A0A2K5ZLG8_MANLE Loading...

Autophagy-related protein 9

Phospholipid scramblase involved in autophagy by mediating autophagosomal membrane expansion. Cycles between the preautophagosomal structure/phagophore assembly site (PAS) and the cytoplasmic vesicle pool and supplies membrane for the growing autophagosome. Lipid scramblase activity plays a key role in preautophagosomal structure/phagophore assembly by distributing the phospholipids that arrive through ATG2 (ATG2A or ATG2B) from the cytoplasmic to the luminal leaflet of the bilayer, thereby driving autophagosomal membrane expansion. Also required to supply phosphatidylinositol 4-phosphate to the autophagosome initiation site by recruiting the phosphatidylinositol 4-kinase beta (PI4KB) in a process dependent on ARFIP2, but not ARFIP1. In addition to autophagy, also plays a role in necrotic cell death. Phospholipid scramblase involved in autophagy. Cycles between the preautophagosomal structure/phagophore assembly site (PAS) and the cytoplasmic vesicle pool and supplies membrane for the growing autophagosome. Lipid scramblase activity plays a key role in preautophagosomal structure/phagophore assembly by distributing the phospholipids that arrive through ATG2 from the cytoplasmic to the luminal leaflet of the bilayer, thereby driving autophagosomal membrane expansion.

AlphaFold DB , UniProt , Accession A0A2K5ZLG8, Species MANLE (Mandrillus leucophaeus, Drill), Gene ATG9A, Length 839 aa.

						>A0A2K5ZLG8_MANLE|A0A2K5ZLG8|ATG9A
MAQFDTEYQRLEASYSDSPPGEEDLLVHVAEGSKSPWHHIENLDLFFSRVYNLHQKNGFTCMLIGEIFELMQFLFVVAFTTFLVSCVDYDILFANKMVNHSLHPTEPVKVTLPDAFLPAQVCSARIQENGSLITILFIAGVFWIHRLIKFIYNICCYWEIHSFYLHALRIPMSALPYCTWQEVQARIVQTQKEHQICIHKRELTELDIYHRILRFQNYMVALVNKSLLPLRFRLPGLGEAVFFTRGLKYNFELILFWGPGSLFLNEWSLKAEYKRGGQRLELAQRLSNRILWIGIANFLLCPLILIWQILYAFFSYAEVLKREPGALGARCWSLYGRCYLRHFNELEHELQSRLNRGYKPASKYMNCFLSPLLTLLAKNGAFFAGSILAVLIALTIYDEDVLAVEHVLTTVTLLGVTVTVCRSFIPDQHMVFCPEQLLRVILAHIHYMPDHWQGNAHRSQTRDEFAQLFQYKAVFILEELLSPIVTPLILIFCLRPRALEIIDFFRNFTVEVVGVGDTCSFAQMDVRQHGHPQWLSAGQTEASVYQQAEDGKTELSLMHFAITNPGWQPPRESTAFLGFLKEQVQRDGAAASLAQGGLLPENALFTSIQSLQSESEPLSLIANVVAGSSCRGPPLPRDLQGSRHRAEVASALRSFSPLQPVQAPTGRAHSTMTGSGVDARTASSGSSVWEGQLQSLVLSEYASTEMSLHALYMHQLHKQQAQAEPERHVWHRRESDESGESAPDEGGEGARAPQSIPRSASYPCAAPRPGAPETTALHGGFQRRYGGITDPGTVPRAPSHFSRLPLGGWAEDGQSASRHPEPVPEEGSEDELPPQVHKV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	34.3	Very low	32.2	Very low	247 Å²	247	178.4 Å²	178.4	100%	1.217	86%	0.863	S	S	*	*				0	119	0	-119	173.1	174.3	0	0	107.1
2	A	36.2	Very low	32.3	Very low	93 Å²	93	178.2 Å²	178.2	77%	0.769	86%	0.86	S	S	*	*			trans	62.9	96.9	168.5	0	0	0	0	0	119.3
3	Q	36.3	Very low	31.9	Very low	167 Å²	167	172 Å²	172	78%	0.78	86%	0.856	S	S	*	*			trans	-58.5	146.1	149.5	-72.1	157	-72.2	0	0	110.7
4	F	33.4	Very low	31.9	Very low	198 Å²	198	166.4 Å²	166.4	87%	0.868	84%	0.842	S	S	*	*			trans	-125	99.2	153.1	-93	-82.4	0	0	0	107.4
5	D	38	Very low	31.5	Very low	132 Å²	132	170.3 Å²	170.3	71%	0.706	84%	0.844	S	S	*	*			trans	-71.3	131.8	162.7	-75.2	-44.7	0	0	0	108.5
6	T	31.8	Very low	31.6	Very low	122 Å²	122	167.2 Å²	167.2	75%	0.748	85%	0.845	S	S	*	*			trans	-128.4	103.9	159.3	33.1	0	0	0	0	108.1
7	E	31.1	Very low	31.6	Very low	193 Å²	193	166.8 Å²	166.8	90%	0.902	85%	0.845	S	S	*	*			trans	-60.5	128.6	170.6	-71.9	175.3	134.3	0	0	110.2
8	Y	33.2	Very low	31.7	Very low	231 Å²	231	163.4 Å²	163.4	91%	0.906	84%	0.84	S	S	*	*			trans	-92.1	113.7	161.3	-88.6	-88.5	0	0	0	109.2
9	Q	26.9	Very low	31.8	Very low	189 Å²	189	160.9 Å²	160.9	88%	0.883	84%	0.835	S	S	*	*			trans	-75.2	124.7	175.4	-162.7	165.2	4.4	0	0	109.9	L11	Q9-L11 PolarHBondContact O-N 3.17Å
10	R	26.4	Very low	32	Very low	221 Å²	221	159.8 Å²	159.8	83%	0.834	84%	0.838	S	S	*	*			trans	-70.8	112.5	174.5	-166.8	-179.6	-161.5	158.6	2.8	108.8	E12	R10-E12 PolarHBondContact O-N 3.11Å; R10-E12 VanDerWaalsContact O-N 3.16Å
11	L	27	Very low	32.3	Very low	169 Å²	169	155.8 Å²	155.8	89%	0.885	84%	0.836	S	S	*	*			trans	-73.4	99.7	162.4	-91.3	158	0	0	0	107.7	Q9 A13	Q9-L11 PolarHBondContact O-N 3.17Å; L11-A13 PolarHBondContact O-N 2.98Å; L11-A13 VanDerWaalsContact O-N 3.12Å
12	E	32.7	Very low	32.3	Very low	176 Å²	176	153.2 Å²	153.2	82%	0.822	82%	0.82	S	S	*	*			trans	-64	101.6	160.3	-72	-176.5	163.5	0	0	108.2	R10	R10-E12 PolarHBondContact O-N 3.11Å; R10-E12 VanDerWaalsContact O-N 3.16Å
13	A	26.9	Very low	32.2	Very low	98 Å²	98	157.9 Å²	157.9	81%	0.81	83%	0.827	S	S	*	*			trans	-97.3	109.1	160.3	0	0	0	0	0	107.7	L11	L11-A13 PolarHBondContact O-N 2.98Å; L11-A13 VanDerWaalsContact O-N 3.12Å
14	S	31.7	Very low	32.2	Very low	94 Å²	94	156.9 Å²	156.9	66%	0.657	83%	0.826	S	S	*	*			trans	-55.3	158	176.4	57.5	0	0	0	0	114
15	Y	26.8	Very low	32.2	Very low	224 Å²	224	154.8 Å²	154.8	88%	0.878	82%	0.823	S	S	*	*			trans	102.6	69.8	173.2	-62.9	-76.6	0	0	0	115.3
16	S	33.1	Very low	32.1	Very low	121 Å²	121	155.9 Å²	155.9	85%	0.846	83%	0.829	S	S	*	*			trans	-76.4	127	148.7	-57.8	0	0	0	0	109.3
17	D	31.5	Very low	32.4	Very low	161 Å²	161	155.1 Å²	155.1	86%	0.861	82%	0.823	S	S	*	*			trans	-155.6	75.3	148.6	-142.3	10.2	0	0	0	109.3
18	S	33.8	Very low	32.3	Very low	106 Å²	106	154.8 Å²	154.8	74%	0.741	82%	0.821	S	S	*	*			trans	-82.8	136.9	166.3	-56.6	0	0	0	0	108.4
19	P	33.2	Very low	32.5	Very low	116 Å²	116	148.6 Å²	148.6	75%	0.753	81%	0.807	S	S	*	*			trans	-63.1	144.7	176.7	25.5	-31.9	0	0	0	111	G21	P19-G21 PolarHBondContact O-N 3.28Å
20	P	35.5	Very low	33	Very low	138 Å²	138	143.5 Å²	143.5	90%	0.896	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	114.1	-178	29.9	-30.8	0	0	0	109.7
21	G	39.1	Very low	33.6	Very low	76 Å²	76	142.2 Å²	142.2	78%	0.784	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	162.7	-10.6	170.3	0	0	0	0	0	119.2	P19	P19-G21 PolarHBondContact O-N 3.28Å
22	E	33.4	Very low	34.2	Very low	192 Å²	192	136.7 Å²	136.7	90%	0.897	79%	0.785	S	S	*	*			trans	-105.9	114.3	176.3	-71.7	-173.8	166	0	0	110.2	D24	E22-D24 PolarHBondContact O-N 3.28Å
23	E	34.7	Very low	34.7	Very low	192 Å²	192	134.2 Å²	134.2	90%	0.897	79%	0.787	S	S	*	*			trans	-59.2	118.8	170.8	-65.8	-178.3	162.8	0	0	108.9	L25	E23-L25 PolarHBondContact O-N 3.3Å
24	D	36.2	Very low	35.9	Very low	145 Å²	145	137.1 Å²	137.1	78%	0.775	78%	0.782	S	S	*	*			trans	-55.3	95.9	172.7	-102.5	-25.3	0	0	0	109.7	E22 L26	E22-D24 PolarHBondContact O-N 3.28Å; D24-L26 HydrophobicContact CB-CG 4.39Å; D24-L26 PolarHBondContact O-N 3.12Å
25	L	33.7	Very low	37.3	Very low	154 Å²	154	134.1 Å²	134.1	81%	0.806	76%	0.76	S	S	*	*			trans	-76.2	78.8	170	-141.7	132.2	0	0	0	107.3	E23 V27	E23-L25 PolarHBondContact O-N 3.3Å; L25-V27 VanDerWaalsContact C-N 3.28Å; L25-V27 HydrophobicContact CD2-CG2 3.84Å; L25-V27 PolarHBondContact O-N 3.47Å
26	L	36.5	Very low	39.4	Very low	156 Å²	156	128.3 Å²	128.3	82%	0.817	75%	0.75	S	S	*	*			trans	-63.5	85.7	175.8	-77.1	161.4	0	0	0	110	D24 H28	D24-L26 HydrophobicContact CB-CG 4.39Å; D24-L26 PolarHBondContact O-N 3.12Å; L26-H28 PolarHBondContact O-N 2.94Å
27	V	36.2	Very low	41.4	Very low	105 Å²	105	123.1 Å²	123.1	64%	0.636	71%	0.712	S	S	*	*			trans	-77.9	99.3	167.2	-177.6	0	0	0	0	108	L25 V29	L25-V27 VanDerWaalsContact C-N 3.28Å; L25-V27 HydrophobicContact CD2-CG2 3.84Å; L25-V27 PolarHBondContact O-N 3.47Å; V27-V29 HydrophobicContact CG1-CG2 3.91Å; V27-V29 PolarHBondContact O-N 2.85Å; V27-V29 VanDerWaalsContact O-N 3.11Å
28	H	31	Very low	43.4	Very low	186 Å²	186	119.6 Å²	119.6	86%	0.861	69%	0.69	S	S	*	*			trans	-71.8	100.1	172.3	-147.6	-50.5	0	0	0	109.2	L26	L26-H28 PolarHBondContact O-N 2.94Å
29	V	35.8	Very low	45.4	Very low	101 Å²	101	119.1 Å²	119.1	61%	0.612	68%	0.676	S	S	*	*			trans	-91.8	126.6	170.2	-177.8	0	0	0	0	108.8	V27	V27-V29 HydrophobicContact CG1-CG2 3.91Å; V27-V29 PolarHBondContact O-N 2.85Å; V27-V29 VanDerWaalsContact O-N 3.11Å
30	A	37.1	Very low	47.6	Very low	83 Å²	83	115 Å²	115	69%	0.686	65%	0.648	S	S	*	*			trans	-55.9	147.1	-179.9	0	0	0	0	0	112.3	G32	A30-G32 PolarHBondContact O-N 2.88Å
31	E	39.6	Very low	49.6	Very low	193 Å²	193	116 Å²	116	90%	0.902	64%	0.641	S	S	*	*			trans	-66.4	74.3	177.5	-67.3	178.6	150.7	0	0	112
32	G	38.8	Very low	51.9	Low	53 Å²	53	114.5 Å²	114.5	55%	0.546	61%	0.614	S	S	.	*	S	Bend	trans	-103.6	124	160.5	0	0	0	0	0	108.7	A30 K34	A30-G32 PolarHBondContact O-N 2.88Å; G32-K34 PolarHBondContact O-N 3.48Å
33	S	43.5	Very low	54.6	Low	124 Å²	124	106 Å²	106	87%	0.867	58%	0.575	S	S	*	*			trans	-6	86.7	179.2	64.5	0	0	0	0	115.1	S35	S33-S35 PolarHBondContact O-N 3.47Å
34	K	52.8	Low	57.3	Low	160 Å²	160	97 Å²	97	70%	0.696	53%	0.533	S	S	*	.			trans	-63.6	107.9	178.4	-67.2	179.1	-178.9	175.5	0	107.6	G32	G32-K34 PolarHBondContact O-N 3.48Å
35	S	60.9	Low	60	Low	30 Å²	30	92.6 Å²	92.6	21%	0.21	51%	0.509	C	S	.	.			trans	-56.1	139.4	170.8	57.9	0	0	0	0	108.1	S33 W37 H38 H194	S33-S35 PolarHBondContact O-N 3.47Å; S35-W37 PolarHBondContact O-N 2.85Å; S35-H38 WeakPolarHBondContact O-CB 3.41Å; S35-H38 PolarHBondContact O-N 2.87Å; S35-H194 WeakPolarHBondContact CB-ND1 3.35Å; S35-H194 PolarHBondContact OG-ND1 2.82Å
36	P	71	Confident	62.8	Low	103 Å²	103	85.6 Å²	85.6	67%	0.669	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-13	-175.6	23.4	-33	0	0	0	113.4
37	W	75.5	Confident	65.6	Low	11 Å²	11	78.2 Å²	78.2	4%	0.042	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	7.3	-178.5	-43	118.8	0	0	0	114.5	S35 H39 E159 F163	S35-W37 PolarHBondContact O-N 2.85Å; W37-H39 PolarHBondContact O-N 2.7Å; W37-E159 HydrophobicContact CH2-CB 4.41Å; W37-E159 HydrophobicContact CH2-CG 3.4Å; W37-E159 WeakPolarHBondContact CH2-O 3.21Å; W37-E159 HydrophobicContact CZ3-CG 3.3Å; W37-E159 WeakPolarHBondContact CZ3-OE1 3.13Å; W37-F163 HydrophobicContact CD2-CB 4.34Å; W37-F163 AromaticContact CD2-CD2 3.89Å; W37-F163 HydrophobicContact CD2-CD2 3.89Å; W37-F163 HydrophobicContact CE3-CB 4.43Å; W37-F163 HydrophobicContact CE3-CD2 4.32Å; W37-F163 HydrophobicContact CG-CD2 4Å; W37-F163 HydrophobicContact CH2-CB 3.98Å; W37-F163 HydrophobicContact CZ2-CB 3.82Å; W37-F163 HydrophobicContact CZ3-CB 4.26Å
38	H	73.7	Confident	68.5	Low	87 Å²	87	74.8 Å²	74.8	40%	0.403	41%	0.414	S	S	.	.	S	Bend	trans	-80.4	117.4	177.8	-168.4	-71	0	0	0	109.3	S35	S35-H38 WeakPolarHBondContact O-CB 3.41Å; S35-H38 PolarHBondContact O-N 2.87Å
39	H	74.9	Confident	71.5	Confident	96 Å²	96	67.2 Å²	67.2	44%	0.444	38%	0.378	S	S	.	.			trans	64.1	85.3	-177.5	-169.1	-112	0	0	0	115.2	W37 I198	W37-H39 PolarHBondContact O-N 2.7Å; H39-I198 HydrophobicContact CB-CD1 3.75Å; H39-I198 HydrophobicContact CB-CG1 4.26Å; H39-I198 WeakPolarHBondContact CD2-CD1 3.44Å
40	I	79.9	Confident	74.4	Confident	30 Å²	30	62.4 Å²	62.4	15%	0.154	35%	0.349	C	S	.	.			trans	-91.1	120	170.1	-55.7	-178.2	0	0	0	108.8	N42 L43 F46 I196	I40-N42 PolarHBondContact O-N 2.85Å; I40-L43 HydrophobicContact CB-CD2 3.91Å; I40-L43 HydrophobicContact CG2-CD2 4.4Å; I40-F46 HydrophobicContact CD1-CD1 4.01Å; I40-F46 HydrophobicContact CD1-CD2 3.46Å; I40-F46 VanDerWaalsContact CD1-CD2 3.46Å; I40-F46 HydrophobicContact CD1-CE1 3.97Å; I40-F46 HydrophobicContact CD1-CE2 3.42Å; I40-F46 VanDerWaalsContact CD1-CE2 3.42Å; I40-F46 HydrophobicContact CD1-CG 3.77Å; I40-F46 HydrophobicContact CD1-CZ 3.68Å; I40-F46 HydrophobicContact CG2-CB 4.1Å; I40-F46 HydrophobicContact CG2-CD2 4.45Å; I40-F46 HydrophobicContact CG2-CG 4.35Å; I40-I196 HydrophobicContact CD1-CG2 3.77Å; I40-I196 HydrophobicContact CG1-CG2 4.25Å
41	E	77.4	Confident	77.3	Confident	160 Å²	160	59.5 Å²	59.5	75%	0.748	32%	0.321	S	S	*	.	S	Bend	trans	-63	-42.4	-177.2	-64.4	-179.4	177.3	0	0	112.6	W267	E41-W267 VanDerWaalsContact O-CH2 3.29Å; E41-W267 WeakPolarHBondContact O-CH2 3.37Å
42	N	87.2	Confident	80	Confident	43 Å²	43	52.6 Å²	52.6	23%	0.23	29%	0.29	C	S	.	.			trans	-112.9	86.7	178.9	-170	-15.1	0	0	0	112	I40 D44 L45 F46 E266 W267	I40-N42 PolarHBondContact O-N 2.85Å; N42-D44 VanDerWaalsContact C-N 3.32Å; N42-D44 PolarHBondContact O-N 3.2Å; N42-D44 PolarHBondContact OD1-N 3.36Å; N42-L45 HydrophobicContact CB-CB 4.47Å; N42-L45 PolarHBondContact OD1-N 3.07Å; N42-F46 WeakPolarHBondContact O-CB 3.25Å; N42-F46 PolarHBondContact O-N 3.48Å; N42-E266 PolarHBondContact ND2-OE2 3.32Å; N42-E266 PolarHBondContact OD1-OE2 3.43Å; N42-W267 HydrophobicContact CB-CZ3 3.89Å
43	L	90.1	Very high	82.8	Confident	15 Å²	15	50.1 Å²	50.1	8%	0.079	26%	0.264	C	S	.	.	H	α-helix	trans	-68.5	-28.8	177.9	-70.7	173.3	0	0	0	113.4	I40 F46 F47 I196 C197	I40-L43 HydrophobicContact CB-CD2 3.91Å; I40-L43 HydrophobicContact CG2-CD2 4.4Å; L43-F46 PolarHBondContact O-N 2.74Å; L43-F47 HydrophobicContact CB-CD2 4.31Å; L43-F47 HydrophobicContact CB-CE2 4.12Å; L43-F47 HydrophobicContact CD2-CE2 4.16Å; L43-F47 WeakPolarHBondContact O-CD2 3.45Å; L43-F47 PolarHBondContact O-N 2.8Å; L43-I196 HydrophobicContact CD2-CG2 3.77Å; L43-C197 HydrophobicContact CD1-CB 4.01Å
44	D	91.8	Very high	85.3	Confident	2 Å²	2	45 Å²	45	1%	0.011	23%	0.226	C	C	.	.	H	α-helix	trans	-68	-48.6	-177.5	-70.2	7.1	0	0	0	110.5	N42 F46 S48 R211 R214 E266	N42-D44 VanDerWaalsContact C-N 3.32Å; N42-D44 PolarHBondContact O-N 3.2Å; N42-D44 PolarHBondContact OD1-N 3.36Å; D44-F46 VanDerWaalsContact C-N 3.35Å; D44-S48 VanDerWaalsContact O-CB 3.27Å; D44-S48 WeakPolarHBondContact O-CB 3.28Å; D44-S48 PolarHBondContact O-N 3.11Å; D44-S48 PolarHBondContact O-OG 3.36Å; D44-R211 WeakPolarHBondContact OD1-CB 3.34Å; D44-R211 WeakPolarHBondContact OD1-CG 3.43Å; D44-R211 IonicContact OD1-NH1 2.74Å; D44-R211 PolarHBondContact OD1-NH1 3.44Å; D44-R211 VanDerWaalsContact OD1-NH1 3.15Å; D44-R214 IonicContact OD1-NH2 3.57Å; D44-R214 PolarHBondContact OD1-NH2 2.95Å; D44-R214 IonicContact OD2-CZ 3.66Å; D44-R214 IonicContact OD2-NE 2.73Å; D44-R214 PolarHBondContact OD2-NE 3.43Å; D44-R214 IonicContact OD2-NH2 3.4Å; D44-R214 PolarHBondContact OD2-NH2 3.2Å; D44-E266 HydrophobicContact CB-CG 4.23Å
45	L	92.1	Very high	87.4	Confident	52 Å²	52	40.3 Å²	40.3	27%	0.272	21%	0.207	S	C	.	.	H	α-helix	trans	-66	-38	174.4	-175.8	59.5	0	0	0	111.9	N42 S48 R49	N42-L45 HydrophobicContact CB-CB 4.47Å; N42-L45 PolarHBondContact OD1-N 3.07Å; L45-S48 PolarHBondContact O-N 2.82Å; L45-R49 HydrophobicContact CD1-CG 4.33Å; L45-R49 WeakPolarHBondContact O-CB 3.46Å; L45-R49 VanDerWaalsContact O-CG 3.26Å; L45-R49 WeakPolarHBondContact O-CG 3.45Å; L45-R49 PolarHBondContact O-N 3.3Å
46	F	93.7	Very high	89	Confident	8 Å²	8	43 Å²	43	4%	0.035	22%	0.215	C	C	.	.	H	α-helix	trans	-59.5	-55.9	176.7	176.5	-98.9	0	0	0	111.7	I40 N42 L43 D44 S48 R49 V50 I160 F163 I196	I40-F46 HydrophobicContact CD1-CD1 4.01Å; I40-F46 HydrophobicContact CD1-CD2 3.46Å; I40-F46 VanDerWaalsContact CD1-CD2 3.46Å; I40-F46 HydrophobicContact CD1-CE1 3.97Å; I40-F46 HydrophobicContact CD1-CE2 3.42Å; I40-F46 VanDerWaalsContact CD1-CE2 3.42Å; I40-F46 HydrophobicContact CD1-CG 3.77Å; I40-F46 HydrophobicContact CD1-CZ 3.68Å; I40-F46 HydrophobicContact CG2-CB 4.1Å; I40-F46 HydrophobicContact CG2-CD2 4.45Å; I40-F46 HydrophobicContact CG2-CG 4.35Å; N42-F46 WeakPolarHBondContact O-CB 3.25Å; N42-F46 PolarHBondContact O-N 3.48Å; L43-F46 PolarHBondContact O-N 2.74Å; D44-F46 VanDerWaalsContact C-N 3.35Å; F46-S48 VanDerWaalsContact C-N 3.3Å; F46-S48 PolarHBondContact O-N 3.5Å; F46-R49 PolarHBondContact O-N 2.89Å; F46-R49 VanDerWaalsContact O-N 3.14Å; F46-V50 HydrophobicContact CD1-CG2 4.2Å; F46-V50 HydrophobicContact CE1-CG2 3.87Å; F46-V50 HydrophobicContact CE2-CG2 4.3Å; F46-V50 HydrophobicContact CZ-CG2 3.93Å; F46-V50 VanDerWaalsContact O-CG2 3.32Å; F46-V50 WeakPolarHBondContact O-CG2 3.22Å; F46-V50 PolarHBondContact O-N 3.19Å; F46-I160 HydrophobicContact CD2-CD1 3.31Å; F46-I160 HydrophobicContact CE2-CD1 3.34Å; F46-I160 HydrophobicContact CG-CD1 4.33Å; F46-I160 HydrophobicContact CZ-CD1 4.36Å; F46-F163 HydrophobicContact CE1-CE1 4.06Å; F46-F163 HydrophobicContact CE1-CZ 4.05Å; F46-F163 HydrophobicContact CE2-CD1 4.44Å; F46-F163 HydrophobicContact CE2-CG 4.37Å; F46-F163 AromaticContact CZ-CD1 3.72Å; F46-F163 HydrophobicContact CZ-CD1 3.72Å; F46-F163 AromaticContact CZ-CD2 3.93Å; F46-F163 HydrophobicContact CZ-CD2 3.93Å; F46-F163 AromaticContact CZ-CE1 3.62Å; F46-F163 HydrophobicContact CZ-CE1 3.62Å; F46-F163 AromaticContact CZ-CE2 3.87Å; F46-F163 HydrophobicContact CZ-CE2 3.87Å; F46-F163 AromaticContact CZ-CG 3.86Å; F46-F163 HydrophobicContact CZ-CG 3.86Å; F46-F163 AromaticContact CZ-CZ 3.7Å; F46-F163 HydrophobicContact CZ-CZ 3.7Å; F46-I196 HydrophobicContact CE1-CG2 4.22Å
47	F	95.1	Very high	90.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.8	-34	179.6	-70	-57.4	0	0	0	112.6	L43 R49 V50 Y51 I187 L203 I208 R211 I212	L43-F47 HydrophobicContact CB-CD2 4.31Å; L43-F47 HydrophobicContact CB-CE2 4.12Å; L43-F47 HydrophobicContact CD2-CE2 4.16Å; L43-F47 WeakPolarHBondContact O-CD2 3.45Å; L43-F47 PolarHBondContact O-N 2.8Å; F47-R49 VanDerWaalsContact C-N 3.31Å; F47-R49 PolarHBondContact O-N 3.06Å; F47-V50 PolarHBondContact O-N 3.34Å; F47-Y51 WeakPolarHBondContact O-CB 3.21Å; F47-Y51 PolarHBondContact O-N 2.74Å; F47-I187 HydrophobicContact CE1-CG2 3.8Å; F47-L203 HydrophobicContact CE1-CD2 4.32Å; F47-L203 HydrophobicContact CE2-CD2 4.37Å; F47-L203 HydrophobicContact CZ-CD2 3.66Å; F47-I208 HydrophobicContact CD1-CG2 4.39Å; F47-I208 HydrophobicContact CG-CG2 4.47Å; F47-R211 HydrophobicContact CD2-CB 4.08Å; F47-R211 HydrophobicContact CD2-CG 4.35Å; F47-I212 HydrophobicContact CB-CD1 4.39Å; F47-I212 HydrophobicContact CB-CG1 3.85Å
48	S	95.6	Very high	91	Very high	34 Å²	34	41.9 Å²	41.9	24%	0.238	21%	0.205	C	C	.	.	H	α-helix	trans	-61	-40.6	173.4	-63.3	0	0	0	0	111.9	D44 L45 F46 N52	D44-S48 VanDerWaalsContact O-CB 3.27Å; D44-S48 WeakPolarHBondContact O-CB 3.28Å; D44-S48 PolarHBondContact O-N 3.11Å; D44-S48 PolarHBondContact O-OG 3.36Å; L45-S48 PolarHBondContact O-N 2.82Å; F46-S48 VanDerWaalsContact C-N 3.3Å; F46-S48 PolarHBondContact O-N 3.5Å; S48-N52 VanDerWaalsContact O-CB 3.3Å; S48-N52 WeakPolarHBondContact O-CB 3.29Å; S48-N52 PolarHBondContact O-N 3.39Å
49	R	95.9	Very high	92	Very high	27 Å²	27	38.6 Å²	38.6	10%	0.102	19%	0.189	C	C	.	.	H	α-helix	trans	-72	-39.9	175.8	-71.4	170.8	172.9	168	-5.7	112.5	L45 F46 F47 N52 L53 C156 Y157 I160	L45-R49 HydrophobicContact CD1-CG 4.33Å; L45-R49 WeakPolarHBondContact O-CB 3.46Å; L45-R49 VanDerWaalsContact O-CG 3.26Å; L45-R49 WeakPolarHBondContact O-CG 3.45Å; L45-R49 PolarHBondContact O-N 3.3Å; F46-R49 PolarHBondContact O-N 2.89Å; F46-R49 VanDerWaalsContact O-N 3.14Å; F47-R49 VanDerWaalsContact C-N 3.31Å; F47-R49 PolarHBondContact O-N 3.06Å; R49-N52 PolarHBondContact O-N 2.8Å; R49-L53 WeakPolarHBondContact O-CB 3.48Å; R49-L53 PolarHBondContact O-N 3.15Å; R49-C156 VanDerWaalsContact NH1-CB 3.31Å; R49-C156 PolarHBondContact NH1-SG 3.4Å; R49-C156 PolarHBondContact NH2-SG 3.17Å; R49-C156 VanDerWaalsContact NH2-SG 3.38Å; R49-Y157 HydrophobicContact CB-CD1 4.22Å; R49-Y157 HydrophobicContact CB-CE1 3.65Å; R49-Y157 HydrophobicContact CG-CE1 3.87Å; R49-I160 HydrophobicContact CB-CD1 4.38Å; R49-I160 HydrophobicContact CB-CG1 3.89Å
50	V	96.3	Very high	93	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-56	-53.1	172.9	171.4	0	0	0	0	109.5	F46 F47 N52 L53 H54 I160 F163 Y164 W180 I187	F46-V50 HydrophobicContact CD1-CG2 4.2Å; F46-V50 HydrophobicContact CE1-CG2 3.87Å; F46-V50 HydrophobicContact CE2-CG2 4.3Å; F46-V50 HydrophobicContact CZ-CG2 3.93Å; F46-V50 VanDerWaalsContact O-CG2 3.32Å; F46-V50 WeakPolarHBondContact O-CG2 3.22Å; F46-V50 PolarHBondContact O-N 3.19Å; F47-V50 PolarHBondContact O-N 3.34Å; V50-N52 PolarHBondContact O-N 2.89Å; V50-L53 PolarHBondContact O-N 2.62Å; V50-H54 PolarHBondContact O-N 3.46Å; V50-I160 HydrophobicContact CB-CG2 4.4Å; V50-I160 HydrophobicContact CG2-CD1 4.25Å; V50-I160 HydrophobicContact CG2-CG2 3.8Å; V50-F163 HydrophobicContact CG2-CD1 4.13Å; V50-F163 HydrophobicContact CG2-CE1 4.07Å; V50-Y164 HydrophobicContact CB-CE2 4.44Å; V50-Y164 HydrophobicContact CG1-CE2 3.89Å; V50-Y164 VanDerWaalsContact CG1-OH 3.27Å; V50-Y164 WeakPolarHBondContact CG1-OH 3.48Å; V50-Y164 PolarHBondContact O-OH 2.95Å; V50-W180 HydrophobicContact CG1-CH2 4.37Å; V50-W180 HydrophobicContact CG1-CZ3 4.42Å; V50-I187 HydrophobicContact CG1-CD1 3.76Å
51	Y	97.3	Very high	93.7	Very high	22 Å²	22	40.5 Å²	40.5	9%	0.086	21%	0.212	C	C	.	.	H	α-helix	trans	-58.5	-47.5	176.4	176.4	-102.7	0	0	0	112.5	F47 L53 H54 Q55 W180 I212 L346 E347 H348	F47-Y51 WeakPolarHBondContact O-CB 3.21Å; F47-Y51 PolarHBondContact O-N 2.74Å; Y51-L53 VanDerWaalsContact C-N 3.34Å; Y51-L53 PolarHBondContact O-N 3.12Å; Y51-H54 WeakPolarHBondContact O-CB 3.44Å; Y51-H54 PolarHBondContact O-N 3.35Å; Y51-Q55 HydrophobicContact CD1-CG 4.09Å; Y51-Q55 HydrophobicContact CD2-CG 4.25Å; Y51-Q55 HydrophobicContact CE1-CG 3.61Å; Y51-Q55 HydrophobicContact CE2-CG 3.79Å; Y51-Q55 HydrophobicContact CG-CG 4.38Å; Y51-Q55 VanDerWaalsContact CZ-CG 3.44Å; Y51-Q55 WeakPolarHBondContact O-CG 3.13Å; Y51-Q55 PolarHBondContact O-N 3.38Å; Y51-W180 AromaticContact CD2-CD2 3.81Å; Y51-W180 HydrophobicContact CD2-CD2 3.81Å; Y51-W180 AromaticContact CD2-CE2 3.84Å; Y51-W180 AromaticContact CD2-CE3 3.8Å; Y51-W180 HydrophobicContact CD2-CE3 3.8Å; Y51-W180 AromaticContact CD2-CH2 3.85Å; Y51-W180 HydrophobicContact CD2-CH2 3.85Å; Y51-W180 AromaticContact CD2-CZ2 3.86Å; Y51-W180 HydrophobicContact CD2-CZ2 3.86Å; Y51-W180 AromaticContact CD2-CZ3 3.83Å; Y51-W180 HydrophobicContact CD2-CZ3 3.83Å; Y51-W180 HydrophobicContact CE2-CD2 4.23Å; Y51-W180 HydrophobicContact CE2-CE3 4.49Å; Y51-W180 HydrophobicContact CG-CH2 4.31Å; Y51-W180 HydrophobicContact CG-CZ3 4.42Å; Y51-I212 HydrophobicContact CD1-CG2 4.22Å; Y51-I212 HydrophobicContact CG-CD1 4.31Å; Y51-I212 HydrophobicContact CG-CG2 4.38Å; Y51-L346 HydrophobicContact CD2-CD1 4.38Å; Y51-L346 HydrophobicContact CD2-CD2 4.22Å; Y51-L346 HydrophobicContact CE1-CD2 4.49Å; Y51-L346 HydrophobicContact CE2-CB 4.17Å; Y51-L346 HydrophobicContact CE2-CD1 3.9Å; Y51-L346 HydrophobicContact CE2-CD2 3.89Å; Y51-L346 HydrophobicContact CE2-CG 4.21Å; Y51-E347 PolarHBondContact OH-N 3.29Å; Y51-H348 AromaticContact CE2-CE1 3.91Å; Y51-H348 AromaticContact CE2-ND1 3.59Å; Y51-H348 AromaticContact CZ-ND1 3.7Å; Y51-H348 PolarHBondContact OH-N 3.24Å; Y51-H348 PolarHBondContact OH-ND1 3.28Å
52	N	96.6	Very high	94.6	Very high	48 Å²	48	33.3 Å²	33.3	26%	0.257	18%	0.178	S	C	.	.	H	α-helix	trans	-64.5	-37.4	-178.6	-167.6	30.5	0	0	0	112.7	S48 R49 V50 H54 Q55 K56 Y157	S48-N52 VanDerWaalsContact O-CB 3.3Å; S48-N52 WeakPolarHBondContact O-CB 3.29Å; S48-N52 PolarHBondContact O-N 3.39Å; R49-N52 PolarHBondContact O-N 2.8Å; V50-N52 PolarHBondContact O-N 2.89Å; N52-H54 VanDerWaalsContact C-N 3.32Å; N52-H54 PolarHBondContact O-N 2.99Å; N52-Q55 PolarHBondContact O-N 3.28Å; N52-K56 WeakPolarHBondContact O-CB 3.12Å; N52-K56 WeakPolarHBondContact O-CG 3.26Å; N52-K56 PolarHBondContact O-N 2.99Å; N52-Y157 PolarHBondContact ND2-OH 3.36Å
53	L	96.8	Very high	95	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.2	-41	176.5	-175.2	64.4	0	0	0	111.7	R49 V50 Y51 N57 G58 F59 M62 I160 Y164 L175	R49-L53 WeakPolarHBondContact O-CB 3.48Å; R49-L53 PolarHBondContact O-N 3.15Å; V50-L53 PolarHBondContact O-N 2.62Å; Y51-L53 VanDerWaalsContact C-N 3.34Å; Y51-L53 PolarHBondContact O-N 3.12Å; L53-N57 PolarHBondContact O-N 3.37Å; L53-G58 PolarHBondContact O-N 2.72Å; L53-G58 VanDerWaalsContact O-N 3.07Å; L53-F59 HydrophobicContact CD1-CB 4.01Å; L53-M62 HydrophobicContact CD1-CE 3.78Å; L53-M62 HydrophobicContact CD1-SD 4.14Å; L53-I160 HydrophobicContact CB-CG2 4.47Å; L53-I160 HydrophobicContact CD2-CB 4.38Å; L53-I160 HydrophobicContact CD2-CG2 3.8Å; L53-Y164 HydrophobicContact CB-CE2 4.34Å; L53-Y164 HydrophobicContact CD2-CD2 3.65Å; L53-Y164 HydrophobicContact CD2-CE2 3.77Å; L53-Y164 HydrophobicContact CG-CE2 4.39Å; L53-L175 HydrophobicContact CG-CD2 4.47Å
54	H	96.7	Very high	95.3	Very high	17 Å²	17	36.5 Å²	36.5	8%	0.079	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-50.5	172.1	171	-88.9	0	0	0	111.5	V50 Y51 N52 K56 N57 C178 W180	V50-H54 PolarHBondContact O-N 3.46Å; Y51-H54 WeakPolarHBondContact O-CB 3.44Å; Y51-H54 PolarHBondContact O-N 3.35Å; N52-H54 VanDerWaalsContact C-N 3.32Å; N52-H54 PolarHBondContact O-N 2.99Å; H54-K56 PolarHBondContact O-N 3.48Å; H54-N57 PolarHBondContact O-N 2.92Å; H54-C178 PolarHBondContact NE2-O 3.49Å; H54-C178 VanDerWaalsContact NE2-O 3.11Å; H54-W180 HydrophobicContact CB-CE3 4.23Å; H54-W180 HydrophobicContact CB-CZ3 4.34Å; H54-W180 AromaticContact CG-CE3 3.98Å; H54-W180 AromaticContact ND1-CE3 3.96Å; H54-W180 PolarHBondContact NE2-N 3Å
55	Q	96.1	Very high	95.5	Very high	61 Å²	61	37.9 Å²	37.9	29%	0.285	21%	0.209	S	C	.	.	H	α-helix	trans	-63.9	-25.3	-178.8	-64.3	-53.7	-43.3	0	0	113.8	Y51 N52 N57 H348	Y51-Q55 HydrophobicContact CD1-CG 4.09Å; Y51-Q55 HydrophobicContact CD2-CG 4.25Å; Y51-Q55 HydrophobicContact CE1-CG 3.61Å; Y51-Q55 HydrophobicContact CE2-CG 3.79Å; Y51-Q55 HydrophobicContact CG-CG 4.38Å; Y51-Q55 VanDerWaalsContact CZ-CG 3.44Å; Y51-Q55 WeakPolarHBondContact O-CG 3.13Å; Y51-Q55 PolarHBondContact O-N 3.38Å; N52-Q55 PolarHBondContact O-N 3.28Å; Q55-N57 VanDerWaalsContact C-N 3.29Å; Q55-H348 PolarHBondContact NE2-ND1 3.01Å
56	K	95.5	Very high	95.6	Very high	88 Å²	88	37.9 Å²	37.9	38%	0.383	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	9.7	175	-65.6	-71.4	-173.9	168.8	0	113.3	N52 H54 G58 C61 M62	N52-K56 WeakPolarHBondContact O-CB 3.12Å; N52-K56 WeakPolarHBondContact O-CG 3.26Å; N52-K56 PolarHBondContact O-N 2.99Å; H54-K56 PolarHBondContact O-N 3.48Å; K56-G58 VanDerWaalsContact C-N 3.28Å; K56-G58 PolarHBondContact O-N 3.35Å; K56-C61 VanDerWaalsContact O-CB 3.23Å; K56-C61 WeakPolarHBondContact O-CB 3.49Å; K56-M62 HydrophobicContact CB-CB 3.76Å; K56-M62 HydrophobicContact CB-CG 4.14Å; K56-M62 HydrophobicContact CG-CB 4.29Å; K56-M62 HydrophobicContact CG-CG 4.14Å
57	N	93.9	Very high	95.8	Very high	86 Å²	86	40.8 Å²	40.8	46%	0.46	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	37.3	177.9	-58	-38.4	0	0	0	113.2	L53 H54 Q55 P176	L53-N57 PolarHBondContact O-N 3.37Å; H54-N57 PolarHBondContact O-N 2.92Å; Q55-N57 VanDerWaalsContact C-N 3.29Å; N57-P176 HydrophobicContact CB-CB 4.15Å; N57-P176 HydrophobicContact CB-CG 4.11Å
58	G	93.9	Very high	95.9	Very high	4 Å²	4	46.2 Å²	46.2	4%	0.041	25%	0.246	C	C	.	.	S	Bend	trans	105	171.4	174	0	0	0	0	0	115.5	L53 K56 M62	L53-G58 PolarHBondContact O-N 2.72Å; L53-G58 VanDerWaalsContact O-N 3.07Å; K56-G58 VanDerWaalsContact C-N 3.28Å; K56-G58 PolarHBondContact O-N 3.35Å; G58-M62 WeakPolarHBondContact O-CB 3.2Å; G58-M62 PolarHBondContact O-N 2.82Å; G58-M62 VanDerWaalsContact O-N 3.13Å
59	F	95.1	Very high	95.9	Very high	17 Å²	17	48.3 Å²	48.3	8%	0.075	25%	0.252	C	S	.	.	H	α-helix	trans	-66.6	-46.6	-169.7	179.6	-97.4	0	0	0	112.8	L53 C61 M62 L63 I154 W158 H161	L53-F59 HydrophobicContact CD1-CB 4.01Å; F59-C61 PolarHBondContact O-N 2.87Å; F59-M62 HydrophobicContact CD2-CE 4Å; F59-M62 HydrophobicContact CE2-CE 4.41Å; F59-M62 PolarHBondContact O-N 3.04Å; F59-L63 HydrophobicContact CE1-CD2 4.21Å; F59-L63 WeakPolarHBondContact O-CB 3.26Å; F59-L63 PolarHBondContact O-N 3.45Å; F59-I154 HydrophobicContact CZ-CG2 4.21Å; F59-W158 HydrophobicContact CD1-CE3 4.16Å; F59-W158 HydrophobicContact CD1-CZ3 4.12Å; F59-W158 AromaticContact CE1-CE3 3.6Å; F59-W158 HydrophobicContact CE1-CE3 3.6Å; F59-W158 AromaticContact CE1-CZ3 3.72Å; F59-W158 HydrophobicContact CE1-CZ3 3.72Å; F59-W158 HydrophobicContact CE2-CE3 4.22Å; F59-W158 AromaticContact CZ-CE3 3.63Å; F59-W158 HydrophobicContact CZ-CE3 3.63Å; F59-W158 HydrophobicContact CZ-CZ3 4.24Å; F59-H161 HydrophobicContact CB-CB 4.37Å; F59-H161 HydrophobicContact CD2-CB 4.3Å; F59-H161 HydrophobicContact CG-CB 4.42Å
60	T	95.6	Very high	95.9	Very high	92 Å²	92	47.6 Å²	47.6	56%	0.564	25%	0.25	S	S	*	.	H	α-helix	trans	-63.4	-43.8	-178.5	-51.7	0	0	0	0	111.9	L63 I64	T60-L63 PolarHBondContact O-N 3.03Å; T60-I64 HydrophobicContact CG2-CD1 3.84Å; T60-I64 HydrophobicContact CG2-CG1 4.48Å; T60-I64 WeakPolarHBondContact O-CB 3.08Å; T60-I64 VanDerWaalsContact O-CG1 3.3Å; T60-I64 WeakPolarHBondContact O-CG1 3.44Å; T60-I64 PolarHBondContact O-N 3.21Å
61	C	95.5	Very high	95.9	Very high	74 Å²	74	52.7 Å²	52.7	50%	0.5	28%	0.276	S	S	.	.	H	α-helix	trans	-61.6	-45	177.2	-64.5	0	0	0	0	111.4	K56 F59 G65	K56-C61 VanDerWaalsContact O-CB 3.23Å; K56-C61 WeakPolarHBondContact O-CB 3.49Å; F59-C61 PolarHBondContact O-N 2.87Å; C61-G65 PolarHBondContact O-N 3.26Å
62	M	95.2	Very high	95.8	Very high	9 Å²	9	56.3 Å²	56.3	4%	0.044	29%	0.293	C	S	.	.	H	α-helix	trans	-62.6	-46.2	175.5	-177.6	-179.8	70.4	0	0	112.2	L53 K56 G58 F59 G65 E66 Y157	L53-M62 HydrophobicContact CD1-CE 3.78Å; L53-M62 HydrophobicContact CD1-SD 4.14Å; K56-M62 HydrophobicContact CB-CB 3.76Å; K56-M62 HydrophobicContact CB-CG 4.14Å; K56-M62 HydrophobicContact CG-CB 4.29Å; K56-M62 HydrophobicContact CG-CG 4.14Å; G58-M62 WeakPolarHBondContact O-CB 3.2Å; G58-M62 PolarHBondContact O-N 2.82Å; G58-M62 VanDerWaalsContact O-N 3.13Å; F59-M62 HydrophobicContact CD2-CE 4Å; F59-M62 HydrophobicContact CE2-CE 4.41Å; F59-M62 PolarHBondContact O-N 3.04Å; M62-G65 PolarHBondContact O-N 3.4Å; M62-E66 WeakPolarHBondContact O-CG 3.44Å; M62-E66 PolarHBondContact O-N 3.27Å; M62-Y157 VanDerWaalsContact CE-CB 3.46Å; M62-Y157 HydrophobicContact CE-CD1 3.43Å; M62-Y157 VanDerWaalsContact CE-CD1 3.43Å; M62-Y157 HydrophobicContact CE-CD2 3.55Å; M62-Y157 HydrophobicContact CE-CE1 3.96Å; M62-Y157 HydrophobicContact CE-CE2 4.1Å; M62-Y157 HydrophobicContact CE-CG 3.2Å; M62-Y157 HydrophobicContact SD-CD1 3.84Å; M62-Y157 HydrophobicContact SD-CD2 4.09Å; M62-Y157 HydrophobicContact SD-CE1 3.72Å; M62-Y157 HydrophobicContact SD-CE2 4.02Å; M62-Y157 HydrophobicContact SD-CG 4.04Å
63	L	95.8	Very high	95.8	Very high	46 Å²	46	54.9 Å²	54.9	24%	0.241	29%	0.285	C	S	.	.	H	α-helix	trans	-58.4	-50.6	178.3	175.8	65.3	0	0	0	111.3	F59 T60 G65 E66 I67 F150 I154	F59-L63 HydrophobicContact CE1-CD2 4.21Å; F59-L63 WeakPolarHBondContact O-CB 3.26Å; F59-L63 PolarHBondContact O-N 3.45Å; T60-L63 PolarHBondContact O-N 3.03Å; L63-G65 VanDerWaalsContact C-N 3.31Å; L63-G65 PolarHBondContact O-N 3.42Å; L63-E66 PolarHBondContact O-N 3.19Å; L63-I67 HydrophobicContact CD1-CD1 4.13Å; L63-I67 HydrophobicContact CG-CD1 3.98Å; L63-I67 VanDerWaalsContact O-CG1 3.27Å; L63-I67 WeakPolarHBondContact O-CG1 3.15Å; L63-I67 PolarHBondContact O-N 2.95Å; L63-F150 HydrophobicContact CD1-CE2 3.92Å; L63-F150 HydrophobicContact CD1-CZ 3.66Å; L63-I154 HydrophobicContact CD1-CD1 3.59Å; L63-I154 HydrophobicContact CD1-CG1 3.78Å
64	I	96.9	Very high	95.8	Very high	80 Å²	80	59.2 Å²	59.2	41%	0.41	31%	0.307	S	S	.	.	H	α-helix	trans	-62.2	-41.5	178.6	-69.4	171.2	0	0	0	110.6	T60 I67 F68	T60-I64 HydrophobicContact CG2-CD1 3.84Å; T60-I64 HydrophobicContact CG2-CG1 4.48Å; T60-I64 WeakPolarHBondContact O-CB 3.08Å; T60-I64 VanDerWaalsContact O-CG1 3.3Å; T60-I64 WeakPolarHBondContact O-CG1 3.44Å; T60-I64 PolarHBondContact O-N 3.21Å; I64-I67 PolarHBondContact O-N 2.86Å; I64-F68 HydrophobicContact CG2-CD2 3.55Å; I64-F68 HydrophobicContact CG2-CE2 3.37Å; I64-F68 VanDerWaalsContact O-CD2 3.23Å; I64-F68 WeakPolarHBondContact O-CD2 3.32Å; I64-F68 PolarHBondContact O-N 3Å
65	G	95.8	Very high	95.9	Very high	30 Å²	30	64.1 Å²	64.1	31%	0.309	33%	0.329	S	S	.	.	H	α-helix	trans	-57.1	-52.1	176.4	0	0	0	0	0	112.4	C61 M62 L63 I67 F68 E69	C61-G65 PolarHBondContact O-N 3.26Å; M62-G65 PolarHBondContact O-N 3.4Å; L63-G65 VanDerWaalsContact C-N 3.31Å; L63-G65 PolarHBondContact O-N 3.42Å; G65-I67 VanDerWaalsContact C-N 3.35Å; G65-I67 PolarHBondContact O-N 2.86Å; G65-F68 PolarHBondContact O-N 2.99Å; G65-E69 WeakPolarHBondContact O-CG 3.35Å; G65-E69 PolarHBondContact O-N 3.47Å
66	E	95	Very high	95.9	Very high	53 Å²	53	61.6 Å²	61.6	25%	0.248	32%	0.318	C	S	.	.	H	α-helix	trans	-63.9	-37.1	178.7	-67.1	-75.2	168.3	0	0	112.3	M62 L63 E69 L70 F150	M62-E66 WeakPolarHBondContact O-CG 3.44Å; M62-E66 PolarHBondContact O-N 3.27Å; L63-E66 PolarHBondContact O-N 3.19Å; E66-E69 PolarHBondContact O-N 3.48Å; E66-L70 PolarHBondContact O-N 2.9Å; E66-F150 HydrophobicContact CB-CD2 3.71Å; E66-F150 HydrophobicContact CB-CE2 3.55Å
67	I	96.9	Very high	96	Very high	68 Å²	68	58.9 Å²	58.9	35%	0.349	31%	0.308	S	S	.	.	H	α-helix	trans	-59.7	-47.5	172.7	-70.6	168.3	0	0	0	110.4	L63 I64 G65 E69 L70 M71 F150	L63-I67 HydrophobicContact CD1-CD1 4.13Å; L63-I67 HydrophobicContact CG-CD1 3.98Å; L63-I67 VanDerWaalsContact O-CG1 3.27Å; L63-I67 WeakPolarHBondContact O-CG1 3.15Å; L63-I67 PolarHBondContact O-N 2.95Å; I64-I67 PolarHBondContact O-N 2.86Å; G65-I67 VanDerWaalsContact C-N 3.35Å; G65-I67 PolarHBondContact O-N 2.86Å; I67-E69 VanDerWaalsContact C-N 3.31Å; I67-E69 PolarHBondContact O-N 2.92Å; I67-L70 PolarHBondContact O-N 3.17Å; I67-M71 HydrophobicContact CG2-CG 4.32Å; I67-M71 HydrophobicContact CG2-SD 3.9Å; I67-M71 WeakPolarHBondContact O-CG 3.3Å; I67-M71 PolarHBondContact O-N 3.42Å; I67-F150 HydrophobicContact CD1-CZ 4.31Å; I67-F150 HydrophobicContact CG1-CE1 4.32Å; I67-F150 HydrophobicContact CG1-CE2 4.28Å; I67-F150 HydrophobicContact CG1-CZ 3.55Å
68	F	97.4	Very high	96.1	Very high	115 Å²	115	57.4 Å²	57.4	50%	0.504	31%	0.308	S	S	.	.	H	α-helix	trans	-62.5	-38	178	-84	-60.5	0	0	0	112.1	I64 G65 L70 M71 Q72	I64-F68 HydrophobicContact CG2-CD2 3.55Å; I64-F68 HydrophobicContact CG2-CE2 3.37Å; I64-F68 VanDerWaalsContact O-CD2 3.23Å; I64-F68 WeakPolarHBondContact O-CD2 3.32Å; I64-F68 PolarHBondContact O-N 3Å; G65-F68 PolarHBondContact O-N 2.99Å; F68-L70 VanDerWaalsContact C-N 3.33Å; F68-L70 PolarHBondContact O-N 3.23Å; F68-M71 HydrophobicContact CD1-SD 4.48Å; F68-M71 PolarHBondContact O-N 2.96Å; F68-Q72 WeakPolarHBondContact O-CB 3.26Å; F68-Q72 VanDerWaalsContact O-CG 3.23Å; F68-Q72 WeakPolarHBondContact O-CG 3.36Å; F68-Q72 PolarHBondContact O-N 3.24Å
69	E	94.8	Very high	96.2	Very high	77 Å²	77	60.8 Å²	60.8	36%	0.36	32%	0.322	S	S	.	.	H	α-helix	trans	-68.2	-31.6	176.8	-62	-175.1	-177.1	0	0	113.2	G65 E66 I67 F73 R146	G65-E69 WeakPolarHBondContact O-CG 3.35Å; G65-E69 PolarHBondContact O-N 3.47Å; E66-E69 PolarHBondContact O-N 3.48Å; I67-E69 VanDerWaalsContact C-N 3.31Å; I67-E69 PolarHBondContact O-N 2.92Å; E69-F73 PolarHBondContact O-N 3.04Å; E69-R146 PolarHBondContact O-NH1 2.96Å; E69-R146 IonicContact OE2-NH2 2.73Å; E69-R146 PolarHBondContact OE2-NH2 3.03Å
70	L	96.6	Very high	96.3	Very high	12 Å²	12	61.1 Å²	61.1	6%	0.063	33%	0.325	C	S	.	.	H	α-helix	trans	-69.1	-42.3	171.1	-72.4	176.3	0	0	0	111.7	E66 I67 F68 F73 L74 W143 R146 L147 F150	E66-L70 PolarHBondContact O-N 2.9Å; I67-L70 PolarHBondContact O-N 3.17Å; F68-L70 VanDerWaalsContact C-N 3.33Å; F68-L70 PolarHBondContact O-N 3.23Å; L70-F73 PolarHBondContact O-N 3.22Å; L70-L74 PolarHBondContact O-N 3.44Å; L70-W143 PolarHBondContact O-NE1 3.3Å; L70-R146 HydrophobicContact CD2-CB 4.1Å; L70-R146 HydrophobicContact CD2-CG 3.67Å; L70-L147 HydrophobicContact CD1-CD1 4.14Å; L70-F150 HydrophobicContact CD1-CB 4Å; L70-F150 HydrophobicContact CD1-CD1 3.68Å; L70-F150 HydrophobicContact CD1-CD2 4.34Å; L70-F150 HydrophobicContact CD1-CE1 4.15Å; L70-F150 HydrophobicContact CD1-CG 3.75Å
71	M	96.9	Very high	96.3	Very high	108 Å²	108	57.6 Å²	57.6	53%	0.532	30%	0.304	S	S	.	.	H	α-helix	trans	-65.3	-39.9	176.5	-72.5	179.3	66.9	0	0	111.9	I67 F68 F73 L74 F75	I67-M71 HydrophobicContact CG2-CG 4.32Å; I67-M71 HydrophobicContact CG2-SD 3.9Å; I67-M71 WeakPolarHBondContact O-CG 3.3Å; I67-M71 PolarHBondContact O-N 3.42Å; F68-M71 HydrophobicContact CD1-SD 4.48Å; F68-M71 PolarHBondContact O-N 2.96Å; M71-F73 PolarHBondContact O-N 3.01Å; M71-L74 PolarHBondContact O-N 3.29Å; M71-F75 VanDerWaalsContact O-CB 3.24Å; M71-F75 WeakPolarHBondContact O-CB 3.34Å; M71-F75 PolarHBondContact O-N 3.12Å
72	Q	95.7	Very high	96.4	Very high	97 Å²	97	57.1 Å²	57.1	45%	0.453	29%	0.293	S	S	.	.	H	α-helix	trans	-59.9	-44.8	177	-79.5	175.6	13	0	0	111.5	F68 F75 V76	F68-Q72 WeakPolarHBondContact O-CB 3.26Å; F68-Q72 VanDerWaalsContact O-CG 3.23Å; F68-Q72 WeakPolarHBondContact O-CG 3.36Å; F68-Q72 PolarHBondContact O-N 3.24Å; Q72-F75 PolarHBondContact O-N 3.4Å; Q72-V76 VanDerWaalsContact O-CG2 3.31Å; Q72-V76 WeakPolarHBondContact O-CG2 3.45Å; Q72-V76 PolarHBondContact O-N 2.97Å
73	F	96.1	Very high	96.4	Very high	18 Å²	18	59.2 Å²	59.2	8%	0.079	30%	0.304	C	S	.	.	H	α-helix	trans	-60.5	-49.4	175.8	-178.1	-85.1	0	0	0	111.5	E69 L70 M71 F75 V76 V77 A139 F142 W143 W307	E69-F73 PolarHBondContact O-N 3.04Å; L70-F73 PolarHBondContact O-N 3.22Å; M71-F73 PolarHBondContact O-N 3.01Å; F73-F75 VanDerWaalsContact C-N 3.33Å; F73-F75 PolarHBondContact O-N 3.21Å; F73-V76 PolarHBondContact O-N 2.99Å; F73-V77 HydrophobicContact CD1-CG2 4.27Å; F73-V77 HydrophobicContact CE1-CG2 3.88Å; F73-V77 HydrophobicContact CZ-CG2 4.06Å; F73-V77 WeakPolarHBondContact O-CG2 3.39Å; F73-V77 PolarHBondContact O-N 2.94Å; F73-V77 VanDerWaalsContact O-N 3.12Å; F73-A139 HydrophobicContact CE1-CB 4.46Å; F73-A139 HydrophobicContact CZ-CB 4.27Å; F73-F142 HydrophobicContact CD2-CE1 4.32Å; F73-F142 HydrophobicContact CE1-CD1 4.39Å; F73-F142 AromaticContact CE2-CD1 3.8Å; F73-F142 HydrophobicContact CE2-CD1 3.8Å; F73-F142 AromaticContact CE2-CE1 3.82Å; F73-F142 HydrophobicContact CE2-CE1 3.82Å; F73-F142 AromaticContact CZ-CD1 3.68Å; F73-F142 HydrophobicContact CZ-CD1 3.68Å; F73-F142 HydrophobicContact CZ-CE1 4.19Å; F73-W143 HydrophobicContact CD1-CB 4.2Å; F73-W143 AromaticContact CD1-CD1 3.56Å; F73-W143 HydrophobicContact CD1-CG 4.23Å; F73-W143 HydrophobicContact CE1-CB 3.95Å; F73-W143 HydrophobicContact CE1-CG 4.44Å; F73-W307 HydrophobicContact CB-CH2 4.32Å; F73-W307 HydrophobicContact CD2-CE3 4.06Å; F73-W307 AromaticContact CD2-CH2 3.57Å; F73-W307 HydrophobicContact CD2-CH2 3.57Å; F73-W307 HydrophobicContact CD2-CZ2 4.17Å; F73-W307 AromaticContact CD2-CZ3 3.49Å; F73-W307 HydrophobicContact CD2-CZ3 3.49Å; F73-W307 VanDerWaalsContact CD2-CZ3 3.49Å; F73-W307 HydrophobicContact CE2-CD2 4.48Å; F73-W307 AromaticContact CE2-CE3 3.96Å; F73-W307 HydrophobicContact CE2-CE3 3.96Å; F73-W307 HydrophobicContact CE2-CH2 4.29Å; F73-W307 AromaticContact CE2-CZ3 3.85Å; F73-W307 HydrophobicContact CE2-CZ3 3.85Å; F73-W307 HydrophobicContact CG-CH2 4.3Å; F73-W307 HydrophobicContact CG-CZ3 4.25Å
74	L	96.9	Very high	96.3	Very high	91 Å²	91	61.4 Å²	61.4	48%	0.476	32%	0.319	S	S	.	.	H	α-helix	trans	-60.9	-43.8	179.6	-178.7	63.1	0	0	0	111.6	L70 M71 V77 A78	L70-L74 PolarHBondContact O-N 3.44Å; M71-L74 PolarHBondContact O-N 3.29Å; L74-V77 PolarHBondContact O-N 3.12Å; L74-A78 WeakPolarHBondContact O-CB 3.42Å; L74-A78 PolarHBondContact O-N 3.26Å
75	F	97.6	Very high	96.2	Very high	120 Å²	120	57.8 Å²	57.8	53%	0.526	30%	0.301	S	S	.	.	H	α-helix	trans	-60.5	-49.6	178.1	174.1	-100.6	0	0	0	111.5	M71 Q72 F73 V77 A78 F79	M71-F75 VanDerWaalsContact O-CB 3.24Å; M71-F75 WeakPolarHBondContact O-CB 3.34Å; M71-F75 PolarHBondContact O-N 3.12Å; Q72-F75 PolarHBondContact O-N 3.4Å; F73-F75 VanDerWaalsContact C-N 3.33Å; F73-F75 PolarHBondContact O-N 3.21Å; F75-V77 VanDerWaalsContact C-N 3.34Å; F75-V77 PolarHBondContact O-N 3.48Å; F75-A78 PolarHBondContact O-N 3.33Å; F75-F79 HydrophobicContact CE1-CD1 4.49Å; F75-F79 HydrophobicContact CE2-CB 4.22Å; F75-F79 HydrophobicContact CE2-CG 4.36Å; F75-F79 HydrophobicContact CZ-CB 4.24Å; F75-F79 HydrophobicContact CZ-CD1 4.19Å; F75-F79 HydrophobicContact CZ-CG 4.12Å; F75-F79 WeakPolarHBondContact O-CB 3.48Å; F75-F79 PolarHBondContact O-N 3.2Å
76	V	96.9	Very high	96.2	Very high	9 Å²	9	57.2 Å²	57.2	6%	0.055	29%	0.292	C	S	.	.	H	α-helix	trans	-59	-46.2	179.7	168.6	0	0	0	0	111.1	Q72 F73 T80 W307 L310 F314	Q72-V76 VanDerWaalsContact O-CG2 3.31Å; Q72-V76 WeakPolarHBondContact O-CG2 3.45Å; Q72-V76 PolarHBondContact O-N 2.97Å; F73-V76 PolarHBondContact O-N 2.99Å; V76-T80 VanDerWaalsContact O-CB 3.25Å; V76-T80 WeakPolarHBondContact O-CB 3.42Å; V76-T80 PolarHBondContact O-N 3.33Å; V76-T80 VanDerWaalsContact O-N 3.07Å; V76-T80 PolarHBondContact O-OG1 3.49Å; V76-W307 HydrophobicContact CB-CH2 4.46Å; V76-W307 HydrophobicContact CB-CZ3 3.99Å; V76-W307 HydrophobicContact CG1-CE3 4.31Å; V76-W307 HydrophobicContact CG1-CH2 4.49Å; V76-W307 HydrophobicContact CG1-CZ3 3.75Å; V76-L310 HydrophobicContact CG1-CB 4.09Å; V76-F314 HydrophobicContact CB-CD2 4.46Å; V76-F314 HydrophobicContact CG1-CD2 3.95Å; V76-F314 HydrophobicContact CG1-CE2 4.02Å; V76-F314 HydrophobicContact CG2-CD2 4.03Å
77	V	96.6	Very high	96.2	Very high	31 Å²	31	55.4 Å²	55.4	19%	0.188	29%	0.285	C	S	.	.	H	α-helix	trans	-67	-49	-180	175.3	0	0	0	0	111.3	F73 L74 F75 T81 L136 A139	F73-V77 HydrophobicContact CD1-CG2 4.27Å; F73-V77 HydrophobicContact CE1-CG2 3.88Å; F73-V77 HydrophobicContact CZ-CG2 4.06Å; F73-V77 WeakPolarHBondContact O-CG2 3.39Å; F73-V77 PolarHBondContact O-N 2.94Å; F73-V77 VanDerWaalsContact O-N 3.12Å; L74-V77 PolarHBondContact O-N 3.12Å; F75-V77 VanDerWaalsContact C-N 3.34Å; F75-V77 PolarHBondContact O-N 3.48Å; V77-T81 WeakPolarHBondContact O-CB 3.41Å; V77-T81 PolarHBondContact O-N 3.09Å; V77-T81 PolarHBondContact O-OG1 3.32Å; V77-L136 HydrophobicContact CG1-CD2 3.72Å; V77-A139 HydrophobicContact CG1-CB 4.42Å
78	A	96.4	Very high	95.9	Very high	54 Å²	54	53.7 Å²	53.7	45%	0.446	28%	0.276	S	S	.	.	H	α-helix	trans	-66.1	-45	-177.8	0	0	0	0	0	112.1	L74 F75 T81 F82	L74-A78 WeakPolarHBondContact O-CB 3.42Å; L74-A78 PolarHBondContact O-N 3.26Å; F75-A78 PolarHBondContact O-N 3.33Å; A78-T81 PolarHBondContact O-N 3.3Å; A78-F82 WeakPolarHBondContact O-CB 3.23Å; A78-F82 PolarHBondContact O-N 2.67Å
79	F	97.3	Very high	95.7	Very high	75 Å²	75	52.6 Å²	52.6	33%	0.329	27%	0.269	S	S	.	.	H	α-helix	trans	-66.5	-41.4	-179.9	-173.4	-121.3	0	0	0	111.8	F75 T81 F82 L83 F314	F75-F79 HydrophobicContact CE1-CD1 4.49Å; F75-F79 HydrophobicContact CE2-CB 4.22Å; F75-F79 HydrophobicContact CE2-CG 4.36Å; F75-F79 HydrophobicContact CZ-CB 4.24Å; F75-F79 HydrophobicContact CZ-CD1 4.19Å; F75-F79 HydrophobicContact CZ-CG 4.12Å; F75-F79 WeakPolarHBondContact O-CB 3.48Å; F75-F79 PolarHBondContact O-N 3.2Å; F79-T81 PolarHBondContact O-N 3.15Å; F79-F82 HydrophobicContact CD2-CD1 4.45Å; F79-F82 HydrophobicContact CE2-CD1 4.5Å; F79-F82 WeakPolarHBondContact O-CB 3.38Å; F79-F82 PolarHBondContact O-N 3.17Å; F79-L83 HydrophobicContact CD1-CD1 4.02Å; F79-L83 HydrophobicContact CE1-CD1 3.61Å; F79-L83 HydrophobicContact CE1-CG 4.27Å; F79-L83 HydrophobicContact CE2-CD1 4.45Å; F79-L83 HydrophobicContact CE2-CD2 4.26Å; F79-L83 HydrophobicContact CE2-CG 4.25Å; F79-L83 HydrophobicContact CZ-CD1 3.85Å; F79-L83 HydrophobicContact CZ-CD2 4.12Å; F79-L83 HydrophobicContact CZ-CG 4.1Å; F79-L83 WeakPolarHBondContact O-CG 3.26Å; F79-L83 PolarHBondContact O-N 3.38Å; F79-F314 AromaticContact CD1-CE1 3.7Å; F79-F314 HydrophobicContact CD1-CE1 3.7Å; F79-F314 AromaticContact CD1-CZ 3.76Å; F79-F314 HydrophobicContact CD1-CZ 3.76Å; F79-F314 AromaticContact CE1-CE1 3.79Å; F79-F314 HydrophobicContact CE1-CE1 3.79Å; F79-F314 HydrophobicContact CE1-CZ 4.24Å
80	T	96.8	Very high	95.4	Very high	25 Å²	25	53.1 Å²	53.1	15%	0.153	28%	0.275	C	S	.	.	H	α-helix	trans	-62.4	-44.1	174.2	-54.9	0	0	0	0	111.2	V76 F82 L83 V84 L310 F314	V76-T80 VanDerWaalsContact O-CB 3.25Å; V76-T80 WeakPolarHBondContact O-CB 3.42Å; V76-T80 PolarHBondContact O-N 3.33Å; V76-T80 VanDerWaalsContact O-N 3.07Å; V76-T80 PolarHBondContact O-OG1 3.49Å; T80-F82 VanDerWaalsContact C-N 3.31Å; T80-F82 PolarHBondContact O-N 2.73Å; T80-L83 PolarHBondContact O-N 2.55Å; T80-V84 HydrophobicContact CG2-CG2 4.42Å; T80-V84 VanDerWaalsContact O-CG2 3.3Å; T80-V84 WeakPolarHBondContact O-CG2 3.49Å; T80-V84 PolarHBondContact O-N 3.43Å; T80-L310 HydrophobicContact CG2-CD1 3.93Å; T80-L310 HydrophobicContact CG2-CD2 3.65Å; T80-L310 HydrophobicContact CG2-CG 4.46Å; T80-F314 WeakPolarHBondContact OG1-CE2 3.26Å
81	T	95.9	Very high	94.9	Very high	18 Å²	18	53.6 Å²	53.6	11%	0.11	28%	0.277	C	S	.	.	H	α-helix	trans	-61.5	-41.8	177.8	-57	0	0	0	0	111.5	V77 A78 F79 V84 S85 I126 L132 L136	V77-T81 WeakPolarHBondContact O-CB 3.41Å; V77-T81 PolarHBondContact O-N 3.09Å; V77-T81 PolarHBondContact O-OG1 3.32Å; A78-T81 PolarHBondContact O-N 3.3Å; F79-T81 PolarHBondContact O-N 3.15Å; T81-V84 PolarHBondContact O-N 3.44Å; T81-S85 WeakPolarHBondContact O-CB 3.47Å; T81-S85 PolarHBondContact O-N 2.85Å; T81-S85 PolarHBondContact O-OG 2.87Å; T81-I126 HydrophobicContact CG2-CD1 4.04Å; T81-I126 HydrophobicContact CG2-CG1 4.38Å; T81-L132 HydrophobicContact CG2-CD2 4.27Å; T81-L136 HydrophobicContact CG2-CD1 3.98Å; T81-L136 HydrophobicContact CG2-CD2 4.4Å; T81-L136 WeakPolarHBondContact OG1-CD2 3.42Å
82	F	95.9	Very high	94.5	Very high	64 Å²	64	51.8 Å²	51.8	28%	0.281	27%	0.269	S	S	.	.	H	α-helix	trans	-60.8	-48.5	174.5	173.3	-95.6	0	0	0	111.8	A78 F79 T80 V84 S85 C86 V87 F116	A78-F82 WeakPolarHBondContact O-CB 3.23Å; A78-F82 PolarHBondContact O-N 2.67Å; F79-F82 HydrophobicContact CD2-CD1 4.45Å; F79-F82 HydrophobicContact CE2-CD1 4.5Å; F79-F82 WeakPolarHBondContact O-CB 3.38Å; F79-F82 PolarHBondContact O-N 3.17Å; T80-F82 VanDerWaalsContact C-N 3.31Å; T80-F82 PolarHBondContact O-N 2.73Å; F82-V84 VanDerWaalsContact C-N 3.3Å; F82-V84 PolarHBondContact O-N 3.29Å; F82-S85 PolarHBondContact O-N 3.23Å; F82-C86 HydrophobicContact CD2-CB 3.43Å; F82-C86 VanDerWaalsContact CD2-CB 3.43Å; F82-C86 HydrophobicContact CE2-CB 3.56Å; F82-C86 HydrophobicContact CG-CB 4.2Å; F82-C86 HydrophobicContact CZ-CB 4.42Å; F82-C86 WeakPolarHBondContact O-CA 3.45Å; F82-C86 WeakPolarHBondContact O-CB 3.48Å; F82-C86 PolarHBondContact O-N 3.27Å; F82-V87 HydrophobicContact CD1-CG2 4.17Å; F82-V87 HydrophobicContact CE1-CG2 3.68Å; F82-V87 HydrophobicContact CZ-CG2 4.09Å; F82-F116 HydrophobicContact CE1-CD1 4.41Å; F82-F116 HydrophobicContact CE1-CE1 4.08Å; F82-F116 HydrophobicContact CE1-CZ 4.42Å; F82-F116 AromaticContact CZ-CD1 3.74Å; F82-F116 HydrophobicContact CZ-CD1 3.74Å; F82-F116 HydrophobicContact CZ-CD2 4.33Å; F82-F116 AromaticContact CZ-CE1 3.79Å; F82-F116 HydrophobicContact CZ-CE1 3.79Å; F82-F116 HydrophobicContact CZ-CE2 4.37Å; F82-F116 HydrophobicContact CZ-CG 4.04Å; F82-F116 HydrophobicContact CZ-CZ 4.11Å
83	L	95.6	Very high	94.1	Very high	53 Å²	53	53.4 Å²	53.4	28%	0.277	28%	0.275	S	S	.	.	H	α-helix	trans	-63.4	-33.7	178.3	-70.3	178.6	0	0	0	113	F79 T80 V87 Y89	F79-L83 HydrophobicContact CD1-CD1 4.02Å; F79-L83 HydrophobicContact CE1-CD1 3.61Å; F79-L83 HydrophobicContact CE1-CG 4.27Å; F79-L83 HydrophobicContact CE2-CD1 4.45Å; F79-L83 HydrophobicContact CE2-CD2 4.26Å; F79-L83 HydrophobicContact CE2-CG 4.25Å; F79-L83 HydrophobicContact CZ-CD1 3.85Å; F79-L83 HydrophobicContact CZ-CD2 4.12Å; F79-L83 HydrophobicContact CZ-CG 4.1Å; F79-L83 WeakPolarHBondContact O-CG 3.26Å; F79-L83 PolarHBondContact O-N 3.38Å; T80-L83 PolarHBondContact O-N 2.55Å; L83-V87 HydrophobicContact CD2-CG2 4.27Å; L83-Y89 WeakPolarHBondContact O-CE2 3.46Å; L83-Y89 PolarHBondContact O-OH 2.95Å
84	V	94.7	Very high	93.4	Very high	91 Å²	91	56.1 Å²	56.1	55%	0.552	30%	0.3	S	S	*	.	H	α-helix	trans	-77	-35.5	179.4	171.1	0	0	0	0	112.1	T80 T81 F82	T80-V84 HydrophobicContact CG2-CG2 4.42Å; T80-V84 VanDerWaalsContact O-CG2 3.3Å; T80-V84 WeakPolarHBondContact O-CG2 3.49Å; T80-V84 PolarHBondContact O-N 3.43Å; T81-V84 PolarHBondContact O-N 3.44Å; F82-V84 VanDerWaalsContact C-N 3.3Å; F82-V84 PolarHBondContact O-N 3.29Å
85	S	94.3	Very high	92.5	Very high	5 Å²	5	57.6 Å²	57.6	4%	0.035	31%	0.309	C	S	.	.	H	α-helix	trans	-117.6	-28.8	-166.3	-50	0	0	0	0	115.4	T81 F82 R125 I126 L132	T81-S85 WeakPolarHBondContact O-CB 3.47Å; T81-S85 PolarHBondContact O-N 2.85Å; T81-S85 PolarHBondContact O-OG 2.87Å; F82-S85 PolarHBondContact O-N 3.23Å; S85-R125 WeakPolarHBondContact O-CD 3.29Å; S85-I126 VanDerWaalsContact CB-CG1 3.5Å; S85-L132 WeakPolarHBondContact OG-CD2 3.5Å
86	C	94.9	Very high	91.3	Very high	17 Å²	17	57.8 Å²	57.8	12%	0.115	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-8.8	-172.7	-58.9	0	0	0	0	114.3	F82 L117 C122	F82-C86 HydrophobicContact CD2-CB 3.43Å; F82-C86 VanDerWaalsContact CD2-CB 3.43Å; F82-C86 HydrophobicContact CE2-CB 3.56Å; F82-C86 HydrophobicContact CG-CB 4.2Å; F82-C86 HydrophobicContact CZ-CB 4.42Å; F82-C86 WeakPolarHBondContact O-CA 3.45Å; F82-C86 WeakPolarHBondContact O-CB 3.48Å; F82-C86 PolarHBondContact O-N 3.27Å; C86-L117 PolarHBondContact O-N 3.47Å; C86-C122 WeakPolarHBondContact CA-SG 3.36Å; C86-C122 HydrophobicContact CB-CB 3.92Å; C86-C122 WeakPolarHBondContact CB-SG 3.36Å; C86-C122 WeakPolarHBondContact SG-CB 3.47Å; C86-C122 CovalentContact SG-SG 2.03Å; C86-C122 PolarHBondContact SG-SG 2.89Å
87	V	94.8	Very high	89.7	Confident	16 Å²	16	65.4 Å²	65.4	10%	0.097	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-101.8	122.9	-178.6	-177.4	0	0	0	0	109.9	F82 L83 Y89 L92 F116	F82-V87 HydrophobicContact CD1-CG2 4.17Å; F82-V87 HydrophobicContact CE1-CG2 3.68Å; F82-V87 HydrophobicContact CZ-CG2 4.09Å; L83-V87 HydrophobicContact CD2-CG2 4.27Å; V87-Y89 HydrophobicContact CB-CE2 4.2Å; V87-Y89 HydrophobicContact CG1-CD1 4.21Å; V87-Y89 HydrophobicContact CG1-CE1 3.98Å; V87-Y89 HydrophobicContact CG1-CE2 4.33Å; V87-Y89 HydrophobicContact CG1-CG 4.49Å; V87-Y89 PolarHBondContact O-N 3.4Å; V87-L92 HydrophobicContact CG1-CD2 4.35Å; V87-F116 HydrophobicContact CG2-CD1 4.22Å; V87-F116 HydrophobicContact CG2-CE1 4.23Å
88	D	92.2	Very high	88.1	Confident	32 Å²	32	66.4 Å²	66.4	17%	0.171	35%	0.353	C	S	.	.			trans	-87.1	99.1	170.3	-169.5	-18.3	0	0	0	109.8	D90 I91 L92 A115 L117	D88-D90 PolarHBondContact O-N 3.49Å; D88-D90 WeakPolarHBondContact OD1-CB 3.43Å; D88-D90 PolarHBondContact OD1-N 2.9Å; D88-I91 HydrophobicContact CB-CD1 4.2Å; D88-I91 HydrophobicContact CB-CG1 4.44Å; D88-I91 PolarHBondContact O-N 3.21Å; D88-I91 WeakPolarHBondContact OD2-CD1 3.46Å; D88-L92 PolarHBondContact O-N 3.47Å; D88-A115 PolarHBondContact N-O 3.37Å; D88-L117 HydrophobicContact CB-CD2 4.22Å
89	Y	91.7	Very high	86.2	Confident	91 Å²	91	70.8 Å²	70.8	36%	0.357	37%	0.369	S	S	.	.	H	α-helix	trans	-68.9	-20.7	-179.9	-66.2	-78.1	0	0	0	113.2	L83 V87 L92 F93	L83-Y89 WeakPolarHBondContact O-CE2 3.46Å; L83-Y89 PolarHBondContact O-OH 2.95Å; V87-Y89 HydrophobicContact CB-CE2 4.2Å; V87-Y89 HydrophobicContact CG1-CD1 4.21Å; V87-Y89 HydrophobicContact CG1-CE1 3.98Å; V87-Y89 HydrophobicContact CG1-CE2 4.33Å; V87-Y89 HydrophobicContact CG1-CG 4.49Å; V87-Y89 PolarHBondContact O-N 3.4Å; Y89-L92 HydrophobicContact CD1-CD2 4.25Å; Y89-L92 PolarHBondContact O-N 2.91Å; Y89-F93 AromaticContact CD1-CE2 3.93Å; Y89-F93 HydrophobicContact CD1-CE2 3.93Å; Y89-F93 AromaticContact CD1-CZ 3.9Å; Y89-F93 HydrophobicContact CD1-CZ 3.9Å; Y89-F93 HydrophobicContact CG-CE2 4.24Å; Y89-F93 WeakPolarHBondContact O-CB 3.33Å; Y89-F93 VanDerWaalsContact O-CD2 3.22Å; Y89-F93 WeakPolarHBondContact O-CD2 3.36Å; Y89-F93 WeakPolarHBondContact O-CG 3.33Å; Y89-F93 PolarHBondContact O-N 3.39Å
90	D	89.1	Confident	84.2	Confident	89 Å²	89	72.4 Å²	72.4	48%	0.476	38%	0.377	S	S	.	.	H	α-helix	trans	-71.7	-36	179.1	-68.4	-37.5	0	0	0	111.5	D88 A94 N95 K96	D88-D90 PolarHBondContact O-N 3.49Å; D88-D90 WeakPolarHBondContact OD1-CB 3.43Å; D88-D90 PolarHBondContact OD1-N 2.9Å; D90-A94 PolarHBondContact O-N 3.46Å; D90-N95 HydrophobicContact CB-CB 4.41Å; D90-N95 WeakPolarHBondContact O-CB 3.45Å; D90-N95 PolarHBondContact O-N 3.24Å; D90-K96 HydrophobicContact CB-CB 4.37Å; D90-K96 PolarHBondContact O-N 3.29Å; D90-K96 VanDerWaalsContact O-N 3.1Å
91	I	87.1	Confident	82.2	Confident	22 Å²	22	76.1 Å²	76.1	11%	0.113	40%	0.404	C	S	.	.	H	α-helix	trans	-73.2	-44	172.7	-61.6	173.5	0	0	0	109.9	D88 F93 A94 K96 V98 V110	D88-I91 HydrophobicContact CB-CD1 4.2Å; D88-I91 HydrophobicContact CB-CG1 4.44Å; D88-I91 PolarHBondContact O-N 3.21Å; D88-I91 WeakPolarHBondContact OD2-CD1 3.46Å; I91-F93 PolarHBondContact O-N 2.9Å; I91-A94 PolarHBondContact O-N 3.33Å; I91-A94 VanDerWaalsContact O-N 3.09Å; I91-K96 HydrophobicContact CG1-CB 4.47Å; I91-K96 HydrophobicContact CG1-CD 4.38Å; I91-V98 HydrophobicContact CG2-CG2 3.54Å; I91-V110 HydrophobicContact CG2-CG1 4.03Å
92	L	88.3	Confident	80.1	Confident	70 Å²	70	82.5 Å²	82.5	37%	0.366	44%	0.437	S	S	.	.	H	α-helix	trans	-63.9	-38.2	-177.7	-172.4	65.1	0	0	0	112.9	V87 D88 Y89 A94 L112 A115	V87-L92 HydrophobicContact CG1-CD2 4.35Å; D88-L92 PolarHBondContact O-N 3.47Å; Y89-L92 HydrophobicContact CD1-CD2 4.25Å; Y89-L92 PolarHBondContact O-N 2.91Å; L92-A94 VanDerWaalsContact C-N 3.27Å; L92-L112 HydrophobicContact CD1-CD2 4.13Å; L92-A115 HydrophobicContact CB-CB 4.07Å; L92-A115 HydrophobicContact CD1-CB 4.23Å
93	F	87.7	Confident	77.8	Confident	131 Å²	131	86.8 Å²	86.8	58%	0.575	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	8.4	176.4	-59.9	-36	0	0	0	113.5	Y89 I91 N95	Y89-F93 AromaticContact CD1-CE2 3.93Å; Y89-F93 HydrophobicContact CD1-CE2 3.93Å; Y89-F93 AromaticContact CD1-CZ 3.9Å; Y89-F93 HydrophobicContact CD1-CZ 3.9Å; Y89-F93 HydrophobicContact CG-CE2 4.24Å; Y89-F93 WeakPolarHBondContact O-CB 3.33Å; Y89-F93 VanDerWaalsContact O-CD2 3.22Å; Y89-F93 WeakPolarHBondContact O-CD2 3.36Å; Y89-F93 WeakPolarHBondContact O-CG 3.33Å; Y89-F93 PolarHBondContact O-N 3.39Å; I91-F93 PolarHBondContact O-N 2.9Å; F93-N95 PolarHBondContact O-N 3.23Å
94	A	79.8	Confident	75.7	Confident	74 Å²	74	90.7 Å²	90.7	61%	0.612	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	23.8	179.6	0	0	0	0	0	114.8	D90 I91 L92 K96	D90-A94 PolarHBondContact O-N 3.46Å; I91-A94 PolarHBondContact O-N 3.33Å; I91-A94 VanDerWaalsContact O-N 3.09Å; L92-A94 VanDerWaalsContact C-N 3.27Å; A94-K96 PolarHBondContact O-N 2.91Å
95	N	79.1	Confident	73.6	Confident	122 Å²	122	92.2 Å²	92.2	65%	0.652	50%	0.496	S	S	*	.	S	Bend	trans	-70.8	-22.9	170.5	-64	-29	0	0	0	111.4	D90 F93	D90-N95 HydrophobicContact CB-CB 4.41Å; D90-N95 WeakPolarHBondContact O-CB 3.45Å; D90-N95 PolarHBondContact O-N 3.24Å; F93-N95 PolarHBondContact O-N 3.23Å
96	K	73	Confident	71.5	Confident	124 Å²	124	99.7 Å²	99.7	54%	0.539	53%	0.53	S	S	.	.	S	Bend	trans	-128.2	125	178.5	-172.6	178.5	178.4	-175.3	0	110.4	D90 I91 A94	D90-K96 HydrophobicContact CB-CB 4.37Å; D90-K96 PolarHBondContact O-N 3.29Å; D90-K96 VanDerWaalsContact O-N 3.1Å; I91-K96 HydrophobicContact CG1-CB 4.47Å; I91-K96 HydrophobicContact CG1-CD 4.38Å; A94-K96 PolarHBondContact O-N 2.91Å
97	M	63.3	Low	69.6	Low	170 Å²	170	105 Å²	105	84%	0.837	56%	0.564	S	S	*	*			trans	-75.5	135.4	175.3	-66.7	-172.4	177.9	0	0	111	N99	M97-N99 PolarHBondContact O-N 3.39Å
98	V	62	Low	68.3	Low	52 Å²	52	109.1 Å²	109.1	32%	0.315	59%	0.589	S	S	.	*			trans	-79.6	111.3	173.2	-176.7	0	0	0	0	108.4	I91 H100	I91-V98 HydrophobicContact CG2-CG2 3.54Å; V98-H100 VanDerWaalsContact C-N 3.28Å; V98-H100 PolarHBondContact O-N 2.89Å
99	N	57.5	Low	67.5	Low	146 Å²	146	116.4 Å²	116.4	78%	0.781	62%	0.619	S	S	*	*			trans	-76.5	79.4	175.5	-72.1	-20	0	0	0	109.9	M97 S101	M97-N99 PolarHBondContact O-N 3.39Å; N99-S101 PolarHBondContact O-N 3.45Å
100	H	55.2	Low	67	Low	108 Å²	108	115.5 Å²	115.5	50%	0.5	62%	0.623	S	S	.	*			trans	-72.3	84.5	157.7	-70.2	-61.1	0	0	0	107.8	V98 L102	V98-H100 VanDerWaalsContact C-N 3.28Å; V98-H100 PolarHBondContact O-N 2.89Å; H100-L102 PolarHBondContact O-N 2.84Å
101	S	54.2	Low	66.8	Low	103 Å²	103	114.6 Å²	114.6	72%	0.72	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	97.9	171.2	49.6	0	0	0	0	109.2	N99	N99-S101 PolarHBondContact O-N 3.45Å
102	L	51.7	Low	66.8	Low	152 Å²	152	119.1 Å²	119.1	80%	0.796	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166.4	-13	138.4	-124.1	85.9	0	0	0	115.7	H100	H100-L102 PolarHBondContact O-N 2.84Å
103	H	48	Very low	66.8	Low	154 Å²	154	119.9 Å²	119.9	71%	0.713	65%	0.654	S	S	*	*			trans	-142.2	117.1	174.3	-77.8	-68.9	0	0	0	112.6	T105	H103-T105 VanDerWaalsContact C-N 3.34Å; H103-T105 PolarHBondContact O-N 3.45Å
104	P	51.9	Low	66.7	Low	135 Å²	135	116 Å²	116	88%	0.877	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	6.8	-171.8	-10.6	27.4	0	0	0	116.5
105	T	50.2	Low	67.1	Low	124 Å²	124	112.5 Å²	112.5	76%	0.761	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.4	5.5	-161.7	44.3	0	0	0	0	116.6	H103	H103-T105 VanDerWaalsContact C-N 3.34Å; H103-T105 PolarHBondContact O-N 3.45Å
106	E	50	Low	67.8	Low	161 Å²	161	111 Å²	111	75%	0.752	60%	0.598	S	S	*	*	S	Bend	trans	-137.1	131.2	170.5	-67.8	-174	173	0	0	110.5	V108	E106-V108 VanDerWaalsContact C-N 3.35Å; E106-V108 PolarHBondContact O-N 2.96Å
107	P	55.5	Low	68.7	Low	130 Å²	130	106.8 Å²	106.8	84%	0.844	58%	0.581	S	S	*	*			trans	-67.2	96.4	172.2	28	-31.8	0	0	0	108.3	K109	P107-K109 PolarHBondContact O-N 3.22Å
108	V	67.8	Low	70.1	Confident	102 Å²	102	102.8 Å²	102.8	62%	0.618	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-62.8	120	174.7	-177.1	0	0	0	0	107.4	E106 V110	E106-V108 VanDerWaalsContact C-N 3.35Å; E106-V108 PolarHBondContact O-N 2.96Å; V108-V110 PolarHBondContact O-N 3.32Å
109	K	74.5	Confident	71.6	Confident	185 Å²	185	104 Å²	104	80%	0.804	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-61.4	125.8	178.6	-68.3	-179.1	178	179	0	109.1	P107 T111	P107-K109 PolarHBondContact O-N 3.22Å; K109-T111 PolarHBondContact O-N 3.16Å
110	V	80.6	Confident	73.3	Confident	71 Å²	71	104.6 Å²	104.6	43%	0.43	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-57.6	125.4	174.4	-179.6	0	0	0	0	108.9	I91 V108 D114	I91-V110 HydrophobicContact CG2-CG1 4.03Å; V108-V110 PolarHBondContact O-N 3.32Å; V110-D114 HydrophobicContact CG1-CB 4.45Å
111	T	84.7	Confident	75.1	Confident	70 Å²	70	102.9 Å²	102.9	43%	0.429	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-96.6	153.4	176.8	73.1	0	0	0	0	110.4	K109 P113 D114	K109-T111 PolarHBondContact O-N 3.16Å; T111-P113 VanDerWaalsContact C-CD 3.49Å; T111-P113 VanDerWaalsContact C-N 3.34Å; T111-D114 WeakPolarHBondContact CA-OD2 3.45Å; T111-D114 WeakPolarHBondContact CB-OD2 3.27Å; T111-D114 PolarHBondContact N-OD2 3.44Å; T111-D114 WeakPolarHBondContact O-CB 3.41Å; T111-D114 PolarHBondContact O-N 3.01Å; T111-D114 PolarHBondContact OG1-OD1 2.95Å; T111-D114 PolarHBondContact OG1-OD2 3.14Å
