A0A5K4FDV3_SCHMA Loading...

Homeobox domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FDV3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 363 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	33.3	Very low	36.7	Very low	251 Å²	251	168.4 Å²	168.4	100%	1.236	84%	0.838	S	S	*	*				0	142.8	0	-84.3	179.1	152.6	0	0	108.7
2	L	35.9	Very low	36.8	Very low	155 Å²	155	166.3 Å²	166.3	81%	0.812	83%	0.832	S	S	*	*			trans	-77.6	162.9	-154.2	-73.8	138.8	0	0	0	116.6
3	N	34	Very low	37.1	Very low	145 Å²	145	163.7 Å²	163.7	78%	0.775	82%	0.822	S	S	*	*			trans	79.6	136.3	155.8	-59.9	-32.8	0	0	0	116.1
4	R	38.6	Very low	37.5	Very low	224 Å²	224	159.4 Å²	159.4	85%	0.845	82%	0.816	S	S	*	*			cis	-164.9	132.1	29.7	-153.1	175	-164.4	-173.3	3.2	108.8
5	H	37.6	Very low	37.9	Very low	165 Å²	165	153.6 Å²	153.6	76%	0.764	80%	0.795	S	S	*	*			trans	-68.5	134.2	166.1	-93.6	-99.8	0	0	0	110.7
6	Y	39.1	Very low	38.4	Very low	214 Å²	214	147.8 Å²	147.8	84%	0.839	77%	0.771	S	S	*	*			trans	-148.9	110.2	144.1	-107	-84.1	0	0	0	108.6
7	L	33.5	Very low	39	Very low	147 Å²	147	143.8 Å²	143.8	77%	0.77	76%	0.759	S	S	*	*			trans	-85.3	128.7	168.4	-82.5	145.7	0	0	0	108.5
8	T	37.8	Very low	39.8	Very low	126 Å²	126	140.7 Å²	140.7	77%	0.773	75%	0.751	S	S	*	*			trans	-150.1	107.8	151	47.9	0	0	0	0	111.8
9	S	33.9	Very low	40.5	Very low	115 Å²	115	141.3 Å²	141.3	80%	0.804	75%	0.746	S	S	*	*			trans	50.6	93	136.9	-51	0	0	0	0	120.6
10	K	39.8	Very low	41.1	Very low	216 Å²	216	139 Å²	139	94%	0.939	73%	0.733	S	S	*	*			trans	-89.1	100.4	146.1	-88.9	175.7	175.3	173.3	0	108.2
11	S	40.5	Very low	41.9	Very low	94 Å²	94	135.7 Å²	135.7	66%	0.657	72%	0.721	S	S	*	*			trans	-80.2	143.9	175	59.9	0	0	0	0	111.6	N13	S11-N13 PolarHBondContact O-N 3.28Å
12	N	37.4	Very low	43.1	Very low	144 Å²	144	126.4 Å²	126.4	77%	0.77	68%	0.684	S	S	*	*			trans	-64.1	104.4	-179.8	-62.5	-37.8	0	0	0	111.6
13	N	41.4	Very low	44.6	Very low	132 Å²	132	122.7 Å²	122.7	71%	0.706	67%	0.668	S	S	*	*			trans	-100.6	11.2	179.8	-97.1	-11.7	0	0	0	115	S11	S11-N13 PolarHBondContact O-N 3.28Å
14	S	42.7	Very low	46.2	Very low	104 Å²	104	118 Å²	118	73%	0.727	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-16.9	-178.3	50.9	0	0	0	0	114.8
15	S	43.5	Very low	47.7	Very low	72 Å²	72	112.1 Å²	112.1	50%	0.503	63%	0.631	S	S	.	*	H	α-helix	trans	-83.9	-12.7	-177.6	53.7	0	0	0	0	115.4
16	S	46.1	Very low	49.3	Very low	60 Å²	60	107.9 Å²	107.9	42%	0.42	62%	0.617	S	S	.	*	H	α-helix	trans	-82.2	-32.5	-173.1	-54.9	0	0	0	0	112.8	K19 M20	S16-K19 PolarHBondContact O-N 3.12Å; S16-M20 WeakPolarHBondContact O-CG 3.36Å; S16-M20 PolarHBondContact O-N 2.96Å; S16-M20 VanDerWaalsContact O-N 3.15Å
17	S	48.3	Very low	51.1	Low	81 Å²	81	99.2 Å²	99.2	57%	0.566	59%	0.585	S	S	*	*	H	α-helix	trans	-66.6	-43.6	-178.3	-174.3	0	0	0	0	112.4	K19 M20 S21	S17-K19 VanDerWaalsContact C-N 3.34Å; S17-K19 PolarHBondContact O-N 3.07Å; S17-M20 PolarHBondContact O-N 3.47Å; S17-S21 PolarHBondContact O-N 2.94Å; S17-S21 VanDerWaalsContact O-N 3.09Å; S17-S21 PolarHBondContact O-OG 2.93Å
18	S	52.9	Low	53	Low	88 Å²	88	96.9 Å²	96.9	62%	0.615	57%	0.569	S	S	*	*	H	α-helix	trans	-65.1	-35.1	177.5	-56.2	0	0	0	0	113.1	A22	S18-A22 PolarHBondContact O-N 3.04Å; S18-A22 VanDerWaalsContact O-N 3.1Å
19	K	52.6	Low	54.9	Low	151 Å²	151	93.7 Å²	93.7	66%	0.657	55%	0.552	S	S	*	*	H	α-helix	trans	-66.4	-41.2	175.4	-72.7	179.8	-178.7	175.3	0	111.4	S16 S17 A22 T23	S16-K19 PolarHBondContact O-N 3.12Å; S17-K19 VanDerWaalsContact C-N 3.34Å; S17-K19 PolarHBondContact O-N 3.07Å; K19-A22 PolarHBondContact O-N 2.66Å; K19-T23 WeakPolarHBondContact O-CG2 3.42Å; K19-T23 PolarHBondContact O-N 2.89Å; K19-T23 PolarHBondContact O-OG1 2.89Å
20	M	53.2	Low	57	Low	96 Å²	96	92.8 Å²	92.8	47%	0.473	54%	0.535	S	S	.	.	H	α-helix	trans	-63.8	-41.3	177	-70.2	178	70.9	0	0	112.3	S16 S17 T23 N24	S16-M20 WeakPolarHBondContact O-CG 3.36Å; S16-M20 PolarHBondContact O-N 2.96Å; S16-M20 VanDerWaalsContact O-N 3.15Å; S17-M20 PolarHBondContact O-N 3.47Å; M20-T23 WeakPolarHBondContact CA-OG1 3.48Å; M20-T23 PolarHBondContact O-N 3.16Å; M20-T23 PolarHBondContact O-OG1 3.23Å; M20-N24 VanDerWaalsContact O-CB 3.3Å; M20-N24 WeakPolarHBondContact O-CB 3.25Å; M20-N24 PolarHBondContact O-N 2.94Å; M20-N24 PolarHBondContact O-ND2 2.87Å
21	S	58.3	Low	58.6	Low	70 Å²	70	84.7 Å²	84.7	49%	0.49	50%	0.498	S	S	.	.	H	α-helix	trans	-63.2	-42.7	174.7	-64.5	0	0	0	0	111.9	S17 N24 V25	S17-S21 PolarHBondContact O-N 2.94Å; S17-S21 VanDerWaalsContact O-N 3.09Å; S17-S21 PolarHBondContact O-OG 2.93Å; S21-N24 PolarHBondContact O-N 2.92Å; S21-V25 WeakPolarHBondContact O-CG2 3.48Å; S21-V25 PolarHBondContact O-N 3.22Å
22	A	58.6	Low	60.3	Low	56 Å²	56	83.5 Å²	83.5	46%	0.463	49%	0.485	S	S	.	.	H	α-helix	trans	-63.3	-43.6	177.7	0	0	0	0	0	112.2	S18 K19 N24 V25 V26	S18-A22 PolarHBondContact O-N 3.04Å; S18-A22 VanDerWaalsContact O-N 3.1Å; K19-A22 PolarHBondContact O-N 2.66Å; A22-N24 VanDerWaalsContact C-N 3.34Å; A22-N24 PolarHBondContact O-N 2.81Å; A22-V25 PolarHBondContact O-N 3.08Å; A22-V26 WeakPolarHBondContact O-CG2 3.47Å; A22-V26 PolarHBondContact O-N 2.95Å
23	T	67.5	Low	62.3	Low	77 Å²	77	79.9 Å²	79.9	47%	0.472	47%	0.468	S	S	.	.	H	α-helix	trans	-62.4	-42.7	176	52.4	0	0	0	0	111.4	K19 M20 V25 V26 I27	K19-T23 WeakPolarHBondContact O-CG2 3.42Å; K19-T23 PolarHBondContact O-N 2.89Å; K19-T23 PolarHBondContact O-OG1 2.89Å; M20-T23 WeakPolarHBondContact CA-OG1 3.48Å; M20-T23 PolarHBondContact O-N 3.16Å; M20-T23 PolarHBondContact O-OG1 3.23Å; T23-V25 PolarHBondContact O-N 3.4Å; T23-V26 PolarHBondContact O-N 3.3Å; T23-I27 WeakPolarHBondContact O-CB 3.46Å; T23-I27 VanDerWaalsContact O-CD1 3.28Å; T23-I27 WeakPolarHBondContact O-CD1 3.35Å; T23-I27 WeakPolarHBondContact O-CG1 3.45Å; T23-I27 PolarHBondContact O-N 2.93Å
24	N	68.1	Low	63.8	Low	45 Å²	45	76.2 Å²	76.2	24%	0.241	45%	0.448	C	S	.	.	H	α-helix	trans	-62	-39.4	178.5	-79.2	-11.3	0	0	0	112.7	M20 S21 A22 K28 F59	M20-N24 VanDerWaalsContact O-CB 3.3Å; M20-N24 WeakPolarHBondContact O-CB 3.25Å; M20-N24 PolarHBondContact O-N 2.94Å; M20-N24 PolarHBondContact O-ND2 2.87Å; S21-N24 PolarHBondContact O-N 2.92Å; A22-N24 VanDerWaalsContact C-N 3.34Å; A22-N24 PolarHBondContact O-N 2.81Å; N24-K28 WeakPolarHBondContact O-CB 3.4Å; N24-K28 PolarHBondContact O-N 2.87Å; N24-F59 HydrophobicContact CB-CE2 3.86Å; N24-F59 HydrophobicContact CB-CZ 3.54Å; N24-F59 VanDerWaalsContact CG-CE2 3.42Å; N24-F59 WeakPolarHBondContact OD1-CE2 3.5Å
25	V	69.8	Low	65.3	Low	101 Å²	101	74.6 Å²	74.6	61%	0.612	43%	0.431	S	S	*	.	H	α-helix	trans	-67.5	-42.9	174.9	172.9	0	0	0	0	111.3	S21 A22 T23 K28 S29	S21-V25 WeakPolarHBondContact O-CG2 3.48Å; S21-V25 PolarHBondContact O-N 3.22Å; A22-V25 PolarHBondContact O-N 3.08Å; T23-V25 PolarHBondContact O-N 3.4Å; V25-K28 PolarHBondContact O-N 2.81Å; V25-S29 PolarHBondContact O-N 2.81Å
26	V	71.3	Confident	66.7	Low	77 Å²	77	76.5 Å²	76.5	47%	0.467	44%	0.436	S	S	.	.	H	α-helix	trans	-61.6	-46.2	176.6	172.9	0	0	0	0	110.7	A22 T23 K28 S29 Q30	A22-V26 WeakPolarHBondContact O-CG2 3.47Å; A22-V26 PolarHBondContact O-N 2.95Å; T23-V26 PolarHBondContact O-N 3.3Å; V26-K28 VanDerWaalsContact C-N 3.33Å; V26-K28 PolarHBondContact O-N 3.37Å; V26-S29 PolarHBondContact O-N 3.33Å; V26-S29 PolarHBondContact O-OG 3.19Å; V26-Q30 WeakPolarHBondContact O-CG 3.27Å; V26-Q30 PolarHBondContact O-N 3.38Å
27	I	75.4	Confident	67.8	Low	31 Å²	31	79.8 Å²	79.8	16%	0.159	44%	0.442	C	S	.	.	H	α-helix	trans	-61	-43	178.3	-68.2	156.3	0	0	0	110.9	T23 Q30 Y31 F52 T53	T23-I27 WeakPolarHBondContact O-CB 3.46Å; T23-I27 VanDerWaalsContact O-CD1 3.28Å; T23-I27 WeakPolarHBondContact O-CD1 3.35Å; T23-I27 WeakPolarHBondContact O-CG1 3.45Å; T23-I27 PolarHBondContact O-N 2.93Å; I27-Q30 PolarHBondContact O-N 2.99Å; I27-Y31 PolarHBondContact O-N 3.24Å; I27-F52 HydrophobicContact CG2-CB 3.99Å; I27-T53 HydrophobicContact CD1-CG2 3.25Å; I27-T53 HydrophobicContact CG1-CG2 4.29Å
28	K	75.2	Confident	68.5	Low	98 Å²	98	78.5 Å²	78.5	43%	0.426	43%	0.427	S	S	.	.	H	α-helix	trans	-60.4	-47.2	175.4	-177.3	164.4	-177.9	169	0	111.9	N24 V25 V26 Q30 Y31 D32 F62	N24-K28 WeakPolarHBondContact O-CB 3.4Å; N24-K28 PolarHBondContact O-N 2.87Å; V25-K28 PolarHBondContact O-N 2.81Å; V26-K28 VanDerWaalsContact C-N 3.33Å; V26-K28 PolarHBondContact O-N 3.37Å; K28-Q30 VanDerWaalsContact C-N 3.29Å; K28-Q30 PolarHBondContact O-N 3.32Å; K28-Y31 PolarHBondContact O-N 3.4Å; K28-Y31 VanDerWaalsContact O-N 3.15Å; K28-D32 WeakPolarHBondContact CG-OD2 3.44Å; K28-D32 WeakPolarHBondContact O-CB 3.24Å; K28-D32 VanDerWaalsContact O-CG 3.26Å; K28-D32 PolarHBondContact O-N 3.47Å; K28-F62 HydrophobicContact CD-CZ 4.1Å
29	S	76.8	Confident	69	Low	60 Å²	60	78.6 Å²	78.6	42%	0.42	43%	0.428	S	S	.	.	H	α-helix	trans	-61	-36.5	178.3	73.8	0	0	0	0	113.1	V25 V26 T33	V25-S29 PolarHBondContact O-N 2.81Å; V26-S29 PolarHBondContact O-N 3.33Å; V26-S29 PolarHBondContact O-OG 3.19Å; S29-T33 WeakPolarHBondContact O-CB 3.48Å; S29-T33 PolarHBondContact O-N 2.97Å; S29-T33 PolarHBondContact O-OG1 3.39Å
30	Q	77	Confident	69.4	Low	95 Å²	95	78.5 Å²	78.5	44%	0.444	43%	0.431	S	S	.	.	H	α-helix	trans	-67.5	-43.2	175.4	-72.3	-179.6	-12.8	0	0	111.4	V26 I27 K28 T33 L34	V26-Q30 WeakPolarHBondContact O-CG 3.27Å; V26-Q30 PolarHBondContact O-N 3.38Å; I27-Q30 PolarHBondContact O-N 2.99Å; K28-Q30 VanDerWaalsContact C-N 3.29Å; K28-Q30 PolarHBondContact O-N 3.32Å; Q30-T33 PolarHBondContact O-N 3.38Å; Q30-L34 WeakPolarHBondContact O-CG 3.48Å; Q30-L34 PolarHBondContact O-N 3.37Å
31	Y	73.7	Confident	69.7	Low	46 Å²	46	78.7 Å²	78.7	18%	0.18	44%	0.435	C	S	.	.	H	α-helix	trans	-64.8	-44.9	177.2	-171.9	-97.4	0	0	0	112	I27 K28 T33 L34 L35 F52	I27-Y31 PolarHBondContact O-N 3.24Å; K28-Y31 PolarHBondContact O-N 3.4Å; K28-Y31 VanDerWaalsContact O-N 3.15Å; Y31-T33 VanDerWaalsContact C-N 3.32Å; Y31-T33 PolarHBondContact O-N 2.92Å; Y31-L34 WeakPolarHBondContact O-CB 3.38Å; Y31-L34 PolarHBondContact O-N 3.3Å; Y31-L35 HydrophobicContact CD1-CD1 3.61Å; Y31-L35 HydrophobicContact CE1-CD1 3.18Å; Y31-L35 HydrophobicContact CE1-CD2 4.41Å; Y31-L35 HydrophobicContact CE1-CG 4.42Å; Y31-L35 HydrophobicContact CE2-CD1 4.21Å; Y31-L35 HydrophobicContact CG-CD1 4.29Å; Y31-L35 WeakPolarHBondContact O-CD1 3.36Å; Y31-L35 PolarHBondContact O-N 3.43Å; Y31-F52 HydrophobicContact CD2-CD2 4.42Å; Y31-F52 HydrophobicContact CD2-CE2 4.41Å
32	D	77.3	Confident	69.8	Low	69 Å²	69	78.3 Å²	78.3	37%	0.369	43%	0.432	S	S	.	.	H	α-helix	trans	-61.1	-42	176.6	-66.7	-21.7	0	0	0	110.9	K28 L34 L35 D36	K28-D32 WeakPolarHBondContact CG-OD2 3.44Å; K28-D32 WeakPolarHBondContact O-CB 3.24Å; K28-D32 VanDerWaalsContact O-CG 3.26Å; K28-D32 PolarHBondContact O-N 3.47Å; D32-L34 VanDerWaalsContact C-N 3.28Å; D32-L34 PolarHBondContact O-N 2.99Å; D32-L35 WeakPolarHBondContact O-CB 3.47Å; D32-L35 PolarHBondContact O-N 3.41Å; D32-L35 VanDerWaalsContact O-N 3.16Å; D32-D36 PolarHBondContact O-N 3.13Å
33	T	78.2	Confident	69.7	Low	68 Å²	68	86.6 Å²	86.6	42%	0.417	45%	0.451	S	S	.	.	H	α-helix	trans	-61.2	-35.7	174	-56.3	0	0	0	0	112.3	S29 Q30 Y31 K37	S29-T33 WeakPolarHBondContact O-CB 3.48Å; S29-T33 PolarHBondContact O-N 2.97Å; S29-T33 PolarHBondContact O-OG1 3.39Å; Q30-T33 PolarHBondContact O-N 3.38Å; Y31-T33 VanDerWaalsContact C-N 3.32Å; Y31-T33 PolarHBondContact O-N 2.92Å; T33-K37 HydrophobicContact CG2-CD 4.29Å; T33-K37 WeakPolarHBondContact O-CB 3.45Å; T33-K37 VanDerWaalsContact O-CG 3.26Å; T33-K37 WeakPolarHBondContact O-CG 3.34Å; T33-K37 PolarHBondContact O-N 2.99Å
34	L	73.1	Confident	69.4	Low	56 Å²	56	88.9 Å²	88.9	29%	0.293	46%	0.46	S	S	.	.	H	α-helix	trans	-72.2	-37.1	176.1	-70.6	173.3	0	0	0	111.8	Q30 Y31 D32 K37 Q38 L46 F52	Q30-L34 WeakPolarHBondContact O-CG 3.48Å; Q30-L34 PolarHBondContact O-N 3.37Å; Y31-L34 WeakPolarHBondContact O-CB 3.38Å; Y31-L34 PolarHBondContact O-N 3.3Å; D32-L34 VanDerWaalsContact C-N 3.28Å; D32-L34 PolarHBondContact O-N 2.99Å; L34-K37 PolarHBondContact O-N 3.22Å; L34-Q38 PolarHBondContact O-N 3.09Å; L34-L46 HydrophobicContact CB-CD2 4.1Å; L34-F52 HydrophobicContact CD1-CE1 4.28Å; L34-F52 HydrophobicContact CD1-CE2 4.09Å; L34-F52 HydrophobicContact CD1-CZ 3.45Å; L34-F52 VanDerWaalsContact CD1-CZ 3.45Å
35	L	73.7	Confident	69.4	Low	70 Å²	70	92.3 Å²	92.3	37%	0.366	49%	0.485	S	S	.	.	H	α-helix	trans	-60.4	-45.1	171.6	-103	75.8	0	0	0	111.6	Y31 D32 Q38 S39 L46	Y31-L35 HydrophobicContact CD1-CD1 3.61Å; Y31-L35 HydrophobicContact CE1-CD1 3.18Å; Y31-L35 HydrophobicContact CE1-CD2 4.41Å; Y31-L35 HydrophobicContact CE1-CG 4.42Å; Y31-L35 HydrophobicContact CE2-CD1 4.21Å; Y31-L35 HydrophobicContact CG-CD1 4.29Å; Y31-L35 WeakPolarHBondContact O-CD1 3.36Å; Y31-L35 PolarHBondContact O-N 3.43Å; D32-L35 WeakPolarHBondContact O-CB 3.47Å; D32-L35 PolarHBondContact O-N 3.41Å; D32-L35 VanDerWaalsContact O-N 3.16Å; L35-Q38 WeakPolarHBondContact O-CB 3.38Å; L35-Q38 PolarHBondContact O-N 3.02Å; L35-S39 PolarHBondContact O-N 3.31Å; L35-L46 HydrophobicContact CD1-CD1 3.46Å; L35-L46 VanDerWaalsContact CD1-CD1 3.46Å; L35-L46 HydrophobicContact CD1-CD2 4.35Å; L35-L46 HydrophobicContact CG-CD1 4.19Å
36	D	73.6	Confident	69.3	Low	112 Å²	112	89.9 Å²	89.9	60%	0.599	47%	0.468	S	S	*	.	H	α-helix	trans	-64.2	-42.6	177.8	-74.9	-14.1	0	0	0	111.4	D32 Q38 S39 M40	D32-D36 PolarHBondContact O-N 3.13Å; D36-Q38 VanDerWaalsContact C-N 3.28Å; D36-Q38 PolarHBondContact O-N 3.49Å; D36-S39 VanDerWaalsContact O-CB 3.25Å; D36-S39 WeakPolarHBondContact O-CB 3.27Å; D36-S39 PolarHBondContact O-N 2.8Å; D36-S39 VanDerWaalsContact O-N 3.16Å; D36-M40 PolarHBondContact O-N 3.38Å
37	K	69.1	Low	69.1	Low	129 Å²	129	88.8 Å²	88.8	56%	0.561	46%	0.463	S	S	*	.	H	α-helix	trans	-64.1	-32.6	175.2	-75.3	174.5	-179	179.1	0	112.6	T33 L34 M40 N41	T33-K37 HydrophobicContact CG2-CD 4.29Å; T33-K37 WeakPolarHBondContact O-CB 3.45Å; T33-K37 VanDerWaalsContact O-CG 3.26Å; T33-K37 WeakPolarHBondContact O-CG 3.34Å; T33-K37 PolarHBondContact O-N 2.99Å; L34-K37 PolarHBondContact O-N 3.22Å; K37-M40 PolarHBondContact O-N 3.46Å; K37-N41 PolarHBondContact O-N 3.41Å; K37-N41 VanDerWaalsContact O-N 3.08Å
