A0A087Y032_POEFO Loading...

Nucleobindin-1

Major calcium-binding protein of the Golgi which may have a role in calcium homeostasis. Acts as a non-receptor guanine nucleotide exchange factor which binds to and activates alpha subunits of guanine nucleotide-binding proteins (G proteins).

AlphaFold DB , UniProt , Accession A0A087Y032, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 450 aa.

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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	36	Very low	37.9	Very low	238 Å²	238	178.8 Å²	178.8	100%	1.172	86%	0.856	S	S	*	*				0	147.4	0	-72.5	179.8	173.1	0	0	108.9
2	R	36.3	Very low	37.8	Very low	229 Å²	229	176.4 Å²	176.4	86%	0.864	85%	0.85	S	S	*	*			trans	47	123.2	165.5	-66.1	-174.9	179.6	-171.4	1.2	117.9
3	R	36.3	Very low	37.5	Very low	228 Å²	228	174.4 Å²	174.4	86%	0.86	85%	0.845	S	S	*	*			cis	-150.9	159.6	-4.8	-93.6	-174.2	174.1	176.5	-2.6	108.6
4	M	36.6	Very low	37.3	Very low	167 Å²	167	171.2 Å²	171.2	82%	0.823	83%	0.833	S	S	*	*			trans	-105.9	155.7	171.1	-69.1	160.2	61.7	0	0	111
5	N	37.5	Very low	37.1	Very low	134 Å²	134	171.1 Å²	171.1	72%	0.717	83%	0.828	S	S	*	*			trans	13.1	142.3	141.8	-53.3	-39.7	0	0	0	118.5
6	L	36.5	Very low	37	Very low	161 Å²	161	168.9 Å²	168.9	84%	0.843	82%	0.819	S	S	*	*				-158.3	173.4	52.8	-107.9	105.6	0	0	0	115.7
7	K	40.3	Very low	36.9	Very low	186 Å²	186	166.1 Å²	166.1	81%	0.809	82%	0.821	S	S	*	*			trans	-46	179.4	167.7	-55.2	-176.6	178.9	-176.8	0	115.4
8	P	46.6	Very low	36.9	Very low	119 Å²	119	162.7 Å²	162.7	77%	0.773	82%	0.823	S	S	*	*			cis	-148.8	170.9	17.4	45.1	-24.7	0	0	0	121.3
9	A	35.6	Very low	36.8	Very low	96 Å²	96	159 Å²	159	79%	0.793	82%	0.82	S	S	*	*			trans	49.3	123.5	140.3	0	0	0	0	0	123.8
10	W	40.1	Very low	36.9	Very low	262 Å²	262	157.9 Å²	157.9	99%	0.992	82%	0.821	S	S	*	*			trans	-140.3	166.8	135.1	-143	40.3	0	0	0	109.8
11	L	35.4	Very low	36.7	Very low	147 Å²	147	162.1 Å²	162.1	77%	0.77	83%	0.826	S	S	*	*			trans	-150.4	163.5	-163.4	-127	173.4	0	0	0	111.5
12	L	36	Very low	36.6	Very low	150 Å²	150	156 Å²	156	79%	0.785	81%	0.807	S	S	*	*			trans	71.3	143.2	179.2	-58.1	158.9	0	0	0	112.6
13	L	34.6	Very low	36.7	Very low	150 Å²	150	150.9 Å²	150.9	79%	0.785	80%	0.8	S	S	*	*			cis	-142.1	168.5	8	-71.9	95.5	0	0	0	107.8
14	L	34.1	Very low	36.7	Very low	130 Å²	130	145.9 Å²	145.9	68%	0.681	80%	0.798	S	S	*	*			cis	-162.9	155.8	-7.7	-114.4	174.3	0	0	0	111
15	F	34.8	Very low	36.6	Very low	170 Å²	170	145.5 Å²	145.5	75%	0.746	80%	0.797	S	S	*	*			trans	53.5	121.3	147.3	-84.9	-160.4	0	0	0	127.1
16	I	36.2	Very low	36.5	Very low	136 Å²	136	145.4 Å²	145.4	70%	0.697	80%	0.797	S	S	*	*				65.5	107.8	128.3	-55.6	175.5	0	0	0	120.2
17	S	34.5	Very low	36.6	Very low	120 Å²	120	148.8 Å²	148.8	84%	0.839	80%	0.798	S	S	*	*				-152.8	155	110.8	-14.1	0	0	0	0	109.5
18	A	37.4	Very low	36.5	Very low	105 Å²	105	146.8 Å²	146.8	87%	0.868	80%	0.797	S	S	*	*			trans	-92.3	138.2	-177.6	0	0	0	0	0	112
19	A	34.6	Very low	36	Very low	93 Å²	93	149.7 Å²	149.7	77%	0.769	80%	0.8	S	S	*	*			trans	-117.5	121.2	166.1	0	0	0	0	0	108.6
20	V	38.2	Very low	35.9	Very low	136 Å²	136	148.7 Å²	148.7	82%	0.824	79%	0.792	S	S	*	*			trans	-80.7	122.9	172.6	176.9	0	0	0	0	107.9	S22	V20-S22 PolarHBondContact O-N 2.91Å
21	W	33.3	Very low	35.6	Very low	248 Å²	248	144.7 Å²	144.7	94%	0.939	78%	0.784	S	S	*	*			trans	-78.6	111	167	-92.1	9.4	0	0	0	109.6
22	S	33.7	Very low	35.5	Very low	109 Å²	109	145.1 Å²	145.1	76%	0.762	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-79.3	139.2	153.9	41.6	0	0	0	0	109.5	V20	V20-S22 PolarHBondContact O-N 2.91Å
23	V	38.8	Very low	35.3	Very low	121 Å²	121	143.2 Å²	143.2	73%	0.733	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-72	143.1	173.8	179.5	0	0	0	0	108.6	I25	V23-I25 PolarHBondContact O-N 2.78Å
24	P	36	Very low	35.1	Very low	124 Å²	124	143.6 Å²	143.6	81%	0.805	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-60.7	126.9	172.8	25.5	-34.8	0	0	0	110.5
25	I	35.4	Very low	35	Very low	158 Å²	158	145 Å²	145	81%	0.81	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-88.5	135	171.9	-68.1	173.3	0	0	0	107.9	V23	V23-I25 PolarHBondContact O-N 2.78Å
26	D	33.9	Very low	34.8	Very low	132 Å²	132	143 Å²	143	71%	0.706	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-65.3	148.5	175.9	-151.1	-36.7	0	0	0	110.6	N28	D26-N28 PolarHBondContact OD1-ND2 3.17Å
27	R	39.4	Very low	34.6	Very low	233 Å²	233	144.7 Å²	144.7	88%	0.879	77%	0.769	S	S	*	*			trans	-126	75.4	-177.6	-86.5	-171	164.9	-156.2	-4	109.8
28	N	38.8	Very low	34.6	Very low	144 Å²	144	142.5 Å²	142.5	77%	0.77	76%	0.758	S	S	*	*			trans	-143.5	52.4	176.6	-73.9	-71.6	0	0	0	110.9	D26	D26-N28 PolarHBondContact OD1-ND2 3.17Å
29	E	34.5	Very low	34.4	Very low	180 Å²	180	144.4 Å²	144.4	84%	0.841	75%	0.749	S	S	*	*	S	Bend	trans	-151.7	20.7	-177.9	-130.6	164	-134.1	0	0	112.5
30	A	34.1	Very low	34.4	Very low	75 Å²	75	148.1 Å²	148.1	62%	0.62	75%	0.751	S	S	*	*	S	Bend	trans	-126.7	9	-171.1	0	0	0	0	0	114.8
31	E	33.9	Very low	34.6	Very low	178 Å²	178	149.6 Å²	149.6	83%	0.832	75%	0.748	S	S	*	*	S	Bend	trans	-113.4	3.8	179.3	-66	-172	162	0	0	113.2
32	Q	32.5	Very low	35.2	Very low	156 Å²	156	143.4 Å²	143.4	73%	0.729	73%	0.734	S	S	*	*	S	Bend	trans	-97.1	-44.5	174.8	-66.7	-166.9	-102.6	0	0	112.4	Q34 K35	Q32-Q34 VanDerWaalsContact C-N 3.27Å; Q32-Q34 PolarHBondContact O-N 2.92Å; Q32-K35 PolarHBondContact O-N 3.31Å
33	D	31.9	Very low	36.2	Very low	109 Å²	109	141.6 Å²	141.6	58%	0.583	71%	0.714	S	S	*	*	H	α-helix	trans	-57.1	-38.3	-179.5	-60.3	-1.7	0	0	0	112.6	K35 Q36	D33-K35 PolarHBondContact O-N 3.02Å; D33-Q36 PolarHBondContact O-N 3.2Å
34	Q	31.8	Very low	37.4	Very low	159 Å²	159	139.9 Å²	139.9	74%	0.743	70%	0.701	S	S	*	*	H	α-helix	trans	-69.9	0.2	178.4	-62.7	-155.8	-49.6	0	0	114.8	Q32	Q32-Q34 VanDerWaalsContact C-N 3.27Å; Q32-Q34 PolarHBondContact O-N 2.92Å
35	K	32	Very low	38.9	Very low	160 Å²	160	136.3 Å²	136.3	70%	0.696	68%	0.677	S	S	*	*	H	α-helix	trans	-101.9	-16.2	167.7	-88.2	-166.6	168.3	-166.2	0	114	Q32 D33	Q32-K35 PolarHBondContact O-N 3.31Å; D33-K35 PolarHBondContact O-N 3.02Å
36	Q	30.3	Very low	40.6	Very low	126 Å²	126	130.2 Å²	130.2	59%	0.589	65%	0.652	S	S	*	*	H	α-helix	trans	-88	-33.5	-176.8	-60.7	-166	-83.8	0	0	112.4	D33 A38 Q39	D33-Q36 PolarHBondContact O-N 3.2Å; Q36-A38 PolarHBondContact O-N 3.2Å; Q36-Q39 PolarHBondContact O-N 3.21Å; Q36-Q39 VanDerWaalsContact O-N 3.09Å
37	E	30.7	Very low	43.1	Very low	172 Å²	172	124.6 Å²	124.6	80%	0.804	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-6	170.9	-66.7	-173.1	143.1	0	0	113.8
38	A	35.5	Very low	45.4	Very low	75 Å²	75	118.7 Å²	118.7	62%	0.62	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	10	176.2	0	0	0	0	0	113.7	Q36	Q36-A38 PolarHBondContact O-N 3.2Å
39	Q	32.8	Very low	47.9	Very low	145 Å²	145	112 Å²	112	68%	0.678	57%	0.565	S	S	*	*	S	Bend	trans	-117.6	9.6	178.6	-63.8	-165.4	-97.6	0	0	113.8	Q36	Q36-Q39 PolarHBondContact O-N 3.21Å; Q36-Q39 VanDerWaalsContact O-N 3.09Å
40	E	34	Very low	50.5	Low	171 Å²	171	103.8 Å²	103.8	80%	0.799	53%	0.527	S	S	*	.			trans	-97.1	8	177.7	-63.8	-166.6	154.4	0	0	113.8	N42	E40-N42 PolarHBondContact O-N 2.97Å; E40-N42 VanDerWaalsContact O-N 3.14Å
41	E	42.7	Very low	53.2	Low	167 Å²	167	108.9 Å²	108.9	78%	0.78	53%	0.53	S	S	*	.			trans	-84.6	41.6	173.2	-62.9	-166.6	148.2	0	0	112.9
42	N	46.8	Very low	56.1	Low	117 Å²	117	100.7 Å²	100.7	63%	0.626	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	141.5	174.2	-83.8	-38.6	0	0	0	111.3	E40 D44 R54	E40-N42 PolarHBondContact O-N 2.97Å; E40-N42 VanDerWaalsContact O-N 3.14Å; N42-D44 PolarHBondContact O-N 3.4Å; N42-R54 PolarHBondContact O-NH1 3.31Å; N42-R54 PolarHBondContact O-NH2 2.61Å
43	M	54.3	Low	59	Low	72 Å²	72	94.2 Å²	94.2	36%	0.355	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	39.4	175.7	-63.7	178.9	159	0	0	116	T45 R54	M43-T45 PolarHBondContact O-N 3.24Å; M43-R54 PolarHBondContact O-NH1 2.88Å; M43-R54 PolarHBondContact O-NH2 2.96Å; M43-R54 VanDerWaalsContact O-NH2 3.09Å
44	D	63.9	Low	61.8	Low	85 Å²	85	93.4 Å²	93.4	46%	0.455	45%	0.45	S	S	.	.			trans	-60	119	161.1	-177.8	16	0	0	0	110.2	N42 G46 Q261	N42-D44 PolarHBondContact O-N 3.4Å; D44-G46 PolarHBondContact O-N 3Å; D44-G46 PolarHBondContact OD1-N 3.4Å; D44-Q261 PolarHBondContact O-NE2 2.96Å
45	T	68.4	Low	64.8	Low	49 Å²	49	88 Å²	88	30%	0.301	43%	0.425	S	S	.	.			trans	-80.7	1.9	177.5	62.2	0	0	0	0	113.5	M43 L47 D50	M43-T45 PolarHBondContact O-N 3.24Å; T45-L47 PolarHBondContact O-N 2.94Å; T45-D50 WeakPolarHBondContact CB-OD1 3.4Å; T45-D50 WeakPolarHBondContact CG2-OD1 3.26Å; T45-D50 PolarHBondContact N-OD1 2.66Å; T45-D50 PolarHBondContact OG1-OD1 2.9Å
46	G	71.4	Confident	67.8	Low	29 Å²	29	80.3 Å²	80.3	30%	0.299	39%	0.392	S	S	.	.	S	Bend	trans	80.3	-1.8	179.1	0	0	0	0	0	114.2	D44	D44-G46 PolarHBondContact O-N 3Å; D44-G46 PolarHBondContact OD1-N 3.4Å
47	L	85.3	Confident	70.7	Confident	14 Å²	14	77.4 Å²	77.4	7%	0.073	38%	0.38	C	S	.	.			trans	-79.2	131.9	176.8	-57.9	178.3	0	0	0	110.6	T45 Y49 D50 L53 A159 D162 L163	T45-L47 PolarHBondContact O-N 2.94Å; L47-Y49 HydrophobicContact CB-CD1 4.37Å; L47-Y49 HydrophobicContact CB-CE1 4.25Å; L47-Y49 HydrophobicContact CD1-CE2 4.01Å; L47-Y49 PolarHBondContact O-N 3.42Å; L47-D50 HydrophobicContact CB-CB 4.1Å; L47-D50 WeakPolarHBondContact O-CB 3.29Å; L47-D50 PolarHBondContact O-N 3.03Å; L47-L53 HydrophobicContact CD1-CD2 4.32Å; L47-A159 HydrophobicContact CD1-CB 4Å; L47-D162 HydrophobicContact CD2-CB 3.61Å; L47-L163 HydrophobicContact CD1-CD1 4.22Å; L47-L163 HydrophobicContact CD1-CD2 4.2Å; L47-L163 HydrophobicContact CD1-CG 4Å; L47-L163 HydrophobicContact CD2-CD2 4.12Å; L47-L163 HydrophobicContact CD2-CG 4.23Å; L47-L163 HydrophobicContact CG-CD2 4.03Å; L47-L163 HydrophobicContact CG-CG 4.28Å
48	Y	87.8	Confident	73.7	Confident	110 Å²	110	75.4 Å²	75.4	43%	0.431	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-2.1	176.5	77.9	-85.6	0	0	0	114.6	R108 L109 F136 H138	Y48-R108 VanDerWaalsContact O-CZ 3.27Å; Y48-R108 PolarHBondContact O-NH1 3.36Å; Y48-R108 PolarHBondContact O-NH2 2.88Å; Y48-L109 HydrophobicContact CE2-CD2 4.26Å; Y48-F136 HydrophobicContact CE2-CD1 4.06Å; Y48-F136 HydrophobicContact CE2-CE1 4.22Å; Y48-F136 WeakPolarHBondContact OH-CD1 3.31Å; Y48-H138 PolarHBondContact OH-CE1 2.85Å; Y48-H138 PolarHBondContact OH-ND1 3.1Å
49	Y	91.2	Very high	76.6	Confident	2 Å²	2	72.4 Å²	72.4	1%	0.008	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	11.9	174.4	59.2	-85.7	0	0	0	112.9	L47 R51 Y52 L53 H138 L155 T158 A159 D162	L47-Y49 HydrophobicContact CB-CD1 4.37Å; L47-Y49 HydrophobicContact CB-CE1 4.25Å; L47-Y49 HydrophobicContact CD1-CE2 4.01Å; L47-Y49 PolarHBondContact O-N 3.42Å; Y49-R51 VanDerWaalsContact C-N 3.32Å; Y49-R51 PolarHBondContact O-N 3.15Å; Y49-Y52 WeakPolarHBondContact O-CA 3.47Å; Y49-Y52 WeakPolarHBondContact O-CB 3.25Å; Y49-Y52 PolarHBondContact O-N 2.83Å; Y49-L53 PolarHBondContact O-N 3.47Å; Y49-H138 WeakPolarHBondContact CB-NE2 3.46Å; Y49-H138 HydrophobicContact CD2-CB 4.17Å; Y49-H138 AromaticContact CD2-CD2 3.7Å; Y49-H138 HydrophobicContact CE2-CB 3.98Å; Y49-H138 AromaticContact CG-CD2 3.66Å; Y49-H138 AromaticContact CG-NE2 3.81Å; Y49-L155 HydrophobicContact CD2-CD1 3.9Å; Y49-L155 HydrophobicContact CE2-CD1 4.07Å; Y49-T158 VanDerWaalsContact OH-C 3.24Å; Y49-T158 WeakPolarHBondContact OH-CG2 3.45Å; Y49-T158 PolarHBondContact OH-O 2.87Å; Y49-A159 HydrophobicContact CE2-CB 4.21Å; Y49-A159 VanDerWaalsContact OH-CA 3.32Å; Y49-A159 WeakPolarHBondContact OH-CA 3.32Å; Y49-A159 PolarHBondContact OH-N 3.16Å; Y49-D162 WeakPolarHBondContact CE1-OD2 3.38Å; Y49-D162 PolarHBondContact OH-OD2 3.29Å
50	D	89.3	Confident	79.5	Confident	8 Å²	8	65.7 Å²	65.7	4%	0.043	31%	0.313	C	S	.	.	H	α-helix	trans	-44.3	-53.8	176.1	166.7	81.8	0	0	0	112	T45 L47 Y52 L53 R54	T45-D50 WeakPolarHBondContact CB-OD1 3.4Å; T45-D50 WeakPolarHBondContact CG2-OD1 3.26Å; T45-D50 PolarHBondContact N-OD1 2.66Å; T45-D50 PolarHBondContact OG1-OD1 2.9Å; L47-D50 HydrophobicContact CB-CB 4.1Å; L47-D50 WeakPolarHBondContact O-CB 3.29Å; L47-D50 PolarHBondContact O-N 3.03Å; D50-Y52 PolarHBondContact O-N 3.18Å; D50-L53 CarbonylContact O-C 3.54Å; D50-L53 WeakPolarHBondContact O-CA 3.32Å; D50-L53 VanDerWaalsContact O-CB 3.31Å; D50-L53 WeakPolarHBondContact O-CB 3.38Å; D50-L53 PolarHBondContact O-N 2.81Å; D50-R54 VanDerWaalsContact CG-NE 3.34Å; D50-R54 PolarHBondContact O-N 3.37Å; D50-R54 IonicContact OD1-CZ 3.91Å; D50-R54 IonicContact OD1-NE 3.17Å; D50-R54 PolarHBondContact OD1-NE 3.45Å; D50-R54 VanDerWaalsContact OD1-NE 3.16Å; D50-R54 IonicContact OD1-NH2 2.66Å; D50-R54 IonicContact OD2-CZ 2.99Å; D50-R54 IonicContact OD2-NE 2.66Å; D50-R54 PolarHBondContact OD2-NE 3.34Å; D50-R54 IonicContact OD2-NH2 3.67Å; D50-R54 PolarHBondContact OD2-NH2 2.82Å
51	R	91.5	Very high	82.2	Confident	182 Å²	182	60.6 Å²	60.6	69%	0.687	29%	0.289	S	S	*	.	H	α-helix	trans	-52.5	-41.8	177.7	177.3	-179.4	170.6	136.6	14.6	113	Y49 R54 E55	Y49-R51 VanDerWaalsContact C-N 3.32Å; Y49-R51 PolarHBondContact O-N 3.15Å; R51-R54 PolarHBondContact O-N 2.86Å; R51-E55 HydrophobicContact CG-CG 4.32Å; R51-E55 IonicContact CZ-OE1 3.64Å; R51-E55 IonicContact NE-OE1 2.93Å; R51-E55 PolarHBondContact NE-OE1 3.41Å; R51-E55 IonicContact NE-OE2 3.69Å; R51-E55 IonicContact NH2-OE1 2.72Å; R51-E55 PolarHBondContact NH2-OE1 2.72Å; R51-E55 WeakPolarHBondContact O-CB 3.4Å; R51-E55 VanDerWaalsContact O-CG 3.28Å; R51-E55 WeakPolarHBondContact O-CG 3.32Å; R51-E55 PolarHBondContact O-N 3.27Å
52	Y	94.3	Very high	84.7	Confident	7 Å²	7	56 Å²	56	3%	0.027	27%	0.273	C	S	.	.	H	α-helix	trans	-72.1	-37.4	179.2	170.7	-110.6	0	0	0	111.7	Y49 D50 V56 L101 E105 L139 F147 L155	Y49-Y52 WeakPolarHBondContact O-CA 3.47Å; Y49-Y52 WeakPolarHBondContact O-CB 3.25Å; Y49-Y52 PolarHBondContact O-N 2.83Å; D50-Y52 PolarHBondContact O-N 3.18Å; Y52-V56 HydrophobicContact CD2-CG2 4.05Å; Y52-V56 HydrophobicContact CE1-CG2 4.46Å; Y52-V56 HydrophobicContact CE2-CG2 3.65Å; Y52-V56 VanDerWaalsContact O-CB 3.29Å; Y52-V56 WeakPolarHBondContact O-CB 3.4Å; Y52-V56 VanDerWaalsContact O-CG2 3.24Å; Y52-V56 WeakPolarHBondContact O-CG2 3.41Å; Y52-V56 PolarHBondContact O-N 3.47Å; Y52-L101 HydrophobicContact CD2-CB 4.36Å; Y52-L101 HydrophobicContact CE2-CB 4.02Å; Y52-E105 HydrophobicContact CD1-CB 4.38Å; Y52-E105 HydrophobicContact CD1-CG 3.93Å; Y52-E105 HydrophobicContact CD2-CB 3.62Å; Y52-E105 HydrophobicContact CD2-CG 4.08Å; Y52-E105 HydrophobicContact CE1-CG 4.19Å; Y52-E105 HydrophobicContact CE2-CB 3.83Å; Y52-E105 HydrophobicContact CE2-CG 4.34Å; Y52-E105 HydrophobicContact CG-CB 3.91Å; Y52-E105 HydrophobicContact CG-CG 3.85Å; Y52-L139 HydrophobicContact CE1-CD2 3.65Å; Y52-L139 WeakPolarHBondContact OH-CD2 3.47Å; Y52-F147 WeakPolarHBondContact OH-CD2 3.4Å; Y52-F147 WeakPolarHBondContact OH-CE2 3.25Å; Y52-L155 HydrophobicContact CD1-CD1 3.9Å; Y52-L155 HydrophobicContact CD1-CD2 4.28Å; Y52-L155 HydrophobicContact CE1-CD1 3.95Å; Y52-L155 HydrophobicContact CE1-CD2 3.86Å; Y52-L155 HydrophobicContact CE1-CG 4.49Å
53	L	92.9	Very high	86.9	Confident	20 Å²	20	51.2 Å²	51.2	11%	0.105	25%	0.247	C	C	.	.	H	α-helix	trans	-58.5	-48	170.7	175.6	67.9	0	0	0	110.8	L47 Y49 D50 V56 I57 L155 A159	L47-L53 HydrophobicContact CD1-CD2 4.32Å; Y49-L53 PolarHBondContact O-N 3.47Å; D50-L53 CarbonylContact O-C 3.54Å; D50-L53 WeakPolarHBondContact O-CA 3.32Å; D50-L53 VanDerWaalsContact O-CB 3.31Å; D50-L53 WeakPolarHBondContact O-CB 3.38Å; D50-L53 PolarHBondContact O-N 2.81Å; L53-V56 PolarHBondContact O-N 2.8Å; L53-I57 HydrophobicContact CD1-CD1 3.92Å; L53-I57 HydrophobicContact CG-CD1 3.95Å; L53-I57 VanDerWaalsContact O-CG1 3.3Å; L53-I57 WeakPolarHBondContact O-CG1 3.44Å; L53-I57 PolarHBondContact O-N 3.29Å; L53-L155 HydrophobicContact CB-CD1 4.22Å; L53-L155 HydrophobicContact CD1-CD1 4.08Å; L53-L155 HydrophobicContact CD1-CD2 4.19Å; L53-L155 HydrophobicContact CD1-CG 3.78Å; L53-A159 HydrophobicContact CD1-CB 4.31Å; L53-A159 HydrophobicContact CD2-CB 3.76Å
54	R	91.7	Very high	88.7	Confident	91 Å²	91	52.8 Å²	52.8	34%	0.343	26%	0.263	S	S	.	.	H	α-helix	trans	-70.3	-44	-178.6	-66.1	-161.8	-80.2	161	-7.1	113.2	N42 M43 D50 R51 V56 I57 E58	N42-R54 PolarHBondContact O-NH1 3.31Å; N42-R54 PolarHBondContact O-NH2 2.61Å; M43-R54 PolarHBondContact O-NH1 2.88Å; M43-R54 PolarHBondContact O-NH2 2.96Å; M43-R54 VanDerWaalsContact O-NH2 3.09Å; D50-R54 VanDerWaalsContact CG-NE 3.34Å; D50-R54 PolarHBondContact O-N 3.37Å; D50-R54 IonicContact OD1-CZ 3.91Å; D50-R54 IonicContact OD1-NE 3.17Å; D50-R54 PolarHBondContact OD1-NE 3.45Å; D50-R54 VanDerWaalsContact OD1-NE 3.16Å; D50-R54 IonicContact OD1-NH2 2.66Å; D50-R54 IonicContact OD2-CZ 2.99Å; D50-R54 IonicContact OD2-NE 2.66Å; D50-R54 PolarHBondContact OD2-NE 3.34Å; D50-R54 IonicContact OD2-NH2 3.67Å; D50-R54 PolarHBondContact OD2-NH2 2.82Å; R51-R54 PolarHBondContact O-N 2.86Å; R54-V56 VanDerWaalsContact C-N 3.27Å; R54-V56 PolarHBondContact O-N 2.82Å; R54-I57 PolarHBondContact O-N 2.8Å; R54-E58 WeakPolarHBondContact O-CB 3.5Å; R54-E58 PolarHBondContact O-N 3.41Å
55	E	94.9	Very high	89.9	Confident	45 Å²	45	52 Å²	52	21%	0.21	26%	0.256	C	S	.	.	H	α-helix	trans	-59.6	-36	172.5	-74.7	174.9	168.4	0	0	111.9	R51 V59 L101	R51-E55 HydrophobicContact CG-CG 4.32Å; R51-E55 IonicContact CZ-OE1 3.64Å; R51-E55 IonicContact NE-OE1 2.93Å; R51-E55 PolarHBondContact NE-OE1 3.41Å; R51-E55 IonicContact NE-OE2 3.69Å; R51-E55 IonicContact NH2-OE1 2.72Å; R51-E55 PolarHBondContact NH2-OE1 2.72Å; R51-E55 WeakPolarHBondContact O-CB 3.4Å; R51-E55 VanDerWaalsContact O-CG 3.28Å; R51-E55 WeakPolarHBondContact O-CG 3.32Å; R51-E55 PolarHBondContact O-N 3.27Å; E55-V59 WeakPolarHBondContact O-CB 3.17Å; E55-V59 VanDerWaalsContact O-CG2 3.25Å; E55-V59 WeakPolarHBondContact O-CG2 3.47Å; E55-V59 PolarHBondContact O-N 2.69Å; E55-L101 HydrophobicContact CB-CD1 3.89Å; E55-L101 HydrophobicContact CB-CD2 3.98Å; E55-L101 VanDerWaalsContact O-CD1 3.29Å; E55-L101 WeakPolarHBondContact O-CD1 3.4Å
56	V	94.4	Very high	90.9	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-68.8	-44	174.1	162.4	0	0	0	0	111.8	Y52 L53 R54 V59 L60 L98 L101 F147 L152 L155	Y52-V56 HydrophobicContact CD2-CG2 4.05Å; Y52-V56 HydrophobicContact CE1-CG2 4.46Å; Y52-V56 HydrophobicContact CE2-CG2 3.65Å; Y52-V56 VanDerWaalsContact O-CB 3.29Å; Y52-V56 WeakPolarHBondContact O-CB 3.4Å; Y52-V56 VanDerWaalsContact O-CG2 3.24Å; Y52-V56 WeakPolarHBondContact O-CG2 3.41Å; Y52-V56 PolarHBondContact O-N 3.47Å; L53-V56 PolarHBondContact O-N 2.8Å; R54-V56 VanDerWaalsContact C-N 3.27Å; R54-V56 PolarHBondContact O-N 2.82Å; V56-V59 PolarHBondContact O-N 2.75Å; V56-L60 HydrophobicContact CG1-CD1 3.74Å; V56-L60 HydrophobicContact CG1-CG 4.42Å; V56-L60 WeakPolarHBondContact O-CB 3.46Å; V56-L60 VanDerWaalsContact O-CG 3.24Å; V56-L60 WeakPolarHBondContact O-CG 3.34Å; V56-L60 PolarHBondContact O-N 3.01Å; V56-L98 HydrophobicContact CB-CD2 4.27Å; V56-L98 HydrophobicContact CG1-CD2 3.95Å; V56-L98 HydrophobicContact CG2-CD2 4.14Å; V56-L101 HydrophobicContact CG2-CD1 4.02Å; V56-F147 HydrophobicContact CG1-CE1 4.45Å; V56-F147 HydrophobicContact CG1-CE2 4.34Å; V56-F147 HydrophobicContact CG1-CZ 3.79Å; V56-F147 HydrophobicContact CG2-CE2 4.25Å; V56-F147 HydrophobicContact CG2-CZ 4.49Å; V56-L152 HydrophobicContact CG1-CD1 4.19Å; V56-L155 HydrophobicContact CB-CD2 4.07Å; V56-L155 HydrophobicContact CG1-CD2 3.85Å; V56-L155 HydrophobicContact CG2-CD2 4.16Å
57	I	91.7	Very high	91.8	Very high	64 Å²	64	53.4 Å²	53.4	33%	0.328	25%	0.247	S	C	.	.	H	α-helix	trans	-64.7	-48.4	178.5	-69.7	166	0	0	0	111	L53 R54 V59 L60 E61 L70	L53-I57 HydrophobicContact CD1-CD1 3.92Å; L53-I57 HydrophobicContact CG-CD1 3.95Å; L53-I57 VanDerWaalsContact O-CG1 3.3Å; L53-I57 WeakPolarHBondContact O-CG1 3.44Å; L53-I57 PolarHBondContact O-N 3.29Å; R54-I57 PolarHBondContact O-N 2.8Å; I57-V59 VanDerWaalsContact C-N 3.29Å; I57-V59 PolarHBondContact O-N 3.35Å; I57-L60 WeakPolarHBondContact O-CB 3.28Å; I57-L60 PolarHBondContact O-N 3.09Å; I57-L60 VanDerWaalsContact O-N 3.1Å; I57-E61 HydrophobicContact CG2-CG 4.37Å; I57-E61 WeakPolarHBondContact O-CG 3.46Å; I57-E61 PolarHBondContact O-N 2.69Å; I57-L70 HydrophobicContact CG2-CD2 4.34Å
58	E	93.8	Very high	92	Very high	130 Å²	130	58.7 Å²	58.7	61%	0.607	27%	0.271	S	S	*	.	H	α-helix	trans	-52.8	-48.4	176.6	-172.4	-154.3	159.8	0	0	111	R54 E61 T62	R54-E58 WeakPolarHBondContact O-CB 3.5Å; R54-E58 PolarHBondContact O-N 3.41Å; E58-E61 PolarHBondContact O-N 3.46Å; E58-T62 WeakPolarHBondContact O-CG2 2.94Å; E58-T62 PolarHBondContact O-N 3.38Å
59	V	95.4	Very high	92	Very high	13 Å²	13	56.6 Å²	56.6	8%	0.079	26%	0.264	C	S	.	.	H	α-helix	trans	-65.1	-41.2	179	166.9	0	0	0	0	111.6	E55 V56 I57 T62 V94 R97 L98 L101	E55-V59 WeakPolarHBondContact O-CB 3.17Å; E55-V59 VanDerWaalsContact O-CG2 3.25Å; E55-V59 WeakPolarHBondContact O-CG2 3.47Å; E55-V59 PolarHBondContact O-N 2.69Å; V56-V59 PolarHBondContact O-N 2.75Å; I57-V59 VanDerWaalsContact C-N 3.29Å; I57-V59 PolarHBondContact O-N 3.35Å; V59-T62 PolarHBondContact O-N 3.12Å; V59-T62 PolarHBondContact O-OG1 2.98Å; V59-V94 HydrophobicContact CG1-CG1 3.77Å; V59-V94 VanDerWaalsContact O-CG1 3.31Å; V59-V94 WeakPolarHBondContact O-CG1 3.46Å; V59-R97 HydrophobicContact CB-CG 4.39Å; V59-R97 HydrophobicContact CG1-CB 3.88Å; V59-R97 HydrophobicContact CG1-CG 3.76Å; V59-R97 HydrophobicContact CG2-CG 3.64Å; V59-L98 HydrophobicContact CB-CD2 4.12Å; V59-L98 HydrophobicContact CG1-CD2 3.68Å; V59-L98 HydrophobicContact CG1-CG 3.76Å; V59-L101 HydrophobicContact CB-CD1 4.34Å; V59-L101 HydrophobicContact CG2-CD1 3.95Å
60	L	93.4	Very high	91.8	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-62.7	-40.4	174.7	-76.5	167.3	0	0	0	112.5	V56 I57 T62 D63 F66 L87 L98 L152	V56-L60 HydrophobicContact CG1-CD1 3.74Å; V56-L60 HydrophobicContact CG1-CG 4.42Å; V56-L60 WeakPolarHBondContact O-CB 3.46Å; V56-L60 VanDerWaalsContact O-CG 3.24Å; V56-L60 WeakPolarHBondContact O-CG 3.34Å; V56-L60 PolarHBondContact O-N 3.01Å; I57-L60 WeakPolarHBondContact O-CB 3.28Å; I57-L60 PolarHBondContact O-N 3.09Å; I57-L60 VanDerWaalsContact O-N 3.1Å; L60-T62 PolarHBondContact O-N 2.99Å; L60-D63 PolarHBondContact O-N 3.31Å; L60-F66 HydrophobicContact CB-CD1 3.74Å; L60-F66 HydrophobicContact CB-CE1 3.81Å; L60-F66 HydrophobicContact CD1-CE1 3.91Å; L60-F66 HydrophobicContact CD1-CZ 4.17Å; L60-F66 HydrophobicContact CD2-CD1 4.06Å; L60-F66 HydrophobicContact CD2-CD2 4.35Å; L60-F66 HydrophobicContact CD2-CE1 3.91Å; L60-F66 HydrophobicContact CD2-CE2 4.21Å; L60-F66 HydrophobicContact CD2-CG 4.28Å; L60-F66 HydrophobicContact CD2-CZ 3.98Å; L60-F66 HydrophobicContact CG-CD1 4.35Å; L60-F66 HydrophobicContact CG-CE1 4.09Å; L60-L87 HydrophobicContact CD2-CD1 3.45Å; L60-L87 VanDerWaalsContact CD2-CD1 3.45Å; L60-L98 HydrophobicContact CD2-CD1 3.7Å; L60-L98 HydrophobicContact CG-CD1 4.23Å; L60-L98 HydrophobicContact CG-CD2 4.24Å; L60-L152 HydrophobicContact CD1-CD1 3.76Å; L60-L152 HydrophobicContact CD1-CD2 3.75Å; L60-L152 HydrophobicContact CD1-CG 4.46Å; L60-L152 HydrophobicContact CD2-CD2 4.39Å
61	E	91.7	Very high	91.5	Very high	64 Å²	64	64.9 Å²	64.9	30%	0.299	30%	0.304	S	S	.	.	H	α-helix	trans	-65.2	-20.1	177.2	-72.6	-155.5	153.6	0	0	113.4	I57 E58 D63 R67 L70	I57-E61 HydrophobicContact CG2-CG 4.37Å; I57-E61 WeakPolarHBondContact O-CG 3.46Å; I57-E61 PolarHBondContact O-N 2.69Å; E58-E61 PolarHBondContact O-N 3.46Å; E61-D63 PolarHBondContact O-N 2.96Å; E61-R67 PolarHBondContact O-NE 3.47Å; E61-R67 PolarHBondContact O-NH2 3.33Å; E61-L70 HydrophobicContact CG-CD2 3.86Å
62	T	93.8	Very high	91.2	Very high	71 Å²	71	61 Å²	61	44%	0.436	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.9	174.3	68.9	0	0	0	0	113.2	E58 V59 L60 P64 V94	E58-T62 WeakPolarHBondContact O-CG2 2.94Å; E58-T62 PolarHBondContact O-N 3.38Å; V59-T62 PolarHBondContact O-N 3.12Å; V59-T62 PolarHBondContact O-OG1 2.98Å; L60-T62 PolarHBondContact O-N 2.99Å; T62-P64 WeakPolarHBondContact O-CD 3.31Å; T62-V94 VanDerWaalsContact OG1-CG2 3.31Å; T62-V94 WeakPolarHBondContact OG1-CG2 3.32Å
63	D	93.8	Very high	90.5	Very high	16 Å²	16	62 Å²	62	9%	0.086	31%	0.311	C	S	.	.	S	Bend	trans	-85.7	117.6	172.3	-170.1	-67	0	0	0	110.9	L60 E61 H65 F66 R67 V90 G91 V94	L60-D63 PolarHBondContact O-N 3.31Å; E61-D63 PolarHBondContact O-N 2.96Å; D63-H65 VanDerWaalsContact C-N 3.3Å; D63-H65 PolarHBondContact O-N 3.48Å; D63-H65 WeakPolarHBondContact OD1-CB 3.3Å; D63-H65 PolarHBondContact OD1-N 3.08Å; D63-F66 HydrophobicContact CB-CB 3.98Å; D63-F66 PolarHBondContact O-N 3.48Å; D63-F66 PolarHBondContact OD1-N 2.96Å; D63-F66 VanDerWaalsContact OD1-N 3.1Å; D63-R67 WeakPolarHBondContact O-CB 3.42Å; D63-R67 PolarHBondContact O-N 3.45Å; D63-V90 HydrophobicContact CB-CG1 4.25Å; D63-G91 PolarHBondContact OD2-N 3.16Å; D63-V94 HydrophobicContact CB-CG2 4.27Å
64	P	91.2	Very high	89.7	Confident	105 Å²	105	66.1 Å²	66.1	68%	0.682	33%	0.333	S	S	*	.	H	α-helix	trans	-63.2	-31.2	-176.3	-24.9	35.3	0	0	0	114.6	T62 E68	T62-P64 WeakPolarHBondContact O-CD 3.31Å; P64-E68 PolarHBondContact O-N 2.76Å
65	H	89.8	Confident	88.8	Confident	67 Å²	67	65.9 Å²	65.9	31%	0.31	34%	0.342	S	S	.	.	H	α-helix	trans	-72.7	-44.3	177.3	170.9	-97.4	0	0	0	110	D63 R67 E68 K69 E86	D63-H65 VanDerWaalsContact C-N 3.3Å; D63-H65 PolarHBondContact O-N 3.48Å; D63-H65 WeakPolarHBondContact OD1-CB 3.3Å; D63-H65 PolarHBondContact OD1-N 3.08Å; H65-R67 PolarHBondContact O-N 3.27Å; H65-E68 PolarHBondContact O-N 2.86Å; H65-K69 WeakPolarHBondContact NE2-CE 3.43Å; H65-K69 VanDerWaalsContact O-CG 3.29Å; H65-K69 WeakPolarHBondContact O-CG 3.25Å; H65-K69 PolarHBondContact O-N 2.71Å; H65-K69 VanDerWaalsContact O-N 3.13Å; H65-E86 IonicContact CE1-OE2 3.41Å; H65-E86 PolarHBondContact CE1-OE2 3.36Å
66	F	89.9	Confident	87.9	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.009	36%	0.359	C	S	.	.	H	α-helix	trans	-65.7	-38.1	177.4	-160.2	-85.1	0	0	0	112.3	L60 D63 K69 L70 L83 E86 V90 L152	L60-F66 HydrophobicContact CB-CD1 3.74Å; L60-F66 HydrophobicContact CB-CE1 3.81Å; L60-F66 HydrophobicContact CD1-CE1 3.91Å; L60-F66 HydrophobicContact CD1-CZ 4.17Å; L60-F66 HydrophobicContact CD2-CD1 4.06Å; L60-F66 HydrophobicContact CD2-CD2 4.35Å; L60-F66 HydrophobicContact CD2-CE1 3.91Å; L60-F66 HydrophobicContact CD2-CE2 4.21Å; L60-F66 HydrophobicContact CD2-CG 4.28Å; L60-F66 HydrophobicContact CD2-CZ 3.98Å; L60-F66 HydrophobicContact CG-CD1 4.35Å; L60-F66 HydrophobicContact CG-CE1 4.09Å; D63-F66 HydrophobicContact CB-CB 3.98Å; D63-F66 PolarHBondContact O-N 3.48Å; D63-F66 PolarHBondContact OD1-N 2.96Å; D63-F66 VanDerWaalsContact OD1-N 3.1Å; F66-K69 WeakPolarHBondContact O-CB 3.46Å; F66-K69 PolarHBondContact O-N 2.96Å; F66-K69 VanDerWaalsContact O-N 3.17Å; F66-L70 WeakPolarHBondContact O-CB 3.45Å; F66-L70 PolarHBondContact O-N 2.73Å; F66-L83 HydrophobicContact CE1-CD1 4.07Å; F66-L83 HydrophobicContact CE1-CD2 4.34Å; F66-L83 HydrophobicContact CE1-CG 4.31Å; F66-L83 HydrophobicContact CE2-CD1 4.03Å; F66-L83 HydrophobicContact CE2-CG 4.31Å; F66-L83 HydrophobicContact CZ-CD1 3.63Å; F66-L83 HydrophobicContact CZ-CD2 4.09Å; F66-L83 HydrophobicContact CZ-CG 3.67Å; F66-E86 HydrophobicContact CD2-CB 4.24Å; F66-E86 HydrophobicContact CE2-CB 4.2Å; F66-V90 HydrophobicContact CB-CG2 3.91Å; F66-V90 HydrophobicContact CD2-CG2 3.54Å; F66-V90 HydrophobicContact CE2-CG2 4.45Å; F66-V90 HydrophobicContact CG-CG2 4.02Å; F66-L152 HydrophobicContact CE2-CD2 4.37Å; F66-L152 HydrophobicContact CZ-CD2 3.84Å
67	R	90.1	Very high	87.1	Confident	106 Å²	106	71 Å²	71	40%	0.4	37%	0.366	S	S	.	.	H	α-helix	trans	-59.8	-45.3	174.4	-167.8	-170.3	-60.3	-148.2	-7.4	112.4	E61 D63 H65 K69 L70 Q71	E61-R67 PolarHBondContact O-NE 3.47Å; E61-R67 PolarHBondContact O-NH2 3.33Å; D63-R67 WeakPolarHBondContact O-CB 3.42Å; D63-R67 PolarHBondContact O-N 3.45Å; H65-R67 PolarHBondContact O-N 3.27Å; R67-K69 VanDerWaalsContact C-N 3.28Å; R67-K69 PolarHBondContact O-N 2.65Å; R67-L70 PolarHBondContact O-N 3.19Å; R67-Q71 WeakPolarHBondContact O-CB 3.18Å; R67-Q71 WeakPolarHBondContact O-CG 3.48Å; R67-Q71 PolarHBondContact O-N 2.85Å
68	E	90	Very high	86.3	Confident	126 Å²	126	69.9 Å²	69.9	59%	0.589	36%	0.361	S	S	*	.	H	α-helix	trans	-60.4	-39.4	175.1	-173	-179	-178.2	0	0	111.2	P64 H65 T72	P64-E68 PolarHBondContact O-N 2.76Å; H65-E68 PolarHBondContact O-N 2.86Å; E68-T72 WeakPolarHBondContact O-CB 3.49Å; E68-T72 WeakPolarHBondContact O-CG2 3.3Å; E68-T72 PolarHBondContact O-N 2.64Å; E68-T72 VanDerWaalsContact O-N 3.13Å; E68-T72 PolarHBondContact O-OG1 2.96Å
69	K	88.1	Confident	85.4	Confident	65 Å²	65	67.5 Å²	67.5	28%	0.283	35%	0.348	S	S	.	.	H	α-helix	trans	-66	-42.6	175.3	-63.7	-70.6	178	150.8	0	112.7	H65 F66 R67 T72 A73 L83 E86	H65-K69 WeakPolarHBondContact NE2-CE 3.43Å; H65-K69 VanDerWaalsContact O-CG 3.29Å; H65-K69 WeakPolarHBondContact O-CG 3.25Å; H65-K69 PolarHBondContact O-N 2.71Å; H65-K69 VanDerWaalsContact O-N 3.13Å; F66-K69 WeakPolarHBondContact O-CB 3.46Å; F66-K69 PolarHBondContact O-N 2.96Å; F66-K69 VanDerWaalsContact O-N 3.17Å; R67-K69 VanDerWaalsContact C-N 3.28Å; R67-K69 PolarHBondContact O-N 2.65Å; K69-T72 PolarHBondContact O-N 3.22Å; K69-A73 VanDerWaalsContact O-CB 3.22Å; K69-A73 WeakPolarHBondContact O-CB 3.36Å; K69-A73 PolarHBondContact O-N 3.29Å; K69-L83 HydrophobicContact CB-CD1 3.97Å; K69-E86 HydrophobicContact CD-CG 4.16Å; K69-E86 WeakPolarHBondContact CE-OE1 3.37Å; K69-E86 HydrophobicContact CG-CB 4.48Å; K69-E86 HydrophobicContact CG-CG 4.11Å; K69-E86 IonicContact NZ-OE1 3.71Å; K69-E86 PolarHBondContact NZ-OE1 2.66Å; K69-E86 IonicContact NZ-OE2 3.47Å
70	L	86.2	Confident	84.6	Confident	42 Å²	42	71 Å²	71	22%	0.22	37%	0.367	C	S	.	.	H	α-helix	trans	-62.5	-46.4	178.1	-174.7	64.8	0	0	0	110.9	I57 E61 F66 R67 T72 L83	I57-L70 HydrophobicContact CG2-CD2 4.34Å; E61-L70 HydrophobicContact CG-CD2 3.86Å; F66-L70 WeakPolarHBondContact O-CB 3.45Å; F66-L70 PolarHBondContact O-N 2.73Å; R67-L70 PolarHBondContact O-N 3.19Å; L70-T72 VanDerWaalsContact C-N 3.3Å; L70-T72 PolarHBondContact O-N 2.84Å; L70-L83 HydrophobicContact CD1-CD2 3.73Å
71	Q	83.8	Confident	84	Confident	142 Å²	142	70.9 Å²	70.9	66%	0.664	37%	0.366	S	S	*	.	H	α-helix	trans	-72.4	-15.1	-179.9	-68.2	-179.9	-11.3	0	0	114.7	R67	R67-Q71 WeakPolarHBondContact O-CB 3.18Å; R67-Q71 WeakPolarHBondContact O-CG 3.48Å; R67-Q71 PolarHBondContact O-N 2.85Å
72	T	83.8	Confident	83.6	Confident	100 Å²	100	74.7 Å²	74.7	61%	0.613	38%	0.378	S	S	*	.	H	α-helix	trans	-115.9	-1.4	-179.3	59.9	0	0	0	0	114.2	E68 K69 L70	E68-T72 WeakPolarHBondContact O-CB 3.49Å; E68-T72 WeakPolarHBondContact O-CG2 3.3Å; E68-T72 PolarHBondContact O-N 2.64Å; E68-T72 VanDerWaalsContact O-N 3.13Å; E68-T72 PolarHBondContact O-OG1 2.96Å; K69-T72 PolarHBondContact O-N 3.22Å; L70-T72 VanDerWaalsContact C-N 3.3Å; L70-T72 PolarHBondContact O-N 2.84Å
73	A	80.4	Confident	83.2	Confident	29 Å²	29	71.7 Å²	71.7	24%	0.24	36%	0.359	C	S	.	.			trans	-78.6	137.2	174.7	0	0	0	0	0	110.9	K69 D77 I78	K69-A73 VanDerWaalsContact O-CB 3.22Å; K69-A73 WeakPolarHBondContact O-CB 3.36Å; K69-A73 PolarHBondContact O-N 3.29Å; A73-D77 HydrophobicContact CB-CB 4.44Å; A73-I78 HydrophobicContact CB-CD1 4.16Å; A73-I78 HydrophobicContact CB-CG1 3.76Å
74	N	75.5	Confident	82.9	Confident	106 Å²	106	71 Å²	71	57%	0.567	36%	0.355	S	S	*	.			trans	-70.1	152.8	167.7	-51.4	-77.1	0	0	0	109.5	E76 D77 I78	N74-E76 PolarHBondContact O-N 3.15Å; N74-E76 VanDerWaalsContact O-N 3.14Å; N74-D77 HydrophobicContact CB-CB 4.47Å; N74-D77 PolarHBondContact ND2-OD2 2.58Å; N74-D77 WeakPolarHBondContact O-CA 3.44Å; N74-D77 WeakPolarHBondContact O-CB 3.46Å; N74-D77 PolarHBondContact O-N 2.79Å; N74-I78 PolarHBondContact O-N 2.86Å
75	T	72.8	Confident	82.7	Confident	87 Å²	87	72 Å²	72	53%	0.534	35%	0.349	S	S	.	.	H	α-helix	trans	-48.5	-42.1	171.9	48.8	0	0	0	0	112.3	D77 I78 K79	T75-D77 PolarHBondContact O-N 3.26Å; T75-I78 WeakPolarHBondContact O-CB 3.26Å; T75-I78 PolarHBondContact O-N 2.77Å; T75-K79 VanDerWaalsContact O-CG 3.32Å; T75-K79 WeakPolarHBondContact O-CG 3.22Å; T75-K79 PolarHBondContact O-N 3.49Å
76	E	76.2	Confident	82.7	Confident	124 Å²	124	70.9 Å²	70.9	58%	0.579	34%	0.344	S	S	*	.	H	α-helix	trans	-65.1	-33.5	175.6	-64.3	-62	112.3	0	0	114	N74 I78 N80	N74-E76 PolarHBondContact O-N 3.15Å; N74-E76 VanDerWaalsContact O-N 3.14Å; E76-I78 VanDerWaalsContact C-N 3.34Å; E76-N80 WeakPolarHBondContact O-CB 3.34Å; E76-N80 PolarHBondContact O-N 2.9Å; E76-N80 PolarHBondContact O-ND2 2.98Å