112	L	87	Confident	77	Confident	118 Å²	118	98.1 Å²	98.1	62%	0.618	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-55.1	-41.2	178.3	-78	169.3	0	0	0	113.6	L92 D114 A115	L92-L112 HydrophobicContact CD1-CD2 4.13Å; L112-D114 PolarHBondContact O-N 3.21Å; L112-A115 PolarHBondContact O-N 2.76Å
113	P	89.4	Confident	79	Confident	86 Å²	86	93.1 Å²	93.1	56%	0.558	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-61.3	-25.7	175.2	-25.6	36.2	0	0	0	114.7	T111 A115 F116	T111-P113 VanDerWaalsContact C-CD 3.49Å; T111-P113 VanDerWaalsContact C-N 3.34Å; P113-A115 PolarHBondContact O-N 3.39Å; P113-F116 PolarHBondContact O-N 2.83Å; P113-F116 VanDerWaalsContact O-N 3.07Å
114	D	85.9	Confident	81.2	Confident	48 Å²	48	87.5 Å²	87.5	26%	0.257	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-68.3	-25.7	179.2	-57.3	-36.7	0	0	0	112.1	V110 T111 L112 F116	V110-D114 HydrophobicContact CG1-CB 4.45Å; T111-D114 WeakPolarHBondContact CA-OD2 3.45Å; T111-D114 WeakPolarHBondContact CB-OD2 3.27Å; T111-D114 PolarHBondContact N-OD2 3.44Å; T111-D114 WeakPolarHBondContact O-CB 3.41Å; T111-D114 PolarHBondContact O-N 3.01Å; T111-D114 PolarHBondContact OG1-OD1 2.95Å; T111-D114 PolarHBondContact OG1-OD2 3.14Å; L112-D114 PolarHBondContact O-N 3.21Å; D114-F116 VanDerWaalsContact C-N 3.35Å
115	A	88.6	Confident	83.2	Confident	1 Å²	1	87.5 Å²	87.5	1%	0.008	49%	0.486	C	S	.	.	G	3₁₀ helix	trans	-82.8	-11.7	174.1	0	0	0	0	0	112.9	D88 L92 L112 P113	D88-A115 PolarHBondContact N-O 3.37Å; L92-A115 HydrophobicContact CB-CB 4.07Å; L92-A115 HydrophobicContact CD1-CB 4.23Å; L112-A115 PolarHBondContact O-N 2.76Å; P113-A115 PolarHBondContact O-N 3.39Å
116	F	93.5	Very high	85.3	Confident	91 Å²	91	83.1 Å²	83.1	40%	0.399	46%	0.457	S	S	.	.	B	Isolated β-bridge	trans	-89	119	-179.9	-60.5	-20.2	0	0	0	110.3	F82 V87 P113 D114	F82-F116 HydrophobicContact CE1-CD1 4.41Å; F82-F116 HydrophobicContact CE1-CE1 4.08Å; F82-F116 HydrophobicContact CE1-CZ 4.42Å; F82-F116 AromaticContact CZ-CD1 3.74Å; F82-F116 HydrophobicContact CZ-CD1 3.74Å; F82-F116 HydrophobicContact CZ-CD2 4.33Å; F82-F116 AromaticContact CZ-CE1 3.79Å; F82-F116 HydrophobicContact CZ-CE1 3.79Å; F82-F116 HydrophobicContact CZ-CE2 4.37Å; F82-F116 HydrophobicContact CZ-CG 4.04Å; F82-F116 HydrophobicContact CZ-CZ 4.11Å; V87-F116 HydrophobicContact CG2-CD1 4.22Å; V87-F116 HydrophobicContact CG2-CE1 4.23Å; P113-F116 PolarHBondContact O-N 2.83Å; P113-F116 VanDerWaalsContact O-N 3.07Å; D114-F116 VanDerWaalsContact C-N 3.35Å
117	L	91.7	Very high	87.4	Confident	36 Å²	36	82.5 Å²	82.5	19%	0.188	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-64.2	143.5	176.9	-64.2	177.8	0	0	0	110.5	C86 D88	C86-L117 PolarHBondContact O-N 3.47Å; D88-L117 HydrophobicContact CB-CD2 4.22Å
118	P	93.1	Very high	89.2	Confident	85 Å²	85	84 Å²	84	55%	0.552	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-60.3	146.4	175.5	25.5	-33.4	0	0	0	110.4	Q120 V121 C122	P118-Q120 PolarHBondContact O-N 3.21Å; P118-V121 HydrophobicContact CG-CB 4.11Å; P118-V121 HydrophobicContact CG-CG2 3.82Å; P118-V121 PolarHBondContact O-N 3.18Å; P118-C122 PolarHBondContact O-N 3.45Å
119	A	93	Very high	90.5	Very high	78 Å²	78	82 Å²	82	65%	0.645	44%	0.436	S	S	*	.	H	α-helix	trans	-53.6	-34.4	-170.7	0	0	0	0	0	114.2	S123	A119-S123 WeakPolarHBondContact O-CB 3.33Å; A119-S123 PolarHBondContact O-N 3.27Å; A119-S123 PolarHBondContact O-OG 3.21Å
120	Q	92.8	Very high	91.4	Very high	158 Å²	158	75.3 Å²	75.3	74%	0.738	42%	0.419	S	S	*	.	H	α-helix	trans	-68.3	-37.2	178.7	-58.4	-59	-21.8	0	0	113	P118 S123 A124	P118-Q120 PolarHBondContact O-N 3.21Å; Q120-S123 PolarHBondContact O-OG 3.31Å; Q120-S123 VanDerWaalsContact O-OG 3.05Å; Q120-A124 WeakPolarHBondContact O-CB 3.35Å; Q120-A124 PolarHBondContact O-N 3.31Å
121	V	93.8	Very high	92	Very high	72 Å²	72	75.7 Å²	75.7	44%	0.436	43%	0.425	S	S	.	.	H	α-helix	trans	-78	-37.6	178	178.7	0	0	0	0	110	P118 A124 R125	P118-V121 HydrophobicContact CG-CB 4.11Å; P118-V121 HydrophobicContact CG-CG2 3.82Å; P118-V121 PolarHBondContact O-N 3.18Å; V121-A124 PolarHBondContact O-N 3.06Å; V121-R125 PolarHBondContact O-N 3.31Å
122	C	94.4	Very high	92.4	Very high	4 Å²	4	73.4 Å²	73.4	3%	0.027	41%	0.41	C	S	.	.	H	α-helix	trans	-65	-44.6	175.8	-172	0	0	0	0	111.9	C86 P118 A124 R125 I126	C86-C122 WeakPolarHBondContact CA-SG 3.36Å; C86-C122 HydrophobicContact CB-CB 3.92Å; C86-C122 WeakPolarHBondContact CB-SG 3.36Å; C86-C122 WeakPolarHBondContact SG-CB 3.47Å; C86-C122 CovalentContact SG-SG 2.03Å; C86-C122 PolarHBondContact SG-SG 2.89Å; P118-C122 PolarHBondContact O-N 3.45Å; C122-A124 VanDerWaalsContact C-N 3.34Å; C122-A124 PolarHBondContact O-N 3.1Å; C122-R125 PolarHBondContact O-N 2.9Å; C122-I126 WeakPolarHBondContact O-CG1 3.4Å; C122-I126 PolarHBondContact O-N 2.95Å
123	S	93.5	Very high	92.8	Very high	47 Å²	47	71.4 Å²	71.4	33%	0.329	40%	0.399	S	S	.	.	H	α-helix	trans	-62	-41.1	178.3	63.1	0	0	0	0	112.1	A119 Q120 I126 Q127	A119-S123 WeakPolarHBondContact O-CB 3.33Å; A119-S123 PolarHBondContact O-N 3.27Å; A119-S123 PolarHBondContact O-OG 3.21Å; Q120-S123 PolarHBondContact O-OG 3.31Å; Q120-S123 VanDerWaalsContact O-OG 3.05Å; S123-I126 PolarHBondContact O-N 3.09Å; S123-Q127 WeakPolarHBondContact O-CG 3.12Å; S123-Q127 PolarHBondContact O-N 3Å
124	A	93.9	Very high	93.1	Very high	36 Å²	36	71 Å²	71	30%	0.298	40%	0.396	S	S	.	.	H	α-helix	trans	-59.8	-47.8	174.2	0	0	0	0	0	111.8	Q120 V121 C122 I126 Q127 E128	Q120-A124 WeakPolarHBondContact O-CB 3.35Å; Q120-A124 PolarHBondContact O-N 3.31Å; V121-A124 PolarHBondContact O-N 3.06Å; C122-A124 VanDerWaalsContact C-N 3.34Å; C122-A124 PolarHBondContact O-N 3.1Å; A124-I126 VanDerWaalsContact C-N 3.32Å; A124-I126 PolarHBondContact O-N 3.24Å; A124-Q127 PolarHBondContact O-N 3.28Å; A124-Q127 VanDerWaalsContact O-N 3.11Å; A124-E128 WeakPolarHBondContact O-CG 3.42Å; A124-E128 PolarHBondContact O-N 3.07Å
125	R	93.8	Very high	93.5	Very high	134 Å²	134	71.8 Å²	71.8	51%	0.506	40%	0.399	S	S	.	.	H	α-helix	trans	-61.8	-37.8	178.3	-173	-179.7	-69.1	-127.6	1.1	113	S85 V121 C122 N129	S85-R125 WeakPolarHBondContact O-CD 3.29Å; V121-R125 PolarHBondContact O-N 3.31Å; C122-R125 PolarHBondContact O-N 2.9Å; R125-N129 PolarHBondContact O-N 3.37Å
126	I	94.1	Very high	93.9	Very high	33 Å²	33	73.8 Å²	73.8	17%	0.169	41%	0.409	C	S	.	.	H	α-helix	trans	-64.7	-42.4	175.1	-68.3	167.6	0	0	0	110.4	T81 S85 C122 S123 A124 N129 L132 L136	T81-I126 HydrophobicContact CG2-CD1 4.04Å; T81-I126 HydrophobicContact CG2-CG1 4.38Å; S85-I126 VanDerWaalsContact CB-CG1 3.5Å; C122-I126 WeakPolarHBondContact O-CG1 3.4Å; C122-I126 PolarHBondContact O-N 2.95Å; S123-I126 PolarHBondContact O-N 3.09Å; A124-I126 VanDerWaalsContact C-N 3.32Å; A124-I126 PolarHBondContact O-N 3.24Å; I126-N129 PolarHBondContact O-N 3.24Å; I126-L132 HydrophobicContact CG2-CD2 4.4Å; I126-L136 HydrophobicContact CG2-CD1 3.99Å
127	Q	93.3	Very high	94	Very high	148 Å²	148	76.4 Å²	76.4	69%	0.692	42%	0.421	S	S	*	.	H	α-helix	trans	-70	-34.4	-180	-72.4	177.7	-0.9	0	0	113.1	S123 A124 N129	S123-Q127 WeakPolarHBondContact O-CG 3.12Å; S123-Q127 PolarHBondContact O-N 3Å; A124-Q127 PolarHBondContact O-N 3.28Å; A124-Q127 VanDerWaalsContact O-N 3.11Å; Q127-N129 VanDerWaalsContact C-N 3.26Å; Q127-N129 PolarHBondContact O-N 3.22Å
128	E	94.3	Very high	94.3	Very high	160 Å²	160	78.2 Å²	78.2	75%	0.748	43%	0.43	S	S	*	.	H	α-helix	trans	-65.9	-28.8	175.4	-74.2	173.6	-175	0	0	112.3	A124 G130	A124-E128 WeakPolarHBondContact O-CG 3.42Å; A124-E128 PolarHBondContact O-N 3.07Å; E128-G130 PolarHBondContact O-N 3.41Å; E128-G130 VanDerWaalsContact O-N 3.13Å
129	N	94.4	Very high	94.4	Very high	62 Å²	62	75 Å²	75	33%	0.332	41%	0.411	S	S	.	.			trans	-84.1	89.3	179	-167.8	-16.3	0	0	0	112.2	R125 I126 Q127 S131 L132 I133	R125-N129 PolarHBondContact O-N 3.37Å; I126-N129 PolarHBondContact O-N 3.24Å; Q127-N129 VanDerWaalsContact C-N 3.26Å; Q127-N129 PolarHBondContact O-N 3.22Å; N129-S131 PolarHBondContact O-N 3.44Å; N129-S131 PolarHBondContact OD1-N 3.34Å; N129-S131 PolarHBondContact OD1-OG 3.05Å; N129-L132 HydrophobicContact CB-CB 3.95Å; N129-L132 PolarHBondContact O-N 2.61Å; N129-L132 VanDerWaalsContact O-N 3.14Å; N129-L132 PolarHBondContact OD1-N 2.74Å; N129-I133 PolarHBondContact O-N 3.02Å
130	G	93.3	Very high	94.6	Very high	43 Å²	43	72.7 Å²	72.7	44%	0.443	39%	0.394	S	S	.	.	H	α-helix	trans	-54.5	-32.5	179	0	0	0	0	0	115.2	E128 I133 T134	E128-G130 PolarHBondContact O-N 3.41Å; E128-G130 VanDerWaalsContact O-N 3.13Å; G130-I133 VanDerWaalsContact O-CG2 3.26Å; G130-I133 WeakPolarHBondContact O-CG2 3.38Å; G130-T134 PolarHBondContact O-N 3.33Å; G130-T134 PolarHBondContact O-OG1 2.87Å
131	S	92.9	Very high	94.9	Very high	79 Å²	79	68.9 Å²	68.9	55%	0.552	38%	0.381	S	S	*	.	H	α-helix	trans	-72.8	-43.6	178	69.5	0	0	0	0	111.9	N129 T134 I135	N129-S131 PolarHBondContact O-N 3.44Å; N129-S131 PolarHBondContact OD1-N 3.34Å; N129-S131 PolarHBondContact OD1-OG 3.05Å; S131-T134 PolarHBondContact O-N 2.87Å; S131-I135 WeakPolarHBondContact O-CG1 3.46Å; S131-I135 PolarHBondContact O-N 2.95Å; S131-I135 VanDerWaalsContact O-N 3.13Å
132	L	94.2	Very high	95	Very high	22 Å²	22	70.6 Å²	70.6	12%	0.115	38%	0.383	C	S	.	.	H	α-helix	trans	-66.7	-44.2	179.5	-178.5	63.7	0	0	0	111.2	T81 S85 I126 N129 T134 I135 L136	T81-L132 HydrophobicContact CG2-CD2 4.27Å; S85-L132 WeakPolarHBondContact OG-CD2 3.5Å; I126-L132 HydrophobicContact CG2-CD2 4.4Å; N129-L132 HydrophobicContact CB-CB 3.95Å; N129-L132 PolarHBondContact O-N 2.61Å; N129-L132 VanDerWaalsContact O-N 3.14Å; N129-L132 PolarHBondContact OD1-N 2.74Å; L132-T134 VanDerWaalsContact C-N 3.26Å; L132-T134 PolarHBondContact O-N 2.86Å; L132-I135 PolarHBondContact O-N 3.44Å; L132-L136 HydrophobicContact CD1-CG 4.47Å; L132-L136 HydrophobicContact CG-CD1 4.16Å; L132-L136 HydrophobicContact CG-CG 4.46Å; L132-L136 WeakPolarHBondContact O-CB 3.45Å; L132-L136 WeakPolarHBondContact O-CG 3.37Å; L132-L136 PolarHBondContact O-N 2.85Å
133	I	95.6	Very high	95.2	Very high	76 Å²	76	73.7 Å²	73.7	39%	0.39	39%	0.394	S	S	.	.	H	α-helix	trans	-62.9	-35.1	178	-165	66.1	0	0	0	111.8	N129 G130 L136 F137	N129-I133 PolarHBondContact O-N 3.02Å; G130-I133 VanDerWaalsContact O-CG2 3.26Å; G130-I133 WeakPolarHBondContact O-CG2 3.38Å; I133-L136 PolarHBondContact O-N 3.49Å; I133-F137 WeakPolarHBondContact O-CB 3.41Å; I133-F137 PolarHBondContact O-N 3.42Å
134	T	94.5	Very high	95.4	Very high	79 Å²	79	75.8 Å²	75.8	49%	0.485	40%	0.401	S	S	.	.	H	α-helix	trans	-65.1	-45.1	175.1	-57.7	0	0	0	0	111.3	G130 S131 L132 F137 I138	G130-T134 PolarHBondContact O-N 3.33Å; G130-T134 PolarHBondContact O-OG1 2.87Å; S131-T134 PolarHBondContact O-N 2.87Å; L132-T134 VanDerWaalsContact C-N 3.26Å; L132-T134 PolarHBondContact O-N 2.86Å; T134-F137 PolarHBondContact O-N 3.5Å; T134-I138 HydrophobicContact CG2-CD1 4.27Å; T134-I138 WeakPolarHBondContact O-CG1 3.41Å; T134-I138 PolarHBondContact O-N 2.93Å; T134-I138 VanDerWaalsContact O-N 3.13Å
135	I	95.6	Very high	95.5	Very high	63 Å²	63	79.7 Å²	79.7	32%	0.323	41%	0.413	S	S	.	.	H	α-helix	trans	-62.8	-44.5	176.3	-66	167.8	0	0	0	110.7	S131 L132 F137 I138 A139 L303 I306	S131-I135 WeakPolarHBondContact O-CG1 3.46Å; S131-I135 PolarHBondContact O-N 2.95Å; S131-I135 VanDerWaalsContact O-N 3.13Å; L132-I135 PolarHBondContact O-N 3.44Å; I135-F137 VanDerWaalsContact C-N 3.34Å; I135-F137 PolarHBondContact O-N 3.47Å; I135-I138 PolarHBondContact O-N 3.35Å; I135-A139 WeakPolarHBondContact O-CB 3.47Å; I135-A139 PolarHBondContact O-N 2.98Å; I135-L303 HydrophobicContact CG1-CD2 4.14Å; I135-I306 HydrophobicContact CD1-CD1 4.24Å
136	L	96.3	Very high	95.6	Very high	43 Å²	43	76.1 Å²	76.1	23%	0.225	40%	0.399	C	S	.	.	H	α-helix	trans	-61.9	-40.3	177.3	-74.1	176.7	0	0	0	112.4	V77 T81 I126 L132 I133 A139 G140	V77-L136 HydrophobicContact CG1-CD2 3.72Å; T81-L136 HydrophobicContact CG2-CD1 3.98Å; T81-L136 HydrophobicContact CG2-CD2 4.4Å; T81-L136 WeakPolarHBondContact OG1-CD2 3.42Å; I126-L136 HydrophobicContact CG2-CD1 3.99Å; L132-L136 HydrophobicContact CD1-CG 4.47Å; L132-L136 HydrophobicContact CG-CD1 4.16Å; L132-L136 HydrophobicContact CG-CG 4.46Å; L132-L136 WeakPolarHBondContact O-CB 3.45Å; L132-L136 WeakPolarHBondContact O-CG 3.37Å; L132-L136 PolarHBondContact O-N 2.85Å; I133-L136 PolarHBondContact O-N 3.49Å; L136-A139 PolarHBondContact O-N 3.03Å; L136-G140 PolarHBondContact O-N 2.77Å
137	F	96.7	Very high	95.8	Very high	147 Å²	147	77 Å²	77	65%	0.645	40%	0.404	S	S	*	.	H	α-helix	trans	-61.2	-49.4	176	177.5	-100	0	0	0	111.4	I133 T134 I135 A139 G140 V141	I133-F137 WeakPolarHBondContact O-CB 3.41Å; I133-F137 PolarHBondContact O-N 3.42Å; T134-F137 PolarHBondContact O-N 3.5Å; I135-F137 VanDerWaalsContact C-N 3.34Å; I135-F137 PolarHBondContact O-N 3.47Å; F137-A139 PolarHBondContact O-N 3.32Å; F137-G140 PolarHBondContact O-N 3.17Å; F137-V141 HydrophobicContact CD1-CG2 4.49Å; F137-V141 HydrophobicContact CE1-CG2 4.07Å; F137-V141 HydrophobicContact CE2-CG2 4.28Å; F137-V141 HydrophobicContact CZ-CG2 3.95Å; F137-V141 WeakPolarHBondContact O-CG2 3.34Å; F137-V141 PolarHBondContact O-N 2.93Å
138	I	96.3	Very high	96	Very high	74 Å²	74	75 Å²	75	38%	0.379	40%	0.397	S	S	.	.	H	α-helix	trans	-63.8	-43.4	179.3	-61.4	168.6	0	0	0	111	T134 I135 G140 V141 F142 L303	T134-I138 HydrophobicContact CG2-CD1 4.27Å; T134-I138 WeakPolarHBondContact O-CG1 3.41Å; T134-I138 PolarHBondContact O-N 2.93Å; T134-I138 VanDerWaalsContact O-N 3.13Å; I135-I138 PolarHBondContact O-N 3.35Å; I138-G140 VanDerWaalsContact C-N 3.31Å; I138-G140 PolarHBondContact O-N 3.27Å; I138-V141 PolarHBondContact O-N 3.03Å; I138-F142 WeakPolarHBondContact O-CB 3.31Å; I138-F142 PolarHBondContact O-N 3.28Å; I138-L303 HydrophobicContact CD1-CD1 3.8Å; I138-L303 HydrophobicContact CG2-CD1 3.9Å
139	A	96.7	Very high	96	Very high	18 Å²	18	73.3 Å²	73.3	15%	0.149	39%	0.387	C	S	.	.	H	α-helix	trans	-61.6	-39	175.4	0	0	0	0	0	112	F73 V77 I135 L136 F137 F142 W143	F73-A139 HydrophobicContact CE1-CB 4.46Å; F73-A139 HydrophobicContact CZ-CB 4.27Å; V77-A139 HydrophobicContact CG1-CB 4.42Å; I135-A139 WeakPolarHBondContact O-CB 3.47Å; I135-A139 PolarHBondContact O-N 2.98Å; L136-A139 PolarHBondContact O-N 3.03Å; F137-A139 PolarHBondContact O-N 3.32Å; A139-F142 PolarHBondContact O-N 3.09Å; A139-W143 WeakPolarHBondContact O-CB 3.13Å; A139-W143 PolarHBondContact O-N 3.15Å
140	G	97.2	Very high	96.1	Very high	29 Å²	29	71.5 Å²	71.5	30%	0.299	38%	0.376	S	S	.	.	H	α-helix	trans	-63.8	-47.4	175.6	0	0	0	0	0	112.6	L136 F137 I138 F142 W143 I144	L136-G140 PolarHBondContact O-N 2.77Å; F137-G140 PolarHBondContact O-N 3.17Å; I138-G140 VanDerWaalsContact C-N 3.31Å; I138-G140 PolarHBondContact O-N 3.27Å; G140-F142 VanDerWaalsContact C-N 3.34Å; G140-F142 PolarHBondContact O-N 3.03Å; G140-W143 PolarHBondContact O-N 2.95Å; G140-I144 VanDerWaalsContact O-CG1 3.29Å; G140-I144 WeakPolarHBondContact O-CG1 3.35Å; G140-I144 PolarHBondContact O-N 3.24Å
141	V	97.5	Very high	96.3	Very high	77 Å²	77	73.8 Å²	73.8	47%	0.467	38%	0.377	S	S	.	.	H	α-helix	trans	-60	-45	175.4	173	0	0	0	0	110.9	F137 I138 W143 I144 H145	F137-V141 HydrophobicContact CD1-CG2 4.49Å; F137-V141 HydrophobicContact CE1-CG2 4.07Å; F137-V141 HydrophobicContact CE2-CG2 4.28Å; F137-V141 HydrophobicContact CZ-CG2 3.95Å; F137-V141 WeakPolarHBondContact O-CG2 3.34Å; F137-V141 PolarHBondContact O-N 2.93Å; I138-V141 PolarHBondContact O-N 3.03Å; V141-W143 PolarHBondContact O-N 3.25Å; V141-I144 PolarHBondContact O-N 3.19Å; V141-H145 WeakPolarHBondContact O-CB 3.47Å; V141-H145 PolarHBondContact O-N 2.96Å
142	F	96.8	Very high	96.4	Very high	109 Å²	109	76.4 Å²	76.4	48%	0.478	38%	0.376	S	S	.	.	H	α-helix	trans	-61.8	-42.7	176.7	177	-102.1	0	0	0	112.4	F73 I138 A139 G140 H145 R146	F73-F142 HydrophobicContact CD2-CE1 4.32Å; F73-F142 HydrophobicContact CE1-CD1 4.39Å; F73-F142 AromaticContact CE2-CD1 3.8Å; F73-F142 HydrophobicContact CE2-CD1 3.8Å; F73-F142 AromaticContact CE2-CE1 3.82Å; F73-F142 HydrophobicContact CE2-CE1 3.82Å; F73-F142 AromaticContact CZ-CD1 3.68Å; F73-F142 HydrophobicContact CZ-CD1 3.68Å; F73-F142 HydrophobicContact CZ-CE1 4.19Å; I138-F142 WeakPolarHBondContact O-CB 3.31Å; I138-F142 PolarHBondContact O-N 3.28Å; A139-F142 PolarHBondContact O-N 3.09Å; G140-F142 VanDerWaalsContact C-N 3.34Å; G140-F142 PolarHBondContact O-N 3.03Å; F142-H145 PolarHBondContact O-N 3.07Å; F142-R146 WeakPolarHBondContact O-CB 3.25Å; F142-R146 PolarHBondContact O-N 3.18Å
143	W	97.9	Very high	96.4	Very high	68 Å²	68	77.2 Å²	77.2	26%	0.258	38%	0.381	S	S	.	.	H	α-helix	trans	-65.3	-43.2	177.5	-175.1	84.6	0	0	0	112.2	L70 F73 A139 G140 V141 R146 L147	L70-W143 PolarHBondContact O-NE1 3.3Å; F73-W143 HydrophobicContact CD1-CB 4.2Å; F73-W143 AromaticContact CD1-CD1 3.56Å; F73-W143 HydrophobicContact CD1-CG 4.23Å; F73-W143 HydrophobicContact CE1-CB 3.95Å; F73-W143 HydrophobicContact CE1-CG 4.44Å; A139-W143 WeakPolarHBondContact O-CB 3.13Å; A139-W143 PolarHBondContact O-N 3.15Å; G140-W143 PolarHBondContact O-N 2.95Å; V141-W143 PolarHBondContact O-N 3.25Å; W143-R146 PolarHBondContact O-N 3.49Å; W143-L147 HydrophobicContact CH2-CD2 3.84Å; W143-L147 HydrophobicContact CZ3-CD2 3.79Å; W143-L147 WeakPolarHBondContact O-CB 3.38Å; W143-L147 PolarHBondContact O-N 3.25Å
144	I	97.8	Very high	96.4	Very high	91 Å²	91	76 Å²	76	47%	0.467	38%	0.375	S	S	.	.	H	α-helix	trans	-61.4	-45.7	175.6	-68.5	168.1	0	0	0	110.5	G140 V141 R146 L147 I148	G140-I144 VanDerWaalsContact O-CG1 3.29Å; G140-I144 WeakPolarHBondContact O-CG1 3.35Å; G140-I144 PolarHBondContact O-N 3.24Å; V141-I144 PolarHBondContact O-N 3.19Å; I144-R146 VanDerWaalsContact C-N 3.3Å; I144-R146 PolarHBondContact O-N 3.12Å; I144-L147 WeakPolarHBondContact O-CB 3.23Å; I144-L147 PolarHBondContact O-N 3.45Å; I144-I148 HydrophobicContact CG2-CD1 3.94Å; I144-I148 HydrophobicContact CG2-CG1 4.46Å; I144-I148 WeakPolarHBondContact O-CG1 3.32Å; I144-I148 PolarHBondContact O-N 3.49Å
145	H	96.9	Very high	96.4	Very high	119 Å²	119	76.4 Å²	76.4	55%	0.551	38%	0.379	S	S	*	.	H	α-helix	trans	-57.8	-43.8	174.8	166.3	-96.2	0	0	0	111.6	V141 F142 L147 I148 K149	V141-H145 WeakPolarHBondContact O-CB 3.47Å; V141-H145 PolarHBondContact O-N 2.96Å; F142-H145 PolarHBondContact O-N 3.07Å; H145-L147 VanDerWaalsContact C-N 3.35Å; H145-L147 PolarHBondContact O-N 3.43Å; H145-I148 PolarHBondContact O-N 3.12Å; H145-K149 PolarHBondContact O-N 2.99Å
146	R	96.6	Very high	96.3	Very high	59 Å²	59	74 Å²	74	22%	0.223	37%	0.368	C	S	.	.	H	α-helix	trans	-64.8	-38.4	177	-163.2	-177.9	169.6	-163.3	1.9	112	E69 L70 F142 W143 I144 K149 F150	E69-R146 PolarHBondContact O-NH1 2.96Å; E69-R146 IonicContact OE2-NH2 2.73Å; E69-R146 PolarHBondContact OE2-NH2 3.03Å; L70-R146 HydrophobicContact CD2-CB 4.1Å; L70-R146 HydrophobicContact CD2-CG 3.67Å; F142-R146 WeakPolarHBondContact O-CB 3.25Å; F142-R146 PolarHBondContact O-N 3.18Å; W143-R146 PolarHBondContact O-N 3.49Å; I144-R146 VanDerWaalsContact C-N 3.3Å; I144-R146 PolarHBondContact O-N 3.12Å; R146-K149 PolarHBondContact O-N 3.47Å; R146-F150 WeakPolarHBondContact O-CB 3.48Å; R146-F150 PolarHBondContact O-N 3.45Å
147	L	97.3	Very high	96.2	Very high	51 Å²	51	73.1 Å²	73.1	27%	0.267	36%	0.362	S	S	.	.	H	α-helix	trans	-64	-45.2	175.4	179.4	65.8	0	0	0	111.7	L70 W143 I144 H145 K149 F150 I151	L70-L147 HydrophobicContact CD1-CD1 4.14Å; W143-L147 HydrophobicContact CH2-CD2 3.84Å; W143-L147 HydrophobicContact CZ3-CD2 3.79Å; W143-L147 WeakPolarHBondContact O-CB 3.38Å; W143-L147 PolarHBondContact O-N 3.25Å; I144-L147 WeakPolarHBondContact O-CB 3.23Å; I144-L147 PolarHBondContact O-N 3.45Å; H145-L147 VanDerWaalsContact C-N 3.35Å; H145-L147 PolarHBondContact O-N 3.43Å; L147-K149 VanDerWaalsContact C-N 3.34Å; L147-K149 PolarHBondContact O-N 3.41Å; L147-F150 HydrophobicContact CD1-CD1 4.16Å; L147-F150 WeakPolarHBondContact O-CB 3.46Å; L147-F150 PolarHBondContact O-N 3.48Å; L147-I151 HydrophobicContact CD1-CD1 4.36Å; L147-I151 HydrophobicContact CG-CD1 4.11Å; L147-I151 WeakPolarHBondContact O-CG1 3.42Å; L147-I151 PolarHBondContact O-N 3.25Å
148	I	97.5	Very high	96.1	Very high	107 Å²	107	73.1 Å²	73.1	55%	0.549	36%	0.358	S	S	.	.	H	α-helix	trans	-60.1	-46.5	176.1	-67.9	167	0	0	0	110.2	I144 H145 F150 I151 Y152	I144-I148 HydrophobicContact CG2-CD1 3.94Å; I144-I148 HydrophobicContact CG2-CG1 4.46Å; I144-I148 WeakPolarHBondContact O-CG1 3.32Å; I144-I148 PolarHBondContact O-N 3.49Å; H145-I148 PolarHBondContact O-N 3.12Å; I148-F150 VanDerWaalsContact C-N 3.3Å; I148-F150 PolarHBondContact O-N 3.21Å; I148-I151 PolarHBondContact O-N 2.92Å; I148-Y152 PolarHBondContact O-N 3.12Å
149	K	95.3	Very high	96	Very high	123 Å²	123	73.9 Å²	73.9	54%	0.535	36%	0.36	S	S	.	.	H	α-helix	trans	-59.9	-40.6	176.1	-176.7	178.2	178.4	-180	0	111.9	H145 R146 L147 Y152 N153	H145-K149 PolarHBondContact O-N 2.99Å; R146-K149 PolarHBondContact O-N 3.47Å; L147-K149 VanDerWaalsContact C-N 3.34Å; L147-K149 PolarHBondContact O-N 3.41Å; K149-Y152 PolarHBondContact O-N 3.22Å; K149-N153 WeakPolarHBondContact O-CB 3.47Å; K149-N153 VanDerWaalsContact O-CG 3.26Å; K149-N153 PolarHBondContact O-N 3.26Å; K149-N153 PolarHBondContact O-ND2 2.93Å
150	F	96.2	Very high	95.9	Very high	24 Å²	24	73.2 Å²	73.2	11%	0.105	35%	0.353	C	S	.	.	H	α-helix	trans	-62.8	-47.1	175.9	165	-107	0	0	0	112	L63 E66 I67 L70 R146 L147 I148 Y152 N153 I154	L63-F150 HydrophobicContact CD1-CE2 3.92Å; L63-F150 HydrophobicContact CD1-CZ 3.66Å; E66-F150 HydrophobicContact CB-CD2 3.71Å; E66-F150 HydrophobicContact CB-CE2 3.55Å; I67-F150 HydrophobicContact CD1-CZ 4.31Å; I67-F150 HydrophobicContact CG1-CE1 4.32Å; I67-F150 HydrophobicContact CG1-CE2 4.28Å; I67-F150 HydrophobicContact CG1-CZ 3.55Å; L70-F150 HydrophobicContact CD1-CB 4Å; L70-F150 HydrophobicContact CD1-CD1 3.68Å; L70-F150 HydrophobicContact CD1-CD2 4.34Å; L70-F150 HydrophobicContact CD1-CE1 4.15Å; L70-F150 HydrophobicContact CD1-CG 3.75Å; R146-F150 WeakPolarHBondContact O-CB 3.48Å; R146-F150 PolarHBondContact O-N 3.45Å; L147-F150 HydrophobicContact CD1-CD1 4.16Å; L147-F150 WeakPolarHBondContact O-CB 3.46Å; L147-F150 PolarHBondContact O-N 3.48Å; I148-F150 VanDerWaalsContact C-N 3.3Å; I148-F150 PolarHBondContact O-N 3.21Å; F150-Y152 VanDerWaalsContact C-N 3.34Å; F150-Y152 PolarHBondContact O-N 3.44Å; F150-N153 WeakPolarHBondContact O-CB 3.35Å; F150-N153 PolarHBondContact O-N 3.46Å; F150-N153 VanDerWaalsContact O-N 3.16Å; F150-I154 HydrophobicContact CD1-CD1 4.01Å; F150-I154 HydrophobicContact CD2-CD1 4.33Å; F150-I154 HydrophobicContact CD2-CG1 4.36Å; F150-I154 HydrophobicContact CE1-CD1 3.46Å; F150-I154 VanDerWaalsContact CE1-CD1 3.46Å; F150-I154 HydrophobicContact CE1-CG1 4.45Å; F150-I154 HydrophobicContact CE2-CD1 3.8Å; F150-I154 HydrophobicContact CE2-CG1 4Å; F150-I154 HydrophobicContact CG-CD1 4.44Å; F150-I154 HydrophobicContact CZ-CD1 3.36Å; F150-I154 HydrophobicContact CZ-CG1 4.09Å; F150-I154 WeakPolarHBondContact O-CG1 3.32Å; F150-I154 PolarHBondContact O-N 3.28Å
151	I	96.5	Very high	95.8	Very high	91 Å²	91	73.1 Å²	73.1	47%	0.467	35%	0.345	S	S	.	.	H	α-helix	trans	-59.8	-45.9	177	-66.9	166.7	0	0	0	110.6	L147 I148 N153 I154 C155	L147-I151 HydrophobicContact CD1-CD1 4.36Å; L147-I151 HydrophobicContact CG-CD1 4.11Å; L147-I151 WeakPolarHBondContact O-CG1 3.42Å; L147-I151 PolarHBondContact O-N 3.25Å; I148-I151 PolarHBondContact O-N 2.92Å; I151-N153 VanDerWaalsContact C-N 3.34Å; I151-N153 PolarHBondContact O-N 3.48Å; I151-I154 WeakPolarHBondContact O-CB 3.36Å; I151-I154 PolarHBondContact O-N 3.48Å; I151-C155 PolarHBondContact O-N 3.07Å
152	Y	95.9	Very high	95.6	Very high	135 Å²	135	71 Å²	71	53%	0.529	33%	0.334	S	S	.	.	H	α-helix	trans	-58.2	-46.1	174.6	173.3	-99.5	0	0	0	111.9	I148 K149 F150 I154 C155 C156	I148-Y152 PolarHBondContact O-N 3.12Å; K149-Y152 PolarHBondContact O-N 3.22Å; F150-Y152 VanDerWaalsContact C-N 3.34Å; F150-Y152 PolarHBondContact O-N 3.44Å; Y152-I154 VanDerWaalsContact C-N 3.34Å; Y152-I154 PolarHBondContact O-N 2.87Å; Y152-C155 PolarHBondContact O-N 2.91Å; Y152-C156 PolarHBondContact O-N 3.3Å; Y152-C156 VanDerWaalsContact O-N 3.13Å; Y152-C156 PolarHBondContact O-SG 3.46Å
153	N	94.4	Very high	95.5	Very high	38 Å²	38	65.8 Å²	65.8	20%	0.203	31%	0.311	C	S	.	.	H	α-helix	trans	-61.9	-39	178.1	-79	-20.6	0	0	0	112.3	K149 F150 I151 C155 C156 Y157	K149-N153 WeakPolarHBondContact O-CB 3.47Å; K149-N153 VanDerWaalsContact O-CG 3.26Å; K149-N153 PolarHBondContact O-N 3.26Å; K149-N153 PolarHBondContact O-ND2 2.93Å; F150-N153 WeakPolarHBondContact O-CB 3.35Å; F150-N153 PolarHBondContact O-N 3.46Å; F150-N153 VanDerWaalsContact O-N 3.16Å; I151-N153 VanDerWaalsContact C-N 3.34Å; I151-N153 PolarHBondContact O-N 3.48Å; N153-C155 VanDerWaalsContact C-N 3.33Å; N153-C155 PolarHBondContact O-N 2.94Å; N153-C156 PolarHBondContact O-N 3.23Å; N153-Y157 HydrophobicContact CB-CD2 4.15Å; N153-Y157 HydrophobicContact CB-CE2 4.28Å; N153-Y157 WeakPolarHBondContact O-CB 3.16Å; N153-Y157 WeakPolarHBondContact O-CD2 3.35Å; N153-Y157 PolarHBondContact O-N 2.87Å
154	I	94.8	Very high	95.3	Very high	52 Å²	52	62.6 Å²	62.6	27%	0.267	30%	0.299	S	S	.	.	H	α-helix	trans	-55.5	-50.3	175.6	-71.6	170.7	0	0	0	110.4	F59 L63 F150 I151 Y152 C156 Y157 W158	F59-I154 HydrophobicContact CZ-CG2 4.21Å; L63-I154 HydrophobicContact CD1-CD1 3.59Å; L63-I154 HydrophobicContact CD1-CG1 3.78Å; F150-I154 HydrophobicContact CD1-CD1 4.01Å; F150-I154 HydrophobicContact CD2-CD1 4.33Å; F150-I154 HydrophobicContact CD2-CG1 4.36Å; F150-I154 HydrophobicContact CE1-CD1 3.46Å; F150-I154 VanDerWaalsContact CE1-CD1 3.46Å; F150-I154 HydrophobicContact CE1-CG1 4.45Å; F150-I154 HydrophobicContact CE2-CD1 3.8Å; F150-I154 HydrophobicContact CE2-CG1 4Å; F150-I154 HydrophobicContact CG-CD1 4.44Å; F150-I154 HydrophobicContact CZ-CD1 3.36Å; F150-I154 HydrophobicContact CZ-CG1 4.09Å; F150-I154 WeakPolarHBondContact O-CG1 3.32Å; F150-I154 PolarHBondContact O-N 3.28Å; I151-I154 WeakPolarHBondContact O-CB 3.36Å; I151-I154 PolarHBondContact O-N 3.48Å; Y152-I154 VanDerWaalsContact C-N 3.34Å; Y152-I154 PolarHBondContact O-N 2.87Å; I154-C156 VanDerWaalsContact C-N 3.33Å; I154-C156 PolarHBondContact O-N 3.35Å; I154-Y157 PolarHBondContact O-N 3.44Å; I154-W158 WeakPolarHBondContact O-CB 3.44Å; I154-W158 PolarHBondContact O-N 3.26Å
155	C	93.9	Very high	95.2	Very high	86 Å²	86	61.3 Å²	61.3	58%	0.581	29%	0.293	S	S	*	.	H	α-helix	trans	-59	-46.7	-179.7	-63.6	0	0	0	0	111.1	I151 Y152 N153 W158 E159	I151-C155 PolarHBondContact O-N 3.07Å; Y152-C155 PolarHBondContact O-N 2.91Å; N153-C155 VanDerWaalsContact C-N 3.33Å; N153-C155 PolarHBondContact O-N 2.94Å; C155-W158 WeakPolarHBondContact O-CB 3.27Å; C155-W158 PolarHBondContact O-N 3.38Å; C155-E159 PolarHBondContact O-N 2.97Å
156	C	93.2	Very high	94.9	Very high	12 Å²	12	62 Å²	62	8%	0.081	30%	0.296	C	S	.	.	H	α-helix	trans	-65.5	-38.2	177.7	-68.8	0	0	0	0	113.6	R49 Y152 N153 I154 W158 E159 I160	R49-C156 VanDerWaalsContact NH1-CB 3.31Å; R49-C156 PolarHBondContact NH1-SG 3.4Å; R49-C156 PolarHBondContact NH2-SG 3.17Å; R49-C156 VanDerWaalsContact NH2-SG 3.38Å; Y152-C156 PolarHBondContact O-N 3.3Å; Y152-C156 VanDerWaalsContact O-N 3.13Å; Y152-C156 PolarHBondContact O-SG 3.46Å; N153-C156 PolarHBondContact O-N 3.23Å; I154-C156 VanDerWaalsContact C-N 3.33Å; I154-C156 PolarHBondContact O-N 3.35Å; C156-W158 VanDerWaalsContact C-N 3.34Å; C156-E159 WeakPolarHBondContact O-CB 3.4Å; C156-E159 PolarHBondContact O-N 3.07Å; C156-I160 PolarHBondContact O-N 3.09Å
157	Y	95.3	Very high	94.7	Very high	26 Å²	26	59.3 Å²	59.3	10%	0.102	29%	0.286	C	S	.	.	H	α-helix	trans	-76.2	-24.5	178.3	-83.4	-70.1	0	0	0	112.7	R49 N52 M62 N153 I154 E159 I160 H161	R49-Y157 HydrophobicContact CB-CD1 4.22Å; R49-Y157 HydrophobicContact CB-CE1 3.65Å; R49-Y157 HydrophobicContact CG-CE1 3.87Å; N52-Y157 PolarHBondContact ND2-OH 3.36Å; M62-Y157 VanDerWaalsContact CE-CB 3.46Å; M62-Y157 HydrophobicContact CE-CD1 3.43Å; M62-Y157 VanDerWaalsContact CE-CD1 3.43Å; M62-Y157 HydrophobicContact CE-CD2 3.55Å; M62-Y157 HydrophobicContact CE-CE1 3.96Å; M62-Y157 HydrophobicContact CE-CE2 4.1Å; M62-Y157 HydrophobicContact CE-CG 3.2Å; M62-Y157 HydrophobicContact SD-CD1 3.84Å; M62-Y157 HydrophobicContact SD-CD2 4.09Å; M62-Y157 HydrophobicContact SD-CE1 3.72Å; M62-Y157 HydrophobicContact SD-CE2 4.02Å; M62-Y157 HydrophobicContact SD-CG 4.04Å; N153-Y157 HydrophobicContact CB-CD2 4.15Å; N153-Y157 HydrophobicContact CB-CE2 4.28Å; N153-Y157 WeakPolarHBondContact O-CB 3.16Å; N153-Y157 WeakPolarHBondContact O-CD2 3.35Å; N153-Y157 PolarHBondContact O-N 2.87Å; I154-Y157 PolarHBondContact O-N 3.44Å; Y157-E159 VanDerWaalsContact C-N 3.28Å; Y157-I160 PolarHBondContact O-N 2.91Å; Y157-H161 WeakPolarHBondContact O-CB 3.33Å; Y157-H161 PolarHBondContact O-N 3.31Å
158	W	94.8	Very high	94.5	Very high	147 Å²	147	57 Å²	57	56%	0.557	27%	0.274	S	S	*	.	H	α-helix	trans	-64.3	-37.7	171.6	-170.9	-98.6	0	0	0	111.6	F59 I154 C155 C156 H161 S162	F59-W158 HydrophobicContact CD1-CE3 4.16Å; F59-W158 HydrophobicContact CD1-CZ3 4.12Å; F59-W158 AromaticContact CE1-CE3 3.6Å; F59-W158 HydrophobicContact CE1-CE3 3.6Å; F59-W158 AromaticContact CE1-CZ3 3.72Å; F59-W158 HydrophobicContact CE1-CZ3 3.72Å; F59-W158 HydrophobicContact CE2-CE3 4.22Å; F59-W158 AromaticContact CZ-CE3 3.63Å; F59-W158 HydrophobicContact CZ-CE3 3.63Å; F59-W158 HydrophobicContact CZ-CZ3 4.24Å; I154-W158 WeakPolarHBondContact O-CB 3.44Å; I154-W158 PolarHBondContact O-N 3.26Å; C155-W158 WeakPolarHBondContact O-CB 3.27Å; C155-W158 PolarHBondContact O-N 3.38Å; C156-W158 VanDerWaalsContact C-N 3.34Å; W158-H161 WeakPolarHBondContact O-CB 3.41Å; W158-H161 PolarHBondContact O-N 2.98Å; W158-S162 PolarHBondContact O-N 2.69Å
159	E	93.4	Very high	94.3	Very high	90 Å²	90	59.3 Å²	59.3	42%	0.421	28%	0.276	S	S	.	.	H	α-helix	trans	-60.3	-49.3	171	-178	-177.1	-176.5	0	0	110.7	W37 C155 C156 Y157 H161 S162 F163	W37-E159 HydrophobicContact CH2-CB 4.41Å; W37-E159 HydrophobicContact CH2-CG 3.4Å; W37-E159 WeakPolarHBondContact CH2-O 3.21Å; W37-E159 HydrophobicContact CZ3-CG 3.3Å; W37-E159 WeakPolarHBondContact CZ3-OE1 3.13Å; C155-E159 PolarHBondContact O-N 2.97Å; C156-E159 WeakPolarHBondContact O-CB 3.4Å; C156-E159 PolarHBondContact O-N 3.07Å; Y157-E159 VanDerWaalsContact C-N 3.28Å; E159-H161 VanDerWaalsContact C-N 3.3Å; E159-H161 PolarHBondContact O-N 3.21Å; E159-S162 VanDerWaalsContact O-CB 3.3Å; E159-S162 WeakPolarHBondContact O-CB 3.11Å; E159-S162 PolarHBondContact O-N 3.19Å; E159-S162 VanDerWaalsContact O-N 3.11Å; E159-F163 PolarHBondContact O-N 3.33Å
160	I	94.7	Very high	94.3	Very high	3 Å²	3	54 Å²	54	2%	0.015	25%	0.253	C	S	.	.	H	α-helix	trans	-61.9	-37.9	175.4	-55.2	-54.2	0	0	0	112.2	F46 R49 V50 L53 C156 Y157 S162 F163 Y164	F46-I160 HydrophobicContact CD2-CD1 3.31Å; F46-I160 HydrophobicContact CE2-CD1 3.34Å; F46-I160 HydrophobicContact CG-CD1 4.33Å; F46-I160 HydrophobicContact CZ-CD1 4.36Å; R49-I160 HydrophobicContact CB-CD1 4.38Å; R49-I160 HydrophobicContact CB-CG1 3.89Å; V50-I160 HydrophobicContact CB-CG2 4.4Å; V50-I160 HydrophobicContact CG2-CD1 4.25Å; V50-I160 HydrophobicContact CG2-CG2 3.8Å; L53-I160 HydrophobicContact CB-CG2 4.47Å; L53-I160 HydrophobicContact CD2-CB 4.38Å; L53-I160 HydrophobicContact CD2-CG2 3.8Å; C156-I160 PolarHBondContact O-N 3.09Å; Y157-I160 PolarHBondContact O-N 2.91Å; I160-S162 VanDerWaalsContact C-N 3.31Å; I160-S162 PolarHBondContact O-N 2.87Å; I160-F163 WeakPolarHBondContact O-CB 3.25Å; I160-F163 PolarHBondContact O-N 2.9Å; I160-F163 VanDerWaalsContact O-N 3.14Å; I160-Y164 HydrophobicContact CG2-CD2 3.97Å; I160-Y164 HydrophobicContact CG2-CE2 3.89Å; I160-Y164 WeakPolarHBondContact O-CD2 3.43Å; I160-Y164 PolarHBondContact O-N 2.61Å
161	H	95.1	Very high	94.2	Very high	28 Å²	28	55.9 Å²	55.9	13%	0.13	27%	0.268	C	S	.	.	H	α-helix	trans	-59.2	-43.7	174.5	168.4	-86.4	0	0	0	111.4	F59 Y157 W158 E159 F163 Y164 L165 M172	F59-H161 HydrophobicContact CB-CB 4.37Å; F59-H161 HydrophobicContact CD2-CB 4.3Å; F59-H161 HydrophobicContact CG-CB 4.42Å; Y157-H161 WeakPolarHBondContact O-CB 3.33Å; Y157-H161 PolarHBondContact O-N 3.31Å; W158-H161 WeakPolarHBondContact O-CB 3.41Å; W158-H161 PolarHBondContact O-N 2.98Å; E159-H161 VanDerWaalsContact C-N 3.3Å; E159-H161 PolarHBondContact O-N 3.21Å; H161-F163 VanDerWaalsContact C-N 3.34Å; H161-F163 PolarHBondContact O-N 2.98Å; H161-Y164 PolarHBondContact O-N 3.28Å; H161-L165 WeakPolarHBondContact CE1-CD1 3.33Å; H161-L165 PolarHBondContact O-N 2.72Å; H161-M172 HydrophobicContact CB-CE 4.32Å; H161-M172 WeakPolarHBondContact CD2-CE 3.28Å; H161-M172 VanDerWaalsContact CD2-CG 3.48Å; H161-M172 WeakPolarHBondContact CD2-CG 3.29Å; H161-M172 PolarHBondContact CD2-SD 3.03Å; H161-M172 VanDerWaalsContact NE2-CG 3.31Å; H161-M172 WeakPolarHBondContact NE2-CG 3.44Å; H161-M172 WeakPolarHBondContact O-CE 3.48Å
162	S	94	Very high	94.1	Very high	32 Å²	32	53.5 Å²	53.5	22%	0.224	26%	0.255	C	S	.	.	H	α-helix	trans	-61.2	-40.9	173.2	-175.5	0	0	0	0	112	W158 E159 I160 Y164 L165 H166	W158-S162 PolarHBondContact O-N 2.69Å; E159-S162 VanDerWaalsContact O-CB 3.3Å; E159-S162 WeakPolarHBondContact O-CB 3.11Å; E159-S162 PolarHBondContact O-N 3.19Å; E159-S162 VanDerWaalsContact O-N 3.11Å; I160-S162 VanDerWaalsContact C-N 3.31Å; I160-S162 PolarHBondContact O-N 2.87Å; S162-Y164 PolarHBondContact O-N 2.88Å; S162-L165 PolarHBondContact O-N 2.82Å; S162-H166 WeakPolarHBondContact O-CB 3.44Å; S162-H166 PolarHBondContact O-CD2 3.25Å; S162-H166 PolarHBondContact O-N 3.01Å; S162-H166 PolarHBondContact OG-CD2 3.04Å
163	F	93.8	Very high	94	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.5	-43.9	175.4	174.4	-107.4	0	0	0	112.5	W37 F46 V50 E159 I160 H161 A167 L168 I196	W37-F163 HydrophobicContact CD2-CB 4.34Å; W37-F163 AromaticContact CD2-CD2 3.89Å; W37-F163 HydrophobicContact CD2-CD2 3.89Å; W37-F163 HydrophobicContact CE3-CB 4.43Å; W37-F163 HydrophobicContact CE3-CD2 4.32Å; W37-F163 HydrophobicContact CG-CD2 4Å; W37-F163 HydrophobicContact CH2-CB 3.98Å; W37-F163 HydrophobicContact CZ2-CB 3.82Å; W37-F163 HydrophobicContact CZ3-CB 4.26Å; F46-F163 HydrophobicContact CE1-CE1 4.06Å; F46-F163 HydrophobicContact CE1-CZ 4.05Å; F46-F163 HydrophobicContact CE2-CD1 4.44Å; F46-F163 HydrophobicContact CE2-CG 4.37Å; F46-F163 AromaticContact CZ-CD1 3.72Å; F46-F163 HydrophobicContact CZ-CD1 3.72Å; F46-F163 AromaticContact CZ-CD2 3.93Å; F46-F163 HydrophobicContact CZ-CD2 3.93Å; F46-F163 AromaticContact CZ-CE1 3.62Å; F46-F163 HydrophobicContact CZ-CE1 3.62Å; F46-F163 AromaticContact CZ-CE2 3.87Å; F46-F163 HydrophobicContact CZ-CE2 3.87Å; F46-F163 AromaticContact CZ-CG 3.86Å; F46-F163 HydrophobicContact CZ-CG 3.86Å; F46-F163 AromaticContact CZ-CZ 3.7Å; F46-F163 HydrophobicContact CZ-CZ 3.7Å; V50-F163 HydrophobicContact CG2-CD1 4.13Å; V50-F163 HydrophobicContact CG2-CE1 4.07Å; E159-F163 PolarHBondContact O-N 3.33Å; I160-F163 WeakPolarHBondContact O-CB 3.25Å; I160-F163 PolarHBondContact O-N 2.9Å; I160-F163 VanDerWaalsContact O-N 3.14Å; H161-F163 VanDerWaalsContact C-N 3.34Å; H161-F163 PolarHBondContact O-N 2.98Å; F163-A167 HydrophobicContact CD2-CB 3.55Å; F163-A167 HydrophobicContact CE2-CB 3.69Å; F163-A167 HydrophobicContact CG-CB 4.37Å; F163-A167 WeakPolarHBondContact O-CA 3.44Å; F163-A167 VanDerWaalsContact O-CB 3.28Å; F163-A167 WeakPolarHBondContact O-CB 3.35Å; F163-A167 PolarHBondContact O-N 3.38Å; F163-L168 HydrophobicContact CD1-CD1 3.67Å; F163-L168 HydrophobicContact CD2-CD1 4.31Å; F163-L168 HydrophobicContact CE1-CD1 3.12Å; F163-L168 HydrophobicContact CE1-CD2 4.4Å; F163-L168 HydrophobicContact CE1-CG 4.39Å; F163-L168 HydrophobicContact CE2-CD1 3.82Å; F163-L168 HydrophobicContact CG-CD1 4.24Å; F163-L168 HydrophobicContact CZ-CD1 3.21Å; F163-L168 PolarHBondContact O-N 2.95Å; F163-L168 VanDerWaalsContact O-N 3.13Å; F163-I196 HydrophobicContact CE2-CD1 3.76Å; F163-I196 HydrophobicContact CE2-CG1 4.5Å; F163-I196 HydrophobicContact CZ-CD1 3.84Å
164	Y	94.8	Very high	94	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.6	-44.9	175.3	-90.4	-85.3	0	0	0	113	V50 L53 I160 H161 S162 L168 R169 I170 M172 L175 V183	V50-Y164 HydrophobicContact CB-CE2 4.44Å; V50-Y164 HydrophobicContact CG1-CE2 3.89Å; V50-Y164 VanDerWaalsContact CG1-OH 3.27Å; V50-Y164 WeakPolarHBondContact CG1-OH 3.48Å; V50-Y164 PolarHBondContact O-OH 2.95Å; L53-Y164 HydrophobicContact CB-CE2 4.34Å; L53-Y164 HydrophobicContact CD2-CD2 3.65Å; L53-Y164 HydrophobicContact CD2-CE2 3.77Å; L53-Y164 HydrophobicContact CG-CE2 4.39Å; I160-Y164 HydrophobicContact CG2-CD2 3.97Å; I160-Y164 HydrophobicContact CG2-CE2 3.89Å; I160-Y164 WeakPolarHBondContact O-CD2 3.43Å; I160-Y164 PolarHBondContact O-N 2.61Å; H161-Y164 PolarHBondContact O-N 3.28Å; S162-Y164 PolarHBondContact O-N 2.88Å; Y164-L168 HydrophobicContact CD1-CD2 3.86Å; Y164-L168 HydrophobicContact CE1-CD2 3.81Å; Y164-R169 PolarHBondContact O-N 3.46Å; Y164-R169 VanDerWaalsContact O-N 3.13Å; Y164-I170 HydrophobicContact CD1-CB 4.37Å; Y164-I170 PolarHBondContact O-N 2.92Å; Y164-M172 HydrophobicContact CG-CE 4.11Å; Y164-L175 HydrophobicContact CD1-CD1 3.73Å; Y164-L175 HydrophobicContact CE1-CD1 3.41Å; Y164-L175 VanDerWaalsContact CE1-CD1 3.41Å; Y164-V183 HydrophobicContact CE1-CG1 3.87Å; Y164-V183 HydrophobicContact CE1-CG2 4.46Å
165	L	93.9	Very high	93.9	Very high	65 Å²	65	48.8 Å²	48.8	34%	0.34	25%	0.252	S	S	.	.	H	α-helix	trans	-69.7	-46.6	-177.8	-69.7	-178.2	0	0	0	112.6	H161 S162 M172	H161-L165 WeakPolarHBondContact CE1-CD1 3.33Å; H161-L165 PolarHBondContact O-N 2.72Å; S162-L165 PolarHBondContact O-N 2.82Å; L165-M172 HydrophobicContact CD2-CE 4.3Å; L165-M172 HydrophobicContact CD2-CG 4.32Å; L165-M172 HydrophobicContact CG-CE 4.14Å
166	H	92.3	Very high	93.9	Very high	134 Å²	134	47.3 Å²	47.3	62%	0.62	24%	0.241	S	C	*	.	H	α-helix	trans	-94.2	-40.4	-170.2	-64.2	-65.1	0	0	0	113.6	S162	S162-H166 WeakPolarHBondContact O-CB 3.44Å; S162-H166 PolarHBondContact O-CD2 3.25Å; S162-H166 PolarHBondContact O-N 3.01Å; S162-H166 PolarHBondContact OG-CD2 3.04Å
167	A	91.2	Very high	93.9	Very high	2 Å²	2	54 Å²	54	2%	0.017	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-46.1	-175.4	0	0	0	0	0	112.6	F163 T190	F163-A167 HydrophobicContact CD2-CB 3.55Å; F163-A167 HydrophobicContact CE2-CB 3.69Å; F163-A167 HydrophobicContact CG-CB 4.37Å; F163-A167 WeakPolarHBondContact O-CA 3.44Å; F163-A167 VanDerWaalsContact O-CB 3.28Å; F163-A167 WeakPolarHBondContact O-CB 3.35Å; F163-A167 PolarHBondContact O-N 3.38Å; A167-T190 HydrophobicContact CB-CG2 4.05Å; A167-T190 PolarHBondContact O-OG1 3.38Å
168	L	92.7	Very high	93.7	Very high	1 Å²	1	54 Å²	54	1%	0.005	27%	0.269	C	S	.	.	S	Bend	trans	-82.5	-19.6	178.7	-84.1	65.6	0	0	0	112.7	F163 Y164 I170 V183 R186 I187	F163-L168 HydrophobicContact CD1-CD1 3.67Å; F163-L168 HydrophobicContact CD2-CD1 4.31Å; F163-L168 HydrophobicContact CE1-CD1 3.12Å; F163-L168 HydrophobicContact CE1-CD2 4.4Å; F163-L168 HydrophobicContact CE1-CG 4.39Å; F163-L168 HydrophobicContact CE2-CD1 3.82Å; F163-L168 HydrophobicContact CG-CD1 4.24Å; F163-L168 HydrophobicContact CZ-CD1 3.21Å; F163-L168 PolarHBondContact O-N 2.95Å; F163-L168 VanDerWaalsContact O-N 3.13Å; Y164-L168 HydrophobicContact CD1-CD2 3.86Å; Y164-L168 HydrophobicContact CE1-CD2 3.81Å; L168-I170 VanDerWaalsContact C-N 3.26Å; L168-I170 HydrophobicContact CB-CD1 4.13Å; L168-I170 HydrophobicContact CB-CG1 4.1Å; L168-I170 HydrophobicContact CD2-CD1 4.16Å; L168-I170 PolarHBondContact O-N 3.09Å; L168-V183 HydrophobicContact CD2-CG1 4.02Å; L168-R186 HydrophobicContact CG-CB 4.26Å; L168-R186 PolarHBondContact O-NH1 2.75Å; L168-I187 HydrophobicContact CD1-CG1 4.35Å; L168-I187 HydrophobicContact CD2-CG1 3.93Å; L168-I187 HydrophobicContact CG-CG1 4.39Å
169	R	94.4	Very high	93.6	Very high	157 Å²	157	48.4 Å²	48.4	59%	0.592	25%	0.251	S	S	*	.			trans	58.2	38.9	-175.2	-51.2	177.2	-171.4	142.7	13.7	111.7	Y164 E193	Y164-R169 PolarHBondContact O-N 3.46Å; Y164-R169 VanDerWaalsContact O-N 3.13Å; R169-E193 IonicContact CZ-OE2 3.62Å; R169-E193 IonicContact NH2-OE2 3.38Å; R169-E193 PolarHBondContact NH2-OE2 3.06Å
170	I	94.7	Very high	93.7	Very high	11 Å²	11	44.4 Å²	44.4	6%	0.056	23%	0.232	C	C	.	.			trans	-109.9	114.3	176.4	-61.5	175.2	0	0	0	108.2	Y164 L168 L175 V183 R186	Y164-I170 HydrophobicContact CD1-CB 4.37Å; Y164-I170 PolarHBondContact O-N 2.92Å; L168-I170 VanDerWaalsContact C-N 3.26Å; L168-I170 HydrophobicContact CB-CD1 4.13Å; L168-I170 HydrophobicContact CB-CG1 4.1Å; L168-I170 HydrophobicContact CD2-CD1 4.16Å; L168-I170 PolarHBondContact O-N 3.09Å; I170-L175 HydrophobicContact CG2-CD1 4.13Å; I170-V183 HydrophobicContact CD1-CG2 4.12Å; I170-R186 HydrophobicContact CD1-CG 4.38Å
171	P	94.9	Very high	93.5	Very high	64 Å²	64	47.1 Å²	47.1	42%	0.416	25%	0.245	S	C	.	.			trans	-70	147.8	175.7	29.2	-32.6	0	0	0	110.9	S173 A174 L175	P171-S173 PolarHBondContact O-N 3.43Å; P171-S173 VanDerWaalsContact O-N 3.13Å; P171-A174 HydrophobicContact CG-CB 3.78Å; P171-A174 PolarHBondContact O-N 3.3Å; P171-L175 PolarHBondContact O-N 2.99Å
172	M	93.7	Very high	93.4	Very high	40 Å²	40	48.9 Å²	48.9	20%	0.197	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-26.4	-179.4	-68.4	-62.2	139.7	0	0	113.9	H161 Y164 L165 A174 L175 P176	H161-M172 HydrophobicContact CB-CE 4.32Å; H161-M172 WeakPolarHBondContact CD2-CE 3.28Å; H161-M172 VanDerWaalsContact CD2-CG 3.48Å; H161-M172 WeakPolarHBondContact CD2-CG 3.29Å; H161-M172 PolarHBondContact CD2-SD 3.03Å; H161-M172 VanDerWaalsContact NE2-CG 3.31Å; H161-M172 WeakPolarHBondContact NE2-CG 3.44Å; H161-M172 WeakPolarHBondContact O-CE 3.48Å; Y164-M172 HydrophobicContact CG-CE 4.11Å; L165-M172 HydrophobicContact CD2-CE 4.3Å; L165-M172 HydrophobicContact CD2-CG 4.32Å; L165-M172 HydrophobicContact CG-CE 4.14Å; M172-A174 VanDerWaalsContact C-N 3.34Å; M172-L175 HydrophobicContact SD-CD2 4.3Å; M172-P176 WeakPolarHBondContact O-CD 3.47Å
173	S	93.8	Very high	93.4	Very high	93 Å²	93	47.3 Å²	47.3	65%	0.65	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-26.8	175.3	52.8	0	0	0	0	113.5	P171 Y177	P171-S173 PolarHBondContact O-N 3.43Å; P171-S173 VanDerWaalsContact O-N 3.13Å; S173-Y177 WeakPolarHBondContact O-CD2 3.47Å; S173-Y177 WeakPolarHBondContact O-CE2 3.43Å
174	A	94.4	Very high	93.4	Very high	33 Å²	33	47.4 Å²	47.4	27%	0.273	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-22.8	177.4	0	0	0	0	0	112.4	P171 M172 P176 Y177 C178	P171-A174 HydrophobicContact CG-CB 3.78Å; P171-A174 PolarHBondContact O-N 3.3Å; M172-A174 VanDerWaalsContact C-N 3.34Å; A174-P176 VanDerWaalsContact C-CD 3.43Å; A174-Y177 PolarHBondContact O-N 3.46Å; A174-C178 PolarHBondContact O-N 3.33Å; A174-C178 VanDerWaalsContact O-N 3.11Å; A174-C178 PolarHBondContact O-SG 3.32Å
175	L	93.3	Very high	93.3	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-52.9	-41.6	-174.8	-166.2	72.5	0	0	0	114.6	L53 Y164 I170 P171 M172 Y177 C178	L53-L175 HydrophobicContact CG-CD2 4.47Å; Y164-L175 HydrophobicContact CD1-CD1 3.73Å; Y164-L175 HydrophobicContact CE1-CD1 3.41Å; Y164-L175 VanDerWaalsContact CE1-CD1 3.41Å; I170-L175 HydrophobicContact CG2-CD1 4.13Å; P171-L175 PolarHBondContact O-N 2.99Å; M172-L175 HydrophobicContact SD-CD2 4.3Å; L175-Y177 PolarHBondContact O-N 2.96Å; L175-C178 PolarHBondContact O-N 2.92Å
176	P	94.1	Very high	93.2	Very high	55 Å²	55	52.3 Å²	52.3	36%	0.357	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-65.8	-18.3	177.9	-21.1	34.2	0	0	0	114.5	N57 M172 A174	N57-P176 HydrophobicContact CB-CB 4.15Å; N57-P176 HydrophobicContact CB-CG 4.11Å; M172-P176 WeakPolarHBondContact O-CD 3.47Å; A174-P176 VanDerWaalsContact C-CD 3.43Å
177	Y	92.1	Very high	93.2	Very high	153 Å²	153	46 Å²	46	60%	0.6	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-102.4	-15.1	-177.5	-53.1	-67.2	0	0	0	112.1	S173 A174 L175 Q692	S173-Y177 WeakPolarHBondContact O-CD2 3.47Å; S173-Y177 WeakPolarHBondContact O-CE2 3.43Å; A174-Y177 PolarHBondContact O-N 3.46Å; L175-Y177 PolarHBondContact O-N 2.96Å; Y177-Q692 VanDerWaalsContact O-CD 3.27Å; Y177-Q692 PolarHBondContact O-NE2 2.93Å
178	C	92.3	Very high	93.2	Very high	26 Å²	26	47.4 Å²	47.4	18%	0.176	25%	0.248	C	C	.	.	S	Bend	trans	-76.3	139.6	173.9	-71.3	0	0	0	0	110.7	H54 A174 L175 V183	H54-C178 PolarHBondContact NE2-O 3.49Å; H54-C178 VanDerWaalsContact NE2-O 3.11Å; A174-C178 PolarHBondContact O-N 3.33Å; A174-C178 VanDerWaalsContact O-N 3.11Å; A174-C178 PolarHBondContact O-SG 3.32Å; L175-C178 PolarHBondContact O-N 2.92Å; C178-V183 HydrophobicContact CB-CG2 4.34Å
179	T	92.6	Very high	92.9	Very high	29 Å²	29	52.7 Å²	52.7	18%	0.178	27%	0.273	C	S	.	.			trans	-79.8	154.4	170.6	61.1	0	0	0	0	111.1	Q181 E182 V183 S695	T179-Q181 PolarHBondContact O-N 3.35Å; T179-E182 PolarHBondContact N-OE1 3.08Å; T179-E182 PolarHBondContact O-N 3.41Å; T179-E182 VanDerWaalsContact O-N 3.15Å; T179-E182 VanDerWaalsContact OG1-CD 3.32Å; T179-E182 WeakPolarHBondContact OG1-CG 3.25Å; T179-E182 PolarHBondContact OG1-N 2.86Å; T179-E182 PolarHBondContact OG1-OE1 3.26Å; T179-V183 PolarHBondContact O-N 3.07Å; T179-S695 WeakPolarHBondContact CG2-OG 3.36Å; T179-S695 PolarHBondContact OG1-OG 3.4Å; T179-S695 VanDerWaalsContact OG1-OG 3.11Å
180	W	94.4	Very high	92.6	Very high	6 Å²	6	45.6 Å²	45.6	2%	0.023	25%	0.247	C	C	.	.	H	α-helix	trans	-59.4	-34.3	175.8	174.7	-107.5	0	0	0	111.9	V50 Y51 H54 E182 V183 Q184 I187 I208 I212 L346 H348	V50-W180 HydrophobicContact CG1-CH2 4.37Å; V50-W180 HydrophobicContact CG1-CZ3 4.42Å; Y51-W180 AromaticContact CD2-CD2 3.81Å; Y51-W180 HydrophobicContact CD2-CD2 3.81Å; Y51-W180 AromaticContact CD2-CE2 3.84Å; Y51-W180 AromaticContact CD2-CE3 3.8Å; Y51-W180 HydrophobicContact CD2-CE3 3.8Å; Y51-W180 AromaticContact CD2-CH2 3.85Å; Y51-W180 HydrophobicContact CD2-CH2 3.85Å; Y51-W180 AromaticContact CD2-CZ2 3.86Å; Y51-W180 HydrophobicContact CD2-CZ2 3.86Å; Y51-W180 AromaticContact CD2-CZ3 3.83Å; Y51-W180 HydrophobicContact CD2-CZ3 3.83Å; Y51-W180 HydrophobicContact CE2-CD2 4.23Å; Y51-W180 HydrophobicContact CE2-CE3 4.49Å; Y51-W180 HydrophobicContact CG-CH2 4.31Å; Y51-W180 HydrophobicContact CG-CZ3 4.42Å; H54-W180 HydrophobicContact CB-CE3 4.23Å; H54-W180 HydrophobicContact CB-CZ3 4.34Å; H54-W180 AromaticContact CG-CE3 3.98Å; H54-W180 AromaticContact ND1-CE3 3.96Å; H54-W180 PolarHBondContact NE2-N 3Å; W180-E182 VanDerWaalsContact C-N 3.34Å; W180-E182 PolarHBondContact O-N 2.76Å; W180-V183 HydrophobicContact CE3-CB 4.14Å; W180-V183 HydrophobicContact CE3-CG1 4.05Å; W180-V183 HydrophobicContact CZ3-CB 4.4Å; W180-V183 HydrophobicContact CZ3-CG1 3.81Å; W180-V183 PolarHBondContact O-N 3.45Å; W180-Q184 WeakPolarHBondContact O-CB 3.04Å; W180-Q184 PolarHBondContact O-N 2.95Å; W180-I187 HydrophobicContact CH2-CD1 4.42Å; W180-I208 HydrophobicContact CZ2-CG2 4.29Å; W180-I212 HydrophobicContact CH2-CD1 4.23Å; W180-I212 HydrophobicContact CZ2-CD1 3.79Å; W180-L346 VanDerWaalsContact CD1-CD1 3.43Å; W180-L346 HydrophobicContact CG-CD1 4.3Å; W180-H348 AromaticContact CD1-CE1 3.99Å; W180-H348 AromaticContact CG-CE1 3.99Å
181	Q	91.7	Very high	92.1	Very high	59 Å²	59	45.2 Å²	45.2	28%	0.276	25%	0.245	S	C	.	.	H	α-helix	trans	-60.2	-42.1	177.2	-66.2	-62.3	-31.1	0	0	112	T179 Q184 A185 Y209 N564	T179-Q181 PolarHBondContact O-N 3.35Å; Q181-Q184 PolarHBondContact O-N 2.98Å; Q181-A185 WeakPolarHBondContact O-CB 3.31Å; Q181-A185 PolarHBondContact O-N 3.01Å; Q181-Y209 PolarHBondContact NE2-OH 3.29Å; Q181-N564 PolarHBondContact NE2-OD1 2.89Å; Q181-N564 VanDerWaalsContact NE2-OD1 3.14Å; Q181-N564 PolarHBondContact OE1-OD1 3.45Å
182	E	91.9	Very high	91.4	Very high	65 Å²	65	49.4 Å²	49.4	30%	0.304	26%	0.256	S	S	.	.	H	α-helix	trans	-64.7	-44	173.8	-71.7	160.2	-125.7	0	0	112	T179 W180 Q184 A185 R186	T179-E182 PolarHBondContact N-OE1 3.08Å; T179-E182 PolarHBondContact O-N 3.41Å; T179-E182 VanDerWaalsContact O-N 3.15Å; T179-E182 VanDerWaalsContact OG1-CD 3.32Å; T179-E182 WeakPolarHBondContact OG1-CG 3.25Å; T179-E182 PolarHBondContact OG1-N 2.86Å; T179-E182 PolarHBondContact OG1-OE1 3.26Å; W180-E182 VanDerWaalsContact C-N 3.34Å; W180-E182 PolarHBondContact O-N 2.76Å; E182-Q184 VanDerWaalsContact C-N 3.35Å; E182-Q184 PolarHBondContact O-N 2.96Å; E182-A185 PolarHBondContact O-N 3.45Å; E182-R186 VanDerWaalsContact O-CG 3.27Å; E182-R186 WeakPolarHBondContact O-CG 3.19Å; E182-R186 PolarHBondContact O-N 2.99Å
183	V	94.8	Very high	90.7	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.8	-45	177.8	174.6	0	0	0	0	110.6	Y164 L168 I170 C178 T179 W180 R186 I187	Y164-V183 HydrophobicContact CE1-CG1 3.87Å; Y164-V183 HydrophobicContact CE1-CG2 4.46Å; L168-V183 HydrophobicContact CD2-CG1 4.02Å; I170-V183 HydrophobicContact CD1-CG2 4.12Å; C178-V183 HydrophobicContact CB-CG2 4.34Å; T179-V183 PolarHBondContact O-N 3.07Å; W180-V183 HydrophobicContact CE3-CB 4.14Å; W180-V183 HydrophobicContact CE3-CG1 4.05Å; W180-V183 HydrophobicContact CZ3-CB 4.4Å; W180-V183 HydrophobicContact CZ3-CG1 3.81Å; W180-V183 PolarHBondContact O-N 3.45Å; V183-R186 WeakPolarHBondContact O-CB 3.29Å; V183-R186 PolarHBondContact O-N 3.24Å; V183-I187 HydrophobicContact CG1-CD1 4.04Å; V183-I187 VanDerWaalsContact O-CG1 3.3Å; V183-I187 WeakPolarHBondContact O-CG1 3.27Å; V183-I187 PolarHBondContact O-N 3.2Å
184	Q	93.9	Very high	89.6	Confident	1 Å²	1	50 Å²	50	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-46.1	177.3	-178.9	170.3	23.4	0	0	111.9	W180 Q181 E182 R186 I187 V188 E205 I208	W180-Q184 WeakPolarHBondContact O-CB 3.04Å; W180-Q184 PolarHBondContact O-N 2.95Å; Q181-Q184 PolarHBondContact O-N 2.98Å; E182-Q184 VanDerWaalsContact C-N 3.35Å; E182-Q184 PolarHBondContact O-N 2.96Å; Q184-R186 VanDerWaalsContact C-N 3.27Å; Q184-R186 PolarHBondContact O-N 2.94Å; Q184-I187 WeakPolarHBondContact O-CB 3.49Å; Q184-I187 PolarHBondContact O-N 3.5Å; Q184-I187 VanDerWaalsContact O-N 3.12Å; Q184-V188 WeakPolarHBondContact O-CG2 3.16Å; Q184-V188 PolarHBondContact O-N 3.42Å; Q184-E205 PolarHBondContact NE2-O 3.18Å; Q184-I208 HydrophobicContact CG-CD1 3.93Å
185	A	91.2	Very high	88.7	Confident	59 Å²	59	53.5 Å²	53.5	49%	0.488	26%	0.259	S	S	.	.	H	α-helix	trans	-59.4	-40	176.5	0	0	0	0	0	111.7	Q181 E182 V188 Q189	Q181-A185 WeakPolarHBondContact O-CB 3.31Å; Q181-A185 PolarHBondContact O-N 3.01Å; E182-A185 PolarHBondContact O-N 3.45Å; A185-V188 PolarHBondContact O-N 3.26Å; A185-Q189 WeakPolarHBondContact O-CB 3.37Å; A185-Q189 PolarHBondContact O-N 3.17Å
186	R	92.3	Very high	88	Confident	110 Å²	110	53.6 Å²	53.6	42%	0.415	26%	0.26	S	S	.	.	H	α-helix	trans	-63	-44.3	173.4	-70.5	-68.6	-171.4	123.4	0.1	111.9	L168 I170 E182 V183 Q184 V188 Q189 T190	L168-R186 HydrophobicContact CG-CB 4.26Å; L168-R186 PolarHBondContact O-NH1 2.75Å; I170-R186 HydrophobicContact CD1-CG 4.38Å; E182-R186 VanDerWaalsContact O-CG 3.27Å; E182-R186 WeakPolarHBondContact O-CG 3.19Å; E182-R186 PolarHBondContact O-N 2.99Å; V183-R186 WeakPolarHBondContact O-CB 3.29Å; V183-R186 PolarHBondContact O-N 3.24Å; Q184-R186 VanDerWaalsContact C-N 3.27Å; Q184-R186 PolarHBondContact O-N 2.94Å; R186-V188 VanDerWaalsContact C-N 3.35Å; R186-V188 PolarHBondContact O-N 2.91Å; R186-Q189 PolarHBondContact O-N 3.22Å; R186-T190 VanDerWaalsContact O-CB 3.28Å; R186-T190 WeakPolarHBondContact O-CB 3.2Å; R186-T190 PolarHBondContact O-N 3.34Å; R186-T190 PolarHBondContact O-OG1 3.38Å
187	I	92.4	Very high	87.1	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-58.3	-47.4	176.6	-68.6	165	0	0	0	111	F47 V50 L168 W180 V183 Q184 Q189 T190 Q191 L203 I208	F47-I187 HydrophobicContact CE1-CG2 3.8Å; V50-I187 HydrophobicContact CG1-CD1 3.76Å; L168-I187 HydrophobicContact CD1-CG1 4.35Å; L168-I187 HydrophobicContact CD2-CG1 3.93Å; L168-I187 HydrophobicContact CG-CG1 4.39Å; W180-I187 HydrophobicContact CH2-CD1 4.42Å; V183-I187 HydrophobicContact CG1-CD1 4.04Å; V183-I187 VanDerWaalsContact O-CG1 3.3Å; V183-I187 WeakPolarHBondContact O-CG1 3.27Å; V183-I187 PolarHBondContact O-N 3.2Å; Q184-I187 WeakPolarHBondContact O-CB 3.49Å; Q184-I187 PolarHBondContact O-N 3.5Å; Q184-I187 VanDerWaalsContact O-N 3.12Å; I187-Q189 VanDerWaalsContact C-N 3.32Å; I187-Q189 PolarHBondContact O-N 3.39Å; I187-T190 PolarHBondContact O-N 2.88Å; I187-Q191 PolarHBondContact O-N 2.9Å; I187-L203 HydrophobicContact CG2-CD2 4.33Å; I187-I208 HydrophobicContact CB-CD1 4.42Å; I187-I208 HydrophobicContact CG2-CD1 3.87Å
188	V	90.5	Very high	86	Confident	31 Å²	31	48 Å²	48	19%	0.188	24%	0.237	C	C	.	.	H	α-helix	trans	-62.9	-38.8	178.9	172.6	0	0	0	0	111.4	Q184 A185 R186 L203 I208	Q184-V188 WeakPolarHBondContact O-CG2 3.16Å; Q184-V188 PolarHBondContact O-N 3.42Å; A185-V188 PolarHBondContact O-N 3.26Å; R186-V188 VanDerWaalsContact C-N 3.35Å; R186-V188 PolarHBondContact O-N 2.91Å; V188-L203 WeakPolarHBondContact CG1-O 3.28Å; V188-I208 HydrophobicContact CG2-CD1 3.86Å
189	Q	88.4	Confident	84.7	Confident	113 Å²	113	54 Å²	54	53%	0.528	26%	0.262	S	S	.	.	H	α-helix	trans	-68.7	-45.4	175.3	-174.5	177.4	5.1	0	0	112.2	A185 R186 I187 Q191 K192	A185-Q189 WeakPolarHBondContact O-CB 3.37Å; A185-Q189 PolarHBondContact O-N 3.17Å; R186-Q189 PolarHBondContact O-N 3.22Å; I187-Q189 VanDerWaalsContact C-N 3.32Å; I187-Q189 PolarHBondContact O-N 3.39Å; Q189-Q191 PolarHBondContact O-N 3.41Å; Q189-K192 WeakPolarHBondContact O-CB 3.39Å; Q189-K192 PolarHBondContact O-N 3.01Å; Q189-K192 VanDerWaalsContact O-N 3.12Å
190	T	86.4	Confident	83.7	Confident	8 Å²	8	55.5 Å²	55.5	5%	0.049	27%	0.266	C	S	.	.	H	α-helix	trans	-63.6	-28.7	-179.5	-63.2	0	0	0	0	111.9	A167 R186 I187 K192 E193 H194	A167-T190 HydrophobicContact CB-CG2 4.05Å; A167-T190 PolarHBondContact O-OG1 3.38Å; R186-T190 VanDerWaalsContact O-CB 3.28Å; R186-T190 WeakPolarHBondContact O-CB 3.2Å; R186-T190 PolarHBondContact O-N 3.34Å; R186-T190 PolarHBondContact O-OG1 3.38Å; I187-T190 PolarHBondContact O-N 2.88Å; T190-K192 PolarHBondContact O-N 3.18Å; T190-K192 VanDerWaalsContact O-N 3.12Å; T190-E193 PolarHBondContact O-N 3.02Å; T190-H194 HydrophobicContact CG2-CB 4.42Å; T190-H194 PolarHBondContact O-N 2.78Å
191	Q	83.9	Confident	82.4	Confident	3 Å²	3	66.3 Å²	66.3	1%	0.014	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-26.8	173.6	175.8	66.7	17.6	0	0	113.1	I187 Q189 H194 I196 C197 K200 L203	I187-Q191 PolarHBondContact O-N 2.9Å; Q189-Q191 PolarHBondContact O-N 3.41Å; Q191-H194 CarbonylContact C-O 3.55Å; Q191-H194 VanDerWaalsContact CA-O 3.31Å; Q191-H194 WeakPolarHBondContact CA-O 3.22Å; Q191-H194 VanDerWaalsContact O-O 3.1Å; Q191-I196 VanDerWaalsContact OE1-CB 3.3Å; Q191-I196 VanDerWaalsContact OE1-N 3.12Å; Q191-C197 PolarHBondContact NE2-O 2.87Å; Q191-C197 VanDerWaalsContact OE1-N 3.15Å; Q191-K200 PolarHBondContact NE2-O 2.85Å; Q191-L203 HydrophobicContact CB-CB 4.39Å; Q191-L203 HydrophobicContact CG-CB 3.9Å
192	K	80.3	Confident	81.8	Confident	151 Å²	151	69.6 Å²	69.6	66%	0.657	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-28.6	175.9	-60.9	-177.9	178.3	-177	0	112.6	Q189 T190	Q189-K192 WeakPolarHBondContact O-CB 3.39Å; Q189-K192 PolarHBondContact O-N 3.01Å; Q189-K192 VanDerWaalsContact O-N 3.12Å; T190-K192 PolarHBondContact O-N 3.18Å; T190-K192 VanDerWaalsContact O-N 3.12Å
193	E	79.3	Confident	81.5	Confident	106 Å²	106	66.9 Å²	66.9	50%	0.495	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-44.1	-179.6	-63.1	-177.6	-169.7	0	0	111.4	R169 T190	R169-E193 IonicContact CZ-OE2 3.62Å; R169-E193 IonicContact NH2-OE2 3.38Å; R169-E193 PolarHBondContact NH2-OE2 3.06Å; T190-E193 PolarHBondContact O-N 3.02Å
194	H	72.1	Confident	81.2	Confident	39 Å²	39	69 Å²	69	18%	0.181	32%	0.323	C	S	.	.	S	Bend	trans	-116.7	113.3	178.4	-60	-80.3	0	0	0	108.2	S35 T190 Q191 I196	S35-H194 WeakPolarHBondContact CB-ND1 3.35Å; S35-H194 PolarHBondContact OG-ND1 2.82Å; T190-H194 HydrophobicContact CG2-CB 4.42Å; T190-H194 PolarHBondContact O-N 2.78Å; Q191-H194 CarbonylContact C-O 3.55Å; Q191-H194 VanDerWaalsContact CA-O 3.31Å; Q191-H194 WeakPolarHBondContact CA-O 3.22Å; Q191-H194 VanDerWaalsContact O-O 3.1Å; H194-I196 HydrophobicContact CB-CG1 4.31Å; H194-I196 PolarHBondContact O-N 3.49Å
195	Q	75.6	Confident	81.1	Confident	108 Å²	108	71 Å²	71	51%	0.505	33%	0.332	S	S	.	.			trans	-71.8	79.1	176.9	-69.3	-174.1	-9.8	0	0	110.8
196	I	76.6	Confident	81.2	Confident	2 Å²	2	69 Å²	69	1%	0.01	31%	0.313	C	S	.	.	S	Bend	trans	-70.3	-43	-179.8	-56.3	158.9	0	0	0	109.4	I40 L43 F46 F163 Q191 H194	I40-I196 HydrophobicContact CD1-CG2 3.77Å; I40-I196 HydrophobicContact CG1-CG2 4.25Å; L43-I196 HydrophobicContact CD2-CG2 3.77Å; F46-I196 HydrophobicContact CE1-CG2 4.22Å; F163-I196 HydrophobicContact CE2-CD1 3.76Å; F163-I196 HydrophobicContact CE2-CG1 4.5Å; F163-I196 HydrophobicContact CZ-CD1 3.84Å; Q191-I196 VanDerWaalsContact OE1-CB 3.3Å; Q191-I196 VanDerWaalsContact OE1-N 3.12Å; H194-I196 HydrophobicContact CB-CG1 4.31Å; H194-I196 PolarHBondContact O-N 3.49Å
197	C	76.3	Confident	81.2	Confident	7 Å²	7	64 Å²	64	5%	0.047	30%	0.295	C	S	.	.			trans	-99.9	123.1	168.7	-171.6	0	0	0	0	111.1	L43 Q191	L43-C197 HydrophobicContact CD1-CB 4.01Å; Q191-C197 PolarHBondContact NE2-O 2.87Å; Q191-C197 VanDerWaalsContact OE1-N 3.15Å
198	I	68.8	Low	81.3	Confident	83 Å²	83	64 Å²	64	43%	0.426	30%	0.295	S	S	.	.	S	Bend	trans	-79.7	-41.4	176.3	-63.9	-168.6	0	0	0	111.6	H39 K200	H39-I198 HydrophobicContact CB-CD1 3.75Å; H39-I198 HydrophobicContact CB-CG1 4.26Å; H39-I198 WeakPolarHBondContact CD2-CD1 3.44Å; I198-K200 PolarHBondContact O-N 2.93Å; I198-K200 VanDerWaalsContact O-N 3.15Å
199	H	64.4	Low	81.6	Confident	152 Å²	152	62.6 Å²	62.6	70%	0.704	29%	0.286	S	S	*	.	S	Bend	trans	-70	-17	-168.3	-62.9	-171.8	0	0	0	113
200	K	72.4	Confident	81.9	Confident	61 Å²	61	57.2 Å²	57.2	27%	0.265	26%	0.261	S	S	.	.			trans	-134.1	123.3	-179.1	-154.8	178.4	177.8	176.1	0	110.1	Q191 I198 E202 D207	Q191-K200 PolarHBondContact NE2-O 2.85Å; I198-K200 PolarHBondContact O-N 2.93Å; I198-K200 VanDerWaalsContact O-N 3.15Å; K200-E202 VanDerWaalsContact C-N 3.27Å; K200-E202 VanDerWaalsContact CD-O 3.24Å; K200-E202 WeakPolarHBondContact CD-O 3.39Å; K200-E202 VanDerWaalsContact CE-O 3.31Å; K200-E202 WeakPolarHBondContact CE-O 3.3Å; K200-E202 VanDerWaalsContact CG-O 3.26Å; K200-E202 WeakPolarHBondContact CG-O 3.41Å; K200-E202 PolarHBondContact O-N 2.78Å; K200-D207 VanDerWaalsContact NZ-CG 3.3Å; K200-D207 IonicContact NZ-OD1 2.78Å; K200-D207 PolarHBondContact NZ-OD1 3.41Å; K200-D207 VanDerWaalsContact NZ-OD1 3.08Å; K200-D207 IonicContact NZ-OD2 3.63Å; K200-D207 PolarHBondContact NZ-OD2 2.96Å