38	Q	63.6	Low	68.7	Low	54 Å²	54	91.9 Å²	91.9	25%	0.252	48%	0.476	S	S	.	.	H	α-helix	trans	-72	-34.5	172.3	-88.3	-159.1	-13.2	0	0	113.9	L34 L35 D36 M40 N41 L44 P45 L46	L34-Q38 PolarHBondContact O-N 3.09Å; L35-Q38 WeakPolarHBondContact O-CB 3.38Å; L35-Q38 PolarHBondContact O-N 3.02Å; D36-Q38 VanDerWaalsContact C-N 3.28Å; D36-Q38 PolarHBondContact O-N 3.49Å; Q38-M40 PolarHBondContact O-N 2.96Å; Q38-M40 VanDerWaalsContact O-N 3.16Å; Q38-N41 CarbonylContact O-C 3.21Å; Q38-N41 VanDerWaalsContact O-C 3.29Å; Q38-N41 PolarHBondContact O-N 3.36Å; Q38-N41 VanDerWaalsContact O-N 3.08Å; Q38-L44 PolarHBondContact NE2-O 3.5Å; Q38-P45 VanDerWaalsContact NE2-C 3.28Å; Q38-L46 HydrophobicContact CG-CD2 3.7Å; Q38-L46 HydrophobicContact CG-CG 4.29Å; Q38-L46 VanDerWaalsContact NE2-CD2 3.25Å
39	S	63.4	Low	68.2	Low	89 Å²	89	88.1 Å²	88.1	62%	0.622	46%	0.462	S	S	*	.	H	α-helix	trans	-55.1	-31.7	171.9	-170.7	0	0	0	0	111	L35 D36	L35-S39 PolarHBondContact O-N 3.31Å; D36-S39 VanDerWaalsContact O-CB 3.25Å; D36-S39 WeakPolarHBondContact O-CB 3.27Å; D36-S39 PolarHBondContact O-N 2.8Å; D36-S39 VanDerWaalsContact O-N 3.16Å
40	M	60.3	Low	67.9	Low	149 Å²	149	88.9 Å²	88.9	73%	0.734	47%	0.466	S	S	*	.	H	α-helix	trans	-89.8	-22.7	177.9	-56.6	-57.8	152	0	0	113.8	D36 K37 Q38	D36-M40 PolarHBondContact O-N 3.38Å; K37-M40 PolarHBondContact O-N 3.46Å; Q38-M40 PolarHBondContact O-N 2.96Å; Q38-M40 VanDerWaalsContact O-N 3.16Å
41	N	59.5	Low	67.5	Low	101 Å²	101	89.1 Å²	89.1	54%	0.54	47%	0.474	S	S	.	.			trans	-136.5	85.3	-175	-64	-56.9	0	0	0	111.8	K37 Q38 W43	K37-N41 PolarHBondContact O-N 3.41Å; K37-N41 VanDerWaalsContact O-N 3.08Å; Q38-N41 CarbonylContact O-C 3.21Å; Q38-N41 VanDerWaalsContact O-C 3.29Å; Q38-N41 PolarHBondContact O-N 3.36Å; Q38-N41 VanDerWaalsContact O-N 3.08Å; N41-W43 PolarHBondContact O-N 3.45Å
42	S	61.3	Low	67.1	Low	61 Å²	61	89.7 Å²	89.7	43%	0.427	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	7.2	-169.3	72.8	0	0	0	0	117.2	R224	S42-R224 PolarHBondContact OG-NH2 3.42Å
43	W	56.4	Low	66.1	Low	230 Å²	230	88.1 Å²	88.1	87%	0.871	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	-0.5	-168.8	-67.2	102.6	0	0	0	114.7	N41	N41-W43 PolarHBondContact O-N 3.45Å
44	L	60.9	Low	65	Low	126 Å²	126	91.4 Å²	91.4	66%	0.66	50%	0.496	S	S	*	.	S	Bend	trans	-107	128.9	177.5	-79.4	152.5	0	0	0	109.7	Q38	Q38-L44 PolarHBondContact NE2-O 3.5Å
45	P	68.3	Low	64	Low	117 Å²	117	92.8 Å²	92.8	76%	0.76	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-62.7	143.2	169.7	-16.9	29.5	0	0	0	111.3	Q38	Q38-P45 VanDerWaalsContact NE2-C 3.28Å
46	L	66.2	Low	63.2	Low	50 Å²	50	92.8 Å²	92.8	26%	0.262	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-71.7	141.3	168.7	-73.8	172.8	0	0	0	107.2	L34 L35 Q38 H48	L34-L46 HydrophobicContact CB-CD2 4.1Å; L35-L46 HydrophobicContact CD1-CD1 3.46Å; L35-L46 VanDerWaalsContact CD1-CD1 3.46Å; L35-L46 HydrophobicContact CD1-CD2 4.35Å; L35-L46 HydrophobicContact CG-CD1 4.19Å; Q38-L46 HydrophobicContact CG-CD2 3.7Å; Q38-L46 HydrophobicContact CG-CG 4.29Å; Q38-L46 VanDerWaalsContact NE2-CD2 3.25Å; L46-H48 PolarHBondContact O-N 3.14Å
47	P	68.3	Low	62.3	Low	54 Å²	54	91.7 Å²	91.7	35%	0.351	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-54.6	135.2	161.9	-12.4	24.5	0	0	0	108.3	V51 F52	P47-V51 HydrophobicContact CB-CB 4.09Å; P47-V51 HydrophobicContact CB-CG1 4.26Å; P47-V51 HydrophobicContact CB-CG2 4.14Å; P47-F52 HydrophobicContact CB-CE2 3.9Å; P47-F52 HydrophobicContact CB-CZ 4.43Å; P47-F52 HydrophobicContact CG-CE2 3.99Å; P47-F52 HydrophobicContact CG-CZ 4.13Å
48	H	65.9	Low	61.6	Low	96 Å²	96	89.4 Å²	89.4	44%	0.444	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-54.3	138.7	173.9	-170	-89.4	0	0	0	108.4	L46 C50 V51	L46-H48 PolarHBondContact O-N 3.14Å; H48-C50 WeakPolarHBondContact ND1-CB 3.43Å; H48-C50 PolarHBondContact ND1-N 2.85Å; H48-C50 PolarHBondContact ND1-SG 3.08Å; H48-C50 PolarHBondContact O-N 2.89Å; H48-V51 VanDerWaalsContact O-CB 3.27Å; H48-V51 WeakPolarHBondContact O-CB 3.36Å; H48-V51 VanDerWaalsContact O-CG2 3.25Å; H48-V51 WeakPolarHBondContact O-CG2 3.29Å; H48-V51 PolarHBondContact O-N 3.33Å
49	P	64.9	Low	60.9	Low	19 Å²	19	89.4 Å²	89.4	12%	0.123	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-49	-33.3	-177.9	8.6	-25.1	0	0	0	114.6	V51 F52 W56	P49-V51 PolarHBondContact O-N 3.46Å; P49-V51 VanDerWaalsContact O-N 3.08Å; P49-F52 PolarHBondContact O-N 2.64Å; P49-W56 VanDerWaalsContact C-CZ2 3.5Å; P49-W56 HydrophobicContact CB-CD2 4.19Å; P49-W56 HydrophobicContact CB-CE3 3.88Å; P49-W56 HydrophobicContact CB-CH2 2.94Å; P49-W56 HydrophobicContact CB-CZ2 3.23Å; P49-W56 HydrophobicContact CB-CZ3 3.26Å; P49-W56 HydrophobicContact CG-CH2 4.15Å; P49-W56 HydrophobicContact CG-CZ3 4.08Å; P49-W56 WeakPolarHBondContact O-CZ2 3.26Å; P49-W56 PolarHBondContact O-NE1 3.44Å; P49-W56 VanDerWaalsContact O-NE1 3.08Å
50	C	70.6	Confident	60.5	Low	75 Å²	75	94 Å²	94	51%	0.507	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-59.9	-16.8	175.5	73.2	0	0	0	0	114.8	H48 F52	H48-C50 WeakPolarHBondContact ND1-CB 3.43Å; H48-C50 PolarHBondContact ND1-N 2.85Å; H48-C50 PolarHBondContact ND1-SG 3.08Å; H48-C50 PolarHBondContact O-N 2.89Å; C50-F52 PolarHBondContact O-N 3.45Å
51	V	69.5	Low	60.2	Low	101 Å²	101	95.8 Å²	95.8	61%	0.612	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-68.8	-24.9	174.9	179.8	0	0	0	0	111.1	P47 H48 P49	P47-V51 HydrophobicContact CB-CB 4.09Å; P47-V51 HydrophobicContact CB-CG1 4.26Å; P47-V51 HydrophobicContact CB-CG2 4.14Å; H48-V51 VanDerWaalsContact O-CB 3.27Å; H48-V51 WeakPolarHBondContact O-CB 3.36Å; H48-V51 VanDerWaalsContact O-CG2 3.25Å; H48-V51 WeakPolarHBondContact O-CG2 3.29Å; H48-V51 PolarHBondContact O-N 3.33Å; P49-V51 PolarHBondContact O-N 3.46Å; P49-V51 VanDerWaalsContact O-N 3.08Å
52	F	64.1	Low	59.6	Low	58 Å²	58	94.7 Å²	94.7	25%	0.254	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-22.7	-175.2	-71.6	-77.5	0	0	0	114.5	I27 Y31 L34 P47 P49 C50	I27-F52 HydrophobicContact CG2-CB 3.99Å; Y31-F52 HydrophobicContact CD2-CD2 4.42Å; Y31-F52 HydrophobicContact CD2-CE2 4.41Å; L34-F52 HydrophobicContact CD1-CE1 4.28Å; L34-F52 HydrophobicContact CD1-CE2 4.09Å; L34-F52 HydrophobicContact CD1-CZ 3.45Å; L34-F52 VanDerWaalsContact CD1-CZ 3.45Å; P47-F52 HydrophobicContact CB-CE2 3.9Å; P47-F52 HydrophobicContact CB-CZ 4.43Å; P47-F52 HydrophobicContact CG-CE2 3.99Å; P47-F52 HydrophobicContact CG-CZ 4.13Å; P49-F52 PolarHBondContact O-N 2.64Å; C50-F52 PolarHBondContact O-N 3.45Å
53	T	56.2	Low	59.1	Low	36 Å²	36	97 Å²	97	22%	0.221	52%	0.515	C	S	.	.			trans	-157.2	151.5	166.3	68.5	0	0	0	0	112.1	I27 N55 W56	I27-T53 HydrophobicContact CD1-CG2 3.25Å; I27-T53 HydrophobicContact CG1-CG2 4.29Å; T53-N55 PolarHBondContact O-N 2.59Å; T53-W56 PolarHBondContact OG1-NE1 3.48Å
54	S	57	Low	58.9	Low	136 Å²	136	89.5 Å²	89.5	95%	0.951	49%	0.492	S	S	*	.	S	Bend	trans	-79.2	2.8	172	12.1	0	0	0	0	113.9
55	N	51.9	Low	58.2	Low	85 Å²	85	90 Å²	90	46%	0.455	49%	0.493	S	S	.	.			trans	-134.8	60.8	-172.1	-166.5	11.6	0	0	0	112.2	T53 S57	T53-N55 PolarHBondContact O-N 2.59Å; N55-S57 VanDerWaalsContact C-N 3.33Å; N55-S57 PolarHBondContact OD1-OG 3.46Å
56	W	55.9	Low	57.6	Low	71 Å²	71	91.7 Å²	91.7	27%	0.269	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-78.2	-14.4	179.1	-87.6	57.8	0	0	0	114	P49 T53 S58 F59 L64	P49-W56 VanDerWaalsContact C-CZ2 3.5Å; P49-W56 HydrophobicContact CB-CD2 4.19Å; P49-W56 HydrophobicContact CB-CE3 3.88Å; P49-W56 HydrophobicContact CB-CH2 2.94Å; P49-W56 HydrophobicContact CB-CZ2 3.23Å; P49-W56 HydrophobicContact CB-CZ3 3.26Å; P49-W56 HydrophobicContact CG-CH2 4.15Å; P49-W56 HydrophobicContact CG-CZ3 4.08Å; P49-W56 WeakPolarHBondContact O-CZ2 3.26Å; P49-W56 PolarHBondContact O-NE1 3.44Å; P49-W56 VanDerWaalsContact O-NE1 3.08Å; T53-W56 PolarHBondContact OG1-NE1 3.48Å; W56-S58 PolarHBondContact O-N 2.89Å; W56-S58 VanDerWaalsContact O-N 3.15Å; W56-F59 PolarHBondContact O-N 2.83Å; W56-F59 VanDerWaalsContact O-N 3.12Å; W56-L64 HydrophobicContact CE3-CD1 4.47Å; W56-L64 HydrophobicContact CZ3-CD1 3.85Å
57	S	55.4	Low	56.8	Low	89 Å²	89	96.4 Å²	96.4	62%	0.622	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-64.8	-16.4	-177.7	38.7	0	0	0	0	114.2	N55 H60	N55-S57 VanDerWaalsContact C-N 3.33Å; N55-S57 PolarHBondContact OD1-OG 3.46Å; S57-H60 PolarHBondContact O-CD2 2.82Å
58	S	53.2	Low	55.7	Low	80 Å²	80	100.1 Å²	100.1	56%	0.559	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-85.2	-3.8	174.9	-71.4	0	0	0	0	114.7	W56 H60	W56-S58 PolarHBondContact O-N 2.89Å; W56-S58 VanDerWaalsContact O-N 3.15Å; S58-H60 PolarHBondContact O-N 3.11Å
59	F	49	Very low	54.6	Low	55 Å²	55	100 Å²	100	24%	0.241	53%	0.53	C	S	.	.			trans	-95.1	59.8	179	-95.3	-75.5	0	0	0	111.8	N24 W56 Q61 F62	N24-F59 HydrophobicContact CB-CE2 3.86Å; N24-F59 HydrophobicContact CB-CZ 3.54Å; N24-F59 VanDerWaalsContact CG-CE2 3.42Å; N24-F59 WeakPolarHBondContact OD1-CE2 3.5Å; W56-F59 PolarHBondContact O-N 2.83Å; W56-F59 VanDerWaalsContact O-N 3.12Å; F59-Q61 PolarHBondContact O-N 3.21Å; F59-F62 HydrophobicContact CB-CD2 4.04Å; F59-F62 AromaticContact CD1-CD2 3.5Å; F59-F62 HydrophobicContact CD1-CD2 3.5Å; F59-F62 VanDerWaalsContact CD1-CD2 3.5Å; F59-F62 AromaticContact CD1-CE2 3.4Å; F59-F62 HydrophobicContact CD1-CE2 3.4Å; F59-F62 VanDerWaalsContact CD1-CE2 3.4Å; F59-F62 HydrophobicContact CE1-CD2 4.16Å; F59-F62 AromaticContact CE1-CE2 3.57Å; F59-F62 HydrophobicContact CE1-CE2 3.57Å; F59-F62 HydrophobicContact CG-CD2 4.03Å; F59-F62 HydrophobicContact CG-CE2 4.15Å; F59-F62 HydrophobicContact CZ-CE2 4.42Å; F59-F62 PolarHBondContact O-N 3.33Å
60	H	54.9	Low	53.6	Low	186 Å²	186	105.3 Å²	105.3	86%	0.861	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	8.4	176.2	-94	-79.2	0	0	0	115	S57 S58	S57-H60 PolarHBondContact O-CD2 2.82Å; S58-H60 PolarHBondContact O-N 3.11Å
61	Q	55	Low	52.3	Low	186 Å²	186	106.7 Å²	106.7	87%	0.869	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111	5.9	-178.2	-161.9	145.9	12.9	0	0	113.9	F59	F59-Q61 PolarHBondContact O-N 3.21Å
62	F	46.4	Very low	50.7	Low	78 Å²	78	106.8 Å²	106.8	34%	0.342	57%	0.571	S	S	.	*			trans	-96.6	111.2	175.8	-88.4	-83.6	0	0	0	112	K28 F59 L64	K28-F62 HydrophobicContact CD-CZ 4.1Å; F59-F62 HydrophobicContact CB-CD2 4.04Å; F59-F62 AromaticContact CD1-CD2 3.5Å; F59-F62 HydrophobicContact CD1-CD2 3.5Å; F59-F62 VanDerWaalsContact CD1-CD2 3.5Å; F59-F62 AromaticContact CD1-CE2 3.4Å; F59-F62 HydrophobicContact CD1-CE2 3.4Å; F59-F62 VanDerWaalsContact CD1-CE2 3.4Å; F59-F62 HydrophobicContact CE1-CD2 4.16Å; F59-F62 AromaticContact CE1-CE2 3.57Å; F59-F62 HydrophobicContact CE1-CE2 3.57Å; F59-F62 HydrophobicContact CG-CD2 4.03Å; F59-F62 HydrophobicContact CG-CE2 4.15Å; F59-F62 HydrophobicContact CZ-CE2 4.42Å; F59-F62 PolarHBondContact O-N 3.33Å; F62-L64 HydrophobicContact CB-CD1 3.55Å; F62-L64 HydrophobicContact CB-CG 3.91Å; F62-L64 HydrophobicContact CD1-CD1 4.3Å; F62-L64 HydrophobicContact CD1-CG 4.33Å; F62-L64 HydrophobicContact CG-CD1 4.08Å; F62-L64 HydrophobicContact CG-CG 4.48Å; F62-L64 PolarHBondContact O-N 3.45Å
63	D	51.9	Low	49.6	Very low	108 Å²	108	110.6 Å²	110.6	58%	0.578	59%	0.593	S	S	*	*			trans	-72.7	49.5	170.7	-131.3	15.8	0	0	0	110.6	I65 K66	D63-I65 PolarHBondContact O-N 3.35Å; D63-I65 VanDerWaalsContact O-N 3.12Å; D63-K66 PolarHBondContact O-N 3.36Å; D63-K66 IonicContact OD2-NZ 2.8Å; D63-K66 PolarHBondContact OD2-NZ 2.97Å
64	L	50.6	Low	48.5	Very low	74 Å²	74	117.7 Å²	117.7	39%	0.387	62%	0.624	S	S	.	*	G	3₁₀ helix	trans	-68.1	-8.1	-173.1	-90.2	154.4	0	0	0	114	W56 F62 K66	W56-L64 HydrophobicContact CE3-CD1 4.47Å; W56-L64 HydrophobicContact CZ3-CD1 3.85Å; F62-L64 HydrophobicContact CB-CD1 3.55Å; F62-L64 HydrophobicContact CB-CG 3.91Å; F62-L64 HydrophobicContact CD1-CD1 4.3Å; F62-L64 HydrophobicContact CD1-CG 4.33Å; F62-L64 HydrophobicContact CG-CD1 4.08Å; F62-L64 HydrophobicContact CG-CG 4.48Å; F62-L64 PolarHBondContact O-N 3.45Å; L64-K66 VanDerWaalsContact C-N 3.26Å; L64-K66 PolarHBondContact O-N 3.18Å
65	I	47.7	Very low	47.5	Very low	135 Å²	135	116.1 Å²	116.1	69%	0.692	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-72	-20.9	178.4	-59.9	175.5	0	0	0	111.5	D63	D63-I65 PolarHBondContact O-N 3.35Å; D63-I65 VanDerWaalsContact O-N 3.12Å
66	K	54.6	Low	46.7	Very low	153 Å²	153	120.7 Å²	120.7	67%	0.665	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-83.3	-17.9	-174.6	-75.1	174.8	-178.2	154.4	0	115.2	D63 L64	D63-K66 PolarHBondContact O-N 3.36Å; D63-K66 IonicContact OD2-NZ 2.8Å; D63-K66 PolarHBondContact OD2-NZ 2.97Å; L64-K66 VanDerWaalsContact C-N 3.26Å; L64-K66 PolarHBondContact O-N 3.18Å
67	N	50.5	Low	45.8	Very low	149 Å²	149	126.7 Å²	126.7	80%	0.797	66%	0.659	S	S	*	*	S	Bend	trans	-126.3	6.8	-168.7	-70.8	-40.3	0	0	0	115.2
68	Y	43.7	Very low	44.6	Very low	133 Å²	133	128 Å²	128	52%	0.522	66%	0.664	S	S	.	*	S	Bend	trans	-133.1	125.6	176.3	-143.7	-96.2	0	0	0	111	L70	Y68-L70 PolarHBondContact O-N 2.87Å
69	P	44.3	Very low	43.8	Very low	93 Å²	93	134.3 Å²	134.3	60%	0.604	68%	0.677	S	S	*	*			trans	-58.7	124.9	168.1	-15.7	28.2	0	0	0	108.8	S71	P69-S71 PolarHBondContact O-N 2.94Å
70	L	44.1	Very low	43.1	Very low	131 Å²	131	140.2 Å²	140.2	69%	0.686	71%	0.705	S	S	*	*	S	Bend	trans	-65.4	24.1	179	-69.6	171.2	0	0	0	114.1	Y68 C72	Y68-L70 PolarHBondContact O-N 2.87Å; L70-C72 VanDerWaalsContact C-N 3.35Å; L70-C72 PolarHBondContact O-N 3.26Å
71	S	42.2	Very low	42.3	Very low	103 Å²	103	136.8 Å²	136.8	72%	0.72	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	10.7	-170.8	58.2	0	0	0	0	115.1	P69	P69-S71 PolarHBondContact O-N 2.94Å
72	C	35.6	Very low	41.1	Very low	104 Å²	104	135.8 Å²	135.8	70%	0.703	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.5	7.9	178.4	-101.3	0	0	0	0	115.2	L70 H74	L70-C72 VanDerWaalsContact C-N 3.35Å; L70-C72 PolarHBondContact O-N 3.26Å; C72-H74 VanDerWaalsContact C-N 3.32Å; C72-H74 PolarHBondContact O-N 3.08Å
73	L	41.5	Very low	40.6	Very low	137 Å²	137	137.9 Å²	137.9	72%	0.717	73%	0.727	S	S	*	*	S	Bend	trans	-91.8	29.1	-178.5	-108.9	126.4	0	0	0	113.9
74	H	34	Very low	39.7	Very low	185 Å²	185	139 Å²	139	86%	0.856	74%	0.738	S	S	*	*	S	Bend	trans	-153.9	80.3	173.1	-74.5	97	0	0	0	110.8	C72	C72-H74 VanDerWaalsContact C-N 3.32Å; C72-H74 PolarHBondContact O-N 3.08Å
75	S	35.4	Very low	39	Very low	104 Å²	104	145.5 Å²	145.5	73%	0.727	76%	0.764	S	S	*	*			trans	-172	129.7	153.2	-135.4	0	0	0	0	112.3
76	K	35.5	Very low	38.2	Very low	180 Å²	180	142.2 Å²	142.2	78%	0.783	76%	0.763	S	S	*	*			trans	83.8	89	159	-49.3	-176.2	-174.3	-172	0	117.1