77	D	76.8	Confident	82.6	Confident	27 Å²	27	70.8 Å²	70.8	14%	0.144	34%	0.343	C	S	.	.	H	α-helix	trans	-76.3	-22.3	175.4	-77.9	-54.3	0	0	0	112.9	A73 N74 T75 N80 R82 L83	A73-D77 HydrophobicContact CB-CB 4.44Å; N74-D77 HydrophobicContact CB-CB 4.47Å; N74-D77 PolarHBondContact ND2-OD2 2.58Å; N74-D77 WeakPolarHBondContact O-CA 3.44Å; N74-D77 WeakPolarHBondContact O-CB 3.46Å; N74-D77 PolarHBondContact O-N 2.79Å; T75-D77 PolarHBondContact O-N 3.26Å; D77-N80 PolarHBondContact O-OD1 3.43Å; D77-R82 VanDerWaalsContact CG-NH1 3.29Å; D77-R82 WeakPolarHBondContact O-CB 3.45Å; D77-R82 PolarHBondContact O-N 3.1Å; D77-R82 WeakPolarHBondContact OD1-CD 3.33Å; D77-R82 IonicContact OD1-CZ 2.85Å; D77-R82 IonicContact OD1-NE 3.81Å; D77-R82 IonicContact OD1-NH1 3.42Å; D77-R82 PolarHBondContact OD1-NH1 2.89Å; D77-R82 IonicContact OD2-NH1 2.73Å; D77-R82 PolarHBondContact OD2-NH1 3.44Å; D77-L83 PolarHBondContact O-N 3.05Å
78	I	76	Confident	82.4	Confident	41 Å²	41	71.3 Å²	71.3	21%	0.21	35%	0.354	C	S	.	.	H	α-helix	trans	-75.6	-53.1	169.9	-65.1	172.6	0	0	0	108.9	A73 N74 T75 E76 N80 G81 L83 I156	A73-I78 HydrophobicContact CB-CD1 4.16Å; A73-I78 HydrophobicContact CB-CG1 3.76Å; N74-I78 PolarHBondContact O-N 2.86Å; T75-I78 WeakPolarHBondContact O-CB 3.26Å; T75-I78 PolarHBondContact O-N 2.77Å; E76-I78 VanDerWaalsContact C-N 3.34Å; I78-N80 VanDerWaalsContact C-N 3.34Å; I78-N80 PolarHBondContact O-N 3.08Å; I78-G81 PolarHBondContact O-N 3.43Å; I78-L83 HydrophobicContact CG1-CD2 4.2Å; I78-I156 HydrophobicContact CG2-CD1 4.34Å; I78-I156 HydrophobicContact CG2-CG2 3.5Å
79	K	74.3	Confident	82.4	Confident	81 Å²	81	70.9 Å²	70.9	35%	0.352	36%	0.355	S	S	.	.	H	α-helix	trans	-61.4	-33.9	179.7	-68.3	-178.6	-170.8	-166	0	113.9	T75 G81 T160 E164	T75-K79 VanDerWaalsContact O-CG 3.32Å; T75-K79 WeakPolarHBondContact O-CG 3.22Å; T75-K79 PolarHBondContact O-N 3.49Å; K79-G81 VanDerWaalsContact C-N 3.29Å; K79-G81 PolarHBondContact O-N 3.46Å; K79-T160 HydrophobicContact CD-CG2 3.81Å; K79-T160 VanDerWaalsContact CE-CG2 3.43Å; K79-T160 HydrophobicContact CG-CG2 3.97Å; K79-E164 IonicContact NZ-OE1 3.64Å; K79-E164 PolarHBondContact NZ-OE1 2.83Å
80	N	79.8	Confident	82.5	Confident	86 Å²	86	68.4 Å²	68.4	46%	0.46	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	10.7	-176.2	76.4	30.1	0	0	0	115.2	E76 D77 I78 R82	E76-N80 WeakPolarHBondContact O-CB 3.34Å; E76-N80 PolarHBondContact O-N 2.9Å; E76-N80 PolarHBondContact O-ND2 2.98Å; D77-N80 PolarHBondContact O-OD1 3.43Å; I78-N80 VanDerWaalsContact C-N 3.34Å; I78-N80 PolarHBondContact O-N 3.08Å; N80-R82 VanDerWaalsContact C-N 3.25Å; N80-R82 PolarHBondContact O-N 3.37Å; N80-R82 WeakPolarHBondContact OD1-CB 3.41Å; N80-R82 PolarHBondContact OD1-N 2.92Å; N80-R82 VanDerWaalsContact OD1-N 3.15Å
81	G	79.9	Confident	82.7	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.01	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.1	19.8	177.1	0	0	0	0	0	114.1	I78 K79 K85	I78-G81 PolarHBondContact O-N 3.43Å; K79-G81 VanDerWaalsContact C-N 3.29Å; K79-G81 PolarHBondContact O-N 3.46Å; G81-K85 PolarHBondContact O-NZ 2.62Å
82	R	83.8	Confident	83.2	Confident	144 Å²	144	67.9 Å²	67.9	54%	0.543	35%	0.347	S	S	.	.	S	Bend	trans	-76.7	-44.4	174.9	178.7	-175.5	-176.1	-174.6	-4.5	111.2	D77 N80 S84 K85	D77-R82 VanDerWaalsContact CG-NH1 3.29Å; D77-R82 WeakPolarHBondContact O-CB 3.45Å; D77-R82 PolarHBondContact O-N 3.1Å; D77-R82 WeakPolarHBondContact OD1-CD 3.33Å; D77-R82 IonicContact OD1-CZ 2.85Å; D77-R82 IonicContact OD1-NE 3.81Å; D77-R82 IonicContact OD1-NH1 3.42Å; D77-R82 PolarHBondContact OD1-NH1 2.89Å; D77-R82 IonicContact OD2-NH1 2.73Å; D77-R82 PolarHBondContact OD2-NH1 3.44Å; N80-R82 VanDerWaalsContact C-N 3.25Å; N80-R82 PolarHBondContact O-N 3.37Å; N80-R82 WeakPolarHBondContact OD1-CB 3.41Å; N80-R82 PolarHBondContact OD1-N 2.92Å; N80-R82 VanDerWaalsContact OD1-N 3.15Å; R82-S84 PolarHBondContact O-N 2.85Å; R82-K85 PolarHBondContact O-N 2.87Å; R82-K85 VanDerWaalsContact O-N 3.14Å
83	L	84.6	Confident	83.6	Confident	8 Å²	8	69.3 Å²	69.3	4%	0.042	35%	0.347	C	S	.	.	H	α-helix	trans	-53.5	-41.9	174.4	178.9	64	0	0	0	111.7	F66 K69 L70 D77 I78 K85 E86 I156	F66-L83 HydrophobicContact CE1-CD1 4.07Å; F66-L83 HydrophobicContact CE1-CD2 4.34Å; F66-L83 HydrophobicContact CE1-CG 4.31Å; F66-L83 HydrophobicContact CE2-CD1 4.03Å; F66-L83 HydrophobicContact CE2-CG 4.31Å; F66-L83 HydrophobicContact CZ-CD1 3.63Å; F66-L83 HydrophobicContact CZ-CD2 4.09Å; F66-L83 HydrophobicContact CZ-CG 3.67Å; K69-L83 HydrophobicContact CB-CD1 3.97Å; L70-L83 HydrophobicContact CD1-CD2 3.73Å; D77-L83 PolarHBondContact O-N 3.05Å; I78-L83 HydrophobicContact CG1-CD2 4.2Å; L83-K85 PolarHBondContact O-N 2.83Å; L83-E86 WeakPolarHBondContact O-CB 3.48Å; L83-E86 PolarHBondContact O-N 3.08Å; L83-I156 HydrophobicContact CD2-CD1 4.25Å
84	S	88.1	Confident	84.2	Confident	1 Å²	1	68 Å²	68	1%	0.007	34%	0.336	C	S	.	.	H	α-helix	trans	-58.5	-20.5	-179.1	-50.9	0	0	0	0	115	R82 L87 A149 E153	R82-S84 PolarHBondContact O-N 2.85Å; S84-L87 WeakPolarHBondContact O-CB 3.32Å; S84-A149 VanDerWaalsContact CB-O 3.26Å; S84-A149 WeakPolarHBondContact CB-O 3.48Å; S84-A149 WeakPolarHBondContact O-CB 3.31Å; S84-E153 WeakPolarHBondContact OG-CA 3.5Å; S84-E153 PolarHBondContact OG-N 2.94Å
85	K	87.8	Confident	85.1	Confident	127 Å²	127	65.2 Å²	65.2	55%	0.552	32%	0.317	S	S	*	.	H	α-helix	trans	-82.3	-22.6	178.4	-67.3	157.9	-174.1	120.8	0	112.8	G81 R82 L83 L87 D88	G81-K85 PolarHBondContact O-NZ 2.62Å; R82-K85 PolarHBondContact O-N 2.87Å; R82-K85 VanDerWaalsContact O-N 3.14Å; L83-K85 PolarHBondContact O-N 2.83Å; K85-L87 PolarHBondContact O-N 3.29Å; K85-D88 PolarHBondContact O-N 3.29Å
86	E	88.5	Confident	86.2	Confident	43 Å²	43	64.1 Å²	64.1	20%	0.201	31%	0.31	C	S	.	.	H	α-helix	trans	-68.8	-17	172.9	-56.3	-75.8	-173.8	0	0	111.2	H65 F66 K69 L83 D88 L89	H65-E86 IonicContact CE1-OE2 3.41Å; H65-E86 PolarHBondContact CE1-OE2 3.36Å; F66-E86 HydrophobicContact CD2-CB 4.24Å; F66-E86 HydrophobicContact CE2-CB 4.2Å; K69-E86 HydrophobicContact CD-CG 4.16Å; K69-E86 WeakPolarHBondContact CE-OE1 3.37Å; K69-E86 HydrophobicContact CG-CB 4.48Å; K69-E86 HydrophobicContact CG-CG 4.11Å; K69-E86 IonicContact NZ-OE1 3.71Å; K69-E86 PolarHBondContact NZ-OE1 2.66Å; K69-E86 IonicContact NZ-OE2 3.47Å; L83-E86 WeakPolarHBondContact O-CB 3.48Å; L83-E86 PolarHBondContact O-N 3.08Å; E86-D88 PolarHBondContact O-N 2.57Å; E86-L89 WeakPolarHBondContact O-CB 3.29Å; E86-L89 PolarHBondContact O-N 2.65Å
87	L	89.3	Confident	87.1	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-58.3	-25.9	175.6	-167.3	70.1	0	0	0	113.3	L60 S84 K85 L89 V90 R95 L98 F147 L152	L60-L87 HydrophobicContact CD2-CD1 3.45Å; L60-L87 VanDerWaalsContact CD2-CD1 3.45Å; S84-L87 WeakPolarHBondContact O-CB 3.32Å; K85-L87 PolarHBondContact O-N 3.29Å; L87-L89 PolarHBondContact O-N 2.93Å; L87-V90 HydrophobicContact CD1-CG2 4.4Å; L87-V90 WeakPolarHBondContact O-CB 3.28Å; L87-V90 PolarHBondContact O-N 3.05Å; L87-R95 PolarHBondContact O-NE 3.02Å; L87-R95 PolarHBondContact O-NH2 3.45Å; L87-L98 HydrophobicContact CD1-CD1 3.86Å; L87-F147 HydrophobicContact CD1-CE1 4.41Å; L87-F147 HydrophobicContact CD2-CD1 3.95Å; L87-F147 HydrophobicContact CD2-CE1 3.92Å; L87-L152 HydrophobicContact CD1-CD2 4.16Å; L87-L152 HydrophobicContact CD2-CB 4.49Å; L87-L152 HydrophobicContact CD2-CD2 4.45Å
88	D	85.9	Confident	88	Confident	117 Å²	117	62.3 Å²	62.3	63%	0.626	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-73.6	-11	175.6	-72.6	-16	0	0	0	113.4	K85 E86 R95	K85-D88 PolarHBondContact O-N 3.29Å; E86-D88 PolarHBondContact O-N 2.57Å; D88-R95 IonicContact OD1-CZ 3.89Å; D88-R95 IonicContact OD1-NH2 2.68Å; D88-R95 PolarHBondContact OD1-NH2 3.46Å
89	L	89	Confident	89	Confident	118 Å²	118	61.8 Å²	61.8	62%	0.618	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-99.7	-9.3	175.9	-54.8	-178.8	0	0	0	113.3	E86 L87	E86-L89 WeakPolarHBondContact O-CB 3.29Å; E86-L89 PolarHBondContact O-N 2.65Å; L87-L89 PolarHBondContact O-N 2.93Å
90	V	90.8	Very high	90	Very high	13 Å²	13	61.3 Å²	61.3	8%	0.079	29%	0.293	C	S	.	.	S	Bend	trans	-70.7	144	-175.3	167.9	0	0	0	0	112.6	D63 F66 L87 V94	D63-V90 HydrophobicContact CB-CG1 4.25Å; F66-V90 HydrophobicContact CB-CG2 3.91Å; F66-V90 HydrophobicContact CD2-CG2 3.54Å; F66-V90 HydrophobicContact CE2-CG2 4.45Å; F66-V90 HydrophobicContact CG-CG2 4.02Å; L87-V90 HydrophobicContact CD1-CG2 4.4Å; L87-V90 WeakPolarHBondContact O-CB 3.28Å; L87-V90 PolarHBondContact O-N 3.05Å; V90-V94 HydrophobicContact CG1-CB 3.53Å; V90-V94 HydrophobicContact CG1-CG1 3.5Å; V90-V94 VanDerWaalsContact CG1-CG1 3.5Å; V90-V94 HydrophobicContact CG1-CG2 4.27Å
91	G	90.8	Very high	90.8	Very high	20 Å²	20	57.4 Å²	57.4	21%	0.206	27%	0.272	C	S	.	.			trans	-54.3	139.8	-179.3	0	0	0	0	0	114.9	D63 H93 V94 R95	D63-G91 PolarHBondContact OD2-N 3.16Å; G91-H93 PolarHBondContact O-N 3.01Å; G91-V94 WeakPolarHBondContact O-CB 3.27Å; G91-V94 PolarHBondContact O-N 3.26Å; G91-R95 PolarHBondContact O-N 3.14Å
92	H	92.5	Very high	91.5	Very high	152 Å²	152	57.4 Å²	57.4	70%	0.704	27%	0.272	S	S	*	.	H	α-helix	trans	-56.3	-28.8	-177.7	177.2	50	0	0	0	114.3	T96	H92-T96 PolarHBondContact CE1-OG1 3.13Å; H92-T96 WeakPolarHBondContact O-CB 3.48Å; H92-T96 PolarHBondContact O-N 3.37Å; H92-T96 PolarHBondContact O-OG1 2.84Å
93	H	92.5	Very high	92	Very high	131 Å²	131	55.1 Å²	55.1	61%	0.606	26%	0.263	S	S	*	.	H	α-helix	trans	-68.6	-44.1	176.3	60.6	-81.3	0	0	0	111.7	G91 T96 R97	G91-H93 PolarHBondContact O-N 3.01Å; H93-T96 PolarHBondContact O-N 2.81Å; H93-R97 PolarHBondContact O-N 3.32Å; H93-R97 VanDerWaalsContact O-N 3.08Å
94	V	94.4	Very high	92.5	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-62.2	-47.4	173.4	-179.1	0	0	0	0	110.5	V59 T62 D63 V90 G91 T96 R97 L98	V59-V94 HydrophobicContact CG1-CG1 3.77Å; V59-V94 VanDerWaalsContact O-CG1 3.31Å; V59-V94 WeakPolarHBondContact O-CG1 3.46Å; T62-V94 VanDerWaalsContact OG1-CG2 3.31Å; T62-V94 WeakPolarHBondContact OG1-CG2 3.32Å; D63-V94 HydrophobicContact CB-CG2 4.27Å; V90-V94 HydrophobicContact CG1-CB 3.53Å; V90-V94 HydrophobicContact CG1-CG1 3.5Å; V90-V94 VanDerWaalsContact CG1-CG1 3.5Å; V90-V94 HydrophobicContact CG1-CG2 4.27Å; G91-V94 WeakPolarHBondContact O-CB 3.27Å; G91-V94 PolarHBondContact O-N 3.26Å; V94-T96 VanDerWaalsContact C-N 3.33Å; V94-T96 PolarHBondContact O-N 3.39Å; V94-R97 WeakPolarHBondContact O-CB 3.43Å; V94-R97 PolarHBondContact O-N 2.78Å; V94-L98 HydrophobicContact CG1-CD1 4.03Å; V94-L98 HydrophobicContact CG1-CG 4.35Å; V94-L98 WeakPolarHBondContact O-CG 3.41Å; V94-L98 PolarHBondContact O-N 3Å
95	R	94.4	Very high	92.8	Very high	47 Å²	47	59.2 Å²	59.2	18%	0.177	28%	0.282	C	S	.	.	H	α-helix	trans	-55.1	-45.6	173.6	-80.9	-68.2	-163.5	132.5	12.5	112.9	L87 D88 G91 R97 L98 D99 F147	L87-R95 PolarHBondContact O-NE 3.02Å; L87-R95 PolarHBondContact O-NH2 3.45Å; D88-R95 IonicContact OD1-CZ 3.89Å; D88-R95 IonicContact OD1-NH2 2.68Å; D88-R95 PolarHBondContact OD1-NH2 3.46Å; G91-R95 PolarHBondContact O-N 3.14Å; R95-R97 PolarHBondContact O-N 3.25Å; R95-L98 PolarHBondContact O-N 2.84Å; R95-D99 VanDerWaalsContact O-CB 3.26Å; R95-D99 WeakPolarHBondContact O-CB 3.26Å; R95-D99 PolarHBondContact O-N 2.74Å; R95-F147 PolarHBondContact NH1-O 3.04Å
96	T	94.5	Very high	93	Very high	63 Å²	63	53.4 Å²	53.4	39%	0.387	26%	0.257	S	S	.	.	H	α-helix	trans	-62.2	-32	177.9	-56.8	0	0	0	0	112.3	H92 H93 V94 D99 E100	H92-T96 PolarHBondContact CE1-OG1 3.13Å; H92-T96 WeakPolarHBondContact O-CB 3.48Å; H92-T96 PolarHBondContact O-N 3.37Å; H92-T96 PolarHBondContact O-OG1 2.84Å; H93-T96 PolarHBondContact O-N 2.81Å; V94-T96 VanDerWaalsContact C-N 3.33Å; V94-T96 PolarHBondContact O-N 3.39Å; T96-D99 WeakPolarHBondContact O-CB 2.92Å; T96-E100 PolarHBondContact O-N 3.48Å
97	R	95.9	Very high	93.1	Very high	114 Å²	114	54.3 Å²	54.3	43%	0.43	27%	0.268	S	S	.	.	H	α-helix	trans	-78.4	-40.9	176.7	-173.9	60.7	170.6	179.2	-1.4	112.6	V59 H93 V94 R95 D99 E100 L101	V59-R97 HydrophobicContact CB-CG 4.39Å; V59-R97 HydrophobicContact CG1-CB 3.88Å; V59-R97 HydrophobicContact CG1-CG 3.76Å; V59-R97 HydrophobicContact CG2-CG 3.64Å; H93-R97 PolarHBondContact O-N 3.32Å; H93-R97 VanDerWaalsContact O-N 3.08Å; V94-R97 WeakPolarHBondContact O-CB 3.43Å; V94-R97 PolarHBondContact O-N 2.78Å; R95-R97 PolarHBondContact O-N 3.25Å; R97-D99 VanDerWaalsContact C-N 3.34Å; R97-E100 WeakPolarHBondContact CD-OE2 3.34Å; R97-E100 IonicContact CZ-OE2 3.99Å; R97-E100 IonicContact NE-OE2 2.61Å; R97-E100 IonicContact NH1-OE1 3.02Å; R97-E100 IonicContact NH1-OE2 3.51Å; R97-E100 PolarHBondContact NH1-OE2 3.35Å; R97-E100 WeakPolarHBondContact O-CA 3.18Å; R97-E100 VanDerWaalsContact O-CB 3.26Å; R97-E100 WeakPolarHBondContact O-CB 3.16Å; R97-E100 PolarHBondContact O-N 3.17Å; R97-L101 PolarHBondContact O-N 2.66Å
98	L	96.1	Very high	93.3	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.4	-42.4	173.4	-66.5	170.5	0	0	0	111.7	V56 V59 L60 L87 V94 R95 E100 L101 K102 F147	V56-L98 HydrophobicContact CB-CD2 4.27Å; V56-L98 HydrophobicContact CG1-CD2 3.95Å; V56-L98 HydrophobicContact CG2-CD2 4.14Å; V59-L98 HydrophobicContact CB-CD2 4.12Å; V59-L98 HydrophobicContact CG1-CD2 3.68Å; V59-L98 HydrophobicContact CG1-CG 3.76Å; L60-L98 HydrophobicContact CD2-CD1 3.7Å; L60-L98 HydrophobicContact CG-CD1 4.23Å; L60-L98 HydrophobicContact CG-CD2 4.24Å; L87-L98 HydrophobicContact CD1-CD1 3.86Å; V94-L98 HydrophobicContact CG1-CD1 4.03Å; V94-L98 HydrophobicContact CG1-CG 4.35Å; V94-L98 WeakPolarHBondContact O-CG 3.41Å; V94-L98 PolarHBondContact O-N 3Å; R95-L98 PolarHBondContact O-N 2.84Å; L98-E100 PolarHBondContact O-N 3.48Å; L98-L101 PolarHBondContact O-N 2.68Å; L98-K102 WeakPolarHBondContact O-CB 3.43Å; L98-K102 PolarHBondContact O-N 3.46Å; L98-F147 HydrophobicContact CB-CB 3.81Å; L98-F147 HydrophobicContact CB-CD1 3.73Å; L98-F147 HydrophobicContact CB-CE1 4.47Å; L98-F147 HydrophobicContact CB-CG 3.84Å; L98-F147 HydrophobicContact CD1-CD1 3.86Å; L98-F147 HydrophobicContact CD1-CE1 4.07Å; L98-F147 HydrophobicContact CD2-CD1 4.42Å; L98-F147 HydrophobicContact CD2-CE1 4.35Å; L98-F147 HydrophobicContact CG-CD1 4.22Å
99	D	95.5	Very high	93.6	Very high	30 Å²	30	53 Å²	53	16%	0.16	25%	0.254	C	S	.	.	H	α-helix	trans	-53.3	-37.4	168.3	-88.1	13.6	0	0	0	112.4	R95 T96 R97 R103 T146 F147	R95-D99 VanDerWaalsContact O-CB 3.26Å; R95-D99 WeakPolarHBondContact O-CB 3.26Å; R95-D99 PolarHBondContact O-N 2.74Å; T96-D99 WeakPolarHBondContact O-CB 2.92Å; R97-D99 VanDerWaalsContact C-N 3.34Å; D99-R103 VanDerWaalsContact C-CZ 3.44Å; D99-R103 WeakPolarHBondContact O-CG 3.42Å; D99-R103 PolarHBondContact O-N 2.96Å; D99-R103 PolarHBondContact O-NE 2.73Å; D99-R103 PolarHBondContact O-NH1 3.31Å; D99-R103 PolarHBondContact O-NH2 2.67Å; D99-T146 WeakPolarHBondContact OD1-CA 3.48Å; D99-F147 PolarHBondContact OD1-N 2.93Å
100	E	95.9	Very high	93.5	Very high	71 Å²	71	51.6 Å²	51.6	33%	0.332	24%	0.241	S	C	.	.	H	α-helix	trans	-72.5	-49.8	177.4	-163.8	-170.1	174.9	0	0	111.8	T96 R97 L98 K102 R103 Q104	T96-E100 PolarHBondContact O-N 3.48Å; R97-E100 WeakPolarHBondContact CD-OE2 3.34Å; R97-E100 IonicContact CZ-OE2 3.99Å; R97-E100 IonicContact NE-OE2 2.61Å; R97-E100 IonicContact NH1-OE1 3.02Å; R97-E100 IonicContact NH1-OE2 3.51Å; R97-E100 PolarHBondContact NH1-OE2 3.35Å; R97-E100 WeakPolarHBondContact O-CA 3.18Å; R97-E100 VanDerWaalsContact O-CB 3.26Å; R97-E100 WeakPolarHBondContact O-CB 3.16Å; R97-E100 PolarHBondContact O-N 3.17Å; L98-E100 PolarHBondContact O-N 3.48Å; E100-K102 VanDerWaalsContact C-N 3.33Å; E100-K102 PolarHBondContact O-N 3.05Å; E100-R103 PolarHBondContact O-N 3.14Å; E100-R103 VanDerWaalsContact O-N 3.1Å; E100-Q104 WeakPolarHBondContact O-CG 3.37Å; E100-Q104 PolarHBondContact O-N 2.75Å; E100-Q104 PolarHBondContact OE1-NE2 2.85Å
101	L	96.5	Very high	93.4	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-56	-46.5	177	-67	178.3	0	0	0	111.3	Y52 E55 V56 V59 R97 L98 R103 Q104 E105	Y52-L101 HydrophobicContact CD2-CB 4.36Å; Y52-L101 HydrophobicContact CE2-CB 4.02Å; E55-L101 HydrophobicContact CB-CD1 3.89Å; E55-L101 HydrophobicContact CB-CD2 3.98Å; E55-L101 VanDerWaalsContact O-CD1 3.29Å; E55-L101 WeakPolarHBondContact O-CD1 3.4Å; V56-L101 HydrophobicContact CG2-CD1 4.02Å; V59-L101 HydrophobicContact CB-CD1 4.34Å; V59-L101 HydrophobicContact CG2-CD1 3.95Å; R97-L101 PolarHBondContact O-N 2.66Å; L98-L101 PolarHBondContact O-N 2.68Å; L101-R103 VanDerWaalsContact C-N 3.3Å; L101-R103 PolarHBondContact O-N 2.91Å; L101-Q104 WeakPolarHBondContact O-CB 3.48Å; L101-Q104 PolarHBondContact O-N 3.42Å; L101-E105 PolarHBondContact O-N 3.18Å
102	K	95.4	Very high	93.2	Very high	1 Å²	1	60.7 Å²	60.7	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-59.8	-39.5	177.3	-173.3	177.2	173.9	-177.4	0	112.3	L98 E100 V106 L139 N143 T146 F147 D151	L98-K102 WeakPolarHBondContact O-CB 3.43Å; L98-K102 PolarHBondContact O-N 3.46Å; E100-K102 VanDerWaalsContact C-N 3.33Å; E100-K102 PolarHBondContact O-N 3.05Å; K102-V106 HydrophobicContact CG-CG2 4.41Å; K102-V106 WeakPolarHBondContact O-CB 3.49Å; K102-V106 VanDerWaalsContact O-CG2 3.25Å; K102-V106 WeakPolarHBondContact O-CG2 3.44Å; K102-V106 PolarHBondContact O-N 2.82Å; K102-L139 HydrophobicContact CG-CD2 4.3Å; K102-N143 WeakPolarHBondContact CE-O 3.49Å; K102-N143 PolarHBondContact NZ-O 3.08Å; K102-T146 VanDerWaalsContact CD-O 3.23Å; K102-T146 WeakPolarHBondContact CD-O 3.48Å; K102-T146 WeakPolarHBondContact CE-O 3.26Å; K102-T146 PolarHBondContact NZ-O 3.2Å; K102-F147 HydrophobicContact CB-CB 4.31Å; K102-F147 HydrophobicContact CB-CD2 4.21Å; K102-F147 HydrophobicContact CD-CB 4.14Å; K102-F147 HydrophobicContact CD-CD2 4.15Å; K102-D151 VanDerWaalsContact CE-OD1 3.23Å; K102-D151 WeakPolarHBondContact CE-OD1 3.45Å; K102-D151 IonicContact NZ-OD1 3.79Å; K102-D151 PolarHBondContact NZ-OD1 3.09Å; K102-D151 IonicContact NZ-OD2 2.77Å; K102-D151 PolarHBondContact NZ-OD2 3.1Å
103	R	94.8	Very high	92.9	Very high	95 Å²	95	53.8 Å²	53.8	36%	0.358	25%	0.249	S	C	.	.	H	α-helix	trans	-68.6	-33	175.2	-73.7	-178.5	-62.6	-101.8	1.3	112.6	D99 E100 L101 S107 N145	D99-R103 VanDerWaalsContact C-CZ 3.44Å; D99-R103 WeakPolarHBondContact O-CG 3.42Å; D99-R103 PolarHBondContact O-N 2.96Å; D99-R103 PolarHBondContact O-NE 2.73Å; D99-R103 PolarHBondContact O-NH1 3.31Å; D99-R103 PolarHBondContact O-NH2 2.67Å; E100-R103 PolarHBondContact O-N 3.14Å; E100-R103 VanDerWaalsContact O-N 3.1Å; L101-R103 VanDerWaalsContact C-N 3.3Å; L101-R103 PolarHBondContact O-N 2.91Å; R103-S107 WeakPolarHBondContact O-CB 3.2Å; R103-S107 PolarHBondContact O-N 3Å; R103-S107 VanDerWaalsContact O-N 3.15Å; R103-S107 PolarHBondContact O-OG 2.75Å; R103-N145 PolarHBondContact NH1-O 2.96Å
104	Q	94.9	Very high	92.6	Very high	87 Å²	87	53.2 Å²	53.2	41%	0.407	25%	0.245	S	C	.	.	H	α-helix	trans	-68.4	-48.7	174.1	-68	173.7	7.2	0	0	110.6	E100 L101 S107 R108	E100-Q104 WeakPolarHBondContact O-CG 3.37Å; E100-Q104 PolarHBondContact O-N 2.75Å; E100-Q104 PolarHBondContact OE1-NE2 2.85Å; L101-Q104 WeakPolarHBondContact O-CB 3.48Å; L101-Q104 PolarHBondContact O-N 3.42Å; Q104-S107 CarbonylContact O-C 3.59Å; Q104-S107 WeakPolarHBondContact O-CA 3.43Å; Q104-S107 WeakPolarHBondContact O-CB 3.48Å; Q104-S107 PolarHBondContact O-N 3.45Å; Q104-S107 VanDerWaalsContact O-N 3.07Å; Q104-R108 PolarHBondContact O-N 3.3Å
105	E	93.8	Very high	92.1	Very high	9 Å²	9	55.5 Å²	55.5	4%	0.042	27%	0.265	C	S	.	.	H	α-helix	trans	-62.1	-49.1	177.1	172.1	62.7	169.3	0	0	112.1	Y52 L101 S107 R108 L109 H138 L139	Y52-E105 HydrophobicContact CD1-CB 4.38Å; Y52-E105 HydrophobicContact CD1-CG 3.93Å; Y52-E105 HydrophobicContact CD2-CB 3.62Å; Y52-E105 HydrophobicContact CD2-CG 4.08Å; Y52-E105 HydrophobicContact CE1-CG 4.19Å; Y52-E105 HydrophobicContact CE2-CB 3.83Å; Y52-E105 HydrophobicContact CE2-CG 4.34Å; Y52-E105 HydrophobicContact CG-CB 3.91Å; Y52-E105 HydrophobicContact CG-CG 3.85Å; L101-E105 PolarHBondContact O-N 3.18Å; E105-S107 PolarHBondContact O-N 2.91Å; E105-S107 VanDerWaalsContact O-N 3.1Å; E105-R108 WeakPolarHBondContact O-CA 3.37Å; E105-R108 WeakPolarHBondContact O-CB 3.35Å; E105-R108 PolarHBondContact O-N 2.99Å; E105-R108 IonicContact OE1-CZ 2.9Å; E105-R108 IonicContact OE1-NE 3.35Å; E105-R108 IonicContact OE1-NH2 2.7Å; E105-R108 PolarHBondContact OE1-NH2 3.27Å; E105-R108 IonicContact OE2-CZ 2.77Å; E105-R108 VanDerWaalsContact OE2-CZ 3.29Å; E105-R108 IonicContact OE2-NE 3.26Å; E105-R108 PolarHBondContact OE2-NE 3.04Å; E105-R108 IonicContact OE2-NH2 3.86Å; E105-R108 PolarHBondContact OE2-NH2 3.47Å; E105-R108 VanDerWaalsContact OE2-NH2 3.1Å; E105-L109 HydrophobicContact CG-CD1 3.96Å; E105-L109 HydrophobicContact CG-CG 4.25Å; E105-L109 WeakPolarHBondContact O-CG 3.46Å; E105-L109 PolarHBondContact O-N 2.86Å; E105-H138 IonicContact OE1-CD2 3.92Å; E105-H138 IonicContact OE1-CE1 2.77Å; E105-H138 IonicContact OE1-NE2 3.96Å; E105-H138 PolarHBondContact OE1-NE2 3.43Å; E105-L139 HydrophobicContact CG-CD1 3.93Å
106	V	92.1	Very high	91.5	Very high	5 Å²	5	60 Å²	60	3%	0.03	29%	0.286	C	S	.	.	H	α-helix	trans	-57	-30.8	174.3	168.7	0	0	0	0	111.6	K102 R110 L133 L139 Q144	K102-V106 HydrophobicContact CG-CG2 4.41Å; K102-V106 WeakPolarHBondContact O-CB 3.49Å; K102-V106 VanDerWaalsContact O-CG2 3.25Å; K102-V106 WeakPolarHBondContact O-CG2 3.44Å; K102-V106 PolarHBondContact O-N 2.82Å; V106-R110 WeakPolarHBondContact O-CB 3.33Å; V106-R110 WeakPolarHBondContact O-CD 3.46Å; V106-R110 WeakPolarHBondContact O-CG 3.44Å; V106-R110 PolarHBondContact O-N 2.68Å; V106-L133 HydrophobicContact CG1-CD1 4.08Å; V106-L139 HydrophobicContact CG2-CD1 4.03Å; V106-Q144 HydrophobicContact CG1-CB 4.36Å
107	S	91.1	Very high	90.7	Very high	62 Å²	62	59 Å²	59	43%	0.434	28%	0.277	S	S	.	.	H	α-helix	trans	-74.4	-38.7	174.2	-59.4	0	0	0	0	112.8	R103 Q104 E105 M111	R103-S107 WeakPolarHBondContact O-CB 3.2Å; R103-S107 PolarHBondContact O-N 3Å; R103-S107 VanDerWaalsContact O-N 3.15Å; R103-S107 PolarHBondContact O-OG 2.75Å; Q104-S107 CarbonylContact O-C 3.59Å; Q104-S107 WeakPolarHBondContact O-CA 3.43Å; Q104-S107 WeakPolarHBondContact O-CB 3.48Å; Q104-S107 PolarHBondContact O-N 3.45Å; Q104-S107 VanDerWaalsContact O-N 3.07Å; E105-S107 PolarHBondContact O-N 2.91Å; E105-S107 VanDerWaalsContact O-N 3.1Å; S107-M111 PolarHBondContact O-N 3.48Å
108	R	93.1	Very high	89.8	Confident	89 Å²	89	58.5 Å²	58.5	34%	0.336	28%	0.283	S	S	.	.	H	α-helix	trans	-60.5	-51.1	171.1	-172.7	-172.7	70.7	122.9	-3.9	110.9	Y48 Q104 E105 R110 M111 L112	Y48-R108 VanDerWaalsContact O-CZ 3.27Å; Y48-R108 PolarHBondContact O-NH1 3.36Å; Y48-R108 PolarHBondContact O-NH2 2.88Å; Q104-R108 PolarHBondContact O-N 3.3Å; E105-R108 WeakPolarHBondContact O-CA 3.37Å; E105-R108 WeakPolarHBondContact O-CB 3.35Å; E105-R108 PolarHBondContact O-N 2.99Å; E105-R108 IonicContact OE1-CZ 2.9Å; E105-R108 IonicContact OE1-NE 3.35Å; E105-R108 IonicContact OE1-NH2 2.7Å; E105-R108 PolarHBondContact OE1-NH2 3.27Å; E105-R108 IonicContact OE2-CZ 2.77Å; E105-R108 VanDerWaalsContact OE2-CZ 3.29Å; E105-R108 IonicContact OE2-NE 3.26Å; E105-R108 PolarHBondContact OE2-NE 3.04Å; E105-R108 IonicContact OE2-NH2 3.86Å; E105-R108 PolarHBondContact OE2-NH2 3.47Å; E105-R108 VanDerWaalsContact OE2-NH2 3.1Å; R108-R110 VanDerWaalsContact C-N 3.34Å; R108-R110 PolarHBondContact O-N 2.97Å; R108-M111 WeakPolarHBondContact O-CA 3.37Å; R108-M111 VanDerWaalsContact O-CB 3.32Å; R108-M111 WeakPolarHBondContact O-CB 3.11Å; R108-M111 PolarHBondContact O-N 2.68Å; R108-L112 HydrophobicContact CG-CD1 4.37Å; R108-L112 WeakPolarHBondContact O-CG 3.43Å; R108-L112 PolarHBondContact O-N 2.86Å
109	L	91	Very high	88.6	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.2	-39.2	179.5	-63.9	177.5	0	0	0	112.3	Y48 E105 M111 L112 L113 L133 F136 L139	Y48-L109 HydrophobicContact CE2-CD2 4.26Å; E105-L109 HydrophobicContact CG-CD1 3.96Å; E105-L109 HydrophobicContact CG-CG 4.25Å; E105-L109 WeakPolarHBondContact O-CG 3.46Å; E105-L109 PolarHBondContact O-N 2.86Å; L109-M111 VanDerWaalsContact C-N 3.34Å; L109-L112 HydrophobicContact CD2-CD1 4.45Å; L109-L112 PolarHBondContact O-N 3.31Å; L109-L113 WeakPolarHBondContact O-CB 3.43Å; L109-L113 WeakPolarHBondContact O-CG 3.39Å; L109-L113 PolarHBondContact O-N 3.5Å; L109-L133 HydrophobicContact CB-CD2 3.83Å; L109-L133 HydrophobicContact CD1-CD2 4.37Å; L109-F136 HydrophobicContact CB-CD2 4.1Å; L109-F136 HydrophobicContact CB-CE2 3.71Å; L109-F136 HydrophobicContact CB-CZ 4.15Å; L109-F136 HydrophobicContact CD1-CB 4.31Å; L109-F136 HydrophobicContact CD1-CD2 3.89Å; L109-F136 HydrophobicContact CD1-CE2 4.32Å; L109-F136 HydrophobicContact CD1-CG 4.07Å; L109-F136 HydrophobicContact CD2-CD1 3.98Å; L109-F136 HydrophobicContact CD2-CD2 4.17Å; L109-F136 HydrophobicContact CD2-CE1 3.78Å; L109-F136 HydrophobicContact CD2-CE2 3.99Å; L109-F136 HydrophobicContact CD2-CG 4.15Å; L109-F136 HydrophobicContact CD2-CZ 3.75Å; L109-F136 HydrophobicContact CG-CD2 4.28Å; L109-F136 HydrophobicContact CG-CE2 4.21Å; L109-F136 HydrophobicContact CG-CZ 4.44Å; L109-L139 HydrophobicContact CD1-CD1 3.45Å; L109-L139 VanDerWaalsContact CD1-CD1 3.45Å
110	R	88.4	Confident	87.1	Confident	88 Å²	88	63.7 Å²	63.7	33%	0.332	32%	0.323	S	S	.	.	H	α-helix	trans	-63.8	-35.8	170.7	-76	167.6	-179.2	170.3	1.7	112.7	V106 R108 K114	V106-R110 WeakPolarHBondContact O-CB 3.33Å; V106-R110 WeakPolarHBondContact O-CD 3.46Å; V106-R110 WeakPolarHBondContact O-CG 3.44Å; V106-R110 PolarHBondContact O-N 2.68Å; R108-R110 VanDerWaalsContact C-N 3.34Å; R108-R110 PolarHBondContact O-N 2.97Å; R110-K114 WeakPolarHBondContact O-CB 3.49Å; R110-K114 PolarHBondContact O-N 3.48Å
111	M	88.6	Confident	85.4	Confident	139 Å²	139	63.4 Å²	63.4	69%	0.685	32%	0.324	S	S	*	.	H	α-helix	trans	-68.4	-43.9	176	-165.5	-173.5	-56.6	0	0	111.6	S107 R108 L109 K114 A115	S107-M111 PolarHBondContact O-N 3.48Å; R108-M111 WeakPolarHBondContact O-CA 3.37Å; R108-M111 VanDerWaalsContact O-CB 3.32Å; R108-M111 WeakPolarHBondContact O-CB 3.11Å; R108-M111 PolarHBondContact O-N 2.68Å; L109-M111 VanDerWaalsContact C-N 3.34Å; M111-K114 PolarHBondContact O-N 2.82Å; M111-A115 PolarHBondContact O-N 3.21Å
112	L	86.8	Confident	83.6	Confident	86 Å²	86	66.5 Å²	66.5	45%	0.45	34%	0.344	S	S	.	.	H	α-helix	trans	-62.2	-44.9	174.7	-66.6	173.2	0	0	0	111.7	R108 L109 K114 A115 K116	R108-L112 HydrophobicContact CG-CD1 4.37Å; R108-L112 WeakPolarHBondContact O-CG 3.43Å; R108-L112 PolarHBondContact O-N 2.86Å; L109-L112 HydrophobicContact CD2-CD1 4.45Å; L109-L112 PolarHBondContact O-N 3.31Å; L112-K114 VanDerWaalsContact C-N 3.33Å; L112-K114 PolarHBondContact O-N 2.66Å; L112-A115 PolarHBondContact O-N 2.81Å; L112-K116 WeakPolarHBondContact O-CB 3.49Å; L112-K116 PolarHBondContact O-N 3.23Å
113	L	85.6	Confident	81.6	Confident	6 Å²	6	73.3 Å²	73.3	3%	0.031	38%	0.375	C	S	.	.	H	α-helix	trans	-57.5	-44.4	172.3	-81.8	170.8	0	0	0	112	L109 K116 L117 L132 L133 F136	L109-L113 WeakPolarHBondContact O-CB 3.43Å; L109-L113 WeakPolarHBondContact O-CG 3.39Å; L109-L113 PolarHBondContact O-N 3.5Å; L113-K116 PolarHBondContact O-N 3.12Å; L113-L117 VanDerWaalsContact O-CG 3.32Å; L113-L117 WeakPolarHBondContact O-CG 3.4Å; L113-L117 PolarHBondContact O-N 3.18Å; L113-L132 HydrophobicContact CD1-CB 3.68Å; L113-L132 HydrophobicContact CD2-CB 3.93Å; L113-L132 HydrophobicContact CD2-CD1 4.43Å; L113-L132 HydrophobicContact CG-CB 4.44Å; L113-L133 HydrophobicContact CD1-CD2 4.19Å; L113-L133 HydrophobicContact CD1-CG 4.36Å; L113-F136 HydrophobicContact CD1-CE2 3.92Å; L113-F136 HydrophobicContact CG-CE2 4.01Å; L113-F136 HydrophobicContact CG-CZ 4.27Å
114	K	84.9	Confident	79.4	Confident	119 Å²	119	74.2 Å²	74.2	52%	0.517	40%	0.396	S	S	.	.	H	α-helix	trans	-63.4	-47.8	176.8	-174.1	-172.9	174.2	-162.4	0	111.3	R110 M111 L112 K116 L117 D118	R110-K114 WeakPolarHBondContact O-CB 3.49Å; R110-K114 PolarHBondContact O-N 3.48Å; M111-K114 PolarHBondContact O-N 2.82Å; L112-K114 VanDerWaalsContact C-N 3.33Å; L112-K114 PolarHBondContact O-N 2.66Å; K114-K116 VanDerWaalsContact C-N 3.32Å; K114-K116 PolarHBondContact O-N 2.72Å; K114-L117 PolarHBondContact O-N 2.87Å; K114-L117 VanDerWaalsContact O-N 3.09Å; K114-D118 WeakPolarHBondContact CE-OD2 3.42Å; K114-D118 IonicContact NZ-OD2 2.73Å; K114-D118 WeakPolarHBondContact O-CB 3.38Å; K114-D118 PolarHBondContact O-N 3.06Å
115	A	84.5	Confident	77.3	Confident	51 Å²	51	76.8 Å²	76.8	42%	0.421	41%	0.412	S	S	.	.	H	α-helix	trans	-57.6	-45.2	178.2	0	0	0	0	0	111.4	M111 L112 L117 D118 S119	M111-A115 PolarHBondContact O-N 3.21Å; L112-A115 PolarHBondContact O-N 2.81Å; A115-L117 VanDerWaalsContact C-N 3.31Å; A115-L117 PolarHBondContact O-N 3.22Å; A115-D118 PolarHBondContact O-N 2.67Å; A115-S119 WeakPolarHBondContact O-CB 3.28Å; A115-S119 PolarHBondContact O-N 2.79Å; A115-S119 PolarHBondContact O-OG 2.91Å; A115-S119 VanDerWaalsContact O-OG 3.11Å
116	K	81.6	Confident	75.4	Confident	142 Å²	142	86.2 Å²	86.2	62%	0.617	46%	0.456	S	S	*	.	H	α-helix	trans	-59.5	-37.5	175.4	-169.9	173.3	-177.3	175.6	0	112.8	L112 L113 K114 A120	L112-K116 WeakPolarHBondContact O-CB 3.49Å; L112-K116 PolarHBondContact O-N 3.23Å; L113-K116 PolarHBondContact O-N 3.12Å; K114-K116 VanDerWaalsContact C-N 3.32Å; K114-K116 PolarHBondContact O-N 2.72Å; K116-A120 VanDerWaalsContact O-CB 3.3Å; K116-A120 WeakPolarHBondContact O-CB 3.31Å; K116-A120 PolarHBondContact O-N 2.81Å; K116-A120 VanDerWaalsContact O-N 3.13Å
117	L	78.2	Confident	73.9	Confident	41 Å²	41	89 Å²	89	22%	0.215	47%	0.47	C	S	.	.	H	α-helix	trans	-75.8	-41.7	177.4	-73.1	169.2	0	0	0	113.3	L113 K114 A115 A120 N121 T122 M127 L132	L113-L117 VanDerWaalsContact O-CG 3.32Å; L113-L117 WeakPolarHBondContact O-CG 3.4Å; L113-L117 PolarHBondContact O-N 3.18Å; K114-L117 PolarHBondContact O-N 2.87Å; K114-L117 VanDerWaalsContact O-N 3.09Å; A115-L117 VanDerWaalsContact C-N 3.31Å; A115-L117 PolarHBondContact O-N 3.22Å; L117-A120 PolarHBondContact O-N 3.08Å; L117-A120 VanDerWaalsContact O-N 3.16Å; L117-N121 PolarHBondContact O-N 3.25Å; L117-T122 PolarHBondContact O-N 3.41Å; L117-M127 HydrophobicContact CD2-CE 3.94Å; L117-L132 HydrophobicContact CD1-CD1 4.04Å
118	D	76.8	Confident	72.9	Confident	103 Å²	103	90.1 Å²	90.1	55%	0.551	47%	0.471	S	S	*	.	H	α-helix	trans	-62.5	-45.7	175.8	-72.5	-15.9	0	0	0	109.7	K114 A115 A120 N121	K114-D118 WeakPolarHBondContact CE-OD2 3.42Å; K114-D118 IonicContact NZ-OD2 2.73Å; K114-D118 WeakPolarHBondContact O-CB 3.38Å; K114-D118 PolarHBondContact O-N 3.06Å; A115-D118 PolarHBondContact O-N 2.67Å; D118-A120 VanDerWaalsContact C-N 3.28Å; D118-A120 PolarHBondContact O-N 3.13Å; D118-N121 PolarHBondContact O-N 2.89Å; D118-N121 VanDerWaalsContact O-N 3.1Å
119	S	70.7	Confident	71.8	Confident	111 Å²	111	90 Å²	90	78%	0.776	47%	0.474	S	S	*	.	H	α-helix	trans	-62.8	-29.5	172.3	-65.5	0	0	0	0	113.7	A115 N121	A115-S119 WeakPolarHBondContact O-CB 3.28Å; A115-S119 PolarHBondContact O-N 2.79Å; A115-S119 PolarHBondContact O-OG 2.91Å; A115-S119 VanDerWaalsContact O-OG 3.11Å; S119-N121 VanDerWaalsContact C-N 3.25Å; S119-N121 PolarHBondContact O-N 3.26Å
120	A	64.7	Low	71	Confident	28 Å²	28	91.2 Å²	91.2	23%	0.231	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-4.9	175.8	0	0	0	0	0	113.9	K116 L117 D118 T122 K361	K116-A120 VanDerWaalsContact O-CB 3.3Å; K116-A120 WeakPolarHBondContact O-CB 3.31Å; K116-A120 PolarHBondContact O-N 2.81Å; K116-A120 VanDerWaalsContact O-N 3.13Å; L117-A120 PolarHBondContact O-N 3.08Å; L117-A120 VanDerWaalsContact O-N 3.16Å; D118-A120 VanDerWaalsContact C-N 3.28Å; D118-A120 PolarHBondContact O-N 3.13Å; A120-T122 PolarHBondContact O-N 3.29Å; A120-K361 PolarHBondContact O-NZ 3.43Å
121	N	59.3	Low	70.4	Confident	66 Å²	66	89.5 Å²	89.5	35%	0.353	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	31.2	-170.5	-163.6	59.2	0	0	0	114.4	L117 D118 S119 Q123 L365	L117-N121 PolarHBondContact O-N 3.25Å; D118-N121 PolarHBondContact O-N 2.89Å; D118-N121 VanDerWaalsContact O-N 3.1Å; S119-N121 VanDerWaalsContact C-N 3.25Å; S119-N121 PolarHBondContact O-N 3.26Å; N121-Q123 VanDerWaalsContact C-N 3.32Å; N121-Q123 PolarHBondContact O-N 3.08Å; N121-L365 HydrophobicContact CB-CD2 4.06Å; N121-L365 WeakPolarHBondContact ND2-CD2 3.36Å
122	T	58.6	Low	69.9	Low	69 Å²	69	85 Å²	85	42%	0.423	46%	0.464	S	S	.	.			trans	-85.6	72.6	-177.6	-50.6	0	0	0	0	111.1	L117 A120 M127	L117-T122 PolarHBondContact O-N 3.41Å; A120-T122 PolarHBondContact O-N 3.29Å; T122-M127 HydrophobicContact CG2-CE 3.78Å
123	Q	53.8	Low	69.6	Low	143 Å²	143	81.4 Å²	81.4	67%	0.668	45%	0.445	S	S	*	.			trans	-72.5	136.4	-177.8	-66.9	-167.3	3	0	0	113.1	N121	N121-Q123 VanDerWaalsContact C-N 3.32Å; N121-Q123 PolarHBondContact O-N 3.08Å
124	S	48.6	Very low	69.5	Low	115 Å²	115	86.5 Å²	86.5	80%	0.804	47%	0.467	S	S	*	.	S	Bend	trans	66	51.2	156.7	66	0	0	0	0	119
125	L	51	Low	69.4	Low	141 Å²	141	85.6 Å²	85.6	74%	0.738	47%	0.465	S	S	*	.			trans	-114.6	148.3	144.5	-73.4	176.1	0	0	0	109.7	M127	L125-M127 HydrophobicContact CB-SD 3.72Å; L125-M127 PolarHBondContact O-N 2.93Å
