X5DR82_HUMAN Loading...

Phosphodiesterase

AlphaFold DB , UniProt , Accession X5DR82, Species HUMAN (Homo sapiens, Human), Gene PDE4B, Length 661 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	30.5	Very low	30.2	Very low	253 Å²	253	164.4 Å²	164.4	100%	1.246	84%	0.839	S	S	*	*				0	-174.9	0	-73.4	168	90.3	0	0	108.9
2	K	33.6	Very low	30.1	Very low	193 Å²	193	157.3 Å²	157.3	84%	0.839	82%	0.823	S	S	*	*			trans	-81.3	154.8	-168.1	-64.5	176.7	174.6	175.1	0	114.2
3	K	32.5	Very low	30.1	Very low	196 Å²	196	157.1 Å²	157.1	85%	0.852	82%	0.824	S	S	*	*			trans	67.3	161	156.4	-70.5	-177.9	173.6	-173.5	0	117.5
4	S	31.9	Very low	30	Very low	96 Å²	96	156.9 Å²	156.9	67%	0.671	82%	0.824	S	S	*	*			cis	-179.6	150.6	-30	-89.7	0	0	0	0	110.3
5	R	34.3	Very low	30	Very low	246 Å²	246	154.7 Å²	154.7	93%	0.928	82%	0.819	S	S	*	*			trans	65.8	151.5	160.6	-77.2	179.8	176.2	-177.1	-2.8	116
6	S	29.9	Very low	29.9	Very low	103 Å²	103	155.5 Å²	155.5	72%	0.72	82%	0.819	S	S	*	*			cis	-171.4	-178.9	-9.1	-176.5	0	0	0	0	109.3
7	V	30.4	Very low	29.8	Very low	122 Å²	122	154.1 Å²	154.1	74%	0.739	81%	0.812	S	S	*	*			trans	81.5	94.8	160.2	-165.9	0	0	0	0	119.5
8	M	26.8	Very low	29.6	Very low	171 Å²	171	156.9 Å²	156.9	84%	0.842	82%	0.816	S	S	*	*				53.5	158.6	111.4	-149	165.5	177.3	0	0	123.1
9	T	26.7	Very low	29.5	Very low	127 Å²	127	154.7 Å²	154.7	78%	0.779	81%	0.805	S	S	*	*			trans	88.2	110.2	-176.9	-43.9	0	0	0	0	112.2
10	V	28.2	Very low	29.4	Very low	111 Å²	111	156.4 Å²	156.4	67%	0.673	81%	0.807	S	S	*	*			cis	105.1	110.7	32.3	170.8	0	0	0	0	111.8
11	M	27	Very low	29.6	Very low	190 Å²	190	155.1 Å²	155.1	94%	0.936	80%	0.801	S	S	*	*			trans	58.3	144.6	161.2	-71.4	173.5	171.4	0	0	120.1
12	A	29.7	Very low	29.6	Very low	79 Å²	79	149.2 Å²	149.2	65%	0.653	78%	0.779	S	S	*	*			trans	-146.7	134.2	174.1	0	0	0	0	0	109.2
13	D	29.3	Very low	29.4	Very low	155 Å²	155	147.8 Å²	147.8	83%	0.829	78%	0.775	S	S	*	*			trans	55.9	156.8	143.2	-41.3	-28.4	0	0	0	119.8
14	D	28.8	Very low	29.2	Very low	154 Å²	154	145 Å²	145	82%	0.824	77%	0.77	S	S	*	*			cis	-149.3	175.1	6	-153.4	-11.5	0	0	0	112
15	V	29.6	Very low	28.9	Very low	124 Å²	124	143.2 Å²	143.2	75%	0.752	77%	0.767	S	S	*	*			trans	-126.4	107.4	-171.6	173.3	0	0	0	0	114.1
16	M	28.9	Very low	29	Very low	168 Å²	168	137.6 Å²	137.6	83%	0.828	76%	0.762	S	S	*	*			trans	71.3	158.3	142.9	-85.5	-72.2	-178.1	0	0	124.1
17	L	27.9	Very low	29.1	Very low	131 Å²	131	138.1 Å²	138.1	69%	0.686	77%	0.766	S	S	*	*			trans	83.5	110.1	149.1	-81.3	156.3	0	0	0	122.3
18	K	26.5	Very low	30	Very low	205 Å²	205	138.5 Å²	138.5	89%	0.891	77%	0.771	S	S	*	*				-167.9	164	102.2	-102.5	167.5	-177.3	174.1	0	114.3
19	N	28.5	Very low	29.9	Very low	115 Å²	115	133.8 Å²	133.8	62%	0.615	77%	0.766	S	S	*	*			trans	-116.9	-171.7	-160.9	-57.9	14.7	0	0	0	115
20	F	26.3	Very low	29.9	Very low	189 Å²	189	139.6 Å²	139.6	83%	0.829	77%	0.774	S	S	*	*			trans	108	111	165.9	-70.7	-85.7	0	0	0	114.6
21	D	33.8	Very low	30	Very low	129 Å²	129	139.8 Å²	139.8	69%	0.69	78%	0.78	S	S	*	*			cis	77.7	134	30.8	-46.8	-70.5	0	0	0	113.3
22	V	31	Very low	30.5	Very low	129 Å²	129	136.1 Å²	136.1	78%	0.782	77%	0.77	S	S	*	*			cis	-155.3	154.7	11.9	69.8	0	0	0	0	111
23	E	30.3	Very low	30.4	Very low	163 Å²	163	140.6 Å²	140.6	76%	0.762	78%	0.782	S	S	*	*				151	171.4	109.4	-129.7	-173.8	-138.5	0	0	109.5
24	N	28.1	Very low	30.5	Very low	138 Å²	138	140.6 Å²	140.6	74%	0.738	78%	0.782	S	S	*	*			cis	-156.9	-165.8	-1.6	-156.5	-32.9	0	0	0	109.8
25	G	24.9	Very low	30.9	Very low	59 Å²	59	138.2 Å²	138.2	61%	0.608	78%	0.775	S	S	*	*			trans	-121.4	-151.4	177.7	0	0	0	0	0	115.1
26	P	35.4	Very low	30.6	Very low	128 Å²	128	141 Å²	141	83%	0.831	78%	0.78	S	S	*	*			cis	-137	-156.1	13.5	44.4	-24.7	0	0	0	115.8
27	S	33.3	Very low	30.4	Very low	114 Å²	114	136.9 Å²	136.9	80%	0.797	77%	0.772	S	S	*	*			trans	-160.9	-164.6	-178.7	-71.4	0	0	0	0	109.1
28	P	48.4	Very low	30.2	Very low	129 Å²	129	135.5 Å²	135.5	84%	0.838	77%	0.774	S	S	*	*			cis	-142.8	-178.6	-2.6	44.7	-26.4	0	0	0	117.6
29	G	24.9	Very low	30.2	Very low	72 Å²	72	131.3 Å²	131.3	74%	0.742	77%	0.77	S	S	*	*				109.8	131.6	128.3	0	0	0	0	0	122.7
30	R	26.6	Very low	30	Very low	250 Å²	250	131.4 Å²	131.4	94%	0.943	78%	0.78	S	S	*	*				171.3	148.2	127.8	-97.2	-179.5	179	-165.5	-1.1	114.5
31	S	30.2	Very low	30.1	Very low	114 Å²	114	127.4 Å²	127.4	80%	0.797	78%	0.782	S	S	*	*			trans	-132.3	160.9	160.8	-48.4	0	0	0	0	107.8
32	P	38.4	Very low	29.7	Very low	114 Å²	114	124.9 Å²	124.9	74%	0.74	79%	0.786	S	S	*	*				-159.8	163	89.5	41.4	-21.6	0	0	0	118.9
33	L	28.3	Very low	29.6	Very low	173 Å²	173	127 Å²	127	91%	0.906	79%	0.793	S	S	*	*			trans	58.4	144.9	142	-65.1	166.4	0	0	0	124.3
34	D	30.1	Very low	29.5	Very low	154 Å²	154	124.9 Å²	124.9	82%	0.824	79%	0.79	S	S	*	*			trans	-68.7	179.1	168.9	-93.5	-59	0	0	0	114.6
35	P	37.1	Very low	29.6	Very low	104 Å²	104	126.8 Å²	126.8	68%	0.675	80%	0.799	S	S	*	*			cis	-146.9	-169.7	21.3	44.4	-23.5	0	0	0	119.1
36	Q	24.3	Very low	29.6	Very low	183 Å²	183	130.9 Å²	130.9	86%	0.855	80%	0.803	S	S	*	*			trans	90.9	136.5	142.2	-92.2	-172.3	-7.5	0	0	125
37	A	25.2	Very low	29.1	Very low	81 Å²	81	129.7 Å²	129.7	67%	0.669	80%	0.804	S	S	*	*			trans	78.3	98.8	134.4	0	0	0	0	0	124.2
38	S	23.6	Very low	28.8	Very low	103 Å²	103	129.2 Å²	129.2	72%	0.72	80%	0.796	S	S	*	*				41.3	126.5	123.3	66.7	0	0	0	0	124.5
39	S	24.8	Very low	27.8	Very low	117 Å²	117	132.9 Å²	132.9	82%	0.818	80%	0.799	S	S	*	*				62.7	106.8	126.4	-54.2	0	0	0	0	122.8
40	S	25.6	Very low	28.3	Very low	117 Å²	117	135.5 Å²	135.5	82%	0.818	80%	0.803	S	S	*	*			trans	-165.3	124.1	134.9	5.7	0	0	0	0	108.9
41	A	27.6	Very low	28.3	Very low	105 Å²	105	126.8 Å²	126.8	87%	0.868	79%	0.791	S	S	*	*				62.1	109.1	83.8	0	0	0	0	0	112.7
42	G	25.1	Very low	28.8	Very low	76 Å²	76	130.7 Å²	130.7	78%	0.784	80%	0.796	S	S	*	*			trans	-108.3	177.6	-171.1	0	0	0	0	0	114.9
43	L	28.7	Very low	28.3	Very low	174 Å²	174	130.5 Å²	130.5	91%	0.911	80%	0.798	S	S	*	*			trans	-152.3	127.1	163.4	-115.4	165.8	0	0	0	113.2
44	V	29.3	Very low	28.7	Very low	118 Å²	118	131 Å²	131	72%	0.715	80%	0.795	S	S	*	*			trans	-30.3	139.7	170	174.8	0	0	0	0	116.7
45	L	28.9	Very low	28.9	Very low	177 Å²	177	134.4 Å²	134.4	93%	0.927	80%	0.797	S	S	*	*				-145.6	150.8	129.2	-110.1	177.5	0	0	0	112.1
46	H	25.5	Very low	29	Very low	146 Å²	146	140.8 Å²	140.8	68%	0.676	81%	0.807	S	S	*	*			trans	-102.8	138.6	-160.4	-162.1	-85.8	0	0	0	112.3	T48	H46-T48 PolarHBondContact CE1-OG1 3.14Å; H46-T48 VanDerWaalsContact CE1-OG1 3.31Å; H46-T48 PolarHBondContact ND1-OG1 2.96Å
47	A	25.1	Very low	29.9	Very low	103 Å²	103	138 Å²	138	85%	0.851	80%	0.795	S	S	*	*			trans	-128.7	112.9	172.6	0	0	0	0	0	110.1
48	T	26.2	Very low	30.9	Very low	104 Å²	104	136.7 Å²	136.7	64%	0.638	78%	0.78	S	S	*	*			trans	-103.8	121.8	-167.5	-39.2	0	0	0	0	111.7	H46	H46-T48 PolarHBondContact CE1-OG1 3.14Å; H46-T48 VanDerWaalsContact CE1-OG1 3.31Å; H46-T48 PolarHBondContact ND1-OG1 2.96Å
49	F	27.9	Very low	32.3	Very low	206 Å²	206	134.6 Å²	134.6	90%	0.904	76%	0.758	S	S	*	*			trans	-156	148.5	150.8	-96.8	-72.6	0	0	0	110.3
50	P	34.9	Very low	33.5	Very low	126 Å²	126	132.6 Å²	132.6	82%	0.818	74%	0.738	S	S	*	*			trans	-101.5	147.4	-170	37.3	-29.6	0	0	0	113.7
51	G	28.5	Very low	34.6	Very low	68 Å²	68	132.9 Å²	132.9	70%	0.701	72%	0.722	S	S	*	*			trans	-173.7	137.3	167.8	0	0	0	0	0	110.4	S53	G51-S53 PolarHBondContact O-N 3.37Å
52	H	39.1	Very low	35.2	Very low	195 Å²	195	135.4 Å²	135.4	90%	0.903	71%	0.709	S	S	*	*			trans	-70.2	94.7	179.2	-80.7	-54.8	0	0	0	111.5	Q54	H52-Q54 PolarHBondContact O-N 3.18Å
53	S	28.5	Very low	35.8	Very low	111 Å²	111	136.2 Å²	136.2	78%	0.776	70%	0.703	S	S	*	*			trans	-83.2	89.4	147.3	48.9	0	0	0	0	108.4	G51 R55	G51-S53 PolarHBondContact O-N 3.37Å; S53-R55 VanDerWaalsContact C-N 3.28Å; S53-R55 PolarHBondContact O-N 3.48Å
54	Q	37.7	Very low	36.1	Very low	182 Å²	182	135.5 Å²	135.5	85%	0.85	70%	0.7	S	S	*	*			trans	-60.8	99.3	160.3	-85.4	-178.8	-49.2	0	0	107.4	H52 R56	H52-Q54 PolarHBondContact O-N 3.18Å; Q54-R56 VanDerWaalsContact C-N 3.34Å; Q54-R56 PolarHBondContact O-N 2.9Å
55	R	34.2	Very low	36.6	Very low	226 Å²	226	134.6 Å²	134.6	85%	0.853	70%	0.699	S	S	*	*			trans	-63.9	100.4	170.3	-171.5	-174.4	-160.3	-144.6	6.6	105.9	S53 E57	S53-R55 VanDerWaalsContact C-N 3.28Å; S53-R55 PolarHBondContact O-N 3.48Å; R55-E57 PolarHBondContact O-N 3.16Å
56	R	39.2	Very low	37	Very low	238 Å²	238	133.5 Å²	133.5	90%	0.898	69%	0.694	S	S	*	*			trans	-45.1	113.8	-175.7	-173.8	-175.2	-170.4	-159.7	3.1	109.3	Q54 S58	Q54-R56 VanDerWaalsContact C-N 3.34Å; Q54-R56 PolarHBondContact O-N 2.9Å; R56-S58 PolarHBondContact O-N 3.05Å
57	E	41.5	Very low	37.5	Very low	126 Å²	126	137.8 Å²	137.8	59%	0.589	71%	0.706	S	S	*	*			trans	-55.9	115.7	-176.7	-71.2	174.6	-177.7	0	0	109.3	R55 R62	R55-E57 PolarHBondContact O-N 3.16Å; E57-R62 HydrophobicContact CB-CG 4.39Å; E57-R62 IonicContact OE2-NE 3.41Å
58	S	46.7	Very low	37.9	Very low	52 Å²	52	140.4 Å²	140.4	36%	0.364	71%	0.706	S	S	.	*			trans	-66.4	145.2	167.2	52.5	0	0	0	0	108	R56 L60 Y61	R56-S58 PolarHBondContact O-N 3.05Å; S58-L60 PolarHBondContact O-N 3.29Å; S58-Y61 CarbonylContact O-C 3.58Å; S58-Y61 PolarHBondContact O-N 3.4Å; S58-Y61 VanDerWaalsContact O-O 3.14Å; S58-Y61 WeakPolarHBondContact OG-CD2 3.27Å
59	F	54.1	Low	38	Very low	59 Å²	59	143.6 Å²	143.6	26%	0.259	72%	0.718	S	S	.	*	T	Hydrogen-bonded Turn	trans	-49.1	-33.6	171.9	168.8	-127.1	0	0	0	113.1	Y61 M178 L179 E182	F59-Y61 PolarHBondContact O-N 3.49Å; F59-Y61 VanDerWaalsContact O-N 3.11Å; F59-M178 HydrophobicContact CE1-CB 3.84Å; F59-M178 VanDerWaalsContact CZ-C 3.41Å; F59-M178 HydrophobicContact CZ-CB 3.66Å; F59-M178 HydrophobicContact CZ-CE 4.21Å; F59-M178 VanDerWaalsContact CZ-O 3.24Å; F59-M178 WeakPolarHBondContact CZ-O 3.21Å; F59-L179 HydrophobicContact CD1-CD1 4.45Å; F59-L179 HydrophobicContact CE1-CB 4.27Å; F59-E182 HydrophobicContact CD2-CG 3.43Å; F59-E182 VanDerWaalsContact CD2-CG 3.43Å; F59-E182 HydrophobicContact CE1-CG 4.21Å; F59-E182 HydrophobicContact CE2-CB 4.46Å; F59-E182 HydrophobicContact CE2-CG 3.08Å; F59-E182 HydrophobicContact CG-CG 4.16Å; F59-E182 HydrophobicContact CZ-CG 3.49Å; F59-E182 VanDerWaalsContact CZ-CG 3.49Å
60	L	49.4	Very low	38.2	Very low	76 Å²	76	139 Å²	139	40%	0.398	71%	0.711	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.1	-8.9	177.4	-57	179.2	0	0	0	115.5	S58 I90 F175	S58-L60 PolarHBondContact O-N 3.29Å; L60-I90 HydrophobicContact CB-CD1 3.99Å; L60-I90 HydrophobicContact CD2-CD1 3.92Å; L60-I90 WeakPolarHBondContact O-CD1 3.29Å; L60-I90 WeakPolarHBondContact O-CG1 3.42Å; L60-F175 HydrophobicContact CD2-CD1 3.77Å; L60-F175 HydrophobicContact CD2-CE1 3.85Å
61	Y	48.3	Very low	38.6	Very low	123 Å²	123	138 Å²	138	48%	0.482	70%	0.704	S	S	.	*	S	Bend	trans	-147	89.7	177.4	-59	-67.7	0	0	0	109.2	S58 F59 L89	S58-Y61 CarbonylContact O-C 3.58Å; S58-Y61 PolarHBondContact O-N 3.4Å; S58-Y61 VanDerWaalsContact O-O 3.14Å; S58-Y61 WeakPolarHBondContact OG-CD2 3.27Å; F59-Y61 PolarHBondContact O-N 3.49Å; F59-Y61 VanDerWaalsContact O-N 3.11Å; Y61-L89 HydrophobicContact CE1-CD2 4.06Å
62	R	41.1	Very low	38.7	Very low	157 Å²	157	144.2 Å²	144.2	59%	0.592	71%	0.712	S	S	*	*			trans	-127	135.4	168.8	-87.5	-170.1	151.2	-168.6	-9.8	109.7	E57	E57-R62 HydrophobicContact CB-CG 4.39Å; E57-R62 IonicContact OE2-NE 3.41Å
63	S	37.5	Very low	38.2	Very low	93 Å²	93	140 Å²	140	65%	0.65	71%	0.711	S	S	*	*			trans	-95.5	134.2	168.5	-55.4	0	0	0	0	108.8	S65	S63-S65 PolarHBondContact O-N 2.91Å
64	D	35.6	Very low	38.3	Very low	160 Å²	160	144 Å²	144	86%	0.856	72%	0.72	S	S	*	*	S	Bend	trans	-74.8	38	-179.1	-77.4	-29.6	0	0	0	113.1
65	S	39.4	Very low	37.9	Very low	98 Å²	98	141.4 Å²	141.4	69%	0.685	72%	0.722	S	S	*	*			trans	-114.7	40.2	-166.3	68.2	0	0	0	0	114.2	S63	S63-S65 PolarHBondContact O-N 2.91Å
66	D	36.6	Very low	37.8	Very low	155 Å²	155	141.2 Å²	141.2	83%	0.829	72%	0.721	S	S	*	*			trans	-136.8	52.6	-179.1	-133.5	-4.1	0	0	0	112.5
67	Y	36.9	Very low	37.2	Very low	236 Å²	236	137.5 Å²	137.5	93%	0.925	72%	0.719	S	S	*	*			trans	-145.2	75.7	174.5	-122.4	-78.2	0	0	0	112.3
68	D	31.9	Very low	36.6	Very low	158 Å²	158	137.2 Å²	137.2	85%	0.845	73%	0.731	S	S	*	*			trans	-157.1	137.8	151.5	-138.6	-17.2	0	0	0	114.5
69	L	29.9	Very low	35.9	Very low	171 Å²	171	140 Å²	140	90%	0.895	75%	0.75	S	S	*	*			trans	-125.4	95.8	172.6	-82.9	172.7	0	0	0	110
70	S	30.4	Very low	34.7	Very low	109 Å²	109	145 Å²	145	76%	0.762	78%	0.779	S	S	*	*			trans	-20.8	155.4	165.1	-121.2	0	0	0	0	117.6
71	P	44.8	Very low	33.8	Very low	104 Å²	104	147 Å²	147	68%	0.675	80%	0.796	S	S	*	*			cis	-154.4	164.2	34.6	40.6	-18.5	0	0	0	121.5
72	K	30.1	Very low	32.9	Very low	200 Å²	200	146 Å²	146	87%	0.87	81%	0.808	S	S	*	*			trans	67.1	112.3	147.7	-73.3	165.8	-179.4	175.5	0	121.4
73	A	29.1	Very low	32.3	Very low	107 Å²	107	146.7 Å²	146.7	88%	0.884	82%	0.818	S	S	*	*				-154.4	163.2	128	0	0	0	0	0	110.4
74	M	29.6	Very low	32	Very low	194 Å²	194	150.5 Å²	150.5	96%	0.956	83%	0.825	S	S	*	*			trans	-112.6	134	-178.8	-65.6	172.1	65.1	0	0	112.5
75	S	29.6	Very low	31.8	Very low	127 Å²	127	150.7 Å²	150.7	89%	0.888	82%	0.821	S	S	*	*			trans	-158.1	179.7	146.3	-158.8	0	0	0	0	111.1
76	R	33.1	Very low	31.6	Very low	223 Å²	223	149.1 Å²	149.1	84%	0.842	82%	0.82	S	S	*	*			trans	-127.7	156.5	-165.1	-78.4	171.7	140	154.3	-7.6	113.7
77	N	26.5	Very low	31.5	Very low	159 Å²	159	148.5 Å²	148.5	85%	0.85	82%	0.817	S	S	*	*			trans	69.3	136.7	170.7	-51.3	-9.4	0	0	0	113.1
78	S	28.3	Very low	31.9	Very low	120 Å²	120	144.3 Å²	144.3	84%	0.839	81%	0.81	S	S	*	*			cis	-137.3	177.6	33.7	50.6	0	0	0	0	114.2
79	S	32.3	Very low	32.8	Very low	110 Å²	110	141.5 Å²	141.5	77%	0.769	80%	0.795	S	S	*	*			trans	-106.6	129.2	-176.4	54	0	0	0	0	112.9
80	L	28.6	Very low	33.7	Very low	165 Å²	165	134.9 Å²	134.9	86%	0.864	76%	0.76	S	S	*	*			trans	-134.7	156	162.1	-77.4	178.7	0	0	0	108.9
81	P	30.3	Very low	35.4	Very low	117 Å²	117	132.7 Å²	132.7	76%	0.76	74%	0.742	S	S	*	*			trans	-70.5	157.2	-171.6	29.5	-35.9	0	0	0	112.5	E83	P81-E83 PolarHBondContact O-N 3.4Å
82	S	28.4	Very low	36.7	Very low	104 Å²	104	130 Å²	130	73%	0.727	72%	0.724	S	S	*	*			trans	-65.3	115	177.3	50.3	0	0	0	0	111.7	Q84	S82-Q84 PolarHBondContact O-N 2.83Å; S82-Q84 VanDerWaalsContact O-N 3.16Å
83	E	30.1	Very low	38.9	Very low	171 Å²	171	122.1 Å²	122.1	80%	0.799	69%	0.693	S	S	*	*			trans	-62.9	111.8	151.5	-75.1	-172.7	125.3	0	0	107.9	P81 H85	P81-E83 PolarHBondContact O-N 3.4Å; E83-H85 VanDerWaalsContact C-N 3.35Å; E83-H85 PolarHBondContact O-N 2.7Å
84	Q	31.1	Very low	41.2	Very low	173 Å²	173	118.2 Å²	118.2	81%	0.808	66%	0.656	S	S	*	*			trans	-63.6	97.4	171.2	-170.2	88.5	22.6	0	0	107.2	S82 G86	S82-Q84 PolarHBondContact O-N 2.83Å; S82-Q84 VanDerWaalsContact O-N 3.16Å; Q84-G86 PolarHBondContact O-N 3.11Å
85	H	31.4	Very low	43.6	Very low	164 Å²	164	110.7 Å²	110.7	76%	0.759	62%	0.624	S	S	*	*			trans	-57.8	108.4	166.8	-84.1	41.1	0	0	0	107.1	E83	E83-H85 VanDerWaalsContact C-N 3.35Å; E83-H85 PolarHBondContact O-N 2.7Å
86	G	34.1	Very low	46.1	Very low	65 Å²	65	109.1 Å²	109.1	67%	0.67	60%	0.603	S	S	*	*			trans	-66.5	134.6	167.5	0	0	0	0	0	108.1	Q84 D88	Q84-G86 PolarHBondContact O-N 3.11Å; G86-D88 PolarHBondContact O-N 3.03Å
87	D	36	Very low	48.5	Very low	142 Å²	142	102.3 Å²	102.3	76%	0.759	59%	0.586	S	S	*	*			trans	-54.1	132.4	175.8	-60.5	-76.5	0	0	0	109.8	L89	D87-L89 HydrophobicContact CB-CD1 4.42Å; D87-L89 HydrophobicContact CB-CG 4.1Å; D87-L89 PolarHBondContact O-N 3.04Å
88	D	44.4	Very low	51.2	Low	148 Å²	148	95.5 Å²	95.5	79%	0.791	55%	0.55	S	S	*	.			trans	-76.7	58.2	176.2	-138.4	-10.9	0	0	0	110	G86 I90	G86-D88 PolarHBondContact O-N 3.03Å; D88-I90 PolarHBondContact O-N 2.96Å
89	L	50.6	Low	53.9	Low	99 Å²	99	92.6 Å²	92.6	52%	0.518	53%	0.533	S	S	.	.			trans	-55.2	128.5	166.7	-70.7	159.4	0	0	0	107.4	Y61 D87 V91	Y61-L89 HydrophobicContact CE1-CD2 4.06Å; D87-L89 HydrophobicContact CB-CD1 4.42Å; D87-L89 HydrophobicContact CB-CG 4.1Å; D87-L89 PolarHBondContact O-N 3.04Å; L89-V91 HydrophobicContact CB-CG2 4.35Å; L89-V91 PolarHBondContact O-N 3.16Å
90	I	48.9	Very low	56.5	Low	32 Å²	32	90.4 Å²	90.4	16%	0.164	52%	0.518	C	S	.	.			trans	-73.2	80.5	173.1	-52.3	176.3	0	0	0	109.7	L60 D88 K174 F175 M178	L60-I90 HydrophobicContact CB-CD1 3.99Å; L60-I90 HydrophobicContact CD2-CD1 3.92Å; L60-I90 WeakPolarHBondContact O-CD1 3.29Å; L60-I90 WeakPolarHBondContact O-CG1 3.42Å; D88-I90 PolarHBondContact O-N 2.96Å; I90-K174 HydrophobicContact CG2-CD 4.42Å; I90-F175 HydrophobicContact CB-CE1 4.32Å; I90-F175 HydrophobicContact CD1-CE1 4.38Å; I90-F175 HydrophobicContact CG2-CD1 4.39Å; I90-F175 HydrophobicContact CG2-CE1 3.59Å; I90-F175 HydrophobicContact CG2-CZ 4.2Å; I90-M178 HydrophobicContact CD1-CE 3.55Å; I90-M178 HydrophobicContact CD1-SD 4.06Å; I90-M178 HydrophobicContact CG1-CE 4.28Å
91	V	65.4	Low	59.4	Low	63 Å²	63	85.2 Å²	85.2	38%	0.382	49%	0.49	S	S	.	.			trans	-64.6	141.3	163	-175.1	0	0	0	0	107.8	L89 A95 Q96 K174	L89-V91 HydrophobicContact CB-CG2 4.35Å; L89-V91 PolarHBondContact O-N 3.16Å; V91-A95 HydrophobicContact CG1-CB 3.76Å; V91-Q96 HydrophobicContact CB-CB 4.48Å; V91-Q96 HydrophobicContact CG1-CB 4.18Å; V91-K174 PolarHBondContact O-NZ 3.08Å
92	T	71.9	Confident	62.1	Low	48 Å²	48	85 Å²	85	29%	0.294	47%	0.474	S	S	.	.			trans	-58.8	140.1	172.9	59.8	0	0	0	0	108.8	F94 A95 Q96 A171	T92-F94 PolarHBondContact O-N 3.32Å; T92-F94 VanDerWaalsContact O-N 3.17Å; T92-A95 PolarHBondContact O-N 3.31Å; T92-A95 WeakPolarHBondContact OG1-CB 3.43Å; T92-A95 PolarHBondContact OG1-N 3.41Å; T92-Q96 PolarHBondContact O-N 2.78Å; T92-A171 HydrophobicContact CG2-CB 3.85Å
93	P	76.8	Confident	65.1	Low	34 Å²	34	83 Å²	83	22%	0.221	46%	0.46	C	S	.	.	H	α-helix	trans	-59.7	-34.3	-173.5	23.3	-31.9	0	0	0	111.8	Q96 V97 M170 K174	P93-Q96 PolarHBondContact O-N 3.11Å; P93-V97 WeakPolarHBondContact O-CG2 3.36Å; P93-V97 PolarHBondContact O-N 3.27Å; P93-M170 HydrophobicContact CG-CB 3.85Å; P93-M170 WeakPolarHBondContact CG-O 3.28Å; P93-K174 HydrophobicContact CB-CD 4.16Å; P93-K174 HydrophobicContact CG-CB 4.26Å; P93-K174 HydrophobicContact CG-CD 4.09Å
94	F	77.9	Confident	68.1	Low	24 Å²	24	78.9 Å²	78.9	11%	0.105	45%	0.447	C	S	.	.	H	α-helix	trans	-58.1	-53	172.1	-177.1	-93	0	0	0	112.7	T92 Q96 V97 L98 L158 Q162 V167 M170	T92-F94 PolarHBondContact O-N 3.32Å; T92-F94 VanDerWaalsContact O-N 3.17Å; F94-Q96 VanDerWaalsContact C-N 3.26Å; F94-Q96 PolarHBondContact O-N 3.38Å; F94-V97 PolarHBondContact O-N 3.05Å; F94-L98 HydrophobicContact CE1-CD2 4.33Å; F94-L98 WeakPolarHBondContact O-CB 3.42Å; F94-L98 PolarHBondContact O-N 2.92Å; F94-L158 HydrophobicContact CE2-CD2 4.48Å; F94-L158 VanDerWaalsContact CZ-O 3.3Å; F94-L158 WeakPolarHBondContact CZ-O 3.25Å; F94-Q162 HydrophobicContact CD1-CG 4.4Å; F94-Q162 HydrophobicContact CE1-CG 3.56Å; F94-Q162 HydrophobicContact CZ-CG 3.7Å; F94-V167 HydrophobicContact CB-CG1 4.08Å; F94-V167 HydrophobicContact CD1-CG1 4.29Å; F94-V167 HydrophobicContact CD1-CG2 4.09Å; F94-V167 HydrophobicContact CD2-CG2 4.4Å; F94-V167 HydrophobicContact CG-CG1 4.32Å; F94-V167 HydrophobicContact CG-CG2 4.05Å; F94-M170 HydrophobicContact CB-SD 4.13Å; F94-M170 HydrophobicContact CD2-SD 4.25Å
95	A	79.9	Confident	71	Confident	36 Å²	36	73.9 Å²	73.9	30%	0.298	42%	0.42	S	S	.	.	H	α-helix	trans	-66.7	-28.8	179.8	0	0	0	0	0	112.7	V91 T92 A99	V91-A95 HydrophobicContact CG1-CB 3.76Å; T92-A95 PolarHBondContact O-N 3.31Å; T92-A95 WeakPolarHBondContact OG1-CB 3.43Å; T92-A95 PolarHBondContact OG1-N 3.41Å; A95-A99 VanDerWaalsContact O-CB 3.28Å; A95-A99 WeakPolarHBondContact O-CB 3.48Å; A95-A99 PolarHBondContact O-N 2.95Å
96	Q	81.4	Confident	73.9	Confident	94 Å²	94	70.1 Å²	70.1	44%	0.439	41%	0.406	S	S	.	.	H	α-helix	trans	-67.7	-42.8	173.1	-172.1	173.6	8.8	0	0	111.4	V91 T92 P93 F94 S100 K174	V91-Q96 HydrophobicContact CB-CB 4.48Å; V91-Q96 HydrophobicContact CG1-CB 4.18Å; T92-Q96 PolarHBondContact O-N 2.78Å; P93-Q96 PolarHBondContact O-N 3.11Å; F94-Q96 VanDerWaalsContact C-N 3.26Å; F94-Q96 PolarHBondContact O-N 3.38Å; Q96-S100 WeakPolarHBondContact O-CB 3.42Å; Q96-S100 PolarHBondContact O-N 3.4Å; Q96-S100 VanDerWaalsContact O-N 3.11Å; Q96-S100 PolarHBondContact O-OG 3.32Å; Q96-K174 VanDerWaalsContact OE1-NZ 3.12Å
97	V	83.8	Confident	76.6	Confident	80 Å²	80	71 Å²	71	49%	0.485	40%	0.395	S	S	.	.	H	α-helix	trans	-65.7	-46.6	173.2	170.4	0	0	0	0	110.5	P93 F94 A99 S100 L101	P93-V97 WeakPolarHBondContact O-CG2 3.36Å; P93-V97 PolarHBondContact O-N 3.27Å; F94-V97 PolarHBondContact O-N 3.05Å; V97-A99 PolarHBondContact O-N 3.37Å; V97-S100 CarbonylContact O-C 3.58Å; V97-S100 WeakPolarHBondContact O-CA 3.39Å; V97-S100 WeakPolarHBondContact O-CB 3.47Å; V97-S100 PolarHBondContact O-N 3.32Å; V97-L101 HydrophobicContact CG1-CD1 3.8Å; V97-L101 HydrophobicContact CG1-CG 4.18Å; V97-L101 WeakPolarHBondContact O-CG 3.25Å; V97-L101 PolarHBondContact O-N 2.84Å
98	L	83.8	Confident	79.2	Confident	17 Å²	17	67 Å²	67	9%	0.089	37%	0.371	C	S	.	.	H	α-helix	trans	-60.1	-45.1	179.8	-168.2	76.1	0	0	0	112.2	F94 S100 L101 R102 L155 L158 E159	F94-L98 HydrophobicContact CE1-CD2 4.33Å; F94-L98 WeakPolarHBondContact O-CB 3.42Å; F94-L98 PolarHBondContact O-N 2.92Å; L98-S100 VanDerWaalsContact C-N 3.28Å; L98-S100 PolarHBondContact O-N 3.04Å; L98-L101 PolarHBondContact O-N 3.36Å; L98-R102 WeakPolarHBondContact O-CB 3.17Å; L98-R102 VanDerWaalsContact O-CG 3.27Å; L98-R102 WeakPolarHBondContact O-CG 3.37Å; L98-R102 PolarHBondContact O-N 3.19Å; L98-L155 HydrophobicContact CD1-CD2 4.05Å; L98-L158 HydrophobicContact CD1-CB 4.48Å; L98-E159 HydrophobicContact CD1-CG 3.58Å; L98-E159 HydrophobicContact CD2-CG 3.78Å; L98-E159 HydrophobicContact CG-CG 4.28Å
99	A	84.8	Confident	81.4	Confident	58 Å²	58	60.6 Å²	60.6	48%	0.479	34%	0.337	S	S	.	.	H	α-helix	trans	-61.8	-36.9	174	0	0	0	0	0	112.2	A95 V97 S103	A95-A99 VanDerWaalsContact O-CB 3.28Å; A95-A99 WeakPolarHBondContact O-CB 3.48Å; A95-A99 PolarHBondContact O-N 2.95Å; V97-A99 PolarHBondContact O-N 3.37Å; A99-S103 WeakPolarHBondContact O-CB 3.47Å; A99-S103 PolarHBondContact O-N 3.5Å
100	S	87.1	Confident	83.2	Confident	65 Å²	65	60.6 Å²	60.6	46%	0.455	34%	0.337	S	S	.	.	H	α-helix	trans	-67.8	-46.1	176.4	-56.1	0	0	0	0	111.8	Q96 V97 L98 S103 V104	Q96-S100 WeakPolarHBondContact O-CB 3.42Å; Q96-S100 PolarHBondContact O-N 3.4Å; Q96-S100 VanDerWaalsContact O-N 3.11Å; Q96-S100 PolarHBondContact O-OG 3.32Å; V97-S100 CarbonylContact O-C 3.58Å; V97-S100 WeakPolarHBondContact O-CA 3.39Å; V97-S100 WeakPolarHBondContact O-CB 3.47Å; V97-S100 PolarHBondContact O-N 3.32Å; L98-S100 VanDerWaalsContact C-N 3.28Å; L98-S100 PolarHBondContact O-N 3.04Å; S100-S103 CarbonylContact O-C 3.53Å; S100-S103 WeakPolarHBondContact O-CA 3.31Å; S100-S103 WeakPolarHBondContact O-CB 3.25Å; S100-S103 PolarHBondContact O-N 2.95Å; S100-S103 VanDerWaalsContact O-N 3.15Å; S100-V104 WeakPolarHBondContact O-CG2 3.45Å; S100-V104 PolarHBondContact O-N 3.2Å
101	L	89.2	Confident	85.1	Confident	55 Å²	55	65.2 Å²	65.2	29%	0.288	36%	0.361	S	S	.	.	H	α-helix	trans	-65.1	-43.3	178	-69.8	173.6	0	0	0	112	V97 L98 S103 V104 R105 L155 L158	V97-L101 HydrophobicContact CG1-CD1 3.8Å; V97-L101 HydrophobicContact CG1-CG 4.18Å; V97-L101 WeakPolarHBondContact O-CG 3.25Å; V97-L101 PolarHBondContact O-N 2.84Å; L98-L101 PolarHBondContact O-N 3.36Å; L101-S103 PolarHBondContact O-N 2.7Å; L101-V104 PolarHBondContact O-N 3.24Å; L101-V104 VanDerWaalsContact O-N 3.12Å; L101-R105 WeakPolarHBondContact O-CB 3.45Å; L101-R105 PolarHBondContact O-N 3.22Å; L101-L155 HydrophobicContact CB-CD2 3.75Å; L101-L158 HydrophobicContact CD1-CD1 3.71Å