77	H	35.8	Very low	37.3	Very low	197 Å²	197	143.6 Å²	143.6	91%	0.912	78%	0.777	S	S	*	*				-157	90.3	125.6	-101.2	-75.1	0	0	0	108.8
78	T	31.8	Very low	36.7	Very low	118 Å²	118	145.3 Å²	145.3	72%	0.724	78%	0.777	S	S	*	*			trans	-96.5	154.7	153.7	45.7	0	0	0	0	107.8
79	Y	36.1	Very low	36.3	Very low	211 Å²	211	147 Å²	147	83%	0.827	79%	0.79	S	S	*	*			trans	96.4	82.9	-177.1	-60	-77	0	0	0	116.9
80	E	33	Very low	35.8	Very low	180 Å²	180	148.1 Å²	148.1	84%	0.841	80%	0.8	S	S	*	*			trans	10.2	125.5	136.5	-64.8	175	153.8	0	0	119.9
81	S	37.6	Very low	35.2	Very low	113 Å²	113	147.9 Å²	147.9	79%	0.79	81%	0.808	S	S	*	*				-175.4	109.6	115.9	33.2	0	0	0	0	111.8
82	N	31.8	Very low	34.8	Very low	166 Å²	166	150.4 Å²	150.4	89%	0.888	81%	0.812	S	S	*	*			trans	21.9	100.8	144.7	-57.4	-21.9	0	0	0	119.3
83	S	34.8	Very low	34.7	Very low	122 Å²	122	153.2 Å²	153.2	85%	0.853	82%	0.82	S	S	*	*			trans	-161.9	111.9	140	179.8	0	0	0	0	110.2	F85	S83-F85 PolarHBondContact O-N 3.08Å
84	T	32.9	Very low	34.6	Very low	131 Å²	131	154.7 Å²	154.7	80%	0.804	83%	0.827	S	S	*	*			trans	-65	111.2	177.2	-54.2	0	0	0	0	111
85	F	37.1	Very low	34.5	Very low	211 Å²	211	154.9 Å²	154.9	93%	0.925	83%	0.828	S	S	*	*			trans	-161.8	128.8	144.5	-109.1	-79.1	0	0	0	109.3	S83	S83-F85 PolarHBondContact O-N 3.08Å
86	G	30.4	Very low	34.5	Very low	66 Å²	66	159.4 Å²	159.4	68%	0.68	84%	0.835	S	S	*	*			trans	-75	147.2	-153.6	0	0	0	0	0	117.4
87	L	35.9	Very low	34.6	Very low	181 Å²	181	159.4 Å²	159.4	95%	0.948	84%	0.842	S	S	*	*			trans	-140.6	91.3	146	-75.7	177.7	0	0	0	107.4
88	K	37.4	Very low	34.5	Very low	185 Å²	185	153.5 Å²	153.5	80%	0.804	84%	0.835	S	S	*	*			trans	-75.1	139.9	162.4	-87.4	-177.8	169.1	-169.7	0	108.4
89	E	34.3	Very low	34.5	Very low	169 Å²	169	153.2 Å²	153.2	79%	0.79	84%	0.838	S	S	*	*			trans	66.9	89.3	150.9	-68.1	160.9	158.7	0	0	118
90	S	34.8	Very low	34.3	Very low	117 Å²	117	151 Å²	151	82%	0.818	84%	0.837	S	S	*	*			trans	-153.8	44.1	152	75.7	0	0	0	0	113.6
91	C	31.7	Very low	34.7	Very low	126 Å²	126	148 Å²	148	85%	0.851	83%	0.831	S	S	*	*	S	Bend	trans	-145	45.1	169.4	-78.9	0	0	0	0	111.2
92	L	34.1	Very low	34.6	Very low	156 Å²	156	151.6 Å²	151.6	82%	0.817	83%	0.833	S	S	*	*			trans	-143.6	94.9	171.9	-79.6	170.6	0	0	0	108
93	N	33.5	Very low	34.7	Very low	163 Å²	163	152.5 Å²	152.5	87%	0.872	83%	0.831	S	S	*	*			trans	-174.1	68.6	162	-95.8	-20.1	0	0	0	110.6
94	I	37.7	Very low	34.8	Very low	167 Å²	167	151.7 Å²	151.7	86%	0.856	83%	0.826	S	S	*	*			trans	-149.2	72.9	141.4	-53.3	-170.4	0	0	0	107.2
95	H	32.2	Very low	34.8	Very low	190 Å²	190	151.5 Å²	151.5	88%	0.88	83%	0.825	S	S	*	*			trans	-129.2	142.3	152.9	-106	-105.3	0	0	0	105.5
96	K	36.5	Very low	34.8	Very low	199 Å²	199	148.2 Å²	148.2	87%	0.865	82%	0.816	S	S	*	*			trans	103.1	89.7	168.8	-146.8	163.9	-167.8	178	0	115.3
97	L	37.6	Very low	34.8	Very low	179 Å²	179	150.7 Å²	150.7	94%	0.937	81%	0.814	S	S	*	*	S	Bend		-175.8	119.7	125.8	-93.5	159.7	0	0	0	110.8
98	G	32.6	Very low	34.7	Very low	74 Å²	74	148.7 Å²	148.7	76%	0.763	80%	0.804	S	S	*	*			trans	80.3	87.7	165	0	0	0	0	0	116.1
99	S	33.5	Very low	34.3	Very low	112 Å²	112	146.5 Å²	146.5	78%	0.783	80%	0.801	S	S	*	*				69.1	110.4	52.4	-126.9	0	0	0	0	115.4
100	M	31.2	Very low	34.5	Very low	165 Å²	165	147.2 Å²	147.2	81%	0.813	80%	0.804	S	S	*	*			trans	80.3	127.3	152.6	-42.6	-151.2	72.3	0	0	116.4
101	T	40.3	Very low	34.5	Very low	117 Å²	117	147.8 Å²	147.8	72%	0.718	80%	0.798	S	S	*	*			cis	-153.5	129	24.8	43.1	0	0	0	0	109.8
102	K	36.4	Very low	34.7	Very low	188 Å²	188	149 Å²	149	82%	0.817	79%	0.794	S	S	*	*				33.5	111.5	110.1	-58.6	-174.6	-176.9	-177.9	0	113.5
103	E	33.7	Very low	34.7	Very low	185 Å²	185	149.4 Å²	149.4	86%	0.864	79%	0.792	S	S	*	*				175.8	156.8	72.6	-104.4	161.5	168.7	0	0	104.5
104	S	37.6	Very low	34.8	Very low	105 Å²	105	146.3 Å²	146.3	73%	0.734	78%	0.778	S	S	*	*			cis	-162.2	142.3	14.1	36.8	0	0	0	0	106.5
105	T	32.1	Very low	34.7	Very low	127 Å²	127	144.3 Å²	144.3	78%	0.779	77%	0.77	S	S	*	*			trans	-47.8	132.2	162.1	29.6	0	0	0	0	112
106	L	36.3	Very low	35	Very low	141 Å²	141	144.1 Å²	144.1	74%	0.738	77%	0.766	S	S	*	*				179.6	116.5	119.1	-112.6	102.9	0	0	0	110
107	N	31.7	Very low	34.9	Very low	119 Å²	119	142.6 Å²	142.6	64%	0.636	76%	0.762	S	S	*	*				62.1	105.6	125.6	-62.1	5	0	0	0	118.7
108	N	33.1	Very low	34.9	Very low	139 Å²	139	138.6 Å²	138.6	74%	0.743	75%	0.748	S	S	*	*				154.8	108.8	100.5	-79.1	-31.8	0	0	0	111.1
109	D	28.8	Very low	35.1	Very low	138 Å²	138	144.4 Å²	144.4	74%	0.738	76%	0.755	S	S	*	*			trans	17.9	113	134.3	-59.5	-46.9	0	0	0	117.5
110	H	38.2	Very low	35.5	Very low	184 Å²	184	144.2 Å²	144.2	85%	0.852	75%	0.745	S	S	*	*			trans	-118.7	82.9	148.9	-109.4	-21.2	0	0	0	108.3	I112	H110-I112 PolarHBondContact O-N 3.36Å
111	D	35.4	Very low	35.7	Very low	130 Å²	130	143.4 Å²	143.4	70%	0.695	74%	0.744	S	S	*	*			trans	32.1	80.8	142.1	-53	-42.9	0	0	0	115.3	E113	D111-E113 PolarHBondContact O-N 3.16Å
112	I	35.1	Very low	35.7	Very low	152 Å²	152	143.2 Å²	143.2	78%	0.779	74%	0.738	S	S	*	*			trans	-65.1	95.3	140.7	-59.9	172.3	0	0	0	104.5	H110 V114	H110-I112 PolarHBondContact O-N 3.36Å; I112-V114 HydrophobicContact CG2-CG2 3.83Å; I112-V114 PolarHBondContact O-N 3.34Å
113	E	35.4	Very low	35.7	Very low	163 Å²	163	142 Å²	142	76%	0.762	74%	0.74	S	S	*	*			trans	-65.8	82.9	167.9	-149.4	174.2	-146.8	0	0	107	D111 N115	D111-E113 PolarHBondContact O-N 3.16Å; E113-N115 PolarHBondContact O-N 2.99Å
114	V	35.4	Very low	35.7	Very low	98 Å²	98	138.6 Å²	138.6	59%	0.594	73%	0.726	S	S	*	*			trans	-63.9	93.5	158.2	179.7	0	0	0	0	103.5	I112 K116	I112-V114 HydrophobicContact CG2-CG2 3.83Å; I112-V114 PolarHBondContact O-N 3.34Å; V114-K116 HydrophobicContact CG1-CG 4.01Å; V114-K116 PolarHBondContact O-N 2.95Å
115	N	35.1	Very low	35.8	Very low	125 Å²	125	140.4 Å²	140.4	67%	0.668	73%	0.733	S	S	*	*			trans	-54.2	91	171.6	-73	-22.1	0	0	0	108.7	E113	E113-N115 PolarHBondContact O-N 2.99Å
116	K	39.3	Very low	35.7	Very low	187 Å²	187	142.5 Å²	142.5	81%	0.813	73%	0.734	S	S	*	*			trans	-96	53.8	163.6	-67.2	-173.9	-178.8	177.1	0	107.4	V114	V114-K116 HydrophobicContact CG1-CG 4.01Å; V114-K116 PolarHBondContact O-N 2.95Å
117	E	34.1	Very low	35.6	Very low	166 Å²	166	142 Å²	142	78%	0.776	73%	0.732	S	S	*	*			trans	-139.8	126.8	178.3	-72.8	-170.6	162.9	0	0	110.5
118	C	38.1	Very low	35.8	Very low	95 Å²	95	144.1 Å²	144.1	64%	0.642	74%	0.738	S	S	*	*			trans	83.3	71.8	163.5	-50.3	0	0	0	0	116.6	I120	C118-I120 HydrophobicContact CB-CD1 3.77Å; C118-I120 HydrophobicContact CB-CG1 3.88Å; C118-I120 PolarHBondContact O-N 3.36Å
119	E	35.6	Very low	35.7	Very low	196 Å²	196	144.5 Å²	144.5	92%	0.916	74%	0.74	S	S	*	*			trans	-57.7	89.3	130.9	-83.4	-178.5	169.1	0	0	107.1
120	I	42.4	Very low	36.1	Very low	109 Å²	109	145.5 Å²	145.5	56%	0.559	74%	0.744	S	S	*	*			trans	-111.6	80	160	-65.9	167.4	0	0	0	104.8	C118 L122	C118-I120 HydrophobicContact CB-CD1 3.77Å; C118-I120 HydrophobicContact CB-CG1 3.88Å; C118-I120 PolarHBondContact O-N 3.36Å; I120-L122 HydrophobicContact CG2-CB 3.64Å; I120-L122 HydrophobicContact CG2-CD1 3.56Å; I120-L122 HydrophobicContact CG2-CD2 4.33Å; I120-L122 HydrophobicContact CG2-CG 4Å; I120-L122 PolarHBondContact O-N 2.86Å
121	D	34.8	Very low	35.8	Very low	148 Å²	148	142.4 Å²	142.4	79%	0.791	74%	0.738	S	S	*	*			trans	-72.5	73.6	155.1	-81.3	-23.9	0	0	0	106.9	N123	D121-N123 PolarHBondContact O-N 3.41Å
122	L	41.2	Very low	35.6	Very low	113 Å²	113	142.2 Å²	142.2	59%	0.592	74%	0.737	S	S	*	*			trans	-80.4	98.9	168	-122.5	66.8	0	0	0	107.7	I120 I124	I120-L122 HydrophobicContact CG2-CB 3.64Å; I120-L122 HydrophobicContact CG2-CD1 3.56Å; I120-L122 HydrophobicContact CG2-CD2 4.33Å; I120-L122 HydrophobicContact CG2-CG 4Å; I120-L122 PolarHBondContact O-N 2.86Å; L122-I124 HydrophobicContact CB-CB 4.24Å; L122-I124 HydrophobicContact CB-CG1 4.45Å; L122-I124 HydrophobicContact CD1-CD1 4.27Å; L122-I124 HydrophobicContact CD2-CB 3.85Å; L122-I124 HydrophobicContact CD2-CD1 3.72Å; L122-I124 HydrophobicContact CD2-CG1 4.07Å; L122-I124 HydrophobicContact CD2-CG2 4.44Å; L122-I124 HydrophobicContact CG-CB 3.85Å; L122-I124 HydrophobicContact CG-CD1 3.63Å; L122-I124 HydrophobicContact CG-CG1 3.73Å; L122-I124 PolarHBondContact O-N 3.46Å
123	N	37.1	Very low	35.5	Very low	161 Å²	161	143 Å²	143	86%	0.861	74%	0.737	S	S	*	*			trans	-61	54.3	150.7	-73.5	-54.5	0	0	0	110.9	D121	D121-N123 PolarHBondContact O-N 3.41Å
124	I	33.9	Very low	35.5	Very low	114 Å²	114	142.5 Å²	142.5	59%	0.585	73%	0.729	S	S	*	*			trans	-137.4	79.1	179.8	-60.8	-176.2	0	0	0	107.9	L122	L122-I124 HydrophobicContact CB-CB 4.24Å; L122-I124 HydrophobicContact CB-CG1 4.45Å; L122-I124 HydrophobicContact CD1-CD1 4.27Å; L122-I124 HydrophobicContact CD2-CB 3.85Å; L122-I124 HydrophobicContact CD2-CD1 3.72Å; L122-I124 HydrophobicContact CD2-CG1 4.07Å; L122-I124 HydrophobicContact CD2-CG2 4.44Å; L122-I124 HydrophobicContact CG-CB 3.85Å; L122-I124 HydrophobicContact CG-CD1 3.63Å; L122-I124 HydrophobicContact CG-CG1 3.73Å; L122-I124 PolarHBondContact O-N 3.46Å
125	V	38.1	Very low	35.9	Very low	143 Å²	143	143.6 Å²	143.6	87%	0.867	74%	0.738	S	S	*	*			trans	-146	58.2	131	-169.6	0	0	0	0	106.2
126	Q	31.5	Very low	36	Very low	172 Å²	172	144.9 Å²	144.9	80%	0.804	75%	0.745	S	S	*	*			trans	-106.3	94.6	143.5	-71.6	-176.2	-16.5	0	0	102.4
127	D	33.3	Very low	36.3	Very low	130 Å²	130	144.4 Å²	144.4	70%	0.695	74%	0.743	S	S	*	*	S	Bend	trans	160.1	107	152.4	-76.1	-16.5	0	0	0	109.1
128	E	35.7	Very low	36.3	Very low	163 Å²	163	145.1 Å²	145.1	76%	0.762	75%	0.747	S	S	*	*			trans	71.5	118.8	135	-50.3	-173	-161.8	0	0	119.7
129	N	32.2	Very low	36.5	Very low	147 Å²	147	150.9 Å²	150.9	79%	0.786	76%	0.756	S	S	*	*			trans	70.1	71.6	153.3	-63.1	-28.8	0	0	0	118.8
130	I	36.3	Very low	36.7	Very low	160 Å²	160	150.1 Å²	150.1	82%	0.821	75%	0.753	S	S	*	*			trans	-118	105.3	138.8	-61.7	-179.8	0	0	0	107.5	N132	I130-N132 PolarHBondContact O-N 2.94Å; I130-N132 VanDerWaalsContact O-N 3.16Å
131	T	32.1	Very low	36.5	Very low	119 Å²	119	151.8 Å²	151.8	73%	0.73	76%	0.761	S	S	*	*			trans	-45.3	112.3	174.2	35.3	0	0	0	0	110.9	E133	T131-E133 PolarHBondContact O-N 2.96Å
132	N	31.4	Very low	36.7	Very low	125 Å²	125	153 Å²	153	67%	0.668	77%	0.767	S	S	*	*			trans	-68.9	79	162	-79.4	-41.7	0	0	0	108.4	I130 Y134	I130-N132 PolarHBondContact O-N 2.94Å; I130-N132 VanDerWaalsContact O-N 3.16Å; N132-Y134 HydrophobicContact CB-CD2 4.47Å; N132-Y134 PolarHBondContact O-N 3.22Å
133	E	32.6	Very low	36.4	Very low	170 Å²	170	152.3 Å²	152.3	79%	0.794	77%	0.769	S	S	*	*			trans	-81.3	79.1	169.7	-150	171.2	-155.3	0	0	108.6	T131	T131-E133 PolarHBondContact O-N 2.96Å
134	Y	36.4	Very low	36.8	Very low	152 Å²	152	154.1 Å²	154.1	60%	0.596	77%	0.769	S	S	*	*			trans	-97.6	119	161.4	-83.3	-87.4	0	0	0	107.6	N132 N136	N132-Y134 HydrophobicContact CB-CD2 4.47Å; N132-Y134 PolarHBondContact O-N 3.22Å; Y134-N136 PolarHBondContact O-N 2.71Å
135	P	41.9	Very low	37.2	Very low	120 Å²	120	157.3 Å²	157.3	78%	0.779	78%	0.782	S	S	*	*			trans	-77	90.7	177	30	-29.9	0	0	0	108.8	K137	P135-K137 PolarHBondContact O-N 3Å
136	N	39	Very low	37.6	Very low	152 Å²	152	160.3 Å²	160.3	81%	0.813	78%	0.783	S	S	*	*			trans	-74.2	118.4	160.1	-78.3	-39.9	0	0	0	107.8	Y134 E138	Y134-N136 PolarHBondContact O-N 2.71Å; N136-E138 PolarHBondContact O-N 3.45Å; N136-E138 VanDerWaalsContact O-N 3.12Å
137	K	43.9	Very low	38.7	Very low	178 Å²	178	161.2 Å²	161.2	77%	0.774	78%	0.784	S	S	*	*			trans	-57.1	111.1	175.8	-65.9	174.9	178.6	-179.4	0	110	P135	P135-K137 PolarHBondContact O-N 3Å
138	E	34.4	Very low	39.1	Very low	181 Å²	181	160.7 Å²	160.7	85%	0.846	79%	0.788	S	S	*	*			trans	7.1	112.9	140.2	-159.9	161	-158.9	0	0	116.6	N136	N136-E138 PolarHBondContact O-N 3.45Å; N136-E138 VanDerWaalsContact O-N 3.12Å
139	Y	42.5	Very low	39.2	Very low	216 Å²	216	160.5 Å²	160.5	85%	0.847	79%	0.791	S	S	*	*			trans	-127.2	140	148.6	-32.2	-77.5	0	0	0	107.6
140	E	39.2	Very low	39.9	Very low	179 Å²	179	161.3 Å²	161.3	84%	0.836	79%	0.794	S	S	*	*			trans	-63.9	134.7	-160.3	-68.5	154.9	131.4	0	0	116.5
141	I	38.3	Very low	40.2	Very low	144 Å²	144	158 Å²	158	74%	0.738	79%	0.785	S	S	*	*				19.9	123	126.3	-52.1	170.9	0	0	0	117.3
142	L	39.9	Very low	41.2	Very low	173 Å²	173	158.8 Å²	158.8	91%	0.906	78%	0.784	S	S	*	*				-170.9	114.3	128	-97.9	172.5	0	0	0	110.2
143	P	35.7	Very low	42.4	Very low	99 Å²	99	160.4 Å²	160.4	64%	0.643	79%	0.787	S	S	*	*			trans	-107.9	148.5	168.3	35.3	-25.2	0	0	0	111.9
144	K	45.1	Very low	43.1	Very low	200 Å²	200	162.6 Å²	162.6	87%	0.87	79%	0.794	S	S	*	*			trans	126.4	116	156.4	-69.2	162.4	-173.2	-177.8	0	111.6
145	E	42.2	Very low	43.7	Very low	181 Å²	181	159.8 Å²	159.8	85%	0.846	80%	0.796	S	S	*	*				-172.2	133.5	106.9	-96.1	-173.2	-167.7	0	0	111.7
146	K	46	Very low	43.9	Very low	205 Å²	205	161.1 Å²	161.1	89%	0.891	80%	0.803	S	S	*	*			trans	-90	130.2	174.8	-67.7	174.2	176.6	177.7	0	109
147	K	53.9	Low	45	Very low	191 Å²	191	159.2 Å²	159.2	83%	0.83	80%	0.797	S	S	*	*			trans	-147.7	154.2	158.1	-86.1	-165.8	-173.6	164.5	0	111.3
148	P	42.1	Very low	46.3	Very low	119 Å²	119	156.1 Å²	156.1	77%	0.773	79%	0.794	S	S	*	*				-108.3	169.5	-125.8	31.9	-21.1	0	0	0	116.1
149	I	38.9	Very low	47.9	Very low	159 Å²	159	153 Å²	153	82%	0.815	79%	0.79	S	S	*	*			trans	-39.1	124.7	174.4	-56.4	156.5	0	0	0	112.6
150	L	46.1	Very low	49.3	Very low	164 Å²	164	147.6 Å²	147.6	86%	0.859	78%	0.781	S	S	*	*			trans	-133.4	124.7	148.6	-130.6	87.4	0	0	0	109.5
151	S	42.5	Very low	50.9	Low	91 Å²	91	144.1 Å²	144.1	64%	0.636	77%	0.774	S	S	*	*			trans	-27.8	149.4	164.9	-39.4	0	0	0	0	115
152	I	53.7	Low	52.2	Low	135 Å²	135	142.2 Å²	142.2	69%	0.692	77%	0.771	S	S	*	*				-176.5	152	100.2	-60.1	127.6	0	0	0	107.3
153	H	56.9	Low	53	Low	160 Å²	160	141.8 Å²	141.8	74%	0.741	76%	0.764	S	S	*	*			trans	69.5	98.4	157.4	45.1	-104.7	0	0	0	120.8	S155	H153-S155 PolarHBondContact O-N 3.34Å
154	K	45.6	Very low	54.1	Low	216 Å²	216	144.7 Å²	144.7	94%	0.939	77%	0.769	S	S	*	*			trans	-49.9	115.5	149.9	-77.2	172.3	173.6	176.2	0	110.4
155	S	49.6	Very low	54.6	Low	93 Å²	93	143.8 Å²	143.8	65%	0.65	77%	0.768	S	S	*	*			trans	-137.6	116.9	148	66.3	0	0	0	0	107.6	H153 T157	H153-S155 PolarHBondContact O-N 3.34Å; S155-T157 VanDerWaalsContact C-N 3.31Å; S155-T157 PolarHBondContact O-N 3.43Å
