A0A096LWS3_POEFO Loading...

Nuclear receptor subfamily 5, group A, member 2

AlphaFold DB , UniProt , Accession A0A096LWS3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 502 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.2	Very low	27.7	Very low	253 Å²	253	145.6 Å²	145.6	100%	1.246	81%	0.814	S	S	*	*				0	143.7	0	-77.1	176.1	163.4	0	0	108.1
2	L	27.3	Very low	27.4	Very low	148 Å²	148	146.2 Å²	146.2	78%	0.775	81%	0.813	S	S	*	*			trans	-80.7	176.8	-175.7	-79.6	162.8	0	0	0	111.7	K4	L2-K4 HydrophobicContact CD2-CB 3.83Å; L2-K4 HydrophobicContact CD2-CD 4.38Å; L2-K4 HydrophobicContact CD2-CG 3.92Å
3	P	34	Very low	27.2	Very low	118 Å²	118	144.5 Å²	144.5	77%	0.766	81%	0.809	S	S	*	*			cis	-120	163.7	11.5	13.2	13	0	0	0	114.1
4	K	27	Very low	26.9	Very low	132 Å²	132	150.3 Å²	150.3	57%	0.574	81%	0.812	S	S	*	*			cis	61.4	101.5	30.1	-91.8	-143.7	171.3	-155.6	0	117.6	L2 E6	L2-K4 HydrophobicContact CD2-CB 3.83Å; L2-K4 HydrophobicContact CD2-CD 4.38Å; L2-K4 HydrophobicContact CD2-CG 3.92Å; K4-E6 WeakPolarHBondContact CE-OE1 3.33Å; K4-E6 WeakPolarHBondContact CE-OE2 3.24Å; K4-E6 IonicContact NZ-OE1 2.75Å; K4-E6 PolarHBondContact NZ-OE1 2.77Å; K4-E6 IonicContact NZ-OE2 2.63Å; K4-E6 PolarHBondContact NZ-OE2 2.65Å
5	V	26.8	Very low	26.7	Very low	142 Å²	142	146.4 Å²	146.4	86%	0.861	80%	0.801	S	S	*	*			trans	-135.6	124.6	137	-178.3	0	0	0	0	107.7
6	E	26.8	Very low	26.7	Very low	131 Å²	131	151.4 Å²	151.4	61%	0.612	81%	0.806	S	S	*	*			trans	-109.6	151.2	168.4	-68.1	148.3	150.9	0	0	108.2	K4	K4-E6 WeakPolarHBondContact CE-OE1 3.33Å; K4-E6 WeakPolarHBondContact CE-OE2 3.24Å; K4-E6 IonicContact NZ-OE1 2.75Å; K4-E6 PolarHBondContact NZ-OE1 2.77Å; K4-E6 IonicContact NZ-OE2 2.63Å; K4-E6 PolarHBondContact NZ-OE2 2.65Å
7	T	27.2	Very low	26.8	Very low	144 Å²	144	146.5 Å²	146.5	88%	0.883	80%	0.8	S	S	*	*			trans	-152.2	129.6	152.6	8.2	0	0	0	0	110.4
8	E	26.5	Very low	26.7	Very low	182 Å²	182	149.5 Å²	149.5	85%	0.85	81%	0.807	S	S	*	*			trans	-104.4	160.5	-174.8	-56.7	171.1	111.7	0	0	112.5
9	S	25.7	Very low	27	Very low	106 Å²	106	152.2 Å²	152.2	74%	0.741	81%	0.814	S	S	*	*			trans	-173.9	121.2	139.3	12.7	0	0	0	0	109.4
10	L	25.6	Very low	26.9	Very low	175 Å²	175	148.1 Å²	148.1	92%	0.916	81%	0.809	S	S	*	*				56.1	134.9	91.9	-58.1	165.6	0	0	0	112.6
11	G	23.4	Very low	27	Very low	71 Å²	71	150.1 Å²	150.1	73%	0.732	81%	0.813	S	S	*	*			cis	133.9	153.2	22.2	0	0	0	0	0	108
12	L	24.6	Very low	26.7	Very low	152 Å²	152	146.1 Å²	146.1	80%	0.796	79%	0.794	S	S	*	*			cis	-168.2	138.5	-0.5	-104.3	167.7	0	0	0	109.7
13	T	24.2	Very low	26.8	Very low	125 Å²	125	144.6 Å²	144.6	77%	0.767	79%	0.792	S	S	*	*			trans	67.8	166.3	161.8	71.5	0	0	0	0	118.3
14	R	24.1	Very low	26.9	Very low	225 Å²	225	150.3 Å²	150.3	85%	0.849	80%	0.799	S	S	*	*			cis	-164.5	165.3	13.4	-147.2	170.1	-174.6	-175.2	1.8	113.5
15	S	23.3	Very low	27	Very low	92 Å²	92	150.2 Å²	150.2	64%	0.643	80%	0.804	S	S	*	*			trans	74	151	158.3	84.1	0	0	0	0	118
16	Y	26.8	Very low	27.1	Very low	227 Å²	227	152.1 Å²	152.1	89%	0.89	81%	0.809	S	S	*	*			cis	-128.3	164.4	-13.4	-74.8	-97.4	0	0	0	106
17	G	28	Very low	27.3	Very low	67 Å²	67	153.9 Å²	153.9	69%	0.691	82%	0.817	S	S	*	*			cis	112.2	61.8	18.1	0	0	0	0	0	112.9
18	E	26.1	Very low	27.4	Very low	201 Å²	201	150.7 Å²	150.7	94%	0.939	81%	0.805	S	S	*	*			trans	-163.7	162.6	158.1	-120.2	172.4	176.6	0	0	114.6
19	Q	31.6	Very low	27.5	Very low	200 Å²	200	148 Å²	148	94%	0.935	80%	0.804	S	S	*	*			trans	-88.9	140.6	-170.3	-64.4	170.4	-15.1	0	0	112.5
20	G	25.7	Very low	27.5	Very low	70 Å²	70	150.7 Å²	150.7	72%	0.722	81%	0.805	S	S	*	*			trans	-147.1	117.2	-178.5	0	0	0	0	0	114.3
21	H	29.1	Very low	27.5	Very low	192 Å²	192	149.9 Å²	149.9	89%	0.889	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-56.5	131.6	177.9	-149	76	0	0	0	112.8
22	M	27.7	Very low	27.7	Very low	169 Å²	169	155.7 Å²	155.7	83%	0.833	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-92.6	134	172.5	-81.4	-71.1	154.6	0	0	111.5
23	P	29.5	Very low	27.8	Very low	115 Å²	115	156.4 Å²	156.4	75%	0.747	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-82.6	135.7	-170.6	31.7	-34.6	0	0	0	113.5
24	R	34.6	Very low	28.1	Very low	239 Å²	239	157.7 Å²	157.7	90%	0.902	81%	0.806	S	S	*	*			trans	-78.5	113.6	162.3	-77.8	178.5	167.6	-178.9	-4	110.1
25	N	30.5	Very low	28.1	Very low	130 Å²	130	154.8 Å²	154.8	70%	0.695	81%	0.807	S	S	*	*				161.9	113	127.8	-92.9	-46.1	0	0	0	112.1
26	L	29.1	Very low	28.4	Very low	181 Å²	181	159.8 Å²	159.8	95%	0.948	81%	0.813	S	S	*	*			trans	-134.5	101.6	137.2	-90.3	109.6	0	0	0	106.9	A28	L26-A28 PolarHBondContact O-N 3.33Å
27	Q	29.5	Very low	28.5	Very low	168 Å²	168	153.1 Å²	153.1	79%	0.785	80%	0.799	S	S	*	*			trans	-69.5	122.1	171.5	-93	174.2	-30.4	0	0	109
28	A	30	Very low	29.2	Very low	78 Å²	78	156.6 Å²	156.6	65%	0.645	79%	0.793	S	S	*	*			trans	-61.5	155.4	163.6	0	0	0	0	0	110	L26 Q30	L26-A28 PolarHBondContact O-N 3.33Å; A28-Q30 PolarHBondContact O-N 3.12Å
29	P	27.5	Very low	29.7	Very low	125 Å²	125	152.8 Å²	152.8	81%	0.812	78%	0.779	S	S	*	*			trans	-62.8	106.1	179.3	-16.8	29.9	0	0	0	109.6	L31	P29-L31 PolarHBondContact O-N 2.83Å
30	Q	26	Very low	30.4	Very low	163 Å²	163	151.5 Å²	151.5	76%	0.762	77%	0.773	S	S	*	*			trans	-70.1	96.7	177.1	-165.6	174.4	20	0	0	107.8	A28 K32	A28-Q30 PolarHBondContact O-N 3.12Å; Q30-K32 PolarHBondContact O-N 3.34Å
31	L	27	Very low	31.4	Very low	158 Å²	158	155.3 Å²	155.3	83%	0.827	78%	0.777	S	S	*	*			trans	-59.1	105.4	171.2	-133.5	90.9	0	0	0	106.8	P29 M33	P29-L31 PolarHBondContact O-N 2.83Å; L31-M33 VanDerWaalsContact C-N 3.26Å; L31-M33 PolarHBondContact O-N 3.43Å
32	K	26	Very low	32.4	Very low	193 Å²	193	153.2 Å²	153.2	84%	0.839	77%	0.771	S	S	*	*			trans	-68.7	90.9	172.6	-76.5	-175.3	174.4	-178.3	0	107.8	Q30 M34	Q30-K32 PolarHBondContact O-N 3.34Å; K32-M34 PolarHBondContact O-N 2.84Å
33	M	27.1	Very low	34	Very low	166 Å²	166	149.4 Å²	149.4	82%	0.818	75%	0.754	S	S	*	*			trans	-52	127.2	156.6	-77.1	176.8	54.8	0	0	107.2	L31 D35	L31-M33 VanDerWaalsContact C-N 3.26Å; L31-M33 PolarHBondContact O-N 3.43Å; M33-D35 PolarHBondContact O-N 3.18Å; M33-D35 VanDerWaalsContact O-N 3.14Å
34	M	30.2	Very low	36.4	Very low	153 Å²	153	148.2 Å²	148.2	75%	0.754	74%	0.739	S	S	*	*			trans	-65.7	112.4	168.4	-83.8	171.8	150.8	0	0	107.5	K32 Y36	K32-M34 PolarHBondContact O-N 2.84Å; M34-Y36 VanDerWaalsContact C-N 3.29Å; M34-Y36 HydrophobicContact CB-CD2 4.19Å; M34-Y36 HydrophobicContact CB-CE2 4.04Å; M34-Y36 PolarHBondContact O-N 2.7Å
35	D	25.1	Very low	39.3	Very low	163 Å²	163	142.4 Å²	142.4	87%	0.872	72%	0.723	S	S	*	*			trans	-57.4	99.9	157.6	-87	-39.2	0	0	0	107.3	M33 S37	M33-D35 PolarHBondContact O-N 3.18Å; M33-D35 VanDerWaalsContact O-N 3.14Å; D35-S37 VanDerWaalsContact C-N 3.25Å; D35-S37 PolarHBondContact O-N 2.73Å
36	Y	29.5	Very low	42.4	Very low	198 Å²	198	136.3 Å²	136.3	78%	0.776	69%	0.691	S	S	*	*			trans	-75.2	88.9	163	-85.7	-82.6	0	0	0	107.1	M34 Y38	M34-Y36 VanDerWaalsContact C-N 3.29Å; M34-Y36 HydrophobicContact CB-CD2 4.19Å; M34-Y36 HydrophobicContact CB-CE2 4.04Å; M34-Y36 PolarHBondContact O-N 2.7Å; Y36-Y38 PolarHBondContact O-N 3.17Å
37	S	29.2	Very low	45.5	Very low	86 Å²	86	130.6 Å²	130.6	60%	0.601	66%	0.664	S	S	*	*			trans	-52.6	128.5	170.2	54.4	0	0	0	0	109.4	D35 D39	D35-S37 VanDerWaalsContact C-N 3.25Å; D35-S37 PolarHBondContact O-N 2.73Å; S37-D39 PolarHBondContact O-N 3.46Å; S37-D39 PolarHBondContact OG-OD2 2.65Å
38	Y	41.8	Very low	48.8	Very low	140 Å²	140	122.6 Å²	122.6	55%	0.549	63%	0.627	S	S	.	*			trans	-72.3	75.9	172.7	-111.7	-106	0	0	0	109.1	Y36 E40 I146 G150	Y36-Y38 PolarHBondContact O-N 3.17Å; Y38-E40 PolarHBondContact O-N 2.76Å; Y38-I146 PolarHBondContact OH-O 2.97Å; Y38-I146 VanDerWaalsContact OH-O 3.06Å; Y38-G150 VanDerWaalsContact OH-CA 3.3Å; Y38-G150 WeakPolarHBondContact OH-CA 3.21Å
39	D	37.2	Very low	51.9	Low	121 Å²	121	119 Å²	119	65%	0.647	60%	0.597	S	S	*	*			trans	-80.6	96.5	169.3	-86.3	-61.2	0	0	0	109.7	S37	S37-D39 PolarHBondContact O-N 3.46Å; S37-D39 PolarHBondContact OG-OD2 2.65Å
40	E	46.6	Very low	55.2	Low	174 Å²	174	114.9 Å²	114.9	81%	0.813	58%	0.577	S	S	*	*			trans	-57.5	144.8	156.3	-64	-171.4	110.6	0	0	109.5	Y38	Y38-E40 PolarHBondContact O-N 2.76Å
41	D	45.6	Very low	58.5	Low	149 Å²	149	108.1 Å²	108.1	80%	0.797	55%	0.546	S	S	*	.			trans	55.5	60.2	179.1	-69.5	-16.6	0	0	0	117.6	D43	D41-D43 PolarHBondContact O-N 2.75Å
42	L	50.7	Low	61.7	Low	149 Å²	149	106.1 Å²	106.1	78%	0.78	53%	0.531	S	S	*	.			trans	-59.4	85.1	142.8	-77.9	177.1	0	0	0	110.2	E44	L42-E44 PolarHBondContact O-N 2.73Å
43	D	60.5	Low	65	Low	88 Å²	88	98.3 Å²	98.3	47%	0.471	50%	0.499	S	S	.	.			trans	-59.4	98.5	174.6	-158.5	23.1	0	0	0	108.7	D41 M45 K52	D41-D43 PolarHBondContact O-N 2.75Å; D43-M45 PolarHBondContact O-N 3.37Å; D43-K52 WeakPolarHBondContact OD1-CE 3.47Å; D43-K52 IonicContact OD1-NZ 3.99Å; D43-K52 PolarHBondContact OD1-NZ 2.95Å; D43-K52 VanDerWaalsContact OD2-CE 3.32Å; D43-K52 WeakPolarHBondContact OD2-CE 3.41Å; D43-K52 IonicContact OD2-NZ 2.74Å; D43-K52 PolarHBondContact OD2-NZ 2.74Å
44	E	81.2	Confident	68.2	Low	91 Å²	91	93.4 Å²	93.4	43%	0.425	48%	0.482	S	S	.	.			trans	-62.1	115	-158.4	-154.6	169.3	172	0	0	111	L42 V53 L61 K139	L42-E44 PolarHBondContact O-N 2.73Å; E44-V53 WeakPolarHBondContact O-CB 3.26Å; E44-V53 WeakPolarHBondContact O-CG2 3.4Å; E44-V53 PolarHBondContact O-N 3.15Å; E44-L61 HydrophobicContact CG-CD1 4.38Å; E44-L61 WeakPolarHBondContact OE1-CD1 3.42Å; E44-L61 WeakPolarHBondContact OE2-CD1 3.26Å; E44-K139 IonicContact OE1-NZ 3.5Å; E44-K139 PolarHBondContact OE1-NZ 3.26Å
45	M	94.4	Very high	71	Confident	117 Å²	117	87.2 Å²	87.2	58%	0.576	46%	0.457	S	S	*	.	B	Isolated β-bridge	trans	-87.9	142.1	-171.8	-78.7	-66.3	-131	0	0	112.5	D43 P47 G50	D43-M45 PolarHBondContact O-N 3.37Å; M45-P47 WeakPolarHBondContact O-CD 3.13Å; M45-G50 VanDerWaalsContact CE-O 3.24Å; M45-G50 WeakPolarHBondContact CE-O 3.39Å
46	C	95.7	Very high	74.2	Confident	1 Å²	1	81.4 Å²	81.4	1%	0.007	42%	0.423	C	S	.	.			trans	-65.8	117.4	-178.3	175.5	0	0	0	0	111.2	V48 C49 G50 D51 V53 C63	C46-V48 PolarHBondContact O-N 3.03Å; C46-C49 PolarHBondContact O-N 2.79Å; C46-G50 PolarHBondContact O-N 2.93Å; C46-D51 WeakPolarHBondContact CB-O 3.36Å; C46-D51 PolarHBondContact N-O 2.91Å; C46-V53 HydrophobicContact CB-CG2 4.33Å; C46-C63 HydrophobicContact CB-CB 3.88Å; C46-C63 PolarHBondContact SG-N 2.97Å; C46-C63 VanDerWaalsContact SG-N 3.36Å
47	P	95.2	Very high	77.2	Confident	61 Å²	61	73 Å²	73	40%	0.396	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-17.4	-171.5	25.7	-35.4	0	0	0	113.8	M45 L60 L61 K105 V109	M45-P47 WeakPolarHBondContact O-CD 3.13Å; P47-L60 HydrophobicContact CG-CD1 3.63Å; P47-L61 WeakPolarHBondContact CD-O 3.39Å; P47-K105 WeakPolarHBondContact O-CE 3.06Å; P47-V109 HydrophobicContact CB-CB 4.33Å; P47-V109 HydrophobicContact CB-CG1 4.06Å; P47-V109 HydrophobicContact CG-CB 4.25Å; P47-V109 HydrophobicContact CG-CG1 4.47Å; P47-V109 HydrophobicContact CG-CG2 4.27Å
48	V	97.6	Very high	80.3	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-39.5	173.2	-175.6	0	0	0	0	111.9	C46 T62 C66 I90 R102 K105 V109 M111	C46-V48 PolarHBondContact O-N 3.03Å; V48-T62 HydrophobicContact CG2-CG2 4.49Å; V48-C66 HydrophobicContact CB-CB 4.43Å; V48-C66 HydrophobicContact CG2-CB 4.45Å; V48-I90 HydrophobicContact CG1-CG2 4.18Å; V48-I90 WeakPolarHBondContact O-CG2 3.21Å; V48-R102 HydrophobicContact CG1-CG 4.21Å; V48-K105 VanDerWaalsContact O-CD 3.29Å; V48-K105 WeakPolarHBondContact O-CD 3.13Å; V48-K105 WeakPolarHBondContact O-CE 3.39Å; V48-K105 PolarHBondContact O-NZ 2.91Å; V48-V109 HydrophobicContact CG2-CG2 3.63Å; V48-M111 HydrophobicContact CG2-SD 4.39Å
49	C	96.6	Very high	82.5	Confident	3 Å²	3	64.3 Å²	64.3	2%	0.02	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-151	7.3	-164.7	68.5	0	0	0	0	117.6	C46 D51 I90 D91 K92 R95	C46-C49 PolarHBondContact O-N 2.79Å; C49-D51 VanDerWaalsContact C-N 3.26Å; C49-D51 PolarHBondContact O-N 2.85Å; C49-I90 WeakPolarHBondContact CA-O 3.31Å; C49-I90 HydrophobicContact CB-CG2 4.02Å; C49-D91 CarbonylContact O-C 3.57Å; C49-D91 VanDerWaalsContact O-C 3.22Å; C49-D91 VanDerWaalsContact O-CA 3.27Å; C49-D91 WeakPolarHBondContact O-CA 3.49Å; C49-K92 PolarHBondContact O-N 3.09Å; C49-R95 HydrophobicContact CB-CB 4.31Å; C49-R95 PolarHBondContact SG-NH1 2.84Å
50	G	95.1	Very high	85.1	Confident	38 Å²	38	60 Å²	60	39%	0.392	32%	0.322	S	S	.	.	S	Bend	trans	62.1	29.5	178.8	0	0	0	0	0	114.5	M45 C46	M45-G50 VanDerWaalsContact CE-O 3.24Å; M45-G50 WeakPolarHBondContact CE-O 3.39Å; C46-G50 PolarHBondContact O-N 2.93Å
51	D	95.9	Very high	87.2	Confident	21 Å²	21	52.7 Å²	52.7	11%	0.112	29%	0.289	C	S	.	.			trans	-104.1	152.6	172	-165.9	15.8	0	0	0	109.5	C46 C49 V53 C63 K92 R95	C46-D51 WeakPolarHBondContact CB-O 3.36Å; C46-D51 PolarHBondContact N-O 2.91Å; C49-D51 VanDerWaalsContact C-N 3.26Å; C49-D51 PolarHBondContact O-N 2.85Å; D51-V53 PolarHBondContact O-N 3.1Å; D51-C63 HydrophobicContact CB-CB 4Å; D51-K92 HydrophobicContact CB-CB 4.27Å; D51-K92 HydrophobicContact CB-CD 4.17Å; D51-K92 HydrophobicContact CB-CG 4.12Å; D51-K92 VanDerWaalsContact OD1-CD 3.31Å; D51-K92 WeakPolarHBondContact OD1-CD 3.44Å; D51-K92 WeakPolarHBondContact OD1-CE 3.32Å; D51-K92 IonicContact OD1-NZ 2.65Å; D51-K92 PolarHBondContact OD1-NZ 3.29Å; D51-R95 IonicContact OD2-CZ 3.67Å; D51-R95 IonicContact OD2-NH1 3.78Å; D51-R95 PolarHBondContact OD2-NH1 3.06Å; D51-R95 IonicContact OD2-NH2 3.96Å; D51-R95 PolarHBondContact OD2-NH2 3.25Å
52	K	95.1	Very high	89.6	Confident	116 Å²	116	45.6 Å²	45.6	50%	0.504	25%	0.251	S	S	.	.	B	Isolated β-bridge	trans	-57.7	132.7	-172.8	-173.6	160	-176.8	146.6	0	111.5	D43 C63	D43-K52 WeakPolarHBondContact OD1-CE 3.47Å; D43-K52 IonicContact OD1-NZ 3.99Å; D43-K52 PolarHBondContact OD1-NZ 2.95Å; D43-K52 VanDerWaalsContact OD2-CE 3.32Å; D43-K52 WeakPolarHBondContact OD2-CE 3.41Å; D43-K52 IonicContact OD2-NZ 2.74Å; D43-K52 PolarHBondContact OD2-NZ 2.74Å; K52-C63 WeakPolarHBondContact O-CA 3.12Å; K52-C63 WeakPolarHBondContact O-CB 3.13Å
53	V	94.9	Very high	91.8	Very high	29 Å²	29	38.6 Å²	38.6	18%	0.176	21%	0.214	C	C	.	.			trans	-64.4	139	176.7	161	0	0	0	0	110.5	E44 C46 D51 L61	E44-V53 WeakPolarHBondContact O-CB 3.26Å; E44-V53 WeakPolarHBondContact O-CG2 3.4Å; E44-V53 PolarHBondContact O-N 3.15Å; C46-V53 HydrophobicContact CB-CG2 4.33Å; D51-V53 PolarHBondContact O-N 3.1Å; V53-L61 HydrophobicContact CG1-CB 3.83Å; V53-L61 HydrophobicContact CG1-CD2 3.89Å; V53-L61 HydrophobicContact CG1-CG 4.32Å; V53-L61 HydrophobicContact CG2-CB 4.09Å
54	S	93.6	Very high	93.6	Very high	64 Å²	64	39.3 Å²	39.3	45%	0.448	22%	0.215	S	C	.	.			trans	-108.5	-2.2	172	66.2	0	0	0	0	113.5	H57 T62 E64	S54-H57 PolarHBondContact OG-NE2 2.93Å; S54-T62 PolarHBondContact N-O 3.09Å; S54-E64 PolarHBondContact OG-N 3.31Å; S54-E64 PolarHBondContact OG-OE2 3.23Å; S54-E64 VanDerWaalsContact OG-OE2 3.06Å
55	G	90.4	Very high	94.4	Very high	22 Å²	22	37 Å²	37	23%	0.227	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	140.3	-170.4	176.9	0	0	0	0	0	113.6	H57 L61 T62	G55-H57 PolarHBondContact O-CD2 3.39Å; G55-H57 PolarHBondContact O-N 2.92Å; G55-H57 PolarHBondContact O-NE2 3.4Å; G55-L61 VanDerWaalsContact C-CD2 3.4Å; G55-L61 WeakPolarHBondContact O-CA 3.3Å; G55-T62 PolarHBondContact O-N 3.46Å; G55-T62 VanDerWaalsContact O-N 3.1Å
56	Y	91.3	Very high	94.6	Very high	42 Å²	42	31.4 Å²	31.4	17%	0.165	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	117.5	176.9	-75.8	-90.9	0	0	0	110.2	L60 L61 Y132 D135 R136	Y56-L60 WeakPolarHBondContact CA-O 3.35Å; Y56-L61 HydrophobicContact CD1-CD2 4.08Å; Y56-L61 HydrophobicContact CD1-CG 4.19Å; Y56-L61 HydrophobicContact CD2-CD2 3.4Å; Y56-L61 VanDerWaalsContact CD2-CD2 3.4Å; Y56-L61 HydrophobicContact CD2-CG 4.26Å; Y56-L61 HydrophobicContact CE1-CD2 4.15Å; Y56-L61 HydrophobicContact CE1-CG 3.95Å; Y56-L61 HydrophobicContact CE2-CD1 4.41Å; Y56-L61 HydrophobicContact CE2-CD2 3.48Å; Y56-L61 VanDerWaalsContact CE2-CD2 3.48Å; Y56-L61 HydrophobicContact CE2-CG 4.02Å; Y56-L61 HydrophobicContact CG-CD2 3.71Å; Y56-L61 HydrophobicContact CG-CG 4.33Å; Y56-Y132 AromaticContact CD1-CD1 3.46Å; Y56-Y132 HydrophobicContact CD1-CD1 3.46Å; Y56-Y132 VanDerWaalsContact CD1-CD1 3.46Å; Y56-Y132 HydrophobicContact CD1-CE1 4.04Å; Y56-Y132 HydrophobicContact CD1-CG 4Å; Y56-Y132 HydrophobicContact CE1-CD1 4.16Å; Y56-Y132 AromaticContact CG-CD1 3.91Å; Y56-Y132 HydrophobicContact CG-CD1 3.91Å; Y56-Y132 HydrophobicContact CG-CE1 4.48Å; Y56-Y132 HydrophobicContact CG-CG 4.02Å; Y56-D135 HydrophobicContact CE1-CB 4.18Å; Y56-D135 WeakPolarHBondContact CE1-OD2 3.38Å; Y56-D135 PolarHBondContact OH-OD2 3.15Å; Y56-R136 PolarHBondContact OH-N 2.96Å
57	H	93.2	Very high	94.7	Very high	22 Å²	22	33.9 Å²	33.9	10%	0.102	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	119.9	176.3	-50.1	-65.3	0	0	0	109.5	S54 G55 G59 L60 T62 E64 K67	S54-H57 PolarHBondContact OG-NE2 2.93Å; G55-H57 PolarHBondContact O-CD2 3.39Å; G55-H57 PolarHBondContact O-N 2.92Å; G55-H57 PolarHBondContact O-NE2 3.4Å; H57-G59 VanDerWaalsContact C-N 3.33Å; H57-G59 PolarHBondContact O-N 3.41Å; H57-L60 PolarHBondContact N-O 2.85Å; H57-T62 PolarHBondContact CD2-O 3.48Å; H57-T62 PolarHBondContact CD2-OG1 3.16Å; H57-E64 IonicContact CE1-OE2 3.09Å; H57-E64 IonicContact NE2-OE2 2.65Å; H57-K67 HydrophobicContact CB-CB 3.84Å; H57-K67 HydrophobicContact CB-CD 4.5Å; H57-K67 HydrophobicContact CB-CG 3.82Å; H57-K67 VanDerWaalsContact CE1-CE 3.48Å; H57-K67 WeakPolarHBondContact CE1-CE 3.27Å; H57-K67 WeakPolarHBondContact ND1-CD 3.18Å; H57-K67 WeakPolarHBondContact ND1-CE 3.27Å
58	Y	92.9	Very high	94.8	Very high	36 Å²	36	31.7 Å²	31.7	14%	0.141	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	38.5	173.3	-46.8	-67	0	0	0	115	K67 F70 K71 M111 K112 A115 V116	Y58-K67 HydrophobicContact CE2-CB 4.39Å; Y58-K67 HydrophobicContact CE2-CG 3.79Å; Y58-F70 AromaticContact CD2-CD1 3.77Å; Y58-F70 HydrophobicContact CD2-CD1 3.77Å; Y58-F70 HydrophobicContact CE2-CD1 4.42Å; Y58-F70 AromaticContact CG-CD1 3.84Å; Y58-F70 HydrophobicContact CG-CD1 3.84Å; Y58-F70 HydrophobicContact CG-CE1 4.16Å; Y58-K71 HydrophobicContact CE2-CB 4.28Å; Y58-K71 WeakPolarHBondContact OH-CB 3.25Å; Y58-M111 HydrophobicContact CD2-CE 3.69Å; Y58-M111 HydrophobicContact CG-CE 4.33Å; Y58-M111 CarbonylContact O-C 3.22Å; Y58-M111 WeakPolarHBondContact O-CA 3.25Å; Y58-K112 WeakPolarHBondContact O-CB 3.48Å; Y58-K112 PolarHBondContact O-N 2.98Å; Y58-A115 HydrophobicContact CD1-CB 3.99Å; Y58-V116 HydrophobicContact CD1-CG2 3.66Å; Y58-V116 HydrophobicContact CE1-CB 4.37Å; Y58-V116 HydrophobicContact CE1-CG2 3.74Å; Y58-V116 HydrophobicContact CG-CG2 4.26Å
59	G	88.7	Confident	94.8	Very high	6 Å²	6	32.5 Å²	32.5	6%	0.062	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	122.1	-33.2	174.5	0	0	0	0	0	114.7	H57 M131 Y132	H57-G59 VanDerWaalsContact C-N 3.33Å; H57-G59 PolarHBondContact O-N 3.41Å; G59-M131 VanDerWaalsContact O-CE 3.3Å; G59-M131 WeakPolarHBondContact O-CE 3.3Å; G59-Y132 PolarHBondContact N-OH 3.07Å; G59-Y132 VanDerWaalsContact N-OH 3.09Å
60	L	91.2	Very high	94.9	Very high	30 Å²	30	32.3 Å²	32.3	16%	0.157	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	175.3	-173.8	66	145.3	0	0	0	113	P47 Y56 H57 T62 V109 G110 M111	P47-L60 HydrophobicContact CG-CD1 3.63Å; Y56-L60 WeakPolarHBondContact CA-O 3.35Å; H57-L60 PolarHBondContact N-O 2.85Å; L60-T62 HydrophobicContact CD1-CG2 4.11Å; L60-T62 HydrophobicContact CG-CG2 4.12Å; L60-T62 PolarHBondContact O-N 3.35Å; L60-V109 HydrophobicContact CD1-CB 4.34Å; L60-V109 HydrophobicContact CD1-CG2 4.01Å; L60-V109 WeakPolarHBondContact CD1-O 3.19Å; L60-V109 WeakPolarHBondContact CD2-O 3.33Å; L60-G110 WeakPolarHBondContact CD2-O 3.42Å; L60-M111 HydrophobicContact CD2-CB 4.33Å; L60-M111 HydrophobicContact CD2-CG 3.68Å
61	L	92.4	Very high	94.9	Very high	21 Å²	21	34.8 Å²	34.8	11%	0.11	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	121.7	176.6	-70.2	177.7	0	0	0	111.9	E44 P47 V53 G55 Y56	E44-L61 HydrophobicContact CG-CD1 4.38Å; E44-L61 WeakPolarHBondContact OE1-CD1 3.42Å; E44-L61 WeakPolarHBondContact OE2-CD1 3.26Å; P47-L61 WeakPolarHBondContact CD-O 3.39Å; V53-L61 HydrophobicContact CG1-CB 3.83Å; V53-L61 HydrophobicContact CG1-CD2 3.89Å; V53-L61 HydrophobicContact CG1-CG 4.32Å; V53-L61 HydrophobicContact CG2-CB 4.09Å; G55-L61 VanDerWaalsContact C-CD2 3.4Å; G55-L61 WeakPolarHBondContact O-CA 3.3Å; Y56-L61 HydrophobicContact CD1-CD2 4.08Å; Y56-L61 HydrophobicContact CD1-CG 4.19Å; Y56-L61 HydrophobicContact CD2-CD2 3.4Å; Y56-L61 VanDerWaalsContact CD2-CD2 3.4Å; Y56-L61 HydrophobicContact CD2-CG 4.26Å; Y56-L61 HydrophobicContact CE1-CD2 4.15Å; Y56-L61 HydrophobicContact CE1-CG 3.95Å; Y56-L61 HydrophobicContact CE2-CD1 4.41Å; Y56-L61 HydrophobicContact CE2-CD2 3.48Å; Y56-L61 VanDerWaalsContact CE2-CD2 3.48Å; Y56-L61 HydrophobicContact CE2-CG 4.02Å; Y56-L61 HydrophobicContact CG-CD2 3.71Å; Y56-L61 HydrophobicContact CG-CG 4.33Å
62	T	95.8	Very high	94.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	169.9	177.3	56.7	0	0	0	0	112.7	V48 S54 G55 H57 L60 M111	V48-T62 HydrophobicContact CG2-CG2 4.49Å; S54-T62 PolarHBondContact N-O 3.09Å; G55-T62 PolarHBondContact O-N 3.46Å; G55-T62 VanDerWaalsContact O-N 3.1Å; H57-T62 PolarHBondContact CD2-O 3.48Å; H57-T62 PolarHBondContact CD2-OG1 3.16Å; L60-T62 HydrophobicContact CD1-CG2 4.11Å; L60-T62 HydrophobicContact CG-CG2 4.12Å; L60-T62 PolarHBondContact O-N 3.35Å; T62-M111 HydrophobicContact CG2-SD 4.23Å
63	C	97.3	Very high	95	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.014	18%	0.181	C	C	.	.			trans	-80.3	157.3	173.3	70.1	0	0	0	0	112.2	C46 D51 K52 S65 C66 K67 R95	C46-C63 HydrophobicContact CB-CB 3.88Å; C46-C63 PolarHBondContact SG-N 2.97Å; C46-C63 VanDerWaalsContact SG-N 3.36Å; D51-C63 HydrophobicContact CB-CB 4Å; K52-C63 WeakPolarHBondContact O-CA 3.12Å; K52-C63 WeakPolarHBondContact O-CB 3.13Å; C63-S65 PolarHBondContact O-N 3.37Å; C63-S65 VanDerWaalsContact O-N 3.15Å; C63-C66 PolarHBondContact O-N 2.77Å; C63-C66 VanDerWaalsContact O-N 3.09Å; C63-C66 VanDerWaalsContact SG-SG 3.65Å; C63-K67 PolarHBondContact O-N 3.37Å; C63-K67 VanDerWaalsContact O-N 3.1Å; C63-R95 PolarHBondContact SG-NH1 3.04Å; C63-R95 VanDerWaalsContact SG-NH1 3.37Å
64	E	97.4	Very high	95	Very high	103 Å²	103	35.8 Å²	35.8	48%	0.481	18%	0.184	S	C	.	.	H	α-helix	trans	-57.7	-32.5	-178.7	-164.5	61.5	-155.5	0	0	113.2	S54 H57 K67 G68	S54-E64 PolarHBondContact OG-N 3.31Å; S54-E64 PolarHBondContact OG-OE2 3.23Å; S54-E64 VanDerWaalsContact OG-OE2 3.06Å; H57-E64 IonicContact CE1-OE2 3.09Å; H57-E64 IonicContact NE2-OE2 2.65Å; E64-K67 VanDerWaalsContact CD-CD 3.44Å; E64-K67 VanDerWaalsContact OE1-CD 3.26Å; E64-K67 WeakPolarHBondContact OE1-CD 3.45Å; E64-K67 WeakPolarHBondContact OE1-CE 3.47Å; E64-K67 IonicContact OE1-NZ 2.77Å; E64-K67 PolarHBondContact OE1-NZ 2.99Å; E64-K67 WeakPolarHBondContact OE2-CD 3.38Å; E64-K67 IonicContact OE2-NZ 3.89Å; E64-K67 PolarHBondContact OE2-NZ 3.2Å; E64-G68 PolarHBondContact O-N 2.97Å
65	S	97.7	Very high	95	Very high	42 Å²	42	35.4 Å²	35.4	29%	0.294	18%	0.175	S	C	.	.	H	α-helix	trans	-65.8	-43.9	177	-169.6	0	0	0	0	112.5	C63 F69 R102	C63-S65 PolarHBondContact O-N 3.37Å; C63-S65 VanDerWaalsContact O-N 3.15Å; S65-F69 VanDerWaalsContact O-CB 3.27Å; S65-F69 WeakPolarHBondContact O-CB 3.31Å; S65-F69 PolarHBondContact O-N 2.91Å; S65-R102 VanDerWaalsContact C-NH2 3.32Å; S65-R102 PolarHBondContact O-NH2 2.88Å; S65-R102 PolarHBondContact OG-NH2 3.28Å
66	C	98.4	Very high	95.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-74	-39.8	-179.3	-71.6	0	0	0	0	111.8	V48 C63 G68 F69 F70 R102	V48-C66 HydrophobicContact CB-CB 4.43Å; V48-C66 HydrophobicContact CG2-CB 4.45Å; C63-C66 PolarHBondContact O-N 2.77Å; C63-C66 VanDerWaalsContact O-N 3.09Å; C63-C66 VanDerWaalsContact SG-SG 3.65Å; C66-G68 PolarHBondContact O-N 2.88Å; C66-F69 PolarHBondContact O-N 3.36Å; C66-F70 VanDerWaalsContact O-CB 3.3Å; C66-F70 WeakPolarHBondContact O-CB 3.43Å; C66-F70 PolarHBondContact O-N 2.83Å; C66-R102 PolarHBondContact SG-NH2 3.03Å
67	K	97.5	Very high	95.2	Very high	53 Å²	53	42.4 Å²	42.4	23%	0.23	21%	0.21	C	C	.	.	H	α-helix	trans	-49.6	-56.1	166	171.4	-154.8	-164.7	179.6	0	111.8	H57 Y58 C63 E64 F69 F70 K71	H57-K67 HydrophobicContact CB-CB 3.84Å; H57-K67 HydrophobicContact CB-CD 4.5Å; H57-K67 HydrophobicContact CB-CG 3.82Å; H57-K67 VanDerWaalsContact CE1-CE 3.48Å; H57-K67 WeakPolarHBondContact CE1-CE 3.27Å; H57-K67 WeakPolarHBondContact ND1-CD 3.18Å; H57-K67 WeakPolarHBondContact ND1-CE 3.27Å; Y58-K67 HydrophobicContact CE2-CB 4.39Å; Y58-K67 HydrophobicContact CE2-CG 3.79Å; C63-K67 PolarHBondContact O-N 3.37Å; C63-K67 VanDerWaalsContact O-N 3.1Å; E64-K67 VanDerWaalsContact CD-CD 3.44Å; E64-K67 VanDerWaalsContact OE1-CD 3.26Å; E64-K67 WeakPolarHBondContact OE1-CD 3.45Å; E64-K67 WeakPolarHBondContact OE1-CE 3.47Å; E64-K67 IonicContact OE1-NZ 2.77Å; E64-K67 PolarHBondContact OE1-NZ 2.99Å; E64-K67 WeakPolarHBondContact OE2-CD 3.38Å; E64-K67 IonicContact OE2-NZ 3.89Å; E64-K67 PolarHBondContact OE2-NZ 3.2Å; K67-F69 PolarHBondContact O-N 3.1Å; K67-F70 PolarHBondContact O-N 2.66Å; K67-K71 WeakPolarHBondContact O-CB 3.38Å; K67-K71 PolarHBondContact O-N 3.45Å
68	G	97.1	Very high	95.3	Very high	16 Å²	16	46.8 Å²	46.8	17%	0.165	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-38.2	-178.1	0	0	0	0	0	113.4	E64 C66 R72	E64-G68 PolarHBondContact O-N 2.97Å; C66-G68 PolarHBondContact O-N 2.88Å; G68-R72 WeakPolarHBondContact O-CG 3.32Å; G68-R72 VanDerWaalsContact O-CZ 3.32Å; G68-R72 PolarHBondContact O-N 3.12Å; G68-R72 VanDerWaalsContact O-N 3.12Å; G68-R72 PolarHBondContact O-NH1 2.91Å
69	F	98.4	Very high	95.5	Very high	16 Å²	16	56.1 Å²	56.1	7%	0.07	26%	0.264	C	S	.	.	H	α-helix	trans	-64.7	-48.5	175.1	171.8	-102.1	0	0	0	112.2	S65 C66 K67 R72 T73 Y80 P99 R102 F103	S65-F69 VanDerWaalsContact O-CB 3.27Å; S65-F69 WeakPolarHBondContact O-CB 3.31Å; S65-F69 PolarHBondContact O-N 2.91Å; C66-F69 PolarHBondContact O-N 3.36Å; K67-F69 PolarHBondContact O-N 3.1Å; F69-R72 PolarHBondContact O-N 3.13Å; F69-T73 WeakPolarHBondContact O-CB 3.24Å; F69-T73 PolarHBondContact O-N 2.92Å; F69-T73 PolarHBondContact O-OG1 3.35Å; F69-Y80 AromaticContact CE2-CE2 3.88Å; F69-Y80 HydrophobicContact CE2-CE2 3.88Å; F69-Y80 HydrophobicContact CZ-CD2 4.41Å; F69-Y80 AromaticContact CZ-CE2 3.73Å; F69-Y80 HydrophobicContact CZ-CE2 3.73Å; F69-P99 HydrophobicContact CE2-CB 4.03Å; F69-P99 HydrophobicContact CZ-CB 4.16Å; F69-P99 WeakPolarHBondContact CZ-O 3.33Å; F69-R102 HydrophobicContact CD1-CG 3.83Å; F69-R102 HydrophobicContact CE1-CB 3.92Å; F69-R102 HydrophobicContact CE1-CG 3.6Å; F69-R102 HydrophobicContact CZ-CB 4.14Å; F69-R102 HydrophobicContact CZ-CG 4.22Å; F69-F103 HydrophobicContact CE1-CB 3.81Å; F69-F103 HydrophobicContact CE1-CD2 4.26Å; F69-F103 HydrophobicContact CZ-CB 3.94Å
70	F	98.1	Very high	95.9	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.6	-50.1	178.2	-168.7	-101.3	0	0	0	111	Y58 C66 K67 R72 T73 V74 F103 C106 L107 M111 K112 L113 V116	Y58-F70 AromaticContact CD2-CD1 3.77Å; Y58-F70 HydrophobicContact CD2-CD1 3.77Å; Y58-F70 HydrophobicContact CE2-CD1 4.42Å; Y58-F70 AromaticContact CG-CD1 3.84Å; Y58-F70 HydrophobicContact CG-CD1 3.84Å; Y58-F70 HydrophobicContact CG-CE1 4.16Å; C66-F70 VanDerWaalsContact O-CB 3.3Å; C66-F70 WeakPolarHBondContact O-CB 3.43Å; C66-F70 PolarHBondContact O-N 2.83Å; K67-F70 PolarHBondContact O-N 2.66Å; F70-R72 PolarHBondContact O-N 3.39Å; F70-T73 PolarHBondContact O-N 3.26Å; F70-T73 VanDerWaalsContact O-N 3.12Å; F70-V74 HydrophobicContact CD1-CG2 4.28Å; F70-V74 HydrophobicContact CE1-CG2 4.04Å; F70-V74 HydrophobicContact CE2-CG2 4.42Å; F70-V74 HydrophobicContact CZ-CG2 4.12Å; F70-V74 WeakPolarHBondContact O-CG2 2.99Å; F70-V74 PolarHBondContact O-N 3.25Å; F70-F103 AromaticContact CD2-CD2 3.99Å; F70-F103 HydrophobicContact CD2-CD2 3.99Å; F70-F103 AromaticContact CD2-CE2 3.62Å; F70-F103 HydrophobicContact CD2-CE2 3.62Å; F70-F103 HydrophobicContact CE2-CD2 4.3Å; F70-F103 AromaticContact CE2-CE2 3.63Å; F70-F103 HydrophobicContact CE2-CE2 3.63Å; F70-F103 HydrophobicContact CE2-CZ 4.39Å; F70-C106 HydrophobicContact CD2-CB 3.68Å; F70-C106 HydrophobicContact CE2-CB 4.08Å; F70-L107 HydrophobicContact CE2-CD2 3.89Å; F70-L107 HydrophobicContact CZ-CD2 4.24Å; F70-M111 HydrophobicContact CB-CE 3.64Å; F70-M111 HydrophobicContact CB-SD 4.18Å; F70-M111 HydrophobicContact CD1-CB 4.36Å; F70-M111 HydrophobicContact CD1-CE 3.9Å; F70-M111 HydrophobicContact CD2-CB 3.92Å; F70-M111 HydrophobicContact CD2-CE 4.25Å; F70-M111 HydrophobicContact CD2-SD 4.06Å; F70-M111 HydrophobicContact CE1-CB 4.03Å; F70-M111 HydrophobicContact CE2-CB 3.56Å; F70-M111 HydrophobicContact CG-CB 4.3Å; F70-M111 HydrophobicContact CG-CE 3.68Å; F70-M111 HydrophobicContact CG-SD 4.09Å; F70-M111 HydrophobicContact CZ-CB 3.62Å; F70-M111 VanDerWaalsContact CZ-O 3.29Å; F70-M111 WeakPolarHBondContact CZ-O 2.98Å; F70-K112 WeakPolarHBondContact CE1-O 3.16Å; F70-L113 HydrophobicContact CE2-CD2 4.39Å; F70-L113 HydrophobicContact CZ-CD2 3.92Å; F70-L113 HydrophobicContact CZ-CG 4.48Å; F70-V116 HydrophobicContact CD1-CG2 3.79Å; F70-V116 HydrophobicContact CE1-CG2 3.67Å
71	K	95.4	Very high	96.1	Very high	90 Å²	90	63.6 Å²	63.6	39%	0.391	30%	0.302	S	S	.	.	H	α-helix	trans	-51.7	-51.7	175.5	-175.1	-178.1	174	177	0	112.2	Y58 K67 T73 Q75	Y58-K71 HydrophobicContact CE2-CB 4.28Å; Y58-K71 WeakPolarHBondContact OH-CB 3.25Å; K67-K71 WeakPolarHBondContact O-CB 3.38Å; K67-K71 PolarHBondContact O-N 3.45Å; K71-T73 VanDerWaalsContact C-N 3.32Å; K71-T73 PolarHBondContact O-N 2.83Å; K71-Q75 HydrophobicContact CG-CG 4.21Å; K71-Q75 VanDerWaalsContact O-CB 3.31Å; K71-Q75 WeakPolarHBondContact O-CB 3.05Å; K71-Q75 WeakPolarHBondContact O-CG 3.27Å; K71-Q75 PolarHBondContact O-N 2.74Å
72	R	95.9	Very high	96.4	Very high	145 Å²	145	63.5 Å²	63.5	55%	0.547	30%	0.303	S	S	.	.	H	α-helix	trans	-68	-30.3	-178.5	-73.7	-172	-58	-88.5	-1.8	113.2	G68 F69 F70 N76	G68-R72 WeakPolarHBondContact O-CG 3.32Å; G68-R72 VanDerWaalsContact O-CZ 3.32Å; G68-R72 PolarHBondContact O-N 3.12Å; G68-R72 VanDerWaalsContact O-N 3.12Å; G68-R72 PolarHBondContact O-NH1 2.91Å; F69-R72 PolarHBondContact O-N 3.13Å; F70-R72 PolarHBondContact O-N 3.39Å; R72-N76 WeakPolarHBondContact O-CB 3.48Å; R72-N76 PolarHBondContact O-N 3.38Å; R72-N76 PolarHBondContact O-ND2 3.45Å
73	T	97.2	Very high	96.3	Very high	2 Å²	2	70.8 Å²	70.8	1%	0.012	34%	0.34	C	S	.	.	H	α-helix	trans	-69.3	-50.4	177.6	-55.7	0	0	0	0	110	F69 F70 K71 N77 K78 Y80 F103	F69-T73 WeakPolarHBondContact O-CB 3.24Å; F69-T73 PolarHBondContact O-N 2.92Å; F69-T73 PolarHBondContact O-OG1 3.35Å; F70-T73 PolarHBondContact O-N 3.26Å; F70-T73 VanDerWaalsContact O-N 3.12Å; K71-T73 VanDerWaalsContact C-N 3.32Å; K71-T73 PolarHBondContact O-N 2.83Å; T73-N77 PolarHBondContact O-N 2.8Å; T73-K78 HydrophobicContact CG2-CB 4.17Å; T73-K78 PolarHBondContact O-N 2.96Å; T73-Y80 HydrophobicContact CG2-CD2 4.28Å; T73-Y80 HydrophobicContact CG2-CE2 3.55Å; T73-Y80 PolarHBondContact OG1-OH 3.36Å; T73-F103 HydrophobicContact CG2-CD1 3.99Å; T73-F103 HydrophobicContact CG2-CD2 3.5Å; T73-F103 VanDerWaalsContact CG2-CD2 3.5Å; T73-F103 HydrophobicContact CG2-CE1 3.97Å; T73-F103 HydrophobicContact CG2-CE2 3.49Å; T73-F103 VanDerWaalsContact CG2-CE2 3.49Å; T73-F103 HydrophobicContact CG2-CG 3.76Å; T73-F103 HydrophobicContact CG2-CZ 3.73Å
74	V	95.3	Very high	96.2	Very high	40 Å²	40	75.2 Å²	75.2	24%	0.242	36%	0.361	C	S	.	.	H	α-helix	trans	-69.6	-51.6	-178.8	-178.3	0	0	0	0	112	F70 N76 N77 F103 L113 V116	F70-V74 HydrophobicContact CD1-CG2 4.28Å; F70-V74 HydrophobicContact CE1-CG2 4.04Å; F70-V74 HydrophobicContact CE2-CG2 4.42Å; F70-V74 HydrophobicContact CZ-CG2 4.12Å; F70-V74 WeakPolarHBondContact O-CG2 2.99Å; F70-V74 PolarHBondContact O-N 3.25Å; V74-N76 PolarHBondContact O-N 3.49Å; V74-N77 PolarHBondContact O-N 3.16Å; V74-N77 VanDerWaalsContact O-N 3.13Å; V74-F103 HydrophobicContact CG2-CE2 4.05Å; V74-F103 HydrophobicContact CG2-CZ 4.15Å; V74-L113 HydrophobicContact CG1-CD2 4.35Å; V74-L113 HydrophobicContact CG2-CD2 3.48Å; V74-L113 VanDerWaalsContact CG2-CD2 3.48Å; V74-V116 HydrophobicContact CB-CB 4.18Å; V74-V116 HydrophobicContact CB-CG1 4.09Å; V74-V116 HydrophobicContact CB-CG2 3.99Å; V74-V116 HydrophobicContact CG1-CB 3.82Å; V74-V116 HydrophobicContact CG1-CG1 3.99Å; V74-V116 HydrophobicContact CG1-CG2 4.05Å; V74-V116 HydrophobicContact CG2-CG2 4.13Å
75	Q	92.6	Very high	96.1	Very high	55 Å²	55	75.9 Å²	75.9	26%	0.257	37%	0.368	S	S	.	.	H	α-helix	trans	-65.5	-22.1	-176.1	-70.2	-164.8	-44.9	0	0	114.7	K71 V116 R117	K71-Q75 HydrophobicContact CG-CG 4.21Å; K71-Q75 VanDerWaalsContact O-CB 3.31Å; K71-Q75 WeakPolarHBondContact O-CB 3.05Å; K71-Q75 WeakPolarHBondContact O-CG 3.27Å; K71-Q75 PolarHBondContact O-N 2.74Å; Q75-V116 HydrophobicContact CG-CG1 3.41Å; Q75-V116 VanDerWaalsContact CG-CG1 3.41Å; Q75-R117 PolarHBondContact NE2-O 3.42Å
76	N	93.3	Very high	95.9	Very high	71 Å²	71	79.9 Å²	79.9	38%	0.38	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	16.9	178.1	-51.6	-67.4	0	0	0	112.2	R72 V74 K78	R72-N76 WeakPolarHBondContact O-CB 3.48Å; R72-N76 PolarHBondContact O-N 3.38Å; R72-N76 PolarHBondContact O-ND2 3.45Å; V74-N76 PolarHBondContact O-N 3.49Å; N76-K78 HydrophobicContact CB-CD 4.35Å; N76-K78 HydrophobicContact CB-CG 4.11Å; N76-K78 PolarHBondContact O-N 3.5Å; N76-K78 VanDerWaalsContact O-N 3.1Å
77	N	93.8	Very high	95.8	Very high	140 Å²	140	83.5 Å²	83.5	75%	0.749	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.2	46.4	-179.1	-162.7	17	0	0	0	113.5	T73 V74 R79	T73-N77 PolarHBondContact O-N 2.8Å; V74-N77 PolarHBondContact O-N 3.16Å; V74-N77 VanDerWaalsContact O-N 3.13Å; N77-R79 PolarHBondContact O-N 3.1Å