102	R	88.3	Confident	86	Confident	113 Å²	113	62.8 Å²	62.8	43%	0.426	35%	0.346	S	S	.	.	H	α-helix	trans	-58.6	-36.1	171.6	-72	166.8	166.4	-161.3	-7	111.9	L98 N106 L155 E159	L98-R102 WeakPolarHBondContact O-CB 3.17Å; L98-R102 VanDerWaalsContact O-CG 3.27Å; L98-R102 WeakPolarHBondContact O-CG 3.37Å; L98-R102 PolarHBondContact O-N 3.19Å; R102-N106 WeakPolarHBondContact O-CB 3.3Å; R102-N106 VanDerWaalsContact O-CG 3.23Å; R102-N106 PolarHBondContact O-N 3.49Å; R102-N106 PolarHBondContact O-ND2 3.28Å; R102-L155 HydrophobicContact CG-CD1 4.46Å; R102-L155 HydrophobicContact CG-CD2 4.13Å; R102-E159 IonicContact CZ-OE1 3.85Å; R102-E159 IonicContact CZ-OE2 3.35Å; R102-E159 IonicContact NE-OE1 2.71Å; R102-E159 PolarHBondContact NE-OE1 3.35Å; R102-E159 IonicContact NH2-OE1 3.14Å; R102-E159 PolarHBondContact NH2-OE1 2.84Å; R102-E159 IonicContact NH2-OE2 2.75Å; R102-E159 PolarHBondContact NH2-OE2 2.81Å
103	S	90.6	Very high	86.2	Confident	62 Å²	62	66.9 Å²	66.9	43%	0.434	37%	0.367	S	S	.	.	H	α-helix	trans	-69.1	-42.1	173	-170.6	0	0	0	0	112.5	A99 S100 L101 N106 N107	A99-S103 WeakPolarHBondContact O-CB 3.47Å; A99-S103 PolarHBondContact O-N 3.5Å; S100-S103 CarbonylContact O-C 3.53Å; S100-S103 WeakPolarHBondContact O-CA 3.31Å; S100-S103 WeakPolarHBondContact O-CB 3.25Å; S100-S103 PolarHBondContact O-N 2.95Å; S100-S103 VanDerWaalsContact O-N 3.15Å; L101-S103 PolarHBondContact O-N 2.7Å; S103-N106 PolarHBondContact O-N 3.14Å; S103-N107 PolarHBondContact O-N 3.24Å; S103-N107 PolarHBondContact O-ND2 3.46Å
104	V	92.7	Very high	85.8	Confident	85 Å²	85	67.3 Å²	67.3	52%	0.515	37%	0.367	S	S	.	.	H	α-helix	trans	-59.6	-48.4	173.8	170.1	0	0	0	0	110.6	S100 L101 N106 N107 F108	S100-V104 WeakPolarHBondContact O-CG2 3.45Å; S100-V104 PolarHBondContact O-N 3.2Å; L101-V104 PolarHBondContact O-N 3.24Å; L101-V104 VanDerWaalsContact O-N 3.12Å; V104-N106 PolarHBondContact O-N 3.29Å; V104-N107 PolarHBondContact O-N 2.99Å; V104-N107 VanDerWaalsContact O-N 3.17Å; V104-F108 WeakPolarHBondContact O-CB 3.33Å; V104-F108 PolarHBondContact O-N 2.64Å
105	R	93.1	Very high	84.7	Confident	68 Å²	68	72.4 Å²	72.4	26%	0.257	39%	0.391	S	S	.	.	H	α-helix	trans	-55.9	-46.4	175.5	-173.6	-83.3	-173.7	-170.1	-3.8	112.1	L101 N107 F108 T109 L148 L151 D152 L155	L101-R105 WeakPolarHBondContact O-CB 3.45Å; L101-R105 PolarHBondContact O-N 3.22Å; R105-N107 PolarHBondContact O-N 3.44Å; R105-F108 WeakPolarHBondContact O-CB 3.38Å; R105-F108 PolarHBondContact O-N 2.95Å; R105-T109 PolarHBondContact O-N 3.18Å; R105-T109 VanDerWaalsContact O-N 3.14Å; R105-L148 HydrophobicContact CG-CD1 4.1Å; R105-L151 HydrophobicContact CB-CD2 3.77Å; R105-L151 HydrophobicContact CB-CG 4.29Å; R105-L151 HydrophobicContact CG-CD2 3.92Å; R105-L151 HydrophobicContact CG-CG 4.22Å; R105-D152 WeakPolarHBondContact CG-OD1 3.47Å; R105-D152 IonicContact CZ-OD1 3.48Å; R105-D152 IonicContact CZ-OD2 3.45Å; R105-D152 IonicContact NE-OD1 2.69Å; R105-D152 PolarHBondContact NE-OD1 3.4Å; R105-D152 IonicContact NE-OD2 3.39Å; R105-D152 PolarHBondContact NE-OD2 2.74Å; R105-D152 IonicContact NH2-OD1 3.47Å; R105-D152 PolarHBondContact NH2-OD1 2.7Å; R105-D152 IonicContact NH2-OD2 2.68Å; R105-D152 PolarHBondContact NH2-OD2 3.26Å; R105-L155 HydrophobicContact CB-CD1 4.02Å; R105-L155 HydrophobicContact CG-CD1 4.02Å
106	N	90.5	Very high	83	Confident	84 Å²	84	73.7 Å²	73.7	45%	0.449	41%	0.408	S	S	.	.	H	α-helix	trans	-65.9	-36.2	177.8	-72.8	-23.9	0	0	0	113	R102 S103 V104 T109 I110	R102-N106 WeakPolarHBondContact O-CB 3.3Å; R102-N106 VanDerWaalsContact O-CG 3.23Å; R102-N106 PolarHBondContact O-N 3.49Å; R102-N106 PolarHBondContact O-ND2 3.28Å; S103-N106 PolarHBondContact O-N 3.14Å; V104-N106 PolarHBondContact O-N 3.29Å; N106-T109 PolarHBondContact O-OG1 2.95Å; N106-I110 WeakPolarHBondContact O-CD1 3.17Å; N106-I110 WeakPolarHBondContact O-CG1 3.01Å
107	N	91.6	Very high	81	Confident	85 Å²	85	75.9 Å²	75.9	46%	0.455	43%	0.428	S	S	.	.	H	α-helix	trans	-71.6	-33.7	173.1	-71.8	-59.4	0	0	0	111.9	S103 V104 R105 I110 L111	S103-N107 PolarHBondContact O-N 3.24Å; S103-N107 PolarHBondContact O-ND2 3.46Å; V104-N107 PolarHBondContact O-N 2.99Å; V104-N107 VanDerWaalsContact O-N 3.17Å; R105-N107 PolarHBondContact O-N 3.44Å; N107-I110 PolarHBondContact O-N 3.48Å; N107-L111 VanDerWaalsContact O-CG 3.31Å; N107-L111 WeakPolarHBondContact O-CG 3.39Å; N107-L111 PolarHBondContact O-N 2.72Å
108	F	91.8	Very high	78.7	Confident	57 Å²	57	76.7 Å²	76.7	25%	0.25	44%	0.437	C	S	.	.	H	α-helix	trans	-61.9	-47.3	177.2	-174.1	-96.2	0	0	0	112	V104 R105 I110 L111 T112 A144 T147 L148	V104-F108 WeakPolarHBondContact O-CB 3.33Å; V104-F108 PolarHBondContact O-N 2.64Å; R105-F108 WeakPolarHBondContact O-CB 3.38Å; R105-F108 PolarHBondContact O-N 2.95Å; F108-I110 PolarHBondContact O-N 3.49Å; F108-L111 PolarHBondContact O-N 2.97Å; F108-L111 VanDerWaalsContact O-N 3.13Å; F108-T112 HydrophobicContact CD1-CG2 4.09Å; F108-T112 HydrophobicContact CD2-CG2 4.3Å; F108-T112 HydrophobicContact CE1-CG2 3.74Å; F108-T112 HydrophobicContact CE2-CG2 3.96Å; F108-T112 HydrophobicContact CG-CG2 4.36Å; F108-T112 HydrophobicContact CZ-CG2 3.68Å; F108-T112 WeakPolarHBondContact O-CG2 3.38Å; F108-T112 PolarHBondContact O-N 2.94Å; F108-T112 PolarHBondContact O-OG1 2.95Å; F108-A144 WeakPolarHBondContact CE1-O 3.4Å; F108-T147 WeakPolarHBondContact CZ-OG1 3.48Å; F108-L148 HydrophobicContact CD1-CB 4.48Å; F108-L148 HydrophobicContact CD1-CD1 4.27Å; F108-L148 HydrophobicContact CE1-CB 4.13Å
109	T	89.1	Confident	76.8	Confident	13 Å²	13	82.9 Å²	82.9	8%	0.08	47%	0.47	C	S	.	.	H	α-helix	trans	-65.5	-19.9	177.6	62.9	0	0	0	0	114.1	R105 N106 L114 H115 L148	R105-T109 PolarHBondContact O-N 3.18Å; R105-T109 VanDerWaalsContact O-N 3.14Å; N106-T109 PolarHBondContact O-OG1 2.95Å; T109-L114 PolarHBondContact O-N 2.97Å; T109-H115 PolarHBondContact O-ND1 2.75Å; T109-H115 PolarHBondContact OG1-CE1 3.17Å; T109-L148 HydrophobicContact CG2-CD1 3.68Å; T109-L148 HydrophobicContact CG2-CD2 3.76Å; T109-L148 HydrophobicContact CG2-CG 4.41Å
110	I	89	Confident	74.5	Confident	99 Å²	99	88.9 Å²	88.9	51%	0.508	49%	0.485	S	S	.	.	H	α-helix	trans	-79.7	-48.6	171	-63.9	167.8	0	0	0	110	N106 N107 F108 T112 N113	N106-I110 WeakPolarHBondContact O-CD1 3.17Å; N106-I110 WeakPolarHBondContact O-CG1 3.01Å; N107-I110 PolarHBondContact O-N 3.48Å; F108-I110 PolarHBondContact O-N 3.49Å; I110-T112 PolarHBondContact O-N 3.02Å; I110-N113 PolarHBondContact O-N 3.28Å
111	L	87.9	Confident	72.2	Confident	130 Å²	130	96.9 Å²	96.9	68%	0.681	51%	0.505	S	S	*	.	H	α-helix	trans	-64.5	-36.2	-177.5	-72	168.3	0	0	0	113.3	N107 F108 N113	N107-L111 VanDerWaalsContact O-CG 3.31Å; N107-L111 WeakPolarHBondContact O-CG 3.39Å; N107-L111 PolarHBondContact O-N 2.72Å; F108-L111 PolarHBondContact O-N 2.97Å; F108-L111 VanDerWaalsContact O-N 3.13Å; L111-N113 VanDerWaalsContact C-N 3.35Å
112	T	84.9	Confident	69.4	Low	11 Å²	11	99.4 Å²	99.4	7%	0.067	53%	0.528	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-6.2	179.5	55.3	0	0	0	0	114	F108 I110 L114 A144	F108-T112 HydrophobicContact CD1-CG2 4.09Å; F108-T112 HydrophobicContact CD2-CG2 4.3Å; F108-T112 HydrophobicContact CE1-CG2 3.74Å; F108-T112 HydrophobicContact CE2-CG2 3.96Å; F108-T112 HydrophobicContact CG-CG2 4.36Å; F108-T112 HydrophobicContact CZ-CG2 3.68Å; F108-T112 WeakPolarHBondContact O-CG2 3.38Å; F108-T112 PolarHBondContact O-N 2.94Å; F108-T112 PolarHBondContact O-OG1 2.95Å; I110-T112 PolarHBondContact O-N 3.02Å; T112-L114 PolarHBondContact O-N 2.85Å; T112-L114 WeakPolarHBondContact OG1-CD1 3.42Å; T112-L114 WeakPolarHBondContact OG1-CG 3.46Å; T112-A144 HydrophobicContact CG2-CB 3.82Å
113	N	77.1	Confident	67.4	Low	135 Å²	135	100.4 Å²	100.4	72%	0.722	55%	0.549	S	S	*	.			trans	56.4	23.7	-172	-61.3	-84.4	0	0	0	114.9	I110 L111 H115	I110-N113 PolarHBondContact O-N 3.28Å; L111-N113 VanDerWaalsContact C-N 3.35Å; N113-H115 PolarHBondContact O-N 3.17Å
114	L	66.6	Low	64.8	Low	43 Å²	43	102.2 Å²	102.2	23%	0.225	57%	0.568	C	S	.	*			trans	-68.9	5.7	175	-68.7	173.3	0	0	0	114.2	T109 T112 G116 A144 M145 L148	T109-L114 PolarHBondContact O-N 2.97Å; T112-L114 PolarHBondContact O-N 2.85Å; T112-L114 WeakPolarHBondContact OG1-CD1 3.42Å; T112-L114 WeakPolarHBondContact OG1-CG 3.46Å; L114-G116 PolarHBondContact O-N 3.03Å; L114-A144 HydrophobicContact CD1-CB 4.07Å; L114-A144 VanDerWaalsContact CD1-O 3.29Å; L114-A144 WeakPolarHBondContact CD1-O 3.15Å; L114-M145 HydrophobicContact CD2-CE 4.36Å; L114-L148 HydrophobicContact CD1-CB 4.31Å; L114-L148 HydrophobicContact CD1-CD2 3.86Å
115	H	55.5	Low	62.3	Low	130 Å²	130	103.1 Å²	103.1	60%	0.602	58%	0.584	S	S	*	*			trans	-63.4	96.8	166.5	-81.8	66.8	0	0	0	109.9	T109 N113	T109-H115 PolarHBondContact O-ND1 2.75Å; T109-H115 PolarHBondContact OG1-CE1 3.17Å; N113-H115 PolarHBondContact O-N 3.17Å
116	G	45	Very low	59.7	Low	64 Å²	64	105.6 Å²	105.6	66%	0.66	61%	0.612	S	S	*	*			trans	-54.4	159.3	-170.8	0	0	0	0	0	115.3	L114 S118	L114-G116 PolarHBondContact O-N 3.03Å; G116-S118 VanDerWaalsContact C-N 3.26Å; G116-S118 PolarHBondContact O-N 3.43Å
117	T	39.4	Very low	57.2	Low	140 Å²	140	110.4 Å²	110.4	86%	0.859	63%	0.632	S	S	*	*			trans	-63.9	76.4	-179.3	39.1	0	0	0	0	112.7	N119	T117-N119 PolarHBondContact O-N 2.71Å
118	S	35.1	Very low	54.6	Low	96 Å²	96	111.7 Å²	111.7	67%	0.671	65%	0.645	S	S	*	*			trans	-50.9	108.2	177	-179.8	0	0	0	0	111.2	G116 K120	G116-S118 VanDerWaalsContact C-N 3.26Å; G116-S118 PolarHBondContact O-N 3.43Å; S118-K120 VanDerWaalsContact C-N 3.27Å; S118-K120 PolarHBondContact O-N 3.3Å
119	N	43.2	Very low	52.3	Low	147 Å²	147	114.2 Å²	114.2	79%	0.786	67%	0.667	S	S	*	*			trans	-68.8	71.4	-172.2	-107.6	-50.7	0	0	0	113.3	T117 R121	T117-N119 PolarHBondContact O-N 2.71Å; N119-R121 VanDerWaalsContact C-N 3.34Å; N119-R121 PolarHBondContact O-N 3.03Å
120	K	36.8	Very low	50.1	Low	184 Å²	184	120.3 Å²	120.3	80%	0.8	70%	0.704	S	S	*	*			trans	-88.8	74.6	167	-72.8	-170.2	177.6	177.3	0	110.5	S118 S122	S118-K120 VanDerWaalsContact C-N 3.27Å; S118-K120 PolarHBondContact O-N 3.3Å; K120-S122 PolarHBondContact O-N 3.17Å
121	R	37.7	Very low	47.9	Very low	233 Å²	233	120.2 Å²	120.2	88%	0.879	71%	0.712	S	S	*	*			trans	-70.9	82.4	-176.7	-160.6	-178.9	-161.9	179.7	7.6	112.2	N119	N119-R121 VanDerWaalsContact C-N 3.34Å; N119-R121 PolarHBondContact O-N 3.03Å
122	S	31.8	Very low	45.8	Very low	109 Å²	109	125.2 Å²	125.2	76%	0.762	72%	0.722	S	S	*	*			trans	-93.1	122.7	170.7	-70.1	0	0	0	0	111.1	K120 A124	K120-S122 PolarHBondContact O-N 3.17Å; S122-A124 PolarHBondContact O-N 3.03Å
123	P	45.5	Very low	44	Very low	133 Å²	133	128.9 Å²	128.9	86%	0.864	74%	0.744	S	S	*	*			trans	-89	102.6	-173.2	32.9	-33.5	0	0	0	113.1
124	A	37.3	Very low	42.9	Very low	101 Å²	101	126.1 Å²	126.1	84%	0.835	73%	0.729	S	S	*	*			trans	-148.1	139.1	163.9	0	0	0	0	0	110.6	S122	S122-A124 PolarHBondContact O-N 3.03Å
125	A	40.2	Very low	42.3	Very low	103 Å²	103	128.4 Å²	128.4	85%	0.851	75%	0.746	S	S	*	*			trans	-84.7	135.9	-167.2	0	0	0	0	0	114.4
126	S	37.4	Very low	42.5	Very low	121 Å²	121	128.9 Å²	128.9	85%	0.846	75%	0.749	S	S	*	*			trans	-167.7	166.7	139.5	30.7	0	0	0	0	110
127	Q	37.4	Very low	43.6	Very low	184 Å²	184	130.6 Å²	130.6	86%	0.86	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-70.7	147	-171.1	-66.4	174.3	-30.6	0	0	112.8
128	P	38.4	Very low	45.2	Very low	113 Å²	113	129.5 Å²	129.5	73%	0.734	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-72.8	135.9	165	31.3	-32.7	0	0	0	110.2
129	P	43.8	Very low	47.3	Very low	109 Å²	109	128.6 Å²	128.6	71%	0.708	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-67.2	141.9	156.7	31.1	-32.1	0	0	0	108.7	S131	P129-S131 VanDerWaalsContact C-N 3.32Å; P129-S131 PolarHBondContact O-N 2.8Å
130	V	42.8	Very low	49.3	Very low	142 Å²	142	127.4 Å²	127.4	86%	0.861	70%	0.704	S	S	*	*			trans	-74.6	89.6	173.3	-178	0	0	0	0	108.6	R132	V130-R132 PolarHBondContact O-N 3.17Å
131	S	42.5	Very low	51.6	Low	97 Å²	97	124 Å²	124	68%	0.678	69%	0.691	S	S	*	*			trans	-59.2	121.1	163.8	-66	0	0	0	0	108.5	P129 V133	P129-S131 VanDerWaalsContact C-N 3.32Å; P129-S131 PolarHBondContact O-N 2.8Å; S131-V133 PolarHBondContact O-N 3.13Å
132	R	44.1	Very low	53.8	Low	235 Å²	235	119 Å²	119	89%	0.887	68%	0.676	S	S	*	*			trans	-69.9	98.9	165.6	-71.6	179.2	174.1	179.8	-3.5	107.2	V130 N134	V130-R132 PolarHBondContact O-N 3.17Å; R132-N134 PolarHBondContact O-N 3.45Å
133	V	46.6	Very low	56.5	Low	88 Å²	88	118.8 Å²	118.8	53%	0.533	67%	0.665	S	S	.	*			trans	-56.1	123	165.4	-179.4	0	0	0	0	106.8	S131 E138	S131-V133 PolarHBondContact O-N 3.13Å; V133-E138 HydrophobicContact CG1-CG 3.83Å
134	N	54	Low	58.6	Low	76 Å²	76	112.7 Å²	112.7	41%	0.406	63%	0.626	S	S	.	*			trans	-88.1	124.6	-178.3	-169.5	31.1	0	0	0	107.4	R132 Q136 E137	R132-N134 PolarHBondContact O-N 3.45Å; N134-Q136 PolarHBondContact ND2-OE1 2.95Å; N134-Q136 PolarHBondContact O-N 3.29Å; N134-E137 HydrophobicContact CB-CG 4.19Å; N134-E137 WeakPolarHBondContact CB-OE2 3.36Å; N134-E137 PolarHBondContact N-OE2 3.19Å; N134-E137 WeakPolarHBondContact O-CB 3.38Å; N134-E137 PolarHBondContact O-N 3.5Å
135	P	54	Low	61	Low	91 Å²	91	112.6 Å²	112.6	59%	0.591	61%	0.609	S	S	*	*	H	α-helix	trans	-56.7	-20.5	-172.5	-29.2	36.1	0	0	0	115.2	E137 S139	P135-E137 VanDerWaalsContact C-N 3.33Å; P135-S139 PolarHBondContact O-N 3.05Å; P135-S139 PolarHBondContact O-OG 3.2Å
136	Q	58.7	Low	63.4	Low	140 Å²	140	111.4 Å²	111.4	65%	0.654	59%	0.586	S	S	*	*	H	α-helix	trans	-67.3	-30.6	173.5	-62	177.6	-57.2	0	0	113	N134 S139 Y140	N134-Q136 PolarHBondContact ND2-OE1 2.95Å; N134-Q136 PolarHBondContact O-N 3.29Å; Q136-S139 WeakPolarHBondContact CA-OG 3.29Å; Q136-S139 PolarHBondContact O-OG 3.46Å; Q136-Y140 WeakPolarHBondContact O-CB 2.98Å; Q136-Y140 PolarHBondContact O-N 2.97Å
137	E	68.2	Low	65.9	Low	101 Å²	101	107.9 Å²	107.9	47%	0.472	56%	0.56	S	S	.	*	H	α-helix	trans	-72.2	-36.6	178.2	-64.3	174.7	132.4	0	0	111.4	N134 P135 Y140 Q141	N134-E137 HydrophobicContact CB-CG 4.19Å; N134-E137 WeakPolarHBondContact CB-OE2 3.36Å; N134-E137 PolarHBondContact N-OE2 3.19Å; N134-E137 WeakPolarHBondContact O-CB 3.38Å; N134-E137 PolarHBondContact O-N 3.5Å; P135-E137 VanDerWaalsContact C-N 3.33Å; E137-Y140 PolarHBondContact O-N 3.05Å; E137-Q141 WeakPolarHBondContact O-CB 3.47Å; E137-Q141 WeakPolarHBondContact O-CG 3.2Å; E137-Q141 PolarHBondContact O-N 3.37Å
138	E	73	Confident	68.5	Low	117 Å²	117	100.2 Å²	100.2	55%	0.547	53%	0.525	S	S	.	.	H	α-helix	trans	-65.5	-45.2	175.1	-64.6	177.9	157.6	0	0	111	V133 Y140 Q141 K142	V133-E138 HydrophobicContact CG1-CG 3.83Å; E138-Y140 VanDerWaalsContact C-N 3.29Å; E138-Y140 PolarHBondContact O-N 2.58Å; E138-Q141 PolarHBondContact O-N 2.92Å; E138-K142 WeakPolarHBondContact O-CB 3.28Å; E138-K142 PolarHBondContact O-N 2.75Å
139	S	80.2	Confident	70.9	Confident	76 Å²	76	100.6 Å²	100.6	53%	0.531	52%	0.516	S	S	.	.	H	α-helix	trans	-63.5	-33.2	173.8	54.9	0	0	0	0	113.3	P135 Q136 L143	P135-S139 PolarHBondContact O-N 3.05Å; P135-S139 PolarHBondContact O-OG 3.2Å; Q136-S139 WeakPolarHBondContact CA-OG 3.29Å; Q136-S139 PolarHBondContact O-OG 3.46Å; S139-L143 WeakPolarHBondContact O-CB 3.46Å; S139-L143 PolarHBondContact O-N 2.68Å
140	Y	84.8	Confident	73.1	Confident	123 Å²	123	101.5 Å²	101.5	48%	0.482	51%	0.511	S	S	.	.	H	α-helix	trans	-71.8	-43.9	176.1	172.8	-97.6	0	0	0	111.8	Q136 E137 E138 L143 A144	Q136-Y140 WeakPolarHBondContact O-CB 2.98Å; Q136-Y140 PolarHBondContact O-N 2.97Å; E137-Y140 PolarHBondContact O-N 3.05Å; E138-Y140 VanDerWaalsContact C-N 3.29Å; E138-Y140 PolarHBondContact O-N 2.58Å; Y140-L143 PolarHBondContact O-N 3.17Å; Y140-A144 VanDerWaalsContact O-CB 3.24Å; Y140-A144 WeakPolarHBondContact O-CB 3.23Å; Y140-A144 PolarHBondContact O-N 3.25Å
141	Q	85.1	Confident	75.3	Confident	113 Å²	113	96.7 Å²	96.7	53%	0.528	48%	0.48	S	S	.	.	H	α-helix	trans	-65.1	-39.9	177.6	-74.9	176.7	10.1	0	0	112	E137 E138 A144 M145	E137-Q141 WeakPolarHBondContact O-CB 3.47Å; E137-Q141 WeakPolarHBondContact O-CG 3.2Å; E137-Q141 PolarHBondContact O-N 3.37Å; E138-Q141 PolarHBondContact O-N 2.92Å; Q141-A144 PolarHBondContact O-N 2.74Å; Q141-M145 WeakPolarHBondContact O-CB 3.34Å; Q141-M145 PolarHBondContact O-N 2.91Å
142	K	84.7	Confident	77.6	Confident	128 Å²	128	94.5 Å²	94.5	56%	0.557	46%	0.461	S	S	*	.	H	α-helix	trans	-61	-52.8	174.9	-170.7	173.5	-176.3	-73.8	0	111.2	E138 A144 M145 E146	E138-K142 WeakPolarHBondContact O-CB 3.28Å; E138-K142 PolarHBondContact O-N 2.75Å; K142-A144 VanDerWaalsContact C-N 3.29Å; K142-A144 PolarHBondContact O-N 3.25Å; K142-M145 WeakPolarHBondContact O-CB 3.24Å; K142-M145 PolarHBondContact O-N 2.87Å; K142-E146 HydrophobicContact CG-CG 4.48Å; K142-E146 IonicContact NZ-OE1 2.56Å; K142-E146 PolarHBondContact NZ-OE1 3.02Å; K142-E146 IonicContact NZ-OE2 3.62Å; K142-E146 WeakPolarHBondContact O-CG 3.3Å; K142-E146 PolarHBondContact O-N 2.91Å
143	L	88.1	Confident	79.7	Confident	103 Å²	103	90.9 Å²	90.9	54%	0.539	45%	0.448	S	S	.	.	H	α-helix	trans	-60.6	-37.8	178	-177.6	64.2	0	0	0	112.4	S139 Y140 M145 T147	S139-L143 WeakPolarHBondContact O-CB 3.46Å; S139-L143 PolarHBondContact O-N 2.68Å; Y140-L143 PolarHBondContact O-N 3.17Å; L143-M145 VanDerWaalsContact C-N 3.33Å; L143-T147 HydrophobicContact CD1-CG2 4.21Å; L143-T147 WeakPolarHBondContact O-CB 3.46Å; L143-T147 WeakPolarHBondContact O-CG2 3.24Å; L143-T147 PolarHBondContact O-N 3.38Å; L143-T147 PolarHBondContact O-OG1 2.66Å
144	A	89.3	Confident	81.5	Confident	5 Å²	5	89.5 Å²	89.5	4%	0.041	44%	0.441	C	S	.	.	H	α-helix	trans	-68	-31	176.4	0	0	0	0	0	113.1	F108 T112 L114 Y140 Q141 K142 L148	F108-A144 WeakPolarHBondContact CE1-O 3.4Å; T112-A144 HydrophobicContact CG2-CB 3.82Å; L114-A144 HydrophobicContact CD1-CB 4.07Å; L114-A144 VanDerWaalsContact CD1-O 3.29Å; L114-A144 WeakPolarHBondContact CD1-O 3.15Å; Y140-A144 VanDerWaalsContact O-CB 3.24Å; Y140-A144 WeakPolarHBondContact O-CB 3.23Å; Y140-A144 PolarHBondContact O-N 3.25Å; Q141-A144 PolarHBondContact O-N 2.74Å; K142-A144 VanDerWaalsContact C-N 3.29Å; K142-A144 PolarHBondContact O-N 3.25Å; A144-L148 WeakPolarHBondContact O-CB 3.5Å; A144-L148 PolarHBondContact O-N 3.16Å
145	M	87.9	Confident	83	Confident	99 Å²	99	86.5 Å²	86.5	49%	0.488	43%	0.425	S	S	.	.	H	α-helix	trans	-75	-49.4	175.2	-175.3	165.6	-77.3	0	0	110.8	L114 Q141 K142 L143 T147 L148 E149	L114-M145 HydrophobicContact CD2-CE 4.36Å; Q141-M145 WeakPolarHBondContact O-CB 3.34Å; Q141-M145 PolarHBondContact O-N 2.91Å; K142-M145 WeakPolarHBondContact O-CB 3.24Å; K142-M145 PolarHBondContact O-N 2.87Å; L143-M145 VanDerWaalsContact C-N 3.33Å; M145-T147 VanDerWaalsContact C-N 3.35Å; M145-T147 PolarHBondContact O-N 2.84Å; M145-L148 WeakPolarHBondContact O-CB 3.15Å; M145-L148 PolarHBondContact O-N 2.76Å; M145-E149 WeakPolarHBondContact O-CG 3.34Å; M145-E149 PolarHBondContact O-N 2.89Å
146	E	89.9	Confident	84.4	Confident	78 Å²	78	86.3 Å²	86.3	36%	0.364	42%	0.419	S	S	.	.	H	α-helix	trans	-55.8	-47.3	176.5	-68.6	169.9	140.9	0	0	111.6	K142 L148 E149 E150	K142-E146 HydrophobicContact CG-CG 4.48Å; K142-E146 IonicContact NZ-OE1 2.56Å; K142-E146 PolarHBondContact NZ-OE1 3.02Å; K142-E146 IonicContact NZ-OE2 3.62Å; K142-E146 WeakPolarHBondContact O-CG 3.3Å; K142-E146 PolarHBondContact O-N 2.91Å; E146-L148 VanDerWaalsContact C-N 3.3Å; E146-L148 PolarHBondContact O-N 3.36Å; E146-E149 PolarHBondContact O-N 3.44Å; E146-E150 PolarHBondContact O-N 3.22Å
147	T	90.5	Very high	85.2	Confident	47 Å²	47	82.6 Å²	82.6	29%	0.288	40%	0.402	S	S	.	.	H	α-helix	trans	-73.1	-16.6	177.8	52.4	0	0	0	0	114.4	F108 L143 M145 L151	F108-T147 WeakPolarHBondContact CZ-OG1 3.48Å; L143-T147 HydrophobicContact CD1-CG2 4.21Å; L143-T147 WeakPolarHBondContact O-CB 3.46Å; L143-T147 WeakPolarHBondContact O-CG2 3.24Å; L143-T147 PolarHBondContact O-N 3.38Å; L143-T147 PolarHBondContact O-OG1 2.66Å; M145-T147 VanDerWaalsContact C-N 3.35Å; M145-T147 PolarHBondContact O-N 2.84Å; T147-L151 VanDerWaalsContact O-CB 3.29Å; T147-L151 WeakPolarHBondContact O-CB 3.36Å; T147-L151 PolarHBondContact O-N 3.07Å
148	L	92	Very high	85.6	Confident	24 Å²	24	81 Å²	81	13%	0.126	40%	0.396	C	S	.	.	H	α-helix	trans	-79	-40.8	168.8	178.8	61.9	0	0	0	111	R105 F108 T109 L114 A144 M145 E146 L151 D152	R105-L148 HydrophobicContact CG-CD1 4.1Å; F108-L148 HydrophobicContact CD1-CB 4.48Å; F108-L148 HydrophobicContact CD1-CD1 4.27Å; F108-L148 HydrophobicContact CE1-CB 4.13Å; T109-L148 HydrophobicContact CG2-CD1 3.68Å; T109-L148 HydrophobicContact CG2-CD2 3.76Å; T109-L148 HydrophobicContact CG2-CG 4.41Å; L114-L148 HydrophobicContact CD1-CB 4.31Å; L114-L148 HydrophobicContact CD1-CD2 3.86Å; A144-L148 WeakPolarHBondContact O-CB 3.5Å; A144-L148 PolarHBondContact O-N 3.16Å; M145-L148 WeakPolarHBondContact O-CB 3.15Å; M145-L148 PolarHBondContact O-N 2.76Å; E146-L148 VanDerWaalsContact C-N 3.3Å; E146-L148 PolarHBondContact O-N 3.36Å; L148-L151 PolarHBondContact O-N 3.29Å; L148-D152 WeakPolarHBondContact O-CB 3.46Å; L148-D152 PolarHBondContact O-N 2.7Å
149	E	89	Confident	85.7	Confident	120 Å²	120	78.2 Å²	78.2	56%	0.561	38%	0.383	S	S	*	.	H	α-helix	trans	-65	-44	176.8	-71.4	171.2	-174.8	0	0	111.1	M145 E146 L151 D152 W153	M145-E149 WeakPolarHBondContact O-CG 3.34Å; M145-E149 PolarHBondContact O-N 2.89Å; E146-E149 PolarHBondContact O-N 3.44Å; E149-L151 VanDerWaalsContact C-N 3.34Å; E149-L151 PolarHBondContact O-N 3.02Å; E149-D152 PolarHBondContact O-N 3.06Å; E149-W153 VanDerWaalsContact O-CB 3.31Å; E149-W153 WeakPolarHBondContact O-CB 3.46Å; E149-W153 PolarHBondContact O-N 3.32Å
150	E	88.9	Confident	85.2	Confident	129 Å²	129	78.7 Å²	78.7	60%	0.603	38%	0.383	S	S	*	.	H	α-helix	trans	-58.6	-42.2	170.7	-74.4	-176.9	162.4	0	0	112.4	E146 C154	E146-E150 PolarHBondContact O-N 3.22Å; E150-C154 WeakPolarHBondContact O-CB 3.37Å; E150-C154 PolarHBondContact O-N 2.73Å; E150-C154 PolarHBondContact O-SG 2.99Å
151	L	90.8	Very high	84.2	Confident	40 Å²	40	77.9 Å²	77.9	21%	0.209	39%	0.386	C	S	.	.	H	α-helix	trans	-70.2	-39.6	-179.9	178.9	59.3	0	0	0	112.6	R105 T147 L148 E149 C154 L155	R105-L151 HydrophobicContact CB-CD2 3.77Å; R105-L151 HydrophobicContact CB-CG 4.29Å; R105-L151 HydrophobicContact CG-CD2 3.92Å; R105-L151 HydrophobicContact CG-CG 4.22Å; T147-L151 VanDerWaalsContact O-CB 3.29Å; T147-L151 WeakPolarHBondContact O-CB 3.36Å; T147-L151 PolarHBondContact O-N 3.07Å; L148-L151 PolarHBondContact O-N 3.29Å; E149-L151 VanDerWaalsContact C-N 3.34Å; E149-L151 PolarHBondContact O-N 3.02Å; L151-C154 PolarHBondContact O-N 3.26Å; L151-L155 WeakPolarHBondContact O-CG 3.32Å; L151-L155 PolarHBondContact O-N 3.41Å
152	D	89.9	Confident	82.9	Confident	52 Å²	52	76.6 Å²	76.6	28%	0.278	38%	0.38	S	S	.	.	H	α-helix	trans	-69.7	-38.8	176.2	-77.9	-17.4	0	0	0	111.3	R105 L148 E149 L155 D156	R105-D152 WeakPolarHBondContact CG-OD1 3.47Å; R105-D152 IonicContact CZ-OD1 3.48Å; R105-D152 IonicContact CZ-OD2 3.45Å; R105-D152 IonicContact NE-OD1 2.69Å; R105-D152 PolarHBondContact NE-OD1 3.4Å; R105-D152 IonicContact NE-OD2 3.39Å; R105-D152 PolarHBondContact NE-OD2 2.74Å; R105-D152 IonicContact NH2-OD1 3.47Å; R105-D152 PolarHBondContact NH2-OD1 2.7Å; R105-D152 IonicContact NH2-OD2 2.68Å; R105-D152 PolarHBondContact NH2-OD2 3.26Å; L148-D152 WeakPolarHBondContact O-CB 3.46Å; L148-D152 PolarHBondContact O-N 2.7Å; E149-D152 PolarHBondContact O-N 3.06Å; D152-L155 PolarHBondContact O-N 3.24Å; D152-D156 PolarHBondContact O-N 2.88Å
153	W	87.4	Confident	81.7	Confident	159 Å²	159	74.7 Å²	74.7	60%	0.602	38%	0.379	S	S	*	.	H	α-helix	trans	-62.1	-46.7	170.4	-178.3	83.3	0	0	0	111.4	E149 L155 D156 Q157	E149-W153 VanDerWaalsContact O-CB 3.31Å; E149-W153 WeakPolarHBondContact O-CB 3.46Å; E149-W153 PolarHBondContact O-N 3.32Å; W153-L155 VanDerWaalsContact C-N 3.26Å; W153-L155 PolarHBondContact O-N 3.2Å; W153-D156 PolarHBondContact O-N 3.42Å; W153-Q157 HydrophobicContact CD2-CG 3.8Å; W153-Q157 VanDerWaalsContact CE2-CG 3.5Å; W153-Q157 HydrophobicContact CE3-CG 4.17Å; W153-Q157 HydrophobicContact CG-CG 4.35Å; W153-Q157 HydrophobicContact CH2-CG 4.02Å; W153-Q157 HydrophobicContact CZ2-CG 3.63Å; W153-Q157 HydrophobicContact CZ3-CG 4.27Å; W153-Q157 WeakPolarHBondContact O-CB 3.35Å; W153-Q157 VanDerWaalsContact O-CG 3.31Å; W153-Q157 WeakPolarHBondContact O-CG 3.24Å; W153-Q157 PolarHBondContact O-N 2.87Å
154	C	85.3	Confident	80.4	Confident	58 Å²	58	80.1 Å²	80.1	39%	0.392	39%	0.394	S	S	.	.	H	α-helix	trans	-60.6	-34.2	175.9	-73.1	0	0	0	0	112.8	E150 L151 L158	E150-C154 WeakPolarHBondContact O-CB 3.37Å; E150-C154 PolarHBondContact O-N 2.73Å; E150-C154 PolarHBondContact O-SG 2.99Å; L151-C154 PolarHBondContact O-N 3.26Å; C154-L158 WeakPolarHBondContact O-CB 3.37Å; C154-L158 WeakPolarHBondContact O-CG 3.42Å; C154-L158 PolarHBondContact O-N 2.78Å
