	trans	-57.8	-44.6	176.1	0	0	0	0	0	111.8	L269 V275 V276 T277	L269-A273 PolarHBondContact O-N 3.42Å; A273-V275 VanDerWaalsContact C-N 3.34Å; A273-V275 PolarHBondContact O-N 3.26Å; A273-V276 PolarHBondContact O-N 3.41Å; A273-T277 WeakPolarHBondContact O-CB 3.49Å; A273-T277 PolarHBondContact O-N 3.5Å; A273-T277 PolarHBondContact O-OG1 2.86Å; A273-T277 VanDerWaalsContact O-OG1 3.07Å
274	N	40.7	Very low	40.7	Very low	107 Å²	107	103.9 Å²	103.9	57%	0.572	63%	0.627	S	S	*	*	H	α-helix	trans	-63.8	-35.5	179	-73.7	-29.4	0	0	0	113.5	S270 L272 S278	S270-N274 PolarHBondContact O-N 3.37Å; S270-N274 PolarHBondContact O-ND2 3.32Å; L272-N274 VanDerWaalsContact C-N 3.33Å; L272-N274 PolarHBondContact O-N 2.95Å; N274-S278 WeakPolarHBondContact O-CB 3.49Å; N274-S278 PolarHBondContact O-N 3.37Å; N274-S278 PolarHBondContact O-OG 2.71Å
275	V	44.5	Very low	41.1	Very low	94 Å²	94	104.8 Å²	104.8	57%	0.57	63%	0.628	S	S	*	*	H	α-helix	trans	-68.4	-42.2	175.2	173.9	0	0	0	0	111.3	T271 L272 A273 S278 L279	T271-V275 WeakPolarHBondContact O-CG2 3.49Å; T271-V275 PolarHBondContact O-N 3.23Å; L272-V275 PolarHBondContact O-N 3.39Å; A273-V275 VanDerWaalsContact C-N 3.34Å; A273-V275 PolarHBondContact O-N 3.26Å; V275-S278 PolarHBondContact O-N 3.47Å; V275-L279 PolarHBondContact O-N 2.97Å; V275-L279 VanDerWaalsContact O-N 3.1Å
276	V	45.6	Very low	41.8	Very low	95 Å²	95	106 Å²	106	58%	0.576	62%	0.618	S	S	*	*	H	α-helix	trans	-67.7	-44.5	178.4	175.6	0	0	0	0	111.5	L272 A273 S278 L279 A280	L272-V276 WeakPolarHBondContact O-CG2 3.48Å; L272-V276 PolarHBondContact O-N 2.76Å; L272-V276 VanDerWaalsContact O-N 3.11Å; A273-V276 PolarHBondContact O-N 3.41Å; V276-S278 VanDerWaalsContact C-N 3.31Å; V276-S278 PolarHBondContact O-N 2.98Å; V276-L279 PolarHBondContact O-N 2.98Å; V276-L279 VanDerWaalsContact O-N 3.12Å; V276-A280 PolarHBondContact O-N 3.19Å
277	T	47.1	Very low	41.9	Very low	78 Å²	78	103.7 Å²	103.7	48%	0.479	61%	0.612	S	S	.	*	H	α-helix	trans	-61	-39.3	175.6	-59.7	0	0	0	0	112	A273 L279 A280 N281	A273-T277 WeakPolarHBondContact O-CB 3.49Å; A273-T277 PolarHBondContact O-N 3.5Å; A273-T277 PolarHBondContact O-OG1 2.86Å; A273-T277 VanDerWaalsContact O-OG1 3.07Å; T277-L279 VanDerWaalsContact C-N 3.32Å; T277-L279 PolarHBondContact O-N 3.25Å; T277-A280 PolarHBondContact O-N 3.16Å; T277-N281 PolarHBondContact O-N 3.44Å
278	S	40.3	Very low	42	Very low	78 Å²	78	108.7 Å²	108.7	55%	0.545	62%	0.621	S	S	.	*	H	α-helix	trans	-63.5	-36.8	174.6	-60.7	0	0	0	0	112.5	N274 V275 V276 L282	N274-S278 WeakPolarHBondContact O-CB 3.49Å; N274-S278 PolarHBondContact O-N 3.37Å; N274-S278 PolarHBondContact O-OG 2.71Å; V275-S278 PolarHBondContact O-N 3.47Å; V276-S278 VanDerWaalsContact C-N 3.31Å; V276-S278 PolarHBondContact O-N 2.98Å; S278-L282 PolarHBondContact O-N 2.95Å
279	L	43.1	Very low	41.8	Very low	132 Å²	132	108.7 Å²	108.7	69%	0.691	63%	0.63	S	S	*	*	H	α-helix	trans	-73.6	-38	178.2	-162.5	68.4	0	0	0	112.1	V275 V276 T277 L282	V275-L279 PolarHBondContact O-N 2.97Å; V275-L279 VanDerWaalsContact O-N 3.1Å; V276-L279 PolarHBondContact O-N 2.98Å; V276-L279 VanDerWaalsContact O-N 3.12Å; T277-L279 VanDerWaalsContact C-N 3.32Å; T277-L279 PolarHBondContact O-N 3.25Å; L279-L282 PolarHBondContact O-N 2.89Å
280	A	42.6	Very low	41.2	Very low	63 Å²	63	111.8 Å²	111.8	52%	0.521	64%	0.641	S	S	.	*	H	α-helix	trans	-65	-42.3	176.1	0	0	0	0	0	112.4	V276 T277 L282 G283	V276-A280 PolarHBondContact O-N 3.19Å; T277-A280 PolarHBondContact O-N 3.16Å; A280-L282 VanDerWaalsContact C-N 3.29Å; A280-L282 PolarHBondContact O-N 3.37Å; A280-G283 PolarHBondContact O-N 2.86Å; A280-G283 VanDerWaalsContact O-N 3.09Å
281	N	41.8	Very low	40.5	Very low	100 Å²	100	116.8 Å²	116.8	54%	0.535	66%	0.663	S	S	.	*	H	α-helix	trans	-68.4	-26.4	178.5	-76.7	-19.2	0	0	0	113.2	T277 G283 K284	T277-N281 PolarHBondContact O-N 3.44Å; N281-G283 PolarHBondContact O-N 2.98Å; N281-K284 PolarHBondContact O-N 2.7Å
282	L	41.9	Very low	39.7	Very low	136 Å²	136	116.7 Å²	116.7	71%	0.712	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-18.3	171.4	-120.2	72.7	0	0	0	113.6	S278 L279 A280	S278-L282 PolarHBondContact O-N 2.95Å; L279-L282 PolarHBondContact O-N 2.89Å; A280-L282 VanDerWaalsContact C-N 3.29Å; A280-L282 PolarHBondContact O-N 3.37Å
283	G	41.9	Very low	39.2	Very low	67 Å²	67	118 Å²	118	69%	0.691	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-14.9	178.7	0	0	0	0	0	115.1	A280 N281	A280-G283 PolarHBondContact O-N 2.86Å; A280-G283 VanDerWaalsContact O-N 3.09Å; N281-G283 PolarHBondContact O-N 2.98Å
284	K	46.2	Very low	38.6	Very low	182 Å²	182	122.6 Å²	122.6	79%	0.791	69%	0.686	S	S	*	*	S	Bend	trans	-104	-0.8	-172	-72.5	-177	176.6	176.1	0	115.2	N281 K286	N281-K284 PolarHBondContact O-N 2.7Å; K284-K286 PolarHBondContact O-N 3.16Å
285	T	35.7	Very low	38.1	Very low	123 Å²	123	124.5 Å²	124.5	76%	0.755	69%	0.694	S	S	*	*			trans	-94.6	58.7	179.8	60.9	0	0	0	0	112.8
286	K	44.5	Very low	37.4	Very low	161 Å²	161	125.6 Å²	125.6	70%	0.7	71%	0.705	S	S	*	*	S	Bend	trans	-148.5	148.7	164.4	-147.6	-179.2	160.5	-83.7	0	110.8	K284	K284-K286 PolarHBondContact O-N 3.16Å
287	D	36.3	Very low	36.9	Very low	128 Å²	128	129.1 Å²	129.1	68%	0.684	72%	0.718	S	S	*	*	S	Bend	trans	66.5	58.6	166.3	-50.2	-40.5	0	0	0	116.7
288	L	34.7	Very low	36	Very low	173 Å²	173	132.8 Å²	132.8	91%	0.906	73%	0.733	S	S	*	*			trans	-148.5	90.1	146.5	-160.6	72.9	0	0	0	113.8
289	S	29.2	Very low	35.5	Very low	112 Å²	112	137.7 Å²	137.7	78%	0.783	75%	0.747	S	S	*	*			trans	-167	89.1	150	50.5	0	0	0	0	112.7
290	Q	31.7	Very low	34.8	Very low	201 Å²	201	136.9 Å²	136.9	94%	0.939	75%	0.752	S	S	*	*			trans	-174.5	139.8	135.6	-105.6	165.2	7.1	0	0	111.2
291	N	30.6	Very low	34.2	Very low	158 Å²	158	142.2 Å²	142.2	85%	0.845	77%	0.771	S	S	*	*			trans	-152.1	165.8	165.4	-160.6	2.1	0	0	0	108.5
292	S	32.3	Very low	33.6	Very low	92 Å²	92	142.3 Å²	142.3	64%	0.643	78%	0.78	S	S	*	*			trans	71.2	119.4	178.6	74.3	0	0	0	0	120.2
293	N	31.4	Very low	33.1	Very low	144 Å²	144	142.2 Å²	142.2	77%	0.77	78%	0.78	S	S	*	*			trans	77	140.9	142	-60.6	20	0	0	0	119.3
294	E	29.5	Very low	32.5	Very low	150 Å²	150	145.2 Å²	145.2	70%	0.701	78%	0.78	S	S	*	*			cis	-155	158.1	-4.5	-131.7	-165.8	119.6	0	0	114.6
295	M	30	Very low	31.6	Very low	148 Å²	148	143.4 Å²	143.4	73%	0.729	78%	0.779	S	S	*	*			trans	34.8	117.3	142	-162	71.5	76.6	0	0	122
296	S	29.3	Very low	31.3	Very low	116 Å²	116	143.7 Å²	143.7	81%	0.811	78%	0.781	S	S	*	*				-174.8	151.5	120.3	54.1	0	0	0	0	115.4