201	R	67.1	Low	82.3	Confident	233 Å²	233	57.5 Å²	57.5	88%	0.879	26%	0.261	S	S	*	.	S	Bend	trans	-62.6	-33.6	179.5	-77.7	-175.6	161.9	-175.9	-4.7	112.9
202	E	79.4	Confident	82.9	Confident	128 Å²	128	58.5 Å²	58.5	60%	0.598	27%	0.266	S	S	*	.	S	Bend	trans	-129.7	125.6	177.9	-62.2	-171.1	153	0	0	109.7	K200	K200-E202 VanDerWaalsContact C-N 3.27Å; K200-E202 VanDerWaalsContact CD-O 3.24Å; K200-E202 WeakPolarHBondContact CD-O 3.39Å; K200-E202 VanDerWaalsContact CE-O 3.31Å; K200-E202 WeakPolarHBondContact CE-O 3.3Å; K200-E202 VanDerWaalsContact CG-O 3.26Å; K200-E202 WeakPolarHBondContact CG-O 3.41Å; K200-E202 PolarHBondContact O-N 2.78Å
203	L	85.6	Confident	83.7	Confident	8 Å²	8	51.7 Å²	51.7	4%	0.042	24%	0.237	C	C	.	.			trans	-85.2	130.9	175	-170.3	69.1	0	0	0	108.5	F47 I187 V188 Q191 D207 I208	F47-L203 HydrophobicContact CE1-CD2 4.32Å; F47-L203 HydrophobicContact CE2-CD2 4.37Å; F47-L203 HydrophobicContact CZ-CD2 3.66Å; I187-L203 HydrophobicContact CG2-CD2 4.33Å; V188-L203 WeakPolarHBondContact CG1-O 3.28Å; Q191-L203 HydrophobicContact CB-CB 4.39Å; Q191-L203 HydrophobicContact CG-CB 3.9Å; L203-D207 HydrophobicContact CD1-CB 3.57Å; L203-D207 HydrophobicContact CG-CB 4.33Å; L203-I208 HydrophobicContact CD2-CD1 3.87Å; L203-I208 HydrophobicContact CD2-CG1 3.61Å; L203-I208 HydrophobicContact CG-CD1 4.44Å; L203-I208 HydrophobicContact CG-CG1 4.06Å
204	T	89.2	Confident	84.6	Confident	46 Å²	46	46.9 Å²	46.9	28%	0.282	21%	0.214	S	C	.	.			trans	-92.8	160.2	174.1	64.1	0	0	0	0	110.6	L206 D207	T204-L206 VanDerWaalsContact C-N 3.26Å; T204-L206 PolarHBondContact O-N 2.84Å; T204-D207 WeakPolarHBondContact CB-OD2 3.25Å; T204-D207 PolarHBondContact N-OD2 3.3Å; T204-D207 PolarHBondContact O-N 3Å; T204-D207 PolarHBondContact OG1-N 3.03Å; T204-D207 PolarHBondContact OG1-OD1 3.06Å; T204-D207 PolarHBondContact OG1-OD2 3.25Å
205	E	91.2	Very high	85.7	Confident	41 Å²	41	46.1 Å²	46.1	19%	0.192	21%	0.21	C	C	.	.	H	α-helix	trans	-56	-47	174.8	-60.6	85.4	173.4	0	0	110.1	Q184 D207 I208 Y209	Q184-E205 PolarHBondContact NE2-O 3.18Å; E205-D207 VanDerWaalsContact C-N 3.29Å; E205-D207 PolarHBondContact O-N 3.36Å; E205-I208 WeakPolarHBondContact O-CB 3.45Å; E205-I208 PolarHBondContact O-N 3.02Å; E205-Y209 VanDerWaalsContact O-CD2 3.3Å; E205-Y209 WeakPolarHBondContact O-CD2 3.28Å; E205-Y209 PolarHBondContact O-N 2.89Å
206	L	93.2	Very high	86.7	Confident	18 Å²	18	42.9 Å²	42.9	9%	0.094	20%	0.195	C	C	.	.	H	α-helix	trans	-57.3	-38.1	179.8	-175.7	63.6	0	0	0	113.1	T204 I208 Y209 H210 N344 F560 W567	T204-L206 VanDerWaalsContact C-N 3.26Å; T204-L206 PolarHBondContact O-N 2.84Å; L206-I208 VanDerWaalsContact C-N 3.28Å; L206-I208 PolarHBondContact O-N 2.88Å; L206-Y209 PolarHBondContact O-N 2.86Å; L206-H210 PolarHBondContact O-N 3.26Å; L206-N344 WeakPolarHBondContact CD1-ND2 3.48Å; L206-F560 HydrophobicContact CB-CE1 4.18Å; L206-F560 HydrophobicContact CB-CZ 4.08Å; L206-F560 HydrophobicContact CD1-CD1 4.48Å; L206-F560 HydrophobicContact CD1-CE1 3.81Å; L206-F560 HydrophobicContact CD1-CE2 4.17Å; L206-F560 HydrophobicContact CD1-CZ 3.64Å; L206-F560 HydrophobicContact CG-CZ 4.49Å; L206-W567 HydrophobicContact CD2-CZ2 3.99Å
207	D	92.6	Very high	87.7	Confident	6 Å²	6	43 Å²	43	3%	0.032	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-41	176.9	-59.3	-44.9	0	0	0	110.8	K200 L203 T204 E205 H210 R211 V515	K200-D207 VanDerWaalsContact NZ-CG 3.3Å; K200-D207 IonicContact NZ-OD1 2.78Å; K200-D207 PolarHBondContact NZ-OD1 3.41Å; K200-D207 VanDerWaalsContact NZ-OD1 3.08Å; K200-D207 IonicContact NZ-OD2 3.63Å; K200-D207 PolarHBondContact NZ-OD2 2.96Å; L203-D207 HydrophobicContact CD1-CB 3.57Å; L203-D207 HydrophobicContact CG-CB 4.33Å; T204-D207 WeakPolarHBondContact CB-OD2 3.25Å; T204-D207 PolarHBondContact N-OD2 3.3Å; T204-D207 PolarHBondContact O-N 3Å; T204-D207 PolarHBondContact OG1-N 3.03Å; T204-D207 PolarHBondContact OG1-OD1 3.06Å; T204-D207 PolarHBondContact OG1-OD2 3.25Å; E205-D207 VanDerWaalsContact C-N 3.29Å; E205-D207 PolarHBondContact O-N 3.36Å; D207-H210 PolarHBondContact O-N 3.37Å; D207-R211 VanDerWaalsContact O-CG 3.22Å; D207-R211 WeakPolarHBondContact O-CG 3.3Å; D207-R211 PolarHBondContact O-N 2.96Å; D207-R211 VanDerWaalsContact O-N 3.09Å; D207-V515 HydrophobicContact CB-CG2 3.92Å
208	I	94.1	Very high	88.7	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.5	-43.2	177.8	-61.1	168.2	0	0	0	110.1	F47 W180 Q184 I187 V188 L203 E205 L206 R211 I212	F47-I208 HydrophobicContact CD1-CG2 4.39Å; F47-I208 HydrophobicContact CG-CG2 4.47Å; W180-I208 HydrophobicContact CZ2-CG2 4.29Å; Q184-I208 HydrophobicContact CG-CD1 3.93Å; I187-I208 HydrophobicContact CB-CD1 4.42Å; I187-I208 HydrophobicContact CG2-CD1 3.87Å; V188-I208 HydrophobicContact CG2-CD1 3.86Å; L203-I208 HydrophobicContact CD2-CD1 3.87Å; L203-I208 HydrophobicContact CD2-CG1 3.61Å; L203-I208 HydrophobicContact CG-CD1 4.44Å; L203-I208 HydrophobicContact CG-CG1 4.06Å; E205-I208 WeakPolarHBondContact O-CB 3.45Å; E205-I208 PolarHBondContact O-N 3.02Å; L206-I208 VanDerWaalsContact C-N 3.28Å; L206-I208 PolarHBondContact O-N 2.88Å; I208-R211 PolarHBondContact O-N 3.08Å; I208-I212 HydrophobicContact CG2-CD1 3.68Å; I208-I212 HydrophobicContact CG2-CG1 4.43Å; I208-I212 WeakPolarHBondContact O-CG1 3.15Å; I208-I212 PolarHBondContact O-N 3.37Å
209	Y	96.3	Very high	90.1	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	17%	0.173	C	C	.	.	H	α-helix	trans	-63.7	-44.8	176.5	-79.6	-102.1	0	0	0	112	Q181 E205 L206 R211 I212 L213 N344 L346 E349 F560 N564	Q181-Y209 PolarHBondContact NE2-OH 3.29Å; E205-Y209 VanDerWaalsContact O-CD2 3.3Å; E205-Y209 WeakPolarHBondContact O-CD2 3.28Å; E205-Y209 PolarHBondContact O-N 2.89Å; L206-Y209 PolarHBondContact O-N 2.86Å; Y209-R211 PolarHBondContact O-N 3.3Å; Y209-I212 PolarHBondContact O-N 3.22Å; Y209-L213 HydrophobicContact CD1-CD1 3.93Å; Y209-L213 VanDerWaalsContact O-CB 3.25Å; Y209-L213 WeakPolarHBondContact O-CB 3.45Å; Y209-L213 PolarHBondContact O-N 2.92Å; Y209-N344 HydrophobicContact CD1-CB 4.34Å; Y209-N344 WeakPolarHBondContact CD1-O 3.09Å; Y209-N344 WeakPolarHBondContact CE1-O 3.37Å; Y209-L346 HydrophobicContact CD1-CD1 4.08Å; Y209-L346 HydrophobicContact CD1-CD2 4.3Å; Y209-L346 HydrophobicContact CD1-CG 3.8Å; Y209-L346 HydrophobicContact CE1-CB 4.5Å; Y209-L346 HydrophobicContact CE1-CD1 3.44Å; Y209-L346 VanDerWaalsContact CE1-CD1 3.44Å; Y209-L346 HydrophobicContact CE1-CD2 4.4Å; Y209-L346 HydrophobicContact CE1-CG 3.47Å; Y209-L346 VanDerWaalsContact CE1-CG 3.47Å; Y209-E349 PolarHBondContact OH-OE1 3.3Å; Y209-E349 VanDerWaalsContact OH-OE1 3.08Å; Y209-F560 AromaticContact CD1-CE2 3.82Å; Y209-F560 HydrophobicContact CD1-CE2 3.82Å; Y209-F560 AromaticContact CD2-CE2 3.6Å; Y209-F560 HydrophobicContact CD2-CE2 3.6Å; Y209-F560 AromaticContact CD2-CZ 3.83Å; Y209-F560 HydrophobicContact CD2-CZ 3.83Å; Y209-F560 AromaticContact CE1-CE2 3.96Å; Y209-F560 HydrophobicContact CE1-CE2 3.96Å; Y209-F560 AromaticContact CE2-CE2 3.76Å; Y209-F560 HydrophobicContact CE2-CE2 3.76Å; Y209-F560 HydrophobicContact CE2-CZ 4.07Å; Y209-F560 AromaticContact CG-CE2 3.64Å; Y209-F560 HydrophobicContact CG-CE2 3.64Å; Y209-F560 HydrophobicContact CG-CZ 4.23Å; Y209-F560 AromaticContact CZ-CE2 3.96Å; Y209-N564 WeakPolarHBondContact CE2-OD1 3.46Å; Y209-N564 PolarHBondContact OH-ND2 2.96Å; Y209-N564 PolarHBondContact OH-OD1 3.28Å
210	H	95.6	Very high	91.7	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-59.7	-37	177.8	-76	160.3	0	0	0	112	L206 D207 R214 N344 V515 T518 A522 Q523	L206-H210 PolarHBondContact O-N 3.26Å; D207-H210 PolarHBondContact O-N 3.37Å; H210-R214 WeakPolarHBondContact O-CA 3.46Å; H210-R214 WeakPolarHBondContact O-CB 3.23Å; H210-R214 PolarHBondContact O-N 3.34Å; H210-N344 PolarHBondContact CD2-OD1 2.75Å; H210-N344 VanDerWaalsContact CD2-OD1 3.26Å; H210-V515 HydrophobicContact CB-CG1 3.83Å; H210-T518 HydrophobicContact CB-CG2 4.19Å; H210-A522 PolarHBondContact NE2-O 3.11Å; H210-Q523 PolarHBondContact CE1-NE2 3.29Å
211	R	94.9	Very high	92.8	Very high	14 Å²	14	28.7 Å²	28.7	5%	0.053	13%	0.128	C	C	.	.	H	α-helix	trans	-70.3	-44.4	177.6	-68.4	-177.2	-176	-75.2	7.1	113.2	D44 F47 D207 I208 Y209 G514 V515	D44-R211 WeakPolarHBondContact OD1-CB 3.34Å; D44-R211 WeakPolarHBondContact OD1-CG 3.43Å; D44-R211 IonicContact OD1-NH1 2.74Å; D44-R211 PolarHBondContact OD1-NH1 3.44Å; D44-R211 VanDerWaalsContact OD1-NH1 3.15Å; F47-R211 HydrophobicContact CD2-CB 4.08Å; F47-R211 HydrophobicContact CD2-CG 4.35Å; D207-R211 VanDerWaalsContact O-CG 3.22Å; D207-R211 WeakPolarHBondContact O-CG 3.3Å; D207-R211 PolarHBondContact O-N 2.96Å; D207-R211 VanDerWaalsContact O-N 3.09Å; I208-R211 PolarHBondContact O-N 3.08Å; Y209-R211 PolarHBondContact O-N 3.3Å; R211-G514 PolarHBondContact NH2-O 3.48Å; R211-V515 HydrophobicContact CG-CG1 4.17Å
212	I	96.6	Very high	94.2	Very high	24 Å²	24	17.6 Å²	17.6	12%	0.123	9%	0.086	C	C	.	.	H	α-helix	trans	-69.7	-38.3	179	-63.2	166.7	0	0	0	111	F47 Y51 W180 I208 Y209 L346	F47-I212 HydrophobicContact CB-CD1 4.39Å; F47-I212 HydrophobicContact CB-CG1 3.85Å; Y51-I212 HydrophobicContact CD1-CG2 4.22Å; Y51-I212 HydrophobicContact CG-CD1 4.31Å; Y51-I212 HydrophobicContact CG-CG2 4.38Å; W180-I212 HydrophobicContact CH2-CD1 4.23Å; W180-I212 HydrophobicContact CZ2-CD1 3.79Å; I208-I212 HydrophobicContact CG2-CD1 3.68Å; I208-I212 HydrophobicContact CG2-CG1 4.43Å; I208-I212 WeakPolarHBondContact O-CG1 3.15Å; I208-I212 PolarHBondContact O-N 3.37Å; Y209-I212 PolarHBondContact O-N 3.22Å; I212-L346 HydrophobicContact CB-CD2 4.38Å; I212-L346 HydrophobicContact CD1-CD2 4.28Å; I212-L346 HydrophobicContact CG2-CD2 3.81Å
213	L	97.2	Very high	95	Very high	7 Å²	7	11.7 Å²	11.7	4%	0.037	6%	0.059	C	C	.	.	H	α-helix	trans	-107.9	7.2	-166.7	-60.9	173.6	0	0	0	114.3	Y209 F215 Q216 N217 R341 N344 E345 L346	Y209-L213 HydrophobicContact CD1-CD1 3.93Å; Y209-L213 VanDerWaalsContact O-CB 3.25Å; Y209-L213 WeakPolarHBondContact O-CB 3.45Å; Y209-L213 PolarHBondContact O-N 2.92Å; L213-F215 PolarHBondContact O-N 3.37Å; L213-Q216 HydrophobicContact CD2-CB 4.39Å; L213-Q216 PolarHBondContact O-N 3.1Å; L213-N217 PolarHBondContact O-N 3.31Å; L213-N217 PolarHBondContact O-ND2 2.82Å; L213-R341 VanDerWaalsContact CD2-NH2 3.34Å; L213-N344 VanDerWaalsContact CD1-C 3.48Å; L213-E345 VanDerWaalsContact CD1-C 3.49Å; L213-E345 VanDerWaalsContact CD1-O 3.31Å; L213-E345 WeakPolarHBondContact CD1-O 3.4Å; L213-L346 HydrophobicContact CD1-CD2 3.95Å; L213-L346 HydrophobicContact CD1-CG 4.29Å; L213-L346 HydrophobicContact CD2-CD2 4.11Å; L213-L346 HydrophobicContact CG-CD2 4.04Å
214	R	96.6	Very high	95.4	Very high	5 Å²	5	11.7 Å²	11.7	2%	0.019	6%	0.059	C	C	.	.	H	α-helix	trans	-42.7	-58.4	-174.6	-169.9	-176.2	-59.5	-88.2	0.5	112.8	D44 H210 Y218 E266 W267 V515 D517	D44-R214 IonicContact OD1-NH2 3.57Å; D44-R214 PolarHBondContact OD1-NH2 2.95Å; D44-R214 IonicContact OD2-CZ 3.66Å; D44-R214 IonicContact OD2-NE 2.73Å; D44-R214 PolarHBondContact OD2-NE 3.43Å; D44-R214 IonicContact OD2-NH2 3.4Å; D44-R214 PolarHBondContact OD2-NH2 3.2Å; H210-R214 WeakPolarHBondContact O-CA 3.46Å; H210-R214 WeakPolarHBondContact O-CB 3.23Å; H210-R214 PolarHBondContact O-N 3.34Å; R214-Y218 HydrophobicContact CG-CE2 4.41Å; R214-Y218 VanDerWaalsContact O-CD2 3.25Å; R214-Y218 WeakPolarHBondContact O-CD2 3.45Å; R214-Y218 PolarHBondContact O-N 2.98Å; R214-E266 WeakPolarHBondContact CD-O 3.34Å; R214-W267 PolarHBondContact NH1-O 2.88Å; R214-V515 PolarHBondContact NH2-O 3.35Å; R214-D517 VanDerWaalsContact NH1-C 3.28Å; R214-D517 PolarHBondContact NH1-O 2.89Å
215	F	96.4	Very high	95.6	Very high	23 Å²	23	10.8 Å²	10.8	10%	0.101	5%	0.051	C	C	.	.	H	α-helix	trans	-76	-30.7	-177.9	-56.7	-40	0	0	0	113.2	L213 N217 Y218 M219 F256 F263 E266	L213-F215 PolarHBondContact O-N 3.37Å; F215-N217 VanDerWaalsContact C-N 3.33Å; F215-N217 PolarHBondContact O-N 3.23Å; F215-Y218 PolarHBondContact O-N 3.18Å; F215-M219 PolarHBondContact O-N 3.19Å; F215-F256 HydrophobicContact CB-CD1 4.42Å; F215-F256 HydrophobicContact CB-CD2 3.92Å; F215-F256 HydrophobicContact CB-CE2 4.16Å; F215-F256 HydrophobicContact CB-CG 4.08Å; F215-F256 HydrophobicContact CB-CZ 4.5Å; F215-F256 HydrophobicContact CD1-CB 3.94Å; F215-F256 AromaticContact CD1-CD1 3.48Å; F215-F256 HydrophobicContact CD1-CD1 3.48Å; F215-F256 VanDerWaalsContact CD1-CD1 3.48Å; F215-F256 HydrophobicContact CD1-CD2 4.37Å; F215-F256 HydrophobicContact CD1-CE1 4.06Å; F215-F256 AromaticContact CD1-CG 3.67Å; F215-F256 HydrophobicContact CD1-CG 3.67Å; F215-F256 HydrophobicContact CD2-CB 4.19Å; F215-F256 HydrophobicContact CD2-CG 4.47Å; F215-F256 HydrophobicContact CE1-CB 4.07Å; F215-F256 AromaticContact CE1-CD1 3.97Å; F215-F256 HydrophobicContact CE1-CD1 3.97Å; F215-F256 HydrophobicContact CE1-CG 4.21Å; F215-F256 HydrophobicContact CE2-CB 4.3Å; F215-F256 HydrophobicContact CG-CB 4.01Å; F215-F256 HydrophobicContact CG-CD1 4.09Å; F215-F256 HydrophobicContact CG-CD2 4.16Å; F215-F256 AromaticContact CG-CG 3.82Å; F215-F256 HydrophobicContact CG-CG 3.82Å; F215-F256 HydrophobicContact CZ-CB 4.24Å; F215-F263 HydrophobicContact CE1-CD1 4.06Å; F215-F263 HydrophobicContact CE1-CD2 4.1Å; F215-F263 HydrophobicContact CE1-CE1 4.11Å; F215-F263 HydrophobicContact CE1-CE2 4.15Å; F215-F263 HydrophobicContact CE1-CG 4.08Å; F215-F263 HydrophobicContact CE1-CZ 4.17Å; F215-E266 HydrophobicContact CE2-CG 3.92Å; F215-E266 HydrophobicContact CZ-CG 4.03Å; F215-E266 VanDerWaalsContact CZ-O 3.23Å; F215-E266 WeakPolarHBondContact CZ-O 3.44Å
216	Q	97	Very high	95.7	Very high	41 Å²	41	11.3 Å²	11.3	19%	0.192	6%	0.06	C	C	.	.	H	α-helix	trans	-66.8	-36.4	175.7	-65.4	-55	-47.8	0	0	111.4	L213 M219 V220 E252	L213-Q216 HydrophobicContact CD2-CB 4.39Å; L213-Q216 PolarHBondContact O-N 3.1Å; Q216-M219 WeakPolarHBondContact O-CB 3.14Å; Q216-M219 PolarHBondContact O-N 2.94Å; Q216-V220 WeakPolarHBondContact O-CG2 3.44Å; Q216-V220 PolarHBondContact O-N 3.45Å; Q216-E252 PolarHBondContact NE2-OE1 3.39Å
217	N	97.3	Very high	95.8	Very high	3 Å²	3	11.2 Å²	11.2	2%	0.016	6%	0.059	C	C	.	.	H	α-helix	trans	-62.8	-42.1	173.9	-74.8	-29.2	0	0	0	112	L213 F215 V220 A221 F343 N344 C519 A522	L213-N217 PolarHBondContact O-N 3.31Å; L213-N217 PolarHBondContact O-ND2 2.82Å; F215-N217 VanDerWaalsContact C-N 3.33Å; F215-N217 PolarHBondContact O-N 3.23Å; N217-V220 PolarHBondContact O-N 3.03Å; N217-A221 PolarHBondContact O-N 3.19Å; N217-F343 HydrophobicContact CB-CD1 4.48Å; N217-N344 PolarHBondContact ND2-OD1 3.13Å; N217-N344 PolarHBondContact OD1-N 2.97Å; N217-C519 HydrophobicContact CB-CB 4.25Å; N217-A522 HydrophobicContact CB-CB 3.89Å; N217-A522 WeakPolarHBondContact ND2-CB 3.45Å
218	Y	97.4	Very high	95.9	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-61.7	-43.2	171.7	-77.7	-67.3	0	0	0	111.9	R214 F215 V220 A221 L222 F256 F263 F504 F505 T509 T518 C519	R214-Y218 HydrophobicContact CG-CE2 4.41Å; R214-Y218 VanDerWaalsContact O-CD2 3.25Å; R214-Y218 WeakPolarHBondContact O-CD2 3.45Å; R214-Y218 PolarHBondContact O-N 2.98Å; F215-Y218 PolarHBondContact O-N 3.18Å; Y218-V220 VanDerWaalsContact C-N 3.35Å; Y218-V220 PolarHBondContact O-N 2.86Å; Y218-A221 PolarHBondContact O-N 2.85Å; Y218-L222 WeakPolarHBondContact O-CB 3.49Å; Y218-L222 VanDerWaalsContact O-CG 3.22Å; Y218-L222 WeakPolarHBondContact O-CG 3.4Å; Y218-L222 PolarHBondContact O-N 3.45Å; Y218-F256 HydrophobicContact CD2-CE1 4.18Å; Y218-F256 HydrophobicContact CG-CE1 4.16Å; Y218-F256 HydrophobicContact CG-CZ 4.44Å; Y218-F263 HydrophobicContact CD2-CZ 4.27Å; Y218-F263 HydrophobicContact CE2-CE1 4.48Å; Y218-F263 HydrophobicContact CE2-CE2 4.36Å; Y218-F263 AromaticContact CE2-CZ 3.6Å; Y218-F263 HydrophobicContact CE2-CZ 3.6Å; Y218-F504 AromaticContact CD1-CE1 3.94Å; Y218-F504 HydrophobicContact CD1-CE1 3.94Å; Y218-F504 HydrophobicContact CD1-CZ 4.4Å; Y218-F504 HydrophobicContact CE1-CE1 4.49Å; Y218-F505 HydrophobicContact CD1-CD1 4.22Å; Y218-F505 AromaticContact CD1-CE1 3.61Å; Y218-F505 HydrophobicContact CD1-CE1 3.61Å; Y218-F505 HydrophobicContact CD1-CZ 4.24Å; Y218-F505 HydrophobicContact CD2-CE1 4.39Å; Y218-F505 AromaticContact CE1-CD1 3.92Å; Y218-F505 HydrophobicContact CE1-CD1 3.92Å; Y218-F505 AromaticContact CE1-CE1 3.72Å; Y218-F505 HydrophobicContact CE1-CE1 3.72Å; Y218-F505 AromaticContact CG-CE1 3.97Å; Y218-F505 HydrophobicContact CG-CE1 3.97Å; Y218-F505 HydrophobicContact CG-CZ 4.45Å; Y218-T509 WeakPolarHBondContact OH-CG2 3.34Å; Y218-T509 PolarHBondContact OH-OG1 3.41Å; Y218-T518 VanDerWaalsContact OH-C 3.24Å; Y218-T518 PolarHBondContact OH-O 3.13Å; Y218-C519 HydrophobicContact CD1-CB 3.74Å; Y218-C519 HydrophobicContact CD2-CB 4.35Å; Y218-C519 HydrophobicContact CE1-CB 3.68Å; Y218-C519 HydrophobicContact CE2-CB 4.28Å; Y218-C519 HydrophobicContact CG-CB 4.09Å; Y218-C519 PolarHBondContact OH-N 3.28Å
219	M	97.6	Very high	96	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.8	-42	175.9	-75.9	-57	-55.3	0	0	112.5	F215 Q216 L222 V223 L228 F243 K248 F251 E252 F256	F215-M219 PolarHBondContact O-N 3.19Å; Q216-M219 WeakPolarHBondContact O-CB 3.14Å; Q216-M219 PolarHBondContact O-N 2.94Å; M219-L222 HydrophobicContact SD-CD1 4.34Å; M219-V223 WeakPolarHBondContact O-CB 3.35Å; M219-V223 VanDerWaalsContact O-CG2 3.22Å; M219-V223 WeakPolarHBondContact O-CG2 3.47Å; M219-V223 PolarHBondContact O-N 3.49Å; M219-V223 VanDerWaalsContact O-N 3.07Å; M219-L228 HydrophobicContact CE-CD1 3.82Å; M219-F243 HydrophobicContact CE-CZ 4.27Å; M219-K248 HydrophobicContact CE-CG 4.49Å; M219-F251 HydrophobicContact CE-CB 4.4Å; M219-F251 HydrophobicContact CE-CD2 4.28Å; M219-F251 HydrophobicContact SD-CB 4.43Å; M219-E252 HydrophobicContact CG-CG 4.27Å; M219-E252 HydrophobicContact SD-CG 4.27Å; M219-F256 HydrophobicContact CG-CE2 3.93Å; M219-F256 HydrophobicContact CG-CZ 4.45Å; M219-F256 HydrophobicContact SD-CE2 3.9Å; M219-F256 HydrophobicContact SD-CZ 4.41Å
220	V	97.1	Very high	95.9	Very high	2 Å²	2	12.1 Å²	12.1	1%	0.012	7%	0.065	C	C	.	.	H	α-helix	trans	-61.9	-44.7	175.8	172.9	0	0	0	0	110.9	Q216 N217 Y218 V223 N224 R341 F343 K552	Q216-V220 WeakPolarHBondContact O-CG2 3.44Å; Q216-V220 PolarHBondContact O-N 3.45Å; N217-V220 PolarHBondContact O-N 3.03Å; Y218-V220 VanDerWaalsContact C-N 3.35Å; Y218-V220 PolarHBondContact O-N 2.86Å; V220-V223 PolarHBondContact O-N 3.13Å; V220-N224 VanDerWaalsContact O-CB 3.29Å; V220-N224 WeakPolarHBondContact O-CB 3.39Å; V220-N224 PolarHBondContact O-N 3.28Å; V220-R341 HydrophobicContact CG2-CB 4.12Å; V220-R341 HydrophobicContact CG2-CG 3.95Å; V220-F343 HydrophobicContact CB-CD1 4.45Å; V220-F343 HydrophobicContact CB-CE1 4.08Å; V220-F343 HydrophobicContact CG1-CD1 4.17Å; V220-F343 HydrophobicContact CG1-CE1 3.76Å; V220-F343 HydrophobicContact CG1-CZ 4.08Å; V220-K552 HydrophobicContact CG1-CD 4.44Å
221	A	96.1	Very high	95.8	Very high	1 Å²	1	18 Å²	18	1%	0.008	9%	0.087	C	C	.	.	H	α-helix	trans	-65.9	-44.2	178.7	0	0	0	0	0	112.5	N217 Y218 V223 N224 K225 F343 F504 F521	N217-A221 PolarHBondContact O-N 3.19Å; Y218-A221 PolarHBondContact O-N 2.85Å; A221-V223 VanDerWaalsContact C-N 3.32Å; A221-V223 PolarHBondContact O-N 2.84Å; A221-N224 PolarHBondContact O-N 2.95Å; A221-K225 WeakPolarHBondContact O-CB 3.31Å; A221-K225 WeakPolarHBondContact O-CG 3.43Å; A221-K225 PolarHBondContact O-N 3.44Å; A221-F343 HydrophobicContact CB-CE1 3.98Å; A221-F343 HydrophobicContact CB-CZ 4.2Å; A221-F504 HydrophobicContact CB-CE2 4.11Å; A221-F504 HydrophobicContact CB-CZ 3.68Å; A221-F521 HydrophobicContact CB-CD2 3.78Å; A221-F521 HydrophobicContact CB-CE2 4.36Å
222	L	96.9	Very high	95.8	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.2	-39	177.7	-73.1	166.7	0	0	0	112.3	Y218 M219 S226 L227 L228 L255 F504 F505	Y218-L222 WeakPolarHBondContact O-CB 3.49Å; Y218-L222 VanDerWaalsContact O-CG 3.22Å; Y218-L222 WeakPolarHBondContact O-CG 3.4Å; Y218-L222 PolarHBondContact O-N 3.45Å; M219-L222 HydrophobicContact SD-CD1 4.34Å; L222-S226 PolarHBondContact O-N 3.31Å; L222-L227 HydrophobicContact CD2-CB 4.15Å; L222-L227 HydrophobicContact CD2-CD1 3.82Å; L222-L227 PolarHBondContact O-N 3.38Å; L222-L228 HydrophobicContact CB-CD1 3.99Å; L222-L228 HydrophobicContact CB-CG 4.12Å; L222-L255 HydrophobicContact CD1-CD1 3.63Å; L222-F504 HydrophobicContact CD2-CD1 3.65Å; L222-F504 HydrophobicContact CD2-CE1 3.68Å; L222-F504 HydrophobicContact CD2-CG 4.19Å; L222-F504 HydrophobicContact CD2-CZ 4.24Å; L222-F504 HydrophobicContact CG-CD1 4.4Å; L222-F504 HydrophobicContact CG-CE1 3.93Å; L222-F504 HydrophobicContact CG-CZ 4.29Å; L222-F505 HydrophobicContact CD1-CZ 4.49Å
223	V	96	Very high	95.6	Very high	5 Å²	5	28.6 Å²	28.6	3%	0.03	13%	0.126	C	C	.	.	H	α-helix	trans	-72.5	-44.3	176.3	174.3	0	0	0	0	111.3	M219 V220 A221 S226 L228 L230 Y335 C338	M219-V223 WeakPolarHBondContact O-CB 3.35Å; M219-V223 VanDerWaalsContact O-CG2 3.22Å; M219-V223 WeakPolarHBondContact O-CG2 3.47Å; M219-V223 PolarHBondContact O-N 3.49Å; M219-V223 VanDerWaalsContact O-N 3.07Å; V220-V223 PolarHBondContact O-N 3.13Å; A221-V223 VanDerWaalsContact C-N 3.32Å; A221-V223 PolarHBondContact O-N 2.84Å; V223-S226 PolarHBondContact O-N 3.4Å; V223-L228 HydrophobicContact CG2-CD1 4.02Å; V223-L230 HydrophobicContact CB-CD1 4.42Å; V223-L230 HydrophobicContact CG1-CD1 3.91Å; V223-L230 HydrophobicContact CG2-CD1 4.07Å; V223-Y335 HydrophobicContact CG1-CD2 4.3Å; V223-Y335 HydrophobicContact CG1-CE2 4.01Å; V223-C338 HydrophobicContact CB-CB 4.5Å; V223-C338 HydrophobicContact CG1-CB 4.27Å; V223-C338 HydrophobicContact CG2-CB 4.25Å
224	N	93.3	Very high	95.4	Very high	7 Å²	7	32.3 Å²	32.3	4%	0.037	15%	0.146	C	C	.	.	H	α-helix	trans	-62.7	-42.2	178.9	177.9	-89.7	0	0	0	111.4	V220 A221 S226 E549 K552	V220-N224 VanDerWaalsContact O-CB 3.29Å; V220-N224 WeakPolarHBondContact O-CB 3.39Å; V220-N224 PolarHBondContact O-N 3.28Å; A221-N224 PolarHBondContact O-N 2.95Å; N224-S226 PolarHBondContact O-N 3.25Å; N224-E549 PolarHBondContact ND2-O 3.39Å; N224-E549 VanDerWaalsContact O-OE2 3.13Å; N224-E549 WeakPolarHBondContact OD1-CB 3.47Å; N224-E549 PolarHBondContact OD1-N 2.9Å; N224-E549 VanDerWaalsContact OD1-N 3.16Å; N224-K552 HydrophobicContact CB-CD 4.35Å; N224-K552 VanDerWaalsContact ND2-CD 3.27Å; N224-K552 WeakPolarHBondContact ND2-CD 3.29Å; N224-K552 VanDerWaalsContact ND2-CE 3.31Å; N224-K552 WeakPolarHBondContact ND2-CE 3.46Å
225	K	93.4	Very high	95.1	Very high	27 Å²	27	38.1 Å²	38.1	12%	0.117	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	5.4	176.8	-71.6	-75.7	178.5	175.5	0	114.7	A221 L227 Y545 Q547	A221-K225 WeakPolarHBondContact O-CB 3.31Å; A221-K225 WeakPolarHBondContact O-CG 3.43Å; A221-K225 PolarHBondContact O-N 3.44Å; K225-L227 HydrophobicContact CB-CD1 4.05Å; K225-L227 HydrophobicContact CB-CG 3.96Å; K225-L227 PolarHBondContact O-N 3.36Å; K225-L227 VanDerWaalsContact O-N 3.1Å; K225-Y545 PolarHBondContact NZ-O 3.44Å; K225-Q547 WeakPolarHBondContact CE-O 3.41Å; K225-Q547 PolarHBondContact NZ-O 2.91Å
226	S	94.5	Very high	94.8	Very high	53 Å²	53	41.2 Å²	41.2	37%	0.371	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	31.7	-179.7	-59.6	0	0	0	0	114.4	L222 V223 N224 L228 R497	L222-S226 PolarHBondContact O-N 3.31Å; V223-S226 PolarHBondContact O-N 3.4Å; N224-S226 PolarHBondContact O-N 3.25Å; S226-L228 VanDerWaalsContact C-N 3.35Å; S226-R497 PolarHBondContact O-NH1 3.07Å
227	L	95.1	Very high	94.2	Very high	15 Å²	15	46.2 Å²	46.2	8%	0.079	25%	0.25	C	S	.	.			trans	-79.8	-20.3	179.4	-68.3	172.9	0	0	0	112.5	L222 K225 R497 E500 F504	L222-L227 HydrophobicContact CD2-CB 4.15Å; L222-L227 HydrophobicContact CD2-CD1 3.82Å; L222-L227 PolarHBondContact O-N 3.38Å; K225-L227 HydrophobicContact CB-CD1 4.05Å; K225-L227 HydrophobicContact CB-CG 3.96Å; K225-L227 PolarHBondContact O-N 3.36Å; K225-L227 VanDerWaalsContact O-N 3.1Å; L227-R497 VanDerWaalsContact O-CD 3.29Å; L227-R497 WeakPolarHBondContact O-CD 3.07Å; L227-E500 HydrophobicContact CD2-CB 4.01Å; L227-F504 HydrophobicContact CD1-CB 3.65Å; L227-F504 HydrophobicContact CD1-CD1 4.34Å; L227-F504 HydrophobicContact CD1-CD2 3.38Å; L227-F504 HydrophobicContact CD1-CE2 4.12Å; L227-F504 HydrophobicContact CD1-CG 3.53Å
228	L	95.7	Very high	93.9	Very high	7 Å²	7	48 Å²	48	4%	0.037	27%	0.269	C	S	.	.	S	Bend	trans	-93.2	138.1	175.1	-61.5	173.6	0	0	0	110	M219 L222 V223 S226 L230 F251 L494	M219-L228 HydrophobicContact CE-CD1 3.82Å; L222-L228 HydrophobicContact CB-CD1 3.99Å; L222-L228 HydrophobicContact CB-CG 4.12Å; V223-L228 HydrophobicContact CG2-CD1 4.02Å; S226-L228 VanDerWaalsContact C-N 3.35Å; L228-L230 HydrophobicContact CB-CD1 4.27Å; L228-L230 HydrophobicContact CB-CD2 3.86Å; L228-L230 HydrophobicContact CB-CG 3.91Å; L228-L230 WeakPolarHBondContact O-CG 3.34Å; L228-L230 PolarHBondContact O-N 3.42Å; L228-F251 HydrophobicContact CB-CE2 4.2Å; L228-F251 HydrophobicContact CB-CZ 4.43Å; L228-F251 HydrophobicContact CD1-CD2 3.77Å; L228-F251 HydrophobicContact CD1-CE2 3.91Å; L228-F251 HydrophobicContact CD1-CG 4.5Å; L228-F251 HydrophobicContact CD2-CD1 4.32Å; L228-F251 HydrophobicContact CD2-CD2 4.13Å; L228-F251 HydrophobicContact CD2-CE1 4.34Å; L228-F251 HydrophobicContact CD2-CE2 4.14Å; L228-F251 HydrophobicContact CD2-CG 4.22Å; L228-F251 HydrophobicContact CD2-CZ 4.24Å; L228-F251 HydrophobicContact CG-CD2 4.45Å; L228-F251 HydrophobicContact CG-CE2 4.3Å; L228-L494 HydrophobicContact CD2-CD1 3.94Å
229	P	94.4	Very high	93.6	Very high	12 Å²	12	51.9 Å²	51.9	8%	0.078	29%	0.287	C	S	.	.			trans	-77.8	86.9	178.3	32.4	-35.1	0	0	0	110.1	F232 I489 C493 L494	P229-F232 HydrophobicContact CB-CZ 4.34Å; P229-F232 WeakPolarHBondContact O-CE2 3.46Å; P229-F232 WeakPolarHBondContact O-CZ 3.46Å; P229-I489 HydrophobicContact CG-CG2 3.96Å; P229-C493 HydrophobicContact CB-CB 3.67Å; P229-C493 HydrophobicContact CG-CB 3.83Å; P229-L494 HydrophobicContact CG-CB 4.14Å; P229-L494 HydrophobicContact CG-CD1 4.27Å
230	L	95.1	Very high	93.4	Very high	8 Å²	8	53.3 Å²	53.3	4%	0.042	30%	0.298	C	S	.	.			trans	-106.9	-21.6	-177	-49	173.7	0	0	0	112.9	V223 L228 V241 F242 F243 F251 Y335	V223-L230 HydrophobicContact CB-CD1 4.42Å; V223-L230 HydrophobicContact CG1-CD1 3.91Å; V223-L230 HydrophobicContact CG2-CD1 4.07Å; L228-L230 HydrophobicContact CB-CD1 4.27Å; L228-L230 HydrophobicContact CB-CD2 3.86Å; L228-L230 HydrophobicContact CB-CG 3.91Å; L228-L230 WeakPolarHBondContact O-CG 3.34Å; L228-L230 PolarHBondContact O-N 3.42Å; L230-V241 CarbonylContact O-C 3.58Å; L230-V241 VanDerWaalsContact O-CA 3.31Å; L230-V241 WeakPolarHBondContact O-CA 3.32Å; L230-F242 PolarHBondContact O-N 2.89Å; L230-F243 HydrophobicContact CD2-CB 4.3Å; L230-F243 HydrophobicContact CD2-CD2 3.66Å; L230-F243 HydrophobicContact CD2-CE2 4.24Å; L230-F243 HydrophobicContact CD2-CG 4.12Å; L230-F251 HydrophobicContact CD2-CE2 3.94Å; L230-F251 HydrophobicContact CD2-CZ 4.44Å; L230-Y335 HydrophobicContact CD1-CD2 4.1Å; L230-Y335 HydrophobicContact CD1-CE2 4.13Å
231	R	93.9	Very high	93.3	Very high	125 Å²	125	54 Å²	54	47%	0.472	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	126.7	-175.1	-70.2	173.5	177.6	-177.4	6.6	110	E239 V241 Y335	R231-E239 WeakPolarHBondContact CD-OE1 3.45Å; R231-V241 HydrophobicContact CG-CG2 4.13Å; R231-Y335 PolarHBondContact NH2-OH 3.21Å
232	F	94	Very high	93.4	Very high	47 Å²	47	55.1 Å²	55.1	21%	0.206	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	141.9	-178.8	-57.5	-79.8	0	0	0	110.1	P229 E239 A240 F242 I489 C493	P229-F232 HydrophobicContact CB-CZ 4.34Å; P229-F232 WeakPolarHBondContact O-CE2 3.46Å; P229-F232 WeakPolarHBondContact O-CZ 3.46Å; F232-E239 WeakPolarHBondContact O-CA 3.18Å; F232-A240 PolarHBondContact N-O 3.23Å; F232-A240 PolarHBondContact O-N 3.45Å; F232-F242 HydrophobicContact CD2-CB 4.04Å; F232-F242 HydrophobicContact CE2-CB 4.01Å; F232-I489 HydrophobicContact CE1-CG1 4.38Å; F232-I489 HydrophobicContact CE2-CD1 3.73Å; F232-I489 HydrophobicContact CE2-CG1 4.31Å; F232-I489 HydrophobicContact CZ-CD1 3.66Å; F232-I489 HydrophobicContact CZ-CG1 3.73Å; F232-I489 HydrophobicContact CZ-CG2 4.09Å; F232-C493 HydrophobicContact CE1-CB 4.33Å
233	R	93.6	Very high	93.4	Very high	212 Å²	212	55.5 Å²	55.5	80%	0.8	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	107.8	172.2	-71.7	-164.8	175	-176.9	1.3	109.8	G238	R233-G238 WeakPolarHBondContact CA-O 3.45Å
234	L	91.3	Very high	93.4	Very high	85 Å²	85	55.3 Å²	55.3	45%	0.445	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	135.4	178.9	-62.3	178.7	0	0	0	110.2	G236 L237 G238 A240	L234-G236 PolarHBondContact O-N 3.28Å; L234-L237 HydrophobicContact CB-CB 4.35Å; L234-L237 PolarHBondContact O-N 3.38Å; L234-G238 PolarHBondContact N-O 3.42Å; L234-G238 PolarHBondContact O-N 2.8Å; L234-A240 HydrophobicContact CD1-CB 3.99Å; L234-A240 HydrophobicContact CG-CB 4.41Å
235	P	92.1	Very high	93.6	Very high	128 Å²	128	62.8 Å²	62.8	83%	0.831	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	126.1	174.8	26.2	-32.8	0	0	0	109.7	L237	P235-L237 PolarHBondContact O-N 3.15Å
236	G	89.2	Confident	93.7	Very high	88 Å²	88	62.7 Å²	62.7	91%	0.907	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.3	-32.8	179.4	0	0	0	0	0	116	L234	L234-G236 PolarHBondContact O-N 3.28Å
237	L	85.1	Confident	93.8	Very high	146 Å²	146	60.2 Å²	60.2	76%	0.764	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-20.3	178.1	-81.6	83.1	0	0	0	113.6	L234 P235	L234-L237 HydrophobicContact CB-CB 4.35Å; L234-L237 PolarHBondContact O-N 3.38Å; P235-L237 PolarHBondContact O-N 3.15Å
238	G	90.3	Very high	93.9	Very high	39 Å²	39	61.1 Å²	61.1	40%	0.402	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	83.6	-141.3	-175.9	0	0	0	0	0	112.1	R233 L234 A240	R233-G238 WeakPolarHBondContact CA-O 3.45Å; L234-G238 PolarHBondContact N-O 3.42Å; L234-G238 PolarHBondContact O-N 2.8Å; G238-A240 PolarHBondContact O-N 2.79Å
239	E	91.4	Very high	94	Very high	83 Å²	83	66.8 Å²	66.8	39%	0.388	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	112.2	-179.9	-169.1	169.3	164	0	0	110.8	R231 F232 Q467	R231-E239 WeakPolarHBondContact CD-OE1 3.45Å; F232-E239 WeakPolarHBondContact O-CA 3.18Å; E239-Q467 PolarHBondContact O-NE2 3.26Å
240	A	92.8	Very high	94.2	Very high	29 Å²	29	66.5 Å²	66.5	24%	0.24	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	139.3	178.9	0	0	0	0	0	110.3	F232 L234 G238	F232-A240 PolarHBondContact N-O 3.23Å; F232-A240 PolarHBondContact O-N 3.45Å; L234-A240 HydrophobicContact CD1-CB 3.99Å; L234-A240 HydrophobicContact CG-CB 4.41Å; G238-A240 PolarHBondContact O-N 2.79Å
241	V	96.1	Very high	94.3	Very high	16 Å²	16	66.1 Å²	66.1	10%	0.097	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	120	174.2	-180	0	0	0	0	108.4	L230 R231 Y335 Q467	L230-V241 CarbonylContact O-C 3.58Å; L230-V241 VanDerWaalsContact O-CA 3.31Å; L230-V241 WeakPolarHBondContact O-CA 3.32Å; R231-V241 HydrophobicContact CG-CG2 4.13Å; V241-Y335 HydrophobicContact CG1-CD1 3.84Å; V241-Y335 HydrophobicContact CG1-CD2 3.84Å; V241-Y335 HydrophobicContact CG1-CE1 4.35Å; V241-Y335 HydrophobicContact CG1-CE2 4.36Å; V241-Y335 HydrophobicContact CG1-CG 3.55Å; V241-Q467 HydrophobicContact CG2-CB 4.1Å; V241-Q467 HydrophobicContact CG2-CG 3.96Å
242	F	96.8	Very high	94.4	Very high	25 Å²	25	61 Å²	61	11%	0.11	33%	0.327	C	S	.	.			trans	-116.4	100.8	179.1	-168.5	-94	0	0	0	110.3	L230 F232 T244 L247 E478 V485 I489	L230-F242 PolarHBondContact O-N 2.89Å; F232-F242 HydrophobicContact CD2-CB 4.04Å; F232-F242 HydrophobicContact CE2-CB 4.01Å; F242-T244 HydrophobicContact CD1-CG2 4.44Å; F242-T244 HydrophobicContact CE1-CG2 3.82Å; F242-T244 HydrophobicContact CE2-CG2 3.97Å; F242-T244 HydrophobicContact CZ-CG2 3.56Å; F242-L247 HydrophobicContact CD1-CD2 4.4Å; F242-E478 HydrophobicContact CD2-CG 4.42Å; F242-E478 HydrophobicContact CE2-CB 4.23Å; F242-E478 HydrophobicContact CE2-CG 4.32Å; F242-V485 HydrophobicContact CD1-CG1 4.08Å; F242-V485 HydrophobicContact CE1-CB 3.98Å; F242-V485 HydrophobicContact CE1-CG1 3.77Å; F242-V485 HydrophobicContact CZ-CB 3.92Å; F242-V485 HydrophobicContact CZ-CG1 4.06Å; F242-V485 HydrophobicContact CZ-CG2 4.46Å; F242-I489 HydrophobicContact CD1-CD1 3.48Å; F242-I489 VanDerWaalsContact CD1-CD1 3.48Å; F242-I489 HydrophobicContact CE1-CD1 4.04Å; F242-I489 HydrophobicContact CG-CD1 4.36Å
243	F	97.5	Very high	94.5	Very high	8 Å²	8	61 Å²	61	4%	0.035	33%	0.329	C	S	.	.			trans	-141.6	97.5	177.2	-172.6	-130	0	0	0	110.9	M219 L230 L247 K248 F251 L334 C338	M219-F243 HydrophobicContact CE-CZ 4.27Å; L230-F243 HydrophobicContact CD2-CB 4.3Å; L230-F243 HydrophobicContact CD2-CD2 3.66Å; L230-F243 HydrophobicContact CD2-CE2 4.24Å; L230-F243 HydrophobicContact CD2-CG 4.12Å; F243-L247 HydrophobicContact CD2-CD2 4.32Å; F243-K248 HydrophobicContact CE2-CB 3.77Å; F243-K248 HydrophobicContact CE2-CG 4.39Å; F243-K248 HydrophobicContact CZ-CB 3.71Å; F243-K248 HydrophobicContact CZ-CD 4.19Å; F243-K248 HydrophobicContact CZ-CG 3.92Å; F243-F251 HydrophobicContact CD2-CE2 4.26Å; F243-F251 AromaticContact CE2-CD2 3.98Å; F243-F251 HydrophobicContact CE2-CD2 3.98Å; F243-F251 AromaticContact CE2-CE2 3.91Å; F243-F251 HydrophobicContact CE2-CE2 3.91Å; F243-L334 HydrophobicContact CD1-CB 4.19Å; F243-L334 HydrophobicContact CD1-CD2 4.06Å; F243-L334 HydrophobicContact CD1-CG 3.79Å; F243-L334 HydrophobicContact CE1-CD2 4.03Å; F243-L334 HydrophobicContact CE1-CG 3.76Å; F243-L334 HydrophobicContact CZ-CD2 4.46Å; F243-C338 HydrophobicContact CE1-CB 4.41Å
244	T	97.1	Very high	94.7	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.006	29%	0.291	C	S	.	.			trans	-102.3	168.4	-176.4	62.6	0	0	0	0	111.8	F242 G246 L247 K248 L334 E478 S482	F242-T244 HydrophobicContact CD1-CG2 4.44Å; F242-T244 HydrophobicContact CE1-CG2 3.82Å; F242-T244 HydrophobicContact CE2-CG2 3.97Å; F242-T244 HydrophobicContact CZ-CG2 3.56Å; T244-G246 VanDerWaalsContact C-N 3.29Å; T244-G246 PolarHBondContact O-N 2.88Å; T244-L247 PolarHBondContact O-N 3.32Å; T244-L247 PolarHBondContact OG1-N 2.82Å; T244-K248 PolarHBondContact O-N 3.09Å; T244-L334 WeakPolarHBondContact O-CD2 3.44Å; T244-E478 HydrophobicContact CG2-CB 4.14Å; T244-S482 WeakPolarHBondContact CB-OG 3.42Å; T244-S482 PolarHBondContact OG1-OG 2.74Å
245	R	96.6	Very high	94.9	Very high	165 Å²	165	47.1 Å²	47.1	62%	0.623	27%	0.271	S	S	*	.	H	α-helix	trans	-60.3	-40.2	175.5	-67.5	173.7	178.8	-169.6	-0.8	112.1	K248 Y249 L334 E479	R245-K248 PolarHBondContact O-N 3.44Å; R245-Y249 WeakPolarHBondContact O-CB 3.41Å; R245-Y249 PolarHBondContact O-N 3.48Å; R245-L334 HydrophobicContact CG-CD2 4.28Å; R245-E479 WeakPolarHBondContact CG-OE1 3.35Å; R245-E479 PolarHBondContact N-OE1 3.18Å
246	G	95.6	Very high	95.1	Very high	25 Å²	25	41.3 Å²	41.3	26%	0.258	23%	0.233	S	C	.	.	H	α-helix	trans	-63.3	-40	177.2	0	0	0	0	0	113	T244 N250	T244-G246 VanDerWaalsContact C-N 3.29Å; T244-G246 PolarHBondContact O-N 2.88Å; G246-N250 PolarHBondContact O-N 2.99Å; G246-N250 VanDerWaalsContact O-N 3.14Å; G246-N250 PolarHBondContact O-ND2 3.45Å
247	L	97	Very high	95.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-70.1	-44	177.5	-173.9	61.6	0	0	0	111.6	F242 F243 T244 Y249 N250 F251 T486 I489 L490	F242-L247 HydrophobicContact CD1-CD2 4.4Å; F243-L247 HydrophobicContact CD2-CD2 4.32Å; T244-L247 PolarHBondContact O-N 3.32Å; T244-L247 PolarHBondContact OG1-N 2.82Å; L247-Y249 PolarHBondContact O-N 3.39Å; L247-N250 PolarHBondContact O-N 3.36Å; L247-F251 HydrophobicContact CD1-CD1 4.44Å; L247-F251 HydrophobicContact CD1-CE1 3.69Å; L247-F251 HydrophobicContact CD1-CE2 4.22Å; L247-F251 HydrophobicContact CD1-CZ 3.57Å; L247-F251 HydrophobicContact CD2-CE2 4.07Å; L247-F251 HydrophobicContact CD2-CZ 3.85Å; L247-F251 HydrophobicContact CG-CD2 4.38Å; L247-F251 HydrophobicContact CG-CE1 4.09Å; L247-F251 HydrophobicContact CG-CE2 3.68Å; L247-F251 HydrophobicContact CG-CZ 3.52Å; L247-F251 WeakPolarHBondContact O-CG 3.32Å; L247-F251 PolarHBondContact O-N 3.36Å; L247-T486 HydrophobicContact CD1-CG2 4Å; L247-I489 HydrophobicContact CD1-CB 4.5Å; L247-I489 HydrophobicContact CD1-CG2 4.13Å; L247-I489 HydrophobicContact CD2-CD1 4.16Å; L247-I489 HydrophobicContact CD2-CG2 4.34Å; L247-L490 HydrophobicContact CD1-CD2 4.18Å; L247-L490 HydrophobicContact CD1-CG 4.46Å
248	K	97.6	Very high	95.5	Very high	35 Å²	35	36.6 Å²	36.6	15%	0.152	19%	0.19	C	C	.	.	H	α-helix	trans	-56.7	-48	174.1	-178.6	178.7	174.2	177.9	0	111.6	M219 F243 T244 R245 N250 F251 E252 L334	M219-K248 HydrophobicContact CE-CG 4.49Å; F243-K248 HydrophobicContact CE2-CB 3.77Å; F243-K248 HydrophobicContact CE2-CG 4.39Å; F243-K248 HydrophobicContact CZ-CB 3.71Å; F243-K248 HydrophobicContact CZ-CD 4.19Å; F243-K248 HydrophobicContact CZ-CG 3.92Å; T244-K248 PolarHBondContact O-N 3.09Å; R245-K248 PolarHBondContact O-N 3.44Å; K248-N250 VanDerWaalsContact C-N 3.28Å; K248-N250 PolarHBondContact O-N 3.28Å; K248-F251 PolarHBondContact O-N 2.73Å; K248-F251 VanDerWaalsContact O-N 3.17Å; K248-E252 WeakPolarHBondContact CE-OE1 3.31Å; K248-E252 IonicContact NZ-OE1 3.21Å; K248-E252 PolarHBondContact O-N 3.01Å; K248-L334 HydrophobicContact CB-CD2 4.17Å; K248-L334 HydrophobicContact CD-CD1 4.45Å; K248-L334 HydrophobicContact CD-CD2 4.4Å
249	Y	97.2	Very high	95.3	Very high	125 Å²	125	41.2 Å²	41.2	49%	0.49	21%	0.213	S	C	.	.	H	α-helix	trans	-57.3	-42.5	177.7	175.4	-97.8	0	0	0	111.9	R245 L247 E252 L253 W257	R245-Y249 WeakPolarHBondContact O-CB 3.41Å; R245-Y249 PolarHBondContact O-N 3.48Å; L247-Y249 PolarHBondContact O-N 3.39Å; Y249-E252 PolarHBondContact O-N 2.79Å; Y249-L253 HydrophobicContact CE1-CD2 4.17Å; Y249-L253 VanDerWaalsContact O-CB 3.28Å; Y249-L253 WeakPolarHBondContact O-CB 3.5Å; Y249-L253 PolarHBondContact O-N 2.86Å; Y249-W257 AromaticContact CD2-CZ3 3.87Å; Y249-W257 HydrophobicContact CD2-CZ3 3.87Å; Y249-W257 HydrophobicContact CE2-CE3 4.37Å; Y249-W257 AromaticContact CE2-CZ3 3.77Å; Y249-W257 HydrophobicContact CE2-CZ3 3.77Å
250	N	97.6	Very high	95	Very high	6 Å²	6	39.3 Å²	39.3	3%	0.032	22%	0.216	C	C	.	.	H	α-helix	trans	-66	-39.3	177.2	-85.3	-71.4	0	0	0	112.8	G246 L247 K248 L253 I254 N297 L490	G246-N250 PolarHBondContact O-N 2.99Å; G246-N250 VanDerWaalsContact O-N 3.14Å; G246-N250 PolarHBondContact O-ND2 3.45Å; L247-N250 PolarHBondContact O-N 3.36Å; K248-N250 VanDerWaalsContact C-N 3.28Å; K248-N250 PolarHBondContact O-N 3.28Å; N250-L253 PolarHBondContact O-N 2.88Å; N250-I254 WeakPolarHBondContact O-CB 3.25Å; N250-I254 VanDerWaalsContact O-CD1 3.3Å; N250-I254 WeakPolarHBondContact O-CD1 3.36Å; N250-I254 WeakPolarHBondContact O-CG1 3.31Å; N250-I254 PolarHBondContact O-N 3.39Å; N250-N297 PolarHBondContact ND2-OD1 2.82Å; N250-N297 PolarHBondContact OD1-ND2 3Å; N250-N297 PolarHBondContact OD1-OD1 2.77Å; N250-L490 HydrophobicContact CB-CD1 3.92Å; N250-L490 HydrophobicContact CB-CD2 4.34Å
251	F	97.4	Very high	95.1	Very high	1 Å²	1	38.1 Å²	38.1	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-61.8	-45.6	173.7	-63.1	-28.3	0	0	0	111.8	M219 L228 L230 F243 L247 K248 L253 I254 L255 L490 L494	M219-F251 HydrophobicContact CE-CB 4.4Å; M219-F251 HydrophobicContact CE-CD2 4.28Å; M219-F251 HydrophobicContact SD-CB 4.43Å; L228-F251 HydrophobicContact CB-CE2 4.2Å; L228-F251 HydrophobicContact CB-CZ 4.43Å; L228-F251 HydrophobicContact CD1-CD2 3.77Å; L228-F251 HydrophobicContact CD1-CE2 3.91Å; L228-F251 HydrophobicContact CD1-CG 4.5Å; L228-F251 HydrophobicContact CD2-CD1 4.32Å; L228-F251 HydrophobicContact CD2-CD2 4.13Å; L228-F251 HydrophobicContact CD2-CE1 4.34Å; L228-F251 HydrophobicContact CD2-CE2 4.14Å; L228-F251 HydrophobicContact CD2-CG 4.22Å; L228-F251 HydrophobicContact CD2-CZ 4.24Å; L228-F251 HydrophobicContact CG-CD2 4.45Å; L228-F251 HydrophobicContact CG-CE2 4.3Å; L230-F251 HydrophobicContact CD2-CE2 3.94Å; L230-F251 HydrophobicContact CD2-CZ 4.44Å; F243-F251 HydrophobicContact CD2-CE2 4.26Å; F243-F251 AromaticContact CE2-CD2 3.98Å; F243-F251 HydrophobicContact CE2-CD2 3.98Å; F243-F251 AromaticContact CE2-CE2 3.91Å; F243-F251 HydrophobicContact CE2-CE2 3.91Å; L247-F251 HydrophobicContact CD1-CD1 4.44Å; L247-F251 HydrophobicContact CD1-CE1 3.69Å; L247-F251 HydrophobicContact CD1-CE2 4.22Å; L247-F251 HydrophobicContact CD1-CZ 3.57Å; L247-F251 HydrophobicContact CD2-CE2 4.07Å; L247-F251 HydrophobicContact CD2-CZ 3.85Å; L247-F251 HydrophobicContact CG-CD2 4.38Å; L247-F251 HydrophobicContact CG-CE1 4.09Å; L247-F251 HydrophobicContact CG-CE2 3.68Å; L247-F251 HydrophobicContact CG-CZ 3.52Å; L247-F251 WeakPolarHBondContact O-CG 3.32Å; L247-F251 PolarHBondContact O-N 3.36Å; K248-F251 PolarHBondContact O-N 2.73Å; K248-F251 VanDerWaalsContact O-N 3.17Å; F251-L253 VanDerWaalsContact C-N 3.34Å; F251-L253 PolarHBondContact O-N 3.34Å; F251-I254 PolarHBondContact O-N 3.43Å; F251-L255 WeakPolarHBondContact O-CB 3.3Å; F251-L255 WeakPolarHBondContact O-CG 3.43Å; F251-L255 PolarHBondContact O-N 2.98Å; F251-L490 HydrophobicContact CD1-CD2 4.14Å; F251-L490 HydrophobicContact CE1-CD2 3.9Å; F251-L494 HydrophobicContact CD1-CD2 3.92Å; F251-L494 HydrophobicContact CE1-CD1 4.06Å; F251-L494 HydrophobicContact CE1-CD2 3.82Å; F251-L494 HydrophobicContact CE1-CG 4.43Å
252	E	96.6	Very high	95	Very high	17 Å²	17	37.4 Å²	37.4	8%	0.079	20%	0.201	C	C	.	.	H	α-helix	trans	-63.9	-40.3	177.3	-68.6	175.8	160.1	0	0	111.6	Q216 M219 K248 Y249 L255 F256 W257	Q216-E252 PolarHBondContact NE2-OE1 3.39Å; M219-E252 HydrophobicContact CG-CG 4.27Å; M219-E252 HydrophobicContact SD-CG 4.27Å; K248-E252 WeakPolarHBondContact CE-OE1 3.31Å; K248-E252 IonicContact NZ-OE1 3.21Å; K248-E252 PolarHBondContact O-N 3.01Å; Y249-E252 PolarHBondContact O-N 2.79Å; E252-L255 PolarHBondContact O-N 3.48Å; E252-F256 HydrophobicContact CB-CD2 4.05Å; E252-F256 HydrophobicContact CG-CD2 4.06Å; E252-F256 HydrophobicContact CG-CE2 4.2Å; E252-F256 WeakPolarHBondContact O-CB 3.5Å; E252-F256 PolarHBondContact O-N 2.98Å; E252-W257 HydrophobicContact CB-CD2 4.46Å; E252-W257 HydrophobicContact CB-CE3 4.16Å; E252-W257 HydrophobicContact CB-CH2 3.92Å; E252-W257 HydrophobicContact CB-CZ2 4.25Å; E252-W257 HydrophobicContact CB-CZ3 3.88Å; E252-W257 PolarHBondContact O-N 2.94Å; E252-W257 VanDerWaalsContact O-N 3.13Å; E252-W257 VanDerWaalsContact OE2-CH2 3.32Å; E252-W257 WeakPolarHBondContact OE2-CH2 3.36Å
253	L	96.6	Very high	94.9	Very high	46 Å²	46	36.4 Å²	36.4	24%	0.241	20%	0.197	C	C	.	.	H	α-helix	trans	-63.7	-39.7	174.5	-179.9	63	0	0	0	112.5	Y249 N250 F251 W257 R289	Y249-L253 HydrophobicContact CE1-CD2 4.17Å; Y249-L253 VanDerWaalsContact O-CB 3.28Å; Y249-L253 WeakPolarHBondContact O-CB 3.5Å; Y249-L253 PolarHBondContact O-N 2.86Å; N250-L253 PolarHBondContact O-N 2.88Å; F251-L253 VanDerWaalsContact C-N 3.34Å; F251-L253 PolarHBondContact O-N 3.34Å; L253-W257 HydrophobicContact CD1-CB 4.31Å; L253-R289 PolarHBondContact O-NH2 2.87Å
254	I	96.7	Very high	94.5	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-70.5	-43.6	179.2	-71.6	159.8	0	0	0	110.6	N250 F251 L286 R289 I290 I293 L490 L494	N250-I254 WeakPolarHBondContact O-CB 3.25Å; N250-I254 VanDerWaalsContact O-CD1 3.3Å; N250-I254 WeakPolarHBondContact O-CD1 3.36Å; N250-I254 WeakPolarHBondContact O-CG1 3.31Å; N250-I254 PolarHBondContact O-N 3.39Å; F251-I254 PolarHBondContact O-N 3.43Å; I254-L286 HydrophobicContact CG2-CD1 3.85Å; I254-R289 PolarHBondContact O-NH1 2.95Å; I254-I290 HydrophobicContact CD1-CG1 4.28Å; I254-I290 HydrophobicContact CG2-CD1 4.49Å; I254-I290 HydrophobicContact CG2-CG1 3.74Å; I254-I293 HydrophobicContact CB-CD1 4.45Å; I254-I293 HydrophobicContact CD1-CG2 4.23Å; I254-I293 HydrophobicContact CG1-CB 4.33Å; I254-I293 HydrophobicContact CG1-CD1 3.55Å; I254-I293 HydrophobicContact CG1-CG2 4.08Å; I254-L490 HydrophobicContact CD1-CD2 3.75Å; I254-L494 HydrophobicContact CD1-CD2 4.01Å
255	L	96.7	Very high	94.1	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-90.9	-43.4	-168.2	-62	174.4	0	0	0	113.2	L222 F251 E252 L262 I501 F505	L222-L255 HydrophobicContact CD1-CD1 3.63Å; F251-L255 WeakPolarHBondContact O-CB 3.3Å; F251-L255 WeakPolarHBondContact O-CG 3.43Å; F251-L255 PolarHBondContact O-N 2.98Å; E252-L255 PolarHBondContact O-N 3.48Å; L255-L262 HydrophobicContact CD2-CD1 4.27Å; L255-L262 PolarHBondContact O-N 3.37Å; L255-I501 HydrophobicContact CD2-CG2 3.81Å; L255-F505 HydrophobicContact CD1-CE2 4.38Å; L255-F505 HydrophobicContact CD2-CE2 4.14Å
256	F	95.4	Very high	93.7	Very high	7 Å²	7	40.3 Å²	40.3	3%	0.031	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-34.5	-166.1	-48.5	-56.3	0	0	0	113.7	F215 Y218 M219 E252 S261 F263 F505	F215-F256 HydrophobicContact CB-CD1 4.42Å; F215-F256 HydrophobicContact CB-CD2 3.92Å; F215-F256 HydrophobicContact CB-CE2 4.16Å; F215-F256 HydrophobicContact CB-CG 4.08Å; F215-F256 HydrophobicContact CB-CZ 4.5Å; F215-F256 HydrophobicContact CD1-CB 3.94Å; F215-F256 AromaticContact CD1-CD1 3.48Å; F215-F256 HydrophobicContact CD1-CD1 3.48Å; F215-F256 VanDerWaalsContact CD1-CD1 3.48Å; F215-F256 HydrophobicContact CD1-CD2 4.37Å; F215-F256 HydrophobicContact CD1-CE1 4.06Å; F215-F256 AromaticContact CD1-CG 3.67Å; F215-F256 HydrophobicContact CD1-CG 3.67Å; F215-F256 HydrophobicContact CD2-CB 4.19Å; F215-F256 HydrophobicContact CD2-CG 4.47Å; F215-F256 HydrophobicContact CE1-CB 4.07Å; F215-F256 AromaticContact CE1-CD1 3.97Å; F215-F256 HydrophobicContact CE1-CD1 3.97Å; F215-F256 HydrophobicContact CE1-CG 4.21Å; F215-F256 HydrophobicContact CE2-CB 4.3Å; F215-F256 HydrophobicContact CG-CB 4.01Å; F215-F256 HydrophobicContact CG-CD1 4.09Å; F215-F256 HydrophobicContact CG-CD2 4.16Å; F215-F256 AromaticContact CG-CG 3.82Å; F215-F256 HydrophobicContact CG-CG 3.82Å; F215-F256 HydrophobicContact CZ-CB 4.24Å; Y218-F256 HydrophobicContact CD2-CE1 4.18Å; Y218-F256 HydrophobicContact CG-CE1 4.16Å; Y218-F256 HydrophobicContact CG-CZ 4.44Å; M219-F256 HydrophobicContact CG-CE2 3.93Å; M219-F256 HydrophobicContact CG-CZ 4.45Å; M219-F256 HydrophobicContact SD-CE2 3.9Å; M219-F256 HydrophobicContact SD-CZ 4.41Å; E252-F256 HydrophobicContact CB-CD2 4.05Å; E252-F256 HydrophobicContact CG-CD2 4.06Å; E252-F256 HydrophobicContact CG-CE2 4.2Å; E252-F256 WeakPolarHBondContact O-CB 3.5Å; E252-F256 PolarHBondContact O-N 2.98Å; F256-S261 PolarHBondContact O-OG 3.13Å; F256-F263 AromaticContact CD1-CD2 3.98Å; F256-F263 HydrophobicContact CD1-CD2 3.98Å; F256-F263 AromaticContact CD1-CE2 3.79Å; F256-F263 HydrophobicContact CD1-CE2 3.79Å; F256-F263 HydrophobicContact CE1-CE2 4.16Å; F256-F505 AromaticContact CE1-CE1 3.98Å; F256-F505 HydrophobicContact CE1-CE1 3.98Å; F256-F505 AromaticContact CE1-CZ 3.69Å; F256-F505 HydrophobicContact CE1-CZ 3.69Å; F256-F505 HydrophobicContact CZ-CZ 4.26Å
257	W	93.1	Very high	93.4	Very high	95 Å²	95	43 Å²	43	36%	0.36	23%	0.23	S	C	.	.	S	Bend	trans	-105.2	150.1	-172.1	-54.8	-29.8	0	0	0	113.6	Y249 E252 L253 R289	Y249-W257 AromaticContact CD2-CZ3 3.87Å; Y249-W257 HydrophobicContact CD2-CZ3 3.87Å; Y249-W257 HydrophobicContact CE2-CE3 4.37Å; Y249-W257 AromaticContact CE2-CZ3 3.77Å; Y249-W257 HydrophobicContact CE2-CZ3 3.77Å; E252-W257 HydrophobicContact CB-CD2 4.46Å; E252-W257 HydrophobicContact CB-CE3 4.16Å; E252-W257 HydrophobicContact CB-CH2 3.92Å; E252-W257 HydrophobicContact CB-CZ2 4.25Å; E252-W257 HydrophobicContact CB-CZ3 3.88Å; E252-W257 PolarHBondContact O-N 2.94Å; E252-W257 VanDerWaalsContact O-N 3.13Å; E252-W257 VanDerWaalsContact OE2-CH2 3.32Å; E252-W257 WeakPolarHBondContact OE2-CH2 3.36Å; L253-W257 HydrophobicContact CD1-CB 4.31Å; W257-R289 PolarHBondContact O-NH2 3.27Å
258	G	89.5	Confident	93.2	Very high	40 Å²	40	44.7 Å²	44.7	41%	0.412	24%	0.242	S	C	.	.	S	Bend	trans	91.2	163.3	176.6	0	0	0	0	0	114.4	G260 S261	G258-G260 VanDerWaalsContact C-N 3.27Å; G258-G260 PolarHBondContact O-N 2.92Å; G258-S261 VanDerWaalsContact O-CB 3.26Å; G258-S261 WeakPolarHBondContact O-CB 3.39Å; G258-S261 PolarHBondContact O-N 3.21Å; G258-S261 VanDerWaalsContact O-N 3.1Å; G258-S261 PolarHBondContact O-OG 2.88Å
259	P	86.8	Confident	93.1	Very high	135 Å²	135	43.2 Å²	43.2	88%	0.877	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-29.6	-170.2	25.1	-34.5	0	0	0	113.4	S261 K270	P259-S261 VanDerWaalsContact C-N 3.31Å; P259-S261 PolarHBondContact O-N 2.88Å; P259-K270 PolarHBondContact O-NZ 3.18Å
260	G	84.9	Confident	92.9	Very high	44 Å²	44	39.1 Å²	39.1	45%	0.454	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	9.5	177	0	0	0	0	0	115.1	G258 R289	G258-G260 VanDerWaalsContact C-N 3.27Å; G258-G260 PolarHBondContact O-N 2.92Å; G260-R289 PolarHBondContact O-NH1 3.42Å
261	S	93.5	Very high	92.8	Very high	4 Å²	4	41.7 Å²	41.7	3%	0.028	24%	0.243	C	C	.	.	S	Bend	trans	-74	167.5	-177.4	67.9	0	0	0	0	114.1	F256 G258 P259 F263 K270	F256-S261 PolarHBondContact O-OG 3.13Å; G258-S261 VanDerWaalsContact O-CB 3.26Å; G258-S261 WeakPolarHBondContact O-CB 3.39Å; G258-S261 PolarHBondContact O-N 3.21Å; G258-S261 VanDerWaalsContact O-N 3.1Å; G258-S261 PolarHBondContact O-OG 2.88Å; P259-S261 VanDerWaalsContact C-N 3.31Å; P259-S261 PolarHBondContact O-N 2.88Å; S261-F263 PolarHBondContact O-N 2.98Å; S261-F263 PolarHBondContact OG-O 3.21Å; S261-F263 VanDerWaalsContact OG-O 3.08Å; S261-K270 WeakPolarHBondContact O-CD 3.11Å; S261-K270 VanDerWaalsContact O-CE 3.23Å; S261-K270 WeakPolarHBondContact O-CE 3.17Å; S261-K270 PolarHBondContact O-NZ 3.25Å
262	L	94.8	Very high	92.6	Very high	1 Å²	1	44 Å²	44	1%	0.005	25%	0.254	C	S	.	.	S	Bend	trans	-66.5	-32.4	179.2	-81.2	70.3	0	0	0	109.8	L255 L269 K270 Y273 L286 I502 F505	L255-L262 HydrophobicContact CD2-CD1 4.27Å; L255-L262 PolarHBondContact O-N 3.37Å; L262-L269 HydrophobicContact CB-CD1 3.77Å; L262-L269 WeakPolarHBondContact O-CD1 3.5Å; L262-K270 WeakPolarHBondContact O-CG 3.36Å; L262-K270 PolarHBondContact O-N 3.49Å; L262-Y273 HydrophobicContact CB-CE2 4.39Å; L262-Y273 HydrophobicContact CG-CD1 4.42Å; L262-Y273 HydrophobicContact CG-CE1 4.13Å; L262-Y273 HydrophobicContact CG-CE2 4.35Å; L262-L286 HydrophobicContact CD1-CD1 4.13Å; L262-I502 HydrophobicContact CD2-CD1 4.3Å; L262-F505 HydrophobicContact CD2-CB 4.04Å; L262-F505 HydrophobicContact CD2-CD1 4.11Å; L262-F505 HydrophobicContact CD2-CD2 3.32Å; L262-F505 HydrophobicContact CD2-CE1 4.43Å; L262-F505 HydrophobicContact CD2-CE2 3.72Å; L262-F505 HydrophobicContact CD2-CG 3.54Å; L262-F505 HydrophobicContact CD2-CZ 4.25Å
263	F	94	Very high	92.4	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.018	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	133.8	176.5	-75.6	-95.3	0	0	0	110.5	F215 Y218 F256 S261 N265 S268 L269 F505	F215-F263 HydrophobicContact CE1-CD1 4.06Å; F215-F263 HydrophobicContact CE1-CD2 4.1Å; F215-F263 HydrophobicContact CE1-CE1 4.11Å; F215-F263 HydrophobicContact CE1-CE2 4.15Å; F215-F263 HydrophobicContact CE1-CG 4.08Å; F215-F263 HydrophobicContact CE1-CZ 4.17Å; Y218-F263 HydrophobicContact CD2-CZ 4.27Å; Y218-F263 HydrophobicContact CE2-CE1 4.48Å; Y218-F263 HydrophobicContact CE2-CE2 4.36Å; Y218-F263 AromaticContact CE2-CZ 3.6Å; Y218-F263 HydrophobicContact CE2-CZ 3.6Å; F256-F263 AromaticContact CD1-CD2 3.98Å; F256-F263 HydrophobicContact CD1-CD2 3.98Å; F256-F263 AromaticContact CD1-CE2 3.79Å; F256-F263 HydrophobicContact CD1-CE2 3.79Å; F256-F263 HydrophobicContact CE1-CE2 4.16Å; S261-F263 PolarHBondContact O-N 2.98Å; S261-F263 PolarHBondContact OG-O 3.21Å; S261-F263 VanDerWaalsContact OG-O 3.08Å; F263-N265 WeakPolarHBondContact CB-O 3.29Å; F263-S268 CarbonylContact C-O 3.11Å; F263-S268 WeakPolarHBondContact CA-O 3.42Å; F263-L269 HydrophobicContact CD2-CD1 4.25Å; F263-L269 HydrophobicContact CE1-CB 4.48Å; F263-L269 HydrophobicContact CE2-CD1 4.04Å; F263-L269 HydrophobicContact CZ-CD1 4.24Å; F263-F505 HydrophobicContact CE2-CD1 4.42Å; F263-F505 AromaticContact CE2-CE1 3.92Å; F263-F505 HydrophobicContact CE2-CE1 3.92Å; F263-F505 HydrophobicContact CZ-CE1 4.47Å
264	L	90.3	Very high	92.3	Very high	114 Å²	114	45.3 Å²	45.3	60%	0.597	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	-53.9	174.5	-180	63.8	0	0	0	109.1	S268 K270	L264-S268 PolarHBondContact N-O 2.98Å; L264-K270 HydrophobicContact CB-CG 3.73Å; L264-K270 HydrophobicContact CD1-CG 4.32Å
265	N	88.4	Confident	92	Very high	81 Å²	81	53.6 Å²	53.6	43%	0.433	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	173.8	173.6	-58.2	-18.4	0	0	0	108	F263 W267 S268	F263-N265 WeakPolarHBondContact CB-O 3.29Å; N265-W267 HydrophobicContact CB-CD2 4.33Å; N265-W267 HydrophobicContact CB-CZ2 4.27Å; N265-W267 PolarHBondContact O-N 3.49Å; N265-S268 PolarHBondContact O-N 2.78Å
266	E	88.3	Confident	91.6	Very high	61 Å²	61	55.3 Å²	55.3	29%	0.285	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.6	-176.5	-162.2	162.9	-174.1	0	0	114	N42 D44 R214 F215	N42-E266 PolarHBondContact ND2-OE2 3.32Å; N42-E266 PolarHBondContact OD1-OE2 3.43Å; D44-E266 HydrophobicContact CB-CG 4.23Å; R214-E266 WeakPolarHBondContact CD-O 3.34Å; F215-E266 HydrophobicContact CE2-CG 3.92Å; F215-E266 HydrophobicContact CZ-CG 4.03Å; F215-E266 VanDerWaalsContact CZ-O 3.23Å; F215-E266 WeakPolarHBondContact CZ-O 3.44Å
267	W	89.3	Confident	91.3	Very high	80 Å²	80	58.9 Å²	58.9	30%	0.303	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-4.3	-175.8	57.3	82.9	0	0	0	116.1	E41 N42 R214 N265 D517	E41-W267 VanDerWaalsContact O-CH2 3.29Å; E41-W267 WeakPolarHBondContact O-CH2 3.37Å; N42-W267 HydrophobicContact CB-CZ3 3.89Å; R214-W267 PolarHBondContact NH1-O 2.88Å; N265-W267 HydrophobicContact CB-CD2 4.33Å; N265-W267 HydrophobicContact CB-CZ2 4.27Å; N265-W267 PolarHBondContact O-N 3.49Å; W267-D517 PolarHBondContact O-N 3.09Å
268	S	93.3	Very high	91.2	Very high	37 Å²	37	58.8 Å²	58.8	26%	0.259	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	131.7	-176.4	-175.4	0	0	0	0	113.2	F263 L264 N265 D517	F263-S268 CarbonylContact C-O 3.11Å; F263-S268 WeakPolarHBondContact CA-O 3.42Å; L264-S268 PolarHBondContact N-O 2.98Å; N265-S268 PolarHBondContact O-N 2.78Å; S268-D517 WeakPolarHBondContact CA-OD2 3.36Å; S268-D517 PolarHBondContact OG-OD2 3.07Å
269	L	94.5	Very high	91.4	Very high	3 Å²	3	62.3 Å²	62.3	2%	0.016	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	136.7	173.9	-170.9	74.7	0	0	0	109.8	L262 F263 A271 K274 F505 T509 D517	L262-L269 HydrophobicContact CB-CD1 3.77Å; L262-L269 WeakPolarHBondContact O-CD1 3.5Å; F263-L269 HydrophobicContact CD2-CD1 4.25Å; F263-L269 HydrophobicContact CE1-CB 4.48Å; F263-L269 HydrophobicContact CE2-CD1 4.04Å; F263-L269 HydrophobicContact CZ-CD1 4.24Å; L269-A271 PolarHBondContact O-N 2.84Å; L269-K274 HydrophobicContact CD2-CG 4.27Å; L269-F505 HydrophobicContact CD1-CD1 4.32Å; L269-T509 HydrophobicContact CD2-CG2 4.24Å; L269-D517 HydrophobicContact CB-CB 4.26Å; L269-D517 PolarHBondContact N-OD2 3Å
270	K	94.5	Very high	91.8	Very high	40 Å²	40	61.4 Å²	61.4	17%	0.174	34%	0.338	C	S	.	.			trans	-57.1	134	177	-66.4	166.2	175.4	171.5	0	110	P259 S261 L262 L264 E272 Y273	P259-K270 PolarHBondContact O-NZ 3.18Å; S261-K270 WeakPolarHBondContact O-CD 3.11Å; S261-K270 VanDerWaalsContact O-CE 3.23Å; S261-K270 WeakPolarHBondContact O-CE 3.17Å; S261-K270 PolarHBondContact O-NZ 3.25Å; L262-K270 WeakPolarHBondContact O-CG 3.36Å; L262-K270 PolarHBondContact O-N 3.49Å; L264-K270 HydrophobicContact CB-CG 3.73Å; L264-K270 HydrophobicContact CD1-CG 4.32Å; K270-E272 HydrophobicContact CB-CG 4.01Å; K270-E272 PolarHBondContact O-N 3.26Å; K270-Y273 HydrophobicContact CB-CD2 3.77Å; K270-Y273 HydrophobicContact CB-CE2 3.92Å; K270-Y273 HydrophobicContact CD-CE2 4.01Å; K270-Y273 HydrophobicContact CG-CE2 4.5Å; K270-Y273 PolarHBondContact O-N 2.89Å
271	A	93.8	Very high	92.3	Very high	60 Å²	60	64.5 Å²	64.5	50%	0.496	34%	0.34	S	S	.	.	H	α-helix	trans	-58.6	-24.4	-173.7	0	0	0	0	0	114	L269 Y273 K274	L269-A271 PolarHBondContact O-N 2.84Å; A271-Y273 VanDerWaalsContact C-N 3.29Å; A271-Y273 PolarHBondContact O-N 3.37Å; A271-K274 PolarHBondContact O-N 3.38Å
272	E	93.4	Very high	92.4	Very high	50 Å²	50	64.3 Å²	64.3	23%	0.234	34%	0.339	C	S	.	.	H	α-helix	trans	-59.2	-36.7	174.3	61	-178.4	-178.3	0	0	112.7	K270 K274 R275 L282 R285	K270-E272 HydrophobicContact CB-CG 4.01Å; K270-E272 PolarHBondContact O-N 3.26Å; E272-K274 VanDerWaalsContact C-N 3.3Å; E272-K274 PolarHBondContact O-N 3.45Å; E272-R275 PolarHBondContact O-N 3.21Å; E272-L282 HydrophobicContact CB-CD1 4.4Å; E272-L282 HydrophobicContact CB-CD2 4.25Å; E272-L282 HydrophobicContact CG-CD2 3.9Å; E272-L282 WeakPolarHBondContact O-CD1 3.49Å; E272-R285 VanDerWaalsContact CD-NH1 3.3Å; E272-R285 IonicContact OE1-NH1 2.97Å; E272-R285 PolarHBondContact OE1-NH1 3.09Å; E272-R285 VanDerWaalsContact OE1-NH1 3.17Å; E272-R285 IonicContact OE2-CZ 2.74Å; E272-R285 IonicContact OE2-NH1 3.03Å; E272-R285 PolarHBondContact OE2-NH1 3.22Å
273	Y	93.7	Very high	92.5	Very high	7 Å²	7	64.7 Å²	64.7	3%	0.027	34%	0.342	C	S	.	.	H	α-helix	trans	-76.7	-16	-179.8	-62.2	-77.5	0	0	0	113.5	L262 K270 A271 R275 L282 I502 R506	L262-Y273 HydrophobicContact CB-CE2 4.39Å; L262-Y273 HydrophobicContact CG-CD1 4.42Å; L262-Y273 HydrophobicContact CG-CE1 4.13Å; L262-Y273 HydrophobicContact CG-CE2 4.35Å; K270-Y273 HydrophobicContact CB-CD2 3.77Å; K270-Y273 HydrophobicContact CB-CE2 3.92Å; K270-Y273 HydrophobicContact CD-CE2 4.01Å; K270-Y273 HydrophobicContact CG-CE2 4.5Å; K270-Y273 PolarHBondContact O-N 2.89Å; A271-Y273 VanDerWaalsContact C-N 3.29Å; A271-Y273 PolarHBondContact O-N 3.37Å; Y273-R275 VanDerWaalsContact C-N 3.32Å; Y273-L282 HydrophobicContact CD1-CB 4.39Å; Y273-L282 HydrophobicContact CD1-CD1 3.91Å; Y273-L282 HydrophobicContact CD1-CD2 4.42Å; Y273-L282 HydrophobicContact CD1-CG 4.48Å; Y273-L282 HydrophobicContact CE1-CB 4.04Å; Y273-L282 HydrophobicContact CE1-CD1 4.21Å; Y273-L282 HydrophobicContact CE1-CD2 3.93Å; Y273-L282 HydrophobicContact CE1-CG 4.28Å; Y273-L282 HydrophobicContact CG-CD1 4.48Å; Y273-I502 HydrophobicContact CD1-CD1 3.77Å; Y273-I502 HydrophobicContact CD1-CG2 4.43Å; Y273-I502 HydrophobicContact CE1-CD1 3.55Å; Y273-R506 WeakPolarHBondContact O-CB 3.3Å; Y273-R506 WeakPolarHBondContact O-CG 3.49Å