155	L	85.6	Confident	79.2	Confident	14 Å²	14	89.4 Å²	89.4	7%	0.073	43%	0.428	C	S	.	.	H	α-helix	trans	-68.7	-46.3	174.2	-81.1	169.9	0	0	0	111.9	L98 L101 R102 R105 L151 D152 W153 L158 E159	L98-L155 HydrophobicContact CD1-CD2 4.05Å; L101-L155 HydrophobicContact CB-CD2 3.75Å; R102-L155 HydrophobicContact CG-CD1 4.46Å; R102-L155 HydrophobicContact CG-CD2 4.13Å; R105-L155 HydrophobicContact CB-CD1 4.02Å; R105-L155 HydrophobicContact CG-CD1 4.02Å; L151-L155 WeakPolarHBondContact O-CG 3.32Å; L151-L155 PolarHBondContact O-N 3.41Å; D152-L155 PolarHBondContact O-N 3.24Å; W153-L155 VanDerWaalsContact C-N 3.26Å; W153-L155 PolarHBondContact O-N 3.2Å; L155-L158 PolarHBondContact O-N 3.46Å; L155-E159 WeakPolarHBondContact O-CB 3.29Å; L155-E159 WeakPolarHBondContact O-CG 3.49Å; L155-E159 PolarHBondContact O-N 3.16Å
156	D	83.2	Confident	78.4	Confident	87 Å²	87	86.5 Å²	86.5	47%	0.465	42%	0.417	S	S	.	.	H	α-helix	trans	-61.3	-43.8	175.3	177.3	81.6	0	0	0	112	D152 W153 E159 T160	D152-D156 PolarHBondContact O-N 2.88Å; W153-D156 PolarHBondContact O-N 3.42Å; D156-E159 PolarHBondContact O-N 2.87Å; D156-E159 VanDerWaalsContact O-N 3.15Å; D156-T160 WeakPolarHBondContact O-CG2 3.45Å; D156-T160 PolarHBondContact O-N 3.27Å; D156-T160 PolarHBondContact O-OG1 3.03Å
157	Q	76.1	Confident	77.7	Confident	62 Å²	62	83.9 Å²	83.9	29%	0.29	41%	0.407	S	S	.	.	H	α-helix	trans	-64.1	-43.1	175.6	-65.9	-54.8	-80.9	0	0	111.8	W153 E159 T160 I161	W153-Q157 HydrophobicContact CD2-CG 3.8Å; W153-Q157 VanDerWaalsContact CE2-CG 3.5Å; W153-Q157 HydrophobicContact CE3-CG 4.17Å; W153-Q157 HydrophobicContact CG-CG 4.35Å; W153-Q157 HydrophobicContact CH2-CG 4.02Å; W153-Q157 HydrophobicContact CZ2-CG 3.63Å; W153-Q157 HydrophobicContact CZ3-CG 4.27Å; W153-Q157 WeakPolarHBondContact O-CB 3.35Å; W153-Q157 VanDerWaalsContact O-CG 3.31Å; W153-Q157 WeakPolarHBondContact O-CG 3.24Å; W153-Q157 PolarHBondContact O-N 2.87Å; Q157-E159 VanDerWaalsContact C-N 3.27Å; Q157-E159 PolarHBondContact O-N 3.29Å; Q157-T160 WeakPolarHBondContact CA-OG1 3.42Å; Q157-T160 PolarHBondContact O-N 2.81Å; Q157-T160 PolarHBondContact O-OG1 2.89Å; Q157-I161 HydrophobicContact CB-CD1 4.28Å; Q157-I161 WeakPolarHBondContact O-CB 3.45Å; Q157-I161 WeakPolarHBondContact O-CD1 3.47Å; Q157-I161 WeakPolarHBondContact O-CG1 3.35Å; Q157-I161 PolarHBondContact O-N 3.41Å
158	L	76.9	Confident	76.9	Confident	66 Å²	66	85 Å²	85	35%	0.346	42%	0.416	S	S	.	.	H	α-helix	trans	-59.8	-38.4	172.3	-78.1	169	0	0	0	112.1	F94 L98 L101 C154 L155	F94-L158 HydrophobicContact CE2-CD2 4.48Å; F94-L158 VanDerWaalsContact CZ-O 3.3Å; F94-L158 WeakPolarHBondContact CZ-O 3.25Å; L98-L158 HydrophobicContact CD1-CB 4.48Å; L101-L158 HydrophobicContact CD1-CD1 3.71Å; C154-L158 WeakPolarHBondContact O-CB 3.37Å; C154-L158 WeakPolarHBondContact O-CG 3.42Å; C154-L158 PolarHBondContact O-N 2.78Å; L155-L158 PolarHBondContact O-N 3.46Å
159	E	74.7	Confident	76.2	Confident	59 Å²	59	89.2 Å²	89.2	28%	0.276	44%	0.435	S	S	.	.	H	α-helix	trans	-74.2	-30.4	-179.7	-70.9	-173.9	-148.4	0	0	113.4	L98 R102 L155 D156 Q157 Q162	L98-E159 HydrophobicContact CD1-CG 3.58Å; L98-E159 HydrophobicContact CD2-CG 3.78Å; L98-E159 HydrophobicContact CG-CG 4.28Å; R102-E159 IonicContact CZ-OE1 3.85Å; R102-E159 IonicContact CZ-OE2 3.35Å; R102-E159 IonicContact NE-OE1 2.71Å; R102-E159 PolarHBondContact NE-OE1 3.35Å; R102-E159 IonicContact NH2-OE1 3.14Å; R102-E159 PolarHBondContact NH2-OE1 2.84Å; R102-E159 IonicContact NH2-OE2 2.75Å; R102-E159 PolarHBondContact NH2-OE2 2.81Å; L155-E159 WeakPolarHBondContact O-CB 3.29Å; L155-E159 WeakPolarHBondContact O-CG 3.49Å; L155-E159 PolarHBondContact O-N 3.16Å; D156-E159 PolarHBondContact O-N 2.87Å; D156-E159 VanDerWaalsContact O-N 3.15Å; Q157-E159 VanDerWaalsContact C-N 3.27Å; Q157-E159 PolarHBondContact O-N 3.29Å; E159-Q162 WeakPolarHBondContact O-CB 3.07Å; E159-Q162 WeakPolarHBondContact O-CG 3.26Å; E159-Q162 PolarHBondContact O-NE2 3.49Å
160	T	69.6	Low	75.5	Confident	87 Å²	87	87.8 Å²	87.8	53%	0.534	43%	0.43	S	S	.	.	H	α-helix	trans	-84.2	-28.6	175	51.9	0	0	0	0	113.4	D156 Q157 Q162	D156-T160 WeakPolarHBondContact O-CG2 3.45Å; D156-T160 PolarHBondContact O-N 3.27Å; D156-T160 PolarHBondContact O-OG1 3.03Å; Q157-T160 WeakPolarHBondContact CA-OG1 3.42Å; Q157-T160 PolarHBondContact O-N 2.81Å; Q157-T160 PolarHBondContact O-OG1 2.89Å; T160-Q162 PolarHBondContact O-N 2.78Å
161	I	62.8	Low	75	Confident	106 Å²	106	82.1 Å²	82.1	54%	0.544	41%	0.405	S	S	.	.			trans	-69.6	2.7	172.8	-70.5	166.5	0	0	0	112.6	Q157 T163	Q157-I161 HydrophobicContact CB-CD1 4.28Å; Q157-I161 WeakPolarHBondContact O-CB 3.45Å; Q157-I161 WeakPolarHBondContact O-CD1 3.47Å; Q157-I161 WeakPolarHBondContact O-CG1 3.35Å; Q157-I161 PolarHBondContact O-N 3.41Å; I161-T163 PolarHBondContact O-N 3.03Å
162	Q	57.8	Low	74.4	Confident	85 Å²	85	82.4 Å²	82.4	40%	0.397	41%	0.41	S	S	.	.			trans	-67.4	59.7	171	-68.7	-174.6	87.5	0	0	113.8	F94 E159 T160 Y164 V167	F94-Q162 HydrophobicContact CD1-CG 4.4Å; F94-Q162 HydrophobicContact CE1-CG 3.56Å; F94-Q162 HydrophobicContact CZ-CG 3.7Å; E159-Q162 WeakPolarHBondContact O-CB 3.07Å; E159-Q162 WeakPolarHBondContact O-CG 3.26Å; E159-Q162 PolarHBondContact O-NE2 3.49Å; T160-Q162 PolarHBondContact O-N 2.78Å; Q162-Y164 PolarHBondContact O-N 3.05Å; Q162-V167 HydrophobicContact CB-CG2 4.2Å; Q162-V167 HydrophobicContact CG-CG2 4.01Å
163	T	60.7	Low	73.9	Confident	89 Å²	89	81.8 Å²	81.8	55%	0.546	41%	0.407	S	S	.	.			trans	-59.2	129.2	158.6	64.9	0	0	0	0	108.3	I161 R165 S166	I161-T163 PolarHBondContact O-N 3.03Å; T163-R165 PolarHBondContact O-N 3.22Å; T163-S166 PolarHBondContact O-N 2.97Å; T163-S166 VanDerWaalsContact O-N 3.09Å; T163-S166 PolarHBondContact O-OG 3.17Å; T163-S166 PolarHBondContact OG1-OG 2.98Å
164	Y	59.6	Low	73.5	Confident	216 Å²	216	76.8 Å²	76.8	85%	0.847	39%	0.389	S	S	*	.	H	α-helix	trans	-54.7	-30.6	-174.8	-75	-86.5	0	0	0	113	Q162 S168	Q162-Y164 PolarHBondContact O-N 3.05Å; Y164-S168 WeakPolarHBondContact O-CB 3.35Å; Y164-S168 PolarHBondContact O-N 2.87Å; Y164-S168 PolarHBondContact O-OG 3.37Å; Y164-S168 VanDerWaalsContact O-OG 3.08Å
165	R	64.1	Low	73.2	Confident	201 Å²	201	77.6 Å²	77.6	76%	0.758	39%	0.386	S	S	*	.	H	α-helix	trans	-63.6	-54.1	175.7	-68.2	-169.2	-178.4	-167.5	2.8	111.9	T163 V167 S168 E169	T163-R165 PolarHBondContact O-N 3.22Å; R165-V167 PolarHBondContact O-N 2.82Å; R165-S168 PolarHBondContact O-N 3.48Å; R165-S168 PolarHBondContact O-OG 3.04Å; R165-E169 WeakPolarHBondContact O-CB 3.48Å; R165-E169 PolarHBondContact O-N 3.38Å
166	S	71.3	Confident	73	Confident	37 Å²	37	79 Å²	79	26%	0.259	39%	0.392	S	S	.	.	H	α-helix	trans	-60.6	-47.8	-173.6	69.3	0	0	0	0	112.7	T163 S168 E169 M170	T163-S166 PolarHBondContact O-N 2.97Å; T163-S166 VanDerWaalsContact O-N 3.09Å; T163-S166 PolarHBondContact O-OG 3.17Å; T163-S166 PolarHBondContact OG1-OG 2.98Å; S166-S168 PolarHBondContact O-N 3.25Å; S166-E169 PolarHBondContact O-N 3.42Å; S166-M170 WeakPolarHBondContact O-CG 3.49Å; S166-M170 PolarHBondContact O-N 2.81Å
167	V	75	Confident	73	Confident	24 Å²	24	84.6 Å²	84.6	15%	0.145	41%	0.406	C	S	.	.	H	α-helix	trans	-64.7	-40.2	178.3	179.9	0	0	0	0	111.4	F94 Q162 R165 E169 A171	F94-V167 HydrophobicContact CB-CG1 4.08Å; F94-V167 HydrophobicContact CD1-CG1 4.29Å; F94-V167 HydrophobicContact CD1-CG2 4.09Å; F94-V167 HydrophobicContact CD2-CG2 4.4Å; F94-V167 HydrophobicContact CG-CG1 4.32Å; F94-V167 HydrophobicContact CG-CG2 4.05Å; Q162-V167 HydrophobicContact CB-CG2 4.2Å; Q162-V167 HydrophobicContact CG-CG2 4.01Å; R165-V167 PolarHBondContact O-N 2.82Å; V167-E169 VanDerWaalsContact C-N 3.33Å; V167-A171 PolarHBondContact O-N 3.21Å; V167-A171 VanDerWaalsContact O-N 3.15Å
168	S	74.8	Confident	73.2	Confident	70 Å²	70	84.1 Å²	84.1	49%	0.49	41%	0.405	S	S	.	.	H	α-helix	trans	-66.7	-34.4	176.1	77.9	0	0	0	0	112.4	Y164 R165 S166 A171 S172	Y164-S168 WeakPolarHBondContact O-CB 3.35Å; Y164-S168 PolarHBondContact O-N 2.87Å; Y164-S168 PolarHBondContact O-OG 3.37Å; Y164-S168 VanDerWaalsContact O-OG 3.08Å; R165-S168 PolarHBondContact O-N 3.48Å; R165-S168 PolarHBondContact O-OG 3.04Å; S166-S168 PolarHBondContact O-N 3.25Å; S168-A171 PolarHBondContact O-N 3.2Å; S168-S172 WeakPolarHBondContact O-CB 3.24Å; S168-S172 PolarHBondContact O-N 3.4Å
169	E	76.9	Confident	73.5	Confident	113 Å²	113	83.2 Å²	83.2	53%	0.528	40%	0.4	S	S	.	.	H	α-helix	trans	-70.4	-45	177	176.1	162.5	-165.1	0	0	111.5	R165 S166 V167 A171 S172 N173	R165-E169 WeakPolarHBondContact O-CB 3.48Å; R165-E169 PolarHBondContact O-N 3.38Å; S166-E169 PolarHBondContact O-N 3.42Å; V167-E169 VanDerWaalsContact C-N 3.33Å; E169-A171 PolarHBondContact O-N 3.09Å; E169-S172 PolarHBondContact O-N 2.93Å; E169-N173 WeakPolarHBondContact CG-ND2 3.13Å; E169-N173 WeakPolarHBondContact O-CB 3.38Å; E169-N173 PolarHBondContact O-N 3.48Å; E169-N173 PolarHBondContact O-ND2 3.4Å; E169-N173 PolarHBondContact OE1-ND2 2.98Å
170	M	74.5	Confident	74	Confident	90 Å²	90	83.7 Å²	83.7	44%	0.443	41%	0.405	S	S	.	.	H	α-helix	trans	-57.6	-41.4	174.6	-63.1	-178.1	-166.9	0	0	111.3	P93 F94 S166 K174	P93-M170 HydrophobicContact CG-CB 3.85Å; P93-M170 WeakPolarHBondContact CG-O 3.28Å; F94-M170 HydrophobicContact CB-SD 4.13Å; F94-M170 HydrophobicContact CD2-SD 4.25Å; S166-M170 WeakPolarHBondContact O-CG 3.49Å; S166-M170 PolarHBondContact O-N 2.81Å; M170-K174 PolarHBondContact O-N 3.45Å
171	A	77.7	Confident	74.7	Confident	10 Å²	10	87.1 Å²	87.1	8%	0.083	41%	0.408	C	S	.	.	H	α-helix	trans	-66.3	-48.4	174.7	0	0	0	0	0	112.2	T92 V167 S168 E169 N173 K174 F175	T92-A171 HydrophobicContact CG2-CB 3.85Å; V167-A171 PolarHBondContact O-N 3.21Å; V167-A171 VanDerWaalsContact O-N 3.15Å; S168-A171 PolarHBondContact O-N 3.2Å; E169-A171 PolarHBondContact O-N 3.09Å; A171-N173 VanDerWaalsContact C-N 3.33Å; A171-N173 PolarHBondContact O-N 3.41Å; A171-K174 WeakPolarHBondContact O-CB 3.32Å; A171-K174 PolarHBondContact O-N 2.93Å; A171-K174 VanDerWaalsContact O-N 3.15Å; A171-F175 HydrophobicContact CB-CD2 4.46Å; A171-F175 HydrophobicContact CB-CE2 4.08Å; A171-F175 WeakPolarHBondContact O-CD2 3.35Å; A171-F175 WeakPolarHBondContact O-CG 3.17Å; A171-F175 PolarHBondContact O-N 3.02Å
172	S	79.8	Confident	75.8	Confident	45 Å²	45	83.9 Å²	83.9	32%	0.315	39%	0.391	S	S	.	.	H	α-helix	trans	-56.9	-44.6	177	-173.4	0	0	0	0	111.6	S168 E169 F175 K176	S168-S172 WeakPolarHBondContact O-CB 3.24Å; S168-S172 PolarHBondContact O-N 3.4Å; E169-S172 PolarHBondContact O-N 2.93Å; S172-F175 PolarHBondContact O-N 2.97Å; S172-K176 WeakPolarHBondContact O-CB 3.3Å; S172-K176 VanDerWaalsContact O-CG 3.24Å; S172-K176 WeakPolarHBondContact O-CG 3.44Å; S172-K176 PolarHBondContact O-N 2.87Å; S172-K176 WeakPolarHBondContact OG-CE 3.47Å
173	N	78.8	Confident	77.2	Confident	40 Å²	40	80.2 Å²	80.2	21%	0.214	37%	0.374	C	S	.	.	H	α-helix	trans	-68.7	-34.3	177.4	-72.9	-29.1	0	0	0	112.4	E169 A171 R177	E169-N173 WeakPolarHBondContact CG-ND2 3.13Å; E169-N173 WeakPolarHBondContact O-CB 3.38Å; E169-N173 PolarHBondContact O-N 3.48Å; E169-N173 PolarHBondContact O-ND2 3.4Å; E169-N173 PolarHBondContact OE1-ND2 2.98Å; A171-N173 VanDerWaalsContact C-N 3.33Å; A171-N173 PolarHBondContact O-N 3.41Å; N173-R177 WeakPolarHBondContact O-CB 3.29Å; N173-R177 WeakPolarHBondContact O-CG 3.37Å; N173-R177 PolarHBondContact O-N 2.85Å
174	K	77.6	Confident	78.4	Confident	53 Å²	53	79.7 Å²	79.7	23%	0.23	37%	0.37	C	S	.	.	H	α-helix	trans	-60.7	-51.5	167.6	-174.4	177.9	179.9	178.6	0	110.3	I90 V91 P93 Q96 M170 A171 K176 R177 M178	I90-K174 HydrophobicContact CG2-CD 4.42Å; V91-K174 PolarHBondContact O-NZ 3.08Å; P93-K174 HydrophobicContact CB-CD 4.16Å; P93-K174 HydrophobicContact CG-CB 4.26Å; P93-K174 HydrophobicContact CG-CD 4.09Å; Q96-K174 VanDerWaalsContact OE1-NZ 3.12Å; M170-K174 PolarHBondContact O-N 3.45Å; A171-K174 WeakPolarHBondContact O-CB 3.32Å; A171-K174 PolarHBondContact O-N 2.93Å; A171-K174 VanDerWaalsContact O-N 3.15Å; K174-K176 PolarHBondContact O-N 3.5Å; K174-R177 PolarHBondContact O-N 3.32Å; K174-M178 HydrophobicContact CG-SD 4.04Å; K174-M178 VanDerWaalsContact O-CB 3.3Å; K174-M178 WeakPolarHBondContact O-CB 3.32Å; K174-M178 VanDerWaalsContact O-CG 3.25Å; K174-M178 WeakPolarHBondContact O-CG 3.45Å; K174-M178 PolarHBondContact O-N 3.14Å
175	F	80.3	Confident	79.6	Confident	75 Å²	75	74.2 Å²	74.2	33%	0.329	35%	0.352	S	S	.	.	H	α-helix	trans	-62.2	-41.6	179.2	-65	-54.6	0	0	0	113.3	L60 I90 A171 S172 M178 L179	L60-F175 HydrophobicContact CD2-CD1 3.77Å; L60-F175 HydrophobicContact CD2-CE1 3.85Å; I90-F175 HydrophobicContact CB-CE1 4.32Å; I90-F175 HydrophobicContact CD1-CE1 4.38Å; I90-F175 HydrophobicContact CG2-CD1 4.39Å; I90-F175 HydrophobicContact CG2-CE1 3.59Å; I90-F175 HydrophobicContact CG2-CZ 4.2Å; A171-F175 HydrophobicContact CB-CD2 4.46Å; A171-F175 HydrophobicContact CB-CE2 4.08Å; A171-F175 WeakPolarHBondContact O-CD2 3.35Å; A171-F175 WeakPolarHBondContact O-CG 3.17Å; A171-F175 PolarHBondContact O-N 3.02Å; S172-F175 PolarHBondContact O-N 2.97Å; F175-M178 PolarHBondContact O-N 3.45Å; F175-L179 WeakPolarHBondContact O-CB 3.31Å; F175-L179 PolarHBondContact O-N 2.73Å
176	K	81.6	Confident	80.5	Confident	45 Å²	45	67.3 Å²	67.3	20%	0.196	33%	0.33	C	S	.	.	H	α-helix	trans	-63.5	-43.7	176.7	-74.2	171.8	176	-178.8	0	111.9	S172 K174 N180 L205 D206	S172-K176 WeakPolarHBondContact O-CB 3.3Å; S172-K176 VanDerWaalsContact O-CG 3.24Å; S172-K176 WeakPolarHBondContact O-CG 3.44Å; S172-K176 PolarHBondContact O-N 2.87Å; S172-K176 WeakPolarHBondContact OG-CE 3.47Å; K174-K176 PolarHBondContact O-N 3.5Å; K176-N180 WeakPolarHBondContact O-CB 3.39Å; K176-N180 PolarHBondContact O-N 3.16Å; K176-N180 PolarHBondContact O-ND2 3.39Å; K176-L205 HydrophobicContact CB-CD2 3.9Å; K176-L205 HydrophobicContact CG-CD2 3.79Å; K176-D206 WeakPolarHBondContact CE-OD2 3.43Å; K176-D206 IonicContact NZ-OD2 3.98Å; K176-D206 PolarHBondContact NZ-OD2 2.76Å
177	R	81.8	Confident	81.3	Confident	203 Å²	203	67.1 Å²	67.1	77%	0.766	33%	0.329	S	S	*	.	H	α-helix	trans	-65.6	-44	174.8	-74.6	178.2	178.6	-174	1.3	111.8	N173 K174 N180 R181	N173-R177 WeakPolarHBondContact O-CB 3.29Å; N173-R177 WeakPolarHBondContact O-CG 3.37Å; N173-R177 PolarHBondContact O-N 2.85Å; K174-R177 PolarHBondContact O-N 3.32Å; R177-N180 PolarHBondContact O-N 3.08Å; R177-R181 PolarHBondContact O-N 2.94Å
178	M	80.9	Confident	82	Confident	52 Å²	52	73.2 Å²	73.2	26%	0.256	36%	0.356	S	S	.	.	H	α-helix	trans	-58.4	-50.2	175.3	-78.5	-174.1	76.7	0	0	111.3	F59 I90 K174 F175 N180 R181	F59-M178 HydrophobicContact CE1-CB 3.84Å; F59-M178 VanDerWaalsContact CZ-C 3.41Å; F59-M178 HydrophobicContact CZ-CB 3.66Å; F59-M178 HydrophobicContact CZ-CE 4.21Å; F59-M178 VanDerWaalsContact CZ-O 3.24Å; F59-M178 WeakPolarHBondContact CZ-O 3.21Å; I90-M178 HydrophobicContact CD1-CE 3.55Å; I90-M178 HydrophobicContact CD1-SD 4.06Å; I90-M178 HydrophobicContact CG1-CE 4.28Å; K174-M178 HydrophobicContact CG-SD 4.04Å; K174-M178 VanDerWaalsContact O-CB 3.3Å; K174-M178 WeakPolarHBondContact O-CB 3.32Å; K174-M178 VanDerWaalsContact O-CG 3.25Å; K174-M178 WeakPolarHBondContact O-CG 3.45Å; K174-M178 PolarHBondContact O-N 3.14Å; F175-M178 PolarHBondContact O-N 3.45Å; M178-N180 PolarHBondContact O-N 2.87Å; M178-R181 WeakPolarHBondContact O-CB 3.31Å; M178-R181 PolarHBondContact O-N 3.49Å
179	L	83.9	Confident	82.5	Confident	47 Å²	47	75.6 Å²	75.6	25%	0.246	36%	0.36	C	S	.	.	H	α-helix	trans	-62.4	-43.8	179.6	179.7	57.1	0	0	0	111.7	F59 F175 R181 E182 L183 I200 L205	F59-L179 HydrophobicContact CD1-CD1 4.45Å; F59-L179 HydrophobicContact CE1-CB 4.27Å; F175-L179 WeakPolarHBondContact O-CB 3.31Å; F175-L179 PolarHBondContact O-N 2.73Å; L179-R181 PolarHBondContact O-N 3Å; L179-E182 PolarHBondContact O-N 3.45Å; L179-L183 HydrophobicContact CD1-CD1 4.29Å; L179-L183 HydrophobicContact CD1-CD2 4.19Å; L179-L183 HydrophobicContact CD1-CG 3.98Å; L179-L183 HydrophobicContact CG-CD1 3.98Å; L179-L183 HydrophobicContact CG-CG 4.11Å; L179-L183 WeakPolarHBondContact O-CG 3.3Å; L179-L183 PolarHBondContact O-N 2.96Å; L179-I200 HydrophobicContact CD2-CG2 4.37Å; L179-L205 HydrophobicContact CB-CD2 4.41Å; L179-L205 HydrophobicContact CD2-CD2 3.95Å; L179-L205 HydrophobicContact CD2-CG 4.2Å; L179-L205 HydrophobicContact CG-CD2 4.42Å
180	N	84.3	Confident	83	Confident	70 Å²	70	72.5 Å²	72.5	37%	0.374	35%	0.351	S	S	.	.	H	α-helix	trans	-53.6	-39.8	175	-88.2	-67.3	0	0	0	112.8	K176 R177 M178 E182 L183 T184 L205	K176-N180 WeakPolarHBondContact O-CB 3.39Å; K176-N180 PolarHBondContact O-N 3.16Å; K176-N180 PolarHBondContact O-ND2 3.39Å; R177-N180 PolarHBondContact O-N 3.08Å; M178-N180 PolarHBondContact O-N 2.87Å; N180-E182 PolarHBondContact O-N 3.42Å; N180-L183 PolarHBondContact O-N 3.16Å; N180-T184 PolarHBondContact O-N 3.38Å; N180-T184 PolarHBondContact O-OG1 3.21Å; N180-L205 WeakPolarHBondContact ND2-CD1 3.39Å; N180-L205 WeakPolarHBondContact OD1-CD1 3.39Å
181	R	85.6	Confident	83.4	Confident	158 Å²	158	78.4 Å²	78.4	60%	0.596	37%	0.369	S	S	*	.	H	α-helix	trans	-59.1	-46.8	179	-166.9	-172.9	72.2	168.9	6	111.9	R177 M178 L179 T184 H185	R177-R181 PolarHBondContact O-N 2.94Å; M178-R181 WeakPolarHBondContact O-CB 3.31Å; M178-R181 PolarHBondContact O-N 3.49Å; L179-R181 PolarHBondContact O-N 3Å; R181-T184 PolarHBondContact O-N 3.36Å; R181-H185 PolarHBondContact O-N 3.04Å
182	E	85.3	Confident	83.8	Confident	39 Å²	39	81.5 Å²	81.5	18%	0.182	39%	0.39	C	S	.	.	H	α-helix	trans	-72	-33.7	178	-54.2	-55.1	126.7	0	0	112.6	F59 L179 N180 T184 H185 L186	F59-E182 HydrophobicContact CD2-CG 3.43Å; F59-E182 VanDerWaalsContact CD2-CG 3.43Å; F59-E182 HydrophobicContact CE1-CG 4.21Å; F59-E182 HydrophobicContact CE2-CB 4.46Å; F59-E182 HydrophobicContact CE2-CG 3.08Å; F59-E182 HydrophobicContact CG-CG 4.16Å; F59-E182 HydrophobicContact CZ-CG 3.49Å; F59-E182 VanDerWaalsContact CZ-CG 3.49Å; L179-E182 PolarHBondContact O-N 3.45Å; N180-E182 PolarHBondContact O-N 3.42Å; E182-T184 VanDerWaalsContact C-N 3.34Å; E182-H185 PolarHBondContact O-N 3.27Å; E182-L186 VanDerWaalsContact O-CB 3.24Å; E182-L186 WeakPolarHBondContact O-CB 3.24Å; E182-L186 PolarHBondContact O-N 2.92Å
183	L	86.4	Confident	84	Confident	8 Å²	8	79.5 Å²	79.5	4%	0.042	38%	0.377	C	S	.	.	H	α-helix	trans	-66.2	-36.3	176.1	-67.7	-173.6	0	0	0	111.5	L179 N180 L186 S187 S197 I200 L205	L179-L183 HydrophobicContact CD1-CD1 4.29Å; L179-L183 HydrophobicContact CD1-CD2 4.19Å; L179-L183 HydrophobicContact CD1-CG 3.98Å; L179-L183 HydrophobicContact CG-CD1 3.98Å; L179-L183 HydrophobicContact CG-CG 4.11Å; L179-L183 WeakPolarHBondContact O-CG 3.3Å; L179-L183 PolarHBondContact O-N 2.96Å; N180-L183 PolarHBondContact O-N 3.16Å; L183-L186 HydrophobicContact CD2-CD2 4.5Å; L183-S187 VanDerWaalsContact O-CB 3.3Å; L183-S187 WeakPolarHBondContact O-CB 3.23Å; L183-S187 PolarHBondContact O-N 2.82Å; L183-S197 VanDerWaalsContact C-OG 3.3Å; L183-S197 WeakPolarHBondContact CB-OG 3.31Å; L183-S197 WeakPolarHBondContact O-CB 3.27Å; L183-S197 PolarHBondContact O-OG 3.41Å; L183-I200 HydrophobicContact CD1-CB 4.19Å; L183-I200 HydrophobicContact CD1-CG2 3.88Å; L183-I200 HydrophobicContact CD2-CB 3.96Å; L183-I200 HydrophobicContact CD2-CD1 4.04Å; L183-I200 HydrophobicContact CD2-CG2 3.94Å; L183-L205 HydrophobicContact CD1-CD1 3.84Å
184	T	85.3	Confident	84.5	Confident	77 Å²	77	80.2 Å²	80.2	47%	0.472	38%	0.38	S	S	.	.	H	α-helix	trans	-61.8	-52.3	170.3	-61	0	0	0	0	111	N180 R181 E182 L186 S187 E188	N180-T184 PolarHBondContact O-N 3.38Å; N180-T184 PolarHBondContact O-OG1 3.21Å; R181-T184 PolarHBondContact O-N 3.36Å; E182-T184 VanDerWaalsContact C-N 3.34Å; T184-L186 PolarHBondContact O-N 3Å; T184-S187 WeakPolarHBondContact O-CA 3.4Å; T184-S187 VanDerWaalsContact O-CB 3.24Å; T184-S187 WeakPolarHBondContact O-CB 3.34Å; T184-S187 PolarHBondContact O-N 2.85Å; T184-E188 PolarHBondContact O-N 2.96Å
185	H	85.6	Confident	84.9	Confident	102 Å²	102	83.4 Å²	83.4	47%	0.472	40%	0.396	S	S	.	.	H	α-helix	trans	-58.1	-45.8	178.6	-179.7	-130.9	0	0	0	112.2	R181 E182 S187 E188 M189	R181-H185 PolarHBondContact O-N 3.04Å; E182-H185 PolarHBondContact O-N 3.27Å; H185-S187 PolarHBondContact O-N 3.43Å; H185-E188 PolarHBondContact O-N 3.47Å; H185-M189 WeakPolarHBondContact O-CG 3.37Å; H185-M189 PolarHBondContact O-N 3.45Å
186	L	82.6	Confident	85.3	Confident	55 Å²	55	83.2 Å²	83.2	29%	0.288	40%	0.401	S	S	.	.	H	α-helix	trans	-60.4	-33.5	175.2	-176.2	65	0	0	0	112.7	E182 L183 T184 G193 V196	E182-L186 VanDerWaalsContact O-CB 3.24Å; E182-L186 WeakPolarHBondContact O-CB 3.24Å; E182-L186 PolarHBondContact O-N 2.92Å; L183-L186 HydrophobicContact CD2-CD2 4.5Å; T184-L186 PolarHBondContact O-N 3Å; L186-G193 CarbonylContact O-C 3.38Å; L186-G193 VanDerWaalsContact O-C 3.27Å; L186-G193 VanDerWaalsContact O-CA 3.25Å; L186-G193 WeakPolarHBondContact O-CA 3.34Å; L186-V196 HydrophobicContact CD2-CB 4.45Å; L186-V196 HydrophobicContact CD2-CG1 4Å
187	S	88.3	Confident	85.5	Confident	34 Å²	34	81.7 Å²	81.7	24%	0.238	40%	0.396	C	S	.	.	H	α-helix	trans	-68.1	-42.3	177	-166.7	0	0	0	0	112.2	L183 T184 H185 N194	L183-S187 VanDerWaalsContact O-CB 3.3Å; L183-S187 WeakPolarHBondContact O-CB 3.23Å; L183-S187 PolarHBondContact O-N 2.82Å; T184-S187 WeakPolarHBondContact O-CA 3.4Å; T184-S187 VanDerWaalsContact O-CB 3.24Å; T184-S187 WeakPolarHBondContact O-CB 3.34Å; T184-S187 PolarHBondContact O-N 2.85Å; H185-S187 PolarHBondContact O-N 3.43Å; S187-N194 PolarHBondContact OG-ND2 3.44Å
188	E	89.5	Confident	85.7	Confident	152 Å²	152	77.1 Å²	77.1	71%	0.71	38%	0.383	S	S	*	.	H	α-helix	trans	-69.8	-33.7	178.1	-67.5	173	-174.8	0	0	112.5	T184 H185 S190	T184-E188 PolarHBondContact O-N 2.96Å; H185-E188 PolarHBondContact O-N 3.47Å; E188-S190 PolarHBondContact O-N 3.31Å
189	M	85.4	Confident	86	Confident	119 Å²	119	81.3 Å²	81.3	59%	0.586	40%	0.397	S	S	*	.	H	α-helix	trans	-62.1	-34.4	-177.5	-74	165.2	72.5	0	0	114.6	H185	H185-M189 WeakPolarHBondContact O-CG 3.37Å; H185-M189 PolarHBondContact O-N 3.45Å
190	S	87.3	Confident	86.2	Confident	48 Å²	48	81.1 Å²	81.1	34%	0.336	40%	0.396	S	S	.	.			trans	-168.4	157.1	178.7	62.7	0	0	0	0	113.5	E188 S192 G193 N194	E188-S190 PolarHBondContact O-N 3.31Å; S190-S192 PolarHBondContact O-N 2.65Å; S190-S192 PolarHBondContact OG-OG 3.02Å; S190-S192 VanDerWaalsContact OG-OG 3.04Å; S190-G193 CarbonylContact O-C 3.53Å; S190-G193 WeakPolarHBondContact O-CA 3.35Å; S190-G193 PolarHBondContact O-N 2.83Å; S190-G193 PolarHBondContact OG-N 3.13Å; S190-N194 PolarHBondContact O-N 3.28Å
191	R	82.9	Confident	86.2	Confident	214 Å²	214	79.2 Å²	79.2	81%	0.808	39%	0.388	S	S	*	.	H	α-helix	trans	-57.7	-31.2	172.6	-173.3	174.2	-179	169.7	2.2	113.6	Q195	R191-Q195 WeakPolarHBondContact O-CG 3.16Å; R191-Q195 PolarHBondContact O-N 2.77Å
192	S	86.4	Confident	86.2	Confident	75 Å²	75	76.1 Å²	76.1	52%	0.524	38%	0.384	S	S	.	.	H	α-helix	trans	-72.9	-38.5	171.8	36.4	0	0	0	0	112.6	S190 Q195 V196	S190-S192 PolarHBondContact O-N 2.65Å; S190-S192 PolarHBondContact OG-OG 3.02Å; S190-S192 VanDerWaalsContact OG-OG 3.04Å; S192-Q195 PolarHBondContact O-N 2.61Å; S192-V196 WeakPolarHBondContact O-CG2 3.31Å; S192-V196 PolarHBondContact O-N 3Å
193	G	84.6	Confident	86.3	Confident	4 Å²	4	77.7 Å²	77.7	4%	0.041	40%	0.396	C	S	.	.	H	α-helix	trans	-66.8	-37.5	175.2	0	0	0	0	0	112.2	L186 S190 V196 S197	L186-G193 CarbonylContact O-C 3.38Å; L186-G193 VanDerWaalsContact O-C 3.27Å; L186-G193 VanDerWaalsContact O-CA 3.25Å; L186-G193 WeakPolarHBondContact O-CA 3.34Å; S190-G193 CarbonylContact O-C 3.53Å; S190-G193 WeakPolarHBondContact O-CA 3.35Å; S190-G193 PolarHBondContact O-N 2.83Å; S190-G193 PolarHBondContact OG-N 3.13Å; G193-V196 PolarHBondContact O-N 2.96Å; G193-S197 WeakPolarHBondContact O-CB 3.44Å; G193-S197 PolarHBondContact O-N 3.37Å