297	M	34.2	Very low	30.5	Very low	170 Å²	170	140.7 Å²	140.7	84%	0.837	78%	0.78	S	S	*	*			trans	-51	168	169.8	-56.2	161.3	179.5	0	0	114.2
298	I	29.8	Very low	30.1	Very low	155 Å²	155	142.3 Å²	142.3	80%	0.795	79%	0.788	S	S	*	*			cis	-143.8	177.6	9.7	1.1	176.6	0	0	0	106.8
299	E	28.6	Very low	29.9	Very low	180 Å²	180	139.3 Å²	139.3	84%	0.841	78%	0.78	S	S	*	*			cis	-162.2	169.5	33.3	-160.3	166.6	-151.5	0	0	109.6
300	S	29.6	Very low	29.8	Very low	115 Å²	115	142.9 Å²	142.9	80%	0.804	79%	0.785	S	S	*	*			trans	-120.2	114.1	-167.9	-59.5	0	0	0	0	116.7
301	L	29.7	Very low	29.8	Very low	175 Å²	175	143.4 Å²	143.4	92%	0.916	78%	0.784	S	S	*	*			trans	-160.9	150.8	152.5	-75	-172.7	0	0	0	108
302	S	27.9	Very low	29.9	Very low	103 Å²	103	144 Å²	144	72%	0.72	78%	0.782	S	S	*	*			cis	-162.2	171.2	-15.8	57.6	0	0	0	0	110.1
303	N	32.2	Very low	29.9	Very low	134 Å²	134	148.1 Å²	148.1	72%	0.717	79%	0.791	S	S	*	*			trans	-65.9	166.2	172.3	-64.4	33.9	0	0	0	113.2
304	D	29.9	Very low	30.1	Very low	129 Å²	129	149.7 Å²	149.7	69%	0.69	80%	0.796	S	S	*	*			cis	-149.6	167.3	7.4	-124	-36.2	0	0	0	112.6
305	D	27.1	Very low	30.4	Very low	144 Å²	144	148.9 Å²	148.9	77%	0.77	79%	0.792	S	S	*	*			trans	38.7	126.6	161.2	-82.3	-36.2	0	0	0	123.3
306	T	28.5	Very low	30.9	Very low	129 Å²	129	146 Å²	146	79%	0.791	78%	0.783	S	S	*	*				173.5	109.6	120.1	-71.5	0	0	0	0	114
307	S	28	Very low	31.6	Very low	98 Å²	98	146 Å²	146	69%	0.685	77%	0.774	S	S	*	*			trans	28.7	134	153.3	73.8	0	0	0	0	125.6
308	L	28.4	Very low	32.4	Very low	162 Å²	162	139.8 Å²	139.8	85%	0.848	75%	0.753	S	S	*	*			trans	89.4	142.7	132	-87.5	168.7	0	0	0	123.7
309	C	29	Very low	33.3	Very low	110 Å²	110	135.9 Å²	135.9	74%	0.743	73%	0.734	S	S	*	*			trans	71.5	96.7	158	-67.9	0	0	0	0	121.3
310	E	27.8	Very low	34.5	Very low	188 Å²	188	131.3 Å²	131.3	88%	0.879	72%	0.718	S	S	*	*				-171.1	104.9	128.2	-111.6	175.5	-164.5	0	0	112.8
311	F	31	Very low	35.9	Very low	212 Å²	212	129.2 Å²	129.2	93%	0.93	70%	0.703	S	S	*	*			trans	-164.9	89.1	170.2	-93.6	-68.9	0	0	0	112.1
312	Q	33.9	Very low	36.9	Very low	170 Å²	170	128.4 Å²	128.4	79%	0.794	69%	0.688	S	S	*	*			trans	-159.8	21.3	168.9	-153.5	57.4	78.6	0	0	117.3
313	E	32.8	Very low	38	Very low	178 Å²	178	126 Å²	126	83%	0.832	67%	0.674	S	S	*	*	S	Bend	trans	-115.3	-13.1	-174.3	-108.5	-171.9	176.4	0	0	118.5
314	M	34.1	Very low	39.5	Very low	177 Å²	177	126.3 Å²	126.3	87%	0.872	67%	0.67	S	S	*	*	S	Bend	trans	-86.3	-20.3	-178.5	-74.5	-150.4	75.8	0	0	116
315	Q	36	Very low	40.7	Very low	134 Å²	134	125.2 Å²	125.2	63%	0.626	66%	0.664	S	S	*	*	H	α-helix	trans	-69	-43	-169.7	-143.7	77.9	21	0	0	113.5	N317 G318	Q315-N317 PolarHBondContact O-N 3.43Å; Q315-G318 PolarHBondContact O-N 2.92Å
316	T	41.3	Very low	42.3	Very low	87 Å²	87	122.7 Å²	122.7	53%	0.534	65%	0.654	S	S	.	*	H	α-helix	trans	-65.6	-36.6	-163.4	51.9	0	0	0	0	114.2	G318 D319 V320	T316-G318 VanDerWaalsContact C-N 3.28Å; T316-G318 PolarHBondContact O-N 3.17Å; T316-D319 PolarHBondContact O-N 3.24Å; T316-V320 WeakPolarHBondContact O-CG2 3.26Å; T316-V320 PolarHBondContact O-N 3.26Å
317	N	43.9	Very low	43.6	Very low	116 Å²	116	120.9 Å²	120.9	62%	0.62	64%	0.639	S	S	*	*	H	α-helix	trans	-66.9	-29.3	-179.7	-68.6	-40.4	0	0	0	112.8	Q315 S321	Q315-N317 PolarHBondContact O-N 3.43Å; N317-S321 PolarHBondContact O-N 3.28Å; N317-S321 PolarHBondContact O-OG 2.9Å
318	G	50.3	Low	44.9	Very low	40 Å²	40	118.8 Å²	118.8	41%	0.412	63%	0.627	S	S	.	*	H	α-helix	trans	-68.6	-45.1	176	0	0	0	0	0	111.8	Q315 T316 S321 R322	Q315-G318 PolarHBondContact O-N 2.92Å; T316-G318 VanDerWaalsContact C-N 3.28Å; T316-G318 PolarHBondContact O-N 3.17Å; G318-S321 WeakPolarHBondContact O-CB 3.23Å; G318-S321 PolarHBondContact O-N 2.91Å; G318-R322 WeakPolarHBondContact O-CB 3.48Å; G318-R322 PolarHBondContact O-N 3.41Å
319	D	48.9	Very low	45.9	Very low	72 Å²	72	118.9 Å²	118.9	39%	0.385	62%	0.621	S	S	.	*	H	α-helix	trans	-75	-35.2	-173.6	-64.7	-34.8	0	0	0	113.5	T316 S321 R322 A323	T316-D319 PolarHBondContact O-N 3.24Å; D319-S321 VanDerWaalsContact C-N 3.33Å; D319-S321 PolarHBondContact O-N 2.82Å; D319-R322 PolarHBondContact O-N 3.28Å; D319-R322 IonicContact OD1-CZ 3.31Å; D319-R322 IonicContact OD1-NE 3.18Å; D319-R322 PolarHBondContact OD1-NE 3.2Å; D319-R322 IonicContact OD1-NH2 3.81Å; D319-R322 PolarHBondContact OD1-NH2 3.13Å; D319-A323 PolarHBondContact O-N 2.68Å
320	V	55	Low	46.8	Very low	84 Å²	84	117.5 Å²	117.5	51%	0.509	62%	0.617	S	S	.	*	H	α-helix	trans	-60.1	-44.9	169.6	174.5	0	0	0	0	110.6	T316 R322 A323 F324	T316-V320 WeakPolarHBondContact O-CG2 3.26Å; T316-V320 PolarHBondContact O-N 3.26Å; V320-R322 PolarHBondContact O-N 3.38Å; V320-A323 PolarHBondContact O-N 3.25Å; V320-F324 HydrophobicContact CG1-CD2 4.14Å; V320-F324 HydrophobicContact CG1-CE2 3.83Å; V320-F324 VanDerWaalsContact O-CD2 3.25Å; V320-F324 WeakPolarHBondContact O-CD2 3.47Å; V320-F324 PolarHBondContact O-N 3.2Å
321	S	57.4	Low	47.6	Very low	71 Å²	71	114.7 Å²	114.7	50%	0.497	61%	0.608	S	S	.	*	H	α-helix	trans	-62.6	-43.8	177.6	-54.3	0	0	0	0	111.5	N317 G318 D319 A323 F324 D325	N317-S321 PolarHBondContact O-N 3.28Å; N317-S321 PolarHBondContact O-OG 2.9Å; G318-S321 WeakPolarHBondContact O-CB 3.23Å; G318-S321 PolarHBondContact O-N 2.91Å; D319-S321 VanDerWaalsContact C-N 3.33Å; D319-S321 PolarHBondContact O-N 2.82Å; S321-A323 VanDerWaalsContact C-N 3.29Å; S321-A323 PolarHBondContact O-N 3.35Å; S321-F324 PolarHBondContact O-N 3.26Å; S321-D325 PolarHBondContact O-N 3.12Å; S321-D325 VanDerWaalsContact O-N 3.12Å
322	R	51.3	Low	48.3	Very low	158 Å²	158	110.6 Å²	110.6	60%	0.596	60%	0.595	S	S	*	*	H	α-helix	trans	-59.6	-37.3	177.9	-139.3	-168.4	-54	-128.3	7.4	112.5	G318 D319 V320 T326	G318-R322 WeakPolarHBondContact O-CB 3.48Å; G318-R322 PolarHBondContact O-N 3.41Å; D319-R322 PolarHBondContact O-N 3.28Å; D319-R322 IonicContact OD1-CZ 3.31Å; D319-R322 IonicContact OD1-NE 3.18Å; D319-R322 PolarHBondContact OD1-NE 3.2Å; D319-R322 IonicContact OD1-NH2 3.81Å; D319-R322 PolarHBondContact OD1-NH2 3.13Å; V320-R322 PolarHBondContact O-N 3.38Å; R322-T326 WeakPolarHBondContact O-CB 3.5Å; R322-T326 PolarHBondContact O-N 3.34Å; R322-T326 VanDerWaalsContact O-N 3.07Å; R322-T326 PolarHBondContact O-OG1 3.06Å