274	K	93.3	Very high	92.6	Very high	83 Å²	83	69.3 Å²	69.3	36%	0.361	36%	0.364	S	S	.	.	H	α-helix	trans	-79.5	-16.2	174.1	-60.2	-172.9	179.2	-173.9	0	111.9	L269 A271 E272 E511 D517	L269-K274 HydrophobicContact CD2-CG 4.27Å; A271-K274 PolarHBondContact O-N 3.38Å; E272-K274 VanDerWaalsContact C-N 3.3Å; E272-K274 PolarHBondContact O-N 3.45Å; K274-E511 IonicContact NZ-OE2 2.66Å; K274-E511 PolarHBondContact NZ-OE2 3.21Å; K274-E511 VanDerWaalsContact NZ-OE2 3.09Å; K274-D517 VanDerWaalsContact CE-OD1 3.32Å; K274-D517 WeakPolarHBondContact CE-OD1 3.15Å; K274-D517 WeakPolarHBondContact CE-OD2 3.5Å; K274-D517 VanDerWaalsContact NZ-CG 3.33Å; K274-D517 IonicContact NZ-OD1 2.95Å; K274-D517 PolarHBondContact NZ-OD1 3.45Å; K274-D517 IonicContact NZ-OD2 3.77Å; K274-D517 PolarHBondContact NZ-OD2 2.97Å; K274-D517 VanDerWaalsContact NZ-OD2 3.15Å
275	R	91.7	Very high	92.9	Very high	174 Å²	174	68.7 Å²	68.7	66%	0.657	35%	0.354	S	S	*	.			trans	-97.2	139.5	-176.7	-62	177.7	-174.2	177.7	1.7	111.5	E272 Y273	E272-R275 PolarHBondContact O-N 3.21Å; Y273-R275 VanDerWaalsContact C-N 3.32Å
276	G	87.2	Confident	93.3	Very high	42 Å²	42	65 Å²	65	43%	0.433	33%	0.334	S	S	.	.	S	Bend	trans	-79.2	-23.8	-178.7	0	0	0	0	0	115.7	Q278	G276-Q278 PolarHBondContact O-N 3.03Å
277	G	88.3	Confident	93.7	Very high	81 Å²	81	62.6 Å²	62.6	84%	0.835	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-29.8	-167.5	0	0	0	0	0	115.8
278	Q	91.8	Very high	94.1	Very high	94 Å²	94	61.9 Å²	61.9	44%	0.439	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	21.3	-173.8	-68.4	170.9	-10.7	0	0	113.3	G276 L280 E281 L282	G276-Q278 PolarHBondContact O-N 3.03Å; Q278-L280 VanDerWaalsContact C-N 3.32Å; Q278-L280 PolarHBondContact O-N 3.28Å; Q278-E281 PolarHBondContact O-N 3.14Å; Q278-L282 HydrophobicContact CB-CD1 4.5Å; Q278-L282 HydrophobicContact CB-CG 4.48Å; Q278-L282 WeakPolarHBondContact O-CG 3.5Å; Q278-L282 PolarHBondContact O-N 3.01Å
279	R	93.4	Very high	94.2	Very high	114 Å²	114	62.2 Å²	62.2	43%	0.43	32%	0.321	S	S	.	.	H	α-helix	trans	-56.1	-39.8	-171.5	70.2	178.5	-175.1	159.1	-2.2	114.4	A283 D503	R279-A283 VanDerWaalsContact O-CB 3.26Å; R279-A283 WeakPolarHBondContact O-CB 3.34Å; R279-A283 PolarHBondContact O-N 3Å; R279-D503 IonicContact NH1-OD2 2.78Å
280	L	95	Very high	94.4	Very high	116 Å²	116	62.1 Å²	62.1	61%	0.607	32%	0.321	S	S	*	.	H	α-helix	trans	-71.6	-38.5	-178	-67.3	175.3	0	0	0	111.6	Q278 A283 Q284 L499	Q278-L280 VanDerWaalsContact C-N 3.32Å; Q278-L280 PolarHBondContact O-N 3.28Å; L280-A283 PolarHBondContact O-N 3.38Å; L280-Q284 WeakPolarHBondContact O-CB 3.05Å; L280-Q284 PolarHBondContact O-N 2.99Å; L280-L499 HydrophobicContact CD2-CD1 4.17Å; L280-L499 HydrophobicContact CD2-CD2 4.37Å
281	E	95.4	Very high	94.5	Very high	108 Å²	108	62.2 Å²	62.2	51%	0.505	32%	0.323	S	S	.	.	H	α-helix	trans	-66.7	-44.6	176.7	-166.6	-164.6	143.2	0	0	110.9	Q278 Q284 R285	Q278-E281 PolarHBondContact O-N 3.14Å; E281-Q284 PolarHBondContact O-N 3.19Å; E281-R285 PolarHBondContact O-N 2.98Å; E281-R285 IonicContact OE1-NH2 3.15Å; E281-R285 PolarHBondContact OE1-NH2 3.17Å
282	L	95.8	Very high	94.7	Very high	1 Å²	1	68 Å²	68	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-63.5	-41.4	176.1	-66.8	174.1	0	0	0	111.9	E272 Y273 Q278 Q284 R285 L286 I502	E272-L282 HydrophobicContact CB-CD1 4.4Å; E272-L282 HydrophobicContact CB-CD2 4.25Å; E272-L282 HydrophobicContact CG-CD2 3.9Å; E272-L282 WeakPolarHBondContact O-CD1 3.49Å; Y273-L282 HydrophobicContact CD1-CB 4.39Å; Y273-L282 HydrophobicContact CD1-CD1 3.91Å; Y273-L282 HydrophobicContact CD1-CD2 4.42Å; Y273-L282 HydrophobicContact CD1-CG 4.48Å; Y273-L282 HydrophobicContact CE1-CB 4.04Å; Y273-L282 HydrophobicContact CE1-CD1 4.21Å; Y273-L282 HydrophobicContact CE1-CD2 3.93Å; Y273-L282 HydrophobicContact CE1-CG 4.28Å; Y273-L282 HydrophobicContact CG-CD1 4.48Å; Q278-L282 HydrophobicContact CB-CD1 4.5Å; Q278-L282 HydrophobicContact CB-CG 4.48Å; Q278-L282 WeakPolarHBondContact O-CG 3.5Å; Q278-L282 PolarHBondContact O-N 3.01Å; L282-Q284 VanDerWaalsContact C-N 3.32Å; L282-Q284 PolarHBondContact O-N 3.01Å; L282-R285 PolarHBondContact O-N 3.37Å; L282-L286 PolarHBondContact O-N 3.34Å; L282-I502 HydrophobicContact CB-CG2 4.3Å
283	A	96.4	Very high	94.9	Very high	9 Å²	9	66.8 Å²	66.8	7%	0.074	33%	0.327	C	S	.	.	H	α-helix	trans	-61.6	-40.6	174.3	0	0	0	0	0	111.7	R279 L280 L286 S287 L499 I502	R279-A283 VanDerWaalsContact O-CB 3.26Å; R279-A283 WeakPolarHBondContact O-CB 3.34Å; R279-A283 PolarHBondContact O-N 3Å; L280-A283 PolarHBondContact O-N 3.38Å; A283-L286 PolarHBondContact O-N 2.68Å; A283-S287 VanDerWaalsContact O-CB 3.25Å; A283-S287 WeakPolarHBondContact O-CB 3.36Å; A283-S287 PolarHBondContact O-N 2.84Å; A283-L499 HydrophobicContact CB-CB 4.11Å; A283-L499 HydrophobicContact CB-CD1 3.83Å; A283-I502 HydrophobicContact CB-CG1 4.34Å
284	Q	96.8	Very high	95.1	Very high	101 Å²	101	66.4 Å²	66.4	47%	0.472	33%	0.326	S	S	.	.	H	α-helix	trans	-67.7	-38.4	176.2	-171.7	65	-2.8	0	0	112.2	L280 E281 L282 S287 N288	L280-Q284 WeakPolarHBondContact O-CB 3.05Å; L280-Q284 PolarHBondContact O-N 2.99Å; E281-Q284 PolarHBondContact O-N 3.19Å; L282-Q284 VanDerWaalsContact C-N 3.32Å; L282-Q284 PolarHBondContact O-N 3.01Å; Q284-S287 WeakPolarHBondContact O-CB 3.22Å; Q284-S287 PolarHBondContact O-N 2.71Å; Q284-N288 WeakPolarHBondContact O-CB 3.27Å; Q284-N288 VanDerWaalsContact O-CG 3.3Å; Q284-N288 PolarHBondContact O-N 2.94Å; Q284-N288 PolarHBondContact O-ND2 3.38Å
285	R	96.3	Very high	95.3	Very high	101 Å²	101	65.2 Å²	65.2	38%	0.381	32%	0.323	S	S	.	.	H	α-helix	trans	-62.2	-44.8	174.5	-165.2	-177.7	-62.1	158.7	1.6	111.3	E272 E281 L282 N288 R289	E272-R285 VanDerWaalsContact CD-NH1 3.3Å; E272-R285 IonicContact OE1-NH1 2.97Å; E272-R285 PolarHBondContact OE1-NH1 3.09Å; E272-R285 VanDerWaalsContact OE1-NH1 3.17Å; E272-R285 IonicContact OE2-CZ 2.74Å; E272-R285 IonicContact OE2-NH1 3.03Å; E272-R285 PolarHBondContact OE2-NH1 3.22Å; E281-R285 PolarHBondContact O-N 2.98Å; E281-R285 IonicContact OE1-NH2 3.15Å; E281-R285 PolarHBondContact OE1-NH2 3.17Å; L282-R285 PolarHBondContact O-N 3.37Å; R285-N288 PolarHBondContact O-N 3.33Å; R285-R289 PolarHBondContact O-N 3.08Å
286	L	96.8	Very high	95.6	Very high	4 Å²	4	59 Å²	59	2%	0.021	31%	0.308	C	S	.	.	H	α-helix	trans	-64.2	-43.8	174.8	-179.7	59.8	0	0	0	111.7	I254 L262 L282 A283 N288 R289 I290 A498 I501 I502	I254-L286 HydrophobicContact CG2-CD1 3.85Å; L262-L286 HydrophobicContact CD1-CD1 4.13Å; L282-L286 PolarHBondContact O-N 3.34Å; A283-L286 PolarHBondContact O-N 2.68Å; L286-N288 PolarHBondContact O-N 2.83Å; L286-R289 WeakPolarHBondContact O-CB 3.43Å; L286-R289 PolarHBondContact O-N 3.48Å; L286-I290 HydrophobicContact CD1-CD1 4.22Å; L286-I290 HydrophobicContact CD1-CG1 4.31Å; L286-I290 HydrophobicContact CG-CD1 3.9Å; L286-I290 HydrophobicContact CG-CG1 4.46Å; L286-I290 VanDerWaalsContact O-CG1 3.28Å; L286-I290 WeakPolarHBondContact O-CG1 3.49Å; L286-I290 PolarHBondContact O-N 3.39Å; L286-A498 HydrophobicContact CB-CB 4.47Å; L286-A498 HydrophobicContact CD2-CB 4.26Å; L286-A498 HydrophobicContact CG-CB 4.3Å; L286-I501 HydrophobicContact CD2-CB 4.3Å; L286-I501 HydrophobicContact CD2-CG2 3.97Å; L286-I502 HydrophobicContact CB-CD1 4.27Å; L286-I502 HydrophobicContact CD2-CD1 3.6Å; L286-I502 HydrophobicContact CD2-CG1 4Å
287	S	97.4	Very high	96.1	Very high	10 Å²	10	58.2 Å²	58.2	7%	0.07	29%	0.294	C	S	.	.	H	α-helix	trans	-57	-45.9	175.8	172.3	0	0	0	0	112.4	A283 Q284 I290 L291 R495	A283-S287 VanDerWaalsContact O-CB 3.25Å; A283-S287 WeakPolarHBondContact O-CB 3.36Å; A283-S287 PolarHBondContact O-N 2.84Å; Q284-S287 WeakPolarHBondContact O-CB 3.22Å; Q284-S287 PolarHBondContact O-N 2.71Å; S287-I290 PolarHBondContact O-N 2.87Å; S287-L291 PolarHBondContact O-N 3.49Å; S287-R495 WeakPolarHBondContact OG-CG 3.47Å; S287-R495 PolarHBondContact OG-NE 3.32Å
288	N	96.7	Very high	96.5	Very high	65 Å²	65	60.4 Å²	60.4	35%	0.348	28%	0.281	S	S	.	.	H	α-helix	trans	-66.3	-37.9	176.5	-71.9	-17.5	0	0	0	112	Q284 R285 L286 L291 W292	Q284-N288 WeakPolarHBondContact O-CB 3.27Å; Q284-N288 VanDerWaalsContact O-CG 3.3Å; Q284-N288 PolarHBondContact O-N 2.94Å; Q284-N288 PolarHBondContact O-ND2 3.38Å; R285-N288 PolarHBondContact O-N 3.33Å; L286-N288 PolarHBondContact O-N 2.83Å; N288-L291 WeakPolarHBondContact O-CB 3.43Å; N288-L291 PolarHBondContact O-N 2.95Å; N288-W292 PolarHBondContact O-N 3.19Å
289	R	96.4	Very high	96.8	Very high	44 Å²	44	61.8 Å²	61.8	17%	0.166	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-46.1	174.4	-178.2	178.9	-179.1	-169.3	-2.9	112	L253 I254 W257 G260 R285 L286 L291 W292 I293	L253-R289 PolarHBondContact O-NH2 2.87Å; I254-R289 PolarHBondContact O-NH1 2.95Å; W257-R289 PolarHBondContact O-NH2 3.27Å; G260-R289 PolarHBondContact O-NH1 3.42Å; R285-R289 PolarHBondContact O-N 3.08Å; L286-R289 WeakPolarHBondContact O-CB 3.43Å; L286-R289 PolarHBondContact O-N 3.48Å; R289-L291 PolarHBondContact O-N 2.8Å; R289-W292 PolarHBondContact O-N 3.48Å; R289-I293 HydrophobicContact CG-CD1 3.96Å; R289-I293 PolarHBondContact O-N 2.77Å
290	I	97.6	Very high	96.9	Very high	1 Å²	1	60.6 Å²	60.6	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-57.2	-42.3	176.3	-69.1	162.7	0	0	0	109.9	I254 L286 S287 I293 G294 L490 L494 R495 A498	I254-I290 HydrophobicContact CD1-CG1 4.28Å; I254-I290 HydrophobicContact CG2-CD1 4.49Å; I254-I290 HydrophobicContact CG2-CG1 3.74Å; L286-I290 HydrophobicContact CD1-CD1 4.22Å; L286-I290 HydrophobicContact CD1-CG1 4.31Å; L286-I290 HydrophobicContact CG-CD1 3.9Å; L286-I290 HydrophobicContact CG-CG1 4.46Å; L286-I290 VanDerWaalsContact O-CG1 3.28Å; L286-I290 WeakPolarHBondContact O-CG1 3.49Å; L286-I290 PolarHBondContact O-N 3.39Å; S287-I290 PolarHBondContact O-N 2.87Å; I290-I293 PolarHBondContact O-N 3.26Å; I290-G294 PolarHBondContact O-N 2.78Å; I290-L490 HydrophobicContact CG2-CB 4.48Å; I290-L490 WeakPolarHBondContact CG2-O 3.37Å; I290-L494 HydrophobicContact CD1-CD2 4.01Å; I290-L494 HydrophobicContact CD1-CG 4.09Å; I290-L494 HydrophobicContact CG1-CD2 4.13Å; I290-L494 HydrophobicContact CG2-CB 4.41Å; I290-L494 HydrophobicContact CG2-CD2 4.04Å; I290-L494 HydrophobicContact CG2-CG 4.45Å; I290-R495 HydrophobicContact CG2-CB 4.24Å; I290-A498 HydrophobicContact CD1-CB 4.36Å
291	L	97.8	Very high	97	Very high	42 Å²	42	56 Å²	56	22%	0.22	27%	0.269	C	S	.	.	H	α-helix	trans	-60.1	-50.4	176.9	179.5	64.6	0	0	0	112.1	S287 N288 R289 I293 G294 I295 I491	S287-L291 PolarHBondContact O-N 3.49Å; N288-L291 WeakPolarHBondContact O-CB 3.43Å; N288-L291 PolarHBondContact O-N 2.95Å; R289-L291 PolarHBondContact O-N 2.8Å; L291-I293 PolarHBondContact O-N 3.13Å; L291-G294 PolarHBondContact O-N 3.3Å; L291-I295 HydrophobicContact CD1-CD1 4.1Å; L291-I295 HydrophobicContact CD1-CG1 4.38Å; L291-I295 HydrophobicContact CG-CD1 3.99Å; L291-I295 WeakPolarHBondContact O-CG1 3.23Å; L291-I295 PolarHBondContact O-N 3.15Å; L291-I491 HydrophobicContact CD1-CG1 4.35Å; L291-I491 HydrophobicContact CD1-CG2 4.1Å
292	W	97.3	Very high	97.1	Very high	180 Å²	180	54.3 Å²	54.3	68%	0.682	27%	0.268	S	S	*	.	H	α-helix	trans	-64.1	-39.6	-179.8	-77.2	116.5	0	0	0	112.9	N288 R289 I295 A296	N288-W292 PolarHBondContact O-N 3.19Å; R289-W292 PolarHBondContact O-N 3.48Å; W292-I295 HydrophobicContact CE3-CD1 4.28Å; W292-I295 HydrophobicContact CZ3-CD1 4.44Å; W292-I295 PolarHBondContact O-N 3.38Å; W292-A296 WeakPolarHBondContact O-CB 3.48Å; W292-A296 PolarHBondContact O-N 2.82Å
293	I	97.5	Very high	97.1	Very high	25 Å²	25	56.6 Å²	56.6	13%	0.128	28%	0.28	C	S	.	.	H	α-helix	trans	-66.5	-39.9	174.1	-69.4	173.6	0	0	0	110.4	I254 R289 I290 L291 A296 N297 L490	I254-I293 HydrophobicContact CB-CD1 4.45Å; I254-I293 HydrophobicContact CD1-CG2 4.23Å; I254-I293 HydrophobicContact CG1-CB 4.33Å; I254-I293 HydrophobicContact CG1-CD1 3.55Å; I254-I293 HydrophobicContact CG1-CG2 4.08Å; R289-I293 HydrophobicContact CG-CD1 3.96Å; R289-I293 PolarHBondContact O-N 2.77Å; I290-I293 PolarHBondContact O-N 3.26Å; L291-I293 PolarHBondContact O-N 3.13Å; I293-A296 PolarHBondContact O-N 3.45Å; I293-N297 PolarHBondContact O-N 2.86Å; I293-N297 PolarHBondContact O-ND2 2.75Å; I293-L490 HydrophobicContact CG2-CD1 4.48Å
294	G	97.6	Very high	97.1	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-60.1	-45.1	173.9	0	0	0	0	0	112.8	I290 L291 N297 F298 P487	I290-G294 PolarHBondContact O-N 2.78Å; L291-G294 PolarHBondContact O-N 3.3Å; G294-N297 PolarHBondContact O-N 3.44Å; G294-F298 PolarHBondContact O-N 2.63Å; G294-P487 WeakPolarHBondContact O-CB 3.44Å
295	I	98.1	Very high	97.1	Very high	58 Å²	58	56.1 Å²	56.1	30%	0.297	28%	0.279	S	S	.	.	H	α-helix	trans	-63.6	-43.1	175.6	-67.9	168.2	0	0	0	110.7	L291 W292 N297 F298 L299	L291-I295 HydrophobicContact CD1-CD1 4.1Å; L291-I295 HydrophobicContact CD1-CG1 4.38Å; L291-I295 HydrophobicContact CG-CD1 3.99Å; L291-I295 WeakPolarHBondContact O-CG1 3.23Å; L291-I295 PolarHBondContact O-N 3.15Å; W292-I295 HydrophobicContact CE3-CD1 4.28Å; W292-I295 HydrophobicContact CZ3-CD1 4.44Å; W292-I295 PolarHBondContact O-N 3.38Å; I295-N297 VanDerWaalsContact C-N 3.35Å; I295-N297 PolarHBondContact O-N 2.94Å; I295-F298 WeakPolarHBondContact O-CB 3.45Å; I295-F298 PolarHBondContact O-N 3.08Å; I295-F298 VanDerWaalsContact O-N 3.16Å; I295-L299 HydrophobicContact CG2-CD1 4.14Å; I295-L299 HydrophobicContact CG2-CG 4.41Å; I295-L299 WeakPolarHBondContact O-CG 3.33Å; I295-L299 PolarHBondContact O-N 3.1Å
296	A	97.4	Very high	97.1	Very high	43 Å²	43	54.6 Å²	54.6	36%	0.355	28%	0.278	S	S	.	.	H	α-helix	trans	-60.6	-42.9	176	0	0	0	0	0	112	W292 I293 F298 L299 L300	W292-A296 WeakPolarHBondContact O-CB 3.48Å; W292-A296 PolarHBondContact O-N 2.82Å; I293-A296 PolarHBondContact O-N 3.45Å; A296-F298 VanDerWaalsContact C-N 3.33Å; A296-F298 PolarHBondContact O-N 3.25Å; A296-L299 PolarHBondContact O-N 3.01Å; A296-L300 WeakPolarHBondContact O-CB 3.41Å; A296-L300 WeakPolarHBondContact O-CG 3.34Å; A296-L300 PolarHBondContact O-N 3.42Å
297	N	97.6	Very high	97.1	Very high	25 Å²	25	57.9 Å²	57.9	13%	0.134	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-39.1	174	-81.7	-91.3	0	0	0	111.9	N250 I293 G294 I295 L300 C301 P487	N250-N297 PolarHBondContact ND2-OD1 2.82Å; N250-N297 PolarHBondContact OD1-ND2 3Å; N250-N297 PolarHBondContact OD1-OD1 2.77Å; I293-N297 PolarHBondContact O-N 2.86Å; I293-N297 PolarHBondContact O-ND2 2.75Å; G294-N297 PolarHBondContact O-N 3.44Å; I295-N297 VanDerWaalsContact C-N 3.35Å; I295-N297 PolarHBondContact O-N 2.94Å; N297-L300 PolarHBondContact O-N 3.27Å; N297-C301 PolarHBondContact O-N 3.47Å; N297-P487 HydrophobicContact CB-CB 4.14Å
298	F	97.9	Very high	97	Very high	127 Å²	127	59.4 Å²	59.4	56%	0.557	30%	0.296	S	S	*	.	H	α-helix	trans	-63.8	-42.2	176.4	-176.7	-103.2	0	0	0	111.9	G294 I295 A296 C301 P487	G294-F298 PolarHBondContact O-N 2.63Å; I295-F298 WeakPolarHBondContact O-CB 3.45Å; I295-F298 PolarHBondContact O-N 3.08Å; I295-F298 VanDerWaalsContact O-N 3.16Å; A296-F298 VanDerWaalsContact C-N 3.33Å; A296-F298 PolarHBondContact O-N 3.25Å; F298-C301 WeakPolarHBondContact O-CB 3.33Å; F298-C301 PolarHBondContact O-N 3.45Å; F298-P487 HydrophobicContact CB-CB 3.88Å; F298-P487 HydrophobicContact CB-CG 4.35Å; F298-P487 HydrophobicContact CD2-CB 4.5Å; F298-P487 HydrophobicContact CD2-CG 4.35Å
299	L	97.1	Very high	97	Very high	124 Å²	124	60.4 Å²	60.4	65%	0.649	30%	0.3	S	S	*	.	H	α-helix	trans	-66.8	-36.6	176.2	-68.4	173.4	0	0	0	112.6	I295 A296 C301 P302	I295-L299 HydrophobicContact CG2-CD1 4.14Å; I295-L299 HydrophobicContact CG2-CG 4.41Å; I295-L299 WeakPolarHBondContact O-CG 3.33Å; I295-L299 PolarHBondContact O-N 3.1Å; A296-L299 PolarHBondContact O-N 3.01Å; L299-C301 VanDerWaalsContact C-N 3.33Å; L299-P302 WeakPolarHBondContact O-CD 3.24Å
300	L	96.4	Very high	97	Very high	88 Å²	88	60.3 Å²	60.3	46%	0.461	30%	0.303	S	S	.	.	H	α-helix	trans	-82	-10.1	177.7	-66.3	173	0	0	0	113.6	A296 N297 L303 I304	A296-L300 WeakPolarHBondContact O-CB 3.41Å; A296-L300 WeakPolarHBondContact O-CG 3.34Å; A296-L300 PolarHBondContact O-N 3.42Å; N297-L300 PolarHBondContact O-N 3.27Å; L300-L303 HydrophobicContact CD2-CD1 4.34Å; L300-L303 PolarHBondContact O-N 3.15Å; L300-L303 VanDerWaalsContact O-N 3.14Å; L300-I304 HydrophobicContact CB-CD1 3.84Å; L300-I304 HydrophobicContact CB-CG1 4.34Å; L300-I304 WeakPolarHBondContact O-CG1 3.26Å; L300-I304 PolarHBondContact O-N 3.25Å; L300-I304 VanDerWaalsContact O-N 3.09Å
301	C	97.3	Very high	96.8	Very high	19 Å²	19	64.5 Å²	64.5	13%	0.128	32%	0.319	C	S	.	.	H	α-helix	trans	-45.8	-52.8	-178.6	178.7	0	0	0	0	114.3	N297 F298 L299 L303 I304 L305 P483	N297-C301 PolarHBondContact O-N 3.47Å; F298-C301 WeakPolarHBondContact O-CB 3.33Å; F298-C301 PolarHBondContact O-N 3.45Å; L299-C301 VanDerWaalsContact C-N 3.33Å; C301-L303 VanDerWaalsContact C-N 3.3Å; C301-L303 PolarHBondContact O-N 2.82Å; C301-I304 PolarHBondContact O-N 3.2Å; C301-L305 VanDerWaalsContact O-CB 3.25Å; C301-L305 WeakPolarHBondContact O-CB 3.48Å; C301-L305 PolarHBondContact O-N 3.21Å; C301-P483 PolarHBondContact SG-O 3.08Å
302	P	96.2	Very high	96.6	Very high	74 Å²	74	63.4 Å²	63.4	48%	0.481	32%	0.316	S	S	.	.	H	α-helix	trans	-61.4	-38.1	-177	22.9	-34	0	0	0	112.7	L299 I306	L299-P302 WeakPolarHBondContact O-CD 3.24Å; P302-I306 WeakPolarHBondContact O-CD1 3.31Å; P302-I306 VanDerWaalsContact O-CG1 3.24Å; P302-I306 WeakPolarHBondContact O-CG1 3.22Å; P302-I306 PolarHBondContact O-N 2.82Å
303	L	95.9	Very high	96.5	Very high	48 Å²	48	60.9 Å²	60.9	25%	0.251	31%	0.31	S	S	.	.	H	α-helix	trans	-70.1	-45	-179.7	-62.8	173.6	0	0	0	111.7	I135 I138 L300 C301 L305 I306 W307	I135-L303 HydrophobicContact CG1-CD2 4.14Å; I138-L303 HydrophobicContact CD1-CD1 3.8Å; I138-L303 HydrophobicContact CG2-CD1 3.9Å; L300-L303 HydrophobicContact CD2-CD1 4.34Å; L300-L303 PolarHBondContact O-N 3.15Å; L300-L303 VanDerWaalsContact O-N 3.14Å; C301-L303 VanDerWaalsContact C-N 3.3Å; C301-L303 PolarHBondContact O-N 2.82Å; L303-L305 VanDerWaalsContact C-N 3.31Å; L303-L305 PolarHBondContact O-N 2.73Å; L303-I306 PolarHBondContact O-N 2.68Å; L303-W307 PolarHBondContact O-N 3Å; L303-W307 VanDerWaalsContact O-N 3.09Å
304	I	96.4	Very high	96.3	Very high	59 Å²	59	62.7 Å²	62.7	30%	0.303	32%	0.317	S	S	.	.	H	α-helix	trans	-65.8	-38.9	178.5	-57.1	167.1	0	0	0	109.7	L300 C301 W307 Q308 P483	L300-I304 HydrophobicContact CB-CD1 3.84Å; L300-I304 HydrophobicContact CB-CG1 4.34Å; L300-I304 WeakPolarHBondContact O-CG1 3.26Å; L300-I304 PolarHBondContact O-N 3.25Å; L300-I304 VanDerWaalsContact O-N 3.09Å; C301-I304 PolarHBondContact O-N 3.2Å; I304-W307 PolarHBondContact O-N 2.92Å; I304-Q308 HydrophobicContact CG2-CG 4.38Å; I304-Q308 VanDerWaalsContact O-CG 3.32Å; I304-Q308 WeakPolarHBondContact O-CG 3.38Å; I304-Q308 PolarHBondContact O-N 3.31Å; I304-P483 HydrophobicContact CB-CB 4.07Å; I304-P483 HydrophobicContact CB-CG 4.22Å; I304-P483 HydrophobicContact CG2-CB 3.94Å; I304-P483 HydrophobicContact CG2-CG 3.62Å
305	L	97.1	Very high	96.1	Very high	41 Å²	41	64.9 Å²	64.9	22%	0.215	33%	0.332	C	S	.	.	H	α-helix	trans	-63.9	-45.3	177.5	-175.9	63.7	0	0	0	112	C301 L303 W307 Q308 I309 L480 P483 I484	C301-L305 VanDerWaalsContact O-CB 3.25Å; C301-L305 WeakPolarHBondContact O-CB 3.48Å; C301-L305 PolarHBondContact O-N 3.21Å; L303-L305 VanDerWaalsContact C-N 3.31Å; L303-L305 PolarHBondContact O-N 2.73Å; L305-W307 VanDerWaalsContact C-N 3.31Å; L305-W307 PolarHBondContact O-N 3.21Å; L305-Q308 PolarHBondContact O-N 3.08Å; L305-I309 HydrophobicContact CD1-CD1 4.27Å; L305-I309 HydrophobicContact CD1-CG1 4.43Å; L305-I309 HydrophobicContact CG-CD1 3.97Å; L305-I309 WeakPolarHBondContact O-CG1 3.5Å; L305-I309 PolarHBondContact O-N 3.35Å; L305-L480 WeakPolarHBondContact CD1-O 3.41Å; L305-P483 HydrophobicContact CB-CB 4.37Å; L305-I484 HydrophobicContact CD1-CD1 4.28Å; L305-I484 HydrophobicContact CD1-CG1 4.47Å; L305-I484 HydrophobicContact CD2-CD1 4.06Å; L305-I484 HydrophobicContact CD2-CG1 4.31Å
306	I	96.3	Very high	95.7	Very high	70 Å²	70	64.9 Å²	64.9	36%	0.359	33%	0.329	S	S	.	.	H	α-helix	trans	-56.7	-47.5	174.5	-70.7	164.4	0	0	0	110.2	I135 P302 L303 Q308 I309 L310	I135-I306 HydrophobicContact CD1-CD1 4.24Å; P302-I306 WeakPolarHBondContact O-CD1 3.31Å; P302-I306 VanDerWaalsContact O-CG1 3.24Å; P302-I306 WeakPolarHBondContact O-CG1 3.22Å; P302-I306 PolarHBondContact O-N 2.82Å; L303-I306 PolarHBondContact O-N 2.68Å; I306-Q308 PolarHBondContact O-N 3.19Å; I306-I309 PolarHBondContact O-N 3.3Å; I306-L310 HydrophobicContact CG2-CD1 3.78Å; I306-L310 HydrophobicContact CG2-CG 4.36Å; I306-L310 WeakPolarHBondContact O-CB 3.3Å; I306-L310 VanDerWaalsContact O-CG 3.27Å; I306-L310 WeakPolarHBondContact O-CG 3.14Å; I306-L310 PolarHBondContact O-N 3.09Å
307	W	96.3	Very high	95.4	Very high	72 Å²	72	64.7 Å²	64.7	27%	0.273	33%	0.328	S	S	.	.	H	α-helix	trans	-58.7	-47.1	176.8	169.1	-101.5	0	0	0	112.4	F73 V76 L303 I304 L305 I309 L310 Y311	F73-W307 HydrophobicContact CB-CH2 4.32Å; F73-W307 HydrophobicContact CD2-CE3 4.06Å; F73-W307 AromaticContact CD2-CH2 3.57Å; F73-W307 HydrophobicContact CD2-CH2 3.57Å; F73-W307 HydrophobicContact CD2-CZ2 4.17Å; F73-W307 AromaticContact CD2-CZ3 3.49Å; F73-W307 HydrophobicContact CD2-CZ3 3.49Å; F73-W307 VanDerWaalsContact CD2-CZ3 3.49Å; F73-W307 HydrophobicContact CE2-CD2 4.48Å; F73-W307 AromaticContact CE2-CE3 3.96Å; F73-W307 HydrophobicContact CE2-CE3 3.96Å; F73-W307 HydrophobicContact CE2-CH2 4.29Å; F73-W307 AromaticContact CE2-CZ3 3.85Å; F73-W307 HydrophobicContact CE2-CZ3 3.85Å; F73-W307 HydrophobicContact CG-CH2 4.3Å; F73-W307 HydrophobicContact CG-CZ3 4.25Å; V76-W307 HydrophobicContact CB-CH2 4.46Å; V76-W307 HydrophobicContact CB-CZ3 3.99Å; V76-W307 HydrophobicContact CG1-CE3 4.31Å; V76-W307 HydrophobicContact CG1-CH2 4.49Å; V76-W307 HydrophobicContact CG1-CZ3 3.75Å; L303-W307 PolarHBondContact O-N 3Å; L303-W307 VanDerWaalsContact O-N 3.09Å; I304-W307 PolarHBondContact O-N 2.92Å; L305-W307 VanDerWaalsContact C-N 3.31Å; L305-W307 PolarHBondContact O-N 3.21Å; W307-I309 PolarHBondContact O-N 2.95Å; W307-L310 PolarHBondContact O-N 3.22Å; W307-Y311 HydrophobicContact CH2-CD2 4.19Å; W307-Y311 AromaticContact CZ2-CD2 3.86Å; W307-Y311 HydrophobicContact CZ2-CD2 3.86Å; W307-Y311 HydrophobicContact CZ2-CG 4.26Å; W307-Y311 VanDerWaalsContact O-CB 3.23Å; W307-Y311 WeakPolarHBondContact O-CB 3.23Å; W307-Y311 PolarHBondContact O-N 3.38Å
308	Q	96.1	Very high	95.1	Very high	43 Å²	43	68.1 Å²	68.1	20%	0.201	34%	0.343	C	S	.	.	H	α-helix	trans	-63.3	-41.6	180	-69.9	-65.8	-7.6	0	0	112.2	I304 L305 I306 A312 L480 P483	I304-Q308 HydrophobicContact CG2-CG 4.38Å; I304-Q308 VanDerWaalsContact O-CG 3.32Å; I304-Q308 WeakPolarHBondContact O-CG 3.38Å; I304-Q308 PolarHBondContact O-N 3.31Å; L305-Q308 PolarHBondContact O-N 3.08Å; I306-Q308 PolarHBondContact O-N 3.19Å; Q308-A312 WeakPolarHBondContact O-CB 3.37Å; Q308-A312 PolarHBondContact O-N 3.47Å; Q308-L480 HydrophobicContact CB-CD1 3.89Å; Q308-P483 HydrophobicContact CG-CG 4.03Å
309	I	96.6	Very high	94.7	Very high	86 Å²	86	63.6 Å²	63.6	44%	0.441	33%	0.325	S	S	.	.	H	α-helix	trans	-61.3	-51	176.2	-67.9	166.5	0	0	0	110.4	L305 I306 W307 A312 F313 L480	L305-I309 HydrophobicContact CD1-CD1 4.27Å; L305-I309 HydrophobicContact CD1-CG1 4.43Å; L305-I309 HydrophobicContact CG-CD1 3.97Å; L305-I309 WeakPolarHBondContact O-CG1 3.5Å; L305-I309 PolarHBondContact O-N 3.35Å; I306-I309 PolarHBondContact O-N 3.3Å; W307-I309 PolarHBondContact O-N 2.95Å; I309-A312 PolarHBondContact O-N 3.37Å; I309-F313 WeakPolarHBondContact O-CB 3.41Å; I309-F313 PolarHBondContact O-N 2.92Å; I309-L480 HydrophobicContact CB-CD1 4.36Å; I309-L480 HydrophobicContact CG1-CD1 3.6Å
310	L	95.9	Very high	94.2	Very high	41 Å²	41	61.8 Å²	61.8	22%	0.215	32%	0.316	C	S	.	.	H	α-helix	trans	-62.4	-46.9	-179	-68.2	174.1	0	0	0	111.4	V76 T80 I306 W307 A312 F313 F314	V76-L310 HydrophobicContact CG1-CB 4.09Å; T80-L310 HydrophobicContact CG2-CD1 3.93Å; T80-L310 HydrophobicContact CG2-CD2 3.65Å; T80-L310 HydrophobicContact CG2-CG 4.46Å; I306-L310 HydrophobicContact CG2-CD1 3.78Å; I306-L310 HydrophobicContact CG2-CG 4.36Å; I306-L310 WeakPolarHBondContact O-CB 3.3Å; I306-L310 VanDerWaalsContact O-CG 3.27Å; I306-L310 WeakPolarHBondContact O-CG 3.14Å; I306-L310 PolarHBondContact O-N 3.09Å; W307-L310 PolarHBondContact O-N 3.22Å; L310-A312 PolarHBondContact O-N 2.97Å; L310-F313 PolarHBondContact O-N 3.48Å; L310-F314 HydrophobicContact CB-CE2 4.41Å; L310-F314 HydrophobicContact CD2-CE2 4.47Å; L310-F314 WeakPolarHBondContact O-CD2 3.45Å; L310-F314 PolarHBondContact O-N 3.21Å
311	Y	93.5	Very high	93.5	Very high	89 Å²	89	65.5 Å²	65.5	35%	0.349	33%	0.329	S	S	.	.	H	α-helix	trans	-64	-42.5	179.8	-175.3	-99.8	0	0	0	111.9	W307 S315	W307-Y311 HydrophobicContact CH2-CD2 4.19Å; W307-Y311 AromaticContact CZ2-CD2 3.86Å; W307-Y311 HydrophobicContact CZ2-CD2 3.86Å; W307-Y311 HydrophobicContact CZ2-CG 4.26Å; W307-Y311 VanDerWaalsContact O-CB 3.23Å; W307-Y311 WeakPolarHBondContact O-CB 3.23Å; W307-Y311 PolarHBondContact O-N 3.38Å; Y311-S315 VanDerWaalsContact O-CB 3.22Å; Y311-S315 WeakPolarHBondContact O-CB 3.44Å; Y311-S315 PolarHBondContact O-N 2.84Å; Y311-S315 PolarHBondContact O-OG 3.4Å
312	A	94.1	Very high	93.2	Very high	19 Å²	19	73 Å²	73	16%	0.157	35%	0.354	C	S	.	.	H	α-helix	trans	-63.9	-42.3	176.1	0	0	0	0	0	111.7	Q308 I309 L310 S315 Y316 I476	Q308-A312 WeakPolarHBondContact O-CB 3.37Å; Q308-A312 PolarHBondContact O-N 3.47Å; I309-A312 PolarHBondContact O-N 3.37Å; L310-A312 PolarHBondContact O-N 2.97Å; A312-S315 PolarHBondContact O-N 3.25Å; A312-Y316 HydrophobicContact CB-CD2 4.37Å; A312-Y316 WeakPolarHBondContact O-CB 2.92Å; A312-Y316 WeakPolarHBondContact O-CD2 3.35Å; A312-Y316 PolarHBondContact O-N 2.73Å; A312-I476 HydrophobicContact CB-CG2 4.45Å
313	F	95.1	Very high	92.9	Very high	128 Å²	128	75 Å²	75	56%	0.561	36%	0.357	S	S	*	.	H	α-helix	trans	-60.1	-54.2	176	178.5	-100.4	0	0	0	111.4	I309 L310 S315 A317	I309-F313 WeakPolarHBondContact O-CB 3.41Å; I309-F313 PolarHBondContact O-N 2.92Å; L310-F313 PolarHBondContact O-N 3.48Å; F313-S315 VanDerWaalsContact C-N 3.28Å; F313-S315 PolarHBondContact O-N 2.85Å; F313-A317 HydrophobicContact CD2-CB 4.02Å; F313-A317 HydrophobicContact CE2-CB 4.06Å; F313-A317 WeakPolarHBondContact O-CB 3.36Å; F313-A317 PolarHBondContact O-N 3.39Å
314	F	94.6	Very high	92.4	Very high	63 Å²	63	73.4 Å²	73.4	28%	0.276	35%	0.35	S	S	.	.	H	α-helix	trans	-66.7	-27.6	-178.3	-69.7	-55.4	0	0	0	113.9	V76 F79 T80 L310	V76-F314 HydrophobicContact CB-CD2 4.46Å; V76-F314 HydrophobicContact CG1-CD2 3.95Å; V76-F314 HydrophobicContact CG1-CE2 4.02Å; V76-F314 HydrophobicContact CG2-CD2 4.03Å; F79-F314 AromaticContact CD1-CE1 3.7Å; F79-F314 HydrophobicContact CD1-CE1 3.7Å; F79-F314 AromaticContact CD1-CZ 3.76Å; F79-F314 HydrophobicContact CD1-CZ 3.76Å; F79-F314 AromaticContact CE1-CE1 3.79Å; F79-F314 HydrophobicContact CE1-CE1 3.79Å; F79-F314 HydrophobicContact CE1-CZ 4.24Å; T80-F314 WeakPolarHBondContact OG1-CE2 3.26Å; L310-F314 HydrophobicContact CB-CE2 4.41Å; L310-F314 HydrophobicContact CD2-CE2 4.47Å; L310-F314 WeakPolarHBondContact O-CD2 3.45Å; L310-F314 PolarHBondContact O-N 3.21Å
315	S	91.4	Very high	91.9	Very high	45 Å²	45	72 Å²	72	32%	0.315	35%	0.349	S	S	.	.	H	α-helix	trans	-87.9	-34.4	-178	-55.4	0	0	0	0	113.6	Y311 A312 F313	Y311-S315 VanDerWaalsContact O-CB 3.22Å; Y311-S315 WeakPolarHBondContact O-CB 3.44Å; Y311-S315 PolarHBondContact O-N 2.84Å; Y311-S315 PolarHBondContact O-OG 3.4Å; A312-S315 PolarHBondContact O-N 3.25Å; F313-S315 VanDerWaalsContact C-N 3.28Å; F313-S315 PolarHBondContact O-N 2.85Å
316	Y	91.6	Very high	91.6	Very high	58 Å²	58	71.6 Å²	71.6	23%	0.227	35%	0.352	C	S	.	.	H	α-helix	trans	-117.2	-16.1	-168.7	-60.9	-69	0	0	0	115	A312 E318 V319 L320 L327 I476	A312-Y316 HydrophobicContact CB-CD2 4.37Å; A312-Y316 WeakPolarHBondContact O-CB 2.92Å; A312-Y316 WeakPolarHBondContact O-CD2 3.35Å; A312-Y316 PolarHBondContact O-N 2.73Å; Y316-E318 VanDerWaalsContact C-N 3.3Å; Y316-E318 PolarHBondContact O-N 3.34Å; Y316-V319 PolarHBondContact O-N 2.95Å; Y316-L320 PolarHBondContact O-N 3.27Å; Y316-L327 HydrophobicContact CD1-CD2 4.3Å; Y316-I476 HydrophobicContact CD1-CD1 3.79Å; Y316-I476 HydrophobicContact CD2-CD1 3.8Å; Y316-I476 HydrophobicContact CD2-CG1 4.16Å; Y316-I476 HydrophobicContact CD2-CG2 4.32Å; Y316-I476 HydrophobicContact CE1-CD1 3.78Å; Y316-I476 HydrophobicContact CE1-CG1 4.38Å; Y316-I476 HydrophobicContact CE2-CD1 3.81Å; Y316-I476 HydrophobicContact CE2-CG1 3.77Å; Y316-I476 HydrophobicContact CE2-CG2 4.41Å; Y316-I476 HydrophobicContact CG-CD1 3.79Å
317	A	90.3	Very high	91.3	Very high	40 Å²	40	69.8 Å²	69.8	33%	0.331	34%	0.343	S	S	.	.	H	α-helix	trans	-63.7	-35.5	-179.7	0	0	0	0	0	112.5	F313 L320 K321	F313-A317 HydrophobicContact CD2-CB 4.02Å; F313-A317 HydrophobicContact CE2-CB 4.06Å; F313-A317 WeakPolarHBondContact O-CB 3.36Å; F313-A317 PolarHBondContact O-N 3.39Å; A317-L320 PolarHBondContact O-N 3.21Å; A317-K321 PolarHBondContact O-N 2.91Å
318	E	90.8	Very high	90.9	Very high	97 Å²	97	68 Å²	68	45%	0.453	35%	0.348	S	S	.	.	H	α-helix	trans	-63.9	-44.9	174.3	-171.7	-80.2	150.9	0	0	111.5	Y316 L320 K321 R322	Y316-E318 VanDerWaalsContact C-N 3.3Å; Y316-E318 PolarHBondContact O-N 3.34Å; E318-L320 VanDerWaalsContact C-N 3.28Å; E318-L320 PolarHBondContact O-N 3.47Å; E318-K321 PolarHBondContact O-N 3.4Å; E318-K321 VanDerWaalsContact O-N 3.1Å; E318-R322 PolarHBondContact O-N 3.37Å; E318-R322 WeakPolarHBondContact OE1-CB 3.46Å; E318-R322 VanDerWaalsContact OE1-CD 3.3Å; E318-R322 WeakPolarHBondContact OE1-CD 3.23Å; E318-R322 IonicContact OE1-CZ 3.88Å; E318-R322 IonicContact OE1-NE 4Å; E318-R322 PolarHBondContact OE1-NE 3.22Å; E318-R322 IonicContact OE1-NH2 3.75Å; E318-R322 IonicContact OE2-CZ 3.52Å; E318-R322 IonicContact OE2-NE 2.96Å; E318-R322 PolarHBondContact OE2-NE 3.09Å; E318-R322 IonicContact OE2-NH2 3.08Å; E318-R322 PolarHBondContact OE2-NH2 3.08Å; E318-R322 VanDerWaalsContact OE2-NH2 3.08Å
319	V	90.4	Very high	90.7	Very high	31 Å²	31	68 Å²	68	19%	0.188	35%	0.354	C	S	.	.	H	α-helix	trans	-61.9	-38.7	179.3	-178.7	0	0	0	0	110.9	Y316 K321 R322 E323 A326	Y316-V319 PolarHBondContact O-N 2.95Å; V319-K321 VanDerWaalsContact C-N 3.27Å; V319-K321 PolarHBondContact O-N 2.87Å; V319-R322 PolarHBondContact O-N 2.91Å; V319-E323 CarbonylContact O-C 3.31Å; V319-E323 WeakPolarHBondContact O-CA 3.47Å; V319-E323 PolarHBondContact O-N 2.95Å; V319-A326 HydrophobicContact CG1-CB 3.78Å
320	L	85.4	Confident	90.6	Very high	86 Å²	86	65 Å²	65	45%	0.45	34%	0.338	S	S	.	.	H	α-helix	trans	-60.1	-37.8	176.6	-177	65.1	0	0	0	112.2	Y316 A317 E318 P324 L327	Y316-L320 PolarHBondContact O-N 3.27Å; A317-L320 PolarHBondContact O-N 3.21Å; E318-L320 VanDerWaalsContact C-N 3.28Å; E318-L320 PolarHBondContact O-N 3.47Å; L320-P324 HydrophobicContact CD1-CB 4.43Å; L320-L327 HydrophobicContact CB-CD1 4.43Å; L320-L327 HydrophobicContact CD1-CD1 3.93Å
321	K	82.6	Confident	90.6	Very high	167 Å²	167	64.4 Å²	64.4	73%	0.726	34%	0.336	S	S	*	.	H	α-helix	trans	-76.7	-42.7	177.7	-174.3	-178.3	177.4	-174.4	0	112.1	A317 E318 V319	A317-K321 PolarHBondContact O-N 2.91Å; E318-K321 PolarHBondContact O-N 3.4Å; E318-K321 VanDerWaalsContact O-N 3.1Å; V319-K321 VanDerWaalsContact C-N 3.27Å; V319-K321 PolarHBondContact O-N 2.87Å
322	R	89.8	Confident	90.8	Very high	175 Å²	175	61.3 Å²	61.3	66%	0.66	32%	0.324	S	S	*	.	H	α-helix	trans	-81.1	-47.4	-173.3	-177.7	166.1	55.5	117.8	1.2	113	E318 V319	E318-R322 PolarHBondContact O-N 3.37Å; E318-R322 WeakPolarHBondContact OE1-CB 3.46Å; E318-R322 VanDerWaalsContact OE1-CD 3.3Å; E318-R322 WeakPolarHBondContact OE1-CD 3.23Å; E318-R322 IonicContact OE1-CZ 3.88Å; E318-R322 IonicContact OE1-NE 4Å; E318-R322 PolarHBondContact OE1-NE 3.22Å; E318-R322 IonicContact OE1-NH2 3.75Å; E318-R322 IonicContact OE2-CZ 3.52Å; E318-R322 IonicContact OE2-NE 2.96Å; E318-R322 PolarHBondContact OE2-NE 3.09Å; E318-R322 IonicContact OE2-NH2 3.08Å; E318-R322 PolarHBondContact OE2-NH2 3.08Å; E318-R322 VanDerWaalsContact OE2-NH2 3.08Å; V319-R322 PolarHBondContact O-N 2.91Å
323	E	89.8	Confident	91	Very high	116 Å²	116	60.4 Å²	60.4	54%	0.542	32%	0.317	S	S	.	.			trans	-146.2	79.1	-176	-166.8	-178.6	175.6	0	0	110.7	V319 G325 A326	V319-E323 CarbonylContact O-C 3.31Å; V319-E323 WeakPolarHBondContact O-CA 3.47Å; V319-E323 PolarHBondContact O-N 2.95Å; E323-G325 PolarHBondContact O-N 3.23Å; E323-G325 VanDerWaalsContact O-N 3.12Å; E323-A326 HydrophobicContact CB-CB 4.46Å; E323-A326 HydrophobicContact CG-CB 4.28Å; E323-A326 VanDerWaalsContact O-CB 3.3Å; E323-A326 WeakPolarHBondContact O-CB 3.47Å; E323-A326 PolarHBondContact O-N 2.73Å
324	P	86.8	Confident	91.1	Very high	16 Å²	16	55.6 Å²	55.6	10%	0.104	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.9	-179.1	22	-32	0	0	0	113.1	L320 A326 L327 T419 V420	L320-P324 HydrophobicContact CD1-CB 4.43Å; P324-A326 PolarHBondContact O-N 3.03Å; P324-L327 PolarHBondContact O-N 2.7Å; P324-T419 WeakPolarHBondContact CG-OG1 3.35Å; P324-V420 HydrophobicContact CB-CG2 3.57Å; P324-V420 HydrophobicContact CG-CG2 3.88Å
325	G	86.4	Confident	91.2	Very high	28 Å²	28	53.3 Å²	53.3	29%	0.289	29%	0.286	S	S	.	.	H	α-helix	trans	-61.4	-25.2	174.7	0	0	0	0	0	113.8	E323 L327 G328 A329	E323-G325 PolarHBondContact O-N 3.23Å; E323-G325 VanDerWaalsContact O-N 3.12Å; G325-L327 VanDerWaalsContact C-N 3.26Å; G325-L327 PolarHBondContact O-N 2.98Å; G325-G328 WeakPolarHBondContact O-CA 3.39Å; G325-G328 PolarHBondContact O-N 2.96Å; G325-A329 PolarHBondContact O-N 2.91Å
326	A	89.8	Confident	91.4	Very high	34 Å²	34	51.2 Å²	51.2	28%	0.281	27%	0.272	S	S	.	.	H	α-helix	trans	-64.9	-29	178.6	0	0	0	0	0	112.7	V319 E323 P324 G328 A329	V319-A326 HydrophobicContact CG1-CB 3.78Å; E323-A326 HydrophobicContact CB-CB 4.46Å; E323-A326 HydrophobicContact CG-CB 4.28Å; E323-A326 VanDerWaalsContact O-CB 3.3Å; E323-A326 WeakPolarHBondContact O-CB 3.47Å; E323-A326 PolarHBondContact O-N 2.73Å; P324-A326 PolarHBondContact O-N 3.03Å; A326-G328 VanDerWaalsContact C-N 3.34Å; A326-A329 VanDerWaalsContact O-CB 3.3Å; A326-A329 WeakPolarHBondContact O-CB 3.17Å; A326-A329 PolarHBondContact O-N 3.32Å
327	L	89.4	Confident	91.6	Very high	31 Å²	31	50.9 Å²	50.9	16%	0.162	27%	0.27	C	S	.	.	H	α-helix	trans	-77.1	-23.5	174.7	-62.2	178.7	0	0	0	112.7	Y316 L320 P324 G325 A329 A473 I476	Y316-L327 HydrophobicContact CD1-CD2 4.3Å; L320-L327 HydrophobicContact CB-CD1 4.43Å; L320-L327 HydrophobicContact CD1-CD1 3.93Å; P324-L327 PolarHBondContact O-N 2.7Å; G325-L327 VanDerWaalsContact C-N 3.26Å; G325-L327 PolarHBondContact O-N 2.98Å; L327-A329 VanDerWaalsContact C-N 3.3Å; L327-A473 HydrophobicContact CB-CB 4.49Å; L327-A473 PolarHBondContact O-N 3.27Å; L327-A473 VanDerWaalsContact O-N 3.15Å; L327-I476 HydrophobicContact CD2-CD1 3.75Å
328	G	88.8	Confident	91.9	Very high	36 Å²	36	49.2 Å²	49.2	37%	0.371	26%	0.256	S	S	.	.	H	α-helix	trans	-78.5	-13.4	171.2	0	0	0	0	0	113.4	G325 A326 Y471	G325-G328 WeakPolarHBondContact O-CA 3.39Å; G325-G328 PolarHBondContact O-N 2.96Å; A326-G328 VanDerWaalsContact C-N 3.34Å; G328-Y471 VanDerWaalsContact O-CD1 3.28Å; G328-Y471 WeakPolarHBondContact O-CD1 3.29Å; G328-Y471 WeakPolarHBondContact O-CE1 3.42Å
329	A	91.4	Very high	92.1	Very high	41 Å²	41	45.4 Å²	45.4	34%	0.339	24%	0.237	S	C	.	.	S	Bend	trans	-63.3	155.6	169.4	0	0	0	0	0	110.7	G325 A326 L327 K472	G325-A329 PolarHBondContact O-N 2.91Å; A326-A329 VanDerWaalsContact O-CB 3.3Å; A326-A329 WeakPolarHBondContact O-CB 3.17Å; A326-A329 PolarHBondContact O-N 3.32Å; L327-A329 VanDerWaalsContact C-N 3.3Å; A329-K472 WeakPolarHBondContact O-CB 3.37Å; A329-K472 PolarHBondContact O-N 3.34Å
330	R	94.8	Very high	92.4	Very high	25 Å²	25	44 Å²	44	9%	0.094	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	158	-179.7	-69.9	177.9	175	-93.5	1.6	110.8	Y358 M365 F469 Q470 Y471	R330-Y358 VanDerWaalsContact O-CE2 3.26Å; R330-Y358 WeakPolarHBondContact O-CE2 3.41Å; R330-Y358 PolarHBondContact O-OH 2.75Å; R330-M365 VanDerWaalsContact NH1-CE 3.32Å; R330-F469 HydrophobicContact CB-CD1 3.69Å; R330-F469 HydrophobicContact CB-CD2 4.5Å; R330-F469 HydrophobicContact CB-CE1 3.29Å; R330-F469 HydrophobicContact CB-CE2 4.17Å; R330-F469 HydrophobicContact CB-CG 4.28Å; R330-F469 HydrophobicContact CB-CZ 3.56Å; R330-F469 HydrophobicContact CG-CD1 4.26Å; R330-F469 HydrophobicContact CG-CE1 4.11Å; R330-F469 PolarHBondContact NH1-O 3.47Å; R330-Q470 CarbonylContact C-O 3.57Å; R330-Q470 WeakPolarHBondContact CA-O 3.01Å; R330-Q470 WeakPolarHBondContact CB-O 3.28Å; R330-Y471 HydrophobicContact CG-CD1 3.8Å; R330-Y471 HydrophobicContact CG-CE1 4.05Å; R330-Y471 HydrophobicContact CG-CG 4.41Å; R330-Y471 VanDerWaalsContact CZ-CZ 3.48Å; R330-Y471 PolarHBondContact NH2-OH 2.88Å
331	C	96.1	Very high	93	Very high	28 Å²	28	40.2 Å²	40.2	19%	0.189	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	154	172.8	57.1	0	0	0	0	110.1	S333 Q470	C331-S333 PolarHBondContact O-N 2.91Å; C331-Q470 PolarHBondContact N-O 3.42Å; C331-Q470 PolarHBondContact O-N 3.43Å
332	W	97.8	Very high	93.7	Very high	23 Å²	23	32.3 Å²	32.3	9%	0.087	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	121.7	171.7	-62.5	107.3	0	0	0	109.9	L340 L354 A361 I445 F465 F469	W332-L340 HydrophobicContact CE3-CD1 4.02Å; W332-L340 HydrophobicContact CZ3-CD1 3.81Å; W332-L354 HydrophobicContact CB-CD1 4.32Å; W332-L354 HydrophobicContact CD2-CD2 3.81Å; W332-L354 HydrophobicContact CE3-CD2 4.11Å; W332-L354 HydrophobicContact CG-CB 4.26Å; W332-L354 HydrophobicContact CG-CD1 4.25Å; W332-L354 HydrophobicContact CG-CD2 4.09Å; W332-L354 HydrophobicContact CG-CG 4.43Å; W332-L354 HydrophobicContact CZ2-CD2 4.38Å; W332-L354 PolarHBondContact NE1-O 2.9Å; W332-A361 HydrophobicContact CH2-CB 4.05Å; W332-A361 HydrophobicContact CZ2-CB 4.11Å; W332-I445 HydrophobicContact CH2-CG2 3.72Å; W332-I445 HydrophobicContact CZ2-CG2 4.25Å; W332-I445 HydrophobicContact CZ3-CG2 4.38Å; W332-F465 HydrophobicContact CH2-CZ 4.44Å; W332-F469 AromaticContact CD2-CD2 3.72Å; W332-F469 HydrophobicContact CD2-CD2 3.72Å; W332-F469 HydrophobicContact CD2-CE2 4.15Å; W332-F469 AromaticContact CE2-CD2 3.98Å; W332-F469 HydrophobicContact CE3-CB 4.4Å; W332-F469 AromaticContact CE3-CD2 3.82Å; W332-F469 HydrophobicContact CE3-CD2 3.82Å; W332-F469 HydrophobicContact CG-CD2 4.17Å; W332-F469 HydrophobicContact CG-CE2 4.39Å; W332-F469 HydrophobicContact CH2-CD2 4.43Å; W332-F469 HydrophobicContact CZ2-CD2 4.35Å; W332-F469 HydrophobicContact CZ2-CE2 4.49Å; W332-F469 HydrophobicContact CZ3-CB 4.38Å; W332-F469 HydrophobicContact CZ3-CD2 4.18Å
333	S	97.3	Very high	94	Very high	1 Å²	1	24 Å²	24	1%	0.007	14%	0.143	C	C	.	.			trans	-67	156.1	179.9	67.9	0	0	0	0	110.7	C331 Y335 G336 R337 Q467 L468 Q470	C331-S333 PolarHBondContact O-N 2.91Å; S333-Y335 PolarHBondContact O-N 3.22Å; S333-G336 PolarHBondContact O-N 3.46Å; S333-G336 VanDerWaalsContact O-N 3.09Å; S333-G336 PolarHBondContact OG-N 3.02Å; S333-R337 WeakPolarHBondContact O-CG 3.18Å; S333-R337 PolarHBondContact O-N 2.92Å; S333-Q467 WeakPolarHBondContact CB-O 3.22Å; S333-Q467 PolarHBondContact OG-O 3.19Å; S333-L468 PolarHBondContact N-O 2.97Å; S333-L468 PolarHBondContact OG-O 2.95Å; S333-Q470 VanDerWaalsContact CB-CD 3.46Å
334	L	97.1	Very high	94.4	Very high	27 Å²	27	18.5 Å²	18.5	14%	0.141	12%	0.117	C	C	.	.	H	α-helix	trans	-61.9	-33.7	175.9	-175.5	64.7	0	0	0	111.3	F243 T244 R245 K248 R337 C338	F243-L334 HydrophobicContact CD1-CB 4.19Å; F243-L334 HydrophobicContact CD1-CD2 4.06Å; F243-L334 HydrophobicContact CD1-CG 3.79Å; F243-L334 HydrophobicContact CE1-CD2 4.03Å; F243-L334 HydrophobicContact CE1-CG 3.76Å; F243-L334 HydrophobicContact CZ-CD2 4.46Å; T244-L334 WeakPolarHBondContact O-CD2 3.44Å; R245-L334 HydrophobicContact CG-CD2 4.28Å; K248-L334 HydrophobicContact CB-CD2 4.17Å; K248-L334 HydrophobicContact CD-CD1 4.45Å; K248-L334 HydrophobicContact CD-CD2 4.4Å; L334-R337 PolarHBondContact O-N 3.39Å; L334-C338 PolarHBondContact O-N 3.45Å
335	Y	96.8	Very high	94.9	Very high	15 Å²	15	17.7 Å²	17.7	6%	0.059	11%	0.112	C	C	.	.	H	α-helix	trans	-60.7	-50	170.9	173.9	-109.9	0	0	0	111.2	V223 L230 R231 V241 S333 R337 C338 Y339 L468	V223-Y335 HydrophobicContact CG1-CD2 4.3Å; V223-Y335 HydrophobicContact CG1-CE2 4.01Å; L230-Y335 HydrophobicContact CD1-CD2 4.1Å; L230-Y335 HydrophobicContact CD1-CE2 4.13Å; R231-Y335 PolarHBondContact NH2-OH 3.21Å; V241-Y335 HydrophobicContact CG1-CD1 3.84Å; V241-Y335 HydrophobicContact CG1-CD2 3.84Å; V241-Y335 HydrophobicContact CG1-CE1 4.35Å; V241-Y335 HydrophobicContact CG1-CE2 4.36Å; V241-Y335 HydrophobicContact CG1-CG 3.55Å; S333-Y335 PolarHBondContact O-N 3.22Å; Y335-R337 VanDerWaalsContact C-N 3.28Å; Y335-R337 PolarHBondContact O-N 3.24Å; Y335-C338 PolarHBondContact O-N 3.4Å; Y335-C338 VanDerWaalsContact O-N 3.09Å; Y335-Y339 WeakPolarHBondContact O-CB 3.48Å; Y335-Y339 PolarHBondContact O-N 3.27Å; Y335-L468 HydrophobicContact CD1-CD2 3.97Å; Y335-L468 HydrophobicContact CE1-CD2 3.9Å
336	G	95.7	Very high	95.4	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-58.7	-37.8	177.2	0	0	0	0	0	112.8	S333 C338 Y339 L340	S333-G336 PolarHBondContact O-N 3.46Å; S333-G336 VanDerWaalsContact O-N 3.09Å; S333-G336 PolarHBondContact OG-N 3.02Å; G336-C338 PolarHBondContact O-N 2.63Å; G336-Y339 PolarHBondContact O-N 2.91Å; G336-L340 VanDerWaalsContact O-CB 3.26Å; G336-L340 WeakPolarHBondContact O-CB 3.48Å; G336-L340 WeakPolarHBondContact O-CG 3.2Å; G336-L340 PolarHBondContact O-N 3.09Å
337	R	97.2	Very high	95.7	Very high	52 Å²	52	18.2 Å²	18.2	20%	0.196	10%	0.101	C	C	.	.	H	α-helix	trans	-61.3	-41.3	174.5	-65.5	177.6	80.5	80.2	-0.1	112.4	S333 L334 Y335 R341 E347 L350 Q351 L354	S333-R337 WeakPolarHBondContact O-CG 3.18Å; S333-R337 PolarHBondContact O-N 2.92Å; L334-R337 PolarHBondContact O-N 3.39Å; Y335-R337 VanDerWaalsContact C-N 3.28Å; Y335-R337 PolarHBondContact O-N 3.24Å; R337-R341 WeakPolarHBondContact O-CB 3.18Å; R337-R341 PolarHBondContact O-N 2.95Å; R337-E347 IonicContact CZ-OE1 2.69Å; R337-E347 IonicContact NE-OE1 3.19Å; R337-E347 IonicContact NH2-OE1 3.69Å; R337-E347 PolarHBondContact NH2-OE1 3.4Å; R337-L350 HydrophobicContact CB-CD2 4.48Å; R337-Q351 VanDerWaalsContact CZ-OE1 3.29Å; R337-L354 HydrophobicContact CG-CD1 4.08Å
338	C	96.1	Very high	96	Very high	4 Å²	4	19.5 Å²	19.5	3%	0.027	11%	0.106	C	C	.	.	H	α-helix	trans	-76.7	-36.4	176.8	-73.8	0	0	0	0	112.5	V223 F243 L334 Y335 G336 K552	V223-C338 HydrophobicContact CB-CB 4.5Å; V223-C338 HydrophobicContact CG1-CB 4.27Å; V223-C338 HydrophobicContact CG2-CB 4.25Å; F243-C338 HydrophobicContact CE1-CB 4.41Å; L334-C338 PolarHBondContact O-N 3.45Å; Y335-C338 PolarHBondContact O-N 3.4Å; Y335-C338 VanDerWaalsContact O-N 3.09Å; G336-C338 PolarHBondContact O-N 2.63Å; C338-K552 PolarHBondContact O-NZ 3.31Å
339	Y	95.8	Very high	96.3	Very high	18 Å²	18	18.8 Å²	18.8	7%	0.071	9%	0.093	C	C	.	.	H	α-helix	trans	-67.6	-46.1	179.6	-179.5	-102.1	0	0	0	111.9	Y335 G336 R341 L468 D550 K552	Y335-Y339 WeakPolarHBondContact O-CB 3.48Å; Y335-Y339 PolarHBondContact O-N 3.27Å; G336-Y339 PolarHBondContact O-N 2.91Å; Y339-R341 VanDerWaalsContact C-N 3.32Å; Y339-R341 PolarHBondContact O-N 2.66Å; Y339-L468 HydrophobicContact CD1-CD1 4.26Å; Y339-L468 HydrophobicContact CD1-CD2 3.62Å; Y339-L468 HydrophobicContact CE1-CD1 4.38Å; Y339-L468 HydrophobicContact CE1-CD2 4.36Å; Y339-L468 HydrophobicContact CG-CD2 4.12Å; Y339-D550 VanDerWaalsContact CE2-OD2 3.25Å; Y339-D550 WeakPolarHBondContact CE2-OD2 3.07Å; Y339-D550 VanDerWaalsContact CZ-OD2 3.26Å; Y339-D550 PolarHBondContact OH-OD2 3.37Å; Y339-K552 WeakPolarHBondContact O-CE 3.37Å; Y339-K552 PolarHBondContact O-NZ 2.87Å
340	L	96.6	Very high	96.5	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.077	C	C	.	.	S	Bend	trans	-82	-6.8	-177	-59.2	173.5	0	0	0	114.3	W332 G336 R353 L354 I445 Y447 L468	W332-L340 HydrophobicContact CE3-CD1 4.02Å; W332-L340 HydrophobicContact CZ3-CD1 3.81Å; G336-L340 VanDerWaalsContact O-CB 3.26Å; G336-L340 WeakPolarHBondContact O-CB 3.48Å; G336-L340 WeakPolarHBondContact O-CG 3.2Å; G336-L340 PolarHBondContact O-N 3.09Å; L340-R353 PolarHBondContact O-NH1 3.32Å; L340-R353 PolarHBondContact O-NH2 3.2Å; L340-L354 HydrophobicContact CD1-CD2 3.82Å; L340-I445 HydrophobicContact CD1-CB 4.22Å; L340-I445 HydrophobicContact CD1-CG2 4.33Å; L340-I445 HydrophobicContact CD2-CB 4.18Å; L340-I445 HydrophobicContact CD2-CD1 4.02Å; L340-I445 HydrophobicContact CD2-CG1 4.35Å; L340-Y447 VanDerWaalsContact O-CD2 3.3Å; L340-Y447 WeakPolarHBondContact O-CD2 3.34Å; L340-Y447 WeakPolarHBondContact O-CE2 3.36Å; L340-L468 HydrophobicContact CD2-CD1 4.36Å
341	R	97.7	Very high	96.6	Very high	8 Å²	8	18.5 Å²	18.5	3%	0.03	9%	0.086	C	C	.	.	P	Polyproline II helix	trans	-75.6	133.6	180	-175.6	171	-168.4	152.7	6.2	111.7	L213 V220 R337 Y339 E345 E347 L350 K552	L213-R341 VanDerWaalsContact CD2-NH2 3.34Å; V220-R341 HydrophobicContact CG2-CB 4.12Å; V220-R341 HydrophobicContact CG2-CG 3.95Å; R337-R341 WeakPolarHBondContact O-CB 3.18Å; R337-R341 PolarHBondContact O-N 2.95Å; Y339-R341 VanDerWaalsContact C-N 3.32Å; Y339-R341 PolarHBondContact O-N 2.66Å; R341-E345 WeakPolarHBondContact CA-OE2 3.43Å; R341-E345 HydrophobicContact CG-CB 4.4Å; R341-E345 PolarHBondContact NE-O 3.28Å; R341-E345 PolarHBondContact NH2-O 2.85Å; R341-E347 IonicContact CZ-OE2 2.86Å; R341-E347 IonicContact NH1-OE2 3.36Å; R341-E347 PolarHBondContact NH1-OE2 3.08Å; R341-E347 IonicContact NH2-OE2 2.89Å; R341-L350 HydrophobicContact CB-CD1 4.27Å; R341-L350 HydrophobicContact CB-CD2 4.09Å; R341-L350 HydrophobicContact CG-CD2 4.19Å; R341-K552 PolarHBondContact O-NZ 3.26Å
342	H	96.9	Very high	96.4	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.093	C	C	.	.	P	Polyproline II helix	trans	-75.4	157.4	168.2	-67.8	-66.4	0	0	0	110.8	E345 R353 H446 Y447 S556 H559	H342-E345 HydrophobicContact CB-CB 3.91Å; H342-E345 IonicContact CD2-OE2 3.08Å; H342-E345 IonicContact CG-OE2 2.67Å; H342-E345 PolarHBondContact N-OE2 2.74Å; H342-R353 VanDerWaalsContact CD2-CZ 3.47Å; H342-R353 PolarHBondContact CD2-NH1 2.94Å; H342-R353 VanDerWaalsContact NE2-CZ 3.28Å; H342-R353 PolarHBondContact NE2-NH1 3.24Å; H342-R353 PolarHBondContact NE2-NH2 3.45Å; H342-H446 AromaticContact CE1-ND1 3.63Å; H342-H446 AromaticContact NE2-CE1 3.86Å; H342-H446 AromaticContact NE2-CG 3.83Å; H342-H446 AromaticContact NE2-ND1 2.89Å; H342-H446 PolarHBondContact NE2-ND1 3.42Å; H342-Y447 AromaticContact CE1-CE2 3.36Å; H342-Y447 WeakPolarHBondContact CE1-CE2 3.43Å; H342-Y447 AromaticContact CE1-CZ 3.48Å; H342-Y447 VanDerWaalsContact CE1-CZ 3.48Å; H342-Y447 PolarHBondContact CE1-OH 3.48Å; H342-Y447 AromaticContact ND1-CE2 3.42Å; H342-Y447 WeakPolarHBondContact ND1-CE2 3.46Å; H342-Y447 AromaticContact ND1-CZ 3.32Å; H342-Y447 VanDerWaalsContact ND1-CZ 3.32Å; H342-Y447 PolarHBondContact ND1-OH 3.48Å; H342-S556 WeakPolarHBondContact CA-OG 3.39Å; H342-S556 WeakPolarHBondContact CB-OG 3.22Å; H342-S556 PolarHBondContact ND1-OG 3.44Å; H342-H559 AromaticContact CD2-CD2 3.67Å; H342-H559 AromaticContact CD2-CG 3.55Å; H342-H559 AromaticContact NE2-CD2 3.95Å
343	F	97.1	Very high	96.2	Very high	1 Å²	1	18.6 Å²	18.6	0%	0.004	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	144.9	163.8	-65.7	-68.6	0	0	0	110.7	N217 V220 A221 E345 F521 A522 M524 K552 S556	N217-F343 HydrophobicContact CB-CD1 4.48Å; V220-F343 HydrophobicContact CB-CD1 4.45Å; V220-F343 HydrophobicContact CB-CE1 4.08Å; V220-F343 HydrophobicContact CG1-CD1 4.17Å; V220-F343 HydrophobicContact CG1-CE1 3.76Å; V220-F343 HydrophobicContact CG1-CZ 4.08Å; A221-F343 HydrophobicContact CB-CE1 3.98Å; A221-F343 HydrophobicContact CB-CZ 4.2Å; F343-E345 PolarHBondContact O-N 3.24Å; F343-F521 HydrophobicContact CD1-CB 4.24Å; F343-F521 HydrophobicContact CD2-CB 4.2Å; F343-F521 HydrophobicContact CE1-CB 3.72Å; F343-F521 HydrophobicContact CE2-CB 3.66Å; F343-F521 HydrophobicContact CE2-CG 4.42Å; F343-F521 HydrophobicContact CG-CB 4.47Å; F343-F521 HydrophobicContact CZ-CB 3.39Å; F343-F521 HydrophobicContact CZ-CG 4.03Å; F343-A522 HydrophobicContact CB-CB 4.45Å; F343-A522 HydrophobicContact CD1-CB 4.41Å; F343-M524 HydrophobicContact CB-CE 4.37Å; F343-M524 WeakPolarHBondContact O-CE 3.4Å; F343-K552 HydrophobicContact CD2-CB 4.44Å; F343-K552 HydrophobicContact CE2-CB 3.96Å; F343-K552 HydrophobicContact CE2-CD 4.24Å; F343-S556 PolarHBondContact N-OG 3.34Å
344	N	97.1	Very high	96.1	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	37.8	-174.8	-51.2	-38.2	0	0	0	114.4	L206 Y209 H210 L213 N217 A522 M524 F560	L206-N344 WeakPolarHBondContact CD1-ND2 3.48Å; Y209-N344 HydrophobicContact CD1-CB 4.34Å; Y209-N344 WeakPolarHBondContact CD1-O 3.09Å; Y209-N344 WeakPolarHBondContact CE1-O 3.37Å; H210-N344 PolarHBondContact CD2-OD1 2.75Å; H210-N344 VanDerWaalsContact CD2-OD1 3.26Å; L213-N344 VanDerWaalsContact CD1-C 3.48Å; N217-N344 PolarHBondContact ND2-OD1 3.13Å; N217-N344 PolarHBondContact OD1-N 2.97Å; N344-A522 PolarHBondContact ND2-O 2.96Å; N344-M524 HydrophobicContact CB-CE 3.6Å; N344-M524 VanDerWaalsContact ND2-CE 3.27Å; N344-M524 WeakPolarHBondContact ND2-CE 3.34Å; N344-F560 HydrophobicContact CB-CD2 3.99Å; N344-F560 HydrophobicContact CB-CE2 4.07Å
345	E	97	Very high	96	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.107	C	C	.	.			trans	-102.7	127.6	172.8	179.1	178.8	-155.3	0	0	110.5	L213 R341 H342 F343 E349 L350 R353 H559	L213-E345 VanDerWaalsContact CD1-C 3.49Å; L213-E345 VanDerWaalsContact CD1-O 3.31Å; L213-E345 WeakPolarHBondContact CD1-O 3.4Å; R341-E345 WeakPolarHBondContact CA-OE2 3.43Å; R341-E345 HydrophobicContact CG-CB 4.4Å; R341-E345 PolarHBondContact NE-O 3.28Å; R341-E345 PolarHBondContact NH2-O 2.85Å; H342-E345 HydrophobicContact CB-CB 3.91Å; H342-E345 IonicContact CD2-OE2 3.08Å; H342-E345 IonicContact CG-OE2 2.67Å; H342-E345 PolarHBondContact N-OE2 2.74Å; F343-E345 PolarHBondContact O-N 3.24Å; E345-E349 HydrophobicContact CG-CB 3.86Å; E345-L350 HydrophobicContact CG-CB 4.23Å; E345-L350 VanDerWaalsContact OE1-CA 3.25Å; E345-L350 WeakPolarHBondContact OE1-CA 3.45Å; E345-L350 PolarHBondContact OE1-N 3.33Å; E345-R353 WeakPolarHBondContact OE1-CD 3.36Å; E345-R353 IonicContact OE1-CZ 3.15Å; E345-R353 IonicContact OE1-NE 3.09Å; E345-R353 IonicContact OE1-NH1 2.77Å; E345-R353 PolarHBondContact OE1-NH1 3.14Å; E345-R353 IonicContact OE2-NH1 3.88Å; E345-R353 PolarHBondContact OE2-NH1 3.36Å; E345-H559 IonicContact OE1-CE1 3.86Å; E345-H559 IonicContact OE1-NE2 2.65Å
346	L	97.3	Very high	95.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.119	C	C	.	.			trans	-75.2	158.8	178.1	-68.5	166.6	0	0	0	111.1	Y51 W180 Y209 I212 L213 H348 E349 L350	Y51-L346 HydrophobicContact CD2-CD1 4.38Å; Y51-L346 HydrophobicContact CD2-CD2 4.22Å; Y51-L346 HydrophobicContact CE1-CD2 4.49Å; Y51-L346 HydrophobicContact CE2-CB 4.17Å; Y51-L346 HydrophobicContact CE2-CD1 3.9Å; Y51-L346 HydrophobicContact CE2-CD2 3.89Å; Y51-L346 HydrophobicContact CE2-CG 4.21Å; W180-L346 VanDerWaalsContact CD1-CD1 3.43Å; W180-L346 HydrophobicContact CG-CD1 4.3Å; Y209-L346 HydrophobicContact CD1-CD1 4.08Å; Y209-L346 HydrophobicContact CD1-CD2 4.3Å; Y209-L346 HydrophobicContact CD1-CG 3.8Å; Y209-L346 HydrophobicContact CE1-CB 4.5Å; Y209-L346 HydrophobicContact CE1-CD1 3.44Å; Y209-L346 VanDerWaalsContact CE1-CD1 3.44Å; Y209-L346 HydrophobicContact CE1-CD2 4.4Å; Y209-L346 HydrophobicContact CE1-CG 3.47Å; Y209-L346 VanDerWaalsContact CE1-CG 3.47Å; I212-L346 HydrophobicContact CB-CD2 4.38Å; I212-L346 HydrophobicContact CD1-CD2 4.28Å; I212-L346 HydrophobicContact CG2-CD2 3.81Å; L213-L346 HydrophobicContact CD1-CD2 3.95Å; L213-L346 HydrophobicContact CD1-CG 4.29Å; L213-L346 HydrophobicContact CD2-CD2 4.11Å; L213-L346 HydrophobicContact CG-CD2 4.04Å; L346-H348 VanDerWaalsContact C-N 3.3Å; L346-H348 PolarHBondContact O-N 2.73Å; L346-E349 HydrophobicContact CB-CG 4.23Å; L346-E349 PolarHBondContact N-OE2 3.14Å; L346-E349 WeakPolarHBondContact O-CB 3.14Å; L346-E349 PolarHBondContact O-N 3.41Å; L346-L350 PolarHBondContact O-N 3.27Å
347	E	96.8	Very high	95.5	Very high	72 Å²	72	25.1 Å²	25.1	34%	0.336	12%	0.119	S	C	.	.	H	α-helix	trans	-63.1	-35.8	-172.6	-166.8	64.4	-160.3	0	0	113	Y51 R337 R341 Q351	Y51-E347 PolarHBondContact OH-N 3.29Å; R337-E347 IonicContact CZ-OE1 2.69Å; R337-E347 IonicContact NE-OE1 3.19Å; R337-E347 IonicContact NH2-OE1 3.69Å; R337-E347 PolarHBondContact NH2-OE1 3.4Å; R341-E347 IonicContact CZ-OE2 2.86Å; R341-E347 IonicContact NH1-OE2 3.36Å; R341-E347 PolarHBondContact NH1-OE2 3.08Å; R341-E347 IonicContact NH2-OE2 2.89Å; E347-Q351 WeakPolarHBondContact O-CB 3.24Å; E347-Q351 PolarHBondContact O-N 3.18Å
348	H	95.1	Very high	95.4	Very high	59 Å²	59	26.7 Å²	26.7	27%	0.273	13%	0.126	S	C	.	.	H	α-helix	trans	-73.2	-31.8	179.8	71.7	-80.9	0	0	0	112.6	Y51 Q55 W180 L346 Q351 S352	Y51-H348 AromaticContact CE2-CE1 3.91Å; Y51-H348 AromaticContact CE2-ND1 3.59Å; Y51-H348 AromaticContact CZ-ND1 3.7Å; Y51-H348 PolarHBondContact OH-N 3.24Å; Y51-H348 PolarHBondContact OH-ND1 3.28Å; Q55-H348 PolarHBondContact NE2-ND1 3.01Å; W180-H348 AromaticContact CD1-CE1 3.99Å; W180-H348 AromaticContact CG-CE1 3.99Å; L346-H348 VanDerWaalsContact C-N 3.3Å; L346-H348 PolarHBondContact O-N 2.73Å; H348-Q351 PolarHBondContact O-N 3.03Å; H348-S352 WeakPolarHBondContact O-CB 3.47Å; H348-S352 PolarHBondContact O-N 2.93Å
349	E	95	Very high	95.3	Very high	20 Å²	20	32.7 Å²	32.7	9%	0.093	15%	0.151	C	C	.	.	H	α-helix	trans	-64.8	-49.3	174.7	-63.9	166.6	-173.5	0	0	110.3	Y209 E345 L346 Q351 S352 R353 H559	Y209-E349 PolarHBondContact OH-OE1 3.3Å; Y209-E349 VanDerWaalsContact OH-OE1 3.08Å; E345-E349 HydrophobicContact CG-CB 3.86Å; L346-E349 HydrophobicContact CB-CG 4.23Å; L346-E349 PolarHBondContact N-OE2 3.14Å; L346-E349 WeakPolarHBondContact O-CB 3.14Å; L346-E349 PolarHBondContact O-N 3.41Å; E349-Q351 PolarHBondContact O-N 3.29Å; E349-S352 WeakPolarHBondContact O-CB 3.44Å; E349-S352 PolarHBondContact O-N 3.42Å; E349-R353 PolarHBondContact O-N 3.24Å; E349-R353 VanDerWaalsContact O-N 3.12Å; E349-H559 IonicContact OE2-CE1 3.17Å
350	L	96.5	Very high	95.1	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-58	-49.1	173.9	176.5	63.5	0	0	0	110.6	R337 R341 E345 L346 S352 R353 L354	R337-L350 HydrophobicContact CB-CD2 4.48Å; R341-L350 HydrophobicContact CB-CD1 4.27Å; R341-L350 HydrophobicContact CB-CD2 4.09Å; R341-L350 HydrophobicContact CG-CD2 4.19Å; E345-L350 HydrophobicContact CG-CB 4.23Å; E345-L350 VanDerWaalsContact OE1-CA 3.25Å; E345-L350 WeakPolarHBondContact OE1-CA 3.45Å; E345-L350 PolarHBondContact OE1-N 3.33Å; L346-L350 PolarHBondContact O-N 3.27Å; L350-S352 VanDerWaalsContact C-N 3.29Å; L350-S352 PolarHBondContact O-N 3.24Å; L350-R353 PolarHBondContact O-N 2.61Å; L350-L354 HydrophobicContact CD1-CD1 4.1Å; L350-L354 HydrophobicContact CD1-CG 4.09Å; L350-L354 HydrophobicContact CG-CD1 3.95Å; L350-L354 HydrophobicContact CG-CG 4.31Å; L350-L354 VanDerWaalsContact O-CG 3.31Å; L350-L354 WeakPolarHBondContact O-CG 3.4Å; L350-L354 PolarHBondContact O-N 2.97Å
351	Q	95.8	Very high	95	Very high	60 Å²	60	32.6 Å²	32.6	28%	0.28	15%	0.153	S	C	.	.	H	α-helix	trans	-62.1	-38	-179.2	-170.2	63.1	39.5	0	0	112	R337 E347 H348 E349 L354 N355	R337-Q351 VanDerWaalsContact CZ-OE1 3.29Å; E347-Q351 WeakPolarHBondContact O-CB 3.24Å; E347-Q351 PolarHBondContact O-N 3.18Å; H348-Q351 PolarHBondContact O-N 3.03Å; E349-Q351 PolarHBondContact O-N 3.29Å; Q351-L354 PolarHBondContact O-N 3.47Å; Q351-N355 PolarHBondContact NE2-OD1 3.34Å; Q351-N355 VanDerWaalsContact O-CB 3.32Å; Q351-N355 WeakPolarHBondContact O-CB 3.38Å; Q351-N355 PolarHBondContact O-N 2.93Å; Q351-N355 PolarHBondContact O-ND2 3.04Å; Q351-N355 PolarHBondContact O-OD1 3.31Å
352	S	91.9	Very high	94.9	Very high	49 Å²	49	33.7 Å²	33.7	34%	0.343	16%	0.162	S	C	.	.	H	α-helix	trans	-60.2	-45.7	175.5	175.8	0	0	0	0	111.9	H348 E349 L350 N355 R356	H348-S352 WeakPolarHBondContact O-CB 3.47Å; H348-S352 PolarHBondContact O-N 2.93Å; E349-S352 WeakPolarHBondContact O-CB 3.44Å; E349-S352 PolarHBondContact O-N 3.42Å; L350-S352 VanDerWaalsContact C-N 3.29Å; L350-S352 PolarHBondContact O-N 3.24Å; S352-N355 PolarHBondContact O-N 2.86Å; S352-R356 WeakPolarHBondContact O-CG 3.44Å; S352-R356 PolarHBondContact O-N 3.43Å; S352-R356 PolarHBondContact O-NE 3.33Å; S352-R356 PolarHBondContact OG-NE 3.48Å
353	R	93.8	Very high	94.6	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.015	19%	0.19	C	C	.	.	H	α-helix	trans	-62	-48.7	174.5	-72.4	168.8	57	-142.5	1	112.1	L340 H342 E345 E349 L350 N355 R356 G357 H444 I445 H446	L340-R353 PolarHBondContact O-NH1 3.32Å; L340-R353 PolarHBondContact O-NH2 3.2Å; H342-R353 VanDerWaalsContact CD2-CZ 3.47Å; H342-R353 PolarHBondContact CD2-NH1 2.94Å; H342-R353 VanDerWaalsContact NE2-CZ 3.28Å; H342-R353 PolarHBondContact NE2-NH1 3.24Å; H342-R353 PolarHBondContact NE2-NH2 3.45Å; E345-R353 WeakPolarHBondContact OE1-CD 3.36Å; E345-R353 IonicContact OE1-CZ 3.15Å; E345-R353 IonicContact OE1-NE 3.09Å; E345-R353 IonicContact OE1-NH1 2.77Å; E345-R353 PolarHBondContact OE1-NH1 3.14Å; E345-R353 IonicContact OE2-NH1 3.88Å; E345-R353 PolarHBondContact OE2-NH1 3.36Å; E349-R353 PolarHBondContact O-N 3.24Å; E349-R353 VanDerWaalsContact O-N 3.12Å; L350-R353 PolarHBondContact O-N 2.61Å; R353-N355 VanDerWaalsContact C-N 3.31Å; R353-N355 PolarHBondContact O-N 3.32Å; R353-R356 PolarHBondContact O-N 2.88Å; R353-G357 PolarHBondContact O-N 2.91Å; R353-H444 PolarHBondContact NE-O 3.31Å; R353-I445 PolarHBondContact NH2-O 3.42Å; R353-H446 PolarHBondContact NE-CE1 3.1Å; R353-H446 PolarHBondContact NE-ND1 3.4Å; R353-H446 PolarHBondContact NH2-ND1 3.01Å