156	T	45.8	Very low	55.4	Low	148 Å²	148	143.3 Å²	143.3	91%	0.908	77%	0.765	S	S	*	*			trans	-70.2	88.8	177.9	-57	0	0	0	0	107.9
157	T	63.3	Low	56	Low	112 Å²	112	139.4 Å²	139.4	69%	0.687	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-91.9	131.9	162.3	53.3	0	0	0	0	108.2	S155	S155-T157 VanDerWaalsContact C-N 3.31Å; S155-T157 PolarHBondContact O-N 3.43Å
158	P	70.2	Confident	56.1	Low	112 Å²	112	136.9 Å²	136.9	73%	0.727	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-59.6	146.1	176.1	25.9	-32.1	0	0	0	109.8
159	P	68.6	Low	56.6	Low	116 Å²	116	136.7 Å²	136.7	75%	0.753	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-59.6	142.9	-178	25.5	-33.2	0	0	0	110.3
160	P	71.2	Confident	57.4	Low	102 Å²	102	135.8 Å²	135.8	66%	0.662	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-60.4	147.1	176.8	25.1	-31.9	0	0	0	110.2
161	P	72.2	Confident	58.3	Low	106 Å²	106	136.1 Å²	136.1	69%	0.688	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-57.5	142.9	178.8	-16.4	27.8	0	0	0	110.1	H163	P161-H163 PolarHBondContact O-N 3.02Å; P161-H163 VanDerWaalsContact O-N 3.07Å
162	P	67.6	Low	59.2	Low	105 Å²	105	141.1 Å²	141.1	68%	0.682	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-55.8	120.5	179	21.6	-30.8	0	0	0	109.4	H164	P162-H164 PolarHBondContact O-N 3.12Å; P162-H164 PolarHBondContact O-ND1 3.01Å
163	H	55.1	Low	59.9	Low	163 Å²	163	138.7 Å²	138.7	76%	0.755	74%	0.74	S	S	*	*			trans	-51	110.4	172.3	-66	-72.8	0	0	0	107.9	P161 H165	P161-H163 PolarHBondContact O-N 3.02Å; P161-H163 VanDerWaalsContact O-N 3.07Å; H163-H165 PolarHBondContact O-N 3.33Å
164	H	59	Low	60.9	Low	160 Å²	160	134.4 Å²	134.4	74%	0.741	73%	0.725	S	S	*	*			trans	-62.1	109.3	174.2	-70.5	32.7	0	0	0	105.9	P162 H166	P162-H164 PolarHBondContact O-N 3.12Å; P162-H164 PolarHBondContact O-ND1 3.01Å; H164-H166 PolarHBondContact O-N 2.88Å
165	H	56.7	Low	62.7	Low	182 Å²	182	130.7 Å²	130.7	84%	0.843	71%	0.714	S	S	*	*			trans	-54.1	106.6	173.7	-71.3	-86.9	0	0	0	107	H163 P167	H163-H165 PolarHBondContact O-N 3.33Å; H165-P167 VanDerWaalsContact O-N 3.14Å
166	H	58.8	Low	64.4	Low	171 Å²	171	135.7 Å²	135.7	79%	0.792	72%	0.719	S	S	*	*			trans	-51.1	124.1	170.7	-70.5	-80.1	0	0	0	106.7	H164 L168	H164-H166 PolarHBondContact O-N 2.88Å; H166-L168 PolarHBondContact O-N 3.19Å
167	P	58.5	Low	66.5	Low	123 Å²	123	132.6 Å²	132.6	80%	0.799	69%	0.694	S	S	*	*			trans	-55.4	118.6	179.1	19	-28.2	0	0	0	106.8	H165 S169	H165-P167 VanDerWaalsContact O-N 3.14Å; P167-S169 PolarHBondContact O-N 3.09Å; P167-S169 VanDerWaalsContact O-N 3.08Å
168	L	55.2	Low	67.8	Low	138 Å²	138	128 Å²	128	72%	0.723	67%	0.666	S	S	*	*			trans	-38.2	121.3	178.6	-67.3	170.1	0	0	0	107.3	H166 M170	H166-L168 PolarHBondContact O-N 3.19Å; L168-M170 VanDerWaalsContact C-N 3.27Å; L168-M170 PolarHBondContact O-N 3.08Å
169	S	52.6	Low	68.9	Low	114 Å²	114	124.5 Å²	124.5	80%	0.797	64%	0.642	S	S	*	*			trans	-57.7	97.6	-173.5	73.5	0	0	0	0	107.9	P167 K171	P167-S169 PolarHBondContact O-N 3.09Å; P167-S169 VanDerWaalsContact O-N 3.08Å; S169-K171 VanDerWaalsContact C-N 3.29Å; S169-K171 PolarHBondContact O-N 3.28Å
170	M	57.1	Low	70.2	Confident	141 Å²	141	123.3 Å²	123.3	70%	0.695	63%	0.63	S	S	*	*			trans	-60.5	102.6	173.2	-76.1	-70.5	-76.7	0	0	104	L168 K172	L168-M170 VanDerWaalsContact C-N 3.27Å; L168-M170 PolarHBondContact O-N 3.08Å; M170-K172 PolarHBondContact O-N 3.44Å
171	K	63.2	Low	71.3	Confident	171 Å²	171	121.5 Å²	121.5	74%	0.743	61%	0.614	S	S	*	*			trans	-51.8	109.7	-177.9	-179.1	169.8	177.7	171.5	0	105.6	S169 F173	S169-K171 VanDerWaalsContact C-N 3.29Å; S169-K171 PolarHBondContact O-N 3.28Å; K171-F173 VanDerWaalsContact C-N 3.35Å; K171-F173 PolarHBondContact O-N 2.95Å
172	K	62.8	Low	72.6	Confident	195 Å²	195	116.5 Å²	116.5	85%	0.848	58%	0.581	S	S	*	*			trans	-63.9	101.1	-172.4	-172.4	165.7	-178.6	171.2	0	106.6	M170 T174	M170-K172 PolarHBondContact O-N 3.44Å; K172-T174 PolarHBondContact O-N 3.33Å
173	F	67.9	Low	73.9	Confident	85 Å²	85	116.5 Å²	116.5	37%	0.373	57%	0.571	S	S	.	*			trans	-54.8	128.8	176.6	-91.8	-90.7	0	0	0	107.9	K171 E177 T178 L181 H208	K171-F173 VanDerWaalsContact C-N 3.35Å; K171-F173 PolarHBondContact O-N 2.95Å; F173-E177 HydrophobicContact CD1-CB 3.86Å; F173-E177 HydrophobicContact CE1-CB 4.48Å; F173-T178 HydrophobicContact CB-CG2 3.7Å; F173-T178 HydrophobicContact CD1-CG2 4.47Å; F173-T178 HydrophobicContact CG-CG2 4.35Å; F173-L181 HydrophobicContact CE1-CD1 4.49Å; F173-H208 AromaticContact CD2-CD2 3.46Å; F173-H208 VanDerWaalsContact CD2-CD2 3.46Å; F173-H208 WeakPolarHBondContact CD2-CD2 3.37Å; F173-H208 AromaticContact CD2-NE2 3.83Å; F173-H208 AromaticContact CE2-CD2 3.55Å; F173-H208 AromaticContact CE2-NE2 3.45Å; F173-H208 WeakPolarHBondContact CE2-NE2 3.35Å
174	T	77.4	Confident	75.9	Confident	69 Å²	69	110.8 Å²	110.8	42%	0.423	55%	0.549	S	S	.	.			trans	-67.5	146.3	174	65.1	0	0	0	0	108.2	K172 R176 E177 T178	K172-T174 PolarHBondContact O-N 3.33Å; T174-R176 PolarHBondContact O-N 3.04Å; T174-E177 PolarHBondContact N-OE2 3.4Å; T174-E177 PolarHBondContact O-N 3.35Å; T174-E177 VanDerWaalsContact OG1-CD 3.27Å; T174-E177 VanDerWaalsContact OG1-CG 3.25Å; T174-E177 WeakPolarHBondContact OG1-CG 3.38Å; T174-E177 PolarHBondContact OG1-N 3.31Å; T174-E177 PolarHBondContact OG1-OE2 3.23Å; T174-T178 PolarHBondContact O-N 3.11Å
175	I	84.1	Confident	77.8	Confident	138 Å²	138	104.5 Å²	104.5	71%	0.708	52%	0.519	S	S	*	.	H	α-helix	trans	-53.5	-26.1	175.2	-62.9	170	0	0	0	111.1	T178 T179	I175-T178 PolarHBondContact O-OG1 3.32Å; I175-T179 WeakPolarHBondContact O-CB 3.26Å; I175-T179 VanDerWaalsContact O-CG2 3.24Å; I175-T179 WeakPolarHBondContact O-CG2 3.4Å; I175-T179 PolarHBondContact O-N 2.71Å; I175-T179 PolarHBondContact O-OG1 3.35Å
176	R	86.2	Confident	79.7	Confident	199 Å²	199	96.3 Å²	96.3	75%	0.751	48%	0.481	S	S	*	.	H	α-helix	trans	-72.2	-45.7	176.8	-63.8	-176.3	-179.8	-152.6	0.4	112.3	T174 T179 N180	T174-R176 PolarHBondContact O-N 3.04Å; R176-T179 WeakPolarHBondContact CA-OG1 3.29Å; R176-T179 PolarHBondContact O-N 3.4Å; R176-T179 PolarHBondContact O-OG1 2.99Å; R176-N180 WeakPolarHBondContact O-CB 3.49Å; R176-N180 PolarHBondContact O-N 2.93Å; R176-N180 PolarHBondContact O-ND2 3.03Å; R176-N180 PolarHBondContact O-OD1 3.31Å
177	E	88.8	Confident	81.3	Confident	83 Å²	83	91.8 Å²	91.8	39%	0.388	46%	0.463	S	S	.	.	H	α-helix	trans	-63.8	-44.5	178.3	-72	160.6	149.1	0	0	111.6	F173 T174 T179 N180 L181	F173-E177 HydrophobicContact CD1-CB 3.86Å; F173-E177 HydrophobicContact CE1-CB 4.48Å; T174-E177 PolarHBondContact N-OE2 3.4Å; T174-E177 PolarHBondContact O-N 3.35Å; T174-E177 VanDerWaalsContact OG1-CD 3.27Å; T174-E177 VanDerWaalsContact OG1-CG 3.25Å; T174-E177 WeakPolarHBondContact OG1-CG 3.38Å; T174-E177 PolarHBondContact OG1-N 3.31Å; T174-E177 PolarHBondContact OG1-OE2 3.23Å; E177-T179 VanDerWaalsContact C-N 3.33Å; E177-T179 PolarHBondContact O-N 3.07Å; E177-N180 PolarHBondContact O-N 3.33Å; E177-L181 WeakPolarHBondContact O-CG 3.49Å; E177-L181 PolarHBondContact O-N 3.16Å; E177-L181 VanDerWaalsContact O-N 3.13Å
178	T	90.9	Very high	83.1	Confident	15 Å²	15	91.6 Å²	91.6	9%	0.092	46%	0.455	C	S	.	.	H	α-helix	trans	-60.4	-44.5	177.4	59.7	0	0	0	0	111.4	F173 T174 I175 L181 L182	F173-T178 HydrophobicContact CB-CG2 3.7Å; F173-T178 HydrophobicContact CD1-CG2 4.47Å; F173-T178 HydrophobicContact CG-CG2 4.35Å; T174-T178 PolarHBondContact O-N 3.11Å; I175-T178 PolarHBondContact O-OG1 3.32Å; T178-L181 PolarHBondContact O-N 3.37Å; T178-L182 WeakPolarHBondContact O-CG 3.38Å; T178-L182 PolarHBondContact O-N 2.92Å
179	T	93.5	Very high	85	Confident	38 Å²	38	88.1 Å²	88.1	23%	0.233	44%	0.435	C	S	.	.	H	α-helix	trans	-69.4	-32.5	178.6	52.3	0	0	0	0	113.2	I175 R176 E177 L182 K183	I175-T179 WeakPolarHBondContact O-CB 3.26Å; I175-T179 VanDerWaalsContact O-CG2 3.24Å; I175-T179 WeakPolarHBondContact O-CG2 3.4Å; I175-T179 PolarHBondContact O-N 2.71Å; I175-T179 PolarHBondContact O-OG1 3.35Å; R176-T179 WeakPolarHBondContact CA-OG1 3.29Å; R176-T179 PolarHBondContact O-N 3.4Å; R176-T179 PolarHBondContact O-OG1 2.99Å; E177-T179 VanDerWaalsContact C-N 3.33Å; E177-T179 PolarHBondContact O-N 3.07Å; T179-L182 PolarHBondContact O-N 3.22Å; T179-K183 WeakPolarHBondContact O-CB 3.15Å; T179-K183 VanDerWaalsContact O-CG 3.27Å; T179-K183 WeakPolarHBondContact O-CG 3.29Å; T179-K183 PolarHBondContact O-N 2.66Å
180	N	95.3	Very high	86.9	Confident	92 Å²	92	87.1 Å²	87.1	49%	0.492	41%	0.414	S	S	.	.	H	α-helix	trans	-65.6	-40.5	175.9	-72.1	-13.4	0	0	0	112.1	R176 E177 L182 K183 S184	R176-N180 WeakPolarHBondContact O-CB 3.49Å; R176-N180 PolarHBondContact O-N 2.93Å; R176-N180 PolarHBondContact O-ND2 3.03Å; R176-N180 PolarHBondContact O-OD1 3.31Å; E177-N180 PolarHBondContact O-N 3.33Å; N180-L182 VanDerWaalsContact C-N 3.34Å; N180-L182 PolarHBondContact O-N 3.44Å; N180-K183 PolarHBondContact O-N 2.95Å; N180-S184 WeakPolarHBondContact O-CB 3.42Å; N180-S184 PolarHBondContact O-N 3.11Å
181	L	95.6	Very high	88.4	Confident	64 Å²	64	89.3 Å²	89.3	34%	0.335	42%	0.416	S	S	.	.	H	α-helix	trans	-59.1	-45.5	174.7	-70.6	167.6	0	0	0	111.6	F173 E177 T178 S184 W185 I206 T207	F173-L181 HydrophobicContact CE1-CD1 4.49Å; E177-L181 WeakPolarHBondContact O-CG 3.49Å; E177-L181 PolarHBondContact O-N 3.16Å; E177-L181 VanDerWaalsContact O-N 3.13Å; T178-L181 PolarHBondContact O-N 3.37Å; L181-S184 PolarHBondContact O-N 3.26Å; L181-W185 PolarHBondContact O-N 3.5Å; L181-W185 VanDerWaalsContact O-N 3.14Å; L181-I206 HydrophobicContact CD1-CG1 4.45Å; L181-I206 HydrophobicContact CD2-CD1 4.49Å; L181-T207 HydrophobicContact CB-CG2 4.01Å; L181-T207 HydrophobicContact CD1-CG2 4.03Å
182	L	97.7	Very high	89.8	Confident	0 Å²	0	86 Å²	86	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-68	-38.2	178.7	-60.8	176.4	0	0	0	112.6	T178 T179 N180 W185 L186 L203 T207 L209 I214 W217 F218	T178-L182 WeakPolarHBondContact O-CG 3.38Å; T178-L182 PolarHBondContact O-N 2.92Å; T179-L182 PolarHBondContact O-N 3.22Å; N180-L182 VanDerWaalsContact C-N 3.34Å; N180-L182 PolarHBondContact O-N 3.44Å; L182-W185 PolarHBondContact O-N 3.02Å; L182-L186 WeakPolarHBondContact O-CB 3.22Å; L182-L186 PolarHBondContact O-N 3.36Å; L182-L203 HydrophobicContact CD2-CB 4.28Å; L182-L203 HydrophobicContact CD2-CD1 4.32Å; L182-L203 HydrophobicContact CD2-CD2 4.28Å; L182-T207 HydrophobicContact CD2-CG2 3.95Å; L182-T207 HydrophobicContact CG-CG2 4.11Å; L182-L209 HydrophobicContact CD1-CD1 4.01Å; L182-I214 HydrophobicContact CD1-CD1 4.3Å; L182-I214 HydrophobicContact CD2-CD1 3.67Å; L182-W217 HydrophobicContact CB-CD2 4.02Å; L182-W217 HydrophobicContact CB-CE3 3.88Å; L182-W217 HydrophobicContact CB-CH2 3.53Å; L182-W217 HydrophobicContact CB-CZ2 3.64Å; L182-W217 HydrophobicContact CB-CZ3 3.65Å; L182-W217 HydrophobicContact CD1-CB 4.35Å; L182-W217 HydrophobicContact CD1-CD2 3.61Å; L182-W217 HydrophobicContact CD1-CE3 4.08Å; L182-W217 HydrophobicContact CD1-CG 3.7Å; L182-W217 HydrophobicContact CD1-CZ2 4.41Å; L182-W217 HydrophobicContact CG-CD2 4.42Å; L182-W217 HydrophobicContact CG-CE3 4.49Å; L182-F218 HydrophobicContact CD2-CE2 4.08Å; L182-F218 HydrophobicContact CD2-CZ 4.43Å
183	K	96.4	Very high	91.4	Very high	106 Å²	106	76.8 Å²	76.8	46%	0.461	37%	0.366	S	S	.	.	H	α-helix	trans	-63.8	-45	174.3	-75.7	174.8	178.7	-177.8	0	111.9	T179 N180 W185 L186 D187 W217	T179-K183 WeakPolarHBondContact O-CB 3.15Å; T179-K183 VanDerWaalsContact O-CG 3.27Å; T179-K183 WeakPolarHBondContact O-CG 3.29Å; T179-K183 PolarHBondContact O-N 2.66Å; N180-K183 PolarHBondContact O-N 2.95Å; K183-W185 VanDerWaalsContact C-N 3.33Å; K183-W185 PolarHBondContact O-N 3.45Å; K183-L186 WeakPolarHBondContact O-CB 3.4Å; K183-L186 PolarHBondContact O-N 2.82Å; K183-L186 VanDerWaalsContact O-N 3.08Å; K183-D187 PolarHBondContact O-N 3.39Å; K183-W217 HydrophobicContact CG-CH2 4.16Å; K183-W217 HydrophobicContact CG-CZ2 4.09Å
184	S	96.8	Very high	92.8	Very high	43 Å²	43	78.4 Å²	78.4	30%	0.301	37%	0.371	S	S	.	.	H	α-helix	trans	-58.2	-45.5	176.9	176.8	0	0	0	0	111.6	N180 L181 L186 D187 N188	N180-S184 WeakPolarHBondContact O-CB 3.42Å; N180-S184 PolarHBondContact O-N 3.11Å; L181-S184 PolarHBondContact O-N 3.26Å; S184-L186 VanDerWaalsContact C-N 3.32Å; S184-L186 PolarHBondContact O-N 3.39Å; S184-D187 PolarHBondContact O-N 3.5Å; S184-N188 PolarHBondContact O-N 3.21Å; S184-N188 VanDerWaalsContact O-N 3.11Å; S184-N188 PolarHBondContact O-ND2 2.84Å
185	W	97.6	Very high	93.8	Very high	28 Å²	28	75.6 Å²	75.6	11%	0.106	35%	0.353	C	S	.	.	H	α-helix	trans	-59.8	-44.5	174.2	-173.2	95.6	0	0	0	111.6	L181 L182 K183 D187 N188 H189 P195 E199 L203 F218	L181-W185 PolarHBondContact O-N 3.5Å; L181-W185 VanDerWaalsContact O-N 3.14Å; L182-W185 PolarHBondContact O-N 3.02Å; K183-W185 VanDerWaalsContact C-N 3.33Å; K183-W185 PolarHBondContact O-N 3.45Å; W185-D187 VanDerWaalsContact C-N 3.33Å; W185-D187 PolarHBondContact O-N 3.22Å; W185-N188 PolarHBondContact O-N 2.9Å; W185-H189 AromaticContact CD1-CE1 3.93Å; W185-H189 AromaticContact CD1-ND1 3.98Å; W185-H189 AromaticContact CD2-ND1 3.58Å; W185-H189 AromaticContact CE2-CE1 3.59Å; W185-H189 AromaticContact CE2-CG 3.79Å; W185-H189 AromaticContact CE2-ND1 3.37Å; W185-H189 HydrophobicContact CE3-CB 4.1Å; W185-H189 AromaticContact CG-ND1 3.97Å; W185-H189 HydrophobicContact CH2-CB 3.66Å; W185-H189 AromaticContact CH2-CG 3.67Å; W185-H189 HydrophobicContact CZ2-CB 4.09Å; W185-H189 AromaticContact CZ2-CD2 3.75Å; W185-H189 AromaticContact CZ2-CE1 3.91Å; W185-H189 AromaticContact CZ2-CG 3.55Å; W185-H189 AromaticContact CZ2-ND1 3.66Å; W185-H189 AromaticContact CZ2-NE2 3.98Å; W185-H189 HydrophobicContact CZ3-CB 3.68Å; W185-H189 AromaticContact NE1-CE1 3.44Å; W185-H189 PolarHBondContact NE1-CE1 2.99Å; W185-H189 AromaticContact NE1-ND1 3.64Å; W185-H189 PolarHBondContact O-N 3.41Å; W185-H189 VanDerWaalsContact O-N 3.09Å; W185-H189 PolarHBondContact O-ND1 2.96Å; W185-P195 HydrophobicContact CH2-CB 3.61Å; W185-P195 HydrophobicContact CH2-CG 4.2Å; W185-P195 HydrophobicContact CZ2-CB 3.68Å; W185-P195 HydrophobicContact CZ3-CB 4.2Å; W185-P195 HydrophobicContact CZ3-CG 4.41Å; W185-E199 HydrophobicContact CZ2-CB 4.49Å; W185-E199 WeakPolarHBondContact CZ2-OE1 3.49Å; W185-L203 HydrophobicContact CB-CD2 4.11Å; W185-L203 HydrophobicContact CD2-CD1 4.19Å; W185-L203 HydrophobicContact CG-CD1 4.05Å; W185-L203 HydrophobicContact CG-CD2 4.13Å; W185-F218 HydrophobicContact CD2-CE1 4.3Å; W185-F218 HydrophobicContact CD2-CZ 4.02Å; W185-F218 HydrophobicContact CE3-CD1 4.36Å; W185-F218 AromaticContact CE3-CE1 3.26Å; W185-F218 HydrophobicContact CE3-CE1 3.26Å; W185-F218 AromaticContact CE3-CZ 3.4Å; W185-F218 HydrophobicContact CE3-CZ 3.4Å; W185-F218 VanDerWaalsContact CE3-CZ 3.4Å; W185-F218 HydrophobicContact CZ3-CD1 4.18Å; W185-F218 AromaticContact CZ3-CE1 3.47Å; W185-F218 HydrophobicContact CZ3-CE1 3.47Å; W185-F218 VanDerWaalsContact CZ3-CE1 3.47Å; W185-F218 AromaticContact CZ3-CZ 3.93Å; W185-F218 HydrophobicContact CZ3-CZ 3.93Å