78	K	95.8	Very high	95.8	Very high	115 Å²	115	81.8 Å²	81.8	50%	0.5	40%	0.402	S	S	.	.			trans	-75.5	121	-174.9	-65.5	-59.1	-172.5	-176.1	0	110.1	T73 N76 Y80	T73-K78 HydrophobicContact CG2-CB 4.17Å; T73-K78 PolarHBondContact O-N 2.96Å; N76-K78 HydrophobicContact CB-CD 4.35Å; N76-K78 HydrophobicContact CB-CG 4.11Å; N76-K78 PolarHBondContact O-N 3.5Å; N76-K78 VanDerWaalsContact O-N 3.1Å; K78-Y80 HydrophobicContact CB-CE1 4.1Å; K78-Y80 HydrophobicContact CB-CE2 4.27Å
79	R	95.5	Very high	95.7	Very high	232 Å²	232	87.9 Å²	87.9	88%	0.875	43%	0.426	S	S	*	.			trans	-95.6	130.3	168	-53.6	-174.8	77.5	-165.8	4	108.2	N77	N77-R79 PolarHBondContact O-N 3.1Å
80	Y	97.3	Very high	95.7	Very high	70 Å²	70	87.6 Å²	87.6	28%	0.275	43%	0.425	S	S	.	.			trans	-114.3	157.8	175.1	-57.1	-59	0	0	0	109	F69 T73 K78 P99 Y100 F103	F69-Y80 AromaticContact CE2-CE2 3.88Å; F69-Y80 HydrophobicContact CE2-CE2 3.88Å; F69-Y80 HydrophobicContact CZ-CD2 4.41Å; F69-Y80 AromaticContact CZ-CE2 3.73Å; F69-Y80 HydrophobicContact CZ-CE2 3.73Å; T73-Y80 HydrophobicContact CG2-CD2 4.28Å; T73-Y80 HydrophobicContact CG2-CE2 3.55Å; T73-Y80 PolarHBondContact OG1-OH 3.36Å; K78-Y80 HydrophobicContact CB-CE1 4.1Å; K78-Y80 HydrophobicContact CB-CE2 4.27Å; Y80-P99 HydrophobicContact CD1-CB 3.85Å; Y80-P99 HydrophobicContact CD1-CG 3.79Å; Y80-P99 HydrophobicContact CD2-CB 3.91Å; Y80-P99 HydrophobicContact CE1-CB 3.98Å; Y80-P99 HydrophobicContact CE1-CG 4.24Å; Y80-P99 HydrophobicContact CE2-CB 4.03Å; Y80-P99 HydrophobicContact CG-CB 3.83Å; Y80-P99 HydrophobicContact CG-CG 3.97Å; Y80-Y100 WeakPolarHBondContact O-CD2 3.29Å; Y80-F103 HydrophobicContact CD2-CB 4.32Å
81	T	97	Very high	95.6	Very high	122 Å²	122	90 Å²	90	75%	0.748	44%	0.438	S	S	*	.			trans	-124.4	140.1	172.6	-50.8	0	0	0	0	107.9
82	C	97.4	Very high	95.6	Very high	19 Å²	19	91.2 Å²	91.2	13%	0.128	44%	0.443	C	S	.	.			trans	-77.5	140	170.2	-160.6	0	0	0	0	109.9	E84 Q86 Y100 C101	C82-E84 PolarHBondContact SG-N 3.45Å; C82-E84 VanDerWaalsContact SG-N 3.4Å; C82-E84 PolarHBondContact SG-O 2.86Å; C82-Q86 HydrophobicContact CB-CB 4.48Å; C82-Q86 HydrophobicContact CB-CG 3.78Å; C82-Y100 HydrophobicContact CB-CD1 3.64Å; C82-Y100 HydrophobicContact CB-CE1 4.3Å; C82-Y100 HydrophobicContact CB-CG 4.01Å; C82-C101 VanDerWaalsContact SG-SG 3.65Å
83	I	94.8	Very high	95.6	Very high	153 Å²	153	90 Å²	90	79%	0.785	45%	0.452	S	S	*	.	S	Bend	trans	-95.2	-2.6	172	57.2	171.4	0	0	0	112.6
84	E	94.3	Very high	95.5	Very high	95 Å²	95	93.3 Å²	93.3	44%	0.444	47%	0.467	S	S	.	.	S	Bend	trans	-122.7	-162.4	176.2	-63.7	174.3	-172.6	0	0	109	C82 Q86 C88	C82-E84 PolarHBondContact SG-N 3.45Å; C82-E84 VanDerWaalsContact SG-N 3.4Å; C82-E84 PolarHBondContact SG-O 2.86Å; E84-Q86 PolarHBondContact O-N 2.96Å; E84-C88 PolarHBondContact OE2-SG 2.89Å
85	N	94.4	Very high	95.5	Very high	118 Å²	118	92.8 Å²	92.8	63%	0.631	46%	0.461	S	S	*	.	S	Bend	trans	-74.1	23.4	-175.3	70.2	-10.1	0	0	0	116.2	S87	N85-S87 VanDerWaalsContact CG-OG 3.29Å; N85-S87 PolarHBondContact ND2-OG 3.43Å; N85-S87 PolarHBondContact O-N 2.93Å; N85-S87 PolarHBondContact OD1-N 3.29Å; N85-S87 PolarHBondContact OD1-OG 3.05Å
86	Q	95.1	Very high	95.7	Very high	125 Å²	125	98.9 Å²	98.9	58%	0.584	49%	0.487	S	S	*	.	S	Bend	trans	59.5	7.2	-175.2	-59.1	-178.7	21.6	0	0	116.4	C82 E84 Y100 C101	C82-Q86 HydrophobicContact CB-CB 4.48Å; C82-Q86 HydrophobicContact CB-CG 3.78Å; E84-Q86 PolarHBondContact O-N 2.96Å; Q86-Y100 HydrophobicContact CB-CE1 3.85Å; Q86-Y100 HydrophobicContact CG-CD1 4.32Å; Q86-Y100 HydrophobicContact CG-CE1 3.68Å; Q86-Y100 PolarHBondContact OE1-OH 3.01Å; Q86-Y100 VanDerWaalsContact OE1-OH 3.11Å; Q86-C101 PolarHBondContact O-SG 3.44Å
87	S	95.9	Very high	95.9	Very high	76 Å²	76	104 Å²	104	53%	0.531	50%	0.501	S	S	.	.			trans	-113.5	21.4	-179.1	85.1	0	0	0	0	114.4	N85 Q89	N85-S87 VanDerWaalsContact CG-OG 3.29Å; N85-S87 PolarHBondContact ND2-OG 3.43Å; N85-S87 PolarHBondContact O-N 2.93Å; N85-S87 PolarHBondContact OD1-N 3.29Å; N85-S87 PolarHBondContact OD1-OG 3.05Å; S87-Q89 PolarHBondContact O-N 3.37Å
88	C	96.9	Very high	96.1	Very high	18 Å²	18	97.7 Å²	97.7	12%	0.122	47%	0.467	C	S	.	.			trans	-54.8	134.1	-176.8	-48.4	0	0	0	0	112.7	E84 C98 C101	E84-C88 PolarHBondContact OE2-SG 2.89Å; C88-C98 HydrophobicContact CB-CB 3.79Å; C88-C101 HydrophobicContact CB-CB 3.9Å
89	Q	95.8	Very high	96.2	Very high	144 Å²	144	94.4 Å²	94.4	67%	0.673	46%	0.458	S	S	*	.			trans	-66.2	138.6	177.4	-69.6	-64.7	-9	0	0	112.2	S87	S87-Q89 PolarHBondContact O-N 3.37Å
90	I	97.7	Very high	96.3	Very high	9 Å²	9	85.9 Å²	85.9	5%	0.046	43%	0.426	C	S	.	.			trans	-123.9	104.2	-177.1	-51.8	-62.4	0	0	0	109.3	V48 C49 R95 C101 R102 K105	V48-I90 HydrophobicContact CG1-CG2 4.18Å; V48-I90 WeakPolarHBondContact O-CG2 3.21Å; C49-I90 WeakPolarHBondContact CA-O 3.31Å; C49-I90 HydrophobicContact CB-CG2 4.02Å; I90-R95 HydrophobicContact CG2-CB 3.81Å; I90-C101 HydrophobicContact CD1-CB 4.03Å; I90-C101 HydrophobicContact CG1-CB 4.47Å; I90-R102 HydrophobicContact CD1-CB 4.03Å; I90-R102 HydrophobicContact CG2-CB 4.48Å; I90-R102 HydrophobicContact CG2-CG 4.22Å; I90-K105 HydrophobicContact CB-CD 3.91Å; I90-K105 HydrophobicContact CG1-CD 4.09Å; I90-K105 HydrophobicContact CG2-CD 4.48Å; I90-K105 PolarHBondContact O-NZ 2.94Å
91	D	96.4	Very high	96.3	Very high	50 Å²	50	83 Å²	83	27%	0.267	42%	0.415	S	S	.	.			trans	-128.3	177.6	172.6	67.9	57.5	0	0	0	112	C49 T93 Q94 R95	C49-D91 CarbonylContact O-C 3.57Å; C49-D91 VanDerWaalsContact O-C 3.22Å; C49-D91 VanDerWaalsContact O-CA 3.27Å; C49-D91 WeakPolarHBondContact O-CA 3.49Å; D91-T93 PolarHBondContact O-N 2.76Å; D91-T93 WeakPolarHBondContact OD1-CA 3.34Å; D91-T93 WeakPolarHBondContact OD1-CB 3.42Å; D91-T93 PolarHBondContact OD1-N 2.9Å; D91-T93 PolarHBondContact OD1-OG1 3.04Å; D91-Q94 PolarHBondContact O-N 3.14Å; D91-Q94 PolarHBondContact OD1-N 3.2Å; D91-Q94 WeakPolarHBondContact OD2-CG 3.34Å; D91-Q94 PolarHBondContact OD2-NE2 3.43Å; D91-R95 WeakPolarHBondContact O-CB 3.41Å; D91-R95 WeakPolarHBondContact O-CG 3.44Å; D91-R95 PolarHBondContact O-N 2.84Å
92	K	95.6	Very high	96.4	Very high	117 Å²	117	77.7 Å²	77.7	51%	0.509	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-36.6	-177	-179.3	171	179.9	149.2	0	113.5	C49 D51 R95	C49-K92 PolarHBondContact O-N 3.09Å; D51-K92 HydrophobicContact CB-CB 4.27Å; D51-K92 HydrophobicContact CB-CD 4.17Å; D51-K92 HydrophobicContact CB-CG 4.12Å; D51-K92 VanDerWaalsContact OD1-CD 3.31Å; D51-K92 WeakPolarHBondContact OD1-CD 3.44Å; D51-K92 WeakPolarHBondContact OD1-CE 3.32Å; D51-K92 IonicContact OD1-NZ 2.65Å; D51-K92 PolarHBondContact OD1-NZ 3.29Å; K92-R95 PolarHBondContact O-NE 3.24Å
93	T	95.9	Very high	96.5	Very high	120 Å²	120	78.7 Å²	78.7	74%	0.736	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-51.8	-176.9	72.6	0	0	0	0	111.4	D91	D91-T93 PolarHBondContact O-N 2.76Å; D91-T93 WeakPolarHBondContact OD1-CA 3.34Å; D91-T93 WeakPolarHBondContact OD1-CB 3.42Å; D91-T93 PolarHBondContact OD1-N 2.9Å; D91-T93 PolarHBondContact OD1-OG1 3.04Å
94	Q	94.5	Very high	96.6	Very high	70 Å²	70	75.7 Å²	75.7	33%	0.327	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	1.8	-169.8	76.3	-171.9	-49.9	0	0	115.6	D91 K96 R97	D91-Q94 PolarHBondContact O-N 3.14Å; D91-Q94 PolarHBondContact OD1-N 3.2Å; D91-Q94 WeakPolarHBondContact OD2-CG 3.34Å; D91-Q94 PolarHBondContact OD2-NE2 3.43Å; Q94-K96 PolarHBondContact O-N 3.25Å; Q94-R97 VanDerWaalsContact O-CB 3.27Å; Q94-R97 WeakPolarHBondContact O-CB 3.35Å; Q94-R97 PolarHBondContact O-N 2.97Å
95	R	96.2	Very high	96.8	Very high	29 Å²	29	74.4 Å²	74.4	11%	0.109	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	0	171.7	61.5	-172.7	176.6	176.9	-2.2	116.7	C49 D51 C63 I90 D91 K92 R102	C49-R95 HydrophobicContact CB-CB 4.31Å; C49-R95 PolarHBondContact SG-NH1 2.84Å; D51-R95 IonicContact OD2-CZ 3.67Å; D51-R95 IonicContact OD2-NH1 3.78Å; D51-R95 PolarHBondContact OD2-NH1 3.06Å; D51-R95 IonicContact OD2-NH2 3.96Å; D51-R95 PolarHBondContact OD2-NH2 3.25Å; C63-R95 PolarHBondContact SG-NH1 3.04Å; C63-R95 VanDerWaalsContact SG-NH1 3.37Å; I90-R95 HydrophobicContact CG2-CB 3.81Å; D91-R95 WeakPolarHBondContact O-CB 3.41Å; D91-R95 WeakPolarHBondContact O-CG 3.44Å; D91-R95 PolarHBondContact O-N 2.84Å; K92-R95 PolarHBondContact O-NE 3.24Å; R95-R102 VanDerWaalsContact O-CD 3.25Å; R95-R102 WeakPolarHBondContact O-CD 3.48Å; R95-R102 PolarHBondContact O-NH1 2.75Å
96	K	96	Very high	97	Very high	184 Å²	184	68.8 Å²	68.8	80%	0.8	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-19.6	170	-65.8	-177.4	-177.1	175.6	0	113	Q94	Q94-K96 PolarHBondContact O-N 3.25Å
97	R	96.9	Very high	97.1	Very high	178 Å²	178	65.6 Å²	65.6	67%	0.672	32%	0.316	S	S	*	.	S	Bend	trans	-68.2	-43.1	-169.9	-170.5	172.4	178.9	150.8	1.9	113.2	Q94	Q94-R97 VanDerWaalsContact O-CB 3.27Å; Q94-R97 WeakPolarHBondContact O-CB 3.35Å; Q94-R97 PolarHBondContact O-N 2.97Å
98	C	98	Very high	97.1	Very high	8 Å²	8	67.3 Å²	67.3	5%	0.054	32%	0.324	C	S	.	.			trans	-126.6	101.1	175.5	-172.5	0	0	0	0	111.7	C88 Y100 C101 R102	C88-C98 HydrophobicContact CB-CB 3.79Å; C98-Y100 VanDerWaalsContact C-N 3.31Å; C98-Y100 PolarHBondContact O-N 2.98Å; C98-C101 HydrophobicContact CB-CB 4.2Å; C98-C101 PolarHBondContact SG-N 3.28Å; C98-C101 VanDerWaalsContact SG-N 3.42Å; C98-C101 PolarHBondContact SG-SG 2.78Å; C98-R102 WeakPolarHBondContact O-CB 3.47Å; C98-R102 PolarHBondContact O-N 3.1Å; C98-R102 VanDerWaalsContact O-N 3.16Å
99	P	97.6	Very high	97	Very high	45 Å²	45	68.4 Å²	68.4	29%	0.292	33%	0.33	S	S	.	.	H	α-helix	trans	-70.2	-27.2	177.5	28.6	-34.1	0	0	0	112.5	F69 Y80 F103	F69-P99 HydrophobicContact CE2-CB 4.03Å; F69-P99 HydrophobicContact CZ-CB 4.16Å; F69-P99 WeakPolarHBondContact CZ-O 3.33Å; Y80-P99 HydrophobicContact CD1-CB 3.85Å; Y80-P99 HydrophobicContact CD1-CG 3.79Å; Y80-P99 HydrophobicContact CD2-CB 3.91Å; Y80-P99 HydrophobicContact CE1-CB 3.98Å; Y80-P99 HydrophobicContact CE1-CG 4.24Å; Y80-P99 HydrophobicContact CE2-CB 4.03Å; Y80-P99 HydrophobicContact CG-CB 3.83Å; Y80-P99 HydrophobicContact CG-CG 3.97Å; P99-F103 WeakPolarHBondContact O-CB 3.38Å; P99-F103 PolarHBondContact O-N 2.97Å
100	Y	98.5	Very high	96.9	Very high	54 Å²	54	63.2 Å²	63.2	21%	0.212	32%	0.315	C	S	.	.	H	α-helix	trans	-60.2	-60.6	173.2	175.3	-88.9	0	0	0	111.1	Y80 C82 Q86 C98 R102 F103 Q104	Y80-Y100 WeakPolarHBondContact O-CD2 3.29Å; C82-Y100 HydrophobicContact CB-CD1 3.64Å; C82-Y100 HydrophobicContact CB-CE1 4.3Å; C82-Y100 HydrophobicContact CB-CG 4.01Å; Q86-Y100 HydrophobicContact CB-CE1 3.85Å; Q86-Y100 HydrophobicContact CG-CD1 4.32Å; Q86-Y100 HydrophobicContact CG-CE1 3.68Å; Q86-Y100 PolarHBondContact OE1-OH 3.01Å; Q86-Y100 VanDerWaalsContact OE1-OH 3.11Å; C98-Y100 VanDerWaalsContact C-N 3.31Å; C98-Y100 PolarHBondContact O-N 2.98Å; Y100-R102 PolarHBondContact O-N 3.07Å; Y100-F103 PolarHBondContact O-N 3.48Å; Y100-Q104 PolarHBondContact O-N 3.07Å
101	C	98.3	Very high	96.8	Very high	8 Å²	8	63 Å²	63	5%	0.054	31%	0.314	C	S	.	.	H	α-helix	trans	-61.7	-33.6	-178.7	-62.4	0	0	0	0	111.8	C82 Q86 C88 I90 C98 K105	C82-C101 VanDerWaalsContact SG-SG 3.65Å; Q86-C101 PolarHBondContact O-SG 3.44Å; C88-C101 HydrophobicContact CB-CB 3.9Å; I90-C101 HydrophobicContact CD1-CB 4.03Å; I90-C101 HydrophobicContact CG1-CB 4.47Å; C98-C101 HydrophobicContact CB-CB 4.2Å; C98-C101 PolarHBondContact SG-N 3.28Å; C98-C101 VanDerWaalsContact SG-N 3.42Å; C98-C101 PolarHBondContact SG-SG 2.78Å; C101-K105 VanDerWaalsContact O-CB 3.23Å; C101-K105 WeakPolarHBondContact O-CB 3.35Å; C101-K105 PolarHBondContact O-N 2.91Å
102	R	98.4	Very high	96.6	Very high	12 Å²	12	63.9 Å²	63.9	5%	0.045	32%	0.316	C	S	.	.	H	α-helix	trans	-63.7	-46	172.9	-172.2	-179.5	-173.2	168.7	-3.9	112.4	V48 S65 C66 F69 I90 R95 C98 Y100 K105 C106	V48-R102 HydrophobicContact CG1-CG 4.21Å; S65-R102 VanDerWaalsContact C-NH2 3.32Å; S65-R102 PolarHBondContact O-NH2 2.88Å; S65-R102 PolarHBondContact OG-NH2 3.28Å; C66-R102 PolarHBondContact SG-NH2 3.03Å; F69-R102 HydrophobicContact CD1-CG 3.83Å; F69-R102 HydrophobicContact CE1-CB 3.92Å; F69-R102 HydrophobicContact CE1-CG 3.6Å; F69-R102 HydrophobicContact CZ-CB 4.14Å; F69-R102 HydrophobicContact CZ-CG 4.22Å; I90-R102 HydrophobicContact CD1-CB 4.03Å; I90-R102 HydrophobicContact CG2-CB 4.48Å; I90-R102 HydrophobicContact CG2-CG 4.22Å; R95-R102 VanDerWaalsContact O-CD 3.25Å; R95-R102 WeakPolarHBondContact O-CD 3.48Å; R95-R102 PolarHBondContact O-NH1 2.75Å; C98-R102 WeakPolarHBondContact O-CB 3.47Å; C98-R102 PolarHBondContact O-N 3.1Å; C98-R102 VanDerWaalsContact O-N 3.16Å; Y100-R102 PolarHBondContact O-N 3.07Å; R102-K105 PolarHBondContact O-N 2.97Å; R102-C106 PolarHBondContact O-N 3.4Å; R102-C106 PolarHBondContact O-SG 2.86Å
103	F	98.4	Very high	96.5	Very high	39 Å²	39	62.3 Å²	62.3	17%	0.171	31%	0.312	C	S	.	.	H	α-helix	trans	-68.9	-41.2	-179.5	-173.6	-118.5	0	0	0	111.4	F69 F70 T73 V74 Y80 P99 Y100 K105 C106 L107 L113	F69-F103 HydrophobicContact CE1-CB 3.81Å; F69-F103 HydrophobicContact CE1-CD2 4.26Å; F69-F103 HydrophobicContact CZ-CB 3.94Å; F70-F103 AromaticContact CD2-CD2 3.99Å; F70-F103 HydrophobicContact CD2-CD2 3.99Å; F70-F103 AromaticContact CD2-CE2 3.62Å; F70-F103 HydrophobicContact CD2-CE2 3.62Å; F70-F103 HydrophobicContact CE2-CD2 4.3Å; F70-F103 AromaticContact CE2-CE2 3.63Å; F70-F103 HydrophobicContact CE2-CE2 3.63Å; F70-F103 HydrophobicContact CE2-CZ 4.39Å; T73-F103 HydrophobicContact CG2-CD1 3.99Å; T73-F103 HydrophobicContact CG2-CD2 3.5Å; T73-F103 VanDerWaalsContact CG2-CD2 3.5Å; T73-F103 HydrophobicContact CG2-CE1 3.97Å; T73-F103 HydrophobicContact CG2-CE2 3.49Å; T73-F103 VanDerWaalsContact CG2-CE2 3.49Å; T73-F103 HydrophobicContact CG2-CG 3.76Å; T73-F103 HydrophobicContact CG2-CZ 3.73Å; V74-F103 HydrophobicContact CG2-CE2 4.05Å; V74-F103 HydrophobicContact CG2-CZ 4.15Å; Y80-F103 HydrophobicContact CD2-CB 4.32Å; P99-F103 WeakPolarHBondContact O-CB 3.38Å; P99-F103 PolarHBondContact O-N 2.97Å; Y100-F103 PolarHBondContact O-N 3.48Å; F103-K105 VanDerWaalsContact C-N 3.35Å; F103-K105 PolarHBondContact O-N 3.3Å; F103-C106 WeakPolarHBondContact O-CB 3.4Å; F103-C106 PolarHBondContact O-N 2.99Å; F103-C106 VanDerWaalsContact O-N 3.16Å; F103-L107 HydrophobicContact CD1-CD1 4.22Å; F103-L107 HydrophobicContact CE1-CD1 3.89Å; F103-L107 HydrophobicContact CE1-CG 4.49Å; F103-L107 HydrophobicContact CZ-CD1 4.29Å; F103-L107 HydrophobicContact CZ-CD2 4.41Å; F103-L107 HydrophobicContact CZ-CG 4.48Å; F103-L107 PolarHBondContact O-N 3.04Å; F103-L107 VanDerWaalsContact O-N 3.08Å; F103-L113 HydrophobicContact CZ-CD2 4.02Å
104	Q	98.1	Very high	96.2	Very high	90 Å²	90	61.3 Å²	61.3	42%	0.421	30%	0.299	S	S	.	.	H	α-helix	trans	-58.5	-47.9	173	-163.6	65.6	3.9	0	0	110.7	Y100 C106 L107 T108	Y100-Q104 PolarHBondContact O-N 3.07Å; Q104-C106 VanDerWaalsContact C-N 3.32Å; Q104-C106 PolarHBondContact O-N 3.39Å; Q104-L107 WeakPolarHBondContact O-CB 3.07Å; Q104-L107 PolarHBondContact O-N 3.08Å; Q104-T108 PolarHBondContact O-N 3.35Å; Q104-T108 PolarHBondContact O-OG1 3.08Å
105	K	98.1	Very high	95.9	Very high	68 Å²	68	59 Å²	59	30%	0.296	29%	0.292	S	S	.	.	H	α-helix	trans	-61.6	-36	175.7	-167	173.8	-179.9	-171.3	0	112.8	P47 V48 I90 C101 R102 F103 L107 T108 V109	P47-K105 WeakPolarHBondContact O-CE 3.06Å; V48-K105 VanDerWaalsContact O-CD 3.29Å; V48-K105 WeakPolarHBondContact O-CD 3.13Å; V48-K105 WeakPolarHBondContact O-CE 3.39Å; V48-K105 PolarHBondContact O-NZ 2.91Å; I90-K105 HydrophobicContact CB-CD 3.91Å; I90-K105 HydrophobicContact CG1-CD 4.09Å; I90-K105 HydrophobicContact CG2-CD 4.48Å; I90-K105 PolarHBondContact O-NZ 2.94Å; C101-K105 VanDerWaalsContact O-CB 3.23Å; C101-K105 WeakPolarHBondContact O-CB 3.35Å; C101-K105 PolarHBondContact O-N 2.91Å; R102-K105 PolarHBondContact O-N 2.97Å; F103-K105 VanDerWaalsContact C-N 3.35Å; F103-K105 PolarHBondContact O-N 3.3Å; K105-L107 VanDerWaalsContact C-N 3.34Å; K105-L107 PolarHBondContact O-N 2.84Å; K105-T108 PolarHBondContact O-N 3.47Å; K105-V109 HydrophobicContact CG-CG1 4.42Å; K105-V109 WeakPolarHBondContact O-CG1 3.29Å; K105-V109 WeakPolarHBondContact O-CG2 3.23Å; K105-V109 PolarHBondContact O-N 3.37Å
106	C	98.1	Very high	95.7	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-58.2	-44.4	171.1	-71.7	0	0	0	0	112	F70 R102 F103 Q104 V109 M111	F70-C106 HydrophobicContact CD2-CB 3.68Å; F70-C106 HydrophobicContact CE2-CB 4.08Å; R102-C106 PolarHBondContact O-N 3.4Å; R102-C106 PolarHBondContact O-SG 2.86Å; F103-C106 WeakPolarHBondContact O-CB 3.4Å; F103-C106 PolarHBondContact O-N 2.99Å; F103-C106 VanDerWaalsContact O-N 3.16Å; Q104-C106 VanDerWaalsContact C-N 3.32Å; Q104-C106 PolarHBondContact O-N 3.39Å; C106-V109 WeakPolarHBondContact O-CG2 3.21Å; C106-M111 HydrophobicContact CB-CB 4.29Å; C106-M111 HydrophobicContact CB-CG 4.19Å; C106-M111 HydrophobicContact CB-SD 3.62Å; C106-M111 WeakPolarHBondContact O-CB 3.43Å; C106-M111 WeakPolarHBondContact O-CG 3.28Å; C106-M111 PolarHBondContact O-N 3.48Å; C106-M111 VanDerWaalsContact SG-SD 3.64Å
107	L	97.4	Very high	95.1	Very high	58 Å²	58	54.3 Å²	54.3	30%	0.304	27%	0.271	S	S	.	.	H	α-helix	trans	-67.5	-45	176.9	-62.5	172	0	0	0	111.3	F70 F103 Q104 K105 V109 G110 L113	F70-L107 HydrophobicContact CE2-CD2 3.89Å; F70-L107 HydrophobicContact CZ-CD2 4.24Å; F103-L107 HydrophobicContact CD1-CD1 4.22Å; F103-L107 HydrophobicContact CE1-CD1 3.89Å; F103-L107 HydrophobicContact CE1-CG 4.49Å; F103-L107 HydrophobicContact CZ-CD1 4.29Å; F103-L107 HydrophobicContact CZ-CD2 4.41Å; F103-L107 HydrophobicContact CZ-CG 4.48Å; F103-L107 PolarHBondContact O-N 3.04Å; F103-L107 VanDerWaalsContact O-N 3.08Å; Q104-L107 WeakPolarHBondContact O-CB 3.07Å; Q104-L107 PolarHBondContact O-N 3.08Å; K105-L107 VanDerWaalsContact C-N 3.34Å; K105-L107 PolarHBondContact O-N 2.84Å; L107-V109 VanDerWaalsContact C-N 3.32Å; L107-V109 PolarHBondContact O-N 3.16Å; L107-G110 WeakPolarHBondContact O-CA 3.34Å; L107-G110 PolarHBondContact O-N 3.46Å; L107-L113 HydrophobicContact CD2-CD1 4.41Å; L107-L113 HydrophobicContact CD2-CD2 3.92Å; L107-L113 HydrophobicContact CD2-CG 3.99Å
108	T	96.4	Very high	94.2	Very high	112 Å²	112	50.8 Å²	50.8	69%	0.687	28%	0.28	S	S	*	.	H	α-helix	trans	-59.4	-37.4	178.7	-54.8	0	0	0	0	112.9	Q104 K105 G110	Q104-T108 PolarHBondContact O-N 3.35Å; Q104-T108 PolarHBondContact O-OG1 3.08Å; K105-T108 PolarHBondContact O-N 3.47Å; T108-G110 PolarHBondContact O-N 3.02Å
109	V	94.6	Very high	93	Very high	41 Å²	41	53.6 Å²	53.6	25%	0.248	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	5.3	174.5	-53.6	0	0	0	0	113.7	P47 V48 L60 K105 C106 L107 M111	P47-V109 HydrophobicContact CB-CB 4.33Å; P47-V109 HydrophobicContact CB-CG1 4.06Å; P47-V109 HydrophobicContact CG-CB 4.25Å; P47-V109 HydrophobicContact CG-CG1 4.47Å; P47-V109 HydrophobicContact CG-CG2 4.27Å; V48-V109 HydrophobicContact CG2-CG2 3.63Å; L60-V109 HydrophobicContact CD1-CB 4.34Å; L60-V109 HydrophobicContact CD1-CG2 4.01Å; L60-V109 WeakPolarHBondContact CD1-O 3.19Å; L60-V109 WeakPolarHBondContact CD2-O 3.33Å; K105-V109 HydrophobicContact CG-CG1 4.42Å; K105-V109 WeakPolarHBondContact O-CG1 3.29Å; K105-V109 WeakPolarHBondContact O-CG2 3.23Å; K105-V109 PolarHBondContact O-N 3.37Å; C106-V109 WeakPolarHBondContact O-CG2 3.21Å; L107-V109 VanDerWaalsContact C-N 3.32Å; L107-V109 PolarHBondContact O-N 3.16Å; V109-M111 HydrophobicContact CG2-CG 4.38Å
110	G	93.6	Very high	91.8	Very high	36 Å²	36	61.3 Å²	61.3	37%	0.371	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	21.7	172.7	0	0	0	0	0	116.4	L60 L107 T108 K112	L60-G110 WeakPolarHBondContact CD2-O 3.42Å; L107-G110 WeakPolarHBondContact O-CA 3.34Å; L107-G110 PolarHBondContact O-N 3.46Å; T108-G110 PolarHBondContact O-N 3.02Å; G110-K112 PolarHBondContact O-N 3.11Å
111	M	96.1	Very high	90.5	Very high	5 Å²	5	66 Å²	66	3%	0.025	34%	0.344	C	S	.	.			trans	-69.1	120	171.5	-63.2	-170.7	76.8	0	0	110.4	V48 Y58 L60 T62 F70 C106 V109	V48-M111 HydrophobicContact CG2-SD 4.39Å; Y58-M111 HydrophobicContact CD2-CE 3.69Å; Y58-M111 HydrophobicContact CG-CE 4.33Å; Y58-M111 CarbonylContact O-C 3.22Å; Y58-M111 WeakPolarHBondContact O-CA 3.25Å; L60-M111 HydrophobicContact CD2-CB 4.33Å; L60-M111 HydrophobicContact CD2-CG 3.68Å; T62-M111 HydrophobicContact CG2-SD 4.23Å; F70-M111 HydrophobicContact CB-CE 3.64Å; F70-M111 HydrophobicContact CB-SD 4.18Å; F70-M111 HydrophobicContact CD1-CB 4.36Å; F70-M111 HydrophobicContact CD1-CE 3.9Å; F70-M111 HydrophobicContact CD2-CB 3.92Å; F70-M111 HydrophobicContact CD2-CE 4.25Å; F70-M111 HydrophobicContact CD2-SD 4.06Å; F70-M111 HydrophobicContact CE1-CB 4.03Å; F70-M111 HydrophobicContact CE2-CB 3.56Å; F70-M111 HydrophobicContact CG-CB 4.3Å; F70-M111 HydrophobicContact CG-CE 3.68Å; F70-M111 HydrophobicContact CG-SD 4.09Å; F70-M111 HydrophobicContact CZ-CB 3.62Å; F70-M111 VanDerWaalsContact CZ-O 3.29Å; F70-M111 WeakPolarHBondContact CZ-O 2.98Å; C106-M111 HydrophobicContact CB-CB 4.29Å; C106-M111 HydrophobicContact CB-CG 4.19Å; C106-M111 HydrophobicContact CB-SD 3.62Å; C106-M111 WeakPolarHBondContact O-CB 3.43Å; C106-M111 WeakPolarHBondContact O-CG 3.28Å; C106-M111 PolarHBondContact O-N 3.48Å; C106-M111 VanDerWaalsContact SG-SD 3.64Å; V109-M111 HydrophobicContact CG2-CG 4.38Å
112	K	92.1	Very high	89.2	Confident	68 Å²	68	78 Å²	78	30%	0.296	39%	0.388	S	S	.	.			trans	-84.4	117.8	-171.5	-71.2	-176.9	172.8	-166.4	0	112.1	Y58 F70 G110 E114 A115 F128	Y58-K112 WeakPolarHBondContact O-CB 3.48Å; Y58-K112 PolarHBondContact O-N 2.98Å; F70-K112 WeakPolarHBondContact CE1-O 3.16Å; G110-K112 PolarHBondContact O-N 3.11Å; K112-E114 VanDerWaalsContact C-N 3.31Å; K112-E114 WeakPolarHBondContact CB-OE1 3.28Å; K112-E114 WeakPolarHBondContact CB-OE2 3.32Å; K112-E114 WeakPolarHBondContact CD-OE1 3.45Å; K112-E114 PolarHBondContact O-N 3.4Å; K112-A115 HydrophobicContact CB-CB 3.97Å; K112-A115 WeakPolarHBondContact O-CB 3.35Å; K112-A115 PolarHBondContact O-N 2.95Å; K112-F128 HydrophobicContact CD-CD1 4.4Å; K112-F128 HydrophobicContact CD-CE1 3.74Å; K112-F128 HydrophobicContact CD-CZ 4.08Å
113	L	93.4	Very high	87.7	Confident	84 Å²	84	80 Å²	80	44%	0.44	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-58.5	-44.7	177.8	-67.9	173.1	0	0	0	111	F70 V74 F103 L107 A115 V116	F70-L113 HydrophobicContact CE2-CD2 4.39Å; F70-L113 HydrophobicContact CZ-CD2 3.92Å; F70-L113 HydrophobicContact CZ-CG 4.48Å; V74-L113 HydrophobicContact CG1-CD2 4.35Å; V74-L113 HydrophobicContact CG2-CD2 3.48Å; V74-L113 VanDerWaalsContact CG2-CD2 3.48Å; F103-L113 HydrophobicContact CZ-CD2 4.02Å; L107-L113 HydrophobicContact CD2-CD1 4.41Å; L107-L113 HydrophobicContact CD2-CD2 3.92Å; L107-L113 HydrophobicContact CD2-CG 3.99Å; L113-A115 PolarHBondContact O-N 2.98Å; L113-A115 VanDerWaalsContact O-N 3.14Å; L113-V116 WeakPolarHBondContact O-CB 3.36Å; L113-V116 PolarHBondContact O-N 2.86Å
114	E	89.4	Confident	86	Confident	99 Å²	99	81.3 Å²	81.3	46%	0.463	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-72.5	-1.5	-178.2	79.3	-68.9	172.5	0	0	114.2	K112 K127 F128	K112-E114 VanDerWaalsContact C-N 3.31Å; K112-E114 WeakPolarHBondContact CB-OE1 3.28Å; K112-E114 WeakPolarHBondContact CB-OE2 3.32Å; K112-E114 WeakPolarHBondContact CD-OE1 3.45Å; K112-E114 PolarHBondContact O-N 3.4Å; E114-K127 WeakPolarHBondContact O-CE 3.32Å; E114-K127 PolarHBondContact O-NZ 2.97Å; E114-F128 HydrophobicContact CG-CZ 4.02Å
115	A	89.3	Confident	84.4	Confident	21 Å²	21	88.7 Å²	88.7	17%	0.174	46%	0.461	C	S	.	.	G	3₁₀ helix	trans	-89.1	-13.5	167.2	0	0	0	0	0	113.2	Y58 K112 L113 F128	Y58-A115 HydrophobicContact CD1-CB 3.99Å; K112-A115 HydrophobicContact CB-CB 3.97Å; K112-A115 WeakPolarHBondContact O-CB 3.35Å; K112-A115 PolarHBondContact O-N 2.95Å; L113-A115 PolarHBondContact O-N 2.98Å; L113-A115 VanDerWaalsContact O-N 3.14Å; A115-F128 HydrophobicContact CB-CD2 3.72Å; A115-F128 HydrophobicContact CB-CE2 3.41Å; A115-F128 VanDerWaalsContact CB-CE2 3.41Å; A115-F128 HydrophobicContact CB-CZ 4.21Å
116	V	90.1	Very high	82.9	Confident	17 Å²	17	89.8 Å²	89.8	10%	0.103	47%	0.47	C	S	.	.	S	Bend	trans	-83.5	124.1	169.2	-174.3	0	0	0	0	108	Y58 F70 V74 Q75 L113	Y58-V116 HydrophobicContact CD1-CG2 3.66Å; Y58-V116 HydrophobicContact CE1-CB 4.37Å; Y58-V116 HydrophobicContact CE1-CG2 3.74Å; Y58-V116 HydrophobicContact CG-CG2 4.26Å; F70-V116 HydrophobicContact CD1-CG2 3.79Å; F70-V116 HydrophobicContact CE1-CG2 3.67Å; V74-V116 HydrophobicContact CB-CB 4.18Å; V74-V116 HydrophobicContact CB-CG1 4.09Å; V74-V116 HydrophobicContact CB-CG2 3.99Å; V74-V116 HydrophobicContact CG1-CB 3.82Å; V74-V116 HydrophobicContact CG1-CG1 3.99Å; V74-V116 HydrophobicContact CG1-CG2 4.05Å; V74-V116 HydrophobicContact CG2-CG2 4.13Å; Q75-V116 HydrophobicContact CG-CG1 3.41Å; Q75-V116 VanDerWaalsContact CG-CG1 3.41Å; L113-V116 WeakPolarHBondContact O-CB 3.36Å; L113-V116 PolarHBondContact O-N 2.86Å
117	R	84.3	Confident	81.8	Confident	98 Å²	98	96.9 Å²	96.9	37%	0.37	50%	0.501	S	S	.	.			trans	-78.2	143.9	175.5	-57.1	-170.5	-176.8	148.1	-0.7	111.5	Q75 D119 G123 G124 R125	Q75-R117 PolarHBondContact NE2-O 3.42Å; R117-D119 WeakPolarHBondContact CB-OD1 3.43Å; R117-D119 VanDerWaalsContact CD-OD1 3.26Å; R117-D119 WeakPolarHBondContact CD-OD1 3.4Å; R117-G123 PolarHBondContact NH1-O 3.37Å; R117-G124 VanDerWaalsContact NH2-C 3.29Å; R117-G124 PolarHBondContact NH2-O 3.17Å; R117-R125 PolarHBondContact NH2-O 3.21Å
118	A	77.7	Confident	80.8	Confident	104 Å²	104	95.4 Å²	95.4	86%	0.86	49%	0.492	S	S	*	.	S	Bend	trans	-72.5	-33.7	172.7	0	0	0	0	0	111.8
119	D	73.5	Confident	79.7	Confident	67 Å²	67	90.8 Å²	90.8	36%	0.358	47%	0.467	S	S	.	.	S	Bend	trans	-72.9	146.6	175.6	76.4	-40	0	0	0	111.6	R117 M121	R117-D119 WeakPolarHBondContact CB-OD1 3.43Å; R117-D119 VanDerWaalsContact CD-OD1 3.26Å; R117-D119 WeakPolarHBondContact CD-OD1 3.4Å; D119-M121 VanDerWaalsContact C-N 3.29Å; D119-M121 HydrophobicContact CB-CG 4.34Å; D119-M121 VanDerWaalsContact OD2-CB 3.24Å; D119-M121 WeakPolarHBondContact OD2-CB 3.2Å; D119-M121 WeakPolarHBondContact OD2-CG 3.45Å
120	R	72.4	Confident	78.7	Confident	207 Å²	207	93.4 Å²	93.4	78%	0.781	49%	0.485	S	S	*	.			trans	-90.1	8.7	175.9	-67.4	-176.3	176.3	-178.4	-0.8	112.5
121	M	71.1	Confident	77.9	Confident	153 Å²	153	95.1 Å²	95.1	75%	0.754	48%	0.484	S	S	*	.			trans	-69.2	152.9	-177.8	-52.2	-158	-168.4	0	0	112.1	D119	D119-M121 VanDerWaalsContact C-N 3.29Å; D119-M121 HydrophobicContact CB-CG 4.34Å; D119-M121 VanDerWaalsContact OD2-CB 3.24Å; D119-M121 WeakPolarHBondContact OD2-CB 3.2Å; D119-M121 WeakPolarHBondContact OD2-CG 3.45Å
122	R	71.7	Confident	77.2	Confident	258 Å²	258	96.2 Å²	96.2	97%	0.974	49%	0.488	S	S	*	.			trans	-104.8	114.6	-175.2	-169.3	178	-175.2	178.8	0.2	109.6
123	G	65.6	Low	76.1	Confident	55 Å²	55	100 Å²	100	57%	0.567	50%	0.504	S	S	*	.			trans	107.1	173.2	176.4	0	0	0	0	0	114.6	R117	R117-G123 PolarHBondContact NH1-O 3.37Å
124	G	64.1	Low	75	Confident	67 Å²	67	103.6 Å²	103.6	69%	0.691	51%	0.512	S	S	*	.			trans	109.5	149.4	-177.6	0	0	0	0	0	113.7	R117	R117-G124 VanDerWaalsContact NH2-C 3.29Å; R117-G124 PolarHBondContact NH2-O 3.17Å
125	R	63.4	Low	74.2	Confident	244 Å²	244	101.3 Å²	101.3	92%	0.921	50%	0.503	S	S	*	.			trans	-59.3	147.7	-177.2	-84.3	-179.4	176.4	159.3	0.1	112.7	R117	R117-R125 PolarHBondContact NH2-O 3.21Å
126	N	67.6	Low	73.5	Confident	91 Å²	91	107 Å²	107	49%	0.487	52%	0.52	S	S	.	.			trans	-92.6	121.5	176.3	51.1	-4.9	0	0	0	110.3	F128 G129	N126-F128 PolarHBondContact O-N 3.47Å; N126-G129 PolarHBondContact O-N 3.32Å
127	K	73.8	Confident	72.3	Confident	149 Å²	149	106.4 Å²	106.4	65%	0.648	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.8	175.2	67.1	-177.8	-179.7	-177.3	0	113.6	E114	E114-K127 WeakPolarHBondContact O-CE 3.32Å; E114-K127 PolarHBondContact O-NZ 2.97Å
128	F	76.7	Confident	71.5	Confident	28 Å²	28	105.6 Å²	105.6	12%	0.123	52%	0.519	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	1.5	175.6	-63.7	-75.2	0	0	0	114.9	K112 E114 A115 N126 M131 Y132	K112-F128 HydrophobicContact CD-CD1 4.4Å; K112-F128 HydrophobicContact CD-CE1 3.74Å; K112-F128 HydrophobicContact CD-CZ 4.08Å; E114-F128 HydrophobicContact CG-CZ 4.02Å; A115-F128 HydrophobicContact CB-CD2 3.72Å; A115-F128 HydrophobicContact CB-CE2 3.41Å; A115-F128 VanDerWaalsContact CB-CE2 3.41Å; A115-F128 HydrophobicContact CB-CZ 4.21Å; N126-F128 PolarHBondContact O-N 3.47Å; F128-M131 HydrophobicContact CD1-SD 4Å; F128-M131 WeakPolarHBondContact O-CB 3.29Å; F128-M131 PolarHBondContact O-N 3.05Å; F128-M131 VanDerWaalsContact O-N 3.07Å; F128-Y132 HydrophobicContact CB-CD2 4.33Å; F128-Y132 HydrophobicContact CB-CE1 3.99Å; F128-Y132 HydrophobicContact CB-CE2 3.66Å; F128-Y132 VanDerWaalsContact CB-CZ 3.46Å; F128-Y132 WeakPolarHBondContact O-CD2 3.46Å; F128-Y132 PolarHBondContact O-N 2.86Å
129	G	73.9	Confident	71.2	Confident	15 Å²	15	103.8 Å²	103.8	16%	0.155	49%	0.492	C	S	.	.	H	α-helix	trans	-50.8	-47.5	177.6	0	0	0	0	0	114	N126 M131 Y132 K133	N126-G129 PolarHBondContact O-N 3.32Å; G129-M131 PolarHBondContact O-N 2.91Å; G129-Y132 PolarHBondContact O-N 2.95Å; G129-K133 PolarHBondContact O-N 3.34Å
130	P	72.2	Confident	71	Confident	96 Å²	96	104.8 Å²	104.8	62%	0.623	50%	0.495	S	S	*	.	H	α-helix	trans	-61.2	-39.4	175.1	-25.3	35.8	0	0	0	113.6	K133 R134	P130-K133 PolarHBondContact O-N 3.27Å; P130-R134 PolarHBondContact O-N 3.07Å
131	M	77.9	Confident	70.7	Confident	71 Å²	71	96.1 Å²	96.1	35%	0.35	46%	0.463	S	S	.	.	H	α-helix	trans	-61.5	-44.9	175.7	178.9	-172.4	164.3	0	0	111.3	G59 F128 G129 K133 R134 D135	G59-M131 VanDerWaalsContact O-CE 3.3Å; G59-M131 WeakPolarHBondContact O-CE 3.3Å; F128-M131 HydrophobicContact CD1-SD 4Å; F128-M131 WeakPolarHBondContact O-CB 3.29Å; F128-M131 PolarHBondContact O-N 3.05Å; F128-M131 VanDerWaalsContact O-N 3.07Å; G129-M131 PolarHBondContact O-N 2.91Å; M131-K133 VanDerWaalsContact C-N 3.33Å; M131-K133 PolarHBondContact O-N 3.31Å; M131-R134 PolarHBondContact O-N 3.23Å; M131-D135 PolarHBondContact O-N 3.29Å
132	Y	80.5	Confident	70.4	Confident	29 Å²	29	95.8 Å²	95.8	11%	0.114	46%	0.458	C	S	.	.	H	α-helix	trans	-68.8	-30.7	179	-53.9	-34.7	0	0	0	113.1	Y56 G59 F128 G129 R136	Y56-Y132 AromaticContact CD1-CD1 3.46Å; Y56-Y132 HydrophobicContact CD1-CD1 3.46Å; Y56-Y132 VanDerWaalsContact CD1-CD1 3.46Å; Y56-Y132 HydrophobicContact CD1-CE1 4.04Å; Y56-Y132 HydrophobicContact CD1-CG 4Å; Y56-Y132 HydrophobicContact CE1-CD1 4.16Å; Y56-Y132 AromaticContact CG-CD1 3.91Å; Y56-Y132 HydrophobicContact CG-CD1 3.91Å; Y56-Y132 HydrophobicContact CG-CE1 4.48Å; Y56-Y132 HydrophobicContact CG-CG 4.02Å; G59-Y132 PolarHBondContact N-OH 3.07Å; G59-Y132 VanDerWaalsContact N-OH 3.09Å; F128-Y132 HydrophobicContact CB-CD2 4.33Å; F128-Y132 HydrophobicContact CB-CE1 3.99Å; F128-Y132 HydrophobicContact CB-CE2 3.66Å; F128-Y132 VanDerWaalsContact CB-CZ 3.46Å; F128-Y132 WeakPolarHBondContact O-CD2 3.46Å; F128-Y132 PolarHBondContact O-N 2.86Å; G129-Y132 PolarHBondContact O-N 2.95Å; Y132-R136 VanDerWaalsContact O-CB 3.28Å; Y132-R136 WeakPolarHBondContact O-CB 3.41Å; Y132-R136 PolarHBondContact O-N 3Å; Y132-R136 VanDerWaalsContact O-N 3.17Å
133	K	70.4	Confident	70.2	Confident	147 Å²	147	89.3 Å²	89.3	64%	0.639	44%	0.436	S	S	*	.	H	α-helix	trans	-63.7	-49.3	169	-73.4	-174.8	175.3	-167.5	0	110.3	G129 P130 M131 R136 A137	G129-K133 PolarHBondContact O-N 3.34Å; P130-K133 PolarHBondContact O-N 3.27Å; M131-K133 VanDerWaalsContact C-N 3.33Å; M131-K133 PolarHBondContact O-N 3.31Å; K133-R136 PolarHBondContact O-N 3.03Å; K133-A137 VanDerWaalsContact O-CB 3.29Å; K133-A137 WeakPolarHBondContact O-CB 3.48Å; K133-A137 PolarHBondContact O-N 3.47Å
134	R	69.4	Low	70	Confident	160 Å²	160	87.1 Å²	87.1	60%	0.604	41%	0.413	S	S	*	.	H	α-helix	trans	-60.8	-45.6	179.9	-158.1	-175.4	-153.5	93.3	0.9	113	P130 M131 A137 L138	P130-R134 PolarHBondContact O-N 3.07Å; M131-R134 PolarHBondContact O-N 3.23Å; R134-A137 WeakPolarHBondContact O-CB 3.37Å; R134-A137 PolarHBondContact O-N 2.88Å; R134-L138 HydrophobicContact CG-CD1 4.46Å; R134-L138 WeakPolarHBondContact O-CG 3.33Å; R134-L138 PolarHBondContact O-N 2.86Å
135	D	71.8	Confident	69.9	Low	50 Å²	50	87 Å²	87	27%	0.267	40%	0.396	S	S	.	.	H	α-helix	trans	-65.2	-42.1	177.9	-170.1	61.6	0	0	0	111.9	Y56 M131 A137 L138 K139	Y56-D135 HydrophobicContact CE1-CB 4.18Å; Y56-D135 WeakPolarHBondContact CE1-OD2 3.38Å; Y56-D135 PolarHBondContact OH-OD2 3.15Å; M131-D135 PolarHBondContact O-N 3.29Å; D135-A137 VanDerWaalsContact C-N 3.32Å; D135-A137 PolarHBondContact O-N 3.22Å; D135-L138 PolarHBondContact O-N 2.87Å; D135-K139 WeakPolarHBondContact O-CG 3.49Å; D135-K139 PolarHBondContact O-N 2.79Å; D135-K139 VanDerWaalsContact OD2-CE 3.28Å; D135-K139 WeakPolarHBondContact OD2-CE 3.4Å; D135-K139 IonicContact OD2-NZ 3.98Å; D135-K139 PolarHBondContact OD2-NZ 3.03Å
136	R	76.4	Confident	70.1	Confident	141 Å²	141	79.5 Å²	79.5	53%	0.532	37%	0.374	S	S	.	.	H	α-helix	trans	-60.7	-42.8	172.7	-174.9	-174	-61.1	-159.1	-3.4	111.5	Y56 Y132 K133 K139 Q140	Y56-R136 PolarHBondContact OH-N 2.96Å; Y132-R136 VanDerWaalsContact O-CB 3.28Å; Y132-R136 WeakPolarHBondContact O-CB 3.41Å; Y132-R136 PolarHBondContact O-N 3Å; Y132-R136 VanDerWaalsContact O-N 3.17Å; K133-R136 PolarHBondContact O-N 3.03Å; R136-K139 PolarHBondContact O-N 3.1Å; R136-Q140 HydrophobicContact CG-CG 4.48Å; R136-Q140 WeakPolarHBondContact O-CB 3.35Å; R136-Q140 WeakPolarHBondContact O-CG 3.38Å; R136-Q140 PolarHBondContact O-N 3.4Å
137	A	64.1	Low	69.9	Low	5 Å²	5	82.3 Å²	82.3	4%	0.041	38%	0.377	C	S	.	.	H	α-helix	trans	-60.6	-52.9	178.2	0	0	0	0	0	110.9	K133 R134 D135 K139 Q140 Q141 L443 M447	K133-A137 VanDerWaalsContact O-CB 3.29Å; K133-A137 WeakPolarHBondContact O-CB 3.48Å; K133-A137 PolarHBondContact O-N 3.47Å; R134-A137 WeakPolarHBondContact O-CB 3.37Å; R134-A137 PolarHBondContact O-N 2.88Å; D135-A137 VanDerWaalsContact C-N 3.32Å; D135-A137 PolarHBondContact O-N 3.22Å; A137-K139 VanDerWaalsContact C-N 3.29Å; A137-K139 PolarHBondContact O-N 3.33Å; A137-Q140 CarbonylContact O-C 3.57Å; A137-Q140 WeakPolarHBondContact O-CB 3.34Å; A137-Q140 PolarHBondContact O-N 3.3Å; A137-Q141 WeakPolarHBondContact O-CB 3.45Å; A137-Q141 PolarHBondContact O-N 3.43Å; A137-L443 HydrophobicContact CB-CD1 4.32Å; A137-L443 HydrophobicContact CB-CD2 3.54Å; A137-L443 HydrophobicContact CB-CG 3.97Å; A137-M447 HydrophobicContact CB-CE 4.28Å; A137-M447 HydrophobicContact CB-SD 3.35Å; A137-M447 WeakPolarHBondContact CB-SD 3.29Å