323	A	51.9	Low	49.2	Very low	52 Å²	52	108.8 Å²	108.8	43%	0.43	60%	0.598	S	S	.	*	H	α-helix	trans	-66.3	-42.4	178.2	0	0	0	0	0	112.4	D319 V320 S321 T326 L327	D319-A323 PolarHBondContact O-N 2.68Å; V320-A323 PolarHBondContact O-N 3.25Å; S321-A323 VanDerWaalsContact C-N 3.29Å; S321-A323 PolarHBondContact O-N 3.35Å; A323-T326 PolarHBondContact O-N 3.36Å; A323-L327 WeakPolarHBondContact O-CG 3.45Å; A323-L327 PolarHBondContact O-N 2.87Å; A323-L327 VanDerWaalsContact O-N 3.08Å
324	F	62.7	Low	49.5	Very low	141 Å²	141	103.1 Å²	103.1	62%	0.618	59%	0.588	S	S	*	*	H	α-helix	trans	-68.5	-40.6	176.6	-73.8	-66.6	0	0	0	112.8	V320 S321 T326 L327 A328	V320-F324 HydrophobicContact CG1-CD2 4.14Å; V320-F324 HydrophobicContact CG1-CE2 3.83Å; V320-F324 VanDerWaalsContact O-CD2 3.25Å; V320-F324 WeakPolarHBondContact O-CD2 3.47Å; V320-F324 PolarHBondContact O-N 3.2Å; S321-F324 PolarHBondContact O-N 3.26Å; F324-T326 VanDerWaalsContact C-N 3.28Å; F324-T326 PolarHBondContact O-N 3.33Å; F324-L327 PolarHBondContact O-N 3.02Å; F324-A328 WeakPolarHBondContact O-CB 3.3Å; F324-A328 PolarHBondContact O-N 3.5Å
325	D	56.5	Low	49.6	Very low	106 Å²	106	103.9 Å²	103.9	57%	0.567	59%	0.59	S	S	*	*	H	α-helix	trans	-61.1	-36.7	173.3	-84.6	-0.4	0	0	0	112.3	S321 A328 K329	S321-D325 PolarHBondContact O-N 3.12Å; S321-D325 VanDerWaalsContact O-N 3.12Å; D325-A328 PolarHBondContact O-N 2.94Å; D325-K329 WeakPolarHBondContact O-CG 3.47Å; D325-K329 PolarHBondContact O-N 3.48Å; D325-K329 VanDerWaalsContact O-N 3.1Å
326	T	60.4	Low	49.4	Very low	92 Å²	92	102.7 Å²	102.7	56%	0.564	60%	0.596	S	S	*	*	H	α-helix	trans	-68.1	-41.5	177.7	-56.2	0	0	0	0	111.3	R322 A323 F324 K329 A330	R322-T326 WeakPolarHBondContact O-CB 3.5Å; R322-T326 PolarHBondContact O-N 3.34Å; R322-T326 VanDerWaalsContact O-N 3.07Å; R322-T326 PolarHBondContact O-OG1 3.06Å; A323-T326 PolarHBondContact O-N 3.36Å; F324-T326 VanDerWaalsContact C-N 3.28Å; F324-T326 PolarHBondContact O-N 3.33Å; T326-K329 PolarHBondContact O-N 3.01Å; T326-A330 PolarHBondContact O-N 3.28Å; T326-A330 VanDerWaalsContact O-N 3.12Å
327	L	54.3	Low	49	Very low	91 Å²	91	104.8 Å²	104.8	48%	0.476	61%	0.609	S	S	.	*	H	α-helix	trans	-65.2	-41.1	173.5	-71.8	166.8	0	0	0	112.1	A323 F324 K329 A330 L331	A323-L327 WeakPolarHBondContact O-CG 3.45Å; A323-L327 PolarHBondContact O-N 2.87Å; A323-L327 VanDerWaalsContact O-N 3.08Å; F324-L327 PolarHBondContact O-N 3.02Å; L327-K329 VanDerWaalsContact C-N 3.33Å; L327-K329 PolarHBondContact O-N 3.03Å; L327-A330 PolarHBondContact O-N 3.3Å; L327-L331 WeakPolarHBondContact O-CG 3.32Å; L327-L331 PolarHBondContact O-N 3.44Å
328	A	55.2	Low	48.4	Very low	53 Å²	53	103.4 Å²	103.4	44%	0.438	61%	0.614	S	S	.	*	H	α-helix	trans	-62.6	-38.5	178.1	0	0	0	0	0	112.6	F324 D325 L331 N332	F324-A328 WeakPolarHBondContact O-CB 3.3Å; F324-A328 PolarHBondContact O-N 3.5Å; D325-A328 PolarHBondContact O-N 2.94Å; A328-L331 PolarHBondContact O-N 3.4Å; A328-N332 PolarHBondContact O-ND2 2.86Å
329	K	50.6	Low	47.2	Very low	164 Å²	164	107.8 Å²	107.8	71%	0.713	64%	0.636	S	S	*	*	H	α-helix	trans	-69	-37.4	174.6	-74.9	174.9	178.9	176.2	0	113	D325 T326 L327 L331 N332	D325-K329 WeakPolarHBondContact O-CG 3.47Å; D325-K329 PolarHBondContact O-N 3.48Å; D325-K329 VanDerWaalsContact O-N 3.1Å; T326-K329 PolarHBondContact O-N 3.01Å; L327-K329 VanDerWaalsContact C-N 3.33Å; L327-K329 PolarHBondContact O-N 3.03Å; K329-L331 PolarHBondContact O-N 3.47Å; K329-N332 PolarHBondContact O-N 2.91Å
330	A	48.1	Very low	46.4	Very low	81 Å²	81	113.7 Å²	113.7	67%	0.669	66%	0.662	S	S	*	*	H	α-helix	trans	-65.2	-20.5	177.3	0	0	0	0	0	113.6	T326 L327	T326-A330 PolarHBondContact O-N 3.28Å; T326-A330 VanDerWaalsContact O-N 3.12Å; L327-A330 PolarHBondContact O-N 3.3Å
331	L	43.3	Very low	45	Very low	130 Å²	130	115.7 Å²	115.7	68%	0.681	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-7.2	-176.4	-68.3	168.6	0	0	0	114.7	L327 A328 K329	L327-L331 WeakPolarHBondContact O-CG 3.32Å; L327-L331 PolarHBondContact O-N 3.44Å; A328-L331 PolarHBondContact O-N 3.4Å; K329-L331 PolarHBondContact O-N 3.47Å
332	N	47	Very low	43.7	Very low	125 Å²	125	117.3 Å²	117.3	67%	0.668	69%	0.691	S	S	*	*			trans	-137.5	79.5	-176.2	-64.2	-82.2	0	0	0	112.5	A328 K329 G334	A328-N332 PolarHBondContact O-ND2 2.86Å; K329-N332 PolarHBondContact O-N 2.91Å; N332-G334 VanDerWaalsContact C-N 3.34Å; N332-G334 PolarHBondContact O-N 3.15Å
333	P	51.8	Low	42.5	Very low	132 Å²	132	117.1 Å²	117.1	86%	0.857	71%	0.707	S	S	*	*			trans	-89.2	49.4	-176.1	37.1	-37.1	0	0	0	113.6
334	G	40.8	Very low	41.5	Very low	60 Å²	60	119.2 Å²	119.2	62%	0.619	72%	0.724	S	S	*	*			trans	-150.3	146.1	-176.8	0	0	0	0	0	115	N332	N332-G334 VanDerWaalsContact C-N 3.34Å; N332-G334 PolarHBondContact O-N 3.15Å
335	E	34.6	Very low	39.8	Very low	193 Å²	193	115.9 Å²	115.9	90%	0.902	73%	0.73	S	S	*	*			trans	57.7	108.3	173	-54.7	-170.7	156.2	0	0	115.7
336	S	32.7	Very low	38.5	Very low	108 Å²	108	119.5 Å²	119.5	76%	0.755	75%	0.745	S	S	*	*			cis	-158.1	129.4	33.5	-66.6	0	0	0	0	115.2
337	T	32.5	Very low	37.2	Very low	131 Å²	131	124.2 Å²	124.2	80%	0.804	76%	0.761	S	S	*	*				40.4	112.3	126.7	-42.7	0	0	0	0	122.2
338	A	31	Very low	35.9	Very low	88 Å²	88	123.4 Å²	123.4	73%	0.727	77%	0.774	S	S	*	*			trans	62.3	150.6	146.9	0	0	0	0	0	118.8
339	C	24.8	Very low	34.8	Very low	131 Å²	131	126.2 Å²	126.2	89%	0.885	79%	0.791	S	S	*	*			cis	-126.9	168.4	25.8	-70.8	0	0	0	0	115.1
340	Q	32.4	Very low	33.8	Very low	197 Å²	197	124.8 Å²	124.8	92%	0.921	80%	0.796	S	S	*	*			trans	-89.1	147.2	-179	-57.9	166.1	-1.4	0	0	112.2
341	S	26.6	Very low	32.8	Very low	126 Å²	126	129 Å²	129	88%	0.881	80%	0.801	S	S	*	*				-163.3	147.4	121.1	-165.2	0	0	0	0	110.9
342	S	29.7	Very low	32.2	Very low	105 Å²	105	130.3 Å²	130.3	73%	0.734	81%	0.808	S	S	*	*			trans	-115.5	136.8	-174.8	57	0	0	0	0	112.5
343	V	26.5	Very low	31.6	Very low	153 Å²	153	132.2 Å²	132.2	93%	0.927	82%	0.816	S	S	*	*			trans	-141.8	149.1	141.3	-169.5	0	0	0	0	107.5
344	A	29.9	Very low	30.9	Very low	97 Å²	97	132.7 Å²	132.7	80%	0.802	82%	0.817	S	S	*	*			trans	-100.2	155.4	-172.3	0	0	0	0	0	114.1
345	G	26.9	Very low	30.3	Very low	71 Å²	71	133.2 Å²	133.2	73%	0.732	82%	0.823	S	S	*	*			trans	89.6	101.3	145.1	0	0	0	0	0	118.7
346	M	29.8	Very low	30.3	Very low	181 Å²	181	131.4 Å²	131.4	89%	0.892	82%	0.819	S	S	*	*				-162.3	144.7	127.2	-161.8	57.2	63.6	0	0	109.9	G348	M346-G348 PolarHBondContact O-N 2.66Å
347	E	33.3	Very low	30.4	Very low	192 Å²	192	131 Å²	131	90%	0.897	82%	0.816	S	S	*	*			trans	-77	115.1	172.6	-66.9	-173.7	136.4	0	0	110.6	S349	E347-S349 PolarHBondContact O-N 3.28Å
348	G	27	Very low	30.8	Very low	73 Å²	73	130.4 Å²	130.4	75%	0.753	82%	0.817	S	S	*	*			trans	-96.2	85.6	-179.6	0	0	0	0	0	112.5	M346 V350	M346-G348 PolarHBondContact O-N 2.66Å; G348-V350 PolarHBondContact O-N 2.93Å