126	Q	53.8	Low	69.5	Low	207 Å²	207	84 Å²	84	97%	0.967	45%	0.449	S	S	*	.			trans	-73.8	75	167.6	-70.7	-175.9	-79.5	0	0	109	D128	Q126-D128 PolarHBondContact O-N 3.03Å
127	M	60.9	Low	69.9	Low	64 Å²	64	82.4 Å²	82.4	32%	0.315	44%	0.443	S	S	.	.			trans	-58.2	129.4	168.5	-98.4	70.1	130.6	0	0	109.2	L117 T122 L125 H129 L132	L117-M127 HydrophobicContact CD2-CE 3.94Å; T122-M127 HydrophobicContact CG2-CE 3.78Å; L125-M127 HydrophobicContact CB-SD 3.72Å; L125-M127 PolarHBondContact O-N 2.93Å; M127-H129 PolarHBondContact O-N 3.12Å; M127-L132 HydrophobicContact CB-CD1 3.95Å; M127-L132 HydrophobicContact CG-CD1 4.16Å
128	D	70.6	Confident	70.5	Confident	85 Å²	85	80.5 Å²	80.5	46%	0.455	43%	0.433	S	S	.	.			trans	-68.4	101.8	169	172.4	26.9	0	0	0	109.5	Q126 A130 S131 L132	Q126-D128 PolarHBondContact O-N 3.03Å; D128-A130 PolarHBondContact O-N 3.13Å; D128-A130 WeakPolarHBondContact OD1-CB 3.4Å; D128-A130 PolarHBondContact OD1-N 3Å; D128-S131 PolarHBondContact O-N 2.87Å; D128-S131 WeakPolarHBondContact OD2-CB 3.25Å; D128-S131 PolarHBondContact OD2-N 3.26Å; D128-S131 PolarHBondContact OD2-OG 3.2Å; D128-L132 PolarHBondContact O-N 3.11Å
129	H	70.3	Confident	71.2	Confident	85 Å²	85	76.1 Å²	76.1	39%	0.394	41%	0.409	S	S	.	.	H	α-helix	trans	-57.7	-27.5	174.8	-73	-75.4	0	0	0	112.5	M127 S131 L132 L133	M127-H129 PolarHBondContact O-N 3.12Å; H129-S131 VanDerWaalsContact C-N 3.34Å; H129-L132 PolarHBondContact O-N 2.96Å; H129-L133 WeakPolarHBondContact O-CB 3.42Å; H129-L133 VanDerWaalsContact O-CG 3.26Å; H129-L133 WeakPolarHBondContact O-CG 3.49Å; H129-L133 PolarHBondContact O-N 3.13Å
130	A	72.4	Confident	72	Confident	27 Å²	27	71.5 Å²	71.5	22%	0.223	38%	0.376	C	S	.	.	H	α-helix	trans	-69	-33.9	174.4	0	0	0	0	0	111.9	D128	D128-A130 PolarHBondContact O-N 3.13Å; D128-A130 WeakPolarHBondContact OD1-CB 3.4Å; D128-A130 PolarHBondContact OD1-N 3Å
131	S	76.8	Confident	72.7	Confident	52 Å²	52	71.6 Å²	71.6	36%	0.364	37%	0.374	S	S	.	.	H	α-helix	trans	-77.1	-28.9	173.2	-68.7	0	0	0	0	113.5	D128 H129 K134	D128-S131 PolarHBondContact O-N 2.87Å; D128-S131 WeakPolarHBondContact OD2-CB 3.25Å; D128-S131 PolarHBondContact OD2-N 3.26Å; D128-S131 PolarHBondContact OD2-OG 3.2Å; H129-S131 VanDerWaalsContact C-N 3.34Å; S131-K134 WeakPolarHBondContact O-CB 3.08Å; S131-K134 PolarHBondContact O-N 3.43Å; S131-K134 PolarHBondContact OG-NZ 2.92Å
132	L	77.4	Confident	73.8	Confident	45 Å²	45	76.1 Å²	76.1	24%	0.236	39%	0.393	C	S	.	.	H	α-helix	trans	-71.2	-34	170.5	-69.3	175.9	0	0	0	112.5	L113 L117 M127 D128 H129 K134 Q135	L113-L132 HydrophobicContact CD1-CB 3.68Å; L113-L132 HydrophobicContact CD2-CB 3.93Å; L113-L132 HydrophobicContact CD2-CD1 4.43Å; L113-L132 HydrophobicContact CG-CB 4.44Å; L117-L132 HydrophobicContact CD1-CD1 4.04Å; M127-L132 HydrophobicContact CB-CD1 3.95Å; M127-L132 HydrophobicContact CG-CD1 4.16Å; D128-L132 PolarHBondContact O-N 3.11Å; H129-L132 PolarHBondContact O-N 2.96Å; L132-K134 PolarHBondContact O-N 2.88Å; L132-Q135 WeakPolarHBondContact O-CG 3.44Å; L132-Q135 PolarHBondContact O-N 2.94Å
133	L	81.9	Confident	75.1	Confident	9 Å²	9	74.1 Å²	74.1	5%	0.047	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-64.4	-17.8	175.6	-75.7	167.9	0	0	0	113.2	V106 L109 L113 H129 Q135 F136 Q144	V106-L133 HydrophobicContact CG1-CD1 4.08Å; L109-L133 HydrophobicContact CB-CD2 3.83Å; L109-L133 HydrophobicContact CD1-CD2 4.37Å; L113-L133 HydrophobicContact CD1-CD2 4.19Å; L113-L133 HydrophobicContact CD1-CG 4.36Å; H129-L133 WeakPolarHBondContact O-CB 3.42Å; H129-L133 VanDerWaalsContact O-CG 3.26Å; H129-L133 WeakPolarHBondContact O-CG 3.49Å; H129-L133 PolarHBondContact O-N 3.13Å; L133-Q135 PolarHBondContact O-N 3.49Å; L133-Q135 VanDerWaalsContact O-N 3.13Å; L133-F136 HydrophobicContact CD2-CD2 3.88Å; L133-F136 HydrophobicContact CD2-CE2 4.04Å; L133-F136 PolarHBondContact O-N 2.89Å; L133-F136 VanDerWaalsContact O-N 3.09Å; L133-Q144 HydrophobicContact CD1-CG 4.35Å
134	K	82.5	Confident	76.5	Confident	114 Å²	114	69 Å²	69	50%	0.496	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-64.4	-10.9	175.3	-62.7	169.7	-175.9	158.5	0	114.5	S131 L132 P141	S131-K134 WeakPolarHBondContact O-CB 3.08Å; S131-K134 PolarHBondContact O-N 3.43Å; S131-K134 PolarHBondContact OG-NZ 2.92Å; L132-K134 PolarHBondContact O-N 2.88Å; K134-P141 HydrophobicContact CB-CG 4.34Å; K134-P141 HydrophobicContact CG-CB 3.73Å; K134-P141 HydrophobicContact CG-CG 3.86Å
135	Q	82.2	Confident	78.4	Confident	99 Å²	99	68.2 Å²	68.2	46%	0.463	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-77.4	-10.3	173.3	81.5	-176.7	11.2	0	0	112.9	L132 L133	L132-Q135 WeakPolarHBondContact O-CG 3.44Å; L132-Q135 PolarHBondContact O-N 2.94Å; L133-Q135 PolarHBondContact O-N 3.49Å; L133-Q135 VanDerWaalsContact O-N 3.13Å
136	F	88.4	Confident	80.3	Confident	19 Å²	19	63.9 Å²	63.9	8%	0.083	32%	0.322	C	S	.	.			trans	-106.5	109.1	-179.6	-55.8	-63.4	0	0	0	108.1	Y48 L109 L113 L133 H138	Y48-F136 HydrophobicContact CE2-CD1 4.06Å; Y48-F136 HydrophobicContact CE2-CE1 4.22Å; Y48-F136 WeakPolarHBondContact OH-CD1 3.31Å; L109-F136 HydrophobicContact CB-CD2 4.1Å; L109-F136 HydrophobicContact CB-CE2 3.71Å; L109-F136 HydrophobicContact CB-CZ 4.15Å; L109-F136 HydrophobicContact CD1-CB 4.31Å; L109-F136 HydrophobicContact CD1-CD2 3.89Å; L109-F136 HydrophobicContact CD1-CE2 4.32Å; L109-F136 HydrophobicContact CD1-CG 4.07Å; L109-F136 HydrophobicContact CD2-CD1 3.98Å; L109-F136 HydrophobicContact CD2-CD2 4.17Å; L109-F136 HydrophobicContact CD2-CE1 3.78Å; L109-F136 HydrophobicContact CD2-CE2 3.99Å; L109-F136 HydrophobicContact CD2-CG 4.15Å; L109-F136 HydrophobicContact CD2-CZ 3.75Å; L109-F136 HydrophobicContact CG-CD2 4.28Å; L109-F136 HydrophobicContact CG-CE2 4.21Å; L109-F136 HydrophobicContact CG-CZ 4.44Å; L113-F136 HydrophobicContact CD1-CE2 3.92Å; L113-F136 HydrophobicContact CG-CE2 4.01Å; L113-F136 HydrophobicContact CG-CZ 4.27Å; L133-F136 HydrophobicContact CD2-CD2 3.88Å; L133-F136 HydrophobicContact CD2-CE2 4.04Å; L133-F136 PolarHBondContact O-N 2.89Å; L133-F136 VanDerWaalsContact O-N 3.09Å; F136-H138 VanDerWaalsContact C-N 3.35Å
137	E	89.8	Confident	82.2	Confident	108 Å²	108	54 Å²	54	51%	0.505	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-21.6	-170.7	-63.5	-175.7	166.2	0	0	113	L139 T158 K161	E137-L139 VanDerWaalsContact C-N 3.27Å; E137-L139 PolarHBondContact O-N 3.12Å; E137-T158 HydrophobicContact CB-CG2 3.71Å; E137-T158 PolarHBondContact O-OG1 3.25Å; E137-K161 WeakPolarHBondContact OE2-CE 3.24Å; E137-K161 IonicContact OE2-NZ 3.67Å; E137-K161 PolarHBondContact OE2-NZ 3.13Å
138	H	90.8	Very high	83.7	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	8.4	-173	67.7	-65.8	0	0	0	116.2	Y48 Y49 E105 F136 L155 T158	Y48-H138 PolarHBondContact OH-CE1 2.85Å; Y48-H138 PolarHBondContact OH-ND1 3.1Å; Y49-H138 WeakPolarHBondContact CB-NE2 3.46Å; Y49-H138 HydrophobicContact CD2-CB 4.17Å; Y49-H138 AromaticContact CD2-CD2 3.7Å; Y49-H138 HydrophobicContact CE2-CB 3.98Å; Y49-H138 AromaticContact CG-CD2 3.66Å; Y49-H138 AromaticContact CG-NE2 3.81Å; E105-H138 IonicContact OE1-CD2 3.92Å; E105-H138 IonicContact OE1-CE1 2.77Å; E105-H138 IonicContact OE1-NE2 3.96Å; E105-H138 PolarHBondContact OE1-NE2 3.43Å; F136-H138 VanDerWaalsContact C-N 3.35Å; H138-L155 HydrophobicContact CB-CD1 4.13Å; H138-T158 HydrophobicContact CB-CG2 4.21Å
139	L	90.1	Very high	84.8	Confident	11 Å²	11	52 Å²	52	6%	0.058	27%	0.267	C	S	.	.	S	Bend	trans	-146.6	150.3	-176.4	-68.2	174.9	0	0	0	111.6	Y52 K102 E105 V106 L109 E137 P141	Y52-L139 HydrophobicContact CE1-CD2 3.65Å; Y52-L139 WeakPolarHBondContact OH-CD2 3.47Å; K102-L139 HydrophobicContact CG-CD2 4.3Å; E105-L139 HydrophobicContact CG-CD1 3.93Å; V106-L139 HydrophobicContact CG2-CD1 4.03Å; L109-L139 HydrophobicContact CD1-CD1 3.45Å; L109-L139 VanDerWaalsContact CD1-CD1 3.45Å; E137-L139 VanDerWaalsContact C-N 3.27Å; E137-L139 PolarHBondContact O-N 3.12Å; L139-P141 WeakPolarHBondContact O-CD 3.35Å
140	D	88.1	Confident	85.8	Confident	15 Å²	15	52.2 Å²	52.2	8%	0.08	27%	0.267	C	S	.	.			trans	-76.3	114	171.6	-171.4	0.9	0	0	0	112.2	H142 N143 K150 D151 L154	D140-H142 PolarHBondContact O-N 3.38Å; D140-H142 VanDerWaalsContact O-N 3.13Å; D140-H142 WeakPolarHBondContact OD1-CB 3.17Å; D140-H142 IonicContact OD1-CD2 2.71Å; D140-H142 PolarHBondContact OD1-CD2 3.13Å; D140-H142 IonicContact OD1-CG 3.54Å; D140-H142 PolarHBondContact OD1-N 3.04Å; D140-N143 CarbonylContact O-C 3.53Å; D140-N143 PolarHBondContact O-N 2.89Å; D140-K150 HydrophobicContact CB-CD 4.4Å; D140-K150 VanDerWaalsContact CG-CE 3.5Å; D140-K150 IonicContact OD1-NZ 3.71Å; D140-K150 PolarHBondContact OD1-NZ 3.25Å; D140-K150 WeakPolarHBondContact OD2-CD 3.44Å; D140-K150 WeakPolarHBondContact OD2-CE 3.28Å; D140-K150 IonicContact OD2-NZ 3.67Å; D140-K150 PolarHBondContact OD2-NZ 3.2Å; D140-D151 PolarHBondContact N-OD1 2.97Å; D140-L154 HydrophobicContact CB-CD1 4.27Å
141	P	80.1	Confident	86.7	Confident	29 Å²	29	51 Å²	51	19%	0.188	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-20.1	179.8	-19.8	35.1	0	0	0	113.2	K134 L139 Q144	K134-P141 HydrophobicContact CB-CG 4.34Å; K134-P141 HydrophobicContact CG-CB 3.73Å; K134-P141 HydrophobicContact CG-CG 3.86Å; L139-P141 WeakPolarHBondContact O-CD 3.35Å; P141-Q144 PolarHBondContact O-NE2 3.46Å
142	H	81.6	Confident	87.5	Confident	161 Å²	161	48.6 Å²	48.6	75%	0.745	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-20	-179.7	-65.6	-82.1	0	0	0	113.8	D140	D140-H142 PolarHBondContact O-N 3.38Å; D140-H142 VanDerWaalsContact O-N 3.13Å; D140-H142 WeakPolarHBondContact OD1-CB 3.17Å; D140-H142 IonicContact OD1-CD2 2.71Å; D140-H142 PolarHBondContact OD1-CD2 3.13Å; D140-H142 IonicContact OD1-CG 3.54Å; D140-H142 PolarHBondContact OD1-N 3.04Å
143	N	85.3	Confident	88.1	Confident	27 Å²	27	50.3 Å²	50.3	14%	0.144	25%	0.246	C	C	.	.			trans	-129.4	117.2	177.7	177.1	0.4	0	0	0	109.5	K102 D140 N145 T146 E148	K102-N143 WeakPolarHBondContact CE-O 3.49Å; K102-N143 PolarHBondContact NZ-O 3.08Å; D140-N143 CarbonylContact O-C 3.53Å; D140-N143 PolarHBondContact O-N 2.89Å; N143-N145 PolarHBondContact OD1-N 3.15Å; N143-T146 PolarHBondContact ND2-O 3.17Å; N143-T146 VanDerWaalsContact ND2-O 3.15Å; N143-T146 PolarHBondContact ND2-OG1 2.88Å; N143-T146 PolarHBondContact OD1-N 2.96Å; N143-T146 PolarHBondContact OD1-O 2.66Å; N143-T146 PolarHBondContact OD1-OG1 3.25Å; N143-E148 PolarHBondContact ND2-OE1 3.33Å; N143-E148 PolarHBondContact ND2-OE2 3.36Å
144	Q	84.5	Confident	88.6	Confident	36 Å²	36	52 Å²	52	17%	0.168	26%	0.255	C	S	.	.	S	Bend	trans	-114.1	3.3	-172.2	-66.4	171.6	29.2	0	0	113.7	V106 L133 P141	V106-Q144 HydrophobicContact CG1-CB 4.36Å; L133-Q144 HydrophobicContact CD1-CG 4.35Å; P141-Q144 PolarHBondContact O-NE2 3.46Å
145	N	87.1	Confident	89.1	Confident	98 Å²	98	46.6 Å²	46.6	52%	0.524	23%	0.232	S	C	.	.	S	Bend	trans	-131.4	-25.8	-167.4	-64	-49.7	0	0	0	115.3	R103 N143	R103-N145 PolarHBondContact NH1-O 2.96Å; N143-N145 PolarHBondContact OD1-N 3.15Å
146	T	91.6	Very high	89.4	Confident	50 Å²	50	42.9 Å²	42.9	31%	0.307	22%	0.215	S	C	.	.	S	Bend	trans	-118	145.8	173.8	51.6	0	0	0	0	110.2	D99 K102 N143 E148	D99-T146 WeakPolarHBondContact OD1-CA 3.48Å; K102-T146 VanDerWaalsContact CD-O 3.23Å; K102-T146 WeakPolarHBondContact CD-O 3.48Å; K102-T146 WeakPolarHBondContact CE-O 3.26Å; K102-T146 PolarHBondContact NZ-O 3.2Å; N143-T146 PolarHBondContact ND2-O 3.17Å; N143-T146 VanDerWaalsContact ND2-O 3.15Å; N143-T146 PolarHBondContact ND2-OG1 2.88Å; N143-T146 PolarHBondContact OD1-N 2.96Å; N143-T146 PolarHBondContact OD1-O 2.66Å; N143-T146 PolarHBondContact OD1-OG1 3.25Å; T146-E148 PolarHBondContact OG1-OE1 2.98Å
147	F	94.3	Very high	89.4	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.226	C	C	.	.			trans	-97.1	115.3	177.3	-175	-88.7	0	0	0	109.8	Y52 V56 L87 R95 L98 D99 K102 D151 L152 L155	Y52-F147 WeakPolarHBondContact OH-CD2 3.4Å; Y52-F147 WeakPolarHBondContact OH-CE2 3.25Å; V56-F147 HydrophobicContact CG1-CE1 4.45Å; V56-F147 HydrophobicContact CG1-CE2 4.34Å; V56-F147 HydrophobicContact CG1-CZ 3.79Å; V56-F147 HydrophobicContact CG2-CE2 4.25Å; V56-F147 HydrophobicContact CG2-CZ 4.49Å; L87-F147 HydrophobicContact CD1-CE1 4.41Å; L87-F147 HydrophobicContact CD2-CD1 3.95Å; L87-F147 HydrophobicContact CD2-CE1 3.92Å; R95-F147 PolarHBondContact NH1-O 3.04Å; L98-F147 HydrophobicContact CB-CB 3.81Å; L98-F147 HydrophobicContact CB-CD1 3.73Å; L98-F147 HydrophobicContact CB-CE1 4.47Å; L98-F147 HydrophobicContact CB-CG 3.84Å; L98-F147 HydrophobicContact CD1-CD1 3.86Å; L98-F147 HydrophobicContact CD1-CE1 4.07Å; L98-F147 HydrophobicContact CD2-CD1 4.42Å; L98-F147 HydrophobicContact CD2-CE1 4.35Å; L98-F147 HydrophobicContact CG-CD1 4.22Å; D99-F147 PolarHBondContact OD1-N 2.93Å; K102-F147 HydrophobicContact CB-CB 4.31Å; K102-F147 HydrophobicContact CB-CD2 4.21Å; K102-F147 HydrophobicContact CD-CB 4.14Å; K102-F147 HydrophobicContact CD-CD2 4.15Å; F147-D151 HydrophobicContact CD2-CB 3.71Å; F147-D151 HydrophobicContact CE2-CB 3.67Å; F147-D151 HydrophobicContact CG-CB 4.29Å; F147-D151 HydrophobicContact CZ-CB 4.21Å; F147-L152 HydrophobicContact CE1-CB 3.86Å; F147-L152 HydrophobicContact CE1-CD1 4.49Å; F147-L152 HydrophobicContact CZ-CB 3.76Å; F147-L152 HydrophobicContact CZ-CD1 4.07Å; F147-L152 HydrophobicContact CZ-CG 4.41Å; F147-L155 HydrophobicContact CE2-CD2 4.46Å
148	E	92.9	Very high	89.4	Confident	85 Å²	85	39.3 Å²	39.3	40%	0.397	20%	0.204	S	C	.	.			trans	-118.5	170	-171.7	-73.2	170.8	-163.2	0	0	111.7	N143 T146 K150 D151 L152	N143-E148 PolarHBondContact ND2-OE1 3.33Å; N143-E148 PolarHBondContact ND2-OE2 3.36Å; T146-E148 PolarHBondContact OG1-OE1 2.98Å; E148-K150 PolarHBondContact O-N 3.38Å; E148-K150 VanDerWaalsContact O-N 3.1Å; E148-D151 PolarHBondContact N-OD2 3.01Å; E148-D151 WeakPolarHBondContact O-CB 3.22Å; E148-D151 PolarHBondContact O-N 3.18Å; E148-L152 PolarHBondContact O-N 2.85Å
149	A	92.1	Very high	89.3	Confident	22 Å²	22	39.6 Å²	39.6	18%	0.182	21%	0.206	C	C	.	.	H	α-helix	trans	-52.1	-38.3	-178.1	0	0	0	0	0	112.3	S84 D151 L152 E153	S84-A149 VanDerWaalsContact CB-O 3.26Å; S84-A149 WeakPolarHBondContact CB-O 3.48Å; S84-A149 WeakPolarHBondContact O-CB 3.31Å; A149-D151 VanDerWaalsContact C-N 3.34Å; A149-D151 PolarHBondContact O-N 3.21Å; A149-L152 PolarHBondContact O-N 2.88Å; A149-E153 WeakPolarHBondContact O-CB 3.48Å; A149-E153 PolarHBondContact O-N 3.28Å
150	K	91.2	Very high	89	Confident	89 Å²	89	40.6 Å²	40.6	39%	0.387	21%	0.212	S	C	.	.	H	α-helix	trans	-65.3	-32.2	177	-178	179.5	162.1	-159.3	0	113.3	D140 E148 L154	D140-K150 HydrophobicContact CB-CD 4.4Å; D140-K150 VanDerWaalsContact CG-CE 3.5Å; D140-K150 IonicContact OD1-NZ 3.71Å; D140-K150 PolarHBondContact OD1-NZ 3.25Å; D140-K150 WeakPolarHBondContact OD2-CD 3.44Å; D140-K150 WeakPolarHBondContact OD2-CE 3.28Å; D140-K150 IonicContact OD2-NZ 3.67Å; D140-K150 PolarHBondContact OD2-NZ 3.2Å; E148-K150 PolarHBondContact O-N 3.38Å; E148-K150 VanDerWaalsContact O-N 3.1Å; K150-L154 HydrophobicContact CG-CD1 4.11Å; K150-L154 HydrophobicContact CG-CG 4.38Å; K150-L154 WeakPolarHBondContact O-CB 3.29Å; K150-L154 VanDerWaalsContact O-CG 3.26Å; K150-L154 WeakPolarHBondContact O-CG 3.47Å; K150-L154 PolarHBondContact O-N 3.31Å
151	D	92.4	Very high	88.9	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-69.1	-41.4	174.8	-63.5	-70.5	0	0	0	111.1	K102 D140 F147 E148 A149 L154 L155	K102-D151 VanDerWaalsContact CE-OD1 3.23Å; K102-D151 WeakPolarHBondContact CE-OD1 3.45Å; K102-D151 IonicContact NZ-OD1 3.79Å; K102-D151 PolarHBondContact NZ-OD1 3.09Å; K102-D151 IonicContact NZ-OD2 2.77Å; K102-D151 PolarHBondContact NZ-OD2 3.1Å; D140-D151 PolarHBondContact N-OD1 2.97Å; F147-D151 HydrophobicContact CD2-CB 3.71Å; F147-D151 HydrophobicContact CE2-CB 3.67Å; F147-D151 HydrophobicContact CG-CB 4.29Å; F147-D151 HydrophobicContact CZ-CB 4.21Å; E148-D151 PolarHBondContact N-OD2 3.01Å; E148-D151 WeakPolarHBondContact O-CB 3.22Å; E148-D151 PolarHBondContact O-N 3.18Å; A149-D151 VanDerWaalsContact C-N 3.34Å; A149-D151 PolarHBondContact O-N 3.21Å; D151-L154 PolarHBondContact O-N 3.03Å; D151-L155 WeakPolarHBondContact O-CB 3.31Å; D151-L155 PolarHBondContact O-N 3.43Å
152	L	92.4	Very high	89.2	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-68.1	-37.6	176.6	-171.7	52.9	0	0	0	111.7	V56 L60 F66 L87 F147 E148 A149 I156	V56-L152 HydrophobicContact CG1-CD1 4.19Å; L60-L152 HydrophobicContact CD1-CD1 3.76Å; L60-L152 HydrophobicContact CD1-CD2 3.75Å; L60-L152 HydrophobicContact CD1-CG 4.46Å; L60-L152 HydrophobicContact CD2-CD2 4.39Å; F66-L152 HydrophobicContact CE2-CD2 4.37Å; F66-L152 HydrophobicContact CZ-CD2 3.84Å; L87-L152 HydrophobicContact CD1-CD2 4.16Å; L87-L152 HydrophobicContact CD2-CB 4.49Å; L87-L152 HydrophobicContact CD2-CD2 4.45Å; F147-L152 HydrophobicContact CE1-CB 3.86Å; F147-L152 HydrophobicContact CE1-CD1 4.49Å; F147-L152 HydrophobicContact CZ-CB 3.76Å; F147-L152 HydrophobicContact CZ-CD1 4.07Å; F147-L152 HydrophobicContact CZ-CG 4.41Å; E148-L152 PolarHBondContact O-N 2.85Å; A149-L152 PolarHBondContact O-N 2.88Å; L152-I156 HydrophobicContact CD1-CD1 3.66Å; L152-I156 HydrophobicContact CD1-CG1 4.01Å; L152-I156 HydrophobicContact CG-CD1 3.82Å; L152-I156 VanDerWaalsContact O-CB 3.27Å; L152-I156 WeakPolarHBondContact O-CB 3.32Å; L152-I156 VanDerWaalsContact O-CG1 3.25Å; L152-I156 WeakPolarHBondContact O-CG1 3.29Å; L152-I156 PolarHBondContact O-N 2.84Å
153	E	90.8	Very high	89.2	Confident	80 Å²	80	38.3 Å²	38.3	37%	0.374	20%	0.2	S	C	.	.	H	α-helix	trans	-62.2	-47	171.9	-174.7	173.8	-170.7	0	0	112	S84 A149 S157	S84-E153 WeakPolarHBondContact OG-CA 3.5Å; S84-E153 PolarHBondContact OG-N 2.94Å; A149-E153 WeakPolarHBondContact O-CB 3.48Å; A149-E153 PolarHBondContact O-N 3.28Å; E153-S157 VanDerWaalsContact O-CB 3.23Å; E153-S157 WeakPolarHBondContact O-CB 3.33Å; E153-S157 PolarHBondContact O-N 2.96Å; E153-S157 PolarHBondContact O-OG 3.45Å
154	L	92.3	Very high	88.9	Confident	46 Å²	46	43 Å²	43	24%	0.241	22%	0.221	C	C	.	.	H	α-helix	trans	-66.1	-44.8	175.8	-75	173.2	0	0	0	112.3	D140 K150 D151 S157 T158	D140-L154 HydrophobicContact CB-CD1 4.27Å; K150-L154 HydrophobicContact CG-CD1 4.11Å; K150-L154 HydrophobicContact CG-CG 4.38Å; K150-L154 WeakPolarHBondContact O-CB 3.29Å; K150-L154 VanDerWaalsContact O-CG 3.26Å; K150-L154 WeakPolarHBondContact O-CG 3.47Å; K150-L154 PolarHBondContact O-N 3.31Å; D151-L154 PolarHBondContact O-N 3.03Å; L154-S157 PolarHBondContact O-N 2.97Å; L154-S157 PolarHBondContact O-OG 3.5Å; L154-T158 WeakPolarHBondContact O-CB 3.46Å; L154-T158 PolarHBondContact O-N 3.03Å; L154-T158 PolarHBondContact O-OG1 3.38Å
155	L	92.8	Very high	88.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.2	-47.8	179.2	178.9	60	0	0	0	111.6	Y49 Y52 L53 V56 H138 F147 D151 A159	Y49-L155 HydrophobicContact CD2-CD1 3.9Å; Y49-L155 HydrophobicContact CE2-CD1 4.07Å; Y52-L155 HydrophobicContact CD1-CD1 3.9Å; Y52-L155 HydrophobicContact CD1-CD2 4.28Å; Y52-L155 HydrophobicContact CE1-CD1 3.95Å; Y52-L155 HydrophobicContact CE1-CD2 3.86Å; Y52-L155 HydrophobicContact CE1-CG 4.49Å; L53-L155 HydrophobicContact CB-CD1 4.22Å; L53-L155 HydrophobicContact CD1-CD1 4.08Å; L53-L155 HydrophobicContact CD1-CD2 4.19Å; L53-L155 HydrophobicContact CD1-CG 3.78Å; V56-L155 HydrophobicContact CB-CD2 4.07Å; V56-L155 HydrophobicContact CG1-CD2 3.85Å; V56-L155 HydrophobicContact CG2-CD2 4.16Å; H138-L155 HydrophobicContact CB-CD1 4.13Å; F147-L155 HydrophobicContact CE2-CD2 4.46Å; D151-L155 WeakPolarHBondContact O-CB 3.31Å; D151-L155 PolarHBondContact O-N 3.43Å; L155-A159 WeakPolarHBondContact O-CB 3.43Å; L155-A159 PolarHBondContact O-N 3.17Å
156	I	88.5	Confident	88.7	Confident	21 Å²	21	42.8 Å²	42.8	11%	0.108	22%	0.217	C	C	.	.	H	α-helix	trans	-67.7	-45.1	178.2	-71.8	171.7	0	0	0	111.6	I78 L83 L152 T160	I78-I156 HydrophobicContact CG2-CD1 4.34Å; I78-I156 HydrophobicContact CG2-CG2 3.5Å; L83-I156 HydrophobicContact CD2-CD1 4.25Å; L152-I156 HydrophobicContact CD1-CD1 3.66Å; L152-I156 HydrophobicContact CD1-CG1 4.01Å; L152-I156 HydrophobicContact CG-CD1 3.82Å; L152-I156 VanDerWaalsContact O-CB 3.27Å; L152-I156 WeakPolarHBondContact O-CB 3.32Å; L152-I156 VanDerWaalsContact O-CG1 3.25Å; L152-I156 WeakPolarHBondContact O-CG1 3.29Å; L152-I156 PolarHBondContact O-N 2.84Å; I156-T160 WeakPolarHBondContact O-CB 3.41Å; I156-T160 PolarHBondContact O-N 2.9Å; I156-T160 PolarHBondContact O-OG1 3.39Å
157	S	88.3	Confident	88.3	Confident	44 Å²	44	41.9 Å²	41.9	31%	0.308	21%	0.21	S	C	.	.	H	α-helix	trans	-71.9	-35.1	-177.6	58.4	0	0	0	0	112.7	E153 L154 K161	E153-S157 VanDerWaalsContact O-CB 3.23Å; E153-S157 WeakPolarHBondContact O-CB 3.33Å; E153-S157 PolarHBondContact O-N 2.96Å; E153-S157 PolarHBondContact O-OG 3.45Å; L154-S157 PolarHBondContact O-N 2.97Å; L154-S157 PolarHBondContact O-OG 3.5Å; S157-K161 VanDerWaalsContact O-CB 3.25Å; S157-K161 WeakPolarHBondContact O-CB 3.43Å; S157-K161 PolarHBondContact O-N 3.36Å
158	T	90.5	Very high	88	Confident	8 Å²	8	44.5 Å²	44.5	5%	0.049	23%	0.232	C	C	.	.	H	α-helix	trans	-69.6	-46.6	172.9	-48.3	0	0	0	0	110.2	Y49 E137 H138 L154 T160 K161 D162	Y49-T158 VanDerWaalsContact OH-C 3.24Å; Y49-T158 WeakPolarHBondContact OH-CG2 3.45Å; Y49-T158 PolarHBondContact OH-O 2.87Å; E137-T158 HydrophobicContact CB-CG2 3.71Å; E137-T158 PolarHBondContact O-OG1 3.25Å; H138-T158 HydrophobicContact CB-CG2 4.21Å; L154-T158 WeakPolarHBondContact O-CB 3.46Å; L154-T158 PolarHBondContact O-N 3.03Å; L154-T158 PolarHBondContact O-OG1 3.38Å; T158-T160 VanDerWaalsContact C-N 3.32Å; T158-T160 PolarHBondContact O-N 2.78Å; T158-K161 PolarHBondContact O-N 2.82Å; T158-D162 WeakPolarHBondContact CG2-OD2 3.41Å; T158-D162 WeakPolarHBondContact O-CB 3.45Å; T158-D162 PolarHBondContact O-N 3.49Å
159	A	88.6	Confident	87.8	Confident	5 Å²	5	46.4 Å²	46.4	4%	0.041	24%	0.241	C	C	.	.	H	α-helix	trans	-58	-44.2	174.6	0	0	0	0	0	111.8	L47 Y49 L53 L155 L163	L47-A159 HydrophobicContact CD1-CB 4Å; Y49-A159 HydrophobicContact CE2-CB 4.21Å; Y49-A159 VanDerWaalsContact OH-CA 3.32Å; Y49-A159 WeakPolarHBondContact OH-CA 3.32Å; Y49-A159 PolarHBondContact OH-N 3.16Å; L53-A159 HydrophobicContact CD1-CB 4.31Å; L53-A159 HydrophobicContact CD2-CB 3.76Å; L155-A159 WeakPolarHBondContact O-CB 3.43Å; L155-A159 PolarHBondContact O-N 3.17Å; A159-L163 WeakPolarHBondContact O-CB 3.5Å; A159-L163 WeakPolarHBondContact O-CD1 3.42Å; A159-L163 WeakPolarHBondContact O-CG 3.11Å; A159-L163 PolarHBondContact O-N 3.49Å
160	T	83.1	Confident	87.6	Confident	32 Å²	32	48.8 Å²	48.8	20%	0.196	25%	0.245	C	C	.	.	H	α-helix	trans	-58.8	-51.1	174.8	-59.3	0	0	0	0	111.4	K79 I156 T158 E164	K79-T160 HydrophobicContact CD-CG2 3.81Å; K79-T160 VanDerWaalsContact CE-CG2 3.43Å; K79-T160 HydrophobicContact CG-CG2 3.97Å; I156-T160 WeakPolarHBondContact O-CB 3.41Å; I156-T160 PolarHBondContact O-N 2.9Å; I156-T160 PolarHBondContact O-OG1 3.39Å; T158-T160 VanDerWaalsContact C-N 3.32Å; T158-T160 PolarHBondContact O-N 2.78Å; T160-E164 HydrophobicContact CG2-CG 4.42Å; T160-E164 WeakPolarHBondContact CG2-OE1 3.28Å; T160-E164 VanDerWaalsContact O-CB 3.32Å; T160-E164 WeakPolarHBondContact O-CB 3.42Å; T160-E164 VanDerWaalsContact O-CG 3.3Å; T160-E164 WeakPolarHBondContact O-CG 3.4Å; T160-E164 PolarHBondContact O-N 3.27Å
161	K	85.6	Confident	87.5	Confident	89 Å²	89	47.5 Å²	47.5	39%	0.387	24%	0.241	S	C	.	.	H	α-helix	trans	-59.8	-50.2	-179.6	164.2	-177.6	149	-84.1	0	111.1	E137 S157 T158 E164 N165	E137-K161 WeakPolarHBondContact OE2-CE 3.24Å; E137-K161 IonicContact OE2-NZ 3.67Å; E137-K161 PolarHBondContact OE2-NZ 3.13Å; S157-K161 VanDerWaalsContact O-CB 3.25Å; S157-K161 WeakPolarHBondContact O-CB 3.43Å; S157-K161 PolarHBondContact O-N 3.36Å; T158-K161 PolarHBondContact O-N 2.82Å; K161-E164 PolarHBondContact O-N 3.03Å; K161-N165 PolarHBondContact O-N 3.42Å; K161-N165 VanDerWaalsContact O-N 3.13Å; K161-N165 PolarHBondContact O-ND2 2.9Å
162	D	86.6	Confident	87.5	Confident	29 Å²	29	51.7 Å²	51.7	16%	0.155	26%	0.26	C	S	.	.	H	α-helix	trans	-67.6	-41.1	-175.5	-62.8	-2.2	0	0	0	109.5	L47 Y49 T158 E164 N165 Y166	L47-D162 HydrophobicContact CD2-CB 3.61Å; Y49-D162 WeakPolarHBondContact CE1-OD2 3.38Å; Y49-D162 PolarHBondContact OH-OD2 3.29Å; T158-D162 WeakPolarHBondContact CG2-OD2 3.41Å; T158-D162 WeakPolarHBondContact O-CB 3.45Å; T158-D162 PolarHBondContact O-N 3.49Å; D162-E164 PolarHBondContact O-N 2.98Å; D162-N165 CarbonylContact O-C 3.56Å; D162-N165 PolarHBondContact O-N 2.99Å; D162-Y166 WeakPolarHBondContact O-CA 3.29Å; D162-Y166 WeakPolarHBondContact O-CB 3.48Å; D162-Y166 PolarHBondContact O-N 3.3Å
163	L	81.9	Confident	87.5	Confident	40 Å²	40	57.6 Å²	57.6	21%	0.209	29%	0.287	C	S	.	.	H	α-helix	trans	-66.3	-34.7	173.4	-69.9	171	0	0	0	113.5	L47 A159 N165 R308	L47-L163 HydrophobicContact CD1-CD1 4.22Å; L47-L163 HydrophobicContact CD1-CD2 4.2Å; L47-L163 HydrophobicContact CD1-CG 4Å; L47-L163 HydrophobicContact CD2-CD2 4.12Å; L47-L163 HydrophobicContact CD2-CG 4.23Å; L47-L163 HydrophobicContact CG-CD2 4.03Å; L47-L163 HydrophobicContact CG-CG 4.28Å; A159-L163 WeakPolarHBondContact O-CB 3.5Å; A159-L163 WeakPolarHBondContact O-CD1 3.42Å; A159-L163 WeakPolarHBondContact O-CG 3.11Å; A159-L163 PolarHBondContact O-N 3.49Å; L163-N165 PolarHBondContact O-N 2.66Å; L163-R308 PolarHBondContact O-NH1 2.92Å
164	E	78.5	Confident	87.7	Confident	124 Å²	124	54.5 Å²	54.5	58%	0.579	27%	0.273	S	S	*	.	H	α-helix	trans	-70.4	-18.9	174.1	-79.1	178.3	-169.8	0	0	113.2	K79 T160 K161 D162	K79-E164 IonicContact NZ-OE1 3.64Å; K79-E164 PolarHBondContact NZ-OE1 2.83Å; T160-E164 HydrophobicContact CG2-CG 4.42Å; T160-E164 WeakPolarHBondContact CG2-OE1 3.28Å; T160-E164 VanDerWaalsContact O-CB 3.32Å; T160-E164 WeakPolarHBondContact O-CB 3.42Å; T160-E164 VanDerWaalsContact O-CG 3.3Å; T160-E164 WeakPolarHBondContact O-CG 3.4Å; T160-E164 PolarHBondContact O-N 3.27Å; K161-E164 PolarHBondContact O-N 3.03Å; D162-E164 PolarHBondContact O-N 2.98Å
165	N	84.2	Confident	87.8	Confident	72 Å²	72	53.8 Å²	53.8	39%	0.385	27%	0.268	S	S	.	.	H	α-helix	trans	-111.9	-11.4	179.6	-67.7	-86.5	0	0	0	114	K161 D162 L163 D167 A168 E169	K161-N165 PolarHBondContact O-N 3.42Å; K161-N165 VanDerWaalsContact O-N 3.13Å; K161-N165 PolarHBondContact O-ND2 2.9Å; D162-N165 CarbonylContact O-C 3.56Å; D162-N165 PolarHBondContact O-N 2.99Å; L163-N165 PolarHBondContact O-N 2.66Å; N165-D167 PolarHBondContact O-N 3.43Å; N165-A168 CarbonylContact O-C 3.6Å; N165-A168 WeakPolarHBondContact O-CA 3.46Å; N165-A168 WeakPolarHBondContact O-CB 3.14Å; N165-A168 PolarHBondContact O-N 3.47Å; N165-E169 PolarHBondContact O-N 3.05Å
166	Y	83.1	Confident	87.9	Confident	58 Å²	58	58.8 Å²	58.8	23%	0.227	29%	0.287	C	S	.	.	H	α-helix	trans	-48.5	-54	-173.1	-177.5	-95.7	0	0	0	112.7	D162 A168 E169 R170	D162-Y166 WeakPolarHBondContact O-CA 3.29Å; D162-Y166 WeakPolarHBondContact O-CB 3.48Å; D162-Y166 PolarHBondContact O-N 3.3Å; Y166-A168 VanDerWaalsContact C-N 3.32Å; Y166-A168 PolarHBondContact O-N 2.77Å; Y166-E169 PolarHBondContact O-N 3.35Å; Y166-R170 HydrophobicContact CD1-CG 4.22Å; Y166-R170 HydrophobicContact CE1-CG 3.94Å; Y166-R170 WeakPolarHBondContact O-CG 3.38Å; Y166-R170 PolarHBondContact O-N 3.19Å
167	D	84.3	Confident	88.3	Confident	32 Å²	32	61.8 Å²	61.8	17%	0.171	30%	0.297	C	S	.	.	H	α-helix	trans	-59.4	-43.6	179.2	-62.4	22.4	0	0	0	110.6	N165 E169 R170 H171 R295 E296	N165-D167 PolarHBondContact O-N 3.43Å; D167-E169 PolarHBondContact O-N 3.34Å; D167-R170 WeakPolarHBondContact O-CB 3.36Å; D167-R170 PolarHBondContact O-N 3.06Å; D167-H171 PolarHBondContact O-CD2 3.03Å; D167-H171 PolarHBondContact O-N 2.93Å; D167-R295 IonicContact OD1-NH2 3.71Å; D167-R295 PolarHBondContact OD1-NH2 3.2Å; D167-R295 IonicContact OD2-CZ 2.73Å; D167-R295 IonicContact OD2-NH2 2.74Å; D167-R295 PolarHBondContact OD2-NH2 3.38Å; D167-E296 WeakPolarHBondContact OD2-CG 3.38Å
168	A	88.7	Confident	88.6	Confident	55 Å²	55	60.8 Å²	60.8	46%	0.455	29%	0.288	S	S	.	.	H	α-helix	trans	-69	-31.3	178.8	0	0	0	0	0	113.8	N165 Y166 E172	N165-A168 CarbonylContact O-C 3.6Å; N165-A168 WeakPolarHBondContact O-CA 3.46Å; N165-A168 WeakPolarHBondContact O-CB 3.14Å; N165-A168 PolarHBondContact O-N 3.47Å; Y166-A168 VanDerWaalsContact C-N 3.32Å; Y166-A168 PolarHBondContact O-N 2.77Å; A168-E172 PolarHBondContact O-N 3.33Å
169	E	87.8	Confident	88.9	Confident	125 Å²	125	61 Å²	61	58%	0.584	29%	0.288	S	S	*	.	H	α-helix	trans	-71.7	-41.5	171.8	-67.9	-169.5	171.1	0	0	110.7	N165 Y166 D167 H171 E172 E173	N165-E169 PolarHBondContact O-N 3.05Å; Y166-E169 PolarHBondContact O-N 3.35Å; D167-E169 PolarHBondContact O-N 3.34Å; E169-H171 PolarHBondContact O-N 3.26Å; E169-E172 PolarHBondContact O-N 3.18Å; E169-E173 WeakPolarHBondContact O-CG 3.18Å; E169-E173 PolarHBondContact O-N 3.09Å
170	R	87.3	Confident	89.2	Confident	71 Å²	71	63.7 Å²	63.7	27%	0.268	30%	0.301	S	S	.	.	H	α-helix	trans	-58.2	-44.7	172.6	-70.1	-75.9	-67.5	-167.5	-3.7	112	Y166 D167 E172 E173 F174 E288 L292	Y166-R170 HydrophobicContact CD1-CG 4.22Å; Y166-R170 HydrophobicContact CE1-CG 3.94Å; Y166-R170 WeakPolarHBondContact O-CG 3.38Å; Y166-R170 PolarHBondContact O-N 3.19Å; D167-R170 WeakPolarHBondContact O-CB 3.36Å; D167-R170 PolarHBondContact O-N 3.06Å; R170-E172 VanDerWaalsContact C-N 3.34Å; R170-E172 PolarHBondContact O-N 2.88Å; R170-E173 PolarHBondContact O-N 2.7Å; R170-F174 WeakPolarHBondContact O-CB 3.23Å; R170-F174 PolarHBondContact O-N 2.86Å; R170-E288 IonicContact NH2-OE2 2.66Å; R170-L292 HydrophobicContact CB-CD1 4.23Å; R170-L292 HydrophobicContact CG-CD1 4.5Å
171	H	90.3	Very high	89.8	Confident	63 Å²	63	65.2 Å²	65.2	29%	0.292	31%	0.306	S	S	.	.	H	α-helix	trans	-54.1	-45.9	173.4	-84.3	-64.8	0	0	0	112.8	D167 E169 K175 E289 E296	D167-H171 PolarHBondContact O-CD2 3.03Å; D167-H171 PolarHBondContact O-N 2.93Å; E169-H171 PolarHBondContact O-N 3.26Å; H171-K175 WeakPolarHBondContact O-CB 3.37Å; H171-K175 PolarHBondContact O-N 3.47Å; H171-E289 IonicContact CE1-OE1 2.62Å; H171-E289 PolarHBondContact CE1-OE1 3.15Å; H171-E289 IonicContact ND1-OE1 2.57Å; H171-E289 PolarHBondContact ND1-OE1 2.77Å; H171-E289 IonicContact NE2-OE1 3.81Å; H171-E296 IonicContact CD2-OE1 2.65Å; H171-E296 IonicContact CE1-OE1 3.64Å; H171-E296 IonicContact NE2-OE1 2.77Å; H171-E296 PolarHBondContact NE2-OE1 2.92Å
172	E	92.8	Very high	90.2	Very high	88 Å²	88	62.3 Å²	62.3	41%	0.411	29%	0.293	S	S	.	.	H	α-helix	trans	-76.8	-27.8	-180	-78.7	-76.4	142.7	0	0	112.7	A168 E169 R170 K175 R176	A168-E172 PolarHBondContact O-N 3.33Å; E169-E172 PolarHBondContact O-N 3.18Å; R170-E172 VanDerWaalsContact C-N 3.34Å; R170-E172 PolarHBondContact O-N 2.88Å; E172-K175 VanDerWaalsContact OE1-CD 3.32Å; E172-K175 WeakPolarHBondContact OE1-CD 3.42Å; E172-K175 IonicContact OE1-NZ 2.84Å; E172-K175 PolarHBondContact OE1-NZ 3.2Å; E172-K175 IonicContact OE2-NZ 3.17Å; E172-R176 WeakPolarHBondContact O-CB 3.38Å; E172-R176 VanDerWaalsContact O-CG 3.25Å; E172-R176 WeakPolarHBondContact O-CG 3.41Å; E172-R176 PolarHBondContact O-N 2.89Å
173	E	91.9	Very high	90.7	Very high	127 Å²	127	62.1 Å²	62.1	59%	0.593	29%	0.292	S	S	*	.	H	α-helix	trans	-65.8	-48.9	168.2	-73.1	-163.7	144.3	0	0	111.7	E169 R170 K175 R176 Y177	E169-E173 WeakPolarHBondContact O-CG 3.18Å; E169-E173 PolarHBondContact O-N 3.09Å; R170-E173 PolarHBondContact O-N 2.7Å; E173-K175 PolarHBondContact O-N 2.92Å; E173-R176 WeakPolarHBondContact O-CB 3.35Å; E173-R176 PolarHBondContact O-N 3.02Å; E173-R176 VanDerWaalsContact O-N 3.13Å; E173-Y177 PolarHBondContact O-N 3.15Å
174	F	94.2	Very high	91.3	Very high	16 Å²	16	66.1 Å²	66.1	7%	0.07	31%	0.309	C	S	.	.	H	α-helix	trans	-63.4	-41	177.1	174.7	-100.6	0	0	0	112	R170 R176 Y177 E178 E286 E289 L333 L338	R170-F174 WeakPolarHBondContact O-CB 3.23Å; R170-F174 PolarHBondContact O-N 2.86Å; F174-R176 VanDerWaalsContact C-N 3.3Å; F174-R176 PolarHBondContact O-N 3.37Å; F174-Y177 HydrophobicContact CD2-CD1 4.38Å; F174-Y177 HydrophobicContact CE2-CD1 4.34Å; F174-Y177 WeakPolarHBondContact O-CB 3.36Å; F174-Y177 PolarHBondContact O-N 3.19Å; F174-Y177 VanDerWaalsContact O-N 3.12Å; F174-E178 HydrophobicContact CE1-CG 4.02Å; F174-E178 HydrophobicContact CE2-CG 4.25Å; F174-E178 HydrophobicContact CZ-CG 3.77Å; F174-E178 PolarHBondContact O-N 3.36Å; F174-E286 HydrophobicContact CE2-CG 4.1Å; F174-E286 HydrophobicContact CZ-CB 4.48Å; F174-E286 HydrophobicContact CZ-CG 3.97Å; F174-E289 HydrophobicContact CB-CG 4.46Å; F174-E289 HydrophobicContact CD1-CB 4.12Å; F174-E289 HydrophobicContact CD1-CG 3.53Å; F174-E289 HydrophobicContact CD2-CB 3.83Å; F174-E289 HydrophobicContact CD2-CG 4.17Å; F174-E289 HydrophobicContact CE1-CB 4.16Å; F174-E289 HydrophobicContact CE1-CG 3.67Å; F174-E289 HydrophobicContact CE2-CB 3.91Å; F174-E289 HydrophobicContact CE2-CG 4.33Å; F174-E289 HydrophobicContact CG-CB 3.94Å; F174-E289 HydrophobicContact CG-CG 3.78Å; F174-E289 HydrophobicContact CZ-CB 4.07Å; F174-E289 HydrophobicContact CZ-CG 4.09Å; F174-L333 HydrophobicContact CE1-CD1 4.15Å; F174-L333 HydrophobicContact CE1-CD2 4.09Å; F174-L333 HydrophobicContact CZ-CD1 3.84Å; F174-L338 HydrophobicContact CD1-CD1 4.38Å; F174-L338 HydrophobicContact CE1-CD1 3.51Å; F174-L338 HydrophobicContact CE1-CD2 4.44Å; F174-L338 HydrophobicContact CZ-CD1 4.22Å