186	L	96.7	Very high	94.5	Very high	10 Å²	10	72.7 Å²	72.7	5%	0.052	34%	0.342	C	S	.	.	H	α-helix	trans	-62.4	-39.6	-179.8	-180	63.9	0	0	0	112.4	L182 K183 S184 H189 R190 P193 W217 F218 A221 L225	L182-L186 WeakPolarHBondContact O-CB 3.22Å; L182-L186 PolarHBondContact O-N 3.36Å; K183-L186 WeakPolarHBondContact O-CB 3.4Å; K183-L186 PolarHBondContact O-N 2.82Å; K183-L186 VanDerWaalsContact O-N 3.08Å; S184-L186 VanDerWaalsContact C-N 3.32Å; S184-L186 PolarHBondContact O-N 3.39Å; L186-H189 CarbonylContact O-C 3.29Å; L186-H189 VanDerWaalsContact O-C 3.27Å; L186-H189 PolarHBondContact O-N 2.86Å; L186-R190 PolarHBondContact O-N 2.99Å; L186-R190 VanDerWaalsContact O-N 3.08Å; L186-P193 HydrophobicContact CD1-CB 3.39Å; L186-P193 HydrophobicContact CD1-CG 4.46Å; L186-W217 HydrophobicContact CD2-CH2 4.13Å; L186-W217 HydrophobicContact CD2-CZ3 4.25Å; L186-F218 HydrophobicContact CB-CE1 4.33Å; L186-F218 HydrophobicContact CD1-CD1 4.49Å; L186-F218 HydrophobicContact CD1-CE1 4.35Å; L186-A221 HydrophobicContact CD2-CB 3.82Å; L186-L225 HydrophobicContact CD2-CD1 3.77Å
187	D	94	Very high	95	Very high	76 Å²	76	71.1 Å²	71.1	41%	0.406	34%	0.341	S	S	.	.	H	α-helix	trans	-65.8	-40	177.5	-71.3	-29.8	0	0	0	111.5	K183 S184 W185 H189 R190	K183-D187 PolarHBondContact O-N 3.39Å; S184-D187 PolarHBondContact O-N 3.5Å; W185-D187 VanDerWaalsContact C-N 3.33Å; W185-D187 PolarHBondContact O-N 3.22Å; D187-H189 PolarHBondContact O-N 3.41Å; D187-R190 WeakPolarHBondContact O-CG 3.49Å; D187-R190 IonicContact OD1-CZ 3.28Å; D187-R190 VanDerWaalsContact OD1-CZ 3.28Å; D187-R190 IonicContact OD1-NE 3Å; D187-R190 PolarHBondContact OD1-NE 3.15Å; D187-R190 IonicContact OD1-NH2 2.71Å; D187-R190 PolarHBondContact OD1-NH2 2.81Å
188	N	96.2	Very high	95.4	Very high	118 Å²	118	72.5 Å²	72.5	63%	0.631	35%	0.351	S	S	*	.	H	α-helix	trans	-67.5	-22.9	173.9	-65.9	-22.5	0	0	0	113.1	S184 W185	S184-N188 PolarHBondContact O-N 3.21Å; S184-N188 VanDerWaalsContact O-N 3.11Å; S184-N188 PolarHBondContact O-ND2 2.84Å; W185-N188 PolarHBondContact O-N 2.9Å
189	H	94.7	Very high	95.8	Very high	65 Å²	65	74 Å²	74	30%	0.301	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	32.5	-176.9	-61.7	80.9	0	0	0	112.7	W185 L186 D187 Y191 N192 P193 E199	W185-H189 AromaticContact CD1-CE1 3.93Å; W185-H189 AromaticContact CD1-ND1 3.98Å; W185-H189 AromaticContact CD2-ND1 3.58Å; W185-H189 AromaticContact CE2-CE1 3.59Å; W185-H189 AromaticContact CE2-CG 3.79Å; W185-H189 AromaticContact CE2-ND1 3.37Å; W185-H189 HydrophobicContact CE3-CB 4.1Å; W185-H189 AromaticContact CG-ND1 3.97Å; W185-H189 HydrophobicContact CH2-CB 3.66Å; W185-H189 AromaticContact CH2-CG 3.67Å; W185-H189 HydrophobicContact CZ2-CB 4.09Å; W185-H189 AromaticContact CZ2-CD2 3.75Å; W185-H189 AromaticContact CZ2-CE1 3.91Å; W185-H189 AromaticContact CZ2-CG 3.55Å; W185-H189 AromaticContact CZ2-ND1 3.66Å; W185-H189 AromaticContact CZ2-NE2 3.98Å; W185-H189 HydrophobicContact CZ3-CB 3.68Å; W185-H189 AromaticContact NE1-CE1 3.44Å; W185-H189 PolarHBondContact NE1-CE1 2.99Å; W185-H189 AromaticContact NE1-ND1 3.64Å; W185-H189 PolarHBondContact O-N 3.41Å; W185-H189 VanDerWaalsContact O-N 3.09Å; W185-H189 PolarHBondContact O-ND1 2.96Å; L186-H189 CarbonylContact O-C 3.29Å; L186-H189 VanDerWaalsContact O-C 3.27Å; L186-H189 PolarHBondContact O-N 2.86Å; D187-H189 PolarHBondContact O-N 3.41Å; H189-Y191 PolarHBondContact O-N 3.09Å; H189-Y191 VanDerWaalsContact O-N 3.15Å; H189-N192 CarbonylContact O-C 3.59Å; H189-N192 PolarHBondContact O-N 3.38Å; H189-N192 VanDerWaalsContact O-N 3.09Å; H189-P193 WeakPolarHBondContact O-CA 3.37Å; H189-P193 VanDerWaalsContact O-N 3.15Å; H189-E199 IonicContact NE2-OE1 3.63Å
190	R	91.7	Very high	96	Very high	94 Å²	94	75.2 Å²	75.2	36%	0.355	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-35.5	-178.7	-75.2	-98.9	-178.3	132.1	-0.1	113.2	L186 D187 W233	L186-R190 PolarHBondContact O-N 2.99Å; L186-R190 VanDerWaalsContact O-N 3.08Å; D187-R190 WeakPolarHBondContact O-CG 3.49Å; D187-R190 IonicContact OD1-CZ 3.28Å; D187-R190 VanDerWaalsContact OD1-CZ 3.28Å; D187-R190 IonicContact OD1-NE 3Å; D187-R190 PolarHBondContact OD1-NE 3.15Å; D187-R190 IonicContact OD1-NH2 2.71Å; D187-R190 PolarHBondContact OD1-NH2 2.81Å; R190-W233 WeakPolarHBondContact O-CZ3 3.46Å
191	Y	89.9	Confident	96.1	Very high	187 Å²	187	74.1 Å²	74.1	73%	0.733	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-17	-178.8	-57.8	-73.4	0	0	0	114.9	H189 W233	H189-Y191 PolarHBondContact O-N 3.09Å; H189-Y191 VanDerWaalsContact O-N 3.15Å; Y191-W233 WeakPolarHBondContact O-CB 3.27Å
192	N	92.8	Very high	96.2	Very high	102 Å²	102	77.2 Å²	77.2	55%	0.545	36%	0.363	S	S	.	.			trans	-153.1	75	176.1	-176.7	38	0	0	0	109.7	H189 Y194	H189-N192 CarbonylContact O-C 3.59Å; H189-N192 PolarHBondContact O-N 3.38Å; H189-N192 VanDerWaalsContact O-N 3.09Å; N192-Y194 PolarHBondContact O-N 2.76Å; N192-Y194 VanDerWaalsContact OD1-CD2 3.31Å; N192-Y194 WeakPolarHBondContact OD1-CD2 3.23Å
193	P	96.1	Very high	96.2	Very high	0 Å²	0	77.6 Å²	77.6	0%	0	37%	0.365	C	S	.	.			trans	-82	48.5	-172.4	30.9	-32.6	0	0	0	112.5	L186 H189 R222 W233	L186-P193 HydrophobicContact CD1-CB 3.39Å; L186-P193 HydrophobicContact CD1-CG 4.46Å; H189-P193 WeakPolarHBondContact O-CA 3.37Å; H189-P193 VanDerWaalsContact O-N 3.15Å; P193-R222 HydrophobicContact CB-CG 4.1Å; P193-R222 HydrophobicContact CG-CG 3.83Å; P193-R222 VanDerWaalsContact O-CD 3.29Å; P193-R222 WeakPolarHBondContact O-CD 3.44Å; P193-R222 PolarHBondContact O-NH1 3.17Å; P193-W233 HydrophobicContact CB-CH2 4.42Å; P193-W233 HydrophobicContact CG-CD2 4.06Å; P193-W233 HydrophobicContact CG-CE3 3.88Å; P193-W233 HydrophobicContact CG-CH2 3.19Å; P193-W233 HydrophobicContact CG-CZ2 3.36Å; P193-W233 HydrophobicContact CG-CZ3 3.48Å; P193-W233 VanDerWaalsContact CG-CZ3 3.48Å
194	Y	97.6	Very high	96.2	Very high	119 Å²	119	73.8 Å²	73.8	47%	0.467	35%	0.352	S	S	.	.			trans	-118.5	89.1	178	-67.2	-90.8	0	0	0	107.9	N192 T196 R222	N192-Y194 PolarHBondContact O-N 2.76Å; N192-Y194 VanDerWaalsContact OD1-CD2 3.31Å; N192-Y194 WeakPolarHBondContact OD1-CD2 3.23Å; Y194-T196 PolarHBondContact O-N 2.77Å; Y194-R222 VanDerWaalsContact CE1-NE 3.28Å
195	P	97.7	Very high	96.2	Very high	10 Å²	10	77.4 Å²	77.4	7%	0.065	37%	0.367	C	S	.	.			trans	-61.7	133.8	-180	24.3	-33.1	0	0	0	110.2	W185 E199 K200 F218	W185-P195 HydrophobicContact CH2-CB 3.61Å; W185-P195 HydrophobicContact CH2-CG 4.2Å; W185-P195 HydrophobicContact CZ2-CB 3.68Å; W185-P195 HydrophobicContact CZ3-CB 4.2Å; W185-P195 HydrophobicContact CZ3-CG 4.41Å; P195-E199 WeakPolarHBondContact CA-OE2 3.39Å; P195-E199 HydrophobicContact CB-CB 4.04Å; P195-K200 HydrophobicContact CB-CG 4.01Å; P195-K200 HydrophobicContact CG-CG 3.97Å; P195-K200 WeakPolarHBondContact O-CE 3.44Å; P195-F218 HydrophobicContact CG-CD1 4.26Å; P195-F218 HydrophobicContact CG-CD2 3.78Å; P195-F218 HydrophobicContact CG-CE2 4.04Å; P195-F218 HydrophobicContact CG-CG 3.91Å; P195-F218 HydrophobicContact CG-CZ 4.39Å
196	T	97.8	Very high	96.1	Very high	77 Å²	77	80 Å²	80	47%	0.472	38%	0.383	S	S	.	.			trans	-63.4	166.9	172.7	61.9	0	0	0	0	111.3	Y194 N198 E199 K200	Y194-T196 PolarHBondContact O-N 2.77Å; T196-N198 VanDerWaalsContact C-N 3.27Å; T196-N198 PolarHBondContact O-N 3.47Å; T196-E199 WeakPolarHBondContact CB-OE2 3.45Å; T196-E199 WeakPolarHBondContact CG2-OE2 3.25Å; T196-E199 PolarHBondContact N-OE2 3.23Å; T196-E199 PolarHBondContact O-N 2.71Å; T196-E199 VanDerWaalsContact OG1-CD 3.29Å; T196-E199 VanDerWaalsContact OG1-CG 3.23Å; T196-E199 WeakPolarHBondContact OG1-CG 3.35Å; T196-E199 PolarHBondContact OG1-N 3.43Å; T196-E199 PolarHBondContact OG1-OE2 3.32Å; T196-K200 WeakPolarHBondContact O-CG 3.42Å; T196-K200 PolarHBondContact O-N 3.31Å
197	K	97.8	Very high	96.1	Very high	167 Å²	167	79.7 Å²	79.7	73%	0.726	38%	0.381	S	S	*	.	H	α-helix	trans	-53	-46.6	176.5	-174.9	177.1	179.3	178.5	0	111.4	K200 I201	K197-K200 PolarHBondContact O-N 3.01Å; K197-I201 HydrophobicContact CG-CD1 4.3Å; K197-I201 WeakPolarHBondContact O-CG1 3.44Å; K197-I201 PolarHBondContact O-N 2.86Å; K197-I201 VanDerWaalsContact O-N 3.11Å
198	N	97.5	Very high	96.2	Very high	111 Å²	111	81.4 Å²	81.4	59%	0.594	39%	0.386	S	S	*	.	H	α-helix	trans	-67.9	-38.8	-178.4	-65.8	5.8	0	0	0	112	T196 I201 K202	T196-N198 VanDerWaalsContact C-N 3.27Å; T196-N198 PolarHBondContact O-N 3.47Å; N198-I201 PolarHBondContact O-N 3.15Å; N198-K202 WeakPolarHBondContact O-CG 3.07Å; N198-K202 PolarHBondContact O-N 3Å
199	E	98.1	Very high	96.1	Very high	47 Å²	47	77.7 Å²	77.7	22%	0.22	37%	0.366	C	S	.	.	H	α-helix	trans	-66.7	-39.7	175.3	-70.5	167.7	131.3	0	0	112	W185 H189 P195 T196 I201 K202 L203	W185-E199 HydrophobicContact CZ2-CB 4.49Å; W185-E199 WeakPolarHBondContact CZ2-OE1 3.49Å; H189-E199 IonicContact NE2-OE1 3.63Å; P195-E199 WeakPolarHBondContact CA-OE2 3.39Å; P195-E199 HydrophobicContact CB-CB 4.04Å; T196-E199 WeakPolarHBondContact CB-OE2 3.45Å; T196-E199 WeakPolarHBondContact CG2-OE2 3.25Å; T196-E199 PolarHBondContact N-OE2 3.23Å; T196-E199 PolarHBondContact O-N 2.71Å; T196-E199 VanDerWaalsContact OG1-CD 3.29Å; T196-E199 VanDerWaalsContact OG1-CG 3.23Å; T196-E199 WeakPolarHBondContact OG1-CG 3.35Å; T196-E199 PolarHBondContact OG1-N 3.43Å; T196-E199 PolarHBondContact OG1-OE2 3.32Å; E199-I201 VanDerWaalsContact C-N 3.29Å; E199-I201 PolarHBondContact O-N 3.02Å; E199-K202 PolarHBondContact O-N 3.06Å; E199-L203 WeakPolarHBondContact O-CB 3.4Å; E199-L203 WeakPolarHBondContact O-CG 3.32Å; E199-L203 PolarHBondContact O-N 3.43Å
200	K	98.1	Very high	96.2	Very high	63 Å²	63	77.3 Å²	77.3	27%	0.274	37%	0.371	S	S	.	.	H	α-helix	trans	-60	-41.4	174.3	-69.9	-179.3	-172.9	177.2	0	111.6	P195 T196 K197 L203 S204 L211 I214	P195-K200 HydrophobicContact CB-CG 4.01Å; P195-K200 HydrophobicContact CG-CG 3.97Å; P195-K200 WeakPolarHBondContact O-CE 3.44Å; T196-K200 WeakPolarHBondContact O-CG 3.42Å; T196-K200 PolarHBondContact O-N 3.31Å; K197-K200 PolarHBondContact O-N 3.01Å; K200-L203 PolarHBondContact O-N 2.94Å; K200-S204 VanDerWaalsContact O-CB 3.26Å; K200-S204 WeakPolarHBondContact O-CB 3.41Å; K200-S204 PolarHBondContact O-N 3.34Å; K200-L211 HydrophobicContact CB-CD2 3.89Å; K200-L211 WeakPolarHBondContact O-CD2 3.44Å; K200-I214 HydrophobicContact CB-CG2 4.42Å; K200-I214 HydrophobicContact CG-CG2 4.28Å
201	I	97.7	Very high	96.5	Very high	70 Å²	70	77 Å²	77	36%	0.359	38%	0.375	S	S	.	.	H	α-helix	trans	-62.5	-50.6	175.2	-65.4	165.2	0	0	0	110.1	K197 N198 E199 L203 S204 L205 L211	K197-I201 HydrophobicContact CG-CD1 4.3Å; K197-I201 WeakPolarHBondContact O-CG1 3.44Å; K197-I201 PolarHBondContact O-N 2.86Å; K197-I201 VanDerWaalsContact O-N 3.11Å; N198-I201 PolarHBondContact O-N 3.15Å; E199-I201 VanDerWaalsContact C-N 3.29Å; E199-I201 PolarHBondContact O-N 3.02Å; I201-L203 VanDerWaalsContact C-N 3.33Å; I201-L203 PolarHBondContact O-N 3.16Å; I201-S204 WeakPolarHBondContact O-CB 3.5Å; I201-S204 PolarHBondContact O-N 3.48Å; I201-L205 HydrophobicContact CG2-CD1 4.14Å; I201-L205 WeakPolarHBondContact O-CG 3.29Å; I201-L205 PolarHBondContact O-N 3.05Å; I201-L211 HydrophobicContact CG1-CD2 4.08Å
202	K	97.9	Very high	96.9	Very high	129 Å²	129	72.9 Å²	72.9	56%	0.561	37%	0.37	S	S	*	.	H	α-helix	trans	-55.5	-46.2	176.2	-71.8	178.1	-178.9	-175.3	0	112.1	N198 E199 L205 I206	N198-K202 WeakPolarHBondContact O-CG 3.07Å; N198-K202 PolarHBondContact O-N 3Å; E199-K202 PolarHBondContact O-N 3.06Å; K202-L205 PolarHBondContact O-N 3.42Å; K202-I206 WeakPolarHBondContact O-CG2 3.41Å; K202-I206 PolarHBondContact O-N 3.39Å; K202-I206 VanDerWaalsContact O-N 3.09Å
203	L	97.4	Very high	97.1	Very high	7 Å²	7	72.8 Å²	72.8	4%	0.037	37%	0.366	C	S	.	.	H	α-helix	trans	-65.3	-39.8	178.8	-69.3	174.8	0	0	0	112.2	L182 W185 E199 K200 I201 I206 T207 I214 F218	L182-L203 HydrophobicContact CD2-CB 4.28Å; L182-L203 HydrophobicContact CD2-CD1 4.32Å; L182-L203 HydrophobicContact CD2-CD2 4.28Å; W185-L203 HydrophobicContact CB-CD2 4.11Å; W185-L203 HydrophobicContact CD2-CD1 4.19Å; W185-L203 HydrophobicContact CG-CD1 4.05Å; W185-L203 HydrophobicContact CG-CD2 4.13Å; E199-L203 WeakPolarHBondContact O-CB 3.4Å; E199-L203 WeakPolarHBondContact O-CG 3.32Å; E199-L203 PolarHBondContact O-N 3.43Å; K200-L203 PolarHBondContact O-N 2.94Å; I201-L203 VanDerWaalsContact C-N 3.33Å; I201-L203 PolarHBondContact O-N 3.16Å; L203-I206 HydrophobicContact CD2-CD1 3.85Å; L203-I206 WeakPolarHBondContact O-CG1 3.5Å; L203-I206 PolarHBondContact O-N 2.92Å; L203-T207 WeakPolarHBondContact O-CB 3.49Å; L203-T207 WeakPolarHBondContact O-CG2 3.36Å; L203-T207 PolarHBondContact O-N 2.73Å; L203-T207 PolarHBondContact O-OG1 3.02Å; L203-I214 HydrophobicContact CB-CD1 4.22Å; L203-I214 HydrophobicContact CB-CG2 4.38Å; L203-F218 HydrophobicContact CD1-CE2 3.5Å; L203-F218 VanDerWaalsContact CD1-CE2 3.5Å; L203-F218 HydrophobicContact CD1-CZ 3.68Å
204	S	97.1	Very high	97.2	Very high	26 Å²	26	72.8 Å²	72.8	18%	0.182	37%	0.366	C	S	.	.	H	α-helix	trans	-60.4	-45.4	175.4	177	0	0	0	0	111.2	K200 I201 H208 L209	K200-S204 VanDerWaalsContact O-CB 3.26Å; K200-S204 WeakPolarHBondContact O-CB 3.41Å; K200-S204 PolarHBondContact O-N 3.34Å; I201-S204 WeakPolarHBondContact O-CB 3.5Å; I201-S204 PolarHBondContact O-N 3.48Å; S204-H208 VanDerWaalsContact O-CA 3.29Å; S204-H208 WeakPolarHBondContact O-CA 3.38Å; S204-H208 PolarHBondContact O-N 3.34Å; S204-L209 WeakPolarHBondContact CA-O 3.38Å; S204-L209 VanDerWaalsContact CB-O 3.27Å; S204-L209 WeakPolarHBondContact CB-O 3.34Å; S204-L209 PolarHBondContact O-N 3.04Å; S204-L209 PolarHBondContact OG-O 3.12Å