138	L	67.6	Low	69.1	Low	80 Å²	80	75.6 Å²	75.6	42%	0.419	35%	0.35	S	S	.	.	H	α-helix	trans	-56.4	-41.3	177	-71.8	166.1	0	0	0	112.1	R134 D135 Q141 K142	R134-L138 HydrophobicContact CG-CD1 4.46Å; R134-L138 WeakPolarHBondContact O-CG 3.33Å; R134-L138 PolarHBondContact O-N 2.86Å; D135-L138 PolarHBondContact O-N 2.87Å; L138-Q141 PolarHBondContact O-N 2.9Å; L138-K142 WeakPolarHBondContact O-CB 3.48Å; L138-K142 PolarHBondContact O-N 3.1Å
139	K	72	Confident	68	Low	66 Å²	66	78 Å²	78	29%	0.287	36%	0.364	S	S	.	.	H	α-helix	trans	-67.2	-39.3	174.9	-71.2	177.5	-178.3	-175.2	0	112.9	E44 D135 R136 A137 K143	E44-K139 IonicContact OE1-NZ 3.5Å; E44-K139 PolarHBondContact OE1-NZ 3.26Å; D135-K139 WeakPolarHBondContact O-CG 3.49Å; D135-K139 PolarHBondContact O-N 2.79Å; D135-K139 VanDerWaalsContact OD2-CE 3.28Å; D135-K139 WeakPolarHBondContact OD2-CE 3.4Å; D135-K139 IonicContact OD2-NZ 3.98Å; D135-K139 PolarHBondContact OD2-NZ 3.03Å; R136-K139 PolarHBondContact O-N 3.1Å; A137-K139 VanDerWaalsContact C-N 3.29Å; A137-K139 PolarHBondContact O-N 3.33Å; K139-K143 WeakPolarHBondContact O-CB 3.49Å; K139-K143 WeakPolarHBondContact O-CG 3.36Å; K139-K143 PolarHBondContact O-N 3.4Å
140	Q	69.4	Low	66.9	Low	88 Å²	88	77.8 Å²	77.8	41%	0.411	36%	0.361	S	S	.	.	H	α-helix	trans	-66.3	-41	174.4	-76.8	175	-45.2	0	0	111.6	R136 A137 K143 A144	R136-Q140 HydrophobicContact CG-CG 4.48Å; R136-Q140 WeakPolarHBondContact O-CB 3.35Å; R136-Q140 WeakPolarHBondContact O-CG 3.38Å; R136-Q140 PolarHBondContact O-N 3.4Å; A137-Q140 CarbonylContact O-C 3.57Å; A137-Q140 WeakPolarHBondContact O-CB 3.34Å; A137-Q140 PolarHBondContact O-N 3.3Å; Q140-K143 CarbonylContact O-C 3.55Å; Q140-K143 PolarHBondContact O-N 3Å; Q140-A144 VanDerWaalsContact O-CB 3.32Å; Q140-A144 WeakPolarHBondContact O-CB 3.32Å; Q140-A144 PolarHBondContact O-N 2.96Å
141	Q	64.3	Low	66	Low	26 Å²	26	77.1 Å²	77.1	12%	0.121	35%	0.352	C	S	.	.	H	α-helix	trans	-61.3	-48.7	174.4	172.6	-175.4	70.4	0	0	111.4	A137 L138 K143 A144 L145 N439 L443 F457	A137-Q141 WeakPolarHBondContact O-CB 3.45Å; A137-Q141 PolarHBondContact O-N 3.43Å; L138-Q141 PolarHBondContact O-N 2.9Å; Q141-K143 VanDerWaalsContact C-N 3.34Å; Q141-K143 PolarHBondContact O-N 3.16Å; Q141-A144 PolarHBondContact O-N 3.38Å; Q141-A144 VanDerWaalsContact O-N 3.1Å; Q141-L145 WeakPolarHBondContact O-CB 3.49Å; Q141-L145 PolarHBondContact O-N 2.89Å; Q141-N439 PolarHBondContact NE2-O 3.16Å; Q141-L443 HydrophobicContact CB-CD2 3.83Å; Q141-L443 HydrophobicContact CG-CD2 4.42Å; Q141-F457 HydrophobicContact CB-CE1 3.88Å; Q141-F457 HydrophobicContact CB-CZ 4.37Å; Q141-F457 HydrophobicContact CG-CE1 3.82Å; Q141-F457 HydrophobicContact CG-CZ 3.89Å
142	K	65.4	Low	64.5	Low	146 Å²	146	75.8 Å²	75.8	64%	0.635	35%	0.345	S	S	*	.	H	α-helix	trans	-59.3	-43	174.8	-170.6	168.7	-175.4	169.8	0	111.9	L138 I146	L138-K142 WeakPolarHBondContact O-CB 3.48Å; L138-K142 PolarHBondContact O-N 3.1Å; K142-I146 HydrophobicContact CG-CD1 4Å; K142-I146 WeakPolarHBondContact O-CB 3.47Å; K142-I146 WeakPolarHBondContact O-CD1 3.48Å; K142-I146 VanDerWaalsContact O-CG1 3.22Å; K142-I146 WeakPolarHBondContact O-CG1 3.31Å; K142-I146 PolarHBondContact O-N 2.83Å
143	K	67.6	Low	62.9	Low	121 Å²	121	80.4 Å²	80.4	53%	0.526	37%	0.37	S	S	.	.	H	α-helix	trans	-67	-30.9	174.2	-73.3	-173.1	176.9	-162	0	113.5	K139 Q140 Q141 R147	K139-K143 WeakPolarHBondContact O-CB 3.49Å; K139-K143 WeakPolarHBondContact O-CG 3.36Å; K139-K143 PolarHBondContact O-N 3.4Å; Q140-K143 CarbonylContact O-C 3.55Å; Q140-K143 PolarHBondContact O-N 3Å; Q141-K143 VanDerWaalsContact C-N 3.34Å; Q141-K143 PolarHBondContact O-N 3.16Å; K143-R147 WeakPolarHBondContact O-CB 3.44Å; K143-R147 WeakPolarHBondContact O-CG 3.37Å; K143-R147 PolarHBondContact O-N 2.79Å; K143-R147 PolarHBondContact O-NE 3.3Å; K143-R147 VanDerWaalsContact O-NE 3.15Å
144	A	62.1	Low	61.7	Low	10 Å²	10	79.1 Å²	79.1	8%	0.083	37%	0.366	C	S	.	.	H	α-helix	trans	-74	-45	175.7	0	0	0	0	0	111.2	Q140 Q141 R147 A148	Q140-A144 VanDerWaalsContact O-CB 3.32Å; Q140-A144 WeakPolarHBondContact O-CB 3.32Å; Q140-A144 PolarHBondContact O-N 2.96Å; Q141-A144 PolarHBondContact O-N 3.38Å; Q141-A144 VanDerWaalsContact O-N 3.1Å; A144-R147 PolarHBondContact O-N 3.45Å; A144-A148 WeakPolarHBondContact O-CB 3.36Å; A144-A148 PolarHBondContact O-N 3.39Å
145	L	61.9	Low	60.6	Low	64 Å²	64	73.5 Å²	73.5	34%	0.335	35%	0.354	S	S	.	.	H	α-helix	trans	-63	-43.4	177.5	-173.9	65.5	0	0	0	111.8	Q141 A148 N149	Q141-L145 WeakPolarHBondContact O-CB 3.49Å; Q141-L145 PolarHBondContact O-N 2.89Å; L145-A148 PolarHBondContact O-N 3.03Å; L145-N149 WeakPolarHBondContact O-CB 2.98Å; L145-N149 VanDerWaalsContact O-CG 3.29Å; L145-N149 PolarHBondContact O-N 3.45Å
146	I	66.1	Low	59.5	Low	87 Å²	87	76 Å²	76	45%	0.446	37%	0.365	S	S	.	.	H	α-helix	trans	-59.1	-49.3	173.5	-69.7	165.3	0	0	0	110.4	Y38 K142 A148 N149 G150	Y38-I146 PolarHBondContact OH-O 2.97Å; Y38-I146 VanDerWaalsContact OH-O 3.06Å; K142-I146 HydrophobicContact CG-CD1 4Å; K142-I146 WeakPolarHBondContact O-CB 3.47Å; K142-I146 WeakPolarHBondContact O-CD1 3.48Å; K142-I146 VanDerWaalsContact O-CG1 3.22Å; K142-I146 WeakPolarHBondContact O-CG1 3.31Å; K142-I146 PolarHBondContact O-N 2.83Å; I146-A148 PolarHBondContact O-N 3.46Å; I146-N149 PolarHBondContact O-N 3.01Å; I146-G150 PolarHBondContact O-N 3.1Å
147	R	65.3	Low	57.8	Low	149 Å²	149	72.3 Å²	72.3	56%	0.562	36%	0.361	S	S	*	.	H	α-helix	trans	-62.4	-41.2	178.4	-75.9	-176.2	-66.8	-179.2	6.9	113	K143 A144 N149 G150 L151	K143-R147 WeakPolarHBondContact O-CB 3.44Å; K143-R147 WeakPolarHBondContact O-CG 3.37Å; K143-R147 PolarHBondContact O-N 2.79Å; K143-R147 PolarHBondContact O-NE 3.3Å; K143-R147 VanDerWaalsContact O-NE 3.15Å; A144-R147 PolarHBondContact O-N 3.45Å; R147-N149 VanDerWaalsContact C-N 3.33Å; R147-N149 PolarHBondContact O-N 3.06Å; R147-G150 PolarHBondContact O-N 2.88Å; R147-L151 WeakPolarHBondContact O-CB 3.16Å; R147-L151 WeakPolarHBondContact O-CG 2.98Å; R147-L151 PolarHBondContact O-N 3Å
148	A	55.8	Low	56.9	Low	9 Å²	9	78.6 Å²	78.6	7%	0.074	39%	0.39	C	S	.	.	H	α-helix	trans	-62.9	-39	174.8	0	0	0	0	0	111.9	A144 L145 I146 K152 L462	A144-A148 WeakPolarHBondContact O-CB 3.36Å; A144-A148 PolarHBondContact O-N 3.39Å; L145-A148 PolarHBondContact O-N 3.03Å; I146-A148 PolarHBondContact O-N 3.46Å; A148-K152 VanDerWaalsContact O-CB 3.29Å; A148-K152 WeakPolarHBondContact O-CB 3.27Å; A148-K152 PolarHBondContact O-N 3.04Å; A148-L462 HydrophobicContact CB-CD2 4.23Å
149	N	54.2	Low	56.1	Low	78 Å²	78	78 Å²	78	42%	0.417	39%	0.389	S	S	.	.	H	α-helix	trans	-71.6	-32.9	178.2	-74.7	-12.4	0	0	0	113.5	L145 I146 R147 K152 I153	L145-N149 WeakPolarHBondContact O-CB 2.98Å; L145-N149 VanDerWaalsContact O-CG 3.29Å; L145-N149 PolarHBondContact O-N 3.45Å; I146-N149 PolarHBondContact O-N 3.01Å; R147-N149 VanDerWaalsContact C-N 3.33Å; R147-N149 PolarHBondContact O-N 3.06Å; N149-K152 WeakPolarHBondContact O-CB 3.48Å; N149-I153 PolarHBondContact O-N 2.91Å
150	G	51	Low	54.8	Low	10 Å²	10	82.4 Å²	82.4	10%	0.103	41%	0.412	C	S	.	.	H	α-helix	trans	-72.6	-43.7	171	0	0	0	0	0	113	Y38 I146 R147 K152 I153 E154	Y38-G150 VanDerWaalsContact OH-CA 3.3Å; Y38-G150 WeakPolarHBondContact OH-CA 3.21Å; I146-G150 PolarHBondContact O-N 3.1Å; R147-G150 PolarHBondContact O-N 2.88Å; G150-K152 PolarHBondContact O-N 3.35Å; G150-I153 WeakPolarHBondContact O-CA 3.37Å; G150-I153 WeakPolarHBondContact O-CB 3.37Å; G150-I153 PolarHBondContact O-N 3.25Å; G150-E154 PolarHBondContact O-N 3.26Å
151	L	53.4	Low	53.5	Low	82 Å²	82	85.7 Å²	85.7	43%	0.429	43%	0.428	S	S	.	.	H	α-helix	trans	-60.6	-30.4	174.6	-74.4	167.9	0	0	0	112.2	R147 E154 A155 L462	R147-L151 WeakPolarHBondContact O-CB 3.16Å; R147-L151 WeakPolarHBondContact O-CG 2.98Å; R147-L151 PolarHBondContact O-N 3Å; L151-E154 PolarHBondContact O-N 3.46Å; L151-A155 WeakPolarHBondContact O-CB 3.37Å; L151-A155 PolarHBondContact O-N 2.93Å; L151-L462 HydrophobicContact CD1-CD2 3.6Å
152	K	46.2	Very low	52.3	Low	44 Å²	44	88.1 Å²	88.1	19%	0.191	45%	0.453	C	S	.	.	H	α-helix	trans	-63.9	-38.4	171.5	-176.9	-174.7	-171.7	178	0	112.4	A148 N149 G150 M156 D421	A148-K152 VanDerWaalsContact O-CB 3.29Å; A148-K152 WeakPolarHBondContact O-CB 3.27Å; A148-K152 PolarHBondContact O-N 3.04Å; N149-K152 WeakPolarHBondContact O-CB 3.48Å; G150-K152 PolarHBondContact O-N 3.35Å; K152-M156 HydrophobicContact CG-SD 4.34Å; K152-M156 WeakPolarHBondContact O-CB 3.47Å; K152-M156 WeakPolarHBondContact O-CG 3.35Å; K152-M156 PolarHBondContact O-N 3.19Å; K152-M156 VanDerWaalsContact O-N 3.08Å; K152-D421 WeakPolarHBondContact CE-OD2 3.32Å; K152-D421 IonicContact NZ-OD1 3.3Å; K152-D421 PolarHBondContact NZ-OD1 3.15Å; K152-D421 IonicContact NZ-OD2 2.75Å; K152-D421 PolarHBondContact NZ-OD2 3.5Å
153	I	46.2	Very low	50.9	Low	125 Å²	125	85.8 Å²	85.8	64%	0.641	45%	0.45	S	S	*	.	H	α-helix	trans	-68.8	-44.4	175.1	-65.9	166.7	0	0	0	110.3	N149 G150 S157	N149-I153 PolarHBondContact O-N 2.91Å; G150-I153 WeakPolarHBondContact O-CA 3.37Å; G150-I153 WeakPolarHBondContact O-CB 3.37Å; G150-I153 PolarHBondContact O-N 3.25Å; I153-S157 PolarHBondContact O-N 2.74Å; I153-S157 VanDerWaalsContact O-N 3.09Å
154	E	44.5	Very low	49.4	Very low	120 Å²	120	85.3 Å²	85.3	56%	0.561	46%	0.46	S	S	*	.	H	α-helix	trans	-66.8	-43.5	178.6	-66.9	179.7	156	0	0	112.5	G150 L151 S157 Q158	G150-E154 PolarHBondContact O-N 3.26Å; L151-E154 PolarHBondContact O-N 3.46Å; E154-S157 WeakPolarHBondContact O-CB 3.3Å; E154-S157 PolarHBondContact O-N 3.01Å; E154-Q158 WeakPolarHBondContact O-CG 3.47Å; E154-Q158 PolarHBondContact O-N 2.9Å
155	A	47.5	Very low	48.3	Very low	42 Å²	42	91.3 Å²	91.3	35%	0.347	50%	0.495	S	S	.	.	H	α-helix	trans	-65.8	-39.8	177.4	0	0	0	0	0	112.2	L151 S157 Q158 V159	L151-A155 WeakPolarHBondContact O-CB 3.37Å; L151-A155 PolarHBondContact O-N 2.93Å; A155-S157 VanDerWaalsContact C-N 3.29Å; A155-S157 PolarHBondContact O-N 3.22Å; A155-Q158 PolarHBondContact O-N 3.4Å; A155-V159 WeakPolarHBondContact O-CG2 3.49Å; A155-V159 PolarHBondContact O-N 2.72Å
156	M	48.5	Very low	46.9	Very low	104 Å²	104	94.3 Å²	94.3	51%	0.512	51%	0.512	S	S	.	.	H	α-helix	trans	-62.8	-36.9	173.1	-75.1	177.1	65.7	0	0	111.8	K152 M160	K152-M156 HydrophobicContact CG-SD 4.34Å; K152-M156 WeakPolarHBondContact O-CB 3.47Å; K152-M156 WeakPolarHBondContact O-CG 3.35Å; K152-M156 PolarHBondContact O-N 3.19Å; K152-M156 VanDerWaalsContact O-N 3.08Å; M156-M160 WeakPolarHBondContact O-CG 3.34Å; M156-M160 PolarHBondContact O-N 2.83Å
157	S	40.6	Very low	45.6	Very low	63 Å²	63	98.4 Å²	98.4	44%	0.441	53%	0.534	S	S	.	.	H	α-helix	trans	-63.9	-43.3	174.4	-168.6	0	0	0	0	112.3	I153 E154 A155 M160 Q161	I153-S157 PolarHBondContact O-N 2.74Å; I153-S157 VanDerWaalsContact O-N 3.09Å; E154-S157 WeakPolarHBondContact O-CB 3.3Å; E154-S157 PolarHBondContact O-N 3.01Å; A155-S157 VanDerWaalsContact C-N 3.29Å; A155-S157 PolarHBondContact O-N 3.22Å; S157-M160 PolarHBondContact O-N 3.45Å; S157-Q161 PolarHBondContact O-N 2.95Å
158	Q	45.1	Very low	44	Very low	137 Å²	137	97 Å²	97	64%	0.64	54%	0.542	S	S	*	.	H	α-helix	trans	-67.2	-38.5	177.9	-70.8	177.4	0.9	0	0	112.9	E154 A155 Q161 A162	E154-Q158 WeakPolarHBondContact O-CG 3.47Å; E154-Q158 PolarHBondContact O-N 2.9Å; A155-Q158 PolarHBondContact O-N 3.4Å; Q158-Q161 PolarHBondContact O-N 3.48Å; Q158-A162 PolarHBondContact O-N 3.43Å
159	V	50	Low	42.9	Very low	68 Å²	68	104.4 Å²	104.4	41%	0.412	58%	0.579	S	S	.	*	H	α-helix	trans	-65.7	-38	176.5	172.8	0	0	0	0	111.6	A155 Q161 A162	A155-V159 WeakPolarHBondContact O-CG2 3.49Å; A155-V159 PolarHBondContact O-N 2.72Å; V159-Q161 PolarHBondContact O-N 2.94Å; V159-A162 PolarHBondContact O-N 3.2Å; V159-A162 VanDerWaalsContact O-N 3.16Å
160	M	46	Very low	41.7	Very low	157 Å²	157	106 Å²	106	77%	0.773	60%	0.596	S	S	*	*	H	α-helix	trans	-65.9	-22.7	174.9	-72.2	-172.4	71.2	0	0	113.8	M156 S157	M156-M160 WeakPolarHBondContact O-CG 3.34Å; M156-M160 PolarHBondContact O-N 2.83Å; S157-M160 PolarHBondContact O-N 3.45Å
161	Q	41.8	Very low	40.7	Very low	157 Å²	157	111.7 Å²	111.7	73%	0.734	63%	0.634	S	S	*	*	H	α-helix	trans	-86	-11.9	175.6	-68.6	179.6	-1.3	0	0	113.4	S157 Q158 V159	S157-Q161 PolarHBondContact O-N 2.95Å; Q158-Q161 PolarHBondContact O-N 3.48Å; V159-Q161 PolarHBondContact O-N 2.94Å
162	A	38.8	Very low	39.5	Very low	78 Å²	78	112.7 Å²	112.7	65%	0.645	65%	0.654	S	S	*	*	S	Bend	trans	-94.5	10	-176.7	0	0	0	0	0	114.2	Q158 V159 P164	Q158-A162 PolarHBondContact O-N 3.43Å; V159-A162 PolarHBondContact O-N 3.2Å; V159-A162 VanDerWaalsContact O-N 3.16Å; A162-P164 WeakPolarHBondContact O-CD 3.49Å
163	V	35.7	Very low	39	Very low	96 Å²	96	118.1 Å²	118.1	58%	0.582	68%	0.684	S	S	*	*			trans	-87.5	112.3	173.6	-175.9	0	0	0	0	109.2	T165	V163-T165 PolarHBondContact O-N 3.36Å; V163-T165 VanDerWaalsContact O-N 3.16Å
164	P	35.9	Very low	38.2	Very low	112 Å²	112	120.3 Å²	120.3	73%	0.727	69%	0.691	S	S	*	*			trans	-69.9	113.4	171.4	-11.3	28.4	0	0	0	108.4	A162 D166	A162-P164 WeakPolarHBondContact O-CD 3.49Å; P164-D166 PolarHBondContact O-N 3.07Å
165	T	40.1	Very low	37.2	Very low	135 Å²	135	122 Å²	122	83%	0.828	70%	0.704	S	S	*	*			trans	-75.3	67.2	169.4	40.6	0	0	0	0	110.5	V163	V163-T165 PolarHBondContact O-N 3.36Å; V163-T165 VanDerWaalsContact O-N 3.16Å
166	D	32.8	Very low	36.2	Very low	127 Å²	127	127.4 Å²	127.4	68%	0.679	73%	0.725	S	S	*	*			trans	-151.5	76.9	167.9	-101.1	-39.2	0	0	0	111.7	P164	P164-D166 PolarHBondContact O-N 3.07Å
167	L	37.7	Very low	35.2	Very low	173 Å²	173	130.8 Å²	130.8	91%	0.906	74%	0.74	S	S	*	*			trans	-107.5	63.6	156.4	-80.7	170.5	0	0	0	109
168	T	31.7	Very low	34.5	Very low	121 Å²	121	133 Å²	133	74%	0.742	76%	0.755	S	S	*	*			trans	-106.1	116.5	165.4	55.2	0	0	0	0	110.1
169	I	32.9	Very low	33.6	Very low	164 Å²	164	131.7 Å²	131.7	84%	0.841	77%	0.767	S	S	*	*			trans	-85.1	115	-178.7	-62.7	166.8	0	0	0	108.9
170	S	30	Very low	32.5	Very low	112 Å²	112	132.8 Å²	132.8	78%	0.783	78%	0.784	S	S	*	*			trans	177.6	102.4	143.6	-84.6	0	0	0	0	113.5
171	S	30	Very low	31.7	Very low	128 Å²	128	130.6 Å²	130.6	90%	0.895	78%	0.784	S	S	*	*			trans	170.9	74.8	137.5	57.7	0	0	0	0	111.6
172	A	27.9	Very low	31.1	Very low	103 Å²	103	132.6 Å²	132.6	85%	0.851	79%	0.79	S	S	*	*			trans	-142.3	44.3	173	0	0	0	0	0	112.3
173	I	35.9	Very low	30.5	Very low	159 Å²	159	132.6 Å²	132.6	82%	0.815	80%	0.798	S	S	*	*			trans	-132.2	139.6	163.9	-52.4	-178.1	0	0	0	106.7
174	Q	27.9	Very low	30.1	Very low	171 Å²	171	136 Å²	136	80%	0.799	81%	0.812	S	S	*	*			trans	78.1	88.1	-175.2	-50.6	-178.3	-10.5	0	0	115.7
175	N	25.2	Very low	30.4	Very low	155 Å²	155	135.8 Å²	135.8	83%	0.829	81%	0.81	S	S	*	*				176.1	97.7	107.5	-84.4	-27.5	0	0	0	111.7
176	I	26.6	Very low	29.9	Very low	155 Å²	155	137 Å²	137	80%	0.795	81%	0.811	S	S	*	*			trans	-129.2	145.8	158.4	-64	179.8	0	0	0	106
177	H	27.7	Very low	29.6	Very low	176 Å²	176	135.9 Å²	135.9	82%	0.815	82%	0.82	S	S	*	*			trans	92.1	123.7	-163.5	-55.4	-57	0	0	0	113
178	S	25.8	Very low	29.2	Very low	110 Å²	110	135.3 Å²	135.3	77%	0.769	82%	0.816	S	S	*	*			cis	-161.8	141	-4.6	-78.1	0	0	0	0	110
179	A	25.4	Very low	30.1	Very low	108 Å²	108	134.7 Å²	134.7	89%	0.893	82%	0.815	S	S	*	*			trans	-165.2	132.1	153	0	0	0	0	0	111.1
180	A	27	Very low	30.9	Very low	92 Å²	92	131.7 Å²	131.7	76%	0.76	81%	0.806	S	S	*	*			trans	-124.8	155	176	0	0	0	0	0	111.3
181	S	28.2	Very low	30.9	Very low	110 Å²	110	132 Å²	132	77%	0.769	80%	0.803	S	S	*	*			trans	68.2	135.3	173.9	76.2	0	0	0	0	115.7
182	K	29.5	Very low	30.7	Very low	199 Å²	199	133 Å²	133	87%	0.865	80%	0.799	S	S	*	*				-163.8	158.7	53.5	-72.8	169.7	176.9	172.1	0	112.3
183	G	25.8	Very low	30.8	Very low	79 Å²	79	139.8 Å²	139.8	81%	0.814	80%	0.804	S	S	*	*			trans	92.2	104.2	137.6	0	0	0	0	0	120.2
184	L	29	Very low	30.4	Very low	167 Å²	167	138.2 Å²	138.2	87%	0.874	80%	0.797	S	S	*	*			trans	-75	174	150.7	-84.7	163.4	0	0	0	110.1
185	P	42	Very low	30.3	Very low	107 Å²	107	140.6 Å²	140.6	70%	0.695	80%	0.799	S	S	*	*			cis	-149.6	167.8	27.3	41	-18.8	0	0	0	121.1
186	L	29.4	Very low	30.3	Very low	162 Å²	162	138.5 Å²	138.5	85%	0.848	80%	0.796	S	S	*	*			trans	39.8	127.1	140.9	-75.5	146.4	0	0	0	123.5
187	A	25.9	Very low	31.4	Very low	103 Å²	103	135.2 Å²	135.2	85%	0.851	79%	0.785	S	S	*	*			trans	-161	148.5	135.4	0	0	0	0	0	113.6
188	L	29.5	Very low	31.4	Very low	160 Å²	160	135.9 Å²	135.9	84%	0.838	79%	0.786	S	S	*	*			trans	-149.1	173.9	173.4	-91.8	166.5	0	0	0	105.9
189	P	50.6	Low	31.5	Very low	109 Å²	109	136.5 Å²	136.5	71%	0.708	79%	0.785	S	S	*	*			cis	-127.2	-130.4	-26.8	33.9	-9.9	0	0	0	108
190	P	49.1	Very low	31.6	Very low	101 Å²	101	137.7 Å²	137.7	66%	0.656	78%	0.781	S	S	*	*			cis	-134.4	-156.3	-26.7	33.5	-9.5	0	0	0	114.5
191	T	30	Very low	31.6	Very low	119 Å²	119	138.4 Å²	138.4	73%	0.73	78%	0.78	S	S	*	*			trans	87	115	168.6	66.4	0	0	0	0	116.4
192	D	25.6	Very low	32.3	Very low	149 Å²	149	138.9 Å²	138.9	80%	0.797	78%	0.781	S	S	*	*				83.8	112.8	53.4	-75.3	-45.9	0	0	0	113.7
193	Y	30.2	Very low	32.3	Very low	244 Å²	244	135.5 Å²	135.5	96%	0.957	78%	0.777	S	S	*	*			trans	-152.2	148.5	136.2	-122.8	-81.7	0	0	0	111.2
194	D	27.3	Very low	32.4	Very low	126 Å²	126	136.4 Å²	136.4	67%	0.674	77%	0.77	S	S	*	*			trans	-117.8	167.6	-160.2	176.9	32.2	0	0	0	112.2
195	R	25.6	Very low	32.4	Very low	222 Å²	222	137.5 Å²	137.5	84%	0.838	77%	0.773	S	S	*	*			trans	99.6	126.9	142.5	-136	168.1	-176.4	125.4	-6.3	121.6
196	S	26.1	Very low	31.7	Very low	110 Å²	110	136.5 Å²	136.5	77%	0.769	77%	0.774	S	S	*	*			trans	-84.6	-160.2	172	-147.5	0	0	0	0	111
197	P	49.4	Very low	31.8	Very low	87 Å²	87	137 Å²	137	57%	0.565	77%	0.774	S	S	*	*			cis	-142	-171.8	-5.7	41	-19.9	0	0	0	116.3
198	F	28.3	Very low	32.5	Very low	190 Å²	190	137 Å²	137	83%	0.833	77%	0.765	S	S	*	*			trans	159.9	103.8	138.9	-84.1	-62.3	0	0	0	107.9
199	V	26.9	Very low	33.6	Very low	123 Å²	123	134.4 Å²	134.4	75%	0.745	76%	0.758	S	S	*	*				61.5	116.3	69	-172.1	0	0	0	0	111.1
200	T	28.2	Very low	32.7	Very low	132 Å²	132	139 Å²	139	81%	0.81	77%	0.77	S	S	*	*				-153.4	152.2	70.4	47.8	0	0	0	0	116.1
201	S	27.4	Very low	31.8	Very low	107 Å²	107	139.1 Å²	139.1	75%	0.748	78%	0.779	S	S	*	*			trans	-102.6	175.3	156.7	-54.7	0	0	0	0	111.6
202	P	42.3	Very low	31.7	Very low	121 Å²	121	137.5 Å²	137.5	79%	0.786	79%	0.786	S	S	*	*				-135.2	146.1	99	34.4	-20.6	0	0	0	112.3
203	V	30.7	Very low	31.8	Very low	128 Å²	128	135.5 Å²	135.5	78%	0.776	78%	0.784	S	S	*	*				60.9	133.4	62.7	-178.4	0	0	0	0	112.5
204	S	27.5	Very low	31.7	Very low	97 Å²	97	130.4 Å²	130.4	68%	0.678	77%	0.772	S	S	*	*			cis	-178.8	163.4	-23.8	-85	0	0	0	0	106.5
205	M	27.7	Very low	31.7	Very low	191 Å²	191	132.9 Å²	132.9	94%	0.941	78%	0.78	S	S	*	*			trans	-176.1	163.5	137.7	-97.7	-38.3	157.8	0	0	115.3
206	A	28.2	Very low	31.7	Very low	85 Å²	85	126 Å²	126	70%	0.702	78%	0.778	S	S	*	*			trans	-156.5	161.6	-163.2	0	0	0	0	0	111.6
207	M	30.8	Very low	31.8	Very low	172 Å²	172	130.8 Å²	130.8	85%	0.847	78%	0.781	S	S	*	*			cis	-145.7	-86.3	-7.1	-118.1	-101.6	-79.1	0	0	115.5
208	P	41.1	Very low	30.8	Very low	103 Å²	103	134.9 Å²	134.9	67%	0.669	79%	0.792	S	S	*	*			trans	-133.9	-147.1	-146.8	41.3	-17	0	0	0	116.3
209	P	53.1	Low	30.7	Very low	106 Å²	106	130.3 Å²	130.3	69%	0.688	79%	0.789	S	S	*	*				-128.8	176.7	-95.9	42.2	-24.9	0	0	0	115
210	H	30.8	Very low	30.7	Very low	206 Å²	206	128.6 Å²	128.6	95%	0.954	79%	0.788	S	S	*	*			trans	-146.6	156	160.4	-90	-66.9	0	0	0	113.1
211	A	30.1	Very low	30.6	Very low	104 Å²	104	133.4 Å²	133.4	86%	0.86	79%	0.793	S	S	*	*			trans	-111.5	161.5	-176.9	0	0	0	0	0	111.9
212	G	27.7	Very low	30.6	Very low	85 Å²	85	131.9 Å²	131.9	88%	0.876	79%	0.794	S	S	*	*			trans	174.6	116.5	173.4	0	0	0	0	0	115.1
213	S	27.6	Very low	29.9	Very low	107 Å²	107	134.4 Å²	134.4	75%	0.748	80%	0.795	S	S	*	*			trans	-90.4	164.9	-171.8	-167.9	0	0	0	0	115.2
214	L	28.2	Very low	29.6	Very low	136 Å²	136	136.7 Å²	136.7	71%	0.712	80%	0.795	S	S	*	*			trans	82.7	122.4	147.1	-117.8	80.2	0	0	0	123.4
215	Q	28	Very low	29.6	Very low	179 Å²	179	140.1 Å²	140.1	84%	0.836	80%	0.801	S	S	*	*			trans	33.3	140.5	134	-68.7	174.1	-28.7	0	0	123.1
216	G	26.7	Very low	29.5	Very low	77 Å²	77	134.4 Å²	134.4	79%	0.794	79%	0.79	S	S	*	*			trans	163.6	84.6	152.2	0	0	0	0	0	119.2
217	Y	27.9	Very low	29.6	Very low	210 Å²	210	136.7 Å²	136.7	82%	0.824	80%	0.796	S	S	*	*			trans	-0.5	140.4	156.5	-74.1	-90.5	0	0	0	124.3
218	Q	27.3	Very low	29.6	Very low	174 Å²	174	140 Å²	140	81%	0.813	80%	0.799	S	S	*	*				96.7	136.6	126.6	-93.2	164.6	-16.2	0	0	124.8
219	A	27.4	Very low	28.9	Very low	93 Å²	93	141.4 Å²	141.4	77%	0.769	81%	0.806	S	S	*	*			trans	60.1	119	150.1	0	0	0	0	0	119
220	A	25.3	Very low	27.8	Very low	88 Å²	88	144.9 Å²	144.9	73%	0.727	82%	0.817	S	S	*	*			cis	97.1	138.6	38.3	0	0	0	0	0	114.8
221	Y	26.7	Very low	27.7	Very low	232 Å²	232	143.5 Å²	143.5	91%	0.91	81%	0.808	S	S	*	*			trans	106.3	127.8	167.6	-69.9	-78.4	0	0	0	119.2
222	G	26.9	Very low	27.4	Very low	75 Å²	75	143.6 Å²	143.6	77%	0.773	80%	0.802	S	S	*	*			trans	165.4	100.9	172.5	0	0	0	0	0	112.4
223	H	27.5	Very low	27.3	Very low	174 Å²	174	146.1 Å²	146.1	81%	0.806	79%	0.791	S	S	*	*			trans	-74.4	160.6	174.3	-86.9	30.8	0	0	0	112.6
224	F	25.3	Very low	27.4	Very low	176 Å²	176	151.2 Å²	151.2	77%	0.772	80%	0.795	S	S	*	*				-173.2	136.6	113.2	-117	-104.6	0	0	0	115.3
225	Q	26.3	Very low	27.8	Very low	170 Å²	170	149.2 Å²	149.2	79%	0.794	79%	0.791	S	S	*	*			trans	4.3	132.5	155.6	-55.7	173.5	-9.2	0	0	120
226	G	26.8	Very low	27.8	Very low	70 Å²	70	148.1 Å²	148.1	72%	0.722	79%	0.791	S	S	*	*				127.8	159.3	76.8	0	0	0	0	0	108.8
227	T	29.3	Very low	28.1	Very low	134 Å²	134	149 Å²	149	82%	0.822	78%	0.783	S	S	*	*			cis	-166.8	163.9	16.7	-28.5	0	0	0	0	111.4
228	R	31.1	Very low	28.2	Very low	242 Å²	242	150 Å²	150	91%	0.913	79%	0.787	S	S	*	*			trans	89	129.3	155.6	-65.2	-176.3	-173.8	-148.3	0.1	121.5
229	T	27.3	Very low	28.2	Very low	132 Å²	132	148.3 Å²	148.3	81%	0.81	79%	0.788	S	S	*	*			trans	-113.9	155.8	175.7	34	0	0	0	0	111.2
230	I	30.2	Very low	28.3	Very low	179 Å²	179	149.1 Å²	149.1	92%	0.918	79%	0.788	S	S	*	*			trans	-138.9	146.4	151.7	-65	-173.4	0	0	0	107.7
231	K	27.6	Very low	28.5	Very low	177 Å²	177	150.2 Å²	150.2	77%	0.77	79%	0.79	S	S	*	*			trans	-144.4	144.7	-167.3	-162.4	-165.6	-176.4	-151.4	0	111.1	E233	K231-E233 IonicContact NZ-OE1 2.83Å
232	S	24.2	Very low	29.3	Very low	105 Å²	105	144.7 Å²	144.7	73%	0.734	78%	0.783	S	S	*	*			trans	-170.7	123.2	163.4	-172.1	0	0	0	0	105.7
233	E	25.8	Very low	29.4	Very low	138 Å²	138	150 Å²	150	65%	0.645	79%	0.788	S	S	*	*				65.7	125.4	55.5	-59.4	-180	-175.6	0	0	111.4	K231	K231-E233 IonicContact NZ-OE1 2.83Å
234	Y	29.4	Very low	29.5	Very low	214 Å²	214	147.3 Å²	147.3	84%	0.839	79%	0.788	S	S	*	*			cis	-140.2	-155	5.7	-142.4	-120	0	0	0	110.4
235	P	37.5	Very low	29.8	Very low	95 Å²	95	146.9 Å²	146.9	62%	0.617	79%	0.792	S	S	*	*			trans	-109	-177	-132.4	42.7	-24.7	0	0	0	115.2
236	D	27	Very low	29.9	Very low	156 Å²	156	146.3 Å²	146.3	83%	0.834	79%	0.792	S	S	*	*			trans	-166.9	161.1	131.9	-105.9	-9.8	0	0	0	112.2
237	P	32.3	Very low	30.1	Very low	96 Å²	96	146.4 Å²	146.4	62%	0.623	79%	0.792	S	S	*	*			trans	-117.3	138.3	-145.2	38.5	-28.1	0	0	0	114.5
238	Y	30.4	Very low	30.1	Very low	231 Å²	231	150.3 Å²	150.3	91%	0.906	79%	0.793	S	S	*	*			trans	-165.3	88.1	142.1	-109.6	-71.2	0	0	0	109.5
239	T	28	Very low	29.9	Very low	137 Å²	137	142.9 Å²	142.9	84%	0.84	78%	0.784	S	S	*	*			trans	-105.9	115.3	167.4	20.2	0	0	0	0	109.8
240	S	28.9	Very low	29.9	Very low	111 Å²	111	146.5 Å²	146.5	78%	0.776	78%	0.784	S	S	*	*			trans	-137.6	91.4	159.1	39.5	0	0	0	0	109.3
241	S	30.5	Very low	30	Very low	110 Å²	110	144 Å²	144	77%	0.769	78%	0.777	S	S	*	*			trans	-71.7	175.5	161.1	-71.2	0	0	0	0	110.6
242	P	44	Very low	30.1	Very low	116 Å²	116	140.5 Å²	140.5	75%	0.753	77%	0.767	S	S	*	*			cis	-115.9	179.6	9.1	23.7	1.6	0	0	0	112.2
243	E	27.1	Very low	30.3	Very low	188 Å²	188	138.8 Å²	138.8	88%	0.879	76%	0.759	S	S	*	*			cis	-147.2	152.4	41.3	-66.8	170.4	149.7	0	0	113.1
244	S	30.9	Very low	30.9	Very low	116 Å²	116	142.1 Å²	142.1	81%	0.811	77%	0.767	S	S	*	*			trans	-151	95.9	-178.6	48.6	0	0	0	0	112.8
245	I	30.2	Very low	30.8	Very low	167 Å²	167	140.2 Å²	140.2	86%	0.856	77%	0.766	S	S	*	*			trans	-140	96.1	162.9	-57.1	-176.8	0	0	0	110.2
246	M	29.7	Very low	31	Very low	159 Å²	159	141.8 Å²	141.8	78%	0.783	78%	0.779	S	S	*	*			trans	168.9	100.4	134.3	-95.8	170.6	67.1	0	0	108.4	Y248	M246-Y248 HydrophobicContact CE-CE2 4.44Å
247	G	31.4	Very low	31.5	Very low	71 Å²	71	137.4 Å²	137.4	73%	0.732	77%	0.771	S	S	*	*			trans	-89	147.5	176.3	0	0	0	0	0	111.9
248	Y	29.6	Very low	31.6	Very low	216 Å²	216	138.1 Å²	138.1	85%	0.847	78%	0.778	S	S	*	*			trans	-134.6	151.7	157.2	-80.3	-72.5	0	0	0	110.5	M246	M246-Y248 HydrophobicContact CE-CE2 4.44Å
249	A	26.5	Very low	32.3	Very low	87 Å²	87	132.7 Å²	132.7	72%	0.719	77%	0.771	S	S	*	*			trans	-71.6	149.3	-162.2	0	0	0	0	0	114	V251	A249-V251 PolarHBondContact O-N 2.98Å
250	Y	27.3	Very low	33.3	Very low	208 Å²	208	130.4 Å²	130.4	82%	0.816	76%	0.757	S	S	*	*			trans	-69.2	110.1	165.6	-172.5	-96.7	0	0	0	109.2	D252	Y250-D252 HydrophobicContact CD1-CB 4.43Å; Y250-D252 HydrophobicContact CE1-CB 3.95Å
251	V	31.1	Very low	35	Very low	127 Å²	127	130.4 Å²	130.4	77%	0.77	76%	0.757	S	S	*	*			trans	-104.8	106.1	172.5	-143.6	0	0	0	0	108.1	A249 A253	A249-V251 PolarHBondContact O-N 2.98Å; V251-A253 PolarHBondContact O-N 2.91Å
252	D	31.5	Very low	37.4	Very low	103 Å²	103	128.7 Å²	128.7	55%	0.551	74%	0.736	S	S	*	*			trans	-76.2	90.6	174.8	-164.5	7	0	0	0	109	Y250	Y250-D252 HydrophobicContact CD1-CB 4.43Å; Y250-D252 HydrophobicContact CE1-CB 3.95Å
253	A	28.1	Very low	39.5	Very low	69 Å²	69	124.2 Å²	124.2	57%	0.57	71%	0.707	S	S	*	*			trans	-100	88.6	-176	0	0	0	0	0	111.1	V251 Q255	V251-A253 PolarHBondContact O-N 2.91Å; A253-Q255 PolarHBondContact O-N 3.28Å
254	Y	36.8	Very low	42.6	Very low	207 Å²	207	121.8 Å²	121.8	81%	0.812	70%	0.695	S	S	*	*			trans	-66.9	77.2	160.3	-74.2	-95.7	0	0	0	110.2
255	Q	28.6	Very low	45.7	Very low	174 Å²	174	117.6 Å²	117.6	81%	0.813	66%	0.664	S	S	*	*			trans	-96.2	99.2	167.1	-76.7	-172.6	-3.3	0	0	110	A253 G257	A253-Q255 PolarHBondContact O-N 3.28Å; Q255-G257 PolarHBondContact O-N 3.05Å
256	S	41.9	Very low	48.9	Very low	128 Å²	128	109.7 Å²	109.7	90%	0.895	62%	0.623	S	S	*	*			trans	-68.8	108.6	162.3	53.1	0	0	0	0	109
257	G	36.9	Very low	52	Low	64 Å²	64	105 Å²	105	66%	0.66	60%	0.603	S	S	*	*			trans	136	69.2	179.8	0	0	0	0	0	112.8	Q255	Q255-G257 PolarHBondContact O-N 3.05Å
258	S	35.4	Very low	55	Low	111 Å²	111	104.6 Å²	104.6	78%	0.776	58%	0.582	S	S	*	*			trans	-60	126.7	160.8	52.1	0	0	0	0	108.6
259	P	43.4	Very low	58.3	Low	117 Å²	117	94.4 Å²	94.4	76%	0.76	54%	0.542	S	S	*	.			trans	-60	143.1	171.7	25	-31.6	0	0	0	109.2	S261	P259-S261 PolarHBondContact O-N 3Å
260	T	49.1	Very low	61.6	Low	90 Å²	90	92.4 Å²	92.4	55%	0.552	52%	0.519	S	S	*	.			trans	-62.1	99	174.1	36.6	0	0	0	0	109.1	F262	T260-F262 WeakPolarHBondContact O-CD2 3.37Å; T260-F262 PolarHBondContact O-N 3.06Å; T260-F262 VanDerWaalsContact OG1-CZ 3.27Å; T260-F262 WeakPolarHBondContact OG1-CZ 3.34Å
261	S	65.6	Low	64.9	Low	111 Å²	111	89 Å²	89	78%	0.776	51%	0.509	S	S	*	.			trans	-74	96.5	179.8	63.9	0	0	0	0	109.5	P259	P259-S261 PolarHBondContact O-N 3Å
262	F	79.7	Confident	68	Low	74 Å²	74	83.8 Å²	83.8	33%	0.325	48%	0.477	S	S	.	.			trans	-69.7	143.3	174.5	-52.5	-61.2	0	0	0	110.3	T260 H264 V267 Y445	T260-F262 WeakPolarHBondContact O-CD2 3.37Å; T260-F262 PolarHBondContact O-N 3.06Å; T260-F262 VanDerWaalsContact OG1-CZ 3.27Å; T260-F262 WeakPolarHBondContact OG1-CZ 3.34Å; F262-H264 PolarHBondContact O-N 3.39Å; F262-V267 HydrophobicContact CB-CG2 4.43Å; F262-Y445 AromaticContact CD1-CD2 3.94Å; F262-Y445 HydrophobicContact CD1-CD2 3.94Å; F262-Y445 AromaticContact CD1-CE2 3.51Å; F262-Y445 HydrophobicContact CD1-CE2 3.51Å; F262-Y445 AromaticContact CE1-CE2 3.82Å; F262-Y445 HydrophobicContact CE1-CE2 3.82Å
263	P	88.6	Confident	71.1	Confident	22 Å²	22	80.8 Å²	80.8	14%	0.143	46%	0.46	C	S	.	.			trans	-54.5	125.7	173.3	-26.6	35.1	0	0	0	110.9	L265 I266 A441 D444	P263-L265 PolarHBondContact O-N 3.45Å; P263-L265 VanDerWaalsContact O-N 3.08Å; P263-I266 HydrophobicContact CB-CD1 4.33Å; P263-I266 HydrophobicContact CB-CG1 4.3Å; P263-I266 HydrophobicContact CG-CD1 4.17Å; P263-I266 WeakPolarHBondContact O-CB 3.35Å; P263-I266 PolarHBondContact O-N 3.27Å; P263-A441 HydrophobicContact CB-CB 3.98Å; P263-D444 HydrophobicContact CG-CB 4.19Å
264	H	92.5	Very high	74.2	Confident	137 Å²	137	80.3 Å²	80.3	63%	0.634	45%	0.451	S	S	*	.	H	α-helix	trans	-53.1	-36.5	-175.2	-173.6	-69.1	0	0	0	112.5	F262 I266 V267 E268	F262-H264 PolarHBondContact O-N 3.39Å; H264-I266 VanDerWaalsContact C-N 3.34Å; H264-I266 PolarHBondContact O-N 3.26Å; H264-V267 WeakPolarHBondContact O-CB 3.27Å; H264-V267 PolarHBondContact O-N 2.96Å; H264-V267 VanDerWaalsContact O-N 3.11Å; H264-E268 IonicContact CE1-OE1 2.59Å; H264-E268 PolarHBondContact CE1-OE1 3.32Å; H264-E268 IonicContact ND1-OE1 2.73Å; H264-E268 IonicContact NE2-OE1 2.74Å; H264-E268 PolarHBondContact O-N 2.84Å; H264-E268 VanDerWaalsContact O-N 3.15Å
265	L	95.9	Very high	76.9	Confident	28 Å²	28	75 Å²	75	15%	0.147	44%	0.437	C	S	.	.	H	α-helix	trans	-54.3	-47.7	175.8	-179.6	59.6	0	0	0	112.2	P263 V267 E268 L269 F326 Q437 V438 A441	P263-L265 PolarHBondContact O-N 3.45Å; P263-L265 VanDerWaalsContact O-N 3.08Å; L265-V267 PolarHBondContact O-N 3.48Å; L265-E268 WeakPolarHBondContact O-CA 3.44Å; L265-E268 WeakPolarHBondContact O-CB 3.3Å; L265-E268 PolarHBondContact O-N 3.43Å; L265-L269 HydrophobicContact CD1-CD2 4.02Å; L265-L269 HydrophobicContact CD1-CG 4.42Å; L265-L269 HydrophobicContact CG-CD2 4.41Å; L265-L269 HydrophobicContact CG-CG 4.33Å; L265-L269 WeakPolarHBondContact O-CG 3.48Å; L265-L269 PolarHBondContact O-N 3.49Å; L265-F326 HydrophobicContact CD1-CE2 3.7Å; L265-F326 HydrophobicContact CD1-CZ 3.57Å; L265-Q437 HydrophobicContact CD2-CB 3.81Å; L265-Q437 WeakPolarHBondContact CD2-O 3.43Å; L265-V438 HydrophobicContact CD2-CG2 4.21Å; L265-A441 HydrophobicContact CB-CB 4.22Å; L265-A441 HydrophobicContact CD2-CB 3.96Å; L265-A441 HydrophobicContact CG-CB 4.47Å
266	I	96.6	Very high	79.8	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.005	42%	0.415	C	S	.	.	H	α-helix	trans	-61.2	-34.7	-179.8	-63.1	-177.2	0	0	0	111	P263 H264 E268 L269 L270 R407 A441 Y445	P263-I266 HydrophobicContact CB-CD1 4.33Å; P263-I266 HydrophobicContact CB-CG1 4.3Å; P263-I266 HydrophobicContact CG-CD1 4.17Å; P263-I266 WeakPolarHBondContact O-CB 3.35Å; P263-I266 PolarHBondContact O-N 3.27Å; H264-I266 VanDerWaalsContact C-N 3.34Å; H264-I266 PolarHBondContact O-N 3.26Å; I266-E268 VanDerWaalsContact C-N 3.35Å; I266-L269 PolarHBondContact O-N 2.98Å; I266-L270 HydrophobicContact CG2-CD1 4.31Å; I266-L270 HydrophobicContact CG2-CG 4.47Å; I266-L270 WeakPolarHBondContact O-CB 3.44Å; I266-L270 WeakPolarHBondContact O-CG 3.22Å; I266-L270 PolarHBondContact O-N 3.18Å; I266-R407 HydrophobicContact CG2-CB 3.7Å; I266-R407 HydrophobicContact CG2-CG 3.71Å; I266-A441 HydrophobicContact CD1-CB 4.31Å; I266-A441 HydrophobicContact CG1-CB 4.02Å; I266-Y445 HydrophobicContact CD1-CD2 4.09Å; I266-Y445 HydrophobicContact CD1-CG 3.93Å
267	V	95	Very high	82.3	Confident	59 Å²	59	68.3 Å²	68.3	36%	0.358	40%	0.399	S	S	.	.	H	α-helix	trans	-65.8	-38.6	175.4	-176	0	0	0	0	111.1	F262 H264 L265 K271	F262-V267 HydrophobicContact CB-CG2 4.43Å; H264-V267 WeakPolarHBondContact O-CB 3.27Å; H264-V267 PolarHBondContact O-N 2.96Å; H264-V267 VanDerWaalsContact O-N 3.11Å; L265-V267 PolarHBondContact O-N 3.48Å; V267-K271 WeakPolarHBondContact O-CG 3.46Å; V267-K271 PolarHBondContact O-N 3.01Å
268	E	95.9	Very high	85	Confident	64 Å²	64	71.8 Å²	71.8	30%	0.299	40%	0.398	S	S	.	.	H	α-helix	trans	-69.9	-38	172.6	-58.5	-49.5	131.1	0	0	112.8	H264 L265 I266 L270 K271 C272	H264-E268 IonicContact CE1-OE1 2.59Å; H264-E268 PolarHBondContact CE1-OE1 3.32Å; H264-E268 IonicContact ND1-OE1 2.73Å; H264-E268 IonicContact NE2-OE1 2.74Å; H264-E268 PolarHBondContact O-N 2.84Å; H264-E268 VanDerWaalsContact O-N 3.15Å; L265-E268 WeakPolarHBondContact O-CA 3.44Å; L265-E268 WeakPolarHBondContact O-CB 3.3Å; L265-E268 PolarHBondContact O-N 3.43Å; I266-E268 VanDerWaalsContact C-N 3.35Å; E268-L270 VanDerWaalsContact C-N 3.34Å; E268-L270 PolarHBondContact O-N 3.33Å; E268-K271 PolarHBondContact O-N 2.67Å; E268-K271 IonicContact OE1-NZ 2.68Å; E268-K271 PolarHBondContact OE1-NZ 2.74Å; E268-K271 WeakPolarHBondContact OE2-CD 3.45Å; E268-K271 IonicContact OE2-NZ 3.74Å; E268-K271 PolarHBondContact OE2-NZ 2.71Å; E268-C272 PolarHBondContact O-SG 3.09Å; E268-C272 VanDerWaalsContact O-SG 3.35Å
269	L	97.1	Very high	87.8	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.005	37%	0.367	C	S	.	.	H	α-helix	trans	-62.6	-41.7	174.6	-55.4	-169.8	0	0	0	111.2	L265 I266 K271 C272 F326 V410 F414 V438	L265-L269 HydrophobicContact CD1-CD2 4.02Å; L265-L269 HydrophobicContact CD1-CG 4.42Å; L265-L269 HydrophobicContact CG-CD2 4.41Å; L265-L269 HydrophobicContact CG-CG 4.33Å; L265-L269 WeakPolarHBondContact O-CG 3.48Å; L265-L269 PolarHBondContact O-N 3.49Å; I266-L269 PolarHBondContact O-N 2.98Å; L269-K271 VanDerWaalsContact C-N 3.3Å; L269-K271 PolarHBondContact O-N 3.49Å; L269-C272 WeakPolarHBondContact O-CB 3.42Å; L269-C272 PolarHBondContact O-N 3.21Å; L269-F326 HydrophobicContact CD2-CE2 4.1Å; L269-V410 HydrophobicContact CB-CB 4.35Å; L269-V410 HydrophobicContact CB-CG2 3.97Å; L269-F414 HydrophobicContact CB-CD2 4.19Å; L269-F414 HydrophobicContact CB-CE2 4.02Å; L269-F414 HydrophobicContact CD1-CB 4.31Å; L269-F414 HydrophobicContact CD1-CD2 3.95Å; L269-F414 HydrophobicContact CD1-CG 4.07Å; L269-F414 HydrophobicContact CD2-CD1 3.91Å; L269-F414 HydrophobicContact CD2-CD2 3.91Å; L269-F414 HydrophobicContact CD2-CE1 3.82Å; L269-F414 HydrophobicContact CD2-CE2 3.81Å; L269-F414 HydrophobicContact CD2-CG 3.96Å; L269-F414 HydrophobicContact CD2-CZ 3.77Å; L269-F414 HydrophobicContact CG-CD2 4.21Å; L269-F414 HydrophobicContact CG-CE2 4.3Å; L269-V438 HydrophobicContact CD1-CG1 4.35Å; L269-V438 HydrophobicContact CD1-CG2 4.18Å