354	L	95.4	Very high	94.5	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-62.1	-37.2	179.7	-67.9	-177.8	0	0	0	112.5	W332 R337 L340 L350 Q351 Y358	W332-L354 HydrophobicContact CB-CD1 4.32Å; W332-L354 HydrophobicContact CD2-CD2 3.81Å; W332-L354 HydrophobicContact CE3-CD2 4.11Å; W332-L354 HydrophobicContact CG-CB 4.26Å; W332-L354 HydrophobicContact CG-CD1 4.25Å; W332-L354 HydrophobicContact CG-CD2 4.09Å; W332-L354 HydrophobicContact CG-CG 4.43Å; W332-L354 HydrophobicContact CZ2-CD2 4.38Å; W332-L354 PolarHBondContact NE1-O 2.9Å; R337-L354 HydrophobicContact CG-CD1 4.08Å; L340-L354 HydrophobicContact CD1-CD2 3.82Å; L350-L354 HydrophobicContact CD1-CD1 4.1Å; L350-L354 HydrophobicContact CD1-CG 4.09Å; L350-L354 HydrophobicContact CG-CD1 3.95Å; L350-L354 HydrophobicContact CG-CG 4.31Å; L350-L354 VanDerWaalsContact O-CG 3.31Å; L350-L354 WeakPolarHBondContact O-CG 3.4Å; L350-L354 PolarHBondContact O-N 2.97Å; Q351-L354 PolarHBondContact O-N 3.47Å; L354-Y358 PolarHBondContact O-N 3.38Å; L354-Y358 VanDerWaalsContact O-N 3.08Å
355	N	94.1	Very high	94.4	Very high	93 Å²	93	40.5 Å²	40.5	50%	0.497	19%	0.192	S	C	.	.	H	α-helix	trans	-65.8	-42.8	176.7	-74.2	-12.1	0	0	0	111.8	Q351 S352 R353 Y358	Q351-N355 PolarHBondContact NE2-OD1 3.34Å; Q351-N355 VanDerWaalsContact O-CB 3.32Å; Q351-N355 WeakPolarHBondContact O-CB 3.38Å; Q351-N355 PolarHBondContact O-N 2.93Å; Q351-N355 PolarHBondContact O-ND2 3.04Å; Q351-N355 PolarHBondContact O-OD1 3.31Å; S352-N355 PolarHBondContact O-N 2.86Å; R353-N355 VanDerWaalsContact C-N 3.31Å; R353-N355 PolarHBondContact O-N 3.32Å; N355-Y358 VanDerWaalsContact O-CB 3.26Å; N355-Y358 WeakPolarHBondContact O-CB 3.14Å; N355-Y358 PolarHBondContact O-N 3.37Å
356	R	89.8	Confident	94.2	Very high	84 Å²	84	44.1 Å²	44.1	32%	0.317	21%	0.211	S	C	.	.	H	α-helix	trans	-68.3	-37.1	178.2	-69.3	175	-67.3	160.2	3.1	112.2	S352 R353 Y358 P360 S703	S352-R356 WeakPolarHBondContact O-CG 3.44Å; S352-R356 PolarHBondContact O-N 3.43Å; S352-R356 PolarHBondContact O-NE 3.33Å; S352-R356 PolarHBondContact OG-NE 3.48Å; R353-R356 PolarHBondContact O-N 2.88Å; R356-Y358 VanDerWaalsContact C-N 3.28Å; R356-Y358 PolarHBondContact O-N 3.01Å; R356-P360 WeakPolarHBondContact O-CD 3.35Å; R356-S703 PolarHBondContact NH1-OG 3.43Å; R356-S703 PolarHBondContact NH2-OG 3.16Å
357	G	92.4	Very high	93.9	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-72.4	-11.7	172.3	0	0	0	0	0	115.2	R353 P360 A361	R353-G357 PolarHBondContact O-N 2.91Å; G357-P360 WeakPolarHBondContact O-CD 3.34Å; G357-P360 WeakPolarHBondContact O-CG 3.39Å; G357-A361 WeakPolarHBondContact O-CB 3.22Å; G357-A361 PolarHBondContact O-N 3.21Å; G357-A361 VanDerWaalsContact O-N 3.07Å
358	Y	95.3	Very high	93.6	Very high	85 Å²	85	43.6 Å²	43.6	33%	0.333	21%	0.21	S	C	.	.	H	α-helix	trans	-67.9	-51.2	-171.2	-178.5	-92.2	0	0	0	113.5	R330 L354 N355 R356 A361 S362 F469	R330-Y358 VanDerWaalsContact O-CE2 3.26Å; R330-Y358 WeakPolarHBondContact O-CE2 3.41Å; R330-Y358 PolarHBondContact O-OH 2.75Å; L354-Y358 PolarHBondContact O-N 3.38Å; L354-Y358 VanDerWaalsContact O-N 3.08Å; N355-Y358 VanDerWaalsContact O-CB 3.26Å; N355-Y358 WeakPolarHBondContact O-CB 3.14Å; N355-Y358 PolarHBondContact O-N 3.37Å; R356-Y358 VanDerWaalsContact C-N 3.28Å; R356-Y358 PolarHBondContact O-N 3.01Å; Y358-A361 PolarHBondContact O-N 2.94Å; Y358-S362 WeakPolarHBondContact O-CB 3.26Å; Y358-S362 PolarHBondContact O-N 3.42Å; Y358-F469 AromaticContact CD2-CE2 3.64Å; Y358-F469 HydrophobicContact CD2-CE2 3.64Å; Y358-F469 AromaticContact CD2-CZ 3.76Å; Y358-F469 HydrophobicContact CD2-CZ 3.76Å; Y358-F469 AromaticContact CE2-CE2 3.7Å; Y358-F469 HydrophobicContact CE2-CE2 3.7Å; Y358-F469 AromaticContact CE2-CZ 3.61Å; Y358-F469 HydrophobicContact CE2-CZ 3.61Å
359	K	93.3	Very high	93.1	Very high	130 Å²	130	44.8 Å²	44.8	57%	0.565	22%	0.218	S	C	*	.	H	α-helix	trans	-57.9	-50.9	179	-71.6	-179	-175.7	169.6	0	112.1	S362 K363 E616	K359-S362 PolarHBondContact O-N 2.81Å; K359-K363 PolarHBondContact O-N 2.91Å; K359-E616 IonicContact NZ-OE1 3.92Å; K359-E616 PolarHBondContact NZ-OE1 2.85Å
360	P	92.3	Very high	92.9	Very high	16 Å²	16	46.9 Å²	46.9	10%	0.104	24%	0.235	C	C	.	.	H	α-helix	trans	-66.5	-36	178.5	25.9	-34	0	0	0	112.6	R356 G357 S362 K363 Y364 V440 I441	R356-P360 WeakPolarHBondContact O-CD 3.35Å; G357-P360 WeakPolarHBondContact O-CD 3.34Å; G357-P360 WeakPolarHBondContact O-CG 3.39Å; P360-S362 PolarHBondContact O-N 3.49Å; P360-K363 PolarHBondContact O-N 3.45Å; P360-Y364 WeakPolarHBondContact O-CB 3.37Å; P360-Y364 PolarHBondContact O-N 2.94Å; P360-V440 HydrophobicContact CB-CG1 4.03Å; P360-V440 HydrophobicContact CG-CG1 4.15Å; P360-I441 HydrophobicContact CB-CG1 3.93Å; P360-I441 HydrophobicContact CG-CG1 4.24Å
361	A	95.1	Very high	92.7	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.5	-42.1	173.6	0	0	0	0	0	112.8	W332 G357 Y358 Y364 M365 I441 F465 F469	W332-A361 HydrophobicContact CH2-CB 4.05Å; W332-A361 HydrophobicContact CZ2-CB 4.11Å; G357-A361 WeakPolarHBondContact O-CB 3.22Å; G357-A361 PolarHBondContact O-N 3.21Å; G357-A361 VanDerWaalsContact O-N 3.07Å; Y358-A361 PolarHBondContact O-N 2.94Å; A361-Y364 PolarHBondContact O-N 2.98Å; A361-M365 PolarHBondContact O-N 3.32Å; A361-I441 HydrophobicContact CB-CD1 4.23Å; A361-I441 HydrophobicContact CB-CG1 4.34Å; A361-F465 HydrophobicContact CB-CE1 4.09Å; A361-F465 HydrophobicContact CB-CZ 3.79Å; A361-F469 HydrophobicContact CB-CD1 4.17Å; A361-F469 HydrophobicContact CB-CE1 4.07Å; A361-F469 HydrophobicContact CB-CG 4.45Å; A361-F469 HydrophobicContact CB-CZ 4.26Å
362	S	94.3	Very high	92.6	Very high	32 Å²	32	54.6 Å²	54.6	22%	0.224	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-46.2	175.2	-173.6	0	0	0	0	111.8	Y358 K359 P360 Y364 M365 N366	Y358-S362 WeakPolarHBondContact O-CB 3.26Å; Y358-S362 PolarHBondContact O-N 3.42Å; K359-S362 PolarHBondContact O-N 2.81Å; P360-S362 PolarHBondContact O-N 3.49Å; S362-Y364 VanDerWaalsContact C-N 3.34Å; S362-Y364 PolarHBondContact O-N 2.97Å; S362-M365 PolarHBondContact O-N 2.75Å; S362-N366 WeakPolarHBondContact O-CB 3.38Å; S362-N366 PolarHBondContact O-N 3.49Å; S362-N366 PolarHBondContact O-ND2 3.34Å
363	K	92.3	Very high	92.7	Very high	137 Å²	137	55.9 Å²	55.9	60%	0.596	29%	0.286	S	S	*	.	H	α-helix	trans	-58.8	-44.3	174.7	-72	-179.5	179.8	-178.3	0	111.9	K359 P360 N366 C367 L437	K359-K363 PolarHBondContact O-N 2.91Å; P360-K363 PolarHBondContact O-N 3.45Å; K363-N366 PolarHBondContact O-N 3.11Å; K363-C367 PolarHBondContact O-N 3.21Å; K363-C367 VanDerWaalsContact O-N 3.15Å; K363-C367 PolarHBondContact O-SG 2.76Å; K363-L437 HydrophobicContact CB-CD1 4.11Å; K363-L437 HydrophobicContact CB-CD2 4.02Å; K363-L437 HydrophobicContact CD-CD2 4.43Å
364	Y	94.2	Very high	92.7	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-59.3	-48.5	177.7	173.6	-97.6	0	0	0	111.5	P360 A361 S362 N366 C367 F368 P434 L437 L438 I441 A456 T461 F465	P360-Y364 WeakPolarHBondContact O-CB 3.37Å; P360-Y364 PolarHBondContact O-N 2.94Å; A361-Y364 PolarHBondContact O-N 2.98Å; S362-Y364 VanDerWaalsContact C-N 3.34Å; S362-Y364 PolarHBondContact O-N 2.97Å; Y364-N366 VanDerWaalsContact C-N 3.32Å; Y364-N366 PolarHBondContact O-N 3.33Å; Y364-C367 WeakPolarHBondContact O-CB 3.33Å; Y364-C367 PolarHBondContact O-N 3.27Å; Y364-C367 VanDerWaalsContact O-N 3.17Å; Y364-F368 HydrophobicContact CD1-CE2 4.23Å; Y364-F368 HydrophobicContact CD2-CE2 4.09Å; Y364-F368 HydrophobicContact CE1-CD2 4.47Å; Y364-F368 AromaticContact CE1-CE2 3.81Å; Y364-F368 HydrophobicContact CE1-CE2 3.81Å; Y364-F368 AromaticContact CE2-CE2 3.66Å; Y364-F368 HydrophobicContact CE2-CE2 3.66Å; Y364-F368 HydrophobicContact CE2-CZ 4.09Å; Y364-F368 HydrophobicContact CG-CE2 4.36Å; Y364-F368 AromaticContact CZ-CE2 3.5Å; Y364-F368 AromaticContact CZ-CZ 3.96Å; Y364-F368 WeakPolarHBondContact O-CD2 3.28Å; Y364-F368 WeakPolarHBondContact O-CE2 3.21Å; Y364-P434 HydrophobicContact CD2-CB 4.14Å; Y364-P434 HydrophobicContact CE2-CB 3.9Å; Y364-L437 HydrophobicContact CD2-CB 4.31Å; Y364-L438 HydrophobicContact CD2-CB 4.41Å; Y364-L438 HydrophobicContact CE2-CB 4.23Å; Y364-L438 HydrophobicContact CE2-CD1 4.25Å; Y364-L438 HydrophobicContact CE2-CD2 4.44Å; Y364-I441 HydrophobicContact CD1-CD1 4.46Å; Y364-I441 HydrophobicContact CG-CD1 4.02Å; Y364-A456 PolarHBondContact OH-O 3.49Å; Y364-T461 WeakPolarHBondContact OH-CG2 3.26Å; Y364-F465 HydrophobicContact CD1-CD1 4.06Å; Y364-F465 HydrophobicContact CD1-CE1 4.16Å; Y364-F465 HydrophobicContact CD1-CG 4.46Å; Y364-F465 HydrophobicContact CE1-CB 4.35Å; Y364-F465 HydrophobicContact CE1-CD1 4.1Å; Y364-F465 HydrophobicContact CE1-CG 4.13Å
365	M	94.9	Very high	92.7	Very high	6 Å²	6	61.1 Å²	61.1	3%	0.03	32%	0.315	C	S	.	.	H	α-helix	trans	-67.2	-32.1	179.2	-68	-54.5	-85.2	0	0	113.2	R330 A361 S362 C367 F368 R462 F465 A466 F469	R330-M365 VanDerWaalsContact NH1-CE 3.32Å; A361-M365 PolarHBondContact O-N 3.32Å; S362-M365 PolarHBondContact O-N 2.75Å; M365-C367 VanDerWaalsContact C-N 3.26Å; M365-C367 PolarHBondContact O-N 3.48Å; M365-F368 PolarHBondContact O-N 2.64Å; M365-F368 VanDerWaalsContact O-N 3.16Å; M365-R462 HydrophobicContact CE-CG 3.97Å; M365-R462 HydrophobicContact SD-CG 4.26Å; M365-F465 HydrophobicContact CE-CD1 4.4Å; M365-F465 HydrophobicContact CG-CD1 3.93Å; M365-F465 HydrophobicContact CG-CE1 3.96Å; M365-F465 HydrophobicContact SD-CD1 3.48Å; M365-F465 WeakPolarHBondContact SD-CD1 3.47Å; M365-F465 HydrophobicContact SD-CE1 4.12Å; M365-F465 HydrophobicContact SD-CG 4.44Å; M365-A466 HydrophobicContact CE-CB 3.76Å; M365-F469 HydrophobicContact CG-CD1 3.98Å
366	N	92.1	Very high	92.8	Very high	76 Å²	76	61.8 Å²	61.8	41%	0.406	32%	0.317	S	S	.	.	H	α-helix	trans	-71.9	-17.8	175.7	-69	-17.2	0	0	0	113.2	S362 K363 Y364 F368 L369 M430	S362-N366 WeakPolarHBondContact O-CB 3.38Å; S362-N366 PolarHBondContact O-N 3.49Å; S362-N366 PolarHBondContact O-ND2 3.34Å; K363-N366 PolarHBondContact O-N 3.11Å; Y364-N366 VanDerWaalsContact C-N 3.32Å; Y364-N366 PolarHBondContact O-N 3.33Å; N366-F368 PolarHBondContact O-N 3.07Å; N366-L369 WeakPolarHBondContact O-CD2 3.31Å; N366-M430 WeakPolarHBondContact O-CE 3.25Å
367	C	91.6	Very high	93.1	Very high	22 Å²	22	58 Å²	58	15%	0.149	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-22.6	169.6	-65.7	0	0	0	0	112.5	K363 Y364 M365 L369 F432	K363-C367 PolarHBondContact O-N 3.21Å; K363-C367 VanDerWaalsContact O-N 3.15Å; K363-C367 PolarHBondContact O-SG 2.76Å; Y364-C367 WeakPolarHBondContact O-CB 3.33Å; Y364-C367 PolarHBondContact O-N 3.27Å; Y364-C367 VanDerWaalsContact O-N 3.17Å; M365-C367 VanDerWaalsContact C-N 3.26Å; M365-C367 PolarHBondContact O-N 3.48Å; C367-L369 PolarHBondContact O-N 3.14Å; C367-F432 HydrophobicContact CB-CD2 3.84Å; C367-F432 HydrophobicContact CB-CE2 3.93Å
368	F	90.8	Very high	93.2	Very high	39 Å²	39	63.1 Å²	63.1	17%	0.171	33%	0.327	C	S	.	.	S	Bend	trans	-97.7	87.3	-179.1	-63.3	-84.1	0	0	0	111.1	Y364 M365 N366 P434 A456 R462	Y364-F368 HydrophobicContact CD1-CE2 4.23Å; Y364-F368 HydrophobicContact CD2-CE2 4.09Å; Y364-F368 HydrophobicContact CE1-CD2 4.47Å; Y364-F368 AromaticContact CE1-CE2 3.81Å; Y364-F368 HydrophobicContact CE1-CE2 3.81Å; Y364-F368 AromaticContact CE2-CE2 3.66Å; Y364-F368 HydrophobicContact CE2-CE2 3.66Å; Y364-F368 HydrophobicContact CE2-CZ 4.09Å; Y364-F368 HydrophobicContact CG-CE2 4.36Å; Y364-F368 AromaticContact CZ-CE2 3.5Å; Y364-F368 AromaticContact CZ-CZ 3.96Å; Y364-F368 WeakPolarHBondContact O-CD2 3.28Å; Y364-F368 WeakPolarHBondContact O-CE2 3.21Å; M365-F368 PolarHBondContact O-N 2.64Å; M365-F368 VanDerWaalsContact O-N 3.16Å; N366-F368 PolarHBondContact O-N 3.07Å; F368-P434 HydrophobicContact CZ-CB 4.3Å; F368-A456 VanDerWaalsContact CZ-O 3.31Å; F368-A456 WeakPolarHBondContact CZ-O 3.39Å; F368-R462 HydrophobicContact CB-CG 3.99Å; F368-R462 HydrophobicContact CD1-CB 4.19Å; F368-R462 HydrophobicContact CD1-CG 4.27Å; F368-R462 HydrophobicContact CD2-CB 4.32Å; F368-R462 HydrophobicContact CD2-CG 4.07Å; F368-R462 HydrophobicContact CE1-CB 4.36Å; F368-R462 HydrophobicContact CG-CB 4.17Å; F368-R462 HydrophobicContact CG-CG 3.83Å
369	L	85	Confident	93.3	Very high	85 Å²	85	62.8 Å²	62.8	45%	0.445	33%	0.331	S	S	.	.			trans	-91.5	138.4	-179.7	-59.2	166.1	0	0	0	110.4	N366 C367 P371 P426 M430	N366-L369 WeakPolarHBondContact O-CD2 3.31Å; C367-L369 PolarHBondContact O-N 3.14Å; L369-P371 VanDerWaalsContact O-CD 3.3Å; L369-P371 WeakPolarHBondContact O-CD 3.11Å; L369-P426 HydrophobicContact CD1-CB 3.65Å; L369-P426 HydrophobicContact CD1-CG 3.5Å; L369-P426 VanDerWaalsContact CD1-CG 3.5Å; L369-P426 HydrophobicContact CD2-CB 3.48Å; L369-P426 VanDerWaalsContact CD2-CB 3.48Å; L369-P426 HydrophobicContact CD2-CG 3.72Å; L369-P426 HydrophobicContact CG-CB 4.18Å; L369-P426 HydrophobicContact CG-CG 4.14Å; L369-M430 HydrophobicContact CD1-CE 4.12Å; L369-M430 HydrophobicContact CD2-CE 4.43Å
370	S	90.5	Very high	93.5	Very high	63 Å²	63	57.9 Å²	57.9	44%	0.441	32%	0.317	S	S	.	.			trans	-84.2	112	169.1	174	0	0	0	0	109	L372 L373 T374	S370-L372 PolarHBondContact O-N 3.25Å; S370-L373 PolarHBondContact O-N 3.27Å; S370-L373 PolarHBondContact OG-N 3.41Å; S370-T374 PolarHBondContact O-N 3.02Å; S370-T374 PolarHBondContact O-OG1 3.04Å
371	P	92.1	Very high	93.7	Very high	108 Å²	108	57.4 Å²	57.4	70%	0.701	31%	0.314	S	S	*	.	H	α-helix	trans	-60.4	-36.7	-176.9	-23.8	35	0	0	0	112.5	L369 L375	L369-P371 VanDerWaalsContact O-CD 3.3Å; L369-P371 WeakPolarHBondContact O-CD 3.11Å; P371-L375 WeakPolarHBondContact O-CB 3.41Å; P371-L375 PolarHBondContact O-N 3.2Å
372	L	94.5	Very high	93.8	Very high	116 Å²	116	64 Å²	64	61%	0.607	34%	0.343	S	S	*	.	H	α-helix	trans	-64.5	-47.2	177.7	-179.8	62.6	0	0	0	111.4	S370 T374 L375 L376	S370-L372 PolarHBondContact O-N 3.25Å; L372-T374 VanDerWaalsContact C-N 3.34Å; L372-T374 PolarHBondContact O-N 3.44Å; L372-L375 PolarHBondContact O-N 2.76Å; L372-L376 HydrophobicContact CD1-CD1 4.42Å; L372-L376 HydrophobicContact CD1-CG 4.46Å; L372-L376 HydrophobicContact CG-CD1 4.27Å; L372-L376 WeakPolarHBondContact O-CG 3.48Å; L372-L376 PolarHBondContact O-N 3.16Å
373	L	92.6	Very high	94	Very high	76 Å²	76	68.6 Å²	68.6	40%	0.398	36%	0.359	S	S	.	.	H	α-helix	trans	-63.6	-41.4	179.5	-175.1	63.1	0	0	0	111.2	S370 L375 L376 A377 F424	S370-L373 PolarHBondContact O-N 3.27Å; S370-L373 PolarHBondContact OG-N 3.41Å; L373-L375 VanDerWaalsContact C-N 3.35Å; L373-L375 PolarHBondContact O-N 2.81Å; L373-L376 PolarHBondContact O-N 3.41Å; L373-A377 VanDerWaalsContact O-CB 3.22Å; L373-A377 WeakPolarHBondContact O-CB 3.48Å; L373-A377 PolarHBondContact O-N 3.17Å; L373-F424 HydrophobicContact CD2-CD1 4.04Å; L373-F424 HydrophobicContact CD2-CE1 4.5Å; L373-F424 HydrophobicContact CD2-CG 4.35Å; L373-F424 HydrophobicContact CG-CB 4.43Å; L373-F424 HydrophobicContact CG-CG 4.44Å
374	T	93.4	Very high	94.2	Very high	20 Å²	20	62.5 Å²	62.5	12%	0.123	33%	0.334	C	S	.	.	H	α-helix	trans	-63.8	-38.8	176.5	-58.5	0	0	0	0	112.2	S370 L372 K378 P426	S370-T374 PolarHBondContact O-N 3.02Å; S370-T374 PolarHBondContact O-OG1 3.04Å; L372-T374 VanDerWaalsContact C-N 3.34Å; L372-T374 PolarHBondContact O-N 3.44Å; T374-K378 HydrophobicContact CG2-CD 4.3Å; T374-K378 WeakPolarHBondContact O-CB 3.49Å; T374-K378 WeakPolarHBondContact O-CG 3.39Å; T374-K378 PolarHBondContact O-N 3.3Å; T374-P426 HydrophobicContact CG2-CG 4.35Å
375	L	95.8	Very high	94.4	Very high	96 Å²	96	63.7 Å²	63.7	50%	0.503	35%	0.347	S	S	.	.	H	α-helix	trans	-64.2	-48.1	176.1	-179.4	64.4	0	0	0	111.5	P371 L372 L373 A377 K378 N379	P371-L375 WeakPolarHBondContact O-CB 3.41Å; P371-L375 PolarHBondContact O-N 3.2Å; L372-L375 PolarHBondContact O-N 2.76Å; L373-L375 VanDerWaalsContact C-N 3.35Å; L373-L375 PolarHBondContact O-N 2.81Å; L375-A377 VanDerWaalsContact C-N 3.34Å; L375-A377 PolarHBondContact O-N 3.39Å; L375-K378 PolarHBondContact O-N 3.48Å; L375-N379 PolarHBondContact O-N 3.46Å; L375-N379 VanDerWaalsContact O-N 3.1Å; L375-N379 PolarHBondContact O-ND2 3.35Å
376	L	96.4	Very high	94.5	Very high	106 Å²	106	65.9 Å²	65.9	56%	0.555	36%	0.363	S	S	*	.	H	α-helix	trans	-60.9	-43.9	177.3	-68.7	175.4	0	0	0	111.5	L372 L373 N379 G380	L372-L376 HydrophobicContact CD1-CD1 4.42Å; L372-L376 HydrophobicContact CD1-CG 4.46Å; L372-L376 HydrophobicContact CG-CD1 4.27Å; L372-L376 WeakPolarHBondContact O-CG 3.48Å; L372-L376 PolarHBondContact O-N 3.16Å; L373-L376 PolarHBondContact O-N 3.41Å; L376-N379 PolarHBondContact O-N 3.3Å; L376-G380 PolarHBondContact O-N 3.42Å
377	A	95.3	Very high	94.7	Very high	5 Å²	5	66.6 Å²	66.6	4%	0.041	37%	0.366	C	S	.	.	H	α-helix	trans	-62.9	-43.7	178.4	0	0	0	0	0	112.6	L373 L375 A381 C421 F424 I425	L373-A377 VanDerWaalsContact O-CB 3.22Å; L373-A377 WeakPolarHBondContact O-CB 3.48Å; L373-A377 PolarHBondContact O-N 3.17Å; L375-A377 VanDerWaalsContact C-N 3.34Å; L375-A377 PolarHBondContact O-N 3.39Å; A377-A381 WeakPolarHBondContact O-CB 3.01Å; A377-A381 PolarHBondContact O-N 3.15Å; A377-C421 WeakPolarHBondContact CB-O 3.47Å; A377-C421 WeakPolarHBondContact O-CB 3.19Å; A377-F424 HydrophobicContact CB-CB 3.76Å; A377-I425 HydrophobicContact CB-CG1 3.99Å
378	K	95.4	Very high	95	Very high	107 Å²	107	66.7 Å²	66.7	47%	0.465	37%	0.365	S	S	.	.	H	α-helix	trans	-62	-48.2	176.9	-77.2	179.5	177.7	-176.7	0	112.1	T374 L375 F382 I425	T374-K378 HydrophobicContact CG2-CD 4.3Å; T374-K378 WeakPolarHBondContact O-CB 3.49Å; T374-K378 WeakPolarHBondContact O-CG 3.39Å; T374-K378 PolarHBondContact O-N 3.3Å; L375-K378 PolarHBondContact O-N 3.48Å; K378-F382 PolarHBondContact O-N 3.41Å; K378-F382 VanDerWaalsContact O-N 3.08Å; K378-I425 HydrophobicContact CB-CD1 4.5Å; K378-I425 HydrophobicContact CG-CD1 3.83Å; K378-I425 HydrophobicContact CG-CG1 3.99Å
379	N	97.1	Very high	95.3	Very high	79 Å²	79	67.5 Å²	67.5	42%	0.422	38%	0.379	S	S	.	.	H	α-helix	trans	-68.8	-43.6	-179.2	-67.7	-21.7	0	0	0	111.3	L375 L376 A381 F382 F383	L375-N379 PolarHBondContact O-N 3.46Å; L375-N379 VanDerWaalsContact O-N 3.1Å; L375-N379 PolarHBondContact O-ND2 3.35Å; L376-N379 PolarHBondContact O-N 3.3Å; N379-A381 PolarHBondContact O-N 2.96Å; N379-F382 PolarHBondContact O-N 3.3Å; N379-F383 HydrophobicContact CB-CE2 4.22Å; N379-F383 WeakPolarHBondContact O-CD2 3.39Å; N379-F383 PolarHBondContact O-N 3.02Å
380	G	96.8	Very high	95.8	Very high	26 Å²	26	67.7 Å²	67.7	27%	0.268	38%	0.383	S	S	.	.	H	α-helix	trans	-59.5	-44.6	175.8	0	0	0	0	0	112.5	L376 F382 A384	L376-G380 PolarHBondContact O-N 3.42Å; G380-F382 VanDerWaalsContact C-N 3.32Å; G380-F382 PolarHBondContact O-N 3.37Å; G380-A384 VanDerWaalsContact O-CB 3.31Å; G380-A384 WeakPolarHBondContact O-CB 3.45Å; G380-A384 PolarHBondContact O-N 2.79Å
381	A	96.8	Very high	96.1	Very high	7 Å²	7	66.1 Å²	66.1	6%	0.058	37%	0.37	C	S	.	.	H	α-helix	trans	-62.5	-37.4	175	0	0	0	0	0	112.7	A377 N379 G385 C421 I425	A377-A381 WeakPolarHBondContact O-CB 3.01Å; A377-A381 PolarHBondContact O-N 3.15Å; N379-A381 PolarHBondContact O-N 2.96Å; A381-G385 WeakPolarHBondContact O-CA 3.25Å; A381-G385 PolarHBondContact O-N 2.91Å; A381-C421 HydrophobicContact CB-CB 3.74Å; A381-I425 HydrophobicContact CB-CD1 4.45Å
382	F	97.7	Very high	96.2	Very high	139 Å²	139	64.5 Å²	64.5	61%	0.61	35%	0.354	S	S	*	.	H	α-helix	trans	-67	-50.8	178.1	177.1	-98.8	0	0	0	111.7	K378 N379 G380 G385 S386	K378-F382 PolarHBondContact O-N 3.41Å; K378-F382 VanDerWaalsContact O-N 3.08Å; N379-F382 PolarHBondContact O-N 3.3Å; G380-F382 VanDerWaalsContact C-N 3.32Å; G380-F382 PolarHBondContact O-N 3.37Å; F382-G385 PolarHBondContact O-N 3.34Å; F382-S386 WeakPolarHBondContact O-CB 3.3Å; F382-S386 PolarHBondContact O-N 3.06Å; F382-S386 PolarHBondContact O-OG 3.49Å
383	F	97.8	Very high	96.3	Very high	127 Å²	127	61.8 Å²	61.8	56%	0.557	35%	0.348	S	S	*	.	H	α-helix	trans	-63.4	-51.7	179.4	-66.2	-59.1	0	0	0	111.7	N379 G385 S386 I387	N379-F383 HydrophobicContact CB-CE2 4.22Å; N379-F383 WeakPolarHBondContact O-CD2 3.39Å; N379-F383 PolarHBondContact O-N 3.02Å; F383-G385 VanDerWaalsContact C-N 3.31Å; F383-G385 PolarHBondContact O-N 2.93Å; F383-S386 PolarHBondContact O-N 3.07Å; F383-S386 PolarHBondContact O-OG 3.08Å; F383-I387 PolarHBondContact O-N 2.98Å
384	A	97.4	Very high	96.4	Very high	9 Å²	9	62.1 Å²	62.1	7%	0.074	35%	0.35	C	S	.	.	H	α-helix	trans	-61.7	-40.6	178.8	0	0	0	0	0	112	G380 L388 L414 T417 V418	G380-A384 VanDerWaalsContact O-CB 3.31Å; G380-A384 WeakPolarHBondContact O-CB 3.45Å; G380-A384 PolarHBondContact O-N 2.79Å; A384-L388 WeakPolarHBondContact O-CB 3.46Å; A384-L388 PolarHBondContact O-N 2.97Å; A384-L414 HydrophobicContact CB-CD2 3.97Å; A384-T417 HydrophobicContact CB-CG2 4.02Å; A384-V418 HydrophobicContact CB-CG2 3.67Å
385	G	97.4	Very high	96.4	Very high	25 Å²	25	62.5 Å²	62.5	26%	0.258	35%	0.352	S	S	.	.	H	α-helix	trans	-66.1	-36.9	178	0	0	0	0	0	113.6	A381 F382 F383 L388 A389	A381-G385 WeakPolarHBondContact O-CA 3.25Å; A381-G385 PolarHBondContact O-N 2.91Å; F382-G385 PolarHBondContact O-N 3.34Å; F383-G385 VanDerWaalsContact C-N 3.31Å; F383-G385 PolarHBondContact O-N 2.93Å; G385-L388 PolarHBondContact O-N 2.9Å; G385-A389 VanDerWaalsContact O-CB 3.27Å; G385-A389 WeakPolarHBondContact O-CB 3.48Å; G385-A389 PolarHBondContact O-N 3.34Å
386	S	97.5	Very high	96.4	Very high	53 Å²	53	64.4 Å²	64.4	37%	0.371	36%	0.362	S	S	.	.	H	α-helix	trans	-65.8	-46.3	177.5	66.8	0	0	0	0	112.3	F382 F383 A389 V390	F382-S386 WeakPolarHBondContact O-CB 3.3Å; F382-S386 PolarHBondContact O-N 3.06Å; F382-S386 PolarHBondContact O-OG 3.49Å; F383-S386 PolarHBondContact O-N 3.07Å; F383-S386 PolarHBondContact O-OG 3.08Å; S386-A389 PolarHBondContact O-N 3.4Å; S386-V390 WeakPolarHBondContact O-CG2 3.46Å; S386-V390 PolarHBondContact O-N 3.19Å
387	I	97.3	Very high	96.4	Very high	91 Å²	91	69.1 Å²	69.1	47%	0.467	37%	0.374	S	S	.	.	H	α-helix	trans	-63.8	-45	175.8	-59.6	168.9	0	0	0	109.9	F383 A389 V390 L391 L414	F383-I387 PolarHBondContact O-N 2.98Å; I387-A389 PolarHBondContact O-N 3.12Å; I387-V390 PolarHBondContact O-N 3.23Å; I387-L391 HydrophobicContact CG2-CD1 4.17Å; I387-L391 WeakPolarHBondContact O-CG 3.12Å; I387-L391 PolarHBondContact O-N 3.06Å; I387-L414 HydrophobicContact CB-CD1 4.01Å; I387-L414 HydrophobicContact CG2-CD1 3.58Å
388	L	96.9	Very high	96.3	Very high	24 Å²	24	72 Å²	72	13%	0.126	39%	0.389	C	S	.	.	H	α-helix	trans	-61	-41.8	178.2	-177.4	60.8	0	0	0	112.2	A384 G385 V390 L391 I392 V411 L414 V418	A384-L388 WeakPolarHBondContact O-CB 3.46Å; A384-L388 PolarHBondContact O-N 2.97Å; G385-L388 PolarHBondContact O-N 2.9Å; L388-V390 PolarHBondContact O-N 2.93Å; L388-L391 PolarHBondContact O-N 3.24Å; L388-I392 HydrophobicContact CD1-CD1 3.98Å; L388-I392 HydrophobicContact CD1-CG1 4.19Å; L388-I392 HydrophobicContact CD2-CD1 4.47Å; L388-I392 HydrophobicContact CG-CD1 3.78Å; L388-I392 HydrophobicContact CG-CG1 4.39Å; L388-I392 WeakPolarHBondContact O-CB 3.41Å; L388-I392 VanDerWaalsContact O-CG1 3.24Å; L388-I392 WeakPolarHBondContact O-CG1 3.17Å; L388-I392 PolarHBondContact O-N 2.85Å; L388-V411 HydrophobicContact CD1-CB 4.29Å; L388-V411 HydrophobicContact CD1-CG1 3.9Å; L388-V411 HydrophobicContact CD1-CG2 4.4Å; L388-L414 HydrophobicContact CB-CB 4.18Å; L388-L414 HydrophobicContact CB-CD1 4.35Å; L388-L414 HydrophobicContact CD1-CB 4.19Å; L388-V418 HydrophobicContact CD2-CG2 4.38Å
389	A	96.9	Very high	96.2	Very high	56 Å²	56	74.3 Å²	74.3	46%	0.463	40%	0.401	S	S	.	.	H	α-helix	trans	-63.8	-40.1	178.5	0	0	0	0	0	112.2	G385 S386 I387 A393	G385-A389 VanDerWaalsContact O-CB 3.27Å; G385-A389 WeakPolarHBondContact O-CB 3.48Å; G385-A389 PolarHBondContact O-N 3.34Å; S386-A389 PolarHBondContact O-N 3.4Å; I387-A389 PolarHBondContact O-N 3.12Å; A389-A393 WeakPolarHBondContact O-CB 3.13Å; A389-A393 PolarHBondContact O-N 3.15Å
390	V	97	Very high	95.9	Very high	89 Å²	89	75.8 Å²	75.8	54%	0.539	41%	0.409	S	S	.	.	H	α-helix	trans	-64.6	-47.1	175	173.1	0	0	0	0	110.7	S386 I387 L388 I392 A393 L394	S386-V390 WeakPolarHBondContact O-CG2 3.46Å; S386-V390 PolarHBondContact O-N 3.19Å; I387-V390 PolarHBondContact O-N 3.23Å; L388-V390 PolarHBondContact O-N 2.93Å; V390-I392 PolarHBondContact O-N 3.43Å; V390-A393 PolarHBondContact O-N 3.38Å; V390-L394 HydrophobicContact CG1-CD1 4.14Å; V390-L394 WeakPolarHBondContact O-CG 3.32Å; V390-L394 PolarHBondContact O-N 2.83Å
391	L	95.1	Very high	95.6	Very high	30 Å²	30	76 Å²	76	16%	0.157	41%	0.405	C	S	.	.	H	α-helix	trans	-61	-44.1	177.2	-71	175	0	0	0	111.7	I387 L388 A393 L394 T395 T410 V411 L414	I387-L391 HydrophobicContact CG2-CD1 4.17Å; I387-L391 WeakPolarHBondContact O-CG 3.12Å; I387-L391 PolarHBondContact O-N 3.06Å; L388-L391 PolarHBondContact O-N 3.24Å; L391-A393 PolarHBondContact O-N 3.49Å; L391-L394 PolarHBondContact O-N 3.25Å; L391-T395 VanDerWaalsContact O-CG2 3.31Å; L391-T395 WeakPolarHBondContact O-CG2 3.32Å; L391-T395 PolarHBondContact O-N 2.83Å; L391-T395 PolarHBondContact O-OG1 3.12Å; L391-T410 HydrophobicContact CD1-CG2 3.89Å; L391-V411 HydrophobicContact CB-CG2 4.04Å; L391-V411 HydrophobicContact CD1-CG2 4.11Å; L391-L414 HydrophobicContact CD1-CD1 4Å
392	I	95.3	Very high	95.3	Very high	73 Å²	73	79.8 Å²	79.8	37%	0.374	42%	0.424	S	S	.	.	H	α-helix	trans	-60.7	-46	176.1	-71.5	170.3	0	0	0	110.7	L388 V390 L394 T395 I396	L388-I392 HydrophobicContact CD1-CD1 3.98Å; L388-I392 HydrophobicContact CD1-CG1 4.19Å; L388-I392 HydrophobicContact CD2-CD1 4.47Å; L388-I392 HydrophobicContact CG-CD1 3.78Å; L388-I392 HydrophobicContact CG-CG1 4.39Å; L388-I392 WeakPolarHBondContact O-CB 3.41Å; L388-I392 VanDerWaalsContact O-CG1 3.24Å; L388-I392 WeakPolarHBondContact O-CG1 3.17Å; L388-I392 PolarHBondContact O-N 2.85Å; V390-I392 PolarHBondContact O-N 3.43Å; I392-L394 VanDerWaalsContact C-N 3.33Å; I392-L394 PolarHBondContact O-N 2.81Å; I392-T395 WeakPolarHBondContact CA-OG1 3.28Å; I392-T395 PolarHBondContact O-N 3.38Å; I392-T395 PolarHBondContact O-OG1 3.23Å; I392-I396 HydrophobicContact CG2-CD1 3.7Å; I392-I396 HydrophobicContact CG2-CG1 4.39Å; I392-I396 VanDerWaalsContact O-CG1 3.32Å; I392-I396 WeakPolarHBondContact O-CG1 3.44Å; I392-I396 PolarHBondContact O-N 2.86Å
393	A	96	Very high	94.9	Very high	59 Å²	59	77.4 Å²	77.4	49%	0.488	43%	0.43	S	S	.	.	H	α-helix	trans	-61.2	-41.6	178.6	0	0	0	0	0	112.1	A389 V390 L391 I396 Y397	A389-A393 WeakPolarHBondContact O-CB 3.13Å; A389-A393 PolarHBondContact O-N 3.15Å; V390-A393 PolarHBondContact O-N 3.38Å; L391-A393 PolarHBondContact O-N 3.49Å; A393-I396 PolarHBondContact O-N 3.38Å; A393-Y397 WeakPolarHBondContact O-CB 3.21Å; A393-Y397 PolarHBondContact O-N 2.95Å
394	L	95	Very high	94.6	Very high	83 Å²	83	75.4 Å²	75.4	44%	0.435	43%	0.428	S	S	.	.	H	α-helix	trans	-64.2	-43.2	175	-71.8	172.9	0	0	0	111.8	V390 L391 I392 I396 Y397 D398 V401	V390-L394 HydrophobicContact CG1-CD1 4.14Å; V390-L394 WeakPolarHBondContact O-CG 3.32Å; V390-L394 PolarHBondContact O-N 2.83Å; L391-L394 PolarHBondContact O-N 3.25Å; I392-L394 VanDerWaalsContact C-N 3.33Å; I392-L394 PolarHBondContact O-N 2.81Å; L394-I396 VanDerWaalsContact C-N 3.29Å; L394-I396 PolarHBondContact O-N 2.97Å; L394-Y397 PolarHBondContact O-N 3.5Å; L394-D398 PolarHBondContact O-N 3.2Å; L394-D398 VanDerWaalsContact O-O 3.12Å; L394-V401 HydrophobicContact CB-CG1 4.28Å; L394-V401 HydrophobicContact CB-CG2 4.41Å
395	T	94	Very high	94.2	Very high	28 Å²	28	82.4 Å²	82.4	17%	0.172	46%	0.459	C	S	.	.	H	α-helix	trans	-67.4	-26.7	177.5	56.9	0	0	0	0	113.9	L391 I392 D398 V401 L402 V407	L391-T395 VanDerWaalsContact O-CG2 3.31Å; L391-T395 WeakPolarHBondContact O-CG2 3.32Å; L391-T395 PolarHBondContact O-N 2.83Å; L391-T395 PolarHBondContact O-OG1 3.12Å; I392-T395 WeakPolarHBondContact CA-OG1 3.28Å; I392-T395 PolarHBondContact O-N 3.38Å; I392-T395 PolarHBondContact O-OG1 3.23Å; T395-D398 CarbonylContact C-O 3.48Å; T395-D398 WeakPolarHBondContact CA-O 3.08Å; T395-D398 CarbonylContact O-C 3.54Å; T395-V401 HydrophobicContact CG2-CB 4.2Å; T395-V401 HydrophobicContact CG2-CG1 4Å; T395-L402 HydrophobicContact CG2-CD2 3.62Å; T395-L402 HydrophobicContact CG2-CG 3.86Å; T395-V407 HydrophobicContact CG2-CG1 4.48Å
396	I	95.3	Very high	93.9	Very high	137 Å²	137	87 Å²	87	70%	0.703	47%	0.474	S	S	*	.	H	α-helix	trans	-78.8	-34.6	174	-69.1	169	0	0	0	110.6	I392 A393 L394	I392-I396 HydrophobicContact CG2-CD1 3.7Å; I392-I396 HydrophobicContact CG2-CG1 4.39Å; I392-I396 VanDerWaalsContact O-CG1 3.32Å; I392-I396 WeakPolarHBondContact O-CG1 3.44Å; I392-I396 PolarHBondContact O-N 2.86Å; A393-I396 PolarHBondContact O-N 3.38Å; L394-I396 VanDerWaalsContact C-N 3.29Å; L394-I396 PolarHBondContact O-N 2.97Å
397	Y	95.9	Very high	93.7	Very high	204 Å²	204	85.3 Å²	85.3	80%	0.8	46%	0.461	S	S	*	.	H	α-helix	trans	-69.8	-43.9	176.9	179.4	-96.2	0	0	0	111.6	A393 L394	A393-Y397 WeakPolarHBondContact O-CB 3.21Å; A393-Y397 PolarHBondContact O-N 2.95Å; L394-Y397 PolarHBondContact O-N 3.5Å
398	D	94.3	Very high	93.4	Very high	67 Å²	67	86 Å²	86	36%	0.358	47%	0.465	S	S	.	.			trans	-143.3	120	179.6	-171.1	-12.7	0	0	0	109.9	L394 T395 D400 V401	L394-D398 PolarHBondContact O-N 3.2Å; L394-D398 VanDerWaalsContact O-O 3.12Å; T395-D398 CarbonylContact C-O 3.48Å; T395-D398 WeakPolarHBondContact CA-O 3.08Å; T395-D398 CarbonylContact O-C 3.54Å; D398-D400 VanDerWaalsContact C-N 3.25Å; D398-D400 PolarHBondContact O-N 2.66Å; D398-D400 WeakPolarHBondContact OD1-CB 3.33Å; D398-D400 PolarHBondContact OD1-N 2.83Å; D398-V401 HydrophobicContact CB-CG2 4.21Å; D398-V401 WeakPolarHBondContact O-CB 3.38Å; D398-V401 WeakPolarHBondContact O-CG2 3.14Å; D398-V401 PolarHBondContact O-N 3.01Å
399	E	91.8	Very high	93.3	Very high	154 Å²	154	88.2 Å²	88.2	72%	0.72	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-70.4	-22.3	-178.6	64.4	-179.7	178.6	0	0	112.9	V401 L402	E399-V401 PolarHBondContact O-N 2.9Å; E399-V401 VanDerWaalsContact O-N 3.11Å; E399-L402 WeakPolarHBondContact O-CB 3.46Å; E399-L402 PolarHBondContact O-N 3.38Å
400	D	91.9	Very high	93.2	Very high	111 Å²	111	88.1 Å²	88.1	59%	0.594	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-64.3	-19.6	-179.9	-71.6	-24.3	0	0	0	112.1	D398 L402 A403	D398-D400 VanDerWaalsContact C-N 3.25Å; D398-D400 PolarHBondContact O-N 2.66Å; D398-D400 WeakPolarHBondContact OD1-CB 3.33Å; D398-D400 PolarHBondContact OD1-N 2.83Å; D400-L402 PolarHBondContact O-N 2.97Å; D400-A403 WeakPolarHBondContact O-CB 3.29Å; D400-A403 PolarHBondContact O-N 3.23Å
401	V	91.1	Very high	93.1	Very high	31 Å²	31	85.4 Å²	85.4	19%	0.188	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-60.1	-27.9	173.2	-179.6	0	0	0	0	111.7	L394 T395 D398 E399 A403 V404 V407	L394-V401 HydrophobicContact CB-CG1 4.28Å; L394-V401 HydrophobicContact CB-CG2 4.41Å; T395-V401 HydrophobicContact CG2-CB 4.2Å; T395-V401 HydrophobicContact CG2-CG1 4Å; D398-V401 HydrophobicContact CB-CG2 4.21Å; D398-V401 WeakPolarHBondContact O-CB 3.38Å; D398-V401 WeakPolarHBondContact O-CG2 3.14Å; D398-V401 PolarHBondContact O-N 3.01Å; E399-V401 PolarHBondContact O-N 2.9Å; E399-V401 VanDerWaalsContact O-N 3.11Å; V401-A403 VanDerWaalsContact C-N 3.29Å; V401-A403 PolarHBondContact O-N 3.2Å; V401-V404 WeakPolarHBondContact O-CB 3.11Å; V401-V404 PolarHBondContact O-N 2.85Å; V401-V407 HydrophobicContact CG1-CG1 4.23Å; V401-V407 WeakPolarHBondContact O-CB 3.39Å
402	L	90.4	Very high	93	Very high	85 Å²	85	87.4 Å²	87.4	45%	0.445	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-70.8	-24	176.3	-70.8	172.5	0	0	0	113.3	T395 E399 D400 V404 L408	T395-L402 HydrophobicContact CG2-CD2 3.62Å; T395-L402 HydrophobicContact CG2-CG 3.86Å; E399-L402 WeakPolarHBondContact O-CB 3.46Å; E399-L402 PolarHBondContact O-N 3.38Å; D400-L402 PolarHBondContact O-N 2.97Å; L402-V404 VanDerWaalsContact C-N 3.31Å; L402-L408 HydrophobicContact CD2-CD1 4.41Å
403	A	88.8	Confident	93	Very high	90 Å²	90	89.5 Å²	89.5	74%	0.744	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-80.6	-13.7	177.3	0	0	0	0	0	112.7	D400 V401	D400-A403 WeakPolarHBondContact O-CB 3.29Å; D400-A403 PolarHBondContact O-N 3.23Å; V401-A403 VanDerWaalsContact C-N 3.29Å; V401-A403 PolarHBondContact O-N 3.2Å
404	V	92.4	Very high	93	Very high	85 Å²	85	87.9 Å²	87.9	52%	0.515	47%	0.465	S	S	.	.	S	Bend	trans	-66.9	139.5	177.2	179.3	0	0	0	0	110.4	V401 L402 H406 V407	V401-V404 WeakPolarHBondContact O-CB 3.11Å; V401-V404 PolarHBondContact O-N 2.85Å; L402-V404 VanDerWaalsContact C-N 3.31Å; V404-H406 PolarHBondContact O-N 3.43Å; V404-V407 HydrophobicContact CB-CG2 3.72Å; V404-V407 HydrophobicContact CG1-CG2 3.9Å; V404-V407 PolarHBondContact O-N 2.87Å
405	E	87.1	Confident	92.9	Very high	155 Å²	155	85 Å²	85	72%	0.724	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	133.5	-178.4	-161.3	178.9	179.6	0	0	111.5	V407	E405-V407 PolarHBondContact O-N 3.3Å
406	H	92.6	Very high	92.9	Very high	122 Å²	122	85.9 Å²	85.9	57%	0.565	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	-1.2	-179.9	-52.6	-54.6	0	0	0	118.1	V404 L408 T409 T410	V404-H406 PolarHBondContact O-N 3.43Å; H406-L408 PolarHBondContact O-N 3.17Å; H406-T409 VanDerWaalsContact CA-OG1 3.28Å; H406-T409 WeakPolarHBondContact CA-OG1 3.47Å; H406-T409 PolarHBondContact O-N 3.45Å; H406-T409 PolarHBondContact O-OG1 3.44Å; H406-T410 WeakPolarHBondContact O-CB 3.4Å; H406-T410 PolarHBondContact O-N 2.96Å; H406-T410 PolarHBondContact O-OG1 2.9Å
407	V	93.1	Very high	92.8	Very high	17 Å²	17	82.4 Å²	82.4	10%	0.103	45%	0.446	C	S	.	.	H	α-helix	trans	-62.4	-47.5	-179.9	172.2	0	0	0	0	111	T395 V401 V404 E405 T409 T410 V411	T395-V407 HydrophobicContact CG2-CG1 4.48Å; V401-V407 HydrophobicContact CG1-CG1 4.23Å; V401-V407 WeakPolarHBondContact O-CB 3.39Å; V404-V407 HydrophobicContact CB-CG2 3.72Å; V404-V407 HydrophobicContact CG1-CG2 3.9Å; V404-V407 PolarHBondContact O-N 2.87Å; E405-V407 PolarHBondContact O-N 3.3Å; V407-T409 PolarHBondContact O-N 3.36Å; V407-T410 PolarHBondContact O-N 3.24Å; V407-V411 HydrophobicContact CG1-CG2 4.3Å; V407-V411 WeakPolarHBondContact O-CB 3.48Å; V407-V411 VanDerWaalsContact O-CG2 3.32Å; V407-V411 WeakPolarHBondContact O-CG2 3.46Å; V407-V411 PolarHBondContact O-N 2.88Å
408	L	91.7	Very high	92.8	Very high	105 Å²	105	74 Å²	74	55%	0.55	42%	0.415	S	S	.	.	H	α-helix	trans	-64.1	-41.1	179.9	-172.2	64.9	0	0	0	112.7	L402 H406 T410 T412	L402-L408 HydrophobicContact CD2-CD1 4.41Å; H406-L408 PolarHBondContact O-N 3.17Å; L408-T410 VanDerWaalsContact C-N 3.33Å; L408-T412 WeakPolarHBondContact O-CG2 3.48Å; L408-T412 PolarHBondContact O-N 3.25Å; L408-T412 PolarHBondContact O-OG1 3.03Å
409	T	93.5	Very high	92.8	Very high	72 Å²	72	74 Å²	74	44%	0.442	42%	0.418	S	S	.	.	H	α-helix	trans	-67.3	-36.3	175.8	52	0	0	0	0	111.4	H406 V407 T412 L413	H406-T409 VanDerWaalsContact CA-OG1 3.28Å; H406-T409 WeakPolarHBondContact CA-OG1 3.47Å; H406-T409 PolarHBondContact O-N 3.45Å; H406-T409 PolarHBondContact O-OG1 3.44Å; V407-T409 PolarHBondContact O-N 3.36Å; T409-T412 WeakPolarHBondContact CA-OG1 3.3Å; T409-T412 PolarHBondContact O-OG1 3.43Å; T409-L413 WeakPolarHBondContact O-CB 3.32Å; T409-L413 VanDerWaalsContact O-CG 3.25Å; T409-L413 WeakPolarHBondContact O-CG 2.89Å; T409-L413 PolarHBondContact O-N 2.78Å
410	T	95.6	Very high	92.8	Very high	54 Å²	54	68.7 Å²	68.7	33%	0.331	40%	0.396	S	S	.	.	H	α-helix	trans	-68.8	-45.9	177.4	-57.9	0	0	0	0	111.1	L391 H406 V407 L408 T412 L413 L414	L391-T410 HydrophobicContact CD1-CG2 3.89Å; H406-T410 WeakPolarHBondContact O-CB 3.4Å; H406-T410 PolarHBondContact O-N 2.96Å; H406-T410 PolarHBondContact O-OG1 2.9Å; V407-T410 PolarHBondContact O-N 3.24Å; L408-T410 VanDerWaalsContact C-N 3.33Å; T410-T412 VanDerWaalsContact C-N 3.32Å; T410-T412 PolarHBondContact O-N 3.18Å; T410-L413 PolarHBondContact O-N 3.46Å; T410-L414 HydrophobicContact CG2-CD1 3.71Å; T410-L414 HydrophobicContact CG2-CG 4.15Å; T410-L414 VanDerWaalsContact O-CB 3.26Å; T410-L414 WeakPolarHBondContact O-CB 3.37Å; T410-L414 WeakPolarHBondContact O-CG 3.45Å; T410-L414 PolarHBondContact O-N 3.22Å
411	V	94.9	Very high	92.9	Very high	32 Å²	32	64.3 Å²	64.3	19%	0.194	37%	0.374	C	S	.	.	H	α-helix	trans	-58	-44.9	175.3	167.9	0	0	0	0	110.9	L388 L391 V407 G415	L388-V411 HydrophobicContact CD1-CB 4.29Å; L388-V411 HydrophobicContact CD1-CG1 3.9Å; L388-V411 HydrophobicContact CD1-CG2 4.4Å; L391-V411 HydrophobicContact CB-CG2 4.04Å; L391-V411 HydrophobicContact CD1-CG2 4.11Å; V407-V411 HydrophobicContact CG1-CG2 4.3Å; V407-V411 WeakPolarHBondContact O-CB 3.48Å; V407-V411 VanDerWaalsContact O-CG2 3.32Å; V407-V411 WeakPolarHBondContact O-CG2 3.46Å; V407-V411 PolarHBondContact O-N 2.88Å; V411-G415 PolarHBondContact O-N 3.28Å
412	T	93.1	Very high	92.9	Very high	71 Å²	71	71 Å²	71	44%	0.436	40%	0.396	S	S	.	.	H	α-helix	trans	-67.3	-45.2	179.4	48.8	0	0	0	0	112.6	L408 T409 T410 G415 V416	L408-T412 WeakPolarHBondContact O-CG2 3.48Å; L408-T412 PolarHBondContact O-N 3.25Å; L408-T412 PolarHBondContact O-OG1 3.03Å; T409-T412 WeakPolarHBondContact CA-OG1 3.3Å; T409-T412 PolarHBondContact O-OG1 3.43Å; T410-T412 VanDerWaalsContact C-N 3.32Å; T410-T412 PolarHBondContact O-N 3.18Å; T412-G415 PolarHBondContact O-N 3.43Å; T412-V416 WeakPolarHBondContact O-CG2 3.44Å; T412-V416 PolarHBondContact O-N 3.35Å
413	L	94.6	Very high	92.9	Very high	117 Å²	117	69.5 Å²	69.5	61%	0.613	39%	0.393	S	S	*	.	H	α-helix	trans	-66.1	-41.6	177.3	-71.2	174.9	0	0	0	112.7	T409 T410 G415 V416 T417	T409-L413 WeakPolarHBondContact O-CB 3.32Å; T409-L413 VanDerWaalsContact O-CG 3.25Å; T409-L413 WeakPolarHBondContact O-CG 2.89Å; T409-L413 PolarHBondContact O-N 2.78Å; T410-L413 PolarHBondContact O-N 3.46Å; L413-G415 VanDerWaalsContact C-N 3.34Å; L413-V416 PolarHBondContact O-N 2.65Å; L413-T417 WeakPolarHBondContact O-CB 3.39Å; L413-T417 PolarHBondContact O-N 2.93Å; L413-T417 PolarHBondContact O-OG1 3.39Å
414	L	95.8	Very high	93	Very high	26 Å²	26	69.6 Å²	69.6	14%	0.136	38%	0.377	C	S	.	.	H	α-helix	trans	-64.3	-40.4	174.3	-71.6	174.7	0	0	0	111	A384 I387 L388 L391 T410 T417 V418	A384-L414 HydrophobicContact CB-CD2 3.97Å; I387-L414 HydrophobicContact CB-CD1 4.01Å; I387-L414 HydrophobicContact CG2-CD1 3.58Å; L388-L414 HydrophobicContact CB-CB 4.18Å; L388-L414 HydrophobicContact CB-CD1 4.35Å; L388-L414 HydrophobicContact CD1-CB 4.19Å; L391-L414 HydrophobicContact CD1-CD1 4Å; T410-L414 HydrophobicContact CG2-CD1 3.71Å; T410-L414 HydrophobicContact CG2-CG 4.15Å; T410-L414 VanDerWaalsContact O-CB 3.26Å; T410-L414 WeakPolarHBondContact O-CB 3.37Å; T410-L414 WeakPolarHBondContact O-CG 3.45Å; T410-L414 PolarHBondContact O-N 3.22Å; L414-T417 PolarHBondContact O-N 2.92Å; L414-V418 VanDerWaalsContact O-CG2 3.32Å; L414-V418 WeakPolarHBondContact O-CG2 3.44Å; L414-V418 PolarHBondContact O-N 2.86Å
415	G	93.9	Very high	93	Very high	23 Å²	23	67.7 Å²	67.7	24%	0.237	36%	0.363	C	S	.	.	H	α-helix	trans	-57.8	-49.1	174	0	0	0	0	0	112.4	V411 T412 L413 T417 V418 T419	V411-G415 PolarHBondContact O-N 3.28Å; T412-G415 PolarHBondContact O-N 3.43Å; L413-G415 VanDerWaalsContact C-N 3.34Å; G415-T417 VanDerWaalsContact C-N 3.35Å; G415-T417 PolarHBondContact O-N 3.48Å; G415-V418 PolarHBondContact O-N 3.12Å; G415-T419 WeakPolarHBondContact O-CG2 3.37Å; G415-T419 PolarHBondContact O-N 3.27Å; G415-T419 PolarHBondContact O-OG1 3.39Å
416	V	92.9	Very high	93	Very high	46 Å²	46	61.7 Å²	61.7	28%	0.279	34%	0.338	S	S	.	.	H	α-helix	trans	-61.9	-41.9	174.5	174	0	0	0	0	111.3	T412 L413 V418 T419 V420	T412-V416 WeakPolarHBondContact O-CG2 3.44Å; T412-V416 PolarHBondContact O-N 3.35Å; L413-V416 PolarHBondContact O-N 2.65Å; V416-V418 PolarHBondContact O-N 3.01Å; V416-T419 WeakPolarHBondContact CA-OG1 3.43Å; V416-T419 PolarHBondContact O-N 2.96Å; V416-T419 PolarHBondContact O-OG1 3.34Å; V416-V420 HydrophobicContact CG1-CG2 4.18Å; V416-V420 WeakPolarHBondContact O-CB 3.25Å; V416-V420 WeakPolarHBondContact O-CG2 3.39Å; V416-V420 PolarHBondContact O-N 3.36Å
417	T	94.5	Very high	92.8	Very high	64 Å²	64	60.8 Å²	60.8	39%	0.393	34%	0.337	S	S	.	.	H	α-helix	trans	-62.2	-43.8	178.9	-58.4	0	0	0	0	111.5	A384 L413 L414 G415 C421	A384-T417 HydrophobicContact CB-CG2 4.02Å; L413-T417 WeakPolarHBondContact O-CB 3.39Å; L413-T417 PolarHBondContact O-N 2.93Å; L413-T417 PolarHBondContact O-OG1 3.39Å; L414-T417 PolarHBondContact O-N 2.92Å; G415-T417 VanDerWaalsContact C-N 3.35Å; G415-T417 PolarHBondContact O-N 3.48Å; T417-C421 WeakPolarHBondContact O-CB 3.39Å; T417-C421 PolarHBondContact O-N 2.98Å; T417-C421 PolarHBondContact O-SG 2.79Å
418	V	95.4	Very high	92.3	Very high	26 Å²	26	67.9 Å²	67.9	16%	0.158	37%	0.369	C	S	.	.	H	α-helix	trans	-64.4	-45.5	177.4	171.8	0	0	0	0	111	A384 L388 L414 G415 V416 C421 R422	A384-V418 HydrophobicContact CB-CG2 3.67Å; L388-V418 HydrophobicContact CD2-CG2 4.38Å; L414-V418 VanDerWaalsContact O-CG2 3.32Å; L414-V418 WeakPolarHBondContact O-CG2 3.44Å; L414-V418 PolarHBondContact O-N 2.86Å; G415-V418 PolarHBondContact O-N 3.12Å; V416-V418 PolarHBondContact O-N 3.01Å; V418-C421 PolarHBondContact O-N 3.33Å; V418-R422 HydrophobicContact CG1-CG 4.23Å; V418-R422 WeakPolarHBondContact O-CB 3.15Å; V418-R422 WeakPolarHBondContact O-CG 3.38Å; V418-R422 PolarHBondContact O-N 3.46Å
419	T	92.8	Very high	92.1	Very high	67 Å²	67	70.4 Å²	70.4	41%	0.411	38%	0.378	S	S	.	.	H	α-helix	trans	-65.9	-40.1	179.8	54.3	0	0	0	0	112	P324 G415 V416 R422 S423	P324-T419 WeakPolarHBondContact CG-OG1 3.35Å; G415-T419 WeakPolarHBondContact O-CG2 3.37Å; G415-T419 PolarHBondContact O-N 3.27Å; G415-T419 PolarHBondContact O-OG1 3.39Å; V416-T419 WeakPolarHBondContact CA-OG1 3.43Å; V416-T419 PolarHBondContact O-N 2.96Å; V416-T419 PolarHBondContact O-OG1 3.34Å; T419-R422 PolarHBondContact O-N 2.97Å; T419-S423 PolarHBondContact O-N 2.87Å
420	V	92.4	Very high	91.7	Very high	44 Å²	44	70.8 Å²	70.8	27%	0.267	38%	0.375	S	S	.	.	H	α-helix	trans	-61	-50.9	172.8	170.7	0	0	0	0	110.7	P324 V416 R422 S423 F424	P324-V420 HydrophobicContact CB-CG2 3.57Å; P324-V420 HydrophobicContact CG-CG2 3.88Å; V416-V420 HydrophobicContact CG1-CG2 4.18Å; V416-V420 WeakPolarHBondContact O-CB 3.25Å; V416-V420 WeakPolarHBondContact O-CG2 3.39Å; V416-V420 PolarHBondContact O-N 3.36Å; V420-R422 VanDerWaalsContact C-N 3.31Å; V420-R422 PolarHBondContact O-N 3.43Å; V420-S423 WeakPolarHBondContact O-CB 3.18Å; V420-S423 PolarHBondContact O-N 3.36Å; V420-S423 PolarHBondContact O-OG 3.45Å; V420-F424 HydrophobicContact CG1-CD2 4.31Å; V420-F424 HydrophobicContact CG1-CE2 3.69Å; V420-F424 HydrophobicContact CG1-CZ 4.5Å; V420-F424 WeakPolarHBondContact O-CD2 3.39Å
421	C	94.1	Very high	91.3	Very high	19 Å²	19	73.8 Å²	73.8	13%	0.128	39%	0.393	C	S	.	.	H	α-helix	trans	-60.5	-41.2	179.6	-69.9	0	0	0	0	111.7	A377 A381 T417 V418 S423 F424	A377-C421 WeakPolarHBondContact CB-O 3.47Å; A377-C421 WeakPolarHBondContact O-CB 3.19Å; A381-C421 HydrophobicContact CB-CB 3.74Å; T417-C421 WeakPolarHBondContact O-CB 3.39Å; T417-C421 PolarHBondContact O-N 2.98Å; T417-C421 PolarHBondContact O-SG 2.79Å; V418-C421 PolarHBondContact O-N 3.33Å; C421-S423 VanDerWaalsContact C-N 3.26Å; C421-S423 PolarHBondContact O-N 3.12Å; C421-F424 PolarHBondContact O-N 3.5Å
422	R	91.4	Very high	90.9	Very high	170 Å²	170	78.4 Å²	78.4	64%	0.642	41%	0.411	S	S	*	.	H	α-helix	trans	-63.2	-30.9	176.2	-72.7	-78.3	-179.7	157.1	2.6	112.5	V418 T419 V420 F424 I425	V418-R422 HydrophobicContact CG1-CG 4.23Å; V418-R422 WeakPolarHBondContact O-CB 3.15Å; V418-R422 WeakPolarHBondContact O-CG 3.38Å; V418-R422 PolarHBondContact O-N 3.46Å; T419-R422 PolarHBondContact O-N 2.97Å; V420-R422 VanDerWaalsContact C-N 3.31Å; V420-R422 PolarHBondContact O-N 3.43Å; R422-F424 VanDerWaalsContact C-N 3.26Å; R422-F424 PolarHBondContact O-N 3.44Å; R422-I425 PolarHBondContact O-N 3.02Å
423	S	90.9	Very high	90.8	Very high	55 Å²	55	76.7 Å²	76.7	39%	0.385	40%	0.402	S	S	.	.	H	α-helix	trans	-68.3	-24.4	177.5	80.2	0	0	0	0	113.6	T419 V420 C421	T419-S423 PolarHBondContact O-N 2.87Å; V420-S423 WeakPolarHBondContact O-CB 3.18Å; V420-S423 PolarHBondContact O-N 3.36Å; V420-S423 PolarHBondContact O-OG 3.45Å; C421-S423 VanDerWaalsContact C-N 3.26Å; C421-S423 PolarHBondContact O-N 3.12Å
424	F	90.6	Very high	90.6	Very high	92 Å²	92	71.6 Å²	71.6	40%	0.404	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-6.8	175.2	-63.4	-52.6	0	0	0	114.3	L373 A377 V420 C421 R422 P426	L373-F424 HydrophobicContact CD2-CD1 4.04Å; L373-F424 HydrophobicContact CD2-CE1 4.5Å; L373-F424 HydrophobicContact CD2-CG 4.35Å; L373-F424 HydrophobicContact CG-CB 4.43Å; L373-F424 HydrophobicContact CG-CG 4.44Å; A377-F424 HydrophobicContact CB-CB 3.76Å; V420-F424 HydrophobicContact CG1-CD2 4.31Å; V420-F424 HydrophobicContact CG1-CE2 3.69Å; V420-F424 HydrophobicContact CG1-CZ 4.5Å; V420-F424 WeakPolarHBondContact O-CD2 3.39Å; C421-F424 PolarHBondContact O-N 3.5Å; R422-F424 VanDerWaalsContact C-N 3.26Å; R422-F424 PolarHBondContact O-N 3.44Å; F424-P426 WeakPolarHBondContact O-CD 3.06Å
425	I	91.8	Very high	90.2	Very high	44 Å²	44	72.6 Å²	72.6	23%	0.226	38%	0.379	C	S	.	.	S	Bend	trans	-87.6	114	177.3	-61.8	170.8	0	0	0	108.1	A377 K378 A381 R422	A377-I425 HydrophobicContact CB-CG1 3.99Å; K378-I425 HydrophobicContact CB-CD1 4.5Å; K378-I425 HydrophobicContact CG-CD1 3.83Å; K378-I425 HydrophobicContact CG-CG1 3.99Å; A381-I425 HydrophobicContact CB-CD1 4.45Å; R422-I425 PolarHBondContact O-N 3.02Å
426	P	88.4	Confident	89.9	Confident	30 Å²	30	74.8 Å²	74.8	20%	0.195	38%	0.384	C	S	.	.			trans	-71.1	158.6	178.4	30.1	-34.7	0	0	0	111.9	L369 T374 F424 M430	L369-P426 HydrophobicContact CD1-CB 3.65Å; L369-P426 HydrophobicContact CD1-CG 3.5Å; L369-P426 VanDerWaalsContact CD1-CG 3.5Å; L369-P426 HydrophobicContact CD2-CB 3.48Å; L369-P426 VanDerWaalsContact CD2-CB 3.48Å; L369-P426 HydrophobicContact CD2-CG 3.72Å; L369-P426 HydrophobicContact CG-CB 4.18Å; L369-P426 HydrophobicContact CG-CG 4.14Å; T374-P426 HydrophobicContact CG2-CG 4.35Å; F424-P426 WeakPolarHBondContact O-CD 3.06Å; P426-M430 HydrophobicContact CB-CE 3.68Å
427	D	87.4	Confident	89.7	Confident	103 Å²	103	73.7 Å²	73.7	55%	0.551	38%	0.376	S	S	*	.			trans	-64	137.9	172.5	177.6	20	0	0	0	110.9	H429 M430	D427-H429 VanDerWaalsContact C-N 3.27Å; D427-H429 PolarHBondContact O-N 3.33Å; D427-H429 PolarHBondContact OD1-N 3.44Å; D427-M430 HydrophobicContact CB-CG 3.71Å; D427-M430 HydrophobicContact CB-SD 4.24Å; D427-M430 WeakPolarHBondContact O-CG 3.24Å
428	Q	83.6	Confident	89.5	Confident	166 Å²	166	70.9 Å²	70.9	78%	0.776	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-24	-176.1	-62.5	-175.4	7.9	0	0	112.3
429	H	87.1	Confident	89.2	Confident	158 Å²	158	73.2 Å²	73.2	73%	0.731	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	24.8	-174.3	-60.3	-61.3	0	0	0	113.7	D427	D427-H429 VanDerWaalsContact C-N 3.27Å; D427-H429 PolarHBondContact O-N 3.33Å; D427-H429 PolarHBondContact OD1-N 3.44Å
430	M	84.1	Confident	88.9	Confident	79 Å²	79	71.2 Å²	71.2	39%	0.389	35%	0.352	S	S	.	.			trans	-73.8	132	177.6	-63.3	-159.6	-56.9	0	0	112.6	N366 L369 P426 D427	N366-M430 WeakPolarHBondContact O-CE 3.25Å; L369-M430 HydrophobicContact CD1-CE 4.12Å; L369-M430 HydrophobicContact CD2-CE 4.43Å; P426-M430 HydrophobicContact CB-CE 3.68Å; D427-M430 HydrophobicContact CB-CG 3.71Å; D427-M430 HydrophobicContact CB-SD 4.24Å; D427-M430 WeakPolarHBondContact O-CG 3.24Å
431	V	87.1	Confident	88.9	Confident	117 Å²	117	69.1 Å²	69.1	71%	0.709	34%	0.339	S	S	*	.			trans	-80.8	129.8	175.4	-178.7	0	0	0	0	110.2
432	F	87.5	Confident	88.8	Confident	129 Å²	129	68.5 Å²	68.5	57%	0.566	34%	0.335	S	S	*	.			trans	-93.2	97.5	178.5	-173.2	-98.5	0	0	0	111.5	C367 P434	C367-F432 HydrophobicContact CB-CD2 3.84Å; C367-F432 HydrophobicContact CB-CE2 3.93Å; F432-P434 HydrophobicContact CD1-CG 4.31Å; F432-P434 HydrophobicContact CE1-CG 3.7Å; F432-P434 HydrophobicContact CE2-CG 4.36Å; F432-P434 HydrophobicContact CZ-CG 3.73Å
433	C	89.7	Confident	88.6	Confident	36 Å²	36	60.4 Å²	60.4	24%	0.243	31%	0.305	C	S	.	.			trans	-136	59.3	-179.9	55.7	0	0	0	0	113.6	E435 Q436 L437	C433-E435 PolarHBondContact O-N 3.12Å; C433-Q436 PolarHBondContact O-N 3.32Å; C433-L437 WeakPolarHBondContact O-CG 3.32Å; C433-L437 PolarHBondContact O-N 2.76Å
434	P	91.3	Very high	88.6	Confident	10 Å²	10	58.3 Å²	58.3	7%	0.065	29%	0.289	C	S	.	.	H	α-helix	trans	-61.8	-37	-172.4	25.1	-35.4	0	0	0	114.1	Y364 F368 F432 L438 A456 H457	Y364-P434 HydrophobicContact CD2-CB 4.14Å; Y364-P434 HydrophobicContact CE2-CB 3.9Å; F368-P434 HydrophobicContact CZ-CB 4.3Å; F432-P434 HydrophobicContact CD1-CG 4.31Å; F432-P434 HydrophobicContact CE1-CG 3.7Å; F432-P434 HydrophobicContact CE2-CG 4.36Å; F432-P434 HydrophobicContact CZ-CG 3.73Å; P434-L438 VanDerWaalsContact O-CB 3.23Å; P434-L438 WeakPolarHBondContact O-CB 3.46Å; P434-L438 PolarHBondContact O-N 2.8Å; P434-A456 HydrophobicContact CB-CB 4.41Å; P434-H457 HydrophobicContact CG-CB 4.13Å
435	E	87.7	Confident	88.7	Confident	46 Å²	46	54 Å²	54	22%	0.215	27%	0.27	C	S	.	.	H	α-helix	trans	-65.7	-40.8	-179.6	-82.7	-71.6	155.2	0	0	113.2	C433 R439 G454 N455 A456	C433-E435 PolarHBondContact O-N 3.12Å; E435-R439 WeakPolarHBondContact O-CG 3.34Å; E435-R439 PolarHBondContact O-N 3.32Å; E435-R439 IonicContact OE2-CZ 3.66Å; E435-R439 IonicContact OE2-NH2 3.53Å; E435-R439 PolarHBondContact OE2-NH2 3.23Å; E435-G454 VanDerWaalsContact OE1-C 3.23Å; E435-G454 VanDerWaalsContact OE1-CA 3.27Å; E435-G454 WeakPolarHBondContact OE1-CA 3.42Å; E435-G454 PolarHBondContact OE1-N 2.88Å; E435-N455 PolarHBondContact OE1-N 2.8Å; E435-A456 HydrophobicContact CG-CB 3.9Å; E435-A456 WeakPolarHBondContact OE1-CB 3.5Å; E435-A456 PolarHBondContact OE1-N 3.15Å
436	Q	86.6	Confident	88.8	Confident	70 Å²	70	52 Å²	52	33%	0.327	26%	0.259	S	S	.	.	H	α-helix	trans	-71	-44.2	178.1	-70.6	172.5	-7.6	0	0	110.6	C433 L438 R439 V440 V625 S629	C433-Q436 PolarHBondContact O-N 3.32Å; Q436-L438 VanDerWaalsContact C-N 3.29Å; Q436-L438 PolarHBondContact O-N 3.36Å; Q436-R439 PolarHBondContact O-N 3.09Å; Q436-V440 WeakPolarHBondContact O-CG2 3.41Å; Q436-V440 PolarHBondContact O-N 3.14Å; Q436-V440 VanDerWaalsContact O-N 3.09Å; Q436-V625 HydrophobicContact CB-CG1 4.34Å; Q436-S629 PolarHBondContact NE2-OG 2.86Å; Q436-S629 VanDerWaalsContact NE2-OG 3.08Å
437	L	89.8	Confident	89.1	Confident	23 Å²	23	50.6 Å²	50.6	12%	0.12	25%	0.25	C	S	.	.	H	α-helix	trans	-58.6	-43.3	177	-69.4	170.6	0	0	0	111.2	K363 Y364 C433 R439 V440 I441	K363-L437 HydrophobicContact CB-CD1 4.11Å; K363-L437 HydrophobicContact CB-CD2 4.02Å; K363-L437 HydrophobicContact CD-CD2 4.43Å; Y364-L437 HydrophobicContact CD2-CB 4.31Å; C433-L437 WeakPolarHBondContact O-CG 3.32Å; C433-L437 PolarHBondContact O-N 2.76Å; L437-R439 VanDerWaalsContact C-N 3.32Å; L437-R439 PolarHBondContact O-N 3.47Å; L437-V440 PolarHBondContact O-N 3.14Å; L437-I441 WeakPolarHBondContact O-CD1 3.47Å; L437-I441 WeakPolarHBondContact O-CG1 3.31Å; L437-I441 PolarHBondContact O-N 2.82Å
438	L	90.6	Very high	89.3	Confident	5 Å²	5	46 Å²	46	3%	0.026	23%	0.226	C	C	.	.	H	α-helix	trans	-65.5	-33.2	-179.3	-165.2	60.4	0	0	0	113	Y364 P434 Q436 I441 L442 M448 W452 A456 T461	Y364-L438 HydrophobicContact CD2-CB 4.41Å; Y364-L438 HydrophobicContact CE2-CB 4.23Å; Y364-L438 HydrophobicContact CE2-CD1 4.25Å; Y364-L438 HydrophobicContact CE2-CD2 4.44Å; P434-L438 VanDerWaalsContact O-CB 3.23Å; P434-L438 WeakPolarHBondContact O-CB 3.46Å; P434-L438 PolarHBondContact O-N 2.8Å; Q436-L438 VanDerWaalsContact C-N 3.29Å; Q436-L438 PolarHBondContact O-N 3.36Å; L438-I441 HydrophobicContact CD1-CD1 4.4Å; L438-I441 PolarHBondContact O-N 2.81Å; L438-L442 WeakPolarHBondContact O-CB 3.44Å; L438-L442 PolarHBondContact O-N 3.38Å; L438-M448 HydrophobicContact CD1-CE 3.62Å; L438-M448 HydrophobicContact CD2-CE 3.16Å; L438-M448 HydrophobicContact CG-CE 3.19Å; L438-W452 HydrophobicContact CD1-CE3 4.49Å; L438-W452 HydrophobicContact CD2-CB 4.46Å; L438-A456 HydrophobicContact CB-CB 4.29Å; L438-A456 HydrophobicContact CD2-CB 3.44Å; L438-A456 VanDerWaalsContact CD2-CB 3.44Å; L438-T461 HydrophobicContact CD2-CG2 4.3Å
439	R	87.4	Confident	89.7	Confident	74 Å²	74	39.2 Å²	39.2	28%	0.279	20%	0.196	S	C	.	.	H	α-helix	trans	-68.5	-42	171.7	-69.3	175.9	-157.1	136	14.1	112.6	E435 Q436 L437 I441 L442 A443 V625	E435-R439 WeakPolarHBondContact O-CG 3.34Å; E435-R439 PolarHBondContact O-N 3.32Å; E435-R439 IonicContact OE2-CZ 3.66Å; E435-R439 IonicContact OE2-NH2 3.53Å; E435-R439 PolarHBondContact OE2-NH2 3.23Å; Q436-R439 PolarHBondContact O-N 3.09Å; L437-R439 VanDerWaalsContact C-N 3.32Å; L437-R439 PolarHBondContact O-N 3.47Å; R439-I441 VanDerWaalsContact C-N 3.31Å; R439-L442 PolarHBondContact O-N 3.01Å; R439-A443 PolarHBondContact O-N 2.9Å; R439-V625 HydrophobicContact CB-CG1 4.41Å; R439-V625 HydrophobicContact CB-CG2 4.5Å
440	V	88.4	Confident	89.6	Confident	25 Å²	25	35 Å²	35	15%	0.152	18%	0.179	C	C	.	.	H	α-helix	trans	-64.3	-39.4	175.2	177.7	0	0	0	0	110.7	P360 Q436 L437 A443 H444 V625	P360-V440 HydrophobicContact CB-CG1 4.03Å; P360-V440 HydrophobicContact CG-CG1 4.15Å; Q436-V440 WeakPolarHBondContact O-CG2 3.41Å; Q436-V440 PolarHBondContact O-N 3.14Å; Q436-V440 VanDerWaalsContact O-N 3.09Å; L437-V440 PolarHBondContact O-N 3.14Å; V440-A443 WeakPolarHBondContact O-CB 3.49Å; V440-A443 PolarHBondContact O-N 3.18Å; V440-H444 PolarHBondContact O-CD2 3.04Å; V440-H444 PolarHBondContact O-N 2.95Å; V440-V625 HydrophobicContact CG2-CB 4.46Å; V440-V625 HydrophobicContact CG2-CG1 4.1Å; V440-V625 HydrophobicContact CG2-CG2 4.25Å
441	I	92.2	Very high	89.9	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.8	-52.1	174	-67.5	162.1	0	0	0	109.8	P360 A361 Y364 L437 L438 R439 A443 H444 I445 F465	P360-I441 HydrophobicContact CB-CG1 3.93Å; P360-I441 HydrophobicContact CG-CG1 4.24Å; A361-I441 HydrophobicContact CB-CD1 4.23Å; A361-I441 HydrophobicContact CB-CG1 4.34Å; Y364-I441 HydrophobicContact CD1-CD1 4.46Å; Y364-I441 HydrophobicContact CG-CD1 4.02Å; L437-I441 WeakPolarHBondContact O-CD1 3.47Å; L437-I441 WeakPolarHBondContact O-CG1 3.31Å; L437-I441 PolarHBondContact O-N 2.82Å; L438-I441 HydrophobicContact CD1-CD1 4.4Å; L438-I441 PolarHBondContact O-N 2.81Å; R439-I441 VanDerWaalsContact C-N 3.31Å; I441-A443 PolarHBondContact O-N 3.12Å; I441-H444 PolarHBondContact O-N 2.93Å; I441-I445 HydrophobicContact CG2-CD1 3.62Å; I441-I445 HydrophobicContact CG2-CG1 4.02Å; I441-I445 HydrophobicContact CG2-CG2 4.18Å; I441-I445 WeakPolarHBondContact O-CG1 3.3Å; I441-I445 PolarHBondContact O-N 3.48Å; I441-F465 HydrophobicContact CD1-CZ 4.16Å; I441-F465 HydrophobicContact CG2-CE2 3.93Å; I441-F465 HydrophobicContact CG2-CZ 4.12Å
442	L	91.4	Very high	90	Very high	7 Å²	7	29.7 Å²	29.7	4%	0.037	15%	0.145	C	C	.	.	H	α-helix	trans	-54	-41.9	178.5	171.5	62	0	0	0	112	L438 R439 H444 I445 H446 M448 L711 H714	L438-L442 WeakPolarHBondContact O-CB 3.44Å; L438-L442 PolarHBondContact O-N 3.38Å; R439-L442 PolarHBondContact O-N 3.01Å; L442-H444 PolarHBondContact O-N 3.05Å; L442-I445 PolarHBondContact O-N 2.78Å; L442-H446 VanDerWaalsContact O-CA 3.32Å; L442-H446 WeakPolarHBondContact O-CA 3.4Å; L442-H446 PolarHBondContact O-N 3.12Å; L442-M448 HydrophobicContact CB-SD 4.27Å; L442-M448 HydrophobicContact CD1-CB 3.73Å; L442-M448 HydrophobicContact CD1-SD 4.21Å; L442-M448 HydrophobicContact CD2-SD 4.06Å; L442-M448 HydrophobicContact CG-SD 4.41Å; L442-L711 HydrophobicContact CD2-CD2 4.04Å; L442-L711 HydrophobicContact CG-CD2 4.16Å; L442-H714 WeakPolarHBondContact CD1-NE2 3.38Å; L442-H714 HydrophobicContact CD2-CB 4.1Å
443	A	87.9	Confident	89.8	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-57.1	-31.8	177.2	0	0	0	0	0	112.6	R439 V440 I441 H446 I621 S707 L711	R439-A443 PolarHBondContact O-N 2.9Å; V440-A443 WeakPolarHBondContact O-CB 3.49Å; V440-A443 PolarHBondContact O-N 3.18Å; I441-A443 PolarHBondContact O-N 3.12Å; A443-H446 PolarHBondContact O-CD2 3.16Å; A443-H446 VanDerWaalsContact O-CD2 3.22Å; A443-H446 PolarHBondContact O-NE2 3.44Å; A443-I621 HydrophobicContact CB-CG2 4.23Å; A443-S707 VanDerWaalsContact O-CA 3.24Å; A443-S707 WeakPolarHBondContact O-CA 3.34Å; A443-S707 WeakPolarHBondContact O-CB 3.25Å; A443-S707 PolarHBondContact O-OG 3.19Å; A443-S707 VanDerWaalsContact O-OG 3.09Å; A443-L711 HydrophobicContact CB-CD1 3.89Å; A443-L711 HydrophobicContact CB-CD2 4.17Å; A443-L711 HydrophobicContact CB-CG 3.97Å
444	H	90.7	Very high	89.5	Confident	11 Å²	11	24.6 Å²	24.6	5%	0.051	12%	0.122	C	C	.	.	H	α-helix	trans	-94	-38.1	179.6	-62.7	-46.3	0	0	0	113.8	R353 V440 I441 L442	R353-H444 PolarHBondContact NE-O 3.31Å; V440-H444 PolarHBondContact O-CD2 3.04Å; V440-H444 PolarHBondContact O-N 2.95Å; I441-H444 PolarHBondContact O-N 2.93Å; L442-H444 PolarHBondContact O-N 3.05Å
445	I	92.9	Very high	89.5	Confident	2 Å²	2	27.4 Å²	27.4	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-89.3	-14.9	-175.9	72	172.3	0	0	0	113.4	W332 L340 R353 I441 L442 Y447	W332-I445 HydrophobicContact CH2-CG2 3.72Å; W332-I445 HydrophobicContact CZ2-CG2 4.25Å; W332-I445 HydrophobicContact CZ3-CG2 4.38Å; L340-I445 HydrophobicContact CD1-CB 4.22Å; L340-I445 HydrophobicContact CD1-CG2 4.33Å; L340-I445 HydrophobicContact CD2-CB 4.18Å; L340-I445 HydrophobicContact CD2-CD1 4.02Å; L340-I445 HydrophobicContact CD2-CG1 4.35Å; R353-I445 PolarHBondContact NH2-O 3.42Å; I441-I445 HydrophobicContact CG2-CD1 3.62Å; I441-I445 HydrophobicContact CG2-CG1 4.02Å; I441-I445 HydrophobicContact CG2-CG2 4.18Å; I441-I445 WeakPolarHBondContact O-CG1 3.3Å; I441-I445 PolarHBondContact O-N 3.48Å; L442-I445 PolarHBondContact O-N 2.78Å; I445-Y447 VanDerWaalsContact CD1-O 3.32Å; I445-Y447 WeakPolarHBondContact CD1-O 3.41Å; I445-Y447 WeakPolarHBondContact CG1-O 3.38Å; I445-Y447 PolarHBondContact O-N 3.39Å
446	H	94	Very high	89.7	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.005	13%	0.126	C	C	.	.			trans	61.8	-25.8	177.7	-49	156.9	0	0	0	116.9	H342 R353 L442 A443 M706 A710 H714	H342-H446 AromaticContact CE1-ND1 3.63Å; H342-H446 AromaticContact NE2-CE1 3.86Å; H342-H446 AromaticContact NE2-CG 3.83Å; H342-H446 AromaticContact NE2-ND1 2.89Å; H342-H446 PolarHBondContact NE2-ND1 3.42Å; R353-H446 PolarHBondContact NE-CE1 3.1Å; R353-H446 PolarHBondContact NE-ND1 3.4Å; R353-H446 PolarHBondContact NH2-ND1 3.01Å; L442-H446 VanDerWaalsContact O-CA 3.32Å; L442-H446 WeakPolarHBondContact O-CA 3.4Å; L442-H446 PolarHBondContact O-N 3.12Å; A443-H446 PolarHBondContact O-CD2 3.16Å; A443-H446 VanDerWaalsContact O-CD2 3.22Å; A443-H446 PolarHBondContact O-NE2 3.44Å; H446-M706 WeakPolarHBondContact CE1-CG 3.28Å; H446-A710 HydrophobicContact CB-CB 4.14Å; H446-H714 PolarHBondContact O-NE2 2.97Å