205	L	96.5	Very high	97.2	Very high	119 Å²	119	69.5 Å²	69.5	62%	0.623	36%	0.361	S	S	*	.	H	α-helix	trans	-61.9	-47.9	177.7	-67.9	171.2	0	0	0	112.4	I201 K202	I201-L205 HydrophobicContact CG2-CD1 4.14Å; I201-L205 WeakPolarHBondContact O-CG 3.29Å; I201-L205 PolarHBondContact O-N 3.05Å; K202-L205 PolarHBondContact O-N 3.42Å
206	I	95.7	Very high	97.2	Very high	84 Å²	84	72.4 Å²	72.4	43%	0.431	38%	0.379	S	S	.	.	H	α-helix	trans	-75	-27.7	-176.9	68	179	0	0	0	113.6	L181 K202 L203	L181-I206 HydrophobicContact CD1-CG1 4.45Å; L181-I206 HydrophobicContact CD2-CD1 4.49Å; K202-I206 WeakPolarHBondContact O-CG2 3.41Å; K202-I206 PolarHBondContact O-N 3.39Å; K202-I206 VanDerWaalsContact O-N 3.09Å; L203-I206 HydrophobicContact CD2-CD1 3.85Å; L203-I206 WeakPolarHBondContact O-CG1 3.5Å; L203-I206 PolarHBondContact O-N 2.92Å
207	T	95.5	Very high	97.2	Very high	3 Å²	3	71.4 Å²	71.4	2%	0.018	37%	0.366	C	S	.	.	H	α-helix	trans	-98.4	-11.6	-177.7	61.6	0	0	0	0	113.5	L181 L182 L203 L209 I214	L181-T207 HydrophobicContact CB-CG2 4.01Å; L181-T207 HydrophobicContact CD1-CG2 4.03Å; L182-T207 HydrophobicContact CD2-CG2 3.95Å; L182-T207 HydrophobicContact CG-CG2 4.11Å; L203-T207 WeakPolarHBondContact O-CB 3.49Å; L203-T207 WeakPolarHBondContact O-CG2 3.36Å; L203-T207 PolarHBondContact O-N 2.73Å; L203-T207 PolarHBondContact O-OG1 3.02Å; T207-L209 PolarHBondContact O-N 3.08Å; T207-L209 PolarHBondContact OG1-N 3.37Å; T207-I214 WeakPolarHBondContact OG1-CD1 3.43Å
208	H	95.6	Very high	97.3	Very high	111 Å²	111	63.5 Å²	63.5	51%	0.514	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	30.3	-171.2	-51.7	-72.1	0	0	0	113.9	F173 S204	F173-H208 AromaticContact CD2-CD2 3.46Å; F173-H208 VanDerWaalsContact CD2-CD2 3.46Å; F173-H208 WeakPolarHBondContact CD2-CD2 3.37Å; F173-H208 AromaticContact CD2-NE2 3.83Å; F173-H208 AromaticContact CE2-CD2 3.55Å; F173-H208 AromaticContact CE2-NE2 3.45Å; F173-H208 WeakPolarHBondContact CE2-NE2 3.35Å; S204-H208 VanDerWaalsContact O-CA 3.29Å; S204-H208 WeakPolarHBondContact O-CA 3.38Å; S204-H208 PolarHBondContact O-N 3.34Å
209	L	95.6	Very high	97.2	Very high	41 Å²	41	59.3 Å²	59.3	22%	0.215	31%	0.313	C	S	.	.			trans	-100.7	147.9	173.2	-62.9	176.3	0	0	0	109.8	L182 S204 T207 Q213 I214	L182-L209 HydrophobicContact CD1-CD1 4.01Å; S204-L209 WeakPolarHBondContact CA-O 3.38Å; S204-L209 VanDerWaalsContact CB-O 3.27Å; S204-L209 WeakPolarHBondContact CB-O 3.34Å; S204-L209 PolarHBondContact O-N 3.04Å; S204-L209 PolarHBondContact OG-O 3.12Å; T207-L209 PolarHBondContact O-N 3.08Å; T207-L209 PolarHBondContact OG1-N 3.37Å; L209-Q213 HydrophobicContact CB-CB 4.06Å; L209-I214 HydrophobicContact CB-CD1 3.84Å; L209-I214 HydrophobicContact CB-CG1 4.12Å; L209-I214 HydrophobicContact CD1-CD1 4.02Å
210	S	96.8	Very high	97.2	Very high	56 Å²	56	60.1 Å²	60.1	39%	0.392	32%	0.318	S	S	.	.			trans	-65.6	154.2	174.5	75.8	0	0	0	0	111.4	T212 Q213 I214	S210-T212 PolarHBondContact O-N 3.2Å; S210-T212 VanDerWaalsContact O-N 3.12Å; S210-Q213 WeakPolarHBondContact O-CA 3.49Å; S210-Q213 WeakPolarHBondContact O-CB 3.41Å; S210-Q213 PolarHBondContact O-N 3.06Å; S210-Q213 WeakPolarHBondContact OG-CG 3.48Å; S210-Q213 PolarHBondContact OG-N 3.35Å; S210-I214 WeakPolarHBondContact O-CG1 3.45Å; S210-I214 PolarHBondContact O-N 3.2Å
211	L	97.6	Very high	97.1	Very high	87 Å²	87	57.5 Å²	57.5	46%	0.455	31%	0.309	S	S	.	.	H	α-helix	trans	-53.3	-35.6	175.9	-69.5	173.9	0	0	0	112.3	K200 I201 I214 S215	K200-L211 HydrophobicContact CB-CD2 3.89Å; K200-L211 WeakPolarHBondContact O-CD2 3.44Å; I201-L211 HydrophobicContact CG1-CD2 4.08Å; L211-I214 PolarHBondContact O-N 2.86Å; L211-S215 VanDerWaalsContact O-CB 3.29Å; L211-S215 WeakPolarHBondContact O-CB 3.41Å; L211-S215 PolarHBondContact O-N 3.16Å
212	T	97.7	Very high	97	Very high	102 Å²	102	56.5 Å²	56.5	63%	0.626	30%	0.3	S	S	*	.	H	α-helix	trans	-66	-42.6	175.5	-55.8	0	0	0	0	112.3	S210 S215 T216	S210-T212 PolarHBondContact O-N 3.2Å; S210-T212 VanDerWaalsContact O-N 3.12Å; T212-S215 PolarHBondContact O-N 3.36Å; T212-T216 WeakPolarHBondContact O-CB 3.25Å; T212-T216 PolarHBondContact O-N 3.43Å; T212-T216 PolarHBondContact O-OG1 2.99Å
213	Q	97.6	Very high	96.9	Very high	99 Å²	99	58 Å²	58	46%	0.463	30%	0.302	S	S	.	.	H	α-helix	trans	-63.4	-45.5	174.9	-73.5	171.6	-33.7	0	0	110.9	L209 S210 T216 W217	L209-Q213 HydrophobicContact CB-CB 4.06Å; S210-Q213 WeakPolarHBondContact O-CA 3.49Å; S210-Q213 WeakPolarHBondContact O-CB 3.41Å; S210-Q213 PolarHBondContact O-N 3.06Å; S210-Q213 WeakPolarHBondContact OG-CG 3.48Å; S210-Q213 PolarHBondContact OG-N 3.35Å; Q213-T216 PolarHBondContact O-N 3.46Å; Q213-W217 VanDerWaalsContact O-CB 3.29Å; Q213-W217 WeakPolarHBondContact O-CB 3.35Å; Q213-W217 PolarHBondContact O-N 3.2Å
214	I	98.2	Very high	96.7	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-57.4	-51.4	174.5	-63	-63.9	0	0	0	110.4	L182 K200 L203 T207 L209 S210 L211 T216 W217 F218	L182-I214 HydrophobicContact CD1-CD1 4.3Å; L182-I214 HydrophobicContact CD2-CD1 3.67Å; K200-I214 HydrophobicContact CB-CG2 4.42Å; K200-I214 HydrophobicContact CG-CG2 4.28Å; L203-I214 HydrophobicContact CB-CD1 4.22Å; L203-I214 HydrophobicContact CB-CG2 4.38Å; T207-I214 WeakPolarHBondContact OG1-CD1 3.43Å; L209-I214 HydrophobicContact CB-CD1 3.84Å; L209-I214 HydrophobicContact CB-CG1 4.12Å; L209-I214 HydrophobicContact CD1-CD1 4.02Å; S210-I214 WeakPolarHBondContact O-CG1 3.45Å; S210-I214 PolarHBondContact O-N 3.2Å; L211-I214 PolarHBondContact O-N 2.86Å; I214-T216 PolarHBondContact O-N 3.46Å; I214-W217 WeakPolarHBondContact O-CB 3.21Å; I214-W217 PolarHBondContact O-N 3.47Å; I214-F218 HydrophobicContact CG2-CD2 3.8Å; I214-F218 HydrophobicContact CG2-CE2 3.87Å; I214-F218 VanDerWaalsContact O-CD2 3.29Å; I214-F218 WeakPolarHBondContact O-CD2 3Å; I214-F218 PolarHBondContact O-N 3.36Å
215	S	97.9	Very high	96.4	Very high	50 Å²	50	63.1 Å²	63.1	35%	0.35	32%	0.319	S	S	.	.	H	α-helix	trans	-58	-47.5	-179.9	-169.4	0	0	0	0	112.1	L211 T212 W217 F218 A219	L211-S215 VanDerWaalsContact O-CB 3.29Å; L211-S215 WeakPolarHBondContact O-CB 3.41Å; L211-S215 PolarHBondContact O-N 3.16Å; T212-S215 PolarHBondContact O-N 3.36Å; S215-W217 PolarHBondContact O-N 3.04Å; S215-F218 PolarHBondContact O-N 2.9Å; S215-A219 PolarHBondContact O-N 3.25Å
216	T	97.7	Very high	95.9	Very high	72 Å²	72	64.7 Å²	64.7	44%	0.442	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-42	177.8	-59.5	0	0	0	0	111.7	T212 Q213 I214 A219 N220	T212-T216 WeakPolarHBondContact O-CB 3.25Å; T212-T216 PolarHBondContact O-N 3.43Å; T212-T216 PolarHBondContact O-OG1 2.99Å; Q213-T216 PolarHBondContact O-N 3.46Å; I214-T216 PolarHBondContact O-N 3.46Å; T216-A219 PolarHBondContact O-N 3.33Å; T216-N220 PolarHBondContact O-N 3.44Å; T216-N220 PolarHBondContact O-ND2 3.08Å
217	W	98.1	Very high	95.5	Very high	55 Å²	55	69.7 Å²	69.7	21%	0.208	34%	0.339	C	S	.	.	H	α-helix	trans	-59.7	-49.2	177.2	-171.6	99.2	0	0	0	111.1	L182 K183 L186 Q213 I214 S215 A219 N220 A221	L182-W217 HydrophobicContact CB-CD2 4.02Å; L182-W217 HydrophobicContact CB-CE3 3.88Å; L182-W217 HydrophobicContact CB-CH2 3.53Å; L182-W217 HydrophobicContact CB-CZ2 3.64Å; L182-W217 HydrophobicContact CB-CZ3 3.65Å; L182-W217 HydrophobicContact CD1-CB 4.35Å; L182-W217 HydrophobicContact CD1-CD2 3.61Å; L182-W217 HydrophobicContact CD1-CE3 4.08Å; L182-W217 HydrophobicContact CD1-CG 3.7Å; L182-W217 HydrophobicContact CD1-CZ2 4.41Å; L182-W217 HydrophobicContact CG-CD2 4.42Å; L182-W217 HydrophobicContact CG-CE3 4.49Å; K183-W217 HydrophobicContact CG-CH2 4.16Å; K183-W217 HydrophobicContact CG-CZ2 4.09Å; L186-W217 HydrophobicContact CD2-CH2 4.13Å; L186-W217 HydrophobicContact CD2-CZ3 4.25Å; Q213-W217 VanDerWaalsContact O-CB 3.29Å; Q213-W217 WeakPolarHBondContact O-CB 3.35Å; Q213-W217 PolarHBondContact O-N 3.2Å; I214-W217 WeakPolarHBondContact O-CB 3.21Å; I214-W217 PolarHBondContact O-N 3.47Å; S215-W217 PolarHBondContact O-N 3.04Å; W217-A219 PolarHBondContact O-N 2.96Å; W217-N220 PolarHBondContact O-N 3Å; W217-A221 HydrophobicContact CE3-CB 4.01Å; W217-A221 HydrophobicContact CH2-CB 4.12Å; W217-A221 HydrophobicContact CZ3-CB 3.74Å; W217-A221 WeakPolarHBondContact O-CB 3.45Å; W217-A221 PolarHBondContact O-N 3.08Å
218	F	98.1	Very high	95	Very high	2 Å²	2	75.7 Å²	75.7	1%	0.009	37%	0.367	C	S	.	.	H	α-helix	trans	-65.2	-36.8	178.6	-85.4	-72.9	0	0	0	113.1	L182 W185 L186 P195 L203 I214 S215 N220 A221 R222	L182-F218 HydrophobicContact CD2-CE2 4.08Å; L182-F218 HydrophobicContact CD2-CZ 4.43Å; W185-F218 HydrophobicContact CD2-CE1 4.3Å; W185-F218 HydrophobicContact CD2-CZ 4.02Å; W185-F218 HydrophobicContact CE3-CD1 4.36Å; W185-F218 AromaticContact CE3-CE1 3.26Å; W185-F218 HydrophobicContact CE3-CE1 3.26Å; W185-F218 AromaticContact CE3-CZ 3.4Å; W185-F218 HydrophobicContact CE3-CZ 3.4Å; W185-F218 VanDerWaalsContact CE3-CZ 3.4Å; W185-F218 HydrophobicContact CZ3-CD1 4.18Å; W185-F218 AromaticContact CZ3-CE1 3.47Å; W185-F218 HydrophobicContact CZ3-CE1 3.47Å; W185-F218 VanDerWaalsContact CZ3-CE1 3.47Å; W185-F218 AromaticContact CZ3-CZ 3.93Å; W185-F218 HydrophobicContact CZ3-CZ 3.93Å; L186-F218 HydrophobicContact CB-CE1 4.33Å; L186-F218 HydrophobicContact CD1-CD1 4.49Å; L186-F218 HydrophobicContact CD1-CE1 4.35Å; P195-F218 HydrophobicContact CG-CD1 4.26Å; P195-F218 HydrophobicContact CG-CD2 3.78Å; P195-F218 HydrophobicContact CG-CE2 4.04Å; P195-F218 HydrophobicContact CG-CG 3.91Å; P195-F218 HydrophobicContact CG-CZ 4.39Å; L203-F218 HydrophobicContact CD1-CE2 3.5Å; L203-F218 VanDerWaalsContact CD1-CE2 3.5Å; L203-F218 HydrophobicContact CD1-CZ 3.68Å; I214-F218 HydrophobicContact CG2-CD2 3.8Å; I214-F218 HydrophobicContact CG2-CE2 3.87Å; I214-F218 VanDerWaalsContact O-CD2 3.29Å; I214-F218 WeakPolarHBondContact O-CD2 3Å; I214-F218 PolarHBondContact O-N 3.36Å; S215-F218 PolarHBondContact O-N 2.9Å; F218-N220 VanDerWaalsContact C-N 3.34Å; F218-N220 PolarHBondContact O-N 3.02Å; F218-A221 PolarHBondContact O-N 2.98Å; F218-R222 WeakPolarHBondContact O-CB 3.24Å; F218-R222 WeakPolarHBondContact O-CG 3.29Å; F218-R222 PolarHBondContact O-N 2.72Å
219	A	96.9	Very high	94.2	Very high	23 Å²	23	77.1 Å²	77.1	19%	0.19	38%	0.378	C	S	.	.	H	α-helix	trans	-60.6	-45.3	173.6	0	0	0	0	0	111.3	S215 T216 W217 R223	S215-A219 PolarHBondContact O-N 3.25Å; T216-A219 PolarHBondContact O-N 3.33Å; W217-A219 PolarHBondContact O-N 2.96Å; A219-R223 WeakPolarHBondContact O-CG 3.28Å; A219-R223 PolarHBondContact O-N 3.48Å
220	N	97.4	Very high	93.2	Very high	63 Å²	63	79.9 Å²	79.9	34%	0.337	39%	0.39	S	S	.	.	H	α-helix	trans	-66.7	-41.8	176.4	-72.7	-27.9	0	0	0	112.5	T216 W217 F218 R223 R224	T216-N220 PolarHBondContact O-N 3.44Å; T216-N220 PolarHBondContact O-ND2 3.08Å; W217-N220 PolarHBondContact O-N 3Å; F218-N220 VanDerWaalsContact C-N 3.34Å; F218-N220 PolarHBondContact O-N 3.02Å; N220-R223 WeakPolarHBondContact O-CB 3.31Å; N220-R223 PolarHBondContact O-N 3.01Å; N220-R223 PolarHBondContact OD1-NH1 2.83Å; N220-R224 WeakPolarHBondContact O-CG 3.5Å; N220-R224 PolarHBondContact O-N 3.42Å; N220-R224 VanDerWaalsContact O-N 3.11Å
221	A	96.3	Very high	91.7	Very high	9 Å²	9	79.5 Å²	79.5	7%	0.074	38%	0.383	C	S	.	.	H	α-helix	trans	-60.7	-48.7	177.9	0	0	0	0	0	111.1	L186 W217 F218 R223 R224 L225	L186-A221 HydrophobicContact CD2-CB 3.82Å; W217-A221 HydrophobicContact CE3-CB 4.01Å; W217-A221 HydrophobicContact CH2-CB 4.12Å; W217-A221 HydrophobicContact CZ3-CB 3.74Å; W217-A221 WeakPolarHBondContact O-CB 3.45Å; W217-A221 PolarHBondContact O-N 3.08Å; F218-A221 PolarHBondContact O-N 2.98Å; A221-R223 VanDerWaalsContact C-N 3.3Å; A221-R223 PolarHBondContact O-N 2.95Å; A221-R224 WeakPolarHBondContact O-CB 3.22Å; A221-R224 PolarHBondContact O-N 2.7Å; A221-L225 WeakPolarHBondContact O-CD1 3.47Å; A221-L225 PolarHBondContact O-N 3.4Å
222	R	96.5	Very high	90.1	Very high	48 Å²	48	79.3 Å²	79.3	18%	0.181	39%	0.385	C	S	.	.	H	α-helix	trans	-58.2	-39.3	175.6	-73.4	-164.7	-62.1	-82.6	-1.8	113	P193 Y194 F218 R224 L225 K226 M231 W233	P193-R222 HydrophobicContact CB-CG 4.1Å; P193-R222 HydrophobicContact CG-CG 3.83Å; P193-R222 VanDerWaalsContact O-CD 3.29Å; P193-R222 WeakPolarHBondContact O-CD 3.44Å; P193-R222 PolarHBondContact O-NH1 3.17Å; Y194-R222 VanDerWaalsContact CE1-NE 3.28Å; F218-R222 WeakPolarHBondContact O-CB 3.24Å; F218-R222 WeakPolarHBondContact O-CG 3.29Å; F218-R222 PolarHBondContact O-N 2.72Å; R222-R224 VanDerWaalsContact C-N 3.31Å; R222-R224 PolarHBondContact O-N 3.39Å; R222-L225 PolarHBondContact O-N 3.1Å; R222-K226 PolarHBondContact O-N 3.09Å; R222-M231 VanDerWaalsContact O-CE 3.25Å; R222-M231 WeakPolarHBondContact O-CE 3.32Å; R222-W233 HydrophobicContact CB-CZ2 4.38Å; R222-W233 HydrophobicContact CG-CH2 4.44Å; R222-W233 HydrophobicContact CG-CZ2 4.17Å
223	R	94.9	Very high	88.7	Confident	160 Å²	160	76.2 Å²	76.2	60%	0.604	36%	0.362	S	S	*	.	H	α-helix	trans	-61.2	-39.6	174.9	-71.2	174.3	-168.2	129.6	-0.7	111.8	A219 N220 A221 K226 K227	A219-R223 WeakPolarHBondContact O-CG 3.28Å; A219-R223 PolarHBondContact O-N 3.48Å; N220-R223 WeakPolarHBondContact O-CB 3.31Å; N220-R223 PolarHBondContact O-N 3.01Å; N220-R223 PolarHBondContact OD1-NH1 2.83Å; A221-R223 VanDerWaalsContact C-N 3.3Å; A221-R223 PolarHBondContact O-N 2.95Å; R223-K226 WeakPolarHBondContact O-CB 3.14Å; R223-K226 PolarHBondContact O-N 2.84Å; R223-K227 PolarHBondContact O-N 3.36Å; R223-K227 VanDerWaalsContact O-N 3.12Å
224	R	94.1	Very high	86.9	Confident	126 Å²	126	78.4 Å²	78.4	48%	0.475	38%	0.375	S	S	.	.	H	α-helix	trans	-67.4	-46.3	177.4	-66.6	172.4	-173.3	-173.1	-1.7	111.8	S42 N220 A221 R222 K226 K227 E228	S42-R224 PolarHBondContact OG-NH2 3.42Å; N220-R224 WeakPolarHBondContact O-CG 3.5Å; N220-R224 PolarHBondContact O-N 3.42Å; N220-R224 VanDerWaalsContact O-N 3.11Å; A221-R224 WeakPolarHBondContact O-CB 3.22Å; A221-R224 PolarHBondContact O-N 2.7Å; R222-R224 VanDerWaalsContact C-N 3.31Å; R222-R224 PolarHBondContact O-N 3.39Å; R224-K226 PolarHBondContact O-N 3.29Å; R224-K227 PolarHBondContact O-N 3.01Å; R224-E228 PolarHBondContact O-N 3.33Å