175	K	95.3	Very high	92	Very high	31 Å²	31	64 Å²	64	14%	0.135	30%	0.296	C	S	.	.	H	α-helix	trans	-60.7	-36.7	172.3	-176.7	-177.1	172.1	-170.1	0	112.5	H171 E172 E173 M179 E343	H171-K175 WeakPolarHBondContact O-CB 3.37Å; H171-K175 PolarHBondContact O-N 3.47Å; E172-K175 VanDerWaalsContact OE1-CD 3.32Å; E172-K175 WeakPolarHBondContact OE1-CD 3.42Å; E172-K175 IonicContact OE1-NZ 2.84Å; E172-K175 PolarHBondContact OE1-NZ 3.2Å; E172-K175 IonicContact OE2-NZ 3.17Å; E173-K175 PolarHBondContact O-N 2.92Å; K175-M179 HydrophobicContact CG-CE 4.42Å; K175-M179 WeakPolarHBondContact O-CG 3.4Å; K175-M179 PolarHBondContact O-N 3.43Å; K175-E343 VanDerWaalsContact CE-OE1 3.28Å; K175-E343 WeakPolarHBondContact CE-OE1 3.11Å; K175-E343 IonicContact NZ-OE1 2.78Å; K175-E343 PolarHBondContact NZ-OE1 3.29Å
176	R	95.1	Very high	92.5	Very high	104 Å²	104	63.4 Å²	63.4	39%	0.392	29%	0.288	S	S	.	.	H	α-helix	trans	-69	-37.6	171.9	-76.3	172.6	-179.2	-86.7	2.2	112.4	E172 E173 F174 M179 L180 F347 E350	E172-R176 WeakPolarHBondContact O-CB 3.38Å; E172-R176 VanDerWaalsContact O-CG 3.25Å; E172-R176 WeakPolarHBondContact O-CG 3.41Å; E172-R176 PolarHBondContact O-N 2.89Å; E173-R176 WeakPolarHBondContact O-CB 3.35Å; E173-R176 PolarHBondContact O-N 3.02Å; E173-R176 VanDerWaalsContact O-N 3.13Å; F174-R176 VanDerWaalsContact C-N 3.3Å; F174-R176 PolarHBondContact O-N 3.37Å; R176-M179 HydrophobicContact CG-CE 4.07Å; R176-M179 PolarHBondContact O-N 2.91Å; R176-L180 WeakPolarHBondContact O-CB 3.32Å; R176-L180 PolarHBondContact O-N 3.47Å; R176-F347 HydrophobicContact CB-CE2 4.14Å; R176-F347 HydrophobicContact CB-CZ 4.45Å; R176-F347 HydrophobicContact CG-CD2 4.46Å; R176-F347 HydrophobicContact CG-CE2 4.01Å; R176-E350 IonicContact CZ-OE2 2.73Å; R176-E350 IonicContact NH1-OE1 2.67Å; R176-E350 IonicContact NH1-OE2 3.31Å; R176-E350 PolarHBondContact NH1-OE2 2.61Å
177	Y	95.5	Very high	93.1	Very high	85 Å²	85	64.9 Å²	64.9	33%	0.333	30%	0.297	S	S	.	.	H	α-helix	trans	-59.8	-49.8	172.8	170.2	-92.4	0	0	0	111.3	E173 F174 M179 L180 K181 D283 M285	E173-Y177 PolarHBondContact O-N 3.15Å; F174-Y177 HydrophobicContact CD2-CD1 4.38Å; F174-Y177 HydrophobicContact CE2-CD1 4.34Å; F174-Y177 WeakPolarHBondContact O-CB 3.36Å; F174-Y177 PolarHBondContact O-N 3.19Å; F174-Y177 VanDerWaalsContact O-N 3.12Å; Y177-M179 PolarHBondContact O-N 3.39Å; Y177-L180 WeakPolarHBondContact O-CB 3.43Å; Y177-L180 PolarHBondContact O-N 3.2Å; Y177-L180 VanDerWaalsContact O-N 3.08Å; Y177-K181 HydrophobicContact CE1-CD 3.74Å; Y177-K181 WeakPolarHBondContact O-CB 3.22Å; Y177-K181 PolarHBondContact O-N 2.97Å; Y177-D283 WeakPolarHBondContact CE1-OD2 3.34Å; Y177-D283 PolarHBondContact OH-OD2 3.14Å; Y177-M285 HydrophobicContact CD1-CB 4.4Å; Y177-M285 HydrophobicContact CE1-CB 3.97Å; Y177-M285 HydrophobicContact CE1-CG 4.25Å; Y177-M285 HydrophobicContact CE2-CG 4.21Å
178	E	94.9	Very high	93.6	Very high	23 Å²	23	69.8 Å²	69.8	11%	0.107	31%	0.314	C	S	.	.	H	α-helix	trans	-63.3	-36.7	177.9	-90.7	-66.2	109	0	0	113.2	F174 K181 E182 L338 Y339	F174-E178 HydrophobicContact CE1-CG 4.02Å; F174-E178 HydrophobicContact CE2-CG 4.25Å; F174-E178 HydrophobicContact CZ-CG 3.77Å; F174-E178 PolarHBondContact O-N 3.36Å; E178-K181 VanDerWaalsContact OE1-CD 3.26Å; E178-K181 WeakPolarHBondContact OE1-CD 3.39Å; E178-K181 WeakPolarHBondContact OE1-CE 3.28Å; E178-K181 IonicContact OE1-NZ 3.84Å; E178-K181 PolarHBondContact OE1-NZ 3.28Å; E178-E182 PolarHBondContact O-N 3.46Å; E178-E182 VanDerWaalsContact O-N 3.15Å; E178-L338 HydrophobicContact CB-CD1 4.41Å; E178-L338 HydrophobicContact CG-CD1 3.86Å; E178-Y339 HydrophobicContact CB-CD1 4.44Å; E178-Y339 HydrophobicContact CB-CE1 3.98Å
179	M	96.4	Very high	93.9	Very high	11 Å²	11	67.7 Å²	67.7	5%	0.054	30%	0.295	C	S	.	.	H	α-helix	trans	-67.4	-35.4	171.1	-74.3	-171.9	-62.8	0	0	112.8	K175 R176 Y177 H183 Y339 E343 L344 F347	K175-M179 HydrophobicContact CG-CE 4.42Å; K175-M179 WeakPolarHBondContact O-CG 3.4Å; K175-M179 PolarHBondContact O-N 3.43Å; R176-M179 HydrophobicContact CG-CE 4.07Å; R176-M179 PolarHBondContact O-N 2.91Å; Y177-M179 PolarHBondContact O-N 3.39Å; M179-H183 WeakPolarHBondContact O-CB 3.44Å; M179-H183 PolarHBondContact O-N 3.43Å; M179-Y339 HydrophobicContact CG-CD1 3.51Å; M179-Y339 HydrophobicContact CG-CD2 3.86Å; M179-Y339 HydrophobicContact CG-CE1 3.86Å; M179-Y339 HydrophobicContact CG-CE2 4.19Å; M179-Y339 HydrophobicContact CG-CG 3.52Å; M179-Y339 HydrophobicContact SD-CD2 4.47Å; M179-Y339 HydrophobicContact SD-CG 4.14Å; M179-E343 HydrophobicContact SD-CB 4.21Å; M179-L344 HydrophobicContact CB-CD1 3.85Å; M179-L344 HydrophobicContact CG-CD1 4.13Å; M179-L344 WeakPolarHBondContact O-CD1 3.48Å; M179-F347 HydrophobicContact CB-CD1 3.61Å; M179-F347 HydrophobicContact CB-CE1 3.91Å; M179-F347 HydrophobicContact CB-CG 4.07Å; M179-F347 HydrophobicContact CE-CB 4.06Å; M179-F347 HydrophobicContact CE-CD2 3.96Å; M179-F347 HydrophobicContact CE-CG 3.97Å; M179-F347 HydrophobicContact SD-CB 3.89Å; M179-F347 HydrophobicContact SD-CG 4.23Å
180	L	95.8	Very high	94.2	Very high	62 Å²	62	67 Å²	67	33%	0.325	29%	0.29	S	S	.	.	H	α-helix	trans	-68.4	-45.6	176.2	-178.9	61.8	0	0	0	111.5	R176 Y177 E182 H183 E184 F347 L351	R176-L180 WeakPolarHBondContact O-CB 3.32Å; R176-L180 PolarHBondContact O-N 3.47Å; Y177-L180 WeakPolarHBondContact O-CB 3.43Å; Y177-L180 PolarHBondContact O-N 3.2Å; Y177-L180 VanDerWaalsContact O-N 3.08Å; L180-E182 VanDerWaalsContact C-N 3.35Å; L180-E182 PolarHBondContact O-N 3.08Å; L180-H183 WeakPolarHBondContact O-CB 3.32Å; L180-H183 PolarHBondContact O-N 2.96Å; L180-H183 VanDerWaalsContact O-N 3.08Å; L180-E184 HydrophobicContact CD1-CG 4.3Å; L180-E184 WeakPolarHBondContact O-CG 3.37Å; L180-E184 PolarHBondContact O-N 3.38Å; L180-F347 HydrophobicContact CB-CE1 3.93Å; L180-F347 HydrophobicContact CB-CZ 4.15Å; L180-F347 HydrophobicContact CD1-CE1 4.44Å; L180-L351 HydrophobicContact CD1-CD1 3.92Å
181	K	94.9	Very high	94.5	Very high	65 Å²	65	67 Å²	67	28%	0.283	31%	0.312	S	S	.	.	H	α-helix	trans	-57.9	-42.3	176.4	179.6	168	152.2	-161.1	0	112.2	Y177 E178 R185 D283 E286	Y177-K181 HydrophobicContact CE1-CD 3.74Å; Y177-K181 WeakPolarHBondContact O-CB 3.22Å; Y177-K181 PolarHBondContact O-N 2.97Å; E178-K181 VanDerWaalsContact OE1-CD 3.26Å; E178-K181 WeakPolarHBondContact OE1-CD 3.39Å; E178-K181 WeakPolarHBondContact OE1-CE 3.28Å; E178-K181 IonicContact OE1-NZ 3.84Å; E178-K181 PolarHBondContact OE1-NZ 3.28Å; K181-R185 WeakPolarHBondContact O-CB 3.45Å; K181-R185 PolarHBondContact O-N 2.89Å; K181-R185 VanDerWaalsContact O-N 3.1Å; K181-D283 IonicContact NZ-OD2 2.8Å; K181-D283 PolarHBondContact NZ-OD2 3.45Å; K181-E286 IonicContact NZ-OE1 3.17Å; K181-E286 PolarHBondContact NZ-OE1 3.09Å
182	E	94.9	Very high	94.7	Very high	27 Å²	27	65.5 Å²	65.5	13%	0.126	31%	0.306	C	S	.	.	H	α-helix	trans	-71.1	-36.1	171.9	174.7	62.8	-172.4	0	0	113.1	E178 L180 R185 R186 Y339 L344	E178-E182 PolarHBondContact O-N 3.46Å; E178-E182 VanDerWaalsContact O-N 3.15Å; L180-E182 VanDerWaalsContact C-N 3.35Å; L180-E182 PolarHBondContact O-N 3.08Å; E182-R185 PolarHBondContact O-N 3.15Å; E182-R185 IonicContact OE1-NH1 2.69Å; E182-R185 PolarHBondContact OE1-NH1 2.94Å; E182-R185 WeakPolarHBondContact OE2-CD 3.47Å; E182-R185 IonicContact OE2-CZ 2.8Å; E182-R185 IonicContact OE2-NE 2.71Å; E182-R185 IonicContact OE2-NH1 2.75Å; E182-R185 PolarHBondContact OE2-NH1 2.91Å; E182-R186 WeakPolarHBondContact O-CB 3.47Å; E182-R186 VanDerWaalsContact O-CG 3.26Å; E182-R186 WeakPolarHBondContact O-CG 3.31Å; E182-R186 PolarHBondContact O-N 3.49Å; E182-R186 IonicContact OE1-CZ 3.68Å; E182-R186 IonicContact OE1-NE 3.01Å; E182-R186 PolarHBondContact OE1-NE 3Å; E182-R186 IonicContact OE1-NH2 2.69Å; E182-R186 PolarHBondContact OE1-NH2 3.43Å; E182-Y339 WeakPolarHBondContact CB-OH 3.27Å; E182-Y339 WeakPolarHBondContact CG-OH 3.45Å; E182-L344 HydrophobicContact CB-CD2 4.42Å; E182-L344 HydrophobicContact CG-CD2 3.62Å
183	H	96	Very high	94.8	Very high	26 Å²	26	66 Å²	66	12%	0.12	31%	0.312	C	S	.	.	H	α-helix	trans	-64.4	-47.4	175.3	176.3	58.3	0	0	0	112.2	M179 L180 R185 R186 E187 E348 L351	M179-H183 WeakPolarHBondContact O-CB 3.44Å; M179-H183 PolarHBondContact O-N 3.43Å; L180-H183 WeakPolarHBondContact O-CB 3.32Å; L180-H183 PolarHBondContact O-N 2.96Å; L180-H183 VanDerWaalsContact O-N 3.08Å; H183-R185 VanDerWaalsContact C-N 3.32Å; H183-R185 PolarHBondContact O-N 3.34Å; H183-R186 WeakPolarHBondContact O-CA 3.38Å; H183-R186 WeakPolarHBondContact O-CB 3.37Å; H183-R186 PolarHBondContact O-N 2.96Å; H183-E187 IonicContact CE1-OE1 2.94Å; H183-E187 PolarHBondContact O-N 2.95Å; H183-E348 HydrophobicContact CB-CG 4.42Å; H183-E348 IonicContact CE1-OE1 2.94Å; H183-E348 IonicContact CG-OE1 2.72Å; H183-E348 VanDerWaalsContact ND1-CD 3.32Å; H183-E348 WeakPolarHBondContact ND1-CG 3.45Å; H183-E348 IonicContact ND1-OE1 3.84Å; H183-E348 PolarHBondContact ND1-OE1 3.34Å; H183-L351 HydrophobicContact CB-CD1 4.5Å; H183-L351 VanDerWaalsContact CD2-CD1 3.44Å; H183-L351 WeakPolarHBondContact CD2-CD1 3.21Å
184	E	95.1	Very high	94.9	Very high	123 Å²	123	65 Å²	65	58%	0.575	31%	0.307	S	S	*	.	H	α-helix	trans	-60.9	-41.7	175.8	-71	-172.4	172	0	0	111.3	L180 R186 E187 Y188	L180-E184 HydrophobicContact CD1-CG 4.3Å; L180-E184 WeakPolarHBondContact O-CG 3.37Å; L180-E184 PolarHBondContact O-N 3.38Å; E184-R186 VanDerWaalsContact C-N 3.34Å; E184-R186 PolarHBondContact O-N 3.37Å; E184-E187 PolarHBondContact O-N 2.84Å; E184-Y188 VanDerWaalsContact O-CB 3.3Å; E184-Y188 WeakPolarHBondContact O-CB 3.44Å; E184-Y188 PolarHBondContact O-N 3.2Å
185	R	94.4	Very high	95	Very high	80 Å²	80	72.2 Å²	72.2	30%	0.302	34%	0.341	S	S	.	.	H	α-helix	trans	-57.3	-43.9	170.4	173.4	178	168.7	-90	-11.6	111.9	K181 E182 H183 L189 L204	K181-R185 WeakPolarHBondContact O-CB 3.45Å; K181-R185 PolarHBondContact O-N 2.89Å; K181-R185 VanDerWaalsContact O-N 3.1Å; E182-R185 PolarHBondContact O-N 3.15Å; E182-R185 IonicContact OE1-NH1 2.69Å; E182-R185 PolarHBondContact OE1-NH1 2.94Å; E182-R185 WeakPolarHBondContact OE2-CD 3.47Å; E182-R185 IonicContact OE2-CZ 2.8Å; E182-R185 IonicContact OE2-NE 2.71Å; E182-R185 IonicContact OE2-NH1 2.75Å; E182-R185 PolarHBondContact OE2-NH1 2.91Å; H183-R185 VanDerWaalsContact C-N 3.32Å; H183-R185 PolarHBondContact O-N 3.34Å; R185-L189 HydrophobicContact CG-CD1 3.96Å; R185-L189 WeakPolarHBondContact O-CB 3.25Å; R185-L189 VanDerWaalsContact O-CG 3.25Å; R185-L189 WeakPolarHBondContact O-CG 3.41Å; R185-L189 PolarHBondContact O-N 2.93Å; R185-L204 HydrophobicContact CG-CD1 4.16Å
186	R	94.9	Very high	95	Very high	60 Å²	60	76.2 Å²	76.2	23%	0.226	36%	0.358	C	S	.	.	H	α-helix	trans	-64.4	-45.2	177.9	-75.2	171.4	-179.1	-151.3	1.1	112	E182 H183 E184 L189 K190 E341	E182-R186 WeakPolarHBondContact O-CB 3.47Å; E182-R186 VanDerWaalsContact O-CG 3.26Å; E182-R186 WeakPolarHBondContact O-CG 3.31Å; E182-R186 PolarHBondContact O-N 3.49Å; E182-R186 IonicContact OE1-CZ 3.68Å; E182-R186 IonicContact OE1-NE 3.01Å; E182-R186 PolarHBondContact OE1-NE 3Å; E182-R186 IonicContact OE1-NH2 2.69Å; E182-R186 PolarHBondContact OE1-NH2 3.43Å; H183-R186 WeakPolarHBondContact O-CA 3.38Å; H183-R186 WeakPolarHBondContact O-CB 3.37Å; H183-R186 PolarHBondContact O-N 2.96Å; E184-R186 VanDerWaalsContact C-N 3.34Å; E184-R186 PolarHBondContact O-N 3.37Å; R186-L189 PolarHBondContact O-N 3.28Å; R186-K190 WeakPolarHBondContact O-CB 3.46Å; R186-K190 WeakPolarHBondContact O-CD 3.47Å; R186-K190 WeakPolarHBondContact O-CG 3.12Å; R186-K190 PolarHBondContact O-N 3.06Å; R186-E341 IonicContact CZ-OE1 3.89Å; R186-E341 IonicContact CZ-OE2 3.66Å; R186-E341 IonicContact NH1-OE1 3.61Å; R186-E341 PolarHBondContact NH1-OE1 3.35Å; R186-E341 IonicContact NH1-OE2 3.37Å; R186-E341 PolarHBondContact NH1-OE2 3.1Å; R186-E341 IonicContact NH2-OE1 3.73Å; R186-E341 IonicContact NH2-OE2 2.78Å; R186-E341 PolarHBondContact NH2-OE2 3.07Å
187	E	94.7	Very high	95	Very high	89 Å²	89	74.2 Å²	74.2	42%	0.416	35%	0.351	S	S	.	.	H	α-helix	trans	-65.2	-41.6	175.8	-68.7	-53.4	135.6	0	0	112.5	H183 E184 L189 K190 G191	H183-E187 IonicContact CE1-OE1 2.94Å; H183-E187 PolarHBondContact O-N 2.95Å; E184-E187 PolarHBondContact O-N 2.84Å; E187-L189 PolarHBondContact O-N 3.03Å; E187-K190 WeakPolarHBondContact O-CB 3.31Å; E187-K190 PolarHBondContact O-N 2.89Å; E187-K190 WeakPolarHBondContact OE1-CD 3.45Å; E187-K190 IonicContact OE1-NZ 2.71Å; E187-K190 PolarHBondContact OE1-NZ 3.43Å; E187-G191 PolarHBondContact O-N 3.01Å; E187-G191 VanDerWaalsContact O-N 3.08Å
188	Y	94.4	Very high	95	Very high	134 Å²	134	74.1 Å²	74.1	53%	0.525	35%	0.353	S	S	.	.	H	α-helix	trans	-58.8	-48.6	174.3	-178.1	-105.3	0	0	0	112	E184 K190 G191 L192 E200	E184-Y188 VanDerWaalsContact O-CB 3.3Å; E184-Y188 WeakPolarHBondContact O-CB 3.44Å; E184-Y188 PolarHBondContact O-N 3.2Å; Y188-K190 PolarHBondContact O-N 3.32Å; Y188-G191 PolarHBondContact O-N 3.39Å; Y188-G191 VanDerWaalsContact O-N 3.16Å; Y188-L192 HydrophobicContact CD1-CD1 4.24Å; Y188-L192 HydrophobicContact CE1-CD1 3.73Å; Y188-L192 HydrophobicContact CE1-CG 4.4Å; Y188-L192 PolarHBondContact O-N 3.01Å; Y188-E200 HydrophobicContact CE1-CG 4.18Å
189	L	95.1	Very high	95	Very high	11 Å²	11	80.3 Å²	80.3	6%	0.058	38%	0.38	C	S	.	.	H	α-helix	trans	-66	-34.2	177.9	-68.3	173.4	0	0	0	112.6	R185 R186 E187 G191 L192 R197 E200 E201	R185-L189 HydrophobicContact CG-CD1 3.96Å; R185-L189 WeakPolarHBondContact O-CB 3.25Å; R185-L189 VanDerWaalsContact O-CG 3.25Å; R185-L189 WeakPolarHBondContact O-CG 3.41Å; R185-L189 PolarHBondContact O-N 2.93Å; R186-L189 PolarHBondContact O-N 3.28Å; E187-L189 PolarHBondContact O-N 3.03Å; L189-G191 VanDerWaalsContact C-N 3.29Å; L189-G191 PolarHBondContact O-N 3Å; L189-L192 HydrophobicContact CD2-CD1 4.35Å; L189-L192 PolarHBondContact O-N 3.23Å; L189-R197 HydrophobicContact CB-CG 4.1Å; L189-R197 HydrophobicContact CD2-CG 3.89Å; L189-R197 PolarHBondContact O-NE 2.94Å; L189-E200 HydrophobicContact CD2-CB 4.15Å; L189-E201 HydrophobicContact CD1-CG 4.04Å; L189-E201 HydrophobicContact CD2-CG 4.1Å
190	K	94.3	Very high	94.9	Very high	111 Å²	111	81.4 Å²	81.4	48%	0.483	39%	0.385	S	S	.	.	H	α-helix	trans	-60.9	-37.8	172.2	-73.9	160	-171.1	160.5	0	111.6	R186 E187 Y188 L192	R186-K190 WeakPolarHBondContact O-CB 3.46Å; R186-K190 WeakPolarHBondContact O-CD 3.47Å; R186-K190 WeakPolarHBondContact O-CG 3.12Å; R186-K190 PolarHBondContact O-N 3.06Å; E187-K190 WeakPolarHBondContact O-CB 3.31Å; E187-K190 PolarHBondContact O-N 2.89Å; E187-K190 WeakPolarHBondContact OE1-CD 3.45Å; E187-K190 IonicContact OE1-NZ 2.71Å; E187-K190 PolarHBondContact OE1-NZ 3.43Å; Y188-K190 PolarHBondContact O-N 3.32Å; K190-L192 VanDerWaalsContact C-N 3.32Å; K190-L192 PolarHBondContact O-N 3.16Å
191	G	93.3	Very high	94.8	Very high	71 Å²	71	82.1 Å²	82.1	73%	0.732	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-11.2	178.9	0	0	0	0	0	116.3	E187 Y188 L189	E187-G191 PolarHBondContact O-N 3.01Å; E187-G191 VanDerWaalsContact O-N 3.08Å; Y188-G191 PolarHBondContact O-N 3.39Å; Y188-G191 VanDerWaalsContact O-N 3.16Å; L189-G191 VanDerWaalsContact C-N 3.29Å; L189-G191 PolarHBondContact O-N 3Å
192	L	95.1	Very high	94.9	Very high	32 Å²	32	84.1 Å²	84.1	17%	0.168	40%	0.395	C	S	.	.	S	Bend	trans	-92.5	149.4	-177.3	-70.7	-179.4	0	0	0	114.2	Y188 L189 K190 K196 R197 E200	Y188-L192 HydrophobicContact CD1-CD1 4.24Å; Y188-L192 HydrophobicContact CE1-CD1 3.73Å; Y188-L192 HydrophobicContact CE1-CG 4.4Å; Y188-L192 PolarHBondContact O-N 3.01Å; L189-L192 HydrophobicContact CD2-CD1 4.35Å; L189-L192 PolarHBondContact O-N 3.23Å; K190-L192 VanDerWaalsContact C-N 3.32Å; K190-L192 PolarHBondContact O-N 3.16Å; L192-K196 HydrophobicContact CB-CB 4.19Å; L192-K196 HydrophobicContact CD1-CB 4.28Å; L192-K196 HydrophobicContact CD2-CB 4.21Å; L192-K196 HydrophobicContact CD2-CD 4.25Å; L192-K196 HydrophobicContact CG-CB 4.47Å; L192-R197 HydrophobicContact CB-CB 4.26Å; L192-R197 PolarHBondContact O-NH2 3.34Å; L192-E200 HydrophobicContact CD1-CB 4.37Å
193	D	95.3	Very high	94.9	Very high	97 Å²	97	87.4 Å²	87.4	52%	0.519	41%	0.407	S	S	.	.			trans	-61	151.5	164.5	-55.3	-70.6	0	0	0	111.3	E195 K196 R197	D193-E195 PolarHBondContact O-N 3.14Å; D193-K196 HydrophobicContact CB-CD 4.17Å; D193-K196 HydrophobicContact CB-CG 4.38Å; D193-K196 WeakPolarHBondContact O-CB 3.44Å; D193-K196 PolarHBondContact O-N 3Å; D193-K196 WeakPolarHBondContact OD2-CD 3.42Å; D193-K196 VanDerWaalsContact OD2-CE 3.25Å; D193-K196 WeakPolarHBondContact OD2-CE 3.35Å; D193-K196 IonicContact OD2-NZ 3.97Å; D193-K196 PolarHBondContact OD2-NZ 3.42Å; D193-R197 PolarHBondContact O-N 3.48Å
194	Q	94.1	Very high	94.8	Very high	107 Å²	107	88.3 Å²	88.3	50%	0.5	41%	0.412	S	S	.	.	H	α-helix	trans	-51.2	-48.8	-175.3	-175.2	63.2	28.2	0	0	114	K196 R197 E198	Q194-K196 VanDerWaalsContact C-N 3.32Å; Q194-K196 PolarHBondContact O-N 3.38Å; Q194-R197 PolarHBondContact O-N 3.26Å; Q194-E198 PolarHBondContact NE2-OE1 3.05Å; Q194-E198 PolarHBondContact O-N 2.93Å
195	E	95.1	Very high	94.7	Very high	168 Å²	168	89.3 Å²	89.3	79%	0.785	42%	0.417	S	S	*	.	H	α-helix	trans	-62.9	-37	179.4	-174.8	-174.7	171.1	0	0	112.4	D193 K199	D193-E195 PolarHBondContact O-N 3.14Å; E195-K199 WeakPolarHBondContact O-CB 3.24Å; E195-K199 PolarHBondContact O-N 2.98Å
196	K	94.9	Very high	94.8	Very high	114 Å²	114	91.9 Å²	91.9	50%	0.496	43%	0.432	S	S	.	.	H	α-helix	trans	-71.7	-42.4	177.6	-63.6	173.8	-174.7	161.9	0	110.7	L192 D193 Q194 K199 E200	L192-K196 HydrophobicContact CB-CB 4.19Å; L192-K196 HydrophobicContact CD1-CB 4.28Å; L192-K196 HydrophobicContact CD2-CB 4.21Å; L192-K196 HydrophobicContact CD2-CD 4.25Å; L192-K196 HydrophobicContact CG-CB 4.47Å; D193-K196 HydrophobicContact CB-CD 4.17Å; D193-K196 HydrophobicContact CB-CG 4.38Å; D193-K196 WeakPolarHBondContact O-CB 3.44Å; D193-K196 PolarHBondContact O-N 3Å; D193-K196 WeakPolarHBondContact OD2-CD 3.42Å; D193-K196 VanDerWaalsContact OD2-CE 3.25Å; D193-K196 WeakPolarHBondContact OD2-CE 3.35Å; D193-K196 IonicContact OD2-NZ 3.97Å; D193-K196 PolarHBondContact OD2-NZ 3.42Å; Q194-K196 VanDerWaalsContact C-N 3.32Å; Q194-K196 PolarHBondContact O-N 3.38Å; K196-K199 PolarHBondContact O-N 3.28Å; K196-E200 PolarHBondContact O-N 3.46Å
197	R	95	Very high	94.8	Very high	62 Å²	62	90.3 Å²	90.3	23%	0.234	43%	0.428	C	S	.	.	H	α-helix	trans	-59.6	-50.8	176.8	-166.1	-171.3	-59.5	128.1	6.6	111.1	L189 L192 D193 Q194 K199 E200 E201	L189-R197 HydrophobicContact CB-CG 4.1Å; L189-R197 HydrophobicContact CD2-CG 3.89Å; L189-R197 PolarHBondContact O-NE 2.94Å; L192-R197 HydrophobicContact CB-CB 4.26Å; L192-R197 PolarHBondContact O-NH2 3.34Å; D193-R197 PolarHBondContact O-N 3.48Å; Q194-R197 PolarHBondContact O-N 3.26Å; R197-K199 PolarHBondContact O-N 2.91Å; R197-E200 PolarHBondContact O-N 3.17Å; R197-E201 HydrophobicContact CG-CG 4.4Å; R197-E201 WeakPolarHBondContact CG-OE1 3.42Å; R197-E201 WeakPolarHBondContact O-CB 3.46Å; R197-E201 WeakPolarHBondContact O-CG 3.3Å; R197-E201 PolarHBondContact O-N 3.34Å
198	E	95.6	Very high	94.6	Very high	83 Å²	83	92.2 Å²	92.2	39%	0.388	44%	0.435	S	S	.	.	H	α-helix	trans	-64.4	-20.9	177.3	-76.1	-177.7	-142	0	0	114.2	Q194 K202	Q194-E198 PolarHBondContact NE2-OE1 3.05Å; Q194-E198 PolarHBondContact O-N 2.93Å; E198-K202 VanDerWaalsContact O-CD 3.26Å; E198-K202 WeakPolarHBondContact O-CD 3.38Å; E198-K202 WeakPolarHBondContact O-CE 3.32Å; E198-K202 VanDerWaalsContact O-CG 3.29Å; E198-K202 WeakPolarHBondContact O-CG 3.39Å; E198-K202 PolarHBondContact O-NZ 3.18Å; E198-K202 IonicContact OE2-NZ 3.52Å
199	K	95.6	Very high	94.6	Very high	154 Å²	154	90.5 Å²	90.5	67%	0.67	43%	0.432	S	S	*	.	H	α-helix	trans	-81.7	-44.6	173.2	-173.6	-170.9	173.5	-164.7	0	110.7	E195 K196 R197 K202 R203	E195-K199 WeakPolarHBondContact O-CB 3.24Å; E195-K199 PolarHBondContact O-N 2.98Å; K196-K199 PolarHBondContact O-N 3.28Å; R197-K199 PolarHBondContact O-N 2.91Å; K199-K202 PolarHBondContact O-N 3.35Å; K199-R203 PolarHBondContact O-N 2.99Å
200	E	94.7	Very high	94.5	Very high	33 Å²	33	94.7 Å²	94.7	15%	0.154	45%	0.45	C	S	.	.	H	α-helix	trans	-71.9	-37.3	-178.6	-156.9	66.7	-162.5	0	0	112.1	Y188 L189 L192 K196 R197 K202 R203 L204	Y188-E200 HydrophobicContact CE1-CG 4.18Å; L189-E200 HydrophobicContact CD2-CB 4.15Å; L192-E200 HydrophobicContact CD1-CB 4.37Å; K196-E200 PolarHBondContact O-N 3.46Å; R197-E200 PolarHBondContact O-N 3.17Å; E200-K202 PolarHBondContact O-N 2.77Å; E200-R203 PolarHBondContact O-N 3.21Å; E200-R203 WeakPolarHBondContact OE1-CD 3.41Å; E200-R203 IonicContact OE1-CZ 3.42Å; E200-R203 IonicContact OE1-NE 3.27Å; E200-R203 IonicContact OE1-NH1 3.97Å; E200-R203 PolarHBondContact OE1-NH1 3.22Å; E200-L204 HydrophobicContact CG-CD1 4.23Å; E200-L204 HydrophobicContact CG-CG 4.4Å; E200-L204 WeakPolarHBondContact O-CB 3.22Å; E200-L204 VanDerWaalsContact O-CG 3.28Å; E200-L204 WeakPolarHBondContact O-CG 3.15Å; E200-L204 PolarHBondContact O-N 3.1Å
201	E	94.4	Very high	94.4	Very high	77 Å²	77	90 Å²	90	36%	0.36	43%	0.429	S	S	.	.	H	α-helix	trans	-56.9	-37.9	171.6	-75	169.2	173.4	0	0	111.8	L189 R197 Q205	L189-E201 HydrophobicContact CD1-CG 4.04Å; L189-E201 HydrophobicContact CD2-CG 4.1Å; R197-E201 HydrophobicContact CG-CG 4.4Å; R197-E201 WeakPolarHBondContact CG-OE1 3.42Å; R197-E201 WeakPolarHBondContact O-CB 3.46Å; R197-E201 WeakPolarHBondContact O-CG 3.3Å; R197-E201 PolarHBondContact O-N 3.34Å; E201-Q205 WeakPolarHBondContact O-CB 3.28Å; E201-Q205 PolarHBondContact O-N 2.94Å
202	K	95.9	Very high	94.4	Very high	108 Å²	108	92.5 Å²	92.5	47%	0.47	42%	0.417	S	S	.	.	H	α-helix	trans	-69.9	-46.3	174	-70.5	171.2	-168.1	117.8	0	111.9	E198 K199 E200 L204 Q205 E206	E198-K202 VanDerWaalsContact O-CD 3.26Å; E198-K202 WeakPolarHBondContact O-CD 3.38Å; E198-K202 WeakPolarHBondContact O-CE 3.32Å; E198-K202 VanDerWaalsContact O-CG 3.29Å; E198-K202 WeakPolarHBondContact O-CG 3.39Å; E198-K202 PolarHBondContact O-NZ 3.18Å; E198-K202 IonicContact OE2-NZ 3.52Å; K199-K202 PolarHBondContact O-N 3.35Å; E200-K202 PolarHBondContact O-N 2.77Å; K202-L204 VanDerWaalsContact C-N 3.34Å; K202-L204 PolarHBondContact O-N 3.33Å; K202-Q205 PolarHBondContact O-N 2.88Å; K202-Q205 VanDerWaalsContact O-N 3.15Å; K202-E206 WeakPolarHBondContact O-CB 3.32Å; K202-E206 VanDerWaalsContact O-CG 3.31Å; K202-E206 WeakPolarHBondContact O-CG 3.44Å; K202-E206 PolarHBondContact O-N 3Å
203	R	95.4	Very high	94.2	Very high	96 Å²	96	97.7 Å²	97.7	36%	0.362	44%	0.44	S	S	.	.	H	α-helix	trans	-56	-48.2	174.3	177.4	180	169.6	-133.8	4.5	111.2	K199 E200 Q205 E206 L207 E280	K199-R203 PolarHBondContact O-N 2.99Å; E200-R203 PolarHBondContact O-N 3.21Å; E200-R203 WeakPolarHBondContact OE1-CD 3.41Å; E200-R203 IonicContact OE1-CZ 3.42Å; E200-R203 IonicContact OE1-NE 3.27Å; E200-R203 IonicContact OE1-NH1 3.97Å; E200-R203 PolarHBondContact OE1-NH1 3.22Å; R203-Q205 VanDerWaalsContact C-N 3.28Å; R203-Q205 PolarHBondContact O-N 3.17Å; R203-E206 WeakPolarHBondContact O-CB 3.46Å; R203-E206 PolarHBondContact O-N 3.27Å; R203-E206 VanDerWaalsContact O-N 3.16Å; R203-L207 HydrophobicContact CG-CD1 4.19Å; R203-L207 HydrophobicContact CG-CG 4.35Å; R203-L207 WeakPolarHBondContact O-CG 3.49Å; R203-L207 PolarHBondContact O-N 2.99Å; R203-E280 IonicContact CZ-OE1 2.82Å; R203-E280 IonicContact NE-OE1 3.71Å; R203-E280 PolarHBondContact NE-OE1 2.82Å; R203-E280 IonicContact NH2-OE1 2.83Å; R203-E280 PolarHBondContact NH2-OE1 2.72Å; R203-E280 IonicContact NH2-OE2 3.91Å; R203-E280 PolarHBondContact NH2-OE2 3.47Å
204	L	93.2	Very high	94	Very high	45 Å²	45	95.6 Å²	95.6	24%	0.236	43%	0.427	C	S	.	.	H	α-helix	trans	-65.2	-32	179.7	-66.2	171.2	0	0	0	112.2	R185 E200 K202 K208	R185-L204 HydrophobicContact CG-CD1 4.16Å; E200-L204 HydrophobicContact CG-CD1 4.23Å; E200-L204 HydrophobicContact CG-CG 4.4Å; E200-L204 WeakPolarHBondContact O-CB 3.22Å; E200-L204 VanDerWaalsContact O-CG 3.28Å; E200-L204 WeakPolarHBondContact O-CG 3.15Å; E200-L204 PolarHBondContact O-N 3.1Å; K202-L204 VanDerWaalsContact C-N 3.34Å; K202-L204 PolarHBondContact O-N 3.33Å; L204-K208 WeakPolarHBondContact O-CG 3.28Å; L204-K208 PolarHBondContact O-N 2.87Å; L204-K208 VanDerWaalsContact O-N 3.12Å
205	Q	93.9	Very high	93.9	Very high	143 Å²	143	94.4 Å²	94.4	67%	0.668	43%	0.429	S	S	*	.	H	α-helix	trans	-71.1	-41.1	171	-174.6	175.1	-1.6	0	0	112.2	E201 K202 R203 L207 K208 E209	E201-Q205 WeakPolarHBondContact O-CB 3.28Å; E201-Q205 PolarHBondContact O-N 2.94Å; K202-Q205 PolarHBondContact O-N 2.88Å; K202-Q205 VanDerWaalsContact O-N 3.15Å; R203-Q205 VanDerWaalsContact C-N 3.28Å; R203-Q205 PolarHBondContact O-N 3.17Å; Q205-L207 VanDerWaalsContact C-N 3.35Å; Q205-K208 PolarHBondContact O-N 3.37Å; Q205-E209 VanDerWaalsContact O-CB 3.32Å; Q205-E209 WeakPolarHBondContact O-CB 3.47Å; Q205-E209 PolarHBondContact O-N 2.84Å
206	E	95.8	Very high	93.7	Very high	134 Å²	134	92.9 Å²	92.9	63%	0.626	42%	0.42	S	S	*	.	H	α-helix	trans	-63.1	-38.8	175.6	-73.2	165.6	-169.8	0	0	111.6	K202 R203 E209 K210	K202-E206 WeakPolarHBondContact O-CB 3.32Å; K202-E206 VanDerWaalsContact O-CG 3.31Å; K202-E206 WeakPolarHBondContact O-CG 3.44Å; K202-E206 PolarHBondContact O-N 3Å; R203-E206 WeakPolarHBondContact O-CB 3.46Å; R203-E206 PolarHBondContact O-N 3.27Å; R203-E206 VanDerWaalsContact O-N 3.16Å; E206-E209 PolarHBondContact O-N 2.98Å; E206-K210 WeakPolarHBondContact O-CB 3.48Å; E206-K210 PolarHBondContact O-N 3.08Å
207	L	94.3	Very high	93.6	Very high	28 Å²	28	87.8 Å²	87.8	15%	0.147	40%	0.398	C	S	.	.	H	α-helix	trans	-66.5	-47.5	173.9	-69.2	179.7	0	0	0	112	R203 Q205 E209 K210 H211 E280 E281	R203-L207 HydrophobicContact CG-CD1 4.19Å; R203-L207 HydrophobicContact CG-CG 4.35Å; R203-L207 WeakPolarHBondContact O-CG 3.49Å; R203-L207 PolarHBondContact O-N 2.99Å; Q205-L207 VanDerWaalsContact C-N 3.35Å; L207-E209 VanDerWaalsContact C-N 3.26Å; L207-E209 PolarHBondContact O-N 3.06Å; L207-K210 WeakPolarHBondContact O-CB 3.4Å; L207-K210 PolarHBondContact O-N 3.29Å; L207-K210 VanDerWaalsContact O-N 3.1Å; L207-H211 PolarHBondContact O-N 3.38Å; L207-E280 HydrophobicContact CD1-CG 4.19Å; L207-E280 HydrophobicContact CD2-CG 3.82Å; L207-E281 HydrophobicContact CB-CB 3.79Å; L207-E281 HydrophobicContact CD2-CB 4.08Å; L207-E281 HydrophobicContact CG-CB 4.4Å
208	K	91.8	Very high	93.4	Very high	129 Å²	129	86.7 Å²	86.7	56%	0.561	40%	0.397	S	S	*	.	H	α-helix	trans	-63.6	-30.7	175.7	-72.1	-166.8	177.8	-147.3	0	113.1	L204 Q205 R212	L204-K208 WeakPolarHBondContact O-CG 3.28Å; L204-K208 PolarHBondContact O-N 2.87Å; L204-K208 VanDerWaalsContact O-N 3.12Å; Q205-K208 PolarHBondContact O-N 3.37Å; K208-R212 WeakPolarHBondContact O-CD 3.35Å; K208-R212 VanDerWaalsContact O-CG 3.3Å; K208-R212 WeakPolarHBondContact O-CG 3.5Å; K208-R212 PolarHBondContact O-N 3.48Å
209	E	93.2	Very high	93.3	Very high	97 Å²	97	83.1 Å²	83.1	45%	0.453	38%	0.381	S	S	.	.	H	α-helix	trans	-77.2	-29.8	173.5	-174.7	58.7	-146.6	0	0	112.4	Q205 E206 L207 Q213	Q205-E209 VanDerWaalsContact O-CB 3.32Å; Q205-E209 WeakPolarHBondContact O-CB 3.47Å; Q205-E209 PolarHBondContact O-N 2.84Å; E206-E209 PolarHBondContact O-N 2.98Å; L207-E209 VanDerWaalsContact C-N 3.26Å; L207-E209 PolarHBondContact O-N 3.06Å; E209-Q213 VanDerWaalsContact O-CG 3.32Å; E209-Q213 WeakPolarHBondContact O-CG 3.03Å; E209-Q213 PolarHBondContact O-NE2 3Å; E209-Q213 PolarHBondContact OE1-NE2 3.18Å
210	K	94.1	Very high	93.1	Very high	99 Å²	99	76 Å²	76	43%	0.43	35%	0.35	S	S	.	.	H	α-helix	trans	-67.6	-49	172.3	-176.8	-177.3	170.7	-135	0	111.2	E206 L207 R212 Q213 N279 E281	E206-K210 WeakPolarHBondContact O-CB 3.48Å; E206-K210 PolarHBondContact O-N 3.08Å; L207-K210 WeakPolarHBondContact O-CB 3.4Å; L207-K210 PolarHBondContact O-N 3.29Å; L207-K210 VanDerWaalsContact O-N 3.1Å; K210-R212 VanDerWaalsContact C-N 3.27Å; K210-R212 PolarHBondContact O-N 2.91Å; K210-Q213 PolarHBondContact O-N 3.41Å; K210-N279 PolarHBondContact NZ-OD1 3.25Å; K210-E281 HydrophobicContact CB-CG 4.31Å; K210-E281 HydrophobicContact CD-CG 4.28Å; K210-E281 WeakPolarHBondContact CD-OE1 3.48Å; K210-E281 WeakPolarHBondContact CE-OE1 3.27Å; K210-E281 HydrophobicContact CG-CG 4.31Å; K210-E281 WeakPolarHBondContact CG-OE1 3.37Å; K210-E281 IonicContact NZ-OE1 2.66Å; K210-E281 PolarHBondContact NZ-OE1 2.83Å; K210-E281 IonicContact NZ-OE2 2.61Å; K210-E281 PolarHBondContact NZ-OE2 2.94Å
211	H	92.8	Very high	92.9	Very high	13 Å²	13	74.8 Å²	74.8	6%	0.06	35%	0.347	C	S	.	.	H	α-helix	trans	-55.6	-42.3	177.4	-176.7	64.7	0	0	0	112	L207 Q213 H214 V274 Y275 E281 D282	L207-H211 PolarHBondContact O-N 3.38Å; H211-Q213 PolarHBondContact O-N 2.97Å; H211-Q213 VanDerWaalsContact O-N 3.09Å; H211-H214 PolarHBondContact O-CD2 2.83Å; H211-V274 PolarHBondContact CE1-O 3.27Å; H211-V274 VanDerWaalsContact CE1-O 3.26Å; H211-V274 PolarHBondContact ND1-O 3.29Å; H211-Y275 AromaticContact CE1-CD1 3.63Å; H211-Y275 AromaticContact CE1-CE1 3.33Å; H211-Y275 WeakPolarHBondContact CE1-CE1 3.5Å; H211-Y275 AromaticContact CE1-CZ 3.92Å; H211-Y275 AromaticContact NE2-CE1 3.69Å; H211-Y275 AromaticContact NE2-CZ 3.98Å; H211-E281 HydrophobicContact CB-CB 4.34Å; H211-E281 HydrophobicContact CB-CG 3.84Å; H211-D282 IonicContact CE1-OD1 2.65Å; H211-D282 IonicContact CG-OD1 3.4Å; H211-D282 IonicContact ND1-OD1 2.66Å; H211-D282 PolarHBondContact ND1-OD1 3.48Å
212	R	91.4	Very high	92.7	Very high	124 Å²	124	71.2 Å²	71.2	47%	0.468	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-13.4	175.1	-82.2	175	166	165.6	2.9	116.1	K208 K210 H214 D334	K208-R212 WeakPolarHBondContact O-CD 3.35Å; K208-R212 VanDerWaalsContact O-CG 3.3Å; K208-R212 WeakPolarHBondContact O-CG 3.5Å; K208-R212 PolarHBondContact O-N 3.48Å; K210-R212 VanDerWaalsContact C-N 3.27Å; K210-R212 PolarHBondContact O-N 2.91Å; R212-H214 VanDerWaalsContact C-N 3.29Å; R212-H214 PolarHBondContact O-N 3.2Å; R212-D334 VanDerWaalsContact CG-OD2 3.31Å; R212-D334 WeakPolarHBondContact CG-OD2 3.33Å; R212-D334 IonicContact CZ-OD2 3.67Å; R212-D334 IonicContact NE-OD2 2.72Å; R212-D334 PolarHBondContact NE-OD2 2.86Å; R212-D334 PolarHBondContact NH2-O 3.34Å; R212-D334 IonicContact NH2-OD2 3.2Å; R212-D334 PolarHBondContact NH2-OD2 3.01Å
213	Q	91.6	Very high	92.4	Very high	140 Å²	140	67.2 Å²	67.2	65%	0.654	32%	0.315	S	S	*	.			trans	-98	44.8	-175.8	-69.5	174.6	24.1	0	0	111.8	E209 K210 H211	E209-Q213 VanDerWaalsContact O-CG 3.32Å; E209-Q213 WeakPolarHBondContact O-CG 3.03Å; E209-Q213 PolarHBondContact O-NE2 3Å; E209-Q213 PolarHBondContact OE1-NE2 3.18Å; K210-Q213 PolarHBondContact O-N 3.41Å; H211-Q213 PolarHBondContact O-N 2.97Å; H211-Q213 VanDerWaalsContact O-N 3.09Å
214	H	91.4	Very high	92.2	Very high	53 Å²	53	64.8 Å²	64.8	25%	0.245	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-84.3	158.4	176.1	62.1	83	0	0	0	113.1	H211 R212 K273 V274	H211-H214 PolarHBondContact O-CD2 2.83Å; R212-H214 VanDerWaalsContact C-N 3.29Å; R212-H214 PolarHBondContact O-N 3.2Å; H214-K273 WeakPolarHBondContact CB-O 3.43Å; H214-V274 HydrophobicContact CB-CB 4.42Å; H214-V274 HydrophobicContact CB-CG1 4.49Å; H214-V274 HydrophobicContact CB-CG2 4.2Å
215	P	92.3	Very high	92.2	Very high	82 Å²	82	62.7 Å²	62.7	53%	0.532	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-59.8	162.4	165.9	-21.2	34.3	0	0	0	112.6	V217 K273	P215-V217 PolarHBondContact O-N 2.87Å; P215-K273 HydrophobicContact CB-CB 4.33Å; P215-K273 HydrophobicContact CB-CG 4.49Å; P215-K273 WeakPolarHBondContact CD-O 3.34Å; P215-K273 HydrophobicContact CG-CB 4.35Å
216	K	90.1	Very high	92.1	Very high	137 Å²	137	55.9 Å²	55.9	60%	0.596	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-66.1	131	179.7	-69.3	-174.7	177.5	-112.5	0	111.7	E329	K216-E329 IonicContact NZ-OE1 3.34Å; K216-E329 PolarHBondContact NZ-OE1 3.49Å; K216-E329 IonicContact NZ-OE2 3.7Å; K216-E329 PolarHBondContact NZ-OE2 3.18Å
217	V	92.7	Very high	92	Very high	6 Å²	6	55.2 Å²	55.2	4%	0.036	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-92.7	123.8	175.4	-173.2	0	0	0	0	108.4	P215 E270 V274 M294 W330	P215-V217 PolarHBondContact O-N 2.87Å; V217-E270 WeakPolarHBondContact CA-OE2 3.25Å; V217-E270 HydrophobicContact CG1-CB 4.09Å; V217-V274 HydrophobicContact CG2-CG2 3.35Å; V217-M294 HydrophobicContact CG1-CE 3.64Å; V217-W330 HydrophobicContact CB-CB 4.14Å; V217-W330 HydrophobicContact CG1-CB 3.87Å; V217-W330 HydrophobicContact CG1-CG 4.24Å; V217-W330 PolarHBondContact O-N 3.01Å