270	L	96.7	Very high	90.3	Very high	45 Å²	45	65 Å²	65	24%	0.236	35%	0.345	C	S	.	.	H	α-helix	trans	-62.3	-33.8	177.1	-77.8	170.8	0	0	0	113.1	I266 E268 C272 E273 Q406 R407 V410	I266-L270 HydrophobicContact CG2-CD1 4.31Å; I266-L270 HydrophobicContact CG2-CG 4.47Å; I266-L270 WeakPolarHBondContact O-CB 3.44Å; I266-L270 WeakPolarHBondContact O-CG 3.22Å; I266-L270 PolarHBondContact O-N 3.18Å; E268-L270 VanDerWaalsContact C-N 3.34Å; E268-L270 PolarHBondContact O-N 3.33Å; L270-C272 PolarHBondContact O-N 3.06Å; L270-E273 PolarHBondContact O-N 3.49Å; L270-Q406 HydrophobicContact CD2-CG 3.89Å; L270-R407 HydrophobicContact CD1-CG 4.15Å; L270-V410 HydrophobicContact CD2-CG1 3.98Å; L270-V410 HydrophobicContact CD2-CG2 4.03Å; L270-V410 HydrophobicContact CG-CG2 4.17Å
271	K	95.9	Very high	92.5	Very high	138 Å²	138	63.5 Å²	63.5	60%	0.6	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-14.9	175.1	-68.4	171.4	-168.2	170.3	0	113.4	V267 E268 L269	V267-K271 WeakPolarHBondContact O-CG 3.46Å; V267-K271 PolarHBondContact O-N 3.01Å; E268-K271 PolarHBondContact O-N 2.67Å; E268-K271 IonicContact OE1-NZ 2.68Å; E268-K271 PolarHBondContact OE1-NZ 2.74Å; E268-K271 WeakPolarHBondContact OE2-CD 3.45Å; E268-K271 IonicContact OE2-NZ 3.74Å; E268-K271 PolarHBondContact OE2-NZ 2.71Å; L269-K271 VanDerWaalsContact C-N 3.3Å; L269-K271 PolarHBondContact O-N 3.49Å
272	C	97.1	Very high	93.9	Very high	16 Å²	16	62.5 Å²	62.5	11%	0.108	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-21.9	176	-57.4	0	0	0	0	112.2	E268 L269 L270 S323 F414	E268-C272 PolarHBondContact O-SG 3.09Å; E268-C272 VanDerWaalsContact O-SG 3.35Å; L269-C272 WeakPolarHBondContact O-CB 3.42Å; L269-C272 PolarHBondContact O-N 3.21Å; L270-C272 PolarHBondContact O-N 3.06Å; C272-S323 VanDerWaalsContact CA-OG 3.3Å; C272-S323 WeakPolarHBondContact CA-OG 3.45Å; C272-S323 WeakPolarHBondContact CB-OG 3.24Å; C272-S323 PolarHBondContact O-OG 3.08Å; C272-F414 HydrophobicContact CB-CE2 4.48Å; C272-F414 HydrophobicContact CB-CZ 4.4Å
273	E	96.1	Very high	94.6	Very high	40 Å²	40	59 Å²	59	19%	0.187	31%	0.308	C	S	.	.	S	Bend	trans	-66.5	133.5	-178.5	-67.8	-61.8	111.7	0	0	111.1	L270 W320 V410 K413	L270-E273 PolarHBondContact O-N 3.49Å; E273-W320 PolarHBondContact OE1-NE1 3.37Å; E273-V410 HydrophobicContact CG-CG1 3.42Å; E273-V410 VanDerWaalsContact CG-CG1 3.42Å; E273-K413 WeakPolarHBondContact OE1-CE 3.49Å; E273-K413 IonicContact OE1-NZ 3.83Å; E273-K413 PolarHBondContact OE1-NZ 2.91Å; E273-K413 IonicContact OE2-NZ 2.74Å; E273-K413 PolarHBondContact OE2-NZ 2.64Å
274	P	93.8	Very high	94.9	Very high	60 Å²	60	60.4 Å²	60.4	39%	0.39	31%	0.314	S	S	.	.			trans	-72.7	159.8	179	32.1	-36.4	0	0	0	111.7	E276 V279	P274-E276 PolarHBondContact O-N 3.42Å; P274-E276 VanDerWaalsContact O-N 3.07Å; P274-V279 HydrophobicContact CB-CG2 3.79Å; P274-V279 HydrophobicContact CG-CG2 4.06Å
275	D	93.1	Very high	95	Very high	94 Å²	94	56.4 Å²	56.4	50%	0.503	31%	0.305	S	S	.	.			trans	-65.5	107.5	168.1	-175.7	-68.8	0	0	0	109.4	P277 Q278 V279	D275-P277 VanDerWaalsContact OD1-CD 3.28Å; D275-P277 WeakPolarHBondContact OD1-CD 3.4Å; D275-Q278 HydrophobicContact CB-CB 3.88Å; D275-Q278 WeakPolarHBondContact O-CB 3.39Å; D275-Q278 PolarHBondContact O-N 3Å; D275-Q278 VanDerWaalsContact OD1-CB 3.31Å; D275-Q278 WeakPolarHBondContact OD1-CB 3.48Å; D275-Q278 PolarHBondContact OD1-N 2.82Å; D275-V279 WeakPolarHBondContact O-CG2 3.49Å; D275-V279 PolarHBondContact O-N 2.9Å
276	E	90.7	Very high	94.8	Very high	75 Å²	75	57.8 Å²	57.8	35%	0.35	31%	0.309	S	S	.	.	H	α-helix	trans	-62.3	-45.6	-174.1	170.8	167.9	-137.1	0	0	113.4	P274 Q278 V279 Q280 R354	P274-E276 PolarHBondContact O-N 3.42Å; P274-E276 VanDerWaalsContact O-N 3.07Å; E276-Q278 VanDerWaalsContact C-N 3.29Å; E276-Q278 PolarHBondContact O-N 3.02Å; E276-V279 PolarHBondContact O-N 3.4Å; E276-Q280 WeakPolarHBondContact O-CB 3.23Å; E276-Q280 PolarHBondContact O-N 3.03Å; E276-R354 IonicContact OE1-CZ 2.74Å; E276-R354 IonicContact OE1-NH1 2.72Å; E276-R354 PolarHBondContact OE1-NH1 2.99Å; E276-R354 IonicContact OE1-NH2 2.67Å; E276-R354 PolarHBondContact OE1-NH2 3.43Å
277	P	93.4	Very high	94.6	Very high	88 Å²	88	58.5 Å²	58.5	57%	0.571	31%	0.313	S	S	*	.	H	α-helix	trans	-54.3	-39.7	169.7	-28.1	35.3	0	0	0	114.1	D275 A281	D275-P277 VanDerWaalsContact OD1-CD 3.28Å; D275-P277 WeakPolarHBondContact OD1-CD 3.4Å; P277-A281 WeakPolarHBondContact O-CB 3.31Å; P277-A281 PolarHBondContact O-N 2.89Å
278	Q	94.4	Very high	94.3	Very high	136 Å²	136	61.2 Å²	61.2	64%	0.636	32%	0.321	S	S	*	.	H	α-helix	trans	-67.4	-44.1	177.1	-174.3	178.2	100	0	0	112	D275 E276 A281 K282	D275-Q278 HydrophobicContact CB-CB 3.88Å; D275-Q278 WeakPolarHBondContact O-CB 3.39Å; D275-Q278 PolarHBondContact O-N 3Å; D275-Q278 VanDerWaalsContact OD1-CB 3.31Å; D275-Q278 WeakPolarHBondContact OD1-CB 3.48Å; D275-Q278 PolarHBondContact OD1-N 2.82Å; E276-Q278 VanDerWaalsContact C-N 3.29Å; E276-Q278 PolarHBondContact O-N 3.02Å; Q278-A281 PolarHBondContact O-N 3.32Å; Q278-K282 WeakPolarHBondContact O-CB 3.43Å; Q278-K282 PolarHBondContact O-N 2.91Å
279	V	93.8	Very high	94	Very high	20 Å²	20	64.7 Å²	64.7	12%	0.121	34%	0.338	C	S	.	.	H	α-helix	trans	-61.9	-46.3	174.9	171.9	0	0	0	0	110.6	P274 D275 E276 A281 K282 I283	P274-V279 HydrophobicContact CB-CG2 3.79Å; P274-V279 HydrophobicContact CG-CG2 4.06Å; D275-V279 WeakPolarHBondContact O-CG2 3.49Å; D275-V279 PolarHBondContact O-N 2.9Å; E276-V279 PolarHBondContact O-N 3.4Å; V279-A281 VanDerWaalsContact C-N 3.34Å; V279-A281 PolarHBondContact O-N 2.89Å; V279-K282 PolarHBondContact O-N 3.42Å; V279-I283 HydrophobicContact CG1-CD1 3.7Å; V279-I283 HydrophobicContact CG1-CG1 4.43Å; V279-I283 WeakPolarHBondContact O-CG1 3.39Å; V279-I283 PolarHBondContact O-N 3.26Å
280	Q	94.9	Very high	93.4	Very high	66 Å²	66	66.2 Å²	66.2	31%	0.308	35%	0.345	S	S	.	.	H	α-helix	trans	-55.5	-47.8	175.3	175.9	-177.4	-12.5	0	0	111.5	E276 I283 L284 V367 T368	E276-Q280 WeakPolarHBondContact O-CB 3.23Å; E276-Q280 PolarHBondContact O-N 3.03Å; Q280-I283 PolarHBondContact O-N 2.89Å; Q280-L284 VanDerWaalsContact O-CB 3.31Å; Q280-L284 WeakPolarHBondContact O-CB 3.37Å; Q280-L284 PolarHBondContact O-N 3.3Å; Q280-V367 WeakPolarHBondContact CG-O 3.22Å; Q280-T368 WeakPolarHBondContact CG-O 3.33Å; Q280-T368 PolarHBondContact NE2-O 3.47Å
281	A	95.7	Very high	92.8	Very high	58 Å²	58	68 Å²	68	48%	0.479	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-42.9	179.5	0	0	0	0	0	112.5	P277 Q278 V279 L284 A285	P277-A281 WeakPolarHBondContact O-CB 3.31Å; P277-A281 PolarHBondContact O-N 2.89Å; Q278-A281 PolarHBondContact O-N 3.32Å; V279-A281 VanDerWaalsContact C-N 3.34Å; V279-A281 PolarHBondContact O-N 2.89Å; A281-L284 PolarHBondContact O-N 2.75Å; A281-A285 WeakPolarHBondContact O-CB 3.46Å; A281-A285 PolarHBondContact O-N 3.36Å
282	K	95.4	Very high	92.3	Very high	90 Å²	90	65.4 Å²	65.4	39%	0.391	36%	0.357	S	S	.	.	H	α-helix	trans	-57.7	-49.1	175.6	-178.5	179.8	174.9	-178.2	0	111.1	Q278 V279 Y286 E319	Q278-K282 WeakPolarHBondContact O-CB 3.43Å; Q278-K282 PolarHBondContact O-N 2.91Å; V279-K282 PolarHBondContact O-N 3.42Å; K282-Y286 PolarHBondContact O-N 3.46Å; K282-Y286 VanDerWaalsContact O-N 3.11Å; K282-E319 IonicContact NZ-OE1 3.73Å; K282-E319 PolarHBondContact NZ-OE1 3.31Å; K282-E319 IonicContact NZ-OE2 2.61Å; K282-E319 PolarHBondContact NZ-OE2 3.23Å
283	I	95.1	Very high	91.4	Very high	1 Å²	1	68.7 Å²	68.7	1%	0.005	38%	0.379	C	S	.	.	H	α-helix	trans	-66.3	-44.1	179.6	-64.1	170.2	0	0	0	111.2	V279 Q280 Y286 L287 M309 Q312 V367 T368	V279-I283 HydrophobicContact CG1-CD1 3.7Å; V279-I283 HydrophobicContact CG1-CG1 4.43Å; V279-I283 WeakPolarHBondContact O-CG1 3.39Å; V279-I283 PolarHBondContact O-N 3.26Å; Q280-I283 PolarHBondContact O-N 2.89Å; I283-Y286 PolarHBondContact O-N 2.91Å; I283-L287 HydrophobicContact CG2-CD1 3.94Å; I283-L287 HydrophobicContact CG2-CG 4.41Å; I283-L287 WeakPolarHBondContact O-CG 3.4Å; I283-L287 PolarHBondContact O-N 3.46Å; I283-M309 HydrophobicContact CG2-CG 4.16Å; I283-Q312 HydrophobicContact CG1-CB 3.91Å; I283-Q312 HydrophobicContact CG2-CB 4.44Å; I283-V367 HydrophobicContact CD1-CG1 3.98Å; I283-V367 HydrophobicContact CD1-CG2 3.79Å; I283-V367 HydrophobicContact CG2-CG1 4.44Å; I283-T368 HydrophobicContact CG2-CG2 4.07Å
284	L	94.3	Very high	90.3	Very high	51 Å²	51	70.5 Å²	70.5	27%	0.267	39%	0.385	S	S	.	.	H	α-helix	trans	-63.6	-43.7	-180	-177.8	62.9	0	0	0	112	Q280 A281 L287 Q288	Q280-L284 VanDerWaalsContact O-CB 3.31Å; Q280-L284 WeakPolarHBondContact O-CB 3.37Å; Q280-L284 PolarHBondContact O-N 3.3Å; A281-L284 PolarHBondContact O-N 2.75Å; L284-L287 PolarHBondContact O-N 2.9Å; L284-Q288 VanDerWaalsContact O-CG 3.31Å; L284-Q288 WeakPolarHBondContact O-CG 3.45Å; L284-Q288 PolarHBondContact O-N 3.34Å
285	A	94.1	Very high	89	Confident	54 Å²	54	69.6 Å²	69.6	45%	0.446	39%	0.386	S	S	.	.	H	α-helix	trans	-62	-44	176.7	0	0	0	0	0	111.8	A281 Q288 Q289	A281-A285 WeakPolarHBondContact O-CB 3.46Å; A281-A285 PolarHBondContact O-N 3.36Å; A285-Q288 PolarHBondContact O-N 3.05Å; A285-Q289 WeakPolarHBondContact O-CB 3.39Å; A285-Q289 PolarHBondContact O-N 3.02Å
286	Y	92.9	Very high	87.3	Confident	56 Å²	56	74.4 Å²	74.4	22%	0.22	40%	0.402	C	S	.	.	H	α-helix	trans	-59.7	-46.6	175.3	176.6	-93.3	0	0	0	112.3	K282 I283 Q288 Q289 E290 K308 Q312	K282-Y286 PolarHBondContact O-N 3.46Å; K282-Y286 VanDerWaalsContact O-N 3.11Å; I283-Y286 PolarHBondContact O-N 2.91Å; Y286-Q288 VanDerWaalsContact C-N 3.34Å; Y286-Q288 PolarHBondContact O-N 3.08Å; Y286-Q289 WeakPolarHBondContact O-CB 3.33Å; Y286-Q289 PolarHBondContact O-N 3.32Å; Y286-E290 HydrophobicContact CD1-CG 4.28Å; Y286-E290 HydrophobicContact CE1-CG 3.74Å; Y286-E290 HydrophobicContact CE2-CG 4.3Å; Y286-E290 PolarHBondContact O-N 3.43Å; Y286-K308 HydrophobicContact CE1-CB 4.48Å; Y286-K308 HydrophobicContact CE1-CD 3.96Å; Y286-K308 PolarHBondContact OH-NZ 3.11Å; Y286-K308 VanDerWaalsContact OH-NZ 3.15Å; Y286-Q312 HydrophobicContact CD1-CG 3.39Å; Y286-Q312 HydrophobicContact CD2-CG 4.5Å; Y286-Q312 HydrophobicContact CE1-CG 3.62Å; Y286-Q312 HydrophobicContact CG-CG 3.87Å
287	L	90.8	Very high	85.5	Confident	17 Å²	17	79.9 Å²	79.9	9%	0.089	43%	0.427	C	S	.	.	H	α-helix	trans	-65.4	-36.6	179	-69.6	172.5	0	0	0	112.4	I283 L284 Q291 K308 M309 T368	I283-L287 HydrophobicContact CG2-CD1 3.94Å; I283-L287 HydrophobicContact CG2-CG 4.41Å; I283-L287 WeakPolarHBondContact O-CG 3.4Å; I283-L287 PolarHBondContact O-N 3.46Å; L284-L287 PolarHBondContact O-N 2.9Å; L287-Q291 WeakPolarHBondContact O-CG 3.35Å; L287-Q291 PolarHBondContact O-N 2.97Å; L287-Q291 VanDerWaalsContact O-N 3.1Å; L287-K308 HydrophobicContact CD2-CB 3.7Å; L287-M309 HydrophobicContact CD1-CB 4.22Å; L287-M309 HydrophobicContact CD1-CG 4.47Å; L287-T368 HydrophobicContact CD1-CG2 3.6Å
288	Q	90.2	Very high	84.1	Confident	115 Å²	115	82 Å²	82	54%	0.537	43%	0.43	S	S	.	.	H	α-helix	trans	-65.2	-41.8	173.1	-73	174.7	1.4	0	0	111.6	L284 A285 Y286 Q291 A292	L284-Q288 VanDerWaalsContact O-CG 3.31Å; L284-Q288 WeakPolarHBondContact O-CG 3.45Å; L284-Q288 PolarHBondContact O-N 3.34Å; A285-Q288 PolarHBondContact O-N 3.05Å; Y286-Q288 VanDerWaalsContact C-N 3.34Å; Y286-Q288 PolarHBondContact O-N 3.08Å; Q288-Q291 PolarHBondContact O-N 2.98Å; Q288-A292 WeakPolarHBondContact O-CB 3.41Å; Q288-A292 PolarHBondContact O-N 3.23Å
289	Q	89.3	Confident	82.8	Confident	138 Å²	138	82.1 Å²	82.1	65%	0.645	43%	0.428	S	S	*	.	H	α-helix	trans	-62.4	-46.4	175.7	-175.5	178.7	-1.8	0	0	111.9	A285 Y286 Q291 A292 S293	A285-Q289 WeakPolarHBondContact O-CB 3.39Å; A285-Q289 PolarHBondContact O-N 3.02Å; Y286-Q289 WeakPolarHBondContact O-CB 3.33Å; Y286-Q289 PolarHBondContact O-N 3.32Å; Q289-Q291 VanDerWaalsContact C-N 3.26Å; Q289-Q291 PolarHBondContact O-N 3.18Å; Q289-A292 PolarHBondContact O-N 2.73Å; Q289-A292 VanDerWaalsContact O-N 3.15Å; Q289-S293 WeakPolarHBondContact O-CB 3.46Å; Q289-S293 PolarHBondContact O-N 3.49Å; Q289-S293 PolarHBondContact O-OG 2.9Å
290	E	84.9	Confident	81.9	Confident	33 Å²	33	82.7 Å²	82.7	15%	0.154	43%	0.431	C	S	.	.	H	α-helix	trans	-62.8	-28	176	-82.5	-72.7	91.2	0	0	113.5	Y286 S293 R294 K308	Y286-E290 HydrophobicContact CD1-CG 4.28Å; Y286-E290 HydrophobicContact CE1-CG 3.74Å; Y286-E290 HydrophobicContact CE2-CG 4.3Å; Y286-E290 PolarHBondContact O-N 3.43Å; E290-S293 PolarHBondContact O-OG 3.3Å; E290-R294 WeakPolarHBondContact O-CD 3.26Å; E290-R294 WeakPolarHBondContact O-CG 3.3Å; E290-R294 PolarHBondContact O-NE 2.95Å; E290-R294 IonicContact OE2-NH2 3.21Å; E290-K308 VanDerWaalsContact OE2-CE 3.25Å; E290-K308 WeakPolarHBondContact OE2-CE 3.38Å; E290-K308 IonicContact OE2-NZ 2.71Å; E290-K308 PolarHBondContact OE2-NZ 3.03Å
291	Q	83.5	Confident	81.1	Confident	81 Å²	81	84 Å²	84	38%	0.379	44%	0.439	S	S	.	.	H	α-helix	trans	-82.7	-27.9	173.8	-73.7	-176.3	6.4	0	0	113.2	L287 Q288 Q289 L305	L287-Q291 WeakPolarHBondContact O-CG 3.35Å; L287-Q291 PolarHBondContact O-N 2.97Å; L287-Q291 VanDerWaalsContact O-N 3.1Å; Q288-Q291 PolarHBondContact O-N 2.98Å; Q289-Q291 VanDerWaalsContact C-N 3.26Å; Q289-Q291 PolarHBondContact O-N 3.18Å; Q291-L305 HydrophobicContact CG-CD2 4.18Å; Q291-L305 VanDerWaalsContact NE2-CD2 3.32Å
292	A	84	Confident	80.5	Confident	85 Å²	85	84.9 Å²	84.9	70%	0.702	44%	0.439	S	S	*	.	H	α-helix	trans	-83.1	-28.8	179.7	0	0	0	0	0	113.2	Q288 Q289 R294	Q288-A292 WeakPolarHBondContact O-CB 3.41Å; Q288-A292 PolarHBondContact O-N 3.23Å; Q289-A292 PolarHBondContact O-N 2.73Å; Q289-A292 VanDerWaalsContact O-N 3.15Å; A292-R294 VanDerWaalsContact C-N 3.3Å
293	S	78.8	Confident	80	Confident	84 Å²	84	81.9 Å²	81.9	59%	0.587	43%	0.426	S	S	*	.	S	Bend	trans	-73.4	-19.1	176.9	61.6	0	0	0	0	113.8	Q289 E290	Q289-S293 WeakPolarHBondContact O-CB 3.46Å; Q289-S293 PolarHBondContact O-N 3.49Å; Q289-S293 PolarHBondContact O-OG 2.9Å; E290-S293 PolarHBondContact O-OG 3.3Å
294	R	74.3	Confident	79.6	Confident	79 Å²	79	82 Å²	82	30%	0.298	43%	0.427	S	S	.	.	S	Bend	trans	-94.9	141.3	-176	-67.7	172.9	-177.1	-97.4	-5.4	112	E290 A292 E298	E290-R294 WeakPolarHBondContact O-CD 3.26Å; E290-R294 WeakPolarHBondContact O-CG 3.3Å; E290-R294 PolarHBondContact O-NE 2.95Å; E290-R294 IonicContact OE2-NH2 3.21Å; A292-R294 VanDerWaalsContact C-N 3.3Å; R294-E298 HydrophobicContact CB-CB 4.27Å; R294-E298 WeakPolarHBondContact CD-O 3.46Å
295	G	65.8	Low	79.2	Confident	40 Å²	40	81.5 Å²	81.5	41%	0.412	42%	0.424	S	S	.	.			trans	-62.2	160.9	175.8	0	0	0	0	0	112.6	H297 E298	G295-H297 PolarHBondContact O-N 3.3Å; G295-E298 PolarHBondContact O-N 3.01Å
296	K	56.8	Low	79	Confident	195 Å²	195	81.9 Å²	81.9	85%	0.848	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-23.9	-178.9	-82.1	-175.8	176.3	177.8	0	114.6
297	H	52.4	Low	78.9	Confident	190 Å²	190	79.4 Å²	79.4	88%	0.88	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-1.2	-179.4	-68	-85.9	0	0	0	114.8	G295	G295-H297 PolarHBondContact O-N 3.3Å
298	E	63.8	Low	78.9	Confident	132 Å²	132	79.7 Å²	79.7	62%	0.617	41%	0.409	S	S	*	.			trans	-116.5	19.4	-176.3	-66.4	-171.2	138.7	0	0	113.7	R294 G295 L300	R294-E298 HydrophobicContact CB-CB 4.27Å; R294-E298 WeakPolarHBondContact CD-O 3.46Å; G295-E298 PolarHBondContact O-N 3.01Å; E298-L300 PolarHBondContact O-N 2.91Å
299	K	68	Low	79.1	Confident	139 Å²	139	75.4 Å²	75.4	60%	0.604	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-64	133.2	179	-70.3	-169.6	172.9	-168.2	0	111.1
300	L	74.6	Confident	79.4	Confident	33 Å²	33	70.1 Å²	70.1	17%	0.173	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-59.7	136.4	174.5	-65.9	172.1	0	0	0	110.5	E298 L305 K308	E298-L300 PolarHBondContact O-N 2.91Å; L300-L305 HydrophobicContact CB-CD2 3.9Å; L300-L305 HydrophobicContact CB-CG 3.97Å; L300-L305 HydrophobicContact CD1-CD2 4.04Å; L300-K308 HydrophobicContact CD1-CG 3.99Å
301	N	79.5	Confident	79.8	Confident	92 Å²	92	68.7 Å²	68.7	49%	0.492	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-70.6	171.2	169.2	67	20	0	0	0	110.8	F303 G304 L305	N301-F303 PolarHBondContact O-N 3.46Å; N301-F303 VanDerWaalsContact O-N 3.14Å; N301-F303 PolarHBondContact OD1-N 3.03Å; N301-G304 PolarHBondContact O-N 3.14Å; N301-G304 VanDerWaalsContact O-N 3.11Å; N301-G304 PolarHBondContact OD1-N 3.23Å; N301-L305 PolarHBondContact O-N 3.01Å
302	T	81.9	Confident	80.4	Confident	77 Å²	77	66.1 Å²	66.1	47%	0.472	35%	0.351	S	S	.	.	H	α-helix	trans	-51.7	-39.2	-179.4	-47.3	0	0	0	0	112.3	M306 Q380	T302-M306 WeakPolarHBondContact O-CG 3.35Å; T302-M306 PolarHBondContact O-N 2.83Å; T302-Q380 PolarHBondContact OG1-OE1 2.88Å
303	F	84.8	Confident	81	Confident	28 Å²	28	63 Å²	63	12%	0.123	32%	0.323	C	S	.	.	H	α-helix	trans	-68	-46.8	178.2	179.8	-103.5	0	0	0	113	N301 L305 M306 C307 Y477 L478 K481 D486 V487	N301-F303 PolarHBondContact O-N 3.46Å; N301-F303 VanDerWaalsContact O-N 3.14Å; N301-F303 PolarHBondContact OD1-N 3.03Å; F303-L305 VanDerWaalsContact C-N 3.27Å; F303-L305 PolarHBondContact O-N 3.39Å; F303-M306 HydrophobicContact CB-CE 4.37Å; F303-M306 HydrophobicContact CD2-CE 4.07Å; F303-M306 WeakPolarHBondContact O-CA 3.45Å; F303-M306 WeakPolarHBondContact O-CB 3.37Å; F303-M306 PolarHBondContact O-N 2.95Å; F303-C307 PolarHBondContact O-N 3.43Å; F303-C307 PolarHBondContact O-SG 3.08Å; F303-Y477 HydrophobicContact CD2-CE1 4.32Å; F303-Y477 AromaticContact CE2-CE1 3.8Å; F303-Y477 HydrophobicContact CE2-CE1 3.8Å; F303-L478 HydrophobicContact CZ-CD1 4.17Å; F303-K481 HydrophobicContact CE1-CB 3.68Å; F303-K481 HydrophobicContact CE1-CD 4.08Å; F303-K481 HydrophobicContact CE1-CG 3.95Å; F303-K481 HydrophobicContact CE2-CB 4.32Å; F303-K481 HydrophobicContact CE2-CG 4Å; F303-K481 HydrophobicContact CZ-CB 3.39Å; F303-K481 HydrophobicContact CZ-CD 4.13Å; F303-K481 HydrophobicContact CZ-CG 3.53Å; F303-D486 HydrophobicContact CD1-CB 4.22Å; F303-D486 HydrophobicContact CE1-CB 4.02Å; F303-V487 HydrophobicContact CE1-CG2 3.64Å; F303-V487 HydrophobicContact CZ-CG2 3.81Å
304	G	86.5	Confident	81.8	Confident	2 Å²	2	59 Å²	59	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-61.7	-34.2	176.2	0	0	0	0	0	113.1	N301 C307 K308	N301-G304 PolarHBondContact O-N 3.14Å; N301-G304 VanDerWaalsContact O-N 3.11Å; N301-G304 PolarHBondContact OD1-N 3.23Å; G304-C307 PolarHBondContact O-N 2.98Å; G304-K308 WeakPolarHBondContact O-CG 3.2Å; G304-K308 PolarHBondContact O-N 3.32Å; G304-K308 VanDerWaalsContact O-N 3.07Å
305	L	86.4	Confident	82.9	Confident	41 Å²	41	59.3 Å²	59.3	22%	0.215	30%	0.299	C	S	.	.	H	α-helix	trans	-67	-40.4	171.3	-66.1	173.9	0	0	0	112	Q291 L300 N301 F303 K308 M309	Q291-L305 HydrophobicContact CG-CD2 4.18Å; Q291-L305 VanDerWaalsContact NE2-CD2 3.32Å; L300-L305 HydrophobicContact CB-CD2 3.9Å; L300-L305 HydrophobicContact CB-CG 3.97Å; L300-L305 HydrophobicContact CD1-CD2 4.04Å; N301-L305 PolarHBondContact O-N 3.01Å; F303-L305 VanDerWaalsContact C-N 3.27Å; F303-L305 PolarHBondContact O-N 3.39Å; L305-K308 PolarHBondContact O-N 2.97Å; L305-M309 VanDerWaalsContact O-CB 3.29Å; L305-M309 WeakPolarHBondContact O-CB 3.26Å; L305-M309 PolarHBondContact O-N 3.14Å
306	M	88.9	Confident	84.4	Confident	62 Å²	62	57.8 Å²	57.8	31%	0.305	28%	0.282	S	S	.	.	H	α-helix	trans	-62.9	-42.4	173.3	-71.4	-172.4	-63.2	0	0	112.2	T302 F303 K308 M309 A310 L385	T302-M306 WeakPolarHBondContact O-CG 3.35Å; T302-M306 PolarHBondContact O-N 2.83Å; F303-M306 HydrophobicContact CB-CE 4.37Å; F303-M306 HydrophobicContact CD2-CE 4.07Å; F303-M306 WeakPolarHBondContact O-CA 3.45Å; F303-M306 WeakPolarHBondContact O-CB 3.37Å; F303-M306 PolarHBondContact O-N 2.95Å; M306-K308 PolarHBondContact O-N 3.25Å; M306-M309 HydrophobicContact CG-CE 4.37Å; M306-M309 PolarHBondContact O-N 3.36Å; M306-A310 WeakPolarHBondContact O-CB 3.4Å; M306-A310 PolarHBondContact O-N 3.29Å; M306-L385 HydrophobicContact CE-CD2 3.95Å
307	C	91.7	Very high	86.3	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.034	24%	0.242	C	C	.	.	H	α-helix	trans	-60.2	-45.7	175.2	-65.9	0	0	0	0	111.9	F303 G304 M309 A310 D311 V487 L493	F303-C307 PolarHBondContact O-N 3.43Å; F303-C307 PolarHBondContact O-SG 3.08Å; G304-C307 PolarHBondContact O-N 2.98Å; C307-M309 VanDerWaalsContact C-N 3.35Å; C307-M309 PolarHBondContact O-N 2.91Å; C307-A310 PolarHBondContact O-N 3Å; C307-D311 WeakPolarHBondContact O-CB 3.5Å; C307-D311 PolarHBondContact O-N 2.91Å; C307-V487 HydrophobicContact CB-CG1 4.35Å; C307-L493 HydrophobicContact CB-CD2 4.14Å
308	K	90.9	Very high	88.5	Confident	22 Å²	22	41.4 Å²	41.4	10%	0.096	21%	0.211	C	C	.	.	H	α-helix	trans	-64.5	-37.1	176.6	-74.6	-79.8	175.5	160.7	0	112.8	Y286 L287 E290 L300 G304 L305 M306 Q312	Y286-K308 HydrophobicContact CE1-CB 4.48Å; Y286-K308 HydrophobicContact CE1-CD 3.96Å; Y286-K308 PolarHBondContact OH-NZ 3.11Å; Y286-K308 VanDerWaalsContact OH-NZ 3.15Å; L287-K308 HydrophobicContact CD2-CB 3.7Å; E290-K308 VanDerWaalsContact OE2-CE 3.25Å; E290-K308 WeakPolarHBondContact OE2-CE 3.38Å; E290-K308 IonicContact OE2-NZ 2.71Å; E290-K308 PolarHBondContact OE2-NZ 3.03Å; L300-K308 HydrophobicContact CD1-CG 3.99Å; G304-K308 WeakPolarHBondContact O-CG 3.2Å; G304-K308 PolarHBondContact O-N 3.32Å; G304-K308 VanDerWaalsContact O-N 3.07Å; L305-K308 PolarHBondContact O-N 2.97Å; M306-K308 PolarHBondContact O-N 3.25Å; K308-Q312 WeakPolarHBondContact O-CG 3.34Å; K308-Q312 PolarHBondContact O-N 2.87Å; K308-Q312 VanDerWaalsContact O-N 3.14Å
309	M	93.8	Very high	90	Very high	26 Å²	26	40 Å²	40	13%	0.128	20%	0.204	C	C	.	.	H	α-helix	trans	-67.6	-43.1	175.2	-176.5	174.6	65.2	0	0	111.9	I283 L287 L305 M306 C307 Q312 T313 L366 V367 T368	I283-M309 HydrophobicContact CG2-CG 4.16Å; L287-M309 HydrophobicContact CD1-CB 4.22Å; L287-M309 HydrophobicContact CD1-CG 4.47Å; L305-M309 VanDerWaalsContact O-CB 3.29Å; L305-M309 WeakPolarHBondContact O-CB 3.26Å; L305-M309 PolarHBondContact O-N 3.14Å; M306-M309 HydrophobicContact CG-CE 4.37Å; M306-M309 PolarHBondContact O-N 3.36Å; C307-M309 VanDerWaalsContact C-N 3.35Å; C307-M309 PolarHBondContact O-N 2.91Å; M309-Q312 PolarHBondContact O-N 3.09Å; M309-T313 WeakPolarHBondContact O-CB 3.16Å; M309-T313 PolarHBondContact O-N 2.88Å; M309-T313 PolarHBondContact O-OG1 3.35Å; M309-L366 HydrophobicContact CE-CB 4.45Å; M309-L366 HydrophobicContact CE-CD1 4.25Å; M309-L366 HydrophobicContact CE-CD2 4.19Å; M309-L366 HydrophobicContact SD-CB 4.12Å; M309-L366 HydrophobicContact SD-CD1 4.31Å; M309-V367 HydrophobicContact CG-CG1 3.4Å; M309-V367 VanDerWaalsContact CG-CG1 3.4Å; M309-V367 HydrophobicContact SD-CG1 3.69Å; M309-T368 HydrophobicContact CG-CG2 4.47Å; M309-T368 HydrophobicContact SD-CG2 3.9Å
310	A	95.1	Very high	91.5	Very high	26 Å²	26	33.7 Å²	33.7	22%	0.215	18%	0.177	C	C	.	.	H	α-helix	trans	-64.8	-42.4	176.1	0	0	0	0	0	111.9	M306 C307 T313 L314 L347 L493	M306-A310 WeakPolarHBondContact O-CB 3.4Å; M306-A310 PolarHBondContact O-N 3.29Å; C307-A310 PolarHBondContact O-N 3Å; A310-T313 PolarHBondContact O-N 3.35Å; A310-L314 WeakPolarHBondContact O-CB 3.29Å; A310-L314 PolarHBondContact O-N 3.11Å; A310-L347 HydrophobicContact CB-CD1 4.42Å; A310-L493 HydrophobicContact CB-CD1 4.46Å; A310-L493 HydrophobicContact CB-CD2 4.15Å
311	D	94.9	Very high	92.6	Very high	4 Å²	4	32.1 Å²	32.1	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-57.8	-48.4	174.5	179.5	73.7	0	0	0	112.4	C307 T313 L314 F315 N491 L492 L493	C307-D311 WeakPolarHBondContact O-CB 3.5Å; C307-D311 PolarHBondContact O-N 2.91Å; D311-T313 PolarHBondContact O-N 2.97Å; D311-L314 WeakPolarHBondContact O-CB 3.36Å; D311-L314 PolarHBondContact O-N 3.49Å; D311-L314 VanDerWaalsContact O-N 3.16Å; D311-F315 VanDerWaalsContact O-CD2 3.27Å; D311-F315 WeakPolarHBondContact O-CD2 3.48Å; D311-F315 PolarHBondContact O-N 3.1Å; D311-F315 VanDerWaalsContact O-N 3.13Å; D311-N491 WeakPolarHBondContact OD1-CB 3.18Å; D311-L492 WeakPolarHBondContact OD1-CB 3.34Å; D311-L492 PolarHBondContact OD1-N 3.44Å; D311-L493 HydrophobicContact CB-CB 4.06Å; D311-L493 PolarHBondContact OD1-N 2.75Å; D311-L493 VanDerWaalsContact OD1-N 3.11Å
312	Q	95.3	Very high	93.4	Very high	27 Å²	27	34.6 Å²	34.6	13%	0.126	17%	0.171	C	C	.	.	H	α-helix	trans	-67.8	-33.8	176.2	-65	-58.3	-71.2	0	0	113.2	I283 Y286 K308 M309 L314 F315 S316	I283-Q312 HydrophobicContact CG1-CB 3.91Å; I283-Q312 HydrophobicContact CG2-CB 4.44Å; Y286-Q312 HydrophobicContact CD1-CG 3.39Å; Y286-Q312 HydrophobicContact CD2-CG 4.5Å; Y286-Q312 HydrophobicContact CE1-CG 3.62Å; Y286-Q312 HydrophobicContact CG-CG 3.87Å; K308-Q312 WeakPolarHBondContact O-CG 3.34Å; K308-Q312 PolarHBondContact O-N 2.87Å; K308-Q312 VanDerWaalsContact O-N 3.14Å; M309-Q312 PolarHBondContact O-N 3.09Å; Q312-L314 VanDerWaalsContact C-N 3.28Å; Q312-L314 PolarHBondContact O-N 2.98Å; Q312-F315 PolarHBondContact O-N 3.4Å; Q312-S316 PolarHBondContact O-N 3.18Å
313	T	96.4	Very high	94.1	Very high	18 Å²	18	32.7 Å²	32.7	11%	0.11	16%	0.161	C	C	.	.	H	α-helix	trans	-64.5	-36.4	172.5	-50.9	0	0	0	0	110.9	M309 A310 D311 S316 I317 L347	M309-T313 WeakPolarHBondContact O-CB 3.16Å; M309-T313 PolarHBondContact O-N 2.88Å; M309-T313 PolarHBondContact O-OG1 3.35Å; A310-T313 PolarHBondContact O-N 3.35Å; D311-T313 PolarHBondContact O-N 2.97Å; T313-S316 CarbonylContact O-C 3.57Å; T313-S316 WeakPolarHBondContact O-CA 3.46Å; T313-S316 WeakPolarHBondContact O-CB 3.47Å; T313-S316 PolarHBondContact O-N 3.41Å; T313-S316 VanDerWaalsContact O-N 3.12Å; T313-I317 HydrophobicContact CG2-CD1 4.47Å; T313-I317 WeakPolarHBondContact O-CG1 3.39Å; T313-I317 PolarHBondContact O-N 3.07Å; T313-L347 HydrophobicContact CG2-CD2 3.61Å
314	L	96.6	Very high	94.7	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-67.2	-37.2	178.2	-175.2	52.8	0	0	0	112.3	A310 D311 Q312 S316 I317 V318 W343 L492 L493 M496	A310-L314 WeakPolarHBondContact O-CB 3.29Å; A310-L314 PolarHBondContact O-N 3.11Å; D311-L314 WeakPolarHBondContact O-CB 3.36Å; D311-L314 PolarHBondContact O-N 3.49Å; D311-L314 VanDerWaalsContact O-N 3.16Å; Q312-L314 VanDerWaalsContact C-N 3.28Å; Q312-L314 PolarHBondContact O-N 2.98Å; L314-S316 VanDerWaalsContact C-N 3.33Å; L314-S316 PolarHBondContact O-N 3.13Å; L314-I317 HydrophobicContact CD1-CB 4.45Å; L314-I317 PolarHBondContact O-N 3.29Å; L314-V318 WeakPolarHBondContact O-CG2 3.43Å; L314-V318 PolarHBondContact O-N 3.25Å; L314-W343 HydrophobicContact CD1-CB 3.7Å; L314-W343 HydrophobicContact CD2-CE3 4.3Å; L314-L492 HydrophobicContact CB-CD2 4.47Å; L314-L492 HydrophobicContact CD2-CD2 4.3Å; L314-L492 HydrophobicContact CD2-CG 3.99Å; L314-L492 HydrophobicContact CG-CD2 3.89Å; L314-L492 HydrophobicContact CG-CG 4.14Å; L314-L493 HydrophobicContact CD2-CD1 4.49Å; L314-M496 HydrophobicContact CD2-CB 4.24Å; L314-M496 HydrophobicContact CD2-CG 4.04Å
315	F	96.4	Very high	95.1	Very high	85 Å²	85	35.2 Å²	35.2	37%	0.373	18%	0.178	S	C	.	.	H	α-helix	trans	-58.5	-43.1	167.6	-78.4	-75.5	0	0	0	112.1	D311 Q312 I317 V318 E319 L492	D311-F315 VanDerWaalsContact O-CD2 3.27Å; D311-F315 WeakPolarHBondContact O-CD2 3.48Å; D311-F315 PolarHBondContact O-N 3.1Å; D311-F315 VanDerWaalsContact O-N 3.13Å; Q312-F315 PolarHBondContact O-N 3.4Å; F315-I317 VanDerWaalsContact C-N 3.33Å; F315-I317 PolarHBondContact O-N 3.14Å; F315-V318 PolarHBondContact O-N 2.87Å; F315-E319 WeakPolarHBondContact O-CG 3.32Å; F315-E319 PolarHBondContact O-N 2.88Å; F315-L492 HydrophobicContact CD1-CD2 3.92Å; F315-L492 HydrophobicContact CD2-CD2 4.21Å; F315-L492 HydrophobicContact CE1-CD2 3.85Å; F315-L492 HydrophobicContact CE2-CB 3.95Å; F315-L492 HydrophobicContact CE2-CD2 4.14Å; F315-L492 HydrophobicContact CG-CD2 4.1Å; F315-L492 HydrophobicContact CZ-CB 3.87Å; F315-L492 HydrophobicContact CZ-CD2 3.96Å
316	S	97	Very high	95.6	Very high	9 Å²	9	34.7 Å²	34.7	6%	0.063	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-31.9	174.8	-69.9	0	0	0	0	113.5	Q312 T313 L314 E319 W320	Q312-S316 PolarHBondContact O-N 3.18Å; T313-S316 CarbonylContact O-C 3.57Å; T313-S316 WeakPolarHBondContact O-CA 3.46Å; T313-S316 WeakPolarHBondContact O-CB 3.47Å; T313-S316 PolarHBondContact O-N 3.41Å; T313-S316 VanDerWaalsContact O-N 3.12Å; L314-S316 VanDerWaalsContact C-N 3.33Å; L314-S316 PolarHBondContact O-N 3.13Å; S316-E319 PolarHBondContact O-N 2.84Å; S316-W320 VanDerWaalsContact O-CB 3.24Å; S316-W320 WeakPolarHBondContact O-CB 3.34Å; S316-W320 PolarHBondContact O-N 2.88Å
317	I	97.9	Very high	96	Very high	3 Å²	3	31.8 Å²	31.8	2%	0.015	16%	0.16	C	C	.	.	H	α-helix	trans	-66.3	-39.6	171.4	-71	166.5	0	0	0	111.1	T313 L314 F315 W320 A321 L346 L347	T313-I317 HydrophobicContact CG2-CD1 4.47Å; T313-I317 WeakPolarHBondContact O-CG1 3.39Å; T313-I317 PolarHBondContact O-N 3.07Å; L314-I317 HydrophobicContact CD1-CB 4.45Å; L314-I317 PolarHBondContact O-N 3.29Å; F315-I317 VanDerWaalsContact C-N 3.33Å; F315-I317 PolarHBondContact O-N 3.14Å; I317-W320 HydrophobicContact CG2-CE3 4.41Å; I317-W320 PolarHBondContact O-N 3.42Å; I317-A321 WeakPolarHBondContact O-CB 3.45Å; I317-A321 PolarHBondContact O-N 3.26Å; I317-L346 HydrophobicContact CD1-CB 3.98Å; I317-L346 HydrophobicContact CG2-CB 4.32Å; I317-L346 HydrophobicContact CG2-CD1 3.64Å; I317-L347 HydrophobicContact CD1-CD2 3.64Å; I317-L347 HydrophobicContact CD1-CG 3.88Å
318	V	97.4	Very high	96.2	Very high	38 Å²	38	39.3 Å²	39.3	23%	0.23	19%	0.188	C	C	.	.	H	α-helix	trans	-67.6	-42.6	175.1	176	0	0	0	0	111.3	L314 F315 A321 R322 L339 L492	L314-V318 WeakPolarHBondContact O-CG2 3.43Å; L314-V318 PolarHBondContact O-N 3.25Å; F315-V318 PolarHBondContact O-N 2.87Å; V318-A321 PolarHBondContact O-N 3.07Å; V318-R322 WeakPolarHBondContact O-CB 3.37Å; V318-R322 VanDerWaalsContact O-CG 3.22Å; V318-R322 WeakPolarHBondContact O-CG 3.39Å; V318-R322 PolarHBondContact O-N 2.7Å; V318-R322 VanDerWaalsContact O-N 3.09Å; V318-L339 HydrophobicContact CG2-CD1 4.28Å; V318-L492 HydrophobicContact CG2-CD2 4.41Å
319	E	96.8	Very high	96.5	Very high	101 Å²	101	44.2 Å²	44.2	47%	0.472	21%	0.211	S	C	.	.	H	α-helix	trans	-59	-45.8	173	-72.2	170.1	175.8	0	0	111	K282 F315 S316 R322 S323	K282-E319 IonicContact NZ-OE1 3.73Å; K282-E319 PolarHBondContact NZ-OE1 3.31Å; K282-E319 IonicContact NZ-OE2 2.61Å; K282-E319 PolarHBondContact NZ-OE2 3.23Å; F315-E319 WeakPolarHBondContact O-CG 3.32Å; F315-E319 PolarHBondContact O-N 2.88Å; S316-E319 PolarHBondContact O-N 2.84Å; E319-R322 PolarHBondContact O-N 3.48Å; E319-S323 PolarHBondContact O-N 2.87Å; E319-S323 VanDerWaalsContact O-N 3.08Å
320	W	98	Very high	96.7	Very high	8 Å²	8	43.3 Å²	43.3	3%	0.03	21%	0.207	C	C	.	.	H	α-helix	trans	-59.2	-51.8	174.9	166.2	84	0	0	0	112.7	E273 S316 I317 R322 S323 L346 K413 F414 L417	E273-W320 PolarHBondContact OE1-NE1 3.37Å; S316-W320 VanDerWaalsContact O-CB 3.24Å; S316-W320 WeakPolarHBondContact O-CB 3.34Å; S316-W320 PolarHBondContact O-N 2.88Å; I317-W320 HydrophobicContact CG2-CE3 4.41Å; I317-W320 PolarHBondContact O-N 3.42Å; W320-R322 VanDerWaalsContact C-N 3.29Å; W320-R322 PolarHBondContact O-N 3.4Å; W320-S323 VanDerWaalsContact O-CB 3.27Å; W320-S323 WeakPolarHBondContact O-CB 3.37Å; W320-S323 PolarHBondContact O-N 2.93Å; W320-S323 PolarHBondContact O-OG 3.47Å; W320-L346 HydrophobicContact CH2-CD2 4.49Å; W320-L346 HydrophobicContact CZ3-CD1 3.88Å; W320-L346 HydrophobicContact CZ3-CD2 4.41Å; W320-K413 HydrophobicContact CH2-CB 3.82Å; W320-K413 HydrophobicContact CZ2-CB 3.7Å; W320-K413 HydrophobicContact CZ2-CD 4.39Å; W320-F414 HydrophobicContact CH2-CD2 4.43Å; W320-F414 HydrophobicContact CH2-CE2 4.43Å; W320-F414 AromaticContact CZ2-CD2 3.84Å; W320-F414 HydrophobicContact CZ2-CD2 3.84Å; W320-F414 AromaticContact CZ2-CE2 3.62Å; W320-F414 HydrophobicContact CZ2-CE2 3.62Å; W320-F414 HydrophobicContact CZ2-CZ 4.26Å; W320-L417 HydrophobicContact CH2-CB 4.16Å; W320-L417 HydrophobicContact CH2-CD2 3.86Å; W320-L417 HydrophobicContact CZ3-CB 4.29Å; W320-L417 HydrophobicContact CZ3-CD2 3.72Å; W320-L417 HydrophobicContact CZ3-CG 4.43Å
321	A	98.3	Very high	96.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.4	-43.4	-179.1	0	0	0	0	0	110.9	I317 V318 S323 S324 F327 L339 L417	I317-A321 WeakPolarHBondContact O-CB 3.45Å; I317-A321 PolarHBondContact O-N 3.26Å; V318-A321 PolarHBondContact O-N 3.07Å; A321-S323 PolarHBondContact O-N 3.08Å; A321-S324 WeakPolarHBondContact O-CB 3.23Å; A321-S324 PolarHBondContact O-N 2.9Å; A321-S324 VanDerWaalsContact O-N 3.14Å; A321-F327 HydrophobicContact CB-CD1 4.11Å; A321-F327 HydrophobicContact CB-CD2 4.45Å; A321-F327 HydrophobicContact CB-CE1 4.02Å; A321-F327 HydrophobicContact CB-CE2 4.37Å; A321-F327 HydrophobicContact CB-CG 4.32Å; A321-F327 HydrophobicContact CB-CZ 4.15Å; A321-F327 WeakPolarHBondContact O-CB 3.3Å; A321-F327 WeakPolarHBondContact O-CD1 3.31Å; A321-F327 WeakPolarHBondContact O-CG 3.43Å; A321-L339 HydrophobicContact CB-CD2 3.97Å; A321-L417 HydrophobicContact CB-CD1 4.49Å; A321-L417 HydrophobicContact CB-CD2 4.08Å
322	R	97.2	Very high	96.9	Very high	143 Å²	143	52.2 Å²	52.2	54%	0.54	25%	0.248	S	C	.	.	H	α-helix	trans	-65.5	-20.9	175.6	-68	174.3	68.7	78.6	0.5	113.8	V318 E319 W320 S324 F327 R328	V318-R322 WeakPolarHBondContact O-CB 3.37Å; V318-R322 VanDerWaalsContact O-CG 3.22Å; V318-R322 WeakPolarHBondContact O-CG 3.39Å; V318-R322 PolarHBondContact O-N 2.7Å; V318-R322 VanDerWaalsContact O-N 3.09Å; E319-R322 PolarHBondContact O-N 3.48Å; W320-R322 VanDerWaalsContact C-N 3.29Å; W320-R322 PolarHBondContact O-N 3.4Å; R322-S324 VanDerWaalsContact C-N 3.29Å; R322-S324 PolarHBondContact O-N 3.27Å; R322-F327 HydrophobicContact CG-CD1 4.44Å; R322-F327 HydrophobicContact CG-CE1 4.29Å; R322-R328 PolarHBondContact O-NE 2.91Å