349	S	30.7	Very low	31.3	Very low	112 Å²	112	131.5 Å²	131.5	78%	0.783	81%	0.81	S	S	*	*			trans	-61	120.7	174	-178.1	0	0	0	0	111.4	E347	E347-S349 PolarHBondContact O-N 3.28Å
350	V	30.1	Very low	32	Very low	135 Å²	135	132.2 Å²	132.2	82%	0.818	81%	0.805	S	S	*	*			trans	-101.9	110.6	168.1	178.9	0	0	0	0	108	G348 L352	G348-V350 PolarHBondContact O-N 2.93Å; V350-L352 PolarHBondContact O-N 3.11Å
351	H	28	Very low	32.4	Very low	170 Å²	170	132.4 Å²	132.4	79%	0.787	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-64.2	118.3	-174.5	-131.3	-66.1	0	0	0	111.4
352	L	30.4	Very low	33.5	Very low	157 Å²	157	132.4 Å²	132.4	82%	0.822	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-70.1	138.1	160.2	-75.3	166.6	0	0	0	108.9	V350	V350-L352 PolarHBondContact O-N 3.11Å
353	I	34.8	Very low	34.4	Very low	165 Å²	165	136.1 Å²	136.1	85%	0.846	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-87.2	128.8	166.7	-65.7	178	0	0	0	107.6	G355	I353-G355 PolarHBondContact O-N 3.26Å
354	T	36	Very low	35.5	Very low	141 Å²	141	135.7 Å²	135.7	87%	0.865	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-63.1	119	178.8	-55.8	0	0	0	0	111.3
355	G	28.7	Very low	36.4	Very low	72 Å²	72	140.5 Å²	140.5	74%	0.742	79%	0.791	S	S	*	*			trans	-140.2	118.8	167.3	0	0	0	0	0	108.5	I353	I353-G355 PolarHBondContact O-N 3.26Å
356	D	35.3	Very low	38.1	Very low	155 Å²	155	139.6 Å²	139.6	83%	0.829	78%	0.781	S	S	*	*			trans	-86.3	117.6	-162.5	-167	6.2	0	0	0	113.2
357	S	33.7	Very low	39.8	Very low	100 Å²	100	136.7 Å²	136.7	70%	0.699	78%	0.776	S	S	*	*			trans	-169.6	124.6	160.7	-84.6	0	0	0	0	111.1	I359	S357-I359 VanDerWaalsContact C-N 3.35Å; S357-I359 PolarHBondContact O-N 3.18Å
358	S	41.1	Very low	41.4	Very low	117 Å²	117	133.2 Å²	133.2	82%	0.818	76%	0.763	S	S	*	*			trans	-79	66.7	-170.9	49.1	0	0	0	0	114.9	N360	S358-N360 PolarHBondContact O-N 3.07Å; S358-N360 VanDerWaalsContact O-N 3.16Å
359	I	41.7	Very low	43.5	Very low	112 Å²	112	133.1 Å²	133.1	57%	0.574	75%	0.745	S	S	*	*			trans	-75.5	98.9	166.2	40.9	178.4	0	0	0	111.2	S357 Y361	S357-I359 VanDerWaalsContact C-N 3.35Å; S357-I359 PolarHBondContact O-N 3.18Å; I359-Y361 HydrophobicContact CB-CE2 4.4Å; I359-Y361 HydrophobicContact CD1-CD2 4.5Å; I359-Y361 HydrophobicContact CD1-CE2 3.55Å; I359-Y361 HydrophobicContact CG1-CD2 4.33Å; I359-Y361 HydrophobicContact CG1-CE2 3.83Å; I359-Y361 WeakPolarHBondContact O-CD2 3.44Å; I359-Y361 PolarHBondContact O-N 2.73Å
360	N	38.7	Very low	45.6	Very low	145 Å²	145	130.6 Å²	130.6	78%	0.775	73%	0.727	S	S	*	*			trans	-58.5	95.2	169.2	-82.3	-59.2	0	0	0	111.3	S358 T362	S358-N360 PolarHBondContact O-N 3.07Å; S358-N360 VanDerWaalsContact O-N 3.16Å; N360-T362 PolarHBondContact O-N 3.38Å
361	Y	42.4	Very low	47.5	Very low	201 Å²	201	131.1 Å²	131.1	79%	0.788	73%	0.725	S	S	*	*			trans	-72.8	107.3	165.9	-81	-89.7	0	0	0	109	I359 E363	I359-Y361 HydrophobicContact CB-CE2 4.4Å; I359-Y361 HydrophobicContact CD1-CD2 4.5Å; I359-Y361 HydrophobicContact CD1-CE2 3.55Å; I359-Y361 HydrophobicContact CG1-CD2 4.33Å; I359-Y361 HydrophobicContact CG1-CE2 3.83Å; I359-Y361 WeakPolarHBondContact O-CD2 3.44Å; I359-Y361 PolarHBondContact O-N 2.73Å; Y361-E363 VanDerWaalsContact C-N 3.28Å; Y361-E363 PolarHBondContact O-N 3.49Å
362	T	49.1	Very low	49.4	Very low	126 Å²	126	127.4 Å²	127.4	77%	0.773	72%	0.719	S	S	*	*			trans	-79	84.5	167.4	-46.9	0	0	0	0	108.4	N360 K364	N360-T362 PolarHBondContact O-N 3.38Å; T362-K364 PolarHBondContact O-N 3.43Å
363	E	49.2	Very low	51.5	Low	184 Å²	184	121 Å²	121	86%	0.86	68%	0.684	S	S	*	*			trans	-60.9	108.8	172.8	-174	160.2	-138.3	0	0	109.3	Y361	Y361-E363 VanDerWaalsContact C-N 3.28Å; Y361-E363 PolarHBondContact O-N 3.49Å
364	K	48	Very low	53.3	Low	144 Å²	144	118.4 Å²	118.4	63%	0.626	68%	0.676	S	S	*	*			trans	-101.2	89.4	174.6	-100.4	-130.4	167.2	-158.3	0	108.1	T362 G366	T362-K364 PolarHBondContact O-N 3.43Å; K364-G366 PolarHBondContact O-N 3.1Å
365	E	49.1	Very low	54.8	Low	198 Å²	198	115.4 Å²	115.4	93%	0.925	67%	0.666	S	S	*	*			trans	-60.7	131.1	170.4	-167.4	178.1	-173.3	0	0	110.2
366	G	62.5	Low	57	Low	51 Å²	51	116 Å²	116	53%	0.526	65%	0.648	S	S	.	*	S	Bend	trans	118.5	166.2	-179.3	0	0	0	0	0	114.5	K364 L368	K364-G366 PolarHBondContact O-N 3.1Å; G366-L368 PolarHBondContact O-N 3.46Å
367	P	65.5	Low	58.9	Low	121 Å²	121	118.3 Å²	118.3	79%	0.786	65%	0.645	S	S	*	*			trans	-60.6	131	-178.7	-24.8	35.5	0	0	0	113	L369	P367-L369 WeakPolarHBondContact CB-O 3.23Å; P367-L369 PolarHBondContact O-N 3.45Å
368	L	66.4	Low	61	Low	118 Å²	118	116.5 Å²	116.5	62%	0.618	63%	0.627	S	S	*	*	S	Bend	trans	-63.2	-22.7	176.7	-70.9	169.2	0	0	0	113.2	G366 S413	G366-L368 PolarHBondContact O-N 3.46Å; L368-S413 WeakPolarHBondContact CD2-OG 3.25Å
369	L	72	Confident	62.7	Low	72 Å²	72	115.1 Å²	115.1	38%	0.377	61%	0.613	S	S	.	*	S	Bend	trans	-126.8	129.6	176.6	-57.9	176.1	0	0	0	108.5	P367 H373 I411	P367-L369 WeakPolarHBondContact CB-O 3.23Å; P367-L369 PolarHBondContact O-N 3.45Å; L369-H373 HydrophobicContact CB-CB 4.4Å; L369-H373 HydrophobicContact CD2-CB 4.19Å; L369-I411 HydrophobicContact CD2-CD1 3.53Å; L369-I411 HydrophobicContact CD2-CG1 3.78Å; L369-I411 HydrophobicContact CD2-CG2 4.4Å
370	S	74.1	Confident	64.4	Low	59 Å²	59	113.7 Å²	113.7	41%	0.413	61%	0.606	S	S	.	*			trans	-88	161.5	163.4	56.5	0	0	0	0	110.6	S372 H373	S370-S372 PolarHBondContact O-N 3.36Å; S370-S372 PolarHBondContact OG-OG 3.12Å; S370-H373 WeakPolarHBondContact O-CB 3.34Å; S370-H373 PolarHBondContact O-N 3.27Å; S370-H373 PolarHBondContact OG-CE1 3.27Å; S370-H373 PolarHBondContact OG-ND1 3.31Å
371	D	71.4	Confident	66	Low	145 Å²	145	107.3 Å²	107.3	78%	0.775	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-54.8	-30.6	-177.9	-50.8	-51.8	0	0	0	113.8	H373 V374	D371-H373 PolarHBondContact O-N 3.12Å; D371-H373 VanDerWaalsContact O-N 3.12Å; D371-V374 WeakPolarHBondContact O-CB 3.42Å; D371-V374 PolarHBondContact O-N 3.37Å
372	S	67.4	Low	67.2	Low	93 Å²	93	103.4 Å²	103.4	65%	0.65	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-59	-19.5	172.9	54.8	0	0	0	0	114.6	S370	S370-S372 PolarHBondContact O-N 3.36Å; S370-S372 PolarHBondContact OG-OG 3.12Å