225	L	90.1	Very high	85.1	Confident	16 Å²	16	83.3 Å²	83.3	8%	0.084	41%	0.407	C	S	.	.	H	α-helix	trans	-56.2	-36.6	174.3	-85.2	81.2	0	0	0	111.7	L186 A221 R222 Q230 M231 W233	L186-L225 HydrophobicContact CD2-CD1 3.77Å; A221-L225 WeakPolarHBondContact O-CD1 3.47Å; A221-L225 PolarHBondContact O-N 3.4Å; R222-L225 PolarHBondContact O-N 3.1Å; L225-Q230 CarbonylContact O-C 3.27Å; L225-Q230 PolarHBondContact O-N 3.02Å; L225-M231 HydrophobicContact CB-CE 4.24Å; L225-M231 PolarHBondContact O-N 3.31Å; L225-W233 HydrophobicContact CB-CH2 3.88Å; L225-W233 HydrophobicContact CB-CZ3 4.33Å; L225-W233 HydrophobicContact CD2-CH2 3.79Å; L225-W233 HydrophobicContact CD2-CZ3 3.66Å; L225-W233 HydrophobicContact CG-CH2 4.45Å
226	K	86.4	Confident	83.2	Confident	151 Å²	151	90.7 Å²	90.7	66%	0.657	43%	0.433	S	S	*	.	H	α-helix	trans	-64.5	-46.8	175.7	-155.7	176	175.8	-178.5	0	112.4	R222 R223 R224 E228 N229 M231	R222-K226 PolarHBondContact O-N 3.09Å; R223-K226 WeakPolarHBondContact O-CB 3.14Å; R223-K226 PolarHBondContact O-N 2.84Å; R224-K226 PolarHBondContact O-N 3.29Å; K226-E228 VanDerWaalsContact C-N 3.31Å; K226-E228 PolarHBondContact O-N 3.05Å; K226-N229 PolarHBondContact O-N 3.41Å; K226-M231 VanDerWaalsContact CA-CE 3.46Å; K226-M231 HydrophobicContact CB-CE 3.4Å; K226-M231 HydrophobicContact CB-SD 4.36Å; K226-M231 HydrophobicContact CD-CE 4.48Å; K226-M231 HydrophobicContact CG-CE 3.83Å; K226-M231 HydrophobicContact CG-SD 4.13Å
227	K	86.8	Confident	81.1	Confident	189 Å²	189	92.5 Å²	92.5	82%	0.822	44%	0.439	S	S	*	.	H	α-helix	trans	-65.5	-37.4	-175.9	-172.4	-178.9	177.2	-173.6	0	111.6	R223 R224 N229	R223-K227 PolarHBondContact O-N 3.36Å; R223-K227 VanDerWaalsContact O-N 3.12Å; R224-K227 PolarHBondContact O-N 3.01Å; K227-N229 PolarHBondContact O-N 3.24Å
228	E	84.1	Confident	78.6	Confident	130 Å²	130	99.3 Å²	99.3	61%	0.607	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	5.9	-177.9	-66.3	171.2	-175.6	0	0	113.5	R224 K226 Q230	R224-E228 PolarHBondContact O-N 3.33Å; K226-E228 VanDerWaalsContact C-N 3.31Å; K226-E228 PolarHBondContact O-N 3.05Å; E228-Q230 HydrophobicContact CB-CB 4.44Å; E228-Q230 HydrophobicContact CB-CG 3.85Å; E228-Q230 PolarHBondContact O-N 3.4Å; E228-Q230 VanDerWaalsContact O-N 3.08Å
229	N	78.9	Confident	76.3	Confident	141 Å²	141	107.2 Å²	107.2	75%	0.754	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	23.6	-172	-157.3	25.8	0	0	0	113.7	K226 K227 M231	K226-N229 PolarHBondContact O-N 3.41Å; K227-N229 PolarHBondContact O-N 3.24Å; N229-M231 PolarHBondContact O-N 3.34Å
230	Q	74.9	Confident	74.2	Confident	98 Å²	98	112.2 Å²	112.2	46%	0.458	52%	0.52	S	S	.	.			trans	-87.2	15.8	174.1	-64.1	-65.3	-26.2	0	0	111.2	L225 E228	L225-Q230 CarbonylContact O-C 3.27Å; L225-Q230 PolarHBondContact O-N 3.02Å; E228-Q230 HydrophobicContact CB-CB 4.44Å; E228-Q230 HydrophobicContact CB-CG 3.85Å; E228-Q230 PolarHBondContact O-N 3.4Å; E228-Q230 VanDerWaalsContact O-N 3.08Å
231	M	65.9	Low	71.8	Confident	49 Å²	49	119.1 Å²	119.1	24%	0.241	54%	0.542	C	S	.	.			trans	-95.5	102.1	-178.7	-175.8	153.9	-46.4	0	0	110	R222 L225 K226 N229 W233	R222-M231 VanDerWaalsContact O-CE 3.25Å; R222-M231 WeakPolarHBondContact O-CE 3.32Å; L225-M231 HydrophobicContact CB-CE 4.24Å; L225-M231 PolarHBondContact O-N 3.31Å; K226-M231 VanDerWaalsContact CA-CE 3.46Å; K226-M231 HydrophobicContact CB-CE 3.4Å; K226-M231 HydrophobicContact CB-SD 4.36Å; K226-M231 HydrophobicContact CD-CE 4.48Å; K226-M231 HydrophobicContact CG-CE 3.83Å; K226-M231 HydrophobicContact CG-SD 4.13Å; N229-M231 PolarHBondContact O-N 3.34Å; M231-W233 HydrophobicContact CB-CE3 4.45Å; M231-W233 HydrophobicContact CB-CH2 4.41Å; M231-W233 HydrophobicContact CB-CZ3 4.29Å; M231-W233 HydrophobicContact CE-CD2 4.47Å; M231-W233 HydrophobicContact CE-CH2 3.23Å; M231-W233 HydrophobicContact CE-CZ2 2.91Å; M231-W233 HydrophobicContact CE-CZ3 4.13Å; M231-W233 HydrophobicContact CG-CD2 3.48Å; M231-W233 VanDerWaalsContact CG-CD2 3.48Å; M231-W233 VanDerWaalsContact CG-CE2 3.45Å; M231-W233 HydrophobicContact CG-CE3 3.64Å; M231-W233 HydrophobicContact CG-CG 4.09Å; M231-W233 HydrophobicContact CG-CH2 3.86Å; M231-W233 HydrophobicContact CG-CZ2 3.73Å; M231-W233 HydrophobicContact CG-CZ3 3.81Å; M231-W233 HydrophobicContact SD-CD2 3.84Å; M231-W233 HydrophobicContact SD-CE3 4.41Å; M231-W233 HydrophobicContact SD-CG 4.41Å; M231-W233 HydrophobicContact SD-CH2 3.9Å; M231-W233 HydrophobicContact SD-CZ2 3.24Å; M231-W233 WeakPolarHBondContact SD-CZ2 3.25Å; M231-W233 HydrophobicContact SD-CZ3 4.43Å; M231-W233 PolarHBondContact SD-NE1 3.37Å
232	T	64.6	Low	69.4	Low	82 Å²	82	125 Å²	125	50%	0.503	57%	0.57	S	S	.	*			trans	-97.6	-4.8	-179.9	54.7	0	0	0	0	113.8	I234	T232-I234 PolarHBondContact O-N 3.36Å; T232-I234 VanDerWaalsContact O-N 3.16Å
233	W	68.1	Low	66.8	Low	38 Å²	38	129.8 Å²	129.8	14%	0.144	60%	0.598	C	S	.	*			trans	-77.5	111.2	-177.7	56.5	91.8	0	0	0	111.6	R190 Y191 P193 R222 L225 M231 P235	R190-W233 WeakPolarHBondContact O-CZ3 3.46Å; Y191-W233 WeakPolarHBondContact O-CB 3.27Å; P193-W233 HydrophobicContact CB-CH2 4.42Å; P193-W233 HydrophobicContact CG-CD2 4.06Å; P193-W233 HydrophobicContact CG-CE3 3.88Å; P193-W233 HydrophobicContact CG-CH2 3.19Å; P193-W233 HydrophobicContact CG-CZ2 3.36Å; P193-W233 HydrophobicContact CG-CZ3 3.48Å; P193-W233 VanDerWaalsContact CG-CZ3 3.48Å; R222-W233 HydrophobicContact CB-CZ2 4.38Å; R222-W233 HydrophobicContact CG-CH2 4.44Å; R222-W233 HydrophobicContact CG-CZ2 4.17Å; L225-W233 HydrophobicContact CB-CH2 3.88Å; L225-W233 HydrophobicContact CB-CZ3 4.33Å; L225-W233 HydrophobicContact CD2-CH2 3.79Å; L225-W233 HydrophobicContact CD2-CZ3 3.66Å; L225-W233 HydrophobicContact CG-CH2 4.45Å; M231-W233 HydrophobicContact CB-CE3 4.45Å; M231-W233 HydrophobicContact CB-CH2 4.41Å; M231-W233 HydrophobicContact CB-CZ3 4.29Å; M231-W233 HydrophobicContact CE-CD2 4.47Å; M231-W233 HydrophobicContact CE-CH2 3.23Å; M231-W233 HydrophobicContact CE-CZ2 2.91Å; M231-W233 HydrophobicContact CE-CZ3 4.13Å; M231-W233 HydrophobicContact CG-CD2 3.48Å; M231-W233 VanDerWaalsContact CG-CD2 3.48Å; M231-W233 VanDerWaalsContact CG-CE2 3.45Å; M231-W233 HydrophobicContact CG-CE3 3.64Å; M231-W233 HydrophobicContact CG-CG 4.09Å; M231-W233 HydrophobicContact CG-CH2 3.86Å; M231-W233 HydrophobicContact CG-CZ2 3.73Å; M231-W233 HydrophobicContact CG-CZ3 3.81Å; M231-W233 HydrophobicContact SD-CD2 3.84Å; M231-W233 HydrophobicContact SD-CE3 4.41Å; M231-W233 HydrophobicContact SD-CG 4.41Å; M231-W233 HydrophobicContact SD-CH2 3.9Å; M231-W233 HydrophobicContact SD-CZ2 3.24Å; M231-W233 WeakPolarHBondContact SD-CZ2 3.25Å; M231-W233 HydrophobicContact SD-CZ3 4.43Å; M231-W233 PolarHBondContact SD-NE1 3.37Å; W233-P235 WeakPolarHBondContact O-CD 3.43Å
234	I	58.6	Low	64.5	Low	144 Å²	144	126.1 Å²	126.1	74%	0.738	59%	0.593	S	S	*	*			trans	-55.1	121.3	174.2	-59.8	156.2	0	0	0	107.3	T232 K236	T232-I234 PolarHBondContact O-N 3.36Å; T232-I234 VanDerWaalsContact O-N 3.16Å; I234-K236 PolarHBondContact O-N 3.25Å
235	P	60.9	Low	62.2	Low	104 Å²	104	125 Å²	125	68%	0.675	60%	0.601	S	S	*	*			trans	-54.7	127.1	169.6	-19.2	30	0	0	0	107.5	W233 I237	W233-P235 WeakPolarHBondContact O-CD 3.43Å; P235-I237 VanDerWaalsContact C-N 3.34Å; P235-I237 PolarHBondContact O-N 3.07Å
236	K	58.5	Low	60	Low	205 Å²	205	131.8 Å²	131.8	89%	0.891	64%	0.637	S	S	*	*			trans	-54.4	104	171.1	-69.6	-176.1	179.5	-178.4	0	107	I234 R238	I234-K236 PolarHBondContact O-N 3.25Å; K236-R238 PolarHBondContact O-N 2.78Å
237	I	53.3	Low	58.1	Low	109 Å²	109	129 Å²	129	56%	0.559	64%	0.637	S	S	*	*			trans	-58.6	114.1	172.8	-64.1	169.9	0	0	0	104.1	P235 H239	P235-I237 VanDerWaalsContact C-N 3.34Å; P235-I237 PolarHBondContact O-N 3.07Å; I237-H239 VanDerWaalsContact C-N 3.3Å; I237-H239 PolarHBondContact O-CD2 3.23Å; I237-H239 VanDerWaalsContact O-CD2 3.23Å; I237-H239 PolarHBondContact O-N 3.31Å
238	R	45.8	Very low	56.1	Low	199 Å²	199	126 Å²	126	75%	0.751	63%	0.628	S	S	*	*			trans	-68.3	100.9	169.9	-59.5	-173.1	-175.2	121.6	-6.4	105.2	K236 H240	K236-R238 PolarHBondContact O-N 2.78Å; R238-H240 WeakPolarHBondContact CB-ND1 3.3Å; R238-H240 PolarHBondContact O-N 2.91Å
239	H	49.2	Very low	54	Low	167 Å²	167	128.3 Å²	128.3	77%	0.773	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	11.5	178.5	-79.9	-96.4	0	0	0	114	I237	I237-H239 VanDerWaalsContact C-N 3.3Å; I237-H239 PolarHBondContact O-CD2 3.23Å; I237-H239 VanDerWaalsContact O-CD2 3.23Å; I237-H239 PolarHBondContact O-N 3.31Å
240	H	53.2	Low	52.2	Low	129 Å²	129	129.3 Å²	129.3	60%	0.597	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	5.8	-177.5	81.7	-100.6	0	0	0	115	R238	R238-H240 WeakPolarHBondContact CB-ND1 3.3Å; R238-H240 PolarHBondContact O-N 2.91Å
241	R	46.4	Very low	50.4	Low	208 Å²	208	132 Å²	132	79%	0.785	66%	0.661	S	S	*	*	S	Bend	trans	-136.4	16	-177.3	-101.7	-179.4	170.3	153.8	-1	116.7
242	I	45.2	Very low	49	Very low	132 Å²	132	137.7 Å²	137.7	68%	0.677	69%	0.692	S	S	*	*			trans	-128.3	65.9	171.5	-48.2	177.7	0	0	0	108.8
243	I	43.5	Very low	48.1	Very low	148 Å²	148	142.3 Å²	142.3	76%	0.759	71%	0.708	S	S	*	*	S	Bend	trans	-121.4	129.1	150.5	-56.9	179.3	0	0	0	103.1
244	T	45.6	Very low	46.8	Very low	83 Å²	83	148.3 Å²	148.3	51%	0.509	74%	0.74	S	S	.	*	S	Bend	trans	67.7	62	178.2	72.3	0	0	0	0	119.5	I248	T244-I248 VanDerWaalsContact O-CD1 3.26Å; T244-I248 WeakPolarHBondContact O-CD1 3.4Å
245	T	45.6	Very low	45.7	Very low	103 Å²	103	147.3 Å²	147.3	63%	0.632	74%	0.744	S	S	*	*	S	Bend	trans	-122.2	-10	147.2	55.3	0	0	0	0	114.1
246	N	43.6	Very low	44.9	Very low	159 Å²	159	150.9 Å²	150.9	85%	0.85	75%	0.751	S	S	*	*	S	Bend	trans	-95.8	4.5	166.6	-69.9	-0.5	0	0	0	113.4
247	S	46.7	Very low	43.9	Very low	93 Å²	93	150.3 Å²	150.3	65%	0.65	75%	0.749	S	S	*	*	S	Bend	trans	-109.7	7.9	176	-57.2	0	0	0	0	113.7
248	I	44.8	Very low	43.4	Very low	124 Å²	124	154.3 Å²	154.3	64%	0.636	77%	0.765	S	S	*	*	S	Bend	trans	-106.7	-0.2	-179.4	-49.2	178	0	0	0	111.3	T244 L250	T244-I248 VanDerWaalsContact O-CD1 3.26Å; T244-I248 WeakPolarHBondContact O-CD1 3.4Å; I248-L250 PolarHBondContact O-N 2.77Å
249	H	40.6	Very low	42.9	Very low	180 Å²	180	151.4 Å²	151.4	83%	0.833	77%	0.765	S	S	*	*	S	Bend	trans	-97.1	39.2	179	-159.5	-42	0	0	0	113.3
250	L	41.7	Very low	43	Very low	161 Å²	161	151.2 Å²	151.2	84%	0.843	77%	0.769	S	S	*	*	S	Bend	trans	-147.4	36.6	176.5	-92	167.3	0	0	0	112.3	I248	I248-L250 PolarHBondContact O-N 2.77Å
251	N	37.4	Very low	42.7	Very low	155 Å²	155	152.5 Å²	152.5	83%	0.829	78%	0.78	S	S	*	*	S	Bend	trans	-151.7	13	173.6	-103.4	-8.3	0	0	0	116.7
252	N	36.8	Very low	42.3	Very low	168 Å²	168	152.4 Å²	152.4	90%	0.898	78%	0.781	S	S	*	*			trans	-121.9	60.4	179.1	-83.6	1.6	0	0	0	112.1
253	Q	45.1	Very low	41.9	Very low	179 Å²	179	151.7 Å²	151.7	84%	0.836	78%	0.779	S	S	*	*			trans	-167.1	110.6	169.1	-166.2	169.8	74.3	0	0	104.3
254	M	41.6	Very low	41.6	Very low	165 Å²	165	148.1 Å²	148.1	81%	0.813	78%	0.779	S	S	*	*			cis	-149.5	129	26.9	-79.6	129	60.9	0	0	108.5
255	C	34.2	Very low	41.2	Very low	122 Å²	122	150.3 Å²	150.3	82%	0.824	79%	0.788	S	S	*	*			trans	-103.2	81	157.4	53.4	0	0	0	0	108
256	H	43.4	Very low	40.8	Very low	179 Å²	179	152.6 Å²	152.6	83%	0.829	80%	0.796	S	S	*	*			trans	-142.5	121.3	166.9	-93	-70.4	0	0	0	110.3
257	K	37.6	Very low	40.5	Very low	194 Å²	194	151 Å²	151	84%	0.843	79%	0.792	S	S	*	*			trans	-46	137.1	172.5	-64.6	167.2	170	-174.5	0	111.6
258	Q	42.7	Very low	39.9	Very low	193 Å²	193	152.4 Å²	152.4	90%	0.902	80%	0.797	S	S	*	*			trans	-157.2	110.1	147.4	-108.2	159.2	4.9	0	0	108.3
259	D	36.6	Very low	39.7	Very low	138 Å²	138	153.9 Å²	153.9	74%	0.738	81%	0.806	S	S	*	*			trans	-58.3	141	160.8	-52.2	-65.2	0	0	0	108.6
260	D	51.5	Low	39.4	Very low	163 Å²	163	151.5 Å²	151.5	87%	0.872	80%	0.804	S	S	*	*			trans	166	139.8	134.5	-77.6	-26	0	0	0	111.6
261	D	46.1	Very low	39.5	Very low	155 Å²	155	151.3 Å²	151.3	83%	0.829	80%	0.803	S	S	*	*			trans	-72.3	165.2	-159.8	-80.4	-53.6	0	0	0	118
262	Y	37.4	Very low	39.5	Very low	206 Å²	206	151.1 Å²	151.1	81%	0.808	80%	0.796	S	S	*	*			trans	97.2	92.4	139.1	-123.6	-101.7	0	0	0	120.8
263	N	37.4	Very low	39.6	Very low	118 Å²	118	151.1 Å²	151.1	63%	0.631	80%	0.796	S	S	*	*				54	124.3	119.1	-157.7	16.2	0	0	0	120.6
264	G	38.4	Very low	39.2	Very low	73 Å²	73	145.9 Å²	145.9	75%	0.753	78%	0.778	S	S	*	*			trans	171.8	89.7	165.6	0	0	0	0	0	113.5
265	N	36.2	Very low	38.8	Very low	129 Å²	129	142.6 Å²	142.6	69%	0.69	77%	0.772	S	S	*	*			trans	-67.3	164.2	-173.3	-53.2	-34.7	0	0	0	114.9
266	N	36.3	Very low	39.1	Very low	151 Å²	151	144.8 Å²	144.8	81%	0.807	77%	0.77	S	S	*	*			trans	84.1	111.8	156.7	-55.7	-20.7	0	0	0	116.7
267	T	39	Very low	38.7	Very low	125 Å²	125	147 Å²	147	77%	0.767	77%	0.772	S	S	*	*				-179.2	122.3	89.6	-61.4	0	0	0	0	109	N269	T267-N269 PolarHBondContact O-N 2.99Å
268	T	33.4	Very low	38.7	Very low	123 Å²	123	143.8 Å²	143.8	76%	0.755	77%	0.769	S	S	*	*			trans	-61.6	121.7	173	46.5	0	0	0	0	111.2
269	N	39.7	Very low	38.1	Very low	154 Å²	154	141 Å²	141	82%	0.824	77%	0.765	S	S	*	*			trans	-137.4	96.6	156.1	-89.7	-25.9	0	0	0	108.7	T267 I271	T267-N269 PolarHBondContact O-N 2.99Å; N269-I271 PolarHBondContact O-N 3.15Å
270	T	35.9	Very low	38.2	Very low	131 Å²	131	141 Å²	141	80%	0.804	77%	0.77	S	S	*	*			trans	-67.3	114.4	175.1	-45.4	0	0	0	0	109.5
271	I	44.1	Very low	37.4	Very low	157 Å²	157	139.2 Å²	139.2	81%	0.805	77%	0.765	S	S	*	*			trans	-107.4	100.2	162.9	-61.1	178.2	0	0	0	107	N269	N269-I271 PolarHBondContact O-N 3.15Å
272	H	36.1	Very low	37.2	Very low	151 Å²	151	137.9 Å²	137.9	70%	0.699	76%	0.763	S	S	*	*			trans	-85.5	112.1	173.6	177.2	-105.4	0	0	0	108.6
273	L	39.1	Very low	37.4	Very low	168 Å²	168	135 Å²	135	88%	0.88	76%	0.762	S	S	*	*			trans	-106.7	97.1	171.3	-140.5	76.6	0	0	0	108.5
274	S	36.5	Very low	37.4	Very low	68 Å²	68	136.3 Å²	136.3	48%	0.476	77%	0.769	S	S	.	*			trans	-84.4	143.2	-177.6	-171.7	0	0	0	0	112.4
275	S	33.3	Very low	37.7	Very low	96 Å²	96	141.8 Å²	141.8	67%	0.671	77%	0.774	S	S	*	*			trans	-41.8	134.1	164.7	-40.8	0	0	0	0	114.3
276	H	40.2	Very low	37.8	Very low	169 Å²	169	142.5 Å²	142.5	78%	0.782	78%	0.778	S	S	*	*			trans	-124.9	95.2	163.2	-77.2	-85.4	0	0	0	109.9
277	Y	36.2	Very low	37.9	Very low	226 Å²	226	140.4 Å²	140.4	89%	0.886	78%	0.775	S	S	*	*			trans	-97.9	117.6	151.1	-70	-85.5	0	0	0	106.2
278	T	37.1	Very low	37.7	Very low	125 Å²	125	139.5 Å²	139.5	77%	0.767	77%	0.774	S	S	*	*			trans	-102.9	112.8	177.6	47.8	0	0	0	0	109.9
279	T	29.5	Very low	37.9	Very low	135 Å²	135	138.9 Å²	138.9	83%	0.828	78%	0.775	S	S	*	*			trans	-104.1	126.7	158.3	35.8	0	0	0	0	108