218	N	92.1	Very high	91.9	Very high	40 Å²	40	55.9 Å²	55.9	21%	0.214	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-73.7	155	174.7	-59.2	-63.5	0	0	0	109.7	A224 Q225 E228 E270 K273	N218-A224 HydrophobicContact CB-CB 4.24Å; N218-A224 WeakPolarHBondContact OD1-CB 3.47Å; N218-Q225 HydrophobicContact CB-CB 3.89Å; N218-E228 PolarHBondContact ND2-OE2 2.94Å; N218-E270 VanDerWaalsContact CB-OE1 3.32Å; N218-E270 WeakPolarHBondContact CB-OE1 3.44Å; N218-E270 PolarHBondContact N-OE2 3.47Å; N218-E270 PolarHBondContact ND2-OE1 3.11Å; N218-K273 PolarHBondContact ND2-NZ 3.38Å
219	A	92	Very high	92.1	Very high	8 Å²	8	49.9 Å²	49.9	7%	0.066	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-65.8	140.5	172.5	0	0	0	0	0	110.6	S222 P327	A219-S222 WeakPolarHBondContact O-CB 3.42Å; A219-S222 PolarHBondContact O-N 3.39Å; A219-S222 VanDerWaalsContact O-N 3.12Å; A219-S222 PolarHBondContact O-OG 3.03Å; A219-P327 HydrophobicContact CB-CB 3.71Å; A219-P327 HydrophobicContact CB-CG 3.78Å
220	P	92.2	Very high	92.2	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.019	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	139.8	-178.5	31.1	-38.3	0	0	0	110.9	S222 F267 M294 H297 V298 W330	P220-S222 PolarHBondContact O-N 2.92Å; P220-F267 HydrophobicContact CB-CD1 3.84Å; P220-F267 HydrophobicContact CB-CE1 3.49Å; P220-F267 VanDerWaalsContact CB-CE1 3.49Å; P220-F267 HydrophobicContact CB-CZ 4.13Å; P220-M294 HydrophobicContact CB-CB 3.73Å; P220-M294 HydrophobicContact CB-CG 3.91Å; P220-M294 HydrophobicContact CB-SD 4.25Å; P220-M294 HydrophobicContact CG-CB 3.9Å; P220-M294 HydrophobicContact CG-CG 3.88Å; P220-H297 HydrophobicContact CG-CB 4.07Å; P220-V298 HydrophobicContact CB-CG2 3.83Å; P220-V298 HydrophobicContact CG-CG2 4.33Å; P220-W330 HydrophobicContact CG-CE3 4.03Å; P220-W330 HydrophobicContact CG-CH2 4.15Å; P220-W330 HydrophobicContact CG-CZ3 3.78Å
221	G	89.9	Confident	92.2	Very high	9 Å²	9	46.4 Å²	46.4	9%	0.093	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	-2.2	-171.6	0	0	0	0	0	114.9	Q225 L226 F324	G221-Q225 VanDerWaalsContact CA-OE1 3.31Å; G221-L226 WeakPolarHBondContact O-CD1 3.5Å; G221-F324 WeakPolarHBondContact O-CD1 3.14Å
222	S	91.1	Very high	92.3	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.014	25%	0.252	C	S	.	.			trans	-72.1	154.7	-176.3	70.5	0	0	0	0	113.6	A219 P220 A224 Q225 L226	A219-S222 WeakPolarHBondContact O-CB 3.42Å; A219-S222 PolarHBondContact O-N 3.39Å; A219-S222 VanDerWaalsContact O-N 3.12Å; A219-S222 PolarHBondContact O-OG 3.03Å; P220-S222 PolarHBondContact O-N 2.92Å; S222-A224 PolarHBondContact O-N 3.37Å; S222-Q225 PolarHBondContact O-N 3.05Å; S222-Q225 VanDerWaalsContact O-N 3.13Å; S222-Q225 WeakPolarHBondContact OG-CB 3.44Å; S222-Q225 PolarHBondContact OG-N 2.78Å; S222-L226 VanDerWaalsContact O-CG 3.29Å; S222-L226 WeakPolarHBondContact O-CG 3.33Å; S222-L226 PolarHBondContact O-N 2.87Å
223	V	89.4	Confident	92.4	Very high	23 Å²	23	49.7 Å²	49.7	14%	0.139	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-16.7	176.9	-178	0	0	0	0	112.4	R227 F324	V223-R227 WeakPolarHBondContact O-CB 3.4Å; V223-R227 VanDerWaalsContact O-CD 3.28Å; V223-R227 WeakPolarHBondContact O-CD 3.37Å; V223-R227 WeakPolarHBondContact O-CG 3.19Å; V223-F324 PolarHBondContact N-O 3.32Å
224	A	90.4	Very high	92.5	Very high	46 Å²	46	44.9 Å²	44.9	38%	0.38	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-56.4	169.7	0	0	0	0	0	111.2	N218 S222 L226 R227 E228	N218-A224 HydrophobicContact CB-CB 4.24Å; N218-A224 WeakPolarHBondContact OD1-CB 3.47Å; S222-A224 PolarHBondContact O-N 3.37Å; A224-L226 PolarHBondContact O-N 2.74Å; A224-R227 WeakPolarHBondContact O-CB 3.37Å; A224-R227 PolarHBondContact O-N 3.09Å; A224-R227 VanDerWaalsContact O-N 3.08Å; A224-E228 PolarHBondContact O-N 3.2Å
225	Q	93.1	Very high	92.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-55.9	-48.4	179	-179.3	-106.1	-26.5	0	0	112.2	N218 G221 S222 R227 E228 V229 L266 E270	N218-Q225 HydrophobicContact CB-CB 3.89Å; G221-Q225 VanDerWaalsContact CA-OE1 3.31Å; S222-Q225 PolarHBondContact O-N 3.05Å; S222-Q225 VanDerWaalsContact O-N 3.13Å; S222-Q225 WeakPolarHBondContact OG-CB 3.44Å; S222-Q225 PolarHBondContact OG-N 2.78Å; Q225-R227 PolarHBondContact O-N 2.9Å; Q225-E228 PolarHBondContact O-N 3.21Å; Q225-E228 VanDerWaalsContact O-N 3.12Å; Q225-V229 WeakPolarHBondContact O-CG2 3.38Å; Q225-V229 PolarHBondContact O-N 2.89Å; Q225-L266 PolarHBondContact NE2-O 2.76Å; Q225-E270 HydrophobicContact CB-CG 4.47Å; Q225-E270 HydrophobicContact CG-CG 3.6Å; Q225-E270 WeakPolarHBondContact CG-OE1 3.32Å
226	L	92.9	Very high	92.7	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-63.2	-28.7	179	-60.2	172.1	0	0	0	112.8	G221 S222 A224 W230 F241 F246 L266 F315 T319	G221-L226 WeakPolarHBondContact O-CD1 3.5Å; S222-L226 VanDerWaalsContact O-CG 3.29Å; S222-L226 WeakPolarHBondContact O-CG 3.33Å; S222-L226 PolarHBondContact O-N 2.87Å; A224-L226 PolarHBondContact O-N 2.74Å; L226-W230 WeakPolarHBondContact O-CB 3.36Å; L226-W230 PolarHBondContact O-N 3.11Å; L226-F241 HydrophobicContact CB-CE2 3.94Å; L226-F241 HydrophobicContact CB-CZ 3.83Å; L226-F241 WeakPolarHBondContact O-CE2 3.49Å; L226-F246 HydrophobicContact CB-CE2 4.36Å; L226-F246 HydrophobicContact CB-CZ 4.32Å; L226-F246 HydrophobicContact CD2-CD1 4.23Å; L226-F246 HydrophobicContact CD2-CE1 3.51Å; L226-F246 HydrophobicContact CD2-CE2 4.5Å; L226-F246 HydrophobicContact CD2-CZ 3.66Å; L226-F246 WeakPolarHBondContact O-CD2 3.33Å; L226-F246 WeakPolarHBondContact O-CE2 3.25Å; L226-L266 HydrophobicContact CD2-CD1 4.24Å; L226-F315 HydrophobicContact CD1-CE2 4.25Å; L226-F315 HydrophobicContact CD1-CZ 3.87Å; L226-F315 HydrophobicContact CD2-CE2 4.31Å; L226-F315 HydrophobicContact CD2-CZ 4.25Å; L226-T319 HydrophobicContact CD1-CG2 4.05Å
227	R	92.3	Very high	92.8	Very high	119 Å²	119	41.4 Å²	41.4	45%	0.449	23%	0.231	S	C	.	.	H	α-helix	trans	-79.1	-32	174.6	-80.3	177.7	179.1	175.8	-0.2	113.1	V223 A224 Q225 W230 E231 F241	V223-R227 WeakPolarHBondContact O-CB 3.4Å; V223-R227 VanDerWaalsContact O-CD 3.28Å; V223-R227 WeakPolarHBondContact O-CD 3.37Å; V223-R227 WeakPolarHBondContact O-CG 3.19Å; A224-R227 WeakPolarHBondContact O-CB 3.37Å; A224-R227 PolarHBondContact O-N 3.09Å; A224-R227 VanDerWaalsContact O-N 3.08Å; Q225-R227 PolarHBondContact O-N 2.9Å; R227-W230 PolarHBondContact O-N 2.9Å; R227-E231 PolarHBondContact O-N 3.36Å; R227-F241 HydrophobicContact CB-CD2 4.46Å; R227-F241 HydrophobicContact CG-CB 4.02Å; R227-F241 HydrophobicContact CG-CD1 3.94Å; R227-F241 HydrophobicContact CG-CD2 3.6Å; R227-F241 HydrophobicContact CG-CE1 4.33Å; R227-F241 HydrophobicContact CG-CE2 4.03Å; R227-F241 HydrophobicContact CG-CG 3.55Å; R227-F241 HydrophobicContact CG-CZ 4.37Å
228	E	93.2	Very high	92.6	Very high	42 Å²	42	43 Å²	43	20%	0.196	24%	0.241	C	C	.	.	H	α-helix	trans	-68.8	-43.2	176.9	-155.6	-176.9	99.2	0	0	110.4	N218 A224 Q225 W230 E231 E232 K273	N218-E228 PolarHBondContact ND2-OE2 2.94Å; A224-E228 PolarHBondContact O-N 3.2Å; Q225-E228 PolarHBondContact O-N 3.21Å; Q225-E228 VanDerWaalsContact O-N 3.12Å; E228-W230 VanDerWaalsContact C-N 3.32Å; E228-W230 PolarHBondContact O-N 2.76Å; E228-E231 PolarHBondContact O-N 3.28Å; E228-E232 WeakPolarHBondContact O-CB 3.37Å; E228-E232 PolarHBondContact O-N 3.13Å; E228-K273 WeakPolarHBondContact OE1-CE 3.05Å; E228-K273 IonicContact OE1-NZ 3.8Å; E228-K273 PolarHBondContact OE1-NZ 3.36Å; E228-K273 IonicContact OE2-NZ 2.75Å; E228-K273 PolarHBondContact OE2-NZ 3.31Å
229	V	95.1	Very high	92.5	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.018	27%	0.267	C	S	.	.	H	α-helix	trans	-58.7	-43.5	170.2	176.4	0	0	0	0	111.1	Q225 E231 T233 D234 F246 H250 L266	Q225-V229 WeakPolarHBondContact O-CG2 3.38Å; Q225-V229 PolarHBondContact O-N 2.89Å; V229-E231 VanDerWaalsContact C-N 3.31Å; V229-E231 PolarHBondContact O-N 3.37Å; V229-T233 WeakPolarHBondContact O-CA 3.47Å; V229-T233 VanDerWaalsContact O-CB 3.23Å; V229-T233 WeakPolarHBondContact O-CB 3.35Å; V229-T233 PolarHBondContact O-N 3.1Å; V229-D234 PolarHBondContact O-N 3.24Å; V229-F246 HydrophobicContact CB-CE2 3.95Å; V229-F246 HydrophobicContact CB-CZ 4.17Å; V229-F246 HydrophobicContact CG1-CE2 3.83Å; V229-F246 HydrophobicContact CG1-CZ 3.94Å; V229-H250 WeakPolarHBondContact CG1-NE2 3.3Å; V229-L266 WeakPolarHBondContact CG2-O 3.35Å
230	W	95.5	Very high	92.5	Very high	11 Å²	11	56 Å²	56	4%	0.042	30%	0.297	C	S	.	.	H	α-helix	trans	-64.2	-29	176.5	179.6	-88	0	0	0	114.3	L226 R227 E228 D234 G235 L236 D237 F241 T245 F246	L226-W230 WeakPolarHBondContact O-CB 3.36Å; L226-W230 PolarHBondContact O-N 3.11Å; R227-W230 PolarHBondContact O-N 2.9Å; E228-W230 VanDerWaalsContact C-N 3.32Å; E228-W230 PolarHBondContact O-N 2.76Å; W230-D234 WeakPolarHBondContact CA-OD2 3.29Å; W230-G235 PolarHBondContact O-N 3.16Å; W230-L236 HydrophobicContact CD2-CB 3.96Å; W230-L236 HydrophobicContact CD2-CD1 3.86Å; W230-L236 HydrophobicContact CE3-CD1 3.71Å; W230-L236 HydrophobicContact CG-CB 4.18Å; W230-L236 HydrophobicContact CH2-CD1 3.6Å; W230-L236 HydrophobicContact CZ2-CB 3.99Å; W230-L236 HydrophobicContact CZ2-CD1 3.71Å; W230-L236 HydrophobicContact CZ2-CG 4.48Å; W230-L236 HydrophobicContact CZ3-CD1 3.59Å; W230-L236 PolarHBondContact O-N 3.27Å; W230-D237 PolarHBondContact NE1-O 3.02Å; W230-F241 HydrophobicContact CB-CD2 3.89Å; W230-F241 HydrophobicContact CB-CE2 4.37Å; W230-F241 HydrophobicContact CD2-CD2 4.03Å; W230-F241 AromaticContact CG-CD2 3.79Å; W230-F241 HydrophobicContact CG-CD2 3.79Å; W230-T245 HydrophobicContact CH2-CG2 3.75Å; W230-T245 HydrophobicContact CZ3-CG2 4Å; W230-F246 HydrophobicContact CB-CD2 4.21Å; W230-F246 HydrophobicContact CB-CE2 4.44Å; W230-F246 HydrophobicContact CE3-CB 4.17Å; W230-F246 AromaticContact CE3-CD2 3.98Å; W230-F246 HydrophobicContact CE3-CD2 3.98Å; W230-F246 HydrophobicContact CZ3-CB 4.28Å
231	E	95.4	Very high	92.6	Very high	113 Å²	113	57.4 Å²	57.4	53%	0.528	30%	0.303	S	S	.	.	H	α-helix	trans	-85.6	-47.2	176.2	-168.5	164	-164.7	0	0	112.3	R227 E228 V229 G235 P238	R227-E231 PolarHBondContact O-N 3.36Å; E228-E231 PolarHBondContact O-N 3.28Å; V229-E231 VanDerWaalsContact C-N 3.31Å; V229-E231 PolarHBondContact O-N 3.37Å; E231-G235 WeakPolarHBondContact O-CA 3.29Å; E231-G235 PolarHBondContact O-N 3.45Å; E231-P238 HydrophobicContact CB-CG 3.98Å; E231-P238 HydrophobicContact CG-CG 3.76Å; E231-P238 WeakPolarHBondContact OE2-CG 3.42Å
232	E	93.9	Very high	92.7	Very high	126 Å²	126	60.4 Å²	60.4	59%	0.589	32%	0.317	S	S	*	.	H	α-helix	trans	-95.2	-30.6	-169	-61.4	-159.7	176.3	0	0	114.7	E228 K269	E228-E232 WeakPolarHBondContact O-CB 3.37Å; E228-E232 PolarHBondContact O-N 3.13Å; E232-K269 HydrophobicContact CB-CD 4.33Å
233	T	93.1	Very high	92.8	Very high	79 Å²	79	61.7 Å²	61.7	49%	0.485	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-51.5	176.7	-55.9	0	0	0	0	110.8	V229 K269	V229-T233 WeakPolarHBondContact O-CA 3.47Å; V229-T233 VanDerWaalsContact O-CB 3.23Å; V229-T233 WeakPolarHBondContact O-CB 3.35Å; V229-T233 PolarHBondContact O-N 3.1Å; T233-K269 WeakPolarHBondContact OG1-CG 3.28Å
234	D	93.5	Very high	93.1	Very high	40 Å²	40	65.8 Å²	65.8	21%	0.214	34%	0.341	C	S	.	.	S	Bend	trans	-80.7	-24.6	-176.4	-56.3	-27.9	0	0	0	113	V229 W230 L236 L249 H250	V229-D234 PolarHBondContact O-N 3.24Å; W230-D234 WeakPolarHBondContact CA-OD2 3.29Å; D234-L236 HydrophobicContact CB-CD1 3.8Å; D234-L236 HydrophobicContact CB-CG 3.85Å; D234-L249 HydrophobicContact CB-CD2 3.87Å; D234-L249 WeakPolarHBondContact OD2-CD2 3.41Å; D234-H250 IonicContact OD1-CE1 3.19Å; D234-H250 IonicContact OD1-NE2 3.67Å; D234-H250 IonicContact OD2-CE1 3.94Å; D234-H250 PolarHBondContact OD2-CE1 3.36Å
235	G	94.1	Very high	93.3	Very high	63 Å²	63	67.1 Å²	67.1	65%	0.649	34%	0.344	S	S	*	.			trans	72.9	27.4	-178.8	0	0	0	0	0	114.8	W230 E231	W230-G235 PolarHBondContact O-N 3.16Å; E231-G235 WeakPolarHBondContact O-CA 3.29Å; E231-G235 PolarHBondContact O-N 3.45Å
236	L	95.3	Very high	93.5	Very high	69 Å²	69	67.1 Å²	67.1	36%	0.361	34%	0.344	S	S	.	.			trans	-104.2	155.7	-173.1	-59.1	175.5	0	0	0	111.9	W230 D234 P238 L249	W230-L236 HydrophobicContact CD2-CB 3.96Å; W230-L236 HydrophobicContact CD2-CD1 3.86Å; W230-L236 HydrophobicContact CE3-CD1 3.71Å; W230-L236 HydrophobicContact CG-CB 4.18Å; W230-L236 HydrophobicContact CH2-CD1 3.6Å; W230-L236 HydrophobicContact CZ2-CB 3.99Å; W230-L236 HydrophobicContact CZ2-CD1 3.71Å; W230-L236 HydrophobicContact CZ2-CG 4.48Å; W230-L236 HydrophobicContact CZ3-CD1 3.59Å; W230-L236 PolarHBondContact O-N 3.27Å; D234-L236 HydrophobicContact CB-CD1 3.8Å; D234-L236 HydrophobicContact CB-CG 3.85Å; L236-P238 WeakPolarHBondContact O-CD 3.36Å; L236-L249 HydrophobicContact CD1-CD2 4Å
237	D	92.6	Very high	93.6	Very high	66 Å²	66	67.1 Å²	67.1	35%	0.353	34%	0.344	S	S	.	.			trans	-66.7	124.4	-178.3	-170.6	-36.5	0	0	0	110.4	W230 K239 E240	W230-D237 PolarHBondContact NE1-O 3.02Å; D237-K239 PolarHBondContact O-N 3.01Å; D237-K239 VanDerWaalsContact OD1-CB 3.25Å; D237-K239 WeakPolarHBondContact OD1-CB 3.47Å; D237-K239 VanDerWaalsContact OD1-CG 3.26Å; D237-K239 WeakPolarHBondContact OD1-CG 3.44Å; D237-K239 PolarHBondContact OD1-N 3.09Å; D237-K239 IonicContact OD1-NZ 2.84Å; D237-K239 PolarHBondContact OD1-NZ 3Å; D237-K239 IonicContact OD2-NZ 3.85Å; D237-K239 PolarHBondContact OD2-NZ 2.95Å; D237-E240 HydrophobicContact CB-CG 4.35Å; D237-E240 PolarHBondContact O-N 3.48Å
238	P	87.9	Confident	93.8	Very high	39 Å²	39	67 Å²	67	25%	0.253	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-56.2	-23.1	177.7	-26.6	33.4	0	0	0	114.9	E231 L236 E240 F241	E231-P238 HydrophobicContact CB-CG 3.98Å; E231-P238 HydrophobicContact CG-CG 3.76Å; E231-P238 WeakPolarHBondContact OE2-CG 3.42Å; L236-P238 WeakPolarHBondContact O-CD 3.36Å; P238-E240 VanDerWaalsContact C-N 3.33Å; P238-F241 WeakPolarHBondContact O-CB 3.48Å
239	K	88.8	Confident	93.9	Very high	173 Å²	173	68.9 Å²	68.9	75%	0.752	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-76	-22.6	177.7	-58.6	173.9	-140.6	74.5	0	112.6	D237	D237-K239 PolarHBondContact O-N 3.01Å; D237-K239 VanDerWaalsContact OD1-CB 3.25Å; D237-K239 WeakPolarHBondContact OD1-CB 3.47Å; D237-K239 VanDerWaalsContact OD1-CG 3.26Å; D237-K239 WeakPolarHBondContact OD1-CG 3.44Å; D237-K239 PolarHBondContact OD1-N 3.09Å; D237-K239 IonicContact OD1-NZ 2.84Å; D237-K239 PolarHBondContact OD1-NZ 3Å; D237-K239 IonicContact OD2-NZ 3.85Å; D237-K239 PolarHBondContact OD2-NZ 2.95Å
240	E	93.3	Very high	93.9	Very high	150 Å²	150	69.7 Å²	69.7	70%	0.701	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-97.2	3.6	178.7	-58.5	-161.9	160.2	0	0	112.5	D237 P238 N242	D237-E240 HydrophobicContact CB-CG 4.35Å; D237-E240 PolarHBondContact O-N 3.48Å; P238-E240 VanDerWaalsContact C-N 3.33Å; E240-N242 PolarHBondContact O-N 3.04Å; E240-N242 VanDerWaalsContact O-N 3.15Å
241	F	93.4	Very high	93.9	Very high	31 Å²	31	69.5 Å²	69.5	14%	0.136	36%	0.362	C	S	.	.			trans	-46.9	119.3	176.5	176.3	-93.6	0	0	0	112.1	L226 R227 W230 P238 P243 F246	L226-F241 HydrophobicContact CB-CE2 3.94Å; L226-F241 HydrophobicContact CB-CZ 3.83Å; L226-F241 WeakPolarHBondContact O-CE2 3.49Å; R227-F241 HydrophobicContact CB-CD2 4.46Å; R227-F241 HydrophobicContact CG-CB 4.02Å; R227-F241 HydrophobicContact CG-CD1 3.94Å; R227-F241 HydrophobicContact CG-CD2 3.6Å; R227-F241 HydrophobicContact CG-CE1 4.33Å; R227-F241 HydrophobicContact CG-CE2 4.03Å; R227-F241 HydrophobicContact CG-CG 3.55Å; R227-F241 HydrophobicContact CG-CZ 4.37Å; W230-F241 HydrophobicContact CB-CD2 3.89Å; W230-F241 HydrophobicContact CB-CE2 4.37Å; W230-F241 HydrophobicContact CD2-CD2 4.03Å; W230-F241 AromaticContact CG-CD2 3.79Å; W230-F241 HydrophobicContact CG-CD2 3.79Å; P238-F241 WeakPolarHBondContact O-CB 3.48Å; F241-P243 HydrophobicContact CE1-CB 4.39Å; F241-P243 HydrophobicContact CZ-CB 4.5Å; F241-F246 HydrophobicContact CE2-CB 4.22Å; F241-F246 AromaticContact CE2-CD2 3.86Å; F241-F246 HydrophobicContact CE2-CD2 3.86Å; F241-F246 HydrophobicContact CE2-CG 4.18Å
242	N	93.2	Very high	93.7	Very high	72 Å²	72	69.5 Å²	69.5	39%	0.385	37%	0.369	S	S	.	.			trans	-131	116.7	179.4	-173.2	-51.6	0	0	0	109.1	E240 K244 T245 F246	E240-N242 PolarHBondContact O-N 3.04Å; E240-N242 VanDerWaalsContact O-N 3.15Å; N242-K244 PolarHBondContact O-N 3.01Å; N242-K244 WeakPolarHBondContact OD1-CB 3.24Å; N242-K244 PolarHBondContact OD1-N 3.37Å; N242-T245 PolarHBondContact O-N 2.94Å; N242-T245 PolarHBondContact OD1-N 3.49Å; N242-F246 PolarHBondContact O-N 3.42Å
243	P	93.3	Very high	93.5	Very high	30 Å²	30	67 Å²	67	20%	0.195	36%	0.36	C	S	.	.	H	α-helix	trans	-63.4	-27.6	-174.4	25.9	-34.7	0	0	0	112.7	F241 F247 F315 L316 T319	F241-P243 HydrophobicContact CE1-CB 4.39Å; F241-P243 HydrophobicContact CZ-CB 4.5Å; P243-F247 WeakPolarHBondContact O-CB 3.22Å; P243-F247 PolarHBondContact O-N 3.45Å; P243-F315 HydrophobicContact CB-CD1 4.49Å; P243-F315 HydrophobicContact CB-CE1 3.84Å; P243-F315 WeakPolarHBondContact O-CE1 3.29Å; P243-L316 HydrophobicContact CB-CD2 3.97Å; P243-L316 HydrophobicContact CG-CD2 3.83Å; P243-T319 HydrophobicContact CB-CG2 4.15Å
244	K	95.1	Very high	93.5	Very high	109 Å²	109	71.7 Å²	71.7	47%	0.474	38%	0.376	S	S	.	.	H	α-helix	trans	-73.9	-29.2	174.6	-177.8	162.4	-179.9	159.2	0	112.6	N242 K248 L312 L316	N242-K244 PolarHBondContact O-N 3.01Å; N242-K244 WeakPolarHBondContact OD1-CB 3.24Å; N242-K244 PolarHBondContact OD1-N 3.37Å; K244-K248 WeakPolarHBondContact O-CG 3.03Å; K244-L312 HydrophobicContact CD-CD2 4.4Å; K244-L312 HydrophobicContact CG-CD1 4.27Å; K244-L312 HydrophobicContact CG-CD2 4.43Å; K244-L316 HydrophobicContact CB-CD2 4.15Å
245	T	95.1	Very high	93.2	Very high	73 Å²	73	73.8 Å²	73.8	45%	0.448	39%	0.388	S	S	.	.	H	α-helix	trans	-78.5	-41.4	172.5	-49.4	0	0	0	0	110.6	W230 N242 F247 K248 L249	W230-T245 HydrophobicContact CH2-CG2 3.75Å; W230-T245 HydrophobicContact CZ3-CG2 4Å; N242-T245 PolarHBondContact O-N 2.94Å; N242-T245 PolarHBondContact OD1-N 3.49Å; T245-F247 PolarHBondContact O-N 3Å; T245-K248 CarbonylContact O-C 3.57Å; T245-K248 PolarHBondContact O-N 3.03Å; T245-L249 PolarHBondContact O-N 3.15Å
246	F	95.9	Very high	93.2	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-54.9	-50.7	175.7	-177.7	-81.9	0	0	0	111.8	L226 V229 W230 F241 N242 K248 L249 H250 L266 F315	L226-F246 HydrophobicContact CB-CE2 4.36Å; L226-F246 HydrophobicContact CB-CZ 4.32Å; L226-F246 HydrophobicContact CD2-CD1 4.23Å; L226-F246 HydrophobicContact CD2-CE1 3.51Å; L226-F246 HydrophobicContact CD2-CE2 4.5Å; L226-F246 HydrophobicContact CD2-CZ 3.66Å; L226-F246 WeakPolarHBondContact O-CD2 3.33Å; L226-F246 WeakPolarHBondContact O-CE2 3.25Å; V229-F246 HydrophobicContact CB-CE2 3.95Å; V229-F246 HydrophobicContact CB-CZ 4.17Å; V229-F246 HydrophobicContact CG1-CE2 3.83Å; V229-F246 HydrophobicContact CG1-CZ 3.94Å; W230-F246 HydrophobicContact CB-CD2 4.21Å; W230-F246 HydrophobicContact CB-CE2 4.44Å; W230-F246 HydrophobicContact CE3-CB 4.17Å; W230-F246 AromaticContact CE3-CD2 3.98Å; W230-F246 HydrophobicContact CE3-CD2 3.98Å; W230-F246 HydrophobicContact CZ3-CB 4.28Å; F241-F246 HydrophobicContact CE2-CB 4.22Å; F241-F246 AromaticContact CE2-CD2 3.86Å; F241-F246 HydrophobicContact CE2-CD2 3.86Å; F241-F246 HydrophobicContact CE2-CG 4.18Å; N242-F246 PolarHBondContact O-N 3.42Å; F246-K248 VanDerWaalsContact C-N 3.33Å; F246-K248 PolarHBondContact O-N 2.87Å; F246-L249 PolarHBondContact O-N 3.49Å; F246-L249 VanDerWaalsContact O-N 3.11Å; F246-H250 AromaticContact CD1-ND1 3.89Å; F246-H250 AromaticContact CD2-CE1 3.91Å; F246-H250 AromaticContact CE1-CE1 3.95Å; F246-H250 AromaticContact CE1-ND1 3.63Å; F246-H250 AromaticContact CE2-CE1 3.45Å; F246-H250 VanDerWaalsContact CE2-CE1 3.45Å; F246-H250 WeakPolarHBondContact CE2-CE1 3.41Å; F246-H250 AromaticContact CE2-ND1 3.91Å; F246-H250 AromaticContact CZ-CE1 3.47Å; F246-H250 VanDerWaalsContact CZ-CE1 3.47Å; F246-H250 WeakPolarHBondContact CZ-CE1 3.49Å; F246-H250 AromaticContact CZ-ND1 3.66Å; F246-H250 AromaticContact CZ-NE2 3.98Å; F246-H250 PolarHBondContact O-N 3.15Å; F246-H250 PolarHBondContact O-ND1 3.13Å; F246-L266 HydrophobicContact CE1-CD1 4.08Å; F246-L266 HydrophobicContact CE1-CD2 4.2Å; F246-L266 HydrophobicContact CZ-CD1 4.39Å; F246-L266 HydrophobicContact CZ-CD2 4.05Å; F246-F315 HydrophobicContact CD1-CE1 4.41Å; F246-F315 AromaticContact CD1-CZ 3.74Å; F246-F315 HydrophobicContact CD1-CZ 3.74Å; F246-F315 HydrophobicContact CE1-CZ 4.24Å
247	F	96.4	Very high	93.1	Very high	1 Å²	1	70.5 Å²	70.5	0%	0.004	37%	0.365	C	S	.	.	H	α-helix	trans	-52	-52.9	176	-177	-78.8	0	0	0	110.7	P243 T245 L249 H250 D251 G256 L258 V310 L312 F315	P243-F247 WeakPolarHBondContact O-CB 3.22Å; P243-F247 PolarHBondContact O-N 3.45Å; T245-F247 PolarHBondContact O-N 3Å; F247-L249 PolarHBondContact O-N 3.32Å; F247-H250 PolarHBondContact O-N 3.03Å; F247-H250 VanDerWaalsContact O-N 3.09Å; F247-D251 HydrophobicContact CD1-CB 4.21Å; F247-D251 HydrophobicContact CE1-CB 4.17Å; F247-D251 WeakPolarHBondContact O-CB 3.42Å; F247-D251 PolarHBondContact O-N 2.88Å; F247-G256 WeakPolarHBondContact CZ-O 3.08Å; F247-L258 HydrophobicContact CD2-CD1 3.58Å; F247-L258 HydrophobicContact CD2-CG 3.94Å; F247-L258 HydrophobicContact CE2-CB 4.49Å; F247-L258 HydrophobicContact CE2-CD1 3.68Å; F247-L258 HydrophobicContact CE2-CG 3.62Å; F247-L258 HydrophobicContact CG-CD1 4.35Å; F247-L258 HydrophobicContact CZ-CD1 4.49Å; F247-L258 HydrophobicContact CZ-CG 3.96Å; F247-V310 WeakPolarHBondContact CE2-O 3.4Å; F247-L312 HydrophobicContact CB-CD1 3.86Å; F247-L312 HydrophobicContact CD1-CB 4.25Å; F247-L312 HydrophobicContact CD1-CD1 3.79Å; F247-L312 HydrophobicContact CD1-CG 4.5Å; F247-L312 HydrophobicContact CD2-CB 4.46Å; F247-L312 HydrophobicContact CD2-CD1 3.96Å; F247-L312 HydrophobicContact CE1-CB 3.91Å; F247-L312 HydrophobicContact CE1-CD1 4.34Å; F247-L312 HydrophobicContact CE2-CB 4.11Å; F247-L312 HydrophobicContact CE2-CD1 4.47Å; F247-L312 HydrophobicContact CG-CD1 3.59Å; F247-L312 HydrophobicContact CZ-CB 3.82Å; F247-F315 HydrophobicContact CB-CD1 4.12Å; F247-F315 HydrophobicContact CB-CE1 4.22Å; F247-F315 HydrophobicContact CD2-CB 3.68Å; F247-F315 AromaticContact CD2-CD1 3.87Å; F247-F315 HydrophobicContact CD2-CD1 3.87Å; F247-F315 HydrophobicContact CD2-CD2 4.22Å; F247-F315 AromaticContact CD2-CG 3.66Å; F247-F315 HydrophobicContact CD2-CG 3.66Å; F247-F315 HydrophobicContact CE2-CB 3.93Å; F247-F315 HydrophobicContact CE2-CG 4.35Å; F247-F315 HydrophobicContact CG-CD1 4.48Å
248	K	95.4	Very high	93.1	Very high	116 Å²	116	67.4 Å²	67.4	50%	0.504	35%	0.348	S	S	.	.	H	α-helix	trans	-71.4	2.6	-177.8	-63.7	-155.7	103.3	-41.7	0	115.7	K244 T245 F246 D251	K244-K248 WeakPolarHBondContact O-CG 3.03Å; T245-K248 CarbonylContact O-C 3.57Å; T245-K248 PolarHBondContact O-N 3.03Å; F246-K248 VanDerWaalsContact C-N 3.33Å; F246-K248 PolarHBondContact O-N 2.87Å; K248-D251 IonicContact NZ-OD2 3.6Å; K248-D251 PolarHBondContact NZ-OD2 3.16Å
249	L	95.5	Very high	93.2	Very high	82 Å²	82	66.3 Å²	66.3	43%	0.429	34%	0.34	S	S	.	.	H	α-helix	trans	-106.5	-15.5	174.8	-174	53.6	0	0	0	111.8	D234 L236 T245 F246 F247	D234-L249 HydrophobicContact CB-CD2 3.87Å; D234-L249 WeakPolarHBondContact OD2-CD2 3.41Å; L236-L249 HydrophobicContact CD1-CD2 4Å; T245-L249 PolarHBondContact O-N 3.15Å; F246-L249 PolarHBondContact O-N 3.49Å; F246-L249 VanDerWaalsContact O-N 3.11Å; F247-L249 PolarHBondContact O-N 3.32Å
250	H	95	Very high	93.3	Very high	21 Å²	21	59.5 Å²	59.5	10%	0.097	31%	0.311	C	S	.	.	H	α-helix	trans	-113.7	-19.5	179.1	-63.7	86.6	0	0	0	112.9	V229 D234 F246 F247 T252 L258 L266	V229-H250 WeakPolarHBondContact CG1-NE2 3.3Å; D234-H250 IonicContact OD1-CE1 3.19Å; D234-H250 IonicContact OD1-NE2 3.67Å; D234-H250 IonicContact OD2-CE1 3.94Å; D234-H250 PolarHBondContact OD2-CE1 3.36Å; F246-H250 AromaticContact CD1-ND1 3.89Å; F246-H250 AromaticContact CD2-CE1 3.91Å; F246-H250 AromaticContact CE1-CE1 3.95Å; F246-H250 AromaticContact CE1-ND1 3.63Å; F246-H250 AromaticContact CE2-CE1 3.45Å; F246-H250 VanDerWaalsContact CE2-CE1 3.45Å; F246-H250 WeakPolarHBondContact CE2-CE1 3.41Å; F246-H250 AromaticContact CE2-ND1 3.91Å; F246-H250 AromaticContact CZ-CE1 3.47Å; F246-H250 VanDerWaalsContact CZ-CE1 3.47Å; F246-H250 WeakPolarHBondContact CZ-CE1 3.49Å; F246-H250 AromaticContact CZ-ND1 3.66Å; F246-H250 AromaticContact CZ-NE2 3.98Å; F246-H250 PolarHBondContact O-N 3.15Å; F246-H250 PolarHBondContact O-ND1 3.13Å; F247-H250 PolarHBondContact O-N 3.03Å; F247-H250 VanDerWaalsContact O-N 3.09Å; H250-T252 PolarHBondContact O-N 3.47Å; H250-T252 PolarHBondContact O-OG1 3.3Å; H250-L258 VanDerWaalsContact C-CD2 3.47Å; H250-L258 HydrophobicContact CB-CD2 4.12Å; H250-L266 HydrophobicContact CB-CD2 3.99Å; H250-L266 WeakPolarHBondContact CD2-CD2 3.49Å
251	D	95.4	Very high	93.1	Very high	7 Å²	7	56.4 Å²	56.4	4%	0.037	30%	0.296	C	S	.	.			trans	-56.7	81.3	152.2	166	19.8	0	0	0	106.8	F247 K248 E254 D255 G256 L258	F247-D251 HydrophobicContact CD1-CB 4.21Å; F247-D251 HydrophobicContact CE1-CB 4.17Å; F247-D251 WeakPolarHBondContact O-CB 3.42Å; F247-D251 PolarHBondContact O-N 2.88Å; K248-D251 IonicContact NZ-OD2 3.6Å; K248-D251 PolarHBondContact NZ-OD2 3.16Å; D251-E254 WeakPolarHBondContact OD1-CA 3.39Å; D251-E254 PolarHBondContact OD1-N 3.35Å; D251-D255 PolarHBondContact OD1-N 3.14Å; D251-G256 PolarHBondContact OD1-N 2.92Å; D251-L258 HydrophobicContact CB-CD2 4.23Å; D251-L258 VanDerWaalsContact N-CD2 3.27Å
252	T	92	Very high	93.1	Very high	112 Å²	112	55.8 Å²	55.8	69%	0.687	29%	0.294	S	S	*	.			trans	-88.6	-24.7	-164	-59.2	0	0	0	0	111.2	H250 E262	H250-T252 PolarHBondContact O-N 3.47Å; H250-T252 PolarHBondContact O-OG1 3.3Å; T252-E262 WeakPolarHBondContact CA-OE1 3.35Å; T252-E262 WeakPolarHBondContact CB-OE1 3.49Å; T252-E262 PolarHBondContact N-OE1 2.86Å
253	N	88.9	Confident	93.1	Very high	75 Å²	75	52.5 Å²	52.5	40%	0.401	28%	0.276	S	S	.	.	S	Bend	trans	-94	-6.1	176.9	71.4	13.3	0	0	0	113.9	D255	N253-D255 VanDerWaalsContact C-N 3.35Å; N253-D255 PolarHBondContact ND2-OD2 2.7Å; N253-D255 VanDerWaalsContact OD1-CB 3.26Å; N253-D255 WeakPolarHBondContact OD1-CB 3.43Å; N253-D255 PolarHBondContact OD1-N 3.05Å; N253-D255 PolarHBondContact OD1-OD1 2.92Å; N253-D255 PolarHBondContact OD1-OD2 2.96Å
254	E	93.3	Very high	93.1	Very high	176 Å²	176	52.6 Å²	52.6	82%	0.822	27%	0.274	S	S	*	.	S	Bend	trans	62.1	22.6	-173.2	-60.6	-166.6	-177	0	0	116.2	D251	D251-E254 WeakPolarHBondContact OD1-CA 3.39Å; D251-E254 PolarHBondContact OD1-N 3.35Å
255	D	87.8	Confident	93.1	Very high	85 Å²	85	50 Å²	50	46%	0.455	27%	0.273	S	S	.	.	S	Bend	trans	-79	-21.3	178.1	79.3	19.9	0	0	0	114	D251 N253 V257	D251-D255 PolarHBondContact OD1-N 3.14Å; N253-D255 VanDerWaalsContact C-N 3.35Å; N253-D255 PolarHBondContact ND2-OD2 2.7Å; N253-D255 VanDerWaalsContact OD1-CB 3.26Å; N253-D255 WeakPolarHBondContact OD1-CB 3.43Å; N253-D255 PolarHBondContact OD1-N 3.05Å; N253-D255 PolarHBondContact OD1-OD1 2.92Å; N253-D255 PolarHBondContact OD1-OD2 2.96Å; D255-V257 WeakPolarHBondContact OD1-CG2 3.49Å; D255-V257 PolarHBondContact OD1-N 3.46Å
256	G	92.9	Very high	93	Very high	33 Å²	33	46.8 Å²	46.8	34%	0.34	25%	0.253	S	S	.	.	S	Bend	trans	91.5	7.3	175.9	0	0	0	0	0	116.8	F247 D251	F247-G256 WeakPolarHBondContact CZ-O 3.08Å; D251-G256 PolarHBondContact OD1-N 2.92Å
257	V	93.4	Very high	93	Very high	30 Å²	30	46.9 Å²	46.9	18%	0.182	25%	0.253	C	S	.	.	S	Bend	trans	-103.2	-171	158.5	-65.1	0	0	0	0	110.4	D255 L309 V310	D255-V257 WeakPolarHBondContact OD1-CG2 3.49Å; D255-V257 PolarHBondContact OD1-N 3.46Å; V257-L309 HydrophobicContact CB-CB 4.13Å; V257-L309 HydrophobicContact CG1-CB 4.27Å; V257-L309 HydrophobicContact CG2-CB 4.15Å; V257-L309 HydrophobicContact CG2-CD1 4.18Å; V257-L309 HydrophobicContact CG2-CD2 4.12Å; V257-L309 HydrophobicContact CG2-CG 4.36Å; V257-V310 CarbonylContact C-O 3.54Å; V257-V310 WeakPolarHBondContact CA-O 3.16Å
258	L	93.3	Very high	92.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.268	C	S	.	.			trans	-126.8	126.8	159.3	-69	170.8	0	0	0	107.2	F247 H250 D251 E262 L263 V310 F315	F247-L258 HydrophobicContact CD2-CD1 3.58Å; F247-L258 HydrophobicContact CD2-CG 3.94Å; F247-L258 HydrophobicContact CE2-CB 4.49Å; F247-L258 HydrophobicContact CE2-CD1 3.68Å; F247-L258 HydrophobicContact CE2-CG 3.62Å; F247-L258 HydrophobicContact CG-CD1 4.35Å; F247-L258 HydrophobicContact CZ-CD1 4.49Å; F247-L258 HydrophobicContact CZ-CG 3.96Å; H250-L258 VanDerWaalsContact C-CD2 3.47Å; H250-L258 HydrophobicContact CB-CD2 4.12Å; D251-L258 HydrophobicContact CB-CD2 4.23Å; D251-L258 VanDerWaalsContact N-CD2 3.27Å; L258-E262 WeakPolarHBondContact CA-OE2 3.43Å; L258-E262 HydrophobicContact CD2-CB 4.23Å; L258-L263 HydrophobicContact CB-CD2 4.22Å; L258-L263 HydrophobicContact CB-CG 4.14Å; L258-L263 HydrophobicContact CD1-CD2 4.09Å; L258-V310 HydrophobicContact CB-CB 4.32Å; L258-V310 PolarHBondContact N-O 3.28Å; L258-V310 PolarHBondContact O-N 2.94Å; L258-F315 HydrophobicContact CD1-CD2 4.25Å; L258-F315 HydrophobicContact CD1-CE2 4.48Å
259	D	90.6	Very high	92.7	Very high	16 Å²	16	46.1 Å²	46.1	9%	0.086	25%	0.254	C	S	.	.			trans	-86.3	-178.2	176.9	89	5.1	0	0	0	113	Q261 E262 L263 L309	D259-Q261 WeakPolarHBondContact OD1-CA 3.34Å; D259-Q261 WeakPolarHBondContact OD1-CB 3.19Å; D259-Q261 PolarHBondContact OD1-N 2.89Å; D259-E262 PolarHBondContact N-OE2 3.47Å; D259-E262 PolarHBondContact OD1-N 3.27Å; D259-L263 WeakPolarHBondContact O-CB 3.43Å; D259-L263 VanDerWaalsContact O-CG 3.25Å; D259-L263 WeakPolarHBondContact O-CG 3.17Å; D259-L263 PolarHBondContact O-N 3.21Å; D259-L309 HydrophobicContact CB-CD2 3.95Å
260	E	89.4	Confident	92.7	Very high	31 Å²	31	42.2 Å²	42.2	15%	0.145	23%	0.234	C	C	.	.	H	α-helix	trans	-64.6	-36	179.5	-75.5	-169.5	174.6	0	0	113.8	E264 R295 M299 R308	E260-E264 WeakPolarHBondContact O-CB 3.42Å; E260-E264 VanDerWaalsContact O-CG 3.24Å; E260-E264 WeakPolarHBondContact O-CG 3.32Å; E260-E264 PolarHBondContact O-N 2.91Å; E260-R295 IonicContact OE2-CZ 2.75Å; E260-R295 IonicContact OE2-NE 3.48Å; E260-R295 IonicContact OE2-NH1 2.68Å; E260-R295 PolarHBondContact OE2-NH1 3.15Å; E260-R295 IonicContact OE2-NH2 2.75Å; E260-M299 HydrophobicContact CG-CE 3.46Å; E260-M299 VanDerWaalsContact CG-CE 3.46Å; E260-R308 IonicContact OE1-CZ 2.99Å; E260-R308 IonicContact OE1-NE 2.79Å; E260-R308 PolarHBondContact OE1-NE 3.32Å; E260-R308 IonicContact OE1-NH2 3.18Å; E260-R308 PolarHBondContact OE1-NH2 2.8Å; E260-R308 IonicContact OE2-CZ 3.21Å; E260-R308 IonicContact OE2-NE 2.87Å; E260-R308 IonicContact OE2-NH2 3.7Å; E260-R308 PolarHBondContact OE2-NH2 3.16Å
261	Q	89.8	Confident	92.7	Very high	85 Å²	85	41.3 Å²	41.3	40%	0.397	23%	0.23	S	C	.	.	H	α-helix	trans	-74.6	-40	-178.8	-51.6	-170.8	-4.5	0	0	110.5	D44 D259 E264 A265	D44-Q261 PolarHBondContact O-NE2 2.96Å; D259-Q261 WeakPolarHBondContact OD1-CA 3.34Å; D259-Q261 WeakPolarHBondContact OD1-CB 3.19Å; D259-Q261 PolarHBondContact OD1-N 2.89Å; Q261-E264 PolarHBondContact O-N 3.08Å; Q261-A265 PolarHBondContact O-N 3.29Å
262	E	94.3	Very high	92.7	Very high	18 Å²	18	45.8 Å²	45.8	8%	0.084	25%	0.25	C	S	.	.	H	α-helix	trans	-65.9	-41	175	-67.3	176.1	139.5	0	0	111.9	T252 L258 D259 L266	T252-E262 WeakPolarHBondContact CA-OE1 3.35Å; T252-E262 WeakPolarHBondContact CB-OE1 3.49Å; T252-E262 PolarHBondContact N-OE1 2.86Å; L258-E262 WeakPolarHBondContact CA-OE2 3.43Å; L258-E262 HydrophobicContact CD2-CB 4.23Å; D259-E262 PolarHBondContact N-OE2 3.47Å; D259-E262 PolarHBondContact OD1-N 3.27Å; E262-L266 WeakPolarHBondContact O-CG 3.48Å
263	L	93.1	Very high	92.8	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.016	23%	0.227	C	C	.	.	H	α-helix	trans	-67.3	-41.6	172.8	-71.6	169.9	0	0	0	112.2	L258 D259 A265 L266 F267 V298 M299 V310	L258-L263 HydrophobicContact CB-CD2 4.22Å; L258-L263 HydrophobicContact CB-CG 4.14Å; L258-L263 HydrophobicContact CD1-CD2 4.09Å; D259-L263 WeakPolarHBondContact O-CB 3.43Å; D259-L263 VanDerWaalsContact O-CG 3.25Å; D259-L263 WeakPolarHBondContact O-CG 3.17Å; D259-L263 PolarHBondContact O-N 3.21Å; L263-A265 VanDerWaalsContact C-N 3.3Å; L263-A265 PolarHBondContact O-N 3.13Å; L263-L266 HydrophobicContact CD2-CD1 4.1Å; L263-L266 WeakPolarHBondContact O-CB 3.49Å; L263-L266 WeakPolarHBondContact O-CG 3.2Å; L263-L266 PolarHBondContact O-N 2.91Å; L263-F267 VanDerWaalsContact O-CE2 3.31Å; L263-F267 WeakPolarHBondContact O-CE2 3.33Å; L263-F267 WeakPolarHBondContact O-CZ 3.42Å; L263-V298 HydrophobicContact CD1-CG1 4.46Å; L263-V298 HydrophobicContact CD2-CG1 4.29Å; L263-M299 HydrophobicContact CD1-CE 3.54Å; L263-M299 HydrophobicContact CD1-SD 3.88Å; L263-V310 HydrophobicContact CD1-CB 4.28Å; L263-V310 HydrophobicContact CD1-CG2 3.78Å