194	N	88.6	Confident	86.1	Confident	54 Å²	54	83.8 Å²	83.8	29%	0.289	42%	0.422	S	S	.	.	H	α-helix	trans	-56.3	-50.6	169.1	173.6	-94.2	0	0	0	112.1	S187 S190 V196 S197 E198	S187-N194 PolarHBondContact OG-ND2 3.44Å; S190-N194 PolarHBondContact O-N 3.28Å; N194-V196 PolarHBondContact O-N 3.1Å; N194-S197 WeakPolarHBondContact O-CB 3.46Å; N194-S197 PolarHBondContact O-N 3.45Å; N194-S197 VanDerWaalsContact O-N 3.16Å; N194-E198 WeakPolarHBondContact O-CG 3.43Å; N194-E198 PolarHBondContact O-N 2.97Å
195	Q	87.3	Confident	85.8	Confident	121 Å²	121	80.9 Å²	80.9	57%	0.565	40%	0.404	S	S	*	.	H	α-helix	trans	-63.3	-37.3	177.1	-70.3	179.4	-40.8	0	0	113.4	R191 S192 Y199	R191-Q195 WeakPolarHBondContact O-CG 3.16Å; R191-Q195 PolarHBondContact O-N 2.77Å; S192-Q195 PolarHBondContact O-N 2.61Å; Q195-Y199 WeakPolarHBondContact O-CB 3.23Å; Q195-Y199 PolarHBondContact O-N 3.44Å
196	V	87.2	Confident	84.9	Confident	71 Å²	71	81.6 Å²	81.6	43%	0.43	41%	0.411	S	S	.	.	H	α-helix	trans	-69.9	-37	174.3	171.9	0	0	0	0	111.2	L186 S192 G193 N194 Y199 I200	L186-V196 HydrophobicContact CD2-CB 4.45Å; L186-V196 HydrophobicContact CD2-CG1 4Å; S192-V196 WeakPolarHBondContact O-CG2 3.31Å; S192-V196 PolarHBondContact O-N 3Å; G193-V196 PolarHBondContact O-N 2.96Å; N194-V196 PolarHBondContact O-N 3.1Å; V196-Y199 PolarHBondContact O-N 3.21Å; V196-I200 HydrophobicContact CG1-CD1 3.7Å; V196-I200 HydrophobicContact CG1-CG1 4.36Å; V196-I200 VanDerWaalsContact O-CG1 3.28Å; V196-I200 WeakPolarHBondContact O-CG1 3.45Å; V196-I200 PolarHBondContact O-N 3.04Å
197	S	86.7	Confident	83.8	Confident	13 Å²	13	83.1 Å²	83.1	9%	0.091	42%	0.415	C	S	.	.	H	α-helix	trans	-64.9	-48.6	176.3	176.6	0	0	0	0	111.6	L183 G193 N194 Y199 I200 S201	L183-S197 VanDerWaalsContact C-OG 3.3Å; L183-S197 WeakPolarHBondContact CB-OG 3.31Å; L183-S197 WeakPolarHBondContact O-CB 3.27Å; L183-S197 PolarHBondContact O-OG 3.41Å; G193-S197 WeakPolarHBondContact O-CB 3.44Å; G193-S197 PolarHBondContact O-N 3.37Å; N194-S197 WeakPolarHBondContact O-CB 3.46Å; N194-S197 PolarHBondContact O-N 3.45Å; N194-S197 VanDerWaalsContact O-N 3.16Å; S197-Y199 VanDerWaalsContact C-N 3.34Å; S197-Y199 PolarHBondContact O-N 3.09Å; S197-I200 PolarHBondContact O-N 3.42Å; S197-S201 WeakPolarHBondContact O-CB 3.2Å; S197-S201 PolarHBondContact O-N 3.05Å
198	E	86.1	Confident	81.8	Confident	106 Å²	106	88.3 Å²	88.3	50%	0.495	44%	0.436	S	S	.	.	H	α-helix	trans	-57.1	-46.2	171.3	-72.6	-175.7	156.6	0	0	111.3	N194 N202	N194-E198 WeakPolarHBondContact O-CG 3.43Å; N194-E198 PolarHBondContact O-N 2.97Å; E198-N202 VanDerWaalsContact O-CB 3.29Å; E198-N202 WeakPolarHBondContact O-CB 3.42Å; E198-N202 PolarHBondContact O-N 3.38Å; E198-N202 PolarHBondContact O-ND2 3.01Å
199	Y	87.4	Confident	79.5	Confident	140 Å²	140	85.8 Å²	85.8	55%	0.549	43%	0.427	S	S	.	.	H	α-helix	trans	-60.9	-49.3	178.2	171.2	-107.2	0	0	0	112.3	Q195 V196 S197 T203 F204	Q195-Y199 WeakPolarHBondContact O-CB 3.23Å; Q195-Y199 PolarHBondContact O-N 3.44Å; V196-Y199 PolarHBondContact O-N 3.21Å; S197-Y199 VanDerWaalsContact C-N 3.34Å; S197-Y199 PolarHBondContact O-N 3.09Å; Y199-T203 HydrophobicContact CE2-CG2 4.46Å; Y199-T203 WeakPolarHBondContact CE2-OG1 3.31Å; Y199-T203 VanDerWaalsContact O-CB 3.23Å; Y199-T203 WeakPolarHBondContact O-CB 3.4Å; Y199-T203 PolarHBondContact O-N 3.17Å; Y199-T203 VanDerWaalsContact O-N 3.17Å; Y199-T203 PolarHBondContact O-OG1 3.48Å; Y199-F204 HydrophobicContact CE1-CE2 4.28Å
200	I	87.2	Confident	77	Confident	43 Å²	43	83.8 Å²	83.8	22%	0.221	42%	0.419	C	S	.	.	H	α-helix	trans	-66.3	-42.9	-178.2	-64.2	167	0	0	0	110.4	L179 L183 V196 S197 T203 F204	L179-I200 HydrophobicContact CD2-CG2 4.37Å; L183-I200 HydrophobicContact CD1-CB 4.19Å; L183-I200 HydrophobicContact CD1-CG2 3.88Å; L183-I200 HydrophobicContact CD2-CB 3.96Å; L183-I200 HydrophobicContact CD2-CD1 4.04Å; L183-I200 HydrophobicContact CD2-CG2 3.94Å; V196-I200 HydrophobicContact CG1-CD1 3.7Å; V196-I200 HydrophobicContact CG1-CG1 4.36Å; V196-I200 VanDerWaalsContact O-CG1 3.28Å; V196-I200 WeakPolarHBondContact O-CG1 3.45Å; V196-I200 PolarHBondContact O-N 3.04Å; S197-I200 PolarHBondContact O-N 3.42Å; I200-T203 PolarHBondContact O-N 3.43Å; I200-F204 HydrophobicContact CB-CD2 4.48Å; I200-F204 HydrophobicContact CG2-CB 4.44Å; I200-F204 HydrophobicContact CG2-CD2 4.04Å; I200-F204 PolarHBondContact O-N 3.33Å
201	S	85.6	Confident	74.6	Confident	31 Å²	31	87 Å²	87	22%	0.217	44%	0.436	C	S	.	.	H	α-helix	trans	-62.8	-46.2	178.7	-174.2	0	0	0	0	112.1	S197 T203 L205	S197-S201 WeakPolarHBondContact O-CB 3.2Å; S197-S201 PolarHBondContact O-N 3.05Å; S201-T203 PolarHBondContact O-N 2.77Å; S201-L205 WeakPolarHBondContact O-CB 3.35Å; S201-L205 PolarHBondContact O-N 3.03Å
202	N	84.9	Confident	72.3	Confident	93 Å²	93	82.4 Å²	82.4	50%	0.497	42%	0.424	S	S	.	.	H	α-helix	trans	-70.5	-13.1	177.8	-71.4	-62.8	0	0	0	114.4	E198 K207	E198-N202 VanDerWaalsContact O-CB 3.29Å; E198-N202 WeakPolarHBondContact O-CB 3.42Å; E198-N202 PolarHBondContact O-N 3.38Å; E198-N202 PolarHBondContact O-ND2 3.01Å; N202-K207 WeakPolarHBondContact OD1-CE 3.45Å; N202-K207 PolarHBondContact OD1-NZ 3.48Å
203	T	86.2	Confident	70	Confident	72 Å²	72	83.8 Å²	83.8	44%	0.442	42%	0.424	S	S	.	.	H	α-helix	trans	-113.9	-33.9	-172	-50.1	0	0	0	0	114	Y199 I200 S201	Y199-T203 HydrophobicContact CE2-CG2 4.46Å; Y199-T203 WeakPolarHBondContact CE2-OG1 3.31Å; Y199-T203 VanDerWaalsContact O-CB 3.23Å; Y199-T203 WeakPolarHBondContact O-CB 3.4Å; Y199-T203 PolarHBondContact O-N 3.17Å; Y199-T203 VanDerWaalsContact O-N 3.17Å; Y199-T203 PolarHBondContact O-OG1 3.48Å; I200-T203 PolarHBondContact O-N 3.43Å; S201-T203 PolarHBondContact O-N 2.77Å
204	F	83.2	Confident	67.4	Low	136 Å²	136	89.2 Å²	89.2	60%	0.596	46%	0.459	S	S	*	.	H	α-helix	trans	-122.9	-3.2	-171.9	-59.1	-80.5	0	0	0	114.1	Y199 I200	Y199-F204 HydrophobicContact CE1-CE2 4.28Å; I200-F204 HydrophobicContact CB-CD2 4.48Å; I200-F204 HydrophobicContact CG2-CB 4.44Å; I200-F204 HydrophobicContact CG2-CD2 4.04Å; I200-F204 PolarHBondContact O-N 3.33Å
205	L	79.3	Confident	64.5	Low	15 Å²	15	90.3 Å²	90.3	8%	0.079	47%	0.47	C	S	.	.	S	Bend	trans	-111.3	124.1	167.8	-66.1	173	0	0	0	108.5	K176 L179 N180 L183 S201 K207	K176-L205 HydrophobicContact CB-CD2 3.9Å; K176-L205 HydrophobicContact CG-CD2 3.79Å; L179-L205 HydrophobicContact CB-CD2 4.41Å; L179-L205 HydrophobicContact CD2-CD2 3.95Å; L179-L205 HydrophobicContact CD2-CG 4.2Å; L179-L205 HydrophobicContact CG-CD2 4.42Å; N180-L205 WeakPolarHBondContact ND2-CD1 3.39Å; N180-L205 WeakPolarHBondContact OD1-CD1 3.39Å; L183-L205 HydrophobicContact CD1-CD1 3.84Å; S201-L205 WeakPolarHBondContact O-CB 3.35Å; S201-L205 PolarHBondContact O-N 3.03Å; L205-K207 PolarHBondContact O-N 3.36Å; L205-K207 VanDerWaalsContact O-N 3.08Å
206	D	67	Low	62	Low	117 Å²	117	90.4 Å²	90.4	63%	0.626	48%	0.482	S	S	*	.			trans	-59.3	116.7	163.3	-58	-60.8	0	0	0	108.1	K176 Q208	K176-D206 WeakPolarHBondContact CE-OD2 3.43Å; K176-D206 IonicContact NZ-OD2 3.98Å; K176-D206 PolarHBondContact NZ-OD2 2.76Å; D206-Q208 VanDerWaalsContact C-N 3.29Å; D206-Q208 PolarHBondContact O-N 3.29Å
207	K	58.4	Low	59.7	Low	87 Å²	87	91 Å²	91	38%	0.378	49%	0.486	S	S	.	.			trans	-65.4	94.2	165.6	-74.5	-176.2	-179.5	174.1	0	108.3	N202 L205 N209 D210	N202-K207 WeakPolarHBondContact OD1-CE 3.45Å; N202-K207 PolarHBondContact OD1-NZ 3.48Å; L205-K207 PolarHBondContact O-N 3.36Å; L205-K207 VanDerWaalsContact O-N 3.08Å; K207-N209 PolarHBondContact O-N 3.21Å; K207-D210 HydrophobicContact CD-CB 4.27Å; K207-D210 VanDerWaalsContact CD-O 3.3Å; K207-D210 WeakPolarHBondContact CD-O 3.43Å; K207-D210 PolarHBondContact O-N 3.47Å
208	Q	46.2	Very low	57.6	Low	143 Å²	143	99.5 Å²	99.5	67%	0.668	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	107.7	158.6	-76.4	-178.8	-31.3	0	0	107.4	D206	D206-Q208 VanDerWaalsContact C-N 3.29Å; D206-Q208 PolarHBondContact O-N 3.29Å
209	N	41	Very low	55.2	Low	99 Å²	99	103.3 Å²	103.3	53%	0.529	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	18.5	173.4	-49.3	-37.8	0	0	0	120.1	K207 K433	K207-N209 PolarHBondContact O-N 3.21Å; N209-K433 WeakPolarHBondContact OD1-CE 3.41Å
210	D	34.7	Very low	52.9	Low	78 Å²	78	100.7 Å²	100.7	42%	0.417	53%	0.534	S	S	.	.			trans	-148.4	92.6	166.6	-122.9	-40	0	0	0	115.3	K207 E212 Q429	K207-D210 HydrophobicContact CD-CB 4.27Å; K207-D210 VanDerWaalsContact CD-O 3.3Å; K207-D210 WeakPolarHBondContact CD-O 3.43Å; K207-D210 PolarHBondContact O-N 3.47Å; D210-E212 PolarHBondContact O-N 3.1Å; D210-Q429 PolarHBondContact OD1-NE2 3.04Å
211	V	36.4	Very low	50.8	Low	114 Å²	114	108.2 Å²	108.2	69%	0.691	56%	0.56	S	S	*	*			trans	-85.9	95.6	168	-169.8	0	0	0	0	108.9	I213 Q429	V211-I213 HydrophobicContact CG1-CD1 4.3Å; V211-I213 HydrophobicContact CG1-CG1 3.87Å; V211-I213 PolarHBondContact O-N 3.46Å; V211-Q429 PolarHBondContact O-NE2 2.97Å
212	E	33.2	Very low	48.6	Very low	118 Å²	118	115.3 Å²	115.3	55%	0.551	59%	0.59	S	S	*	*			trans	-78	85.4	175.2	-75.4	-145.4	88.1	0	0	112.1	D210 K425	D210-E212 PolarHBondContact O-N 3.1Å; E212-K425 IonicContact OE1-NZ 3.41Å; E212-K425 PolarHBondContact OE1-NZ 2.83Å
213	I	39.7	Very low	46.4	Very low	105 Å²	105	119.1 Å²	119.1	54%	0.538	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-82.3	131.5	165.9	-52.6	-174.3	0	0	0	108.8	V211 S215	V211-I213 HydrophobicContact CG1-CD1 4.3Å; V211-I213 HydrophobicContact CG1-CG1 3.87Å; V211-I213 PolarHBondContact O-N 3.46Å; I213-S215 PolarHBondContact O-N 3.17Å
214	P	29.6	Very low	44.3	Very low	118 Å²	118	122.5 Å²	122.5	77%	0.766	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-63	126.2	175.9	25	-33.9	0	0	0	111
215	S	28	Very low	42.3	Very low	76 Å²	76	124.7 Å²	124.7	53%	0.531	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-68.5	140.5	178	48.4	0	0	0	0	111.3	I213 T217	I213-S215 PolarHBondContact O-N 3.17Å; S215-T217 PolarHBondContact O-N 3.06Å
216	P	34.7	Very low	40.3	Very low	124 Å²	124	133.5 Å²	133.5	81%	0.805	66%	0.657	S	S	*	*			trans	-71.1	94.8	-179.1	28.7	-34.4	0	0	0	110.4
217	T	38.4	Very low	38.9	Very low	84 Å²	84	135.5 Å²	135.5	52%	0.515	66%	0.663	S	S	.	*			trans	-65.6	143.8	174.9	76.9	0	0	0	0	110.2	S215 K219 D220	S215-T217 PolarHBondContact O-N 3.06Å; T217-K219 PolarHBondContact O-N 2.98Å; T217-D220 PolarHBondContact O-N 2.71Å; T217-D220 VanDerWaalsContact O-N 3.16Å
218	Q	43	Very low	38	Very low	191 Å²	191	136.6 Å²	136.6	89%	0.893	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-58.3	-16.8	-172.1	-69.3	175.5	-25.2	0	0	114.5	D220	Q218-D220 PolarHBondContact O-N 2.61Å
219	K	36.1	Very low	37.6	Very low	185 Å²	185	137.8 Å²	137.8	80%	0.804	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-74.3	-16.1	179.7	-73.4	-175.2	174.1	178.9	0	115	T217	T217-K219 PolarHBondContact O-N 2.98Å
220	D	38.8	Very low	37.4	Very low	85 Å²	85	141.6 Å²	141.6	46%	0.455	70%	0.696	S	S	.	*	G	3₁₀ helix	trans	-88.4	-6	-178.5	-74.4	-51.7	0	0	0	114.6	T217 Q218 E222 K223	T217-D220 PolarHBondContact O-N 2.71Å; T217-D220 VanDerWaalsContact O-N 3.16Å; Q218-D220 PolarHBondContact O-N 2.61Å; D220-E222 PolarHBondContact O-N 3.3Å; D220-K223 PolarHBondContact O-N 3.04Å
221	R	43.5	Very low	37.7	Very low	202 Å²	202	143 Å²	143	76%	0.762	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-59.3	-28.2	179.6	-108.2	-176.2	174.5	-169.5	-2.7	113.4
222	E	39.4	Very low	38.1	Very low	180 Å²	180	144.6 Å²	144.6	84%	0.841	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-82.8	-25.8	-176.2	-61.8	-168.5	136.6	0	0	114.7	D220	D220-E222 PolarHBondContact O-N 3.3Å
223	K	38.1	Very low	39.1	Very low	173 Å²	173	141 Å²	141	75%	0.752	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-19.4	-172.8	-74	-179.4	179.5	172.8	0	114.9	D220 K225	D220-K223 PolarHBondContact O-N 3.04Å; K223-K225 VanDerWaalsContact C-N 3.28Å; K223-K225 PolarHBondContact O-N 3.39Å; K223-K225 VanDerWaalsContact O-N 3.14Å
224	K	42.4	Very low	39.2	Very low	143 Å²	143	139.3 Å²	139.3	62%	0.622	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-72.3	-2.4	-169.5	-85.6	-170.5	170.5	-173.8	0	116.9	K226	K224-K226 PolarHBondContact O-N 2.82Å
225	K	40.6	Very low	40	Very low	181 Å²	181	135.4 Å²	135.4	79%	0.787	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-68.4	9.9	179.2	-83.9	-171.3	174.7	-179.8	0	116.3	K223	K223-K225 VanDerWaalsContact C-N 3.28Å; K223-K225 PolarHBondContact O-N 3.39Å; K223-K225 VanDerWaalsContact O-N 3.14Å
226	K	37.2	Very low	41	Very low	201 Å²	201	133.6 Å²	133.6	87%	0.874	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-133.6	8.4	-178.9	-73.2	-166	174.1	-172.5	0	116.2	K224	K224-K226 PolarHBondContact O-N 2.82Å
227	Q	37.7	Very low	41.7	Very low	158 Å²	158	134.2 Å²	134.2	74%	0.738	65%	0.647	S	S	*	*			trans	-132.4	29.9	-177.8	-72.7	-178.2	-48	0	0	113.3	L229	Q227-L229 PolarHBondContact O-N 2.71Å
228	Q	38.8	Very low	42	Very low	110 Å²	110	138.3 Å²	138.3	51%	0.514	66%	0.657	S	S	.	*	G	3₁₀ helix	trans	-78.1	-14	-165.4	-66.3	-175.9	-70.3	0	0	116.1	M230 T231	Q228-M230 VanDerWaalsContact C-N 3.34Å; Q228-M230 PolarHBondContact O-N 3.48Å; Q228-T231 PolarHBondContact O-N 3.19Å
229	L	38.5	Very low	42.2	Very low	168 Å²	168	132.4 Å²	132.4	88%	0.88	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-72.1	-14.6	-169	-75.6	165.4	0	0	0	116.2	Q227	Q227-L229 PolarHBondContact O-N 2.71Å
230	M	36.1	Very low	42.4	Very low	180 Å²	180	132.2 Å²	132.2	89%	0.887	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-121.3	15	-178.5	-68.4	-74	-69.5	0	0	112.4	Q228	Q228-M230 VanDerWaalsContact C-N 3.34Å; Q228-M230 PolarHBondContact O-N 3.48Å
231	T	41.6	Very low	42.6	Very low	107 Å²	107	133 Å²	133	66%	0.656	64%	0.636	S	S	*	*	S	Bend	trans	-136.6	25.3	-176.4	68.8	0	0	0	0	112.9	Q228	Q228-T231 PolarHBondContact O-N 3.19Å
232	Q	44.4	Very low	42.1	Very low	147 Å²	147	128.1 Å²	128.1	69%	0.687	63%	0.633	S	S	*	*			trans	-109.3	126.9	167.6	-69.7	-177.1	-51	0	0	107.3	S234	Q232-S234 PolarHBondContact O-N 3.41Å
233	I	54.9	Low	42	Very low	42 Å²	42	124.8 Å²	124.8	22%	0.215	63%	0.63	C	S	.	*			trans	-77.6	114.9	164.7	-61	168.1	0	0	0	105.2	G235 V236 A406 K410	I233-G235 PolarHBondContact O-N 2.89Å; I233-V236 HydrophobicContact CB-CG2 4.05Å; I233-V236 HydrophobicContact CD1-CG2 4.49Å; I233-V236 HydrophobicContact CG2-CG2 4.15Å; I233-V236 PolarHBondContact O-N 3.36Å; I233-A406 HydrophobicContact CD1-CB 3.88Å; I233-K410 HydrophobicContact CD1-CB 4.13Å; I233-K410 HydrophobicContact CD1-CG 4.27Å
234	S	42.5	Very low	41.9	Very low	70 Å²	70	120.8 Å²	120.8	49%	0.49	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58	115.6	165.3	-71.4	0	0	0	0	107.9	Q232 E389	Q232-S234 PolarHBondContact O-N 3.41Å; S234-E389 WeakPolarHBondContact CB-OE2 3.24Å; S234-E389 PolarHBondContact OG-OE2 2.81Å
235	G	45.2	Very low	42	Very low	37 Å²	37	120.1 Å²	120.1	38%	0.381	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	136.8	-46.7	-177.1	0	0	0	0	0	113	I233 K237	I233-G235 PolarHBondContact O-N 2.89Å; G235-K237 VanDerWaalsContact C-N 3.3Å; G235-K237 PolarHBondContact O-N 2.99Å
236	V	49.1	Very low	41.9	Very low	37 Å²	37	117 Å²	117	22%	0.224	62%	0.618	C	S	.	*			trans	-67.5	85.2	-177.8	-175.8	0	0	0	0	110.8	I233 K238 V407 K410 L411	I233-V236 HydrophobicContact CB-CG2 4.05Å; I233-V236 HydrophobicContact CD1-CG2 4.49Å; I233-V236 HydrophobicContact CG2-CG2 4.15Å; I233-V236 PolarHBondContact O-N 3.36Å; V236-K238 PolarHBondContact O-N 3.5Å; V236-K238 VanDerWaalsContact O-N 3.16Å; V236-V407 HydrophobicContact CG2-CG2 4.02Å; V236-K410 HydrophobicContact CG2-CG 4.39Å; V236-L411 HydrophobicContact CG1-CD2 4.24Å
237	K	50.5	Low	42	Very low	138 Å²	138	115.5 Å²	115.5	60%	0.6	62%	0.619	S	S	*	*			trans	-57.8	116.4	173.7	-69.6	163.4	-170.8	156.1	0	107.1	G235 L239 H323	G235-K237 VanDerWaalsContact C-N 3.3Å; G235-K237 PolarHBondContact O-N 2.99Å; K237-L239 PolarHBondContact O-N 3.04Å; K237-H323 PolarHBondContact O-NE2 2.83Å
238	K	44.4	Very low	42.4	Very low	170 Å²	170	113.2 Å²	113.2	74%	0.739	62%	0.617	S	S	*	*			trans	-70.8	86.6	172.6	-171.5	175.1	-177.2	172	0	109.4	V236 M240	V236-K238 PolarHBondContact O-N 3.5Å; V236-K238 VanDerWaalsContact O-N 3.16Å; K238-M240 PolarHBondContact O-N 3.06Å; K238-M240 VanDerWaalsContact O-N 3.08Å
239	L	47.5	Very low	43.5	Very low	66 Å²	66	113.1 Å²	113.1	35%	0.346	63%	0.628	S	S	.	*			trans	-53.5	117.1	170.1	-81.8	110	0	0	0	108.6	K237 H241 D322 H323	K237-L239 PolarHBondContact O-N 3.04Å; L239-H241 PolarHBondContact O-N 3.03Å; L239-D322 HydrophobicContact CD1-CB 3.93Å; L239-D322 HydrophobicContact CD2-CB 3.8Å; L239-H323 VanDerWaalsContact CD1-CE1 3.47Å; L239-H323 WeakPolarHBondContact CD1-CE1 3.35Å
240	M	39.7	Very low	45	Very low	182 Å²	182	109.1 Å²	109.1	90%	0.897	61%	0.606	S	S	*	*			trans	-80.1	80.5	167.5	-71.6	-165	66.3	0	0	107.6	K238 S242	K238-M240 PolarHBondContact O-N 3.06Å; K238-M240 VanDerWaalsContact O-N 3.08Å; M240-S242 PolarHBondContact O-N 3.2Å
241	H	42	Very low	47.1	Very low	101 Å²	101	101.3 Å²	101.3	47%	0.468	57%	0.569	S	S	.	*			trans	-46.2	111.6	167.5	-80.8	-44.3	0	0	0	108.9	L239 S243 T319 D322	L239-H241 PolarHBondContact O-N 3.03Å; H241-S243 PolarHBondContact O-N 3.31Å; H241-T319 PolarHBondContact NE2-OG1 3.39Å; H241-D322 IonicContact CE1-OD2 3.35Å; H241-D322 PolarHBondContact CE1-OD2 3Å; H241-D322 VanDerWaalsContact CE1-OD2 3.28Å
242	S	33.3	Very low	49.2	Very low	99 Å²	99	102.8 Å²	102.8	69%	0.692	56%	0.563	S	S	*	*			trans	-63.8	132.3	171.1	56.5	0	0	0	0	106.9	M240 S244	M240-S242 PolarHBondContact O-N 3.2Å; S242-S244 PolarHBondContact O-N 2.91Å
243	S	36.7	Very low	51.3	Low	111 Å²	111	96.7 Å²	96.7	78%	0.776	53%	0.534	S	S	*	.	S	Bend	trans	-71.2	77.2	-173.9	56.8	0	0	0	0	110.7	H241 N246	H241-S243 PolarHBondContact O-N 3.31Å; S243-N246 PolarHBondContact O-ND2 3.02Å
244	S	37.1	Very low	53	Low	88 Å²	88	94.8 Å²	94.8	62%	0.615	53%	0.525	S	S	*	.			trans	-122.9	2.5	-171.2	-160.4	0	0	0	0	113.9	S242 N246	S242-S244 PolarHBondContact O-N 2.91Å; S244-N246 PolarHBondContact O-N 3.44Å
245	L	45.1	Very low	55.3	Low	129 Å²	129	91.5 Å²	91.5	68%	0.675	50%	0.502	S	S	*	.			trans	-71.2	56.7	158.9	-68.8	175.8	0	0	0	110.1	N247	L245-N247 VanDerWaalsContact C-N 3.29Å; L245-N247 PolarHBondContact O-N 3.3Å
246	N	38.5	Very low	57.4	Low	117 Å²	117	94.7 Å²	94.7	63%	0.626	51%	0.51	S	S	*	.			trans	-84.6	70.4	-177.4	-77.5	-52.7	0	0	0	111.2	S243 S244 T248	S243-N246 PolarHBondContact O-ND2 3.02Å; S244-N246 PolarHBondContact O-N 3.44Å; N246-T248 VanDerWaalsContact C-N 3.31Å; N246-T248 PolarHBondContact O-N 3.09Å; N246-T248 VanDerWaalsContact O-N 3.11Å
247	N	39.3	Very low	59.3	Low	168 Å²	168	94 Å²	94	90%	0.898	51%	0.506	S	S	*	.	S	Bend	trans	59.6	31.9	152.1	-152.2	49.9	0	0	0	116.1	L245	L245-N247 VanDerWaalsContact C-N 3.29Å; L245-N247 PolarHBondContact O-N 3.3Å
248	T	45.4	Very low	61.2	Low	111 Å²	111	96.3 Å²	96.3	68%	0.681	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-83.8	156.8	162.4	47.1	0	0	0	0	110.4	N246	N246-T248 VanDerWaalsContact C-N 3.31Å; N246-T248 PolarHBondContact O-N 3.09Å; N246-T248 VanDerWaalsContact O-N 3.11Å
249	S	62.3	Low	63.4	Low	107 Å²	107	91.2 Å²	91.2	75%	0.748	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-56.6	141.4	171.7	46.1	0	0	0	0	111.4	S251	S249-S251 PolarHBondContact O-N 2.89Å
250	I	70.1	Confident	65.6	Low	84 Å²	84	91.1 Å²	91.1	43%	0.431	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-49.3	123	170.3	-62.8	153.4	0	0	0	108.4	Y294 D311 I314	I250-Y294 WeakPolarHBondContact CG2-OH 3.46Å; I250-D311 WeakPolarHBondContact CG1-OD1 3.34Å; I250-I314 HydrophobicContact CG2-CD1 3.92Å
251	S	79.6	Confident	68.1	Low	16 Å²	16	89 Å²	89	11%	0.112	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-69	153.4	-178.2	62.3	0	0	0	0	111.4	S249 F253 G254 V255 N256	S249-S251 PolarHBondContact O-N 2.89Å; S251-F253 PolarHBondContact O-N 3.05Å; S251-F253 VanDerWaalsContact O-N 3.13Å; S251-G254 PolarHBondContact O-N 2.8Å; S251-G254 VanDerWaalsContact OG-C 3.25Å; S251-G254 WeakPolarHBondContact OG-CA 3.24Å; S251-G254 PolarHBondContact OG-N 3.17Å; S251-V255 WeakPolarHBondContact CB-O 3.48Å; S251-V255 PolarHBondContact OG-N 3.46Å; S251-V255 PolarHBondContact OG-O 2.92Å; S251-N256 WeakPolarHBondContact CB-OD1 3.33Å
252	R	85.4	Confident	70.6	Confident	139 Å²	139	88.8 Å²	88.8	53%	0.525	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-36.1	-170.6	-177.8	175.5	170.3	-160.9	-6.4	112.6
253	F	89.7	Confident	73.6	Confident	19 Å²	19	84 Å²	84	8%	0.083	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	17.1	-175.5	-54.3	-68.7	0	0	0	113.7	S251 V255 E260 L263 A264 L267	S251-F253 PolarHBondContact O-N 3.05Å; S251-F253 VanDerWaalsContact O-N 3.13Å; F253-V255 HydrophobicContact CB-CG2 4.27Å; F253-V255 PolarHBondContact O-N 3.16Å; F253-E260 HydrophobicContact CD2-CG 4.28Å; F253-E260 HydrophobicContact CE2-CB 4.14Å; F253-E260 HydrophobicContact CE2-CG 4.29Å; F253-E260 WeakPolarHBondContact CE2-O 3.08Å; F253-L263 HydrophobicContact CB-CD2 3.91Å; F253-L263 HydrophobicContact CD2-CD2 3.89Å; F253-L263 HydrophobicContact CD2-CG 4.23Å; F253-L263 HydrophobicContact CG-CD2 4.02Å; F253-L263 HydrophobicContact CG-CG 4.32Å; F253-A264 HydrophobicContact CE1-CB 4.49Å; F253-A264 HydrophobicContact CE2-CB 4.22Å; F253-A264 HydrophobicContact CZ-CB 3.6Å; F253-L267 HydrophobicContact CD1-CD1 3.41Å; F253-L267 VanDerWaalsContact CD1-CD1 3.41Å; F253-L267 HydrophobicContact CE1-CD1 3.73Å; F253-L267 HydrophobicContact CG-CD1 4.12Å
254	G	89	Confident	76.4	Confident	1 Å²	1	79.5 Å²	79.5	1%	0.01	43%	0.425	C	S	.	.	S	Bend	trans	73.1	-15.3	-179.7	0	0	0	0	0	115.2	S251 I314	S251-G254 PolarHBondContact O-N 2.8Å; S251-G254 VanDerWaalsContact OG-C 3.25Å; S251-G254 WeakPolarHBondContact OG-CA 3.24Å; S251-G254 PolarHBondContact OG-N 3.17Å; G254-I314 WeakPolarHBondContact O-CG2 3.14Å
255	V	91.6	Very high	79.2	Confident	2 Å²	2	81 Å²	81	1%	0.012	42%	0.421	C	S	.	.	S	Bend	trans	-108.2	149.2	171	-61.6	0	0	0	0	110.1	S251 F253 L263 R287 T290 C291	S251-V255 WeakPolarHBondContact CB-O 3.48Å; S251-V255 PolarHBondContact OG-N 3.46Å; S251-V255 PolarHBondContact OG-O 2.92Å; F253-V255 HydrophobicContact CB-CG2 4.27Å; F253-V255 PolarHBondContact O-N 3.16Å; V255-L263 HydrophobicContact CG2-CD2 3.86Å; V255-R287 HydrophobicContact CG1-CB 3.67Å; V255-T290 HydrophobicContact CG1-CG2 3.85Å; V255-C291 HydrophobicContact CG1-CB 4.06Å; V255-C291 HydrophobicContact CG2-CB 4.19Å
256	N	89.1	Confident	81.7	Confident	104 Å²	104	75.7 Å²	75.7	56%	0.556	39%	0.392	S	S	*	.			trans	-91.6	123.6	171.8	-69.4	-47.5	0	0	0	108.6	S251 H285	S251-N256 WeakPolarHBondContact CB-OD1 3.33Å; N256-H285 PolarHBondContact O-CD2 3.06Å; N256-H285 VanDerWaalsContact O-CD2 3.31Å
257	T	89.1	Confident	84.4	Confident	21 Å²	21	71.1 Å²	71.1	13%	0.129	37%	0.368	C	S	.	.			trans	-147	150.7	178.2	-178.6	0	0	0	0	111.7	N259 E260 L263 Y283 H285	T257-N259 VanDerWaalsContact C-N 3.28Å; T257-N259 PolarHBondContact OG1-N 2.97Å; T257-E260 HydrophobicContact CG2-CG 3.92Å; T257-L263 HydrophobicContact CG2-CD2 3.87Å; T257-Y283 VanDerWaalsContact CB-O 3.31Å; T257-Y283 WeakPolarHBondContact CB-O 3.39Å; T257-Y283 PolarHBondContact OG1-O 3.2Å; T257-H285 PolarHBondContact OG1-NE2 3.18Å
258	E	89.4	Confident	87.2	Confident	188 Å²	188	70.2 Å²	70.2	88%	0.879	36%	0.358	S	S	*	.	S	Bend	trans	-79.3	-15	168.2	-63.2	-174.7	173.2	0	0	111.9	E260	E258-E260 PolarHBondContact O-N 2.93Å
259	N	92.1	Very high	89.7	Confident	63 Å²	63	67.6 Å²	67.6	34%	0.337	34%	0.34	S	S	.	.			trans	-96.4	32.1	-176.6	-68.4	-56.1	0	0	0	113.6	T257 D261 H262 L263 Y283	T257-N259 VanDerWaalsContact C-N 3.28Å; T257-N259 PolarHBondContact OG1-N 2.97Å; N259-D261 VanDerWaalsContact C-N 3.26Å; N259-D261 PolarHBondContact O-N 3.34Å; N259-D261 VanDerWaalsContact O-N 3.16Å; N259-H262 PolarHBondContact O-N 3.29Å; N259-H262 VanDerWaalsContact O-N 3.13Å; N259-L263 PolarHBondContact O-N 3.23Å; N259-Y283 HydrophobicContact CB-CD1 4.02Å; N259-Y283 HydrophobicContact CB-CG 4.46Å
260	E	92.3	Very high	91.4	Very high	63 Å²	63	63 Å²	63	29%	0.294	31%	0.307	S	S	.	.	H	α-helix	trans	-54.6	-36.5	-175.3	-78.9	-153.2	164.7	0	0	113.6	F253 T257 E258 A264	F253-E260 HydrophobicContact CD2-CG 4.28Å; F253-E260 HydrophobicContact CE2-CB 4.14Å; F253-E260 HydrophobicContact CE2-CG 4.29Å; F253-E260 WeakPolarHBondContact CE2-O 3.08Å; T257-E260 HydrophobicContact CG2-CG 3.92Å; E258-E260 PolarHBondContact O-N 2.93Å; E260-A264 VanDerWaalsContact O-CB 3.23Å; E260-A264 WeakPolarHBondContact O-CB 3.4Å; E260-A264 PolarHBondContact O-N 2.81Å