280	T	38.4	Very low	37.7	Very low	137 Å²	137	136.6 Å²	136.6	84%	0.84	77%	0.771	S	S	*	*			trans	-148.4	128.7	153.7	36.4	0	0	0	0	111.1
281	T	34.7	Very low	37.6	Very low	126 Å²	126	136.1 Å²	136.1	77%	0.773	77%	0.773	S	S	*	*			trans	-38.3	149.9	168.5	32.5	0	0	0	0	118.5
282	T	42.7	Very low	37.2	Very low	127 Å²	127	132.2 Å²	132.2	78%	0.779	77%	0.772	S	S	*	*				-165.2	119.4	129.8	23.3	0	0	0	0	111.7
283	D	42.2	Very low	37.1	Very low	145 Å²	145	130.5 Å²	130.5	78%	0.775	78%	0.776	S	S	*	*			trans	58.3	111.3	136.9	-52.6	-25.9	0	0	0	124.6
284	N	35.7	Very low	36.7	Very low	146 Å²	146	128.4 Å²	128.4	78%	0.781	78%	0.775	S	S	*	*			trans	22.5	122.7	131.6	-87.6	-16.5	0	0	0	119.7
285	H	45.7	Very low	36.5	Very low	188 Å²	188	131.5 Å²	131.5	87%	0.87	79%	0.786	S	S	*	*				-165.2	139.2	113.9	-92.7	-62.6	0	0	0	112.2
286	N	37.5	Very low	36.5	Very low	145 Å²	145	133.2 Å²	133.2	78%	0.775	79%	0.787	S	S	*	*			trans	-39.6	142.5	176.2	-71.5	-34.3	0	0	0	116.5
287	S	39.5	Very low	36.3	Very low	106 Å²	106	131.5 Å²	131.5	74%	0.741	78%	0.784	S	S	*	*				175.7	109.3	97.1	-69.9	0	0	0	0	111.8
288	S	35.1	Very low	36	Very low	107 Å²	107	128.4 Å²	128.4	75%	0.748	78%	0.783	S	S	*	*			trans	32.7	139.3	135.9	52.6	0	0	0	0	122.6
289	S	37.4	Very low	36	Very low	110 Å²	110	128.8 Å²	128.8	77%	0.769	79%	0.785	S	S	*	*			trans	84.9	136.6	150.2	66.9	0	0	0	0	117.9
290	S	34.9	Very low	36.2	Very low	105 Å²	105	129.3 Å²	129.3	73%	0.734	78%	0.783	S	S	*	*			cis	-169.2	143	-12.7	-92	0	0	0	0	106.1
291	S	33.6	Very low	36.2	Very low	121 Å²	121	132 Å²	132	85%	0.846	79%	0.786	S	S	*	*			trans	46.4	129.7	143.9	63.4	0	0	0	0	121.1
292	G	35.8	Very low	36	Very low	76 Å²	76	134.1 Å²	134.1	78%	0.784	79%	0.792	S	S	*	*			trans	174.8	73.4	156.1	0	0	0	0	0	116.1	C294	G292-C294 PolarHBondContact O-N 3.15Å
293	S	34.1	Very low	36	Very low	114 Å²	114	133 Å²	133	80%	0.797	79%	0.787	S	S	*	*			trans	-53.2	125.3	169.9	-168.1	0	0	0	0	112.2	N295	S293-N295 PolarHBondContact O-N 3.47Å
294	C	31	Very low	35.6	Very low	125 Å²	125	134.9 Å²	134.9	85%	0.845	79%	0.791	S	S	*	*			trans	-93.6	89.4	172.5	56.3	0	0	0	0	110.5	G292	G292-C294 PolarHBondContact O-N 3.15Å
295	N	32.4	Very low	36.1	Very low	133 Å²	133	133.7 Å²	133.7	71%	0.711	79%	0.789	S	S	*	*			trans	-129.2	126.4	157.6	-94.7	-10.7	0	0	0	107.2	S293	S293-N295 PolarHBondContact O-N 3.47Å
296	N	32.9	Very low	35.9	Very low	131 Å²	131	131.1 Å²	131.1	70%	0.701	79%	0.786	S	S	*	*			trans	150.9	118.7	131.2	-75.7	-24.4	0	0	0	113.2
297	N	35.4	Very low	36.3	Very low	133 Å²	133	128.5 Å²	128.5	71%	0.711	78%	0.779	S	S	*	*				63.5	117.2	120.2	-51.8	-23.4	0	0	0	120	T299	N297-T299 PolarHBondContact O-N 3.23Å
298	N	30.3	Very low	36.5	Very low	162 Å²	162	129.3 Å²	129.3	87%	0.866	78%	0.775	S	S	*	*			trans	-19.6	120.5	141.9	-62.1	-37.7	0	0	0	114.3
299	T	37.7	Very low	37	Very low	133 Å²	133	129.7 Å²	129.7	82%	0.816	77%	0.768	S	S	*	*			trans	-157.3	138.2	143	-5.9	0	0	0	0	110.9	N297	N297-T299 PolarHBondContact O-N 3.23Å
300	D	33.5	Very low	37.2	Very low	146 Å²	146	131.6 Å²	131.6	78%	0.781	76%	0.759	S	S	*	*			trans	-52.5	134	178.9	-56.9	-75.8	0	0	0	114.4
301	Q	39.2	Very low	37.6	Very low	192 Å²	192	130.6 Å²	130.6	90%	0.897	75%	0.751	S	S	*	*			trans	-166.4	119.6	144.2	-112.8	159.5	87.9	0	0	111.8
302	L	29.7	Very low	38.1	Very low	172 Å²	172	129.4 Å²	129.4	90%	0.901	74%	0.739	S	S	*	*			trans	-77	127.3	170.1	175.1	71	0	0	0	109.2
303	P	43	Very low	38.5	Very low	103 Å²	103	130.2 Å²	130.2	67%	0.669	73%	0.725	S	S	*	*			trans	-112.9	139.3	159.2	31.3	-17.5	0	0	0	111.9	V305	P303-V305 PolarHBondContact O-N 3.31Å
304	E	33.8	Very low	39	Very low	185 Å²	185	130.7 Å²	130.7	86%	0.864	72%	0.716	S	S	*	*			trans	-63.6	106.2	-179	-149.1	170.5	-177.3	0	0	111.4
305	V	44.8	Very low	39.7	Very low	121 Å²	121	129.1 Å²	129.1	73%	0.733	70%	0.703	S	S	*	*			trans	-143.5	78.2	173	-87.4	0	0	0	0	109.7	P303	P303-V305 PolarHBondContact O-N 3.31Å
306	T	41.7	Very low	40.2	Very low	134 Å²	134	129.1 Å²	129.1	82%	0.822	70%	0.703	S	S	*	*			trans	-111.8	-4	-178.3	50.7	0	0	0	0	114.6
307	S	45.7	Very low	40.5	Very low	90 Å²	90	127.6 Å²	127.6	63%	0.629	70%	0.701	S	S	*	*	S	Bend	trans	-91.5	-35.3	-177.8	55.3	0	0	0	0	115
308	D	44.5	Very low	40.4	Very low	123 Å²	123	125.9 Å²	125.9	66%	0.658	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-17.4	-163.7	-68.4	-17.1	0	0	0	115.3	R310	D308-R310 PolarHBondContact O-N 3.44Å
309	L	44.9	Very low	40.9	Very low	115 Å²	115	125.8 Å²	125.8	60%	0.602	70%	0.697	S	S	*	*	H	α-helix	trans	-78.8	-20.4	-174.7	-134.4	79.4	0	0	0	113.7	I313	L309-I313 HydrophobicContact CD2-CD1 4.28Å; L309-I313 HydrophobicContact CG-CD1 4.35Å
310	R	43.2	Very low	40.9	Very low	150 Å²	150	127.5 Å²	127.5	57%	0.566	70%	0.696	S	S	*	*	H	α-helix	trans	-77.8	-29.4	-172.9	-153.7	176.6	175.9	-158.4	0.8	112.3	D308 M314	D308-R310 PolarHBondContact O-N 3.44Å; R310-M314 HydrophobicContact CG-SD 4.23Å; R310-M314 WeakPolarHBondContact O-CB 3.49Å; R310-M314 WeakPolarHBondContact O-CG 3.4Å; R310-M314 PolarHBondContact O-N 3.12Å
311	S	42	Very low	41	Very low	83 Å²	83	126.1 Å²	126.1	58%	0.58	70%	0.695	S	S	*	*	H	α-helix	trans	-72.9	-41.4	176.6	-170.3	0	0	0	0	112.1	I313 T315	S311-I313 VanDerWaalsContact C-N 3.35Å; S311-I313 PolarHBondContact O-N 2.93Å; S311-T315 WeakPolarHBondContact O-CG2 3.37Å; S311-T315 PolarHBondContact O-N 2.85Å; S311-T315 PolarHBondContact O-OG1 2.8Å
312	T	44.9	Very low	40.8	Very low	96 Å²	96	124.3 Å²	124.3	59%	0.589	69%	0.69	S	S	*	*	H	α-helix	trans	-73.1	-24	-175.3	-49.7	0	0	0	0	113.6
313	I	44.3	Very low	41.1	Very low	93 Å²	93	123.1 Å²	123.1	48%	0.477	69%	0.685	S	S	.	*	H	α-helix	trans	-95.6	-28.4	-179.8	-59.7	175.2	0	0	0	111.8	L309 S311	L309-I313 HydrophobicContact CD2-CD1 4.28Å; L309-I313 HydrophobicContact CG-CD1 4.35Å; S311-I313 VanDerWaalsContact C-N 3.35Å; S311-I313 PolarHBondContact O-N 2.93Å
314	M	44.2	Very low	40.7	Very low	124 Å²	124	126.2 Å²	126.2	61%	0.611	70%	0.696	S	S	*	*	H	α-helix	trans	-78.2	-28	178	-74	-173.2	68.4	0	0	113.7	R310 N316 C317	R310-M314 HydrophobicContact CG-SD 4.23Å; R310-M314 WeakPolarHBondContact O-CB 3.49Å; R310-M314 WeakPolarHBondContact O-CG 3.4Å; R310-M314 PolarHBondContact O-N 3.12Å; M314-N316 VanDerWaalsContact C-N 3.28Å; M314-N316 PolarHBondContact O-N 3.37Å; M314-C317 PolarHBondContact O-N 3.12Å
315	T	46.2	Very low	41	Very low	93 Å²	93	125.6 Å²	125.6	57%	0.571	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-70.2	-20.2	179.5	44.4	0	0	0	0	114	S311	S311-T315 WeakPolarHBondContact O-CG2 3.37Å; S311-T315 PolarHBondContact O-N 2.85Å; S311-T315 PolarHBondContact O-OG1 2.8Å
316	N	42.5	Very low	40.8	Very low	133 Å²	133	128 Å²	128	71%	0.711	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-91.9	0.5	176.1	-72.3	-15.6	0	0	0	114.2	M314	M314-N316 VanDerWaalsContact C-N 3.28Å; M314-N316 PolarHBondContact O-N 3.37Å
317	C	38.9	Very low	40.8	Very low	98 Å²	98	128.2 Å²	128.2	66%	0.662	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-98.4	8.3	-178.2	-77.1	0	0	0	0	114.7	M314	M314-C317 PolarHBondContact O-N 3.12Å
318	S	34	Very low	40.6	Very low	98 Å²	98	131.8 Å²	131.8	69%	0.685	70%	0.698	S	S	*	*			trans	-129.1	72.1	-179.5	-64.1	0	0	0	0	111.7
319	I	40.4	Very low	40.5	Very low	159 Å²	159	136.6 Å²	136.6	82%	0.815	71%	0.708	S	S	*	*			trans	-128	126	163.1	-58.6	-175.7	0	0	0	109.5
320	H	38	Very low	40.3	Very low	169 Å²	169	138.9 Å²	138.9	78%	0.782	72%	0.716	S	S	*	*			trans	-58.9	159.7	-172.4	-76	-112.4	0	0	0	114.7	L322	H320-L322 PolarHBondContact O-N 2.8Å
321	P	35	Very low	40.4	Very low	117 Å²	117	140.8 Å²	140.8	76%	0.76	73%	0.731	S	S	*	*			trans	-90.9	95.3	-177.3	34.6	-27.9	0	0	0	110.8
322	L	36.1	Very low	40.5	Very low	154 Å²	154	144 Å²	144	81%	0.806	74%	0.736	S	S	*	*			trans	-149.2	137.3	169.8	-77.2	177.9	0	0	0	113.4	H320	H320-L322 PolarHBondContact O-N 2.8Å
323	N	35.9	Very low	40.3	Very low	148 Å²	148	146.8 Å²	146.8	79%	0.791	75%	0.747	S	S	*	*			trans	86.4	92.2	160.3	-65.2	-1.7	0	0	0	119.4	H325	N323-H325 PolarHBondContact O-N 3.19Å
324	N	34	Very low	40.1	Very low	167 Å²	167	147.7 Å²	147.7	89%	0.893	76%	0.757	S	S	*	*			trans	-39.1	118.3	140.1	-74.5	-15.3	0	0	0	111.1
325	H	39.8	Very low	39.7	Very low	173 Å²	173	147 Å²	147	80%	0.801	76%	0.764	S	S	*	*			trans	-112	112.8	151	-135.7	-55.3	0	0	0	107.6	N323 D327	N323-H325 PolarHBondContact O-N 3.19Å; H325-D327 PolarHBondContact O-N 3.4Å
326	H	41.3	Very low	39.5	Very low	171 Å²	171	150 Å²	150	79%	0.792	78%	0.776	S	S	*	*			trans	-81.1	109.1	178	-144.8	-3.2	0	0	0	106.8	H328	H326-H328 PolarHBondContact O-N 3.43Å
327	D	41.9	Very low	39.4	Very low	139 Å²	139	150.3 Å²	150.3	74%	0.743	78%	0.778	S	S	*	*			trans	-74.6	112.7	169.3	-78.7	-39.1	0	0	0	109.3	H325 Y329	H325-D327 PolarHBondContact O-N 3.4Å; D327-Y329 PolarHBondContact O-N 3.41Å
328	H	40.4	Very low	39.3	Very low	164 Å²	164	155.8 Å²	155.8	76%	0.759	78%	0.784	S	S	*	*			trans	-85.4	94.6	-178.6	-148.1	75.3	0	0	0	108.8	H326	H326-H328 PolarHBondContact O-N 3.43Å
329	Y	43.1	Very low	39.7	Very low	224 Å²	224	158.4 Å²	158.4	88%	0.878	79%	0.791	S	S	*	*			trans	-85.8	111.4	164.4	-94	-84.2	0	0	0	109.6	D327 H331	D327-Y329 PolarHBondContact O-N 3.41Å; Y329-H331 PolarHBondContact O-N 3.42Å
330	H	40.3	Very low	39.8	Very low	163 Å²	163	160.2 Å²	160.2	76%	0.755	80%	0.796	S	S	*	*			trans	-48.1	119.3	175.9	-97	-98.6	0	0	0	113
331	H	46.2	Very low	40.1	Very low	190 Å²	190	160.6 Å²	160.6	88%	0.88	80%	0.797	S	S	*	*			trans	-106.8	107.8	156	-110.6	-72.8	0	0	0	108.6	Y329	Y329-H331 PolarHBondContact O-N 3.42Å
332	H	42.9	Very low	40.6	Very low	152 Å²	152	161.6 Å²	161.6	70%	0.704	80%	0.796	S	S	*	*			trans	-100.4	93	175.8	-177	-66.8	0	0	0	109.6
333	L	41.1	Very low	40.8	Very low	154 Å²	154	165.3 Å²	165.3	81%	0.806	80%	0.8	S	S	*	*			trans	-145.8	88.6	157.2	-84.2	176.7	0	0	0	109.5
334	T	40.7	Very low	40.8	Very low	111 Å²	111	166.4 Å²	166.4	68%	0.681	80%	0.802	S	S	*	*			trans	24.7	119.7	138.7	44.7	0	0	0	0	119.6
335	S	36	Very low	41.6	Very low	110 Å²	110	164.1 Å²	164.1	77%	0.769	80%	0.796	S	S	*	*			trans	-37.1	142.6	163.8	63.8	0	0	0	0	116.2
336	L	41.9	Very low	41.8	Very low	157 Å²	157	165 Å²	165	82%	0.822	80%	0.798	S	S	*	*			trans	-171.9	145.3	136	-96.7	156.7	0	0	0	109.8
337	N	39.1	Very low	42	Very low	139 Å²	139	164.1 Å²	164.1	74%	0.743	80%	0.799	S	S	*	*			trans	80.8	89.4	179.6	-75.9	-22	0	0	0	117.6
338	R	37.6	Very low	42	Very low	212 Å²	212	163.6 Å²	163.6	80%	0.8	80%	0.801	S	S	*	*				67.2	101	76.8	-71.8	-173.9	-153	-127.5	-0.2	114
339	N	41.5	Very low	42.5	Very low	154 Å²	154	165.2 Å²	165.2	82%	0.824	81%	0.806	S	S	*	*				33.7	106.6	127.9	-64.2	-21.4	0	0	0	117.6
340	Q	43.7	Very low	42.7	Very low	197 Å²	197	164.4 Å²	164.4	92%	0.921	81%	0.807	S	S	*	*			trans	-141.2	111.7	132.3	-72.8	-154.7	0.9	0	0	110.7
341	H	44.2	Very low	42.5	Very low	177 Å²	177	163.7 Å²	163.7	82%	0.819	81%	0.807	S	S	*	*			trans	-55.8	138.5	155.9	-86.9	-70.9	0	0	0	110.2
342	N	44.1	Very low	43.1	Very low	138 Å²	138	160.4 Å²	160.4	74%	0.738	80%	0.803	S	S	*	*				164.5	126	118.2	-86.2	-38.4	0	0	0	113.9
343	R	42.1	Very low	43	Very low	231 Å²	231	160.4 Å²	160.4	87%	0.872	81%	0.808	S	S	*	*			trans	59.2	111.8	137.5	-64	-179.9	175.7	-167.3	-2.7	120.2
344	M	35.3	Very low	43.2	Very low	171 Å²	171	160.5 Å²	160.5	84%	0.842	80%	0.804	S	S	*	*			trans	-67.2	159.5	151.9	-70.4	-163.1	83.9	0	0	111.8
345	P	51.2	Low	43.5	Very low	119 Å²	119	165 Å²	165	77%	0.773	81%	0.809	S	S	*	*				-135.8	148.7	125.5	33.7	-19.8	0	0	0	114.1
346	K	44	Very low	44	Very low	193 Å²	193	169.3 Å²	169.3	84%	0.839	81%	0.814	S	S	*	*			trans	-64.3	137.6	171.8	-61.5	170.8	179.5	175.3	0	109.9
347	N	44.2	Very low	44.2	Very low	151 Å²	151	169.9 Å²	169.9	81%	0.807	81%	0.814	S	S	*	*			trans	-131.8	103.7	166.4	-131	-8.5	0	0	0	110.3
348	T	41.5	Very low	44.7	Very low	129 Å²	129	170 Å²	170	79%	0.791	81%	0.813	S	S	*	*			trans	-73	127.6	168.2	47.4	0	0	0	0	109.6
349	K	51.5	Low	45	Very low	197 Å²	197	169.7 Å²	169.7	86%	0.857	82%	0.818	S	S	*	*			trans	-129.9	131.7	159.8	-82.7	-173.5	178.7	177.4	0	110.7
350	K	48.4	Very low	45.7	Very low	207 Å²	207	170.1 Å²	170.1	90%	0.9	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-55.5	143.5	-171.7	-75.8	167.3	165.6	176.2	0	114.4
351	I	35.3	Very low	46.1	Very low	149 Å²	149	169.8 Å²	169.8	76%	0.764	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-85.9	138.9	158	-61.4	159.3	0	0	0	108.1
352	P	58.1	Low	46.7	Very low	121 Å²	121	166.8 Å²	166.8	79%	0.786	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-101.1	119.7	154.7	-0.8	20.9	0	0	0	110.6
353	N	42.6	Very low	47.4	Very low	152 Å²	152	172.9 Å²	172.9	81%	0.813	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-74.7	130.7	160.7	-86.8	-26.1	0	0	0	109.1
354	E	45.3	Very low	47.7	Very low	156 Å²	156	170 Å²	170	73%	0.729	82%	0.822	S	S	*	*			trans	170.7	129	157.1	-104.6	-172.3	-141.6	0	0	105.5
355	R	45.3	Very low	48.3	Very low	204 Å²	204	169.9 Å²	169.9	77%	0.77	82%	0.821	S	S	*	*			cis	-154.5	144.5	20.3	-86.5	159.6	-172.6	-172.6	-2.4	108.4
356	K	46.3	Very low	48.2	Very low	202 Å²	202	172.8 Å²	172.8	88%	0.878	82%	0.824	S	S	*	*			trans	-73.1	126.4	153.5	-67.9	172.9	176.9	175	0	107.7
357	M	46.2	Very low	48.4	Very low	168 Å²	168	171.6 Å²	171.6	83%	0.828	82%	0.823	S	S	*	*			trans	-132.6	85.9	159.7	-78.7	-90	-83.5	0	0	104.3
358	I	50.9	Low	48.7	Very low	141 Å²	141	172.9 Å²	172.9	72%	0.723	82%	0.824	S	S	*	*				51.6	98.1	101.8	-58.9	179.5	0	0	0	111.1	H360	I358-H360 PolarHBondContact O-N 3.47Å
359	F	42.9	Very low	49.2	Very low	206 Å²	206	175.8 Å²	175.8	90%	0.904	83%	0.826	S	S	*	*			trans	-57.6	124.5	153.6	-92.1	-99.9	0	0	0	108.6
360	H	55.8	Low	49	Very low	163 Å²	163	174.3 Å²	174.3	76%	0.755	82%	0.824	S	S	*	*			trans	-132.9	114.7	155.6	-146.7	-78.3	0	0	0	108.7	I358 V362	I358-H360 PolarHBondContact O-N 3.47Å; H360-V362 WeakPolarHBondContact ND1-CG2 3.26Å
361	F	53.5	Low	49	Very low	190 Å²	190	171.8 Å²	171.8	83%	0.833	82%	0.818	S	S	*	*			trans	-80.3	126.7	171.1	-156	-92.9	0	0	0	107
362	V	57.4	Low	50.2	Low	115 Å²	115	173.7 Å²	173.7	70%	0.697	82%	0.823	S	S	*	*			trans	-145	114.7	161.4	-177.6	0	0	0	0	108.9	H360	H360-V362 WeakPolarHBondContact ND1-CG2 3.26Å
363	K	58	Low	49.5	Very low	266 Å²	266	178.5 Å²	178.5	100%	1.157	83%	0.826	S	S	*	*			trans	50	0	160	-81.4	-177.5	171.4	177.5	0	120.4

Retrieved 363 of 363 residues in 59.4 ms (Link to these results)

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