264	E	93.5	Very high	93	Very high	32 Å²	32	39.2 Å²	39.2	15%	0.15	21%	0.209	C	C	.	.	H	α-helix	trans	-60.4	-38	176	-88.1	-171.7	-143.8	0	0	112.9	E260 Q261 L266 F267 R291 R295	E260-E264 WeakPolarHBondContact O-CB 3.42Å; E260-E264 VanDerWaalsContact O-CG 3.24Å; E260-E264 WeakPolarHBondContact O-CG 3.32Å; E260-E264 PolarHBondContact O-N 2.91Å; Q261-E264 PolarHBondContact O-N 3.08Å; E264-L266 PolarHBondContact O-N 2.75Å; E264-F267 PolarHBondContact O-N 3.43Å; E264-F267 VanDerWaalsContact O-N 3.09Å; E264-R291 HydrophobicContact CB-CG 4.26Å; E264-R291 HydrophobicContact CG-CG 3.97Å; E264-R291 WeakPolarHBondContact OE2-CD 3.35Å; E264-R291 IonicContact OE2-NH1 2.63Å; E264-R295 HydrophobicContact CG-CB 4.18Å; E264-R295 HydrophobicContact CG-CG 4.28Å; E264-R295 WeakPolarHBondContact OE1-CD 3.37Å; E264-R295 IonicContact OE1-CZ 2.68Å; E264-R295 IonicContact OE1-NE 3.93Å; E264-R295 IonicContact OE1-NH1 2.68Å; E264-R295 PolarHBondContact OE1-NH1 3.11Å
265	A	93.9	Very high	93.2	Very high	55 Å²	55	31 Å²	31	46%	0.455	17%	0.171	S	C	.	.	H	α-helix	trans	-57.7	-36.4	176.5	0	0	0	0	0	112.3	Q261 L263 F267 T268	Q261-A265 PolarHBondContact O-N 3.29Å; L263-A265 VanDerWaalsContact C-N 3.3Å; L263-A265 PolarHBondContact O-N 3.13Å; A265-F267 PolarHBondContact O-N 3.13Å; A265-T268 WeakPolarHBondContact O-CB 3.43Å; A265-T268 PolarHBondContact O-N 3.19Å; A265-T268 PolarHBondContact O-OG1 3.17Å
266	L	94.2	Very high	93.5	Very high	5 Å²	5	29.4 Å²	29.4	3%	0.026	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-24.8	178.9	-45.2	-176.4	0	0	0	113.1	Q225 L226 V229 F246 H250 E262 L263 E264	Q225-L266 PolarHBondContact NE2-O 2.76Å; L226-L266 HydrophobicContact CD2-CD1 4.24Å; V229-L266 WeakPolarHBondContact CG2-O 3.35Å; F246-L266 HydrophobicContact CE1-CD1 4.08Å; F246-L266 HydrophobicContact CE1-CD2 4.2Å; F246-L266 HydrophobicContact CZ-CD1 4.39Å; F246-L266 HydrophobicContact CZ-CD2 4.05Å; H250-L266 HydrophobicContact CB-CD2 3.99Å; H250-L266 WeakPolarHBondContact CD2-CD2 3.49Å; E262-L266 WeakPolarHBondContact O-CG 3.48Å; L263-L266 HydrophobicContact CD2-CD1 4.1Å; L263-L266 WeakPolarHBondContact O-CB 3.49Å; L263-L266 WeakPolarHBondContact O-CG 3.2Å; L263-L266 PolarHBondContact O-N 2.91Å; E264-L266 PolarHBondContact O-N 2.75Å
267	F	95.3	Very high	93.6	Very high	1 Å²	1	32.4 Å²	32.4	0%	0.004	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-13.5	-178	-50	-37.6	0	0	0	112.8	P220 L263 E264 A265 K269 E270 L271 R291 M294 R295 V298	P220-F267 HydrophobicContact CB-CD1 3.84Å; P220-F267 HydrophobicContact CB-CE1 3.49Å; P220-F267 VanDerWaalsContact CB-CE1 3.49Å; P220-F267 HydrophobicContact CB-CZ 4.13Å; L263-F267 VanDerWaalsContact O-CE2 3.31Å; L263-F267 WeakPolarHBondContact O-CE2 3.33Å; L263-F267 WeakPolarHBondContact O-CZ 3.42Å; E264-F267 PolarHBondContact O-N 3.43Å; E264-F267 VanDerWaalsContact O-N 3.09Å; A265-F267 PolarHBondContact O-N 3.13Å; F267-K269 VanDerWaalsContact C-N 3.29Å; F267-K269 PolarHBondContact O-N 2.81Å; F267-E270 WeakPolarHBondContact O-CB 3.25Å; F267-E270 PolarHBondContact O-N 3.5Å; F267-L271 HydrophobicContact CB-CD1 4.16Å; F267-L271 WeakPolarHBondContact O-CG 3.41Å; F267-L271 PolarHBondContact O-N 2.71Å; F267-R291 HydrophobicContact CB-CG 4.34Å; F267-R291 HydrophobicContact CD2-CG 4.07Å; F267-M294 HydrophobicContact CB-SD 3.78Å; F267-M294 HydrophobicContact CD1-CB 4.21Å; F267-M294 HydrophobicContact CD1-SD 4.22Å; F267-M294 HydrophobicContact CD2-CB 3.65Å; F267-M294 HydrophobicContact CE1-CB 4.42Å; F267-M294 HydrophobicContact CE2-CB 3.9Å; F267-M294 HydrophobicContact CG-CB 3.86Å; F267-M294 HydrophobicContact CG-SD 3.94Å; F267-M294 HydrophobicContact CZ-CB 4.28Å; F267-R295 HydrophobicContact CE2-CB 3.94Å; F267-V298 HydrophobicContact CE1-CG2 3.98Å; F267-V298 HydrophobicContact CZ-CB 4.35Å; F267-V298 HydrophobicContact CZ-CG2 3.74Å
268	T	93.6	Very high	93.6	Very high	49 Å²	49	39 Å²	39	30%	0.301	20%	0.202	S	C	.	.	H	α-helix	trans	-52.1	-45.3	-176.8	-49.3	0	0	0	0	112.2	A265 E270 L271 E272	A265-T268 WeakPolarHBondContact O-CB 3.43Å; A265-T268 PolarHBondContact O-N 3.19Å; A265-T268 PolarHBondContact O-OG1 3.17Å; T268-E270 PolarHBondContact O-N 2.92Å; T268-L271 PolarHBondContact O-N 2.94Å; T268-E272 HydrophobicContact CG2-CG 4.4Å; T268-E272 WeakPolarHBondContact O-CB 3.41Å; T268-E272 WeakPolarHBondContact O-CG 3.26Å; T268-E272 PolarHBondContact O-N 2.72Å
269	K	92.3	Very high	93.6	Very high	53 Å²	53	42 Å²	42	23%	0.23	22%	0.218	C	C	.	.	H	α-helix	trans	-65.6	-34.2	178.9	-71.8	-72.3	151.9	-146.3	0	113.9	E232 T233 F267 E272	E232-K269 HydrophobicContact CB-CD 4.33Å; T233-K269 WeakPolarHBondContact OG1-CG 3.28Å; F267-K269 VanDerWaalsContact C-N 3.29Å; F267-K269 PolarHBondContact O-N 2.81Å; K269-E272 IonicContact NZ-OE1 3.74Å; K269-E272 IonicContact NZ-OE2 3.16Å; K269-E272 PolarHBondContact NZ-OE2 2.94Å
270	E	94.1	Very high	93.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-71.9	-38.3	175.9	-66.9	-62.1	160.7	0	0	111.6	V217 N218 Q225 F267 T268 K273 M294	V217-E270 WeakPolarHBondContact CA-OE2 3.25Å; V217-E270 HydrophobicContact CG1-CB 4.09Å; N218-E270 VanDerWaalsContact CB-OE1 3.32Å; N218-E270 WeakPolarHBondContact CB-OE1 3.44Å; N218-E270 PolarHBondContact N-OE2 3.47Å; N218-E270 PolarHBondContact ND2-OE1 3.11Å; Q225-E270 HydrophobicContact CB-CG 4.47Å; Q225-E270 HydrophobicContact CG-CG 3.6Å; Q225-E270 WeakPolarHBondContact CG-OE1 3.32Å; F267-E270 WeakPolarHBondContact O-CB 3.25Å; F267-E270 PolarHBondContact O-N 3.5Å; T268-E270 PolarHBondContact O-N 2.92Å; E270-K273 VanDerWaalsContact CD-NZ 3.25Å; E270-K273 WeakPolarHBondContact O-CB 3.3Å; E270-K273 PolarHBondContact O-N 2.94Å; E270-K273 IonicContact OE1-NZ 3.19Å; E270-K273 PolarHBondContact OE1-NZ 3.41Å; E270-K273 IonicContact OE2-NZ 2.73Å; E270-K273 PolarHBondContact OE2-NZ 3.19Å; E270-M294 HydrophobicContact CB-CE 4.28Å
271	L	95.1	Very high	93.8	Very high	1 Å²	1	47 Å²	47	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-75.4	-35.9	-179.5	-64.5	168.8	0	0	0	112.4	F267 T268 K273 V274 Y275 M287 E290 R291 M294	F267-L271 HydrophobicContact CB-CD1 4.16Å; F267-L271 WeakPolarHBondContact O-CG 3.41Å; F267-L271 PolarHBondContact O-N 2.71Å; T268-L271 PolarHBondContact O-N 2.94Å; L271-K273 PolarHBondContact O-N 3.21Å; L271-K273 VanDerWaalsContact O-N 3.08Å; L271-V274 PolarHBondContact O-N 3.31Å; L271-Y275 HydrophobicContact CD2-CE2 4.48Å; L271-Y275 PolarHBondContact O-N 3.42Å; L271-M287 HydrophobicContact CB-CE 3.52Å; L271-M287 HydrophobicContact CB-CG 4.06Å; L271-M287 HydrophobicContact CD1-CE 4.44Å; L271-M287 HydrophobicContact CD1-CG 4.4Å; L271-E290 HydrophobicContact CD2-CB 3.83Å; L271-E290 HydrophobicContact CD2-CG 3.68Å; L271-R291 HydrophobicContact CD1-CB 3.61Å; L271-R291 HydrophobicContact CD1-CG 3.71Å; L271-M294 HydrophobicContact CD2-CE 3.91Å; L271-M294 HydrophobicContact CD2-SD 4.26Å; L271-M294 HydrophobicContact CG-CE 4.47Å; L271-M294 HydrophobicContact CG-SD 4.41Å
272	E	94.9	Very high	94	Very high	101 Å²	101	43.8 Å²	43.8	47%	0.472	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-16.2	173.1	-80.6	179.4	158.6	0	0	113.7	T268 K269	T268-E272 HydrophobicContact CG2-CG 4.4Å; T268-E272 WeakPolarHBondContact O-CB 3.41Å; T268-E272 WeakPolarHBondContact O-CG 3.26Å; T268-E272 PolarHBondContact O-N 2.72Å; K269-E272 IonicContact NZ-OE1 3.74Å; K269-E272 IonicContact NZ-OE2 3.16Å; K269-E272 PolarHBondContact NZ-OE2 2.94Å
273	K	94.2	Very high	93.9	Very high	43 Å²	43	44.3 Å²	44.3	19%	0.187	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-30.9	171.8	-61.2	168.8	-172.6	176.6	0	112.4	H214 P215 N218 E228 E270 L271	H214-K273 WeakPolarHBondContact CB-O 3.43Å; P215-K273 HydrophobicContact CB-CB 4.33Å; P215-K273 HydrophobicContact CB-CG 4.49Å; P215-K273 WeakPolarHBondContact CD-O 3.34Å; P215-K273 HydrophobicContact CG-CB 4.35Å; N218-K273 PolarHBondContact ND2-NZ 3.38Å; E228-K273 WeakPolarHBondContact OE1-CE 3.05Å; E228-K273 IonicContact OE1-NZ 3.8Å; E228-K273 PolarHBondContact OE1-NZ 3.36Å; E228-K273 IonicContact OE2-NZ 2.75Å; E228-K273 PolarHBondContact OE2-NZ 3.31Å; E270-K273 VanDerWaalsContact CD-NZ 3.25Å; E270-K273 WeakPolarHBondContact O-CB 3.3Å; E270-K273 PolarHBondContact O-N 2.94Å; E270-K273 IonicContact OE1-NZ 3.19Å; E270-K273 PolarHBondContact OE1-NZ 3.41Å; E270-K273 IonicContact OE2-NZ 2.73Å; E270-K273 PolarHBondContact OE2-NZ 3.19Å; L271-K273 PolarHBondContact O-N 3.21Å; L271-K273 VanDerWaalsContact O-N 3.08Å
274	V	94.8	Very high	93.9	Very high	6 Å²	6	46.9 Å²	46.9	4%	0.036	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-30.7	-169.7	-172.3	0	0	0	0	111.7	H211 H214 V217 L271 T332	H211-V274 PolarHBondContact CE1-O 3.27Å; H211-V274 VanDerWaalsContact CE1-O 3.26Å; H211-V274 PolarHBondContact ND1-O 3.29Å; H214-V274 HydrophobicContact CB-CB 4.42Å; H214-V274 HydrophobicContact CB-CG1 4.49Å; H214-V274 HydrophobicContact CB-CG2 4.2Å; V217-V274 HydrophobicContact CG2-CG2 3.35Å; L271-V274 PolarHBondContact O-N 3.31Å; V274-T332 HydrophobicContact CG1-CG2 4.29Å; V274-T332 HydrophobicContact CG2-CG2 4.37Å
275	Y	96	Very high	93.9	Very high	4 Å²	4	49 Å²	49	2%	0.016	25%	0.253	C	S	.	.			trans	-130.1	112.5	-171.2	-60.1	-81	0	0	0	111.5	H211 L271 D282 D283 E286 M287 E290	H211-Y275 AromaticContact CE1-CD1 3.63Å; H211-Y275 AromaticContact CE1-CE1 3.33Å; H211-Y275 WeakPolarHBondContact CE1-CE1 3.5Å; H211-Y275 AromaticContact CE1-CZ 3.92Å; H211-Y275 AromaticContact NE2-CE1 3.69Å; H211-Y275 AromaticContact NE2-CZ 3.98Å; L271-Y275 HydrophobicContact CD2-CE2 4.48Å; L271-Y275 PolarHBondContact O-N 3.42Å; Y275-D282 HydrophobicContact CD1-CB 4.3Å; Y275-D283 WeakPolarHBondContact CD1-O 3.44Å; Y275-E286 HydrophobicContact CE1-CB 3.68Å; Y275-M287 HydrophobicContact CD1-CB 4.05Å; Y275-M287 HydrophobicContact CD2-CB 3.76Å; Y275-M287 HydrophobicContact CD2-CG 3.71Å; Y275-M287 HydrophobicContact CE2-CB 4.27Å; Y275-M287 HydrophobicContact CE2-CG 4.49Å; Y275-M287 HydrophobicContact CG-CB 3.66Å; Y275-M287 HydrophobicContact CG-CG 3.86Å; Y275-E290 HydrophobicContact CE2-CB 4.33Å
276	D	94.8	Very high	93.9	Very high	51 Å²	51	47.7 Å²	47.7	27%	0.273	24%	0.238	S	C	.	.			trans	-111.2	120.8	165.5	-176.2	-17.7	0	0	0	110.4	K278 N279 D282	D276-K278 PolarHBondContact O-N 2.84Å; D276-K278 WeakPolarHBondContact OD1-CB 3.13Å; D276-K278 VanDerWaalsContact OD1-CG 3.29Å; D276-K278 WeakPolarHBondContact OD1-CG 3.17Å; D276-K278 PolarHBondContact OD1-N 2.88Å; D276-K278 IonicContact OD1-NZ 2.72Å; D276-K278 PolarHBondContact OD1-NZ 3.35Å; D276-K278 IonicContact OD2-NZ 2.83Å; D276-K278 PolarHBondContact OD2-NZ 2.9Å; D276-N279 PolarHBondContact O-N 3.09Å; D276-D282 PolarHBondContact N-OD2 2.74Å
277	P	93.9	Very high	93.9	Very high	97 Å²	97	48.5 Å²	48.5	63%	0.63	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	0.4	175.9	23.6	-34.3	0	0	0	115.9	M284	P277-M284 HydrophobicContact CB-CE 4.38Å; P277-M284 HydrophobicContact CB-CG 4.3Å; P277-M284 HydrophobicContact CB-SD 3.66Å; P277-M284 HydrophobicContact CG-SD 4.2Å
278	K	94.1	Very high	93.7	Very high	169 Å²	169	52.3 Å²	52.3	74%	0.735	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-14.3	173	-58.8	174.4	-135.1	69.6	0	113.6	D276	D276-K278 PolarHBondContact O-N 2.84Å; D276-K278 WeakPolarHBondContact OD1-CB 3.13Å; D276-K278 VanDerWaalsContact OD1-CG 3.29Å; D276-K278 WeakPolarHBondContact OD1-CG 3.17Å; D276-K278 PolarHBondContact OD1-N 2.88Å; D276-K278 IonicContact OD1-NZ 2.72Å; D276-K278 PolarHBondContact OD1-NZ 3.35Å; D276-K278 IonicContact OD2-NZ 2.83Å; D276-K278 PolarHBondContact OD2-NZ 2.9Å
279	N	93.4	Very high	93.8	Very high	63 Å²	63	50.3 Å²	50.3	34%	0.337	25%	0.247	S	C	.	.	S	Bend	trans	-82.4	160.6	175.6	-81.3	-35.4	0	0	0	111	K210 D276 E281 D282	K210-N279 PolarHBondContact NZ-OD1 3.25Å; D276-N279 PolarHBondContact O-N 3.09Å; N279-E281 VanDerWaalsContact CG-OE1 3.26Å; N279-E281 PolarHBondContact ND2-OE1 3.2Å; N279-D282 HydrophobicContact CB-CB 4.03Å; N279-D282 VanDerWaalsContact CB-OD2 3.31Å; N279-D282 WeakPolarHBondContact CB-OD2 3.45Å; N279-D282 PolarHBondContact ND2-OD2 3.46Å
280	E	92.4	Very high	93.9	Very high	125 Å²	125	47.9 Å²	47.9	58%	0.584	24%	0.236	S	C	*	.	S	Bend	trans	-99.5	-10.2	175.7	71.9	168.9	-164.7	0	0	113.3	R203 L207	R203-E280 IonicContact CZ-OE1 2.82Å; R203-E280 IonicContact NE-OE1 3.71Å; R203-E280 PolarHBondContact NE-OE1 2.82Å; R203-E280 IonicContact NH2-OE1 2.83Å; R203-E280 PolarHBondContact NH2-OE1 2.72Å; R203-E280 IonicContact NH2-OE2 3.91Å; R203-E280 PolarHBondContact NH2-OE2 3.47Å; L207-E280 HydrophobicContact CD1-CG 4.19Å; L207-E280 HydrophobicContact CD2-CG 3.82Å
281	E	91.5	Very high	93.9	Very high	26 Å²	26	51 Å²	51	12%	0.121	25%	0.248	C	C	.	.	S	Bend	trans	-98	-12.8	175.8	73	-73.9	-177.6	0	0	114.7	L207 K210 H211 N279	L207-E281 HydrophobicContact CB-CB 3.79Å; L207-E281 HydrophobicContact CD2-CB 4.08Å; L207-E281 HydrophobicContact CG-CB 4.4Å; K210-E281 HydrophobicContact CB-CG 4.31Å; K210-E281 HydrophobicContact CD-CG 4.28Å; K210-E281 WeakPolarHBondContact CD-OE1 3.48Å; K210-E281 WeakPolarHBondContact CE-OE1 3.27Å; K210-E281 HydrophobicContact CG-CG 4.31Å; K210-E281 WeakPolarHBondContact CG-OE1 3.37Å; K210-E281 IonicContact NZ-OE1 2.66Å; K210-E281 PolarHBondContact NZ-OE1 2.83Å; K210-E281 IonicContact NZ-OE2 2.61Å; K210-E281 PolarHBondContact NZ-OE2 2.94Å; H211-E281 HydrophobicContact CB-CB 4.34Å; H211-E281 HydrophobicContact CB-CG 3.84Å; N279-E281 VanDerWaalsContact CG-OE1 3.26Å; N279-E281 PolarHBondContact ND2-OE1 3.2Å
282	D	93.8	Very high	93.8	Very high	18 Å²	18	51.6 Å²	51.6	10%	0.096	25%	0.251	C	S	.	.			trans	-95.9	115.5	-177.3	-63.3	-14.1	0	0	0	110	H211 Y275 D276 N279 M284	H211-D282 IonicContact CE1-OD1 2.65Å; H211-D282 IonicContact CG-OD1 3.4Å; H211-D282 IonicContact ND1-OD1 2.66Å; H211-D282 PolarHBondContact ND1-OD1 3.48Å; Y275-D282 HydrophobicContact CD1-CB 4.3Å; D276-D282 PolarHBondContact N-OD2 2.74Å; N279-D282 HydrophobicContact CB-CB 4.03Å; N279-D282 VanDerWaalsContact CB-OD2 3.31Å; N279-D282 WeakPolarHBondContact CB-OD2 3.45Å; N279-D282 PolarHBondContact ND2-OD2 3.46Å; D282-M284 HydrophobicContact CB-CE 4.08Å
283	D	93.4	Very high	93.7	Very high	29 Å²	29	49.4 Å²	49.4	16%	0.155	24%	0.238	C	C	.	.			trans	-95.8	126.7	-179.6	-169.4	-16.7	0	0	0	111.5	Y177 K181 Y275 M285 E286 M287	Y177-D283 WeakPolarHBondContact CE1-OD2 3.34Å; Y177-D283 PolarHBondContact OH-OD2 3.14Å; K181-D283 IonicContact NZ-OD2 2.8Å; K181-D283 PolarHBondContact NZ-OD2 3.45Å; Y275-D283 WeakPolarHBondContact CD1-O 3.44Å; D283-M285 VanDerWaalsContact C-N 3.3Å; D283-M285 PolarHBondContact O-N 2.95Å; D283-M285 WeakPolarHBondContact OD1-CB 3.46Å; D283-M285 PolarHBondContact OD1-N 3.32Å; D283-E286 HydrophobicContact CB-CB 4.07Å; D283-E286 HydrophobicContact CB-CG 3.75Å; D283-E286 WeakPolarHBondContact O-CB 3.45Å; D283-E286 PolarHBondContact O-N 3.24Å; D283-M287 PolarHBondContact O-N 3.06Å
284	M	93.4	Very high	93.7	Very high	56 Å²	56	47.4 Å²	47.4	28%	0.276	23%	0.23	S	C	.	.	H	α-helix	trans	-72.7	-23.7	179.2	-57.4	-60.4	96.2	0	0	112.4	P277 D282 M287 E288	P277-M284 HydrophobicContact CB-CE 4.38Å; P277-M284 HydrophobicContact CB-CG 4.3Å; P277-M284 HydrophobicContact CB-SD 3.66Å; P277-M284 HydrophobicContact CG-SD 4.2Å; D282-M284 HydrophobicContact CB-CE 4.08Å; M284-M287 WeakPolarHBondContact O-CB 3.32Å; M284-M287 PolarHBondContact O-N 3.38Å; M284-M287 HydrophobicContact SD-SD 4.17Å; M284-E288 PolarHBondContact O-N 3.47Å
285	M	92.1	Very high	93.6	Very high	77 Å²	77	47.5 Å²	47.5	38%	0.379	23%	0.23	S	C	.	.	H	α-helix	trans	-69.7	-36.9	171.3	-59	-53.3	-47.9	0	0	111.2	Y177 D283 E289	Y177-M285 HydrophobicContact CD1-CB 4.4Å; Y177-M285 HydrophobicContact CE1-CB 3.97Å; Y177-M285 HydrophobicContact CE1-CG 4.25Å; Y177-M285 HydrophobicContact CE2-CG 4.21Å; D283-M285 VanDerWaalsContact C-N 3.3Å; D283-M285 PolarHBondContact O-N 2.95Å; D283-M285 WeakPolarHBondContact OD1-CB 3.46Å; D283-M285 PolarHBondContact OD1-N 3.32Å; M285-E289 PolarHBondContact O-N 2.83Å; M285-E289 VanDerWaalsContact O-N 3.1Å
286	E	93.8	Very high	93.4	Very high	28 Å²	28	50 Å²	50	13%	0.131	24%	0.241	C	C	.	.	H	α-helix	trans	-66.5	-38.5	171.7	-64.6	-178.6	-143.4	0	0	110.9	F174 K181 Y275 D283 E289 E290 L333	F174-E286 HydrophobicContact CE2-CG 4.1Å; F174-E286 HydrophobicContact CZ-CB 4.48Å; F174-E286 HydrophobicContact CZ-CG 3.97Å; K181-E286 IonicContact NZ-OE1 3.17Å; K181-E286 PolarHBondContact NZ-OE1 3.09Å; Y275-E286 HydrophobicContact CE1-CB 3.68Å; D283-E286 HydrophobicContact CB-CB 4.07Å; D283-E286 HydrophobicContact CB-CG 3.75Å; D283-E286 WeakPolarHBondContact O-CB 3.45Å; D283-E286 PolarHBondContact O-N 3.24Å; E286-E289 PolarHBondContact O-N 2.87Å; E286-E290 WeakPolarHBondContact O-CB 3.26Å; E286-E290 PolarHBondContact O-N 3.2Å; E286-L333 HydrophobicContact CB-CD1 3.94Å; E286-L333 HydrophobicContact CG-CD1 4.46Å; E286-L333 VanDerWaalsContact O-CD1 3.29Å; E286-L333 WeakPolarHBondContact O-CD1 3.43Å
287	M	94.4	Very high	93.3	Very high	22 Å²	22	51.2 Å²	51.2	11%	0.108	25%	0.245	C	C	.	.	H	α-helix	trans	-62.5	-43	174.8	-168.9	-161.5	-175.4	0	0	112.9	L271 Y275 D283 M284 R291	L271-M287 HydrophobicContact CB-CE 3.52Å; L271-M287 HydrophobicContact CB-CG 4.06Å; L271-M287 HydrophobicContact CD1-CE 4.44Å; L271-M287 HydrophobicContact CD1-CG 4.4Å; Y275-M287 HydrophobicContact CD1-CB 4.05Å; Y275-M287 HydrophobicContact CD2-CB 3.76Å; Y275-M287 HydrophobicContact CD2-CG 3.71Å; Y275-M287 HydrophobicContact CE2-CB 4.27Å; Y275-M287 HydrophobicContact CE2-CG 4.49Å; Y275-M287 HydrophobicContact CG-CB 3.66Å; Y275-M287 HydrophobicContact CG-CG 3.86Å; D283-M287 PolarHBondContact O-N 3.06Å; M284-M287 WeakPolarHBondContact O-CB 3.32Å; M284-M287 PolarHBondContact O-N 3.38Å; M284-M287 HydrophobicContact SD-SD 4.17Å; M287-R291 PolarHBondContact O-N 3.34Å; M287-R291 VanDerWaalsContact O-N 3.11Å
288	E	92.5	Very high	93.2	Very high	81 Å²	81	46.9 Å²	46.9	38%	0.379	22%	0.217	S	C	.	.	H	α-helix	trans	-64.4	-45.1	175.7	-78.4	-177.3	-157.7	0	0	111.6	R170 M284 R291 L292	R170-E288 IonicContact NH2-OE2 2.66Å; M284-E288 PolarHBondContact O-N 3.47Å; E288-R291 VanDerWaalsContact O-CB 3.28Å; E288-R291 WeakPolarHBondContact O-CB 3.44Å; E288-R291 PolarHBondContact O-N 3.17Å; E288-L292 PolarHBondContact O-N 3.18Å; E288-L292 VanDerWaalsContact O-N 3.09Å
289	E	93.9	Very high	93	Very high	7 Å²	7	39.8 Å²	39.8	3%	0.033	19%	0.186	C	C	.	.	H	α-helix	trans	-63	-44	176.6	177	58.6	-134.7	0	0	112.1	H171 F174 M285 E286 R291 L292 R293 L333	H171-E289 IonicContact CE1-OE1 2.62Å; H171-E289 PolarHBondContact CE1-OE1 3.15Å; H171-E289 IonicContact ND1-OE1 2.57Å; H171-E289 PolarHBondContact ND1-OE1 2.77Å; H171-E289 IonicContact NE2-OE1 3.81Å; F174-E289 HydrophobicContact CB-CG 4.46Å; F174-E289 HydrophobicContact CD1-CB 4.12Å; F174-E289 HydrophobicContact CD1-CG 3.53Å; F174-E289 HydrophobicContact CD2-CB 3.83Å; F174-E289 HydrophobicContact CD2-CG 4.17Å; F174-E289 HydrophobicContact CE1-CB 4.16Å; F174-E289 HydrophobicContact CE1-CG 3.67Å; F174-E289 HydrophobicContact CE2-CB 3.91Å; F174-E289 HydrophobicContact CE2-CG 4.33Å; F174-E289 HydrophobicContact CG-CB 3.94Å; F174-E289 HydrophobicContact CG-CG 3.78Å; F174-E289 HydrophobicContact CZ-CB 4.07Å; F174-E289 HydrophobicContact CZ-CG 4.09Å; M285-E289 PolarHBondContact O-N 2.83Å; M285-E289 VanDerWaalsContact O-N 3.1Å; E286-E289 PolarHBondContact O-N 2.87Å; E289-R291 PolarHBondContact O-N 3.46Å; E289-L292 PolarHBondContact O-N 2.94Å; E289-L292 VanDerWaalsContact O-N 3.13Å; E289-R293 WeakPolarHBondContact O-CG 3.45Å; E289-R293 PolarHBondContact O-N 2.98Å; E289-R293 WeakPolarHBondContact OE1-CG 3.5Å; E289-L333 HydrophobicContact CB-CD1 4.1Å; E289-L333 HydrophobicContact CG-CD1 4.04Å; E289-L333 HydrophobicContact CG-CD2 4.08Å
290	E	94.9	Very high	92.9	Very high	1 Å²	1	45 Å²	45	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-61.3	-32.3	176.6	-167	64.2	-98.7	0	0	111.6	L271 Y275 E286 R293 M294 W330 T332 L333	L271-E290 HydrophobicContact CD2-CB 3.83Å; L271-E290 HydrophobicContact CD2-CG 3.68Å; Y275-E290 HydrophobicContact CE2-CB 4.33Å; E286-E290 WeakPolarHBondContact O-CB 3.26Å; E286-E290 PolarHBondContact O-N 3.2Å; E290-R293 IonicContact OE1-CZ 3.94Å; E290-R293 IonicContact OE1-NE 2.86Å; E290-R293 IonicContact OE1-NH1 2.79Å; E290-R293 PolarHBondContact OE1-NH1 2.89Å; E290-R293 IonicContact OE1-NH2 3.29Å; E290-R293 PolarHBondContact OE1-NH2 2.93Å; E290-R293 IonicContact OE2-CZ 3.49Å; E290-R293 IonicContact OE2-NH1 3.7Å; E290-R293 PolarHBondContact OE2-NH1 3.5Å; E290-M294 HydrophobicContact CG-CE 4.3Å; E290-M294 VanDerWaalsContact O-CG 3.31Å; E290-M294 WeakPolarHBondContact O-CG 3.35Å; E290-M294 PolarHBondContact O-N 3.12Å; E290-W330 VanDerWaalsContact CD-NE1 3.33Å; E290-W330 WeakPolarHBondContact OE1-CZ2 3.44Å; E290-W330 PolarHBondContact OE1-NE1 3.09Å; E290-T332 WeakPolarHBondContact OE2-CA 3.46Å; E290-L333 HydrophobicContact CB-CD1 4.25Å; E290-L333 WeakPolarHBondContact OE2-CG 3.39Å; E290-L333 PolarHBondContact OE2-N 3.18Å
291	R	95	Very high	92.7	Very high	67 Å²	67	42.2 Å²	42.2	25%	0.253	20%	0.195	S	C	.	.	H	α-helix	trans	-65.8	-45.2	172.6	-159.4	-167.3	-60.7	173.9	0.9	112.5	E264 F267 L271 M287 E288 E289 M294 R295	E264-R291 HydrophobicContact CB-CG 4.26Å; E264-R291 HydrophobicContact CG-CG 3.97Å; E264-R291 WeakPolarHBondContact OE2-CD 3.35Å; E264-R291 IonicContact OE2-NH1 2.63Å; F267-R291 HydrophobicContact CB-CG 4.34Å; F267-R291 HydrophobicContact CD2-CG 4.07Å; L271-R291 HydrophobicContact CD1-CB 3.61Å; L271-R291 HydrophobicContact CD1-CG 3.71Å; M287-R291 PolarHBondContact O-N 3.34Å; M287-R291 VanDerWaalsContact O-N 3.11Å; E288-R291 VanDerWaalsContact O-CB 3.28Å; E288-R291 WeakPolarHBondContact O-CB 3.44Å; E288-R291 PolarHBondContact O-N 3.17Å; E289-R291 PolarHBondContact O-N 3.46Å; R291-M294 WeakPolarHBondContact O-CB 3.5Å; R291-M294 PolarHBondContact O-N 2.72Å; R291-R295 PolarHBondContact O-N 3.37Å
292	L	92.1	Very high	92.7	Very high	13 Å²	13	41.1 Å²	41.1	7%	0.068	19%	0.19	C	C	.	.	H	α-helix	trans	-60.8	-45.8	175.6	-65.5	176.4	0	0	0	110.8	R170 E288 E289 M294 R295 E296	R170-L292 HydrophobicContact CB-CD1 4.23Å; R170-L292 HydrophobicContact CG-CD1 4.5Å; E288-L292 PolarHBondContact O-N 3.18Å; E288-L292 VanDerWaalsContact O-N 3.09Å; E289-L292 PolarHBondContact O-N 2.94Å; E289-L292 VanDerWaalsContact O-N 3.13Å; L292-M294 VanDerWaalsContact C-N 3.29Å; L292-M294 PolarHBondContact O-N 2.57Å; L292-R295 VanDerWaalsContact CD2-NH1 3.3Å; L292-R295 WeakPolarHBondContact O-CB 3.44Å; L292-R295 PolarHBondContact O-N 3.03Å; L292-R295 VanDerWaalsContact O-N 3.15Å; L292-E296 PolarHBondContact O-N 2.97Å
293	R	93.3	Very high	92.6	Very high	54 Å²	54	41.1 Å²	41.1	20%	0.204	19%	0.19	C	C	.	.	H	α-helix	trans	-58.7	-37.4	173.6	-72	179.2	52.8	-133.6	-25.5	113.3	E289 E290 H297 W330 E331 L333	E289-R293 WeakPolarHBondContact O-CG 3.45Å; E289-R293 PolarHBondContact O-N 2.98Å; E289-R293 WeakPolarHBondContact OE1-CG 3.5Å; E290-R293 IonicContact OE1-CZ 3.94Å; E290-R293 IonicContact OE1-NE 2.86Å; E290-R293 IonicContact OE1-NH1 2.79Å; E290-R293 PolarHBondContact OE1-NH1 2.89Å; E290-R293 IonicContact OE1-NH2 3.29Å; E290-R293 PolarHBondContact OE1-NH2 2.93Å; E290-R293 IonicContact OE2-CZ 3.49Å; E290-R293 IonicContact OE2-NH1 3.7Å; E290-R293 PolarHBondContact OE2-NH1 3.5Å; R293-H297 WeakPolarHBondContact O-CB 3.4Å; R293-H297 PolarHBondContact O-N 3.47Å; R293-W330 HydrophobicContact CB-CZ2 4.1Å; R293-E331 PolarHBondContact NH2-O 3.13Å; R293-L333 VanDerWaalsContact NH1-CD2 3.3Å; R293-L333 VanDerWaalsContact NH1-CG 3.3Å
294	M	94	Very high	92.4	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-67.7	-44.2	174.6	-76.9	-171.5	-173.5	0	0	111.8	V217 P220 F267 E270 L271 E290 R291 L292 H297 V298 W330	V217-M294 HydrophobicContact CG1-CE 3.64Å; P220-M294 HydrophobicContact CB-CB 3.73Å; P220-M294 HydrophobicContact CB-CG 3.91Å; P220-M294 HydrophobicContact CB-SD 4.25Å; P220-M294 HydrophobicContact CG-CB 3.9Å; P220-M294 HydrophobicContact CG-CG 3.88Å; F267-M294 HydrophobicContact CB-SD 3.78Å; F267-M294 HydrophobicContact CD1-CB 4.21Å; F267-M294 HydrophobicContact CD1-SD 4.22Å; F267-M294 HydrophobicContact CD2-CB 3.65Å; F267-M294 HydrophobicContact CE1-CB 4.42Å; F267-M294 HydrophobicContact CE2-CB 3.9Å; F267-M294 HydrophobicContact CG-CB 3.86Å; F267-M294 HydrophobicContact CG-SD 3.94Å; F267-M294 HydrophobicContact CZ-CB 4.28Å; E270-M294 HydrophobicContact CB-CE 4.28Å; L271-M294 HydrophobicContact CD2-CE 3.91Å; L271-M294 HydrophobicContact CD2-SD 4.26Å; L271-M294 HydrophobicContact CG-CE 4.47Å; L271-M294 HydrophobicContact CG-SD 4.41Å; E290-M294 HydrophobicContact CG-CE 4.3Å; E290-M294 VanDerWaalsContact O-CG 3.31Å; E290-M294 WeakPolarHBondContact O-CG 3.35Å; E290-M294 PolarHBondContact O-N 3.12Å; R291-M294 WeakPolarHBondContact O-CB 3.5Å; R291-M294 PolarHBondContact O-N 2.72Å; L292-M294 VanDerWaalsContact C-N 3.29Å; L292-M294 PolarHBondContact O-N 2.57Å; M294-H297 WeakPolarHBondContact O-CB 3.47Å; M294-H297 PolarHBondContact O-N 3Å; M294-V298 PolarHBondContact O-N 3.45Å; M294-V298 VanDerWaalsContact O-N 3.08Å; M294-W330 HydrophobicContact CE-CG 4.16Å; M294-W330 HydrophobicContact CG-CH2 4.41Å; M294-W330 HydrophobicContact CG-CZ2 3.78Å
295	R	93.4	Very high	92	Very high	9 Å²	9	45.6 Å²	45.6	3%	0.034	22%	0.215	C	C	.	.	H	α-helix	trans	-60.1	-50.8	176.5	-173.1	-167.8	72.7	-167.2	11.6	112.1	D167 E260 E264 F267 R291 L292 H297 V298 M299	D167-R295 IonicContact OD1-NH2 3.71Å; D167-R295 PolarHBondContact OD1-NH2 3.2Å; D167-R295 IonicContact OD2-CZ 2.73Å; D167-R295 IonicContact OD2-NH2 2.74Å; D167-R295 PolarHBondContact OD2-NH2 3.38Å; E260-R295 IonicContact OE2-CZ 2.75Å; E260-R295 IonicContact OE2-NE 3.48Å; E260-R295 IonicContact OE2-NH1 2.68Å; E260-R295 PolarHBondContact OE2-NH1 3.15Å; E260-R295 IonicContact OE2-NH2 2.75Å; E264-R295 HydrophobicContact CG-CB 4.18Å; E264-R295 HydrophobicContact CG-CG 4.28Å; E264-R295 WeakPolarHBondContact OE1-CD 3.37Å; E264-R295 IonicContact OE1-CZ 2.68Å; E264-R295 IonicContact OE1-NE 3.93Å; E264-R295 IonicContact OE1-NH1 2.68Å; E264-R295 PolarHBondContact OE1-NH1 3.11Å; F267-R295 HydrophobicContact CE2-CB 3.94Å; R291-R295 PolarHBondContact O-N 3.37Å; L292-R295 VanDerWaalsContact CD2-NH1 3.3Å; L292-R295 WeakPolarHBondContact O-CB 3.44Å; L292-R295 PolarHBondContact O-N 3.03Å; L292-R295 VanDerWaalsContact O-N 3.15Å; R295-H297 PolarHBondContact O-N 3.23Å; R295-V298 PolarHBondContact O-N 3.13Å; R295-M299 HydrophobicContact CG-CG 4.44Å; R295-M299 PolarHBondContact O-N 2.75Å
296	E	91.3	Very high	91.6	Very high	57 Å²	57	50.4 Å²	50.4	27%	0.266	23%	0.234	S	C	.	.	H	α-helix	trans	-54.3	-42	174.8	-85.9	-175.4	-115.2	0	0	112.1	D167 H171 L292 V298 K300	D167-E296 WeakPolarHBondContact OD2-CG 3.38Å; H171-E296 IonicContact CD2-OE1 2.65Å; H171-E296 IonicContact CE1-OE1 3.64Å; H171-E296 IonicContact NE2-OE1 2.77Å; H171-E296 PolarHBondContact NE2-OE1 2.92Å; L292-E296 PolarHBondContact O-N 2.97Å; E296-V298 VanDerWaalsContact C-N 3.32Å; E296-V298 PolarHBondContact O-N 2.87Å; E296-K300 WeakPolarHBondContact O-CB 3.32Å; E296-K300 PolarHBondContact O-N 2.85Å
297	H	91.8	Very high	91.1	Very high	76 Å²	76	52.6 Å²	52.6	35%	0.352	25%	0.246	S	C	.	.	H	α-helix	trans	-64	-38.8	178.4	-171.8	94.4	0	0	0	111.9	P220 R293 M294 R295 N301 W330	P220-H297 HydrophobicContact CG-CB 4.07Å; R293-H297 WeakPolarHBondContact O-CB 3.4Å; R293-H297 PolarHBondContact O-N 3.47Å; M294-H297 WeakPolarHBondContact O-CB 3.47Å; M294-H297 PolarHBondContact O-N 3Å; R295-H297 PolarHBondContact O-N 3.23Å; H297-N301 PolarHBondContact O-ND2 2.66Å; H297-W330 HydrophobicContact CB-CH2 3.8Å; H297-W330 HydrophobicContact CB-CZ3 3.92Å; H297-W330 AromaticContact CG-CZ3 3.68Å; H297-W330 AromaticContact ND1-CZ3 3.69Å
298	V	91.9	Very high	90.6	Very high	5 Å²	5	54.8 Å²	54.8	3%	0.03	25%	0.253	C	S	.	.	H	α-helix	trans	-69.2	-57.4	175.7	173.6	0	0	0	0	110.3	P220 L263 F267 M294 R295 E296 K300 N301 V302	P220-V298 HydrophobicContact CB-CG2 3.83Å; P220-V298 HydrophobicContact CG-CG2 4.33Å; L263-V298 HydrophobicContact CD1-CG1 4.46Å; L263-V298 HydrophobicContact CD2-CG1 4.29Å; F267-V298 HydrophobicContact CE1-CG2 3.98Å; F267-V298 HydrophobicContact CZ-CB 4.35Å; F267-V298 HydrophobicContact CZ-CG2 3.74Å; M294-V298 PolarHBondContact O-N 3.45Å; M294-V298 VanDerWaalsContact O-N 3.08Å; R295-V298 PolarHBondContact O-N 3.13Å; E296-V298 VanDerWaalsContact C-N 3.32Å; E296-V298 PolarHBondContact O-N 2.87Å; V298-K300 VanDerWaalsContact C-N 3.34Å; V298-K300 PolarHBondContact O-N 3.3Å; V298-N301 CarbonylContact O-C 3.48Å; V298-N301 PolarHBondContact O-N 2.77Å; V298-V302 HydrophobicContact CG1-CB 4.26Å; V298-V302 HydrophobicContact CG1-CG2 3.85Å; V298-V302 WeakPolarHBondContact O-CB 3.4Å; V298-V302 WeakPolarHBondContact O-CG2 3.4Å; V298-V302 PolarHBondContact O-N 2.8Å
299	M	90.8	Very high	90.5	Very high	20 Å²	20	53.6 Å²	53.6	10%	0.099	25%	0.249	C	C	.	.	H	α-helix	trans	-50.7	-52.8	-179	-72.3	-56.5	-162	0	0	111.6	E260 L263 R295 N301 V302 D303 R308 V310	E260-M299 HydrophobicContact CG-CE 3.46Å; E260-M299 VanDerWaalsContact CG-CE 3.46Å; L263-M299 HydrophobicContact CD1-CE 3.54Å; L263-M299 HydrophobicContact CD1-SD 3.88Å; R295-M299 HydrophobicContact CG-CG 4.44Å; R295-M299 PolarHBondContact O-N 2.75Å; M299-N301 PolarHBondContact O-N 2.9Å; M299-V302 PolarHBondContact O-N 3.37Å; M299-D303 WeakPolarHBondContact O-CB 3.32Å; M299-D303 PolarHBondContact O-N 3.2Å; M299-D303 HydrophobicContact SD-CB 4.24Å; M299-R308 WeakPolarHBondContact CE-O 3.42Å; M299-V310 HydrophobicContact SD-CG2 3.8Å
300	K	90.4	Very high	90.5	Very high	173 Å²	173	53.2 Å²	53.2	75%	0.752	25%	0.248	S	C	*	.	H	α-helix	trans	-58.5	-19.4	-179	-174.5	172.1	-176.5	168.3	0	115.5	E296 V298	E296-K300 WeakPolarHBondContact O-CB 3.32Å; E296-K300 PolarHBondContact O-N 2.85Å; V298-K300 VanDerWaalsContact C-N 3.34Å; V298-K300 PolarHBondContact O-N 3.3Å
301	N	89.3	Confident	90.5	Very high	66 Å²	66	54.8 Å²	54.8	35%	0.353	26%	0.259	S	S	.	.	H	α-helix	trans	-118.1	-8.7	-177.4	-67.7	-71.6	0	0	0	113.7	H297 V298 M299 K321 F324	H297-N301 PolarHBondContact O-ND2 2.66Å; V298-N301 CarbonylContact O-C 3.48Å; V298-N301 PolarHBondContact O-N 2.77Å; M299-N301 PolarHBondContact O-N 2.9Å; N301-K321 PolarHBondContact O-NZ 2.93Å; N301-F324 HydrophobicContact CB-CE2 4.29Å; N301-F324 HydrophobicContact CB-CZ 3.82Å
302	V	92	Very high	90.6	Very high	3 Å²	3	53.4 Å²	53.4	2%	0.018	26%	0.256	C	S	.	.	H	α-helix	trans	-117.6	-52.9	-176.9	-176.9	0	0	0	0	111.3	V298 M299 L304 V310 E314 F324	V298-V302 HydrophobicContact CG1-CB 4.26Å; V298-V302 HydrophobicContact CG1-CG2 3.85Å; V298-V302 WeakPolarHBondContact O-CB 3.4Å; V298-V302 WeakPolarHBondContact O-CG2 3.4Å; V298-V302 PolarHBondContact O-N 2.8Å; M299-V302 PolarHBondContact O-N 3.37Å; V302-L304 PolarHBondContact O-N 3.36Å; V302-V310 HydrophobicContact CB-CG2 4.34Å; V302-V310 HydrophobicContact CG1-CB 4.45Å; V302-V310 HydrophobicContact CG1-CG1 3.59Å; V302-V310 HydrophobicContact CG1-CG2 3.94Å; V302-E314 HydrophobicContact CG1-CB 4.38Å; V302-F324 HydrophobicContact CG2-CE1 3.85Å; V302-F324 HydrophobicContact CG2-CZ 3.84Å
303	D	90.9	Very high	90.7	Very high	18 Å²	18	59.4 Å²	59.4	10%	0.096	28%	0.284	C	S	.	.			trans	-64.6	118.1	171.6	172.1	5.4	0	0	0	109	M299 N305 K306 R308	M299-D303 WeakPolarHBondContact O-CB 3.32Å; M299-D303 PolarHBondContact O-N 3.2Å; M299-D303 HydrophobicContact SD-CB 4.24Å; D303-N305 PolarHBondContact OD1-N 2.81Å; D303-K306 WeakPolarHBondContact OD1-CA 3.15Å; D303-K306 PolarHBondContact OD1-N 2.82Å; D303-K306 VanDerWaalsContact OD2-CA 3.26Å; D303-K306 WeakPolarHBondContact OD2-CA 3.16Å; D303-R308 PolarHBondContact OD2-N 3.21Å
304	L	89.6	Confident	90.8	Very high	92 Å²	92	57.6 Å²	57.6	48%	0.482	28%	0.278	S	S	.	.	S	Bend	trans	-102	-17.3	-179.4	-59.2	-180	0	0	0	112.4	V302 E314 K317	V302-L304 PolarHBondContact O-N 3.36Å; L304-E314 HydrophobicContact CB-CG 4.39Å; L304-E314 WeakPolarHBondContact CB-OE1 3.24Å; L304-E314 HydrophobicContact CD1-CG 4.21Å; L304-E314 HydrophobicContact CG-CG 4.12Å; L304-E314 PolarHBondContact N-OE1 3.1Å; L304-K317 HydrophobicContact CD1-CD 3.96Å
305	N	84.9	Confident	90.8	Very high	87 Å²	87	58 Å²	58	47%	0.465	28%	0.279	S	S	.	.	S	Bend	trans	-103.5	-26	-168.8	90.3	68.5	0	0	0	112.4	D303 D307 E314	D303-N305 PolarHBondContact OD1-N 2.81Å; N305-D307 PolarHBondContact ND2-OD1 3.33Å; N305-D307 VanDerWaalsContact ND2-OD1 3.11Å; N305-D307 PolarHBondContact ND2-OD2 3.34Å; N305-D307 VanDerWaalsContact OD1-CB 3.25Å; N305-D307 WeakPolarHBondContact OD1-CB 3.31Å; N305-D307 PolarHBondContact OD1-N 3.43Å; N305-D307 VanDerWaalsContact OD1-N 3.13Å; N305-D307 PolarHBondContact OD1-OD1 2.63Å; N305-D307 PolarHBondContact OD1-OD2 3.36Å; N305-E314 PolarHBondContact N-OE1 2.85Å; N305-E314 PolarHBondContact ND2-OE1 2.78Å