261	D	93.7	Very high	92.8	Very high	138 Å²	138	62.6 Å²	62.6	74%	0.738	31%	0.306	S	S	*	.	H	α-helix	trans	-70.4	-37.1	179.9	-69.4	-37.1	0	0	0	113.1	N259 K265	N259-D261 VanDerWaalsContact C-N 3.26Å; N259-D261 PolarHBondContact O-N 3.34Å; N259-D261 VanDerWaalsContact O-N 3.16Å; D261-K265 PolarHBondContact O-N 3.08Å
262	H	94.8	Very high	93.7	Very high	96 Å²	96	67.1 Å²	67.1	44%	0.444	32%	0.323	S	S	.	.	H	α-helix	trans	-70.1	-43.7	174.5	-66.5	101.9	0	0	0	110.5	N259 A264 K265 E266 Y283	N259-H262 PolarHBondContact O-N 3.29Å; N259-H262 VanDerWaalsContact O-N 3.13Å; H262-A264 VanDerWaalsContact C-N 3.32Å; H262-A264 PolarHBondContact O-N 2.82Å; H262-K265 PolarHBondContact O-N 2.89Å; H262-E266 PolarHBondContact O-N 2.84Å; H262-E266 VanDerWaalsContact O-N 3.15Å; H262-Y283 HydrophobicContact CB-CD1 3.68Å; H262-Y283 HydrophobicContact CB-CD2 3.86Å; H262-Y283 HydrophobicContact CB-CE1 3.69Å; H262-Y283 HydrophobicContact CB-CE2 3.87Å; H262-Y283 HydrophobicContact CB-CG 3.79Å; H262-Y283 AromaticContact CG-CE1 3.97Å
263	L	94.9	Very high	94.3	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-62.4	-39.6	176.4	-173	58.2	0	0	0	111.9	F253 V255 T257 N259 K265 L267 V280	F253-L263 HydrophobicContact CB-CD2 3.91Å; F253-L263 HydrophobicContact CD2-CD2 3.89Å; F253-L263 HydrophobicContact CD2-CG 4.23Å; F253-L263 HydrophobicContact CG-CD2 4.02Å; F253-L263 HydrophobicContact CG-CG 4.32Å; V255-L263 HydrophobicContact CG2-CD2 3.86Å; T257-L263 HydrophobicContact CG2-CD2 3.87Å; N259-L263 PolarHBondContact O-N 3.23Å; L263-K265 VanDerWaalsContact C-N 3.31Å; L263-K265 PolarHBondContact O-N 2.64Å; L263-L267 HydrophobicContact CD1-CD1 4.29Å; L263-L267 HydrophobicContact CG-CD1 4.08Å; L263-L267 WeakPolarHBondContact O-CB 3.48Å; L263-L267 VanDerWaalsContact O-CG 3.25Å; L263-L267 WeakPolarHBondContact O-CG 3.12Å; L263-L267 PolarHBondContact O-N 2.95Å; L263-L267 VanDerWaalsContact O-N 3.15Å; L263-V280 HydrophobicContact CD1-CG1 4.02Å
264	A	95.3	Very high	94.5	Very high	16 Å²	16	63.5 Å²	63.5	13%	0.132	32%	0.317	C	S	.	.	H	α-helix	trans	-57.7	-43.6	174.3	0	0	0	0	0	112.1	F253 E260 H262 L267 E268	F253-A264 HydrophobicContact CE1-CB 4.49Å; F253-A264 HydrophobicContact CE2-CB 4.22Å; F253-A264 HydrophobicContact CZ-CB 3.6Å; E260-A264 VanDerWaalsContact O-CB 3.23Å; E260-A264 WeakPolarHBondContact O-CB 3.4Å; E260-A264 PolarHBondContact O-N 2.81Å; H262-A264 VanDerWaalsContact C-N 3.32Å; H262-A264 PolarHBondContact O-N 2.82Å; A264-L267 PolarHBondContact O-N 3.36Å; A264-E268 PolarHBondContact O-N 3.21Å
265	K	96.6	Very high	94.9	Very high	120 Å²	120	63.5 Å²	63.5	52%	0.522	32%	0.317	S	S	.	.	H	α-helix	trans	-66.4	-47.7	-178.8	177.3	-176.9	159.4	-78.8	0	112.2	D261 H262 L263 L267 E268	D261-K265 PolarHBondContact O-N 3.08Å; H262-K265 PolarHBondContact O-N 2.89Å; L263-K265 VanDerWaalsContact C-N 3.31Å; L263-K265 PolarHBondContact O-N 2.64Å; K265-L267 PolarHBondContact O-N 2.88Å; K265-E268 WeakPolarHBondContact O-CB 3.15Å; K265-E268 PolarHBondContact O-N 3.04Å
266	E	96.9	Very high	95.2	Very high	17 Å²	17	64.7 Å²	64.7	8%	0.079	32%	0.324	C	S	.	.	H	α-helix	trans	-66.3	-26.9	179	-52.9	-60.6	108	0	0	111.7	H262 E268 D269 N279 V280 Y283	H262-E266 PolarHBondContact O-N 2.84Å; H262-E266 VanDerWaalsContact O-N 3.15Å; E266-E268 VanDerWaalsContact C-N 3.29Å; E266-E268 PolarHBondContact O-N 2.83Å; E266-D269 PolarHBondContact O-N 3.41Å; E266-N279 HydrophobicContact CG-CB 4.04Å; E266-N279 WeakPolarHBondContact OE2-CB 3.45Å; E266-N279 PolarHBondContact OE2-ND2 3.16Å; E266-V280 HydrophobicContact CB-CG2 3.96Å; E266-Y283 HydrophobicContact CG-CD2 3.93Å; E266-Y283 HydrophobicContact CG-CE2 3.78Å
267	L	97	Very high	95.7	Very high	21 Å²	21	59.8 Å²	59.8	11%	0.11	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-77.3	-5.6	173.4	-67.8	171.6	0	0	0	114.1	F253 L263 A264 K265 D269 L270 I292 A295	F253-L267 HydrophobicContact CD1-CD1 3.41Å; F253-L267 VanDerWaalsContact CD1-CD1 3.41Å; F253-L267 HydrophobicContact CE1-CD1 3.73Å; F253-L267 HydrophobicContact CG-CD1 4.12Å; L263-L267 HydrophobicContact CD1-CD1 4.29Å; L263-L267 HydrophobicContact CG-CD1 4.08Å; L263-L267 WeakPolarHBondContact O-CB 3.48Å; L263-L267 VanDerWaalsContact O-CG 3.25Å; L263-L267 WeakPolarHBondContact O-CG 3.12Å; L263-L267 PolarHBondContact O-N 2.95Å; L263-L267 VanDerWaalsContact O-N 3.15Å; A264-L267 PolarHBondContact O-N 3.36Å; K265-L267 PolarHBondContact O-N 2.88Å; L267-D269 PolarHBondContact O-N 3.24Å; L267-L270 HydrophobicContact CD2-CD1 4.25Å; L267-L270 VanDerWaalsContact O-CB 3.3Å; L267-L270 WeakPolarHBondContact O-CB 3.34Å; L267-L270 PolarHBondContact O-N 3.24Å; L267-I292 HydrophobicContact CD2-CD1 3.95Å; L267-A295 HydrophobicContact CD2-CB 4.1Å
268	E	97.3	Very high	96.1	Very high	148 Å²	148	60 Å²	60	69%	0.692	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-66.7	-19.8	166.1	-62.6	-176.7	-174.5	0	0	111.8	A264 K265 E266	A264-E268 PolarHBondContact O-N 3.21Å; K265-E268 WeakPolarHBondContact O-CB 3.15Å; K265-E268 PolarHBondContact O-N 3.04Å; E266-E268 VanDerWaalsContact C-N 3.29Å; E266-E268 PolarHBondContact O-N 2.83Å
269	D	97.9	Very high	96.5	Very high	56 Å²	56	53.8 Å²	53.8	30%	0.299	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-93.7	7.2	176.5	-64.7	-28.9	0	0	0	113.2	E266 L267 N271 K272 L275	E266-D269 PolarHBondContact O-N 3.41Å; L267-D269 PolarHBondContact O-N 3.24Å; D269-N271 PolarHBondContact O-N 3.44Å; D269-K272 HydrophobicContact CB-CD 4.19Å; D269-K272 WeakPolarHBondContact O-CB 3.33Å; D269-K272 PolarHBondContact O-N 2.99Å; D269-K272 WeakPolarHBondContact OD1-CD 3.4Å; D269-K272 WeakPolarHBondContact OD1-CE 3.37Å; D269-K272 IonicContact OD1-NZ 2.72Å; D269-K272 PolarHBondContact OD1-NZ 3.18Å; D269-L275 HydrophobicContact CB-CB 4.44Å; D269-L275 HydrophobicContact CB-CD1 4.46Å
270	L	98.4	Very high	96.8	Very high	11 Å²	11	50.8 Å²	50.8	6%	0.058	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-36.4	-176.6	-176.3	70	0	0	0	113.9	L267 I292 A295 I296 E299 Q341 H344	L267-L270 HydrophobicContact CD2-CD1 4.25Å; L267-L270 VanDerWaalsContact O-CB 3.3Å; L267-L270 WeakPolarHBondContact O-CB 3.34Å; L267-L270 PolarHBondContact O-N 3.24Å; L270-I292 HydrophobicContact CD1-CD1 4.15Å; L270-A295 HydrophobicContact CD1-CB 4.08Å; L270-A295 HydrophobicContact CD2-CB 3.8Å; L270-I296 HydrophobicContact CD1-CG1 4.11Å; L270-E299 HydrophobicContact CD2-CB 4.13Å; L270-E299 HydrophobicContact CD2-CG 4.42Å; L270-Q341 PolarHBondContact O-NE2 3.46Å; L270-H344 PolarHBondContact O-CD2 3.46Å
271	N	98.4	Very high	97.1	Very high	76 Å²	76	48.1 Å²	48.1	41%	0.406	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	10.5	-177.5	-63.9	-18.8	0	0	0	113.5	D269 E299 H344	D269-N271 PolarHBondContact O-N 3.44Å; N271-E299 PolarHBondContact ND2-OE1 3.4Å; N271-H344 PolarHBondContact OD1-NE2 3.18Å
272	K	98.1	Very high	97.2	Very high	111 Å²	111	44.2 Å²	44.2	48%	0.483	23%	0.234	S	C	.	.	S	Bend	trans	-115.3	149.9	-175.2	-56.1	179.2	-166.4	164.4	0	111.5	D269 Q341	D269-K272 HydrophobicContact CB-CD 4.19Å; D269-K272 WeakPolarHBondContact O-CB 3.33Å; D269-K272 PolarHBondContact O-N 2.99Å; D269-K272 WeakPolarHBondContact OD1-CD 3.4Å; D269-K272 WeakPolarHBondContact OD1-CE 3.37Å; D269-K272 IonicContact OD1-NZ 2.72Å; D269-K272 PolarHBondContact OD1-NZ 3.18Å; K272-Q341 PolarHBondContact O-NE2 3.2Å
273	W	98.2	Very high	97.4	Very high	55 Å²	55	42.6 Å²	42.6	21%	0.208	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	141.5	167.3	-157	-113.9	0	0	0	110	V345 L346 T494 K495 W552 I566	W273-V345 HydrophobicContact CE3-CB 4.07Å; W273-V345 HydrophobicContact CE3-CG1 3.95Å; W273-V345 HydrophobicContact CZ3-CB 4.41Å; W273-L346 HydrophobicContact CZ3-CD2 4.28Å; W273-L346 HydrophobicContact CZ3-CG 4.13Å; W273-T494 VanDerWaalsContact CZ2-OG1 3.31Å; W273-T494 WeakPolarHBondContact CZ2-OG1 3.49Å; W273-T494 PolarHBondContact NE1-O 3.33Å; W273-T494 PolarHBondContact NE1-OG1 3.39Å; W273-K495 HydrophobicContact CZ2-CD 4.4Å; W273-W552 AromaticContact CH2-CH2 3.54Å; W273-W552 HydrophobicContact CH2-CH2 3.54Å; W273-W552 AromaticContact CH2-CZ2 3.94Å; W273-W552 HydrophobicContact CH2-CZ2 3.94Å; W273-W552 AromaticContact CZ2-CH2 3.62Å; W273-W552 HydrophobicContact CZ2-CH2 3.62Å; W273-W552 AromaticContact CZ2-CZ2 3.82Å; W273-W552 HydrophobicContact CZ2-CZ2 3.82Å; W273-I566 HydrophobicContact CD2-CD1 4.11Å; W273-I566 HydrophobicContact CE3-CD1 4.49Å; W273-I566 HydrophobicContact CG-CD1 4.35Å; W273-I566 HydrophobicContact CG-CG1 4.39Å; W273-I566 HydrophobicContact CZ2-CG2 4.37Å
274	G	93.9	Very high	97.4	Very high	27 Å²	27	42.7 Å²	42.7	28%	0.278	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	24.7	178.2	0	0	0	0	0	116	N276 L499	G274-N276 PolarHBondContact O-N 2.86Å; G274-L499 WeakPolarHBondContact O-CD1 3.28Å
275	L	98.1	Very high	97.3	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.005	24%	0.244	C	C	.	.			trans	-52.4	134.7	164.7	169	146.6	0	0	0	110	D269 I277 V280 I292 Q341	D269-L275 HydrophobicContact CB-CB 4.44Å; D269-L275 HydrophobicContact CB-CD1 4.46Å; L275-I277 HydrophobicContact CD2-CB 4.22Å; L275-I277 HydrophobicContact CD2-CD1 3.96Å; L275-I277 PolarHBondContact O-N 3.31Å; L275-V280 HydrophobicContact CD2-CG2 4.16Å; L275-I292 HydrophobicContact CD1-CD1 4.25Å; L275-I292 HydrophobicContact CD2-CD1 4.06Å; L275-Q341 HydrophobicContact CD1-CG 4.38Å; L275-Q341 HydrophobicContact CD2-CG 4.38Å
276	N	98.3	Very high	97.3	Very high	27 Å²	27	46.5 Å²	46.5	14%	0.144	25%	0.245	C	C	.	.			trans	-78.9	88.2	-179.8	-167.6	-36.1	0	0	0	111.2	G274 F278 N279 V280 L499	G274-N276 PolarHBondContact O-N 2.86Å; N276-F278 PolarHBondContact O-N 2.96Å; N276-F278 WeakPolarHBondContact OD1-CB 3.39Å; N276-F278 PolarHBondContact OD1-N 2.83Å; N276-N279 HydrophobicContact CB-CB 4.15Å; N276-N279 VanDerWaalsContact CG-CG 3.44Å; N276-N279 PolarHBondContact ND2-ND2 3.11Å; N276-N279 WeakPolarHBondContact O-CB 3.25Å; N276-N279 PolarHBondContact O-N 2.99Å; N276-N279 PolarHBondContact OD1-N 3.13Å; N276-V280 PolarHBondContact O-N 2.83Å; N276-L499 HydrophobicContact CB-CD2 4.26Å
277	I	98.4	Very high	97.3	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-63.2	-28.9	-178.5	-162.4	72.4	0	0	0	112.9	L275 V280 A281 I292 L334 A337 D338 W503	L275-I277 HydrophobicContact CD2-CB 4.22Å; L275-I277 HydrophobicContact CD2-CD1 3.96Å; L275-I277 PolarHBondContact O-N 3.31Å; I277-V280 PolarHBondContact O-N 2.99Å; I277-A281 PolarHBondContact O-N 3.13Å; I277-I292 HydrophobicContact CD1-CD1 4.09Å; I277-I292 HydrophobicContact CD1-CG1 3.73Å; I277-L334 HydrophobicContact CG1-CD1 3.99Å; I277-L334 HydrophobicContact CG2-CD1 4.26Å; I277-L334 HydrophobicContact CG2-CG 4.45Å; I277-A337 HydrophobicContact CD1-CB 3.74Å; I277-A337 HydrophobicContact CG1-CB 4.19Å; I277-D338 HydrophobicContact CB-CB 4.43Å; I277-D338 HydrophobicContact CG1-CB 4.2Å; I277-D338 HydrophobicContact CG2-CB 4.19Å; I277-W503 HydrophobicContact CG2-CZ2 3.93Å
278	F	98.5	Very high	97.4	Very high	26 Å²	26	48.2 Å²	48.2	11%	0.114	25%	0.249	C	C	.	.	H	α-helix	trans	-66.7	-41.6	175.7	-52.4	-85.4	0	0	0	111.3	N276 A281 G282 L334 L499 Q502 W503	N276-F278 PolarHBondContact O-N 2.96Å; N276-F278 WeakPolarHBondContact OD1-CB 3.39Å; N276-F278 PolarHBondContact OD1-N 2.83Å; F278-A281 PolarHBondContact O-N 3.18Å; F278-G282 PolarHBondContact O-N 3.4Å; F278-L334 HydrophobicContact CD1-CD2 3.61Å; F278-L334 HydrophobicContact CE1-CD2 3.57Å; F278-L499 HydrophobicContact CD2-CD2 3.58Å; F278-L499 HydrophobicContact CE2-CB 4.33Å; F278-L499 HydrophobicContact CE2-CD2 3.69Å; F278-Q502 HydrophobicContact CE1-CB 3.93Å; F278-Q502 HydrophobicContact CE2-CB 3.93Å; F278-Q502 HydrophobicContact CZ-CB 3.55Å; F278-W503 HydrophobicContact CE1-CZ2 4.46Å; F278-W503 AromaticContact CZ-CD2 3.89Å; F278-W503 HydrophobicContact CZ-CD2 3.89Å; F278-W503 AromaticContact CZ-CE2 3.71Å; F278-W503 HydrophobicContact CZ-CE3 4.39Å; F278-W503 HydrophobicContact CZ-CG 4.26Å; F278-W503 HydrophobicContact CZ-CH2 4.47Å; F278-W503 HydrophobicContact CZ-CZ2 4.02Å
279	N	98.1	Very high	97.5	Very high	57 Å²	57	41.2 Å²	41.2	31%	0.305	22%	0.217	S	C	.	.	H	α-helix	trans	-62.6	-44.3	172.8	-71.9	-9.9	0	0	0	111.4	E266 N276 A281 G282 Y283	E266-N279 HydrophobicContact CG-CB 4.04Å; E266-N279 WeakPolarHBondContact OE2-CB 3.45Å; E266-N279 PolarHBondContact OE2-ND2 3.16Å; N276-N279 HydrophobicContact CB-CB 4.15Å; N276-N279 VanDerWaalsContact CG-CG 3.44Å; N276-N279 PolarHBondContact ND2-ND2 3.11Å; N276-N279 WeakPolarHBondContact O-CB 3.25Å; N276-N279 PolarHBondContact O-N 2.99Å; N276-N279 PolarHBondContact OD1-N 3.13Å; N279-A281 VanDerWaalsContact C-N 3.31Å; N279-A281 PolarHBondContact O-N 3.42Å; N279-G282 PolarHBondContact O-N 2.65Å; N279-G282 VanDerWaalsContact O-N 3.13Å; N279-Y283 HydrophobicContact CB-CD2 4.35Å; N279-Y283 HydrophobicContact CB-CE2 3.97Å; N279-Y283 WeakPolarHBondContact O-CD2 3.25Å; N279-Y283 PolarHBondContact O-N 3.09Å
280	V	98.2	Very high	97.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.2	-40.3	176.5	173.6	0	0	0	0	111.3	L263 E266 L275 N276 I277 S284 C291 I292	L263-V280 HydrophobicContact CD1-CG1 4.02Å; E266-V280 HydrophobicContact CB-CG2 3.96Å; L275-V280 HydrophobicContact CD2-CG2 4.16Å; N276-V280 PolarHBondContact O-N 2.83Å; I277-V280 PolarHBondContact O-N 2.99Å; V280-S284 WeakPolarHBondContact O-CB 3.48Å; V280-S284 PolarHBondContact O-N 3Å; V280-S284 PolarHBondContact O-OG 2.93Å; V280-C291 HydrophobicContact CG1-CB 4.42Å; V280-I292 HydrophobicContact CG1-CD1 4.15Å; V280-I292 HydrophobicContact CG1-CG1 4.03Å
281	A	97.7	Very high	97.5	Very high	6 Å²	6	38 Å²	38	5%	0.05	20%	0.2	C	C	.	.	H	α-helix	trans	-62.6	-44.6	172.4	0	0	0	0	0	112.4	I277 F278 N279 Y283 S284 N286 P288 L334	I277-A281 PolarHBondContact O-N 3.13Å; F278-A281 PolarHBondContact O-N 3.18Å; N279-A281 VanDerWaalsContact C-N 3.31Å; N279-A281 PolarHBondContact O-N 3.42Å; A281-Y283 PolarHBondContact O-N 3.49Å; A281-S284 WeakPolarHBondContact CA-OG 3.23Å; A281-S284 PolarHBondContact O-N 3.33Å; A281-S284 PolarHBondContact O-OG 2.95Å; A281-N286 VanDerWaalsContact O-CA 3.31Å; A281-N286 WeakPolarHBondContact O-CA 3.44Å; A281-N286 PolarHBondContact O-N 2.88Å; A281-P288 HydrophobicContact CB-CB 3.98Å; A281-P288 HydrophobicContact CB-CG 3.91Å; A281-L334 HydrophobicContact CB-CD1 3.55Å
282	G	96.9	Very high	97.5	Very high	56 Å²	56	34.4 Å²	34.4	58%	0.577	18%	0.18	S	C	*	.	H	α-helix	trans	-58	-47.7	176.3	0	0	0	0	0	113.3	F278 N279	F278-G282 PolarHBondContact O-N 3.4Å; N279-G282 PolarHBondContact O-N 2.65Å; N279-G282 VanDerWaalsContact O-N 3.13Å
283	Y	97.4	Very high	97.5	Very high	63 Å²	63	29.1 Å²	29.1	25%	0.247	16%	0.157	C	C	.	.	H	α-helix	trans	-80	-18.1	-178.1	-56.5	-50.4	0	0	0	114.3	T257 N259 H262 E266 N279 A281	T257-Y283 VanDerWaalsContact CB-O 3.31Å; T257-Y283 WeakPolarHBondContact CB-O 3.39Å; T257-Y283 PolarHBondContact OG1-O 3.2Å; N259-Y283 HydrophobicContact CB-CD1 4.02Å; N259-Y283 HydrophobicContact CB-CG 4.46Å; H262-Y283 HydrophobicContact CB-CD1 3.68Å; H262-Y283 HydrophobicContact CB-CD2 3.86Å; H262-Y283 HydrophobicContact CB-CE1 3.69Å; H262-Y283 HydrophobicContact CB-CE2 3.87Å; H262-Y283 HydrophobicContact CB-CG 3.79Å; H262-Y283 AromaticContact CG-CE1 3.97Å; E266-Y283 HydrophobicContact CG-CD2 3.93Å; E266-Y283 HydrophobicContact CG-CE2 3.78Å; N279-Y283 HydrophobicContact CB-CD2 4.35Å; N279-Y283 HydrophobicContact CB-CE2 3.97Å; N279-Y283 WeakPolarHBondContact O-CD2 3.25Å; N279-Y283 PolarHBondContact O-N 3.09Å; A281-Y283 PolarHBondContact O-N 3.49Å
284	S	95.9	Very high	97.5	Very high	1 Å²	1	27 Å²	27	1%	0.007	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	7.8	178.4	60.3	0	0	0	0	115	V280 A281 R287	V280-S284 WeakPolarHBondContact O-CB 3.48Å; V280-S284 PolarHBondContact O-N 3Å; V280-S284 PolarHBondContact O-OG 2.93Å; A281-S284 WeakPolarHBondContact CA-OG 3.23Å; A281-S284 PolarHBondContact O-N 3.33Å; A281-S284 PolarHBondContact O-OG 2.95Å; S284-R287 VanDerWaalsContact OG-C 3.26Å; S284-R287 PolarHBondContact OG-N 3.45Å; S284-R287 VanDerWaalsContact OG-N 3.09Å
285	H	93.9	Very high	97.7	Very high	115 Å²	115	26.3 Å²	26.3	53%	0.532	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	45.9	-167.1	-62.8	-83.8	0	0	0	113	N256 T257	N256-H285 PolarHBondContact O-CD2 3.06Å; N256-H285 VanDerWaalsContact O-CD2 3.31Å; T257-H285 PolarHBondContact OG1-NE2 3.18Å
286	N	95.6	Very high	97.8	Very high	102 Å²	102	26.3 Å²	26.3	55%	0.545	14%	0.141	S	C	.	.	S	Bend	trans	57.8	46.7	-177.5	-156.5	79.6	0	0	0	112.8	A281	A281-N286 VanDerWaalsContact O-CA 3.31Å; A281-N286 WeakPolarHBondContact O-CA 3.44Å; A281-N286 PolarHBondContact O-N 2.88Å
287	R	97.6	Very high	97.8	Very high	73 Å²	73	25 Å²	25	28%	0.275	13%	0.134	S	C	.	.			trans	-125.8	50.5	172.4	-64.5	-64.8	-176.6	163.9	-1.8	112.4	V255 S284 L289 C291 E321 D322	V255-R287 HydrophobicContact CG1-CB 3.67Å; S284-R287 VanDerWaalsContact OG-C 3.26Å; S284-R287 PolarHBondContact OG-N 3.45Å; S284-R287 VanDerWaalsContact OG-N 3.09Å; R287-L289 VanDerWaalsContact C-N 3.32Å; R287-L289 PolarHBondContact O-N 2.99Å; R287-C291 WeakPolarHBondContact O-CB 3.39Å; R287-C291 PolarHBondContact O-N 3.2Å; R287-C291 VanDerWaalsContact O-N 3.1Å; R287-E321 VanDerWaalsContact C-OE1 3.31Å; R287-E321 WeakPolarHBondContact CA-OE1 3.33Å; R287-E321 WeakPolarHBondContact CA-OE2 3.31Å; R287-E321 VanDerWaalsContact CD-OE2 3.3Å; R287-E321 WeakPolarHBondContact CD-OE2 3.47Å; R287-D322 IonicContact CZ-OD1 2.97Å; R287-D322 IonicContact NH1-OD1 2.65Å; R287-D322 PolarHBondContact NH1-OD1 2.81Å; R287-D322 IonicContact NH2-OD1 2.67Å; R287-D322 PolarHBondContact NH2-OD1 3.37Å
288	P	98.3	Very high	97.7	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-60.5	-40.1	-176.8	27	-35.7	0	0	0	112.3	A281 C291 I292 E321 L334 A337	A281-P288 HydrophobicContact CB-CB 3.98Å; A281-P288 HydrophobicContact CB-CG 3.91Å; P288-C291 PolarHBondContact O-N 3.38Å; P288-I292 VanDerWaalsContact O-CB 3.3Å; P288-I292 WeakPolarHBondContact O-CB 3.4Å; P288-I292 WeakPolarHBondContact O-CG1 3.21Å; P288-I292 PolarHBondContact O-N 3.3Å; P288-E321 VanDerWaalsContact CD-OE1 3.23Å; P288-E321 WeakPolarHBondContact CD-OE1 3.46Å; P288-L334 HydrophobicContact CB-CD1 4.14Å; P288-L334 HydrophobicContact CG-CB 4.39Å; P288-L334 HydrophobicContact CG-CD1 3.91Å; P288-A337 HydrophobicContact CB-CB 3.91Å; P288-A337 HydrophobicContact CG-CB 4.41Å
289	L	98.8	Very high	97.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-68.5	-45.6	-175.9	-177	62.3	0	0	0	111.1	R287 C291 M293 M317 L320 E321 Y324 A336 A337 A369	R287-L289 VanDerWaalsContact C-N 3.32Å; R287-L289 PolarHBondContact O-N 2.99Å; L289-C291 VanDerWaalsContact C-N 3.33Å; L289-C291 PolarHBondContact O-N 3.06Å; L289-M293 HydrophobicContact CD1-CG 3.85Å; L289-M293 HydrophobicContact CG-CG 4.47Å; L289-M293 WeakPolarHBondContact O-CB 3.36Å; L289-M293 VanDerWaalsContact O-CG 3.27Å; L289-M293 WeakPolarHBondContact O-CG 3.45Å; L289-M293 PolarHBondContact O-N 3.39Å; L289-M317 HydrophobicContact CD1-CE 4.27Å; L289-M317 HydrophobicContact CD2-CE 4.21Å; L289-M317 HydrophobicContact CG-CE 3.73Å; L289-L320 HydrophobicContact CD2-CD2 4.03Å; L289-L320 HydrophobicContact CD2-CG 4.33Å; L289-E321 HydrophobicContact CB-CG 4.41Å; L289-E321 WeakPolarHBondContact CB-OE1 3.43Å; L289-E321 HydrophobicContact CD2-CB 4.49Å; L289-E321 PolarHBondContact N-OE1 3.02Å; L289-Y324 HydrophobicContact CD2-CD2 3.97Å; L289-Y324 HydrophobicContact CD2-CE2 3.65Å; L289-A336 HydrophobicContact CD1-CB 4.1Å; L289-A336 HydrophobicContact CD2-CB 4.17Å; L289-A337 HydrophobicContact CB-CB 4.18Å; L289-A337 HydrophobicContact CD1-CB 4.27Å; L289-A369 HydrophobicContact CD1-CB 4.12Å
290	T	98.5	Very high	97.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.5	-43.7	175.4	-58.7	0	0	0	0	111.4	V255 Y294 M317 M318 E321	V255-T290 HydrophobicContact CG1-CG2 3.85Å; T290-Y294 VanDerWaalsContact O-CB 3.31Å; T290-Y294 WeakPolarHBondContact O-CB 3.38Å; T290-Y294 PolarHBondContact O-N 2.97Å; T290-Y294 VanDerWaalsContact O-N 3.09Å; T290-M317 HydrophobicContact CG2-CB 4.06Å; T290-M318 HydrophobicContact CG2-CG 4.07Å; T290-E321 VanDerWaalsContact CB-OE2 3.24Å; T290-E321 WeakPolarHBondContact CB-OE2 3.28Å; T290-E321 PolarHBondContact N-OE2 3.47Å; T290-E321 PolarHBondContact OG1-OE2 3.36Å
291	C	98.3	Very high	97.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-67.1	-52.6	-177.9	-173.8	0	0	0	0	112.8	V255 V280 R287 P288 L289 Y294 A295	V255-C291 HydrophobicContact CG1-CB 4.06Å; V255-C291 HydrophobicContact CG2-CB 4.19Å; V280-C291 HydrophobicContact CG1-CB 4.42Å; R287-C291 WeakPolarHBondContact O-CB 3.39Å; R287-C291 PolarHBondContact O-N 3.2Å; R287-C291 VanDerWaalsContact O-N 3.1Å; P288-C291 PolarHBondContact O-N 3.38Å; L289-C291 VanDerWaalsContact C-N 3.33Å; L289-C291 PolarHBondContact O-N 3.06Å; C291-Y294 PolarHBondContact O-N 3.08Å; C291-A295 PolarHBondContact O-N 3.28Å
292	I	98.7	Very high	97.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.6	-46.1	-178.9	-73.3	-70.9	0	0	0	110.7	L267 L270 L275 I277 V280 P288 Y294 A295 I296 A337 Q341	L267-I292 HydrophobicContact CD2-CD1 3.95Å; L270-I292 HydrophobicContact CD1-CD1 4.15Å; L275-I292 HydrophobicContact CD1-CD1 4.25Å; L275-I292 HydrophobicContact CD2-CD1 4.06Å; I277-I292 HydrophobicContact CD1-CD1 4.09Å; I277-I292 HydrophobicContact CD1-CG1 3.73Å; V280-I292 HydrophobicContact CG1-CD1 4.15Å; V280-I292 HydrophobicContact CG1-CG1 4.03Å; P288-I292 VanDerWaalsContact O-CB 3.3Å; P288-I292 WeakPolarHBondContact O-CB 3.4Å; P288-I292 WeakPolarHBondContact O-CG1 3.21Å; P288-I292 PolarHBondContact O-N 3.3Å; I292-Y294 VanDerWaalsContact C-N 3.31Å; I292-Y294 PolarHBondContact O-N 2.8Å; I292-A295 PolarHBondContact O-N 3.05Å; I292-I296 HydrophobicContact CG2-CD1 3.54Å; I292-I296 HydrophobicContact CG2-CG1 4.3Å; I292-I296 VanDerWaalsContact O-CG1 3.29Å; I292-I296 WeakPolarHBondContact O-CG1 3.24Å; I292-I296 PolarHBondContact O-N 2.79Å; I292-A337 HydrophobicContact CG1-CB 4.48Å; I292-Q341 HydrophobicContact CG2-CB 4Å
293	M	98.8	Very high	97.8	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-63.9	-36.7	178.8	-74.5	-74.5	-73.3	0	0	112.1	L289 F297 F313 M317 A340 I365 A369	L289-M293 HydrophobicContact CD1-CG 3.85Å; L289-M293 HydrophobicContact CG-CG 4.47Å; L289-M293 WeakPolarHBondContact O-CB 3.36Å; L289-M293 VanDerWaalsContact O-CG 3.27Å; L289-M293 WeakPolarHBondContact O-CG 3.45Å; L289-M293 PolarHBondContact O-N 3.39Å; M293-F297 HydrophobicContact CE-CD2 4.35Å; M293-F297 HydrophobicContact CE-CE2 3.59Å; M293-F297 HydrophobicContact CE-CZ 4.29Å; M293-F297 VanDerWaalsContact O-CB 3.31Å; M293-F297 WeakPolarHBondContact O-CB 3.37Å; M293-F297 WeakPolarHBondContact O-CD2 3.19Å; M293-F297 PolarHBondContact O-N 3.33Å; M293-F297 HydrophobicContact SD-CE2 4.32Å; M293-F313 HydrophobicContact CB-CE1 4.37Å; M293-F313 HydrophobicContact CB-CZ 3.96Å; M293-F313 WeakPolarHBondContact O-CZ 3.36Å; M293-M317 HydrophobicContact CB-CE 3.69Å; M293-M317 HydrophobicContact CB-CG 4.37Å; M293-M317 HydrophobicContact CB-SD 4.09Å; M293-M317 HydrophobicContact CE-CE 4.22Å; M293-M317 HydrophobicContact CE-SD 4.01Å; M293-M317 HydrophobicContact CG-CE 3.59Å; M293-M317 HydrophobicContact CG-SD 4.35Å; M293-A340 HydrophobicContact SD-CB 4Å; M293-I365 HydrophobicContact CE-CG2 4.01Å; M293-I365 HydrophobicContact SD-CG2 3.58Å; M293-I365 VanDerWaalsContact SD-CG2 3.58Å; M293-A369 HydrophobicContact CE-CB 3.39Å; M293-A369 HydrophobicContact CG-CB 4.18Å; M293-A369 HydrophobicContact SD-CB 3.67Å