373	H	74.6	Confident	67.9	Low	21 Å²	21	102.9 Å²	102.9	10%	0.097	57%	0.573	C	S	.	*	G	3₁₀ helix	trans	-89.6	-10.7	173.9	-64.2	89.9	0	0	0	113.2	L369 S370 D371 W407 S410 I411	L369-H373 HydrophobicContact CB-CB 4.4Å; L369-H373 HydrophobicContact CD2-CB 4.19Å; S370-H373 WeakPolarHBondContact O-CB 3.34Å; S370-H373 PolarHBondContact O-N 3.27Å; S370-H373 PolarHBondContact OG-CE1 3.27Å; S370-H373 PolarHBondContact OG-ND1 3.31Å; D371-H373 PolarHBondContact O-N 3.12Å; D371-H373 VanDerWaalsContact O-N 3.12Å; H373-W407 PolarHBondContact O-NE1 3.21Å; H373-S410 PolarHBondContact CD2-OG 3.25Å; H373-S410 PolarHBondContact NE2-OG 3.08Å; H373-I411 VanDerWaalsContact CD2-CG1 3.42Å; H373-I411 WeakPolarHBondContact CD2-CG1 3.35Å; H373-I411 PolarHBondContact NE2-N 3.26Å
374	V	72.3	Confident	68.9	Low	112 Å²	112	101.2 Å²	101.2	68%	0.679	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-28.1	176.2	-174.7	0	0	0	0	110.9	D371 F376	D371-V374 WeakPolarHBondContact O-CB 3.42Å; D371-V374 PolarHBondContact O-N 3.37Å; V374-F376 PolarHBondContact O-N 2.94Å; V374-F376 VanDerWaalsContact O-N 3.12Å
375	A	68.4	Low	70.2	Confident	78 Å²	78	96.8 Å²	96.8	65%	0.645	55%	0.553	S	S	*	*			trans	-83.9	78.9	-175.6	0	0	0	0	0	114.1	R377	A375-R377 PolarHBondContact O-N 2.87Å; A375-R377 VanDerWaalsContact O-N 3.11Å
376	F	73.9	Confident	71.5	Confident	83 Å²	83	95 Å²	95	36%	0.364	54%	0.544	S	S	.	.			trans	-81.7	82.2	175.8	-164.8	-94.3	0	0	0	113	V374 L378 L400 L403 S404 W407	V374-F376 PolarHBondContact O-N 2.94Å; V374-F376 VanDerWaalsContact O-N 3.12Å; F376-L378 PolarHBondContact O-N 3.4Å; F376-L400 HydrophobicContact CE1-CD1 3.61Å; F376-L400 HydrophobicContact CZ-CD1 3.86Å; F376-L403 HydrophobicContact CE1-CD2 3.99Å; F376-L403 HydrophobicContact CE1-CG 4.46Å; F376-L403 HydrophobicContact CE2-CB 4.43Å; F376-L403 HydrophobicContact CE2-CD2 4.17Å; F376-L403 HydrophobicContact CE2-CG 3.83Å; F376-L403 HydrophobicContact CZ-CB 4.06Å; F376-L403 HydrophobicContact CZ-CD2 3.8Å; F376-L403 HydrophobicContact CZ-CG 3.76Å; F376-S404 WeakPolarHBondContact CZ-OG 3.37Å; F376-W407 HydrophobicContact CD2-CB 4.35Å; F376-W407 HydrophobicContact CD2-CG 4.14Å; F376-W407 HydrophobicContact CE2-CB 4.15Å; F376-W407 HydrophobicContact CE2-CG 4.36Å
377	R	74.3	Confident	72.1	Confident	205 Å²	205	100.7 Å²	100.7	77%	0.774	55%	0.551	S	S	*	*			trans	-91.8	90.5	-172.9	-163.9	175.5	-166.4	-98.2	4.4	113.7	A375	A375-R377 PolarHBondContact O-N 2.87Å; A375-R377 VanDerWaalsContact O-N 3.11Å
378	L	78.8	Confident	72.8	Confident	62 Å²	62	101.3 Å²	101.3	33%	0.325	55%	0.547	S	S	.	.			trans	-77.3	124.5	172.7	-177	67.2	0	0	0	111.9	F376 M380 R399 L400 L403	F376-L378 PolarHBondContact O-N 3.4Å; L378-M380 HydrophobicContact CD2-SD 4.07Å; L378-M380 HydrophobicContact CG-SD 4.49Å; L378-R399 HydrophobicContact CD1-CB 4.21Å; L378-L400 HydrophobicContact CD1-CB 4.35Å; L378-L400 HydrophobicContact CD2-CB 4.49Å; L378-L400 HydrophobicContact CD2-CD1 4.44Å; L378-L403 HydrophobicContact CB-CD2 4.36Å; L378-L403 HydrophobicContact CD1-CD2 4.22Å
379	T	77.6	Confident	73.6	Confident	87 Å²	87	99.7 Å²	99.7	53%	0.534	54%	0.539	S	S	.	.			trans	-100.5	111.9	172.3	-53.8	0	0	0	0	110.3	R399	T379-R399 PolarHBondContact O-NH1 3.31Å
380	M	76.1	Confident	74.2	Confident	83 Å²	83	101.7 Å²	101.7	41%	0.409	55%	0.554	S	S	.	*			trans	-63.9	157.1	176.6	-63.7	-59.4	-69.1	0	0	112.2	L378 Y392 S396 R399	L378-M380 HydrophobicContact CD2-SD 4.07Å; L378-M380 HydrophobicContact CG-SD 4.49Å; M380-Y392 HydrophobicContact CE-CE1 3.76Å; M380-Y392 WeakPolarHBondContact CE-OH 3.49Å; M380-S396 VanDerWaalsContact CE-OG 3.23Å; M380-S396 WeakPolarHBondContact CE-OG 3.43Å; M380-R399 PolarHBondContact O-NH1 3.46Å
381	P	72.6	Confident	74.5	Confident	11 Å²	11	106.3 Å²	106.3	7%	0.071	57%	0.569	C	S	.	*			trans	-61.8	146.4	168.9	-14.7	28	0	0	0	111.2	Y392 E395 S396	P381-Y392 HydrophobicContact CB-CD2 3.98Å; P381-Y392 HydrophobicContact CB-CE2 3.73Å; P381-Y392 HydrophobicContact CG-CD2 3.87Å; P381-Y392 HydrophobicContact CG-CE2 3.7Å; P381-E395 HydrophobicContact CG-CB 4.37Å; P381-E395 HydrophobicContact CG-CG 4.2Å; P381-S396 WeakPolarHBondContact CD-OG 3.37Å
382	S	67.7	Low	75.1	Confident	118 Å²	118	100.6 Å²	100.6	83%	0.825	54%	0.537	S	S	*	.	S	Bend	trans	-133.4	138.3	179.6	-174.4	0	0	0	0	109.6
383	P	63.9	Low	76.1	Confident	116 Å²	116	100.1 Å²	100.1	75%	0.753	53%	0.526	S	S	*	.	S	Bend	cis	-66.8	148.9	-0.9	29.5	-36	0	0	0	112.5
384	M	70	Confident	76.6	Confident	148 Å²	148	100.7 Å²	100.7	73%	0.729	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-69.3	127.1	171.4	-173.8	160.7	81.6	0	0	108.5	Y392	M384-Y392 WeakPolarHBondContact CG-OH 3.42Å
385	P	75.4	Confident	77.2	Confident	52 Å²	52	99.4 Å²	99.4	34%	0.338	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-70.7	145.6	-176.8	29.3	-35.6	0	0	0	111.3	Y387 Y392	P385-Y387 PolarHBondContact O-N 3.26Å; P385-Y387 VanDerWaalsContact O-N 3.16Å; P385-Y392 VanDerWaalsContact CD-CD2 3.4Å; P385-Y392 HydrophobicContact CG-CD1 4.1Å; P385-Y392 HydrophobicContact CG-CD2 3.75Å; P385-Y392 HydrophobicContact CG-CE2 4.19Å; P385-Y392 HydrophobicContact CG-CG 3.69Å
386	E	75.5	Confident	77.9	Confident	160 Å²	160	96.4 Å²	96.4	75%	0.748	50%	0.499	S	S	*	.	S	Bend	trans	-58.1	-26.9	178.7	-163.4	-172.5	147.4	0	0	112.9
387	Y	76.1	Confident	78.5	Confident	171 Å²	171	94.4 Å²	94.4	67%	0.671	50%	0.498	S	S	*	.	S	Bend	trans	-132.7	144.7	176.5	-54.5	-83.4	0	0	0	111.3	P385 N389	P385-Y387 PolarHBondContact O-N 3.26Å; P385-Y387 VanDerWaalsContact O-N 3.16Å; Y387-N389 PolarHBondContact O-N 2.86Å
388	L	80.6	Confident	79.1	Confident	134 Å²	134	88.2 Å²	88.2	70%	0.702	49%	0.486	S	S	*	.			trans	-71.4	95.8	-175.7	-172.6	70.9	0	0	0	112.1	Y392 I393	L388-Y392 HydrophobicContact CD1-CD1 4.08Å; L388-I393 HydrophobicContact CD1-CD1 4.42Å; L388-I393 HydrophobicContact CD1-CG1 3.92Å; L388-I393 HydrophobicContact CD2-CD1 4.04Å; L388-I393 HydrophobicContact CD2-CG1 4.34Å; L388-I393 HydrophobicContact CG-CD1 3.9Å; L388-I393 HydrophobicContact CG-CG1 3.96Å
389	N	83.5	Confident	79.5	Confident	83 Å²	83	89.6 Å²	89.6	44%	0.444	49%	0.487	S	S	.	.			trans	-87.9	143.4	-179.3	-171.5	-26.6	0	0	0	112.2	Y387 H391 Y392 I393	Y387-N389 PolarHBondContact O-N 2.86Å; N389-H391 PolarHBondContact O-N 2.91Å; N389-H391 PolarHBondContact OD1-CD2 2.88Å; N389-H391 PolarHBondContact OD1-N 3.16Å; N389-Y392 WeakPolarHBondContact O-CB 3.43Å; N389-Y392 PolarHBondContact O-N 3.29Å; N389-I393 PolarHBondContact O-N 3.43Å
390	V	84.8	Confident	79.9	Confident	115 Å²	115	88.9 Å²	88.9	70%	0.697	48%	0.479	S	S	*	.	H	α-helix	trans	-50.2	-37.7	171.3	179.8	0	0	0	0	112.3	I393 G394	V390-I393 PolarHBondContact O-N 3.21Å; V390-G394 PolarHBondContact O-N 3.43Å