323	S	96.6	Very high	96.9	Very high	37 Å²	37	54.5 Å²	54.5	26%	0.259	26%	0.261	S	S	.	.	H	α-helix	trans	-68.3	-29.2	174.1	82.4	0	0	0	0	112.2	C272 E319 W320 A321 R328	C272-S323 VanDerWaalsContact CA-OG 3.3Å; C272-S323 WeakPolarHBondContact CA-OG 3.45Å; C272-S323 WeakPolarHBondContact CB-OG 3.24Å; C272-S323 PolarHBondContact O-OG 3.08Å; E319-S323 PolarHBondContact O-N 2.87Å; E319-S323 VanDerWaalsContact O-N 3.08Å; W320-S323 VanDerWaalsContact O-CB 3.27Å; W320-S323 WeakPolarHBondContact O-CB 3.37Å; W320-S323 PolarHBondContact O-N 2.93Å; W320-S323 PolarHBondContact O-OG 3.47Å; A321-S323 PolarHBondContact O-N 3.08Å; S323-R328 PolarHBondContact O-NH2 2.99Å
324	S	96.2	Very high	97	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.256	C	S	.	.	S	Bend	trans	-67	138.8	-179.7	-175	0	0	0	0	113.6	A321 R322 F326 R328 F414	A321-S324 WeakPolarHBondContact O-CB 3.23Å; A321-S324 PolarHBondContact O-N 2.9Å; A321-S324 VanDerWaalsContact O-N 3.14Å; R322-S324 VanDerWaalsContact C-N 3.29Å; R322-S324 PolarHBondContact O-N 3.27Å; S324-F326 PolarHBondContact OG-N 2.94Å; S324-R328 VanDerWaalsContact O-CG 3.29Å; S324-R328 WeakPolarHBondContact O-CG 3.28Å; S324-R328 PolarHBondContact O-N 3.45Å; S324-F414 VanDerWaalsContact OG-CE1 3.29Å; S324-F414 WeakPolarHBondContact OG-CE1 3.42Å
325	V	94.4	Very high	97	Very high	84 Å²	84	54.6 Å²	54.6	51%	0.509	26%	0.261	S	S	.	.	H	α-helix	trans	-61.9	-46.5	172.4	-64.4	0	0	0	0	111.9	F327 R328 E329	V325-F327 VanDerWaalsContact C-N 3.31Å; V325-F327 PolarHBondContact O-N 3.26Å; V325-R328 PolarHBondContact O-N 3.39Å; V325-E329 PolarHBondContact O-N 2.97Å
326	F	96.8	Very high	97	Very high	29 Å²	29	55.1 Å²	55.1	13%	0.127	27%	0.265	C	S	.	.	H	α-helix	trans	-62.7	-37.2	-177.3	-52.7	-62.7	0	0	0	112.7	L265 L269 S324 E329 F414 F418 V434	L265-F326 HydrophobicContact CD1-CE2 3.7Å; L265-F326 HydrophobicContact CD1-CZ 3.57Å; L269-F326 HydrophobicContact CD2-CE2 4.1Å; S324-F326 PolarHBondContact OG-N 2.94Å; F326-E329 PolarHBondContact O-N 2.89Å; F326-F414 HydrophobicContact CD2-CE1 4.31Å; F326-F418 HydrophobicContact CB-CE1 4.23Å; F326-F418 HydrophobicContact CB-CE2 4.46Å; F326-F418 HydrophobicContact CB-CZ 3.73Å; F326-V434 HydrophobicContact CB-CG2 3.8Å; F326-V434 HydrophobicContact CD1-CG2 3.75Å; F326-V434 HydrophobicContact CD2-CG1 4.37Å; F326-V434 HydrophobicContact CD2-CG2 4.4Å; F326-V434 HydrophobicContact CE1-CG2 4.45Å; F326-V434 HydrophobicContact CG-CG1 4.44Å; F326-V434 HydrophobicContact CG-CG2 3.72Å
327	F	97.8	Very high	97	Very high	2 Å²	2	57 Å²	57	1%	0.009	27%	0.272	C	S	.	.	H	α-helix	trans	-71.8	-34	-179.7	-165.2	-101.4	0	0	0	111.7	A321 R322 V325 E329 L330 Q335 L338 L339 L417 F418	A321-F327 HydrophobicContact CB-CD1 4.11Å; A321-F327 HydrophobicContact CB-CD2 4.45Å; A321-F327 HydrophobicContact CB-CE1 4.02Å; A321-F327 HydrophobicContact CB-CE2 4.37Å; A321-F327 HydrophobicContact CB-CG 4.32Å; A321-F327 HydrophobicContact CB-CZ 4.15Å; A321-F327 WeakPolarHBondContact O-CB 3.3Å; A321-F327 WeakPolarHBondContact O-CD1 3.31Å; A321-F327 WeakPolarHBondContact O-CG 3.43Å; R322-F327 HydrophobicContact CG-CD1 4.44Å; R322-F327 HydrophobicContact CG-CE1 4.29Å; V325-F327 VanDerWaalsContact C-N 3.31Å; V325-F327 PolarHBondContact O-N 3.26Å; F327-E329 VanDerWaalsContact C-N 3.27Å; F327-E329 PolarHBondContact O-N 3.34Å; F327-L330 HydrophobicContact CD2-CD1 4.35Å; F327-L330 WeakPolarHBondContact O-CB 3.32Å; F327-L330 PolarHBondContact O-N 2.9Å; F327-Q335 HydrophobicContact CD1-CG 3.92Å; F327-Q335 HydrophobicContact CD2-CG 4.46Å; F327-Q335 HydrophobicContact CE1-CB 3.69Å; F327-Q335 HydrophobicContact CE1-CG 3.51Å; F327-Q335 HydrophobicContact CE2-CB 4.1Å; F327-Q335 HydrophobicContact CE2-CG 4.09Å; F327-Q335 HydrophobicContact CG-CG 4.39Å; F327-Q335 HydrophobicContact CZ-CB 3.41Å; F327-Q335 VanDerWaalsContact CZ-CB 3.41Å; F327-Q335 HydrophobicContact CZ-CG 3.6Å; F327-Q335 PolarHBondContact O-NE2 3.49Å; F327-L338 HydrophobicContact CE2-CB 4.43Å; F327-L338 HydrophobicContact CE2-CD1 4.35Å; F327-L339 HydrophobicContact CE1-CD1 4.23Å; F327-L339 HydrophobicContact CE2-CG 4.31Å; F327-L339 HydrophobicContact CZ-CD1 3.63Å; F327-L339 HydrophobicContact CZ-CD2 4.43Å; F327-L339 HydrophobicContact CZ-CG 3.78Å; F327-L417 HydrophobicContact CD2-CD1 4.33Å; F327-L417 HydrophobicContact CD2-CD2 4.01Å; F327-L417 HydrophobicContact CD2-CG 4.4Å; F327-L417 HydrophobicContact CE2-CD1 3.96Å; F327-L417 HydrophobicContact CE2-CD2 4.44Å; F327-F418 HydrophobicContact CB-CZ 4.21Å; F327-F418 HydrophobicContact CD2-CZ 4.29Å
328	R	96.8	Very high	97	Very high	163 Å²	163	56.9 Å²	56.9	62%	0.615	27%	0.272	S	S	*	.	H	α-helix	trans	-67.8	-23.5	176.2	-67.1	172.5	-160	-168.1	14.1	113.6	R322 S323 S324 V325 L330	R322-R328 PolarHBondContact O-NE 2.91Å; S323-R328 PolarHBondContact O-NH2 2.99Å; S324-R328 VanDerWaalsContact O-CG 3.29Å; S324-R328 WeakPolarHBondContact O-CG 3.28Å; S324-R328 PolarHBondContact O-N 3.45Å; V325-R328 PolarHBondContact O-N 3.39Å; R328-L330 VanDerWaalsContact C-N 3.32Å
329	E	96.8	Very high	97	Very high	124 Å²	124	55.9 Å²	55.9	58%	0.579	27%	0.265	S	S	*	.	H	α-helix	trans	-75.1	-21.2	175.7	-70	174.3	-131.8	0	0	112.9	V325 F326 F327 L430	V325-E329 PolarHBondContact O-N 2.97Å; F326-E329 PolarHBondContact O-N 2.89Å; F327-E329 VanDerWaalsContact C-N 3.27Å; F327-E329 PolarHBondContact O-N 3.34Å; E329-L430 HydrophobicContact CB-CD2 3.69Å
330	L	97.2	Very high	96.9	Very high	8 Å²	8	53.3 Å²	53.3	4%	0.042	25%	0.253	C	S	.	.	S	Bend	trans	-75.7	149.5	174.9	-66.6	171.4	0	0	0	111.7	F327 R328 D334 Q335 L338 F418 N427 L430 V431	F327-L330 HydrophobicContact CD2-CD1 4.35Å; F327-L330 WeakPolarHBondContact O-CB 3.32Å; F327-L330 PolarHBondContact O-N 2.9Å; R328-L330 VanDerWaalsContact C-N 3.32Å; L330-D334 HydrophobicContact CB-CB 4.22Å; L330-D334 HydrophobicContact CD2-CB 4.21Å; L330-Q335 HydrophobicContact CB-CG 3.89Å; L330-Q335 PolarHBondContact O-NE2 2.91Å; L330-L338 HydrophobicContact CD1-CD1 3.4Å; L330-F418 HydrophobicContact CD1-CE1 3.98Å; L330-N427 HydrophobicContact CD2-CB 4.03Å; L330-L430 HydrophobicContact CD2-CB 4.49Å; L330-L430 HydrophobicContact CD2-CD2 3.83Å; L330-L430 HydrophobicContact CD2-CG 4.44Å; L330-L430 HydrophobicContact CG-CD2 4.05Å; L330-V431 HydrophobicContact CD2-CG2 4.34Å
331	K	97.2	Very high	96.8	Very high	120 Å²	120	54.4 Å²	54.4	52%	0.522	26%	0.259	S	S	.	.			trans	-66.6	154.6	168.2	-69.6	179.3	176.5	-179.3	0	110.5	D333 D334 Q335 E426	K331-D333 PolarHBondContact O-N 3.01Å; K331-D334 PolarHBondContact O-N 3.26Å; K331-D334 VanDerWaalsContact O-N 3.13Å; K331-Q335 WeakPolarHBondContact O-CG 3.43Å; K331-Q335 PolarHBondContact O-N 3.11Å; K331-E426 WeakPolarHBondContact CD-OE1 3.36Å; K331-E426 IonicContact NZ-OE1 3.58Å; K331-E426 PolarHBondContact NZ-OE1 3.05Å; K331-E426 IonicContact NZ-OE2 3.47Å; K331-E426 PolarHBondContact NZ-OE2 3.45Å
332	V	97.1	Very high	96.7	Very high	96 Å²	96	54.4 Å²	54.4	58%	0.582	26%	0.259	S	S	*	.	H	α-helix	trans	-55.5	-36	179.8	-180	0	0	0	0	112.3	Q335 M336	V332-Q335 WeakPolarHBondContact O-CB 3.42Å; V332-Q335 PolarHBondContact O-N 3.33Å; V332-M336 HydrophobicContact CG1-CG 4.4Å; V332-M336 HydrophobicContact CG1-SD 4.16Å; V332-M336 WeakPolarHBondContact O-CB 3.41Å; V332-M336 VanDerWaalsContact O-CG 3.29Å; V332-M336 WeakPolarHBondContact O-CG 3.3Å; V332-M336 PolarHBondContact O-N 3.34Å
333	D	96.5	Very high	96.7	Very high	76 Å²	76	47.9 Å²	47.9	41%	0.406	24%	0.235	S	C	.	.	H	α-helix	trans	-64.6	-48.1	177.2	-175.1	58.2	0	0	0	112.5	K331 Q335 M336 K337	K331-D333 PolarHBondContact O-N 3.01Å; D333-Q335 PolarHBondContact O-N 3.04Å; D333-M336 PolarHBondContact O-N 3.37Å; D333-K337 WeakPolarHBondContact O-CG 3.48Å; D333-K337 PolarHBondContact O-N 3.38Å; D333-K337 IonicContact OD1-NZ 2.9Å; D333-K337 WeakPolarHBondContact OD2-CE 3.41Å; D333-K337 IonicContact OD2-NZ 2.97Å; D333-K337 PolarHBondContact OD2-NZ 2.88Å
334	D	97.5	Very high	96.8	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-41.3	172.4	-78.8	-5.3	0	0	0	111.9	L330 K331 M336 K337 L338 L425 E426 N427	L330-D334 HydrophobicContact CB-CB 4.22Å; L330-D334 HydrophobicContact CD2-CB 4.21Å; K331-D334 PolarHBondContact O-N 3.26Å; K331-D334 VanDerWaalsContact O-N 3.13Å; D334-M336 VanDerWaalsContact C-N 3.32Å; D334-M336 PolarHBondContact O-N 3.33Å; D334-K337 PolarHBondContact O-N 2.95Å; D334-L338 WeakPolarHBondContact O-CG 3.46Å; D334-L338 PolarHBondContact O-N 3Å; D334-L425 HydrophobicContact CB-CD2 3.96Å; D334-L425 VanDerWaalsContact OD1-CA 3.31Å; D334-L425 WeakPolarHBondContact OD1-CA 3.45Å; D334-E426 PolarHBondContact OD1-N 3.27Å; D334-E426 PolarHBondContact OD2-N 2.83Å; D334-E426 VanDerWaalsContact OD2-N 3.17Å; D334-N427 PolarHBondContact OD2-N 2.92Å
335	Q	97.8	Very high	96.9	Very high	20 Å²	20	47 Å²	47	9%	0.093	23%	0.227	C	C	.	.	H	α-helix	trans	-57.5	-44.7	174.6	-72	177.5	7.1	0	0	111.5	F327 L330 K331 V332 D333 L339	F327-Q335 HydrophobicContact CD1-CG 3.92Å; F327-Q335 HydrophobicContact CD2-CG 4.46Å; F327-Q335 HydrophobicContact CE1-CB 3.69Å; F327-Q335 HydrophobicContact CE1-CG 3.51Å; F327-Q335 HydrophobicContact CE2-CB 4.1Å; F327-Q335 HydrophobicContact CE2-CG 4.09Å; F327-Q335 HydrophobicContact CG-CG 4.39Å; F327-Q335 HydrophobicContact CZ-CB 3.41Å; F327-Q335 VanDerWaalsContact CZ-CB 3.41Å; F327-Q335 HydrophobicContact CZ-CG 3.6Å; F327-Q335 PolarHBondContact O-NE2 3.49Å; L330-Q335 HydrophobicContact CB-CG 3.89Å; L330-Q335 PolarHBondContact O-NE2 2.91Å; K331-Q335 WeakPolarHBondContact O-CG 3.43Å; K331-Q335 PolarHBondContact O-N 3.11Å; V332-Q335 WeakPolarHBondContact O-CB 3.42Å; V332-Q335 PolarHBondContact O-N 3.33Å; D333-Q335 PolarHBondContact O-N 3.04Å; Q335-L339 WeakPolarHBondContact O-CG 3.25Å; Q335-L339 PolarHBondContact O-N 3.15Å; Q335-L339 VanDerWaalsContact O-N 3.14Å
336	M	95.8	Very high	97.1	Very high	96 Å²	96	43 Å²	43	47%	0.473	20%	0.203	S	C	.	.	H	α-helix	trans	-65.1	-47.7	177.2	-74.7	179.2	68.7	0	0	111.3	V332 D333 D334 L338 L339 Q340	V332-M336 HydrophobicContact CG1-CG 4.4Å; V332-M336 HydrophobicContact CG1-SD 4.16Å; V332-M336 WeakPolarHBondContact O-CB 3.41Å; V332-M336 VanDerWaalsContact O-CG 3.29Å; V332-M336 WeakPolarHBondContact O-CG 3.3Å; V332-M336 PolarHBondContact O-N 3.34Å; D333-M336 PolarHBondContact O-N 3.37Å; D334-M336 VanDerWaalsContact C-N 3.32Å; D334-M336 PolarHBondContact O-N 3.33Å; M336-L338 PolarHBondContact O-N 3.08Å; M336-L339 PolarHBondContact O-N 3.23Å; M336-Q340 VanDerWaalsContact O-CB 3.25Å; M336-Q340 WeakPolarHBondContact O-CB 3.43Å; M336-Q340 WeakPolarHBondContact O-CG 3.44Å; M336-Q340 PolarHBondContact O-N 3.16Å
337	K	96.6	Very high	97.1	Very high	48 Å²	48	43 Å²	43	21%	0.209	20%	0.204	C	C	.	.	H	α-helix	trans	-56.9	-45.1	177.7	-72.2	164.6	178.4	165.7	0	112.7	D333 D334 N341 V422 N424 L425	D333-K337 WeakPolarHBondContact O-CG 3.48Å; D333-K337 PolarHBondContact O-N 3.38Å; D333-K337 IonicContact OD1-NZ 2.9Å; D333-K337 WeakPolarHBondContact OD2-CE 3.41Å; D333-K337 IonicContact OD2-NZ 2.97Å; D333-K337 PolarHBondContact OD2-NZ 2.88Å; D334-K337 PolarHBondContact O-N 2.95Å; K337-N341 WeakPolarHBondContact O-CB 3.31Å; K337-N341 PolarHBondContact O-N 3.35Å; K337-V422 HydrophobicContact CB-CG1 3.88Å; K337-N424 PolarHBondContact NZ-O 3.34Å; K337-L425 HydrophobicContact CB-CD2 4.18Å; K337-L425 HydrophobicContact CD-CD2 4.33Å
338	L	97.4	Very high	97.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.7	-49.4	177.4	-69.9	-177.9	0	0	0	111.7	F327 L330 D334 M336 N341 C342 L417 F418 V422 L425 V431	F327-L338 HydrophobicContact CE2-CB 4.43Å; F327-L338 HydrophobicContact CE2-CD1 4.35Å; L330-L338 HydrophobicContact CD1-CD1 3.4Å; D334-L338 WeakPolarHBondContact O-CG 3.46Å; D334-L338 PolarHBondContact O-N 3Å; M336-L338 PolarHBondContact O-N 3.08Å; L338-N341 PolarHBondContact O-N 3.3Å; L338-C342 PolarHBondContact O-N 3.36Å; L338-C342 VanDerWaalsContact O-N 3.11Å; L338-C342 PolarHBondContact O-SG 3.42Å; L338-L417 HydrophobicContact CB-CD1 4.45Å; L338-F418 HydrophobicContact CD1-CD1 4.22Å; L338-F418 HydrophobicContact CD1-CE1 4.35Å; L338-V422 HydrophobicContact CD2-CB 4.15Å; L338-V422 HydrophobicContact CD2-CG1 4.34Å; L338-V422 HydrophobicContact CD2-CG2 3.94Å; L338-L425 HydrophobicContact CD2-CD1 4.11Å; L338-L425 HydrophobicContact CD2-CD2 4.15Å; L338-L425 HydrophobicContact CG-CD2 4.25Å; L338-V431 HydrophobicContact CD1-CG2 4.26Å; L338-V431 HydrophobicContact CD2-CG1 4.43Å
339	L	97.7	Very high	97.2	Very high	17 Å²	17	36.6 Å²	36.6	9%	0.089	18%	0.182	C	C	.	.	H	α-helix	trans	-64.1	-43.3	179.3	-73.4	169.4	0	0	0	112.1	V318 A321 F327 Q335 M336 N341 C342 W343 L417 M496	V318-L339 HydrophobicContact CG2-CD1 4.28Å; A321-L339 HydrophobicContact CB-CD2 3.97Å; F327-L339 HydrophobicContact CE1-CD1 4.23Å; F327-L339 HydrophobicContact CE2-CG 4.31Å; F327-L339 HydrophobicContact CZ-CD1 3.63Å; F327-L339 HydrophobicContact CZ-CD2 4.43Å; F327-L339 HydrophobicContact CZ-CG 3.78Å; Q335-L339 WeakPolarHBondContact O-CG 3.25Å; Q335-L339 PolarHBondContact O-N 3.15Å; Q335-L339 VanDerWaalsContact O-N 3.14Å; M336-L339 PolarHBondContact O-N 3.23Å; L339-N341 PolarHBondContact O-N 3.2Å; L339-C342 PolarHBondContact O-N 3.19Å; L339-W343 WeakPolarHBondContact O-CB 3.39Å; L339-W343 PolarHBondContact O-N 3.44Å; L339-L417 HydrophobicContact CD2-CD1 4Å; L339-M496 VanDerWaalsContact C-CE 3.49Å; L339-M496 HydrophobicContact CB-CE 3.98Å; L339-M496 WeakPolarHBondContact O-CE 3.34Å
340	Q	95.7	Very high	97.3	Very high	48 Å²	48	32 Å²	32	22%	0.224	16%	0.161	C	C	.	.	H	α-helix	trans	-61.4	-33.4	176.6	-73.6	167.8	-8.3	0	0	111.9	M336 W343 M496 A499 K500	M336-Q340 VanDerWaalsContact O-CB 3.25Å; M336-Q340 WeakPolarHBondContact O-CB 3.43Å; M336-Q340 WeakPolarHBondContact O-CG 3.44Å; M336-Q340 PolarHBondContact O-N 3.16Å; Q340-W343 VanDerWaalsContact O-CD1 3.27Å; Q340-M496 HydrophobicContact CG-CE 4.2Å; Q340-M496 HydrophobicContact CG-SD 3.87Å; Q340-A499 HydrophobicContact CG-CB 3.83Å; Q340-K500 WeakPolarHBondContact O-CD 3.36Å; Q340-K500 WeakPolarHBondContact O-CG 3.49Å
341	N	95.1	Very high	97.3	Very high	30 Å²	30	34 Å²	34	16%	0.16	17%	0.17	C	C	.	.	H	α-helix	trans	-69.7	-46.8	173.2	178.6	82.6	0	0	0	112.4	K337 L338 L339 V422 K500	K337-N341 WeakPolarHBondContact O-CB 3.31Å; K337-N341 PolarHBondContact O-N 3.35Å; L338-N341 PolarHBondContact O-N 3.3Å; L339-N341 PolarHBondContact O-N 3.2Å; N341-V422 HydrophobicContact CB-CG2 3.64Å; N341-K500 VanDerWaalsContact O-CE 3.23Å; N341-K500 WeakPolarHBondContact O-CE 3.43Å; N341-K500 PolarHBondContact O-NZ 2.95Å
342	C	96.9	Very high	97.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-105.4	-4.7	-163	72.4	0	0	0	0	117.1	L338 L339 S344 E345 L346 V416	L338-C342 PolarHBondContact O-N 3.36Å; L338-C342 VanDerWaalsContact O-N 3.11Å; L338-C342 PolarHBondContact O-SG 3.42Å; L339-C342 PolarHBondContact O-N 3.19Å; C342-S344 VanDerWaalsContact C-N 3.3Å; C342-S344 PolarHBondContact O-N 3.09Å; C342-S344 VanDerWaalsContact O-N 3.16Å; C342-E345 WeakPolarHBondContact O-CB 3.33Å; C342-E345 PolarHBondContact O-N 3.11Å; C342-E345 VanDerWaalsContact O-N 3.09Å; C342-L346 PolarHBondContact O-N 2.91Å; C342-V416 HydrophobicContact CB-CG1 3.79Å; C342-V416 WeakPolarHBondContact CB-O 3.48Å
343	W	97.4	Very high	97.4	Very high	7 Å²	7	25 Å²	25	3%	0.027	12%	0.123	C	C	.	.	H	α-helix	trans	-52.7	-42.3	-171	66.7	-91.4	0	0	0	114.7	L314 L339 Q340 L346 L347 E475 L478 L493 M496 L497	L314-W343 HydrophobicContact CD1-CB 3.7Å; L314-W343 HydrophobicContact CD2-CE3 4.3Å; L339-W343 WeakPolarHBondContact O-CB 3.39Å; L339-W343 PolarHBondContact O-N 3.44Å; Q340-W343 VanDerWaalsContact O-CD1 3.27Å; W343-L346 PolarHBondContact O-N 3.43Å; W343-L347 HydrophobicContact CE3-CD1 3.69Å; W343-L347 HydrophobicContact CZ3-CD1 3.8Å; W343-L347 WeakPolarHBondContact O-CG 3.43Å; W343-L347 PolarHBondContact O-N 3.21Å; W343-E475 HydrophobicContact CH2-CG 4.22Å; W343-E475 HydrophobicContact CZ2-CG 4.01Å; W343-L478 HydrophobicContact CH2-CD2 4.07Å; W343-L493 HydrophobicContact CE3-CD1 4.2Å; W343-L493 HydrophobicContact CH2-CD1 3.92Å; W343-L493 HydrophobicContact CZ3-CD1 3.43Å; W343-L493 VanDerWaalsContact CZ3-CD1 3.43Å; W343-M496 HydrophobicContact CB-CE 3.79Å; W343-M496 HydrophobicContact CD2-CB 4.17Å; W343-M496 HydrophobicContact CG-CB 4.12Å; W343-M496 HydrophobicContact CG-CE 3.98Å; W343-M496 PolarHBondContact NE1-O 3.12Å; W343-L497 HydrophobicContact CH2-CD1 4.42Å; W343-L497 HydrophobicContact CZ2-CB 4.24Å; W343-L497 HydrophobicContact CZ2-CD1 4.12Å
344	S	97.6	Very high	97.4	Very high	5 Å²	5	22.9 Å²	22.9	4%	0.035	11%	0.11	C	C	.	.	H	α-helix	trans	-72.5	-39.9	-179.7	54.8	0	0	0	0	112	C342 L346 L347 I348 E475 K500	C342-S344 VanDerWaalsContact C-N 3.3Å; C342-S344 PolarHBondContact O-N 3.09Å; C342-S344 VanDerWaalsContact O-N 3.16Å; S344-L346 VanDerWaalsContact C-N 3.3Å; S344-L346 PolarHBondContact O-N 3.22Å; S344-L347 PolarHBondContact O-N 3.29Å; S344-I348 WeakPolarHBondContact O-CG1 3.49Å; S344-I348 PolarHBondContact O-N 3.21Å; S344-E475 VanDerWaalsContact CB-OE1 3.3Å; S344-E475 WeakPolarHBondContact CB-OE1 3.15Å; S344-E475 PolarHBondContact OG-OE1 3.32Å; S344-K500 PolarHBondContact OG-NZ 2.86Å
345	E	98.1	Very high	97.4	Very high	12 Å²	12	22.8 Å²	22.8	6%	0.056	11%	0.109	C	C	.	.	H	α-helix	trans	-60.6	-40.6	173.6	-67.2	-179.9	-127	0	0	110.6	C342 L349 V416 I467 R468 S471	C342-E345 WeakPolarHBondContact O-CB 3.33Å; C342-E345 PolarHBondContact O-N 3.11Å; C342-E345 VanDerWaalsContact O-N 3.09Å; E345-L349 WeakPolarHBondContact O-CB 3.46Å; E345-L349 PolarHBondContact O-N 3.02Å; E345-V416 HydrophobicContact CB-CG1 3.65Å; E345-I467 HydrophobicContact CB-CG2 4.24Å; E345-R468 HydrophobicContact CG-CB 4.29Å; E345-R468 HydrophobicContact CG-CG 4.42Å; E345-R468 IonicContact OE1-NE 2.68Å; E345-S471 VanDerWaalsContact CG-OG 3.25Å; E345-S471 WeakPolarHBondContact CG-OG 3.42Å
346	L	98.5	Very high	97.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-68.4	-43	175.3	-68.4	176.2	0	0	0	112.9	I317 W320 C342 W343 S344 I348 L349 D350 K413 V416	I317-L346 HydrophobicContact CD1-CB 3.98Å; I317-L346 HydrophobicContact CG2-CB 4.32Å; I317-L346 HydrophobicContact CG2-CD1 3.64Å; W320-L346 HydrophobicContact CH2-CD2 4.49Å; W320-L346 HydrophobicContact CZ3-CD1 3.88Å; W320-L346 HydrophobicContact CZ3-CD2 4.41Å; C342-L346 PolarHBondContact O-N 2.91Å; W343-L346 PolarHBondContact O-N 3.43Å; S344-L346 VanDerWaalsContact C-N 3.3Å; S344-L346 PolarHBondContact O-N 3.22Å; L346-I348 VanDerWaalsContact C-N 3.34Å; L346-I348 PolarHBondContact O-N 3.36Å; L346-L349 PolarHBondContact O-N 3.25Å; L346-D350 WeakPolarHBondContact O-CB 3.5Å; L346-D350 PolarHBondContact O-N 3.3Å; L346-K413 HydrophobicContact CD2-CB 4.23Å; L346-K413 HydrophobicContact CD2-CG 4.36Å; L346-V416 HydrophobicContact CD2-CB 4.01Å; L346-V416 HydrophobicContact CD2-CG1 3.64Å; L346-V416 HydrophobicContact CG-CG1 3.81Å
347	L	98.1	Very high	97.3	Very high	29 Å²	29	21.8 Å²	21.8	15%	0.152	11%	0.109	C	C	.	.	H	α-helix	trans	-59.5	-43.4	174.5	-75.8	174	0	0	0	112.2	A310 T313 I317 W343 S344 H351	A310-L347 HydrophobicContact CB-CD1 4.42Å; T313-L347 HydrophobicContact CG2-CD2 3.61Å; I317-L347 HydrophobicContact CD1-CD2 3.64Å; I317-L347 HydrophobicContact CD1-CG 3.88Å; W343-L347 HydrophobicContact CE3-CD1 3.69Å; W343-L347 HydrophobicContact CZ3-CD1 3.8Å; W343-L347 WeakPolarHBondContact O-CG 3.43Å; W343-L347 PolarHBondContact O-N 3.21Å; S344-L347 PolarHBondContact O-N 3.29Å; L347-H351 WeakPolarHBondContact O-CB 3.43Å; L347-H351 PolarHBondContact O-N 3.21Å; L347-H351 VanDerWaalsContact O-N 3.08Å
348	I	98.3	Very high	97.1	Very high	32 Å²	32	23.8 Å²	23.8	16%	0.164	12%	0.12	C	C	.	.	H	α-helix	trans	-67.8	-43.8	176.8	-65.6	-60.8	0	0	0	110.7	S344 L346 H351 V352 I467 I470 A474	S344-I348 WeakPolarHBondContact O-CG1 3.49Å; S344-I348 PolarHBondContact O-N 3.21Å; L346-I348 VanDerWaalsContact C-N 3.34Å; L346-I348 PolarHBondContact O-N 3.36Å; I348-H351 PolarHBondContact O-N 2.99Å; I348-V352 HydrophobicContact CG2-CG2 4.13Å; I348-V352 VanDerWaalsContact O-CB 3.28Å; I348-V352 WeakPolarHBondContact O-CB 3.49Å; I348-V352 VanDerWaalsContact O-CG2 3.23Å; I348-V352 WeakPolarHBondContact O-CG2 3.38Å; I348-V352 PolarHBondContact O-N 3.12Å; I348-I467 HydrophobicContact CB-CG2 4.47Å; I348-I467 HydrophobicContact CG2-CG2 4.23Å; I348-I470 HydrophobicContact CD1-CG2 4.11Å; I348-I470 HydrophobicContact CG1-CG2 4.36Å; I348-I470 HydrophobicContact CG2-CB 4.31Å; I348-I470 HydrophobicContact CG2-CG2 3.92Å; I348-A474 HydrophobicContact CD1-CB 4.43Å
349	L	98.6	Very high	96.5	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.7	-47.6	178.8	175.4	53	0	0	0	112.3	E345 L346 H351 V352 F353 F409 L412 K413 V416 I467	E345-L349 WeakPolarHBondContact O-CB 3.46Å; E345-L349 PolarHBondContact O-N 3.02Å; L346-L349 PolarHBondContact O-N 3.25Å; L349-H351 VanDerWaalsContact C-N 3.33Å; L349-H351 PolarHBondContact O-N 2.99Å; L349-V352 PolarHBondContact O-N 3.11Å; L349-F353 WeakPolarHBondContact O-CB 3.46Å; L349-F353 PolarHBondContact O-N 2.74Å; L349-F409 HydrophobicContact CD1-CD2 3.97Å; L349-F409 HydrophobicContact CD1-CE2 3.96Å; L349-F409 HydrophobicContact CG-CD2 4.28Å; L349-F409 HydrophobicContact CG-CE2 3.88Å; L349-L412 HydrophobicContact CD2-CB 4.25Å; L349-K413 HydrophobicContact CD2-CB 4.44Å; L349-K413 HydrophobicContact CD2-CG 3.76Å; L349-K413 HydrophobicContact CG-CG 4.27Å; L349-V416 HydrophobicContact CD2-CG2 4.16Å; L349-I467 HydrophobicContact CB-CG2 4.4Å; L349-I467 HydrophobicContact CD1-CD1 3.9Å
350	D	97.8	Very high	96.2	Very high	26 Å²	26	30.5 Å²	30.5	14%	0.139	15%	0.151	C	C	.	.	H	α-helix	trans	-61.9	-39.8	175.6	-81.6	-7.1	0	0	0	111.3	L346 R354 F409 K413	L346-D350 WeakPolarHBondContact O-CB 3.5Å; L346-D350 PolarHBondContact O-N 3.3Å; D350-R354 VanDerWaalsContact O-CB 3.3Å; D350-R354 WeakPolarHBondContact O-CB 3.48Å; D350-R354 PolarHBondContact O-N 2.93Å; D350-R354 VanDerWaalsContact O-N 3.13Å; D350-F409 VanDerWaalsContact OD1-CZ 3.26Å; D350-F409 WeakPolarHBondContact OD1-CZ 3.3Å; D350-K413 WeakPolarHBondContact OD1-CD 3.41Å; D350-K413 VanDerWaalsContact OD1-CE 3.3Å; D350-K413 WeakPolarHBondContact OD1-CE 3.34Å; D350-K413 IonicContact OD1-NZ 3.15Å; D350-K413 PolarHBondContact OD1-NZ 2.86Å; D350-K413 IonicContact OD2-NZ 2.71Å
351	H	97.1	Very high	95.8	Very high	50 Å²	50	37.8 Å²	37.8	23%	0.231	19%	0.185	C	C	.	.	H	α-helix	trans	-65.9	-46.8	175.4	177.5	72.7	0	0	0	112.3	L347 I348 L349 R354 Q355	L347-H351 WeakPolarHBondContact O-CB 3.43Å; L347-H351 PolarHBondContact O-N 3.21Å; L347-H351 VanDerWaalsContact O-N 3.08Å; I348-H351 PolarHBondContact O-N 2.99Å; L349-H351 VanDerWaalsContact C-N 3.33Å; L349-H351 PolarHBondContact O-N 2.99Å; H351-R354 WeakPolarHBondContact O-CB 3.43Å; H351-R354 PolarHBondContact O-N 3.01Å; H351-Q355 PolarHBondContact CE1-NE2 2.83Å; H351-Q355 PolarHBondContact ND1-NE2 2.68Å; H351-Q355 VanDerWaalsContact O-CG 3.3Å; H351-Q355 WeakPolarHBondContact O-CG 3.39Å; H351-Q355 PolarHBondContact O-N 2.87Å; H351-Q355 VanDerWaalsContact O-N 3.08Å; H351-Q355 PolarHBondContact O-NE2 2.68Å
352	V	98.1	Very high	95.6	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-62.7	-46.1	179.9	162.6	0	0	0	0	110.8	I348 L349 R354 Q355 V356 L395 V396 L399	I348-V352 HydrophobicContact CG2-CG2 4.13Å; I348-V352 VanDerWaalsContact O-CB 3.28Å; I348-V352 WeakPolarHBondContact O-CB 3.49Å; I348-V352 VanDerWaalsContact O-CG2 3.23Å; I348-V352 WeakPolarHBondContact O-CG2 3.38Å; I348-V352 PolarHBondContact O-N 3.12Å; L349-V352 PolarHBondContact O-N 3.11Å; V352-R354 PolarHBondContact O-N 2.81Å; V352-Q355 WeakPolarHBondContact O-CB 3.05Å; V352-Q355 PolarHBondContact O-N 3.32Å; V352-Q355 VanDerWaalsContact O-N 3.07Å; V352-V356 WeakPolarHBondContact O-CG2 3.49Å; V352-V356 PolarHBondContact O-N 2.99Å; V352-L395 HydrophobicContact CG1-CD2 4.14Å; V352-L395 HydrophobicContact CG1-CG 4.09Å; V352-L395 HydrophobicContact CG2-CD2 4.12Å; V352-V396 HydrophobicContact CB-CG2 4.36Å; V352-V396 HydrophobicContact CG1-CG2 3.9Å; V352-V396 HydrophobicContact CG2-CG2 4.41Å; V352-L399 HydrophobicContact CG1-CD1 3.46Å; V352-L399 VanDerWaalsContact CG1-CD1 3.46Å
353	F	98.1	Very high	95.4	Very high	27 Å²	27	38.1 Å²	38.1	12%	0.118	20%	0.195	C	C	.	.	H	α-helix	trans	-63.4	-41.9	177.6	-178.4	-111.8	0	0	0	112.4	L349 Q355 V356 V357 L404 Q406 F409	L349-F353 WeakPolarHBondContact O-CB 3.46Å; L349-F353 PolarHBondContact O-N 2.74Å; F353-Q355 PolarHBondContact O-N 3.02Å; F353-V356 WeakPolarHBondContact O-CB 3.42Å; F353-V356 PolarHBondContact O-N 3.45Å; F353-V357 HydrophobicContact CD1-CG2 4.32Å; F353-V357 HydrophobicContact CD2-CG2 4.06Å; F353-V357 HydrophobicContact CE1-CG2 3.9Å; F353-V357 HydrophobicContact CE2-CG2 3.61Å; F353-V357 HydrophobicContact CG-CG2 4.4Å; F353-V357 HydrophobicContact CZ-CG2 3.53Å; F353-V357 WeakPolarHBondContact O-CG2 3.49Å; F353-V357 PolarHBondContact O-N 2.88Å; F353-L404 HydrophobicContact CD2-CD2 3.66Å; F353-L404 HydrophobicContact CD2-CG 4.24Å; F353-L404 HydrophobicContact CE2-CD2 4.21Å; F353-L404 HydrophobicContact CE2-CG 4.28Å; F353-Q406 HydrophobicContact CZ-CB 4.22Å; F353-F409 HydrophobicContact CB-CD2 3.43Å; F353-F409 VanDerWaalsContact CB-CD2 3.43Å; F353-F409 HydrophobicContact CB-CE2 3.17Å; F353-F409 HydrophobicContact CB-CG 4.19Å; F353-F409 HydrophobicContact CB-CZ 3.74Å; F353-F409 HydrophobicContact CD1-CB 4.44Å; F353-F409 AromaticContact CD1-CD1 3.5Å; F353-F409 HydrophobicContact CD1-CD1 3.5Å; F353-F409 AromaticContact CD1-CD2 3.75Å; F353-F409 HydrophobicContact CD1-CD2 3.75Å; F353-F409 AromaticContact CD1-CE1 3.4Å; F353-F409 HydrophobicContact CD1-CE1 3.4Å; F353-F409 AromaticContact CD1-CE2 3.66Å; F353-F409 HydrophobicContact CD1-CE2 3.66Å; F353-F409 AromaticContact CD1-CG 3.64Å; F353-F409 HydrophobicContact CD1-CG 3.64Å; F353-F409 AromaticContact CD1-CZ 3.43Å; F353-F409 HydrophobicContact CD1-CZ 3.43Å; F353-F409 VanDerWaalsContact CD1-CZ 3.43Å; F353-F409 HydrophobicContact CD2-CB 3.8Å; F353-F409 HydrophobicContact CD2-CD1 4.37Å; F353-F409 AromaticContact CD2-CD2 3.68Å; F353-F409 HydrophobicContact CD2-CD2 3.68Å; F353-F409 HydrophobicContact CD2-CE2 4.26Å; F353-F409 AromaticContact CD2-CG 3.7Å; F353-F409 HydrophobicContact CD2-CG 3.7Å; F353-F409 HydrophobicContact CE1-CB 4.31Å; F353-F409 AromaticContact CE1-CD1 3.51Å; F353-F409 HydrophobicContact CE1-CD1 3.51Å; F353-F409 HydrophobicContact CE1-CD2 4.41Å; F353-F409 AromaticContact CE1-CE1 3.73Å; F353-F409 HydrophobicContact CE1-CE1 3.73Å; F353-F409 AromaticContact CE1-CG 3.84Å; F353-F409 HydrophobicContact CE1-CG 3.84Å; F353-F409 HydrophobicContact CE1-CZ 4.24Å; F353-F409 HydrophobicContact CE2-CB 3.65Å; F353-F409 HydrophobicContact CE2-CD1 4.37Å; F353-F409 HydrophobicContact CE2-CD2 4.35Å; F353-F409 AromaticContact CE2-CG 3.9Å; F353-F409 HydrophobicContact CE2-CG 3.9Å; F353-F409 HydrophobicContact CG-CB 4.19Å; F353-F409 AromaticContact CG-CD1 3.95Å; F353-F409 HydrophobicContact CG-CD1 3.95Å; F353-F409 AromaticContact CG-CD2 3.32Å; F353-F409 HydrophobicContact CG-CD2 3.32Å; F353-F409 HydrophobicContact CG-CE1 4.05Å; F353-F409 AromaticContact CG-CE2 3.44Å; F353-F409 HydrophobicContact CG-CE2 3.44Å; F353-F409 VanDerWaalsContact CG-CE2 3.44Å; F353-F409 AromaticContact CG-CG 3.56Å; F353-F409 HydrophobicContact CG-CG 3.56Å; F353-F409 AromaticContact CG-CZ 3.76Å; F353-F409 HydrophobicContact CG-CZ 3.76Å; F353-F409 HydrophobicContact CZ-CB 3.92Å; F353-F409 AromaticContact CZ-CD1 3.96Å; F353-F409 HydrophobicContact CZ-CD1 3.96Å; F353-F409 AromaticContact CZ-CG 3.96Å; F353-F409 HydrophobicContact CZ-CG 3.96Å
354	R	97.1	Very high	95.3	Very high	31 Å²	31	38.5 Å²	38.5	12%	0.117	20%	0.198	C	C	.	.	H	α-helix	trans	-54.3	-39.1	170.9	177.4	-175.4	-53.2	-63.4	-26	112.1	E276 D350 H351 V352 H358 L365	E276-R354 IonicContact OE1-CZ 2.74Å; E276-R354 IonicContact OE1-NH1 2.72Å; E276-R354 PolarHBondContact OE1-NH1 2.99Å; E276-R354 IonicContact OE1-NH2 2.67Å; E276-R354 PolarHBondContact OE1-NH2 3.43Å; D350-R354 VanDerWaalsContact O-CB 3.3Å; D350-R354 WeakPolarHBondContact O-CB 3.48Å; D350-R354 PolarHBondContact O-N 2.93Å; D350-R354 VanDerWaalsContact O-N 3.13Å; H351-R354 WeakPolarHBondContact O-CB 3.43Å; H351-R354 PolarHBondContact O-N 3.01Å; V352-R354 PolarHBondContact O-N 2.81Å; R354-H358 WeakPolarHBondContact O-CB 3.39Å; R354-H358 PolarHBondContact O-N 3.31Å; R354-L365 VanDerWaalsContact CD-O 3.22Å; R354-L365 WeakPolarHBondContact CD-O 3.13Å; R354-L365 HydrophobicContact CG-CB 4.44Å; R354-L365 HydrophobicContact CG-CD2 4.1Å; R354-L365 HydrophobicContact CG-CG 4.36Å
355	Q	97.3	Very high	95.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-70.4	-43.7	174.7	-53	-32.6	-73	0	0	111.7	H351 V352 F353 V357 A359 I364 L365 V396 R400	H351-Q355 PolarHBondContact CE1-NE2 2.83Å; H351-Q355 PolarHBondContact ND1-NE2 2.68Å; H351-Q355 VanDerWaalsContact O-CG 3.3Å; H351-Q355 WeakPolarHBondContact O-CG 3.39Å; H351-Q355 PolarHBondContact O-N 2.87Å; H351-Q355 VanDerWaalsContact O-N 3.08Å; H351-Q355 PolarHBondContact O-NE2 2.68Å; V352-Q355 WeakPolarHBondContact O-CB 3.05Å; V352-Q355 PolarHBondContact O-N 3.32Å; V352-Q355 VanDerWaalsContact O-N 3.07Å; F353-Q355 PolarHBondContact O-N 3.02Å; Q355-V357 VanDerWaalsContact C-N 3.29Å; Q355-V357 PolarHBondContact O-N 3.06Å; Q355-A359 HydrophobicContact CB-CB 3.91Å; Q355-A359 WeakPolarHBondContact O-CB 3.48Å; Q355-A359 PolarHBondContact O-N 2.68Å; Q355-A359 VanDerWaalsContact O-N 3.08Å; Q355-I364 VanDerWaalsContact OE1-CA 3.27Å; Q355-L365 PolarHBondContact NE2-O 3.33Å; Q355-V396 HydrophobicContact CB-CB 4.46Å; Q355-V396 HydrophobicContact CB-CG1 3.94Å; Q355-V396 HydrophobicContact CB-CG2 3.62Å; Q355-V396 HydrophobicContact CG-CG2 4.18Å; Q355-R400 PolarHBondContact O-NH2 3.46Å
356	V	97.1	Very high	94.9	Very high	19 Å²	19	40 Å²	40	12%	0.115	21%	0.205	C	C	.	.	H	α-helix	trans	-52.7	-47.4	177.5	169.7	0	0	0	0	111	V352 F353 V396 L399 R400	V352-V356 WeakPolarHBondContact O-CG2 3.49Å; V352-V356 PolarHBondContact O-N 2.99Å; F353-V356 WeakPolarHBondContact O-CB 3.42Å; F353-V356 PolarHBondContact O-N 3.45Å; V356-V396 HydrophobicContact CG2-CB 4.38Å; V356-V396 HydrophobicContact CG2-CG1 4.03Å; V356-V396 HydrophobicContact CG2-CG2 4.42Å; V356-L399 HydrophobicContact CG2-CB 3.61Å; V356-L399 HydrophobicContact CG2-CD1 4.3Å; V356-R400 HydrophobicContact CB-CG 4.34Å; V356-R400 HydrophobicContact CG1-CG 3.94Å; V356-R400 HydrophobicContact CG2-CG 4.38Å; V356-R400 PolarHBondContact O-NE 3.01Å
357	V	94.9	Very high	94.7	Very high	75 Å²	75	40.7 Å²	40.7	46%	0.455	21%	0.21	S	C	.	.	H	α-helix	trans	-83.6	-39.2	-174.9	-173	0	0	0	0	113.4	F353 Q355	F353-V357 HydrophobicContact CD1-CG2 4.32Å; F353-V357 HydrophobicContact CD2-CG2 4.06Å; F353-V357 HydrophobicContact CE1-CG2 3.9Å; F353-V357 HydrophobicContact CE2-CG2 3.61Å; F353-V357 HydrophobicContact CG-CG2 4.4Å; F353-V357 HydrophobicContact CZ-CG2 3.53Å; F353-V357 WeakPolarHBondContact O-CG2 3.49Å; F353-V357 PolarHBondContact O-N 2.88Å; Q355-V357 VanDerWaalsContact C-N 3.29Å; Q355-V357 PolarHBondContact O-N 3.06Å
358	H	92.9	Very high	94.5	Very high	91 Å²	91	39.5 Å²	39.5	42%	0.421	20%	0.203	S	C	.	.	H	α-helix	trans	-126.9	-10.5	-164.4	-56.5	-66.5	0	0	0	116.8	R354 L365	R354-H358 WeakPolarHBondContact O-CB 3.39Å; R354-H358 PolarHBondContact O-N 3.31Å; H358-L365 HydrophobicContact CB-CD2 3.44Å; H358-L365 VanDerWaalsContact CB-CD2 3.44Å
359	A	85.3	Confident	94.2	Very high	17 Å²	17	39.4 Å²	39.4	14%	0.14	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-72	141.3	-178.4	0	0	0	0	0	112.2	Q355 R400	Q355-A359 HydrophobicContact CB-CB 3.91Å; Q355-A359 WeakPolarHBondContact O-CB 3.48Å; Q355-A359 PolarHBondContact O-N 2.68Å; Q355-A359 VanDerWaalsContact O-N 3.08Å; A359-R400 PolarHBondContact O-NH2 3.48Å
360	K	89.5	Confident	93.8	Very high	141 Å²	141	44.4 Å²	44.4	61%	0.613	23%	0.233	S	C	*	.	P	Polyproline II helix	trans	-85.2	165.2	174.2	-64.1	178.6	179.1	-179	0	109.8	G362	K360-G362 PolarHBondContact O-N 3.34Å
361	E	87.8	Confident	93.6	Very high	200 Å²	200	46.4 Å²	46.4	94%	0.935	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	131.8	169.8	-169.6	168.2	-161.5	0	0	109.8
362	G	90.4	Very high	93.3	Very high	33 Å²	33	45.8 Å²	45.8	34%	0.34	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	-4.4	-179.8	0	0	0	0	0	117	K360 D373 Y374	K360-G362 PolarHBondContact O-N 3.34Å; G362-D373 WeakPolarHBondContact O-CA 3.34Å; G362-Y374 VanDerWaalsContact C-CE2 3.43Å; G362-Y374 VanDerWaalsContact O-CD2 3.23Å; G362-Y374 WeakPolarHBondContact O-CD2 3.17Å; G362-Y374 PolarHBondContact O-N 2.97Å
363	S	93.8	Very high	93	Very high	4 Å²	4	50.1 Å²	50.1	3%	0.028	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	158.8	-176	73.3	0	0	0	0	114.3	Q371 V372	S363-Q371 PolarHBondContact OG-OE1 3.47Å; S363-V372 CarbonylContact C-O 3.56Å; S363-V372 VanDerWaalsContact CA-O 3.31Å; S363-V372 WeakPolarHBondContact CA-O 3.3Å; S363-V372 WeakPolarHBondContact CB-O 3.42Å
364	I	94.1	Very high	92.7	Very high	16 Å²	16	52.3 Å²	52.3	8%	0.082	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	146.5	164.4	66.5	176.8	0	0	0	111.4	Q355 L366 Q371 V372 Y374 I377 L389	Q355-I364 VanDerWaalsContact OE1-CA 3.27Å; I364-L366 HydrophobicContact CD1-CD2 3.68Å; I364-L366 HydrophobicContact CG1-CD2 4.08Å; I364-Q371 CarbonylContact O-C 3.51Å; I364-Q371 VanDerWaalsContact O-CA 3.32Å; I364-Q371 WeakPolarHBondContact O-CA 3.39Å; I364-Q371 PolarHBondContact O-OE1 3.36Å; I364-V372 HydrophobicContact CG1-CB 4.06Å; I364-V372 PolarHBondContact N-O 3.42Å; I364-V372 PolarHBondContact O-N 3.08Å; I364-Y374 HydrophobicContact CG2-CD1 4.25Å; I364-Y374 HydrophobicContact CG2-CE1 3.59Å; I364-I377 HydrophobicContact CD1-CD1 3.49Å; I364-I377 VanDerWaalsContact CD1-CD1 3.49Å; I364-I377 HydrophobicContact CG1-CD1 3.85Å; I364-I377 HydrophobicContact CG2-CD1 4.49Å; I364-L389 HydrophobicContact CG2-CD1 3.83Å