306	K	84.2	Confident	90.8	Very high	179 Å²	179	59.9 Å²	59.9	78%	0.778	29%	0.29	S	S	*	.	S	Bend	trans	74.9	42.4	179.1	-55.9	-168.8	173.3	-163.1	0	115.7	D303	D303-K306 WeakPolarHBondContact OD1-CA 3.15Å; D303-K306 PolarHBondContact OD1-N 2.82Å; D303-K306 VanDerWaalsContact OD2-CA 3.26Å; D303-K306 WeakPolarHBondContact OD2-CA 3.16Å
307	D	81.6	Confident	90.8	Very high	74 Å²	74	61.6 Å²	61.6	40%	0.396	30%	0.297	S	S	.	.	S	Bend	trans	-94.4	-1.4	169.5	61.4	8.4	0	0	0	113.9	N305 L309	N305-D307 PolarHBondContact ND2-OD1 3.33Å; N305-D307 VanDerWaalsContact ND2-OD1 3.11Å; N305-D307 PolarHBondContact ND2-OD2 3.34Å; N305-D307 VanDerWaalsContact OD1-CB 3.25Å; N305-D307 WeakPolarHBondContact OD1-CB 3.31Å; N305-D307 PolarHBondContact OD1-N 3.43Å; N305-D307 VanDerWaalsContact OD1-N 3.13Å; N305-D307 PolarHBondContact OD1-OD1 2.63Å; N305-D307 PolarHBondContact OD1-OD2 3.36Å; D307-L309 PolarHBondContact OD1-N 3.18Å
308	R	84.7	Confident	90.7	Very high	67 Å²	67	58.1 Å²	58.1	25%	0.253	28%	0.281	S	S	.	.	S	Bend	trans	65.9	22.6	-174	-58	174.1	65.9	160.8	-6.5	113.6	L163 E260 M299 D303	L163-R308 PolarHBondContact O-NH1 2.92Å; E260-R308 IonicContact OE1-CZ 2.99Å; E260-R308 IonicContact OE1-NE 2.79Å; E260-R308 PolarHBondContact OE1-NE 3.32Å; E260-R308 IonicContact OE1-NH2 3.18Å; E260-R308 PolarHBondContact OE1-NH2 2.8Å; E260-R308 IonicContact OE2-CZ 3.21Å; E260-R308 IonicContact OE2-NE 2.87Å; E260-R308 IonicContact OE2-NH2 3.7Å; E260-R308 PolarHBondContact OE2-NH2 3.16Å; M299-R308 WeakPolarHBondContact CE-O 3.42Å; D303-R308 PolarHBondContact OD2-N 3.21Å
309	L	90.1	Very high	90.4	Very high	56 Å²	56	58.8 Å²	58.8	29%	0.293	29%	0.285	S	S	.	.			trans	-123.4	149.9	173.5	-57.3	170.8	0	0	0	108.9	V257 D259 D307	V257-L309 HydrophobicContact CB-CB 4.13Å; V257-L309 HydrophobicContact CG1-CB 4.27Å; V257-L309 HydrophobicContact CG2-CB 4.15Å; V257-L309 HydrophobicContact CG2-CD1 4.18Å; V257-L309 HydrophobicContact CG2-CD2 4.12Å; V257-L309 HydrophobicContact CG2-CG 4.36Å; D259-L309 HydrophobicContact CB-CD2 3.95Å; D307-L309 PolarHBondContact OD1-N 3.18Å
310	V	93.8	Very high	90.1	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.317	C	S	.	.			trans	-109.1	104.5	175.9	168.2	0	0	0	0	109.8	F247 V257 L258 L263 M299 V302 F315	F247-V310 WeakPolarHBondContact CE2-O 3.4Å; V257-V310 CarbonylContact C-O 3.54Å; V257-V310 WeakPolarHBondContact CA-O 3.16Å; L258-V310 HydrophobicContact CB-CB 4.32Å; L258-V310 PolarHBondContact N-O 3.28Å; L258-V310 PolarHBondContact O-N 2.94Å; L263-V310 HydrophobicContact CD1-CB 4.28Å; L263-V310 HydrophobicContact CD1-CG2 3.78Å; M299-V310 HydrophobicContact SD-CG2 3.8Å; V302-V310 HydrophobicContact CB-CG2 4.34Å; V302-V310 HydrophobicContact CG1-CB 4.45Å; V302-V310 HydrophobicContact CG1-CG1 3.59Å; V302-V310 HydrophobicContact CG1-CG2 3.94Å; V310-F315 HydrophobicContact CG1-CB 3.88Å; V310-F315 HydrophobicContact CG1-CD2 4.35Å
311	S	96	Very high	89.7	Confident	34 Å²	34	60.1 Å²	60.1	24%	0.238	29%	0.293	C	S	.	.			trans	-69.1	156.4	175	74.2	0	0	0	0	112.3	E313 E314 F315	S311-E313 PolarHBondContact O-N 3.01Å; S311-E314 VanDerWaalsContact CB-OE2 3.28Å; S311-E314 WeakPolarHBondContact CB-OE2 3.46Å; S311-E314 PolarHBondContact N-OE2 2.85Å; S311-E314 PolarHBondContact O-N 2.9Å; S311-E314 VanDerWaalsContact O-N 3.08Å; S311-E314 PolarHBondContact OG-N 2.8Å; S311-E314 PolarHBondContact OG-OE2 2.75Å; S311-F315 PolarHBondContact O-N 2.84Å
312	L	95.6	Very high	88.7	Confident	38 Å²	38	65.9 Å²	65.9	20%	0.199	32%	0.315	C	S	.	.	H	α-helix	trans	-56.8	-30.2	174.1	177.8	63.3	0	0	0	113.1	K244 F247 L316	K244-L312 HydrophobicContact CD-CD2 4.4Å; K244-L312 HydrophobicContact CG-CD1 4.27Å; K244-L312 HydrophobicContact CG-CD2 4.43Å; F247-L312 HydrophobicContact CB-CD1 3.86Å; F247-L312 HydrophobicContact CD1-CB 4.25Å; F247-L312 HydrophobicContact CD1-CD1 3.79Å; F247-L312 HydrophobicContact CD1-CG 4.5Å; F247-L312 HydrophobicContact CD2-CB 4.46Å; F247-L312 HydrophobicContact CD2-CD1 3.96Å; F247-L312 HydrophobicContact CE1-CB 3.91Å; F247-L312 HydrophobicContact CE1-CD1 4.34Å; F247-L312 HydrophobicContact CE2-CB 4.11Å; F247-L312 HydrophobicContact CE2-CD1 4.47Å; F247-L312 HydrophobicContact CG-CD1 3.59Å; F247-L312 HydrophobicContact CZ-CB 3.82Å; L312-L316 HydrophobicContact CD1-CD1 3.87Å; L312-L316 HydrophobicContact CD1-CG 3.97Å; L312-L316 HydrophobicContact CG-CD1 4Å; L312-L316 HydrophobicContact CG-CG 4.47Å; L312-L316 WeakPolarHBondContact O-CB 3.28Å; L312-L316 WeakPolarHBondContact O-CD1 3.26Å; L312-L316 WeakPolarHBondContact O-CG 3.33Å; L312-L316 PolarHBondContact O-N 2.9Å; L312-L316 VanDerWaalsContact O-N 3.13Å
313	E	95.3	Very high	87.5	Confident	138 Å²	138	72.3 Å²	72.3	65%	0.645	34%	0.344	S	S	*	.	H	α-helix	trans	-69.6	-45.9	174.9	-171.7	-179.6	138.9	0	0	110.9	S311 L316 K317	S311-E313 PolarHBondContact O-N 3.01Å; E313-L316 PolarHBondContact O-N 3.03Å; E313-K317 WeakPolarHBondContact O-CB 3.49Å; E313-K317 PolarHBondContact O-N 3.45Å; E313-K317 IonicContact OE1-NZ 3.54Å
314	E	94.9	Very high	86.6	Confident	16 Å²	16	72.3 Å²	72.3	8%	0.075	34%	0.344	C	S	.	.	H	α-helix	trans	-65.1	-41.1	179.5	-77	159.1	132.7	0	0	112.2	V302 L304 N305 S311 K317 S318	V302-E314 HydrophobicContact CG1-CB 4.38Å; L304-E314 HydrophobicContact CB-CG 4.39Å; L304-E314 WeakPolarHBondContact CB-OE1 3.24Å; L304-E314 HydrophobicContact CD1-CG 4.21Å; L304-E314 HydrophobicContact CG-CG 4.12Å; L304-E314 PolarHBondContact N-OE1 3.1Å; N305-E314 PolarHBondContact N-OE1 2.85Å; N305-E314 PolarHBondContact ND2-OE1 2.78Å; S311-E314 VanDerWaalsContact CB-OE2 3.28Å; S311-E314 WeakPolarHBondContact CB-OE2 3.46Å; S311-E314 PolarHBondContact N-OE2 2.85Å; S311-E314 PolarHBondContact O-N 2.9Å; S311-E314 VanDerWaalsContact O-N 3.08Å; S311-E314 PolarHBondContact OG-N 2.8Å; S311-E314 PolarHBondContact OG-OE2 2.75Å; E314-K317 PolarHBondContact O-N 2.91Å; E314-S318 WeakPolarHBondContact O-CB 3.34Å; E314-S318 PolarHBondContact O-N 2.98Å
315	F	94.8	Very high	85.6	Confident	9 Å²	9	71.3 Å²	71.3	4%	0.039	34%	0.344	C	S	.	.	H	α-helix	trans	-61.1	-51.7	173.6	-174.5	-95.4	0	0	0	112.4	L226 P243 F246 F247 L258 V310 S311 K317 S318 T319	L226-F315 HydrophobicContact CD1-CE2 4.25Å; L226-F315 HydrophobicContact CD1-CZ 3.87Å; L226-F315 HydrophobicContact CD2-CE2 4.31Å; L226-F315 HydrophobicContact CD2-CZ 4.25Å; P243-F315 HydrophobicContact CB-CD1 4.49Å; P243-F315 HydrophobicContact CB-CE1 3.84Å; P243-F315 WeakPolarHBondContact O-CE1 3.29Å; F246-F315 HydrophobicContact CD1-CE1 4.41Å; F246-F315 AromaticContact CD1-CZ 3.74Å; F246-F315 HydrophobicContact CD1-CZ 3.74Å; F246-F315 HydrophobicContact CE1-CZ 4.24Å; F247-F315 HydrophobicContact CB-CD1 4.12Å; F247-F315 HydrophobicContact CB-CE1 4.22Å; F247-F315 HydrophobicContact CD2-CB 3.68Å; F247-F315 AromaticContact CD2-CD1 3.87Å; F247-F315 HydrophobicContact CD2-CD1 3.87Å; F247-F315 HydrophobicContact CD2-CD2 4.22Å; F247-F315 AromaticContact CD2-CG 3.66Å; F247-F315 HydrophobicContact CD2-CG 3.66Å; F247-F315 HydrophobicContact CE2-CB 3.93Å; F247-F315 HydrophobicContact CE2-CG 4.35Å; F247-F315 HydrophobicContact CG-CD1 4.48Å; L258-F315 HydrophobicContact CD1-CD2 4.25Å; L258-F315 HydrophobicContact CD1-CE2 4.48Å; V310-F315 HydrophobicContact CG1-CB 3.88Å; V310-F315 HydrophobicContact CG1-CD2 4.35Å; S311-F315 PolarHBondContact O-N 2.84Å; F315-K317 VanDerWaalsContact C-N 3.3Å; F315-K317 PolarHBondContact O-N 2.68Å; F315-S318 PolarHBondContact O-N 2.98Å; F315-S318 PolarHBondContact O-OG 3.01Å; F315-T319 HydrophobicContact CD1-CG2 4.43Å; F315-T319 HydrophobicContact CE1-CG2 4.09Å; F315-T319 HydrophobicContact CZ-CG2 4.3Å; F315-T319 WeakPolarHBondContact O-CG2 3.44Å; F315-T319 PolarHBondContact O-N 3.38Å; F315-T319 VanDerWaalsContact O-N 3.1Å
316	L	93.3	Very high	84.6	Confident	49 Å²	49	74 Å²	74	26%	0.257	36%	0.358	S	S	.	.	H	α-helix	trans	-60.8	-43.9	179	-70.4	172.1	0	0	0	111	P243 K244 L312 E313 S318 T319 E320	P243-L316 HydrophobicContact CB-CD2 3.97Å; P243-L316 HydrophobicContact CG-CD2 3.83Å; K244-L316 HydrophobicContact CB-CD2 4.15Å; L312-L316 HydrophobicContact CD1-CD1 3.87Å; L312-L316 HydrophobicContact CD1-CG 3.97Å; L312-L316 HydrophobicContact CG-CD1 4Å; L312-L316 HydrophobicContact CG-CG 4.47Å; L312-L316 WeakPolarHBondContact O-CB 3.28Å; L312-L316 WeakPolarHBondContact O-CD1 3.26Å; L312-L316 WeakPolarHBondContact O-CG 3.33Å; L312-L316 PolarHBondContact O-N 2.9Å; L312-L316 VanDerWaalsContact O-N 3.13Å; E313-L316 PolarHBondContact O-N 3.03Å; L316-S318 VanDerWaalsContact C-N 3.28Å; L316-S318 PolarHBondContact O-N 2.93Å; L316-T319 PolarHBondContact O-N 3.05Å; L316-T319 PolarHBondContact O-OG1 2.95Å; L316-E320 PolarHBondContact O-N 2.89Å
317	K	91.7	Very high	84.1	Confident	94 Å²	94	68.1 Å²	68.1	41%	0.409	34%	0.339	S	S	.	.	H	α-helix	trans	-67	-21.1	178.2	-174.4	178.9	-176.3	177.6	0	114.1	L304 E313 E314 F315 K321	L304-K317 HydrophobicContact CD1-CD 3.96Å; E313-K317 WeakPolarHBondContact O-CB 3.49Å; E313-K317 PolarHBondContact O-N 3.45Å; E313-K317 IonicContact OE1-NZ 3.54Å; E314-K317 PolarHBondContact O-N 2.91Å; F315-K317 VanDerWaalsContact C-N 3.3Å; F315-K317 PolarHBondContact O-N 2.68Å; K317-K321 WeakPolarHBondContact O-CG 3.35Å
318	S	89.1	Confident	83.8	Confident	3 Å²	3	71.8 Å²	71.8	2%	0.021	35%	0.351	C	S	.	.	H	α-helix	trans	-80.7	-42.9	169.8	74.6	0	0	0	0	111.6	E314 F315 L316 E320 K321	E314-S318 WeakPolarHBondContact O-CB 3.34Å; E314-S318 PolarHBondContact O-N 2.98Å; F315-S318 PolarHBondContact O-N 2.98Å; F315-S318 PolarHBondContact O-OG 3.01Å; L316-S318 VanDerWaalsContact C-N 3.28Å; L316-S318 PolarHBondContact O-N 2.93Å; S318-E320 PolarHBondContact O-N 2.63Å; S318-K321 VanDerWaalsContact O-CB 3.27Å; S318-K321 WeakPolarHBondContact O-CB 3.34Å; S318-K321 PolarHBondContact O-N 2.74Å
319	T	84.9	Confident	83.6	Confident	19 Å²	19	73.9 Å²	73.9	12%	0.117	36%	0.364	C	S	.	.	H	α-helix	trans	-62.6	-25.6	177.5	65.2	0	0	0	0	113.8	L226 P243 F315 L316 K321	L226-T319 HydrophobicContact CD1-CG2 4.05Å; P243-T319 HydrophobicContact CB-CG2 4.15Å; F315-T319 HydrophobicContact CD1-CG2 4.43Å; F315-T319 HydrophobicContact CE1-CG2 4.09Å; F315-T319 HydrophobicContact CZ-CG2 4.3Å; F315-T319 WeakPolarHBondContact O-CG2 3.44Å; F315-T319 PolarHBondContact O-N 3.38Å; F315-T319 VanDerWaalsContact O-N 3.1Å; L316-T319 PolarHBondContact O-N 3.05Å; L316-T319 PolarHBondContact O-OG1 2.95Å; T319-K321 VanDerWaalsContact C-N 3.32Å
320	E	84.4	Confident	83.6	Confident	164 Å²	164	73 Å²	73	77%	0.766	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-15.6	172.4	-71	-173.1	-179.5	0	0	114.3	L316 S318	L316-E320 PolarHBondContact O-N 2.89Å; S318-E320 PolarHBondContact O-N 2.63Å
321	K	82.1	Confident	83.4	Confident	57 Å²	57	76.6 Å²	76.6	25%	0.248	37%	0.373	C	S	.	.	S	Bend	trans	-72.5	134.5	-179.8	-63.2	172.2	-171	175	0	110.7	N301 K317 S318 T319 E323 F324 S325	N301-K321 PolarHBondContact O-NZ 2.93Å; K317-K321 WeakPolarHBondContact O-CG 3.35Å; S318-K321 VanDerWaalsContact O-CB 3.27Å; S318-K321 WeakPolarHBondContact O-CB 3.34Å; S318-K321 PolarHBondContact O-N 2.74Å; T319-K321 VanDerWaalsContact C-N 3.32Å; K321-E323 PolarHBondContact O-N 2.93Å; K321-F324 HydrophobicContact CB-CD2 3.79Å; K321-F324 HydrophobicContact CB-CE2 4.49Å; K321-F324 HydrophobicContact CD-CD2 3.93Å; K321-F324 HydrophobicContact CD-CE2 3.78Å; K321-F324 HydrophobicContact CG-CD2 4.46Å; K321-F324 PolarHBondContact O-N 3.18Å; K321-S325 PolarHBondContact O-N 2.86Å
322	K	68.8	Low	83	Confident	187 Å²	187	75.5 Å²	75.5	81%	0.813	37%	0.365	S	S	*	.	H	α-helix	trans	-61.4	-28.4	177.4	-68.6	-175.9	179.8	179.2	0	113.3	F324 S325 N326	K322-F324 VanDerWaalsContact C-N 3.3Å; K322-F324 PolarHBondContact O-N 2.65Å; K322-S325 PolarHBondContact O-N 2.84Å; K322-N326 PolarHBondContact O-N 3.37Å
323	E	66.3	Low	82.5	Confident	138 Å²	138	74.1 Å²	74.1	65%	0.645	36%	0.358	S	S	*	.	H	α-helix	trans	-61.8	-37.2	175.1	-67.1	108.5	-168.9	0	0	112.1	K321 P327	K321-E323 PolarHBondContact O-N 2.93Å; E323-P327 VanDerWaalsContact O-CA 3.31Å; E323-P327 WeakPolarHBondContact O-CA 3.35Å; E323-P327 WeakPolarHBondContact O-CB 3.33Å; E323-P327 WeakPolarHBondContact O-CD 3.4Å; E323-P327 VanDerWaalsContact O-N 3.16Å
324	F	71.9	Confident	81.9	Confident	18 Å²	18	69.6 Å²	69.6	8%	0.079	34%	0.338	C	S	.	.	H	α-helix	trans	-80.9	-22.1	-179.3	-74.5	-108.4	0	0	0	113	G221 V223 N301 V302 K321 K322	G221-F324 WeakPolarHBondContact O-CD1 3.14Å; V223-F324 PolarHBondContact N-O 3.32Å; N301-F324 HydrophobicContact CB-CE2 4.29Å; N301-F324 HydrophobicContact CB-CZ 3.82Å; V302-F324 HydrophobicContact CG2-CE1 3.85Å; V302-F324 HydrophobicContact CG2-CZ 3.84Å; K321-F324 HydrophobicContact CB-CD2 3.79Å; K321-F324 HydrophobicContact CB-CE2 4.49Å; K321-F324 HydrophobicContact CD-CD2 3.93Å; K321-F324 HydrophobicContact CD-CE2 3.78Å; K321-F324 HydrophobicContact CG-CD2 4.46Å; K321-F324 PolarHBondContact O-N 3.18Å; K322-F324 VanDerWaalsContact C-N 3.3Å; K322-F324 PolarHBondContact O-N 2.65Å
325	S	68.8	Low	81.2	Confident	71 Å²	71	71.5 Å²	71.5	50%	0.497	36%	0.357	S	S	.	.	H	α-helix	trans	-81.9	-19.3	176	-64.5	0	0	0	0	114	K321 K322	K321-S325 PolarHBondContact O-N 2.86Å; K322-S325 PolarHBondContact O-N 2.84Å
326	N	65.4	Low	80.5	Confident	142 Å²	142	76.5 Å²	76.5	76%	0.759	38%	0.378	S	S	*	.	S	Bend	trans	-153.8	57	-178.7	-158.3	63.1	0	0	0	111.7	K322	K322-N326 PolarHBondContact O-N 3.37Å
327	P	72.1	Confident	80.1	Confident	56 Å²	56	80.1 Å²	80.1	36%	0.364	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-70.6	170.3	-176.7	32.9	-38.5	0	0	0	111.9	A219 E323	A219-P327 HydrophobicContact CB-CB 3.71Å; A219-P327 HydrophobicContact CB-CG 3.78Å; E323-P327 VanDerWaalsContact O-CA 3.31Å; E323-P327 WeakPolarHBondContact O-CA 3.35Å; E323-P327 WeakPolarHBondContact O-CB 3.33Å; E323-P327 WeakPolarHBondContact O-CD 3.4Å; E323-P327 VanDerWaalsContact O-N 3.16Å
328	K	75.6	Confident	80	Confident	151 Å²	151	78.7 Å²	78.7	66%	0.657	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-71.6	146.1	163	-164.3	-173.7	-179.8	-172.7	0	109.1	E331	K328-E331 IonicContact NZ-OE1 3.86Å; K328-E331 PolarHBondContact NZ-OE1 3.48Å
329	E	80.6	Confident	80.2	Confident	111 Å²	111	80.8 Å²	80.8	52%	0.519	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-52.9	143.9	167.9	-65.8	167.9	-158.9	0	0	110.4	K216	K216-E329 IonicContact NZ-OE1 3.34Å; K216-E329 PolarHBondContact NZ-OE1 3.49Å; K216-E329 IonicContact NZ-OE2 3.7Å; K216-E329 PolarHBondContact NZ-OE2 3.18Å
330	W	90.3	Very high	80.7	Confident	38 Å²	38	83 Å²	83	14%	0.144	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-68.2	140.8	-175.7	-174	-109.6	0	0	0	111.2	V217 P220 E290 R293 M294 H297	V217-W330 HydrophobicContact CB-CB 4.14Å; V217-W330 HydrophobicContact CG1-CB 3.87Å; V217-W330 HydrophobicContact CG1-CG 4.24Å; V217-W330 PolarHBondContact O-N 3.01Å; P220-W330 HydrophobicContact CG-CE3 4.03Å; P220-W330 HydrophobicContact CG-CH2 4.15Å; P220-W330 HydrophobicContact CG-CZ3 3.78Å; E290-W330 VanDerWaalsContact CD-NE1 3.33Å; E290-W330 WeakPolarHBondContact OE1-CZ2 3.44Å; E290-W330 PolarHBondContact OE1-NE1 3.09Å; R293-W330 HydrophobicContact CB-CZ2 4.1Å; M294-W330 HydrophobicContact CE-CG 4.16Å; M294-W330 HydrophobicContact CG-CH2 4.41Å; M294-W330 HydrophobicContact CG-CZ2 3.78Å; H297-W330 HydrophobicContact CB-CH2 3.8Å; H297-W330 HydrophobicContact CB-CZ3 3.92Å; H297-W330 AromaticContact CG-CZ3 3.68Å; H297-W330 AromaticContact ND1-CZ3 3.69Å
331	E	88.8	Confident	81.3	Confident	75 Å²	75	78.8 Å²	78.8	35%	0.35	40%	0.403	S	S	.	.			trans	-100.8	107.3	177.1	-70.7	-179.2	176	0	0	109.1	R293 K328 K336	R293-E331 PolarHBondContact NH2-O 3.13Å; K328-E331 IonicContact NZ-OE1 3.86Å; K328-E331 PolarHBondContact NZ-OE1 3.48Å; E331-K336 WeakPolarHBondContact OE2-CE 3.32Å; E331-K336 IonicContact OE2-NZ 3.96Å; E331-K336 PolarHBondContact OE2-NZ 3.41Å
332	T	87.7	Confident	81.9	Confident	11 Å²	11	81.9 Å²	81.9	7%	0.067	42%	0.418	C	S	.	.			trans	-62.7	159.3	177.3	39.4	0	0	0	0	113.2	V274 E290 D334 A335	V274-T332 HydrophobicContact CG1-CG2 4.29Å; V274-T332 HydrophobicContact CG2-CG2 4.37Å; E290-T332 WeakPolarHBondContact OE2-CA 3.46Å; T332-D334 VanDerWaalsContact C-N 3.25Å; T332-D334 WeakPolarHBondContact CB-OD1 3.23Å; T332-D334 PolarHBondContact O-N 3.03Å; T332-D334 PolarHBondContact OG1-OD1 3.38Å; T332-A335 VanDerWaalsContact O-CB 3.28Å; T332-A335 WeakPolarHBondContact O-CB 3.25Å; T332-A335 PolarHBondContact O-N 2.88Å; T332-A335 VanDerWaalsContact O-N 3.14Å
333	L	86.8	Confident	83.2	Confident	10 Å²	10	75.8 Å²	75.8	5%	0.052	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-50	-44	179.4	-77.9	167.7	0	0	0	112.6	F174 E286 E289 E290 R293 A335 K336 L338	F174-L333 HydrophobicContact CE1-CD1 4.15Å; F174-L333 HydrophobicContact CE1-CD2 4.09Å; F174-L333 HydrophobicContact CZ-CD1 3.84Å; E286-L333 HydrophobicContact CB-CD1 3.94Å; E286-L333 HydrophobicContact CG-CD1 4.46Å; E286-L333 VanDerWaalsContact O-CD1 3.29Å; E286-L333 WeakPolarHBondContact O-CD1 3.43Å; E289-L333 HydrophobicContact CB-CD1 4.1Å; E289-L333 HydrophobicContact CG-CD1 4.04Å; E289-L333 HydrophobicContact CG-CD2 4.08Å; E290-L333 HydrophobicContact CB-CD1 4.25Å; E290-L333 WeakPolarHBondContact OE2-CG 3.39Å; E290-L333 PolarHBondContact OE2-N 3.18Å; R293-L333 VanDerWaalsContact NH1-CD2 3.3Å; R293-L333 VanDerWaalsContact NH1-CG 3.3Å; L333-A335 PolarHBondContact O-N 2.87Å; L333-K336 PolarHBondContact O-N 3.46Å; L333-L338 HydrophobicContact CD2-CD2 3.87Å
334	D	81.9	Confident	84.6	Confident	42 Å²	42	69.2 Å²	69.2	23%	0.225	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-59.6	-19.6	-176.4	88.5	-75.2	0	0	0	114.4	R212 T332 K336	R212-D334 VanDerWaalsContact CG-OD2 3.31Å; R212-D334 WeakPolarHBondContact CG-OD2 3.33Å; R212-D334 IonicContact CZ-OD2 3.67Å; R212-D334 IonicContact NE-OD2 2.72Å; R212-D334 PolarHBondContact NE-OD2 2.86Å; R212-D334 PolarHBondContact NH2-O 3.34Å; R212-D334 IonicContact NH2-OD2 3.2Å; R212-D334 PolarHBondContact NH2-OD2 3.01Å; T332-D334 VanDerWaalsContact C-N 3.25Å; T332-D334 WeakPolarHBondContact CB-OD1 3.23Å; T332-D334 PolarHBondContact O-N 3.03Å; T332-D334 PolarHBondContact OG1-OD1 3.38Å; D334-K336 VanDerWaalsContact C-N 3.31Å; D334-K336 PolarHBondContact O-N 2.96Å
335	A	79.3	Confident	85.8	Confident	56 Å²	56	73.2 Å²	73.2	46%	0.463	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-75	-16.6	-175.2	0	0	0	0	0	113.3	T332 L333	T332-A335 VanDerWaalsContact O-CB 3.28Å; T332-A335 WeakPolarHBondContact O-CB 3.25Å; T332-A335 PolarHBondContact O-N 2.88Å; T332-A335 VanDerWaalsContact O-N 3.14Å; L333-A335 PolarHBondContact O-N 2.87Å
336	K	80.6	Confident	87.2	Confident	114 Å²	114	78.6 Å²	78.6	50%	0.496	39%	0.391	S	S	.	.	S	Bend	trans	-141.8	135.7	-179.4	-59.9	-173.1	-164.6	76.9	0	112	E331 L333 D334 L338	E331-K336 WeakPolarHBondContact OE2-CE 3.32Å; E331-K336 IonicContact OE2-NZ 3.96Å; E331-K336 PolarHBondContact OE2-NZ 3.41Å; L333-K336 PolarHBondContact O-N 3.46Å; D334-K336 VanDerWaalsContact C-N 3.31Å; D334-K336 PolarHBondContact O-N 2.96Å; K336-L338 PolarHBondContact O-N 2.96Å
337	P	85.9	Confident	88.6	Confident	125 Å²	125	72.6 Å²	72.6	81%	0.812	36%	0.358	S	S	*	.			trans	-60.3	129.2	170.6	-22.2	33.7	0	0	0	112
338	L	89.8	Confident	89.8	Confident	65 Å²	65	70.7 Å²	70.7	34%	0.34	34%	0.344	S	S	.	.	S	Bend	trans	-81.1	-22	-179.1	-63.7	159.4	0	0	0	113.2	F174 E178 L333 K336	F174-L338 HydrophobicContact CD1-CD1 4.38Å; F174-L338 HydrophobicContact CE1-CD1 3.51Å; F174-L338 HydrophobicContact CE1-CD2 4.44Å; F174-L338 HydrophobicContact CZ-CD1 4.22Å; E178-L338 HydrophobicContact CB-CD1 4.41Å; E178-L338 HydrophobicContact CG-CD1 3.86Å; L333-L338 HydrophobicContact CD2-CD2 3.87Å; K336-L338 PolarHBondContact O-N 2.96Å
339	Y	92.9	Very high	90.8	Very high	47 Å²	47	65.1 Å²	65.1	18%	0.184	33%	0.326	C	S	.	.	S	Bend	trans	-141.9	159.3	179.6	57.6	-95.6	0	0	0	110.7	E178 M179 E182 L344	E178-Y339 HydrophobicContact CB-CD1 4.44Å; E178-Y339 HydrophobicContact CB-CE1 3.98Å; M179-Y339 HydrophobicContact CG-CD1 3.51Å; M179-Y339 HydrophobicContact CG-CD2 3.86Å; M179-Y339 HydrophobicContact CG-CE1 3.86Å; M179-Y339 HydrophobicContact CG-CE2 4.19Å; M179-Y339 HydrophobicContact CG-CG 3.52Å; M179-Y339 HydrophobicContact SD-CD2 4.47Å; M179-Y339 HydrophobicContact SD-CG 4.14Å; E182-Y339 WeakPolarHBondContact CB-OH 3.27Å; E182-Y339 WeakPolarHBondContact CG-OH 3.45Å; Y339-L344 HydrophobicContact CD2-CB 3.99Å; Y339-L344 HydrophobicContact CE2-CB 3.99Å; Y339-L344 HydrophobicContact CE2-CD2 3.91Å; Y339-L344 HydrophobicContact CE2-CG 4.4Å
340	T	95.6	Very high	91.5	Very high	65 Å²	65	63.1 Å²	63.1	40%	0.399	32%	0.316	S	S	.	.			trans	-89.2	157.1	172.5	57.4	0	0	0	0	111.8	E342 E343 L344	T340-E342 PolarHBondContact O-N 3.15Å; T340-E343 WeakPolarHBondContact CB-OE2 3.23Å; T340-E343 PolarHBondContact N-OE2 3.14Å; T340-E343 PolarHBondContact O-N 3Å; T340-E343 VanDerWaalsContact OG1-CG 3.28Å; T340-E343 WeakPolarHBondContact OG1-CG 3.44Å; T340-E343 PolarHBondContact OG1-N 2.9Å; T340-E343 PolarHBondContact OG1-OE2 3.23Å; T340-L344 PolarHBondContact O-N 2.98Å
341	E	95.4	Very high	91.7	Very high	75 Å²	75	63.3 Å²	63.3	35%	0.35	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-31.9	174.2	178.2	62.8	-150.2	0	0	111	R186 L344 Q345	R186-E341 IonicContact CZ-OE1 3.89Å; R186-E341 IonicContact CZ-OE2 3.66Å; R186-E341 IonicContact NH1-OE1 3.61Å; R186-E341 PolarHBondContact NH1-OE1 3.35Å; R186-E341 IonicContact NH1-OE2 3.37Å; R186-E341 PolarHBondContact NH1-OE2 3.1Å; R186-E341 IonicContact NH2-OE1 3.73Å; R186-E341 IonicContact NH2-OE2 2.78Å; R186-E341 PolarHBondContact NH2-OE2 3.07Å; E341-L344 PolarHBondContact O-N 3.2Å; E341-Q345 WeakPolarHBondContact O-CB 3.26Å; E341-Q345 VanDerWaalsContact O-CG 3.27Å; E341-Q345 WeakPolarHBondContact O-CG 3.33Å; E341-Q345 PolarHBondContact O-N 3.01Å; E341-Q345 PolarHBondContact OE1-NE2 2.73Å
342	E	96.5	Very high	92	Very high	122 Å²	122	65.1 Å²	65.1	57%	0.57	32%	0.324	S	S	*	.	H	α-helix	trans	-67.2	-30.7	172.9	-66.9	81.6	176.5	0	0	114	T340 R346	T340-E342 PolarHBondContact O-N 3.15Å; E342-R346 WeakPolarHBondContact O-CD 3.3Å; E342-R346 VanDerWaalsContact O-CG 3.25Å; E342-R346 WeakPolarHBondContact O-CG 3.38Å; E342-R346 PolarHBondContact O-N 2.91Å; E342-R346 PolarHBondContact O-NE 2.86Å
343	E	95.5	Very high	92.4	Very high	60 Å²	60	70.2 Å²	70.2	28%	0.28	35%	0.351	S	S	.	.	H	α-helix	trans	-74.3	-46.7	171.5	-77.1	163.9	119.4	0	0	110.7	K175 M179 T340 Q345 R346 F347	K175-E343 VanDerWaalsContact CE-OE1 3.28Å; K175-E343 WeakPolarHBondContact CE-OE1 3.11Å; K175-E343 IonicContact NZ-OE1 2.78Å; K175-E343 PolarHBondContact NZ-OE1 3.29Å; M179-E343 HydrophobicContact SD-CB 4.21Å; T340-E343 WeakPolarHBondContact CB-OE2 3.23Å; T340-E343 PolarHBondContact N-OE2 3.14Å; T340-E343 PolarHBondContact O-N 3Å; T340-E343 VanDerWaalsContact OG1-CG 3.28Å; T340-E343 WeakPolarHBondContact OG1-CG 3.44Å; T340-E343 PolarHBondContact OG1-N 2.9Å; T340-E343 PolarHBondContact OG1-OE2 3.23Å; E343-Q345 VanDerWaalsContact C-N 3.33Å; E343-Q345 PolarHBondContact O-N 2.86Å; E343-R346 WeakPolarHBondContact O-CB 3.46Å; E343-R346 PolarHBondContact O-N 2.69Å; E343-R346 VanDerWaalsContact O-N 3.08Å; E343-F347 PolarHBondContact O-N 3.28Å
344	L	96.5	Very high	92.7	Very high	0 Å²	0	74.2 Å²	74.2	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-58.3	-43.8	177	178.2	59	0	0	0	111.6	M179 E182 Y339 T340 E341 R346 F347 E348	M179-L344 HydrophobicContact CB-CD1 3.85Å; M179-L344 HydrophobicContact CG-CD1 4.13Å; M179-L344 WeakPolarHBondContact O-CD1 3.48Å; E182-L344 HydrophobicContact CB-CD2 4.42Å; E182-L344 HydrophobicContact CG-CD2 3.62Å; Y339-L344 HydrophobicContact CD2-CB 3.99Å; Y339-L344 HydrophobicContact CE2-CB 3.99Å; Y339-L344 HydrophobicContact CE2-CD2 3.91Å; Y339-L344 HydrophobicContact CE2-CG 4.4Å; T340-L344 PolarHBondContact O-N 2.98Å; E341-L344 PolarHBondContact O-N 3.2Å; L344-R346 VanDerWaalsContact C-N 3.27Å; L344-R346 PolarHBondContact O-N 3.45Å; L344-F347 PolarHBondContact O-N 2.9Å; L344-F347 VanDerWaalsContact O-N 3.13Å; L344-E348 HydrophobicContact CD1-CG 4.31Å; L344-E348 HydrophobicContact CG-CG 4.48Å; L344-E348 WeakPolarHBondContact O-CG 3.19Å; L344-E348 PolarHBondContact O-N 3.03Å
345	Q	96.4	Very high	93.2	Very high	102 Å²	102	78.5 Å²	78.5	48%	0.477	39%	0.386	S	S	.	.	H	α-helix	trans	-64.2	-29.5	177.5	-74.2	175.6	19.7	0	0	113.6	E341 E343 A349	E341-Q345 WeakPolarHBondContact O-CB 3.26Å; E341-Q345 VanDerWaalsContact O-CG 3.27Å; E341-Q345 WeakPolarHBondContact O-CG 3.33Å; E341-Q345 PolarHBondContact O-N 3.01Å; E341-Q345 PolarHBondContact OE1-NE2 2.73Å; E343-Q345 VanDerWaalsContact C-N 3.33Å; E343-Q345 PolarHBondContact O-N 2.86Å; Q345-A349 PolarHBondContact O-N 3.36Å
346	R	96.8	Very high	93.9	Very high	184 Å²	184	80.7 Å²	80.7	69%	0.694	39%	0.387	S	S	*	.	H	α-helix	trans	-73.2	-41.7	171.3	-68.3	167.6	-168.7	-165.8	5.2	111.2	E342 E343 L344 A349 E350	E342-R346 WeakPolarHBondContact O-CD 3.3Å; E342-R346 VanDerWaalsContact O-CG 3.25Å; E342-R346 WeakPolarHBondContact O-CG 3.38Å; E342-R346 PolarHBondContact O-N 2.91Å; E342-R346 PolarHBondContact O-NE 2.86Å; E343-R346 WeakPolarHBondContact O-CB 3.46Å; E343-R346 PolarHBondContact O-N 2.69Å; E343-R346 VanDerWaalsContact O-N 3.08Å; L344-R346 VanDerWaalsContact C-N 3.27Å; L344-R346 PolarHBondContact O-N 3.45Å; R346-A349 WeakPolarHBondContact O-CB 3.24Å; R346-A349 PolarHBondContact O-N 2.64Å; R346-A349 VanDerWaalsContact O-N 3.13Å; R346-E350 PolarHBondContact O-N 3.34Å
347	F	96.4	Very high	94.6	Very high	15 Å²	15	81.7 Å²	81.7	7%	0.066	39%	0.394	C	S	.	.	H	α-helix	trans	-63.8	-43.9	176.9	-176.6	-103.9	0	0	0	111.7	R176 M179 L180 E343 L344 A349 E350 L351	R176-F347 HydrophobicContact CB-CE2 4.14Å; R176-F347 HydrophobicContact CB-CZ 4.45Å; R176-F347 HydrophobicContact CG-CD2 4.46Å; R176-F347 HydrophobicContact CG-CE2 4.01Å; M179-F347 HydrophobicContact CB-CD1 3.61Å; M179-F347 HydrophobicContact CB-CE1 3.91Å; M179-F347 HydrophobicContact CB-CG 4.07Å; M179-F347 HydrophobicContact CE-CB 4.06Å; M179-F347 HydrophobicContact CE-CD2 3.96Å; M179-F347 HydrophobicContact CE-CG 3.97Å; M179-F347 HydrophobicContact SD-CB 3.89Å; M179-F347 HydrophobicContact SD-CG 4.23Å; L180-F347 HydrophobicContact CB-CE1 3.93Å; L180-F347 HydrophobicContact CB-CZ 4.15Å; L180-F347 HydrophobicContact CD1-CE1 4.44Å; E343-F347 PolarHBondContact O-N 3.28Å; L344-F347 PolarHBondContact O-N 2.9Å; L344-F347 VanDerWaalsContact O-N 3.13Å; F347-A349 PolarHBondContact O-N 2.96Å; F347-E350 WeakPolarHBondContact O-CB 3.42Å; F347-E350 PolarHBondContact O-N 2.98Å; F347-E350 VanDerWaalsContact O-N 3.15Å; F347-L351 HydrophobicContact CD1-CD1 3.97Å; F347-L351 HydrophobicContact CD1-CG 4.32Å; F347-L351 HydrophobicContact CE1-CD1 3.61Å; F347-L351 HydrophobicContact CE1-CD2 4.42Å; F347-L351 HydrophobicContact CE1-CG 4.06Å; F347-L351 HydrophobicContact CZ-CD1 4.25Å; F347-L351 HydrophobicContact CZ-CD2 4.24Å; F347-L351 HydrophobicContact CZ-CG 4.31Å; F347-L351 WeakPolarHBondContact O-CG 3.23Å; F347-L351 PolarHBondContact O-N 2.8Å
348	E	96	Very high	94.9	Very high	17 Å²	17	81.6 Å²	81.6	8%	0.079	39%	0.385	C	S	.	.	H	α-helix	trans	-60.3	-30.8	171.9	-64.6	-158.5	151.1	0	0	112.7	H183 L344 R352	H183-E348 HydrophobicContact CB-CG 4.42Å; H183-E348 IonicContact CE1-OE1 2.94Å; H183-E348 IonicContact CG-OE1 2.72Å; H183-E348 VanDerWaalsContact ND1-CD 3.32Å; H183-E348 WeakPolarHBondContact ND1-CG 3.45Å; H183-E348 IonicContact ND1-OE1 3.84Å; H183-E348 PolarHBondContact ND1-OE1 3.34Å; L344-E348 HydrophobicContact CD1-CG 4.31Å; L344-E348 HydrophobicContact CG-CG 4.48Å; L344-E348 WeakPolarHBondContact O-CG 3.19Å; L344-E348 PolarHBondContact O-N 3.03Å; E348-R352 WeakPolarHBondContact O-CG 3.41Å; E348-R352 PolarHBondContact O-N 2.99Å; E348-R352 VanDerWaalsContact O-N 3.14Å; E348-R352 PolarHBondContact O-NE 2.56Å; E348-R352 IonicContact OE2-NH1 3.92Å; E348-R352 PolarHBondContact OE2-NH1 3.39Å; E348-R352 VanDerWaalsContact OE2-NH1 3.17Å
349	A	96.6	Very high	95.1	Very high	33 Å²	33	84.2 Å²	84.2	27%	0.273	39%	0.394	S	S	.	.	H	α-helix	trans	-72.5	-44.3	173.8	0	0	0	0	0	111.5	Q345 R346 F347 L351 R352 D353	Q345-A349 PolarHBondContact O-N 3.36Å; R346-A349 WeakPolarHBondContact O-CB 3.24Å; R346-A349 PolarHBondContact O-N 2.64Å; R346-A349 VanDerWaalsContact O-N 3.13Å; F347-A349 PolarHBondContact O-N 2.96Å; A349-L351 VanDerWaalsContact C-N 3.25Å; A349-L351 PolarHBondContact O-N 3.03Å; A349-R352 PolarHBondContact O-N 2.74Å; A349-D353 PolarHBondContact O-N 3.1Å
350	E	95.7	Very high	95.2	Very high	69 Å²	69	89.3 Å²	89.3	32%	0.322	41%	0.413	S	S	.	.	H	α-helix	trans	-56.5	-39.4	173.3	-162.8	-167.7	152.3	0	0	111.5	R176 R346 F347 K354	R176-E350 IonicContact CZ-OE2 2.73Å; R176-E350 IonicContact NH1-OE1 2.67Å; R176-E350 IonicContact NH1-OE2 3.31Å; R176-E350 PolarHBondContact NH1-OE2 2.61Å; R346-E350 PolarHBondContact O-N 3.34Å; F347-E350 WeakPolarHBondContact O-CB 3.42Å; F347-E350 PolarHBondContact O-N 2.98Å; F347-E350 VanDerWaalsContact O-N 3.15Å; E350-K354 WeakPolarHBondContact O-CB 3.35Å; E350-K354 WeakPolarHBondContact O-CD 3.48Å; E350-K354 VanDerWaalsContact O-CG 3.24Å; E350-K354 WeakPolarHBondContact O-CG 3.25Å; E350-K354 PolarHBondContact O-N 2.88Å; E350-K354 VanDerWaalsContact OE1-CE 3.31Å; E350-K354 WeakPolarHBondContact OE1-CE 3.09Å; E350-K354 IonicContact OE1-NZ 2.68Å; E350-K354 PolarHBondContact OE1-NZ 3.42Å
351	L	94.7	Very high	95	Very high	43 Å²	43	90.2 Å²	90.2	23%	0.225	41%	0.411	C	S	.	.	H	α-helix	trans	-66.3	-47.3	174.9	-70.8	-179.7	0	0	0	112.6	L180 H183 F347 A349 K354 E355	L180-L351 HydrophobicContact CD1-CD1 3.92Å; H183-L351 HydrophobicContact CB-CD1 4.5Å; H183-L351 VanDerWaalsContact CD2-CD1 3.44Å; H183-L351 WeakPolarHBondContact CD2-CD1 3.21Å; F347-L351 HydrophobicContact CD1-CD1 3.97Å; F347-L351 HydrophobicContact CD1-CG 4.32Å; F347-L351 HydrophobicContact CE1-CD1 3.61Å; F347-L351 HydrophobicContact CE1-CD2 4.42Å; F347-L351 HydrophobicContact CE1-CG 4.06Å; F347-L351 HydrophobicContact CZ-CD1 4.25Å; F347-L351 HydrophobicContact CZ-CD2 4.24Å; F347-L351 HydrophobicContact CZ-CG 4.31Å; F347-L351 WeakPolarHBondContact O-CG 3.23Å; F347-L351 PolarHBondContact O-N 2.8Å; A349-L351 VanDerWaalsContact C-N 3.25Å; A349-L351 PolarHBondContact O-N 3.03Å; L351-K354 PolarHBondContact O-N 2.94Å; L351-E355 PolarHBondContact O-N 3.48Å
352	R	94.6	Very high	94.9	Very high	112 Å²	112	89.5 Å²	89.5	42%	0.423	42%	0.418	S	S	.	.	H	α-helix	trans	-63.2	-42.1	178.7	-74.3	-179.6	-64.2	-100.2	-1.7	112.5	E348 A349 K354 E355 E356	E348-R352 WeakPolarHBondContact O-CG 3.41Å; E348-R352 PolarHBondContact O-N 2.99Å; E348-R352 VanDerWaalsContact O-N 3.14Å; E348-R352 PolarHBondContact O-NE 2.56Å; E348-R352 IonicContact OE2-NH1 3.92Å; E348-R352 PolarHBondContact OE2-NH1 3.39Å; E348-R352 VanDerWaalsContact OE2-NH1 3.17Å; A349-R352 PolarHBondContact O-N 2.74Å; R352-K354 VanDerWaalsContact C-N 3.32Å; R352-K354 PolarHBondContact O-N 3.13Å; R352-E355 PolarHBondContact O-N 3.22Å; R352-E356 PolarHBondContact O-N 2.84Å
353	D	96.1	Very high	94.8	Very high	118 Å²	118	88.4 Å²	88.4	63%	0.631	41%	0.413	S	S	*	.	H	α-helix	trans	-63.3	-39.8	177.5	-73.2	-13.2	0	0	0	111.1	A349 E356 E357	A349-D353 PolarHBondContact O-N 3.1Å; D353-E356 PolarHBondContact O-N 3.31Å; D353-E357 PolarHBondContact O-N 3.4Å
354	K	92.8	Very high	94.7	Very high	94 Å²	94	89.3 Å²	89.3	41%	0.409	42%	0.423	S	S	.	.	H	α-helix	trans	-67.1	-40.2	172.8	-74.1	171.9	-175.1	173.2	0	112.9	E350 L351 R352 E356 E357 L358	E350-K354 WeakPolarHBondContact O-CB 3.35Å; E350-K354 WeakPolarHBondContact O-CD 3.48Å; E350-K354 VanDerWaalsContact O-CG 3.24Å; E350-K354 WeakPolarHBondContact O-CG 3.25Å; E350-K354 PolarHBondContact O-N 2.88Å; E350-K354 VanDerWaalsContact OE1-CE 3.31Å; E350-K354 WeakPolarHBondContact OE1-CE 3.09Å; E350-K354 IonicContact OE1-NZ 2.68Å; E350-K354 PolarHBondContact OE1-NZ 3.42Å; L351-K354 PolarHBondContact O-N 2.94Å; R352-K354 VanDerWaalsContact C-N 3.32Å; R352-K354 PolarHBondContact O-N 3.13Å; K354-E356 VanDerWaalsContact C-N 3.33Å; K354-E357 PolarHBondContact O-N 2.86Å; K354-L358 WeakPolarHBondContact O-CB 3.25Å; K354-L358 VanDerWaalsContact O-CG 3.29Å; K354-L358 WeakPolarHBondContact O-CG 3.38Å; K354-L358 PolarHBondContact O-N 3.31Å
355	E	92.8	Very high	94.4	Very high	132 Å²	132	92.1 Å²	92.1	62%	0.617	44%	0.437	S	S	*	.	H	α-helix	trans	-61.6	-43.5	175.9	-163.5	-159.3	156.8	0	0	110.5	L351 R352 L358 K359	L351-E355 PolarHBondContact O-N 3.48Å; R352-E355 PolarHBondContact O-N 3.22Å; E355-L358 PolarHBondContact O-N 3.03Å; E355-K359 WeakPolarHBondContact O-CB 3.47Å; E355-K359 PolarHBondContact O-N 3.24Å