391	H	79.4	Confident	80.4	Confident	155 Å²	155	91 Å²	91	72%	0.718	49%	0.492	S	S	*	.	H	α-helix	trans	-63.8	-42.6	176	-73.3	-88.2	0	0	0	112.5	N389 G394 E395	N389-H391 PolarHBondContact O-N 2.91Å; N389-H391 PolarHBondContact OD1-CD2 2.88Å; N389-H391 PolarHBondContact OD1-N 3.16Å; H391-G394 PolarHBondContact O-N 3.31Å; H391-E395 WeakPolarHBondContact O-CB 3.35Å; H391-E395 PolarHBondContact O-N 2.92Å
392	Y	85.2	Confident	81	Confident	25 Å²	25	97.1 Å²	97.1	10%	0.098	52%	0.517	C	S	.	.	H	α-helix	trans	-70.3	-37.8	178.1	-178.2	-99.3	0	0	0	112	M380 P381 M384 P385 L388 N389 S396	M380-Y392 HydrophobicContact CE-CE1 3.76Å; M380-Y392 WeakPolarHBondContact CE-OH 3.49Å; P381-Y392 HydrophobicContact CB-CD2 3.98Å; P381-Y392 HydrophobicContact CB-CE2 3.73Å; P381-Y392 HydrophobicContact CG-CD2 3.87Å; P381-Y392 HydrophobicContact CG-CE2 3.7Å; M384-Y392 WeakPolarHBondContact CG-OH 3.42Å; P385-Y392 VanDerWaalsContact CD-CD2 3.4Å; P385-Y392 HydrophobicContact CG-CD1 4.1Å; P385-Y392 HydrophobicContact CG-CD2 3.75Å; P385-Y392 HydrophobicContact CG-CE2 4.19Å; P385-Y392 HydrophobicContact CG-CG 3.69Å; L388-Y392 HydrophobicContact CD1-CD1 4.08Å; N389-Y392 WeakPolarHBondContact O-CB 3.43Å; N389-Y392 PolarHBondContact O-N 3.29Å; Y392-S396 VanDerWaalsContact O-CB 3.23Å; Y392-S396 WeakPolarHBondContact O-CB 3.44Å; Y392-S396 PolarHBondContact O-N 3.23Å; Y392-S396 PolarHBondContact O-OG 3.37Å
393	I	86.4	Confident	81.7	Confident	83 Å²	83	94.1 Å²	94.1	43%	0.426	49%	0.492	S	S	.	.	H	α-helix	trans	-60.2	-50.1	170.6	-63.9	164.4	0	0	0	109.9	L388 N389 V390 S396 A397	L388-I393 HydrophobicContact CD1-CD1 4.42Å; L388-I393 HydrophobicContact CD1-CG1 3.92Å; L388-I393 HydrophobicContact CD2-CD1 4.04Å; L388-I393 HydrophobicContact CD2-CG1 4.34Å; L388-I393 HydrophobicContact CG-CD1 3.9Å; L388-I393 HydrophobicContact CG-CG1 3.96Å; N389-I393 PolarHBondContact O-N 3.43Å; V390-I393 PolarHBondContact O-N 3.21Å; I393-S396 PolarHBondContact O-N 3.19Å; I393-A397 VanDerWaalsContact O-CB 3.26Å; I393-A397 WeakPolarHBondContact O-CB 3.45Å; I393-A397 PolarHBondContact O-N 3.32Å
394	G	87.1	Confident	82.7	Confident	34 Å²	34	90.9 Å²	90.9	35%	0.351	47%	0.472	S	S	.	.	H	α-helix	trans	-63.2	-42.4	-178.3	0	0	0	0	0	113.1	V390 H391 S398	V390-G394 PolarHBondContact O-N 3.43Å; H391-G394 PolarHBondContact O-N 3.31Å; G394-S398 WeakPolarHBondContact O-CB 3.36Å; G394-S398 PolarHBondContact O-N 2.95Å; G394-S398 PolarHBondContact O-OG 3.44Å
395	E	83.3	Confident	83.4	Confident	84 Å²	84	89.3 Å²	89.3	39%	0.393	46%	0.464	S	S	.	.	H	α-helix	trans	-65.1	-47.4	174.8	-165.5	-168.7	159.8	0	0	111.4	P381 H391 A397 S398 R399	P381-E395 HydrophobicContact CG-CB 4.37Å; P381-E395 HydrophobicContact CG-CG 4.2Å; H391-E395 WeakPolarHBondContact O-CB 3.35Å; H391-E395 PolarHBondContact O-N 2.92Å; E395-A397 PolarHBondContact O-N 3.26Å; E395-S398 PolarHBondContact O-N 3.37Å; E395-S398 VanDerWaalsContact O-N 3.15Å; E395-R399 WeakPolarHBondContact O-CG 3.41Å; E395-R399 PolarHBondContact O-N 3.34Å; E395-R399 IonicContact OE1-CZ 2.66Å; E395-R399 IonicContact OE1-NE 3.31Å; E395-R399 PolarHBondContact OE1-NE 3.3Å; E395-R399 IonicContact OE1-NH2 2.93Å; E395-R399 PolarHBondContact OE1-NH2 2.96Å
396	S	84.5	Confident	83.6	Confident	15 Å²	15	91.8 Å²	91.8	11%	0.105	47%	0.471	C	S	.	.	H	α-helix	trans	-63	-40.9	180	-56.8	0	0	0	0	112	M380 P381 Y392 I393 R399 L400	M380-S396 VanDerWaalsContact CE-OG 3.23Å; M380-S396 WeakPolarHBondContact CE-OG 3.43Å; P381-S396 WeakPolarHBondContact CD-OG 3.37Å; Y392-S396 VanDerWaalsContact O-CB 3.23Å; Y392-S396 WeakPolarHBondContact O-CB 3.44Å; Y392-S396 PolarHBondContact O-N 3.23Å; Y392-S396 PolarHBondContact O-OG 3.37Å; I393-S396 PolarHBondContact O-N 3.19Å; S396-R399 PolarHBondContact O-N 3.26Å; S396-L400 WeakPolarHBondContact O-CB 3.28Å; S396-L400 PolarHBondContact O-N 3.21Å
397	A	85.7	Confident	84.1	Confident	42 Å²	42	88.4 Å²	88.4	35%	0.347	45%	0.451	S	S	.	.	H	α-helix	trans	-65.6	-38.4	173.6	0	0	0	0	0	112.3	I393 E395 L400 L401	I393-A397 VanDerWaalsContact O-CB 3.26Å; I393-A397 WeakPolarHBondContact O-CB 3.45Å; I393-A397 PolarHBondContact O-N 3.32Å; E395-A397 PolarHBondContact O-N 3.26Å; A397-L400 PolarHBondContact O-N 2.95Å; A397-L401 WeakPolarHBondContact O-CB 3.37Å; A397-L401 VanDerWaalsContact O-CG 3.3Å; A397-L401 WeakPolarHBondContact O-CG 3.29Å; A397-L401 PolarHBondContact O-N 3.49Å
398	S	88	Confident	84.4	Confident	75 Å²	75	81.6 Å²	81.6	52%	0.524	43%	0.43	S	S	.	.	H	α-helix	trans	-66.7	-43.1	176.5	-59	0	0	0	0	111.8	G394 E395 L401 F402	G394-S398 WeakPolarHBondContact O-CB 3.36Å; G394-S398 PolarHBondContact O-N 2.95Å; G394-S398 PolarHBondContact O-OG 3.44Å; E395-S398 PolarHBondContact O-N 3.37Å; E395-S398 VanDerWaalsContact O-N 3.15Å; S398-L401 PolarHBondContact O-N 3.27Å; S398-F402 WeakPolarHBondContact O-CB 3.35Å; S398-F402 PolarHBondContact O-N 2.88Å
399	R	85.4	Confident	84.3	Confident	91 Å²	91	79.4 Å²	79.4	34%	0.343	42%	0.419	S	S	.	.	H	α-helix	trans	-59.4	-46.1	172.7	-71.5	173.8	178	-139.5	3.8	111.1	L378 T379 M380 E395 S396 L403	L378-R399 HydrophobicContact CD1-CB 4.21Å; T379-R399 PolarHBondContact O-NH1 3.31Å; M380-R399 PolarHBondContact O-NH1 3.46Å; E395-R399 WeakPolarHBondContact O-CG 3.41Å; E395-R399 PolarHBondContact O-N 3.34Å; E395-R399 IonicContact OE1-CZ 2.66Å; E395-R399 IonicContact OE1-NE 3.31Å; E395-R399 PolarHBondContact OE1-NE 3.3Å; E395-R399 IonicContact OE1-NH2 2.93Å; E395-R399 PolarHBondContact OE1-NH2 2.96Å; S396-R399 PolarHBondContact O-N 3.26Å; R399-L403 VanDerWaalsContact O-CB 3.29Å; R399-L403 WeakPolarHBondContact O-CB 3.37Å; R399-L403 PolarHBondContact O-N 3.31Å
400	L	86.4	Confident	84	Confident	72 Å²	72	77.6 Å²	77.6	38%	0.377	41%	0.413	S	S	.	.	H	α-helix	trans	-60.4	-50.8	177.2	175.7	60.5	0	0	0	111.9	F376 L378 S396 A397 F402 L403 S404	F376-L400 HydrophobicContact CE1-CD1 3.61Å; F376-L400 HydrophobicContact CZ-CD1 3.86Å; L378-L400 HydrophobicContact CD1-CB 4.35Å; L378-L400 HydrophobicContact CD2-CB 4.49Å; L378-L400 HydrophobicContact CD2-CD1 4.44Å; S396-L400 WeakPolarHBondContact O-CB 3.28Å; S396-L400 PolarHBondContact O-N 3.21Å; A397-L400 PolarHBondContact O-N 2.95Å; L400-F402 PolarHBondContact O-N 2.91Å; L400-L403 PolarHBondContact O-N 3.2Å; L400-S404 WeakPolarHBondContact O-CB 3.27Å; L400-S404 PolarHBondContact O-N 3.46Å; L400-S404 PolarHBondContact O-OG 3.12Å; L400-S404 VanDerWaalsContact O-OG 3.06Å