365	L	94.8	Very high	92.3	Very high	22 Å²	22	54.4 Å²	54.4	12%	0.115	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	117.6	167.6	-175.2	67.8	0	0	0	109.9	R354 Q355 H358 G369 Q371	R354-L365 VanDerWaalsContact CD-O 3.22Å; R354-L365 WeakPolarHBondContact CD-O 3.13Å; R354-L365 HydrophobicContact CG-CB 4.44Å; R354-L365 HydrophobicContact CG-CD2 4.1Å; R354-L365 HydrophobicContact CG-CG 4.36Å; Q355-L365 PolarHBondContact NE2-O 3.33Å; H358-L365 HydrophobicContact CB-CD2 3.44Å; H358-L365 VanDerWaalsContact CB-CD2 3.44Å; L365-G369 WeakPolarHBondContact CD1-O 3.48Å; L365-Q371 HydrophobicContact CD1-CG 4.05Å
366	L	93.9	Very high	91.9	Very high	25 Å²	25	57 Å²	57	13%	0.131	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-75.6	161.9	172.9	-57.2	-172.6	0	0	0	111.3	M309 I364 T368 G369 Q370 V372	M309-L366 HydrophobicContact CE-CB 4.45Å; M309-L366 HydrophobicContact CE-CD1 4.25Å; M309-L366 HydrophobicContact CE-CD2 4.19Å; M309-L366 HydrophobicContact SD-CB 4.12Å; M309-L366 HydrophobicContact SD-CD1 4.31Å; I364-L366 HydrophobicContact CD1-CD2 3.68Å; I364-L366 HydrophobicContact CG1-CD2 4.08Å; L366-T368 WeakPolarHBondContact CB-OG1 3.31Å; L366-T368 PolarHBondContact O-N 3.46Å; L366-G369 WeakPolarHBondContact O-CA 3.47Å; L366-G369 PolarHBondContact O-N 3.13Å; L366-Q370 HydrophobicContact CD1-CB 4.38Å; L366-Q370 PolarHBondContact N-O 3.31Å; L366-V372 HydrophobicContact CD1-CG2 3.82Å; L366-V372 HydrophobicContact CG-CG2 4.03Å
367	V	94.3	Very high	91.3	Very high	16 Å²	16	57.2 Å²	57.2	10%	0.097	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-18.6	174.7	67.8	0	0	0	0	112.8	Q280 I283 M309 G369	Q280-V367 WeakPolarHBondContact CG-O 3.22Å; I283-V367 HydrophobicContact CD1-CG1 3.98Å; I283-V367 HydrophobicContact CD1-CG2 3.79Å; I283-V367 HydrophobicContact CG2-CG1 4.44Å; M309-V367 HydrophobicContact CG-CG1 3.4Å; M309-V367 VanDerWaalsContact CG-CG1 3.4Å; M309-V367 HydrophobicContact SD-CG1 3.69Å; V367-G369 PolarHBondContact O-N 2.87Å
368	T	93.6	Very high	90.9	Very high	4 Å²	4	56.5 Å²	56.5	3%	0.025	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-6.1	168.9	54.8	0	0	0	0	114	Q280 I283 L287 M309 L366 Q370	Q280-T368 WeakPolarHBondContact CG-O 3.33Å; Q280-T368 PolarHBondContact NE2-O 3.47Å; I283-T368 HydrophobicContact CG2-CG2 4.07Å; L287-T368 HydrophobicContact CD1-CG2 3.6Å; M309-T368 HydrophobicContact CG-CG2 4.47Å; M309-T368 HydrophobicContact SD-CG2 3.9Å; L366-T368 WeakPolarHBondContact CB-OG1 3.31Å; L366-T368 PolarHBondContact O-N 3.46Å; T368-Q370 PolarHBondContact O-N 2.93Å; T368-Q370 PolarHBondContact OG1-N 2.94Å; T368-Q370 PolarHBondContact OG1-OE1 3.21Å
369	G	91.6	Very high	90.5	Very high	29 Å²	29	56.6 Å²	56.6	30%	0.299	33%	0.326	S	S	.	.	S	Bend	trans	76.6	4.1	-171.6	0	0	0	0	0	114.5	L365 L366 V367	L365-G369 WeakPolarHBondContact CD1-O 3.48Å; L366-G369 WeakPolarHBondContact O-CA 3.47Å; L366-G369 PolarHBondContact O-N 3.13Å; V367-G369 PolarHBondContact O-N 2.87Å
370	Q	91.4	Very high	90.2	Very high	106 Å²	106	61.6 Å²	61.6	50%	0.495	35%	0.346	S	S	.	.			trans	-74.6	132.4	174.2	-68.5	172.9	-24.6	0	0	110.3	L366 T368	L366-Q370 HydrophobicContact CD1-CB 4.38Å; L366-Q370 PolarHBondContact N-O 3.31Å; T368-Q370 PolarHBondContact O-N 2.93Å; T368-Q370 PolarHBondContact OG1-N 2.94Å; T368-Q370 PolarHBondContact OG1-OE1 3.21Å
371	Q	93.6	Very high	89.6	Confident	68 Å²	68	55.7 Å²	55.7	32%	0.318	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	135.1	168.9	-70	-78.6	2.3	0	0	109	S363 I364 L365	S363-Q371 PolarHBondContact OG-OE1 3.47Å; I364-Q371 CarbonylContact O-C 3.51Å; I364-Q371 VanDerWaalsContact O-CA 3.32Å; I364-Q371 WeakPolarHBondContact O-CA 3.39Å; I364-Q371 PolarHBondContact O-OE1 3.36Å; L365-Q371 HydrophobicContact CD1-CG 4.05Å
372	V	90.9	Very high	89.4	Confident	36 Å²	36	48.1 Å²	48.1	22%	0.218	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	120	177.6	-174.9	0	0	0	0	109.1	S363 I364 L366 V376 I377	S363-V372 CarbonylContact C-O 3.56Å; S363-V372 VanDerWaalsContact CA-O 3.31Å; S363-V372 WeakPolarHBondContact CA-O 3.3Å; S363-V372 WeakPolarHBondContact CB-O 3.42Å; I364-V372 HydrophobicContact CG1-CB 4.06Å; I364-V372 PolarHBondContact N-O 3.42Å; I364-V372 PolarHBondContact O-N 3.08Å; L366-V372 HydrophobicContact CD1-CG2 3.82Å; L366-V372 HydrophobicContact CG-CG2 4.03Å; V372-V376 HydrophobicContact CG1-CB 4.25Å; V372-V376 HydrophobicContact CG1-CG1 4.28Å; V372-I377 HydrophobicContact CG1-CD1 4.19Å; V372-I377 HydrophobicContact CG1-CG1 3.78Å
373	D	92	Very high	89.3	Confident	93 Å²	93	50 Å²	50	50%	0.497	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	144	-178.3	-56.3	-41.8	0	0	0	111.6	G362 A375 V376 I377	G362-D373 WeakPolarHBondContact O-CA 3.34Å; D373-A375 PolarHBondContact O-N 3.2Å; D373-A375 VanDerWaalsContact O-N 3.13Å; D373-V376 HydrophobicContact CB-CG2 4.31Å; D373-V376 WeakPolarHBondContact O-CB 3.47Å; D373-V376 PolarHBondContact O-N 2.96Å; D373-I377 PolarHBondContact O-N 2.93Å
374	Y	90.3	Very high	89	Confident	73 Å²	73	53.3 Å²	53.3	29%	0.286	33%	0.332	S	S	.	.	H	α-helix	trans	-57	-31.5	178.7	-60.9	-42.3	0	0	0	112.9	G362 I364 V376 I377 A378 L389 Q393	G362-Y374 VanDerWaalsContact C-CE2 3.43Å; G362-Y374 VanDerWaalsContact O-CD2 3.23Å; G362-Y374 WeakPolarHBondContact O-CD2 3.17Å; G362-Y374 PolarHBondContact O-N 2.97Å; I364-Y374 HydrophobicContact CG2-CD1 4.25Å; I364-Y374 HydrophobicContact CG2-CE1 3.59Å; Y374-V376 PolarHBondContact O-N 3.41Å; Y374-I377 PolarHBondContact O-N 3.45Å; Y374-A378 VanDerWaalsContact O-CB 3.32Å; Y374-A378 WeakPolarHBondContact O-CB 3.22Å; Y374-A378 PolarHBondContact O-N 2.91Å; Y374-L389 HydrophobicContact CD1-CD2 4.02Å; Y374-L389 HydrophobicContact CE1-CD1 4.41Å; Y374-L389 HydrophobicContact CE1-CD2 4.48Å; Y374-Q393 HydrophobicContact CE1-CG 4.17Å; Y374-Q393 PolarHBondContact OH-NE2 3.04Å; Y374-Q393 PolarHBondContact OH-OE1 2.98Å
375	A	90	Very high	88.6	Confident	75 Å²	75	54.4 Å²	54.4	62%	0.62	34%	0.337	S	S	*	.	H	α-helix	trans	-65.3	-35.8	176.4	0	0	0	0	0	113	D373 S379	D373-A375 PolarHBondContact O-N 3.2Å; D373-A375 VanDerWaalsContact O-N 3.13Å; A375-S379 WeakPolarHBondContact O-CB 3.43Å; A375-S379 PolarHBondContact O-N 3.47Å; A375-S379 VanDerWaalsContact O-N 3.11Å; A375-S379 PolarHBondContact O-OG 3.46Å
376	V	87.4	Confident	88.4	Confident	55 Å²	55	55.5 Å²	55.5	33%	0.333	34%	0.343	S	S	.	.	H	α-helix	trans	-67.8	-41.6	174.9	178.9	0	0	0	0	109.8	V372 D373 Y374 S379 Q380	V372-V376 HydrophobicContact CG1-CB 4.25Å; V372-V376 HydrophobicContact CG1-CG1 4.28Å; D373-V376 HydrophobicContact CB-CG2 4.31Å; D373-V376 WeakPolarHBondContact O-CB 3.47Å; D373-V376 PolarHBondContact O-N 2.96Å; Y374-V376 PolarHBondContact O-N 3.41Å; V376-S379 PolarHBondContact O-OG 3.27Å; V376-Q380 WeakPolarHBondContact O-CB 3.38Å; V376-Q380 WeakPolarHBondContact O-CG 3.47Å; V376-Q380 PolarHBondContact O-N 3.35Å
377	I	84.8	Confident	88.3	Confident	23 Å²	23	58.7 Å²	58.7	12%	0.118	36%	0.361	C	S	.	.	H	α-helix	trans	-65.3	-52.7	176.5	-54.5	172.2	0	0	0	109.8	I364 V372 D373 Y374 S379 Q380 A381 L389	I364-I377 HydrophobicContact CD1-CD1 3.49Å; I364-I377 VanDerWaalsContact CD1-CD1 3.49Å; I364-I377 HydrophobicContact CG1-CD1 3.85Å; I364-I377 HydrophobicContact CG2-CD1 4.49Å; V372-I377 HydrophobicContact CG1-CD1 4.19Å; V372-I377 HydrophobicContact CG1-CG1 3.78Å; D373-I377 PolarHBondContact O-N 2.93Å; Y374-I377 PolarHBondContact O-N 3.45Å; I377-S379 PolarHBondContact O-N 3Å; I377-S379 VanDerWaalsContact O-N 3.11Å; I377-Q380 PolarHBondContact O-N 2.95Å; I377-A381 HydrophobicContact CG2-CB 3.8Å; I377-A381 WeakPolarHBondContact O-CA 3.24Å; I377-A381 WeakPolarHBondContact O-CB 3.21Å; I377-A381 PolarHBondContact O-N 3.43Å; I377-L389 HydrophobicContact CB-CD2 4.25Å; I377-L389 HydrophobicContact CD1-CD2 3.77Å; I377-L389 HydrophobicContact CG2-CD2 3.89Å
378	A	86.1	Confident	88.2	Confident	59 Å²	59	58.7 Å²	58.7	49%	0.488	36%	0.36	S	S	.	.	H	α-helix	trans	-56.2	-32.4	-178.9	0	0	0	0	0	113.7	Y374 N386	Y374-A378 VanDerWaalsContact O-CB 3.32Å; Y374-A378 WeakPolarHBondContact O-CB 3.22Å; Y374-A378 PolarHBondContact O-N 2.91Å; A378-N386 WeakPolarHBondContact CA-OD1 3.33Å
379	S	85.1	Confident	88.2	Confident	94 Å²	94	59.7 Å²	59.7	66%	0.657	37%	0.365	S	S	*	.	H	α-helix	trans	-82.4	-21.2	177.4	57.1	0	0	0	0	114.9	A375 V376 I377	A375-S379 WeakPolarHBondContact O-CB 3.43Å; A375-S379 PolarHBondContact O-N 3.47Å; A375-S379 VanDerWaalsContact O-N 3.11Å; A375-S379 PolarHBondContact O-OG 3.46Å; V376-S379 PolarHBondContact O-OG 3.27Å; I377-S379 PolarHBondContact O-N 3Å; I377-S379 VanDerWaalsContact O-N 3.11Å
380	Q	79.1	Confident	88.3	Confident	121 Å²	121	61.2 Å²	61.2	57%	0.565	37%	0.371	S	S	*	.	H	α-helix	trans	-110.5	-17	-177.9	-63.7	-176.4	21.2	0	0	113.9	T302 V376 I377	T302-Q380 PolarHBondContact OG1-OE1 2.88Å; V376-Q380 WeakPolarHBondContact O-CB 3.38Å; V376-Q380 WeakPolarHBondContact O-CG 3.47Å; V376-Q380 PolarHBondContact O-N 3.35Å; I377-Q380 PolarHBondContact O-N 2.95Å
381	A	77.8	Confident	88.5	Confident	17 Å²	17	59.6 Å²	59.6	14%	0.14	36%	0.363	C	S	.	.	S	Bend	trans	-96.9	138.8	-176.1	0	0	0	0	0	111.8	I377 L385 N386	I377-A381 HydrophobicContact CG2-CB 3.8Å; I377-A381 WeakPolarHBondContact O-CA 3.24Å; I377-A381 WeakPolarHBondContact O-CB 3.21Å; I377-A381 PolarHBondContact O-N 3.43Å; A381-L385 HydrophobicContact CB-CB 4.07Å; A381-L385 HydrophobicContact CB-CD2 3.77Å; A381-L385 HydrophobicContact CB-CG 4Å; A381-N386 PolarHBondContact O-ND2 2.9Å; A381-N386 VanDerWaalsContact O-ND2 3.11Å
382	G	83.2	Confident	88.6	Confident	42 Å²	42	56.8 Å²	56.8	43%	0.433	35%	0.352	S	S	.	.			trans	-68.4	161.1	166.9	0	0	0	0	0	112	T384 L385 N386	G382-T384 VanDerWaalsContact C-N 3.25Å; G382-T384 PolarHBondContact O-N 3.49Å; G382-T384 VanDerWaalsContact O-N 3.12Å; G382-L385 PolarHBondContact O-N 3.46Å; G382-N386 PolarHBondContact O-N 3.2Å
383	A	87.4	Confident	88.8	Confident	71 Å²	71	56.7 Å²	56.7	59%	0.587	35%	0.349	S	S	*	.	H	α-helix	trans	-49.1	-41.9	-176.7	0	0	0	0	0	113.8	L385 N386 N387	A383-L385 VanDerWaalsContact C-N 3.34Å; A383-L385 PolarHBondContact O-N 3.35Å; A383-N386 PolarHBondContact O-N 2.64Å; A383-N387 VanDerWaalsContact O-CG 3.26Å; A383-N387 PolarHBondContact O-N 3.21Å; A383-N387 PolarHBondContact O-OD1 3.23Å
384	T	87.4	Confident	89	Confident	75 Å²	75	56.9 Å²	56.9	46%	0.46	35%	0.347	S	S	.	.	H	α-helix	trans	-56.9	-43.6	177.9	-43.7	0	0	0	0	113.1	G382 N387 L388 Y477	G382-T384 VanDerWaalsContact C-N 3.25Å; G382-T384 PolarHBondContact O-N 3.49Å; G382-T384 VanDerWaalsContact O-N 3.12Å; T384-N387 PolarHBondContact O-N 2.7Å; T384-L388 WeakPolarHBondContact O-CG 3.26Å; T384-L388 PolarHBondContact O-N 3.06Å; T384-Y477 HydrophobicContact CG2-CD2 3.64Å; T384-Y477 HydrophobicContact CG2-CE2 4.41Å; T384-Y477 HydrophobicContact CG2-CG 4.09Å
385	L	86.8	Confident	89.4	Confident	38 Å²	38	53.4 Å²	53.4	20%	0.199	33%	0.333	C	S	.	.	H	α-helix	trans	-75.1	-32	-179.3	178.2	60.9	0	0	0	111.8	M306 A381 G382 A383 L389 Y477	M306-L385 HydrophobicContact CE-CD2 3.95Å; A381-L385 HydrophobicContact CB-CB 4.07Å; A381-L385 HydrophobicContact CB-CD2 3.77Å; A381-L385 HydrophobicContact CB-CG 4Å; G382-L385 PolarHBondContact O-N 3.46Å; A383-L385 VanDerWaalsContact C-N 3.34Å; A383-L385 PolarHBondContact O-N 3.35Å; L385-L389 WeakPolarHBondContact O-CB 3.3Å; L385-L389 PolarHBondContact O-N 2.89Å; L385-Y477 HydrophobicContact CB-CE1 4.34Å
386	N	89.9	Confident	89.7	Confident	45 Å²	45	49.8 Å²	49.8	24%	0.241	30%	0.303	C	S	.	.	H	α-helix	trans	-66.1	-40.1	171.2	-70.9	-41.6	0	0	0	111.9	A378 A381 G382 A383 L389 S390	A378-N386 WeakPolarHBondContact CA-OD1 3.33Å; A381-N386 PolarHBondContact O-ND2 2.9Å; A381-N386 VanDerWaalsContact O-ND2 3.11Å; G382-N386 PolarHBondContact O-N 3.2Å; A383-N386 PolarHBondContact O-N 2.64Å; N386-L389 PolarHBondContact O-N 2.82Å; N386-S390 PolarHBondContact O-N 2.97Å
387	N	91.6	Very high	90.2	Very high	93 Å²	93	49.9 Å²	49.9	50%	0.497	31%	0.31	S	S	.	.	H	α-helix	trans	-65.3	-45.8	175.7	-66.8	-3.8	0	0	0	111.6	A383 T384 L389 S390 H391	A383-N387 VanDerWaalsContact O-CG 3.26Å; A383-N387 PolarHBondContact O-N 3.21Å; A383-N387 PolarHBondContact O-OD1 3.23Å; T384-N387 PolarHBondContact O-N 2.7Å; N387-L389 VanDerWaalsContact C-N 3.3Å; N387-L389 PolarHBondContact O-N 3Å; N387-S390 WeakPolarHBondContact O-CB 3.49Å; N387-S390 PolarHBondContact O-N 3.07Å; N387-S390 VanDerWaalsContact O-N 3.14Å; N387-H391 PolarHBondContact O-N 3.18Å
388	L	92.9	Very high	90.8	Very high	15 Å²	15	52.3 Å²	52.3	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-54.9	-45.1	173	-81.7	169.4	0	0	0	112	T384 A392 I470 Q473 A474 Y477	T384-L388 WeakPolarHBondContact O-CG 3.26Å; T384-L388 PolarHBondContact O-N 3.06Å; L388-A392 WeakPolarHBondContact O-CB 3.46Å; L388-A392 PolarHBondContact O-N 3.38Å; L388-I470 HydrophobicContact CD2-CG2 4.18Å; L388-Q473 HydrophobicContact CD2-CB 3.52Å; L388-Q473 HydrophobicContact CG-CB 4.47Å; L388-A474 HydrophobicContact CD1-CB 4.38Å; L388-A474 HydrophobicContact CD2-CB 4.28Å; L388-Y477 HydrophobicContact CD1-CD1 4.44Å; L388-Y477 HydrophobicContact CD1-CG 4.45Å
389	L	92.8	Very high	91.4	Very high	26 Å²	26	49.6 Å²	49.6	14%	0.136	30%	0.297	C	S	.	.	H	α-helix	trans	-63.9	-42.6	176.1	177.5	60.7	0	0	0	111.7	I364 Y374 I377 L385 N386 N387 A392 Q393	I364-L389 HydrophobicContact CG2-CD1 3.83Å; Y374-L389 HydrophobicContact CD1-CD2 4.02Å; Y374-L389 HydrophobicContact CE1-CD1 4.41Å; Y374-L389 HydrophobicContact CE1-CD2 4.48Å; I377-L389 HydrophobicContact CB-CD2 4.25Å; I377-L389 HydrophobicContact CD1-CD2 3.77Å; I377-L389 HydrophobicContact CG2-CD2 3.89Å; L385-L389 WeakPolarHBondContact O-CB 3.3Å; L385-L389 PolarHBondContact O-N 2.89Å; N386-L389 PolarHBondContact O-N 2.82Å; N387-L389 VanDerWaalsContact C-N 3.3Å; N387-L389 PolarHBondContact O-N 3Å; L389-A392 PolarHBondContact O-N 3.35Å; L389-Q393 HydrophobicContact CD1-CG 4.1Å; L389-Q393 HydrophobicContact CG-CG 4.47Å; L389-Q393 WeakPolarHBondContact O-CG 3.48Å; L389-Q393 PolarHBondContact O-N 2.83Å
390	S	93.8	Very high	91.9	Very high	60 Å²	60	49.8 Å²	49.8	42%	0.42	28%	0.283	S	S	.	.	H	α-helix	trans	-58.7	-51.3	176.6	-165.4	0	0	0	0	111.5	N386 N387 A392 Q393 E394	N386-S390 PolarHBondContact O-N 2.97Å; N387-S390 WeakPolarHBondContact O-CB 3.49Å; N387-S390 PolarHBondContact O-N 3.07Å; N387-S390 VanDerWaalsContact O-N 3.14Å; S390-A392 VanDerWaalsContact C-N 3.3Å; S390-A392 PolarHBondContact O-N 3.29Å; S390-Q393 PolarHBondContact O-N 2.65Å; S390-Q393 VanDerWaalsContact O-N 3.09Å; S390-E394 PolarHBondContact O-N 2.89Å
391	H	95.3	Very high	92.7	Very high	73 Å²	73	48.2 Å²	48.2	34%	0.338	29%	0.285	S	S	.	.	H	α-helix	trans	-59.4	-40.4	177.3	-61.7	160.4	0	0	0	111.9	N387 E394 L395 I470 Q473	N387-H391 PolarHBondContact O-N 3.18Å; H391-E394 PolarHBondContact O-N 3.16Å; H391-L395 PolarHBondContact O-N 3.38Å; H391-L395 VanDerWaalsContact O-N 3.09Å; H391-I470 HydrophobicContact CB-CD1 4.11Å; H391-I470 HydrophobicContact CB-CG1 3.98Å; H391-Q473 PolarHBondContact ND1-OE1 3.49Å
392	A	96.1	Very high	93.6	Very high	9 Å²	9	48.3 Å²	48.3	7%	0.074	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-40.4	174.7	0	0	0	0	0	112.4	L388 L389 S390 L395 V396	L388-A392 WeakPolarHBondContact O-CB 3.46Å; L388-A392 PolarHBondContact O-N 3.38Å; L389-A392 PolarHBondContact O-N 3.35Å; S390-A392 VanDerWaalsContact C-N 3.3Å; S390-A392 PolarHBondContact O-N 3.29Å; A392-L395 PolarHBondContact O-N 3.24Å; A392-V396 VanDerWaalsContact O-CG2 3.24Å; A392-V396 WeakPolarHBondContact O-CG2 3.28Å; A392-V396 PolarHBondContact O-N 3.4Å
393	Q	95.4	Very high	94.2	Very high	33 Å²	33	51.7 Å²	51.7	15%	0.154	29%	0.288	C	S	.	.	H	α-helix	trans	-69.4	-36.2	177.7	-68.7	-53	-34.8	0	0	113.1	Y374 L389 S390 L395 V396 A397	Y374-Q393 HydrophobicContact CE1-CG 4.17Å; Y374-Q393 PolarHBondContact OH-NE2 3.04Å; Y374-Q393 PolarHBondContact OH-OE1 2.98Å; L389-Q393 HydrophobicContact CD1-CG 4.1Å; L389-Q393 HydrophobicContact CG-CG 4.47Å; L389-Q393 WeakPolarHBondContact O-CG 3.48Å; L389-Q393 PolarHBondContact O-N 2.83Å; S390-Q393 PolarHBondContact O-N 2.65Å; S390-Q393 VanDerWaalsContact O-N 3.09Å; Q393-L395 VanDerWaalsContact C-N 3.32Å; Q393-L395 PolarHBondContact O-N 2.96Å; Q393-V396 PolarHBondContact O-N 3.31Å; Q393-A397 WeakPolarHBondContact O-CB 3.4Å; Q393-A397 PolarHBondContact O-N 3.09Å
394	E	96.3	Very high	94.7	Very high	97 Å²	97	48.9 Å²	48.9	45%	0.453	26%	0.263	S	S	.	.	H	α-helix	trans	-60.8	-42.7	171	-71.8	173.1	-140.8	0	0	111.7	S390 H391 A397 K398	S390-E394 PolarHBondContact O-N 2.89Å; H391-E394 PolarHBondContact O-N 3.16Å; E394-A397 PolarHBondContact O-N 2.92Å; E394-K398 WeakPolarHBondContact O-CG 3.42Å; E394-K398 PolarHBondContact O-N 2.91Å
395	L	97.6	Very high	95.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.3	-42	174.8	176.6	59.8	0	0	0	112	V352 H391 A392 Q393 A397 K398 L399 R463 E466 I467 I470	V352-L395 HydrophobicContact CG1-CD2 4.14Å; V352-L395 HydrophobicContact CG1-CG 4.09Å; V352-L395 HydrophobicContact CG2-CD2 4.12Å; H391-L395 PolarHBondContact O-N 3.38Å; H391-L395 VanDerWaalsContact O-N 3.09Å; A392-L395 PolarHBondContact O-N 3.24Å; Q393-L395 VanDerWaalsContact C-N 3.32Å; Q393-L395 PolarHBondContact O-N 2.96Å; L395-A397 VanDerWaalsContact C-N 3.33Å; L395-A397 PolarHBondContact O-N 2.85Å; L395-K398 PolarHBondContact O-N 3.32Å; L395-L399 HydrophobicContact CD1-CD1 4.09Å; L395-L399 HydrophobicContact CD1-CG 4.22Å; L395-L399 HydrophobicContact CG-CD1 4.13Å; L395-L399 WeakPolarHBondContact O-CG 3.35Å; L395-L399 PolarHBondContact O-N 3.01Å; L395-R463 HydrophobicContact CD1-CB 4.06Å; L395-R463 HydrophobicContact CD1-CG 4.3Å; L395-E466 HydrophobicContact CD1-CB 4.29Å; L395-I467 HydrophobicContact CD2-CG1 3.66Å; L395-I470 HydrophobicContact CB-CD1 4.32Å; L395-I470 HydrophobicContact CD2-CD1 3.85Å
396	V	98.1	Very high	95.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-59.7	-43.1	173.5	169.1	0	0	0	0	111.1	V352 Q355 V356 A392 Q393 L399 R400	V352-V396 HydrophobicContact CB-CG2 4.36Å; V352-V396 HydrophobicContact CG1-CG2 3.9Å; V352-V396 HydrophobicContact CG2-CG2 4.41Å; Q355-V396 HydrophobicContact CB-CB 4.46Å; Q355-V396 HydrophobicContact CB-CG1 3.94Å; Q355-V396 HydrophobicContact CB-CG2 3.62Å; Q355-V396 HydrophobicContact CG-CG2 4.18Å; V356-V396 HydrophobicContact CG2-CB 4.38Å; V356-V396 HydrophobicContact CG2-CG1 4.03Å; V356-V396 HydrophobicContact CG2-CG2 4.42Å; A392-V396 VanDerWaalsContact O-CG2 3.24Å; A392-V396 WeakPolarHBondContact O-CG2 3.28Å; A392-V396 PolarHBondContact O-N 3.4Å; Q393-V396 PolarHBondContact O-N 3.31Å; V396-L399 PolarHBondContact O-N 2.96Å; V396-R400 HydrophobicContact CG1-CG 4.48Å; V396-R400 WeakPolarHBondContact O-CB 3.36Å; V396-R400 WeakPolarHBondContact O-CG 3.21Å; V396-R400 PolarHBondContact O-N 3.25Å
397	A	96.8	Very high	96	Very high	56 Å²	56	51 Å²	51	46%	0.463	26%	0.262	S	S	.	.	H	α-helix	trans	-62.9	-43.7	176.6	0	0	0	0	0	112.2	Q393 E394 L395 R400 S401	Q393-A397 WeakPolarHBondContact O-CB 3.4Å; Q393-A397 PolarHBondContact O-N 3.09Å; E394-A397 PolarHBondContact O-N 2.92Å; L395-A397 VanDerWaalsContact C-N 3.33Å; L395-A397 PolarHBondContact O-N 2.85Å; A397-R400 PolarHBondContact O-N 2.5Å; A397-S401 PolarHBondContact O-N 2.74Å
398	K	97.4	Very high	96.3	Very high	75 Å²	75	46.6 Å²	46.6	33%	0.326	24%	0.239	S	C	.	.	H	α-helix	trans	-60.5	-42.8	173.5	-69.1	163.9	-176.2	162.9	0	112.1	E394 L395 S401 L402 E466	E394-K398 WeakPolarHBondContact O-CG 3.42Å; E394-K398 PolarHBondContact O-N 2.91Å; L395-K398 PolarHBondContact O-N 3.32Å; K398-S401 PolarHBondContact O-N 2.83Å; K398-S401 PolarHBondContact O-OG 3.09Å; K398-L402 WeakPolarHBondContact O-CG 3.41Å; K398-L402 PolarHBondContact O-N 3.5Å; K398-L402 VanDerWaalsContact O-N 3.1Å; K398-E466 WeakPolarHBondContact CD-OE2 3.31Å; K398-E466 IonicContact NZ-OE2 3.16Å; K398-E466 PolarHBondContact NZ-OE2 3.35Å
399	L	98	Very high	96.6	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-72.4	-33.5	179.9	-73.5	172.8	0	0	0	113.2	V352 V356 L395 V396 L402 Q403 L404 L460 R463	V352-L399 HydrophobicContact CG1-CD1 3.46Å; V352-L399 VanDerWaalsContact CG1-CD1 3.46Å; V356-L399 HydrophobicContact CG2-CB 3.61Å; V356-L399 HydrophobicContact CG2-CD1 4.3Å; L395-L399 HydrophobicContact CD1-CD1 4.09Å; L395-L399 HydrophobicContact CD1-CG 4.22Å; L395-L399 HydrophobicContact CG-CD1 4.13Å; L395-L399 WeakPolarHBondContact O-CG 3.35Å; L395-L399 PolarHBondContact O-N 3.01Å; V396-L399 PolarHBondContact O-N 2.96Å; L399-L402 HydrophobicContact CD2-CD1 4.48Å; L399-L402 PolarHBondContact O-N 3.35Å; L399-Q403 PolarHBondContact O-N 3.02Å; L399-L404 HydrophobicContact CB-CB 4.26Å; L399-L404 HydrophobicContact CB-CD2 4.34Å; L399-L404 HydrophobicContact CD1-CD2 4.05Å; L399-L404 HydrophobicContact CD2-CB 4.22Å; L399-L404 HydrophobicContact CD2-CD2 3.91Å; L399-L404 HydrophobicContact CD2-CG 4.45Å; L399-L404 HydrophobicContact CG-CD2 4.33Å; L399-L404 PolarHBondContact O-N 2.91Å; L399-L460 HydrophobicContact CD2-CD2 4.47Å; L399-R463 HydrophobicContact CD2-CB 4.3Å; L399-R463 HydrophobicContact CD2-CG 3.75Å; L399-R463 HydrophobicContact CG-CG 4.44Å
400	R	97	Very high	96.9	Very high	99 Å²	99	45 Å²	45	37%	0.374	23%	0.23	S	C	.	.	H	α-helix	trans	-64.7	-41.8	169.7	-75.6	176.9	-179.8	156.1	-2.3	111.9	Q355 V356 A359 V396 A397 L402 Q403	Q355-R400 PolarHBondContact O-NH2 3.46Å; V356-R400 HydrophobicContact CB-CG 4.34Å; V356-R400 HydrophobicContact CG1-CG 3.94Å; V356-R400 HydrophobicContact CG2-CG 4.38Å; V356-R400 PolarHBondContact O-NE 3.01Å; A359-R400 PolarHBondContact O-NH2 3.48Å; V396-R400 HydrophobicContact CG1-CG 4.48Å; V396-R400 WeakPolarHBondContact O-CB 3.36Å; V396-R400 WeakPolarHBondContact O-CG 3.21Å; V396-R400 PolarHBondContact O-N 3.25Å; A397-R400 PolarHBondContact O-N 2.5Å; R400-L402 VanDerWaalsContact C-N 3.32Å; R400-L402 PolarHBondContact O-N 3.25Å; R400-Q403 PolarHBondContact O-N 3.42Å
401	S	96.1	Very high	97.1	Very high	88 Å²	88	42.1 Å²	42.1	62%	0.615	21%	0.21	S	C	*	.	H	α-helix	trans	-67	-33.5	178.1	74.3	0	0	0	0	112.7	A397 K398 Q403	A397-S401 PolarHBondContact O-N 2.74Å; K398-S401 PolarHBondContact O-N 2.83Å; K398-S401 PolarHBondContact O-OG 3.09Å; S401-Q403 PolarHBondContact O-N 2.96Å
402	L	96.2	Very high	97.3	Very high	18 Å²	18	38.7 Å²	38.7	9%	0.094	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-11.5	170	-68.5	171.1	0	0	0	113.7	K398 L399 R400 K456 Q459 L460 R463	K398-L402 WeakPolarHBondContact O-CG 3.41Å; K398-L402 PolarHBondContact O-N 3.5Å; K398-L402 VanDerWaalsContact O-N 3.1Å; L399-L402 HydrophobicContact CD2-CD1 4.48Å; L399-L402 PolarHBondContact O-N 3.35Å; R400-L402 VanDerWaalsContact C-N 3.32Å; R400-L402 PolarHBondContact O-N 3.25Å; L402-K456 WeakPolarHBondContact O-CE 3.46Å; L402-K456 PolarHBondContact O-NZ 3.16Å; L402-K456 VanDerWaalsContact O-NZ 3.15Å; L402-Q459 HydrophobicContact CD1-CB 3.93Å; L402-Q459 HydrophobicContact CD2-CB 3.57Å; L402-Q459 HydrophobicContact CD2-CG 4.05Å; L402-Q459 HydrophobicContact CG-CB 4.43Å; L402-L460 HydrophobicContact CD1-CD2 4.37Å; L402-R463 HydrophobicContact CD1-CG 4.37Å
403	Q	96.4	Very high	97.4	Very high	114 Å²	114	38.5 Å²	38.5	53%	0.533	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	52.7	-172.1	-53.5	174.2	-6.4	0	0	111.2	L399 R400 S401 D405 K456	L399-Q403 PolarHBondContact O-N 3.02Å; R400-Q403 PolarHBondContact O-N 3.42Å; S401-Q403 PolarHBondContact O-N 2.96Å; Q403-D405 PolarHBondContact O-N 3.14Å; Q403-K456 PolarHBondContact O-NZ 3.17Å
404	L	97.9	Very high	97.5	Very high	11 Å²	11	37 Å²	37	6%	0.058	19%	0.185	C	C	.	.			trans	-58.8	121.3	174.3	177.1	72.9	0	0	0	110	F353 L399 E408 L412 L460	F353-L404 HydrophobicContact CD2-CD2 3.66Å; F353-L404 HydrophobicContact CD2-CG 4.24Å; F353-L404 HydrophobicContact CE2-CD2 4.21Å; F353-L404 HydrophobicContact CE2-CG 4.28Å; L399-L404 HydrophobicContact CB-CB 4.26Å; L399-L404 HydrophobicContact CB-CD2 4.34Å; L399-L404 HydrophobicContact CD1-CD2 4.05Å; L399-L404 HydrophobicContact CD2-CB 4.22Å; L399-L404 HydrophobicContact CD2-CD2 3.91Å; L399-L404 HydrophobicContact CD2-CG 4.45Å; L399-L404 HydrophobicContact CG-CD2 4.33Å; L399-L404 PolarHBondContact O-N 2.91Å; L404-E408 WeakPolarHBondContact CA-OE2 3.46Å; L404-E408 HydrophobicContact CD1-CB 3.62Å; L404-L412 HydrophobicContact CD1-CD1 3.92Å; L404-L460 HydrophobicContact CD1-CD2 3.63Å
405	D	96.7	Very high	97.6	Very high	21 Å²	21	32.8 Å²	32.8	11%	0.112	17%	0.165	C	C	.	.			trans	-107.7	172.6	175.7	80.9	68.6	0	0	0	113.2	Q403 R407 E408 F409 Y445 Y450	Q403-D405 PolarHBondContact O-N 3.14Å; D405-R407 VanDerWaalsContact C-N 3.31Å; D405-R407 PolarHBondContact O-N 3.1Å; D405-R407 WeakPolarHBondContact OD1-CA 3.25Å; D405-R407 VanDerWaalsContact OD1-CB 3.26Å; D405-R407 WeakPolarHBondContact OD1-CB 3.48Å; D405-R407 WeakPolarHBondContact OD1-CD 3.47Å; D405-R407 PolarHBondContact OD1-N 3.35Å; D405-E408 PolarHBondContact N-OE2 3.24Å; D405-E408 PolarHBondContact O-N 3.4Å; D405-F409 WeakPolarHBondContact O-CB 3.49Å; D405-F409 PolarHBondContact O-N 3.36Å; D405-Y445 PolarHBondContact OD1-OH 3.19Å; D405-Y445 VanDerWaalsContact OD2-CE1 3.3Å; D405-Y445 WeakPolarHBondContact OD2-CE1 3.28Å; D405-Y445 PolarHBondContact OD2-OH 3.22Å; D405-Y450 WeakPolarHBondContact OD2-CE2 3.43Å; D405-Y450 PolarHBondContact OD2-OH 3.39Å
406	Q	97.1	Very high	97.7	Very high	99 Å²	99	33 Å²	33	46%	0.463	17%	0.167	S	C	.	.	H	α-helix	trans	-59.9	-33.2	-176.4	-165	-176	16.9	0	0	114.2	L270 F353 V410	L270-Q406 HydrophobicContact CD2-CG 3.89Å; F353-Q406 HydrophobicContact CZ-CB 4.22Å; Q406-V410 WeakPolarHBondContact O-CG1 3.25Å; Q406-V410 PolarHBondContact O-N 3.48Å
407	R	97.1	Very high	97.7	Very high	84 Å²	84	33 Å²	33	32%	0.317	17%	0.167	S	C	.	.	H	α-helix	trans	-69.9	-41.8	179	-70.3	73	169.6	-154.8	5.4	110.2	I266 L270 D405 V410 C411 Y445	I266-R407 HydrophobicContact CG2-CB 3.7Å; I266-R407 HydrophobicContact CG2-CG 3.71Å; L270-R407 HydrophobicContact CD1-CG 4.15Å; D405-R407 VanDerWaalsContact C-N 3.31Å; D405-R407 PolarHBondContact O-N 3.1Å; D405-R407 WeakPolarHBondContact OD1-CA 3.25Å; D405-R407 VanDerWaalsContact OD1-CB 3.26Å; D405-R407 WeakPolarHBondContact OD1-CB 3.48Å; D405-R407 WeakPolarHBondContact OD1-CD 3.47Å; D405-R407 PolarHBondContact OD1-N 3.35Å; R407-V410 VanDerWaalsContact O-CG2 3.31Å; R407-V410 WeakPolarHBondContact O-CG2 3.4Å; R407-C411 PolarHBondContact O-N 3.33Å; R407-C411 PolarHBondContact O-SG 3.42Å; R407-Y445 HydrophobicContact CB-CD1 4.33Å; R407-Y445 HydrophobicContact CB-CD2 4.34Å; R407-Y445 HydrophobicContact CB-CE1 3.86Å; R407-Y445 HydrophobicContact CB-CE2 3.87Å; R407-Y445 HydrophobicContact CG-CD2 4.45Å; R407-Y445 HydrophobicContact CG-CE1 4.49Å; R407-Y445 HydrophobicContact CG-CE2 3.71Å
408	E	97.9	Very high	97.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-68.5	-43.1	177.4	-61.3	175.7	149.6	0	0	110.5	L404 D405 C411 L412 L442 Y445 V446 Y450 K456 L460	L404-E408 WeakPolarHBondContact CA-OE2 3.46Å; L404-E408 HydrophobicContact CD1-CB 3.62Å; D405-E408 PolarHBondContact N-OE2 3.24Å; D405-E408 PolarHBondContact O-N 3.4Å; E408-C411 WeakPolarHBondContact O-CB 3.33Å; E408-C411 PolarHBondContact O-N 2.95Å; E408-L412 WeakPolarHBondContact O-CG 3.48Å; E408-L412 PolarHBondContact O-N 2.97Å; E408-L442 HydrophobicContact CB-CD1 4.04Å; E408-L442 HydrophobicContact CG-CD1 3.94Å; E408-Y445 HydrophobicContact CG-CD1 3.93Å; E408-Y445 HydrophobicContact CG-CE1 3.81Å; E408-V446 WeakPolarHBondContact OE1-CG2 3.49Å; E408-Y450 WeakPolarHBondContact OE1-CE2 3.4Å; E408-K456 VanDerWaalsContact CD-CE 3.45Å; E408-K456 WeakPolarHBondContact OE1-CE 3.35Å; E408-K456 IonicContact OE1-NZ 2.73Å; E408-K456 PolarHBondContact OE1-NZ 2.95Å; E408-K456 WeakPolarHBondContact OE2-CE 3.32Å; E408-K456 IonicContact OE2-NZ 2.75Å; E408-K456 PolarHBondContact OE2-NZ 2.99Å; E408-L460 HydrophobicContact CB-CD1 4.23Å; E408-L460 HydrophobicContact CG-CD1 4.24Å
409	F	98.6	Very high	97.5	Very high	7 Å²	7	27.5 Å²	27.5	3%	0.031	13%	0.134	C	C	.	.	H	α-helix	trans	-57.8	-49	175.4	168.4	-110.9	0	0	0	113.5	L349 D350 F353 D405 C411 L412 K413	L349-F409 HydrophobicContact CD1-CD2 3.97Å; L349-F409 HydrophobicContact CD1-CE2 3.96Å; L349-F409 HydrophobicContact CG-CD2 4.28Å; L349-F409 HydrophobicContact CG-CE2 3.88Å; D350-F409 VanDerWaalsContact OD1-CZ 3.26Å; D350-F409 WeakPolarHBondContact OD1-CZ 3.3Å; F353-F409 HydrophobicContact CB-CD2 3.43Å; F353-F409 VanDerWaalsContact CB-CD2 3.43Å; F353-F409 HydrophobicContact CB-CE2 3.17Å; F353-F409 HydrophobicContact CB-CG 4.19Å; F353-F409 HydrophobicContact CB-CZ 3.74Å; F353-F409 HydrophobicContact CD1-CB 4.44Å; F353-F409 AromaticContact CD1-CD1 3.5Å; F353-F409 HydrophobicContact CD1-CD1 3.5Å; F353-F409 AromaticContact CD1-CD2 3.75Å; F353-F409 HydrophobicContact CD1-CD2 3.75Å; F353-F409 AromaticContact CD1-CE1 3.4Å; F353-F409 HydrophobicContact CD1-CE1 3.4Å; F353-F409 AromaticContact CD1-CE2 3.66Å; F353-F409 HydrophobicContact CD1-CE2 3.66Å; F353-F409 AromaticContact CD1-CG 3.64Å; F353-F409 HydrophobicContact CD1-CG 3.64Å; F353-F409 AromaticContact CD1-CZ 3.43Å; F353-F409 HydrophobicContact CD1-CZ 3.43Å; F353-F409 VanDerWaalsContact CD1-CZ 3.43Å; F353-F409 HydrophobicContact CD2-CB 3.8Å; F353-F409 HydrophobicContact CD2-CD1 4.37Å; F353-F409 AromaticContact CD2-CD2 3.68Å; F353-F409 HydrophobicContact CD2-CD2 3.68Å; F353-F409 HydrophobicContact CD2-CE2 4.26Å; F353-F409 AromaticContact CD2-CG 3.7Å; F353-F409 HydrophobicContact CD2-CG 3.7Å; F353-F409 HydrophobicContact CE1-CB 4.31Å; F353-F409 AromaticContact CE1-CD1 3.51Å; F353-F409 HydrophobicContact CE1-CD1 3.51Å; F353-F409 HydrophobicContact CE1-CD2 4.41Å; F353-F409 AromaticContact CE1-CE1 3.73Å; F353-F409 HydrophobicContact CE1-CE1 3.73Å; F353-F409 AromaticContact CE1-CG 3.84Å; F353-F409 HydrophobicContact CE1-CG 3.84Å; F353-F409 HydrophobicContact CE1-CZ 4.24Å; F353-F409 HydrophobicContact CE2-CB 3.65Å; F353-F409 HydrophobicContact CE2-CD1 4.37Å; F353-F409 HydrophobicContact CE2-CD2 4.35Å; F353-F409 AromaticContact CE2-CG 3.9Å; F353-F409 HydrophobicContact CE2-CG 3.9Å; F353-F409 HydrophobicContact CG-CB 4.19Å; F353-F409 AromaticContact CG-CD1 3.95Å; F353-F409 HydrophobicContact CG-CD1 3.95Å; F353-F409 AromaticContact CG-CD2 3.32Å; F353-F409 HydrophobicContact CG-CD2 3.32Å; F353-F409 HydrophobicContact CG-CE1 4.05Å; F353-F409 AromaticContact CG-CE2 3.44Å; F353-F409 HydrophobicContact CG-CE2 3.44Å; F353-F409 VanDerWaalsContact CG-CE2 3.44Å; F353-F409 AromaticContact CG-CG 3.56Å; F353-F409 HydrophobicContact CG-CG 3.56Å; F353-F409 AromaticContact CG-CZ 3.76Å; F353-F409 HydrophobicContact CG-CZ 3.76Å; F353-F409 HydrophobicContact CZ-CB 3.92Å; F353-F409 AromaticContact CZ-CD1 3.96Å; F353-F409 HydrophobicContact CZ-CD1 3.96Å; F353-F409 AromaticContact CZ-CG 3.96Å; F353-F409 HydrophobicContact CZ-CG 3.96Å; D405-F409 WeakPolarHBondContact O-CB 3.49Å; D405-F409 PolarHBondContact O-N 3.36Å; F409-C411 VanDerWaalsContact C-N 3.29Å; F409-C411 PolarHBondContact O-N 3.35Å; F409-L412 WeakPolarHBondContact O-CB 3.44Å; F409-L412 PolarHBondContact O-N 3.35Å; F409-L412 VanDerWaalsContact O-N 3.08Å; F409-K413 HydrophobicContact CD1-CD 4.15Å; F409-K413 HydrophobicContact CD2-CD 4.46Å; F409-K413 HydrophobicContact CD2-CG 4.46Å; F409-K413 HydrophobicContact CE1-CD 3.57Å; F409-K413 HydrophobicContact CE2-CD 3.93Å; F409-K413 HydrophobicContact CE2-CG 4.12Å; F409-K413 HydrophobicContact CZ-CD 3.49Å; F409-K413 VanDerWaalsContact CZ-CD 3.49Å; F409-K413 HydrophobicContact CZ-CG 4.2Å; F409-K413 PolarHBondContact O-N 3.5Å
410	V	98.4	Very high	97.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.6	-36.3	177.8	-62.4	0	0	0	0	111.9	L269 L270 E273 Q406 R407 L412 K413 F414	L269-V410 HydrophobicContact CB-CB 4.35Å; L269-V410 HydrophobicContact CB-CG2 3.97Å; L270-V410 HydrophobicContact CD2-CG1 3.98Å; L270-V410 HydrophobicContact CD2-CG2 4.03Å; L270-V410 HydrophobicContact CG-CG2 4.17Å; E273-V410 HydrophobicContact CG-CG1 3.42Å; E273-V410 VanDerWaalsContact CG-CG1 3.42Å; Q406-V410 WeakPolarHBondContact O-CG1 3.25Å; Q406-V410 PolarHBondContact O-N 3.48Å; R407-V410 VanDerWaalsContact O-CG2 3.31Å; R407-V410 WeakPolarHBondContact O-CG2 3.4Å; V410-L412 VanDerWaalsContact C-N 3.35Å; V410-L412 PolarHBondContact O-N 2.62Å; V410-K413 PolarHBondContact O-N 2.84Å; V410-F414 WeakPolarHBondContact O-CD2 3.24Å; V410-F414 PolarHBondContact O-N 2.9Å
411	C	98.6	Very high	96.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.1	-44.7	171.8	-68.2	0	0	0	0	111.5	R407 E408 F409 K413 F414 L415 V438 L442	R407-C411 PolarHBondContact O-N 3.33Å; R407-C411 PolarHBondContact O-SG 3.42Å; E408-C411 WeakPolarHBondContact O-CB 3.33Å; E408-C411 PolarHBondContact O-N 2.95Å; F409-C411 VanDerWaalsContact C-N 3.29Å; F409-C411 PolarHBondContact O-N 3.35Å; C411-K413 PolarHBondContact O-N 2.94Å; C411-F414 PolarHBondContact O-N 2.86Å; C411-L415 WeakPolarHBondContact O-CG 3.24Å; C411-L415 PolarHBondContact O-N 3.26Å; C411-V438 HydrophobicContact CB-CG1 3.89Å; C411-V438 WeakPolarHBondContact O-CG1 3.02Å; C411-L442 HydrophobicContact CB-CB 3.96Å; C411-L442 HydrophobicContact CB-CD1 3.92Å; C411-L442 HydrophobicContact CB-CD2 4.01Å; C411-L442 HydrophobicContact CB-CG 4.18Å
412	L	98.7	Very high	96.6	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-61.7	-41.8	176.4	-65.1	175.8	0	0	0	112.1	L349 L404 E408 F409 V410 F414 L415 V416 L442 L464	L349-L412 HydrophobicContact CD2-CB 4.25Å; L404-L412 HydrophobicContact CD1-CD1 3.92Å; E408-L412 WeakPolarHBondContact O-CG 3.48Å; E408-L412 PolarHBondContact O-N 2.97Å; F409-L412 WeakPolarHBondContact O-CB 3.44Å; F409-L412 PolarHBondContact O-N 3.35Å; F409-L412 VanDerWaalsContact O-N 3.08Å; V410-L412 VanDerWaalsContact C-N 3.35Å; V410-L412 PolarHBondContact O-N 2.62Å; L412-F414 VanDerWaalsContact C-N 3.33Å; L412-F414 PolarHBondContact O-N 3.2Å; L412-L415 PolarHBondContact O-N 2.96Å; L412-V416 WeakPolarHBondContact O-CG2 3.29Å; L412-V416 PolarHBondContact O-N 3.48Å; L412-L442 HydrophobicContact CD2-CD2 4.48Å; L412-L464 HydrophobicContact CB-CD2 4.29Å; L412-L464 HydrophobicContact CD2-CD1 4.29Å; L412-L464 HydrophobicContact CD2-CD2 3.94Å; L412-L464 HydrophobicContact CD2-CG 4.16Å