294	Y	98.4	Very high	97.8	Very high	10 Å²	10	37.9 Å²	37.9	4%	0.039	18%	0.177	C	C	.	.	H	α-helix	trans	-66.5	-41.8	174.5	-168.4	-111.2	0	0	0	112.1	I250 T290 C291 I292 F297 Q298 L303 S310 F313 I314	I250-Y294 WeakPolarHBondContact CG2-OH 3.46Å; T290-Y294 VanDerWaalsContact O-CB 3.31Å; T290-Y294 WeakPolarHBondContact O-CB 3.38Å; T290-Y294 PolarHBondContact O-N 2.97Å; T290-Y294 VanDerWaalsContact O-N 3.09Å; C291-Y294 PolarHBondContact O-N 3.08Å; I292-Y294 VanDerWaalsContact C-N 3.31Å; I292-Y294 PolarHBondContact O-N 2.8Å; Y294-F297 PolarHBondContact O-N 2.82Å; Y294-Q298 HydrophobicContact CE1-CG 4.39Å; Y294-Q298 VanDerWaalsContact CZ-NE2 3.29Å; Y294-Q298 WeakPolarHBondContact O-CG 3.33Å; Y294-Q298 PolarHBondContact O-N 2.99Å; Y294-Q298 PolarHBondContact OH-NE2 3.09Å; Y294-L303 HydrophobicContact CD2-CD1 4.48Å; Y294-L303 HydrophobicContact CE2-CD1 3.96Å; Y294-S310 PolarHBondContact OH-OG 3.41Å; Y294-F313 AromaticContact CD2-CD1 3.7Å; Y294-F313 HydrophobicContact CD2-CD1 3.7Å; Y294-F313 AromaticContact CD2-CE1 3.9Å; Y294-F313 HydrophobicContact CD2-CE1 3.9Å; Y294-F313 HydrophobicContact CE2-CD1 4.49Å; Y294-F313 HydrophobicContact CG-CE1 4.47Å; Y294-I314 HydrophobicContact CD2-CD1 4.47Å; Y294-I314 HydrophobicContact CD2-CG1 4.18Å; Y294-I314 HydrophobicContact CE2-CD1 4.1Å; Y294-I314 HydrophobicContact CE2-CG1 4.24Å
295	A	98.4	Very high	97.9	Very high	13 Å²	13	41 Å²	41	11%	0.107	20%	0.196	C	C	.	.	H	α-helix	trans	-62.5	-48.7	176	0	0	0	0	0	111.9	L267 L270 C291 I292 F297 Q298 E299	L267-A295 HydrophobicContact CD2-CB 4.1Å; L270-A295 HydrophobicContact CD1-CB 4.08Å; L270-A295 HydrophobicContact CD2-CB 3.8Å; C291-A295 PolarHBondContact O-N 3.28Å; I292-A295 PolarHBondContact O-N 3.05Å; A295-F297 VanDerWaalsContact C-N 3.33Å; A295-F297 PolarHBondContact O-N 3.2Å; A295-Q298 PolarHBondContact O-N 3Å; A295-Q298 VanDerWaalsContact O-N 3.17Å; A295-E299 WeakPolarHBondContact O-CB 3.49Å; A295-E299 PolarHBondContact O-N 3.2Å
296	I	98.8	Very high	98.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57.3	-44.5	175.9	-68.9	167.4	0	0	0	111.6	L270 I292 Q298 E299 R300 H344 I365	L270-I296 HydrophobicContact CD1-CG1 4.11Å; I292-I296 HydrophobicContact CG2-CD1 3.54Å; I292-I296 HydrophobicContact CG2-CG1 4.3Å; I292-I296 VanDerWaalsContact O-CG1 3.29Å; I292-I296 WeakPolarHBondContact O-CG1 3.24Å; I292-I296 PolarHBondContact O-N 2.79Å; I296-Q298 VanDerWaalsContact C-N 3.3Å; I296-Q298 PolarHBondContact O-N 3.14Å; I296-E299 PolarHBondContact O-N 2.9Å; I296-R300 PolarHBondContact O-N 3.38Å; I296-H344 HydrophobicContact CD1-CB 3.76Å; I296-H344 HydrophobicContact CG1-CB 4.01Å; I296-H344 HydrophobicContact CG2-CB 4.29Å; I296-I365 HydrophobicContact CG2-CD1 3.75Å; I296-I365 HydrophobicContact CG2-CG1 4.39Å; I296-I365 HydrophobicContact CG2-CG2 3.85Å
297	F	98.6	Very high	98.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-72.9	-19.9	-179.1	-88.9	-115.7	0	0	0	113.8	M293 Y294 A295 L302 L303 I308 F313 L362 I365	M293-F297 HydrophobicContact CE-CD2 4.35Å; M293-F297 HydrophobicContact CE-CE2 3.59Å; M293-F297 HydrophobicContact CE-CZ 4.29Å; M293-F297 VanDerWaalsContact O-CB 3.31Å; M293-F297 WeakPolarHBondContact O-CB 3.37Å; M293-F297 WeakPolarHBondContact O-CD2 3.19Å; M293-F297 PolarHBondContact O-N 3.33Å; M293-F297 HydrophobicContact SD-CE2 4.32Å; Y294-F297 PolarHBondContact O-N 2.82Å; A295-F297 VanDerWaalsContact C-N 3.33Å; A295-F297 PolarHBondContact O-N 3.2Å; F297-L302 HydrophobicContact CB-CB 4.42Å; F297-L302 HydrophobicContact CD1-CB 3.57Å; F297-L302 HydrophobicContact CD1-CD1 4.1Å; F297-L302 HydrophobicContact CD1-CG 4.49Å; F297-L302 HydrophobicContact CD2-CD1 4.02Å; F297-L302 HydrophobicContact CE1-CB 4.02Å; F297-L302 HydrophobicContact CE1-CD1 4.16Å; F297-L302 HydrophobicContact CE2-CD1 4.08Å; F297-L302 HydrophobicContact CG-CB 4.04Å; F297-L302 HydrophobicContact CG-CD1 4.05Å; F297-L302 HydrophobicContact CZ-CD1 4.17Å; F297-L302 PolarHBondContact O-N 3.06Å; F297-L303 HydrophobicContact CB-CD2 4.16Å; F297-L303 HydrophobicContact CB-CG 4.06Å; F297-L303 HydrophobicContact CD1-CD2 4.02Å; F297-L303 PolarHBondContact O-N 3.02Å; F297-I308 HydrophobicContact CD1-CD1 4.37Å; F297-I308 HydrophobicContact CE1-CD1 4.02Å; F297-F313 HydrophobicContact CB-CE2 4.15Å; F297-F313 HydrophobicContact CB-CZ 3.98Å; F297-F313 AromaticContact CD1-CD2 3.94Å; F297-F313 HydrophobicContact CD1-CD2 3.94Å; F297-F313 AromaticContact CD1-CE2 3.34Å; F297-F313 HydrophobicContact CD1-CE2 3.34Å; F297-F313 HydrophobicContact CD1-CZ 4.01Å; F297-F313 AromaticContact CD2-CE2 3.78Å; F297-F313 HydrophobicContact CD2-CE2 3.78Å; F297-F313 AromaticContact CD2-CZ 3.73Å; F297-F313 HydrophobicContact CD2-CZ 3.73Å; F297-F313 HydrophobicContact CE1-CD2 4.15Å; F297-F313 AromaticContact CE1-CE2 3.5Å; F297-F313 HydrophobicContact CE1-CE2 3.5Å; F297-F313 HydrophobicContact CE1-CZ 4.41Å; F297-F313 AromaticContact CE2-CE2 3.92Å; F297-F313 HydrophobicContact CE2-CE2 3.92Å; F297-F313 HydrophobicContact CE2-CZ 4.15Å; F297-F313 HydrophobicContact CG-CD2 4.38Å; F297-F313 AromaticContact CG-CE2 3.48Å; F297-F313 HydrophobicContact CG-CE2 3.48Å; F297-F313 VanDerWaalsContact CG-CE2 3.48Å; F297-F313 AromaticContact CG-CZ 3.63Å; F297-F313 HydrophobicContact CG-CZ 3.63Å; F297-F313 AromaticContact CZ-CE2 3.78Å; F297-F313 HydrophobicContact CZ-CE2 3.78Å; F297-F313 HydrophobicContact CZ-CZ 4.46Å; F297-L362 HydrophobicContact CE1-CD1 3.42Å; F297-L362 VanDerWaalsContact CE1-CD1 3.42Å; F297-L362 HydrophobicContact CZ-CD1 3.4Å; F297-L362 VanDerWaalsContact CZ-CD1 3.4Å; F297-I365 HydrophobicContact CD2-CG2 4.44Å; F297-I365 HydrophobicContact CE2-CG2 3.8Å
298	Q	97.1	Very high	98.3	Very high	92 Å²	92	37.4 Å²	37.4	43%	0.43	17%	0.171	S	C	.	.	H	α-helix	trans	-79.3	-49.1	167.2	-74.8	-171.1	-11	0	0	111.6	Y294 A295 I296 R300 D301 L303	Y294-Q298 HydrophobicContact CE1-CG 4.39Å; Y294-Q298 VanDerWaalsContact CZ-NE2 3.29Å; Y294-Q298 WeakPolarHBondContact O-CG 3.33Å; Y294-Q298 PolarHBondContact O-N 2.99Å; Y294-Q298 PolarHBondContact OH-NE2 3.09Å; A295-Q298 PolarHBondContact O-N 3Å; A295-Q298 VanDerWaalsContact O-N 3.17Å; I296-Q298 VanDerWaalsContact C-N 3.3Å; I296-Q298 PolarHBondContact O-N 3.14Å; Q298-R300 PolarHBondContact O-N 3.34Å; Q298-D301 PolarHBondContact O-N 2.88Å; Q298-L303 HydrophobicContact CG-CD1 4.34Å
299	E	97.9	Very high	98.2	Very high	111 Å²	111	40 Å²	40	52%	0.519	19%	0.189	S	C	.	.	H	α-helix	trans	-59.9	-45	-177.2	-177.3	68	175.8	0	0	112	L270 N271 A295 I296 D301	L270-E299 HydrophobicContact CD2-CB 4.13Å; L270-E299 HydrophobicContact CD2-CG 4.42Å; N271-E299 PolarHBondContact ND2-OE1 3.4Å; A295-E299 WeakPolarHBondContact O-CB 3.49Å; A295-E299 PolarHBondContact O-N 3.2Å; I296-E299 PolarHBondContact O-N 2.9Å; E299-D301 VanDerWaalsContact C-N 3.28Å; E299-D301 PolarHBondContact O-N 3.06Å
300	R	98	Very high	98.1	Very high	55 Å²	55	41.2 Å²	41.2	21%	0.208	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	8.8	176.3	-65.1	-173.5	175.5	-85	-2.5	114.2	I296 Q298 L302 H344 L347 S348	I296-R300 PolarHBondContact O-N 3.38Å; Q298-R300 PolarHBondContact O-N 3.34Å; R300-L302 HydrophobicContact CB-CD1 4.13Å; R300-L302 HydrophobicContact CB-CD2 4.36Å; R300-L302 HydrophobicContact CB-CG 3.82Å; R300-L302 PolarHBondContact O-N 3.2Å; R300-H344 PolarHBondContact NE-CE1 2.67Å; R300-H344 PolarHBondContact NE-ND1 2.8Å; R300-H344 PolarHBondContact NH2-O 2.65Å; R300-L347 VanDerWaalsContact NH2-C 3.32Å; R300-L347 PolarHBondContact NH2-O 3.35Å; R300-S348 PolarHBondContact NH2-OG 3.38Å
301	D	98.1	Very high	97.9	Very high	55 Å²	55	45.9 Å²	45.9	29%	0.294	22%	0.223	S	C	.	.			trans	47.7	24.2	-176	-150.5	5.3	0	0	0	117.1	Q298 E299 L303 K304 T305	Q298-D301 PolarHBondContact O-N 2.88Å; E299-D301 VanDerWaalsContact C-N 3.28Å; E299-D301 PolarHBondContact O-N 3.06Å; D301-L303 PolarHBondContact O-N 2.83Å; D301-K304 PolarHBondContact O-N 3.35Å; D301-K304 VanDerWaalsContact OD1-CB 3.26Å; D301-K304 WeakPolarHBondContact OD1-CB 3.37Å; D301-K304 WeakPolarHBondContact OD1-CD 3.41Å; D301-K304 WeakPolarHBondContact OD1-CE 3.48Å; D301-K304 WeakPolarHBondContact OD1-CG 3.24Å; D301-K304 IonicContact OD1-NZ 2.71Å; D301-K304 PolarHBondContact OD1-NZ 3.41Å; D301-K304 WeakPolarHBondContact OD2-CD 3.23Å; D301-K304 IonicContact OD2-NZ 2.75Å; D301-K304 PolarHBondContact OD2-NZ 3.37Å; D301-T305 PolarHBondContact O-N 3.46Å; D301-T305 PolarHBondContact O-OG1 3.5Å
302	L	98.4	Very high	97.8	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-60.5	-31.6	-174.3	-62.5	174	0	0	0	112	F297 R300 F306 I361 L362 I365	F297-L302 HydrophobicContact CB-CB 4.42Å; F297-L302 HydrophobicContact CD1-CB 3.57Å; F297-L302 HydrophobicContact CD1-CD1 4.1Å; F297-L302 HydrophobicContact CD1-CG 4.49Å; F297-L302 HydrophobicContact CD2-CD1 4.02Å; F297-L302 HydrophobicContact CE1-CB 4.02Å; F297-L302 HydrophobicContact CE1-CD1 4.16Å; F297-L302 HydrophobicContact CE2-CD1 4.08Å; F297-L302 HydrophobicContact CG-CB 4.04Å; F297-L302 HydrophobicContact CG-CD1 4.05Å; F297-L302 HydrophobicContact CZ-CD1 4.17Å; F297-L302 PolarHBondContact O-N 3.06Å; R300-L302 HydrophobicContact CB-CD1 4.13Å; R300-L302 HydrophobicContact CB-CD2 4.36Å; R300-L302 HydrophobicContact CB-CG 3.82Å; R300-L302 PolarHBondContact O-N 3.2Å; L302-F306 HydrophobicContact CB-CD2 4.46Å; L302-F306 HydrophobicContact CD2-CD2 4.25Å; L302-F306 HydrophobicContact CD2-CE2 3.93Å; L302-F306 WeakPolarHBondContact O-CB 3.44Å; L302-F306 PolarHBondContact O-N 3.22Å; L302-I361 HydrophobicContact CD2-CG2 4.29Å; L302-L362 HydrophobicContact CD1-CD1 4.47Å; L302-I365 HydrophobicContact CD1-CD1 4.05Å
303	L	97.7	Very high	97.8	Very high	17 Å²	17	46.2 Å²	46.2	9%	0.089	23%	0.225	C	C	.	.	H	α-helix	trans	-60.5	-44.4	174.9	-61.7	179.1	0	0	0	112.2	Y294 F297 Q298 D301 R307 I308 F313	Y294-L303 HydrophobicContact CD2-CD1 4.48Å; Y294-L303 HydrophobicContact CE2-CD1 3.96Å; F297-L303 HydrophobicContact CB-CD2 4.16Å; F297-L303 HydrophobicContact CB-CG 4.06Å; F297-L303 HydrophobicContact CD1-CD2 4.02Å; F297-L303 PolarHBondContact O-N 3.02Å; Q298-L303 HydrophobicContact CG-CD1 4.34Å; D301-L303 PolarHBondContact O-N 2.83Å; L303-R307 CarbonylContact O-C 3.27Å; L303-R307 VanDerWaalsContact O-CA 3.29Å; L303-R307 WeakPolarHBondContact O-CA 3.35Å; L303-R307 PolarHBondContact O-N 3.2Å; L303-I308 HydrophobicContact CD2-CB 3.95Å; L303-I308 HydrophobicContact CD2-CG2 4.21Å; L303-I308 PolarHBondContact O-N 3.36Å; L303-F313 HydrophobicContact CD2-CB 4.04Å; L303-F313 HydrophobicContact CD2-CD2 3.88Å; L303-F313 HydrophobicContact CD2-CG 3.91Å
304	K	97.9	Very high	97.7	Very high	149 Å²	149	47 Å²	47	65%	0.648	23%	0.229	S	C	*	.	H	α-helix	trans	-74.8	-47.1	178.2	-63.6	-171	-147.6	81.9	0	110.9	D301 F306 R307	D301-K304 PolarHBondContact O-N 3.35Å; D301-K304 VanDerWaalsContact OD1-CB 3.26Å; D301-K304 WeakPolarHBondContact OD1-CB 3.37Å; D301-K304 WeakPolarHBondContact OD1-CD 3.41Å; D301-K304 WeakPolarHBondContact OD1-CE 3.48Å; D301-K304 WeakPolarHBondContact OD1-CG 3.24Å; D301-K304 IonicContact OD1-NZ 2.71Å; D301-K304 PolarHBondContact OD1-NZ 3.41Å; D301-K304 WeakPolarHBondContact OD2-CD 3.23Å; D301-K304 IonicContact OD2-NZ 2.75Å; D301-K304 PolarHBondContact OD2-NZ 3.37Å; K304-F306 VanDerWaalsContact C-N 3.34Å; K304-F306 PolarHBondContact O-N 3.3Å; K304-R307 PolarHBondContact O-N 3.1Å
305	T	98.3	Very high	97.6	Very high	67 Å²	67	47.5 Å²	47.5	41%	0.411	23%	0.233	S	C	.	.	H	α-helix	trans	-56.1	-46	-178.2	-63.8	0	0	0	0	112.2	D301 D358	D301-T305 PolarHBondContact O-N 3.46Å; D301-T305 PolarHBondContact O-OG1 3.5Å; T305-D358 HydrophobicContact CG2-CB 4.06Å
306	F	98.4	Very high	97.6	Very high	14 Å²	14	46.9 Å²	46.9	6%	0.061	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	4.8	179.8	-63.4	-64.9	0	0	0	114.6	L302 K304 I308 D358 L359 L362 L423	L302-F306 HydrophobicContact CB-CD2 4.46Å; L302-F306 HydrophobicContact CD2-CD2 4.25Å; L302-F306 HydrophobicContact CD2-CE2 3.93Å; L302-F306 WeakPolarHBondContact O-CB 3.44Å; L302-F306 PolarHBondContact O-N 3.22Å; K304-F306 VanDerWaalsContact C-N 3.34Å; K304-F306 PolarHBondContact O-N 3.3Å; F306-I308 VanDerWaalsContact C-N 3.3Å; F306-I308 HydrophobicContact CB-CD1 4.05Å; F306-I308 HydrophobicContact CB-CG1 3.9Å; F306-I308 PolarHBondContact O-N 2.76Å; F306-D358 HydrophobicContact CE2-CB 3.75Å; F306-D358 WeakPolarHBondContact CE2-O 3.16Å; F306-D358 VanDerWaalsContact CZ-C 3.48Å; F306-D358 HydrophobicContact CZ-CB 3.51Å; F306-D358 WeakPolarHBondContact CZ-O 3.13Å; F306-L359 HydrophobicContact CE1-CD1 4.05Å; F306-L359 HydrophobicContact CZ-CB 4.33Å; F306-L359 HydrophobicContact CZ-CD1 4.3Å; F306-L362 HydrophobicContact CD1-CD2 4.29Å; F306-L362 HydrophobicContact CD2-CB 4.4Å; F306-L362 HydrophobicContact CD2-CD2 3.62Å; F306-L362 HydrophobicContact CD2-CG 4.4Å; F306-L362 HydrophobicContact CE1-CD2 4.39Å; F306-L362 HydrophobicContact CE2-CB 3.87Å; F306-L362 HydrophobicContact CE2-CD2 3.73Å; F306-L362 HydrophobicContact CE2-CG 4.32Å; F306-L362 HydrophobicContact CG-CD2 3.88Å; F306-L362 HydrophobicContact CZ-CB 4.41Å; F306-L362 HydrophobicContact CZ-CD2 4.11Å; F306-L423 HydrophobicContact CB-CD2 4.05Å; F306-L423 HydrophobicContact CD1-CD2 3.29Å; F306-L423 HydrophobicContact CE1-CD2 4.03Å; F306-L423 HydrophobicContact CG-CD2 3.99Å
307	R	98.1	Very high	97.6	Very high	186 Å²	186	47 Å²	47	70%	0.702	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	41.7	173.2	-44.3	177.6	76.8	-171.3	5.4	111.8	L303 K304 N422	L303-R307 CarbonylContact O-C 3.27Å; L303-R307 VanDerWaalsContact O-CA 3.29Å; L303-R307 WeakPolarHBondContact O-CA 3.35Å; L303-R307 PolarHBondContact O-N 3.2Å; K304-R307 PolarHBondContact O-N 3.1Å; R307-N422 HydrophobicContact CB-CB 4.23Å; R307-N422 PolarHBondContact O-ND2 2.91Å
308	I	98	Very high	97.5	Very high	13 Å²	13	49.1 Å²	49.1	7%	0.067	24%	0.239	C	C	.	.			trans	-88.5	126.8	178.7	-44.1	179.5	0	0	0	107.3	F297 L303 F306 F313 I419	F297-I308 HydrophobicContact CD1-CD1 4.37Å; F297-I308 HydrophobicContact CE1-CD1 4.02Å; L303-I308 HydrophobicContact CD2-CB 3.95Å; L303-I308 HydrophobicContact CD2-CG2 4.21Å; L303-I308 PolarHBondContact O-N 3.36Å; F306-I308 VanDerWaalsContact C-N 3.3Å; F306-I308 HydrophobicContact CB-CD1 4.05Å; F306-I308 HydrophobicContact CB-CG1 3.9Å; F306-I308 PolarHBondContact O-N 2.76Å; I308-F313 HydrophobicContact CG2-CB 4.05Å; I308-F313 HydrophobicContact CG2-CD2 4.41Å; I308-I419 WeakPolarHBondContact CG1-O 3.49Å; I308-I419 HydrophobicContact CG2-CB 3.94Å; I308-I419 HydrophobicContact CG2-CG2 3.95Å
309	S	97.1	Very high	97.5	Very high	55 Å²	55	45 Å²	45	39%	0.385	22%	0.221	S	C	.	.			trans	-76.2	143.6	172.3	67.3	0	0	0	0	110.1	D311 T312 F313	S309-D311 PolarHBondContact O-N 3.01Å; S309-T312 PolarHBondContact O-N 2.99Å; S309-T312 VanDerWaalsContact O-N 3.14Å; S309-T312 WeakPolarHBondContact OG-CB 3.3Å; S309-T312 PolarHBondContact OG-N 3.43Å; S309-T312 PolarHBondContact OG-OG1 2.95Å; S309-F313 PolarHBondContact O-N 3.19Å
310	S	95.8	Very high	97.5	Very high	27 Å²	27	39.8 Å²	39.8	19%	0.189	20%	0.196	C	C	.	.	H	α-helix	trans	-54.3	-39	175.5	-56.5	0	0	0	0	111.7	Y294 T312 F313 I314	Y294-S310 PolarHBondContact OH-OG 3.41Å; S310-T312 PolarHBondContact O-N 3.16Å; S310-F313 PolarHBondContact O-N 3.36Å; S310-I314 WeakPolarHBondContact O-CB 3.44Å; S310-I314 WeakPolarHBondContact O-CD1 3.35Å; S310-I314 VanDerWaalsContact O-CG1 3.24Å; S310-I314 WeakPolarHBondContact O-CG1 3.38Å; S310-I314 PolarHBondContact O-N 3.08Å
311	D	94.9	Very high	97.5	Very high	97 Å²	97	37.6 Å²	37.6	52%	0.519	19%	0.188	S	C	.	.	H	α-helix	trans	-61.7	-45.5	178.7	-45.4	-40	0	0	0	111.8	I250 S309 T315	I250-D311 WeakPolarHBondContact CG1-OD1 3.34Å; S309-D311 PolarHBondContact O-N 3.01Å; D311-T315 VanDerWaalsContact O-CB 3.25Å; D311-T315 WeakPolarHBondContact O-CB 3.08Å; D311-T315 PolarHBondContact O-N 3.42Å; D311-T315 PolarHBondContact O-OG1 3.43Å
312	T	96.3	Very high	97.5	Very high	8 Å²	8	37.1 Å²	37.1	5%	0.049	19%	0.185	C	C	.	.	H	α-helix	trans	-66.5	-39.7	176.7	-71.4	0	0	0	0	111.4	S309 S310 Y316 H416 I419 M421	S309-T312 PolarHBondContact O-N 2.99Å; S309-T312 VanDerWaalsContact O-N 3.14Å; S309-T312 WeakPolarHBondContact OG-CB 3.3Å; S309-T312 PolarHBondContact OG-N 3.43Å; S309-T312 PolarHBondContact OG-OG1 2.95Å; S310-T312 PolarHBondContact O-N 3.16Å; T312-Y316 WeakPolarHBondContact O-CB 3.38Å; T312-Y316 PolarHBondContact O-N 3.06Å; T312-H416 WeakPolarHBondContact CA-O 3.43Å; T312-H416 WeakPolarHBondContact CG2-O 3.48Å; T312-I419 HydrophobicContact CG2-CG2 3.89Å; T312-M421 HydrophobicContact CG2-CE 3.84Å
313	F	98.1	Very high	97.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64	-52.3	177.7	-174.8	-90	0	0	0	112	M293 Y294 F297 L303 I308 S309 S310 T315 Y316 M317 I419	M293-F313 HydrophobicContact CB-CE1 4.37Å; M293-F313 HydrophobicContact CB-CZ 3.96Å; M293-F313 WeakPolarHBondContact O-CZ 3.36Å; Y294-F313 AromaticContact CD2-CD1 3.7Å; Y294-F313 HydrophobicContact CD2-CD1 3.7Å; Y294-F313 AromaticContact CD2-CE1 3.9Å; Y294-F313 HydrophobicContact CD2-CE1 3.9Å; Y294-F313 HydrophobicContact CE2-CD1 4.49Å; Y294-F313 HydrophobicContact CG-CE1 4.47Å; F297-F313 HydrophobicContact CB-CE2 4.15Å; F297-F313 HydrophobicContact CB-CZ 3.98Å; F297-F313 AromaticContact CD1-CD2 3.94Å; F297-F313 HydrophobicContact CD1-CD2 3.94Å; F297-F313 AromaticContact CD1-CE2 3.34Å; F297-F313 HydrophobicContact CD1-CE2 3.34Å; F297-F313 HydrophobicContact CD1-CZ 4.01Å; F297-F313 AromaticContact CD2-CE2 3.78Å; F297-F313 HydrophobicContact CD2-CE2 3.78Å; F297-F313 AromaticContact CD2-CZ 3.73Å; F297-F313 HydrophobicContact CD2-CZ 3.73Å; F297-F313 HydrophobicContact CE1-CD2 4.15Å; F297-F313 AromaticContact CE1-CE2 3.5Å; F297-F313 HydrophobicContact CE1-CE2 3.5Å; F297-F313 HydrophobicContact CE1-CZ 4.41Å; F297-F313 AromaticContact CE2-CE2 3.92Å; F297-F313 HydrophobicContact CE2-CE2 3.92Å; F297-F313 HydrophobicContact CE2-CZ 4.15Å; F297-F313 HydrophobicContact CG-CD2 4.38Å; F297-F313 AromaticContact CG-CE2 3.48Å; F297-F313 HydrophobicContact CG-CE2 3.48Å; F297-F313 VanDerWaalsContact CG-CE2 3.48Å; F297-F313 AromaticContact CG-CZ 3.63Å; F297-F313 HydrophobicContact CG-CZ 3.63Å; F297-F313 AromaticContact CZ-CE2 3.78Å; F297-F313 HydrophobicContact CZ-CE2 3.78Å; F297-F313 HydrophobicContact CZ-CZ 4.46Å; L303-F313 HydrophobicContact CD2-CB 4.04Å; L303-F313 HydrophobicContact CD2-CD2 3.88Å; L303-F313 HydrophobicContact CD2-CG 3.91Å; I308-F313 HydrophobicContact CG2-CB 4.05Å; I308-F313 HydrophobicContact CG2-CD2 4.41Å; S309-F313 PolarHBondContact O-N 3.19Å; S310-F313 PolarHBondContact O-N 3.36Å; F313-T315 VanDerWaalsContact C-N 3.34Å; F313-T315 PolarHBondContact O-N 3.44Å; F313-Y316 PolarHBondContact O-N 3.23Å; F313-M317 HydrophobicContact CD1-CG 3.87Å; F313-M317 HydrophobicContact CE1-CG 3.47Å; F313-M317 VanDerWaalsContact CE1-CG 3.47Å; F313-M317 HydrophobicContact CE2-CG 4.19Å; F313-M317 HydrophobicContact CE2-SD 4.44Å; F313-M317 HydrophobicContact CG-CG 4.42Å; F313-M317 HydrophobicContact CZ-CG 3.67Å; F313-M317 HydrophobicContact CZ-SD 4.14Å; F313-M317 WeakPolarHBondContact O-CB 3.43Å; F313-M317 WeakPolarHBondContact O-CG 3.34Å; F313-M317 PolarHBondContact O-N 2.96Å; F313-I419 HydrophobicContact CB-CG2 4.38Å; F313-I419 HydrophobicContact CD2-CG2 4.25Å
314	I	96.7	Very high	97.5	Very high	16 Å²	16	37.2 Å²	37.2	8%	0.082	19%	0.185	C	C	.	.	H	α-helix	trans	-63.6	-40.5	179.6	-65.8	163	0	0	0	110.3	I250 G254 Y294 S310 Y316 M317 M318	I250-I314 HydrophobicContact CG2-CD1 3.92Å; G254-I314 WeakPolarHBondContact O-CG2 3.14Å; Y294-I314 HydrophobicContact CD2-CD1 4.47Å; Y294-I314 HydrophobicContact CD2-CG1 4.18Å; Y294-I314 HydrophobicContact CE2-CD1 4.1Å; Y294-I314 HydrophobicContact CE2-CG1 4.24Å; S310-I314 WeakPolarHBondContact O-CB 3.44Å; S310-I314 WeakPolarHBondContact O-CD1 3.35Å; S310-I314 VanDerWaalsContact O-CG1 3.24Å; S310-I314 WeakPolarHBondContact O-CG1 3.38Å; S310-I314 PolarHBondContact O-N 3.08Å; I314-Y316 PolarHBondContact O-N 2.89Å; I314-M317 PolarHBondContact O-N 2.96Å; I314-M318 HydrophobicContact CG2-CE 3.52Å; I314-M318 HydrophobicContact CG2-CG 4.15Å; I314-M318 HydrophobicContact CG2-SD 3.75Å; I314-M318 WeakPolarHBondContact O-CB 3.27Å; I314-M318 WeakPolarHBondContact O-CG 3.25Å; I314-M318 PolarHBondContact O-N 3.21Å
315	T	96.8	Very high	97.5	Very high	22 Å²	22	31.7 Å²	31.7	14%	0.135	16%	0.162	C	C	.	.	H	α-helix	trans	-62.2	-42.1	176.1	-54.6	0	0	0	0	111.7	D311 F313 T319 H416	D311-T315 VanDerWaalsContact O-CB 3.25Å; D311-T315 WeakPolarHBondContact O-CB 3.08Å; D311-T315 PolarHBondContact O-N 3.42Å; D311-T315 PolarHBondContact O-OG1 3.43Å; F313-T315 VanDerWaalsContact C-N 3.34Å; F313-T315 PolarHBondContact O-N 3.44Å; T315-T319 VanDerWaalsContact O-CB 3.31Å; T315-T319 WeakPolarHBondContact O-CB 3.2Å; T315-T319 PolarHBondContact O-N 3.42Å; T315-T319 PolarHBondContact O-OG1 3.36Å; T315-H416 HydrophobicContact CG2-CB 4.37Å
316	Y	98.4	Very high	97.4	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65.3	-50.3	173.7	179.6	-97.6	0	0	0	111.8	T312 F313 I314 M318 T319 L320 F366 G408 L411 L412 C417 I419	T312-Y316 WeakPolarHBondContact O-CB 3.38Å; T312-Y316 PolarHBondContact O-N 3.06Å; F313-Y316 PolarHBondContact O-N 3.23Å; I314-Y316 PolarHBondContact O-N 2.89Å; Y316-M318 PolarHBondContact O-N 2.83Å; Y316-T319 CarbonylContact O-C 3.57Å; Y316-T319 PolarHBondContact O-N 3.43Å; Y316-T319 VanDerWaalsContact O-N 3.16Å; Y316-L320 HydrophobicContact CE1-CB 4.33Å; Y316-L320 HydrophobicContact CE1-CD2 4.04Å; Y316-L320 WeakPolarHBondContact O-CB 3.46Å; Y316-L320 PolarHBondContact O-N 2.87Å; Y316-F366 HydrophobicContact CE1-CD2 4.48Å; Y316-F366 AromaticContact CE1-CE2 3.65Å; Y316-F366 HydrophobicContact CE1-CE2 3.65Å; Y316-F366 HydrophobicContact CE1-CZ 4.48Å; Y316-F366 AromaticContact CZ-CE2 3.73Å; Y316-F366 WeakPolarHBondContact OH-CE2 3.26Å; Y316-F366 WeakPolarHBondContact OH-CZ 3.29Å; Y316-G408 PolarHBondContact OH-O 3.36Å; Y316-L411 HydrophobicContact CD2-CB 4.46Å; Y316-L411 HydrophobicContact CE2-CB 3.83Å; Y316-L412 HydrophobicContact CD2-CD2 3.78Å; Y316-L412 HydrophobicContact CD2-CG 4.4Å; Y316-L412 HydrophobicContact CE2-CD2 3.51Å; Y316-L412 HydrophobicContact CE2-CG 3.77Å; Y316-C417 HydrophobicContact CD2-CB 4.15Å; Y316-C417 VanDerWaalsContact CD2-O 3.3Å; Y316-C417 WeakPolarHBondContact CD2-O 3.38Å; Y316-I419 HydrophobicContact CD1-CD1 4.02Å; Y316-I419 HydrophobicContact CD1-CG1 4.41Å; Y316-I419 HydrophobicContact CD1-CG2 4.44Å; Y316-I419 HydrophobicContact CE1-CD1 4.22Å; Y316-I419 HydrophobicContact CG-CG1 4.46Å; Y316-I419 HydrophobicContact CG-CG2 4.18Å
317	M	98.5	Very high	97.3	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-64.5	-42.1	-175.6	-70.5	-49.4	-49.4	0	0	113	L289 T290 M293 F313 I314 T319 L320 E321	L289-M317 HydrophobicContact CD1-CE 4.27Å; L289-M317 HydrophobicContact CD2-CE 4.21Å; L289-M317 HydrophobicContact CG-CE 3.73Å; T290-M317 HydrophobicContact CG2-CB 4.06Å; M293-M317 HydrophobicContact CB-CE 3.69Å; M293-M317 HydrophobicContact CB-CG 4.37Å; M293-M317 HydrophobicContact CB-SD 4.09Å; M293-M317 HydrophobicContact CE-CE 4.22Å; M293-M317 HydrophobicContact CE-SD 4.01Å; M293-M317 HydrophobicContact CG-CE 3.59Å; M293-M317 HydrophobicContact CG-SD 4.35Å; F313-M317 HydrophobicContact CD1-CG 3.87Å; F313-M317 HydrophobicContact CE1-CG 3.47Å; F313-M317 VanDerWaalsContact CE1-CG 3.47Å; F313-M317 HydrophobicContact CE2-CG 4.19Å; F313-M317 HydrophobicContact CE2-SD 4.44Å; F313-M317 HydrophobicContact CG-CG 4.42Å; F313-M317 HydrophobicContact CZ-CG 3.67Å; F313-M317 HydrophobicContact CZ-SD 4.14Å; F313-M317 WeakPolarHBondContact O-CB 3.43Å; F313-M317 WeakPolarHBondContact O-CG 3.34Å; F313-M317 PolarHBondContact O-N 2.96Å; I314-M317 PolarHBondContact O-N 2.96Å; M317-T319 VanDerWaalsContact C-N 3.32Å; M317-T319 PolarHBondContact O-N 3.12Å; M317-L320 HydrophobicContact CE-CD2 3.69Å; M317-L320 PolarHBondContact O-N 3.34Å; M317-L320 HydrophobicContact SD-CD2 4.22Å; M317-E321 VanDerWaalsContact O-CB 3.32Å; M317-E321 WeakPolarHBondContact O-CB 3.31Å; M317-E321 PolarHBondContact O-N 2.9Å
318	M	96.7	Very high	97.3	Very high	45 Å²	45	30.7 Å²	30.7	22%	0.222	18%	0.177	C	C	.	.	H	α-helix	trans	-62.1	-41.6	173.1	-71.7	179.8	173.5	0	0	111.3	T290 I314 Y316 L320 E321 D322	T290-M318 HydrophobicContact CG2-CG 4.07Å; I314-M318 HydrophobicContact CG2-CE 3.52Å; I314-M318 HydrophobicContact CG2-CG 4.15Å; I314-M318 HydrophobicContact CG2-SD 3.75Å; I314-M318 WeakPolarHBondContact O-CB 3.27Å; I314-M318 WeakPolarHBondContact O-CG 3.25Å; I314-M318 PolarHBondContact O-N 3.21Å; Y316-M318 PolarHBondContact O-N 2.83Å; M318-L320 VanDerWaalsContact C-N 3.35Å; M318-E321 PolarHBondContact O-N 3.46Å; M318-D322 WeakPolarHBondContact O-CB 3.34Å; M318-D322 PolarHBondContact O-N 3.45Å