401	L	87.5	Confident	83.9	Confident	128 Å²	128	72.4 Å²	72.4	67%	0.67	38%	0.381	S	S	*	.	H	α-helix	trans	-60.8	-43.1	179.4	-74.1	166.7	0	0	0	112.4	A397 S398 M405	A397-L401 WeakPolarHBondContact O-CB 3.37Å; A397-L401 VanDerWaalsContact O-CG 3.3Å; A397-L401 WeakPolarHBondContact O-CG 3.29Å; A397-L401 PolarHBondContact O-N 3.49Å; S398-L401 PolarHBondContact O-N 3.27Å; L401-M405 PolarHBondContact O-N 3.25Å
402	F	84.6	Confident	83.8	Confident	139 Å²	139	67.8 Å²	67.8	61%	0.61	37%	0.365	S	S	*	.	H	α-helix	trans	-65.6	-43.1	177.1	-173.6	-94.5	0	0	0	111.9	S398 L400 M405 H406	S398-F402 WeakPolarHBondContact O-CB 3.35Å; S398-F402 PolarHBondContact O-N 2.88Å; L400-F402 PolarHBondContact O-N 2.91Å; F402-M405 PolarHBondContact O-N 2.94Å; F402-H406 PolarHBondContact O-N 3.11Å
403	L	82.6	Confident	83.4	Confident	55 Å²	55	68.7 Å²	68.7	29%	0.288	38%	0.375	S	S	.	.	H	α-helix	trans	-65.8	-41.4	177.8	-172.8	62.7	0	0	0	111.9	F376 L378 R399 L400 M405 H406 W407	F376-L403 HydrophobicContact CE1-CD2 3.99Å; F376-L403 HydrophobicContact CE1-CG 4.46Å; F376-L403 HydrophobicContact CE2-CB 4.43Å; F376-L403 HydrophobicContact CE2-CD2 4.17Å; F376-L403 HydrophobicContact CE2-CG 3.83Å; F376-L403 HydrophobicContact CZ-CB 4.06Å; F376-L403 HydrophobicContact CZ-CD2 3.8Å; F376-L403 HydrophobicContact CZ-CG 3.76Å; L378-L403 HydrophobicContact CB-CD2 4.36Å; L378-L403 HydrophobicContact CD1-CD2 4.22Å; R399-L403 VanDerWaalsContact O-CB 3.29Å; R399-L403 WeakPolarHBondContact O-CB 3.37Å; R399-L403 PolarHBondContact O-N 3.31Å; L400-L403 PolarHBondContact O-N 3.2Å; L403-M405 VanDerWaalsContact C-N 3.33Å; L403-M405 PolarHBondContact O-N 3.22Å; L403-H406 PolarHBondContact O-N 3.41Å; L403-W407 VanDerWaalsContact O-CB 3.28Å; L403-W407 WeakPolarHBondContact O-CB 3.15Å; L403-W407 PolarHBondContact O-N 2.76Å
404	S	85.3	Confident	82.8	Confident	47 Å²	47	70.2 Å²	70.2	33%	0.329	38%	0.379	S	S	.	.	H	α-helix	trans	-60.5	-40.5	173.1	-64.9	0	0	0	0	112.3	F376 L400 A408	F376-S404 WeakPolarHBondContact CZ-OG 3.37Å; L400-S404 WeakPolarHBondContact O-CB 3.27Å; L400-S404 PolarHBondContact O-N 3.46Å; L400-S404 PolarHBondContact O-OG 3.12Å; L400-S404 VanDerWaalsContact O-OG 3.06Å; S404-A408 WeakPolarHBondContact O-CB 3.26Å; S404-A408 PolarHBondContact O-N 3.33Å
405	M	83.6	Confident	82	Confident	115 Å²	115	73 Å²	73	57%	0.567	38%	0.383	S	S	*	.	H	α-helix	trans	-68.1	-42.4	175.7	-170.7	65.6	-175.7	0	0	111.8	L401 F402 L403 A408 L409	L401-M405 PolarHBondContact O-N 3.25Å; F402-M405 PolarHBondContact O-N 2.94Å; L403-M405 VanDerWaalsContact C-N 3.33Å; L403-M405 PolarHBondContact O-N 3.22Å; M405-A408 PolarHBondContact O-N 2.96Å; M405-L409 HydrophobicContact CE-CD1 4.03Å; M405-L409 HydrophobicContact CE-CD2 4.34Å; M405-L409 HydrophobicContact CE-CG 4.17Å; M405-L409 HydrophobicContact CG-CD1 4.17Å; M405-L409 WeakPolarHBondContact O-CB 3.4Å; M405-L409 VanDerWaalsContact O-CG 3.26Å; M405-L409 WeakPolarHBondContact O-CG 3.34Å; M405-L409 PolarHBondContact O-N 2.87Å
406	H	80	Confident	81.2	Confident	104 Å²	104	72 Å²	72	48%	0.481	39%	0.389	S	S	.	.	H	α-helix	trans	-64.5	-40.1	176.9	-172.2	-75.8	0	0	0	112	F402 L403 L409 S410	F402-H406 PolarHBondContact O-N 3.11Å; L403-H406 PolarHBondContact O-N 3.41Å; H406-L409 CarbonylContact O-C 3.58Å; H406-L409 PolarHBondContact O-N 3.16Å; H406-S410 PolarHBondContact O-N 3.13Å
407	W	85.7	Confident	80.3	Confident	89 Å²	89	77.3 Å²	77.3	34%	0.337	42%	0.415	S	S	.	.	H	α-helix	trans	-64.2	-45.1	174.2	176.1	90	0	0	0	112.3	H373 F376 L403 L409 S410 I411	H373-W407 PolarHBondContact O-NE1 3.21Å; F376-W407 HydrophobicContact CD2-CB 4.35Å; F376-W407 HydrophobicContact CD2-CG 4.14Å; F376-W407 HydrophobicContact CE2-CB 4.15Å; F376-W407 HydrophobicContact CE2-CG 4.36Å; L403-W407 VanDerWaalsContact O-CB 3.28Å; L403-W407 WeakPolarHBondContact O-CB 3.15Å; L403-W407 PolarHBondContact O-N 2.76Å; W407-L409 PolarHBondContact O-N 3.05Å; W407-S410 PolarHBondContact O-N 3.05Å; W407-S410 PolarHBondContact O-OG 3.46Å; W407-I411 HydrophobicContact CD2-CD1 4.4Å; W407-I411 HydrophobicContact CE3-CD1 4.24Å; W407-I411 HydrophobicContact CH2-CD1 3.92Å; W407-I411 HydrophobicContact CZ2-CD1 4.09Å; W407-I411 HydrophobicContact CZ3-CD1 4Å
408	A	82.8	Confident	79	Confident	28 Å²	28	77.8 Å²	77.8	23%	0.231	42%	0.424	C	S	.	.	H	α-helix	trans	-61.7	-35.4	174.3	0	0	0	0	0	111.8	S404 M405 F414	S404-A408 WeakPolarHBondContact O-CB 3.26Å; S404-A408 PolarHBondContact O-N 3.33Å; M405-A408 PolarHBondContact O-N 2.96Å; A408-F414 VanDerWaalsContact O-CB 3.27Å; A408-F414 WeakPolarHBondContact O-CB 3.42Å
409	L	78.6	Confident	77.4	Confident	88 Å²	88	81.9 Å²	81.9	46%	0.461	43%	0.432	S	S	.	.	H	α-helix	trans	-78.3	-18.1	177.1	-72.4	174.2	0	0	0	114.6	M405 H406 W407 Q415	M405-L409 HydrophobicContact CE-CD1 4.03Å; M405-L409 HydrophobicContact CE-CD2 4.34Å; M405-L409 HydrophobicContact CE-CG 4.17Å; M405-L409 HydrophobicContact CG-CD1 4.17Å; M405-L409 WeakPolarHBondContact O-CB 3.4Å; M405-L409 VanDerWaalsContact O-CG 3.26Å; M405-L409 WeakPolarHBondContact O-CG 3.34Å; M405-L409 PolarHBondContact O-N 2.87Å; H406-L409 CarbonylContact O-C 3.58Å; H406-L409 PolarHBondContact O-N 3.16Å; W407-L409 PolarHBondContact O-N 3.05Å; L409-Q415 WeakPolarHBondContact O-CG 3.44Å; L409-Q415 PolarHBondContact O-NE2 3.28Å
410	S	77.9	Confident	75.6	Confident	46 Å²	46	85 Å²	85	32%	0.322	45%	0.449	S	S	.	.	H	α-helix	trans	-77.2	-24.9	175.2	64.9	0	0	0	0	112.5	H373 H406 W407 P412	H373-S410 PolarHBondContact CD2-OG 3.25Å; H373-S410 PolarHBondContact NE2-OG 3.08Å; H406-S410 PolarHBondContact O-N 3.13Å; W407-S410 PolarHBondContact O-N 3.05Å; W407-S410 PolarHBondContact O-OG 3.46Å; S410-P412 WeakPolarHBondContact O-CD 3.41Å
411	I	82.9	Confident	73.6	Confident	5 Å²	5	90.5 Å²	90.5	3%	0.026	47%	0.469	C	S	.	.	S	Bend	trans	-69.1	119.4	176.2	-62	164.9	0	0	0	110	L369 H373 W407 S413 F414 Q415	L369-I411 HydrophobicContact CD2-CD1 3.53Å; L369-I411 HydrophobicContact CD2-CG1 3.78Å; L369-I411 HydrophobicContact CD2-CG2 4.4Å; H373-I411 VanDerWaalsContact CD2-CG1 3.42Å; H373-I411 WeakPolarHBondContact CD2-CG1 3.35Å; H373-I411 PolarHBondContact NE2-N 3.26Å; W407-I411 HydrophobicContact CD2-CD1 4.4Å; W407-I411 HydrophobicContact CE3-CD1 4.24Å; W407-I411 HydrophobicContact CH2-CD1 3.92Å; W407-I411 HydrophobicContact CZ2-CD1 4.09Å; W407-I411 HydrophobicContact CZ3-CD1 4Å; I411-S413 VanDerWaalsContact C-N 3.26Å; I411-S413 PolarHBondContact O-N 3.41Å; I411-S413 VanDerWaalsContact O-N 3.13Å; I411-F414 HydrophobicContact CB-CD2 3.9Å; I411-F414 HydrophobicContact CD1-CD2 4.09Å; I411-F414 HydrophobicContact CD1-CE2 4.13Å; I411-F414 HydrophobicContact CG2-CD2 3.78Å; I411-F414 HydrophobicContact CG2-CE2 4.35Å; I411-F414 PolarHBondContact O-N 2.79Å; I411-Q415 PolarHBondContact O-N 3.34Å