413	K	98.6	Very high	96.2	Very high	5 Å²	5	32.6 Å²	32.6	2%	0.022	15%	0.153	C	C	.	.	H	α-helix	trans	-58.2	-43.6	174.2	-71.3	176.5	66.8	160.4	0	112.1	E273 W320 L346 L349 D350 F409 V410 C411 V416 L417	E273-K413 WeakPolarHBondContact OE1-CE 3.49Å; E273-K413 IonicContact OE1-NZ 3.83Å; E273-K413 PolarHBondContact OE1-NZ 2.91Å; E273-K413 IonicContact OE2-NZ 2.74Å; E273-K413 PolarHBondContact OE2-NZ 2.64Å; W320-K413 HydrophobicContact CH2-CB 3.82Å; W320-K413 HydrophobicContact CZ2-CB 3.7Å; W320-K413 HydrophobicContact CZ2-CD 4.39Å; L346-K413 HydrophobicContact CD2-CB 4.23Å; L346-K413 HydrophobicContact CD2-CG 4.36Å; L349-K413 HydrophobicContact CD2-CB 4.44Å; L349-K413 HydrophobicContact CD2-CG 3.76Å; L349-K413 HydrophobicContact CG-CG 4.27Å; D350-K413 WeakPolarHBondContact OD1-CD 3.41Å; D350-K413 VanDerWaalsContact OD1-CE 3.3Å; D350-K413 WeakPolarHBondContact OD1-CE 3.34Å; D350-K413 IonicContact OD1-NZ 3.15Å; D350-K413 PolarHBondContact OD1-NZ 2.86Å; D350-K413 IonicContact OD2-NZ 2.71Å; F409-K413 HydrophobicContact CD1-CD 4.15Å; F409-K413 HydrophobicContact CD2-CD 4.46Å; F409-K413 HydrophobicContact CD2-CG 4.46Å; F409-K413 HydrophobicContact CE1-CD 3.57Å; F409-K413 HydrophobicContact CE2-CD 3.93Å; F409-K413 HydrophobicContact CE2-CG 4.12Å; F409-K413 HydrophobicContact CZ-CD 3.49Å; F409-K413 VanDerWaalsContact CZ-CD 3.49Å; F409-K413 HydrophobicContact CZ-CG 4.2Å; F409-K413 PolarHBondContact O-N 3.5Å; V410-K413 PolarHBondContact O-N 2.84Å; C411-K413 PolarHBondContact O-N 2.94Å; K413-V416 PolarHBondContact O-N 3.32Å; K413-L417 WeakPolarHBondContact O-CB 3.38Å; K413-L417 PolarHBondContact O-N 3.18Å
414	F	98.6	Very high	96	Very high	1 Å²	1	34 Å²	34	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-68.1	-35.7	177	-89.4	-93.4	0	0	0	112.9	L269 C272 W320 S324 F326 V410 C411 L412 V416 L417 F418 V438	L269-F414 HydrophobicContact CB-CD2 4.19Å; L269-F414 HydrophobicContact CB-CE2 4.02Å; L269-F414 HydrophobicContact CD1-CB 4.31Å; L269-F414 HydrophobicContact CD1-CD2 3.95Å; L269-F414 HydrophobicContact CD1-CG 4.07Å; L269-F414 HydrophobicContact CD2-CD1 3.91Å; L269-F414 HydrophobicContact CD2-CD2 3.91Å; L269-F414 HydrophobicContact CD2-CE1 3.82Å; L269-F414 HydrophobicContact CD2-CE2 3.81Å; L269-F414 HydrophobicContact CD2-CG 3.96Å; L269-F414 HydrophobicContact CD2-CZ 3.77Å; L269-F414 HydrophobicContact CG-CD2 4.21Å; L269-F414 HydrophobicContact CG-CE2 4.3Å; C272-F414 HydrophobicContact CB-CE2 4.48Å; C272-F414 HydrophobicContact CB-CZ 4.4Å; W320-F414 HydrophobicContact CH2-CD2 4.43Å; W320-F414 HydrophobicContact CH2-CE2 4.43Å; W320-F414 AromaticContact CZ2-CD2 3.84Å; W320-F414 HydrophobicContact CZ2-CD2 3.84Å; W320-F414 AromaticContact CZ2-CE2 3.62Å; W320-F414 HydrophobicContact CZ2-CE2 3.62Å; W320-F414 HydrophobicContact CZ2-CZ 4.26Å; S324-F414 VanDerWaalsContact OG-CE1 3.29Å; S324-F414 WeakPolarHBondContact OG-CE1 3.42Å; F326-F414 HydrophobicContact CD2-CE1 4.31Å; V410-F414 WeakPolarHBondContact O-CD2 3.24Å; V410-F414 PolarHBondContact O-N 2.9Å; C411-F414 PolarHBondContact O-N 2.86Å; L412-F414 VanDerWaalsContact C-N 3.33Å; L412-F414 PolarHBondContact O-N 3.2Å; F414-V416 VanDerWaalsContact C-N 3.33Å; F414-L417 PolarHBondContact O-N 3.48Å; F414-F418 AromaticContact CD1-CD2 3.9Å; F414-F418 HydrophobicContact CD1-CD2 3.9Å; F414-F418 AromaticContact CD1-CE2 3.64Å; F414-F418 HydrophobicContact CD1-CE2 3.64Å; F414-F418 AromaticContact CE1-CE2 3.87Å; F414-F418 HydrophobicContact CE1-CE2 3.87Å; F414-F418 WeakPolarHBondContact O-CB 3.5Å; F414-F418 WeakPolarHBondContact O-CD2 3.5Å; F414-F418 PolarHBondContact O-N 2.98Å; F414-V438 HydrophobicContact CB-CG1 4.14Å; F414-V438 HydrophobicContact CB-CG2 4.1Å
415	L	98.4	Very high	95.8	Very high	8 Å²	8	34.4 Å²	34.4	4%	0.042	17%	0.167	C	C	.	.	H	α-helix	trans	-67.9	-31.3	173.6	-67.1	175.6	0	0	0	113	C411 L412 Q435 V438 N439 L442 L461 L464	C411-L415 WeakPolarHBondContact O-CG 3.24Å; C411-L415 PolarHBondContact O-N 3.26Å; L412-L415 PolarHBondContact O-N 2.96Å; L415-Q435 HydrophobicContact CD2-CG 4.29Å; L415-V438 HydrophobicContact CD2-CB 4.09Å; L415-V438 HydrophobicContact CD2-CG1 3.92Å; L415-V438 HydrophobicContact CG-CG1 3.85Å; L415-N439 VanDerWaalsContact CD2-ND2 3.3Å; L415-N439 WeakPolarHBondContact CD2-ND2 3.43Å; L415-L442 HydrophobicContact CD1-CD2 4.39Å; L415-L461 HydrophobicContact CD1-CD2 3.66Å; L415-L464 HydrophobicContact CB-CD1 4.24Å; L415-L464 HydrophobicContact CD1-CD1 4.45Å
416	V	98.4	Very high	95.7	Very high	6 Å²	6	38.9 Å²	38.9	4%	0.036	19%	0.187	C	C	.	.	H	α-helix	trans	-72.5	-44.3	173.2	168.3	0	0	0	0	111.4	C342 E345 L346 L349 L412 K413 F414 L464	C342-V416 HydrophobicContact CB-CG1 3.79Å; C342-V416 WeakPolarHBondContact CB-O 3.48Å; E345-V416 HydrophobicContact CB-CG1 3.65Å; L346-V416 HydrophobicContact CD2-CB 4.01Å; L346-V416 HydrophobicContact CD2-CG1 3.64Å; L346-V416 HydrophobicContact CG-CG1 3.81Å; L349-V416 HydrophobicContact CD2-CG2 4.16Å; L412-V416 WeakPolarHBondContact O-CG2 3.29Å; L412-V416 PolarHBondContact O-N 3.48Å; K413-V416 PolarHBondContact O-N 3.32Å; F414-V416 VanDerWaalsContact C-N 3.33Å; V416-L464 HydrophobicContact CG2-CD2 3.71Å
417	L	98.4	Very high	95.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.3	-48.2	178.6	178.3	62.4	0	0	0	112.1	W320 A321 F327 L338 L339 K413 F414 S419	W320-L417 HydrophobicContact CH2-CB 4.16Å; W320-L417 HydrophobicContact CH2-CD2 3.86Å; W320-L417 HydrophobicContact CZ3-CB 4.29Å; W320-L417 HydrophobicContact CZ3-CD2 3.72Å; W320-L417 HydrophobicContact CZ3-CG 4.43Å; A321-L417 HydrophobicContact CB-CD1 4.49Å; A321-L417 HydrophobicContact CB-CD2 4.08Å; F327-L417 HydrophobicContact CD2-CD1 4.33Å; F327-L417 HydrophobicContact CD2-CD2 4.01Å; F327-L417 HydrophobicContact CD2-CG 4.4Å; F327-L417 HydrophobicContact CE2-CD1 3.96Å; F327-L417 HydrophobicContact CE2-CD2 4.44Å; L338-L417 HydrophobicContact CB-CD1 4.45Å; L339-L417 HydrophobicContact CD2-CD1 4Å; K413-L417 WeakPolarHBondContact O-CB 3.38Å; K413-L417 PolarHBondContact O-N 3.18Å; F414-L417 PolarHBondContact O-N 3.48Å; L417-S419 VanDerWaalsContact C-N 3.27Å; L417-S419 PolarHBondContact O-N 2.87Å
418	F	97.9	Very high	95.5	Very high	1 Å²	1	36.8 Å²	36.8	0%	0.004	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	57.8	179.6	-67.3	-89.1	0	0	0	110.7	F326 F327 L330 L338 F414 V431 V434 Q435	F326-F418 HydrophobicContact CB-CE1 4.23Å; F326-F418 HydrophobicContact CB-CE2 4.46Å; F326-F418 HydrophobicContact CB-CZ 3.73Å; F327-F418 HydrophobicContact CB-CZ 4.21Å; F327-F418 HydrophobicContact CD2-CZ 4.29Å; L330-F418 HydrophobicContact CD1-CE1 3.98Å; L338-F418 HydrophobicContact CD1-CD1 4.22Å; L338-F418 HydrophobicContact CD1-CE1 4.35Å; F414-F418 AromaticContact CD1-CD2 3.9Å; F414-F418 HydrophobicContact CD1-CD2 3.9Å; F414-F418 AromaticContact CD1-CE2 3.64Å; F414-F418 HydrophobicContact CD1-CE2 3.64Å; F414-F418 AromaticContact CE1-CE2 3.87Å; F414-F418 HydrophobicContact CE1-CE2 3.87Å; F414-F418 WeakPolarHBondContact O-CB 3.5Å; F414-F418 WeakPolarHBondContact O-CD2 3.5Å; F414-F418 PolarHBondContact O-N 2.98Å; F418-V431 HydrophobicContact CB-CG1 3.87Å; F418-V431 HydrophobicContact CD1-CB 4.39Å; F418-V431 HydrophobicContact CD1-CG1 4.13Å; F418-V431 HydrophobicContact CD1-CG2 4.24Å; F418-V434 HydrophobicContact CB-CG1 4.18Å; F418-V434 HydrophobicContact CD1-CB 4.1Å; F418-V434 HydrophobicContact CD1-CG1 3.98Å; F418-V434 HydrophobicContact CD1-CG2 4.42Å; F418-V434 HydrophobicContact CD2-CG1 3.68Å; F418-V434 HydrophobicContact CE1-CB 4.48Å; F418-V434 HydrophobicContact CE1-CG1 4.29Å; F418-V434 HydrophobicContact CE1-CG2 4.35Å; F418-V434 HydrophobicContact CE2-CG1 4.02Å; F418-V434 HydrophobicContact CG-CB 4.18Å; F418-V434 HydrophobicContact CG-CG1 3.66Å; F418-V434 HydrophobicContact CZ-CG1 4.32Å; F418-Q435 WeakPolarHBondContact O-CG 3.42Å; F418-Q435 PolarHBondContact O-NE2 2.86Å
419	S	93.4	Very high	95.3	Very high	13 Å²	13	43.4 Å²	43.4	9%	0.091	21%	0.213	C	C	.	.			trans	-73.8	132.5	178.8	178.5	0	0	0	0	112.3	L417 D421	L417-S419 VanDerWaalsContact C-N 3.27Å; L417-S419 PolarHBondContact O-N 2.87Å; S419-D421 VanDerWaalsContact C-N 3.27Å; S419-D421 PolarHBondContact O-N 3.25Å; S419-D421 PolarHBondContact OG-N 3.14Å
420	L	91.2	Very high	95.2	Very high	65 Å²	65	44.1 Å²	44.1	34%	0.34	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-5.2	177.7	-54.4	-179.7	0	0	0	113.7	V422 F428 V431 E432 Q435	L420-V422 VanDerWaalsContact C-N 3.3Å; L420-F428 HydrophobicContact CD2-CZ 4.36Å; L420-V431 HydrophobicContact CD2-CG1 4.13Å; L420-E432 HydrophobicContact CD2-CB 4.3Å; L420-Q435 HydrophobicContact CD1-CB 4.46Å; L420-Q435 HydrophobicContact CD1-CG 4.23Å; L420-Q435 HydrophobicContact CD2-CB 4.21Å; L420-Q435 HydrophobicContact CD2-CG 3.92Å; L420-Q435 HydrophobicContact CG-CB 4.5Å; L420-Q435 HydrophobicContact CG-CG 3.91Å
421	D	88.9	Confident	95.1	Very high	63 Å²	63	44.1 Å²	44.1	34%	0.337	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-12.3	177.7	-55.3	-39.7	0	0	0	113.2	K152 S419 K423 R468	K152-D421 WeakPolarHBondContact CE-OD2 3.32Å; K152-D421 IonicContact NZ-OD1 3.3Å; K152-D421 PolarHBondContact NZ-OD1 3.15Å; K152-D421 IonicContact NZ-OD2 2.75Å; K152-D421 PolarHBondContact NZ-OD2 3.5Å; S419-D421 VanDerWaalsContact C-N 3.27Å; S419-D421 PolarHBondContact O-N 3.25Å; S419-D421 PolarHBondContact OG-N 3.14Å; D421-K423 PolarHBondContact O-N 3.04Å; D421-R468 IonicContact OD2-CZ 2.68Å; D421-R468 IonicContact OD2-NH1 2.66Å; D421-R468 PolarHBondContact OD2-NH1 3.26Å; D421-R468 IonicContact OD2-NH2 2.64Å
422	V	91.1	Very high	94.9	Very high	14 Å²	14	47.6 Å²	47.6	9%	0.085	23%	0.233	C	C	.	.			trans	-73.7	116.2	-171	-176.6	0	0	0	0	109.6	K337 L338 N341 L420 L425	K337-V422 HydrophobicContact CB-CG1 3.88Å; L338-V422 HydrophobicContact CD2-CB 4.15Å; L338-V422 HydrophobicContact CD2-CG1 4.34Å; L338-V422 HydrophobicContact CD2-CG2 3.94Å; N341-V422 HydrophobicContact CB-CG2 3.64Å; L420-V422 VanDerWaalsContact C-N 3.3Å; V422-L425 HydrophobicContact CB-CD1 3.96Å; V422-L425 HydrophobicContact CB-CG 4.2Å; V422-L425 HydrophobicContact CG1-CD1 4.24Å; V422-L425 HydrophobicContact CG1-CD2 3.9Å; V422-L425 HydrophobicContact CG1-CG 3.95Å
423	K	88.8	Confident	94.8	Very high	171 Å²	171	49.8 Å²	49.8	74%	0.743	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	153	-175.1	-61.2	177.6	-176.2	172.8	0	111.1	D421 L425	D421-K423 PolarHBondContact O-N 3.04Å; K423-L425 VanDerWaalsContact C-N 3.26Å; K423-L425 PolarHBondContact O-N 3.11Å
424	N	90.9	Very high	94.7	Very high	143 Å²	143	49.6 Å²	49.6	77%	0.765	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	32.2	171.3	-50.6	-26.9	0	0	0	114.4	K337	K337-N424 PolarHBondContact NZ-O 3.34Å
425	L	93.8	Very high	94.6	Very high	20 Å²	20	51 Å²	51	11%	0.105	25%	0.254	C	S	.	.			trans	-69.4	135.7	168.8	-70	171.2	0	0	0	110.3	D334 K337 L338 V422 K423 F428 V431	D334-L425 HydrophobicContact CB-CD2 3.96Å; D334-L425 VanDerWaalsContact OD1-CA 3.31Å; D334-L425 WeakPolarHBondContact OD1-CA 3.45Å; K337-L425 HydrophobicContact CB-CD2 4.18Å; K337-L425 HydrophobicContact CD-CD2 4.33Å; L338-L425 HydrophobicContact CD2-CD1 4.11Å; L338-L425 HydrophobicContact CD2-CD2 4.15Å; L338-L425 HydrophobicContact CG-CD2 4.25Å; V422-L425 HydrophobicContact CB-CD1 3.96Å; V422-L425 HydrophobicContact CB-CG 4.2Å; V422-L425 HydrophobicContact CG1-CD1 4.24Å; V422-L425 HydrophobicContact CG1-CD2 3.9Å; V422-L425 HydrophobicContact CG1-CG 3.95Å; K423-L425 VanDerWaalsContact C-N 3.26Å; K423-L425 PolarHBondContact O-N 3.11Å; L425-F428 HydrophobicContact CB-CB 4.42Å; L425-F428 HydrophobicContact CD1-CD2 4.3Å; L425-V431 HydrophobicContact CD1-CB 4.43Å; L425-V431 HydrophobicContact CD1-CG1 4.49Å; L425-V431 HydrophobicContact CD1-CG2 3.96Å
426	E	94.9	Very high	94.4	Very high	115 Å²	115	57 Å²	57	54%	0.537	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-43.4	174.3	-67.8	-163.2	-126.7	0	0	111.6	K331 D334	K331-E426 WeakPolarHBondContact CD-OE1 3.36Å; K331-E426 IonicContact NZ-OE1 3.58Å; K331-E426 PolarHBondContact NZ-OE1 3.05Å; K331-E426 IonicContact NZ-OE2 3.47Å; K331-E426 PolarHBondContact NZ-OE2 3.45Å; D334-E426 PolarHBondContact OD1-N 3.27Å; D334-E426 PolarHBondContact OD2-N 2.83Å; D334-E426 VanDerWaalsContact OD2-N 3.17Å
427	N	94.5	Very high	94.3	Very high	65 Å²	65	60.8 Å²	60.8	35%	0.348	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	57.2	-179.5	-165.5	-0.7	0	0	0	112.4	L330 D334 H429 L430	L330-N427 HydrophobicContact CD2-CB 4.03Å; D334-N427 PolarHBondContact OD2-N 2.92Å; N427-H429 PolarHBondContact O-N 2.97Å; N427-L430 HydrophobicContact CB-CB 4.48Å; N427-L430 WeakPolarHBondContact ND2-CB 3.49Å; N427-L430 PolarHBondContact O-N 3.23Å; N427-L430 WeakPolarHBondContact OD1-CB 3.31Å; N427-L430 PolarHBondContact OD1-N 3.11Å
428	F	95.1	Very high	94.2	Very high	75 Å²	75	60.8 Å²	60.8	33%	0.329	30%	0.299	S	S	.	.	H	α-helix	trans	-53.4	-38.3	176.3	-177.2	-91.3	0	0	0	113	L420 L425 L430 V431 E432	L420-F428 HydrophobicContact CD2-CZ 4.36Å; L425-F428 HydrophobicContact CB-CB 4.42Å; L425-F428 HydrophobicContact CD1-CD2 4.3Å; F428-L430 VanDerWaalsContact C-N 3.33Å; F428-L430 PolarHBondContact O-N 3.06Å; F428-V431 WeakPolarHBondContact O-CB 3.49Å; F428-V431 PolarHBondContact O-N 3.49Å; F428-V431 VanDerWaalsContact O-N 3.1Å; F428-E432 HydrophobicContact CD1-CB 4.45Å; F428-E432 HydrophobicContact CE1-CB 4.19Å; F428-E432 PolarHBondContact O-N 3.35Å
429	H	94.6	Very high	94.2	Very high	139 Å²	139	61.2 Å²	61.2	64%	0.644	30%	0.302	S	S	*	.	H	α-helix	trans	-64.1	-31.8	-179.3	-69.7	-52.9	0	0	0	114.1	N427 E432 S433	N427-H429 PolarHBondContact O-N 2.97Å; H429-E432 IonicContact ND1-OE2 2.75Å; H429-E432 PolarHBondContact ND1-OE2 3.27Å; H429-S433 WeakPolarHBondContact O-CB 3.3Å; H429-S433 PolarHBondContact O-N 3.05Å
430	L	96.7	Very high	94.1	Very high	22 Å²	22	62.5 Å²	62.5	12%	0.115	31%	0.313	C	S	.	.	H	α-helix	trans	-67.5	-42.8	172.3	177.4	59.3	0	0	0	110.7	E329 L330 N427 F428 S433 V434	E329-L430 HydrophobicContact CB-CD2 3.69Å; L330-L430 HydrophobicContact CD2-CB 4.49Å; L330-L430 HydrophobicContact CD2-CD2 3.83Å; L330-L430 HydrophobicContact CD2-CG 4.44Å; L330-L430 HydrophobicContact CG-CD2 4.05Å; N427-L430 HydrophobicContact CB-CB 4.48Å; N427-L430 WeakPolarHBondContact ND2-CB 3.49Å; N427-L430 PolarHBondContact O-N 3.23Å; N427-L430 WeakPolarHBondContact OD1-CB 3.31Å; N427-L430 PolarHBondContact OD1-N 3.11Å; F428-L430 VanDerWaalsContact C-N 3.33Å; F428-L430 PolarHBondContact O-N 3.06Å; L430-S433 PolarHBondContact O-N 2.82Å; L430-V434 HydrophobicContact CD1-CG2 4.04Å; L430-V434 HydrophobicContact CG-CG2 4.47Å; L430-V434 WeakPolarHBondContact O-CB 3.36Å; L430-V434 VanDerWaalsContact O-CG2 3.24Å; L430-V434 WeakPolarHBondContact O-CG2 3.35Å; L430-V434 PolarHBondContact O-N 3.4Å
431	V	96.4	Very high	94.4	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62.9	-44.5	178.1	-175.5	0	0	0	0	111.1	L330 L338 F418 L420 L425 F428 V434 Q435	L330-V431 HydrophobicContact CD2-CG2 4.34Å; L338-V431 HydrophobicContact CD1-CG2 4.26Å; L338-V431 HydrophobicContact CD2-CG1 4.43Å; F418-V431 HydrophobicContact CB-CG1 3.87Å; F418-V431 HydrophobicContact CD1-CB 4.39Å; F418-V431 HydrophobicContact CD1-CG1 4.13Å; F418-V431 HydrophobicContact CD1-CG2 4.24Å; L420-V431 HydrophobicContact CD2-CG1 4.13Å; L425-V431 HydrophobicContact CD1-CB 4.43Å; L425-V431 HydrophobicContact CD1-CG1 4.49Å; L425-V431 HydrophobicContact CD1-CG2 3.96Å; F428-V431 WeakPolarHBondContact O-CB 3.49Å; F428-V431 PolarHBondContact O-N 3.49Å; F428-V431 VanDerWaalsContact O-N 3.1Å; V431-V434 PolarHBondContact O-N 2.97Å; V431-Q435 WeakPolarHBondContact O-CB 3.44Å; V431-Q435 PolarHBondContact O-N 2.9Å
432	E	94.4	Very high	94.7	Very high	73 Å²	73	56.9 Å²	56.9	34%	0.341	29%	0.285	S	S	.	.	H	α-helix	trans	-57.7	-51.1	172.8	-176.2	173.3	-126.3	0	0	112.2	L420 F428 H429 V434 Q435 E436	L420-E432 HydrophobicContact CD2-CB 4.3Å; F428-E432 HydrophobicContact CD1-CB 4.45Å; F428-E432 HydrophobicContact CE1-CB 4.19Å; F428-E432 PolarHBondContact O-N 3.35Å; H429-E432 IonicContact ND1-OE2 2.75Å; H429-E432 PolarHBondContact ND1-OE2 3.27Å; E432-V434 PolarHBondContact O-N 2.89Å; E432-Q435 VanDerWaalsContact O-CB 3.31Å; E432-Q435 WeakPolarHBondContact O-CB 3.45Å; E432-Q435 PolarHBondContact O-N 3.36Å; E432-E436 PolarHBondContact O-N 3.49Å
433	S	96.3	Very high	94.8	Very high	47 Å²	47	56.7 Å²	56.7	33%	0.329	28%	0.283	S	S	.	.	H	α-helix	trans	-60.4	-40.9	178.2	178.8	0	0	0	0	113	H429 L430 E436 Q437	H429-S433 WeakPolarHBondContact O-CB 3.3Å; H429-S433 PolarHBondContact O-N 3.05Å; L430-S433 PolarHBondContact O-N 2.82Å; S433-E436 PolarHBondContact O-N 2.98Å; S433-Q437 WeakPolarHBondContact O-CB 3.22Å; S433-Q437 VanDerWaalsContact O-CG 3.22Å; S433-Q437 WeakPolarHBondContact O-CG 3.27Å; S433-Q437 PolarHBondContact O-N 2.7Å; S433-Q437 PolarHBondContact O-NE2 3.28Å; S433-Q437 PolarHBondContact OG-NE2 3.14Å
434	V	96.9	Very high	94.8	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-66	-43.3	175.9	173.3	0	0	0	0	110.6	F326 F418 L430 V431 E432 E436 Q437 V438	F326-V434 HydrophobicContact CB-CG2 3.8Å; F326-V434 HydrophobicContact CD1-CG2 3.75Å; F326-V434 HydrophobicContact CD2-CG1 4.37Å; F326-V434 HydrophobicContact CD2-CG2 4.4Å; F326-V434 HydrophobicContact CE1-CG2 4.45Å; F326-V434 HydrophobicContact CG-CG1 4.44Å; F326-V434 HydrophobicContact CG-CG2 3.72Å; F418-V434 HydrophobicContact CB-CG1 4.18Å; F418-V434 HydrophobicContact CD1-CB 4.1Å; F418-V434 HydrophobicContact CD1-CG1 3.98Å; F418-V434 HydrophobicContact CD1-CG2 4.42Å; F418-V434 HydrophobicContact CD2-CG1 3.68Å; F418-V434 HydrophobicContact CE1-CB 4.48Å; F418-V434 HydrophobicContact CE1-CG1 4.29Å; F418-V434 HydrophobicContact CE1-CG2 4.35Å; F418-V434 HydrophobicContact CE2-CG1 4.02Å; F418-V434 HydrophobicContact CG-CB 4.18Å; F418-V434 HydrophobicContact CG-CG1 3.66Å; F418-V434 HydrophobicContact CZ-CG1 4.32Å; L430-V434 HydrophobicContact CD1-CG2 4.04Å; L430-V434 HydrophobicContact CG-CG2 4.47Å; L430-V434 WeakPolarHBondContact O-CB 3.36Å; L430-V434 VanDerWaalsContact O-CG2 3.24Å; L430-V434 WeakPolarHBondContact O-CG2 3.35Å; L430-V434 PolarHBondContact O-N 3.4Å; V431-V434 PolarHBondContact O-N 2.97Å; E432-V434 PolarHBondContact O-N 2.89Å; V434-E436 PolarHBondContact O-N 3.4Å; V434-Q437 PolarHBondContact O-N 3.48Å; V434-V438 HydrophobicContact CG1-CG2 4.1Å; V434-V438 WeakPolarHBondContact O-CB 3.5Å; V434-V438 VanDerWaalsContact O-CG2 3.24Å; V434-V438 WeakPolarHBondContact O-CG2 3.31Å; V434-V438 PolarHBondContact O-N 3.29Å
435	Q	96.4	Very high	95	Very high	29 Å²	29	45 Å²	45	14%	0.136	23%	0.229	C	C	.	.	H	α-helix	trans	-55.1	-50	173.3	-105.1	-102.5	7.1	0	0	112.1	L415 F418 L420 V431 E432 N439	L415-Q435 HydrophobicContact CD2-CG 4.29Å; F418-Q435 WeakPolarHBondContact O-CG 3.42Å; F418-Q435 PolarHBondContact O-NE2 2.86Å; L420-Q435 HydrophobicContact CD1-CB 4.46Å; L420-Q435 HydrophobicContact CD1-CG 4.23Å; L420-Q435 HydrophobicContact CD2-CB 4.21Å; L420-Q435 HydrophobicContact CD2-CG 3.92Å; L420-Q435 HydrophobicContact CG-CB 4.5Å; L420-Q435 HydrophobicContact CG-CG 3.91Å; V431-Q435 WeakPolarHBondContact O-CB 3.44Å; V431-Q435 PolarHBondContact O-N 2.9Å; E432-Q435 VanDerWaalsContact O-CB 3.31Å; E432-Q435 WeakPolarHBondContact O-CB 3.45Å; E432-Q435 PolarHBondContact O-N 3.36Å; Q435-N439 VanDerWaalsContact O-CB 3.25Å; Q435-N439 WeakPolarHBondContact O-CB 3.37Å; Q435-N439 PolarHBondContact O-N 2.85Å; Q435-N439 PolarHBondContact O-ND2 3.48Å; Q435-N439 PolarHBondContact OE1-ND2 3.25Å
436	E	93.1	Very high	94.9	Very high	136 Å²	136	44.3 Å²	44.3	64%	0.636	23%	0.225	S	C	*	.	H	α-helix	trans	-61.5	-45.6	178.8	-69.8	-166.2	151.4	0	0	112	E432 S433 V434 A440	E432-E436 PolarHBondContact O-N 3.49Å; S433-E436 PolarHBondContact O-N 2.98Å; V434-E436 PolarHBondContact O-N 3.4Å; E436-A440 VanDerWaalsContact O-CB 3.26Å; E436-A440 WeakPolarHBondContact O-CB 3.41Å; E436-A440 PolarHBondContact O-N 2.97Å
437	Q	96.6	Very high	94.5	Very high	84 Å²	84	42.1 Å²	42.1	39%	0.393	22%	0.216	S	C	.	.	H	α-helix	trans	-63	-46.9	179.9	-75.2	178.2	72.7	0	0	112.4	L265 S433 V434 A440 A441	L265-Q437 HydrophobicContact CD2-CB 3.81Å; L265-Q437 WeakPolarHBondContact CD2-O 3.43Å; S433-Q437 WeakPolarHBondContact O-CB 3.22Å; S433-Q437 VanDerWaalsContact O-CG 3.22Å; S433-Q437 WeakPolarHBondContact O-CG 3.27Å; S433-Q437 PolarHBondContact O-N 2.7Å; S433-Q437 PolarHBondContact O-NE2 3.28Å; S433-Q437 PolarHBondContact OG-NE2 3.14Å; V434-Q437 PolarHBondContact O-N 3.48Å; Q437-A440 PolarHBondContact O-N 3.19Å; Q437-A441 WeakPolarHBondContact O-CB 3.23Å; Q437-A441 PolarHBondContact O-N 3Å
438	V	97.4	Very high	94.3	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-66.1	-44.5	179.1	175.5	0	0	0	0	110.7	L265 L269 C411 F414 L415 V434 A440 A441 L442	L265-V438 HydrophobicContact CD2-CG2 4.21Å; L269-V438 HydrophobicContact CD1-CG1 4.35Å; L269-V438 HydrophobicContact CD1-CG2 4.18Å; C411-V438 HydrophobicContact CB-CG1 3.89Å; C411-V438 WeakPolarHBondContact O-CG1 3.02Å; F414-V438 HydrophobicContact CB-CG1 4.14Å; F414-V438 HydrophobicContact CB-CG2 4.1Å; L415-V438 HydrophobicContact CD2-CB 4.09Å; L415-V438 HydrophobicContact CD2-CG1 3.92Å; L415-V438 HydrophobicContact CG-CG1 3.85Å; V434-V438 HydrophobicContact CG1-CG2 4.1Å; V434-V438 WeakPolarHBondContact O-CB 3.5Å; V434-V438 VanDerWaalsContact O-CG2 3.24Å; V434-V438 WeakPolarHBondContact O-CG2 3.31Å; V434-V438 PolarHBondContact O-N 3.29Å; V438-A440 PolarHBondContact O-N 3.46Å; V438-A441 PolarHBondContact O-N 2.92Å; V438-L442 WeakPolarHBondContact O-CB 3.44Å; V438-L442 PolarHBondContact O-N 3.49Å
439	N	96.3	Very high	94	Very high	9 Å²	9	42 Å²	42	5%	0.048	22%	0.224	C	C	.	.	H	α-helix	trans	-59.4	-44.4	174.8	-86.9	-65	0	0	0	112.1	Q141 L415 Q435 L443 F457	Q141-N439 PolarHBondContact NE2-O 3.16Å; L415-N439 VanDerWaalsContact CD2-ND2 3.3Å; L415-N439 WeakPolarHBondContact CD2-ND2 3.43Å; Q435-N439 VanDerWaalsContact O-CB 3.25Å; Q435-N439 WeakPolarHBondContact O-CB 3.37Å; Q435-N439 PolarHBondContact O-N 2.85Å; Q435-N439 PolarHBondContact O-ND2 3.48Å; Q435-N439 PolarHBondContact OE1-ND2 3.25Å; N439-L443 VanDerWaalsContact O-CB 3.3Å; N439-L443 WeakPolarHBondContact O-CB 3.35Å; N439-L443 PolarHBondContact O-N 3.38Å; N439-F457 WeakPolarHBondContact O-CE2 3.43Å
440	A	92.5	Very high	93.7	Very high	40 Å²	40	37.6 Å²	37.6	33%	0.331	20%	0.202	S	C	.	.	H	α-helix	trans	-65.8	-40.2	178.8	0	0	0	0	0	112.3	E436 Q437 V438 D444	E436-A440 VanDerWaalsContact O-CB 3.26Å; E436-A440 WeakPolarHBondContact O-CB 3.41Å; E436-A440 PolarHBondContact O-N 2.97Å; Q437-A440 PolarHBondContact O-N 3.19Å; V438-A440 PolarHBondContact O-N 3.46Å; A440-D444 WeakPolarHBondContact O-CB 3.23Å; A440-D444 PolarHBondContact O-N 3.12Å
441	A	96.1	Very high	93.1	Very high	10 Å²	10	40.5 Å²	40.5	8%	0.083	22%	0.222	C	C	.	.	H	α-helix	trans	-67.9	-44.7	176.7	0	0	0	0	0	112.2	P263 L265 I266 Q437 V438 L443 D444 Y445	P263-A441 HydrophobicContact CB-CB 3.98Å; L265-A441 HydrophobicContact CB-CB 4.22Å; L265-A441 HydrophobicContact CD2-CB 3.96Å; L265-A441 HydrophobicContact CG-CB 4.47Å; I266-A441 HydrophobicContact CD1-CB 4.31Å; I266-A441 HydrophobicContact CG1-CB 4.02Å; Q437-A441 WeakPolarHBondContact O-CB 3.23Å; Q437-A441 PolarHBondContact O-N 3Å; V438-A441 PolarHBondContact O-N 2.92Å; A441-L443 VanDerWaalsContact C-N 3.31Å; A441-L443 PolarHBondContact O-N 2.91Å; A441-D444 PolarHBondContact O-N 3.28Å; A441-Y445 WeakPolarHBondContact O-CB 3.46Å; A441-Y445 PolarHBondContact O-N 3.2Å
442	L	96.5	Very high	92.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.1	-42.9	175.1	178.4	59.1	0	0	0	111.6	E408 C411 L412 L415 V438 Y445 V446 F457 L460	E408-L442 HydrophobicContact CB-CD1 4.04Å; E408-L442 HydrophobicContact CG-CD1 3.94Å; C411-L442 HydrophobicContact CB-CB 3.96Å; C411-L442 HydrophobicContact CB-CD1 3.92Å; C411-L442 HydrophobicContact CB-CD2 4.01Å; C411-L442 HydrophobicContact CB-CG 4.18Å; L412-L442 HydrophobicContact CD2-CD2 4.48Å; L415-L442 HydrophobicContact CD1-CD2 4.39Å; V438-L442 WeakPolarHBondContact O-CB 3.44Å; V438-L442 PolarHBondContact O-N 3.49Å; L442-Y445 PolarHBondContact O-N 3.46Å; L442-V446 HydrophobicContact CD1-CG2 4.12Å; L442-V446 WeakPolarHBondContact O-CB 3.43Å; L442-V446 VanDerWaalsContact O-CG2 3.27Å; L442-V446 WeakPolarHBondContact O-CG2 3.39Å; L442-V446 PolarHBondContact O-N 3.47Å; L442-F457 HydrophobicContact CB-CE2 4.15Å; L442-F457 HydrophobicContact CD2-CD2 4.3Å; L442-F457 HydrophobicContact CD2-CE2 4.05Å; L442-F457 HydrophobicContact CG-CD2 3.99Å; L442-F457 HydrophobicContact CG-CE2 3.96Å; L442-L460 HydrophobicContact CD1-CD1 4.39Å
443	L	93.5	Very high	92.3	Very high	10 Å²	10	47.8 Å²	47.8	5%	0.052	26%	0.257	C	S	.	.	H	α-helix	trans	-63.2	-47.1	177.5	179	63.1	0	0	0	112.7	A137 Q141 N439 A441 Y445 V446 M447 F457	A137-L443 HydrophobicContact CB-CD1 4.32Å; A137-L443 HydrophobicContact CB-CD2 3.54Å; A137-L443 HydrophobicContact CB-CG 3.97Å; Q141-L443 HydrophobicContact CB-CD2 3.83Å; Q141-L443 HydrophobicContact CG-CD2 4.42Å; N439-L443 VanDerWaalsContact O-CB 3.3Å; N439-L443 WeakPolarHBondContact O-CB 3.35Å; N439-L443 PolarHBondContact O-N 3.38Å; A441-L443 VanDerWaalsContact C-N 3.31Å; A441-L443 PolarHBondContact O-N 2.91Å; L443-Y445 VanDerWaalsContact C-N 3.31Å; L443-Y445 PolarHBondContact O-N 2.86Å; L443-V446 PolarHBondContact O-N 2.88Å; L443-M447 HydrophobicContact CD1-CG 4.17Å; L443-M447 HydrophobicContact CD1-SD 4.07Å; L443-M447 HydrophobicContact CG-SD 4.3Å; L443-M447 WeakPolarHBondContact O-CB 3.37Å; L443-M447 VanDerWaalsContact O-CG 3.32Å; L443-M447 WeakPolarHBondContact O-CG 3.37Å; L443-M447 PolarHBondContact O-N 3.44Å; L443-F457 HydrophobicContact CB-CD2 3.78Å; L443-F457 HydrophobicContact CB-CE2 3.7Å; L443-F457 HydrophobicContact CB-CG 4.34Å; L443-F457 HydrophobicContact CB-CZ 4.2Å; L443-F457 HydrophobicContact CD1-CB 3.95Å; L443-F457 HydrophobicContact CD1-CD1 3.82Å; L443-F457 HydrophobicContact CD1-CD2 3.91Å; L443-F457 HydrophobicContact CD1-CE1 4.34Å; L443-F457 HydrophobicContact CD1-CE2 4.42Å; L443-F457 HydrophobicContact CD1-CG 3.59Å; L443-F457 HydrophobicContact CG-CD2 4.45Å
444	D	88.9	Confident	91.8	Very high	65 Å²	65	51.3 Å²	51.3	35%	0.348	28%	0.276	S	S	.	.	H	α-helix	trans	-62.5	-41.1	177.9	-162.1	34.9	0	0	0	111	P263 A440 A441 C448	P263-D444 HydrophobicContact CG-CB 4.19Å; A440-D444 WeakPolarHBondContact O-CB 3.23Å; A440-D444 PolarHBondContact O-N 3.12Å; A441-D444 PolarHBondContact O-N 3.28Å; D444-C448 WeakPolarHBondContact O-CB 3.33Å; D444-C448 PolarHBondContact O-N 3.09Å; D444-C448 PolarHBondContact O-SG 3.41Å
445	Y	93.8	Very high	91.4	Very high	5 Å²	5	55.3 Å²	55.3	2%	0.02	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-53	174	-177.7	-93.7	0	0	0	112.3	F262 I266 D405 R407 E408 A441 L442 L443 M447 C448 N449 Y450	F262-Y445 AromaticContact CD1-CD2 3.94Å; F262-Y445 HydrophobicContact CD1-CD2 3.94Å; F262-Y445 AromaticContact CD1-CE2 3.51Å; F262-Y445 HydrophobicContact CD1-CE2 3.51Å; F262-Y445 AromaticContact CE1-CE2 3.82Å; F262-Y445 HydrophobicContact CE1-CE2 3.82Å; I266-Y445 HydrophobicContact CD1-CD2 4.09Å; I266-Y445 HydrophobicContact CD1-CG 3.93Å; D405-Y445 PolarHBondContact OD1-OH 3.19Å; D405-Y445 VanDerWaalsContact OD2-CE1 3.3Å; D405-Y445 WeakPolarHBondContact OD2-CE1 3.28Å; D405-Y445 PolarHBondContact OD2-OH 3.22Å; R407-Y445 HydrophobicContact CB-CD1 4.33Å; R407-Y445 HydrophobicContact CB-CD2 4.34Å; R407-Y445 HydrophobicContact CB-CE1 3.86Å; R407-Y445 HydrophobicContact CB-CE2 3.87Å; R407-Y445 HydrophobicContact CG-CD2 4.45Å; R407-Y445 HydrophobicContact CG-CE1 4.49Å; R407-Y445 HydrophobicContact CG-CE2 3.71Å; E408-Y445 HydrophobicContact CG-CD1 3.93Å; E408-Y445 HydrophobicContact CG-CE1 3.81Å; A441-Y445 WeakPolarHBondContact O-CB 3.46Å; A441-Y445 PolarHBondContact O-N 3.2Å; L442-Y445 PolarHBondContact O-N 3.46Å; L443-Y445 VanDerWaalsContact C-N 3.31Å; L443-Y445 PolarHBondContact O-N 2.86Å; Y445-M447 PolarHBondContact O-N 3.49Å; Y445-C448 PolarHBondContact O-N 3.46Å; Y445-N449 VanDerWaalsContact CD2-ND2 3.34Å; Y445-N449 WeakPolarHBondContact CD2-ND2 3.47Å; Y445-N449 HydrophobicContact CE1-CB 4.49Å; Y445-N449 WeakPolarHBondContact CE2-ND2 3.35Å; Y445-N449 WeakPolarHBondContact O-CB 3.45Å; Y445-N449 PolarHBondContact O-N 3.27Å; Y445-N449 PolarHBondContact O-ND2 2.9Å; Y445-Y450 HydrophobicContact CE1-CE2 4.08Å
446	V	91.8	Very high	91.3	Very high	4 Å²	4	54 Å²	54	2%	0.024	29%	0.291	C	S	.	.	H	α-helix	trans	-59.5	-46.4	179.6	168.8	0	0	0	0	110.9	E408 L442 L443 C448 Y450 K456 F457 L460	E408-V446 WeakPolarHBondContact OE1-CG2 3.49Å; L442-V446 HydrophobicContact CD1-CG2 4.12Å; L442-V446 WeakPolarHBondContact O-CB 3.43Å; L442-V446 VanDerWaalsContact O-CG2 3.27Å; L442-V446 WeakPolarHBondContact O-CG2 3.39Å; L442-V446 PolarHBondContact O-N 3.47Å; L443-V446 PolarHBondContact O-N 2.88Å; V446-C448 VanDerWaalsContact C-N 3.29Å; V446-C448 PolarHBondContact O-N 3.33Å; V446-Y450 CarbonylContact O-C 3.57Å; V446-Y450 WeakPolarHBondContact O-CA 3.36Å; V446-Y450 WeakPolarHBondContact O-CB 3.37Å; V446-Y450 PolarHBondContact O-N 3.14Å; V446-K456 HydrophobicContact CG1-CB 3.85Å; V446-K456 HydrophobicContact CG1-CD 4.23Å; V446-K456 HydrophobicContact CG1-CG 4.2Å; V446-F457 HydrophobicContact CB-CB 4.42Å; V446-F457 HydrophobicContact CG1-CB 4.11Å; V446-L460 HydrophobicContact CG2-CD1 4.04Å
447	M	87.8	Confident	91.4	Very high	69 Å²	69	48 Å²	48	34%	0.34	26%	0.263	S	S	.	.	H	α-helix	trans	-67.3	-27.2	-178.7	-72.7	-170.3	75.8	0	0	114.1	A137 L443 Y445	A137-M447 HydrophobicContact CB-CE 4.28Å; A137-M447 HydrophobicContact CB-SD 3.35Å; A137-M447 WeakPolarHBondContact CB-SD 3.29Å; L443-M447 HydrophobicContact CD1-CG 4.17Å; L443-M447 HydrophobicContact CD1-SD 4.07Å; L443-M447 HydrophobicContact CG-SD 4.3Å; L443-M447 WeakPolarHBondContact O-CB 3.37Å; L443-M447 VanDerWaalsContact O-CG 3.32Å; L443-M447 WeakPolarHBondContact O-CG 3.37Å; L443-M447 PolarHBondContact O-N 3.44Å; Y445-M447 PolarHBondContact O-N 3.49Å
448	C	89.3	Confident	91.1	Very high	87 Å²	87	44.8 Å²	44.8	59%	0.588	25%	0.253	S	S	*	.	H	α-helix	trans	-86.5	-38.5	178.6	-68.7	0	0	0	0	112.9	D444 Y445 V446	D444-C448 WeakPolarHBondContact O-CB 3.33Å; D444-C448 PolarHBondContact O-N 3.09Å; D444-C448 PolarHBondContact O-SG 3.41Å; Y445-C448 PolarHBondContact O-N 3.46Å; V446-C448 VanDerWaalsContact C-N 3.29Å; V446-C448 PolarHBondContact O-N 3.33Å
449	N	89.2	Confident	91	Very high	51 Å²	51	47.6 Å²	47.6	27%	0.273	27%	0.266	S	S	.	.	H	α-helix	trans	-95.2	-28.3	-174	-62.4	-84.6	0	0	0	113.1	Y445 P451	Y445-N449 VanDerWaalsContact CD2-ND2 3.34Å; Y445-N449 WeakPolarHBondContact CD2-ND2 3.47Å; Y445-N449 HydrophobicContact CE1-CB 4.49Å; Y445-N449 WeakPolarHBondContact CE2-ND2 3.35Å; Y445-N449 WeakPolarHBondContact O-CB 3.45Å; Y445-N449 PolarHBondContact O-N 3.27Å; Y445-N449 PolarHBondContact O-ND2 2.9Å; N449-P451 WeakPolarHBondContact O-CD 3.37Å
450	Y	89.1	Confident	91	Very high	47 Å²	47	47.2 Å²	47.2	18%	0.184	26%	0.264	C	S	.	.			trans	-120.8	52.3	180	-59.1	-83.8	0	0	0	112.7	D405 E408 Y445 V446 Q452 Q453 K456	D405-Y450 WeakPolarHBondContact OD2-CE2 3.43Å; D405-Y450 PolarHBondContact OD2-OH 3.39Å; E408-Y450 WeakPolarHBondContact OE1-CE2 3.4Å; Y445-Y450 HydrophobicContact CE1-CE2 4.08Å; V446-Y450 CarbonylContact O-C 3.57Å; V446-Y450 WeakPolarHBondContact O-CA 3.36Å; V446-Y450 WeakPolarHBondContact O-CB 3.37Å; V446-Y450 PolarHBondContact O-N 3.14Å; Y450-Q452 PolarHBondContact O-N 3.25Å; Y450-Q453 PolarHBondContact O-N 3.37Å; Y450-K456 HydrophobicContact CD1-CD 4.35Å; Y450-K456 HydrophobicContact CD2-CD 4.03Å; Y450-K456 VanDerWaalsContact CE2-NZ 3.29Å; Y450-K456 HydrophobicContact CG-CD 3.88Å; Y450-K456 VanDerWaalsContact CZ-NZ 3.32Å
451	P	83.8	Confident	91.2	Very high	82 Å²	82	45.8 Å²	45.8	53%	0.532	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-14.7	-172.2	28.1	-37.4	0	0	0	114.7	N449	N449-P451 WeakPolarHBondContact O-CD 3.37Å
452	Q	86.8	Confident	91.1	Very high	177 Å²	177	47.6 Å²	47.6	83%	0.827	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-24.5	174.9	-55.6	-61.6	-9.8	0	0	113	Y450 T454	Y450-Q452 PolarHBondContact O-N 3.25Å; Q452-T454 PolarHBondContact O-N 3.43Å
453	Q	87.5	Confident	91.1	Very high	50 Å²	50	49 Å²	49	23%	0.234	26%	0.264	C	S	.	.			trans	-99.3	70.1	-178.1	-56.5	-174.4	19.2	0	0	110.2	Y450 D455 K456	Y450-Q453 PolarHBondContact O-N 3.37Å; Q453-D455 PolarHBondContact O-N 3.18Å; Q453-D455 VanDerWaalsContact O-N 3.08Å; Q453-K456 HydrophobicContact CB-CB 3.8Å; Q453-K456 VanDerWaalsContact O-CB 3.32Å; Q453-K456 WeakPolarHBondContact O-CB 3.49Å; Q453-K456 PolarHBondContact O-N 2.86Å
454	T	85.1	Confident	91.3	Very high	120 Å²	120	50 Å²	50	74%	0.736	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.7	-169.2	58.4	0	0	0	0	115.6	Q452	Q452-T454 PolarHBondContact O-N 3.43Å
455	D	88.6	Confident	91.6	Very high	86 Å²	86	48.6 Å²	48.6	46%	0.46	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-7.4	175.1	68.2	-42.6	0	0	0	113.8	Q453 F457 G458 Q459	Q453-D455 PolarHBondContact O-N 3.18Å; Q453-D455 VanDerWaalsContact O-N 3.08Å; D455-F457 VanDerWaalsContact C-N 3.26Å; D455-F457 PolarHBondContact O-N 3.36Å; D455-F457 VanDerWaalsContact O-N 3.1Å; D455-G458 WeakPolarHBondContact O-CA 3.49Å; D455-G458 PolarHBondContact O-N 3.41Å; D455-Q459 HydrophobicContact CB-CG 4.4Å; D455-Q459 PolarHBondContact O-N 3.11Å; D455-Q459 WeakPolarHBondContact OD2-CG 3.44Å; D455-Q459 PolarHBondContact OD2-NE2 2.95Å