447	Y	94.1	Very high	90	Very high	1 Å²	1	26.3 Å²	26.3	0%	0.004	13%	0.131	C	C	.	.			trans	-114.1	137.1	-177.4	-62.6	-70	0	0	0	111.8	L340 H342 I445 K552 L555 S556	L340-Y447 VanDerWaalsContact O-CD2 3.3Å; L340-Y447 WeakPolarHBondContact O-CD2 3.34Å; L340-Y447 WeakPolarHBondContact O-CE2 3.36Å; H342-Y447 AromaticContact CE1-CE2 3.36Å; H342-Y447 WeakPolarHBondContact CE1-CE2 3.43Å; H342-Y447 AromaticContact CE1-CZ 3.48Å; H342-Y447 VanDerWaalsContact CE1-CZ 3.48Å; H342-Y447 PolarHBondContact CE1-OH 3.48Å; H342-Y447 AromaticContact ND1-CE2 3.42Å; H342-Y447 WeakPolarHBondContact ND1-CE2 3.46Å; H342-Y447 AromaticContact ND1-CZ 3.32Å; H342-Y447 VanDerWaalsContact ND1-CZ 3.32Å; H342-Y447 PolarHBondContact ND1-OH 3.48Å; I445-Y447 VanDerWaalsContact CD1-O 3.32Å; I445-Y447 WeakPolarHBondContact CD1-O 3.41Å; I445-Y447 WeakPolarHBondContact CG1-O 3.38Å; I445-Y447 PolarHBondContact O-N 3.39Å; Y447-K552 HydrophobicContact CD1-CG 4.36Å; Y447-K552 HydrophobicContact CE1-CB 4.3Å; Y447-K552 HydrophobicContact CE1-CG 3.61Å; Y447-K552 WeakPolarHBondContact OH-CA 3.45Å; Y447-L555 HydrophobicContact CD1-CD1 3.87Å; Y447-L555 HydrophobicContact CE1-CB 4.08Å; Y447-L555 HydrophobicContact CE1-CD1 3.58Å; Y447-L555 HydrophobicContact CE1-CG 4.46Å; Y447-S556 PolarHBondContact OH-OG 3.35Å
448	M	91.3	Very high	90.2	Very high	7 Å²	7	32.2 Å²	32.2	3%	0.034	15%	0.152	C	C	.	.			trans	-163.9	134.4	-175.3	-173	-170	-164.1	0	0	109.3	L438 L442 W452 Q453	L438-M448 HydrophobicContact CD1-CE 3.62Å; L438-M448 HydrophobicContact CD2-CE 3.16Å; L438-M448 HydrophobicContact CG-CE 3.19Å; L442-M448 HydrophobicContact CB-SD 4.27Å; L442-M448 HydrophobicContact CD1-CB 3.73Å; L442-M448 HydrophobicContact CD1-SD 4.21Å; L442-M448 HydrophobicContact CD2-SD 4.06Å; L442-M448 HydrophobicContact CG-SD 4.41Å; M448-W452 HydrophobicContact CE-CB 3.39Å; M448-W452 HydrophobicContact CE-CD2 4.23Å; M448-W452 HydrophobicContact CE-CE3 3.64Å; M448-W452 HydrophobicContact CE-CG 4.21Å; M448-W452 HydrophobicContact CG-CB 4.25Å; M448-W452 HydrophobicContact CG-CD2 4.11Å; M448-W452 HydrophobicContact CG-CE3 3.43Å; M448-W452 VanDerWaalsContact CG-CE3 3.43Å; M448-W452 HydrophobicContact CG-CG 4.48Å; M448-W452 HydrophobicContact CG-CZ3 4.04Å; M448-W452 HydrophobicContact SD-CB 4.44Å; M448-W452 HydrophobicContact SD-CE3 4.46Å; M448-Q453 HydrophobicContact CE-CG 4.41Å; M448-Q453 HydrophobicContact SD-CG 3.97Å
449	P	91.5	Very high	90.2	Very high	22 Å²	22	35.5 Å²	35.5	14%	0.143	18%	0.175	C	C	.	.			trans	-60.5	140.8	171.4	-24.9	34.6	0	0	0	112.7	H451 W452	P449-H451 VanDerWaalsContact C-N 3.32Å; P449-H451 VanDerWaalsContact CB-CE1 3.44Å; P449-H451 WeakPolarHBondContact CB-CE1 3.41Å; P449-H451 PolarHBondContact O-N 3.39Å; P449-W452 HydrophobicContact CB-CD2 4.36Å; P449-W452 HydrophobicContact CB-CG 4.32Å; P449-W452 HydrophobicContact CG-CD2 4.17Å; P449-W452 HydrophobicContact CG-CH2 4.25Å; P449-W452 HydrophobicContact CG-CZ2 3.72Å; P449-W452 WeakPolarHBondContact O-CB 3.34Å; P449-W452 PolarHBondContact O-N 3.16Å
450	D	86.4	Confident	90.5	Very high	70 Å²	70	37.3 Å²	37.3	37%	0.374	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-62.3	-35.6	-171	-55.4	-41.3	0	0	0	113.5	W452 Q453 H717	D450-W452 PolarHBondContact O-N 3.27Å; D450-Q453 PolarHBondContact O-N 3Å; D450-H717 IonicContact OD1-CD2 2.8Å; D450-H717 IonicContact OD1-NE2 3.1Å; D450-H717 PolarHBondContact OD1-NE2 3.47Å; D450-H717 IonicContact OD2-NE2 3.68Å
451	H	88.8	Confident	90.9	Very high	81 Å²	81	36.2 Å²	36.2	38%	0.375	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-71.5	-11.3	-176.3	63.2	-76	0	0	0	114.2	P449 N455 E464	P449-H451 VanDerWaalsContact C-N 3.32Å; P449-H451 VanDerWaalsContact CB-CE1 3.44Å; P449-H451 WeakPolarHBondContact CB-CE1 3.41Å; P449-H451 PolarHBondContact O-N 3.39Å; H451-N455 PolarHBondContact O-ND2 3.37Å; H451-E464 IonicContact CD2-OE2 3.77Å; H451-E464 IonicContact CE1-OE2 3.78Å; H451-E464 PolarHBondContact CE1-OE2 2.73Å; H451-E464 VanDerWaalsContact NE2-CD 3.35Å; H451-E464 IonicContact NE2-OE1 3.86Å; H451-E464 PolarHBondContact NE2-OE1 3.25Å; H451-E464 IonicContact NE2-OE2 3.98Å; H451-E464 PolarHBondContact NE2-OE2 3.48Å
452	W	90.3	Very high	91	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.015	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-74.5	-30.9	176.8	-68.4	10.7	0	0	0	112.1	L438 M448 P449 D450 G454 N455 A456 T461 E464 F465 L468	L438-W452 HydrophobicContact CD1-CE3 4.49Å; L438-W452 HydrophobicContact CD2-CB 4.46Å; M448-W452 HydrophobicContact CE-CB 3.39Å; M448-W452 HydrophobicContact CE-CD2 4.23Å; M448-W452 HydrophobicContact CE-CE3 3.64Å; M448-W452 HydrophobicContact CE-CG 4.21Å; M448-W452 HydrophobicContact CG-CB 4.25Å; M448-W452 HydrophobicContact CG-CD2 4.11Å; M448-W452 HydrophobicContact CG-CE3 3.43Å; M448-W452 VanDerWaalsContact CG-CE3 3.43Å; M448-W452 HydrophobicContact CG-CG 4.48Å; M448-W452 HydrophobicContact CG-CZ3 4.04Å; M448-W452 HydrophobicContact SD-CB 4.44Å; M448-W452 HydrophobicContact SD-CE3 4.46Å; P449-W452 HydrophobicContact CB-CD2 4.36Å; P449-W452 HydrophobicContact CB-CG 4.32Å; P449-W452 HydrophobicContact CG-CD2 4.17Å; P449-W452 HydrophobicContact CG-CH2 4.25Å; P449-W452 HydrophobicContact CG-CZ2 3.72Å; P449-W452 WeakPolarHBondContact O-CB 3.34Å; P449-W452 PolarHBondContact O-N 3.16Å; D450-W452 PolarHBondContact O-N 3.27Å; W452-G454 PolarHBondContact O-N 3.36Å; W452-N455 CarbonylContact O-C 3.46Å; W452-N455 PolarHBondContact O-N 2.89Å; W452-A456 PolarHBondContact O-N 2.98Å; W452-T461 HydrophobicContact CB-CG2 3.81Å; W452-T461 HydrophobicContact CD2-CG2 3.81Å; W452-T461 HydrophobicContact CE3-CG2 4.35Å; W452-T461 HydrophobicContact CG-CG2 3.55Å; W452-E464 HydrophobicContact CZ2-CB 3.65Å; W452-E464 PolarHBondContact NE1-OE2 3.19Å; W452-F465 HydrophobicContact CE3-CD2 4.44Å; W452-F465 HydrophobicContact CH2-CB 4.05Å; W452-F465 AromaticContact CH2-CD2 3.88Å; W452-F465 HydrophobicContact CH2-CD2 3.88Å; W452-F465 HydrophobicContact CH2-CG 4.47Å; W452-F465 HydrophobicContact CZ2-CB 4.49Å; W452-F465 HydrophobicContact CZ3-CB 4.36Å; W452-F465 AromaticContact CZ3-CD2 3.57Å; W452-F465 HydrophobicContact CZ3-CD2 3.57Å; W452-F465 HydrophobicContact CZ3-CE2 4.41Å; W452-F465 HydrophobicContact CZ3-CG 4.46Å; W452-L468 HydrophobicContact CH2-CD1 3.72Å; W452-L468 HydrophobicContact CZ3-CD1 4.34Å
453	Q	84	Confident	91.1	Very high	47 Å²	47	43.3 Å²	43.3	22%	0.22	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	121.9	-179.1	-68.1	-160.7	24	0	0	111.4	M448 D450 N455 H714	M448-Q453 HydrophobicContact CE-CG 4.41Å; M448-Q453 HydrophobicContact SD-CG 3.97Å; D450-Q453 PolarHBondContact O-N 3Å; Q453-N455 VanDerWaalsContact C-N 3.29Å; Q453-H714 PolarHBondContact NE2-ND1 3.29Å
454	G	83.2	Confident	91.4	Very high	10 Å²	10	45.4 Å²	45.4	10%	0.103	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.6	-6.4	-178.4	0	0	0	0	0	114.7	E435 W452 R637	E435-G454 VanDerWaalsContact OE1-C 3.23Å; E435-G454 VanDerWaalsContact OE1-CA 3.27Å; E435-G454 WeakPolarHBondContact OE1-CA 3.42Å; E435-G454 PolarHBondContact OE1-N 2.88Å; W452-G454 PolarHBondContact O-N 3.36Å; G454-R637 PolarHBondContact O-NH2 3.41Å
455	N	90.6	Very high	91.7	Very high	70 Å²	70	44.9 Å²	44.9	37%	0.374	22%	0.219	S	C	.	.			trans	-121.2	24.7	175	-65.9	-36.6	0	0	0	111.9	E435 H451 W452 Q453 H457 R458 T461	E435-N455 PolarHBondContact OE1-N 2.8Å; H451-N455 PolarHBondContact O-ND2 3.37Å; W452-N455 CarbonylContact O-C 3.46Å; W452-N455 PolarHBondContact O-N 2.89Å; Q453-N455 VanDerWaalsContact C-N 3.29Å; N455-H457 PolarHBondContact O-N 3.03Å; N455-R458 HydrophobicContact CB-CG 4.06Å; N455-R458 WeakPolarHBondContact O-CB 3.27Å; N455-R458 WeakPolarHBondContact O-CG 3.32Å; N455-R458 PolarHBondContact O-N 3.46Å; N455-T461 PolarHBondContact O-OG1 3.47Å
456	A	91.4	Very high	91.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-20.2	-170.7	0	0	0	0	0	114.8	Y364 F368 P434 E435 L438 W452	Y364-A456 PolarHBondContact OH-O 3.49Å; F368-A456 VanDerWaalsContact CZ-O 3.31Å; F368-A456 WeakPolarHBondContact CZ-O 3.39Å; P434-A456 HydrophobicContact CB-CB 4.41Å; E435-A456 HydrophobicContact CG-CB 3.9Å; E435-A456 WeakPolarHBondContact OE1-CB 3.5Å; E435-A456 PolarHBondContact OE1-N 3.15Å; L438-A456 HydrophobicContact CB-CB 4.29Å; L438-A456 HydrophobicContact CD2-CB 3.44Å; L438-A456 VanDerWaalsContact CD2-CB 3.44Å; W452-A456 PolarHBondContact O-N 2.98Å
457	H	92.2	Very high	91.9	Very high	93 Å²	93	48 Å²	48	43%	0.431	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-0.3	-178.5	61.9	-85	0	0	0	113.6	P434 N455	P434-H457 HydrophobicContact CG-CB 4.13Å; N455-H457 PolarHBondContact O-N 3.03Å
458	R	94.1	Very high	92.1	Very high	147 Å²	147	48.2 Å²	48.2	56%	0.555	24%	0.24	S	C	*	.	S	Bend	trans	-81.3	147.8	-176.5	-66.2	-68.6	-175.3	143.8	2.6	111.4	N455 Q460 T461 R462	N455-R458 HydrophobicContact CB-CG 4.06Å; N455-R458 WeakPolarHBondContact O-CB 3.27Å; N455-R458 WeakPolarHBondContact O-CG 3.32Å; N455-R458 PolarHBondContact O-N 3.46Å; R458-Q460 VanDerWaalsContact C-N 3.26Å; R458-Q460 PolarHBondContact O-N 3.35Å; R458-T461 PolarHBondContact O-N 3.05Å; R458-R462 PolarHBondContact O-N 2.86Å
459	S	92.4	Very high	92.3	Very high	73 Å²	73	47.9 Å²	47.9	51%	0.51	24%	0.238	S	C	.	.	H	α-helix	trans	-60.2	-37.3	174.9	55.4	0	0	0	0	112.1	T461 R462 D463	S459-T461 PolarHBondContact O-N 3.01Å; S459-R462 WeakPolarHBondContact O-CB 3.31Å; S459-R462 PolarHBondContact O-N 2.99Å; S459-D463 VanDerWaalsContact O-CG 3.25Å; S459-D463 PolarHBondContact O-N 2.78Å
460	Q	93.6	Very high	92.6	Very high	112 Å²	112	47.7 Å²	47.7	52%	0.523	24%	0.235	S	C	.	.	H	α-helix	trans	-55.3	-50.9	176.3	-177.3	-178.8	4.5	0	0	111.8	R458 R462 D463 E464	R458-Q460 VanDerWaalsContact C-N 3.26Å; R458-Q460 PolarHBondContact O-N 3.35Å; Q460-R462 VanDerWaalsContact C-N 3.32Å; Q460-R462 PolarHBondContact O-N 3.32Å; Q460-D463 PolarHBondContact O-N 3.45Å; Q460-E464 VanDerWaalsContact CG-OE1 3.25Å; Q460-E464 WeakPolarHBondContact CG-OE1 3.33Å; Q460-E464 PolarHBondContact NE2-OE1 3.47Å; Q460-E464 WeakPolarHBondContact O-CG 3.37Å; Q460-E464 PolarHBondContact O-N 3.24Å
461	T	95.4	Very high	93	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.012	24%	0.237	C	C	.	.	H	α-helix	trans	-62.5	-39.5	178.4	-54.8	0	0	0	0	111.8	Y364 L438 W452 N455 R458 S459 F465	Y364-T461 WeakPolarHBondContact OH-CG2 3.26Å; L438-T461 HydrophobicContact CD2-CG2 4.3Å; W452-T461 HydrophobicContact CB-CG2 3.81Å; W452-T461 HydrophobicContact CD2-CG2 3.81Å; W452-T461 HydrophobicContact CE3-CG2 4.35Å; W452-T461 HydrophobicContact CG-CG2 3.55Å; N455-T461 PolarHBondContact O-OG1 3.47Å; R458-T461 PolarHBondContact O-N 3.05Å; S459-T461 PolarHBondContact O-N 3.01Å; T461-F465 WeakPolarHBondContact O-CB 3.46Å; T461-F465 PolarHBondContact O-N 3.15Å
462	R	94.8	Very high	93.3	Very high	83 Å²	83	48.8 Å²	48.8	31%	0.313	23%	0.233	S	C	.	.	H	α-helix	trans	-61.2	-45	173.8	176.2	-144.9	64.9	-169.4	-5	111.7	M365 F368 R458 S459 Q460 F465 A466	M365-R462 HydrophobicContact CE-CG 3.97Å; M365-R462 HydrophobicContact SD-CG 4.26Å; F368-R462 HydrophobicContact CB-CG 3.99Å; F368-R462 HydrophobicContact CD1-CB 4.19Å; F368-R462 HydrophobicContact CD1-CG 4.27Å; F368-R462 HydrophobicContact CD2-CB 4.32Å; F368-R462 HydrophobicContact CD2-CG 4.07Å; F368-R462 HydrophobicContact CE1-CB 4.36Å; F368-R462 HydrophobicContact CG-CB 4.17Å; F368-R462 HydrophobicContact CG-CG 3.83Å; R458-R462 PolarHBondContact O-N 2.86Å; S459-R462 WeakPolarHBondContact O-CB 3.31Å; S459-R462 PolarHBondContact O-N 2.99Å; Q460-R462 VanDerWaalsContact C-N 3.32Å; Q460-R462 PolarHBondContact O-N 3.32Å; R462-F465 PolarHBondContact O-N 3.44Å; R462-A466 WeakPolarHBondContact O-CB 3.46Å; R462-A466 PolarHBondContact O-N 3.01Å
463	D	93.9	Very high	93.5	Very high	74 Å²	74	50.9 Å²	50.9	40%	0.396	25%	0.252	S	S	.	.	H	α-helix	trans	-69.1	-42.3	-176.2	-68.9	-34.4	0	0	0	112.2	S459 Q460 A466 Q467	S459-D463 VanDerWaalsContact O-CG 3.25Å; S459-D463 PolarHBondContact O-N 2.78Å; Q460-D463 PolarHBondContact O-N 3.45Å; D463-A466 WeakPolarHBondContact O-CB 3.49Å; D463-A466 PolarHBondContact O-N 3.4Å; D463-Q467 PolarHBondContact O-N 3.11Å
464	E	94.6	Very high	94	Very high	44 Å²	44	51.3 Å²	51.3	21%	0.206	26%	0.257	C	S	.	.	H	α-helix	trans	-67.7	-39.5	174	-64.2	173.4	-160.8	0	0	111.5	H451 W452 Q460 A466 Q467	H451-E464 IonicContact CD2-OE2 3.77Å; H451-E464 IonicContact CE1-OE2 3.78Å; H451-E464 PolarHBondContact CE1-OE2 2.73Å; H451-E464 VanDerWaalsContact NE2-CD 3.35Å; H451-E464 IonicContact NE2-OE1 3.86Å; H451-E464 PolarHBondContact NE2-OE1 3.25Å; H451-E464 IonicContact NE2-OE2 3.98Å; H451-E464 PolarHBondContact NE2-OE2 3.48Å; W452-E464 HydrophobicContact CZ2-CB 3.65Å; W452-E464 PolarHBondContact NE1-OE2 3.19Å; Q460-E464 VanDerWaalsContact CG-OE1 3.25Å; Q460-E464 WeakPolarHBondContact CG-OE1 3.33Å; Q460-E464 PolarHBondContact NE2-OE1 3.47Å; Q460-E464 WeakPolarHBondContact O-CG 3.37Å; Q460-E464 PolarHBondContact O-N 3.24Å; E464-A466 VanDerWaalsContact C-N 3.28Å; E464-A466 PolarHBondContact O-N 2.94Å; E464-Q467 VanDerWaalsContact O-CB 3.31Å; E464-Q467 WeakPolarHBondContact O-CB 3.48Å; E464-Q467 PolarHBondContact O-N 2.97Å; E464-Q467 VanDerWaalsContact O-N 3.15Å
465	F	96.5	Very high	94.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.2	-33.6	173.5	-170.4	-92.9	0	0	0	112.2	W332 A361 Y364 M365 I441 W452 T461 R462 Q467 L468 F469	W332-F465 HydrophobicContact CH2-CZ 4.44Å; A361-F465 HydrophobicContact CB-CE1 4.09Å; A361-F465 HydrophobicContact CB-CZ 3.79Å; Y364-F465 HydrophobicContact CD1-CD1 4.06Å; Y364-F465 HydrophobicContact CD1-CE1 4.16Å; Y364-F465 HydrophobicContact CD1-CG 4.46Å; Y364-F465 HydrophobicContact CE1-CB 4.35Å; Y364-F465 HydrophobicContact CE1-CD1 4.1Å; Y364-F465 HydrophobicContact CE1-CG 4.13Å; M365-F465 HydrophobicContact CE-CD1 4.4Å; M365-F465 HydrophobicContact CG-CD1 3.93Å; M365-F465 HydrophobicContact CG-CE1 3.96Å; M365-F465 HydrophobicContact SD-CD1 3.48Å; M365-F465 WeakPolarHBondContact SD-CD1 3.47Å; M365-F465 HydrophobicContact SD-CE1 4.12Å; M365-F465 HydrophobicContact SD-CG 4.44Å; I441-F465 HydrophobicContact CD1-CZ 4.16Å; I441-F465 HydrophobicContact CG2-CE2 3.93Å; I441-F465 HydrophobicContact CG2-CZ 4.12Å; W452-F465 HydrophobicContact CE3-CD2 4.44Å; W452-F465 HydrophobicContact CH2-CB 4.05Å; W452-F465 AromaticContact CH2-CD2 3.88Å; W452-F465 HydrophobicContact CH2-CD2 3.88Å; W452-F465 HydrophobicContact CH2-CG 4.47Å; W452-F465 HydrophobicContact CZ2-CB 4.49Å; W452-F465 HydrophobicContact CZ3-CB 4.36Å; W452-F465 AromaticContact CZ3-CD2 3.57Å; W452-F465 HydrophobicContact CZ3-CD2 3.57Å; W452-F465 HydrophobicContact CZ3-CE2 4.41Å; W452-F465 HydrophobicContact CZ3-CG 4.46Å; T461-F465 WeakPolarHBondContact O-CB 3.46Å; T461-F465 PolarHBondContact O-N 3.15Å; R462-F465 PolarHBondContact O-N 3.44Å; F465-Q467 PolarHBondContact O-N 3.41Å; F465-L468 PolarHBondContact O-N 3.3Å; F465-F469 HydrophobicContact CD1-CB 4.05Å; F465-F469 HydrophobicContact CE1-CB 3.65Å; F465-F469 HydrophobicContact CE1-CD1 4.06Å; F465-F469 HydrophobicContact CE1-CG 4.13Å; F465-F469 HydrophobicContact CZ-CB 4.29Å; F465-F469 PolarHBondContact O-N 3.03Å
466	A	95.8	Very high	94.9	Very high	27 Å²	27	50.4 Å²	50.4	22%	0.223	25%	0.248	C	C	.	.	H	α-helix	trans	-63.1	-25.1	175.9	0	0	0	0	0	112.8	M365 R462 D463 E464 L468 F469 Q470	M365-A466 HydrophobicContact CE-CB 3.76Å; R462-A466 WeakPolarHBondContact O-CB 3.46Å; R462-A466 PolarHBondContact O-N 3.01Å; D463-A466 WeakPolarHBondContact O-CB 3.49Å; D463-A466 PolarHBondContact O-N 3.4Å; E464-A466 VanDerWaalsContact C-N 3.28Å; E464-A466 PolarHBondContact O-N 2.94Å; A466-L468 VanDerWaalsContact C-N 3.31Å; A466-F469 CarbonylContact O-C 3.6Å; A466-F469 VanDerWaalsContact O-C 3.31Å; A466-F469 PolarHBondContact O-N 2.97Å; A466-Q470 WeakPolarHBondContact O-CA 3.33Å; A466-Q470 PolarHBondContact O-N 3.25Å
467	Q	95.8	Very high	95.1	Very high	41 Å²	41	55 Å²	55	19%	0.192	27%	0.272	C	S	.	.	H	α-helix	trans	-68.5	-30.7	172.9	-59.1	173	-5.3	0	0	111.9	E239 V241 S333 D463 E464 F465	E239-Q467 PolarHBondContact O-NE2 3.26Å; V241-Q467 HydrophobicContact CG2-CB 4.1Å; V241-Q467 HydrophobicContact CG2-CG 3.96Å; S333-Q467 WeakPolarHBondContact CB-O 3.22Å; S333-Q467 PolarHBondContact OG-O 3.19Å; D463-Q467 PolarHBondContact O-N 3.11Å; E464-Q467 VanDerWaalsContact O-CB 3.31Å; E464-Q467 WeakPolarHBondContact O-CB 3.48Å; E464-Q467 PolarHBondContact O-N 2.97Å; E464-Q467 VanDerWaalsContact O-N 3.15Å; F465-Q467 PolarHBondContact O-N 3.41Å
468	L	96.6	Very high	95.3	Very high	6 Å²	6	52 Å²	52	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-84.2	-33.8	174.2	-56	178.8	0	0	0	111.9	S333 Y335 Y339 L340 W452 F465 A466	S333-L468 PolarHBondContact N-O 2.97Å; S333-L468 PolarHBondContact OG-O 2.95Å; Y335-L468 HydrophobicContact CD1-CD2 3.97Å; Y335-L468 HydrophobicContact CE1-CD2 3.9Å; Y339-L468 HydrophobicContact CD1-CD1 4.26Å; Y339-L468 HydrophobicContact CD1-CD2 3.62Å; Y339-L468 HydrophobicContact CE1-CD1 4.38Å; Y339-L468 HydrophobicContact CE1-CD2 4.36Å; Y339-L468 HydrophobicContact CG-CD2 4.12Å; L340-L468 HydrophobicContact CD2-CD1 4.36Å; W452-L468 HydrophobicContact CH2-CD1 3.72Å; W452-L468 HydrophobicContact CZ3-CD1 4.34Å; F465-L468 PolarHBondContact O-N 3.3Å; A466-L468 VanDerWaalsContact C-N 3.31Å
469	F	97.5	Very high	95.4	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	76	-173.4	-163.2	-119.6	0	0	0	111.5	R330 W332 Y358 A361 M365 F465 A466	R330-F469 HydrophobicContact CB-CD1 3.69Å; R330-F469 HydrophobicContact CB-CD2 4.5Å; R330-F469 HydrophobicContact CB-CE1 3.29Å; R330-F469 HydrophobicContact CB-CE2 4.17Å; R330-F469 HydrophobicContact CB-CG 4.28Å; R330-F469 HydrophobicContact CB-CZ 3.56Å; R330-F469 HydrophobicContact CG-CD1 4.26Å; R330-F469 HydrophobicContact CG-CE1 4.11Å; R330-F469 PolarHBondContact NH1-O 3.47Å; W332-F469 AromaticContact CD2-CD2 3.72Å; W332-F469 HydrophobicContact CD2-CD2 3.72Å; W332-F469 HydrophobicContact CD2-CE2 4.15Å; W332-F469 AromaticContact CE2-CD2 3.98Å; W332-F469 HydrophobicContact CE3-CB 4.4Å; W332-F469 AromaticContact CE3-CD2 3.82Å; W332-F469 HydrophobicContact CE3-CD2 3.82Å; W332-F469 HydrophobicContact CG-CD2 4.17Å; W332-F469 HydrophobicContact CG-CE2 4.39Å; W332-F469 HydrophobicContact CH2-CD2 4.43Å; W332-F469 HydrophobicContact CZ2-CD2 4.35Å; W332-F469 HydrophobicContact CZ2-CE2 4.49Å; W332-F469 HydrophobicContact CZ3-CB 4.38Å; W332-F469 HydrophobicContact CZ3-CD2 4.18Å; Y358-F469 AromaticContact CD2-CE2 3.64Å; Y358-F469 HydrophobicContact CD2-CE2 3.64Å; Y358-F469 AromaticContact CD2-CZ 3.76Å; Y358-F469 HydrophobicContact CD2-CZ 3.76Å; Y358-F469 AromaticContact CE2-CE2 3.7Å; Y358-F469 HydrophobicContact CE2-CE2 3.7Å; Y358-F469 AromaticContact CE2-CZ 3.61Å; Y358-F469 HydrophobicContact CE2-CZ 3.61Å; A361-F469 HydrophobicContact CB-CD1 4.17Å; A361-F469 HydrophobicContact CB-CE1 4.07Å; A361-F469 HydrophobicContact CB-CG 4.45Å; A361-F469 HydrophobicContact CB-CZ 4.26Å; M365-F469 HydrophobicContact CG-CD1 3.98Å; F465-F469 HydrophobicContact CD1-CB 4.05Å; F465-F469 HydrophobicContact CE1-CB 3.65Å; F465-F469 HydrophobicContact CE1-CD1 4.06Å; F465-F469 HydrophobicContact CE1-CG 4.13Å; F465-F469 HydrophobicContact CZ-CB 4.29Å; F465-F469 PolarHBondContact O-N 3.03Å; A466-F469 CarbonylContact O-C 3.6Å; A466-F469 VanDerWaalsContact O-C 3.31Å; A466-F469 PolarHBondContact O-N 2.97Å
470	Q	96.2	Very high	95.6	Very high	18 Å²	18	45 Å²	45	8%	0.084	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	162.6	-171.3	72.4	-170.1	33.9	0	0	113.5	R330 C331 S333 A466 F475 E478	R330-Q470 CarbonylContact C-O 3.57Å; R330-Q470 WeakPolarHBondContact CA-O 3.01Å; R330-Q470 WeakPolarHBondContact CB-O 3.28Å; C331-Q470 PolarHBondContact N-O 3.42Å; C331-Q470 PolarHBondContact O-N 3.43Å; S333-Q470 VanDerWaalsContact CB-CD 3.46Å; A466-Q470 WeakPolarHBondContact O-CA 3.33Å; A466-Q470 PolarHBondContact O-N 3.25Å; Q470-F475 HydrophobicContact CG-CB 4.49Å; Q470-E478 PolarHBondContact NE2-OE2 3.23Å; Q470-E478 PolarHBondContact OE1-OE2 2.92Å
471	Y	95.3	Very high	95.7	Very high	106 Å²	106	43.2 Å²	43.2	42%	0.416	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	145.9	172.3	-73.9	-69.9	0	0	0	111.6	G328 R330 A473 V474 F475	G328-Y471 VanDerWaalsContact O-CD1 3.28Å; G328-Y471 WeakPolarHBondContact O-CD1 3.29Å; G328-Y471 WeakPolarHBondContact O-CE1 3.42Å; R330-Y471 HydrophobicContact CG-CD1 3.8Å; R330-Y471 HydrophobicContact CG-CE1 4.05Å; R330-Y471 HydrophobicContact CG-CG 4.41Å; R330-Y471 VanDerWaalsContact CZ-CZ 3.48Å; R330-Y471 PolarHBondContact NH2-OH 2.88Å; Y471-A473 VanDerWaalsContact C-N 3.3Å; Y471-A473 PolarHBondContact O-N 3.47Å; Y471-V474 HydrophobicContact CD2-CG2 4.43Å; Y471-V474 PolarHBondContact O-N 3.48Å; Y471-F475 PolarHBondContact O-N 2.9Å
472	K	95.1	Very high	95.9	Very high	67 Å²	67	43.3 Å²	43.3	29%	0.291	22%	0.22	S	C	.	.	H	α-helix	trans	-60.8	-40.3	174.2	-171.6	80	177.8	-176.5	0	111.4	A329 V474 F475 I476	A329-K472 WeakPolarHBondContact O-CB 3.37Å; A329-K472 PolarHBondContact O-N 3.34Å; K472-V474 VanDerWaalsContact C-N 3.35Å; K472-V474 PolarHBondContact O-N 2.89Å; K472-F475 WeakPolarHBondContact O-CB 3.26Å; K472-F475 PolarHBondContact O-N 2.9Å; K472-I476 HydrophobicContact CG-CD1 4.32Å; K472-I476 WeakPolarHBondContact O-CG1 3.14Å; K472-I476 PolarHBondContact O-N 2.88Å
473	A	93.9	Very high	96	Very high	49 Å²	49	39.8 Å²	39.8	41%	0.405	21%	0.208	S	C	.	.	H	α-helix	trans	-60.5	-41.3	174.4	0	0	0	0	0	112.8	L327 Y471 I476 L477	L327-A473 HydrophobicContact CB-CB 4.49Å; L327-A473 PolarHBondContact O-N 3.27Å; L327-A473 VanDerWaalsContact O-N 3.15Å; Y471-A473 VanDerWaalsContact C-N 3.3Å; Y471-A473 PolarHBondContact O-N 3.47Å; A473-I476 PolarHBondContact O-N 2.92Å; A473-L477 PolarHBondContact O-N 3.35Å
474	V	95.3	Very high	96.1	Very high	56 Å²	56	40 Å²	40	34%	0.339	21%	0.208	S	C	.	.	H	α-helix	trans	-65.7	-42.7	176.3	174	0	0	0	0	110.6	Y471 K472 I476 L477 E478	Y471-V474 HydrophobicContact CD2-CG2 4.43Å; Y471-V474 PolarHBondContact O-N 3.48Å; K472-V474 VanDerWaalsContact C-N 3.35Å; K472-V474 PolarHBondContact O-N 2.89Å; V474-I476 VanDerWaalsContact C-N 3.33Å; V474-I476 PolarHBondContact O-N 3.45Å; V474-L477 PolarHBondContact O-N 3.33Å; V474-E478 HydrophobicContact CG1-CG 4.24Å; V474-E478 WeakPolarHBondContact CG1-OE1 3.33Å; V474-E478 WeakPolarHBondContact O-CB 3.35Å; V474-E478 WeakPolarHBondContact O-CG 3.26Å; V474-E478 PolarHBondContact O-N 3.22Å
475	F	96.2	Very high	96.3	Very high	29 Å²	29	40 Å²	40	13%	0.127	21%	0.211	C	C	.	.	H	α-helix	trans	-55.8	-45.1	172.9	172.2	-100.3	0	0	0	112.6	Q470 Y471 K472 E478 E479	Q470-F475 HydrophobicContact CG-CB 4.49Å; Y471-F475 PolarHBondContact O-N 2.9Å; K472-F475 WeakPolarHBondContact O-CB 3.26Å; K472-F475 PolarHBondContact O-N 2.9Å; F475-E478 PolarHBondContact O-N 3.38Å; F475-E479 HydrophobicContact CD2-CG 4.4Å; F475-E479 HydrophobicContact CE1-CG 4.22Å; F475-E479 HydrophobicContact CE2-CG 3.91Å; F475-E479 HydrophobicContact CZ-CG 3.81Å; F475-E479 WeakPolarHBondContact O-CG 3.32Å; F475-E479 PolarHBondContact O-N 3.46Å
476	I	95.6	Very high	96.3	Very high	31 Å²	31	40.1 Å²	40.1	16%	0.159	21%	0.212	C	C	.	.	H	α-helix	trans	-65.5	-42.4	178.6	-63.9	162.5	0	0	0	110.6	A312 Y316 L327 K472 A473 V474 E479 L480	A312-I476 HydrophobicContact CB-CG2 4.45Å; Y316-I476 HydrophobicContact CD1-CD1 3.79Å; Y316-I476 HydrophobicContact CD2-CD1 3.8Å; Y316-I476 HydrophobicContact CD2-CG1 4.16Å; Y316-I476 HydrophobicContact CD2-CG2 4.32Å; Y316-I476 HydrophobicContact CE1-CD1 3.78Å; Y316-I476 HydrophobicContact CE1-CG1 4.38Å; Y316-I476 HydrophobicContact CE2-CD1 3.81Å; Y316-I476 HydrophobicContact CE2-CG1 3.77Å; Y316-I476 HydrophobicContact CE2-CG2 4.41Å; Y316-I476 HydrophobicContact CG-CD1 3.79Å; L327-I476 HydrophobicContact CD2-CD1 3.75Å; K472-I476 HydrophobicContact CG-CD1 4.32Å; K472-I476 WeakPolarHBondContact O-CG1 3.14Å; K472-I476 PolarHBondContact O-N 2.88Å; A473-I476 PolarHBondContact O-N 2.92Å; V474-I476 VanDerWaalsContact C-N 3.33Å; V474-I476 PolarHBondContact O-N 3.45Å; I476-E479 PolarHBondContact O-N 3.5Å; I476-L480 WeakPolarHBondContact O-CB 3.31Å; I476-L480 PolarHBondContact O-N 3.39Å
477	L	96	Very high	96.4	Very high	97 Å²	97	38.9 Å²	38.9	51%	0.508	20%	0.202	S	C	.	.	H	α-helix	trans	-63.3	-43.8	177.2	-179.3	63.1	0	0	0	111.9	A473 V474 L480 L481	A473-L477 PolarHBondContact O-N 3.35Å; V474-L477 PolarHBondContact O-N 3.33Å; L477-L480 PolarHBondContact O-N 2.86Å; L477-L481 HydrophobicContact CD1-CD1 4.14Å; L477-L481 HydrophobicContact CD1-CG 4.26Å; L477-L481 HydrophobicContact CG-CD1 4.02Å; L477-L481 HydrophobicContact CG-CG 4.49Å; L477-L481 WeakPolarHBondContact O-CB 3.28Å; L477-L481 VanDerWaalsContact O-CG 3.3Å; L477-L481 WeakPolarHBondContact O-CG 3.41Å; L477-L481 PolarHBondContact O-N 3.43Å
478	E	96.1	Very high	96.5	Very high	31 Å²	31	40.8 Å²	40.8	15%	0.145	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-44	176.5	-74.1	170	176.4	0	0	112	F242 T244 Q470 V474 F475 L480 L481 S482	F242-E478 HydrophobicContact CD2-CG 4.42Å; F242-E478 HydrophobicContact CE2-CB 4.23Å; F242-E478 HydrophobicContact CE2-CG 4.32Å; T244-E478 HydrophobicContact CG2-CB 4.14Å; Q470-E478 PolarHBondContact NE2-OE2 3.23Å; Q470-E478 PolarHBondContact OE1-OE2 2.92Å; V474-E478 HydrophobicContact CG1-CG 4.24Å; V474-E478 WeakPolarHBondContact CG1-OE1 3.33Å; V474-E478 WeakPolarHBondContact O-CB 3.35Å; V474-E478 WeakPolarHBondContact O-CG 3.26Å; V474-E478 PolarHBondContact O-N 3.22Å; F475-E478 PolarHBondContact O-N 3.38Å; E478-L480 VanDerWaalsContact C-N 3.31Å; E478-L480 PolarHBondContact O-N 2.88Å; E478-L481 PolarHBondContact O-N 2.95Å; E478-S482 PolarHBondContact O-N 3.29Å
479	E	96.8	Very high	96.5	Very high	20 Å²	20	40.8 Å²	40.8	9%	0.093	21%	0.213	C	C	.	.	H	α-helix	trans	-65.1	-34.5	175.6	-71.6	-68.5	153.8	0	0	111.9	R245 F475 I476 S482	R245-E479 WeakPolarHBondContact CG-OE1 3.35Å; R245-E479 PolarHBondContact N-OE1 3.18Å; F475-E479 HydrophobicContact CD2-CG 4.4Å; F475-E479 HydrophobicContact CE1-CG 4.22Å; F475-E479 HydrophobicContact CE2-CG 3.91Å; F475-E479 HydrophobicContact CZ-CG 3.81Å; F475-E479 WeakPolarHBondContact O-CG 3.32Å; F475-E479 PolarHBondContact O-N 3.46Å; I476-E479 PolarHBondContact O-N 3.5Å; E479-S482 VanDerWaalsContact O-CB 3.25Å; E479-S482 WeakPolarHBondContact O-CB 3.38Å; E479-S482 PolarHBondContact O-N 3Å
480	L	96.8	Very high	96.5	Very high	52 Å²	52	40.8 Å²	40.8	27%	0.272	21%	0.213	S	C	.	.	H	α-helix	trans	-70.4	-37.3	175.4	-164.4	63.8	0	0	0	112.7	L305 Q308 I309 I476 L477 E478 S482 P483	L305-L480 WeakPolarHBondContact CD1-O 3.41Å; Q308-L480 HydrophobicContact CB-CD1 3.89Å; I309-L480 HydrophobicContact CB-CD1 4.36Å; I309-L480 HydrophobicContact CG1-CD1 3.6Å; I476-L480 WeakPolarHBondContact O-CB 3.31Å; I476-L480 PolarHBondContact O-N 3.39Å; L477-L480 PolarHBondContact O-N 2.86Å; E478-L480 VanDerWaalsContact C-N 3.31Å; E478-L480 PolarHBondContact O-N 2.88Å; L480-S482 VanDerWaalsContact C-N 3.32Å; L480-P483 VanDerWaalsContact O-CD 3.28Å; L480-P483 WeakPolarHBondContact O-CD 3.5Å
481	L	96.6	Very high	96.6	Very high	74 Å²	74	41.4 Å²	41.4	39%	0.387	22%	0.216	S	C	.	.	H	α-helix	trans	-78.3	-17.3	175.1	-66.9	175.1	0	0	0	112.6	L477 E478 P483 I484 V485	L477-L481 HydrophobicContact CD1-CD1 4.14Å; L477-L481 HydrophobicContact CD1-CG 4.26Å; L477-L481 HydrophobicContact CG-CD1 4.02Å; L477-L481 HydrophobicContact CG-CG 4.49Å; L477-L481 WeakPolarHBondContact O-CB 3.28Å; L477-L481 VanDerWaalsContact O-CG 3.3Å; L477-L481 WeakPolarHBondContact O-CG 3.41Å; L477-L481 PolarHBondContact O-N 3.43Å; E478-L481 PolarHBondContact O-N 2.95Å; L481-P483 VanDerWaalsContact C-CD 3.49Å; L481-I484 PolarHBondContact O-N 2.94Å; L481-I484 VanDerWaalsContact O-N 3.12Å; L481-V485 HydrophobicContact CB-CG2 4.35Å; L481-V485 WeakPolarHBondContact O-CG2 3.44Å; L481-V485 PolarHBondContact O-N 3.33Å
482	S	97.8	Very high	96.7	Very high	5 Å²	5	43.1 Å²	43.1	4%	0.035	23%	0.226	C	C	.	.	H	α-helix	trans	-50.5	-48.6	-177.7	-169.4	0	0	0	0	114	T244 E478 E479 L480 I484 V485 T486	T244-S482 WeakPolarHBondContact CB-OG 3.42Å; T244-S482 PolarHBondContact OG1-OG 2.74Å; E478-S482 PolarHBondContact O-N 3.29Å; E479-S482 VanDerWaalsContact O-CB 3.25Å; E479-S482 WeakPolarHBondContact O-CB 3.38Å; E479-S482 PolarHBondContact O-N 3Å; L480-S482 VanDerWaalsContact C-N 3.32Å; S482-I484 PolarHBondContact O-N 3.17Å; S482-V485 PolarHBondContact O-N 3.33Å; S482-T486 WeakPolarHBondContact O-CB 3.48Å; S482-T486 PolarHBondContact O-N 3.15Å; S482-T486 PolarHBondContact O-OG1 3.47Å; S482-T486 PolarHBondContact OG-OG1 3.47Å
483	P	97.6	Very high	96.8	Very high	9 Å²	9	42 Å²	42	6%	0.058	23%	0.226	C	C	.	.	H	α-helix	trans	-62.4	-30.2	-177.1	-23	36.5	0	0	0	113.2	C301 I304 L305 Q308 L480 L481 P487	C301-P483 PolarHBondContact SG-O 3.08Å; I304-P483 HydrophobicContact CB-CB 4.07Å; I304-P483 HydrophobicContact CB-CG 4.22Å; I304-P483 HydrophobicContact CG2-CB 3.94Å; I304-P483 HydrophobicContact CG2-CG 3.62Å; L305-P483 HydrophobicContact CB-CB 4.37Å; Q308-P483 HydrophobicContact CG-CG 4.03Å; L480-P483 VanDerWaalsContact O-CD 3.28Å; L480-P483 WeakPolarHBondContact O-CD 3.5Å; L481-P483 VanDerWaalsContact C-CD 3.49Å; P483-P487 WeakPolarHBondContact O-CD 3.32Å
484	I	97.2	Very high	96.9	Very high	78 Å²	78	39.8 Å²	39.8	40%	0.4	21%	0.208	S	C	.	.	H	α-helix	trans	-81.9	-46.5	-178.6	-55.3	173	0	0	0	110.4	L305 L481 S482 P487	L305-I484 HydrophobicContact CD1-CD1 4.28Å; L305-I484 HydrophobicContact CD1-CG1 4.47Å; L305-I484 HydrophobicContact CD2-CD1 4.06Å; L305-I484 HydrophobicContact CD2-CG1 4.31Å; L481-I484 PolarHBondContact O-N 2.94Å; L481-I484 VanDerWaalsContact O-N 3.12Å; S482-I484 PolarHBondContact O-N 3.17Å; I484-P487 WeakPolarHBondContact O-CD 3.36Å; I484-P487 WeakPolarHBondContact O-CG 3.33Å
485	V	97.2	Very high	97	Very high	43 Å²	43	41.2 Å²	41.2	26%	0.261	21%	0.207	S	C	.	.	H	α-helix	trans	-81.5	-33.4	-172.1	179.2	0	0	0	0	112.4	F242 L481 S482 L488 I489	F242-V485 HydrophobicContact CD1-CG1 4.08Å; F242-V485 HydrophobicContact CE1-CB 3.98Å; F242-V485 HydrophobicContact CE1-CG1 3.77Å; F242-V485 HydrophobicContact CZ-CB 3.92Å; F242-V485 HydrophobicContact CZ-CG1 4.06Å; F242-V485 HydrophobicContact CZ-CG2 4.46Å; L481-V485 HydrophobicContact CB-CG2 4.35Å; L481-V485 WeakPolarHBondContact O-CG2 3.44Å; L481-V485 PolarHBondContact O-N 3.33Å; S482-V485 PolarHBondContact O-N 3.33Å; V485-L488 WeakPolarHBondContact O-CB 3.3Å; V485-L488 PolarHBondContact O-N 3.15Å; V485-L488 VanDerWaalsContact O-N 3.14Å; V485-I489 HydrophobicContact CG1-CD1 3.64Å; V485-I489 HydrophobicContact CG1-CG1 3.96Å; V485-I489 PolarHBondContact O-N 2.92Å
486	T	97.8	Very high	97.1	Very high	4 Å²	4	44.4 Å²	44.4	3%	0.025	23%	0.231	C	C	.	.	H	α-helix	trans	-53.4	-52.7	-178.8	-61.5	0	0	0	0	113.8	L247 S482 L488 I489 L490	L247-T486 HydrophobicContact CD1-CG2 4Å; S482-T486 WeakPolarHBondContact O-CB 3.48Å; S482-T486 PolarHBondContact O-N 3.15Å; S482-T486 PolarHBondContact O-OG1 3.47Å; S482-T486 PolarHBondContact OG-OG1 3.47Å; T486-L488 PolarHBondContact O-N 3.2Å; T486-I489 PolarHBondContact O-N 3.23Å; T486-L490 HydrophobicContact CG2-CD1 3.91Å; T486-L490 HydrophobicContact CG2-CG 4.26Å; T486-L490 WeakPolarHBondContact O-CG 3.3Å; T486-L490 PolarHBondContact O-N 3.07Å
487	P	97.7	Very high	97.1	Very high	1 Å²	1	47 Å²	47	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-60.7	-34.4	179.4	22.7	-33.5	0	0	0	112.6	G294 N297 F298 P483 I484 L490 I491	G294-P487 WeakPolarHBondContact O-CB 3.44Å; N297-P487 HydrophobicContact CB-CB 4.14Å; F298-P487 HydrophobicContact CB-CB 3.88Å; F298-P487 HydrophobicContact CB-CG 4.35Å; F298-P487 HydrophobicContact CD2-CB 4.5Å; F298-P487 HydrophobicContact CD2-CG 4.35Å; P483-P487 WeakPolarHBondContact O-CD 3.32Å; I484-P487 WeakPolarHBondContact O-CD 3.36Å; I484-P487 WeakPolarHBondContact O-CG 3.33Å; P487-L490 PolarHBondContact O-N 3.06Å; P487-I491 WeakPolarHBondContact O-CB 3.27Å; P487-I491 VanDerWaalsContact O-CG1 3.23Å; P487-I491 WeakPolarHBondContact O-CG1 3.25Å; P487-I491 PolarHBondContact O-N 2.83Å
488	L	97.2	Very high	97.2	Very high	81 Å²	81	42.6 Å²	42.6	42%	0.424	22%	0.216	S	C	.	.	H	α-helix	trans	-66.3	-44.9	177	-55.8	177.4	0	0	0	111.4	V485 T486 L490 F492	V485-L488 WeakPolarHBondContact O-CB 3.3Å; V485-L488 PolarHBondContact O-N 3.15Å; V485-L488 VanDerWaalsContact O-N 3.14Å; T486-L488 PolarHBondContact O-N 3.2Å; L488-L490 PolarHBondContact O-N 3.35Å; L488-F492 HydrophobicContact CB-CD2 4.33Å; L488-F492 HydrophobicContact CD2-CD2 4.38Å; L488-F492 HydrophobicContact CD2-CE2 3.94Å; L488-F492 WeakPolarHBondContact O-CB 3.27Å; L488-F492 VanDerWaalsContact O-CD2 3.3Å; L488-F492 WeakPolarHBondContact O-CD2 3.28Å; L488-F492 PolarHBondContact O-N 2.93Å
489	I	97.5	Very high	97.2	Very high	6 Å²	6	44 Å²	44	3%	0.031	22%	0.224	C	C	.	.	I	π-helix	trans	-62.2	-44.7	176.3	-67.3	175.8	0	0	0	110.6	P229 F232 F242 L247 V485 T486 C493 L494	P229-I489 HydrophobicContact CG-CG2 3.96Å; F232-I489 HydrophobicContact CE1-CG1 4.38Å; F232-I489 HydrophobicContact CE2-CD1 3.73Å; F232-I489 HydrophobicContact CE2-CG1 4.31Å; F232-I489 HydrophobicContact CZ-CD1 3.66Å; F232-I489 HydrophobicContact CZ-CG1 3.73Å; F232-I489 HydrophobicContact CZ-CG2 4.09Å; F242-I489 HydrophobicContact CD1-CD1 3.48Å; F242-I489 VanDerWaalsContact CD1-CD1 3.48Å; F242-I489 HydrophobicContact CE1-CD1 4.04Å; F242-I489 HydrophobicContact CG-CD1 4.36Å; L247-I489 HydrophobicContact CD1-CB 4.5Å; L247-I489 HydrophobicContact CD1-CG2 4.13Å; L247-I489 HydrophobicContact CD2-CD1 4.16Å; L247-I489 HydrophobicContact CD2-CG2 4.34Å; V485-I489 HydrophobicContact CG1-CD1 3.64Å; V485-I489 HydrophobicContact CG1-CG1 3.96Å; V485-I489 PolarHBondContact O-N 2.92Å; T486-I489 PolarHBondContact O-N 3.23Å; I489-C493 HydrophobicContact CG2-CB 4.27Å; I489-C493 CarbonylContact O-C 3.6Å; I489-C493 WeakPolarHBondContact O-CA 3.47Å; I489-C493 VanDerWaalsContact O-CB 3.28Å; I489-C493 WeakPolarHBondContact O-CB 3.24Å; I489-C493 PolarHBondContact O-N 2.7Å; I489-L494 PolarHBondContact O-N 3.38Å
490	L	97.6	Very high	97.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.239	C	C	.	.	I	π-helix	trans	-62.3	-48.2	-179.9	-68.1	176.8	0	0	0	111.8	L247 N250 F251 I254 I290 I293 T486 P487 L488 L494 R495	L247-L490 HydrophobicContact CD1-CD2 4.18Å; L247-L490 HydrophobicContact CD1-CG 4.46Å; N250-L490 HydrophobicContact CB-CD1 3.92Å; N250-L490 HydrophobicContact CB-CD2 4.34Å; F251-L490 HydrophobicContact CD1-CD2 4.14Å; F251-L490 HydrophobicContact CE1-CD2 3.9Å; I254-L490 HydrophobicContact CD1-CD2 3.75Å; I290-L490 HydrophobicContact CG2-CB 4.48Å; I290-L490 WeakPolarHBondContact CG2-O 3.37Å; I293-L490 HydrophobicContact CG2-CD1 4.48Å; T486-L490 HydrophobicContact CG2-CD1 3.91Å; T486-L490 HydrophobicContact CG2-CG 4.26Å; T486-L490 WeakPolarHBondContact O-CG 3.3Å; T486-L490 PolarHBondContact O-N 3.07Å; P487-L490 PolarHBondContact O-N 3.06Å; L488-L490 PolarHBondContact O-N 3.35Å; L490-L494 HydrophobicContact CD2-CD2 3.76Å; L490-R495 PolarHBondContact O-N 3.05Å
491	I	97.3	Very high	97.2	Very high	31 Å²	31	44.9 Å²	44.9	16%	0.159	23%	0.227	C	C	.	.	I	π-helix	trans	-72.6	-45.8	-174.7	-66	170.1	0	0	0	111.7	L291 P487 R495	L291-I491 HydrophobicContact CD1-CG1 4.35Å; L291-I491 HydrophobicContact CD1-CG2 4.1Å; P487-I491 WeakPolarHBondContact O-CB 3.27Å; P487-I491 VanDerWaalsContact O-CG1 3.23Å; P487-I491 WeakPolarHBondContact O-CG1 3.25Å; P487-I491 PolarHBondContact O-N 2.83Å; I491-R495 VanDerWaalsContact O-CB 3.31Å; I491-R495 WeakPolarHBondContact O-CB 3.33Å
492	F	97.4	Very high	97.2	Very high	141 Å²	141	41.5 Å²	41.5	62%	0.618	21%	0.209	S	C	*	.	I	π-helix	trans	-97.8	-30.5	-169.4	-60.4	-66.2	0	0	0	114	L488 P496	L488-F492 HydrophobicContact CB-CD2 4.33Å; L488-F492 HydrophobicContact CD2-CD2 4.38Å; L488-F492 HydrophobicContact CD2-CE2 3.94Å; L488-F492 WeakPolarHBondContact O-CB 3.27Å; L488-F492 VanDerWaalsContact O-CD2 3.3Å; L488-F492 WeakPolarHBondContact O-CD2 3.28Å; L488-F492 PolarHBondContact O-N 2.93Å; F492-P496 WeakPolarHBondContact O-CD 3.4Å; F492-P496 WeakPolarHBondContact O-CG 3.4Å
493	C	97	Very high	97.1	Very high	43 Å²	43	42.4 Å²	42.4	29%	0.291	21%	0.213	S	C	.	.	I	π-helix	trans	-106.8	-38.8	-171.2	-53.6	0	0	0	0	113.2	P229 F232 I489	P229-C493 HydrophobicContact CB-CB 3.67Å; P229-C493 HydrophobicContact CG-CB 3.83Å; F232-C493 HydrophobicContact CE1-CB 4.33Å; I489-C493 HydrophobicContact CG2-CB 4.27Å; I489-C493 CarbonylContact O-C 3.6Å; I489-C493 WeakPolarHBondContact O-CA 3.47Å; I489-C493 VanDerWaalsContact O-CB 3.28Å; I489-C493 WeakPolarHBondContact O-CB 3.24Å; I489-C493 PolarHBondContact O-N 2.7Å
494	L	97.3	Very high	97	Very high	4 Å²	4	42 Å²	42	2%	0.021	21%	0.21	C	C	.	.	I	π-helix	trans	-80	-40	-179.1	-174.8	70.7	0	0	0	111.8	L228 P229 F251 I254 I290 I489 L490 R497 I501	L228-L494 HydrophobicContact CD2-CD1 3.94Å; P229-L494 HydrophobicContact CG-CB 4.14Å; P229-L494 HydrophobicContact CG-CD1 4.27Å; F251-L494 HydrophobicContact CD1-CD2 3.92Å; F251-L494 HydrophobicContact CE1-CD1 4.06Å; F251-L494 HydrophobicContact CE1-CD2 3.82Å; F251-L494 HydrophobicContact CE1-CG 4.43Å; I254-L494 HydrophobicContact CD1-CD2 4.01Å; I290-L494 HydrophobicContact CD1-CD2 4.01Å; I290-L494 HydrophobicContact CD1-CG 4.09Å; I290-L494 HydrophobicContact CG1-CD2 4.13Å; I290-L494 HydrophobicContact CG2-CB 4.41Å; I290-L494 HydrophobicContact CG2-CD2 4.04Å; I290-L494 HydrophobicContact CG2-CG 4.45Å; I489-L494 PolarHBondContact O-N 3.38Å; L490-L494 HydrophobicContact CD2-CD2 3.76Å; L494-R497 WeakPolarHBondContact O-CB 3.47Å; L494-R497 PolarHBondContact O-N 3.36Å; L494-I501 HydrophobicContact CD1-CD1 3.85Å
495	R	97.2	Very high	97	Very high	85 Å²	85	38.2 Å²	38.2	32%	0.321	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-56.5	-42.5	-175.2	-169.6	179.4	168.3	-138.8	-2	114.3	S287 I290 L490 I491 R497 A498	S287-R495 WeakPolarHBondContact OG-CG 3.47Å; S287-R495 PolarHBondContact OG-NE 3.32Å; I290-R495 HydrophobicContact CG2-CB 4.24Å; L490-R495 PolarHBondContact O-N 3.05Å; I491-R495 VanDerWaalsContact O-CB 3.31Å; I491-R495 WeakPolarHBondContact O-CB 3.33Å; R495-R497 PolarHBondContact O-N 3.27Å; R495-A498 WeakPolarHBondContact O-CB 3.28Å; R495-A498 PolarHBondContact O-N 3.01Å
496	P	96.9	Very high	96.9	Very high	97 Å²	97	39 Å²	39	63%	0.63	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-61.8	-27.5	175.1	-23.4	35.1	0	0	0	113.9	F492 A498	F492-P496 WeakPolarHBondContact O-CD 3.4Å; F492-P496 WeakPolarHBondContact O-CG 3.4Å; P496-A498 VanDerWaalsContact C-N 3.3Å; P496-A498 PolarHBondContact O-N 3.21Å
497	R	96.9	Very high	96.7	Very high	86 Å²	86	42.6 Å²	42.6	33%	0.325	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-85.7	4	-179.2	-64	-177.1	170.9	-97.6	9.2	113.9	S226 L227 L494 R495 L499 E500 I501	S226-R497 PolarHBondContact O-NH1 3.07Å; L227-R497 VanDerWaalsContact O-CD 3.29Å; L227-R497 WeakPolarHBondContact O-CD 3.07Å; L494-R497 WeakPolarHBondContact O-CB 3.47Å; L494-R497 PolarHBondContact O-N 3.36Å; R495-R497 PolarHBondContact O-N 3.27Å; R497-L499 PolarHBondContact O-N 3.27Å; R497-E500 IonicContact NH1-OE2 3.3Å; R497-E500 PolarHBondContact NH1-OE2 3.21Å; R497-E500 PolarHBondContact O-N 3.37Å; R497-I501 WeakPolarHBondContact O-CG1 3.43Å; R497-I501 PolarHBondContact O-N 3.48Å
498	A	96.8	Very high	96.6	Very high	3 Å²	3	42.6 Å²	42.6	3%	0.025	21%	0.209	C	C	.	.	H	α-helix	trans	-56.9	-37.2	-178.5	0	0	0	0	0	112.6	L286 I290 R495 P496 I501 I502	L286-A498 HydrophobicContact CB-CB 4.47Å; L286-A498 HydrophobicContact CD2-CB 4.26Å; L286-A498 HydrophobicContact CG-CB 4.3Å; I290-A498 HydrophobicContact CD1-CB 4.36Å; R495-A498 WeakPolarHBondContact O-CB 3.28Å; R495-A498 PolarHBondContact O-N 3.01Å; P496-A498 VanDerWaalsContact C-N 3.3Å; P496-A498 PolarHBondContact O-N 3.21Å; A498-I501 PolarHBondContact O-N 2.94Å; A498-I502 WeakPolarHBondContact O-CG1 3.49Å; A498-I502 PolarHBondContact O-N 3.43Å
499	L	96.9	Very high	96.6	Very high	61 Å²	61	40 Å²	40	32%	0.319	20%	0.196	S	C	.	.	H	α-helix	trans	-64.8	-47.6	178.2	-178.3	62.2	0	0	0	112.2	L280 A283 R497 I501 I502 D503	L280-L499 HydrophobicContact CD2-CD1 4.17Å; L280-L499 HydrophobicContact CD2-CD2 4.37Å; A283-L499 HydrophobicContact CB-CB 4.11Å; A283-L499 HydrophobicContact CB-CD1 3.83Å; R497-L499 PolarHBondContact O-N 3.27Å; L499-I501 VanDerWaalsContact C-N 3.27Å; L499-I501 PolarHBondContact O-N 3.47Å; L499-I502 PolarHBondContact O-N 3.08Å; L499-D503 PolarHBondContact O-N 3.09Å
500	E	95.9	Very high	96.4	Very high	89 Å²	89	42.1 Å²	42.1	42%	0.416	21%	0.209	S	C	.	.	H	α-helix	trans	-59.7	-39.3	177.1	-63.2	169.8	-160.2	0	0	111.3	L227 R497 D503 F504	L227-E500 HydrophobicContact CD2-CB 4.01Å; R497-E500 IonicContact NH1-OE2 3.3Å; R497-E500 PolarHBondContact NH1-OE2 3.21Å; R497-E500 PolarHBondContact O-N 3.37Å; E500-D503 PolarHBondContact O-N 3.07Å; E500-F504 WeakPolarHBondContact O-CB 3.47Å; E500-F504 PolarHBondContact O-N 3.11Å
501	I	97.1	Very high	96.3	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-64.7	-44.3	176.8	-66.5	168.5	0	0	0	111	L255 L286 L494 R497 A498 L499 F504 F505	L255-I501 HydrophobicContact CD2-CG2 3.81Å; L286-I501 HydrophobicContact CD2-CB 4.3Å; L286-I501 HydrophobicContact CD2-CG2 3.97Å; L494-I501 HydrophobicContact CD1-CD1 3.85Å; R497-I501 WeakPolarHBondContact O-CG1 3.43Å; R497-I501 PolarHBondContact O-N 3.48Å; A498-I501 PolarHBondContact O-N 2.94Å; L499-I501 VanDerWaalsContact C-N 3.27Å; L499-I501 PolarHBondContact O-N 3.47Å; I501-F504 WeakPolarHBondContact O-CB 3.45Å; I501-F504 PolarHBondContact O-N 3.33Å; I501-F505 HydrophobicContact CG2-CD2 3.92Å; I501-F505 HydrophobicContact CG2-CE2 3.9Å; I501-F505 WeakPolarHBondContact O-CD2 3.36Å; I501-F505 PolarHBondContact O-N 3.48Å
502	I	96.8	Very high	96	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-63.3	-44.1	176.6	-66.9	-50.2	0	0	0	111.1	L262 Y273 L282 A283 L286 A498 L499 F504 F505 R506	L262-I502 HydrophobicContact CD2-CD1 4.3Å; Y273-I502 HydrophobicContact CD1-CD1 3.77Å; Y273-I502 HydrophobicContact CD1-CG2 4.43Å; Y273-I502 HydrophobicContact CE1-CD1 3.55Å; L282-I502 HydrophobicContact CB-CG2 4.3Å; A283-I502 HydrophobicContact CB-CG1 4.34Å; L286-I502 HydrophobicContact CB-CD1 4.27Å; L286-I502 HydrophobicContact CD2-CD1 3.6Å; L286-I502 HydrophobicContact CD2-CG1 4Å; A498-I502 WeakPolarHBondContact O-CG1 3.49Å; A498-I502 PolarHBondContact O-N 3.43Å; L499-I502 PolarHBondContact O-N 3.08Å; I502-F504 VanDerWaalsContact C-N 3.26Å; I502-F504 PolarHBondContact O-N 2.92Å; I502-F505 PolarHBondContact O-N 3.42Å; I502-R506 PolarHBondContact O-N 3.11Å
503	D	95.4	Very high	95.5	Very high	24 Å²	24	47.8 Å²	47.8	13%	0.128	25%	0.247	C	C	.	.	H	α-helix	trans	-63.6	-34.4	176.7	-77.7	-27.6	0	0	0	111.7	R279 L499 E500 R506 N507	R279-D503 IonicContact NH1-OD2 2.78Å; L499-D503 PolarHBondContact O-N 3.09Å; E500-D503 PolarHBondContact O-N 3.07Å; D503-R506 IonicContact OD1-CZ 2.7Å; D503-R506 IonicContact OD1-NH1 3.21Å; D503-R506 PolarHBondContact OD1-NH1 3.5Å; D503-R506 IonicContact OD1-NH2 2.87Å; D503-R506 PolarHBondContact OD1-NH2 2.86Å; D503-N507 VanDerWaalsContact O-CB 3.3Å; D503-N507 WeakPolarHBondContact O-CB 3.31Å; D503-N507 PolarHBondContact O-N 3.49Å
504	F	96.4	Very high	94.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.9	-52	173	170.1	-90.8	0	0	0	112.1	Y218 A221 L222 L227 E500 I501 I502 R506 N507 F508 F521	Y218-F504 AromaticContact CD1-CE1 3.94Å; Y218-F504 HydrophobicContact CD1-CE1 3.94Å; Y218-F504 HydrophobicContact CD1-CZ 4.4Å; Y218-F504 HydrophobicContact CE1-CE1 4.49Å; A221-F504 HydrophobicContact CB-CE2 4.11Å; A221-F504 HydrophobicContact CB-CZ 3.68Å; L222-F504 HydrophobicContact CD2-CD1 3.65Å; L222-F504 HydrophobicContact CD2-CE1 3.68Å; L222-F504 HydrophobicContact CD2-CG 4.19Å; L222-F504 HydrophobicContact CD2-CZ 4.24Å; L222-F504 HydrophobicContact CG-CD1 4.4Å; L222-F504 HydrophobicContact CG-CE1 3.93Å; L222-F504 HydrophobicContact CG-CZ 4.29Å; L227-F504 HydrophobicContact CD1-CB 3.65Å; L227-F504 HydrophobicContact CD1-CD1 4.34Å; L227-F504 HydrophobicContact CD1-CD2 3.38Å; L227-F504 HydrophobicContact CD1-CE2 4.12Å; L227-F504 HydrophobicContact CD1-CG 3.53Å; E500-F504 WeakPolarHBondContact O-CB 3.47Å; E500-F504 PolarHBondContact O-N 3.11Å; I501-F504 WeakPolarHBondContact O-CB 3.45Å; I501-F504 PolarHBondContact O-N 3.33Å; I502-F504 VanDerWaalsContact C-N 3.26Å; I502-F504 PolarHBondContact O-N 2.92Å; F504-R506 VanDerWaalsContact C-N 3.26Å; F504-R506 PolarHBondContact O-N 3.32Å; F504-N507 PolarHBondContact O-N 3.39Å; F504-F508 HydrophobicContact CB-CD2 4.44Å; F504-F508 HydrophobicContact CD2-CB 4.32Å; F504-F508 AromaticContact CD2-CD2 3.37Å; F504-F508 HydrophobicContact CD2-CD2 3.37Å; F504-F508 HydrophobicContact CD2-CE2 4.01Å; F504-F508 HydrophobicContact CD2-CG 4.18Å; F504-F508 HydrophobicContact CE2-CB 4.1Å; F504-F508 AromaticContact CE2-CD2 3.79Å; F504-F508 HydrophobicContact CE2-CD2 3.79Å; F504-F508 HydrophobicContact CE2-CG 4.17Å; F504-F508 HydrophobicContact CG-CD2 4.08Å; F504-F508 HydrophobicContact CZ-CB 4.38Å; F504-F508 WeakPolarHBondContact O-CB 3.41Å; F504-F508 PolarHBondContact O-N 2.94Å; F504-F521 HydrophobicContact CE2-CE2 4.01Å
505	F	96.2	Very high	94.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.5	-31.4	179.3	-83.8	-80.9	0	0	0	112.5	Y218 L222 L255 F256 L262 F263 L269 I501 I502 T509	Y218-F505 HydrophobicContact CD1-CD1 4.22Å; Y218-F505 AromaticContact CD1-CE1 3.61Å; Y218-F505 HydrophobicContact CD1-CE1 3.61Å; Y218-F505 HydrophobicContact CD1-CZ 4.24Å; Y218-F505 HydrophobicContact CD2-CE1 4.39Å; Y218-F505 AromaticContact CE1-CD1 3.92Å; Y218-F505 HydrophobicContact CE1-CD1 3.92Å; Y218-F505 AromaticContact CE1-CE1 3.72Å; Y218-F505 HydrophobicContact CE1-CE1 3.72Å; Y218-F505 AromaticContact CG-CE1 3.97Å; Y218-F505 HydrophobicContact CG-CE1 3.97Å; Y218-F505 HydrophobicContact CG-CZ 4.45Å; L222-F505 HydrophobicContact CD1-CZ 4.49Å; L255-F505 HydrophobicContact CD1-CE2 4.38Å; L255-F505 HydrophobicContact CD2-CE2 4.14Å; F256-F505 AromaticContact CE1-CE1 3.98Å; F256-F505 HydrophobicContact CE1-CE1 3.98Å; F256-F505 AromaticContact CE1-CZ 3.69Å; F256-F505 HydrophobicContact CE1-CZ 3.69Å; F256-F505 HydrophobicContact CZ-CZ 4.26Å; L262-F505 HydrophobicContact CD2-CB 4.04Å; L262-F505 HydrophobicContact CD2-CD1 4.11Å; L262-F505 HydrophobicContact CD2-CD2 3.32Å; L262-F505 HydrophobicContact CD2-CE1 4.43Å; L262-F505 HydrophobicContact CD2-CE2 3.72Å; L262-F505 HydrophobicContact CD2-CG 3.54Å; L262-F505 HydrophobicContact CD2-CZ 4.25Å; F263-F505 HydrophobicContact CE2-CD1 4.42Å; F263-F505 AromaticContact CE2-CE1 3.92Å; F263-F505 HydrophobicContact CE2-CE1 3.92Å; F263-F505 HydrophobicContact CZ-CE1 4.47Å; L269-F505 HydrophobicContact CD1-CD1 4.32Å; I501-F505 HydrophobicContact CG2-CD2 3.92Å; I501-F505 HydrophobicContact CG2-CE2 3.9Å; I501-F505 WeakPolarHBondContact O-CD2 3.36Å; I501-F505 PolarHBondContact O-N 3.48Å; I502-F505 PolarHBondContact O-N 3.42Å; F505-T509 VanDerWaalsContact O-CB 3.23Å; F505-T509 WeakPolarHBondContact O-CB 3.47Å; F505-T509 PolarHBondContact O-OG1 2.89Å
506	R	95.1	Very high	94.2	Very high	59 Å²	59	43.3 Å²	43.3	22%	0.223	24%	0.235	C	C	.	.	H	α-helix	trans	-68.2	-47	174.4	-173	-176	68.5	-132	-10.8	112	Y273 I502 D503 F504	Y273-R506 WeakPolarHBondContact O-CB 3.3Å; Y273-R506 WeakPolarHBondContact O-CG 3.49Å; I502-R506 PolarHBondContact O-N 3.11Å; D503-R506 IonicContact OD1-CZ 2.7Å; D503-R506 IonicContact OD1-NH1 3.21Å; D503-R506 PolarHBondContact OD1-NH1 3.5Å; D503-R506 IonicContact OD1-NH2 2.87Å; D503-R506 PolarHBondContact OD1-NH2 2.86Å; F504-R506 VanDerWaalsContact C-N 3.26Å; F504-R506 PolarHBondContact O-N 3.32Å
507	N	94.2	Very high	94.2	Very high	79 Å²	79	38.8 Å²	38.8	42%	0.422	21%	0.205	S	C	.	.	H	α-helix	trans	-85.7	-26.6	-170.4	-64	-4.8	0	0	0	113.3	D503 F504	D503-N507 VanDerWaalsContact O-CB 3.3Å; D503-N507 WeakPolarHBondContact O-CB 3.31Å; D503-N507 PolarHBondContact O-N 3.49Å; F504-N507 PolarHBondContact O-N 3.39Å
508	F	95.7	Very high	94.1	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.009	19%	0.19	C	C	.	.	S	Bend	trans	-116	30.1	-173.7	-60.1	-71.8	0	0	0	113.7	F504 S520 F521 H529 Y545 Q546	F504-F508 HydrophobicContact CB-CD2 4.44Å; F504-F508 HydrophobicContact CD2-CB 4.32Å; F504-F508 AromaticContact CD2-CD2 3.37Å; F504-F508 HydrophobicContact CD2-CD2 3.37Å; F504-F508 HydrophobicContact CD2-CE2 4.01Å; F504-F508 HydrophobicContact CD2-CG 4.18Å; F504-F508 HydrophobicContact CE2-CB 4.1Å; F504-F508 AromaticContact CE2-CD2 3.79Å; F504-F508 HydrophobicContact CE2-CD2 3.79Å; F504-F508 HydrophobicContact CE2-CG 4.17Å; F504-F508 HydrophobicContact CG-CD2 4.08Å; F504-F508 HydrophobicContact CZ-CB 4.38Å; F504-F508 WeakPolarHBondContact O-CB 3.41Å; F504-F508 PolarHBondContact O-N 2.94Å; F508-S520 WeakPolarHBondContact O-CB 3.27Å; F508-S520 PolarHBondContact O-N 2.8Å; F508-F521 HydrophobicContact CB-CE2 4.09Å; F508-F521 HydrophobicContact CD1-CD2 4.37Å; F508-F521 HydrophobicContact CD1-CE1 4.48Å; F508-F521 AromaticContact CD1-CE2 3.48Å; F508-F521 HydrophobicContact CD1-CE2 3.48Å; F508-F521 VanDerWaalsContact CD1-CE2 3.48Å; F508-F521 AromaticContact CD1-CZ 3.53Å; F508-F521 HydrophobicContact CD1-CZ 3.53Å; F508-F521 HydrophobicContact CD2-CE2 4.25Å; F508-F521 HydrophobicContact CE1-CE1 4.33Å; F508-F521 AromaticContact CE1-CE2 3.88Å; F508-F521 HydrophobicContact CE1-CE2 3.88Å; F508-F521 AromaticContact CE1-CZ 3.44Å; F508-F521 HydrophobicContact CE1-CZ 3.44Å; F508-F521 VanDerWaalsContact CE1-CZ 3.44Å; F508-F521 AromaticContact CG-CE2 3.69Å; F508-F521 HydrophobicContact CG-CE2 3.69Å; F508-F521 HydrophobicContact CG-CZ 4.15Å; F508-F521 HydrophobicContact CZ-CE2 4.41Å; F508-F521 AromaticContact CZ-CZ 3.98Å; F508-F521 HydrophobicContact CZ-CZ 3.98Å; F508-H529 AromaticContact CD1-NE2 3.92Å; F508-Y545 HydrophobicContact CE2-CD1 4.16Å; F508-Y545 AromaticContact CE2-CE1 3.43Å; F508-Y545 HydrophobicContact CE2-CE1 3.43Å; F508-Y545 VanDerWaalsContact CE2-CE1 3.43Å; F508-Y545 AromaticContact CE2-CZ 3.78Å; F508-Y545 AromaticContact CZ-CD1 3.87Å; F508-Y545 HydrophobicContact CZ-CD1 3.87Å; F508-Y545 AromaticContact CZ-CE1 3.62Å; F508-Y545 HydrophobicContact CZ-CE1 3.62Å; F508-Y545 WeakPolarHBondContact CZ-O 3.42Å; F508-Q546 HydrophobicContact CE1-CB 4.35Å; F508-Q546 HydrophobicContact CE1-CG 4.18Å; F508-Q546 HydrophobicContact CZ-CG 4.34Å
509	T	96.1	Very high	94.1	Very high	26 Å²	26	34.7 Å²	34.7	16%	0.16	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	126.2	169.9	-61.3	0	0	0	0	109.8	Y218 L269 F505 D517 T518	Y218-T509 WeakPolarHBondContact OH-CG2 3.34Å; Y218-T509 PolarHBondContact OH-OG1 3.41Å; L269-T509 HydrophobicContact CD2-CG2 4.24Å; F505-T509 VanDerWaalsContact O-CB 3.23Å; F505-T509 WeakPolarHBondContact O-CB 3.47Å; F505-T509 PolarHBondContact O-OG1 2.89Å; T509-D517 HydrophobicContact CG2-CB 3.7Å; T509-T518 WeakPolarHBondContact CA-O 3.45Å
510	V	94.6	Very high	94	Very high	51 Å²	51	32 Å²	32	31%	0.309	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	132.1	177.9	179.3	0	0	0	0	109.4	V512 T518 S520	V510-V512 PolarHBondContact O-N 2.99Å; V510-T518 PolarHBondContact N-O 2.77Å; V510-T518 PolarHBondContact O-N 2.94Å; V510-T518 PolarHBondContact O-OG1 2.97Å; V510-S520 WeakPolarHBondContact CG2-OG 3.49Å
511	E	94.2	Very high	93.9	Very high	139 Å²	139	27.9 Å²	27.9	65%	0.65	16%	0.156	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	111.6	176.8	-170.9	168	169.4	0	0	110	K274	K274-E511 IonicContact NZ-OE2 2.66Å; K274-E511 PolarHBondContact NZ-OE2 3.21Å; K274-E511 VanDerWaalsContact NZ-OE2 3.09Å
512	V	91.3	Very high	93.8	Very high	27 Å²	27	27.8 Å²	27.8	16%	0.164	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	126.1	-179.7	180	0	0	0	0	109.2	V510 G514 V515 G516 T518	V510-V512 PolarHBondContact O-N 2.99Å; V512-G514 PolarHBondContact O-N 3.25Å; V512-V515 HydrophobicContact CB-CB 4.2Å; V512-V515 HydrophobicContact CG1-CB 4.23Å; V512-V515 HydrophobicContact CG1-CG2 4.26Å; V512-V515 PolarHBondContact O-N 2.96Å; V512-G516 PolarHBondContact N-O 3.01Å; V512-G516 PolarHBondContact O-N 3.39Å; V512-T518 HydrophobicContact CG2-CG2 4.18Å; V512-T518 VanDerWaalsContact CG2-OG1 3.3Å; V512-T518 WeakPolarHBondContact CG2-OG1 3.23Å
513	V	86.9	Confident	93.6	Very high	124 Å²	124	30 Å²	30	75%	0.752	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	124.4	-179.7	-176.9	0	0	0	0	110.6	V515	V513-V515 VanDerWaalsContact C-N 3.29Å; V513-V515 PolarHBondContact O-N 3.49Å
514	G	83.8	Confident	93.4	Very high	19 Å²	19	29 Å²	29	20%	0.196	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	-19.2	-179.5	0	0	0	0	0	114.8	R211 V512	R211-G514 PolarHBondContact NH2-O 3.48Å; V512-G514 PolarHBondContact O-N 3.25Å
515	V	90.1	Very high	93.1	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.024	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-38.6	-180	179.3	0	0	0	0	112.3	D207 H210 R211 R214 V512 V513 T518	D207-V515 HydrophobicContact CB-CG2 3.92Å; H210-V515 HydrophobicContact CB-CG1 3.83Å; R211-V515 HydrophobicContact CG-CG1 4.17Å; R214-V515 PolarHBondContact NH2-O 3.35Å; V512-V515 HydrophobicContact CB-CB 4.2Å; V512-V515 HydrophobicContact CG1-CB 4.23Å; V512-V515 HydrophobicContact CG1-CG2 4.26Å; V512-V515 PolarHBondContact O-N 2.96Å; V513-V515 VanDerWaalsContact C-N 3.29Å; V513-V515 PolarHBondContact O-N 3.49Å; V515-T518 HydrophobicContact CG1-CG2 3.84Å
516	G	91.9	Very high	92.6	Very high	15 Å²	15	30.6 Å²	30.6	16%	0.155	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	102.2	-151.6	-175.4	0	0	0	0	0	113	V512 T518	V512-G516 PolarHBondContact N-O 3.01Å; V512-G516 PolarHBondContact O-N 3.39Å; G516-T518 PolarHBondContact O-N 3.44Å
517	D	96	Very high	92.2	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.011	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	111.4	-171.9	-71.6	-45.5	0	0	0	112.3	R214 W267 S268 L269 K274 T509	R214-D517 VanDerWaalsContact NH1-C 3.28Å; R214-D517 PolarHBondContact NH1-O 2.89Å; W267-D517 PolarHBondContact O-N 3.09Å; S268-D517 WeakPolarHBondContact CA-OD2 3.36Å; S268-D517 PolarHBondContact OG-OD2 3.07Å; L269-D517 HydrophobicContact CB-CB 4.26Å; L269-D517 PolarHBondContact N-OD2 3Å; K274-D517 VanDerWaalsContact CE-OD1 3.32Å; K274-D517 WeakPolarHBondContact CE-OD1 3.15Å; K274-D517 WeakPolarHBondContact CE-OD2 3.5Å; K274-D517 VanDerWaalsContact NZ-CG 3.33Å; K274-D517 IonicContact NZ-OD1 2.95Å; K274-D517 PolarHBondContact NZ-OD1 3.45Å; K274-D517 IonicContact NZ-OD2 3.77Å; K274-D517 PolarHBondContact NZ-OD2 2.97Å; K274-D517 VanDerWaalsContact NZ-OD2 3.15Å; T509-D517 HydrophobicContact CG2-CB 3.7Å
518	T	95.7	Very high	91.6	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.018	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	159.4	-177.8	65.1	0	0	0	0	111.7	H210 Y218 T509 V510 V512 V515 G516 S520 Q523	H210-T518 HydrophobicContact CB-CG2 4.19Å; Y218-T518 VanDerWaalsContact OH-C 3.24Å; Y218-T518 PolarHBondContact OH-O 3.13Å; T509-T518 WeakPolarHBondContact CA-O 3.45Å; V510-T518 PolarHBondContact N-O 2.77Å; V510-T518 PolarHBondContact O-N 2.94Å; V510-T518 PolarHBondContact O-OG1 2.97Å; V512-T518 HydrophobicContact CG2-CG2 4.18Å; V512-T518 VanDerWaalsContact CG2-OG1 3.3Å; V512-T518 WeakPolarHBondContact CG2-OG1 3.23Å; V515-T518 HydrophobicContact CG1-CG2 3.84Å; G516-T518 PolarHBondContact O-N 3.44Å; T518-S520 PolarHBondContact O-N 3.33Å; T518-Q523 PolarHBondContact OG1-NE2 3.19Å
519	C	96.4	Very high	91.2	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.007	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	131.1	174.9	-175.8	0	0	0	0	110.4	N217 Y218 F521 A522	N217-C519 HydrophobicContact CB-CB 4.25Å; Y218-C519 HydrophobicContact CD1-CB 3.74Å; Y218-C519 HydrophobicContact CD2-CB 4.35Å; Y218-C519 HydrophobicContact CE1-CB 3.68Å; Y218-C519 HydrophobicContact CE2-CB 4.28Å; Y218-C519 HydrophobicContact CG-CB 4.09Å; Y218-C519 PolarHBondContact OH-N 3.28Å; C519-F521 VanDerWaalsContact C-N 3.31Å; C519-F521 PolarHBondContact O-N 3.49Å; C519-A522 HydrophobicContact CB-CB 4.27Å; C519-A522 WeakPolarHBondContact O-CB 3.36Å; C519-A522 PolarHBondContact O-N 3.44Å
520	S	94.8	Very high	90.6	Very high	4 Å²	4	32.7 Å²	32.7	3%	0.028	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-56.6	-42	-177.7	-162.6	0	0	0	0	113	F508 V510 T518 A522 Q523 H529	F508-S520 WeakPolarHBondContact O-CB 3.27Å; F508-S520 PolarHBondContact O-N 2.8Å; V510-S520 WeakPolarHBondContact CG2-OG 3.49Å; T518-S520 PolarHBondContact O-N 3.33Å; S520-A522 PolarHBondContact O-N 3.01Å; S520-Q523 WeakPolarHBondContact O-CB 3.15Å; S520-Q523 PolarHBondContact O-N 3.46Å; S520-Q523 VanDerWaalsContact O-N 3.09Å; S520-H529 PolarHBondContact OG-CE1 3.13Å; S520-H529 PolarHBondContact OG-NE2 3.2Å
521	F	94.1	Very high	90.1	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.009	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-62.8	-28	176.6	-61.2	-74.9	0	0	0	113.5	A221 F343 F504 F508 C519 Q523 M524 H529 Q546 A548	A221-F521 HydrophobicContact CB-CD2 3.78Å; A221-F521 HydrophobicContact CB-CE2 4.36Å; F343-F521 HydrophobicContact CD1-CB 4.24Å; F343-F521 HydrophobicContact CD2-CB 4.2Å; F343-F521 HydrophobicContact CE1-CB 3.72Å; F343-F521 HydrophobicContact CE2-CB 3.66Å; F343-F521 HydrophobicContact CE2-CG 4.42Å; F343-F521 HydrophobicContact CG-CB 4.47Å; F343-F521 HydrophobicContact CZ-CB 3.39Å; F343-F521 HydrophobicContact CZ-CG 4.03Å; F504-F521 HydrophobicContact CE2-CE2 4.01Å; F508-F521 HydrophobicContact CB-CE2 4.09Å; F508-F521 HydrophobicContact CD1-CD2 4.37Å; F508-F521 HydrophobicContact CD1-CE1 4.48Å; F508-F521 AromaticContact CD1-CE2 3.48Å; F508-F521 HydrophobicContact CD1-CE2 3.48Å; F508-F521 VanDerWaalsContact CD1-CE2 3.48Å; F508-F521 AromaticContact CD1-CZ 3.53Å; F508-F521 HydrophobicContact CD1-CZ 3.53Å; F508-F521 HydrophobicContact CD2-CE2 4.25Å; F508-F521 HydrophobicContact CE1-CE1 4.33Å; F508-F521 AromaticContact CE1-CE2 3.88Å; F508-F521 HydrophobicContact CE1-CE2 3.88Å; F508-F521 AromaticContact CE1-CZ 3.44Å; F508-F521 HydrophobicContact CE1-CZ 3.44Å; F508-F521 VanDerWaalsContact CE1-CZ 3.44Å; F508-F521 AromaticContact CG-CE2 3.69Å; F508-F521 HydrophobicContact CG-CE2 3.69Å; F508-F521 HydrophobicContact CG-CZ 4.15Å; F508-F521 HydrophobicContact CZ-CE2 4.41Å; F508-F521 AromaticContact CZ-CZ 3.98Å; F508-F521 HydrophobicContact CZ-CZ 3.98Å; C519-F521 VanDerWaalsContact C-N 3.31Å; C519-F521 PolarHBondContact O-N 3.49Å; F521-Q523 PolarHBondContact O-N 3.14Å; F521-M524 PolarHBondContact O-N 2.97Å; F521-M524 VanDerWaalsContact O-N 3.08Å; F521-H529 HydrophobicContact CD1-CB 3.79Å; F521-H529 AromaticContact CD1-CD2 3.54Å; F521-H529 AromaticContact CD1-CG 3.79Å; F521-H529 HydrophobicContact CE1-CB 3.97Å; F521-H529 AromaticContact CE1-CD2 3.35Å; F521-H529 WeakPolarHBondContact CE1-CD2 3.33Å; F521-H529 AromaticContact CE1-CG 3.93Å; F521-H529 AromaticContact CZ-CD2 3.92Å; F521-Q546 VanDerWaalsContact CE1-O 3.26Å; F521-Q546 WeakPolarHBondContact CE1-O 3.42Å; F521-A548 HydrophobicContact CD1-CB 4.01Å; F521-A548 HydrophobicContact CE1-CB 4.19Å