412	P	76.7	Confident	71.5	Confident	58 Å²	58	91.3 Å²	91.3	38%	0.377	47%	0.473	S	S	.	.	H	α-helix	trans	-58.6	-31.5	-173.6	-28.1	36.2	0	0	0	115.1	S410 Q415 A416	S410-P412 WeakPolarHBondContact O-CD 3.41Å; P412-Q415 WeakPolarHBondContact O-CB 3.2Å; P412-Q415 PolarHBondContact O-N 3.01Å; P412-A416 PolarHBondContact O-N 3.09Å; P412-A416 VanDerWaalsContact O-N 3.13Å
413	S	75.4	Confident	69.5	Low	45 Å²	45	91.6 Å²	91.6	32%	0.315	48%	0.479	S	S	.	.	H	α-helix	trans	-67.9	-35.2	-178.3	-50.6	0	0	0	0	112.8	L368 I411 A416 L417	L368-S413 WeakPolarHBondContact CD2-OG 3.25Å; I411-S413 VanDerWaalsContact C-N 3.26Å; I411-S413 PolarHBondContact O-N 3.41Å; I411-S413 VanDerWaalsContact O-N 3.13Å; S413-A416 PolarHBondContact O-N 3.13Å; S413-L417 PolarHBondContact O-N 3.45Å
414	F	74.5	Confident	67.6	Low	114 Å²	114	95.5 Å²	95.5	50%	0.5	50%	0.5	S	S	.	.	H	α-helix	trans	-74.1	-31.2	173.5	-73	-73.5	0	0	0	112	A408 I411 A416 L417 G418	A408-F414 VanDerWaalsContact O-CB 3.27Å; A408-F414 WeakPolarHBondContact O-CB 3.42Å; I411-F414 HydrophobicContact CB-CD2 3.9Å; I411-F414 HydrophobicContact CD1-CD2 4.09Å; I411-F414 HydrophobicContact CD1-CE2 4.13Å; I411-F414 HydrophobicContact CG2-CD2 3.78Å; I411-F414 HydrophobicContact CG2-CE2 4.35Å; I411-F414 PolarHBondContact O-N 2.79Å; F414-A416 VanDerWaalsContact C-N 3.3Å; F414-A416 PolarHBondContact O-N 2.96Å; F414-L417 WeakPolarHBondContact O-CB 3.41Å; F414-L417 PolarHBondContact O-N 3.41Å; F414-G418 PolarHBondContact O-N 3.44Å
415	Q	70.1	Confident	65.1	Low	94 Å²	94	97.2 Å²	97.2	44%	0.439	53%	0.525	S	S	.	.	H	α-helix	trans	-63.2	-35.1	171.6	-60.5	-176.5	8.3	0	0	112.5	L409 I411 P412 G418	L409-Q415 WeakPolarHBondContact O-CG 3.44Å; L409-Q415 PolarHBondContact O-NE2 3.28Å; I411-Q415 PolarHBondContact O-N 3.34Å; P412-Q415 WeakPolarHBondContact O-CB 3.2Å; P412-Q415 PolarHBondContact O-N 3.01Å; Q415-G418 PolarHBondContact O-N 3.48Å
416	A	67.5	Low	62.6	Low	63 Å²	63	96.3 Å²	96.3	52%	0.521	54%	0.536	S	S	.	.	H	α-helix	trans	-64.6	-41.2	174.2	0	0	0	0	0	111.7	P412 S413 F414 G418 K419	P412-A416 PolarHBondContact O-N 3.09Å; P412-A416 VanDerWaalsContact O-N 3.13Å; S413-A416 PolarHBondContact O-N 3.13Å; F414-A416 VanDerWaalsContact C-N 3.3Å; F414-A416 PolarHBondContact O-N 2.96Å; A416-G418 VanDerWaalsContact C-N 3.3Å; A416-G418 PolarHBondContact O-N 3.41Å; A416-K419 PolarHBondContact O-N 3.45Å
417	L	64.6	Low	60.5	Low	126 Å²	126	99.4 Å²	99.4	66%	0.66	55%	0.55	S	S	*	*	H	α-helix	trans	-58.8	-40.5	176.5	-138	78.3	0	0	0	112.3	S413 F414 K419 K420	S413-L417 PolarHBondContact O-N 3.45Å; F414-L417 WeakPolarHBondContact O-CB 3.41Å; F414-L417 PolarHBondContact O-N 3.41Å; L417-K419 VanDerWaalsContact C-N 3.29Å; L417-K419 PolarHBondContact O-N 2.93Å; L417-K420 PolarHBondContact O-N 2.79Å
418	G	58.8	Low	57.9	Low	51 Å²	51	102.9 Å²	102.9	53%	0.526	58%	0.575	S	S	.	*	H	α-helix	trans	-63.2	-27.9	180	0	0	0	0	0	114.8	F414 Q415 A416	F414-G418 PolarHBondContact O-N 3.44Å; Q415-G418 PolarHBondContact O-N 3.48Å; A416-G418 VanDerWaalsContact C-N 3.3Å; A416-G418 PolarHBondContact O-N 3.41Å
419	K	54.1	Low	55.4	Low	161 Å²	161	109.2 Å²	109.2	70%	0.7	60%	0.6	S	S	*	*	H	α-helix	trans	-76.6	-27.1	178.2	-67.4	-177.6	179.8	-179.7	0	113.1	A416 L417 K421	A416-K419 PolarHBondContact O-N 3.45Å; L417-K419 VanDerWaalsContact C-N 3.29Å; L417-K419 PolarHBondContact O-N 2.93Å; K419-K421 VanDerWaalsContact C-N 3.26Å; K419-K421 PolarHBondContact O-N 2.81Å
420	K	47.1	Very low	53.2	Low	158 Å²	158	111.6 Å²	111.6	69%	0.687	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-2	-171.3	-143.6	171.3	-176	177.8	0	114.4	L417	L417-K420 PolarHBondContact O-N 2.79Å
421	K	45.7	Very low	51	Low	187 Å²	187	116.2 Å²	116.2	81%	0.813	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	10.5	178	-75	-164.1	172.1	-170.3	0	115.3	K419	K419-K421 VanDerWaalsContact C-N 3.26Å; K419-K421 PolarHBondContact O-N 2.81Å
422	I	42.9	Very low	48.6	Very low	145 Å²	145	119.1 Å²	119.1	74%	0.744	68%	0.675	S	S	*	*	S	Bend	trans	-105.7	-17.6	-176.8	-66.2	178.2	0	0	0	112.8
423	I	43.6	Very low	46.3	Very low	145 Å²	145	123.4 Å²	123.4	74%	0.744	70%	0.7	S	S	*	*	S	Bend	trans	-94.1	-42.7	-175	-61.3	178.9	0	0	0	111.5
424	D	41	Very low	44.2	Very low	137 Å²	137	132.7 Å²	132.7	73%	0.733	75%	0.745	S	S	*	*	S	Bend	trans	-106.3	108.9	-174.5	-59.1	-58.8	0	0	0	112.9
425	G	33.3	Very low	42.7	Very low	82 Å²	82	133.6 Å²	133.6	85%	0.845	76%	0.757	S	S	*	*	S	Bend	trans	97	67.8	154.7	0	0	0	0	0	118.5
426	A	31.8	Very low	41.3	Very low	96 Å²	96	135.7 Å²	135.7	79%	0.793	77%	0.774	S	S	*	*			trans	-152	43.6	162.3	0	0	0	0	0	115.2	L428	A426-L428 PolarHBondContact O-N 3.03Å
427	H	34.3	Very low	39.8	Very low	169 Å²	169	139.7 Å²	139.7	78%	0.782	79%	0.788	S	S	*	*			trans	-77.6	63.6	165.3	-167.9	-68.8	0	0	0	110.7
428	L	32.1	Very low	38.4	Very low	163 Å²	163	140.5 Å²	140.5	85%	0.853	80%	0.795	S	S	*	*			trans	-105	109.7	171.9	-155.2	75	0	0	0	108.3	A426	A426-L428 PolarHBondContact O-N 3.03Å
429	Q	30.6	Very low	37.1	Very low	161 Å²	161	146.1 Å²	146.1	75%	0.752	81%	0.812	S	S	*	*			trans	-62.9	137.4	-171.3	-82	163.3	-88.1	0	0	112.5	T431	Q429-T431 PolarHBondContact O-N 3.12Å; Q429-T431 VanDerWaalsContact O-N 3.1Å
430	T	31.6	Very low	36	Very low	138 Å²	138	145.1 Å²	145.1	85%	0.847	82%	0.82	S	S	*	*			trans	-54.3	111.2	170.5	-47.8	0	0	0	0	110.5	G432	T430-G432 PolarHBondContact O-N 3.45Å; T430-G432 VanDerWaalsContact O-N 3.12Å
431	T	32.7	Very low	35.2	Very low	143 Å²	143	144.2 Å²	144.2	88%	0.877	83%	0.829	S	S	*	*			trans	-68.4	106.1	164.5	49	0	0	0	0	108.7	Q429	Q429-T431 PolarHBondContact O-N 3.12Å; Q429-T431 VanDerWaalsContact O-N 3.1Å
432	G	31.6	Very low	34.3	Very low	65 Å²	65	140.9 Å²	140.9	67%	0.67	83%	0.83	S	S	*	*			trans	-152.5	88.5	-179.9	0	0	0	0	0	112.2	T430	T430-G432 PolarHBondContact O-N 3.45Å; T430-G432 VanDerWaalsContact O-N 3.12Å
433	V	29.9	Very low	33.6	Very low	148 Å²	148	140.6 Å²	140.6	90%	0.897	84%	0.838	S	S	*	*			trans	-140.5	149.7	155.2	-146.5	0	0	0	0	108.5
434	L	31.1	Very low	32.7	Very low	240 Å²	240	140.2 Å²	140.2	100%	1.257	85%	0.846	S	S	*	*			trans	-73.5	0	157.4	-87.2	155	0	0	0	110.8

Retrieved 434 of 434 residues in 439.1 ms (Link to these results)

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