319	T	97.3	Very high	97.4	Very high	7 Å²	7	30.4 Å²	30.4	4%	0.043	18%	0.177	C	C	.	.	H	α-helix	trans	-68.3	-33.1	177.8	-55.8	0	0	0	0	112.4	H241 T315 Y316 M317 H323 L411	H241-T319 PolarHBondContact NE2-OG1 3.39Å; T315-T319 VanDerWaalsContact O-CB 3.31Å; T315-T319 WeakPolarHBondContact O-CB 3.2Å; T315-T319 PolarHBondContact O-N 3.42Å; T315-T319 PolarHBondContact O-OG1 3.36Å; Y316-T319 CarbonylContact O-C 3.57Å; Y316-T319 PolarHBondContact O-N 3.43Å; Y316-T319 VanDerWaalsContact O-N 3.16Å; M317-T319 VanDerWaalsContact C-N 3.32Å; M317-T319 PolarHBondContact O-N 3.12Å; T319-H323 PolarHBondContact O-ND1 2.88Å; T319-L411 HydrophobicContact CG2-CD1 4.45Å; T319-L411 HydrophobicContact CG2-CD2 4.19Å
320	L	98.4	Very high	97.4	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-68.6	-48	173.6	-178.4	73.2	0	0	0	110.9	L289 Y316 M317 M318 D322 H323 Y324 A369 I370 V373 L411	L289-L320 HydrophobicContact CD2-CD2 4.03Å; L289-L320 HydrophobicContact CD2-CG 4.33Å; Y316-L320 HydrophobicContact CE1-CB 4.33Å; Y316-L320 HydrophobicContact CE1-CD2 4.04Å; Y316-L320 WeakPolarHBondContact O-CB 3.46Å; Y316-L320 PolarHBondContact O-N 2.87Å; M317-L320 HydrophobicContact CE-CD2 3.69Å; M317-L320 PolarHBondContact O-N 3.34Å; M317-L320 HydrophobicContact SD-CD2 4.22Å; M318-L320 VanDerWaalsContact C-N 3.35Å; L320-D322 VanDerWaalsContact C-N 3.29Å; L320-D322 PolarHBondContact O-N 3.26Å; L320-H323 PolarHBondContact O-N 3.16Å; L320-Y324 HydrophobicContact CG-CE2 4.35Å; L320-Y324 WeakPolarHBondContact O-CD2 3.23Å; L320-A369 HydrophobicContact CD2-CB 4.42Å; L320-A369 WeakPolarHBondContact CD2-O 3.37Å; L320-I370 HydrophobicContact CD1-CB 4.42Å; L320-I370 HydrophobicContact CD1-CG2 3.78Å; L320-I370 HydrophobicContact CD2-CG2 3.95Å; L320-V373 HydrophobicContact CD1-CB 4.06Å; L320-V373 HydrophobicContact CD1-CG1 4.24Å; L320-V373 HydrophobicContact CD1-CG2 3.78Å; L320-L411 HydrophobicContact CB-CD1 4.37Å; L320-L411 HydrophobicContact CD1-CD1 4.02Å
321	E	98.4	Very high	97.6	Very high	8 Å²	8	28.9 Å²	28.9	4%	0.037	16%	0.161	C	C	.	.	H	α-helix	trans	-63.3	-34	177.2	-175.6	150.6	-134.8	0	0	112.2	R287 P288 L289 T290 M317 M318 H323 Y324 S333	R287-E321 VanDerWaalsContact C-OE1 3.31Å; R287-E321 WeakPolarHBondContact CA-OE1 3.33Å; R287-E321 WeakPolarHBondContact CA-OE2 3.31Å; R287-E321 VanDerWaalsContact CD-OE2 3.3Å; R287-E321 WeakPolarHBondContact CD-OE2 3.47Å; P288-E321 VanDerWaalsContact CD-OE1 3.23Å; P288-E321 WeakPolarHBondContact CD-OE1 3.46Å; L289-E321 HydrophobicContact CB-CG 4.41Å; L289-E321 WeakPolarHBondContact CB-OE1 3.43Å; L289-E321 HydrophobicContact CD2-CB 4.49Å; L289-E321 PolarHBondContact N-OE1 3.02Å; T290-E321 VanDerWaalsContact CB-OE2 3.24Å; T290-E321 WeakPolarHBondContact CB-OE2 3.28Å; T290-E321 PolarHBondContact N-OE2 3.47Å; T290-E321 PolarHBondContact OG1-OE2 3.36Å; M317-E321 VanDerWaalsContact O-CB 3.32Å; M317-E321 WeakPolarHBondContact O-CB 3.31Å; M317-E321 PolarHBondContact O-N 2.9Å; M318-E321 PolarHBondContact O-N 3.46Å; E321-H323 PolarHBondContact O-N 3.47Å; E321-Y324 PolarHBondContact O-N 3.11Å; E321-S333 WeakPolarHBondContact OE1-CB 3.35Å; E321-S333 PolarHBondContact OE1-OG 3.11Å
322	D	97.3	Very high	97.8	Very high	45 Å²	45	25.1 Å²	25.1	24%	0.241	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.9	171.1	-73.7	-19.3	0	0	0	114.6	L239 H241 R287 M318 L320	L239-D322 HydrophobicContact CD1-CB 3.93Å; L239-D322 HydrophobicContact CD2-CB 3.8Å; H241-D322 IonicContact CE1-OD2 3.35Å; H241-D322 PolarHBondContact CE1-OD2 3Å; H241-D322 VanDerWaalsContact CE1-OD2 3.28Å; R287-D322 IonicContact CZ-OD1 2.97Å; R287-D322 IonicContact NH1-OD1 2.65Å; R287-D322 PolarHBondContact NH1-OD1 2.81Å; R287-D322 IonicContact NH2-OD1 2.67Å; R287-D322 PolarHBondContact NH2-OD1 3.37Å; M318-D322 WeakPolarHBondContact O-CB 3.34Å; M318-D322 PolarHBondContact O-N 3.45Å; L320-D322 VanDerWaalsContact C-N 3.29Å; L320-D322 PolarHBondContact O-N 3.26Å
323	H	97.9	Very high	97.9	Very high	7 Å²	7	25.1 Å²	25.1	3%	0.032	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-3.1	174	-75.8	75.2	0	0	0	113.4	K237 L239 T319 L320 E321 H325 V373 D374 L411	K237-H323 PolarHBondContact O-NE2 2.83Å; L239-H323 VanDerWaalsContact CD1-CE1 3.47Å; L239-H323 WeakPolarHBondContact CD1-CE1 3.35Å; T319-H323 PolarHBondContact O-ND1 2.88Å; L320-H323 PolarHBondContact O-N 3.16Å; E321-H323 PolarHBondContact O-N 3.47Å; H323-H325 PolarHBondContact O-CD2 3.28Å; H323-V373 HydrophobicContact CB-CG2 3.55Å; H323-D374 VanDerWaalsContact O-CA 3.25Å; H323-D374 WeakPolarHBondContact O-CA 3.04Å; H323-D374 PolarHBondContact O-N 3.24Å; H323-L411 HydrophobicContact CB-CD1 4.35Å
324	Y	98.6	Very high	97.9	Very high	13 Å²	13	25.6 Å²	25.6	5%	0.051	14%	0.143	C	C	.	.	S	Bend	trans	-82.4	136	163.4	-79.5	-84.7	0	0	0	109.8	L289 L320 E321 S326 N332 A336 A369 D372 V373	L289-Y324 HydrophobicContact CD2-CD2 3.97Å; L289-Y324 HydrophobicContact CD2-CE2 3.65Å; L320-Y324 HydrophobicContact CG-CE2 4.35Å; L320-Y324 WeakPolarHBondContact O-CD2 3.23Å; E321-Y324 PolarHBondContact O-N 3.11Å; Y324-S326 PolarHBondContact O-N 2.96Å; Y324-N332 VanDerWaalsContact CD1-C 3.45Å; Y324-A336 HydrophobicContact CE1-CB 3.79Å; Y324-A336 HydrophobicContact CE2-CB 3.98Å; Y324-A336 VanDerWaalsContact CZ-CB 3.43Å; Y324-A336 VanDerWaalsContact OH-CB 3.31Å; Y324-A336 WeakPolarHBondContact OH-CB 3.23Å; Y324-A369 PolarHBondContact OH-O 2.95Å; Y324-A369 VanDerWaalsContact OH-O 3.1Å; Y324-D372 VanDerWaalsContact CE1-C 3.45Å; Y324-D372 HydrophobicContact CE1-CB 3.61Å; Y324-D372 WeakPolarHBondContact CE1-O 3.4Å; Y324-D372 PolarHBondContact OH-N 2.98Å; Y324-V373 HydrophobicContact CD2-CB 4.4Å; Y324-V373 HydrophobicContact CD2-CG2 4.15Å; Y324-V373 HydrophobicContact CE1-CB 4.48Å; Y324-V373 HydrophobicContact CE2-CB 3.81Å; Y324-V373 HydrophobicContact CE2-CG2 3.99Å; Y324-V373 PolarHBondContact OH-N 2.87Å
325	H	97.8	Very high	98	Very high	34 Å²	34	24.8 Å²	24.8	16%	0.157	14%	0.139	C	C	.	.			trans	-84.5	116.8	-171.2	-66.6	-168.8	0	0	0	109.8	H323 D327 V328 D374	H323-H325 PolarHBondContact O-CD2 3.28Å; H325-D327 PolarHBondContact O-N 2.94Å; H325-V328 HydrophobicContact CB-CB 4.13Å; H325-V328 HydrophobicContact CB-CG2 3.61Å; H325-V328 PolarHBondContact O-N 2.8Å; H325-D374 IonicContact CD2-OD1 3.43Å; H325-D374 IonicContact CE1-OD1 3.17Å; H325-D374 IonicContact NE2-OD1 3.28Å; H325-D374 PolarHBondContact NE2-OD1 2.88Å
326	S	96.4	Very high	98.1	Very high	116 Å²	116	23.8 Å²	23.8	81%	0.811	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-9.5	-177.5	59.6	0	0	0	0	114.3	Y324	Y324-S326 PolarHBondContact O-N 2.96Å
327	D	96.4	Very high	98.1	Very high	122 Å²	122	23.8 Å²	23.8	65%	0.652	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-4.2	173.3	50.7	-46.7	0	0	0	113.4	H325	H325-D327 PolarHBondContact O-N 2.94Å
328	V	98.4	Very high	98.2	Very high	7 Å²	7	23.9 Å²	23.9	4%	0.042	13%	0.133	C	C	.	.	S	Bend	trans	-93.5	124.2	173.9	173	0	0	0	0	109.2	H325 H331 N332 E510	H325-V328 HydrophobicContact CB-CB 4.13Å; H325-V328 HydrophobicContact CB-CG2 3.61Å; H325-V328 PolarHBondContact O-N 2.8Å; V328-H331 HydrophobicContact CG1-CB 4.18Å; V328-N332 PolarHBondContact O-ND2 3.39Å; V328-E510 VanDerWaalsContact CG1-CD 3.49Å; V328-E510 HydrophobicContact CG1-CG 4.32Å; V328-E510 WeakPolarHBondContact CG1-OE2 3.47Å
329	A	98.4	Very high	98.3	Very high	8 Å²	8	21.7 Å²	21.7	7%	0.066	12%	0.123	C	C	.	.	S	Bend	trans	-73.3	-35.8	-164	0	0	0	0	0	114.6	N332 R506 E509 E510	A329-N332 PolarHBondContact O-ND2 2.57Å; A329-R506 WeakPolarHBondContact O-CG 3.4Å; A329-R506 PolarHBondContact O-NH1 3.15Å; A329-E509 HydrophobicContact CB-CB 3.95Å; A329-E509 HydrophobicContact CB-CG 4.08Å; A329-E510 HydrophobicContact CB-CB 4.23Å
330	Y	98.8	Very high	98.3	Very high	13 Å²	13	21.4 Å²	21.4	5%	0.051	12%	0.121	C	C	.	.	S	Bend	trans	-111.6	-60.6	-178.8	176.8	-85	0	0	0	112.3	N332 H335 N492 W503 R506 I507 E510	Y330-N332 PolarHBondContact O-N 3.29Å; Y330-N332 PolarHBondContact O-ND2 3.28Å; Y330-H335 AromaticContact CE1-CD2 3.61Å; Y330-H335 AromaticContact CE1-CE1 3.82Å; Y330-H335 AromaticContact CE1-CG 3.82Å; Y330-H335 AromaticContact CE1-ND1 3.94Å; Y330-H335 AromaticContact CE1-NE2 3.6Å; Y330-H335 AromaticContact CZ-CE1 3.57Å; Y330-H335 AromaticContact CZ-CG 3.97Å; Y330-H335 AromaticContact CZ-ND1 3.62Å; Y330-H335 AromaticContact CZ-NE2 3.85Å; Y330-H335 VanDerWaalsContact O-CB 3.27Å; Y330-H335 WeakPolarHBondContact O-CB 3.23Å; Y330-H335 PolarHBondContact OH-CE1 2.97Å; Y330-H335 PolarHBondContact OH-ND1 3.27Å; Y330-H335 PolarHBondContact OH-NE2 2.67Å; Y330-N492 WeakPolarHBondContact CE2-ND2 3.22Å; Y330-N492 PolarHBondContact OH-ND2 3.47Å; Y330-W503 AromaticContact CD2-CE3 3.66Å; Y330-W503 HydrophobicContact CD2-CE3 3.66Å; Y330-W503 HydrophobicContact CD2-CZ3 4.14Å; Y330-W503 HydrophobicContact CE2-CB 4.49Å; Y330-W503 HydrophobicContact CE2-CD2 4.29Å; Y330-W503 AromaticContact CE2-CE3 3.71Å; Y330-W503 HydrophobicContact CE2-CE3 3.71Å; Y330-W503 HydrophobicContact CE2-CZ3 4.32Å; Y330-R506 HydrophobicContact CD2-CB 4.28Å; Y330-I507 HydrophobicContact CD1-CD1 3.81Å; Y330-I507 HydrophobicContact CD2-CB 3.76Å; Y330-I507 HydrophobicContact CD2-CD1 4.29Å; Y330-I507 HydrophobicContact CE1-CD1 4.3Å; Y330-I507 HydrophobicContact CE2-CB 4.28Å; Y330-I507 HydrophobicContact CG-CB 4.05Å; Y330-I507 HydrophobicContact CG-CD1 3.81Å; Y330-I507 HydrophobicContact CG-CG1 4.48Å; Y330-E510 WeakPolarHBondContact CA-OE2 3.32Å; Y330-E510 WeakPolarHBondContact CB-OE2 3.16Å; Y330-E510 PolarHBondContact N-OE2 3.3Å
331	H	98.8	Very high	98.4	Very high	37 Å²	37	21.3 Å²	21.3	17%	0.171	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	67.1	-173.3	-55	95.2	0	0	0	111.6	V328 D372 H375 E510	V328-H331 HydrophobicContact CG1-CB 4.18Å; H331-D372 IonicContact CD2-OD2 3.52Å; H331-D372 PolarHBondContact CD2-OD2 2.97Å; H331-D372 IonicContact CG-OD2 2.71Å; H331-H375 HydrophobicContact CB-CB 4.04Å; H331-H375 VanDerWaalsContact CB-ND1 3.25Å; H331-H375 WeakPolarHBondContact CB-ND1 3.34Å; H331-H375 AromaticContact CE1-CE1 3.98Å; H331-H375 AromaticContact CG-CE1 3.6Å; H331-H375 AromaticContact CG-ND1 3.58Å; H331-H375 AromaticContact ND1-CE1 3.35Å; H331-H375 PolarHBondContact ND1-CE1 2.73Å; H331-H375 VanDerWaalsContact ND1-CE1 3.35Å; H331-H375 AromaticContact ND1-ND1 3.68Å; H331-E510 IonicContact CE1-OE1 2.61Å; H331-E510 IonicContact CG-OE1 2.69Å; H331-E510 PolarHBondContact N-OE2 2.84Å; H331-E510 VanDerWaalsContact ND1-CD 3.3Å; H331-E510 IonicContact ND1-OE1 3.78Å; H331-E510 PolarHBondContact ND1-OE1 3.19Å; H331-E510 IonicContact ND1-OE2 2.72Å; H331-E510 PolarHBondContact ND1-OE2 3.27Å
332	N	98.7	Very high	98.4	Very high	17 Å²	17	21 Å²	21	9%	0.091	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.6	-175.8	-179.6	65.4	59.2	0	0	0	110.8	Y324 V328 A329 Y330 L334 H335 A336	Y324-N332 VanDerWaalsContact CD1-C 3.45Å; V328-N332 PolarHBondContact O-ND2 3.39Å; A329-N332 PolarHBondContact O-ND2 2.57Å; Y330-N332 PolarHBondContact O-N 3.29Å; Y330-N332 PolarHBondContact O-ND2 3.28Å; N332-L334 PolarHBondContact O-N 2.77Å; N332-L334 VanDerWaalsContact O-N 3.09Å; N332-L334 WeakPolarHBondContact OD1-CB 3.44Å; N332-L334 PolarHBondContact OD1-N 2.63Å; N332-H335 PolarHBondContact O-N 2.94Å; N332-A336 PolarHBondContact O-N 2.77Å
333	S	98.8	Very high	98.5	Very high	9 Å²	9	18.8 Å²	18.8	6%	0.063	11%	0.107	C	C	.	.	H	α-helix	trans	-64	-20.1	-172.8	78.8	0	0	0	0	114.2	E321 A337	E321-S333 WeakPolarHBondContact OE1-CB 3.35Å; E321-S333 PolarHBondContact OE1-OG 3.11Å; S333-A337 VanDerWaalsContact O-CB 3.26Å; S333-A337 WeakPolarHBondContact O-CB 3.38Å; S333-A337 PolarHBondContact O-N 3.21Å
334	L	98.8	Very high	98.5	Very high	9 Å²	9	18.5 Å²	18.5	5%	0.047	11%	0.106	C	C	.	.	H	α-helix	trans	-66.5	-44	173.6	-171.5	71.4	0	0	0	111.4	I277 F278 A281 P288 N332 A337 D338 W503	I277-L334 HydrophobicContact CG1-CD1 3.99Å; I277-L334 HydrophobicContact CG2-CD1 4.26Å; I277-L334 HydrophobicContact CG2-CG 4.45Å; F278-L334 HydrophobicContact CD1-CD2 3.61Å; F278-L334 HydrophobicContact CE1-CD2 3.57Å; A281-L334 HydrophobicContact CB-CD1 3.55Å; P288-L334 HydrophobicContact CB-CD1 4.14Å; P288-L334 HydrophobicContact CG-CB 4.39Å; P288-L334 HydrophobicContact CG-CD1 3.91Å; N332-L334 PolarHBondContact O-N 2.77Å; N332-L334 VanDerWaalsContact O-N 3.09Å; N332-L334 WeakPolarHBondContact OD1-CB 3.44Å; N332-L334 PolarHBondContact OD1-N 2.63Å; L334-A337 PolarHBondContact O-N 2.8Å; L334-D338 PolarHBondContact O-N 2.78Å; L334-W503 HydrophobicContact CB-CH2 4.14Å; L334-W503 HydrophobicContact CD2-CH2 3.82Å; L334-W503 HydrophobicContact CD2-CZ3 4.28Å; L334-W503 HydrophobicContact CG-CH2 3.7Å; L334-W503 HydrophobicContact CG-CZ2 4.3Å
335	H	98.9	Very high	98.5	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-69	-47	178.7	176.2	52.9	0	0	0	110.1	Y330 N332 A337 D338 V339 H371 D372 D489 W503	Y330-H335 AromaticContact CE1-CD2 3.61Å; Y330-H335 AromaticContact CE1-CE1 3.82Å; Y330-H335 AromaticContact CE1-CG 3.82Å; Y330-H335 AromaticContact CE1-ND1 3.94Å; Y330-H335 AromaticContact CE1-NE2 3.6Å; Y330-H335 AromaticContact CZ-CE1 3.57Å; Y330-H335 AromaticContact CZ-CG 3.97Å; Y330-H335 AromaticContact CZ-ND1 3.62Å; Y330-H335 AromaticContact CZ-NE2 3.85Å; Y330-H335 VanDerWaalsContact O-CB 3.27Å; Y330-H335 WeakPolarHBondContact O-CB 3.23Å; Y330-H335 PolarHBondContact OH-CE1 2.97Å; Y330-H335 PolarHBondContact OH-ND1 3.27Å; Y330-H335 PolarHBondContact OH-NE2 2.67Å; N332-H335 PolarHBondContact O-N 2.94Å; H335-A337 PolarHBondContact O-N 3.05Å; H335-A337 VanDerWaalsContact O-N 3.14Å; H335-D338 PolarHBondContact O-N 3.47Å; H335-V339 WeakPolarHBondContact CE1-CG2 3.49Å; H335-V339 WeakPolarHBondContact O-CG2 3.5Å; H335-V339 PolarHBondContact O-N 2.75Å; H335-H371 AromaticContact NE2-NE2 3.61Å; H335-D372 IonicContact CD2-OD2 3.3Å; H335-D372 PolarHBondContact CD2-OD2 3.4Å; H335-D372 IonicContact NE2-OD2 3.79Å; H335-D489 IonicContact NE2-OD1 3.89Å; H335-W503 HydrophobicContact CB-CH2 3.84Å; H335-W503 HydrophobicContact CB-CZ3 4.02Å
336	A	98.9	Very high	98.6	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-55.6	-33.3	173.4	0	0	0	0	0	113.3	L289 Y324 N332 A340	L289-A336 HydrophobicContact CD1-CB 4.1Å; L289-A336 HydrophobicContact CD2-CB 4.17Å; Y324-A336 HydrophobicContact CE1-CB 3.79Å; Y324-A336 HydrophobicContact CE2-CB 3.98Å; Y324-A336 VanDerWaalsContact CZ-CB 3.43Å; Y324-A336 VanDerWaalsContact OH-CB 3.31Å; Y324-A336 WeakPolarHBondContact OH-CB 3.23Å; N332-A336 PolarHBondContact O-N 2.77Å; A336-A340 WeakPolarHBondContact O-CB 3.41Å; A336-A340 PolarHBondContact O-N 2.63Å
337	A	98.9	Very high	98.7	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-73.2	-38.6	175.3	0	0	0	0	0	112.9	I277 P288 L289 I292 S333 L334 H335 Q341	I277-A337 HydrophobicContact CD1-CB 3.74Å; I277-A337 HydrophobicContact CG1-CB 4.19Å; P288-A337 HydrophobicContact CB-CB 3.91Å; P288-A337 HydrophobicContact CG-CB 4.41Å; L289-A337 HydrophobicContact CB-CB 4.18Å; L289-A337 HydrophobicContact CD1-CB 4.27Å; I292-A337 HydrophobicContact CG1-CB 4.48Å; S333-A337 VanDerWaalsContact O-CB 3.26Å; S333-A337 WeakPolarHBondContact O-CB 3.38Å; S333-A337 PolarHBondContact O-N 3.21Å; L334-A337 PolarHBondContact O-N 2.8Å; H335-A337 PolarHBondContact O-N 3.05Å; H335-A337 VanDerWaalsContact O-N 3.14Å; A337-Q341 WeakPolarHBondContact O-CB 3.38Å; A337-Q341 PolarHBondContact O-N 3.37Å
338	D	98.9	Very high	98.7	Very high	3 Å²	3	9.9 Å²	9.9	2%	0.016	6%	0.058	C	C	.	.	H	α-helix	trans	-67.8	-42.3	174.4	-165.9	15.1	0	0	0	111.6	I277 L334 H335 A340 Q341 S342 K495 W503	I277-D338 HydrophobicContact CB-CB 4.43Å; I277-D338 HydrophobicContact CG1-CB 4.2Å; I277-D338 HydrophobicContact CG2-CB 4.19Å; L334-D338 PolarHBondContact O-N 2.78Å; H335-D338 PolarHBondContact O-N 3.47Å; D338-A340 PolarHBondContact O-N 2.88Å; D338-Q341 PolarHBondContact O-N 3.24Å; D338-S342 WeakPolarHBondContact O-CB 3.38Å; D338-S342 PolarHBondContact O-N 3.36Å; D338-S342 PolarHBondContact O-OG 2.79Å; D338-S342 PolarHBondContact OD1-OG 3.4Å; D338-K495 IonicContact OD1-NZ 2.64Å; D338-K495 PolarHBondContact OD1-NZ 3.23Å; D338-K495 IonicContact OD2-NZ 2.61Å; D338-K495 PolarHBondContact OD2-NZ 3.26Å; D338-W503 HydrophobicContact CB-CZ2 3.86Å; D338-W503 PolarHBondContact OD2-NE1 3.15Å
339	V	98.9	Very high	98.6	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-65.4	-39.2	175.2	-178.6	0	0	0	0	111.1	H335 T343 A368 A488 D489	H335-V339 WeakPolarHBondContact CE1-CG2 3.49Å; H335-V339 WeakPolarHBondContact O-CG2 3.5Å; H335-V339 PolarHBondContact O-N 2.75Å; V339-T343 VanDerWaalsContact O-CB 3.25Å; V339-T343 WeakPolarHBondContact O-CB 3.31Å; V339-T343 PolarHBondContact O-N 3.2Å; V339-T343 PolarHBondContact O-OG1 3.25Å; V339-A368 HydrophobicContact CG1-CB 4.02Å; V339-A488 HydrophobicContact CG1-CB 3.96Å; V339-D489 HydrophobicContact CG1-CB 4.46Å
340	A	98.9	Very high	98.5	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-66.2	-40.7	174.2	0	0	0	0	0	112.8	M293 A336 D338 H344 A368	M293-A340 HydrophobicContact SD-CB 4Å; A336-A340 WeakPolarHBondContact O-CB 3.41Å; A336-A340 PolarHBondContact O-N 2.63Å; D338-A340 PolarHBondContact O-N 2.88Å; A340-H344 WeakPolarHBondContact O-CB 3.36Å; A340-H344 PolarHBondContact O-N 2.91Å; A340-A368 HydrophobicContact CB-CB 4.28Å
341	Q	98.9	Very high	98.2	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-69.3	-43	175.7	-167.5	-86.7	-19.9	0	0	111.8	L270 K272 L275 I292 A337 D338 H344 V345	L270-Q341 PolarHBondContact O-NE2 3.46Å; K272-Q341 PolarHBondContact O-NE2 3.2Å; L275-Q341 HydrophobicContact CD1-CG 4.38Å; L275-Q341 HydrophobicContact CD2-CG 4.38Å; I292-Q341 HydrophobicContact CG2-CB 4Å; A337-Q341 WeakPolarHBondContact O-CB 3.38Å; A337-Q341 PolarHBondContact O-N 3.37Å; D338-Q341 PolarHBondContact O-N 3.24Å; Q341-H344 CarbonylContact O-C 3.56Å; Q341-H344 WeakPolarHBondContact O-CA 3.28Å; Q341-H344 WeakPolarHBondContact O-CB 3.2Å; Q341-H344 PolarHBondContact O-N 2.97Å; Q341-H344 VanDerWaalsContact O-N 3.11Å; Q341-V345 WeakPolarHBondContact O-CG2 3.36Å; Q341-V345 PolarHBondContact O-N 3.2Å
342	S	98.9	Very high	98	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.2	-45.8	175.9	-60.8	0	0	0	0	111	D338 H344 V345 L346 K495	D338-S342 WeakPolarHBondContact O-CB 3.38Å; D338-S342 PolarHBondContact O-N 3.36Å; D338-S342 PolarHBondContact O-OG 2.79Å; D338-S342 PolarHBondContact OD1-OG 3.4Å; S342-H344 VanDerWaalsContact C-N 3.31Å; S342-H344 PolarHBondContact O-N 3.41Å; S342-V345 PolarHBondContact O-N 3.15Å; S342-V345 VanDerWaalsContact O-N 3.14Å; S342-L346 WeakPolarHBondContact O-CG 3.41Å; S342-L346 PolarHBondContact O-N 3.42Å; S342-K495 WeakPolarHBondContact OG-CE 3.46Å; S342-K495 PolarHBondContact OG-NZ 3.17Å
343	T	98.9	Very high	97.7	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.4	-41.5	172.3	-58.4	0	0	0	0	111.2	V339 V345 L346 L347 A364 A368 M484 V485 A488	V339-T343 VanDerWaalsContact O-CB 3.25Å; V339-T343 WeakPolarHBondContact O-CB 3.31Å; V339-T343 PolarHBondContact O-N 3.2Å; V339-T343 PolarHBondContact O-OG1 3.25Å; T343-V345 VanDerWaalsContact C-N 3.34Å; T343-V345 PolarHBondContact O-N 2.84Å; T343-L346 PolarHBondContact O-N 3.15Å; T343-L347 HydrophobicContact CG2-CD1 4.07Å; T343-L347 HydrophobicContact CG2-CG 4.44Å; T343-L347 WeakPolarHBondContact O-CB 3.25Å; T343-L347 VanDerWaalsContact O-CG 3.29Å; T343-L347 WeakPolarHBondContact O-CG 3.13Å; T343-L347 PolarHBondContact O-N 3.36Å; T343-A364 HydrophobicContact CG2-CB 4.17Å; T343-A368 HydrophobicContact CG2-CB 4.44Å; T343-M484 HydrophobicContact CG2-SD 4.49Å; T343-V485 HydrophobicContact CG2-CG2 4.21Å; T343-A488 VanDerWaalsContact OG1-CB 3.24Å; T343-A488 WeakPolarHBondContact OG1-CB 3.32Å
344	H	98.8	Very high	97.3	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-62.7	-35.4	175.1	164.3	89.1	0	0	0	113.1	L270 N271 I296 R300 A340 Q341 S342	L270-H344 PolarHBondContact O-CD2 3.46Å; N271-H344 PolarHBondContact OD1-NE2 3.18Å; I296-H344 HydrophobicContact CD1-CB 3.76Å; I296-H344 HydrophobicContact CG1-CB 4.01Å; I296-H344 HydrophobicContact CG2-CB 4.29Å; R300-H344 PolarHBondContact NE-CE1 2.67Å; R300-H344 PolarHBondContact NE-ND1 2.8Å; R300-H344 PolarHBondContact NH2-O 2.65Å; A340-H344 WeakPolarHBondContact O-CB 3.36Å; A340-H344 PolarHBondContact O-N 2.91Å; Q341-H344 CarbonylContact O-C 3.56Å; Q341-H344 WeakPolarHBondContact O-CA 3.28Å; Q341-H344 WeakPolarHBondContact O-CB 3.2Å; Q341-H344 PolarHBondContact O-N 2.97Å; Q341-H344 VanDerWaalsContact O-N 3.11Å; S342-H344 VanDerWaalsContact C-N 3.31Å; S342-H344 PolarHBondContact O-N 3.41Å
345	V	98.8	Very high	97.2	Very high	22 Å²	22	21 Å²	21	13%	0.133	14%	0.137	C	C	.	.	H	α-helix	trans	-71.6	-43.8	174.7	177.6	0	0	0	0	111.2	W273 Q341 S342 T343 L347 S348 T349	W273-V345 HydrophobicContact CE3-CB 4.07Å; W273-V345 HydrophobicContact CE3-CG1 3.95Å; W273-V345 HydrophobicContact CZ3-CB 4.41Å; Q341-V345 WeakPolarHBondContact O-CG2 3.36Å; Q341-V345 PolarHBondContact O-N 3.2Å; S342-V345 PolarHBondContact O-N 3.15Å; S342-V345 VanDerWaalsContact O-N 3.14Å; T343-V345 VanDerWaalsContact C-N 3.34Å; T343-V345 PolarHBondContact O-N 2.84Å; V345-L347 VanDerWaalsContact C-N 3.28Å; V345-L347 PolarHBondContact O-N 3.17Å; V345-S348 WeakPolarHBondContact O-CA 3.03Å; V345-S348 WeakPolarHBondContact O-CB 3.42Å; V345-S348 PolarHBondContact O-N 3.3Å; V345-T349 PolarHBondContact O-N 2.96Å
346	L	98.6	Very high	97.1	Very high	2 Å²	2	21.9 Å²	21.9	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-65.2	-29.1	177.5	-63.4	176.6	0	0	0	113	W273 S342 T343 S348 T349 M484 C487 A488 W552 W555	W273-L346 HydrophobicContact CZ3-CD2 4.28Å; W273-L346 HydrophobicContact CZ3-CG 4.13Å; S342-L346 WeakPolarHBondContact O-CG 3.41Å; S342-L346 PolarHBondContact O-N 3.42Å; T343-L346 PolarHBondContact O-N 3.15Å; L346-S348 PolarHBondContact O-N 3.26Å; L346-T349 WeakPolarHBondContact O-CB 3.44Å; L346-T349 PolarHBondContact O-N 3.32Å; L346-T349 PolarHBondContact O-OG1 3.46Å; L346-M484 HydrophobicContact CB-CE 4.16Å; L346-M484 HydrophobicContact CB-CG 3.6Å; L346-M484 HydrophobicContact CB-SD 3.91Å; L346-M484 HydrophobicContact CD1-CG 3.89Å; L346-M484 HydrophobicContact CG-CG 4.42Å; L346-M484 WeakPolarHBondContact O-CE 3.3Å; L346-C487 HydrophobicContact CD1-CB 4.26Å; L346-A488 HydrophobicContact CD1-CB 4.37Å; L346-W552 HydrophobicContact CD1-CH2 4.16Å; L346-W552 HydrophobicContact CD2-CH2 4.14Å; L346-W552 HydrophobicContact CD2-CZ3 4.19Å; L346-W555 HydrophobicContact CB-CZ2 4.33Å; L346-W555 HydrophobicContact CD1-CZ2 4.49Å; L346-W555 HydrophobicContact CD2-CZ2 4.23Å
347	L	98.4	Very high	97	Very high	15 Å²	15	25.4 Å²	25.4	8%	0.079	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-1.3	169	-73.5	170.3	0	0	0	114	R300 T343 V345 F356 I361 A364 I365 L481 M484	R300-L347 VanDerWaalsContact NH2-C 3.32Å; R300-L347 PolarHBondContact NH2-O 3.35Å; T343-L347 HydrophobicContact CG2-CD1 4.07Å; T343-L347 HydrophobicContact CG2-CG 4.44Å; T343-L347 WeakPolarHBondContact O-CB 3.25Å; T343-L347 VanDerWaalsContact O-CG 3.29Å; T343-L347 WeakPolarHBondContact O-CG 3.13Å; T343-L347 PolarHBondContact O-N 3.36Å; V345-L347 VanDerWaalsContact C-N 3.28Å; V345-L347 PolarHBondContact O-N 3.17Å; L347-F356 HydrophobicContact CD2-CD2 4.13Å; L347-I361 HydrophobicContact CD1-CG2 4.35Å; L347-I361 HydrophobicContact CD2-CG1 4.36Å; L347-A364 HydrophobicContact CD1-CB 4.14Å; L347-I365 HydrophobicContact CD1-CD1 3.9Å; L347-I365 HydrophobicContact CD1-CG1 3.61Å; L347-L481 HydrophobicContact CD2-CD2 4.09Å; L347-M484 HydrophobicContact CB-SD 4.46Å; L347-M484 HydrophobicContact CD2-CE 4.01Å; L347-M484 HydrophobicContact CD2-SD 3.52Å; L347-M484 VanDerWaalsContact CD2-SD 3.52Å; L347-M484 HydrophobicContact CG-CE 4.4Å; L347-M484 HydrophobicContact CG-SD 3.55Å; L347-M484 VanDerWaalsContact CG-SD 3.55Å