522	A	94.7	Very high	89.6	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-77.1	-3.6	178.5	0	0	0	0	0	113.5	H210 N217 F343 N344 C519 S520	H210-A522 PolarHBondContact NE2-O 3.11Å; N217-A522 HydrophobicContact CB-CB 3.89Å; N217-A522 WeakPolarHBondContact ND2-CB 3.45Å; F343-A522 HydrophobicContact CB-CB 4.45Å; F343-A522 HydrophobicContact CD1-CB 4.41Å; N344-A522 PolarHBondContact ND2-O 2.96Å; C519-A522 HydrophobicContact CB-CB 4.27Å; C519-A522 WeakPolarHBondContact O-CB 3.36Å; C519-A522 PolarHBondContact O-N 3.44Å; S520-A522 PolarHBondContact O-N 3.01Å
523	Q	92.1	Very high	89.1	Confident	50 Å²	50	31.1 Å²	31.1	23%	0.234	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-75.4	-12.4	165	-62.6	-55.2	-40.9	0	0	112.4	H210 T518 S520 F521 D525	H210-Q523 PolarHBondContact CE1-NE2 3.29Å; T518-Q523 PolarHBondContact OG1-NE2 3.19Å; S520-Q523 WeakPolarHBondContact O-CB 3.15Å; S520-Q523 PolarHBondContact O-N 3.46Å; S520-Q523 VanDerWaalsContact O-N 3.09Å; F521-Q523 PolarHBondContact O-N 3.14Å; Q523-D525 HydrophobicContact CB-CB 4.47Å; Q523-D525 PolarHBondContact O-N 3.34Å
524	M	92.3	Very high	88.8	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.005	13%	0.132	C	C	.	.			trans	55.3	34.3	-178.1	-56.6	163.8	173.2	0	0	112.1	F343 N344 F521 V526 L557 F560	F343-M524 HydrophobicContact CB-CE 4.37Å; F343-M524 WeakPolarHBondContact O-CE 3.4Å; N344-M524 HydrophobicContact CB-CE 3.6Å; N344-M524 VanDerWaalsContact ND2-CE 3.27Å; N344-M524 WeakPolarHBondContact ND2-CE 3.34Å; F521-M524 PolarHBondContact O-N 2.97Å; F521-M524 VanDerWaalsContact O-N 3.08Å; M524-V526 PolarHBondContact O-N 3.32Å; M524-L557 HydrophobicContact CB-CB 4.08Å; M524-L557 HydrophobicContact CB-CD1 4.11Å; M524-L557 HydrophobicContact SD-CD1 4.43Å; M524-F560 HydrophobicContact CE-CB 3.58Å; M524-F560 HydrophobicContact CE-CD2 4.01Å; M524-F560 HydrophobicContact CE-CG 3.83Å; M524-F560 HydrophobicContact SD-CB 3.79Å; M524-F560 HydrophobicContact SD-CD1 4.4Å; M524-F560 HydrophobicContact SD-CG 4.07Å
525	D	88.2	Confident	88.6	Confident	28 Å²	28	25 Å²	25	15%	0.15	12%	0.124	C	C	.	.			trans	-80.9	103.1	-179.5	-173.2	-16.5	0	0	0	110.1	Q523 R527 Q528 H529	Q523-D525 HydrophobicContact CB-CB 4.47Å; Q523-D525 PolarHBondContact O-N 3.34Å; D525-R527 PolarHBondContact O-N 3.13Å; D525-R527 WeakPolarHBondContact OD1-CB 3.43Å; D525-R527 PolarHBondContact OD1-N 2.92Å; D525-Q528 HydrophobicContact CB-CB 4.4Å; D525-Q528 PolarHBondContact O-N 3.29Å; D525-Q528 PolarHBondContact OD1-N 3.33Å; D525-Q528 WeakPolarHBondContact OD2-CG 3.34Å; D525-Q528 PolarHBondContact OD2-NE2 2.74Å; D525-H529 PolarHBondContact O-N 3.36Å
526	V	87.3	Confident	87.5	Confident	7 Å²	7	26.4 Å²	26.4	4%	0.042	14%	0.135	C	C	.	.	H	α-helix	trans	-64.1	-29.1	-178.9	-176.5	0	0	0	0	111.8	M524 G530 L535 T553 L557 F576	M524-V526 PolarHBondContact O-N 3.32Å; V526-G530 WeakPolarHBondContact O-CA 3.47Å; V526-G530 PolarHBondContact O-N 2.91Å; V526-L535 HydrophobicContact CG1-CD1 3.48Å; V526-L535 VanDerWaalsContact CG1-CD1 3.48Å; V526-L535 HydrophobicContact CG1-CD2 3.46Å; V526-L535 VanDerWaalsContact CG1-CD2 3.46Å; V526-L535 HydrophobicContact CG1-CG 4.1Å; V526-T553 HydrophobicContact CG2-CG2 4.41Å; V526-L557 HydrophobicContact CG2-CD2 3.6Å; V526-F576 HydrophobicContact CG1-CD2 4.36Å; V526-F576 HydrophobicContact CG1-CG 4.39Å; V526-F576 HydrophobicContact CG2-CB 4.48Å; V526-F576 HydrophobicContact CG2-CD1 4.19Å; V526-F576 HydrophobicContact CG2-CG 4.28Å
527	R	85.1	Confident	86	Confident	100 Å²	100	31 Å²	31	38%	0.377	17%	0.171	S	C	.	.	H	α-helix	trans	-76.5	-41.7	-178.1	-173	179.3	173.5	-168.6	-6.2	111.5	D525 T540 E541 E572	D525-R527 PolarHBondContact O-N 3.13Å; D525-R527 WeakPolarHBondContact OD1-CB 3.43Å; D525-R527 PolarHBondContact OD1-N 2.92Å; R527-T540 PolarHBondContact O-OG1 2.96Å; R527-E541 HydrophobicContact CG-CG 4.23Å; R527-E541 IonicContact CZ-OE1 2.71Å; R527-E541 IonicContact CZ-OE2 3.62Å; R527-E541 VanDerWaalsContact NE-CD 3.26Å; R527-E541 IonicContact NE-OE1 3.21Å; R527-E541 PolarHBondContact NE-OE1 3.48Å; R527-E541 IonicContact NE-OE2 3.08Å; R527-E541 PolarHBondContact NE-OE2 3.43Å; R527-E541 IonicContact NH2-OE1 2.82Å; R527-E541 PolarHBondContact NH2-OE1 3.26Å; R527-E541 IonicContact NH2-OE2 3.91Å; R527-E541 PolarHBondContact O-N 2.83Å; R527-E572 WeakPolarHBondContact CB-OE2 3.49Å; R527-E572 VanDerWaalsContact CD-CD 3.5Å; R527-E572 WeakPolarHBondContact CD-OE1 3.47Å; R527-E572 VanDerWaalsContact CD-OE2 3.25Å; R527-E572 WeakPolarHBondContact CD-OE2 3.41Å; R527-E572 IonicContact CZ-OE1 3.88Å; R527-E572 IonicContact NE-OE1 3.47Å; R527-E572 IonicContact NH1-OE1 3.53Å; R527-E572 PolarHBondContact NH1-OE1 2.9Å
528	Q	82.6	Confident	84.4	Confident	103 Å²	103	34.8 Å²	34.8	48%	0.481	21%	0.211	S	C	.	.	H	α-helix	trans	-85.5	-31.4	-176.8	-66.7	-177.8	27.2	0	0	114	D525 A542	D525-Q528 HydrophobicContact CB-CB 4.4Å; D525-Q528 PolarHBondContact O-N 3.29Å; D525-Q528 PolarHBondContact OD1-N 3.33Å; D525-Q528 WeakPolarHBondContact OD2-CG 3.34Å; D525-Q528 PolarHBondContact OD2-NE2 2.74Å; Q528-A542 WeakPolarHBondContact O-CB 3.48Å
529	H	86.6	Confident	83	Confident	6 Å²	6	38 Å²	38	3%	0.028	23%	0.225	C	C	.	.	H	α-helix	trans	-129.9	9.1	-173.4	-51.4	84.8	0	0	0	113.5	F508 S520 F521 D525 Q546 A548 T553	F508-H529 AromaticContact CD1-NE2 3.92Å; S520-H529 PolarHBondContact OG-CE1 3.13Å; S520-H529 PolarHBondContact OG-NE2 3.2Å; F521-H529 HydrophobicContact CD1-CB 3.79Å; F521-H529 AromaticContact CD1-CD2 3.54Å; F521-H529 AromaticContact CD1-CG 3.79Å; F521-H529 HydrophobicContact CE1-CB 3.97Å; F521-H529 AromaticContact CE1-CD2 3.35Å; F521-H529 WeakPolarHBondContact CE1-CD2 3.33Å; F521-H529 AromaticContact CE1-CG 3.93Å; F521-H529 AromaticContact CZ-CD2 3.92Å; D525-H529 PolarHBondContact O-N 3.36Å; H529-Q546 PolarHBondContact CD2-O 3.27Å; H529-Q546 VanDerWaalsContact CD2-O 3.28Å; H529-A548 PolarHBondContact O-N 3.44Å; H529-T553 PolarHBondContact O-OG1 3.25Å
530	G	83.8	Confident	82.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.234	C	C	.	.			trans	-72.6	147.6	178.3	0	0	0	0	0	112.5	V526 T540 E554	V526-G530 WeakPolarHBondContact O-CA 3.47Å; V526-G530 PolarHBondContact O-N 2.91Å; G530-T540 PolarHBondContact O-OG1 3.47Å; G530-E554 WeakPolarHBondContact CA-OE1 3.35Å
531	H	85.1	Confident	81.3	Confident	20 Å²	20	45.5 Å²	45.5	9%	0.093	26%	0.262	C	S	.	.			trans	-89.7	125.4	-179.3	-163.7	-82	0	0	0	110.1	Q533 W534 L535 A548 E554	H531-Q533 PolarHBondContact CE1-OE1 3.46Å; H531-Q533 PolarHBondContact ND1-N 3.44Å; H531-Q533 PolarHBondContact O-N 2.82Å; H531-Q533 VanDerWaalsContact O-N 3.12Å; H531-W534 HydrophobicContact CB-CB 4.4Å; H531-W534 HydrophobicContact CB-CG 4.34Å; H531-W534 AromaticContact CG-CD1 3.74Å; H531-W534 AromaticContact ND1-CD1 3.46Å; H531-W534 PolarHBondContact O-N 2.89Å; H531-L535 PolarHBondContact O-N 3.35Å; H531-A548 PolarHBondContact CD2-O 3.47Å; H531-E554 PolarHBondContact N-OE1 3.48Å
532	P	83.3	Confident	80.6	Confident	66 Å²	66	46.2 Å²	46.2	43%	0.429	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-28.8	-172.6	24.4	-33.4	0	0	0	112.9	W534 T540	P532-W534 VanDerWaalsContact C-N 3.3Å; P532-W534 PolarHBondContact O-N 2.98Å; P532-T540 HydrophobicContact CB-CG2 3.92Å
533	Q	80.3	Confident	80	Confident	99 Å²	99	48.9 Å²	48.9	46%	0.463	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-11.6	177.7	-56.7	175.9	-13.8	0	0	114.3	H531 H717 Q720	H531-Q533 PolarHBondContact CE1-OE1 3.46Å; H531-Q533 PolarHBondContact ND1-N 3.44Å; H531-Q533 PolarHBondContact O-N 2.82Å; H531-Q533 VanDerWaalsContact O-N 3.12Å; Q533-H717 PolarHBondContact O-ND1 3.21Å; Q533-H717 PolarHBondContact OE1-CE1 3.04Å; Q533-Q720 PolarHBondContact O-OE1 2.94Å; Q533-Q720 VanDerWaalsContact O-OE1 3.11Å
534	W	80.8	Confident	79.5	Confident	8 Å²	8	52.2 Å²	52.2	3%	0.03	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-10.5	178.2	-69.4	74.5	0	0	0	112	H531 P532 E554 L555 M713 H714 H717	H531-W534 HydrophobicContact CB-CB 4.4Å; H531-W534 HydrophobicContact CB-CG 4.34Å; H531-W534 AromaticContact CG-CD1 3.74Å; H531-W534 AromaticContact ND1-CD1 3.46Å; H531-W534 PolarHBondContact O-N 2.89Å; P532-W534 VanDerWaalsContact C-N 3.3Å; P532-W534 PolarHBondContact O-N 2.98Å; W534-E554 HydrophobicContact CB-CG 4.4Å; W534-L555 HydrophobicContact CH2-CD1 4.36Å; W534-L555 HydrophobicContact CZ3-CD1 4.06Å; W534-L555 HydrophobicContact CZ3-CG 4.47Å; W534-M713 HydrophobicContact CE3-CB 4.42Å; W534-M713 HydrophobicContact CE3-CE 4.23Å; W534-M713 HydrophobicContact CZ3-CB 4.19Å; W534-H714 AromaticContact CH2-CD2 3.89Å; W534-H714 AromaticContact CH2-CE1 3.59Å; W534-H714 AromaticContact CH2-ND1 3.95Å; W534-H714 AromaticContact CH2-NE2 3.56Å; W534-H717 HydrophobicContact CD2-CB 4.47Å
535	L	80.4	Confident	79.1	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.031	33%	0.331	C	S	.	.	S	Bend	trans	-113	166	-177.3	-65.9	169.7	0	0	0	110.9	V526 H531 Q539 T540 E554 F576 Q720	V526-L535 HydrophobicContact CG1-CD1 3.48Å; V526-L535 VanDerWaalsContact CG1-CD1 3.48Å; V526-L535 HydrophobicContact CG1-CD2 3.46Å; V526-L535 VanDerWaalsContact CG1-CD2 3.46Å; V526-L535 HydrophobicContact CG1-CG 4.1Å; H531-L535 PolarHBondContact O-N 3.35Å; L535-Q539 HydrophobicContact CB-CB 4.31Å; L535-T540 HydrophobicContact CD1-CG2 4.19Å; L535-E554 HydrophobicContact CD2-CG 3.96Å; L535-E554 HydrophobicContact CG-CG 4.31Å; L535-F576 HydrophobicContact CD2-CD2 3.55Å; L535-F576 HydrophobicContact CD2-CE2 3.38Å; L535-F576 HydrophobicContact CD2-CZ 4.32Å; L535-Q720 PolarHBondContact O-NE2 2.85Å
536	S	67	Low	79	Confident	34 Å²	34	60.1 Å²	60.1	24%	0.238	34%	0.343	C	S	.	.			trans	-78.2	148.6	169.1	-60.7	0	0	0	0	110	G538 Q539 F579	S536-G538 PolarHBondContact O-N 3.38Å; S536-Q539 VanDerWaalsContact N-OE1 3.12Å; S536-Q539 WeakPolarHBondContact O-CB 3.47Å; S536-Q539 WeakPolarHBondContact O-CG 3.45Å; S536-Q539 PolarHBondContact O-N 3.19Å; S536-F579 VanDerWaalsContact OG-CE1 3.29Å; S536-F579 WeakPolarHBondContact OG-CE1 3.41Å; S536-F579 WeakPolarHBondContact OG-CZ 3.35Å
537	A	59.6	Low	79	Confident	110 Å²	110	61 Å²	61	91%	0.909	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	129.1	-176.2	0	0	0	0	0	112.2
538	G	61.7	Low	79	Confident	83 Å²	83	56.3 Å²	56.3	86%	0.856	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.7	6.1	177.1	0	0	0	0	0	116.6	S536	S536-G538 PolarHBondContact O-N 3.38Å
539	Q	67.8	Low	79.2	Confident	69 Å²	69	55 Å²	55	32%	0.322	32%	0.323	S	S	.	.	S	Bend	trans	-93.3	-9.4	-179.8	-68.1	-178.6	-30.5	0	0	115.1	L535 S536	L535-Q539 HydrophobicContact CB-CB 4.31Å; S536-Q539 VanDerWaalsContact N-OE1 3.12Å; S536-Q539 WeakPolarHBondContact O-CB 3.47Å; S536-Q539 WeakPolarHBondContact O-CG 3.45Å; S536-Q539 PolarHBondContact O-N 3.19Å
540	T	76.8	Confident	79	Confident	30 Å²	30	56.5 Å²	56.5	18%	0.184	33%	0.331	C	S	.	.			trans	-124.9	138.3	177.9	-178.8	0	0	0	0	110.7	R527 G530 P532 L535 A542	R527-T540 PolarHBondContact O-OG1 2.96Å; G530-T540 PolarHBondContact O-OG1 3.47Å; P532-T540 HydrophobicContact CB-CG2 3.92Å; L535-T540 HydrophobicContact CD1-CG2 4.19Å; T540-A542 VanDerWaalsContact OG1-CB 3.26Å; T540-A542 WeakPolarHBondContact OG1-CB 3.39Å; T540-A542 PolarHBondContact OG1-N 3.39Å; T540-A542 VanDerWaalsContact OG1-N 3.15Å
541	E	78.2	Confident	79.2	Confident	133 Å²	133	56.5 Å²	56.5	62%	0.621	33%	0.331	S	S	*	.			trans	-101.2	3.5	172.3	-65.9	176.3	-171.4	0	0	111.2	R527 S543	R527-E541 HydrophobicContact CG-CG 4.23Å; R527-E541 IonicContact CZ-OE1 2.71Å; R527-E541 IonicContact CZ-OE2 3.62Å; R527-E541 VanDerWaalsContact NE-CD 3.26Å; R527-E541 IonicContact NE-OE1 3.21Å; R527-E541 PolarHBondContact NE-OE1 3.48Å; R527-E541 IonicContact NE-OE2 3.08Å; R527-E541 PolarHBondContact NE-OE2 3.43Å; R527-E541 IonicContact NH2-OE1 2.82Å; R527-E541 PolarHBondContact NH2-OE1 3.26Å; R527-E541 IonicContact NH2-OE2 3.91Å; R527-E541 PolarHBondContact O-N 2.83Å; E541-S543 PolarHBondContact O-N 3.49Å
542	A	78.3	Confident	79.5	Confident	18 Å²	18	55.6 Å²	55.6	15%	0.149	33%	0.327	C	S	.	.			trans	-67.9	130	-175.5	0	0	0	0	0	112	Q528 T540 Q546 Q547	Q528-A542 WeakPolarHBondContact O-CB 3.48Å; T540-A542 VanDerWaalsContact OG1-CB 3.26Å; T540-A542 WeakPolarHBondContact OG1-CB 3.39Å; T540-A542 PolarHBondContact OG1-N 3.39Å; T540-A542 VanDerWaalsContact OG1-N 3.15Å; A542-Q546 HydrophobicContact CB-CB 4.46Å; A542-Q547 HydrophobicContact CB-CB 4.04Å
543	S	82.9	Confident	80	Confident	55 Å²	55	52.4 Å²	52.4	39%	0.385	31%	0.306	S	S	.	.			trans	-72.6	165.4	164.7	64.9	0	0	0	0	111.6	E541 Y545 Q546 Q547	E541-S543 PolarHBondContact O-N 3.49Å; S543-Y545 PolarHBondContact O-N 2.91Å; S543-Y545 VanDerWaalsContact O-N 3.12Å; S543-Q546 PolarHBondContact O-N 3.18Å; S543-Q546 WeakPolarHBondContact OG-CG 3.36Å; S543-Q546 PolarHBondContact OG-N 2.91Å; S543-Q546 PolarHBondContact OG-OE1 3.16Å; S543-Q547 PolarHBondContact O-N 3.43Å
544	V	82.3	Confident	80.5	Confident	121 Å²	121	47.7 Å²	47.7	73%	0.733	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-34.8	176.6	-179	0	0	0	0	112.1	Q547	V544-Q547 WeakPolarHBondContact O-CG 3.38Å
545	Y	83.7	Confident	81.1	Confident	107 Å²	107	47.3 Å²	47.3	42%	0.42	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-31.6	176.8	-177.7	-102.7	0	0	0	112.6	K225 F508 S543	K225-Y545 PolarHBondContact NZ-O 3.44Å; F508-Y545 HydrophobicContact CE2-CD1 4.16Å; F508-Y545 AromaticContact CE2-CE1 3.43Å; F508-Y545 HydrophobicContact CE2-CE1 3.43Å; F508-Y545 VanDerWaalsContact CE2-CE1 3.43Å; F508-Y545 AromaticContact CE2-CZ 3.78Å; F508-Y545 AromaticContact CZ-CD1 3.87Å; F508-Y545 HydrophobicContact CZ-CD1 3.87Å; F508-Y545 AromaticContact CZ-CE1 3.62Å; F508-Y545 HydrophobicContact CZ-CE1 3.62Å; F508-Y545 WeakPolarHBondContact CZ-O 3.42Å; S543-Y545 PolarHBondContact O-N 2.91Å; S543-Y545 VanDerWaalsContact O-N 3.12Å
546	Q	85.3	Confident	81.8	Confident	88 Å²	88	47 Å²	47	41%	0.411	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-25.4	-174.4	-72.6	164.9	-36.7	0	0	114.6	F508 F521 H529 A542 S543	F508-Q546 HydrophobicContact CE1-CB 4.35Å; F508-Q546 HydrophobicContact CE1-CG 4.18Å; F508-Q546 HydrophobicContact CZ-CG 4.34Å; F521-Q546 VanDerWaalsContact CE1-O 3.26Å; F521-Q546 WeakPolarHBondContact CE1-O 3.42Å; H529-Q546 PolarHBondContact CD2-O 3.27Å; H529-Q546 VanDerWaalsContact CD2-O 3.28Å; A542-Q546 HydrophobicContact CB-CB 4.46Å; S543-Q546 PolarHBondContact O-N 3.18Å; S543-Q546 WeakPolarHBondContact OG-CG 3.36Å; S543-Q546 PolarHBondContact OG-N 2.91Å; S543-Q546 PolarHBondContact OG-OE1 3.16Å
547	Q	86.7	Confident	83	Confident	26 Å²	26	45.4 Å²	45.4	12%	0.121	27%	0.27	C	S	.	.	S	Bend	trans	-64.6	146.9	-179.8	67	-175.5	6.7	0	0	112.7	K225 A542 S543 V544	K225-Q547 WeakPolarHBondContact CE-O 3.41Å; K225-Q547 PolarHBondContact NZ-O 2.91Å; A542-Q547 HydrophobicContact CB-CB 4.04Å; S543-Q547 PolarHBondContact O-N 3.43Å; V544-Q547 WeakPolarHBondContact O-CG 3.38Å
548	A	86.1	Confident	84.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-76.9	142.1	168.6	0	0	0	0	0	110.9	F521 H529 H531 K552 T553	F521-A548 HydrophobicContact CD1-CB 4.01Å; F521-A548 HydrophobicContact CE1-CB 4.19Å; H529-A548 PolarHBondContact O-N 3.44Å; H531-A548 PolarHBondContact CD2-O 3.47Å; A548-K552 HydrophobicContact CB-CB 4.17Å; A548-T553 WeakPolarHBondContact CB-OG1 3.36Å
549	E	86.4	Confident	86.1	Confident	76 Å²	76	37 Å²	37	36%	0.355	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-79.5	155.6	177.9	-57.2	-176.2	-173.8	0	0	110.9	N224 G551 K552	N224-E549 PolarHBondContact ND2-O 3.39Å; N224-E549 VanDerWaalsContact O-OE2 3.13Å; N224-E549 WeakPolarHBondContact OD1-CB 3.47Å; N224-E549 PolarHBondContact OD1-N 2.9Å; N224-E549 VanDerWaalsContact OD1-N 3.16Å; E549-G551 VanDerWaalsContact C-N 3.26Å; E549-G551 PolarHBondContact O-N 3.43Å; E549-K552 WeakPolarHBondContact O-CG 3.3Å; E549-K552 PolarHBondContact O-N 3.19Å
550	D	83.8	Confident	87.3	Confident	37 Å²	37	33.8 Å²	33.8	20%	0.198	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	57.7	27.4	176.4	-55.6	-32.1	0	0	0	115.6	Y339 K552	Y339-D550 VanDerWaalsContact CE2-OD2 3.25Å; Y339-D550 WeakPolarHBondContact CE2-OD2 3.07Å; Y339-D550 VanDerWaalsContact CZ-OD2 3.26Å; Y339-D550 PolarHBondContact OH-OD2 3.37Å; D550-K552 PolarHBondContact O-N 3.49Å
551	G	87.1	Confident	88.1	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	65.2	26	179	0	0	0	0	0	113.8	E549 T553 E554 L555	E549-G551 VanDerWaalsContact C-N 3.26Å; E549-G551 PolarHBondContact O-N 3.43Å; G551-T553 VanDerWaalsContact C-N 3.33Å; G551-T553 PolarHBondContact O-N 3.42Å; G551-E554 VanDerWaalsContact C-OE2 3.25Å; G551-E554 WeakPolarHBondContact CA-OE2 3.26Å; G551-E554 PolarHBondContact O-N 3.28Å; G551-L555 PolarHBondContact O-N 3.13Å; G551-L555 VanDerWaalsContact O-N 3.09Å
552	K	92	Very high	88.6	Confident	1 Å²	1	28.5 Å²	28.5	0%	0.004	15%	0.152	C	C	.	.	H	α-helix	trans	-59.4	-39.8	-176.4	-80.4	-150.1	176.2	-161.2	0	113.4	V220 N224 C338 Y339 R341 F343 Y447 A548 E549 D550 S556	V220-K552 HydrophobicContact CG1-CD 4.44Å; N224-K552 HydrophobicContact CB-CD 4.35Å; N224-K552 VanDerWaalsContact ND2-CD 3.27Å; N224-K552 WeakPolarHBondContact ND2-CD 3.29Å; N224-K552 VanDerWaalsContact ND2-CE 3.31Å; N224-K552 WeakPolarHBondContact ND2-CE 3.46Å; C338-K552 PolarHBondContact O-NZ 3.31Å; Y339-K552 WeakPolarHBondContact O-CE 3.37Å; Y339-K552 PolarHBondContact O-NZ 2.87Å; R341-K552 PolarHBondContact O-NZ 3.26Å; F343-K552 HydrophobicContact CD2-CB 4.44Å; F343-K552 HydrophobicContact CE2-CB 3.96Å; F343-K552 HydrophobicContact CE2-CD 4.24Å; Y447-K552 HydrophobicContact CD1-CG 4.36Å; Y447-K552 HydrophobicContact CE1-CB 4.3Å; Y447-K552 HydrophobicContact CE1-CG 3.61Å; Y447-K552 WeakPolarHBondContact OH-CA 3.45Å; A548-K552 HydrophobicContact CB-CB 4.17Å; E549-K552 WeakPolarHBondContact O-CG 3.3Å; E549-K552 PolarHBondContact O-N 3.19Å; D550-K552 PolarHBondContact O-N 3.49Å; K552-S556 WeakPolarHBondContact O-CB 3.37Å; K552-S556 PolarHBondContact O-N 3.43Å; K552-S556 PolarHBondContact O-OG 3.26Å
553	T	92.4	Very high	89.2	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.1	-49	-178.1	-56.5	0	0	0	0	110.7	V526 H529 A548 G551 L557	V526-T553 HydrophobicContact CG2-CG2 4.41Å; H529-T553 PolarHBondContact O-OG1 3.25Å; A548-T553 WeakPolarHBondContact CB-OG1 3.36Å; G551-T553 VanDerWaalsContact C-N 3.33Å; G551-T553 PolarHBondContact O-N 3.42Å; T553-L557 WeakPolarHBondContact O-CB 3.31Å; T553-L557 PolarHBondContact O-N 3.33Å
554	E	91.6	Very high	89.5	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-67.4	-51.1	-176.5	-61.9	78.2	-175.1	0	0	111.2	G530 H531 W534 L535 G551 S556 L557 M558 F576 M713	G530-E554 WeakPolarHBondContact CA-OE1 3.35Å; H531-E554 PolarHBondContact N-OE1 3.48Å; W534-E554 HydrophobicContact CB-CG 4.4Å; L535-E554 HydrophobicContact CD2-CG 3.96Å; L535-E554 HydrophobicContact CG-CG 4.31Å; G551-E554 VanDerWaalsContact C-OE2 3.25Å; G551-E554 WeakPolarHBondContact CA-OE2 3.26Å; G551-E554 PolarHBondContact O-N 3.28Å; E554-S556 VanDerWaalsContact C-N 3.35Å; E554-S556 PolarHBondContact O-N 2.8Å; E554-L557 PolarHBondContact O-N 3.35Å; E554-M558 VanDerWaalsContact O-CG 3.28Å; E554-M558 WeakPolarHBondContact O-CG 3.18Å; E554-M558 PolarHBondContact O-N 3.17Å; E554-F576 HydrophobicContact CB-CE1 4.32Å; E554-F576 HydrophobicContact CB-CZ 3.95Å; E554-F576 HydrophobicContact CG-CE2 4.41Å; E554-F576 HydrophobicContact CG-CZ 4.02Å; E554-M713 HydrophobicContact CB-CE 4.43Å
555	L	92.7	Very high	89.8	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-67.8	-34.9	-178.9	-69.6	172.7	0	0	0	112	Y447 W534 G551 H559 M706 A710 M713	Y447-L555 HydrophobicContact CD1-CD1 3.87Å; Y447-L555 HydrophobicContact CE1-CB 4.08Å; Y447-L555 HydrophobicContact CE1-CD1 3.58Å; Y447-L555 HydrophobicContact CE1-CG 4.46Å; W534-L555 HydrophobicContact CH2-CD1 4.36Å; W534-L555 HydrophobicContact CZ3-CD1 4.06Å; W534-L555 HydrophobicContact CZ3-CG 4.47Å; G551-L555 PolarHBondContact O-N 3.13Å; G551-L555 VanDerWaalsContact O-N 3.09Å; L555-H559 VanDerWaalsContact O-CB 3.29Å; L555-H559 WeakPolarHBondContact O-CB 3.39Å; L555-H559 PolarHBondContact O-N 2.79Å; L555-M706 HydrophobicContact CB-CE 4.41Å; L555-M706 HydrophobicContact CD2-CE 4.14Å; L555-M706 WeakPolarHBondContact O-CE 3.41Å; L555-A710 HydrophobicContact CD2-CB 4.41Å; L555-M713 HydrophobicContact CD2-CB 4.3Å; L555-M713 HydrophobicContact CD2-CG 4.38Å
556	S	94.7	Very high	89.8	Confident	0 Å²	0	24 Å²	24	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-67.5	-40.7	173.4	-71.8	0	0	0	0	112.7	H342 F343 Y447 K552 E554 H559 F560	H342-S556 WeakPolarHBondContact CA-OG 3.39Å; H342-S556 WeakPolarHBondContact CB-OG 3.22Å; H342-S556 PolarHBondContact ND1-OG 3.44Å; F343-S556 PolarHBondContact N-OG 3.34Å; Y447-S556 PolarHBondContact OH-OG 3.35Å; K552-S556 WeakPolarHBondContact O-CB 3.37Å; K552-S556 PolarHBondContact O-N 3.43Å; K552-S556 PolarHBondContact O-OG 3.26Å; E554-S556 VanDerWaalsContact C-N 3.35Å; E554-S556 PolarHBondContact O-N 2.8Å; S556-H559 PolarHBondContact O-N 3.31Å; S556-F560 WeakPolarHBondContact O-CB 3.35Å; S556-F560 PolarHBondContact O-N 3.13Å
557	L	94.1	Very high	90.1	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.9	-47.5	174.9	177.3	58.8	0	0	0	111.3	M524 V526 T553 E554 F560 A561 W567 F576 L577	M524-L557 HydrophobicContact CB-CB 4.08Å; M524-L557 HydrophobicContact CB-CD1 4.11Å; M524-L557 HydrophobicContact SD-CD1 4.43Å; V526-L557 HydrophobicContact CG2-CD2 3.6Å; T553-L557 WeakPolarHBondContact O-CB 3.31Å; T553-L557 PolarHBondContact O-N 3.33Å; E554-L557 PolarHBondContact O-N 3.35Å; L557-F560 PolarHBondContact O-N 3.36Å; L557-A561 WeakPolarHBondContact O-CB 3.49Å; L557-A561 PolarHBondContact O-N 2.96Å; L557-W567 HydrophobicContact CD1-CH2 3.7Å; L557-W567 HydrophobicContact CD1-CZ3 3.89Å; L557-F576 HydrophobicContact CD2-CD1 3.78Å; L557-F576 HydrophobicContact CD2-CE1 4.34Å; L557-L577 HydrophobicContact CD2-CG 4.48Å
558	M	91.4	Very high	90.1	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.02	16%	0.158	C	C	.	.	H	α-helix	trans	-62.9	-46.9	178.9	-67.6	169.2	62.8	0	0	111.5	E554 F560 A561 I562 F576 L577 L580 M706 H709 M713	E554-M558 VanDerWaalsContact O-CG 3.28Å; E554-M558 WeakPolarHBondContact O-CG 3.18Å; E554-M558 PolarHBondContact O-N 3.17Å; M558-F560 VanDerWaalsContact C-N 3.31Å; M558-F560 PolarHBondContact O-N 2.94Å; M558-A561 PolarHBondContact O-N 2.9Å; M558-I562 WeakPolarHBondContact O-CB 3.42Å; M558-I562 WeakPolarHBondContact O-CD1 3.3Å; M558-I562 VanDerWaalsContact O-CG1 3.25Å; M558-I562 WeakPolarHBondContact O-CG1 3.48Å; M558-I562 PolarHBondContact O-N 3.4Å; M558-F576 HydrophobicContact CG-CE1 4.2Å; M558-F576 HydrophobicContact SD-CE1 4.32Å; M558-F576 HydrophobicContact SD-CZ 4.43Å; M558-L577 HydrophobicContact CG-CD2 3.81Å; M558-L580 HydrophobicContact CE-CD2 3.34Å; M558-L580 HydrophobicContact CG-CD2 4.31Å; M558-L580 HydrophobicContact SD-CD2 3.48Å; M558-L580 WeakPolarHBondContact SD-CD2 3.36Å; M558-M706 HydrophobicContact CB-CE 4.31Å; M558-M706 HydrophobicContact CB-SD 4.02Å; M558-H709 HydrophobicContact CE-CB 3.4Å; M558-H709 VanDerWaalsContact CE-CB 3.4Å; M558-M713 HydrophobicContact CE-CG 4.09Å; M558-M713 HydrophobicContact SD-CG 4.01Å; M558-M713 HydrophobicContact SD-SD 4.39Å
559	H	93.8	Very high	90.2	Very high	13 Å²	13	28.1 Å²	28.1	6%	0.06	17%	0.166	C	C	.	.	H	α-helix	trans	-56.3	-47.2	176.6	178.4	-90.9	0	0	0	111.5	H342 E345 E349 L555 S556 I562 T563 M706	H342-H559 AromaticContact CD2-CD2 3.67Å; H342-H559 AromaticContact CD2-CG 3.55Å; H342-H559 AromaticContact NE2-CD2 3.95Å; E345-H559 IonicContact OE1-CE1 3.86Å; E345-H559 IonicContact OE1-NE2 2.65Å; E349-H559 IonicContact OE2-CE1 3.17Å; L555-H559 VanDerWaalsContact O-CB 3.29Å; L555-H559 WeakPolarHBondContact O-CB 3.39Å; L555-H559 PolarHBondContact O-N 2.79Å; S556-H559 PolarHBondContact O-N 3.31Å; H559-I562 PolarHBondContact O-N 3.47Å; H559-T563 VanDerWaalsContact O-CB 3.28Å; H559-T563 WeakPolarHBondContact O-CB 3.04Å; H559-T563 PolarHBondContact O-N 3.02Å; H559-T563 PolarHBondContact O-OG1 3.39Å; H559-M706 HydrophobicContact CB-CE 4.02Å; H559-M706 HydrophobicContact CB-SD 4.17Å
560	F	94	Very high	90.3	Very high	1 Å²	1	27.8 Å²	27.8	0%	0.004	17%	0.171	C	C	.	.	H	α-helix	trans	-66.9	-42.9	-177.9	-168.2	-94.9	0	0	0	112.4	L206 Y209 N344 M524 S556 L557 M558 T563 N564 W567	L206-F560 HydrophobicContact CB-CE1 4.18Å; L206-F560 HydrophobicContact CB-CZ 4.08Å; L206-F560 HydrophobicContact CD1-CD1 4.48Å; L206-F560 HydrophobicContact CD1-CE1 3.81Å; L206-F560 HydrophobicContact CD1-CE2 4.17Å; L206-F560 HydrophobicContact CD1-CZ 3.64Å; L206-F560 HydrophobicContact CG-CZ 4.49Å; Y209-F560 AromaticContact CD1-CE2 3.82Å; Y209-F560 HydrophobicContact CD1-CE2 3.82Å; Y209-F560 AromaticContact CD2-CE2 3.6Å; Y209-F560 HydrophobicContact CD2-CE2 3.6Å; Y209-F560 AromaticContact CD2-CZ 3.83Å; Y209-F560 HydrophobicContact CD2-CZ 3.83Å; Y209-F560 AromaticContact CE1-CE2 3.96Å; Y209-F560 HydrophobicContact CE1-CE2 3.96Å; Y209-F560 AromaticContact CE2-CE2 3.76Å; Y209-F560 HydrophobicContact CE2-CE2 3.76Å; Y209-F560 HydrophobicContact CE2-CZ 4.07Å; Y209-F560 AromaticContact CG-CE2 3.64Å; Y209-F560 HydrophobicContact CG-CE2 3.64Å; Y209-F560 HydrophobicContact CG-CZ 4.23Å; Y209-F560 AromaticContact CZ-CE2 3.96Å; N344-F560 HydrophobicContact CB-CD2 3.99Å; N344-F560 HydrophobicContact CB-CE2 4.07Å; M524-F560 HydrophobicContact CE-CB 3.58Å; M524-F560 HydrophobicContact CE-CD2 4.01Å; M524-F560 HydrophobicContact CE-CG 3.83Å; M524-F560 HydrophobicContact SD-CB 3.79Å; M524-F560 HydrophobicContact SD-CD1 4.4Å; M524-F560 HydrophobicContact SD-CG 4.07Å; S556-F560 WeakPolarHBondContact O-CB 3.35Å; S556-F560 PolarHBondContact O-N 3.13Å; L557-F560 PolarHBondContact O-N 3.36Å; M558-F560 VanDerWaalsContact C-N 3.31Å; M558-F560 PolarHBondContact O-N 2.94Å; F560-T563 PolarHBondContact O-N 2.88Å; F560-N564 HydrophobicContact CE1-CB 4.49Å; F560-N564 WeakPolarHBondContact CE2-ND2 3.4Å; F560-N564 WeakPolarHBondContact O-CB 3.21Å; F560-N564 PolarHBondContact O-N 3.46Å; F560-N564 PolarHBondContact O-ND2 2.89Å; F560-W567 AromaticContact CD1-CD2 3.82Å; F560-W567 HydrophobicContact CD1-CD2 3.82Å; F560-W567 AromaticContact CD1-CE3 3.55Å; F560-W567 HydrophobicContact CD1-CE3 3.55Å; F560-W567 HydrophobicContact CD1-CG 4.43Å; F560-W567 HydrophobicContact CD1-CH2 4.19Å; F560-W567 HydrophobicContact CD1-CZ2 4.45Å; F560-W567 AromaticContact CD1-CZ3 3.74Å; F560-W567 HydrophobicContact CD1-CZ3 3.74Å; F560-W567 HydrophobicContact CE1-CB 4.26Å; F560-W567 AromaticContact CE1-CD2 3.58Å; F560-W567 HydrophobicContact CE1-CD2 3.58Å; F560-W567 AromaticContact CE1-CE2 3.94Å; F560-W567 AromaticContact CE1-CE3 3.82Å; F560-W567 HydrophobicContact CE1-CE3 3.82Å; F560-W567 AromaticContact CE1-CG 3.78Å; F560-W567 HydrophobicContact CE1-CG 3.78Å; F560-W567 HydrophobicContact CE1-CZ2 4.46Å; F560-W567 HydrophobicContact CE1-CZ3 4.34Å
561	A	91.7	Very high	90.5	Very high	24 Å²	24	37 Å²	37	20%	0.198	20%	0.203	C	C	.	.	H	α-helix	trans	-66.1	-36	178.1	0	0	0	0	0	113.1	L557 M558 W567 L577	L557-A561 WeakPolarHBondContact O-CB 3.49Å; L557-A561 PolarHBondContact O-N 2.96Å; M558-A561 PolarHBondContact O-N 2.9Å; A561-W567 HydrophobicContact CB-CE3 4.43Å; A561-W567 HydrophobicContact CB-CZ3 4.24Å; A561-L577 HydrophobicContact CB-CD1 3.85Å
562	I	89.7	Confident	90.3	Very high	27 Å²	27	40.6 Å²	40.6	14%	0.138	22%	0.22	C	C	.	.	H	α-helix	trans	-74.4	-39.1	177	-69	167.7	0	0	0	110.9	M558 H559 A702 E705 M706	M558-I562 WeakPolarHBondContact O-CB 3.42Å; M558-I562 WeakPolarHBondContact O-CD1 3.3Å; M558-I562 VanDerWaalsContact O-CG1 3.25Å; M558-I562 WeakPolarHBondContact O-CG1 3.48Å; M558-I562 PolarHBondContact O-N 3.4Å; H559-I562 PolarHBondContact O-N 3.47Å; I562-A702 HydrophobicContact CG2-CB 3.69Å; I562-A702 WeakPolarHBondContact CG2-O 3.18Å; I562-E705 HydrophobicContact CD1-CG 4.28Å; I562-M706 HydrophobicContact CD1-CB 4.04Å; I562-M706 HydrophobicContact CD1-SD 3.87Å
563	T	89.9	Confident	90.1	Very high	34 Å²	34	40.7 Å²	40.7	21%	0.209	22%	0.221	C	C	.	.	H	α-helix	trans	-72.5	-36.3	-179.5	-56.6	0	0	0	0	112.2	H559 F560 P565	H559-T563 VanDerWaalsContact O-CB 3.28Å; H559-T563 WeakPolarHBondContact O-CB 3.04Å; H559-T563 PolarHBondContact O-N 3.02Å; H559-T563 PolarHBondContact O-OG1 3.39Å; F560-T563 PolarHBondContact O-N 2.88Å; T563-P565 WeakPolarHBondContact O-CD 3.22Å
564	N	90.7	Very high	89.9	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.011	24%	0.238	C	C	.	.			trans	-119.8	79	-176.6	-53.4	-81.7	0	0	0	110.3	Q181 Y209 F560 G566 W567	Q181-N564 PolarHBondContact NE2-OD1 2.89Å; Q181-N564 VanDerWaalsContact NE2-OD1 3.14Å; Q181-N564 PolarHBondContact OE1-OD1 3.45Å; Y209-N564 WeakPolarHBondContact CE2-OD1 3.46Å; Y209-N564 PolarHBondContact OH-ND2 2.96Å; Y209-N564 PolarHBondContact OH-OD1 3.28Å; F560-N564 HydrophobicContact CE1-CB 4.49Å; F560-N564 WeakPolarHBondContact CE2-ND2 3.4Å; F560-N564 WeakPolarHBondContact O-CB 3.21Å; F560-N564 PolarHBondContact O-N 3.46Å; F560-N564 PolarHBondContact O-ND2 2.89Å; N564-G566 PolarHBondContact O-N 3.43Å; N564-W567 HydrophobicContact CB-CB 4.27Å; N564-W567 WeakPolarHBondContact O-CB 3.1Å; N564-W567 PolarHBondContact O-N 2.91Å; N564-W567 VanDerWaalsContact O-N 3.13Å
565	P	87.6	Confident	89.7	Confident	113 Å²	113	46.6 Å²	46.6	73%	0.734	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-18.3	-175.1	27.3	-35.7	0	0	0	114.2	T563 W567	T563-P565 WeakPolarHBondContact O-CD 3.22Å; P565-W567 VanDerWaalsContact C-N 3.29Å
566	G	85	Confident	89.5	Confident	58 Å²	58	47.2 Å²	47.2	60%	0.598	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-18	174.1	0	0	0	0	0	113.8	N564	N564-G566 PolarHBondContact O-N 3.43Å
567	W	90	Very high	89.1	Confident	21 Å²	21	48.4 Å²	48.4	8%	0.08	27%	0.272	C	S	.	.			trans	-72.9	129.2	179.7	174.5	63.9	0	0	0	111	L206 L557 F560 A561 N564 P565 P569	L206-W567 HydrophobicContact CD2-CZ2 3.99Å; L557-W567 HydrophobicContact CD1-CH2 3.7Å; L557-W567 HydrophobicContact CD1-CZ3 3.89Å; F560-W567 AromaticContact CD1-CD2 3.82Å; F560-W567 HydrophobicContact CD1-CD2 3.82Å; F560-W567 AromaticContact CD1-CE3 3.55Å; F560-W567 HydrophobicContact CD1-CE3 3.55Å; F560-W567 HydrophobicContact CD1-CG 4.43Å; F560-W567 HydrophobicContact CD1-CH2 4.19Å; F560-W567 HydrophobicContact CD1-CZ2 4.45Å; F560-W567 AromaticContact CD1-CZ3 3.74Å; F560-W567 HydrophobicContact CD1-CZ3 3.74Å; F560-W567 HydrophobicContact CE1-CB 4.26Å; F560-W567 AromaticContact CE1-CD2 3.58Å; F560-W567 HydrophobicContact CE1-CD2 3.58Å; F560-W567 AromaticContact CE1-CE2 3.94Å; F560-W567 AromaticContact CE1-CE3 3.82Å; F560-W567 HydrophobicContact CE1-CE3 3.82Å; F560-W567 AromaticContact CE1-CG 3.78Å; F560-W567 HydrophobicContact CE1-CG 3.78Å; F560-W567 HydrophobicContact CE1-CZ2 4.46Å; F560-W567 HydrophobicContact CE1-CZ3 4.34Å; A561-W567 HydrophobicContact CB-CE3 4.43Å; A561-W567 HydrophobicContact CB-CZ3 4.24Å; N564-W567 HydrophobicContact CB-CB 4.27Å; N564-W567 WeakPolarHBondContact O-CB 3.1Å; N564-W567 PolarHBondContact O-N 2.91Å; N564-W567 VanDerWaalsContact O-N 3.13Å; P565-W567 VanDerWaalsContact C-N 3.29Å; W567-P569 HydrophobicContact CE3-CB 4.25Å; W567-P569 HydrophobicContact CH2-CB 3.89Å; W567-P569 HydrophobicContact CZ2-CB 4.42Å; W567-P569 HydrophobicContact CZ3-CB 3.79Å; W567-P569 WeakPolarHBondContact O-CD 3.23Å
568	Q	88.6	Confident	88.7	Confident	153 Å²	153	49.9 Å²	49.9	72%	0.715	29%	0.287	S	S	*	.			trans	-89.7	109.3	175	-172.1	63.5	45.5	0	0	110.1
569	P	87.9	Confident	88.5	Confident	26 Å²	26	52.4 Å²	52.4	17%	0.169	30%	0.298	C	S	.	.			trans	-66.5	150.7	-179.8	22.5	-30.3	0	0	0	112.2	W567 T574 L577	W567-P569 HydrophobicContact CE3-CB 4.25Å; W567-P569 HydrophobicContact CH2-CB 3.89Å; W567-P569 HydrophobicContact CZ2-CB 4.42Å; W567-P569 HydrophobicContact CZ3-CB 3.79Å; W567-P569 WeakPolarHBondContact O-CD 3.23Å; P569-T574 WeakPolarHBondContact CG-OG1 3.31Å; P569-T574 PolarHBondContact O-OG1 3.37Å; P569-T574 VanDerWaalsContact O-OG1 3.14Å; P569-L577 HydrophobicContact CG-CD1 4.47Å
570	P	88.6	Confident	88.1	Confident	70 Å²	70	52.1 Å²	52.1	46%	0.455	30%	0.297	S	S	.	.			trans	-56.9	163.1	169.4	-24.4	33.9	0	0	0	112.6	E572 S573 T574	P570-E572 VanDerWaalsContact C-N 3.34Å; P570-E572 PolarHBondContact O-N 2.85Å; P570-S573 PolarHBondContact O-N 2.99Å; P570-T574 WeakPolarHBondContact O-CB 3.41Å; P570-T574 PolarHBondContact O-N 3.37Å; P570-T574 PolarHBondContact O-OG1 2.76Å
571	R	86.2	Confident	87.6	Confident	231 Å²	231	58.1 Å²	58.1	87%	0.872	32%	0.323	S	S	*	.	H	α-helix	trans	-56.7	-44.3	-175.9	-69.9	-175	176.6	-177.5	-0.5	113.2	T574 A575	R571-T574 PolarHBondContact O-N 2.87Å; R571-A575 WeakPolarHBondContact O-CB 3.23Å; R571-A575 PolarHBondContact O-N 2.91Å
572	E	84.9	Confident	87.3	Confident	74 Å²	74	61.9 Å²	61.9	35%	0.346	34%	0.337	S	S	.	.	H	α-helix	trans	-67.7	-46.3	-178.3	-56.3	-170	168.3	0	0	111.1	R527 P570 T574 A575 F576	R527-E572 WeakPolarHBondContact CB-OE2 3.49Å; R527-E572 VanDerWaalsContact CD-CD 3.5Å; R527-E572 WeakPolarHBondContact CD-OE1 3.47Å; R527-E572 VanDerWaalsContact CD-OE2 3.25Å; R527-E572 WeakPolarHBondContact CD-OE2 3.41Å; R527-E572 IonicContact CZ-OE1 3.88Å; R527-E572 IonicContact NE-OE1 3.47Å; R527-E572 IonicContact NH1-OE1 3.53Å; R527-E572 PolarHBondContact NH1-OE1 2.9Å; P570-E572 VanDerWaalsContact C-N 3.34Å; P570-E572 PolarHBondContact O-N 2.85Å; E572-T574 VanDerWaalsContact C-N 3.31Å; E572-T574 PolarHBondContact O-N 3.43Å; E572-A575 PolarHBondContact O-N 3.36Å; E572-F576 PolarHBondContact O-N 3.04Å
573	S	87.1	Confident	87	Confident	4 Å²	4	62.7 Å²	62.7	3%	0.028	34%	0.34	C	S	.	.	H	α-helix	trans	-59.3	-40.3	173	-52.5	0	0	0	0	112.4	P570 F576 L577	P570-S573 PolarHBondContact O-N 2.99Å; S573-F576 PolarHBondContact O-N 3.45Å; S573-L577 WeakPolarHBondContact O-CB 3.39Å; S573-L577 VanDerWaalsContact O-CG 3.27Å; S573-L577 WeakPolarHBondContact O-CG 3.25Å; S573-L577 PolarHBondContact O-N 3.49Å
574	T	88.6	Confident	86.6	Confident	59 Å²	59	61.3 Å²	61.3	36%	0.362	33%	0.331	S	S	.	.	H	α-helix	trans	-64.6	-42.5	176.5	-53.2	0	0	0	0	111.3	P569 P570 R571 E572 L577 G578	P569-T574 WeakPolarHBondContact CG-OG1 3.31Å; P569-T574 PolarHBondContact O-OG1 3.37Å; P569-T574 VanDerWaalsContact O-OG1 3.14Å; P570-T574 WeakPolarHBondContact O-CB 3.41Å; P570-T574 PolarHBondContact O-N 3.37Å; P570-T574 PolarHBondContact O-OG1 2.76Å; R571-T574 PolarHBondContact O-N 2.87Å; E572-T574 VanDerWaalsContact C-N 3.31Å; E572-T574 PolarHBondContact O-N 3.43Å; T574-L577 PolarHBondContact O-N 3.23Å; T574-G578 PolarHBondContact O-N 2.87Å
575	A	87.4	Confident	86.1	Confident	65 Å²	65	64 Å²	64	54%	0.537	34%	0.344	S	S	.	.	H	α-helix	trans	-63.3	-43.5	177.6	0	0	0	0	0	111.6	R571 E572 G578 F579	R571-A575 WeakPolarHBondContact O-CB 3.23Å; R571-A575 PolarHBondContact O-N 2.91Å; E572-A575 PolarHBondContact O-N 3.36Å; A575-G578 PolarHBondContact O-N 2.92Å; A575-F579 WeakPolarHBondContact O-CB 3.4Å; A575-F579 PolarHBondContact O-N 3.12Å
576	F	87.4	Confident	85.8	Confident	13 Å²	13	64.3 Å²	64.3	6%	0.057	33%	0.33	C	S	.	.	H	α-helix	trans	-61.4	-50.6	174.5	168.7	-105.3	0	0	0	112.2	V526 L535 E554 L557 M558 E572 S573 G578 F579 L580 M713	V526-F576 HydrophobicContact CG1-CD2 4.36Å; V526-F576 HydrophobicContact CG1-CG 4.39Å; V526-F576 HydrophobicContact CG2-CB 4.48Å; V526-F576 HydrophobicContact CG2-CD1 4.19Å; V526-F576 HydrophobicContact CG2-CG 4.28Å; L535-F576 HydrophobicContact CD2-CD2 3.55Å; L535-F576 HydrophobicContact CD2-CE2 3.38Å; L535-F576 HydrophobicContact CD2-CZ 4.32Å; E554-F576 HydrophobicContact CB-CE1 4.32Å; E554-F576 HydrophobicContact CB-CZ 3.95Å; E554-F576 HydrophobicContact CG-CE2 4.41Å; E554-F576 HydrophobicContact CG-CZ 4.02Å; L557-F576 HydrophobicContact CD2-CD1 3.78Å; L557-F576 HydrophobicContact CD2-CE1 4.34Å; M558-F576 HydrophobicContact CG-CE1 4.2Å; M558-F576 HydrophobicContact SD-CE1 4.32Å; M558-F576 HydrophobicContact SD-CZ 4.43Å; E572-F576 PolarHBondContact O-N 3.04Å; S573-F576 PolarHBondContact O-N 3.45Å; F576-G578 VanDerWaalsContact C-N 3.3Å; F576-G578 PolarHBondContact O-N 3.39Å; F576-F579 PolarHBondContact O-N 2.87Å; F576-L580 HydrophobicContact CZ-CD2 4.45Å; F576-L580 WeakPolarHBondContact O-CB 3.43Å; F576-L580 PolarHBondContact O-N 3.37Å; F576-M713 HydrophobicContact CZ-CE 4.27Å
577	L	87.3	Confident	85.6	Confident	25 Å²	25	62.9 Å²	62.9	13%	0.131	31%	0.309	C	S	.	.	H	α-helix	trans	-62.6	-38.1	178.9	-68.8	174.2	0	0	0	111.9	L557 M558 A561 P569 S573 T574 K581	L557-L577 HydrophobicContact CD2-CG 4.48Å; M558-L577 HydrophobicContact CG-CD2 3.81Å; A561-L577 HydrophobicContact CB-CD1 3.85Å; P569-L577 HydrophobicContact CG-CD1 4.47Å; S573-L577 WeakPolarHBondContact O-CB 3.39Å; S573-L577 VanDerWaalsContact O-CG 3.27Å; S573-L577 WeakPolarHBondContact O-CG 3.25Å; S573-L577 PolarHBondContact O-N 3.49Å; T574-L577 PolarHBondContact O-N 3.23Å; L577-K581 WeakPolarHBondContact O-CB 3.31Å; L577-K581 VanDerWaalsContact O-CG 3.29Å; L577-K581 WeakPolarHBondContact O-CG 3.48Å; L577-K581 PolarHBondContact O-N 3.45Å
578	G	85.9	Confident	84.8	Confident	30 Å²	30	62 Å²	62	31%	0.309	31%	0.306	S	S	.	.	H	α-helix	trans	-63.3	-49.5	174.5	0	0	0	0	0	112.1	T574 A575 F576 L580 K581 E582	T574-G578 PolarHBondContact O-N 2.87Å; A575-G578 PolarHBondContact O-N 2.92Å; F576-G578 VanDerWaalsContact C-N 3.3Å; F576-G578 PolarHBondContact O-N 3.39Å; G578-L580 VanDerWaalsContact C-N 3.32Å; G578-L580 PolarHBondContact O-N 3.35Å; G578-K581 PolarHBondContact O-N 3.18Å; G578-E582 WeakPolarHBondContact O-CG 3.46Å; G578-E582 PolarHBondContact O-N 3.04Å
579	F	86.3	Confident	84.1	Confident	58 Å²	58	56 Å²	56	25%	0.254	28%	0.283	S	S	.	.	H	α-helix	trans	-57.2	-44.9	175.7	172.3	-98.6	0	0	0	112	S536 A575 F576 E582 Q583	S536-F579 VanDerWaalsContact OG-CE1 3.29Å; S536-F579 WeakPolarHBondContact OG-CE1 3.41Å; S536-F579 WeakPolarHBondContact OG-CZ 3.35Å; A575-F579 WeakPolarHBondContact O-CB 3.4Å; A575-F579 PolarHBondContact O-N 3.12Å; F576-F579 PolarHBondContact O-N 2.87Å; F579-E582 PolarHBondContact O-N 3.37Å; F579-Q583 WeakPolarHBondContact O-CB 3.27Å; F579-Q583 PolarHBondContact O-N 3.37Å
580	L	84.8	Confident	83.3	Confident	7 Å²	7	57.5 Å²	57.5	4%	0.037	30%	0.297	C	S	.	.	H	α-helix	trans	-63.3	-45	178.4	-178	62.7	0	0	0	111.6	M558 F576 G578 E582 Q583 V584 Y712 M713	M558-L580 HydrophobicContact CE-CD2 3.34Å; M558-L580 HydrophobicContact CG-CD2 4.31Å; M558-L580 HydrophobicContact SD-CD2 3.48Å; M558-L580 WeakPolarHBondContact SD-CD2 3.36Å; F576-L580 HydrophobicContact CZ-CD2 4.45Å; F576-L580 WeakPolarHBondContact O-CB 3.43Å; F576-L580 PolarHBondContact O-N 3.37Å; G578-L580 VanDerWaalsContact C-N 3.32Å; G578-L580 PolarHBondContact O-N 3.35Å; L580-E582 VanDerWaalsContact C-N 3.34Å; L580-E582 PolarHBondContact O-N 2.82Å; L580-Q583 PolarHBondContact O-N 2.73Å; L580-V584 WeakPolarHBondContact O-CG2 3.34Å; L580-V584 PolarHBondContact O-N 3.39Å; L580-Y712 HydrophobicContact CD1-CD1 4.08Å; L580-Y712 HydrophobicContact CD1-CE1 3.78Å; L580-M713 HydrophobicContact CD1-SD 3.53Å; L580-M713 VanDerWaalsContact CD1-SD 3.53Å; L580-M713 HydrophobicContact CD2-SD 3.97Å; L580-M713 HydrophobicContact CG-SD 4.42Å
581	K	84.9	Confident	82	Confident	126 Å²	126	54.3 Å²	54.3	55%	0.548	28%	0.277	S	S	.	.	H	α-helix	trans	-59.5	-44.8	175.3	-77	178.1	179.3	-174	0	111.4	L577 G578 Q583 V584 Q585	L577-K581 WeakPolarHBondContact O-CB 3.31Å; L577-K581 VanDerWaalsContact O-CG 3.29Å; L577-K581 WeakPolarHBondContact O-CG 3.48Å; L577-K581 PolarHBondContact O-N 3.45Å; G578-K581 PolarHBondContact O-N 3.18Å; K581-Q583 VanDerWaalsContact C-N 3.34Å; K581-Q583 PolarHBondContact O-N 3.21Å; K581-V584 PolarHBondContact O-N 3.19Å; K581-Q585 WeakPolarHBondContact O-CB 3.36Å; K581-Q585 WeakPolarHBondContact O-CG 3.41Å; K581-Q585 PolarHBondContact O-N 3.03Å
582	E	85	Confident	80.8	Confident	104 Å²	104	46.6 Å²	46.6	49%	0.486	26%	0.258	S	S	.	.	H	α-helix	trans	-61.5	-41.4	175.4	-73	-179	-175.5	0	0	112.3	G578 F579 L580 Q585 R586	G578-E582 WeakPolarHBondContact O-CG 3.46Å; G578-E582 PolarHBondContact O-N 3.04Å; F579-E582 PolarHBondContact O-N 3.37Å; L580-E582 VanDerWaalsContact C-N 3.34Å; L580-E582 PolarHBondContact O-N 2.82Å; E582-Q585 WeakPolarHBondContact O-CB 3.42Å; E582-Q585 PolarHBondContact O-N 3.41Å; E582-R586 WeakPolarHBondContact O-CG 3.33Å; E582-R586 PolarHBondContact O-N 3.21Å; E582-R586 IonicContact OE2-CZ 3.8Å; E582-R586 IonicContact OE2-NH2 2.85Å; E582-R586 PolarHBondContact OE2-NH2 3.26Å
583	Q	83.1	Confident	79.5	Confident	43 Å²	43	50 Å²	50	20%	0.201	28%	0.278	C	S	.	.	H	α-helix	trans	-65.5	-43.2	179.7	-165.1	66.1	16.4	0	0	111.7	F579 L580 K581 Q585 R586 D587 Y712	F579-Q583 WeakPolarHBondContact O-CB 3.27Å; F579-Q583 PolarHBondContact O-N 3.37Å; L580-Q583 PolarHBondContact O-N 2.73Å; K581-Q583 VanDerWaalsContact C-N 3.34Å; K581-Q583 PolarHBondContact O-N 3.21Å; Q583-Q585 VanDerWaalsContact C-N 3.3Å; Q583-Q585 PolarHBondContact O-N 2.86Å; Q583-R586 PolarHBondContact O-N 3.15Å; Q583-D587 VanDerWaalsContact O-CG 3.31Å; Q583-D587 PolarHBondContact O-N 2.97Å; Q583-Y712 VanDerWaalsContact CG-OH 3.26Å; Q583-Y712 WeakPolarHBondContact CG-OH 3.47Å
584	V	82.1	Confident	77.9	Confident	5 Å²	5	54 Å²	54	3%	0.03	31%	0.311	C	S	.	.	H	α-helix	trans	-58.9	-43.2	172.4	169.8	0	0	0	0	110.7	L580 K581 G588 A649 L652 Y712	L580-V584 WeakPolarHBondContact O-CG2 3.34Å; L580-V584 PolarHBondContact O-N 3.39Å; K581-V584 PolarHBondContact O-N 3.19Å; V584-G588 PolarHBondContact O-N 2.66Å; V584-A649 HydrophobicContact CG1-CB 4.39Å; V584-L652 HydrophobicContact CG1-CB 3.52Å; V584-L652 HydrophobicContact CG1-CD1 3.82Å; V584-L652 HydrophobicContact CG1-CG 4.32Å; V584-L652 HydrophobicContact CG2-CD1 3.99Å; V584-Y712 HydrophobicContact CG2-CD1 3.77Å; V584-Y712 HydrophobicContact CG2-CD2 4.38Å; V584-Y712 HydrophobicContact CG2-CE1 3.52Å; V584-Y712 HydrophobicContact CG2-CE2 4.17Å; V584-Y712 HydrophobicContact CG2-CG 4.19Å
585	Q	80.1	Confident	76.1	Confident	58 Å²	58	55.5 Å²	55.5	27%	0.271	32%	0.315	S	S	.	.	H	α-helix	trans	-65.3	-40.8	177.8	-69.5	-77.8	-15.4	0	0	112.4	K581 E582 Q583 A589 R653 S656	K581-Q585 WeakPolarHBondContact O-CB 3.36Å; K581-Q585 WeakPolarHBondContact O-CG 3.41Å; K581-Q585 PolarHBondContact O-N 3.03Å; E582-Q585 WeakPolarHBondContact O-CB 3.42Å; E582-Q585 PolarHBondContact O-N 3.41Å; Q583-Q585 VanDerWaalsContact C-N 3.3Å; Q583-Q585 PolarHBondContact O-N 2.86Å; Q585-A589 WeakPolarHBondContact O-CB 3.46Å; Q585-A589 PolarHBondContact O-N 3.07Å; Q585-A589 VanDerWaalsContact O-N 3.07Å; Q585-R653 PolarHBondContact O-NH1 3.42Å; Q585-R653 PolarHBondContact O-NH2 3.31Å; Q585-R653 VanDerWaalsContact OE1-CZ 3.24Å; Q585-S656 PolarHBondContact NE2-OG 2.93Å; Q585-S656 VanDerWaalsContact NE2-OG 3.07Å
586	R	81.3	Confident	73.9	Confident	120 Å²	120	55 Å²	55	45%	0.453	32%	0.316	S	S	.	.	H	α-helix	trans	-64.3	-49.4	175.9	-72.9	-178.5	-158.5	108.5	9.2	111.5	E582 Q583 G588 A589 A590	E582-R586 WeakPolarHBondContact O-CG 3.33Å; E582-R586 PolarHBondContact O-N 3.21Å; E582-R586 IonicContact OE2-CZ 3.8Å; E582-R586 IonicContact OE2-NH2 2.85Å; E582-R586 PolarHBondContact OE2-NH2 3.26Å; Q583-R586 PolarHBondContact O-N 3.15Å; R586-G588 PolarHBondContact O-N 2.96Å; R586-A589 WeakPolarHBondContact O-CB 3.49Å; R586-A589 PolarHBondContact O-N 3.35Å; R586-A589 VanDerWaalsContact O-N 3.12Å; R586-A590 PolarHBondContact O-N 2.98Å
587	D	79.4	Confident	71.6	Confident	29 Å²	29	58.3 Å²	58.3	16%	0.155	35%	0.353	C	S	.	.	H	α-helix	trans	-67.1	-37.7	-178.2	-67.2	-16.1	0	0	0	111.9	Q583 A589 A590 A591 R645 A649 Y712	Q583-D587 VanDerWaalsContact O-CG 3.31Å; Q583-D587 PolarHBondContact O-N 2.97Å; D587-A589 VanDerWaalsContact C-N 3.29Å; D587-A589 PolarHBondContact O-N 3.13Å; D587-A590 PolarHBondContact O-N 3.43Å; D587-A591 PolarHBondContact O-N 2.8Å; D587-R645 IonicContact OD1-NH2 3.95Å; D587-R645 IonicContact OD2-CZ 3.93Å; D587-R645 IonicContact OD2-NE 2.74Å; D587-R645 PolarHBondContact OD2-NE 3.38Å; D587-R645 IonicContact OD2-NH2 3.95Å; D587-R645 PolarHBondContact OD2-NH2 2.95Å; D587-A649 HydrophobicContact CB-CB 3.84Å; D587-Y712 WeakPolarHBondContact OD2-CE2 3.33Å; D587-Y712 PolarHBondContact OD2-OH 2.86Å
588	G	74.1	Confident	69.1	Low	1 Å²	1	64.6 Å²	64.6	1%	0.01	39%	0.386	C	S	.	.	H	α-helix	trans	-64.3	-32.3	172.8	0	0	0	0	0	112.7	V584 R586 A591 S592	V584-G588 PolarHBondContact O-N 2.66Å; R586-G588 PolarHBondContact O-N 2.96Å; G588-A591 WeakPolarHBondContact O-CB 3.27Å; G588-A591 PolarHBondContact O-N 3.02Å; G588-S592 PolarHBondContact O-N 3.47Å
589	A	73.8	Confident	66.9	Low	28 Å²	28	69 Å²	69	23%	0.231	40%	0.402	C	S	.	.	H	α-helix	trans	-72.1	-40.5	175.4	0	0	0	0	0	111.5	Q585 R586 D587 A591 S592 L593	Q585-A589 WeakPolarHBondContact O-CB 3.46Å; Q585-A589 PolarHBondContact O-N 3.07Å; Q585-A589 VanDerWaalsContact O-N 3.07Å; R586-A589 WeakPolarHBondContact O-CB 3.49Å; R586-A589 PolarHBondContact O-N 3.35Å; R586-A589 VanDerWaalsContact O-N 3.12Å; D587-A589 VanDerWaalsContact C-N 3.29Å; D587-A589 PolarHBondContact O-N 3.13Å; A589-A591 PolarHBondContact O-N 3.41Å; A589-S592 PolarHBondContact O-N 3.31Å; A589-S592 PolarHBondContact O-OG 3.2Å; A589-L593 WeakPolarHBondContact O-CB 3.32Å; A589-L593 WeakPolarHBondContact O-CD1 3.26Å; A589-L593 WeakPolarHBondContact O-CG 3.22Å; A589-L593 PolarHBondContact O-N 3.44Å; A589-L593 VanDerWaalsContact O-N 3.12Å
590	A	70.7	Confident	64.5	Low	57 Å²	57	70.9 Å²	70.9	47%	0.471	42%	0.42	S	S	.	.	H	α-helix	trans	-62.3	-36.1	173.8	0	0	0	0	0	111.3	R586 D587 A594	R586-A590 PolarHBondContact O-N 2.98Å; D587-A590 PolarHBondContact O-N 3.43Å; A590-A594 VanDerWaalsContact O-CB 3.23Å; A590-A594 WeakPolarHBondContact O-CB 3.4Å; A590-A594 PolarHBondContact O-N 3Å
591	A	62.8	Low	62.2	Low	4 Å²	4	79.7 Å²	79.7	3%	0.033	46%	0.461	C	S	.	.	H	α-helix	trans	-60.4	-51.1	175	0	0	0	0	0	112.6	D587 G588 A589 L593 A594 Q595 A646	D587-A591 PolarHBondContact O-N 2.8Å; G588-A591 WeakPolarHBondContact O-CB 3.27Å; G588-A591 PolarHBondContact O-N 3.02Å; A589-A591 PolarHBondContact O-N 3.41Å; A591-L593 VanDerWaalsContact C-N 3.32Å; A591-L593 PolarHBondContact O-N 3.29Å; A591-A594 PolarHBondContact O-N 3.4Å; A591-Q595 PolarHBondContact O-N 3.27Å; A591-A646 HydrophobicContact CB-CB 3.41Å; A591-A646 VanDerWaalsContact CB-CB 3.41Å; A591-A646 WeakPolarHBondContact CB-O 3.21Å
592	S	60	Low	60.2	Low	68 Å²	68	79.1 Å²	79.1	48%	0.476	46%	0.464	S	S	.	.	H	α-helix	trans	-67.1	-34	-177.5	61.1	0	0	0	0	112.3	G588 A589	G588-S592 PolarHBondContact O-N 3.47Å; A589-S592 PolarHBondContact O-N 3.31Å; A589-S592 PolarHBondContact O-OG 3.2Å
593	L	57.7	Low	57.9	Low	145 Å²	145	76.3 Å²	76.3	76%	0.759	46%	0.459	S	S	*	.	H	α-helix	trans	-70.5	-38.7	173.2	-73.8	162.8	0	0	0	112.4	A589 A591	A589-L593 WeakPolarHBondContact O-CB 3.32Å; A589-L593 WeakPolarHBondContact O-CD1 3.26Å; A589-L593 WeakPolarHBondContact O-CG 3.22Å; A589-L593 PolarHBondContact O-N 3.44Å; A589-L593 VanDerWaalsContact O-N 3.12Å; A591-L593 VanDerWaalsContact C-N 3.32Å; A591-L593 PolarHBondContact O-N 3.29Å
594	A	54.3	Low	55.9	Low	88 Å²	88	79 Å²	79	73%	0.727	47%	0.474	S	S	*	.	H	α-helix	trans	-74.5	-23.2	-179.8	0	0	0	0	0	113.9	A590 A591	A590-A594 VanDerWaalsContact O-CB 3.23Å; A590-A594 WeakPolarHBondContact O-CB 3.4Å; A590-A594 PolarHBondContact O-N 3Å; A591-A594 PolarHBondContact O-N 3.4Å
595	Q	50.5	Low	53.8	Low	92 Å²	92	85.5 Å²	85.5	43%	0.43	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	4.5	-179.1	-81.7	173.8	-7.3	0	0	115.1	A591	A591-Q595 PolarHBondContact O-N 3.27Å
596	G	40.1	Very low	51.6	Low	54 Å²	54	86.6 Å²	86.6	56%	0.557	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	68.3	166.9	0	0	0	0	0	114.6	L598	G596-L598 PolarHBondContact O-N 3.45Å
597	G	40	Very low	49.4	Very low	82 Å²	82	83.6 Å²	83.6	85%	0.845	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	12.3	155.7	0	0	0	0	0	119.2
598	L	35.3	Very low	47.6	Very low	157 Å²	157	87.6 Å²	87.6	82%	0.822	53%	0.53	S	S	*	.			trans	-118.4	34.2	-175	-88.5	166.7	0	0	0	114.5	G596	G596-L598 PolarHBondContact O-N 3.45Å
599	L	38.2	Very low	45.7	Very low	124 Å²	124	94.3 Å²	94.3	65%	0.649	56%	0.561	S	S	*	*	S	Bend	trans	-111.7	120.7	155.7	-75.2	173.6	0	0	0	107.9	E601	L599-E601 PolarHBondContact O-N 2.94Å
600	P	36.4	Very low	43.5	Very low	96 Å²	96	97.2 Å²	97.2	62%	0.623	58%	0.58	S	S	*	*			trans	-64.5	122.5	168.3	-3.7	18.2	0	0	0	106.9	N602 A603	P600-N602 PolarHBondContact O-N 3.34Å; P600-A603 PolarHBondContact O-N 3.13Å
601	E	37.2	Very low	41.7	Very low	192 Å²	192	98 Å²	98	90%	0.897	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.1	1.5	178.7	-91.5	179.6	144.3	0	0	115.3	L599	L599-E601 PolarHBondContact O-N 2.94Å
602	N	41.3	Very low	40.3	Very low	115 Å²	115	107.2 Å²	107.2	62%	0.615	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.1	2.9	-174.5	-70	-39	0	0	0	115.1	P600 T606	P600-N602 PolarHBondContact O-N 3.34Å; N602-T606 WeakPolarHBondContact O-CB 3.25Å; N602-T606 WeakPolarHBondContact O-CG2 3.38Å; N602-T606 PolarHBondContact O-N 3.48Å; N602-T606 VanDerWaalsContact O-N 3.14Å; N602-T606 PolarHBondContact O-OG1 3.46Å
603	A	37.7	Very low	38.8	Very low	45 Å²	45	107.8 Å²	107.8	37%	0.372	62%	0.622	S	S	.	*	H	α-helix	trans	-76.8	-32.4	-178.7	0	0	0	0	0	113.8	P600 T606 S607	P600-A603 PolarHBondContact O-N 3.13Å; A603-T606 WeakPolarHBondContact CA-OG1 3.42Å; A603-T606 PolarHBondContact O-OG1 3.4Å; A603-S607 PolarHBondContact O-N 3.44Å; A603-S607 PolarHBondContact O-OG 3.12Å
604	L	41.8	Very low	37.5	Very low	99 Å²	99	110.7 Å²	110.7	52%	0.518	63%	0.632	S	S	.	*	H	α-helix	trans	-73.7	-36.1	176.3	-72.3	172	0	0	0	111.8	I608	L604-I608 WeakPolarHBondContact O-CG1 3.3Å
605	F	37.4	Very low	36.5	Very low	141 Å²	141	110.1 Å²	110.1	62%	0.618	62%	0.622	S	S	*	*	H	α-helix	trans	-74.4	-35.7	177.6	-158.3	-94.3	0	0	0	112.5	I608	F605-I608 WeakPolarHBondContact O-CB 3.48Å; F605-I608 PolarHBondContact O-N 3.47Å
606	T	34.3	Very low	35.9	Very low	81 Å²	81	110.9 Å²	110.9	50%	0.497	63%	0.626	S	S	.	*	H	α-helix	trans	-71.7	-28	174.7	41.6	0	0	0	0	113.2	N602 A603 I608 Q609 S610	N602-T606 WeakPolarHBondContact O-CB 3.25Å; N602-T606 WeakPolarHBondContact O-CG2 3.38Å; N602-T606 PolarHBondContact O-N 3.48Å; N602-T606 VanDerWaalsContact O-N 3.14Å; N602-T606 PolarHBondContact O-OG1 3.46Å; A603-T606 WeakPolarHBondContact CA-OG1 3.42Å; A603-T606 PolarHBondContact O-OG1 3.4Å; T606-I608 VanDerWaalsContact C-N 3.26Å; T606-I608 PolarHBondContact O-N 3.3Å; T606-Q609 PolarHBondContact O-N 3.17Å; T606-S610 PolarHBondContact O-N 3.44Å
607	S	35.4	Very low	35.9	Very low	57 Å²	57	111.4 Å²	111.4	40%	0.399	62%	0.62	S	S	.	*	H	α-helix	trans	-68.4	-24.2	172.4	-58.3	0	0	0	0	113	A603	A603-S607 PolarHBondContact O-N 3.44Å; A603-S607 PolarHBondContact O-OG 3.12Å
608	I	41	Very low	35.9	Very low	113 Å²	113	111.2 Å²	111.2	58%	0.579	60%	0.599	S	S	*	*	H	α-helix	trans	-74.2	-31	175.7	-67.3	169.2	0	0	0	111.3	L604 F605 T606	L604-I608 WeakPolarHBondContact O-CG1 3.3Å; F605-I608 WeakPolarHBondContact O-CB 3.48Å; F605-I608 PolarHBondContact O-N 3.47Å; T606-I608 VanDerWaalsContact C-N 3.26Å; T606-I608 PolarHBondContact O-N 3.3Å
609	Q	33.7	Very low	36.7	Very low	142 Å²	142	105.9 Å²	105.9	66%	0.664	58%	0.575	S	S	*	*	H	α-helix	trans	-88.8	-23.8	179.1	-86.8	-178.8	-17.9	0	0	114.4	T606	T606-Q609 PolarHBondContact O-N 3.17Å
610	S	27	Very low	37.4	Very low	90 Å²	90	102.5 Å²	102.5	63%	0.629	56%	0.557	S	S	*	*	S	Bend	trans	-88	-3.5	-176.9	73.5	0	0	0	0	115.2	T606	T606-S610 PolarHBondContact O-N 3.44Å
611	L	34.3	Very low	38.4	Very low	74 Å²	74	98.3 Å²	98.3	39%	0.387	53%	0.529	S	S	.	.			trans	-102.9	42.5	-178.9	-82.3	164.6	0	0	0	112.8	S613	L611-S613 PolarHBondContact O-N 3.37Å; L611-S613 VanDerWaalsContact O-N 3.15Å
612	Q	32.1	Very low	39.3	Very low	197 Å²	197	91.2 Å²	91.2	92%	0.921	50%	0.504	S	S	*	.			trans	-71.7	13.2	162.2	-75.7	-173.2	-25.8	0	0	113.2
613	S	29.5	Very low	40.1	Very low	79 Å²	79	90.4 Å²	90.4	55%	0.552	50%	0.499	S	S	*	.	S	Bend	trans	-114.4	97.7	169	75.9	0	0	0	0	111.6	L611 S615	L611-S613 PolarHBondContact O-N 3.37Å; L611-S613 VanDerWaalsContact O-N 3.15Å; S613-S615 VanDerWaalsContact C-N 3.32Å; S613-S615 PolarHBondContact O-N 3.47Å; S613-S615 PolarHBondContact O-OG 2.91Å
614	E	30.6	Very low	41.2	Very low	206 Å²	206	89.1 Å²	89.1	96%	0.963	49%	0.487	S	S	*	.	S	Bend	trans	44.1	25.1	149.4	-63	-151.2	148.9	0	0	121
615	S	32.8	Very low	41.9	Very low	76 Å²	76	84.7 Å²	84.7	53%	0.531	46%	0.464	S	S	.	.			trans	-131.6	123.6	173.6	47.6	0	0	0	0	113.9	S613	S613-S615 VanDerWaalsContact C-N 3.32Å; S613-S615 PolarHBondContact O-N 3.47Å; S613-S615 PolarHBondContact O-OG 2.91Å
616	E	36.7	Very low	42.5	Very low	108 Å²	108	80.3 Å²	80.3	51%	0.505	45%	0.453	S	S	.	.			trans	-44.2	156.9	-171.8	-67.5	164.8	145.8	0	0	115.8	K359 L618 S619	K359-E616 IonicContact NZ-OE1 3.92Å; K359-E616 PolarHBondContact NZ-OE1 2.85Å; E616-L618 HydrophobicContact CB-CB 4.28Å; E616-L618 HydrophobicContact CB-CD1 4.08Å; E616-L618 HydrophobicContact CB-CG 3.95Å; E616-L618 PolarHBondContact O-N 3.41Å; E616-L618 WeakPolarHBondContact OE2-CD1 3.4Å; E616-S619 PolarHBondContact O-N 3.06Å
617	P	40.5	Very low	43.1	Very low	66 Å²	66	78.6 Å²	78.6	43%	0.429	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	5.7	170.4	24.9	-34.5	0	0	0	115.1	S619	P617-S619 PolarHBondContact O-N 3.2Å; P617-S619 VanDerWaalsContact O-N 3.16Å
618	L	40.9	Very low	43.6	Very low	78 Å²	78	77.4 Å²	77.4	41%	0.408	44%	0.444	S	S	.	.	H	α-helix	trans	-53.8	-24	165.1	-70.8	176.3	0	0	0	112.4	E616 L620 A622	E616-L618 HydrophobicContact CB-CB 4.28Å; E616-L618 HydrophobicContact CB-CD1 4.08Å; E616-L618 HydrophobicContact CB-CG 3.95Å; E616-L618 PolarHBondContact O-N 3.41Å; E616-L618 WeakPolarHBondContact OE2-CD1 3.4Å; L618-L620 PolarHBondContact O-N 3Å; L618-A622 WeakPolarHBondContact O-CA 3.35Å; L618-A622 WeakPolarHBondContact O-CB 3.36Å; L618-A622 PolarHBondContact O-N 3.3Å
619	S	51.8	Low	43.6	Very low	44 Å²	44	75.3 Å²	75.3	31%	0.308	44%	0.439	S	S	.	.	H	α-helix	trans	-60	-39.5	-177.6	64.5	0	0	0	0	113.5	E616 P617 N623	E616-S619 PolarHBondContact O-N 3.06Å; P617-S619 PolarHBondContact O-N 3.2Å; P617-S619 VanDerWaalsContact O-N 3.16Å; S619-N623 WeakPolarHBondContact O-CB 3.47Å; S619-N623 PolarHBondContact O-N 2.88Å; S619-N623 PolarHBondContact O-ND2 3.43Å; S619-N623 PolarHBondContact O-OD1 3.35Å
620	L	53.2	Low	43.6	Very low	54 Å²	54	73.9 Å²	73.9	28%	0.283	44%	0.443	S	S	.	.	H	α-helix	trans	-73.8	-49	-178.9	-71.4	173.8	0	0	0	112.6	L618 A622 N623 V624 F655	L618-L620 PolarHBondContact O-N 3Å; L620-A622 VanDerWaalsContact C-N 3.33Å; L620-N623 PolarHBondContact O-N 2.85Å; L620-V624 WeakPolarHBondContact O-CG2 3.07Å; L620-V624 PolarHBondContact O-N 3.13Å; L620-F655 HydrophobicContact CD1-CZ 4.15Å
621	I	57.8	Low	44.1	Very low	7 Å²	7	81.7 Å²	81.7	4%	0.036	46%	0.459	C	S	.	.	H	α-helix	trans	-64.8	-41.7	175.8	-63.6	173.5	0	0	0	109.7	A443 N623 V624 V625	A443-I621 HydrophobicContact CB-CG2 4.23Å; I621-N623 VanDerWaalsContact C-N 3.34Å; I621-N623 PolarHBondContact O-N 3.34Å; I621-V624 PolarHBondContact O-N 3.14Å; I621-V625 HydrophobicContact CG2-CG2 4.15Å; I621-V625 VanDerWaalsContact O-CB 3.29Å; I621-V625 WeakPolarHBondContact O-CB 3.24Å; I621-V625 WeakPolarHBondContact O-CG2 3.23Å; I621-V625 PolarHBondContact O-N 3.03Å
622	A	55.2	Low	44.1	Very low	44 Å²	44	81.1 Å²	81.1	36%	0.364	47%	0.471	S	S	.	.	H	α-helix	trans	-63.6	-38.6	175	0	0	0	0	0	111.5	L618 L620 V625 A626	L618-A622 WeakPolarHBondContact O-CA 3.35Å; L618-A622 WeakPolarHBondContact O-CB 3.36Å; L618-A622 PolarHBondContact O-N 3.3Å; L620-A622 VanDerWaalsContact C-N 3.33Å; A622-V625 PolarHBondContact O-N 3.42Å; A622-A626 WeakPolarHBondContact O-CA 3.3Å; A622-A626 WeakPolarHBondContact O-CB 3.45Å; A622-A626 PolarHBondContact O-N 3.37Å
623	N	58.9	Low	44.2	Very low	97 Å²	97	76.8 Å²	76.8	52%	0.519	46%	0.46	S	S	.	.	H	α-helix	trans	-67.2	-40.6	176.8	-74.6	-17.5	0	0	0	112	S619 L620 I621 G627	S619-N623 WeakPolarHBondContact O-CB 3.47Å; S619-N623 PolarHBondContact O-N 2.88Å; S619-N623 PolarHBondContact O-ND2 3.43Å; S619-N623 PolarHBondContact O-OD1 3.35Å; L620-N623 PolarHBondContact O-N 2.85Å; I621-N623 VanDerWaalsContact C-N 3.34Å; I621-N623 PolarHBondContact O-N 3.34Å; N623-G627 WeakPolarHBondContact O-CA 3.3Å; N623-G627 PolarHBondContact O-N 3.36Å
624	V	60	Low	44.6	Very low	18 Å²	18	79.5 Å²	79.5	11%	0.109	48%	0.475	C	S	.	.	H	α-helix	trans	-66.3	-40.3	174.4	173.6	0	0	0	0	111.1	L620 I621 H644 V648 A651 L708	L620-V624 WeakPolarHBondContact O-CG2 3.07Å; L620-V624 PolarHBondContact O-N 3.13Å; I621-V624 PolarHBondContact O-N 3.14Å; V624-H644 PolarHBondContact O-CE1 2.92Å; V624-H644 VanDerWaalsContact O-CE1 3.25Å; V624-V648 HydrophobicContact CG1-CB 4.48Å; V624-V648 HydrophobicContact CG1-CG2 3.58Å; V624-A651 HydrophobicContact CG2-CB 3.77Å; V624-L708 HydrophobicContact CG2-CD2 4.36Å
625	V	57.6	Low	45.1	Very low	6 Å²	6	72.2 Å²	72.2	4%	0.036	44%	0.443	C	S	.	.	H	α-helix	trans	-75.9	-32.9	178.7	174.9	0	0	0	0	112.2	Q436 R439 V440 I621 A622	Q436-V625 HydrophobicContact CB-CG1 4.34Å; R439-V625 HydrophobicContact CB-CG1 4.41Å; R439-V625 HydrophobicContact CB-CG2 4.5Å; V440-V625 HydrophobicContact CG2-CB 4.46Å; V440-V625 HydrophobicContact CG2-CG1 4.1Å; V440-V625 HydrophobicContact CG2-CG2 4.25Å; I621-V625 HydrophobicContact CG2-CG2 4.15Å; I621-V625 VanDerWaalsContact O-CB 3.29Å; I621-V625 WeakPolarHBondContact O-CB 3.24Å; I621-V625 WeakPolarHBondContact O-CG2 3.23Å; I621-V625 PolarHBondContact O-N 3.03Å; A622-V625 PolarHBondContact O-N 3.42Å
626	A	49.8	Very low	45.9	Very low	49 Å²	49	72.5 Å²	72.5	41%	0.405	44%	0.443	S	S	.	.	H	α-helix	trans	-86.6	-26.9	-178.6	0	0	0	0	0	113.4	A622 S628 S629	A622-A626 WeakPolarHBondContact O-CA 3.3Å; A622-A626 WeakPolarHBondContact O-CB 3.45Å; A622-A626 PolarHBondContact O-N 3.37Å; A626-S628 PolarHBondContact O-N 2.75Å; A626-S629 PolarHBondContact O-N 3.28Å