456	K	94	Very high	91.6	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-48.5	-44.8	-174.3	-176.9	-178.7	-173.7	-179.5	0	112.8	L402 Q403 E408 V446 Y450 Q453 G458 Q459 L460	L402-K456 WeakPolarHBondContact O-CE 3.46Å; L402-K456 PolarHBondContact O-NZ 3.16Å; L402-K456 VanDerWaalsContact O-NZ 3.15Å; Q403-K456 PolarHBondContact O-NZ 3.17Å; E408-K456 VanDerWaalsContact CD-CE 3.45Å; E408-K456 WeakPolarHBondContact OE1-CE 3.35Å; E408-K456 IonicContact OE1-NZ 2.73Å; E408-K456 PolarHBondContact OE1-NZ 2.95Å; E408-K456 WeakPolarHBondContact OE2-CE 3.32Å; E408-K456 IonicContact OE2-NZ 2.75Å; E408-K456 PolarHBondContact OE2-NZ 2.99Å; V446-K456 HydrophobicContact CG1-CB 3.85Å; V446-K456 HydrophobicContact CG1-CD 4.23Å; V446-K456 HydrophobicContact CG1-CG 4.2Å; Y450-K456 HydrophobicContact CD1-CD 4.35Å; Y450-K456 HydrophobicContact CD2-CD 4.03Å; Y450-K456 VanDerWaalsContact CE2-NZ 3.29Å; Y450-K456 HydrophobicContact CG-CD 3.88Å; Y450-K456 VanDerWaalsContact CZ-NZ 3.32Å; Q453-K456 HydrophobicContact CB-CB 3.8Å; Q453-K456 VanDerWaalsContact O-CB 3.32Å; Q453-K456 WeakPolarHBondContact O-CB 3.49Å; Q453-K456 PolarHBondContact O-N 2.86Å; K456-G458 VanDerWaalsContact C-N 3.35Å; K456-G458 PolarHBondContact O-N 2.99Å; K456-Q459 WeakPolarHBondContact O-CB 3.4Å; K456-Q459 PolarHBondContact O-N 3.29Å; K456-Q459 VanDerWaalsContact O-N 3.16Å; K456-L460 HydrophobicContact CG-CD1 4.11Å; K456-L460 HydrophobicContact CG-CG 4.19Å; K456-L460 VanDerWaalsContact O-CG 3.31Å; K456-L460 WeakPolarHBondContact O-CG 3.43Å; K456-L460 PolarHBondContact O-N 3.32Å
457	F	94.7	Very high	91.9	Very high	11 Å²	11	50.4 Å²	50.4	5%	0.048	27%	0.272	C	S	.	.	H	α-helix	trans	-56.5	-46.9	178	175	-94.9	0	0	0	112.3	Q141 N439 L442 L443 V446 D455 L460 L461	Q141-F457 HydrophobicContact CB-CE1 3.88Å; Q141-F457 HydrophobicContact CB-CZ 4.37Å; Q141-F457 HydrophobicContact CG-CE1 3.82Å; Q141-F457 HydrophobicContact CG-CZ 3.89Å; N439-F457 WeakPolarHBondContact O-CE2 3.43Å; L442-F457 HydrophobicContact CB-CE2 4.15Å; L442-F457 HydrophobicContact CD2-CD2 4.3Å; L442-F457 HydrophobicContact CD2-CE2 4.05Å; L442-F457 HydrophobicContact CG-CD2 3.99Å; L442-F457 HydrophobicContact CG-CE2 3.96Å; L443-F457 HydrophobicContact CB-CD2 3.78Å; L443-F457 HydrophobicContact CB-CE2 3.7Å; L443-F457 HydrophobicContact CB-CG 4.34Å; L443-F457 HydrophobicContact CB-CZ 4.2Å; L443-F457 HydrophobicContact CD1-CB 3.95Å; L443-F457 HydrophobicContact CD1-CD1 3.82Å; L443-F457 HydrophobicContact CD1-CD2 3.91Å; L443-F457 HydrophobicContact CD1-CE1 4.34Å; L443-F457 HydrophobicContact CD1-CE2 4.42Å; L443-F457 HydrophobicContact CD1-CG 3.59Å; L443-F457 HydrophobicContact CG-CD2 4.45Å; V446-F457 HydrophobicContact CB-CB 4.42Å; V446-F457 HydrophobicContact CG1-CB 4.11Å; D455-F457 VanDerWaalsContact C-N 3.26Å; D455-F457 PolarHBondContact O-N 3.36Å; D455-F457 VanDerWaalsContact O-N 3.1Å; F457-L460 PolarHBondContact O-N 2.89Å; F457-L461 HydrophobicContact CD1-CD1 4.36Å; F457-L461 HydrophobicContact CE1-CD1 3.55Å; F457-L461 HydrophobicContact CE1-CG 4.33Å; F457-L461 HydrophobicContact CE2-CD1 4.45Å; F457-L461 HydrophobicContact CZ-CD1 3.61Å; F457-L461 HydrophobicContact CZ-CG 4.24Å; F457-L461 PolarHBondContact O-N 2.83Å
458	G	90.9	Very high	92.3	Very high	17 Å²	17	49.7 Å²	49.7	18%	0.175	27%	0.265	C	S	.	.	H	α-helix	trans	-67	-41.2	176.5	0	0	0	0	0	111.8	D455 K456 L460 L461 L462	D455-G458 WeakPolarHBondContact O-CA 3.49Å; D455-G458 PolarHBondContact O-N 3.41Å; K456-G458 VanDerWaalsContact C-N 3.35Å; K456-G458 PolarHBondContact O-N 2.99Å; G458-L460 VanDerWaalsContact C-N 3.33Å; G458-L460 PolarHBondContact O-N 3.08Å; G458-L461 PolarHBondContact O-N 2.77Å; G458-L462 VanDerWaalsContact O-CG 3.31Å; G458-L462 WeakPolarHBondContact O-CG 3.22Å; G458-L462 PolarHBondContact O-N 3.4Å
459	Q	94.8	Very high	92.6	Very high	60 Å²	60	47.2 Å²	47.2	28%	0.28	25%	0.252	S	S	.	.	H	α-helix	trans	-61.3	-38.4	176.7	-65.1	-70.3	1.6	0	0	112.7	L402 D455 K456 L462 R463	L402-Q459 HydrophobicContact CD1-CB 3.93Å; L402-Q459 HydrophobicContact CD2-CB 3.57Å; L402-Q459 HydrophobicContact CD2-CG 4.05Å; L402-Q459 HydrophobicContact CG-CB 4.43Å; D455-Q459 HydrophobicContact CB-CG 4.4Å; D455-Q459 PolarHBondContact O-N 3.11Å; D455-Q459 WeakPolarHBondContact OD2-CG 3.44Å; D455-Q459 PolarHBondContact OD2-NE2 2.95Å; K456-Q459 WeakPolarHBondContact O-CB 3.4Å; K456-Q459 PolarHBondContact O-N 3.29Å; K456-Q459 VanDerWaalsContact O-N 3.16Å; Q459-L462 PolarHBondContact O-N 2.78Å; Q459-R463 WeakPolarHBondContact O-CG 3.46Å; Q459-R463 PolarHBondContact O-N 3.27Å; Q459-R463 PolarHBondContact O-NH1 3.02Å
460	L	96.6	Very high	93	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.5	-47.7	175.6	-72.5	172.8	0	0	0	111.3	L399 L402 L404 E408 L442 V446 K456 F457 G458 L462 R463	L399-L460 HydrophobicContact CD2-CD2 4.47Å; L402-L460 HydrophobicContact CD1-CD2 4.37Å; L404-L460 HydrophobicContact CD1-CD2 3.63Å; E408-L460 HydrophobicContact CB-CD1 4.23Å; E408-L460 HydrophobicContact CG-CD1 4.24Å; L442-L460 HydrophobicContact CD1-CD1 4.39Å; V446-L460 HydrophobicContact CG2-CD1 4.04Å; K456-L460 HydrophobicContact CG-CD1 4.11Å; K456-L460 HydrophobicContact CG-CG 4.19Å; K456-L460 VanDerWaalsContact O-CG 3.31Å; K456-L460 WeakPolarHBondContact O-CG 3.43Å; K456-L460 PolarHBondContact O-N 3.32Å; F457-L460 PolarHBondContact O-N 2.89Å; G458-L460 VanDerWaalsContact C-N 3.33Å; G458-L460 PolarHBondContact O-N 3.08Å; L460-L462 VanDerWaalsContact C-N 3.28Å; L460-L462 PolarHBondContact O-N 3.31Å; L460-R463 WeakPolarHBondContact O-CB 3.43Å; L460-R463 PolarHBondContact O-N 3.26Å
461	L	95.9	Very high	93.4	Very high	10 Å²	10	43 Å²	43	5%	0.052	23%	0.232	C	C	.	.	H	α-helix	trans	-62.9	-34.5	177.3	-65.1	-174.2	0	0	0	112.5	L415 F457 G458 R463 L464 P465	L415-L461 HydrophobicContact CD1-CD2 3.66Å; F457-L461 HydrophobicContact CD1-CD1 4.36Å; F457-L461 HydrophobicContact CE1-CD1 3.55Å; F457-L461 HydrophobicContact CE1-CG 4.33Å; F457-L461 HydrophobicContact CE2-CD1 4.45Å; F457-L461 HydrophobicContact CZ-CD1 3.61Å; F457-L461 HydrophobicContact CZ-CG 4.24Å; F457-L461 PolarHBondContact O-N 2.83Å; G458-L461 PolarHBondContact O-N 2.77Å; L461-R463 PolarHBondContact O-N 3.39Å; L461-L464 HydrophobicContact CD2-CD1 4.17Å; L461-L464 WeakPolarHBondContact O-CB 3.45Å; L461-L464 PolarHBondContact O-N 3.44Å; L461-L464 VanDerWaalsContact O-N 3.11Å; L461-P465 WeakPolarHBondContact O-CD 3.2Å
462	L	94.8	Very high	93.9	Very high	48 Å²	48	42.3 Å²	42.3	25%	0.251	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-10.2	175.2	-70.8	173.6	0	0	0	114.1	A148 L151 G458 Q459 L460	A148-L462 HydrophobicContact CB-CD2 4.23Å; L151-L462 HydrophobicContact CD1-CD2 3.6Å; G458-L462 VanDerWaalsContact O-CG 3.31Å; G458-L462 WeakPolarHBondContact O-CG 3.22Å; G458-L462 PolarHBondContact O-N 3.4Å; Q459-L462 PolarHBondContact O-N 2.78Å; L460-L462 VanDerWaalsContact C-N 3.28Å; L460-L462 PolarHBondContact O-N 3.31Å
463	R	96.9	Very high	94.3	Very high	29 Å²	29	36.9 Å²	36.9	11%	0.109	20%	0.198	C	C	.	.	H	α-helix	trans	-83	-20.2	171.4	-53.7	-65.2	78.1	92	-14.1	112.8	L395 L399 L402 Q459 L460 L461 E466 I467	L395-R463 HydrophobicContact CD1-CB 4.06Å; L395-R463 HydrophobicContact CD1-CG 4.3Å; L399-R463 HydrophobicContact CD2-CB 4.3Å; L399-R463 HydrophobicContact CD2-CG 3.75Å; L399-R463 HydrophobicContact CG-CG 4.44Å; L402-R463 HydrophobicContact CD1-CG 4.37Å; Q459-R463 WeakPolarHBondContact O-CG 3.46Å; Q459-R463 PolarHBondContact O-N 3.27Å; Q459-R463 PolarHBondContact O-NH1 3.02Å; L460-R463 WeakPolarHBondContact O-CB 3.43Å; L460-R463 PolarHBondContact O-N 3.26Å; L461-R463 PolarHBondContact O-N 3.39Å; R463-E466 IonicContact CZ-OE1 3.35Å; R463-E466 IonicContact NE-OE1 2.64Å; R463-E466 PolarHBondContact NE-OE1 3.37Å; R463-E466 IonicContact NH2-OE1 2.89Å; R463-E466 PolarHBondContact NH2-OE1 2.97Å; R463-E466 PolarHBondContact O-N 2.84Å; R463-I467 WeakPolarHBondContact O-CG1 3.42Å; R463-I467 PolarHBondContact O-N 2.91Å
464	L	96.4	Very high	94.6	Very high	31 Å²	31	35.8 Å²	35.8	16%	0.162	20%	0.197	C	C	.	.	H	α-helix	trans	-62.5	-44	178.9	-62.3	177.2	0	0	0	112.6	L412 L415 V416 L461 E466 I467 R468	L412-L464 HydrophobicContact CB-CD2 4.29Å; L412-L464 HydrophobicContact CD2-CD1 4.29Å; L412-L464 HydrophobicContact CD2-CD2 3.94Å; L412-L464 HydrophobicContact CD2-CG 4.16Å; L415-L464 HydrophobicContact CB-CD1 4.24Å; L415-L464 HydrophobicContact CD1-CD1 4.45Å; V416-L464 HydrophobicContact CG2-CD2 3.71Å; L461-L464 HydrophobicContact CD2-CD1 4.17Å; L461-L464 WeakPolarHBondContact O-CB 3.45Å; L461-L464 PolarHBondContact O-N 3.44Å; L461-L464 VanDerWaalsContact O-N 3.11Å; L464-E466 VanDerWaalsContact C-N 3.31Å; L464-E466 PolarHBondContact O-N 3.37Å; L464-I467 HydrophobicContact CD2-CD1 4.16Å; L464-I467 PolarHBondContact O-N 3.26Å; L464-R468 PolarHBondContact O-N 2.94Å
465	P	95.4	Very high	95	Very high	36 Å²	36	30.5 Å²	30.5	23%	0.234	17%	0.165	C	C	.	.	H	α-helix	trans	-60.9	-35	171.4	-24.9	35.4	0	0	0	114	L461 R468 A469	L461-P465 WeakPolarHBondContact O-CD 3.2Å; P465-R468 PolarHBondContact O-N 3.15Å; P465-A469 WeakPolarHBondContact O-CB 3.29Å; P465-A469 PolarHBondContact O-N 3.09Å
466	E	95.5	Very high	95.2	Very high	46 Å²	46	31.7 Å²	31.7	22%	0.215	17%	0.167	C	C	.	.	H	α-helix	trans	-68.1	-42.4	177.2	-67	179	-122.4	0	0	111.5	L395 K398 R463 L464 R468 A469 I470	L395-E466 HydrophobicContact CD1-CB 4.29Å; K398-E466 WeakPolarHBondContact CD-OE2 3.31Å; K398-E466 IonicContact NZ-OE2 3.16Å; K398-E466 PolarHBondContact NZ-OE2 3.35Å; R463-E466 IonicContact CZ-OE1 3.35Å; R463-E466 IonicContact NE-OE1 2.64Å; R463-E466 PolarHBondContact NE-OE1 3.37Å; R463-E466 IonicContact NH2-OE1 2.89Å; R463-E466 PolarHBondContact NH2-OE1 2.97Å; R463-E466 PolarHBondContact O-N 2.84Å; L464-E466 VanDerWaalsContact C-N 3.31Å; L464-E466 PolarHBondContact O-N 3.37Å; E466-R468 VanDerWaalsContact C-N 3.32Å; E466-R468 PolarHBondContact O-N 3.32Å; E466-A469 PolarHBondContact O-N 3.19Å; E466-I470 WeakPolarHBondContact O-CG1 3.45Å; E466-I470 PolarHBondContact O-N 3.27Å; E466-I470 VanDerWaalsContact O-N 3.1Å
467	I	97.7	Very high	95	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-57.1	-46.8	172.7	-68.9	158.5	0	0	0	110.4	E345 I348 L349 L395 R463 L464 I470 S471	E345-I467 HydrophobicContact CB-CG2 4.24Å; I348-I467 HydrophobicContact CB-CG2 4.47Å; I348-I467 HydrophobicContact CG2-CG2 4.23Å; L349-I467 HydrophobicContact CB-CG2 4.4Å; L349-I467 HydrophobicContact CD1-CD1 3.9Å; L395-I467 HydrophobicContact CD2-CG1 3.66Å; R463-I467 WeakPolarHBondContact O-CG1 3.42Å; R463-I467 PolarHBondContact O-N 2.91Å; L464-I467 HydrophobicContact CD2-CD1 4.16Å; L464-I467 PolarHBondContact O-N 3.26Å; I467-I470 PolarHBondContact O-N 2.77Å; I467-S471 WeakPolarHBondContact O-CB 3.4Å; I467-S471 PolarHBondContact O-N 3.25Å
468	R	96.5	Very high	94.9	Very high	53 Å²	53	33.7 Å²	33.7	20%	0.2	18%	0.176	C	C	.	.	H	α-helix	trans	-66.5	-35.8	179.3	-176.3	167.9	174.5	165.7	-2.1	113.6	E345 D421 L464 P465 E466 S471 L472	E345-R468 HydrophobicContact CG-CB 4.29Å; E345-R468 HydrophobicContact CG-CG 4.42Å; E345-R468 IonicContact OE1-NE 2.68Å; D421-R468 IonicContact OD2-CZ 2.68Å; D421-R468 IonicContact OD2-NH1 2.66Å; D421-R468 PolarHBondContact OD2-NH1 3.26Å; D421-R468 IonicContact OD2-NH2 2.64Å; L464-R468 PolarHBondContact O-N 2.94Å; P465-R468 PolarHBondContact O-N 3.15Å; E466-R468 VanDerWaalsContact C-N 3.32Å; E466-R468 PolarHBondContact O-N 3.32Å; R468-S471 WeakPolarHBondContact CA-OG 3.34Å; R468-S471 PolarHBondContact O-N 3.07Å; R468-S471 PolarHBondContact O-OG 3.36Å; R468-S471 VanDerWaalsContact O-OG 3.06Å; R468-L472 HydrophobicContact CG-CD1 4.2Å; R468-L472 HydrophobicContact CG-CG 4.48Å; R468-L472 WeakPolarHBondContact O-CB 3.36Å; R468-L472 VanDerWaalsContact O-CG 3.25Å; R468-L472 WeakPolarHBondContact O-CG 3.35Å; R468-L472 PolarHBondContact O-N 2.99Å
469	A	95.7	Very high	94.9	Very high	36 Å²	36	36.2 Å²	36.2	30%	0.298	18%	0.181	S	C	.	.	H	α-helix	trans	-63.6	-43.5	174.1	0	0	0	0	0	111.4	P465 E466 Q473	P465-A469 WeakPolarHBondContact O-CB 3.29Å; P465-A469 PolarHBondContact O-N 3.09Å; E466-A469 PolarHBondContact O-N 3.19Å; A469-Q473 WeakPolarHBondContact O-CG 3.2Å; A469-Q473 PolarHBondContact O-N 3.32Å
470	I	97.1	Very high	94.6	Very high	9 Å²	9	40 Å²	40	5%	0.046	19%	0.193	C	C	.	.	H	α-helix	trans	-66.3	-41.5	175.9	-64	166	0	0	0	110.8	I348 L388 H391 L395 E466 I467 Q473 A474	I348-I470 HydrophobicContact CD1-CG2 4.11Å; I348-I470 HydrophobicContact CG1-CG2 4.36Å; I348-I470 HydrophobicContact CG2-CB 4.31Å; I348-I470 HydrophobicContact CG2-CG2 3.92Å; L388-I470 HydrophobicContact CD2-CG2 4.18Å; H391-I470 HydrophobicContact CB-CD1 4.11Å; H391-I470 HydrophobicContact CB-CG1 3.98Å; L395-I470 HydrophobicContact CB-CD1 4.32Å; L395-I470 HydrophobicContact CD2-CD1 3.85Å; E466-I470 WeakPolarHBondContact O-CG1 3.45Å; E466-I470 PolarHBondContact O-N 3.27Å; E466-I470 VanDerWaalsContact O-N 3.1Å; I467-I470 PolarHBondContact O-N 2.77Å; I470-Q473 PolarHBondContact O-N 3.41Å; I470-A474 WeakPolarHBondContact O-CB 3.46Å; I470-A474 PolarHBondContact O-N 3.32Å
471	S	96.9	Very high	94.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.7	-39.7	-179.5	79.5	0	0	0	0	112.4	E345 I467 R468 A474 E475	E345-S471 VanDerWaalsContact CG-OG 3.25Å; E345-S471 WeakPolarHBondContact CG-OG 3.42Å; I467-S471 WeakPolarHBondContact O-CB 3.4Å; I467-S471 PolarHBondContact O-N 3.25Å; R468-S471 WeakPolarHBondContact CA-OG 3.34Å; R468-S471 PolarHBondContact O-N 3.07Å; R468-S471 PolarHBondContact O-OG 3.36Å; R468-S471 VanDerWaalsContact O-OG 3.06Å; S471-A474 PolarHBondContact O-N 3.11Å; S471-E475 WeakPolarHBondContact O-CG 3.49Å; S471-E475 PolarHBondContact O-N 3.34Å
472	L	94.9	Very high	93.9	Very high	67 Å²	67	43.6 Å²	43.6	35%	0.351	21%	0.209	S	C	.	.	H	α-helix	trans	-62.8	-45.7	175.4	-72.4	169.3	0	0	0	111.7	R468 A474 E475 E476	R468-L472 HydrophobicContact CG-CD1 4.2Å; R468-L472 HydrophobicContact CG-CG 4.48Å; R468-L472 WeakPolarHBondContact O-CB 3.36Å; R468-L472 VanDerWaalsContact O-CG 3.25Å; R468-L472 WeakPolarHBondContact O-CG 3.35Å; R468-L472 PolarHBondContact O-N 2.99Å; L472-A474 VanDerWaalsContact C-N 3.28Å; L472-A474 PolarHBondContact O-N 2.93Å; L472-E475 WeakPolarHBondContact O-CB 3.48Å; L472-E475 PolarHBondContact O-N 3.06Å; L472-E476 WeakPolarHBondContact O-CG 3.25Å; L472-E476 PolarHBondContact O-N 3.15Å
473	Q	94.8	Very high	93.5	Very high	63 Å²	63	46.6 Å²	46.6	29%	0.294	23%	0.225	S	C	.	.	H	α-helix	trans	-61.8	-36.3	174.7	-70	174.5	11.8	0	0	111.8	L388 H391 A469 I470 Y477	L388-Q473 HydrophobicContact CD2-CB 3.52Å; L388-Q473 HydrophobicContact CG-CB 4.47Å; H391-Q473 PolarHBondContact ND1-OE1 3.49Å; A469-Q473 WeakPolarHBondContact O-CG 3.2Å; A469-Q473 PolarHBondContact O-N 3.32Å; I470-Q473 PolarHBondContact O-N 3.41Å; Q473-Y477 WeakPolarHBondContact O-CB 3.33Å; Q473-Y477 PolarHBondContact O-N 3.45Å
474	A	94.6	Very high	93	Very high	27 Å²	27	49.5 Å²	49.5	22%	0.223	24%	0.242	C	C	.	.	H	α-helix	trans	-70	-38.6	176	0	0	0	0	0	112.5	I348 L388 I470 S471 L472 Y477 L478	I348-A474 HydrophobicContact CD1-CB 4.43Å; L388-A474 HydrophobicContact CD1-CB 4.38Å; L388-A474 HydrophobicContact CD2-CB 4.28Å; I470-A474 WeakPolarHBondContact O-CB 3.46Å; I470-A474 PolarHBondContact O-N 3.32Å; S471-A474 PolarHBondContact O-N 3.11Å; L472-A474 VanDerWaalsContact C-N 3.28Å; L472-A474 PolarHBondContact O-N 2.93Å; A474-Y477 PolarHBondContact O-N 2.59Å; A474-L478 VanDerWaalsContact O-CB 3.28Å; A474-L478 WeakPolarHBondContact O-CB 3.4Å; A474-L478 PolarHBondContact O-N 3.42Å
475	E	93.4	Very high	92.3	Very high	10 Å²	10	50.9 Å²	50.9	5%	0.047	27%	0.265	C	S	.	.	H	α-helix	trans	-62.9	-43.2	172.8	-74.9	167.9	-133.1	0	0	112	W343 S344 S471 L472 L478 Y479 L497 K500	W343-E475 HydrophobicContact CH2-CG 4.22Å; W343-E475 HydrophobicContact CZ2-CG 4.01Å; S344-E475 VanDerWaalsContact CB-OE1 3.3Å; S344-E475 WeakPolarHBondContact CB-OE1 3.15Å; S344-E475 PolarHBondContact OG-OE1 3.32Å; S471-E475 WeakPolarHBondContact O-CG 3.49Å; S471-E475 PolarHBondContact O-N 3.34Å; L472-E475 WeakPolarHBondContact O-CB 3.48Å; L472-E475 PolarHBondContact O-N 3.06Å; E475-L478 PolarHBondContact O-N 3.13Å; E475-Y479 VanDerWaalsContact O-CB 3.23Å; E475-Y479 WeakPolarHBondContact O-CB 3.47Å; E475-Y479 PolarHBondContact O-N 3.5Å; E475-L497 HydrophobicContact CB-CD1 4.29Å; E475-K500 IonicContact OE1-NZ 3.96Å; E475-K500 PolarHBondContact OE1-NZ 2.96Å; E475-K500 WeakPolarHBondContact OE2-CD 3.34Å; E475-K500 WeakPolarHBondContact OE2-CE 3.16Å; E475-K500 IonicContact OE2-NZ 3.11Å; E475-K500 PolarHBondContact OE2-NZ 3.15Å
476	E	91.1	Very high	91.5	Very high	111 Å²	111	52.2 Å²	52.2	52%	0.519	27%	0.27	S	S	.	.	H	α-helix	trans	-64.2	-44.6	175.8	-73	-178.3	160.3	0	0	112	L472 Y479 Y480	L472-E476 WeakPolarHBondContact O-CG 3.25Å; L472-E476 PolarHBondContact O-N 3.15Å; E476-Y479 PolarHBondContact O-N 3.28Å; E476-Y480 WeakPolarHBondContact O-CB 3.46Å; E476-Y480 PolarHBondContact O-N 3.17Å
477	Y	91.3	Very high	90.7	Very high	34 Å²	34	50.2 Å²	50.2	13%	0.133	26%	0.261	C	S	.	.	H	α-helix	trans	-62.5	-43.7	175.7	178.2	-110.5	0	0	0	112.2	F303 T384 L385 L388 Q473 A474 K481	F303-Y477 HydrophobicContact CD2-CE1 4.32Å; F303-Y477 AromaticContact CE2-CE1 3.8Å; F303-Y477 HydrophobicContact CE2-CE1 3.8Å; T384-Y477 HydrophobicContact CG2-CD2 3.64Å; T384-Y477 HydrophobicContact CG2-CE2 4.41Å; T384-Y477 HydrophobicContact CG2-CG 4.09Å; L385-Y477 HydrophobicContact CB-CE1 4.34Å; L388-Y477 HydrophobicContact CD1-CD1 4.44Å; L388-Y477 HydrophobicContact CD1-CG 4.45Å; Q473-Y477 WeakPolarHBondContact O-CB 3.33Å; Q473-Y477 PolarHBondContact O-N 3.45Å; A474-Y477 PolarHBondContact O-N 2.59Å; Y477-K481 HydrophobicContact CE1-CG 4.34Å; Y477-K481 HydrophobicContact CE2-CG 4.15Å; Y477-K481 WeakPolarHBondContact O-CB 3.4Å; Y477-K481 WeakPolarHBondContact O-CG 3.27Å; Y477-K481 PolarHBondContact O-N 2.83Å; Y477-K481 WeakPolarHBondContact OH-CE 3.45Å
478	L	91.9	Very high	89.5	Confident	18 Å²	18	51.3 Å²	51.3	9%	0.094	27%	0.268	C	S	.	.	H	α-helix	trans	-64	-40.9	175.9	-177.1	66.5	0	0	0	111.6	F303 W343 A474 E475 K481 H482 V487 L493 L497	F303-L478 HydrophobicContact CZ-CD1 4.17Å; W343-L478 HydrophobicContact CH2-CD2 4.07Å; A474-L478 VanDerWaalsContact O-CB 3.28Å; A474-L478 WeakPolarHBondContact O-CB 3.4Å; A474-L478 PolarHBondContact O-N 3.42Å; E475-L478 PolarHBondContact O-N 3.13Å; L478-K481 PolarHBondContact O-N 3.42Å; L478-H482 WeakPolarHBondContact O-CB 3.35Å; L478-H482 PolarHBondContact O-N 2.88Å; L478-V487 HydrophobicContact CD1-CG1 4.28Å; L478-V487 HydrophobicContact CD1-CG2 3.81Å; L478-L493 HydrophobicContact CD1-CD2 4.34Å; L478-L493 HydrophobicContact CD2-CD1 3.87Å; L478-L493 HydrophobicContact CD2-CD2 4.13Å; L478-L493 HydrophobicContact CD2-CG 3.93Å; L478-L497 HydrophobicContact CB-CD2 4.48Å; L478-L497 HydrophobicContact CD2-CD1 4.38Å; L478-L497 HydrophobicContact CD2-CD2 3.97Å; L478-L497 HydrophobicContact CG-CD2 3.89Å
479	Y	90.6	Very high	88.2	Confident	70 Å²	70	53 Å²	53	28%	0.275	29%	0.287	S	S	.	.	H	α-helix	trans	-67	-44.5	177.6	-175.4	-108.4	0	0	0	112.3	E475 E476 K481 H482 L483 L497	E475-Y479 VanDerWaalsContact O-CB 3.23Å; E475-Y479 WeakPolarHBondContact O-CB 3.47Å; E475-Y479 PolarHBondContact O-N 3.5Å; E476-Y479 PolarHBondContact O-N 3.28Å; Y479-K481 VanDerWaalsContact C-N 3.28Å; Y479-K481 PolarHBondContact O-N 3.14Å; Y479-H482 WeakPolarHBondContact O-CB 3.5Å; Y479-H482 PolarHBondContact O-N 3.39Å; Y479-H482 VanDerWaalsContact O-N 3.15Å; Y479-L483 HydrophobicContact CD1-CD1 4.08Å; Y479-L483 HydrophobicContact CD1-CG 4.45Å; Y479-L483 HydrophobicContact CE1-CD1 3.59Å; Y479-L483 HydrophobicContact CE1-CG 4.1Å; Y479-L483 HydrophobicContact CE2-CD2 4.46Å; Y479-L483 WeakPolarHBondContact O-CG 3.34Å; Y479-L483 PolarHBondContact O-N 3.18Å; Y479-L497 HydrophobicContact CD2-CD2 4.25Å; Y479-L497 HydrophobicContact CD2-CG 4.44Å
480	Y	89.7	Confident	87.1	Confident	140 Å²	140	58.9 Å²	58.9	55%	0.549	31%	0.313	S	S	.	.	H	α-helix	trans	-56.2	-44.1	171.4	173	-99.5	0	0	0	111.3	E476 L483 N484	E476-Y480 WeakPolarHBondContact O-CB 3.46Å; E476-Y480 PolarHBondContact O-N 3.17Å; Y480-L483 PolarHBondContact O-N 3.1Å; Y480-N484 WeakPolarHBondContact CE1-ND2 3.31Å; Y480-N484 WeakPolarHBondContact CE2-ND2 3.41Å; Y480-N484 VanDerWaalsContact CZ-ND2 3.26Å; Y480-N484 PolarHBondContact O-N 3.33Å; Y480-N484 PolarHBondContact O-ND2 3.23Å
481	K	88.3	Confident	86.5	Confident	47 Å²	47	59 Å²	59	20%	0.204	31%	0.314	C	S	.	.	H	α-helix	trans	-65.9	-37.8	176.2	-77.2	-71.9	178.9	-168.1	0	113.1	F303 Y477 L478 Y479 N484 G485 D486 V487	F303-K481 HydrophobicContact CE1-CB 3.68Å; F303-K481 HydrophobicContact CE1-CD 4.08Å; F303-K481 HydrophobicContact CE1-CG 3.95Å; F303-K481 HydrophobicContact CE2-CB 4.32Å; F303-K481 HydrophobicContact CE2-CG 4Å; F303-K481 HydrophobicContact CZ-CB 3.39Å; F303-K481 HydrophobicContact CZ-CD 4.13Å; F303-K481 HydrophobicContact CZ-CG 3.53Å; Y477-K481 HydrophobicContact CE1-CG 4.34Å; Y477-K481 HydrophobicContact CE2-CG 4.15Å; Y477-K481 WeakPolarHBondContact O-CB 3.4Å; Y477-K481 WeakPolarHBondContact O-CG 3.27Å; Y477-K481 PolarHBondContact O-N 2.83Å; Y477-K481 WeakPolarHBondContact OH-CE 3.45Å; L478-K481 PolarHBondContact O-N 3.42Å; Y479-K481 VanDerWaalsContact C-N 3.28Å; Y479-K481 PolarHBondContact O-N 3.14Å; K481-N484 PolarHBondContact O-N 3.29Å; K481-G485 PolarHBondContact O-N 2.96Å; K481-D486 HydrophobicContact CB-CB 4.26Å; K481-D486 HydrophobicContact CD-CB 3.78Å; K481-D486 WeakPolarHBondContact CD-OD2 3.38Å; K481-D486 WeakPolarHBondContact CE-OD2 3.29Å; K481-D486 IonicContact NZ-OD2 2.82Å; K481-D486 PolarHBondContact NZ-OD2 3.13Å; K481-D486 WeakPolarHBondContact O-CB 3.46Å; K481-D486 PolarHBondContact O-N 3.46Å; K481-V487 HydrophobicContact CB-CG2 3.84Å
482	H	87.8	Confident	86.2	Confident	38 Å²	38	60.5 Å²	60.5	18%	0.176	32%	0.322	C	S	.	.	H	α-helix	trans	-63.8	-44.3	175.3	174.7	66.7	0	0	0	112	L478 Y479 N484 G485 V487 I494 H498	L478-H482 WeakPolarHBondContact O-CB 3.35Å; L478-H482 PolarHBondContact O-N 2.88Å; Y479-H482 WeakPolarHBondContact O-CB 3.5Å; Y479-H482 PolarHBondContact O-N 3.39Å; Y479-H482 VanDerWaalsContact O-N 3.15Å; H482-N484 PolarHBondContact O-N 2.92Å; H482-G485 PolarHBondContact O-N 3.45Å; H482-V487 HydrophobicContact CB-CB 4.15Å; H482-V487 HydrophobicContact CB-CG2 3.95Å; H482-I494 HydrophobicContact CB-CD1 4.05Å; H482-I494 WeakPolarHBondContact ND1-CD1 3.43Å; H482-H498 AromaticContact CD2-CE1 3.88Å; H482-H498 AromaticContact NE2-CE1 3.44Å; H482-H498 PolarHBondContact NE2-CE1 3.3Å; H482-H498 AromaticContact NE2-NE2 3.44Å; H482-H498 PolarHBondContact NE2-NE2 2.9Å
483	L	86.6	Confident	86.1	Confident	112 Å²	112	57.4 Å²	57.4	59%	0.586	31%	0.306	S	S	*	.	H	α-helix	trans	-61.2	-29.7	176	-69.7	180	0	0	0	113.5	Y479 Y480 G485	Y479-L483 HydrophobicContact CD1-CD1 4.08Å; Y479-L483 HydrophobicContact CD1-CG 4.45Å; Y479-L483 HydrophobicContact CE1-CD1 3.59Å; Y479-L483 HydrophobicContact CE1-CG 4.1Å; Y479-L483 HydrophobicContact CE2-CD2 4.46Å; Y479-L483 WeakPolarHBondContact O-CG 3.34Å; Y479-L483 PolarHBondContact O-N 3.18Å; Y480-L483 PolarHBondContact O-N 3.1Å; L483-G485 VanDerWaalsContact C-N 3.28Å
484	N	86.6	Confident	85.9	Confident	89 Å²	89	54.9 Å²	54.9	48%	0.476	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-2	174.7	-73.5	-69.9	0	0	0	113.7	Y480 K481 H482 D486	Y480-N484 WeakPolarHBondContact CE1-ND2 3.31Å; Y480-N484 WeakPolarHBondContact CE2-ND2 3.41Å; Y480-N484 VanDerWaalsContact CZ-ND2 3.26Å; Y480-N484 PolarHBondContact O-N 3.33Å; Y480-N484 PolarHBondContact O-ND2 3.23Å; K481-N484 PolarHBondContact O-N 3.29Å; H482-N484 PolarHBondContact O-N 2.92Å; N484-D486 VanDerWaalsContact C-N 3.3Å; N484-D486 PolarHBondContact O-N 3.37Å
485	G	81.6	Confident	85.8	Confident	61 Å²	61	59.4 Å²	59.4	63%	0.629	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	8.5	-176.2	0	0	0	0	0	115	K481 H482 L483 V487	K481-G485 PolarHBondContact O-N 2.96Å; H482-G485 PolarHBondContact O-N 3.45Å; L483-G485 VanDerWaalsContact C-N 3.28Å; G485-V487 VanDerWaalsContact C-N 3.34Å
486	D	78.8	Confident	85.8	Confident	63 Å²	63	59.9 Å²	59.9	34%	0.337	31%	0.313	S	S	.	.			trans	-76	-19.2	-178.9	-78.2	-29	0	0	0	113.3	F303 K481 N484	F303-D486 HydrophobicContact CD1-CB 4.22Å; F303-D486 HydrophobicContact CE1-CB 4.02Å; K481-D486 HydrophobicContact CB-CB 4.26Å; K481-D486 HydrophobicContact CD-CB 3.78Å; K481-D486 WeakPolarHBondContact CD-OD2 3.38Å; K481-D486 WeakPolarHBondContact CE-OD2 3.29Å; K481-D486 IonicContact NZ-OD2 2.82Å; K481-D486 PolarHBondContact NZ-OD2 3.13Å; K481-D486 WeakPolarHBondContact O-CB 3.46Å; K481-D486 PolarHBondContact O-N 3.46Å; N484-D486 VanDerWaalsContact C-N 3.3Å; N484-D486 PolarHBondContact O-N 3.37Å
487	V	78.6	Confident	85.8	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.024	29%	0.289	C	S	.	.	S	Bend	trans	-95.7	129.8	-178.2	-173.5	0	0	0	0	110	F303 C307 L478 K481 H482 G485 C489 I494	F303-V487 HydrophobicContact CE1-CG2 3.64Å; F303-V487 HydrophobicContact CZ-CG2 3.81Å; C307-V487 HydrophobicContact CB-CG1 4.35Å; L478-V487 HydrophobicContact CD1-CG1 4.28Å; L478-V487 HydrophobicContact CD1-CG2 3.81Å; K481-V487 HydrophobicContact CB-CG2 3.84Å; H482-V487 HydrophobicContact CB-CB 4.15Å; H482-V487 HydrophobicContact CB-CG2 3.95Å; G485-V487 VanDerWaalsContact C-N 3.34Å; V487-C489 PolarHBondContact O-N 2.96Å; V487-I494 HydrophobicContact CB-CD1 4.18Å; V487-I494 HydrophobicContact CG1-CD1 3.56Å; V487-I494 HydrophobicContact CG1-CG1 3.85Å
488	P	73.5	Confident	85.6	Confident	26 Å²	26	57 Å²	57	17%	0.169	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-54.5	131.4	173.6	-25.2	34.3	0	0	0	111.8	N491	P488-N491 PolarHBondContact O-ND2 2.95Å
489	C	69.4	Low	85.3	Confident	88 Å²	88	57.6 Å²	57.6	60%	0.595	31%	0.308	S	S	*	.	S	Bend	trans	-75.7	170.6	176.6	-57.3	0	0	0	0	112.3	V487	V487-C489 PolarHBondContact O-N 2.96Å
490	N	71.1	Confident	84.7	Confident	159 Å²	159	56.7 Å²	56.7	85%	0.85	31%	0.306	S	S	*	.	S	Bend	trans	56.6	57.9	170.5	-53.1	-12.9	0	0	0	113.6
491	N	85.1	Confident	84	Confident	13 Å²	13	55.7 Å²	55.7	7%	0.07	30%	0.301	C	S	.	.	S	Bend	trans	-147.2	163.5	174.1	60.3	53	0	0	0	111.2	D311 P488 L493 I494 E495	D311-N491 WeakPolarHBondContact OD1-CB 3.18Å; P488-N491 PolarHBondContact O-ND2 2.95Å; N491-L493 VanDerWaalsContact C-N 3.26Å; N491-L493 PolarHBondContact O-N 2.95Å; N491-L493 WeakPolarHBondContact OD1-CB 3.47Å; N491-L493 PolarHBondContact OD1-N 3.49Å; N491-I494 PolarHBondContact O-N 3.44Å; N491-I494 VanDerWaalsContact O-N 3.15Å; N491-I494 PolarHBondContact OD1-N 3.44Å; N491-E495 PolarHBondContact O-N 3.41Å; N491-E495 VanDerWaalsContact O-N 3.12Å
492	L	91.5	Very high	82.6	Confident	30 Å²	30	60.3 Å²	60.3	16%	0.157	35%	0.348	C	S	.	.	H	α-helix	trans	-63	-35	-173.2	179.7	63.2	0	0	0	111.4	D311 L314 F315 V318 I494 E495 M496	D311-L492 WeakPolarHBondContact OD1-CB 3.34Å; D311-L492 PolarHBondContact OD1-N 3.44Å; L314-L492 HydrophobicContact CB-CD2 4.47Å; L314-L492 HydrophobicContact CD2-CD2 4.3Å; L314-L492 HydrophobicContact CD2-CG 3.99Å; L314-L492 HydrophobicContact CG-CD2 3.89Å; L314-L492 HydrophobicContact CG-CG 4.14Å; F315-L492 HydrophobicContact CD1-CD2 3.92Å; F315-L492 HydrophobicContact CD2-CD2 4.21Å; F315-L492 HydrophobicContact CE1-CD2 3.85Å; F315-L492 HydrophobicContact CE2-CB 3.95Å; F315-L492 HydrophobicContact CE2-CD2 4.14Å; F315-L492 HydrophobicContact CG-CD2 4.1Å; F315-L492 HydrophobicContact CZ-CB 3.87Å; F315-L492 HydrophobicContact CZ-CD2 3.96Å; V318-L492 HydrophobicContact CG2-CD2 4.41Å; L492-I494 VanDerWaalsContact C-N 3.33Å; L492-I494 PolarHBondContact O-N 3.34Å; L492-E495 PolarHBondContact O-N 3.35Å; L492-M496 HydrophobicContact CD1-CG 3.83Å; L492-M496 HydrophobicContact CD1-SD 4.43Å; L492-M496 HydrophobicContact CG-CG 4.12Å; L492-M496 WeakPolarHBondContact O-CB 3.33Å; L492-M496 WeakPolarHBondContact O-CG 3.4Å; L492-M496 PolarHBondContact O-N 2.74Å
493	L	92.4	Very high	82.3	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.016	36%	0.356	C	S	.	.	H	α-helix	trans	-57.1	-43.7	175.5	179.4	66.6	0	0	0	112.5	C307 A310 D311 L314 W343 L478 N491 L497	C307-L493 HydrophobicContact CB-CD2 4.14Å; A310-L493 HydrophobicContact CB-CD1 4.46Å; A310-L493 HydrophobicContact CB-CD2 4.15Å; D311-L493 HydrophobicContact CB-CB 4.06Å; D311-L493 PolarHBondContact OD1-N 2.75Å; D311-L493 VanDerWaalsContact OD1-N 3.11Å; L314-L493 HydrophobicContact CD2-CD1 4.49Å; W343-L493 HydrophobicContact CE3-CD1 4.2Å; W343-L493 HydrophobicContact CH2-CD1 3.92Å; W343-L493 HydrophobicContact CZ3-CD1 3.43Å; W343-L493 VanDerWaalsContact CZ3-CD1 3.43Å; L478-L493 HydrophobicContact CD1-CD2 4.34Å; L478-L493 HydrophobicContact CD2-CD1 3.87Å; L478-L493 HydrophobicContact CD2-CD2 4.13Å; L478-L493 HydrophobicContact CD2-CG 3.93Å; N491-L493 VanDerWaalsContact C-N 3.26Å; N491-L493 PolarHBondContact O-N 2.95Å; N491-L493 WeakPolarHBondContact OD1-CB 3.47Å; N491-L493 PolarHBondContact OD1-N 3.49Å; L493-L497 WeakPolarHBondContact O-CB 3.18Å; L493-L497 PolarHBondContact O-N 3.47Å; L493-L497 VanDerWaalsContact O-N 3.09Å
494	I	90	Very high	82.1	Confident	10 Å²	10	58.7 Å²	58.7	5%	0.051	34%	0.344	C	S	.	.	H	α-helix	trans	-74.1	-39.4	177.6	-73.1	-57.4	0	0	0	112.1	H482 V487 N491 L492 M496 L497 H498	H482-I494 HydrophobicContact CB-CD1 4.05Å; H482-I494 WeakPolarHBondContact ND1-CD1 3.43Å; V487-I494 HydrophobicContact CB-CD1 4.18Å; V487-I494 HydrophobicContact CG1-CD1 3.56Å; V487-I494 HydrophobicContact CG1-CG1 3.85Å; N491-I494 PolarHBondContact O-N 3.44Å; N491-I494 VanDerWaalsContact O-N 3.15Å; N491-I494 PolarHBondContact OD1-N 3.44Å; L492-I494 VanDerWaalsContact C-N 3.33Å; L492-I494 PolarHBondContact O-N 3.34Å; I494-M496 VanDerWaalsContact C-N 3.31Å; I494-M496 PolarHBondContact O-N 3.15Å; I494-L497 HydrophobicContact CD1-CD2 3.98Å; I494-L497 PolarHBondContact O-N 2.92Å; I494-H498 WeakPolarHBondContact CG2-NE2 3.34Å; I494-H498 PolarHBondContact O-CD2 3.15Å; I494-H498 PolarHBondContact O-N 2.94Å
495	E	91.8	Very high	81.9	Confident	122 Å²	122	57.1 Å²	57.1	57%	0.57	34%	0.337	S	S	*	.	H	α-helix	trans	-58.1	-44.6	174.6	-70.2	174.6	-164.5	0	0	111.6	N491 L492 H498 A499	N491-E495 PolarHBondContact O-N 3.41Å; N491-E495 VanDerWaalsContact O-N 3.12Å; L492-E495 PolarHBondContact O-N 3.35Å; E495-H498 PolarHBondContact O-N 3.42Å; E495-A499 WeakPolarHBondContact O-CB 3.25Å; E495-A499 PolarHBondContact O-N 3.24Å
496	M	93.7	Very high	81.9	Confident	19 Å²	19	56.8 Å²	56.8	9%	0.094	32%	0.32	C	S	.	.	H	α-helix	trans	-71.7	-30.8	179.4	-66.1	-71.7	-76.9	0	0	112.7	L314 L339 Q340 W343 L492 I494 K500	L314-M496 HydrophobicContact CD2-CB 4.24Å; L314-M496 HydrophobicContact CD2-CG 4.04Å; L339-M496 VanDerWaalsContact C-CE 3.49Å; L339-M496 HydrophobicContact CB-CE 3.98Å; L339-M496 WeakPolarHBondContact O-CE 3.34Å; Q340-M496 HydrophobicContact CG-CE 4.2Å; Q340-M496 HydrophobicContact CG-SD 3.87Å; W343-M496 HydrophobicContact CB-CE 3.79Å; W343-M496 HydrophobicContact CD2-CB 4.17Å; W343-M496 HydrophobicContact CG-CB 4.12Å; W343-M496 HydrophobicContact CG-CE 3.98Å; W343-M496 PolarHBondContact NE1-O 3.12Å; L492-M496 HydrophobicContact CD1-CG 3.83Å; L492-M496 HydrophobicContact CD1-SD 4.43Å; L492-M496 HydrophobicContact CG-CG 4.12Å; L492-M496 WeakPolarHBondContact O-CB 3.33Å; L492-M496 WeakPolarHBondContact O-CG 3.4Å; L492-M496 PolarHBondContact O-N 2.74Å; I494-M496 VanDerWaalsContact C-N 3.31Å; I494-M496 PolarHBondContact O-N 3.15Å; M496-K500 PolarHBondContact O-N 2.61Å
497	L	90.8	Very high	82.1	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-67.7	-38.6	172	-176.9	66	0	0	0	112.5	W343 E475 L478 Y479 L493 I494	W343-L497 HydrophobicContact CH2-CD1 4.42Å; W343-L497 HydrophobicContact CZ2-CB 4.24Å; W343-L497 HydrophobicContact CZ2-CD1 4.12Å; E475-L497 HydrophobicContact CB-CD1 4.29Å; L478-L497 HydrophobicContact CB-CD2 4.48Å; L478-L497 HydrophobicContact CD2-CD1 4.38Å; L478-L497 HydrophobicContact CD2-CD2 3.97Å; L478-L497 HydrophobicContact CG-CD2 3.89Å; Y479-L497 HydrophobicContact CD2-CD2 4.25Å; Y479-L497 HydrophobicContact CD2-CG 4.44Å; L493-L497 WeakPolarHBondContact O-CB 3.18Å; L493-L497 PolarHBondContact O-N 3.47Å; L493-L497 VanDerWaalsContact O-N 3.09Å; I494-L497 HydrophobicContact CD1-CD2 3.98Å; I494-L497 PolarHBondContact O-N 2.92Å
498	H	87.9	Confident	82.3	Confident	84 Å²	84	59.9 Å²	59.9	39%	0.389	34%	0.338	S	S	.	.	H	α-helix	trans	-72.5	-45.3	174.6	-70.2	-54	0	0	0	111.9	H482 I494 E495 K500 R501 A502	H482-H498 AromaticContact CD2-CE1 3.88Å; H482-H498 AromaticContact NE2-CE1 3.44Å; H482-H498 PolarHBondContact NE2-CE1 3.3Å; H482-H498 AromaticContact NE2-NE2 3.44Å; H482-H498 PolarHBondContact NE2-NE2 2.9Å; I494-H498 WeakPolarHBondContact CG2-NE2 3.34Å; I494-H498 PolarHBondContact O-CD2 3.15Å; I494-H498 PolarHBondContact O-N 2.94Å; E495-H498 PolarHBondContact O-N 3.42Å; H498-K500 VanDerWaalsContact C-N 3.27Å; H498-K500 PolarHBondContact O-N 2.71Å; H498-R501 PolarHBondContact O-N 2.95Å; H498-A502 PolarHBondContact O-N 2.63Å
499	A	86.8	Confident	82.9	Confident	30 Å²	30	62.4 Å²	62.4	25%	0.248	35%	0.35	C	S	.	.	H	α-helix	trans	-59.9	-34.5	-176.7	0	0	0	0	0	113.3	Q340 E495 R501	Q340-A499 HydrophobicContact CG-CB 3.83Å; E495-A499 WeakPolarHBondContact O-CB 3.25Å; E495-A499 PolarHBondContact O-N 3.24Å; A499-R501 PolarHBondContact O-N 2.75Å
500	K	78.1	Confident	84	Confident	51 Å²	51	60.4 Å²	60.4	22%	0.222	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-12	176.9	-165.5	173.8	176.2	174.4	0	113.9	Q340 N341 S344 E475 M496 H498	Q340-K500 WeakPolarHBondContact O-CD 3.36Å; Q340-K500 WeakPolarHBondContact O-CG 3.49Å; N341-K500 VanDerWaalsContact O-CE 3.23Å; N341-K500 WeakPolarHBondContact O-CE 3.43Å; N341-K500 PolarHBondContact O-NZ 2.95Å; S344-K500 PolarHBondContact OG-NZ 2.86Å; E475-K500 IonicContact OE1-NZ 3.96Å; E475-K500 PolarHBondContact OE1-NZ 2.96Å; E475-K500 WeakPolarHBondContact OE2-CD 3.34Å; E475-K500 WeakPolarHBondContact OE2-CE 3.16Å; E475-K500 IonicContact OE2-NZ 3.11Å; E475-K500 PolarHBondContact OE2-NZ 3.15Å; M496-K500 PolarHBondContact O-N 2.61Å; H498-K500 VanDerWaalsContact C-N 3.27Å; H498-K500 PolarHBondContact O-N 2.71Å
501	R	74.2	Confident	85.1	Confident	119 Å²	119	52.2 Å²	52.2	45%	0.449	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-1.9	179.4	-69.4	-178	174.5	-103.1	-4	113.7	H498 A499	H498-R501 PolarHBondContact O-N 2.95Å; A499-R501 PolarHBondContact O-N 2.75Å
502	A	58.6	Low	85.1	Confident	144 Å²	144	55.7 Å²	55.7	100%	1.19	31%	0.308	S	S	*	.			trans	-89.2	0	173.5	0	0	0	0	0	111.5	H498	H498-A502 PolarHBondContact O-N 2.63Å

Retrieved 502 of 502 residues in 3238.5 ms (Link to these results)

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