356	E	95.4	Very high	94.2	Very high	103 Å²	103	94.9 Å²	94.9	48%	0.481	44%	0.444	S	S	.	.	H	α-helix	trans	-62.3	-41.6	174	-80.4	-150	-151.8	0	0	112.8	R352 D353 K354 R360	R352-E356 PolarHBondContact O-N 2.84Å; D353-E356 PolarHBondContact O-N 3.31Å; K354-E356 VanDerWaalsContact C-N 3.33Å; E356-R360 WeakPolarHBondContact O-CB 3.29Å; E356-R360 WeakPolarHBondContact O-CD 3.47Å; E356-R360 WeakPolarHBondContact O-CG 3.43Å; E356-R360 PolarHBondContact O-N 2.94Å; E356-R360 IonicContact OE2-CZ 2.8Å; E356-R360 IonicContact OE2-NE 3.1Å; E356-R360 IonicContact OE2-NH2 3.9Å; E356-R360 PolarHBondContact OE2-NH2 2.88Å
357	E	94.6	Very high	94.1	Very high	135 Å²	135	91.9 Å²	91.9	63%	0.631	44%	0.437	S	S	*	.	H	α-helix	trans	-62.7	-49.6	175.1	-167	-170.1	152.9	0	0	111.7	D353 K354 K359 R360 K361	D353-E357 PolarHBondContact O-N 3.4Å; K354-E357 PolarHBondContact O-N 2.86Å; E357-K359 VanDerWaalsContact C-N 3.31Å; E357-K359 PolarHBondContact O-N 3.32Å; E357-R360 PolarHBondContact O-N 2.96Å; E357-K361 PolarHBondContact O-N 2.93Å
358	L	91.9	Very high	93.8	Very high	122 Å²	122	95 Å²	95	64%	0.639	45%	0.452	S	S	*	.	H	α-helix	trans	-61.1	-39.6	178.8	-72.7	172.6	0	0	0	111.7	K354 E355 K361 A362	K354-L358 WeakPolarHBondContact O-CB 3.25Å; K354-L358 VanDerWaalsContact O-CG 3.29Å; K354-L358 WeakPolarHBondContact O-CG 3.38Å; K354-L358 PolarHBondContact O-N 3.31Å; E355-L358 PolarHBondContact O-N 3.03Å; L358-K361 PolarHBondContact O-N 3.06Å; L358-A362 WeakPolarHBondContact O-CB 3.26Å; L358-A362 PolarHBondContact O-N 3.33Å
359	K	94.3	Very high	93.6	Very high	121 Å²	121	100.7 Å²	100.7	53%	0.526	48%	0.479	S	S	.	.	H	α-helix	trans	-64.2	-47.4	175	-179.2	178.9	176.8	-178	0	111.9	E355 E357 K361 A362 E363	E355-K359 WeakPolarHBondContact O-CB 3.47Å; E355-K359 PolarHBondContact O-N 3.24Å; E357-K359 VanDerWaalsContact C-N 3.31Å; E357-K359 PolarHBondContact O-N 3.32Å; K359-K361 VanDerWaalsContact C-N 3.28Å; K359-K361 PolarHBondContact O-N 2.93Å; K359-A362 PolarHBondContact O-N 3.29Å; K359-E363 WeakPolarHBondContact CE-OE1 3.07Å; K359-E363 WeakPolarHBondContact O-CG 3.41Å; K359-E363 PolarHBondContact O-N 3Å
360	R	94.9	Very high	93.5	Very high	154 Å²	154	103.6 Å²	103.6	58%	0.581	49%	0.487	S	S	*	.	H	α-helix	trans	-59.2	-40.7	174.9	-68	163.3	-166	-172.8	7.4	110.9	E356 E357 E363 T364	E356-R360 WeakPolarHBondContact O-CB 3.29Å; E356-R360 WeakPolarHBondContact O-CD 3.47Å; E356-R360 WeakPolarHBondContact O-CG 3.43Å; E356-R360 PolarHBondContact O-N 2.94Å; E356-R360 IonicContact OE2-CZ 2.8Å; E356-R360 IonicContact OE2-NE 3.1Å; E356-R360 IonicContact OE2-NH2 3.9Å; E356-R360 PolarHBondContact OE2-NH2 2.88Å; E357-R360 PolarHBondContact O-N 2.96Å; R360-E363 PolarHBondContact O-N 3.35Å; R360-T364 PolarHBondContact O-N 3.1Å; R360-T364 VanDerWaalsContact O-N 3.08Å; R360-T364 PolarHBondContact O-OG1 2.73Å
361	K	91.7	Very high	93.4	Very high	84 Å²	84	106.1 Å²	106.1	37%	0.365	50%	0.502	S	S	.	.	H	α-helix	trans	-66.2	-40.5	174.7	-170.4	177.8	179.4	-176.6	0	112.5	A120 E357 L358 K359 E363 T364 L365	A120-K361 PolarHBondContact O-NZ 3.43Å; E357-K361 PolarHBondContact O-N 2.93Å; L358-K361 PolarHBondContact O-N 3.06Å; K359-K361 VanDerWaalsContact C-N 3.28Å; K359-K361 PolarHBondContact O-N 2.93Å; K361-E363 VanDerWaalsContact C-N 3.34Å; K361-T364 PolarHBondContact O-N 3.35Å; K361-T364 PolarHBondContact O-OG1 2.72Å; K361-L365 HydrophobicContact CG-CD1 4.09Å; K361-L365 HydrophobicContact CG-CG 4.46Å; K361-L365 WeakPolarHBondContact O-CB 3.33Å; K361-L365 VanDerWaalsContact O-CG 3.3Å; K361-L365 WeakPolarHBondContact O-CG 3.03Å; K361-L365 PolarHBondContact O-N 3.37Å
362	A	92.8	Very high	93.3	Very high	59 Å²	59	108.8 Å²	108.8	49%	0.488	52%	0.516	S	S	.	.	H	α-helix	trans	-65.1	-38	175.8	0	0	0	0	0	111.9	L358 K359 R366	L358-A362 WeakPolarHBondContact O-CB 3.26Å; L358-A362 PolarHBondContact O-N 3.33Å; K359-A362 PolarHBondContact O-N 3.29Å; A362-R366 VanDerWaalsContact O-CB 3.32Å; A362-R366 WeakPolarHBondContact O-CB 3.43Å; A362-R366 PolarHBondContact O-N 3.32Å
363	E	94.3	Very high	93.2	Very high	100 Å²	100	112.2 Å²	112.2	47%	0.467	53%	0.528	S	S	.	.	H	α-helix	trans	-64.8	-41.5	174.3	-73.1	175.9	-163.7	0	0	112.1	K359 R360 K361 R366 Q367	K359-E363 WeakPolarHBondContact CE-OE1 3.07Å; K359-E363 WeakPolarHBondContact O-CG 3.41Å; K359-E363 PolarHBondContact O-N 3Å; R360-E363 PolarHBondContact O-N 3.35Å; K361-E363 VanDerWaalsContact C-N 3.34Å; E363-R366 PolarHBondContact O-N 3.15Å; E363-Q367 WeakPolarHBondContact O-CG 3.21Å; E363-Q367 PolarHBondContact O-N 3.28Å; E363-Q367 VanDerWaalsContact O-N 3.13Å
364	T	93.7	Very high	93.2	Very high	79 Å²	79	112 Å²	112	49%	0.485	52%	0.524	S	S	.	.	H	α-helix	trans	-69.1	-43.6	175.4	56.2	0	0	0	0	112.7	R360 K361 R366 Q367 E368	R360-T364 PolarHBondContact O-N 3.1Å; R360-T364 VanDerWaalsContact O-N 3.08Å; R360-T364 PolarHBondContact O-OG1 2.73Å; K361-T364 PolarHBondContact O-N 3.35Å; K361-T364 PolarHBondContact O-OG1 2.72Å; T364-R366 VanDerWaalsContact C-N 3.26Å; T364-R366 PolarHBondContact O-N 2.96Å; T364-Q367 PolarHBondContact O-N 2.66Å; T364-Q367 VanDerWaalsContact O-N 3.15Å; T364-E368 PolarHBondContact O-N 3.39Å
365	L	89.6	Confident	93.2	Very high	59 Å²	59	116 Å²	116	31%	0.309	54%	0.536	S	S	.	.	H	α-helix	trans	-60.4	-35.8	175.5	-74	170.2	0	0	0	112.2	N121 K361 E368 Q369	N121-L365 HydrophobicContact CB-CD2 4.06Å; N121-L365 WeakPolarHBondContact ND2-CD2 3.36Å; K361-L365 HydrophobicContact CG-CD1 4.09Å; K361-L365 HydrophobicContact CG-CG 4.46Å; K361-L365 WeakPolarHBondContact O-CB 3.33Å; K361-L365 VanDerWaalsContact O-CG 3.3Å; K361-L365 WeakPolarHBondContact O-CG 3.03Å; K361-L365 PolarHBondContact O-N 3.37Å; L365-E368 PolarHBondContact O-N 3.13Å; L365-Q369 WeakPolarHBondContact O-CB 3.48Å; L365-Q369 PolarHBondContact O-N 3.26Å
366	R	92.3	Very high	93.1	Very high	160 Å²	160	111.6 Å²	111.6	60%	0.604	53%	0.526	S	S	*	.	H	α-helix	trans	-66.3	-43.9	173.9	180	177.5	170.6	174.3	-2.6	112.2	A362 E363 T364 E368 Q369 E370	A362-R366 VanDerWaalsContact O-CB 3.32Å; A362-R366 WeakPolarHBondContact O-CB 3.43Å; A362-R366 PolarHBondContact O-N 3.32Å; E363-R366 PolarHBondContact O-N 3.15Å; T364-R366 VanDerWaalsContact C-N 3.26Å; T364-R366 PolarHBondContact O-N 2.96Å; R366-E368 VanDerWaalsContact C-N 3.32Å; R366-E368 PolarHBondContact O-N 3.2Å; R366-Q369 PolarHBondContact O-N 3.29Å; R366-E370 IonicContact CZ-OE1 3.4Å; R366-E370 IonicContact NE-OE1 3.22Å; R366-E370 PolarHBondContact NE-OE1 2.73Å; R366-E370 IonicContact NH2-OE1 3.29Å; R366-E370 PolarHBondContact NH2-OE1 3.38Å; R366-E370 WeakPolarHBondContact O-CG 3.39Å; R366-E370 PolarHBondContact O-N 2.9Å
367	Q	94.2	Very high	93.1	Very high	120 Å²	120	112.1 Å²	112.1	56%	0.561	53%	0.527	S	S	*	.	H	α-helix	trans	-61.6	-42.2	175.8	-69.5	170.5	26.1	0	0	111.2	E363 T364 E370 L371	E363-Q367 WeakPolarHBondContact O-CG 3.21Å; E363-Q367 PolarHBondContact O-N 3.28Å; E363-Q367 VanDerWaalsContact O-N 3.13Å; T364-Q367 PolarHBondContact O-N 2.66Å; T364-Q367 VanDerWaalsContact O-N 3.15Å; Q367-E370 PolarHBondContact O-N 2.85Å; Q367-L371 WeakPolarHBondContact O-CB 3.22Å; Q367-L371 WeakPolarHBondContact O-CG 3.48Å; Q367-L371 PolarHBondContact O-N 2.98Å
368	E	90.9	Very high	93.1	Very high	82 Å²	82	108.6 Å²	108.6	38%	0.383	52%	0.521	S	S	.	.	H	α-helix	trans	-61.1	-46.1	173.7	-175.6	178.9	-159.4	0	0	111.8	T364 L365 R366 E370 L371 L372	T364-E368 PolarHBondContact O-N 3.39Å; L365-E368 PolarHBondContact O-N 3.13Å; R366-E368 VanDerWaalsContact C-N 3.32Å; R366-E368 PolarHBondContact O-N 3.2Å; E368-E370 VanDerWaalsContact C-N 3.34Å; E368-E370 PolarHBondContact O-N 3.39Å; E368-L371 PolarHBondContact O-N 3.19Å; E368-L372 HydrophobicContact CG-CD1 3.98Å; E368-L372 HydrophobicContact CG-CG 4.35Å; E368-L372 WeakPolarHBondContact O-CB 3.49Å; E368-L372 VanDerWaalsContact O-CG 3.32Å; E368-L372 WeakPolarHBondContact O-CG 3.26Å; E368-L372 PolarHBondContact O-N 3.29Å
369	Q	91.5	Very high	93.1	Very high	136 Å²	136	107.6 Å²	107.6	64%	0.636	52%	0.515	S	S	*	.	H	α-helix	trans	-61.1	-40.7	177.1	-170.5	-174.7	50.8	0	0	112.2	L365 R366 R373	L365-Q369 WeakPolarHBondContact O-CB 3.48Å; L365-Q369 PolarHBondContact O-N 3.26Å; R366-Q369 PolarHBondContact O-N 3.29Å; Q369-R373 VanDerWaalsContact O-CB 3.28Å; Q369-R373 WeakPolarHBondContact O-CB 3.36Å; Q369-R373 PolarHBondContact O-N 2.85Å
370	E	94.3	Very high	93.1	Very high	94 Å²	94	106.5 Å²	106.5	44%	0.439	51%	0.512	S	S	.	.	H	α-helix	trans	-65.7	-44.7	176.3	-71.8	179	-164.1	0	0	110.8	R366 Q367 E368 R373 E374	R366-E370 IonicContact CZ-OE1 3.4Å; R366-E370 IonicContact NE-OE1 3.22Å; R366-E370 PolarHBondContact NE-OE1 2.73Å; R366-E370 IonicContact NH2-OE1 3.29Å; R366-E370 PolarHBondContact NH2-OE1 3.38Å; R366-E370 WeakPolarHBondContact O-CG 3.39Å; R366-E370 PolarHBondContact O-N 2.9Å; Q367-E370 PolarHBondContact O-N 2.85Å; E368-E370 VanDerWaalsContact C-N 3.34Å; E368-E370 PolarHBondContact O-N 3.39Å; E370-R373 WeakPolarHBondContact O-CB 3.34Å; E370-R373 PolarHBondContact O-N 3.17Å; E370-E374 VanDerWaalsContact O-CG 3.22Å; E370-E374 WeakPolarHBondContact O-CG 3.4Å; E370-E374 PolarHBondContact O-N 3.13Å
371	L	94.8	Very high	93.1	Very high	122 Å²	122	101.3 Å²	101.3	64%	0.639	50%	0.502	S	S	*	.	H	α-helix	trans	-61.2	-45.6	174.2	-73.4	168.3	0	0	0	113.3	Q367 E368 R373 E374 R375	Q367-L371 WeakPolarHBondContact O-CB 3.22Å; Q367-L371 WeakPolarHBondContact O-CG 3.48Å; Q367-L371 PolarHBondContact O-N 2.98Å; E368-L371 PolarHBondContact O-N 3.19Å; L371-R373 VanDerWaalsContact C-N 3.29Å; L371-R373 PolarHBondContact O-N 3.45Å; L371-E374 PolarHBondContact O-N 3.49Å; L371-R375 PolarHBondContact O-N 2.9Å
372	L	92.3	Very high	93.1	Very high	99 Å²	99	103.3 Å²	103.3	52%	0.518	51%	0.513	S	S	.	.	H	α-helix	trans	-62.2	-38	176.4	-73.5	173.2	0	0	0	111.4	E368 R375 G376	E368-L372 HydrophobicContact CG-CD1 3.98Å; E368-L372 HydrophobicContact CG-CG 4.35Å; E368-L372 WeakPolarHBondContact O-CB 3.49Å; E368-L372 VanDerWaalsContact O-CG 3.32Å; E368-L372 WeakPolarHBondContact O-CG 3.26Å; E368-L372 PolarHBondContact O-N 3.29Å; L372-R375 PolarHBondContact O-N 3.3Å; L372-G376 PolarHBondContact O-N 3.29Å
373	R	92.9	Very high	93.1	Very high	183 Å²	183	106.9 Å²	106.9	69%	0.691	52%	0.517	S	S	*	.	H	α-helix	trans	-65.4	-36.9	175.1	-172	-179.8	-175.8	-172.4	3.2	112	Q369 E370 L371 K377	Q369-R373 VanDerWaalsContact O-CB 3.28Å; Q369-R373 WeakPolarHBondContact O-CB 3.36Å; Q369-R373 PolarHBondContact O-N 2.85Å; E370-R373 WeakPolarHBondContact O-CB 3.34Å; E370-R373 PolarHBondContact O-N 3.17Å; L371-R373 VanDerWaalsContact C-N 3.29Å; L371-R373 PolarHBondContact O-N 3.45Å; R373-K377 WeakPolarHBondContact O-CG 3.42Å; R373-K377 PolarHBondContact O-N 2.88Å; R373-K377 VanDerWaalsContact O-N 3.16Å
374	E	95.1	Very high	93.1	Very high	114 Å²	114	109 Å²	109	53%	0.533	52%	0.521	S	S	.	.	H	α-helix	trans	-70.2	-44.3	174.9	-56.7	-128.7	113	0	0	112	E370 L371 G376 K377 A378	E370-E374 VanDerWaalsContact O-CG 3.22Å; E370-E374 WeakPolarHBondContact O-CG 3.4Å; E370-E374 PolarHBondContact O-N 3.13Å; L371-E374 PolarHBondContact O-N 3.49Å; E374-G376 PolarHBondContact O-N 2.75Å; E374-K377 WeakPolarHBondContact O-CB 3.43Å; E374-K377 PolarHBondContact O-N 3.1Å; E374-K377 VanDerWaalsContact O-N 3.14Å; E374-K377 IonicContact OE1-NZ 2.85Å; E374-K377 PolarHBondContact OE1-NZ 3.42Å; E374-A378 PolarHBondContact O-N 3.04Å
375	R	92.4	Very high	93	Very high	178 Å²	178	111.4 Å²	111.4	67%	0.672	53%	0.527	S	S	*	.	H	α-helix	trans	-57.6	-38.3	173.1	-171.3	174.1	-177.2	170	1.3	111.8	L371 L372 A378 L379	L371-R375 PolarHBondContact O-N 2.9Å; L372-R375 PolarHBondContact O-N 3.3Å; R375-A378 PolarHBondContact O-N 2.82Å; R375-L379 HydrophobicContact CG-CD1 4.37Å; R375-L379 PolarHBondContact O-N 3.24Å
376	G	92.3	Very high	93	Very high	39 Å²	39	116.5 Å²	116.5	40%	0.402	54%	0.543	S	S	.	.	H	α-helix	trans	-61.4	-47.3	173.1	0	0	0	0	0	113.4	L372 E374 A378 L379 E380	L372-G376 PolarHBondContact O-N 3.29Å; E374-G376 PolarHBondContact O-N 2.75Å; G376-A378 VanDerWaalsContact C-N 3.32Å; G376-A378 PolarHBondContact O-N 3.23Å; G376-L379 PolarHBondContact O-N 3.31Å; G376-E380 PolarHBondContact O-N 3.18Å
377	K	95.3	Very high	92.9	Very high	115 Å²	115	114.4 Å²	114.4	50%	0.5	54%	0.54	S	S	.	.	H	α-helix	trans	-58.1	-44	174.4	-62.9	166.3	-162	163.5	0	111.4	R373 E374 E380 A381	R373-K377 WeakPolarHBondContact O-CG 3.42Å; R373-K377 PolarHBondContact O-N 2.88Å; R373-K377 VanDerWaalsContact O-N 3.16Å; E374-K377 WeakPolarHBondContact O-CB 3.43Å; E374-K377 PolarHBondContact O-N 3.1Å; E374-K377 VanDerWaalsContact O-N 3.14Å; E374-K377 IonicContact OE1-NZ 2.85Å; E374-K377 PolarHBondContact OE1-NZ 3.42Å; K377-E380 PolarHBondContact O-N 2.78Å; K377-A381 PolarHBondContact O-N 3.24Å
378	A	93.6	Very high	92.7	Very high	61 Å²	61	115.2 Å²	115.2	50%	0.504	54%	0.544	S	S	.	.	H	α-helix	trans	-64.9	-42.9	-179	0	0	0	0	0	112.2	E374 R375 G376 E380 A381 Q382	E374-A378 PolarHBondContact O-N 3.04Å; R375-A378 PolarHBondContact O-N 2.82Å; G376-A378 VanDerWaalsContact C-N 3.32Å; G376-A378 PolarHBondContact O-N 3.23Å; A378-E380 VanDerWaalsContact C-N 3.33Å; A378-E380 PolarHBondContact O-N 2.71Å; A378-A381 PolarHBondContact O-N 2.9Å; A378-Q382 WeakPolarHBondContact O-CB 3.42Å; A378-Q382 PolarHBondContact O-N 2.89Å
379	L	92.3	Very high	92.7	Very high	100 Å²	100	113.6 Å²	113.6	52%	0.524	54%	0.544	S	S	.	.	H	α-helix	trans	-61.5	-38.6	172.5	-98.3	150.5	0	0	0	112.4	R375 G376 K383	R375-L379 HydrophobicContact CG-CD1 4.37Å; R375-L379 PolarHBondContact O-N 3.24Å; G376-L379 PolarHBondContact O-N 3.31Å; L379-K383 VanDerWaalsContact O-CB 3.29Å; L379-K383 WeakPolarHBondContact O-CB 3.31Å; L379-K383 PolarHBondContact O-N 3.2Å
380	E	94.3	Very high	92.7	Very high	99 Å²	99	110.1 Å²	110.1	46%	0.463	53%	0.533	S	S	.	.	H	α-helix	trans	-69.2	-40	176.3	-150.9	-156.7	146.2	0	0	112.3	G376 K377 A378 K383 R384	G376-E380 PolarHBondContact O-N 3.18Å; K377-E380 PolarHBondContact O-N 2.78Å; A378-E380 VanDerWaalsContact C-N 3.33Å; A378-E380 PolarHBondContact O-N 2.71Å; E380-K383 PolarHBondContact O-N 3.15Å; E380-R384 VanDerWaalsContact O-CG 3.28Å; E380-R384 WeakPolarHBondContact O-CG 3.45Å; E380-R384 PolarHBondContact O-N 3.32Å; E380-R384 IonicContact OE1-CZ 3.86Å; E380-R384 IonicContact OE1-NE 3.97Å; E380-R384 PolarHBondContact OE1-NE 2.78Å; E380-R384 IonicContact OE1-NH2 3.65Å; E380-R384 PolarHBondContact OE1-NH2 2.67Å; E380-R384 IonicContact OE2-NH2 2.58Å
381	A	94.1	Very high	92.5	Very high	44 Å²	44	110.7 Å²	110.7	36%	0.364	54%	0.538	S	S	.	.	H	α-helix	trans	-60.7	-51.3	174	0	0	0	0	0	111.4	K377 A378 K383 R384 E385	K377-A381 PolarHBondContact O-N 3.24Å; A378-A381 PolarHBondContact O-N 2.9Å; A381-K383 VanDerWaalsContact C-N 3.27Å; A381-K383 PolarHBondContact O-N 3.41Å; A381-R384 WeakPolarHBondContact O-CB 3.46Å; A381-R384 PolarHBondContact O-N 3.21Å; A381-E385 WeakPolarHBondContact O-CG 3.46Å; A381-E385 PolarHBondContact O-N 2.98Å
382	Q	91.7	Very high	92.2	Very high	127 Å²	127	110.2 Å²	110.2	59%	0.593	53%	0.533	S	S	*	.	H	α-helix	trans	-56.8	-40.1	176.2	-172.6	-176.4	42.2	0	0	112.1	A378 E385 Y386	A378-Q382 WeakPolarHBondContact O-CB 3.42Å; A378-Q382 PolarHBondContact O-N 2.89Å; Q382-E385 PolarHBondContact O-N 2.86Å; Q382-Y386 WeakPolarHBondContact O-CB 3.31Å; Q382-Y386 PolarHBondContact O-N 2.71Å
383	K	92.6	Very high	91.7	Very high	134 Å²	134	111.1 Å²	111.1	58%	0.583	54%	0.535	S	S	*	.	H	α-helix	trans	-64.9	-40	175.9	-175.9	177.7	179.8	179.9	0	112.3	L379 E380 A381 Q387	L379-K383 VanDerWaalsContact O-CB 3.29Å; L379-K383 WeakPolarHBondContact O-CB 3.31Å; L379-K383 PolarHBondContact O-N 3.2Å; E380-K383 PolarHBondContact O-N 3.15Å; A381-K383 VanDerWaalsContact C-N 3.27Å; A381-K383 PolarHBondContact O-N 3.41Å; K383-Q387 WeakPolarHBondContact O-CB 3.49Å; K383-Q387 VanDerWaalsContact O-CG 3.29Å; K383-Q387 WeakPolarHBondContact O-CG 3.2Å; K383-Q387 PolarHBondContact O-N 3.05Å
384	R	94.3	Very high	91.4	Very high	143 Å²	143	104.9 Å²	104.9	54%	0.54	52%	0.52	S	S	.	.	H	α-helix	trans	-67.6	-43.3	176.1	-70.3	167.4	178.5	-146.1	6.7	111.5	E380 A381 Q387 Q388	E380-R384 VanDerWaalsContact O-CG 3.28Å; E380-R384 WeakPolarHBondContact O-CG 3.45Å; E380-R384 PolarHBondContact O-N 3.32Å; E380-R384 IonicContact OE1-CZ 3.86Å; E380-R384 IonicContact OE1-NE 3.97Å; E380-R384 PolarHBondContact OE1-NE 2.78Å; E380-R384 IonicContact OE1-NH2 3.65Å; E380-R384 PolarHBondContact OE1-NH2 2.67Å; E380-R384 IonicContact OE2-NH2 2.58Å; A381-R384 WeakPolarHBondContact O-CB 3.46Å; A381-R384 PolarHBondContact O-N 3.21Å; R384-Q387 PolarHBondContact O-N 3.25Å; R384-Q388 WeakPolarHBondContact O-CG 3.26Å; R384-Q388 PolarHBondContact O-N 3.4Å
385	E	91.6	Very high	90.8	Very high	130 Å²	130	104.6 Å²	104.6	61%	0.607	52%	0.519	S	S	*	.	H	α-helix	trans	-60.4	-47.4	174.8	-71.7	173.3	-178.4	0	0	111.6	A381 Q382 Q387 Q388 A389	A381-E385 WeakPolarHBondContact O-CG 3.46Å; A381-E385 PolarHBondContact O-N 2.98Å; Q382-E385 PolarHBondContact O-N 2.86Å; E385-Q387 VanDerWaalsContact C-N 3.35Å; E385-Q387 PolarHBondContact O-N 3.27Å; E385-Q388 PolarHBondContact O-N 3.28Å; E385-A389 PolarHBondContact O-N 2.88Å
386	Y	89.9	Confident	90.2	Very high	166 Å²	166	103 Å²	103	65%	0.651	51%	0.513	S	S	*	.	H	α-helix	trans	-59.7	-43.3	176.1	-178	-97.4	0	0	0	112.2	Q382 Q388 A389 V390	Q382-Y386 WeakPolarHBondContact O-CB 3.31Å; Q382-Y386 PolarHBondContact O-N 2.71Å; Y386-Q388 VanDerWaalsContact C-N 3.35Å; Y386-Q388 PolarHBondContact O-N 3.2Å; Y386-A389 PolarHBondContact O-N 3.33Å; Y386-V390 HydrophobicContact CD1-CG2 4.23Å; Y386-V390 HydrophobicContact CE1-CG2 3.81Å; Y386-V390 HydrophobicContact CE2-CG2 4.3Å; Y386-V390 WeakPolarHBondContact O-CG2 3.4Å; Y386-V390 PolarHBondContact O-N 3.35Å
387	Q	90.1	Very high	89.4	Confident	116 Å²	116	107.2 Å²	107.2	54%	0.542	52%	0.522	S	S	.	.	H	α-helix	trans	-61.3	-40.5	175	-77.6	176.8	-20.7	0	0	112.5	K383 R384 E385 L391	K383-Q387 WeakPolarHBondContact O-CB 3.49Å; K383-Q387 VanDerWaalsContact O-CG 3.29Å; K383-Q387 WeakPolarHBondContact O-CG 3.2Å; K383-Q387 PolarHBondContact O-N 3.05Å; R384-Q387 PolarHBondContact O-N 3.25Å; E385-Q387 VanDerWaalsContact C-N 3.35Å; E385-Q387 PolarHBondContact O-N 3.27Å; Q387-L391 WeakPolarHBondContact O-CB 3.23Å; Q387-L391 PolarHBondContact O-N 2.8Å; Q387-L391 VanDerWaalsContact O-N 3.13Å
388	Q	90.7	Very high	88.5	Confident	138 Å²	138	107.6 Å²	107.6	65%	0.645	52%	0.524	S	S	*	.	H	α-helix	trans	-65.4	-45.9	175.9	-71.7	176.6	10.5	0	0	111.8	R384 E385 Y386 V390 L391 E392	R384-Q388 WeakPolarHBondContact O-CG 3.26Å; R384-Q388 PolarHBondContact O-N 3.4Å; E385-Q388 PolarHBondContact O-N 3.28Å; Y386-Q388 VanDerWaalsContact C-N 3.35Å; Y386-Q388 PolarHBondContact O-N 3.2Å; Q388-V390 PolarHBondContact O-N 3.31Å; Q388-L391 PolarHBondContact O-N 3.08Å; Q388-L391 VanDerWaalsContact O-N 3.15Å; Q388-E392 PolarHBondContact O-N 2.77Å
389	A	90.6	Very high	87.5	Confident	47 Å²	47	110.4 Å²	110.4	39%	0.388	53%	0.526	S	S	.	.	H	α-helix	trans	-62.2	-40.9	179.1	0	0	0	0	0	112.9	E385 Y386 L391 E392 M393	E385-A389 PolarHBondContact O-N 2.88Å; Y386-A389 PolarHBondContact O-N 3.33Å; A389-L391 VanDerWaalsContact C-N 3.33Å; A389-L391 PolarHBondContact O-N 2.85Å; A389-E392 PolarHBondContact O-N 3.02Å; A389-M393 WeakPolarHBondContact O-CG 3.46Å; A389-M393 PolarHBondContact O-N 2.93Å
390	V	91.1	Very high	86.2	Confident	64 Å²	64	112 Å²	112	39%	0.388	53%	0.531	S	S	.	.	H	α-helix	trans	-63	-39.9	173.9	169.6	0	0	0	0	111.4	Y386 Q388 S394	Y386-V390 HydrophobicContact CD1-CG2 4.23Å; Y386-V390 HydrophobicContact CE1-CG2 3.81Å; Y386-V390 HydrophobicContact CE2-CG2 4.3Å; Y386-V390 WeakPolarHBondContact O-CG2 3.4Å; Y386-V390 PolarHBondContact O-N 3.35Å; Q388-V390 PolarHBondContact O-N 3.31Å; V390-S394 PolarHBondContact O-N 3Å
391	L	90.2	Very high	84.5	Confident	105 Å²	105	114.6 Å²	114.6	55%	0.55	54%	0.543	S	S	.	.	H	α-helix	trans	-70.8	-40.2	-179.9	-155.5	160.3	0	0	0	111.4	Q387 Q388 A389 S394 Q395	Q387-L391 WeakPolarHBondContact O-CB 3.23Å; Q387-L391 PolarHBondContact O-N 2.8Å; Q387-L391 VanDerWaalsContact O-N 3.13Å; Q388-L391 PolarHBondContact O-N 3.08Å; Q388-L391 VanDerWaalsContact O-N 3.15Å; A389-L391 VanDerWaalsContact C-N 3.33Å; A389-L391 PolarHBondContact O-N 2.85Å; L391-S394 PolarHBondContact O-N 2.97Å; L391-Q395 HydrophobicContact CD2-CG 4.26Å; L391-Q395 PolarHBondContact O-N 3.3Å
392	E	88.1	Confident	82.8	Confident	113 Å²	113	120.1 Å²	120.1	53%	0.528	56%	0.561	S	S	.	*	H	α-helix	trans	-61.2	-48.3	172.3	-166.7	-161.7	135.9	0	0	111.4	Q388 A389 S394 Q395 R396	Q388-E392 PolarHBondContact O-N 2.77Å; A389-E392 PolarHBondContact O-N 3.02Å; E392-S394 VanDerWaalsContact C-N 3.27Å; E392-S394 PolarHBondContact O-N 3.19Å; E392-Q395 PolarHBondContact O-N 3.37Å; E392-Q395 VanDerWaalsContact O-N 3.15Å; E392-R396 WeakPolarHBondContact O-CB 3.44Å; E392-R396 PolarHBondContact O-N 3.44Å; E392-R396 IonicContact OE1-NH1 2.82Å
393	M	83.3	Confident	80.9	Confident	117 Å²	117	118.1 Å²	118.1	58%	0.576	57%	0.566	S	S	*	*	H	α-helix	trans	-58	-39.3	176.4	-75.7	-165.8	-67.8	0	0	112.2	A389 R396 Q397	A389-M393 WeakPolarHBondContact O-CG 3.46Å; A389-M393 PolarHBondContact O-N 2.93Å; M393-R396 PolarHBondContact O-N 2.9Å; M393-Q397 PolarHBondContact O-N 3.14Å
394	S	85.4	Confident	78.7	Confident	53 Å²	53	114.3 Å²	114.3	37%	0.371	57%	0.566	S	S	.	*	H	α-helix	trans	-65.3	-42	176.1	-170.6	0	0	0	0	112.7	V390 L391 E392 K398	V390-S394 PolarHBondContact O-N 3Å; L391-S394 PolarHBondContact O-N 2.97Å; E392-S394 VanDerWaalsContact C-N 3.27Å; E392-S394 PolarHBondContact O-N 3.19Å; S394-K398 WeakPolarHBondContact O-CG 3.13Å; S394-K398 PolarHBondContact O-N 3.45Å; S394-K398 VanDerWaalsContact O-N 3.14Å
395	Q	82.9	Confident	76.2	Confident	107 Å²	107	115.4 Å²	115.4	50%	0.5	58%	0.582	S	S	.	*	H	α-helix	trans	-63.7	-42	173.5	-70.4	-171.7	43	0	0	111.7	L391 E392 Q397 K398 Q399	L391-Q395 HydrophobicContact CD2-CG 4.26Å; L391-Q395 PolarHBondContact O-N 3.3Å; E392-Q395 PolarHBondContact O-N 3.37Å; E392-Q395 VanDerWaalsContact O-N 3.15Å; Q395-Q397 PolarHBondContact O-N 3.1Å; Q395-K398 PolarHBondContact O-N 2.97Å; Q395-K398 VanDerWaalsContact O-N 3.16Å; Q395-Q399 WeakPolarHBondContact O-CG 3.12Å; Q395-Q399 PolarHBondContact O-N 3.06Å
396	R	80.1	Confident	73.6	Confident	146 Å²	146	112.2 Å²	112.2	55%	0.551	58%	0.584	S	S	*	*	H	α-helix	trans	-66.5	-35.7	-178.9	-161.6	167.4	-179	167.3	-3.7	112.3	E392 M393 Q400	E392-R396 WeakPolarHBondContact O-CB 3.44Å; E392-R396 PolarHBondContact O-N 3.44Å; E392-R396 IonicContact OE1-NH1 2.82Å; M393-R396 PolarHBondContact O-N 2.9Å; R396-Q400 WeakPolarHBondContact O-CG 3.41Å; R396-Q400 PolarHBondContact O-N 2.99Å; R396-Q400 VanDerWaalsContact O-N 3.12Å
397	Q	76.1	Confident	70.9	Confident	126 Å²	126	113.6 Å²	113.6	59%	0.589	60%	0.596	S	S	*	*	H	α-helix	trans	-64	-44.8	169.1	-79.5	-174.7	-20.7	0	0	112.3	M393 Q395 Q400 Q401	M393-Q397 PolarHBondContact O-N 3.14Å; Q395-Q397 PolarHBondContact O-N 3.1Å; Q397-Q400 PolarHBondContact O-N 2.81Å; Q397-Q401 WeakPolarHBondContact O-CG 3.29Å; Q397-Q401 PolarHBondContact O-N 2.89Å
398	K	75.4	Confident	68.6	Low	124 Å²	124	113.7 Å²	113.7	54%	0.539	61%	0.607	S	S	.	*	H	α-helix	trans	-61.4	-44.9	177.2	-72.6	179.1	179.5	-177	0	112.1	S394 Q395 Q400 Q401 E402	S394-K398 WeakPolarHBondContact O-CG 3.13Å; S394-K398 PolarHBondContact O-N 3.45Å; S394-K398 VanDerWaalsContact O-N 3.14Å; Q395-K398 PolarHBondContact O-N 2.97Å; Q395-K398 VanDerWaalsContact O-N 3.16Å; K398-Q400 VanDerWaalsContact C-N 3.28Å; K398-Q400 PolarHBondContact O-N 3.01Å; K398-Q401 WeakPolarHBondContact O-CB 3.45Å; K398-Q401 PolarHBondContact O-N 2.93Å; K398-E402 WeakPolarHBondContact O-CG 3.49Å; K398-E402 PolarHBondContact O-N 3.31Å
399	Q	72.9	Confident	66.2	Low	119 Å²	119	113.1 Å²	113.1	56%	0.556	62%	0.615	S	S	*	*	H	α-helix	trans	-60.5	-36	175.2	-71.2	174.9	1.9	0	0	112.5	Q395 A403	Q395-Q399 WeakPolarHBondContact O-CG 3.12Å; Q395-Q399 PolarHBondContact O-N 3.06Å; Q399-A403 VanDerWaalsContact O-CB 3.24Å; Q399-A403 WeakPolarHBondContact O-CB 3.39Å; Q399-A403 PolarHBondContact O-N 2.72Å
400	Q	64.3	Low	63.6	Low	134 Å²	134	115.7 Å²	115.7	63%	0.626	64%	0.637	S	S	*	*	H	α-helix	trans	-71.2	-29	174.1	-74.3	176.2	-6.2	0	0	113.2	R396 Q397 K398 G404	R396-Q400 WeakPolarHBondContact O-CG 3.41Å; R396-Q400 PolarHBondContact O-N 2.99Å; R396-Q400 VanDerWaalsContact O-N 3.12Å; Q397-Q400 PolarHBondContact O-N 2.81Å; K398-Q400 VanDerWaalsContact C-N 3.28Å; K398-Q400 PolarHBondContact O-N 3.01Å; Q400-G404 WeakPolarHBondContact O-CA 3.41Å; Q400-G404 PolarHBondContact O-N 3.06Å; Q400-G404 VanDerWaalsContact O-N 3.17Å
401	Q	60.1	Low	60.9	Low	153 Å²	153	116.2 Å²	116.2	72%	0.715	66%	0.655	S	S	*	*	H	α-helix	trans	-75.1	-39.5	172	-71.5	176.8	-20.7	0	0	112	Q397 K398 G404	Q397-Q401 WeakPolarHBondContact O-CG 3.29Å; Q397-Q401 PolarHBondContact O-N 2.89Å; K398-Q401 WeakPolarHBondContact O-CB 3.45Å; K398-Q401 PolarHBondContact O-N 2.93Å; Q401-G404 PolarHBondContact O-N 3.41Å
402	E	56.6	Low	58.4	Low	161 Å²	161	118.6 Å²	118.6	75%	0.752	67%	0.668	S	S	*	*	H	α-helix	trans	-72.9	-36.5	178.5	-70.8	175.6	166.5	0	0	112.8	K398 G404	K398-E402 WeakPolarHBondContact O-CG 3.49Å; K398-E402 PolarHBondContact O-N 3.31Å; E402-G404 PolarHBondContact O-N 3.41Å
403	A	52.7	Low	55.9	Low	84 Å²	84	120.8 Å²	120.8	69%	0.694	68%	0.683	S	S	*	*	S	Bend	trans	-74.9	-11.9	168.8	0	0	0	0	0	113.1	Q399 N405	Q399-A403 VanDerWaalsContact O-CB 3.24Å; Q399-A403 WeakPolarHBondContact O-CB 3.39Å; Q399-A403 PolarHBondContact O-N 2.72Å; A403-N405 PolarHBondContact O-N 3.4Å
404	G	46.1	Very low	54.2	Low	55 Å²	55	119.1 Å²	119.1	57%	0.567	70%	0.695	S	S	*	*			trans	-76.8	32.8	-171.6	0	0	0	0	0	116.2	Q400 Q401 E402	Q400-G404 WeakPolarHBondContact O-CA 3.41Å; Q400-G404 PolarHBondContact O-N 3.06Å; Q400-G404 VanDerWaalsContact O-N 3.17Å; Q401-G404 PolarHBondContact O-N 3.41Å; E402-G404 PolarHBondContact O-N 3.41Å
405	N	42.1	Very low	51.6	Low	166 Å²	166	125.5 Å²	125.5	89%	0.888	72%	0.719	S	S	*	*			trans	-116.8	34.5	176.3	-156.8	17.8	0	0	0	112.9	A403	A403-N405 PolarHBondContact O-N 3.4Å
406	G	36.3	Very low	49.3	Very low	63 Å²	63	128.3 Å²	128.3	65%	0.649	74%	0.737	S	S	*	*	S	Bend	trans	-135.5	135	172	0	0	0	0	0	110.4
407	Q	34.2	Very low	46.9	Very low	194 Å²	194	129.4 Å²	129.4	91%	0.907	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-75.9	148.8	-170.4	-70.5	168.2	-91.7	0	0	113.5
408	P	40.6	Very low	44.8	Very low	119 Å²	119	132.5 Å²	132.5	77%	0.773	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-85.3	143.8	-176.9	33.6	-35.3	0	0	0	113.3
409	P	42.1	Very low	42.7	Very low	125 Å²	125	134.7 Å²	134.7	81%	0.812	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-85.7	135.7	158.1	33.4	-29.8	0	0	0	110.5
410	A	35.4	Very low	41	Very low	102 Å²	102	134.1 Å²	134.1	84%	0.843	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-85.4	143.1	176	0	0	0	0	0	112.1
411	G	34	Very low	39.4	Very low	75 Å²	75	136.3 Å²	136.3	77%	0.773	79%	0.789	S	S	*	*			trans	-130.3	130.6	166.9	0	0	0	0	0	109.7
412	L	36.8	Very low	38	Very low	155 Å²	155	134.7 Å²	134.7	81%	0.812	79%	0.79	S	S	*	*			trans	-83.6	160.7	-175.8	-78.4	87.6	0	0	0	112.7
413	N	36.5	Very low	36.8	Very low	159 Å²	159	135.6 Å²	135.6	85%	0.85	79%	0.794	S	S	*	*			trans	68.4	77.5	170.1	-56.2	-15	0	0	0	115.3
414	G	47.4	Very low	35.8	Very low	81 Å²	81	141 Å²	141	84%	0.835	80%	0.802	S	S	*	*			trans	-80	117.9	171.7	0	0	0	0	0	113.4
415	Q	31.4	Very low	35.6	Very low	187 Å²	187	142.9 Å²	142.9	87%	0.874	80%	0.804	S	S	*	*			trans	-147.5	114.3	154.1	-98.4	-177.8	-0.4	0	0	108.3
416	L	33.9	Very low	35	Very low	166 Å²	166	144.5 Å²	144.5	87%	0.869	81%	0.806	S	S	*	*			trans	-98.3	103.3	171	-94.1	168	0	0	0	109.2
417	Q	29.1	Very low	34.6	Very low	169 Å²	169	149.5 Å²	149.5	79%	0.79	81%	0.813	S	S	*	*			trans	-93.6	104	-175.2	-172.1	176.5	35.9	0	0	110.2
418	F	34	Very low	34.4	Very low	191 Å²	191	148.8 Å²	148.8	84%	0.838	81%	0.813	S	S	*	*			trans	-82.8	126	169	-80.6	-91.3	0	0	0	110.1
419	Q	30.5	Very low	33.8	Very low	170 Å²	170	151.8 Å²	151.8	79%	0.794	81%	0.814	S	S	*	*			trans	-119.9	115	-179.1	-174.8	167.6	84	0	0	109.8
420	P	36.1	Very low	33.2	Very low	107 Å²	107	152 Å²	152	70%	0.695	81%	0.813	S	S	*	*			trans	-77.8	139.6	-179.7	30.5	-33.4	0	0	0	111.7
421	Q	32.6	Very low	33.2	Very low	180 Å²	180	153 Å²	153	84%	0.841	81%	0.811	S	S	*	*			trans	-66.3	131.2	171.8	-77.8	-81.8	-17.3	0	0	110.5
422	T	29.9	Very low	32.8	Very low	120 Å²	120	153.5 Å²	153.5	74%	0.736	81%	0.807	S	S	*	*			trans	-113.1	117.2	-176.6	42.8	0	0	0	0	112
423	H	31.4	Very low	32.4	Very low	180 Å²	180	155.3 Å²	155.3	83%	0.833	81%	0.812	S	S	*	*			trans	-123.5	132.8	163.8	-72.3	-11.9	0	0	0	109.4
424	K	31.1	Very low	32	Very low	198 Å²	198	152.8 Å²	152.8	86%	0.861	81%	0.812	S	S	*	*			trans	-167.8	158.5	-168.9	-147.4	-161.1	176.6	-172.1	0	108.1
425	P	41.3	Very low	31.1	Very low	94 Å²	94	158.2 Å²	158.2	61%	0.61	82%	0.816	S	S	*	*				-119.8	175.1	-64.8	37.7	-26.4	0	0	0	111.3
426	E	29.8	Very low	31.2	Very low	200 Å²	200	157.1 Å²	157.1	94%	0.935	82%	0.816	S	S	*	*			trans	-127.6	142	142.7	-79.6	-165.8	134.5	0	0	109.6
427	E	28.9	Very low	31	Very low	168 Å²	168	156 Å²	156	79%	0.785	81%	0.811	S	S	*	*			trans	-107.4	150.6	178.2	-60.9	178.3	104	0	0	110.2
428	I	29.3	Very low	31.2	Very low	178 Å²	178	155.8 Å²	155.8	91%	0.913	82%	0.815	S	S	*	*			trans	-159.4	157.1	140.2	-98.7	144.8	0	0	0	107.7
429	K	29.1	Very low	31.4	Very low	182 Å²	182	152 Å²	152	79%	0.791	81%	0.81	S	S	*	*			trans	-95.8	143.8	-149.3	-69.7	173.4	176.4	173.5	0	117
430	V	29.9	Very low	31.5	Very low	130 Å²	130	148.8 Å²	148.8	79%	0.788	81%	0.812	S	S	*	*			trans	-25.1	150.8	143.3	-89.5	0	0	0	0	115.8
431	P	34.3	Very low	31.6	Very low	124 Å²	124	152.4 Å²	152.4	81%	0.805	82%	0.82	S	S	*	*				-138.3	171.1	59.5	31.2	-10.2	0	0	0	116.4
432	A	26	Very low	31.8	Very low	84 Å²	84	149 Å²	149	69%	0.694	81%	0.813	S	S	*	*			cis	-166.5	-167.5	-18.1	0	0	0	0	0	109.7
433	E	27.8	Very low	32.2	Very low	194 Å²	194	149.4 Å²	149.4	91%	0.907	82%	0.818	S	S	*	*			trans	84.8	166.7	172.4	-54.5	-167.1	158.8	0	0	118.1
434	A	29.5	Very low	32.4	Very low	105 Å²	105	150.2 Å²	150.2	87%	0.868	82%	0.822	S	S	*	*			trans	64.5	57.4	-172.6	0	0	0	0	0	117.3
435	Q	28	Very low	32.6	Very low	195 Å²	195	148.2 Å²	148.2	91%	0.911	82%	0.82	S	S	*	*			trans	-79.2	117.7	152.2	-83.2	-172.4	-36.1	0	0	109.8
436	N	32.4	Very low	32.2	Very low	164 Å²	164	151.2 Å²	151.2	88%	0.877	83%	0.831	S	S	*	*			trans	-135	105	163.7	-157.5	-4.2	0	0	0	107.6
437	N	30.8	Very low	32.6	Very low	142 Å²	142	147.1 Å²	147.1	76%	0.759	82%	0.821	S	S	*	*			trans	-154.6	108.1	-165.2	-157.5	30.1	0	0	0	110.9
438	L	32.8	Very low	33.3	Very low	165 Å²	165	146.9 Å²	146.9	86%	0.864	82%	0.824	S	S	*	*			trans	-129.3	124	166.2	-77.4	175.4	0	0	0	108.3
439	P	38.6	Very low	33.5	Very low	113 Å²	113	146.7 Å²	146.7	73%	0.734	82%	0.819	S	S	*	*			trans	-80.1	151.1	-178.5	33.3	-34.9	0	0	0	111.7
440	A	32.3	Very low	33.8	Very low	102 Å²	102	148 Å²	148	84%	0.843	84%	0.842	S	S	*	*			trans	-95.1	112	168.7	0	0	0	0	0	110.2
441	E	37.3	Very low	34	Very low	183 Å²	183	148.9 Å²	148.9	86%	0.855	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-91.4	138.2	166.3	-73.4	-162.5	120.7	0	0	111.5
442	P	37.3	Very low	34	Very low	107 Å²	107	150.2 Å²	150.2	70%	0.695	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-84.3	147.7	168	34.4	-32.6	0	0	0	111.1	Q444	P442-Q444 PolarHBondContact O-N 2.68Å
443	P	37.7	Very low	34.5	Very low	130 Å²	130	153.8 Å²	153.8	84%	0.844	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-70	120.3	-177.5	28.1	-34.5	0	0	0	112.1
444	Q	36.2	Very low	34.9	Very low	197 Å²	197	151.5 Å²	151.5	92%	0.921	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-80.1	133	164	-64.8	-169.4	13.8	0	0	109.8	P442	P442-Q444 PolarHBondContact O-N 2.68Å
445	N	34.7	Very low	35.2	Very low	155 Å²	155	154.4 Å²	154.4	83%	0.829	85%	0.851	S	S	*	*			trans	-139.3	99.8	-180	-168.7	-2.4	0	0	0	109.3
446	L	33.3	Very low	35.7	Very low	158 Å²	158	151.7 Å²	151.7	83%	0.827	85%	0.847	S	S	*	*			trans	-141	144.7	174.5	-80.6	176.6	0	0	0	110
447	P	39.4	Very low	35.9	Very low	114 Å²	114	150.8 Å²	150.8	74%	0.74	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-83.9	152.6	-173.7	34.5	-35.9	0	0	0	112.6
448	I	43.2	Very low	36.3	Very low	163 Å²	163	151.5 Å²	151.5	84%	0.836	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-103.2	127.4	166.6	-62.6	178.4	0	0	0	108.8
449	H	33.2	Very low	36.6	Very low	173 Å²	173	150.3 Å²	150.3	80%	0.801	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-101	140.1	169.7	-117.2	-82.1	0	0	0	108.5
450	T	35.9	Very low	36.4	Very low	209 Å²	209	153.7 Å²	153.7	100%	1.282	86%	0.861	S	S	*	*			trans	64.2	0	175.9	26.1	0	0	0	0	116.9

Retrieved 450 of 450 residues in 200.1 ms (Link to these results)

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