627	G	46.9	Very low	46.5	Very low	45 Å²	45	75.8 Å²	75.8	46%	0.464	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-53.4	-24.3	174.7	0	0	0	0	0	113.2	N623 S629	N623-G627 WeakPolarHBondContact O-CA 3.3Å; N623-G627 PolarHBondContact O-N 3.36Å; G627-S629 VanDerWaalsContact C-N 3.26Å; G627-S629 PolarHBondContact O-N 3.25Å
628	S	45.5	Very low	46.9	Very low	33 Å²	33	77.8 Å²	77.8	23%	0.231	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-64.3	-18.3	173.9	-169.6	0	0	0	0	115.1	A626	A626-S628 PolarHBondContact O-N 2.75Å
629	S	39.8	Very low	47.3	Very low	69 Å²	69	78.6 Å²	78.6	48%	0.483	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-110.9	-7.6	-163.4	-60.3	0	0	0	0	117.8	Q436 A626 G627	Q436-S629 PolarHBondContact NE2-OG 2.86Å; Q436-S629 VanDerWaalsContact NE2-OG 3.08Å; A626-S629 PolarHBondContact O-N 3.28Å; G627-S629 VanDerWaalsContact C-N 3.26Å; G627-S629 PolarHBondContact O-N 3.25Å
630	C	34.3	Very low	47.4	Very low	111 Å²	111	81 Å²	81	75%	0.75	47%	0.468	S	S	*	.	S	Bend	trans	-123.6	-1.6	-161.5	-68.7	0	0	0	0	119.7
631	R	37	Very low	47.6	Very low	255 Å²	255	79.9 Å²	79.9	96%	0.962	47%	0.47	S	S	*	.	S	Bend	trans	-153.7	90.3	177.3	-107.3	167.7	-178.6	-177.2	-0.9	113.9
632	G	36.1	Very low	47.7	Very low	61 Å²	61	82.8 Å²	82.8	63%	0.629	49%	0.491	S	S	*	.	S	Bend	trans	156.5	155.4	162.7	0	0	0	0	0	114.5
633	P	34.1	Very low	48	Very low	106 Å²	106	87.1 Å²	87.1	69%	0.688	50%	0.498	S	S	*	.	S	Bend	trans	-60.9	153.4	173.3	25.7	-31.7	0	0	0	111	L635	P633-L635 PolarHBondContact O-N 3.5Å
634	P	37.4	Very low	48.2	Very low	136 Å²	136	83.3 Å²	83.3	88%	0.883	48%	0.477	S	S	*	.			trans	-60.4	112.6	-176.3	23.6	-31.8	0	0	0	110.4
635	L	41	Very low	48.5	Very low	54 Å²	54	83.6 Å²	83.6	28%	0.283	48%	0.476	S	S	.	.			trans	-84	155.3	172.1	-86.7	114.9	0	0	0	110.8	P633 L639	P633-L635 PolarHBondContact O-N 3.5Å; L635-L639 HydrophobicContact CB-CB 4.41Å; L635-L639 HydrophobicContact CD2-CB 3.83Å; L635-L639 HydrophobicContact CD2-CD2 3.46Å; L635-L639 VanDerWaalsContact CD2-CD2 3.46Å; L635-L639 HydrophobicContact CD2-CG 4.28Å
636	P	48.7	Very low	49	Very low	81 Å²	81	84.2 Å²	84.2	53%	0.526	48%	0.482	S	S	.	.			trans	-52.7	144.6	170.2	-22.1	31.9	0	0	0	111.6	D638 L639 Q640	P636-D638 PolarHBondContact O-N 3.38Å; P636-L639 PolarHBondContact O-N 2.99Å; P636-Q640 PolarHBondContact O-N 2.89Å
637	R	50.2	Low	49.8	Very low	177 Å²	177	84.1 Å²	84.1	67%	0.668	47%	0.473	S	S	*	.	H	α-helix	trans	-53.3	-31.5	-173.8	-142.1	173.7	-171.3	171.5	-1.6	113.1	G454 Q640 G641	G454-R637 PolarHBondContact O-NH2 3.41Å; R637-Q640 PolarHBondContact O-N 3.34Å; R637-G641 PolarHBondContact O-N 2.85Å
638	D	47.7	Very low	51	Low	108 Å²	108	82 Å²	82	58%	0.578	45%	0.451	S	S	*	.	H	α-helix	trans	-72.9	-38	-179.1	-52.8	-33.4	0	0	0	112.5	P636 Q640 S642	P636-D638 PolarHBondContact O-N 3.38Å; D638-Q640 VanDerWaalsContact C-N 3.34Å; D638-S642 PolarHBondContact O-N 2.96Å
639	L	50.3	Low	52.1	Low	95 Å²	95	80.4 Å²	80.4	50%	0.497	44%	0.44	S	S	.	.	H	α-helix	trans	-73.5	-28	174.5	-91.6	78.7	0	0	0	112.1	L635 P636 R643	L635-L639 HydrophobicContact CB-CB 4.41Å; L635-L639 HydrophobicContact CD2-CB 3.83Å; L635-L639 HydrophobicContact CD2-CD2 3.46Å; L635-L639 VanDerWaalsContact CD2-CD2 3.46Å; L635-L639 HydrophobicContact CD2-CG 4.28Å; P636-L639 PolarHBondContact O-N 2.99Å; L639-R643 PolarHBondContact O-N 3.41Å; L639-R643 VanDerWaalsContact O-N 3.12Å
640	Q	54.7	Low	53.4	Low	94 Å²	94	79.2 Å²	79.2	44%	0.439	43%	0.432	S	S	.	.	H	α-helix	trans	-71.1	-37.5	176.9	-161.2	170.3	26.6	0	0	112	P636 R637 D638 H644	P636-Q640 PolarHBondContact O-N 2.89Å; R637-Q640 PolarHBondContact O-N 3.34Å; D638-Q640 VanDerWaalsContact C-N 3.34Å; Q640-H644 PolarHBondContact O-N 3.4Å
641	G	56.7	Low	55	Low	32 Å²	32	74.7 Å²	74.7	33%	0.33	40%	0.402	S	S	.	.	H	α-helix	trans	-66.4	-40.1	173.1	0	0	0	0	0	113.1	R637 H644 R645	R637-G641 PolarHBondContact O-N 2.85Å; G641-H644 PolarHBondContact O-N 3.14Å; G641-R645 PolarHBondContact O-N 2.99Å; G641-R645 VanDerWaalsContact O-N 3.12Å
642	S	59.8	Low	56.6	Low	68 Å²	68	62.8 Å²	62.8	48%	0.476	36%	0.358	S	S	.	.	H	α-helix	trans	-64.6	-43.1	176.6	-179.8	0	0	0	0	112.7	D638 R645 A646	D638-S642 PolarHBondContact O-N 2.96Å; S642-R645 PolarHBondContact O-N 2.93Å; S642-A646 WeakPolarHBondContact O-CB 3.48Å; S642-A646 PolarHBondContact O-N 3.1Å; S642-A646 VanDerWaalsContact O-N 3.12Å
643	R	60.9	Low	57.9	Low	135 Å²	135	64.1 Å²	64.1	51%	0.509	34%	0.344	S	S	.	.	H	α-helix	trans	-62.4	-44	175.2	-78.2	-176	176.5	-171.8	-0.4	113	L639 R645 A646 E647	L639-R643 PolarHBondContact O-N 3.41Å; L639-R643 VanDerWaalsContact O-N 3.12Å; R643-R645 PolarHBondContact O-N 3.38Å; R643-A646 WeakPolarHBondContact O-CB 3.43Å; R643-A646 PolarHBondContact O-N 2.73Å; R643-E647 WeakPolarHBondContact O-CG 3.37Å; R643-E647 PolarHBondContact O-N 3.08Å
644	H	62.7	Low	59.2	Low	17 Å²	17	62.9 Å²	62.9	8%	0.079	34%	0.338	C	S	.	.	H	α-helix	trans	-67.4	-36.9	-178.6	-168.1	46.7	0	0	0	112.3	V624 Q640 G641 A646 E647 V648 Q715	V624-H644 PolarHBondContact O-CE1 2.92Å; V624-H644 VanDerWaalsContact O-CE1 3.25Å; Q640-H644 PolarHBondContact O-N 3.4Å; G641-H644 PolarHBondContact O-N 3.14Å; H644-A646 VanDerWaalsContact C-N 3.31Å; H644-A646 PolarHBondContact O-N 2.95Å; H644-E647 IonicContact ND1-OE2 3.54Å; H644-E647 PolarHBondContact O-N 3.37Å; H644-V648 WeakPolarHBondContact O-CG2 3.38Å; H644-V648 PolarHBondContact O-N 2.7Å; H644-Q715 PolarHBondContact CD2-NE2 2.87Å; H644-Q715 PolarHBondContact NE2-NE2 3.2Å
645	R	67.2	Low	60.2	Low	24 Å²	24	57.4 Å²	57.4	9%	0.091	30%	0.3	C	S	.	.	H	α-helix	trans	-59.6	-42.2	170.4	179.4	179.5	167.4	170.9	2.1	112.1	D587 G641 S642 R643 V648 A649 Y712 L716	D587-R645 IonicContact OD1-NH2 3.95Å; D587-R645 IonicContact OD2-CZ 3.93Å; D587-R645 IonicContact OD2-NE 2.74Å; D587-R645 PolarHBondContact OD2-NE 3.38Å; D587-R645 IonicContact OD2-NH2 3.95Å; D587-R645 PolarHBondContact OD2-NH2 2.95Å; G641-R645 PolarHBondContact O-N 2.99Å; G641-R645 VanDerWaalsContact O-N 3.12Å; S642-R645 PolarHBondContact O-N 2.93Å; R643-R645 PolarHBondContact O-N 3.38Å; R645-V648 PolarHBondContact O-N 3.32Å; R645-A649 WeakPolarHBondContact O-CB 3.19Å; R645-A649 PolarHBondContact O-N 3.48Å; R645-Y712 HydrophobicContact CG-CD2 4.06Å; R645-Y712 HydrophobicContact CG-CE2 3.72Å; R645-Y712 PolarHBondContact NH2-OH 3.34Å; R645-L716 VanDerWaalsContact CZ-CD1 3.49Å; R645-L716 VanDerWaalsContact NH1-CD1 3.26Å; R645-L716 VanDerWaalsContact NH2-CD1 3.33Å
646	A	67.4	Low	60.6	Low	18 Å²	18	57.3 Å²	57.3	15%	0.149	30%	0.304	C	S	.	.	H	α-helix	trans	-64.6	-39.1	177.5	0	0	0	0	0	111.6	A591 S642 R643 H644 S650	A591-A646 HydrophobicContact CB-CB 3.41Å; A591-A646 VanDerWaalsContact CB-CB 3.41Å; A591-A646 WeakPolarHBondContact CB-O 3.21Å; S642-A646 WeakPolarHBondContact O-CB 3.48Å; S642-A646 PolarHBondContact O-N 3.1Å; S642-A646 VanDerWaalsContact O-N 3.12Å; R643-A646 WeakPolarHBondContact O-CB 3.43Å; R643-A646 PolarHBondContact O-N 2.73Å; H644-A646 VanDerWaalsContact C-N 3.31Å; H644-A646 PolarHBondContact O-N 2.95Å; A646-S650 WeakPolarHBondContact O-CB 3.36Å; A646-S650 PolarHBondContact O-N 3.36Å
647	E	67.7	Low	60.2	Low	47 Å²	47	59.3 Å²	59.3	22%	0.22	32%	0.317	C	S	.	.	H	α-helix	trans	-66.7	-46.8	174.4	-72.2	168.8	-179.8	0	0	112.7	R643 H644 A649 S650 A651	R643-E647 WeakPolarHBondContact O-CG 3.37Å; R643-E647 PolarHBondContact O-N 3.08Å; H644-E647 IonicContact ND1-OE2 3.54Å; H644-E647 PolarHBondContact O-N 3.37Å; E647-A649 VanDerWaalsContact C-N 3.32Å; E647-A649 PolarHBondContact O-N 3Å; E647-S650 PolarHBondContact O-N 2.97Å; E647-A651 WeakPolarHBondContact O-CB 3.33Å; E647-A651 PolarHBondContact O-N 3.42Å
648	V	70.8	Confident	59.3	Low	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-62.7	-41.6	175.8	177.3	0	0	0	0	110.4	V624 H644 R645 A651 L652 L708 L711	V624-V648 HydrophobicContact CG1-CB 4.48Å; V624-V648 HydrophobicContact CG1-CG2 3.58Å; H644-V648 WeakPolarHBondContact O-CG2 3.38Å; H644-V648 PolarHBondContact O-N 2.7Å; R645-V648 PolarHBondContact O-N 3.32Å; V648-A651 PolarHBondContact O-N 2.89Å; V648-L652 HydrophobicContact CG1-CD1 4.26Å; V648-L652 WeakPolarHBondContact O-CG 3.46Å; V648-L652 PolarHBondContact O-N 2.72Å; V648-L708 HydrophobicContact CG1-CB 4.46Å; V648-L708 HydrophobicContact CG1-CD2 4.44Å; V648-L708 WeakPolarHBondContact CG1-O 3.31Å; V648-L711 HydrophobicContact CG1-CB 4.39Å
649	A	68.6	Low	58.3	Low	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-65.3	-39.9	176.7	0	0	0	0	0	112.2	V584 D587 R645 E647 L652 R653 Y712	V584-A649 HydrophobicContact CG1-CB 4.39Å; D587-A649 HydrophobicContact CB-CB 3.84Å; R645-A649 WeakPolarHBondContact O-CB 3.19Å; R645-A649 PolarHBondContact O-N 3.48Å; E647-A649 VanDerWaalsContact C-N 3.32Å; E647-A649 PolarHBondContact O-N 3Å; A649-L652 PolarHBondContact O-N 3.33Å; A649-R653 WeakPolarHBondContact O-CB 3.36Å; A649-R653 PolarHBondContact O-N 3.39Å; A649-Y712 HydrophobicContact CB-CD2 4.34Å; A649-Y712 HydrophobicContact CB-CE2 4.06Å
650	S	68	Low	57.1	Low	44 Å²	44	62.9 Å²	62.9	31%	0.308	35%	0.35	S	S	.	.	H	α-helix	trans	-63.6	-40.4	172.8	-174.4	0	0	0	0	111.9	A646 E647 R653 S654	A646-S650 WeakPolarHBondContact O-CB 3.36Å; A646-S650 PolarHBondContact O-N 3.36Å; E647-S650 PolarHBondContact O-N 2.97Å; S650-R653 WeakPolarHBondContact O-CB 3.46Å; S650-R653 PolarHBondContact O-N 3.37Å; S650-S654 PolarHBondContact O-N 3.26Å
651	A	67.9	Low	55.7	Low	16 Å²	16	64 Å²	64	13%	0.132	36%	0.363	C	S	.	.	H	α-helix	trans	-63.4	-48.5	175	0	0	0	0	0	110.8	V624 E647 V648 R653 S654 F655 L708	V624-A651 HydrophobicContact CG2-CB 3.77Å; E647-A651 WeakPolarHBondContact O-CB 3.33Å; E647-A651 PolarHBondContact O-N 3.42Å; V648-A651 PolarHBondContact O-N 2.89Å; A651-R653 PolarHBondContact O-N 3.02Å; A651-S654 PolarHBondContact O-N 2.87Å; A651-S654 VanDerWaalsContact O-N 3.1Å; A651-S654 PolarHBondContact O-OG 2.9Å; A651-F655 WeakPolarHBondContact O-CD2 3.4Å; A651-L708 HydrophobicContact CB-CD1 4.14Å; A651-L708 HydrophobicContact CB-CD2 4.32Å
652	L	70.3	Confident	54.2	Low	6 Å²	6	71.2 Å²	71.2	3%	0.031	39%	0.388	C	S	.	.	H	α-helix	trans	-57.8	-34.2	174.3	-76.4	168.6	0	0	0	112.6	V584 V648 A649 S654 F655 L708 Y712	V584-L652 HydrophobicContact CG1-CB 3.52Å; V584-L652 HydrophobicContact CG1-CD1 3.82Å; V584-L652 HydrophobicContact CG1-CG 4.32Å; V584-L652 HydrophobicContact CG2-CD1 3.99Å; V648-L652 HydrophobicContact CG1-CD1 4.26Å; V648-L652 WeakPolarHBondContact O-CG 3.46Å; V648-L652 PolarHBondContact O-N 2.72Å; A649-L652 PolarHBondContact O-N 3.33Å; L652-S654 VanDerWaalsContact C-N 3.28Å; L652-S654 PolarHBondContact O-N 2.8Å; L652-F655 WeakPolarHBondContact O-CB 3.37Å; L652-F655 PolarHBondContact O-N 3.32Å; L652-L708 HydrophobicContact CD1-CB 4.39Å; L652-L708 HydrophobicContact CD2-CB 3.41Å; L652-L708 VanDerWaalsContact CD2-CB 3.41Å; L652-L708 HydrophobicContact CD2-CD1 4.17Å; L652-L708 HydrophobicContact CD2-CG 4.45Å; L652-L708 HydrophobicContact CG-CB 3.74Å; L652-L708 HydrophobicContact CG-CD1 4.41Å; L652-Y712 HydrophobicContact CD1-CG 4.3Å
653	R	62.8	Low	52.4	Low	88 Å²	88	71.9 Å²	71.9	33%	0.332	40%	0.398	S	S	.	.	H	α-helix	trans	-62.9	-33.8	177.9	-145	-173	-166.1	144.9	17.4	113	Q585 A649 S650 A651 F655 S656	Q585-R653 PolarHBondContact O-NH1 3.42Å; Q585-R653 PolarHBondContact O-NH2 3.31Å; Q585-R653 VanDerWaalsContact OE1-CZ 3.24Å; A649-R653 WeakPolarHBondContact O-CB 3.36Å; A649-R653 PolarHBondContact O-N 3.39Å; S650-R653 WeakPolarHBondContact O-CB 3.46Å; S650-R653 PolarHBondContact O-N 3.37Å; A651-R653 PolarHBondContact O-N 3.02Å; R653-F655 PolarHBondContact O-N 2.81Å; R653-S656 PolarHBondContact O-N 3.11Å
654	S	62.3	Low	50.8	Low	80 Å²	80	71.2 Å²	71.2	56%	0.559	41%	0.411	S	S	*	.	H	α-helix	trans	-69.8	-15.1	175.1	61.5	0	0	0	0	113.6	S650 A651 L652	S650-S654 PolarHBondContact O-N 3.26Å; A651-S654 PolarHBondContact O-N 2.87Å; A651-S654 VanDerWaalsContact O-N 3.1Å; A651-S654 PolarHBondContact O-OG 2.9Å; L652-S654 VanDerWaalsContact C-N 3.28Å; L652-S654 PolarHBondContact O-N 2.8Å
655	F	59.2	Low	49.2	Very low	21 Å²	21	77.6 Å²	77.6	9%	0.092	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-9.9	174.2	-70.1	-102.5	0	0	0	113.1	L620 A651 L652 R653 Y701 E705 L708	L620-F655 HydrophobicContact CD1-CZ 4.15Å; A651-F655 WeakPolarHBondContact O-CD2 3.4Å; L652-F655 WeakPolarHBondContact O-CB 3.37Å; L652-F655 PolarHBondContact O-N 3.32Å; R653-F655 PolarHBondContact O-N 2.81Å; F655-Y701 VanDerWaalsContact C-OH 3.27Å; F655-Y701 WeakPolarHBondContact CA-OH 3.24Å; F655-Y701 HydrophobicContact CB-CE1 4.44Å; F655-Y701 WeakPolarHBondContact CB-OH 3.11Å; F655-Y701 HydrophobicContact CD1-CD1 4.23Å; F655-Y701 AromaticContact CD1-CD2 3.78Å; F655-Y701 HydrophobicContact CD1-CD2 3.78Å; F655-Y701 AromaticContact CD1-CE1 3.73Å; F655-Y701 HydrophobicContact CD1-CE1 3.73Å; F655-Y701 AromaticContact CD1-CE2 3.22Å; F655-Y701 HydrophobicContact CD1-CE2 3.22Å; F655-Y701 HydrophobicContact CD1-CG 4.27Å; F655-Y701 AromaticContact CD1-CZ 3.22Å; F655-Y701 AromaticContact CE1-CD2 3.75Å; F655-Y701 HydrophobicContact CE1-CD2 3.75Å; F655-Y701 AromaticContact CE1-CE2 3.58Å; F655-Y701 HydrophobicContact CE1-CE2 3.58Å; F655-Y701 HydrophobicContact CE1-CG 4.38Å; F655-Y701 HydrophobicContact CG-CE2 4.21Å; F655-Y701 AromaticContact CG-CZ 3.97Å; F655-Y701 PolarHBondContact O-OH 3.47Å; F655-E705 HydrophobicContact CD1-CB 4.4Å; F655-L708 HydrophobicContact CD2-CD1 4.03Å; F655-L708 HydrophobicContact CE2-CD1 3.56Å; F655-L708 HydrophobicContact CZ-CD1 4.21Å
656	S	49.6	Very low	47.3	Very low	52 Å²	52	79.8 Å²	79.8	36%	0.364	48%	0.482	S	S	.	.	S	Bend	trans	-75	127.7	174.1	-70.5	0	0	0	0	109.7	Q585 R653 L658	Q585-S656 PolarHBondContact NE2-OG 2.93Å; Q585-S656 VanDerWaalsContact NE2-OG 3.07Å; R653-S656 PolarHBondContact O-N 3.11Å; S656-L658 PolarHBondContact O-N 3.04Å; S656-L658 VanDerWaalsContact O-N 3.08Å
657	P	39.4	Very low	45.5	Very low	123 Å²	123	91 Å²	91	80%	0.799	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-59.7	120	175.6	22.4	-29.7	0	0	0	108.8	Q659	P657-Q659 PolarHBondContact O-N 3.36Å; P657-Q659 VanDerWaalsContact O-N 3.13Å
658	L	31.7	Very low	43.4	Very low	156 Å²	156	93.5 Å²	93.5	82%	0.817	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-49.6	119.4	170.6	-80.5	148.7	0	0	0	108.5	S656	S656-L658 PolarHBondContact O-N 3.04Å; S656-L658 VanDerWaalsContact O-N 3.08Å
659	Q	25.4	Very low	41.3	Very low	173 Å²	173	102 Å²	102	81%	0.808	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-49.9	142.7	156	-79	180	-28.3	0	0	108.1	P657 V661	P657-Q659 PolarHBondContact O-N 3.36Å; P657-Q659 VanDerWaalsContact O-N 3.13Å; Q659-V661 PolarHBondContact O-N 3.37Å
660	P	25.9	Very low	39.3	Very low	126 Å²	126	106.8 Å²	106.8	82%	0.818	62%	0.622	S	S	*	*			trans	-61.4	105.2	-177.5	24.1	-30.7	0	0	0	108.9	Q662	P660-Q662 PolarHBondContact O-N 3.19Å; P660-Q662 VanDerWaalsContact O-N 3.08Å
661	V	24.5	Very low	37.3	Very low	117 Å²	117	111.8 Å²	111.8	71%	0.709	65%	0.65	S	S	*	*			trans	-61.9	112.7	166.9	174.7	0	0	0	0	105.5	Q659 A663	Q659-V661 PolarHBondContact O-N 3.37Å; V661-A663 PolarHBondContact O-N 3.39Å
662	Q	25.1	Very low	35.3	Very low	184 Å²	184	119.4 Å²	119.4	86%	0.86	69%	0.685	S	S	*	*			trans	-54.5	105.7	166.9	-75.2	176	-20.9	0	0	107.6	P660 P664	P660-Q662 PolarHBondContact O-N 3.19Å; P660-Q662 VanDerWaalsContact O-N 3.08Å; Q662-P664 WeakPolarHBondContact O-CD 3.22Å
663	A	23.5	Very low	33.3	Very low	83 Å²	83	126 Å²	126	69%	0.686	73%	0.727	S	S	*	*			trans	-62.6	124.8	171.3	0	0	0	0	0	108.3	V661 T665	V661-A663 PolarHBondContact O-N 3.39Å; A663-T665 PolarHBondContact O-N 3.3Å
664	P	27	Very low	31.5	Very low	120 Å²	120	125.4 Å²	125.4	78%	0.779	75%	0.748	S	S	*	*			trans	-69.1	124.9	169.6	27.6	-29	0	0	0	107.9	Q662 G666	Q662-P664 WeakPolarHBondContact O-CD 3.22Å; P664-G666 PolarHBondContact O-N 3.49Å
665	T	28.5	Very low	29.8	Very low	152 Å²	152	127.6 Å²	127.6	93%	0.933	76%	0.763	S	S	*	*			trans	-56.6	104.3	172.9	44.6	0	0	0	0	110.5	A663	A663-T665 PolarHBondContact O-N 3.3Å
666	G	26.8	Very low	28.1	Very low	70 Å²	70	130.2 Å²	130.2	72%	0.722	80%	0.796	S	S	*	*			trans	-129	106	172	0	0	0	0	0	110.5	P664	P664-G666 PolarHBondContact O-N 3.49Å
667	R	29.4	Very low	27.1	Very low	252 Å²	252	134.6 Å²	134.6	95%	0.951	82%	0.82	S	S	*	*			trans	-55.4	130.4	170.5	-83.1	171.9	163.6	156.9	-5.8	111
668	A	25.2	Very low	26.4	Very low	100 Å²	100	136.1 Å²	136.1	83%	0.826	82%	0.821	S	S	*	*			trans	-151.2	143.3	150.9	0	0	0	0	0	110.9
669	H	26.4	Very low	26.1	Very low	180 Å²	180	133 Å²	133	83%	0.833	82%	0.818	S	S	*	*			trans	-74.9	151.1	-160.6	-83	-95.8	0	0	0	115.9
670	S	26.3	Very low	26.2	Very low	99 Å²	99	136.2 Å²	136.2	69%	0.692	82%	0.822	S	S	*	*			trans	-35.4	143.6	159.7	51.8	0	0	0	0	117.1
671	T	26.8	Very low	26.2	Very low	149 Å²	149	136.3 Å²	136.3	91%	0.914	82%	0.821	S	S	*	*			trans	-148.8	134.3	135	22	0	0	0	0	110.5
672	M	25.7	Very low	26.3	Very low	176 Å²	176	135.9 Å²	135.9	87%	0.867	83%	0.83	S	S	*	*			trans	-91.3	147	-178	-64	-156.3	81.9	0	0	112.2
673	T	27.6	Very low	26.3	Very low	146 Å²	146	132 Å²	132	90%	0.896	82%	0.823	S	S	*	*			trans	-171.1	126.8	140.2	47.5	0	0	0	0	105.5
674	G	24.9	Very low	26.7	Very low	75 Å²	75	134.7 Å²	134.7	77%	0.773	84%	0.837	S	S	*	*			cis	125.5	92.4	17.6	0	0	0	0	0	108.7
675	S	26.7	Very low	26.8	Very low	126 Å²	126	131.6 Å²	131.6	88%	0.881	83%	0.827	S	S	*	*			trans	175.8	115.1	145.6	59.5	0	0	0	0	110.3
676	G	24.1	Very low	26.9	Very low	76 Å²	76	127.4 Å²	127.4	78%	0.784	80%	0.804	S	S	*	*			trans	-87	160.7	-179.7	0	0	0	0	0	114
677	V	27.8	Very low	27.4	Very low	144 Å²	144	128.9 Å²	128.9	87%	0.873	80%	0.803	S	S	*	*			trans	-144.8	115.4	144.1	-172.7	0	0	0	0	106.7
678	D	25.4	Very low	27.5	Very low	155 Å²	155	121.7 Å²	121.7	83%	0.829	79%	0.787	S	S	*	*			trans	-71.8	130.7	169.1	-80.3	-48.5	0	0	0	110.1
679	A	25.3	Very low	27.6	Very low	89 Å²	89	125.8 Å²	125.8	74%	0.736	78%	0.781	S	S	*	*			trans	-145.9	95.9	152.4	0	0	0	0	0	109.1	T681	A679-T681 PolarHBondContact O-N 2.93Å
680	R	26.5	Very low	27.8	Very low	241 Å²	241	122.9 Å²	122.9	91%	0.909	77%	0.768	S	S	*	*			trans	-66.3	115.2	163.1	-69	177.3	-179.4	162.3	0.6	108
681	T	25.7	Very low	28.4	Very low	128 Å²	128	119.9 Å²	119.9	79%	0.785	75%	0.752	S	S	*	*			trans	-144	108.1	154.9	-17.8	0	0	0	0	107.5	A679 S683	A679-T681 PolarHBondContact O-N 2.93Å; T681-S683 PolarHBondContact O-N 3Å
682	A	28.2	Very low	29	Very low	108 Å²	108	114.5 Å²	114.5	89%	0.893	72%	0.717	S	S	*	*			trans	-63.5	125.4	167.2	0	0	0	0	0	108.4
683	S	25.1	Very low	29.5	Very low	104 Å²	104	111.7 Å²	111.7	73%	0.727	71%	0.705	S	S	*	*			trans	-143.3	93.9	166.9	174.1	0	0	0	0	107.6	T681 G685	T681-S683 PolarHBondContact O-N 3Å; S683-G685 PolarHBondContact O-N 3.35Å; S683-G685 VanDerWaalsContact O-N 3.14Å
684	S	31	Very low	30.6	Very low	138 Å²	138	110.9 Å²	110.9	97%	0.965	69%	0.691	S	S	*	*			trans	-60.4	103.9	160	-77.2	0	0	0	0	108.3
685	G	29.9	Very low	31.8	Very low	56 Å²	56	108.4 Å²	108.4	58%	0.577	66%	0.662	S	S	*	*			trans	-175.1	8	176.7	0	0	0	0	0	116.8	S683	S683-G685 PolarHBondContact O-N 3.35Å; S683-G685 VanDerWaalsContact O-N 3.14Å
686	S	30.1	Very low	33.1	Very low	63 Å²	63	107.1 Å²	107.1	44%	0.441	64%	0.644	S	S	.	*			trans	-94.4	-15.1	-169.1	-170.7	0	0	0	0	115.8	V688 W689 E690	S686-V688 VanDerWaalsContact C-N 3.32Å; S686-V688 PolarHBondContact O-N 3.44Å; S686-W689 PolarHBondContact O-N 2.85Å; S686-E690 PolarHBondContact O-N 3.21Å; S686-E690 VanDerWaalsContact O-N 3.15Å; S686-E690 PolarHBondContact OG-OE2 2.85Å
687	S	37.6	Very low	34.8	Very low	101 Å²	101	107.6 Å²	107.6	71%	0.706	63%	0.632	S	S	*	*	H	α-helix	trans	-68.5	-24.8	-166.2	58.1	0	0	0	0	115.4	G691	S687-G691 PolarHBondContact O-N 3.31Å
688	V	31.1	Very low	36.5	Very low	101 Å²	101	105.8 Å²	105.8	61%	0.612	62%	0.617	S	S	*	*	H	α-helix	trans	-78.3	-43.4	-179.8	-179.6	0	0	0	0	111.1	S686 G691 Q692	S686-V688 VanDerWaalsContact C-N 3.32Å; S686-V688 PolarHBondContact O-N 3.44Å; V688-G691 PolarHBondContact O-N 2.69Å; V688-Q692 VanDerWaalsContact O-CB 3.31Å; V688-Q692 WeakPolarHBondContact O-CB 3.32Å; V688-Q692 PolarHBondContact O-N 2.85Å; V688-Q692 VanDerWaalsContact O-N 3.07Å
689	W	27.4	Very low	38.5	Very low	186 Å²	186	102 Å²	102	71%	0.705	60%	0.602	S	S	*	*	H	α-helix	trans	-70.4	-38	179.7	-70.2	95.6	0	0	0	112	S686 L693	S686-W689 PolarHBondContact O-N 2.85Å; W689-L693 WeakPolarHBondContact O-CB 3.5Å; W689-L693 PolarHBondContact O-N 3.43Å; W689-L693 VanDerWaalsContact O-N 3.09Å
690	E	30.3	Very low	40.6	Very low	120 Å²	120	103 Å²	103	56%	0.561	59%	0.592	S	S	*	*	H	α-helix	trans	-64.9	-45.7	173.1	-98.8	164	141.5	0	0	112	S686 Q692 Q694	S686-E690 PolarHBondContact O-N 3.21Å; S686-E690 VanDerWaalsContact O-N 3.15Å; S686-E690 PolarHBondContact OG-OE2 2.85Å; E690-Q692 VanDerWaalsContact C-N 3.31Å; E690-Q692 PolarHBondContact O-N 3.45Å; E690-Q694 VanDerWaalsContact O-CB 3.28Å; E690-Q694 WeakPolarHBondContact O-CB 3.28Å; E690-Q694 PolarHBondContact O-N 3.47Å; E690-Q694 VanDerWaalsContact O-N 3.08Å
691	G	39	Very low	42.9	Very low	35 Å²	35	96 Å²	96	36%	0.361	57%	0.566	S	S	.	*	H	α-helix	trans	-62.8	-35	177.8	0	0	0	0	0	113.7	S687 V688 S695	S687-G691 PolarHBondContact O-N 3.31Å; V688-G691 PolarHBondContact O-N 2.69Å; G691-S695 WeakPolarHBondContact O-CB 3.33Å; G691-S695 PolarHBondContact O-N 2.89Å
692	Q	38.9	Very low	45.4	Very low	36 Å²	36	90.7 Å²	90.7	17%	0.168	54%	0.536	C	S	.	.	H	α-helix	trans	-78.2	-41	-177.4	-167.9	180	-12.4	0	0	113.1	Y177 V688 E690 Q694 S695 L696	Y177-Q692 VanDerWaalsContact O-CD 3.27Å; Y177-Q692 PolarHBondContact O-NE2 2.93Å; V688-Q692 VanDerWaalsContact O-CB 3.31Å; V688-Q692 WeakPolarHBondContact O-CB 3.32Å; V688-Q692 PolarHBondContact O-N 2.85Å; V688-Q692 VanDerWaalsContact O-N 3.07Å; E690-Q692 VanDerWaalsContact C-N 3.31Å; E690-Q692 PolarHBondContact O-N 3.45Å; Q692-Q694 PolarHBondContact O-N 2.92Å; Q692-S695 PolarHBondContact O-N 3.03Å; Q692-L696 PolarHBondContact O-N 3.44Å
693	L	37.7	Very low	47.8	Very low	118 Å²	118	86.3 Å²	86.3	62%	0.618	50%	0.498	S	S	*	.	H	α-helix	trans	-60	-39.6	170	-110	148.6	0	0	0	110.4	W689 V697	W689-L693 WeakPolarHBondContact O-CB 3.5Å; W689-L693 PolarHBondContact O-N 3.43Å; W689-L693 VanDerWaalsContact O-N 3.09Å; L693-V697 VanDerWaalsContact O-CB 3.31Å; L693-V697 WeakPolarHBondContact O-CB 3.36Å; L693-V697 WeakPolarHBondContact O-CG2 3.22Å; L693-V697 PolarHBondContact O-N 3.26Å
694	Q	48.9	Very low	50.4	Low	129 Å²	129	82.2 Å²	82.2	60%	0.603	47%	0.469	S	S	*	.	H	α-helix	trans	-65.5	-41.7	176.1	-146	159.9	17.7	0	0	111.6	E690 Q692 L698	E690-Q694 VanDerWaalsContact O-CB 3.28Å; E690-Q694 WeakPolarHBondContact O-CB 3.28Å; E690-Q694 PolarHBondContact O-N 3.47Å; E690-Q694 VanDerWaalsContact O-N 3.08Å; Q692-Q694 PolarHBondContact O-N 2.92Å; Q694-L698 HydrophobicContact CG-CD1 4.45Å; Q694-L698 VanDerWaalsContact O-CB 3.24Å; Q694-L698 WeakPolarHBondContact O-CB 3.34Å; Q694-L698 WeakPolarHBondContact O-CD1 3.47Å; Q694-L698 WeakPolarHBondContact O-CG 3.36Å; Q694-L698 PolarHBondContact O-N 3.43Å
695	S	50.6	Low	52.9	Low	23 Å²	23	77.5 Å²	77.5	16%	0.161	43%	0.431	C	S	.	.	H	α-helix	trans	-65.4	-43.7	177.6	-173	0	0	0	0	113.5	T179 G691 Q692 L698 S699	T179-S695 WeakPolarHBondContact CG2-OG 3.36Å; T179-S695 PolarHBondContact OG1-OG 3.4Å; T179-S695 VanDerWaalsContact OG1-OG 3.11Å; G691-S695 WeakPolarHBondContact O-CB 3.33Å; G691-S695 PolarHBondContact O-N 2.89Å; Q692-S695 PolarHBondContact O-N 3.03Å; S695-L698 PolarHBondContact O-N 2.97Å; S695-S699 PolarHBondContact O-N 2.03Å
696	L	54.8	Low	55.6	Low	99 Å²	99	75 Å²	75	52%	0.518	41%	0.405	S	S	.	.	H	α-helix	trans	-65.1	-44.6	176.3	-73.7	169.4	0	0	0	111.8	Q692 L698 S699 E700	Q692-L696 PolarHBondContact O-N 3.44Å; L696-L698 VanDerWaalsContact C-N 3.31Å; L696-L698 PolarHBondContact O-N 2.82Å; L696-S699 PolarHBondContact O-N 3.03Å; L696-E700 PolarHBondContact O-N 3.49Å
697	V	58.6	Low	58.2	Low	85 Å²	85	72 Å²	72	52%	0.515	38%	0.384	S	S	.	.	H	α-helix	trans	-63	-39.5	175.7	170.9	0	0	0	0	111	L693 E700 Y701	L693-V697 VanDerWaalsContact O-CB 3.31Å; L693-V697 WeakPolarHBondContact O-CB 3.36Å; L693-V697 WeakPolarHBondContact O-CG2 3.22Å; L693-V697 PolarHBondContact O-N 3.26Å; V697-E700 PolarHBondContact O-N 3.28Å; V697-Y701 VanDerWaalsContact O-CB 3.25Å; V697-Y701 WeakPolarHBondContact O-CB 3.42Å; V697-Y701 PolarHBondContact O-N 3.05Å
698	L	63.5	Low	60.4	Low	107 Å²	107	67.5 Å²	67.5	56%	0.56	35%	0.352	S	S	*	.	H	α-helix	trans	-65.9	-37.7	175.1	-75.1	168.5	0	0	0	112.3	Q694 S695 L696 Y701 A702	Q694-L698 HydrophobicContact CG-CD1 4.45Å; Q694-L698 VanDerWaalsContact O-CB 3.24Å; Q694-L698 WeakPolarHBondContact O-CB 3.34Å; Q694-L698 WeakPolarHBondContact O-CD1 3.47Å; Q694-L698 WeakPolarHBondContact O-CG 3.36Å; Q694-L698 PolarHBondContact O-N 3.43Å; S695-L698 PolarHBondContact O-N 2.97Å; L696-L698 VanDerWaalsContact C-N 3.31Å; L696-L698 PolarHBondContact O-N 2.82Å; L698-Y701 PolarHBondContact O-N 2.94Å; L698-A702 WeakPolarHBondContact O-CB 3.35Å; L698-A702 PolarHBondContact O-N 3.26Å
699	S	67.3	Low	63	Low	76 Å²	76	63.4 Å²	63.4	53%	0.531	33%	0.326	S	S	.	.	H	α-helix	trans	-66.8	-42.2	176.5	-174.4	0	0	0	0	112.3	S695 L696 S703	S695-S699 PolarHBondContact O-N 2.03Å; L696-S699 PolarHBondContact O-N 3.03Å; S699-S703 WeakPolarHBondContact O-CB 3.48Å; S699-S703 PolarHBondContact O-N 3.48Å
700	E	69.6	Low	65.8	Low	110 Å²	110	54.5 Å²	54.5	51%	0.514	29%	0.292	S	S	.	.	H	α-helix	trans	-65	-41.7	174.3	-71.2	-169.6	165.1	0	0	111.7	L696 V697 S703 T704	L696-E700 PolarHBondContact O-N 3.49Å; V697-E700 PolarHBondContact O-N 3.28Å; E700-S703 PolarHBondContact O-N 3.15Å; E700-T704 WeakPolarHBondContact O-CG2 3.32Å; E700-T704 PolarHBondContact O-N 3.31Å; E700-T704 PolarHBondContact O-OG1 3.22Å
701	Y	76.3	Confident	68.5	Low	92 Å²	92	49 Å²	49	36%	0.361	27%	0.267	S	S	.	.	H	α-helix	trans	-61.2	-52.7	175.2	-172.3	-89.8	0	0	0	111.9	F655 V697 L698 S703 T704 E705	F655-Y701 VanDerWaalsContact C-OH 3.27Å; F655-Y701 WeakPolarHBondContact CA-OH 3.24Å; F655-Y701 HydrophobicContact CB-CE1 4.44Å; F655-Y701 WeakPolarHBondContact CB-OH 3.11Å; F655-Y701 HydrophobicContact CD1-CD1 4.23Å; F655-Y701 AromaticContact CD1-CD2 3.78Å; F655-Y701 HydrophobicContact CD1-CD2 3.78Å; F655-Y701 AromaticContact CD1-CE1 3.73Å; F655-Y701 HydrophobicContact CD1-CE1 3.73Å; F655-Y701 AromaticContact CD1-CE2 3.22Å; F655-Y701 HydrophobicContact CD1-CE2 3.22Å; F655-Y701 HydrophobicContact CD1-CG 4.27Å; F655-Y701 AromaticContact CD1-CZ 3.22Å; F655-Y701 AromaticContact CE1-CD2 3.75Å; F655-Y701 HydrophobicContact CE1-CD2 3.75Å; F655-Y701 AromaticContact CE1-CE2 3.58Å; F655-Y701 HydrophobicContact CE1-CE2 3.58Å; F655-Y701 HydrophobicContact CE1-CG 4.38Å; F655-Y701 HydrophobicContact CG-CE2 4.21Å; F655-Y701 AromaticContact CG-CZ 3.97Å; F655-Y701 PolarHBondContact O-OH 3.47Å; V697-Y701 VanDerWaalsContact O-CB 3.25Å; V697-Y701 WeakPolarHBondContact O-CB 3.42Å; V697-Y701 PolarHBondContact O-N 3.05Å; L698-Y701 PolarHBondContact O-N 2.94Å; Y701-S703 PolarHBondContact O-N 2.95Å; Y701-T704 PolarHBondContact O-N 2.76Å; Y701-T704 VanDerWaalsContact O-N 3.12Å; Y701-T704 PolarHBondContact O-OG1 2.96Å; Y701-E705 WeakPolarHBondContact O-CB 3.4Å; Y701-E705 PolarHBondContact O-N 3.24Å
702	A	77.7	Confident	70.7	Confident	18 Å²	18	47.3 Å²	47.3	15%	0.149	25%	0.25	C	C	.	.	H	α-helix	trans	-54.4	-42.2	176.9	0	0	0	0	0	111.2	I562 L698 M706	I562-A702 HydrophobicContact CG2-CB 3.69Å; I562-A702 WeakPolarHBondContact CG2-O 3.18Å; L698-A702 WeakPolarHBondContact O-CB 3.35Å; L698-A702 PolarHBondContact O-N 3.26Å; A702-M706 PolarHBondContact O-N 3.35Å
703	S	78.1	Confident	73	Confident	16 Å²	16	45.8 Å²	45.8	11%	0.112	24%	0.242	C	C	.	.	H	α-helix	trans	-75.9	-30.7	-179.6	-168.9	0	0	0	0	114.5	R356 S699 E700 Y701 S707	R356-S703 PolarHBondContact NH1-OG 3.43Å; R356-S703 PolarHBondContact NH2-OG 3.16Å; S699-S703 WeakPolarHBondContact O-CB 3.48Å; S699-S703 PolarHBondContact O-N 3.48Å; E700-S703 PolarHBondContact O-N 3.15Å; Y701-S703 PolarHBondContact O-N 2.95Å; S703-S707 WeakPolarHBondContact O-CB 3.33Å; S703-S707 PolarHBondContact O-N 3.02Å; S703-S707 PolarHBondContact O-OG 3.21Å
704	T	79.5	Confident	75.3	Confident	17 Å²	17	40.3 Å²	40.3	10%	0.104	21%	0.214	C	C	.	.	H	α-helix	trans	-69.8	-39.6	172.8	50.8	0	0	0	0	111.1	E700 Y701 S707 L708	E700-T704 WeakPolarHBondContact O-CG2 3.32Å; E700-T704 PolarHBondContact O-N 3.31Å; E700-T704 PolarHBondContact O-OG1 3.22Å; Y701-T704 PolarHBondContact O-N 2.76Å; Y701-T704 VanDerWaalsContact O-N 3.12Å; Y701-T704 PolarHBondContact O-OG1 2.96Å; T704-S707 WeakPolarHBondContact O-CB 3.32Å; T704-S707 PolarHBondContact O-N 3.21Å; T704-L708 WeakPolarHBondContact O-CG 3.45Å; T704-L708 PolarHBondContact O-N 2.88Å
705	E	83.3	Confident	77	Confident	39 Å²	39	35.2 Å²	35.2	18%	0.182	19%	0.19	C	C	.	.	H	α-helix	trans	-56.3	-50.7	171	-176.3	-178.2	176.7	0	0	110.9	I562 F655 Y701 S707 L708 H709	I562-E705 HydrophobicContact CD1-CG 4.28Å; F655-E705 HydrophobicContact CD1-CB 4.4Å; Y701-E705 WeakPolarHBondContact O-CB 3.4Å; Y701-E705 PolarHBondContact O-N 3.24Å; E705-S707 VanDerWaalsContact C-N 3.33Å; E705-S707 PolarHBondContact O-N 2.92Å; E705-L708 PolarHBondContact O-N 3.46Å; E705-H709 WeakPolarHBondContact O-CB 3.47Å; E705-H709 PolarHBondContact O-CD2 2.9Å; E705-H709 PolarHBondContact O-N 3.44Å; E705-H709 IonicContact OE1-NE2 3.72Å
706	M	87.6	Confident	78.5	Confident	4 Å²	4	35 Å²	35	2%	0.02	19%	0.186	C	C	.	.	H	α-helix	trans	-61.6	-39.6	176.6	-176.6	60.6	-164.1	0	0	112.6	H446 L555 M558 H559 I562 A702 L708 H709 A710	H446-M706 WeakPolarHBondContact CE1-CG 3.28Å; L555-M706 HydrophobicContact CB-CE 4.41Å; L555-M706 HydrophobicContact CD2-CE 4.14Å; L555-M706 WeakPolarHBondContact O-CE 3.41Å; M558-M706 HydrophobicContact CB-CE 4.31Å; M558-M706 HydrophobicContact CB-SD 4.02Å; H559-M706 HydrophobicContact CB-CE 4.02Å; H559-M706 HydrophobicContact CB-SD 4.17Å; I562-M706 HydrophobicContact CD1-CB 4.04Å; I562-M706 HydrophobicContact CD1-SD 3.87Å; A702-M706 PolarHBondContact O-N 3.35Å; M706-L708 VanDerWaalsContact C-N 3.34Å; M706-L708 PolarHBondContact O-N 3.37Å; M706-H709 PolarHBondContact O-N 3.43Å; M706-A710 WeakPolarHBondContact O-CB 3.47Å; M706-A710 PolarHBondContact O-N 3.1Å
707	S	84.8	Confident	79.9	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.007	16%	0.164	C	C	.	.	H	α-helix	trans	-61.4	-43.4	179.2	-58.3	0	0	0	0	111.6	A443 S703 T704 E705 A710 L711	A443-S707 VanDerWaalsContact O-CA 3.24Å; A443-S707 WeakPolarHBondContact O-CA 3.34Å; A443-S707 WeakPolarHBondContact O-CB 3.25Å; A443-S707 PolarHBondContact O-OG 3.19Å; A443-S707 VanDerWaalsContact O-OG 3.09Å; S703-S707 WeakPolarHBondContact O-CB 3.33Å; S703-S707 PolarHBondContact O-N 3.02Å; S703-S707 PolarHBondContact O-OG 3.21Å; T704-S707 WeakPolarHBondContact O-CB 3.32Å; T704-S707 PolarHBondContact O-N 3.21Å; E705-S707 VanDerWaalsContact C-N 3.33Å; E705-S707 PolarHBondContact O-N 2.92Å; S707-A710 PolarHBondContact O-N 3.45Å; S707-L711 WeakPolarHBondContact O-CG 3.33Å; S707-L711 PolarHBondContact O-N 3.47Å; S707-L711 VanDerWaalsContact O-N 3.13Å
708	L	84.2	Confident	81	Confident	5 Å²	5	30 Å²	30	3%	0.026	15%	0.154	C	C	.	.	H	α-helix	trans	-68.4	-40.5	176.9	-70.2	172.9	0	0	0	111.6	V624 V648 A651 L652 F655 T704 E705 M706 L711 Y712	V624-L708 HydrophobicContact CG2-CD2 4.36Å; V648-L708 HydrophobicContact CG1-CB 4.46Å; V648-L708 HydrophobicContact CG1-CD2 4.44Å; V648-L708 WeakPolarHBondContact CG1-O 3.31Å; A651-L708 HydrophobicContact CB-CD1 4.14Å; A651-L708 HydrophobicContact CB-CD2 4.32Å; L652-L708 HydrophobicContact CD1-CB 4.39Å; L652-L708 HydrophobicContact CD2-CB 3.41Å; L652-L708 VanDerWaalsContact CD2-CB 3.41Å; L652-L708 HydrophobicContact CD2-CD1 4.17Å; L652-L708 HydrophobicContact CD2-CG 4.45Å; L652-L708 HydrophobicContact CG-CB 3.74Å; L652-L708 HydrophobicContact CG-CD1 4.41Å; F655-L708 HydrophobicContact CD2-CD1 4.03Å; F655-L708 HydrophobicContact CE2-CD1 3.56Å; F655-L708 HydrophobicContact CZ-CD1 4.21Å; T704-L708 WeakPolarHBondContact O-CG 3.45Å; T704-L708 PolarHBondContact O-N 2.88Å; E705-L708 PolarHBondContact O-N 3.46Å; M706-L708 VanDerWaalsContact C-N 3.34Å; M706-L708 PolarHBondContact O-N 3.37Å; L708-L711 PolarHBondContact O-N 3.09Å; L708-Y712 WeakPolarHBondContact O-CB 3.42Å; L708-Y712 PolarHBondContact O-N 3.01Å
709	H	85.6	Confident	81.6	Confident	15 Å²	15	27.5 Å²	27.5	7%	0.069	14%	0.139	C	C	.	.	H	α-helix	trans	-61.9	-41.6	174.9	-94	-52.8	0	0	0	112.7	M558 E705 M706 Y712 M713	M558-H709 HydrophobicContact CE-CB 3.4Å; M558-H709 VanDerWaalsContact CE-CB 3.4Å; E705-H709 WeakPolarHBondContact O-CB 3.47Å; E705-H709 PolarHBondContact O-CD2 2.9Å; E705-H709 PolarHBondContact O-N 3.44Å; E705-H709 IonicContact OE1-NE2 3.72Å; M706-H709 PolarHBondContact O-N 3.43Å; H709-Y712 PolarHBondContact O-N 3.38Å; H709-M713 WeakPolarHBondContact O-CG 3.42Å; H709-M713 PolarHBondContact O-N 3.03Å
710	A	86.3	Confident	82.1	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.8	-47.1	174.8	0	0	0	0	0	111.1	H446 L555 M706 S707 Y712 M713 H714	H446-A710 HydrophobicContact CB-CB 4.14Å; L555-A710 HydrophobicContact CD2-CB 4.41Å; M706-A710 WeakPolarHBondContact O-CB 3.47Å; M706-A710 PolarHBondContact O-N 3.1Å; S707-A710 PolarHBondContact O-N 3.45Å; A710-Y712 VanDerWaalsContact C-N 3.3Å; A710-Y712 PolarHBondContact O-N 2.9Å; A710-M713 PolarHBondContact O-N 3.21Å; A710-H714 PolarHBondContact O-CD2 3.02Å; A710-H714 VanDerWaalsContact O-CD2 3.25Å; A710-H714 PolarHBondContact O-N 2.94Å
711	L	85.2	Confident	82.1	Confident	4 Å²	4	24 Å²	24	2%	0.021	12%	0.124	C	C	.	.	H	α-helix	trans	-58.3	-42.9	175.1	-72.3	176.1	0	0	0	112.1	L442 A443 V648 S707 L708 Q715	L442-L711 HydrophobicContact CD2-CD2 4.04Å; L442-L711 HydrophobicContact CG-CD2 4.16Å; A443-L711 HydrophobicContact CB-CD1 3.89Å; A443-L711 HydrophobicContact CB-CD2 4.17Å; A443-L711 HydrophobicContact CB-CG 3.97Å; V648-L711 HydrophobicContact CG1-CB 4.39Å; S707-L711 WeakPolarHBondContact O-CG 3.33Å; S707-L711 PolarHBondContact O-N 3.47Å; S707-L711 VanDerWaalsContact O-N 3.13Å; L708-L711 PolarHBondContact O-N 3.09Å; L711-Q715 WeakPolarHBondContact O-CG 3.49Å; L711-Q715 PolarHBondContact O-N 3.38Å; L711-Q715 VanDerWaalsContact O-N 3.09Å
712	Y	86.3	Confident	81.7	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-63.6	-46.9	178.4	-179.7	-96.1	0	0	0	112.1	L580 Q583 V584 D587 R645 A649 L652 L708 H709 A710 H714 Q715 L716	L580-Y712 HydrophobicContact CD1-CD1 4.08Å; L580-Y712 HydrophobicContact CD1-CE1 3.78Å; Q583-Y712 VanDerWaalsContact CG-OH 3.26Å; Q583-Y712 WeakPolarHBondContact CG-OH 3.47Å; V584-Y712 HydrophobicContact CG2-CD1 3.77Å; V584-Y712 HydrophobicContact CG2-CD2 4.38Å; V584-Y712 HydrophobicContact CG2-CE1 3.52Å; V584-Y712 HydrophobicContact CG2-CE2 4.17Å; V584-Y712 HydrophobicContact CG2-CG 4.19Å; D587-Y712 WeakPolarHBondContact OD2-CE2 3.33Å; D587-Y712 PolarHBondContact OD2-OH 2.86Å; R645-Y712 HydrophobicContact CG-CD2 4.06Å; R645-Y712 HydrophobicContact CG-CE2 3.72Å; R645-Y712 PolarHBondContact NH2-OH 3.34Å; A649-Y712 HydrophobicContact CB-CD2 4.34Å; A649-Y712 HydrophobicContact CB-CE2 4.06Å; L652-Y712 HydrophobicContact CD1-CG 4.3Å; L708-Y712 WeakPolarHBondContact O-CB 3.42Å; L708-Y712 PolarHBondContact O-N 3.01Å; H709-Y712 PolarHBondContact O-N 3.38Å; A710-Y712 VanDerWaalsContact C-N 3.3Å; A710-Y712 PolarHBondContact O-N 2.9Å; Y712-H714 PolarHBondContact O-N 3.07Å; Y712-Q715 PolarHBondContact O-N 3.4Å; Y712-L716 WeakPolarHBondContact O-CB 3.4Å; Y712-L716 PolarHBondContact O-N 3.38Å
713	M	86.8	Confident	80.9	Confident	3 Å²	3	27.5 Å²	27.5	2%	0.015	16%	0.155	C	C	.	.	H	α-helix	trans	-60.8	-43.9	178.5	-74.8	-62.7	-68	0	0	112	W534 E554 L555 M558 F576 L580 H709 A710 Q715 L716 H717	W534-M713 HydrophobicContact CE3-CB 4.42Å; W534-M713 HydrophobicContact CE3-CE 4.23Å; W534-M713 HydrophobicContact CZ3-CB 4.19Å; E554-M713 HydrophobicContact CB-CE 4.43Å; L555-M713 HydrophobicContact CD2-CB 4.3Å; L555-M713 HydrophobicContact CD2-CG 4.38Å; M558-M713 HydrophobicContact CE-CG 4.09Å; M558-M713 HydrophobicContact SD-CG 4.01Å; M558-M713 HydrophobicContact SD-SD 4.39Å; F576-M713 HydrophobicContact CZ-CE 4.27Å; L580-M713 HydrophobicContact CD1-SD 3.53Å; L580-M713 VanDerWaalsContact CD1-SD 3.53Å; L580-M713 HydrophobicContact CD2-SD 3.97Å; L580-M713 HydrophobicContact CG-SD 4.42Å; H709-M713 WeakPolarHBondContact O-CG 3.42Å; H709-M713 PolarHBondContact O-N 3.03Å; A710-M713 PolarHBondContact O-N 3.21Å; M713-Q715 VanDerWaalsContact C-N 3.3Å; M713-Q715 PolarHBondContact O-N 3.46Å; M713-L716 PolarHBondContact O-N 3.22Å; M713-L716 HydrophobicContact SD-CD2 4.42Å; M713-H717 WeakPolarHBondContact O-CB 3.45Å; M713-H717 PolarHBondContact O-N 3Å
714	H	86.6	Confident	79.5	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.019	19%	0.186	C	C	.	.	H	α-helix	trans	-62.2	-37	175.7	-89.5	-92.1	0	0	0	112.7	L442 H446 Q453 W534 A710 Y712 K718	L442-H714 WeakPolarHBondContact CD1-NE2 3.38Å; L442-H714 HydrophobicContact CD2-CB 4.1Å; H446-H714 PolarHBondContact O-NE2 2.97Å; Q453-H714 PolarHBondContact NE2-ND1 3.29Å; W534-H714 AromaticContact CH2-CD2 3.89Å; W534-H714 AromaticContact CH2-CE1 3.59Å; W534-H714 AromaticContact CH2-ND1 3.95Å; W534-H714 AromaticContact CH2-NE2 3.56Å; A710-H714 PolarHBondContact O-CD2 3.02Å; A710-H714 VanDerWaalsContact O-CD2 3.25Å; A710-H714 PolarHBondContact O-N 2.94Å; Y712-H714 PolarHBondContact O-N 3.07Å; H714-K718 WeakPolarHBondContact O-CB 3.41Å; H714-K718 PolarHBondContact O-N 3.38Å; H714-K718 VanDerWaalsContact O-N 3.09Å
715	Q	84.6	Confident	77.7	Confident	22 Å²	22	38.7 Å²	38.7	10%	0.103	21%	0.213	C	C	.	.	H	α-helix	trans	-72.6	-38.4	176.7	-71.4	169.8	17.7	0	0	112.6	H644 L711 Y712 M713 K718 Q719	H644-Q715 PolarHBondContact CD2-NE2 2.87Å; H644-Q715 PolarHBondContact NE2-NE2 3.2Å; L711-Q715 WeakPolarHBondContact O-CG 3.49Å; L711-Q715 PolarHBondContact O-N 3.38Å; L711-Q715 VanDerWaalsContact O-N 3.09Å; Y712-Q715 PolarHBondContact O-N 3.4Å; M713-Q715 VanDerWaalsContact C-N 3.3Å; M713-Q715 PolarHBondContact O-N 3.46Å; Q715-K718 PolarHBondContact O-N 3.36Å; Q715-Q719 PolarHBondContact O-N 3.28Å
716	L	82.9	Confident	75.4	Confident	17 Å²	17	45.7 Å²	45.7	9%	0.089	25%	0.246	C	C	.	.	H	α-helix	trans	-60.6	-51.3	173.8	176.8	66.5	0	0	0	110.4	R645 Y712 M713 K718 Q719 Q720	R645-L716 VanDerWaalsContact CZ-CD1 3.49Å; R645-L716 VanDerWaalsContact NH1-CD1 3.26Å; R645-L716 VanDerWaalsContact NH2-CD1 3.33Å; Y712-L716 WeakPolarHBondContact O-CB 3.4Å; Y712-L716 PolarHBondContact O-N 3.38Å; M713-L716 PolarHBondContact O-N 3.22Å; M713-L716 HydrophobicContact SD-CD2 4.42Å; L716-K718 VanDerWaalsContact C-N 3.32Å; L716-K718 PolarHBondContact O-N 3.22Å; L716-Q719 PolarHBondContact O-N 2.99Å; L716-Q719 VanDerWaalsContact O-N 3.15Å; L716-Q720 PolarHBondContact O-N 3.3Å
717	H	83.8	Confident	72.8	Confident	8 Å²	8	56.3 Å²	56.3	4%	0.037	29%	0.285	C	S	.	.	H	α-helix	trans	-54.9	-47.4	177.6	172.7	60	0	0	0	111.5	D450 Q533 W534 M713 Q719 Q720 A721	D450-H717 IonicContact OD1-CD2 2.8Å; D450-H717 IonicContact OD1-NE2 3.1Å; D450-H717 PolarHBondContact OD1-NE2 3.47Å; D450-H717 IonicContact OD2-NE2 3.68Å; Q533-H717 PolarHBondContact O-ND1 3.21Å; Q533-H717 PolarHBondContact OE1-CE1 3.04Å; W534-H717 HydrophobicContact CD2-CB 4.47Å; M713-H717 WeakPolarHBondContact O-CB 3.45Å; M713-H717 PolarHBondContact O-N 3Å; H717-Q719 VanDerWaalsContact C-N 3.33Å; H717-Q719 PolarHBondContact O-N 3.11Å; H717-Q720 PolarHBondContact O-N 3.18Å; H717-A721 WeakPolarHBondContact O-CB 3.36Å; H717-A721 PolarHBondContact O-N 2.65Å
718	K	81.2	Confident	70.6	Confident	73 Å²	73	63.8 Å²	63.8	32%	0.317	32%	0.32	S	S	.	.	H	α-helix	trans	-58.8	-41.6	178.1	-176.9	177.4	-177.9	173.2	0	113.2	H714 Q715 L716 A721 Q722	H714-K718 WeakPolarHBondContact O-CB 3.41Å; H714-K718 PolarHBondContact O-N 3.38Å; H714-K718 VanDerWaalsContact O-N 3.09Å; Q715-K718 PolarHBondContact O-N 3.36Å; L716-K718 VanDerWaalsContact C-N 3.32Å; L716-K718 PolarHBondContact O-N 3.22Å; K718-A721 PolarHBondContact O-N 3.03Å; K718-Q722 VanDerWaalsContact O-CG 3.28Å; K718-Q722 WeakPolarHBondContact O-CG 3.37Å; K718-Q722 PolarHBondContact O-N 3.32Å
719	Q	76.4	Confident	67.9	Low	54 Å²	54	70 Å²	70	25%	0.252	36%	0.358	S	S	.	.	H	α-helix	trans	-68.4	-38.6	178.7	-74.1	-178.4	-5	0	0	111.8	Q715 L716 H717 Q722 A723	Q715-Q719 PolarHBondContact O-N 3.28Å; L716-Q719 PolarHBondContact O-N 2.99Å; L716-Q719 VanDerWaalsContact O-N 3.15Å; H717-Q719 VanDerWaalsContact C-N 3.33Å; H717-Q719 PolarHBondContact O-N 3.11Å; Q719-Q722 PolarHBondContact O-N 2.94Å; Q719-A723 WeakPolarHBondContact O-CB 3.47Å; Q719-A723 PolarHBondContact O-N 2.88Å
720	Q	76.5	Confident	65.1	Low	53 Å²	53	79.9 Å²	79.9	25%	0.248	40%	0.395	C	S	.	.	H	α-helix	trans	-63.8	-44.6	174.6	-70.6	174.9	-35.4	0	0	111.2	Q533 L535 L716 H717 Q722 A723 E724	Q533-Q720 PolarHBondContact O-OE1 2.94Å; Q533-Q720 VanDerWaalsContact O-OE1 3.11Å; L535-Q720 PolarHBondContact O-NE2 2.85Å; L716-Q720 PolarHBondContact O-N 3.3Å; H717-Q720 PolarHBondContact O-N 3.18Å; Q720-Q722 PolarHBondContact O-N 3.29Å; Q720-A723 PolarHBondContact O-N 2.94Å; Q720-A723 VanDerWaalsContact O-N 3.11Å; Q720-E724 PolarHBondContact O-N 3.31Å
721	A	71.6	Confident	62.4	Low	58 Å²	58	86.8 Å²	86.8	48%	0.479	43%	0.426	S	S	.	.	H	α-helix	trans	-62.5	-29.5	176	0	0	0	0	0	113.3	H717 K718	H717-A721 WeakPolarHBondContact O-CB 3.36Å; H717-A721 PolarHBondContact O-N 2.65Å; K718-A721 PolarHBondContact O-N 3.03Å
722	Q	66.9	Low	59.8	Low	105 Å²	105	98.2 Å²	98.2	49%	0.491	47%	0.469	S	S	.	.	H	α-helix	trans	-81.1	-26.6	175	-72.8	177.6	-25.3	0	0	113.2	K718 Q719 Q720	K718-Q722 VanDerWaalsContact O-CG 3.28Å; K718-Q722 WeakPolarHBondContact O-CG 3.37Å; K718-Q722 PolarHBondContact O-N 3.32Å; Q719-Q722 PolarHBondContact O-N 2.94Å; Q720-Q722 PolarHBondContact O-N 3.29Å
723	A	60.3	Low	56.9	Low	80 Å²	80	109.2 Å²	109.2	66%	0.661	51%	0.511	S	S	*	.	H	α-helix	trans	-79.5	-21.6	178.4	0	0	0	0	0	113.3	Q719 Q720 P725	Q719-A723 WeakPolarHBondContact O-CB 3.47Å; Q719-A723 PolarHBondContact O-N 2.88Å; Q720-A723 PolarHBondContact O-N 2.94Å; Q720-A723 VanDerWaalsContact O-N 3.11Å; A723-P725 WeakPolarHBondContact O-CD 3.39Å
724	E	50	Low	54	Low	166 Å²	166	116.3 Å²	116.3	78%	0.776	54%	0.544	S	S	*	.			trans	-107	72.5	172.3	-69	-170	155.6	0	0	112.5	Q720	Q720-E724 PolarHBondContact O-N 3.31Å
725	P	40.1	Very low	51.4	Low	102 Å²	102	121 Å²	121	66%	0.662	58%	0.578	S	S	*	*			trans	-79.7	129.1	166.9	33.3	-28.8	0	0	0	108.9	A723	A723-P725 WeakPolarHBondContact O-CD 3.39Å
726	E	36.1	Very low	48.9	Very low	186 Å²	186	127.8 Å²	127.8	87%	0.869	61%	0.614	S	S	*	*	S	Bend	trans	85	84	170	-50.9	-166.4	165.1	0	0	118.3
727	R	33.1	Very low	46.5	Very low	226 Å²	226	136.1 Å²	136.1	85%	0.853	65%	0.653	S	S	*	*	S	Bend	trans	-148.3	-9.4	142.6	-120.8	179.1	-165.6	-159.2	2.9	118.5
728	H	37.9	Very low	43.9	Very low	159 Å²	159	141.3 Å²	141.3	74%	0.736	69%	0.69	S	S	*	*			trans	-136.3	49.1	-167.1	-63.4	-61.5	0	0	0	116.4
729	V	28.7	Very low	41.5	Very low	134 Å²	134	141.5 Å²	141.5	81%	0.812	71%	0.713	S	S	*	*	S	Bend	trans	-92.8	-11.1	165.9	177.7	0	0	0	0	112.7
730	W	26.6	Very low	39.2	Very low	223 Å²	223	148.4 Å²	148.4	85%	0.845	75%	0.745	S	S	*	*	S	Bend	trans	-96.3	-7.8	-169.9	-76.9	105.2	0	0	0	117.9
731	H	28.8	Very low	36.9	Very low	145 Å²	145	151.6 Å²	151.6	67%	0.671	77%	0.773	S	S	*	*	S	Bend	trans	-103.1	7.5	-174.7	-76.2	-59.3	0	0	0	116.7
732	R	30.8	Very low	34.9	Very low	244 Å²	244	153.5 Å²	153.5	92%	0.921	79%	0.789	S	S	*	*	S	Bend	trans	-85	-1.8	177.9	-165.4	175	-83.9	173.4	-5	114
733	R	25.3	Very low	33.4	Very low	231 Å²	231	154.6 Å²	154.6	87%	0.872	81%	0.805	S	S	*	*	S	Bend	trans	-120	-3.2	-169.6	-144.1	178.1	-171.7	177.9	1.3	117
734	E	25.8	Very low	32	Very low	153 Å²	153	158.3 Å²	158.3	72%	0.715	81%	0.814	S	S	*	*	S	Bend	trans	-111.5	20.2	-176.1	-71.5	-176.5	167.1	0	0	114.1
735	S	31.6	Very low	31.1	Very low	103 Å²	103	159.7 Å²	159.7	72%	0.72	82%	0.82	S	S	*	*	S	Bend	trans	-95.3	3	176.7	-54.1	0	0	0	0	114.5
736	D	32	Very low	30.5	Very low	164 Å²	164	158.7 Å²	158.7	88%	0.877	83%	0.828	S	S	*	*	S	Bend	trans	-105	1.8	-177.8	-80.9	-16.2	0	0	0	114.8
737	E	33.3	Very low	30	Very low	191 Å²	191	153.7 Å²	153.7	89%	0.893	83%	0.827	S	S	*	*			trans	-138.8	82.6	175.2	-76.5	-171.7	136.1	0	0	112.1
738	S	29.8	Very low	29.8	Very low	117 Å²	117	152.7 Å²	152.7	82%	0.818	83%	0.832	S	S	*	*			trans	-156.4	90.2	156.6	56.7	0	0	0	0	109.9
739	G	30	Very low	29.3	Very low	77 Å²	77	148.7 Å²	148.7	79%	0.794	83%	0.834	S	S	*	*			trans	-164.7	54.2	179.6	0	0	0	0	0	112.4
740	E	27.2	Very low	29.3	Very low	200 Å²	200	146.8 Å²	146.8	94%	0.935	83%	0.832	S	S	*	*			trans	-148.9	110.5	159.8	-115.6	172.4	179.7	0	0	110.4
741	S	29.3	Very low	29.4	Very low	120 Å²	120	148 Å²	148	84%	0.839	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-83.1	123.6	174	48.2	0	0	0	0	110
742	A	28.9	Very low	29.6	Very low	97 Å²	97	145.7 Å²	145.7	80%	0.802	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-96.6	142.3	164.8	0	0	0	0	0	110.4
743	P	35.4	Very low	29.7	Very low	128 Å²	128	140 Å²	140	83%	0.831	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-88.4	155.6	168.5	35.2	-29.3	0	0	0	111.7
744	D	31.1	Very low	29.7	Very low	158 Å²	158	137.9 Å²	137.9	85%	0.845	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-78.8	135.3	-176.9	-163.2	12.6	0	0	0	111.5
745	E	30.6	Very low	29.6	Very low	195 Å²	195	135.7 Å²	135.7	91%	0.911	84%	0.839	S	S	*	*			trans	-167.9	112.5	149.7	-112.3	-175.6	-163.4	0	0	112.4
746	G	27.8	Very low	29.3	Very low	81 Å²	81	138.3 Å²	138.3	84%	0.835	84%	0.843	S	S	*	*			trans	68.2	121	132.7	0	0	0	0	0	121.5
747	G	26.8	Very low	29.9	Very low	81 Å²	81	135.7 Å²	135.7	84%	0.835	84%	0.835	S	S	*	*			trans	132.8	131	141.8	0	0	0	0	0	117.4
748	E	27.9	Very low	29.6	Very low	205 Å²	205	137.9 Å²	137.9	96%	0.958	84%	0.835	S	S	*	*			trans	-54	157.3	-178.6	-60.9	164.7	126.7	0	0	116.4
749	G	27.9	Very low	29.5	Very low	76 Å²	76	137.5 Å²	137.5	78%	0.784	83%	0.832	S	S	*	*			trans	133.9	97.8	146.1	0	0	0	0	0	118
750	A	28.4	Very low	29.4	Very low	94 Å²	94	138.3 Å²	138.3	78%	0.777	83%	0.832	S	S	*	*			trans	29.1	134.1	138.5	0	0	0	0	0	123
751	R	27.8	Very low	29.4	Very low	247 Å²	247	134.3 Å²	134.3	93%	0.932	83%	0.826	S	S	*	*			trans	83.4	129.4	144	-75.9	178	179.8	173.9	1.1	119.8
752	A	34.6	Very low	29.3	Very low	97 Å²	97	139.2 Å²	139.2	80%	0.802	83%	0.828	S	S	*	*			trans	-56.9	165.2	170.9	0	0	0	0	0	114.4
753	P	32.8	Very low	29.7	Very low	124 Å²	124	140.3 Å²	140.3	81%	0.805	83%	0.826	S	S	*	*			trans	-140.1	149.5	134.9	32.5	-15.6	0	0	0	115.5
754	Q	24	Very low	29.3	Very low	187 Å²	187	140.2 Å²	140.2	87%	0.874	83%	0.828	S	S	*	*			trans	-88	165.5	155	-85.6	-177.7	-21.3	0	0	110.9
755	S	25.2	Very low	29	Very low	107 Å²	107	138 Å²	138	75%	0.748	83%	0.831	S	S	*	*			trans	86.5	99.3	157.1	72.9	0	0	0	0	121.2
756	I	25.2	Very low	28.9	Very low	159 Å²	159	133.2 Å²	133.2	82%	0.815	83%	0.825	S	S	*	*				42.6	153.3	102.4	-57.2	175.5	0	0	0	117.8
757	P	44.9	Very low	29.2	Very low	109 Å²	109	135.4 Å²	135.4	71%	0.708	82%	0.824	S	S	*	*			cis	-136.2	-179.6	-16.3	32.6	-12.8	0	0	0	115.7
758	R	25.3	Very low	29.1	Very low	236 Å²	236	143.2 Å²	143.2	89%	0.891	83%	0.829	S	S	*	*			trans	-173.6	107.9	133.7	-101.4	172.3	-177.4	-179.5	1.9	109.9
759	S	28.6	Very low	29.9	Very low	109 Å²	109	139.5 Å²	139.5	76%	0.762	82%	0.822	S	S	*	*				56.5	136.6	96.2	69	0	0	0	0	114.4
760	A	28.5	Very low	29.9	Very low	95 Å²	95	139.7 Å²	139.7	79%	0.785	82%	0.824	S	S	*	*			cis	-162.4	163.4	-0.6	0	0	0	0	0	104
761	S	26.9	Very low	29.7	Very low	115 Å²	115	139.9 Å²	139.9	80%	0.804	83%	0.826	S	S	*	*				-178	143.8	51.5	38.9	0	0	0	0	110.1
762	Y	26	Very low	30.4	Very low	224 Å²	224	133.7 Å²	133.7	88%	0.878	82%	0.817	S	S	*	*			trans	-73.1	-172.5	176.6	-81.2	-85.1	0	0	0	114.4
763	P	38.6	Very low	30	Very low	119 Å²	119	137.2 Å²	137.2	77%	0.773	82%	0.817	S	S	*	*			cis	-136.5	162.7	-1.5	12.6	14.5	0	0	0	118.5
764	C	26.2	Very low	29.6	Very low	127 Å²	127	137 Å²	137	86%	0.858	81%	0.814	S	S	*	*			trans	-78.2	171.6	158.3	-76.4	0	0	0	0	113.2
765	A	25.9	Very low	29.8	Very low	110 Å²	110	134.2 Å²	134.2	91%	0.909	81%	0.81	S	S	*	*			trans	-146.9	122.9	141.7	0	0	0	0	0	112.7
766	A	27.1	Very low	29.9	Very low	96 Å²	96	133.4 Å²	133.4	79%	0.793	81%	0.809	S	S	*	*			trans	-133.9	146.1	158.9	0	0	0	0	0	107.1
767	P	33.8	Very low	30	Very low	126 Å²	126	132.5 Å²	132.5	82%	0.818	81%	0.805	S	S	*	*			trans	-107.4	148.3	176.9	35.5	-26.4	0	0	0	113.6
768	R	25.1	Very low	29.2	Very low	246 Å²	246	136 Å²	136	93%	0.928	81%	0.812	S	S	*	*			trans	-143	167.4	165.8	-102.6	-160.6	178.7	175.9	1.4	109.9
769	P	44.9	Very low	29.3	Very low	127 Å²	127	128.5 Å²	128.5	83%	0.825	81%	0.808	S	S	*	*			trans	-111.3	172.1	-133.9	41.7	-36.2	0	0	0	116.5
770	G	27.2	Very low	29.2	Very low	79 Å²	79	126.6 Å²	126.6	81%	0.814	81%	0.805	S	S	*	*			trans	162.9	130.1	161.8	0	0	0	0	0	114.7
771	A	26.2	Very low	29.1	Very low	99 Å²	99	132.6 Å²	132.6	82%	0.818	81%	0.814	S	S	*	*			trans	-77.7	-171.4	-175.9	0	0	0	0	0	113.9
772	P	40.8	Very low	29.2	Very low	116 Å²	116	134.1 Å²	134.1	75%	0.753	81%	0.808	S	S	*	*			cis	-142.7	-172.7	8	38.5	-14.6	0	0	0	118.1
773	E	26	Very low	29.4	Very low	171 Å²	171	131.9 Å²	131.9	80%	0.799	80%	0.799	S	S	*	*			trans	103.6	114.3	154.6	-71.2	-173.3	164.7	0	0	122.9
774	T	25.5	Very low	29	Very low	121 Å²	121	134.7 Å²	134.7	74%	0.742	79%	0.794	S	S	*	*			trans	54.7	132.1	142.8	58	0	0	0	0	119.5
775	T	28	Very low	29.2	Very low	128 Å²	128	138 Å²	138	79%	0.785	79%	0.79	S	S	*	*			cis	-175.3	147.2	40.3	-10.7	0	0	0	0	109.2
776	A	26.9	Very low	29.3	Very low	89 Å²	89	136.3 Å²	136.3	74%	0.736	78%	0.783	S	S	*	*			trans	58.5	145.7	154.3	0	0	0	0	0	119.6
777	L	27.9	Very low	29.4	Very low	140 Å²	140	135.2 Å²	135.2	73%	0.733	78%	0.781	S	S	*	*			cis	-168.2	146.4	3.5	-112.8	160.9	0	0	0	107.3
778	H	27.4	Very low	29.3	Very low	184 Å²	184	136.8 Å²	136.8	85%	0.852	78%	0.78	S	S	*	*			trans	58.1	135.2	156	-71.1	-2.5	0	0	0	120.5
779	G	27.4	Very low	29.6	Very low	77 Å²	77	131.7 Å²	131.7	79%	0.794	78%	0.777	S	S	*	*			cis	-160.8	146.6	5.3	0	0	0	0	0	109.8
780	G	26.3	Very low	29	Very low	69 Å²	69	133.1 Å²	133.1	71%	0.711	78%	0.778	S	S	*	*			trans	-101	160.5	175.8	0	0	0	0	0	111.5
781	F	26.9	Very low	30.2	Very low	222 Å²	222	135.2 Å²	135.2	97%	0.974	78%	0.777	S	S	*	*			trans	-145.6	133.5	137.5	-109.2	-81.3	0	0	0	110.1
782	Q	28.5	Very low	30.2	Very low	146 Å²	146	133.7 Å²	133.7	68%	0.682	77%	0.771	S	S	*	*			trans	-122	147.9	-174.2	-130.9	-172.7	3.9	0	0	107.9
783	R	31.2	Very low	29.7	Very low	178 Å²	178	135.2 Å²	135.2	67%	0.672	78%	0.778	S	S	*	*			trans	82.2	119.8	133.9	-92	178.3	-173.7	-171.1	5.3	122.8
784	R	30.3	Very low	29.8	Very low	178 Å²	178	133.4 Å²	133.4	67%	0.672	78%	0.779	S	S	*	*				83.6	135.4	111.7	-98.1	176.5	174.1	-166.1	-0.4	123.1
785	Y	30.8	Very low	30.8	Very low	197 Å²	197	132.9 Å²	132.9	77%	0.773	78%	0.777	S	S	*	*			trans	82	126.7	139.6	-88.4	-71.4	0	0	0	123
786	G	27.8	Very low	30.8	Very low	74 Å²	74	138 Å²	138	76%	0.763	78%	0.782	S	S	*	*				118.4	104.4	112.2	0	0	0	0	0	120.8
787	G	27.4	Very low	30.9	Very low	73 Å²	73	138 Å²	138	75%	0.753	78%	0.782	S	S	*	*				72.6	122	116.2	0	0	0	0	0	126
788	I	33	Very low	32.1	Very low	158 Å²	158	136.8 Å²	136.8	81%	0.81	78%	0.783	S	S	*	*			trans	73	119.8	133.4	-30.8	-177.6	0	0	0	122.4
789	T	31.4	Very low	32	Very low	139 Å²	139	132.8 Å²	132.8	85%	0.853	78%	0.775	S	S	*	*				161.7	137.1	109.2	43.5	0	0	0	0	114.8
790	D	31.3	Very low	32	Very low	157 Å²	157	137 Å²	137	84%	0.84	78%	0.775	S	S	*	*			trans	-41.1	-173.1	174	-92.8	-24.3	0	0	0	121.9
791	P	52.6	Low	32.1	Very low	124 Å²	124	142.8 Å²	142.8	81%	0.805	78%	0.78	S	S	*	*			cis	-140.7	-179.8	-33.3	36.5	-17.5	0	0	0	114.7
792	G	27.1	Very low	32.2	Very low	67 Å²	67	137 Å²	137	69%	0.691	77%	0.767	S	S	*	*			trans	155.4	100.3	151.6	0	0	0	0	0	121.5
793	T	29.1	Very low	32.3	Very low	148 Å²	148	140.7 Å²	140.7	91%	0.908	78%	0.775	S	S	*	*			trans	66	122.3	136.9	22	0	0	0	0	125.4
794	V	29.9	Very low	32.4	Very low	133 Å²	133	139 Å²	139	81%	0.806	78%	0.779	S	S	*	*			trans	-55.1	174	163.1	-136.1	0	0	0	0	112.7
795	P	45.7	Very low	33.7	Very low	110 Å²	110	135.2 Å²	135.2	71%	0.714	78%	0.777	S	S	*	*			cis	-151.2	176	11.8	42.5	-19.6	0	0	0	121.6
796	R	28.2	Very low	33.6	Very low	234 Å²	234	134.1 Å²	134.1	88%	0.883	78%	0.784	S	S	*	*			trans	64.4	109.5	141	-95.9	-179.7	166.7	140.9	-3.7	123.4
797	A	29.6	Very low	33.7	Very low	90 Å²	90	134.3 Å²	134.3	74%	0.744	79%	0.786	S	S	*	*				64.7	173.8	113.4	0	0	0	0	0	120.8
798	P	51.5	Low	33.7	Very low	115 Å²	115	133.9 Å²	133.9	75%	0.747	78%	0.781	S	S	*	*				-131.3	-173.4	-84.9	38.4	-20.1	0	0	0	113.6
799	S	26.9	Very low	33.7	Very low	99 Å²	99	138.8 Å²	138.8	69%	0.692	79%	0.79	S	S	*	*			trans	116.7	143.2	138	80.1	0	0	0	0	121
800	H	27	Very low	33.6	Very low	167 Å²	167	137 Å²	137	77%	0.773	79%	0.789	S	S	*	*			trans	88.1	97.3	152.7	-75.5	-73.4	0	0	0	123.1
801	F	27.9	Very low	33.8	Very low	189 Å²	189	138.4 Å²	138.4	83%	0.829	79%	0.791	S	S	*	*				29.9	129.9	113	-91.6	-87.3	0	0	0	121.3
802	S	30	Very low	32.7	Very low	101 Å²	101	141 Å²	141	71%	0.706	80%	0.798	S	S	*	*				120.7	115.1	117.2	64.1	0	0	0	0	120.4
803	R	30.6	Very low	32.9	Very low	223 Å²	223	141.4 Å²	141.4	84%	0.842	80%	0.801	S	S	*	*				65.2	119.8	126.4	-73.9	-174.5	178.5	-161.7	1.8	123.2
804	L	32.2	Very low	33.1	Very low	143 Å²	143	143.5 Å²	143.5	75%	0.749	80%	0.801	S	S	*	*				76.6	170.9	125.8	-72.4	169.9	0	0	0	119.1
805	P	57.4	Low	33	Very low	99 Å²	99	142.8 Å²	142.8	64%	0.643	80%	0.802	S	S	*	*				-137.8	-172.5	-71.8	37.4	-16	0	0	0	112.9
806	L	29.7	Very low	32.4	Very low	173 Å²	173	142 Å²	142	91%	0.906	80%	0.804	S	S	*	*				153.7	143.6	129.6	-112.4	101.6	0	0	0	116.2
807	G	28.4	Very low	32.5	Very low	78 Å²	78	136 Å²	136	80%	0.804	80%	0.798	S	S	*	*			trans	108.7	126	145.2	0	0	0	0	0	115.9
808	G	27.8	Very low	32.4	Very low	64 Å²	64	143.4 Å²	143.4	66%	0.66	81%	0.807	S	S	*	*			cis	130.6	136.9	3	0	0	0	0	0	112.1
809	W	33.4	Very low	31.7	Very low	261 Å²	261	146.5 Å²	146.5	99%	0.989	81%	0.811	S	S	*	*			trans	97.9	113.3	158.8	-58.9	85.6	0	0	0	120.7
810	A	29.2	Very low	32.7	Very low	101 Å²	101	147.6 Å²	147.6	84%	0.835	82%	0.816	S	S	*	*				171.1	140	94.2	0	0	0	0	0	113.1
811	E	36.1	Very low	33.1	Very low	188 Å²	188	148 Å²	148	88%	0.879	82%	0.818	S	S	*	*			trans	-98.9	157.3	174.7	-71.3	-179.3	125.6	0	0	112.5
812	D	29.7	Very low	34.4	Very low	179 Å²	179	143.5 Å²	143.5	96%	0.957	81%	0.808	S	S	*	*			trans	-170.1	151.1	136.8	-101.3	-25.4	0	0	0	111.9
813	G	30.8	Very low	34.6	Very low	74 Å²	74	144.7 Å²	144.7	76%	0.763	81%	0.811	S	S	*	*			trans	-119.8	-175.8	-159.4	0	0	0	0	0	120.3
814	Q	32.3	Very low	35.6	Very low	192 Å²	192	140 Å²	140	90%	0.897	81%	0.809	S	S	*	*			trans	77.1	118.2	155.3	-71.2	178.5	-0.1	0	0	124.8
815	S	29.2	Very low	35.7	Very low	118 Å²	118	140.9 Å²	140.9	83%	0.825	81%	0.81	S	S	*	*				83.9	125.4	128.1	72.9	0	0	0	0	126.2
816	A	31.5	Very low	34.6	Very low	93 Å²	93	145 Å²	145	77%	0.769	82%	0.82	S	S	*	*			trans	87	115.3	138.5	0	0	0	0	0	125.7
817	S	30.3	Very low	34.6	Very low	108 Å²	108	140.3 Å²	140.3	76%	0.755	81%	0.813	S	S	*	*			trans	68.2	123.9	136	73.8	0	0	0	0	124.3
818	R	29.5	Very low	34.7	Very low	246 Å²	246	141 Å²	141	93%	0.928	81%	0.806	S	S	*	*				165.3	137.5	116.8	-91.5	-179.8	178	176.3	-0	113.2
819	H	35.4	Very low	34.9	Very low	181 Å²	181	145.7 Å²	145.7	84%	0.838	81%	0.81	S	S	*	*			trans	-85.3	169.8	173	-101.4	-66.6	0	0	0	112.7
820	P	47.9	Very low	34.8	Very low	121 Å²	121	139.4 Å²	139.4	79%	0.786	80%	0.796	S	S	*	*				-146.5	137.3	98.5	32.5	-12.9	0	0	0	117.3
821	E	35.5	Very low	35	Very low	175 Å²	175	142.2 Å²	142.2	82%	0.818	79%	0.792	S	S	*	*				16.3	175.2	127.8	-84.3	-165.6	151.1	0	0	124
822	P	55.9	Low	34.9	Very low	96 Å²	96	140.6 Å²	140.6	62%	0.623	79%	0.789	S	S	*	*			cis	-147.7	165.1	-39.1	41.7	-23.2	0	0	0	117.1
823	V	33.8	Very low	35.8	Very low	125 Å²	125	137.4 Å²	137.4	76%	0.758	78%	0.777	S	S	*	*				49.7	148.3	126.7	-169.6	0	0	0	0	119.7
824	P	52.2	Low	37.3	Very low	125 Å²	125	139.2 Å²	139.2	81%	0.812	78%	0.776	S	S	*	*			cis	-144.9	171.4	40.2	39.4	-16.3	0	0	0	121.8
825	E	34.5	Very low	37.3	Very low	162 Å²	162	138.9 Å²	138.9	76%	0.757	77%	0.774	S	S	*	*			trans	-81.1	172.8	175.8	-62.4	173.4	126.4	0	0	115.4
826	E	34.3	Very low	37.6	Very low	186 Å²	186	138.6 Å²	138.6	87%	0.869	77%	0.767	S	S	*	*				107.2	133.9	127.5	-106.3	-176.1	-174.5	0	0	122.8
827	G	28.9	Very low	37.9	Very low	73 Å²	73	141.5 Å²	141.5	75%	0.753	77%	0.765	S	S	*	*			trans	107.6	137.5	148.9	0	0	0	0	0	117
828	S	30.6	Very low	38.3	Very low	93 Å²	93	144.4 Å²	144.4	65%	0.65	76%	0.764	S	S	*	*			cis	-175.8	157.5	-10.8	55.9	0	0	0	0	108.2
829	E	31.3	Very low	39	Very low	162 Å²	162	143 Å²	143	76%	0.757	78%	0.782	S	S	*	*			trans	66.3	146.4	147.2	-66	156.7	154.3	0	0	119.5
830	D	31.9	Very low	39.2	Very low	129 Å²	129	141.1 Å²	141.1	69%	0.69	78%	0.779	S	S	*	*			cis	-168	152.2	3.3	-112.2	-22.7	0	0	0	110.7
831	E	32.9	Very low	38.7	Very low	161 Å²	161	142.1 Å²	142.1	75%	0.752	78%	0.779	S	S	*	*			trans	50.6	137.7	140.9	-71.3	-168	137.5	0	0	127
832	L	34.4	Very low	38.9	Very low	154 Å²	154	140.3 Å²	140.3	81%	0.806	78%	0.776	S	S	*	*			trans	107	119.6	146	-72.4	147.9	0	0	0	121.6
833	P	48.4	Very low	37.9	Very low	111 Å²	111	142.9 Å²	142.9	72%	0.721	79%	0.785	S	S	*	*			trans	-111	-162.3	138.8	37.8	-24.7	0	0	0	110
834	P	62.2	Low	38.2	Very low	113 Å²	113	144 Å²	144	73%	0.734	79%	0.787	S	S	*	*				-116.2	177.2	-58.1	36.1	-21	0	0	0	111.7
835	Q	33.2	Very low	37.2	Very low	184 Å²	184	145.3 Å²	145.3	86%	0.86	79%	0.786	S	S	*	*			trans	-173	115.8	144.7	-106.2	179.2	30.5	0	0	115.9
836	V	36.1	Very low	37.4	Very low	112 Å²	112	144.1 Å²	144.1	68%	0.679	79%	0.788	S	S	*	*				61.4	122.7	114.4	-176.9	0	0	0	0	122.7
837	H	36.2	Very low	37.7	Very low	154 Å²	154	140.8 Å²	140.8	71%	0.713	78%	0.781	S	S	*	*			trans	91.5	122.7	140.2	-81.4	-19.8	0	0	0	125.5
838	K	39.8	Very low	38.4	Very low	170 Å²	170	146.5 Å²	146.5	74%	0.739	78%	0.784	S	S	*	*				69.4	120.8	129.5	-72.8	177.3	178.6	177.9	0	119.3
839	V	43.9	Very low	39.1	Very low	215 Å²	215	151.4 Å²	151.4	100%	1.303	80%	0.796	S	S	*	*				-135.2	0	84.8	173.2	0	0	0	0	109.2

Retrieved 839 of 839 residues in 3534 ms (Link to these results)

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