348	S	97.2	Very high	97	Very high	64 Å²	64	29.6 Å²	29.6	45%	0.448	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.1	3.5	173.8	-66.6	0	0	0	0	113.4	R300 V345 L346	R300-S348 PolarHBondContact NH2-OG 3.38Å; V345-S348 WeakPolarHBondContact O-CA 3.03Å; V345-S348 WeakPolarHBondContact O-CB 3.42Å; V345-S348 PolarHBondContact O-N 3.3Å; L346-S348 PolarHBondContact O-N 3.26Å
349	T	96.4	Very high	97	Very high	14 Å²	14	30.6 Å²	30.6	9%	0.086	19%	0.19	C	C	.	.			trans	-56.6	123.8	175.5	-68.5	0	0	0	0	111	V345 L346 T351 L352 D353 V559 D562	V345-T349 PolarHBondContact O-N 2.96Å; L346-T349 WeakPolarHBondContact O-CB 3.44Å; L346-T349 PolarHBondContact O-N 3.32Å; L346-T349 PolarHBondContact O-OG1 3.46Å; T349-T351 VanDerWaalsContact C-N 3.31Å; T349-T351 PolarHBondContact O-N 2.94Å; T349-L352 HydrophobicContact CG2-CD1 4.44Å; T349-L352 HydrophobicContact CG2-CG 4.3Å; T349-L352 WeakPolarHBondContact O-CA 3.37Å; T349-L352 WeakPolarHBondContact O-CB 3.13Å; T349-L352 PolarHBondContact O-N 2.93Å; T349-D353 PolarHBondContact O-N 3.46Å; T349-V559 HydrophobicContact CG2-CB 3.69Å; T349-V559 HydrophobicContact CG2-CG1 3.99Å; T349-V559 HydrophobicContact CG2-CG2 3.97Å; T349-D562 HydrophobicContact CG2-CB 3.67Å; T349-D562 WeakPolarHBondContact CG2-OD2 3.43Å
350	P	95.4	Very high	97	Very high	82 Å²	82	31.2 Å²	31.2	53%	0.532	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-51.7	-39.7	-176	-31.1	34.8	0	0	0	115.7	L352 D353 D562	P350-L352 PolarHBondContact O-N 3.15Å; P350-L352 VanDerWaalsContact O-N 3.1Å; P350-D353 WeakPolarHBondContact O-CB 3.5Å; P350-D353 PolarHBondContact O-N 3.5Å; P350-D562 WeakPolarHBondContact CD-OD2 3.5Å
351	T	93	Very high	97	Very high	10 Å²	10	32.4 Å²	32.4	6%	0.061	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-60.7	-18	175.6	-58.5	0	0	0	0	113.1	T349 V468 L469 V559 D562	T349-T351 VanDerWaalsContact C-N 3.31Å; T349-T351 PolarHBondContact O-N 2.94Å; T351-V468 WeakPolarHBondContact O-CA 3.38Å; T351-L469 HydrophobicContact CG2-CB 4.13Å; T351-L469 WeakPolarHBondContact O-CB 3.47Å; T351-L469 PolarHBondContact O-N 3.39Å; T351-V559 HydrophobicContact CG2-CB 4.37Å; T351-V559 PolarHBondContact OG1-O 2.87Å; T351-D562 VanDerWaalsContact CB-OD2 3.29Å; T351-D562 WeakPolarHBondContact CB-OD2 3.41Å; T351-D562 PolarHBondContact N-OD2 3.15Å; T351-D562 PolarHBondContact OG1-OD2 3.49Å
352	L	94.8	Very high	97	Very high	7 Å²	7	32.4 Å²	32.4	4%	0.037	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-107.6	7.5	179.2	-56.5	179.4	0	0	0	113.2	T349 P350 A354 V355 F356 L469 M484 W555 V559	T349-L352 HydrophobicContact CG2-CD1 4.44Å; T349-L352 HydrophobicContact CG2-CG 4.3Å; T349-L352 WeakPolarHBondContact O-CA 3.37Å; T349-L352 WeakPolarHBondContact O-CB 3.13Å; T349-L352 PolarHBondContact O-N 2.93Å; P350-L352 PolarHBondContact O-N 3.15Å; P350-L352 VanDerWaalsContact O-N 3.1Å; L352-A354 PolarHBondContact O-N 2.89Å; L352-V355 WeakPolarHBondContact O-CB 3.45Å; L352-V355 WeakPolarHBondContact O-CG2 3.25Å; L352-V355 PolarHBondContact O-N 3.2Å; L352-V355 VanDerWaalsContact O-N 3.15Å; L352-F356 HydrophobicContact CB-CE2 4.27Å; L352-F356 HydrophobicContact CD1-CE2 4.22Å; L352-F356 HydrophobicContact CD2-CE2 4.42Å; L352-L469 HydrophobicContact CD2-CB 4.17Å; L352-L469 HydrophobicContact CD2-CD2 3.73Å; L352-M484 HydrophobicContact CD1-CE 3.46Å; L352-M484 VanDerWaalsContact CD1-CE 3.46Å; L352-W555 HydrophobicContact CD1-CH2 4.16Å; L352-W555 HydrophobicContact CD1-CZ2 4.18Å; L352-V559 HydrophobicContact CD1-CG1 4.15Å; L352-V559 HydrophobicContact CD2-CG1 4.39Å; L352-V559 HydrophobicContact CG-CG1 4.17Å
353	D	91.8	Very high	97	Very high	113 Å²	113	32.4 Å²	32.4	60%	0.604	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	136.1	179.7	-178.7	38.3	0	0	0	112.5	T349 P350 V355 V468	T349-D353 PolarHBondContact O-N 3.46Å; P350-D353 WeakPolarHBondContact O-CB 3.5Å; P350-D353 PolarHBondContact O-N 3.5Å; D353-V355 PolarHBondContact O-N 2.86Å; D353-V468 WeakPolarHBondContact O-CG1 3.35Å
354	A	91.9	Very high	97	Very high	94 Å²	94	32.4 Å²	32.4	78%	0.777	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	8.7	-173.3	0	0	0	0	0	116.4	L352	L352-A354 PolarHBondContact O-N 2.89Å
355	V	95.1	Very high	97	Very high	15 Å²	15	32.3 Å²	32.3	9%	0.091	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-46.5	-179.9	176.9	0	0	0	0	110.7	L352 D353 V468 L469 L471 R477	L352-V355 WeakPolarHBondContact O-CB 3.45Å; L352-V355 WeakPolarHBondContact O-CG2 3.25Å; L352-V355 PolarHBondContact O-N 3.2Å; L352-V355 VanDerWaalsContact O-N 3.15Å; D353-V355 PolarHBondContact O-N 2.86Å; V355-V468 HydrophobicContact CG2-CG1 3.56Å; V355-L469 VanDerWaalsContact CG2-O 3.27Å; V355-L469 WeakPolarHBondContact CG2-O 3.49Å; V355-L471 HydrophobicContact CG1-CB 4.29Å; V355-L471 HydrophobicContact CG1-CD1 3.7Å; V355-L471 HydrophobicContact CG1-CG 4.02Å; V355-R477 PolarHBondContact O-NH1 2.87Å; V355-R477 PolarHBondContact O-NH2 3.17Å
356	F	97.5	Very high	97	Very high	18 Å²	18	31.3 Å²	31.3	8%	0.079	19%	0.192	C	C	.	.	S	Bend	trans	-93.4	143.5	-176.5	-59.5	-66.5	0	0	0	112.8	L347 L352 E360 I361 L471 V480 L481 M484	L347-F356 HydrophobicContact CD2-CD2 4.13Å; L352-F356 HydrophobicContact CB-CE2 4.27Å; L352-F356 HydrophobicContact CD1-CE2 4.22Å; L352-F356 HydrophobicContact CD2-CE2 4.42Å; F356-E360 HydrophobicContact CB-CB 4.19Å; F356-E360 HydrophobicContact CD1-CB 4.37Å; F356-I361 HydrophobicContact CB-CD1 4.42Å; F356-I361 HydrophobicContact CB-CG1 3.97Å; F356-L471 HydrophobicContact CE1-CD1 4.09Å; F356-L471 HydrophobicContact CZ-CD1 4.02Å; F356-V480 HydrophobicContact CZ-CB 4.13Å; F356-V480 HydrophobicContact CZ-CG1 3.81Å; F356-L481 HydrophobicContact CD1-CD1 3.97Å; F356-L481 HydrophobicContact CD1-CD2 3.83Å; F356-L481 HydrophobicContact CD1-CG 4.01Å; F356-L481 HydrophobicContact CD2-CD2 4.28Å; F356-L481 HydrophobicContact CE1-CD1 3.94Å; F356-L481 HydrophobicContact CE1-CD2 3.65Å; F356-L481 HydrophobicContact CE1-CG 3.58Å; F356-L481 HydrophobicContact CE2-CD2 4.11Å; F356-L481 HydrophobicContact CG-CD2 4.15Å; F356-L481 HydrophobicContact CZ-CD2 3.8Å; F356-L481 HydrophobicContact CZ-CG 4.03Å; F356-M484 HydrophobicContact CE2-CE 4.16Å
357	T	97.9	Very high	97	Very high	74 Å²	74	31.2 Å²	31.2	45%	0.454	19%	0.192	S	C	.	.			trans	-79.8	158.8	171.7	65.8	0	0	0	0	111.1	L359 E360 I361	T357-L359 PolarHBondContact O-N 3.45Å; T357-E360 VanDerWaalsContact CB-OE2 3.28Å; T357-E360 WeakPolarHBondContact CB-OE2 3.26Å; T357-E360 WeakPolarHBondContact CG2-OE2 3.42Å; T357-E360 PolarHBondContact N-OE2 2.92Å; T357-E360 WeakPolarHBondContact O-CB 3.45Å; T357-E360 PolarHBondContact O-N 3.21Å; T357-E360 PolarHBondContact OG1-OE2 3.42Å; T357-I361 WeakPolarHBondContact O-CG1 3.3Å; T357-I361 PolarHBondContact O-N 3Å
358	D	98.4	Very high	97	Very high	88 Å²	88	30.5 Å²	30.5	47%	0.471	19%	0.188	S	C	.	.	H	α-helix	trans	-48.7	-31.9	174.3	-49.3	-36.7	0	0	0	113.3	T305 F306 L362	T305-D358 HydrophobicContact CG2-CB 4.06Å; F306-D358 HydrophobicContact CE2-CB 3.75Å; F306-D358 WeakPolarHBondContact CE2-O 3.16Å; F306-D358 VanDerWaalsContact CZ-C 3.48Å; F306-D358 HydrophobicContact CZ-CB 3.51Å; F306-D358 WeakPolarHBondContact CZ-O 3.13Å; D358-L362 WeakPolarHBondContact O-CB 3.32Å; D358-L362 PolarHBondContact O-N 3.3Å
359	L	98.6	Very high	97.1	Very high	24 Å²	24	27.5 Å²	27.5	13%	0.126	17%	0.167	C	C	.	.	H	α-helix	trans	-78	-31.7	-178.2	-168.6	73.8	0	0	0	112.4	F306 T357 A363 L423 Q427 T430 L431 M434	F306-L359 HydrophobicContact CE1-CD1 4.05Å; F306-L359 HydrophobicContact CZ-CB 4.33Å; F306-L359 HydrophobicContact CZ-CD1 4.3Å; T357-L359 PolarHBondContact O-N 3.45Å; L359-A363 VanDerWaalsContact O-CB 3.25Å; L359-A363 WeakPolarHBondContact O-CB 3.48Å; L359-A363 PolarHBondContact O-N 3.5Å; L359-L423 HydrophobicContact CD1-CD1 4.37Å; L359-Q427 HydrophobicContact CD1-CB 4.1Å; L359-Q427 HydrophobicContact CD1-CG 4.33Å; L359-Q427 HydrophobicContact CD2-CB 4.21Å; L359-Q427 HydrophobicContact CD2-CG 4.11Å; L359-T430 HydrophobicContact CD2-CG2 4.18Å; L359-L431 HydrophobicContact CD1-CB 4.21Å; L359-L431 HydrophobicContact CD1-CD1 4.11Å; L359-L431 HydrophobicContact CG-CB 4.48Å; L359-M434 HydrophobicContact CD2-CE 4.4Å; L359-M434 HydrophobicContact CG-CE 4.18Å; L359-M434 WeakPolarHBondContact O-CE 3.49Å
360	E	98.7	Very high	97.2	Very high	13 Å²	13	26.8 Å²	26.8	6%	0.061	16%	0.163	C	C	.	.	H	α-helix	trans	-74.4	-43.5	172.9	-75.2	152.8	136.1	0	0	110.3	F356 T357 A363 A364 M434 R477 L481	F356-E360 HydrophobicContact CB-CB 4.19Å; F356-E360 HydrophobicContact CD1-CB 4.37Å; T357-E360 VanDerWaalsContact CB-OE2 3.28Å; T357-E360 WeakPolarHBondContact CB-OE2 3.26Å; T357-E360 WeakPolarHBondContact CG2-OE2 3.42Å; T357-E360 PolarHBondContact N-OE2 2.92Å; T357-E360 WeakPolarHBondContact O-CB 3.45Å; T357-E360 PolarHBondContact O-N 3.21Å; T357-E360 PolarHBondContact OG1-OE2 3.42Å; E360-A363 PolarHBondContact O-N 3.01Å; E360-A363 VanDerWaalsContact O-N 3.16Å; E360-A364 PolarHBondContact O-N 3.06Å; E360-M434 HydrophobicContact CG-CE 3.91Å; E360-M434 HydrophobicContact CG-SD 3.54Å; E360-M434 VanDerWaalsContact CG-SD 3.54Å; E360-R477 VanDerWaalsContact CD-NH2 3.29Å; E360-R477 IonicContact OE1-CZ 3.78Å; E360-R477 IonicContact OE1-NE 2.64Å; E360-R477 PolarHBondContact OE1-NE 3.39Å; E360-R477 IonicContact OE1-NH2 3.85Å; E360-R477 PolarHBondContact OE1-NH2 2.92Å; E360-R477 VanDerWaalsContact OE1-NH2 3.11Å; E360-R477 IonicContact OE2-CZ 3.2Å; E360-R477 IonicContact OE2-NE 2.63Å; E360-R477 IonicContact OE2-NH2 3.54Å; E360-R477 PolarHBondContact OE2-NH2 3.37Å; E360-L481 HydrophobicContact CB-CD1 3.92Å; E360-L481 HydrophobicContact CG-CD1 4.14Å
361	I	98.8	Very high	97.4	Very high	24 Å²	24	22.9 Å²	22.9	12%	0.123	14%	0.137	C	C	.	.	H	α-helix	trans	-56.6	-50.8	171.9	-69.2	168.8	0	0	0	110.5	L302 L347 F356 T357 A363 A364 I365	L302-I361 HydrophobicContact CD2-CG2 4.29Å; L347-I361 HydrophobicContact CD1-CG2 4.35Å; L347-I361 HydrophobicContact CD2-CG1 4.36Å; F356-I361 HydrophobicContact CB-CD1 4.42Å; F356-I361 HydrophobicContact CB-CG1 3.97Å; T357-I361 WeakPolarHBondContact O-CG1 3.3Å; T357-I361 PolarHBondContact O-N 3Å; I361-A363 VanDerWaalsContact C-N 3.31Å; I361-A363 PolarHBondContact O-N 2.97Å; I361-A364 PolarHBondContact O-N 2.89Å; I361-I365 HydrophobicContact CG2-CD1 3.72Å; I361-I365 WeakPolarHBondContact O-CD1 3.44Å; I361-I365 WeakPolarHBondContact O-CG1 3.43Å; I361-I365 PolarHBondContact O-N 2.87Å; I361-I365 VanDerWaalsContact O-N 3.12Å
362	L	98.9	Very high	97.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.4	-41.7	175.1	176.4	65.1	0	0	0	112.1	F297 L302 F306 D358 F366 F420 L423 L431	F297-L362 HydrophobicContact CE1-CD1 3.42Å; F297-L362 VanDerWaalsContact CE1-CD1 3.42Å; F297-L362 HydrophobicContact CZ-CD1 3.4Å; F297-L362 VanDerWaalsContact CZ-CD1 3.4Å; L302-L362 HydrophobicContact CD1-CD1 4.47Å; F306-L362 HydrophobicContact CD1-CD2 4.29Å; F306-L362 HydrophobicContact CD2-CB 4.4Å; F306-L362 HydrophobicContact CD2-CD2 3.62Å; F306-L362 HydrophobicContact CD2-CG 4.4Å; F306-L362 HydrophobicContact CE1-CD2 4.39Å; F306-L362 HydrophobicContact CE2-CB 3.87Å; F306-L362 HydrophobicContact CE2-CD2 3.73Å; F306-L362 HydrophobicContact CE2-CG 4.32Å; F306-L362 HydrophobicContact CG-CD2 3.88Å; F306-L362 HydrophobicContact CZ-CB 4.41Å; F306-L362 HydrophobicContact CZ-CD2 4.11Å; D358-L362 WeakPolarHBondContact O-CB 3.32Å; D358-L362 PolarHBondContact O-N 3.3Å; L362-F366 WeakPolarHBondContact O-CB 3.5Å; L362-F366 PolarHBondContact O-N 3.32Å; L362-F420 HydrophobicContact CD1-CE1 4.26Å; L362-F420 HydrophobicContact CD2-CD1 4.39Å; L362-F420 HydrophobicContact CD2-CE1 3.94Å; L362-F420 HydrophobicContact CG-CE1 4.22Å; L362-L423 HydrophobicContact CD2-CD1 4.49Å; L362-L431 HydrophobicContact CD2-CD1 3.53Å; L362-L431 HydrophobicContact CG-CD1 3.8Å
363	A	98.9	Very high	97.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-68.6	-39.9	-179.5	0	0	0	0	0	112.6	L359 E360 I361 A367 L431 M434 V435 M438	L359-A363 VanDerWaalsContact O-CB 3.25Å; L359-A363 WeakPolarHBondContact O-CB 3.48Å; L359-A363 PolarHBondContact O-N 3.5Å; E360-A363 PolarHBondContact O-N 3.01Å; E360-A363 VanDerWaalsContact O-N 3.16Å; I361-A363 VanDerWaalsContact C-N 3.31Å; I361-A363 PolarHBondContact O-N 2.97Å; A363-A367 VanDerWaalsContact O-CB 3.23Å; A363-A367 WeakPolarHBondContact O-CB 3.25Å; A363-A367 PolarHBondContact O-N 2.85Å; A363-L431 HydrophobicContact CB-CG 4.15Å; A363-M434 HydrophobicContact CB-CB 4.01Å; A363-M434 HydrophobicContact CB-CE 3.75Å; A363-V435 HydrophobicContact CB-CG2 3.95Å; A363-M438 HydrophobicContact CB-CE 3.83Å
364	A	98.9	Very high	98.2	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-69.3	-47.1	-179.4	0	0	0	0	0	111.8	T343 L347 E360 I361 F366 A367 A368 M438 L481	T343-A364 HydrophobicContact CG2-CB 4.17Å; L347-A364 HydrophobicContact CD1-CB 4.14Å; E360-A364 PolarHBondContact O-N 3.06Å; I361-A364 PolarHBondContact O-N 2.89Å; A364-F366 VanDerWaalsContact C-N 3.32Å; A364-F366 PolarHBondContact O-N 2.93Å; A364-A367 PolarHBondContact O-N 3.46Å; A364-A368 PolarHBondContact O-N 2.77Å; A364-M438 HydrophobicContact CB-CE 4.29Å; A364-M438 HydrophobicContact CB-SD 3.91Å; A364-L481 HydrophobicContact CB-CD2 4.19Å
365	I	98.9	Very high	98.5	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-63.7	-39.5	176.7	-61.9	161.5	0	0	0	110.6	M293 I296 F297 L302 L347 I361 A369	M293-I365 HydrophobicContact CE-CG2 4.01Å; M293-I365 HydrophobicContact SD-CG2 3.58Å; M293-I365 VanDerWaalsContact SD-CG2 3.58Å; I296-I365 HydrophobicContact CG2-CD1 3.75Å; I296-I365 HydrophobicContact CG2-CG1 4.39Å; I296-I365 HydrophobicContact CG2-CG2 3.85Å; F297-I365 HydrophobicContact CD2-CG2 4.44Å; F297-I365 HydrophobicContact CE2-CG2 3.8Å; L302-I365 HydrophobicContact CD1-CD1 4.05Å; L347-I365 HydrophobicContact CD1-CD1 3.9Å; L347-I365 HydrophobicContact CD1-CG1 3.61Å; I361-I365 HydrophobicContact CG2-CD1 3.72Å; I361-I365 WeakPolarHBondContact O-CD1 3.44Å; I361-I365 WeakPolarHBondContact O-CG1 3.43Å; I361-I365 PolarHBondContact O-N 2.87Å; I361-I365 VanDerWaalsContact O-N 3.12Å; I365-A369 WeakPolarHBondContact O-CB 3.43Å; I365-A369 PolarHBondContact O-N 2.79Å; I365-A369 VanDerWaalsContact O-N 3.1Å
366	F	98.9	Very high	98.7	Very high	1 Å²	1	15 Å²	15	0%	0.004	8%	0.083	C	C	.	.	H	α-helix	trans	-67.9	-39.4	174.3	-179.2	-96.4	0	0	0	112.7	Y316 L362 A364 A369 I370 F409 L412 I419 F420 V435	Y316-F366 HydrophobicContact CE1-CD2 4.48Å; Y316-F366 AromaticContact CE1-CE2 3.65Å; Y316-F366 HydrophobicContact CE1-CE2 3.65Å; Y316-F366 HydrophobicContact CE1-CZ 4.48Å; Y316-F366 AromaticContact CZ-CE2 3.73Å; Y316-F366 WeakPolarHBondContact OH-CE2 3.26Å; Y316-F366 WeakPolarHBondContact OH-CZ 3.29Å; L362-F366 WeakPolarHBondContact O-CB 3.5Å; L362-F366 PolarHBondContact O-N 3.32Å; A364-F366 VanDerWaalsContact C-N 3.32Å; A364-F366 PolarHBondContact O-N 2.93Å; F366-A369 PolarHBondContact O-N 2.63Å; F366-I370 HydrophobicContact CD1-CD1 4.33Å; F366-I370 HydrophobicContact CD2-CG2 4.49Å; F366-I370 HydrophobicContact CE1-CD1 3.74Å; F366-I370 HydrophobicContact CE1-CG1 4.36Å; F366-I370 HydrophobicContact CE1-CG2 4.19Å; F366-I370 HydrophobicContact CE2-CG2 4.11Å; F366-I370 HydrophobicContact CZ-CD1 4.32Å; F366-I370 HydrophobicContact CZ-CG2 3.94Å; F366-I370 WeakPolarHBondContact O-CG1 3.4Å; F366-I370 PolarHBondContact O-N 3.38Å; F366-F409 HydrophobicContact CE1-CE1 4.33Å; F366-F409 HydrophobicContact CE1-CE2 4.36Å; F366-F409 HydrophobicContact CE1-CZ 4.08Å; F366-L412 HydrophobicContact CZ-CD1 4.49Å; F366-I419 HydrophobicContact CD2-CD1 3.97Å; F366-I419 HydrophobicContact CE2-CD1 3.87Å; F366-F420 HydrophobicContact CB-CZ 4.41Å; F366-F420 HydrophobicContact CD1-CE2 4.24Å; F366-F420 HydrophobicContact CD1-CZ 4.06Å; F366-F420 HydrophobicContact CD2-CE2 4.12Å; F366-F420 AromaticContact CD2-CZ 3.57Å; F366-F420 HydrophobicContact CD2-CZ 3.57Å; F366-F420 AromaticContact CE1-CE2 3.93Å; F366-F420 HydrophobicContact CE1-CE2 3.93Å; F366-F420 HydrophobicContact CE1-CZ 4.19Å; F366-F420 AromaticContact CE2-CE2 3.8Å; F366-F420 HydrophobicContact CE2-CE2 3.8Å; F366-F420 AromaticContact CE2-CZ 3.72Å; F366-F420 HydrophobicContact CE2-CZ 3.72Å; F366-F420 HydrophobicContact CG-CE2 4.32Å; F366-F420 AromaticContact CG-CZ 3.75Å; F366-F420 HydrophobicContact CG-CZ 3.75Å; F366-F420 AromaticContact CZ-CE2 3.7Å; F366-F420 HydrophobicContact CZ-CE2 3.7Å; F366-F420 HydrophobicContact CZ-CZ 4.03Å; F366-V435 HydrophobicContact CD1-CB 4.47Å; F366-V435 HydrophobicContact CD1-CG1 3.87Å; F366-V435 HydrophobicContact CD1-CG2 3.74Å; F366-V435 HydrophobicContact CE1-CG1 4.07Å; F366-V435 HydrophobicContact CE1-CG2 4.43Å
367	A	98.9	Very high	98.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-60.8	-51.9	176.2	0	0	0	0	0	110.9	A363 A364 A369 I370 H371 V435 M438 V439	A363-A367 VanDerWaalsContact O-CB 3.23Å; A363-A367 WeakPolarHBondContact O-CB 3.25Å; A363-A367 PolarHBondContact O-N 2.85Å; A364-A367 PolarHBondContact O-N 3.46Å; A367-A369 VanDerWaalsContact C-N 3.28Å; A367-A369 PolarHBondContact O-N 2.89Å; A367-I370 PolarHBondContact O-N 3.37Å; A367-H371 WeakPolarHBondContact O-CB 3.27Å; A367-H371 PolarHBondContact O-N 3.48Å; A367-V435 HydrophobicContact CB-CG1 4.12Å; A367-M438 HydrophobicContact CB-CB 3.91Å; A367-M438 HydrophobicContact CB-CE 4.14Å; A367-M438 HydrophobicContact CB-SD 4.36Å; A367-V439 HydrophobicContact CB-CG2 3.98Å
368	A	98.9	Very high	98.7	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-54.5	-41.7	175.4	0	0	0	0	0	112.6	V339 A340 T343 A364 I370 H371	V339-A368 HydrophobicContact CG1-CB 4.02Å; A340-A368 HydrophobicContact CB-CB 4.28Å; T343-A368 HydrophobicContact CG2-CB 4.44Å; A364-A368 PolarHBondContact O-N 2.77Å; A368-I370 VanDerWaalsContact C-N 3.31Å; A368-I370 PolarHBondContact O-N 2.82Å; A368-H371 PolarHBondContact O-ND1 2.79Å
369	A	98.9	Very high	98.7	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-69.8	-21.1	178.8	0	0	0	0	0	115.1	L289 M293 L320 Y324 I365 F366 A367	L289-A369 HydrophobicContact CD1-CB 4.12Å; M293-A369 HydrophobicContact CE-CB 3.39Å; M293-A369 HydrophobicContact CG-CB 4.18Å; M293-A369 HydrophobicContact SD-CB 3.67Å; L320-A369 HydrophobicContact CD2-CB 4.42Å; L320-A369 WeakPolarHBondContact CD2-O 3.37Å; Y324-A369 PolarHBondContact OH-O 2.95Å; Y324-A369 VanDerWaalsContact OH-O 3.1Å; I365-A369 WeakPolarHBondContact O-CB 3.43Å; I365-A369 PolarHBondContact O-N 2.79Å; I365-A369 VanDerWaalsContact O-N 3.1Å; F366-A369 PolarHBondContact O-N 2.63Å; A367-A369 VanDerWaalsContact C-N 3.28Å; A367-A369 PolarHBondContact O-N 2.89Å
370	I	98.9	Very high	98.7	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-110.2	-3.1	180	74.1	161	0	0	0	114.2	L320 F366 A367 A368 D372 V373 L405 F409 V435 V439	L320-I370 HydrophobicContact CD1-CB 4.42Å; L320-I370 HydrophobicContact CD1-CG2 3.78Å; L320-I370 HydrophobicContact CD2-CG2 3.95Å; F366-I370 HydrophobicContact CD1-CD1 4.33Å; F366-I370 HydrophobicContact CD2-CG2 4.49Å; F366-I370 HydrophobicContact CE1-CD1 3.74Å; F366-I370 HydrophobicContact CE1-CG1 4.36Å; F366-I370 HydrophobicContact CE1-CG2 4.19Å; F366-I370 HydrophobicContact CE2-CG2 4.11Å; F366-I370 HydrophobicContact CZ-CD1 4.32Å; F366-I370 HydrophobicContact CZ-CG2 3.94Å; F366-I370 WeakPolarHBondContact O-CG1 3.4Å; F366-I370 PolarHBondContact O-N 3.38Å; A367-I370 PolarHBondContact O-N 3.37Å; A368-I370 VanDerWaalsContact C-N 3.31Å; A368-I370 PolarHBondContact O-N 2.82Å; I370-D372 PolarHBondContact O-N 2.71Å; I370-V373 HydrophobicContact CB-CG1 4.36Å; I370-V373 WeakPolarHBondContact O-CG1 3.39Å; I370-V373 PolarHBondContact O-N 2.78Å; I370-L405 HydrophobicContact CD1-CD2 4.27Å; I370-F409 HydrophobicContact CD1-CD2 4.39Å; I370-F409 HydrophobicContact CD1-CE2 4.39Å; I370-V435 HydrophobicContact CD1-CG1 3.91Å; I370-V439 HydrophobicContact CG1-CG2 4.25Å
371	H	98.9	Very high	98.6	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-26.6	-162	76.7	-73.5	0	0	0	114.5	H335 A367 A368 H404 V439	H335-H371 AromaticContact NE2-NE2 3.61Å; A367-H371 WeakPolarHBondContact O-CB 3.27Å; A367-H371 PolarHBondContact O-N 3.48Å; A368-H371 PolarHBondContact O-ND1 2.79Å; H371-H404 WeakPolarHBondContact O-CB 3.22Å; H371-H404 PolarHBondContact O-CD2 3.21Å; H371-V439 HydrophobicContact CB-CG1 4.24Å; H371-V439 HydrophobicContact CB-CG2 4.25Å
372	D	98.8	Very high	98.6	Very high	14 Å²	14	12.8 Å²	12.8	8%	0.075	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.7	9.8	-176.3	-90.3	1.1	0	0	0	114.4	Y324 H331 H335 I370 D374 H375 H404	Y324-D372 VanDerWaalsContact CE1-C 3.45Å; Y324-D372 HydrophobicContact CE1-CB 3.61Å; Y324-D372 WeakPolarHBondContact CE1-O 3.4Å; Y324-D372 PolarHBondContact OH-N 2.98Å; H331-D372 IonicContact CD2-OD2 3.52Å; H331-D372 PolarHBondContact CD2-OD2 2.97Å; H331-D372 IonicContact CG-OD2 2.71Å; H335-D372 IonicContact CD2-OD2 3.3Å; H335-D372 PolarHBondContact CD2-OD2 3.4Å; H335-D372 IonicContact NE2-OD2 3.79Å; I370-D372 PolarHBondContact O-N 2.71Å; D372-D374 PolarHBondContact O-N 3.33Å; D372-H375 VanDerWaalsContact O-CB 3.23Å; D372-H375 WeakPolarHBondContact O-CB 3.4Å; D372-H375 PolarHBondContact O-N 3.5Å; D372-H404 VanDerWaalsContact C-ND1 3.29Å
373	V	98.8	Very high	98.6	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	130.8	-169.6	66.5	0	0	0	0	112.3	L320 H323 Y324 I370 H404 V407	L320-V373 HydrophobicContact CD1-CB 4.06Å; L320-V373 HydrophobicContact CD1-CG1 4.24Å; L320-V373 HydrophobicContact CD1-CG2 3.78Å; H323-V373 HydrophobicContact CB-CG2 3.55Å; Y324-V373 HydrophobicContact CD2-CB 4.4Å; Y324-V373 HydrophobicContact CD2-CG2 4.15Å; Y324-V373 HydrophobicContact CE1-CB 4.48Å; Y324-V373 HydrophobicContact CE2-CB 3.81Å; Y324-V373 HydrophobicContact CE2-CG2 3.99Å; Y324-V373 PolarHBondContact OH-N 2.87Å; I370-V373 HydrophobicContact CB-CG1 4.36Å; I370-V373 WeakPolarHBondContact O-CG1 3.39Å; I370-V373 PolarHBondContact O-N 2.78Å; V373-H404 HydrophobicContact CG1-CB 4.46Å; V373-H404 WeakPolarHBondContact CG1-O 3.48Å; V373-H404 PolarHBondContact N-ND1 2.92Å; V373-H404 PolarHBondContact O-ND1 3.11Å; V373-V407 HydrophobicContact CG1-CB 3.97Å; V373-V407 HydrophobicContact CG1-CG1 3.86Å; V373-V407 HydrophobicContact CG2-CG1 4Å
374	D	98.4	Very high	98.5	Very high	13 Å²	13	15.2 Å²	15.2	7%	0.07	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	24.3	-172.5	-153.3	46.3	0	0	0	114.3	H323 H325 D372 H403 V407	H323-D374 VanDerWaalsContact O-CA 3.25Å; H323-D374 WeakPolarHBondContact O-CA 3.04Å; H323-D374 PolarHBondContact O-N 3.24Å; H325-D374 IonicContact CD2-OD1 3.43Å; H325-D374 IonicContact CE1-OD1 3.17Å; H325-D374 IonicContact NE2-OD1 3.28Å; H325-D374 PolarHBondContact NE2-OD1 2.88Å; D372-D374 PolarHBondContact O-N 3.33Å; D374-H403 IonicContact OD2-CD2 2.67Å; D374-H403 IonicContact OD2-CE1 3.78Å; D374-H403 IonicContact OD2-NE2 2.8Å; D374-H403 PolarHBondContact OD2-NE2 2.96Å; D374-V407 HydrophobicContact CB-CG1 4.3Å; D374-V407 HydrophobicContact CB-CG2 4.13Å
375	H	98.6	Very high	98.5	Very high	8 Å²	8	19.2 Å²	19.2	4%	0.037	10%	0.104	C	C	.	.			trans	-61.9	126.9	173.1	-172.4	-96	0	0	0	112.7	H331 D372 G377 H404 E510	H331-H375 HydrophobicContact CB-CB 4.04Å; H331-H375 VanDerWaalsContact CB-ND1 3.25Å; H331-H375 WeakPolarHBondContact CB-ND1 3.34Å; H331-H375 AromaticContact CE1-CE1 3.98Å; H331-H375 AromaticContact CG-CE1 3.6Å; H331-H375 AromaticContact CG-ND1 3.58Å; H331-H375 AromaticContact ND1-CE1 3.35Å; H331-H375 PolarHBondContact ND1-CE1 2.73Å; H331-H375 VanDerWaalsContact ND1-CE1 3.35Å; H331-H375 AromaticContact ND1-ND1 3.68Å; D372-H375 VanDerWaalsContact O-CB 3.23Å; D372-H375 WeakPolarHBondContact O-CB 3.4Å; D372-H375 PolarHBondContact O-N 3.5Å; H375-G377 VanDerWaalsContact C-N 3.31Å; H375-G377 PolarHBondContact ND1-N 3.42Å; H375-G377 VanDerWaalsContact ND1-N 3.2Å; H375-G377 PolarHBondContact O-N 2.72Å; H375-H404 AromaticContact CD2-NE2 3.83Å; H375-E510 IonicContact CE1-OE1 3.43Å; H375-E510 PolarHBondContact CE1-OE1 2.91Å; H375-E510 IonicContact ND1-OE1 2.58Å
376	P	98.2	Very high	98.4	Very high	38 Å²	38	21.4 Å²	21.4	25%	0.247	12%	0.118	C	C	.	.			trans	-86.6	9.5	-171	35.5	-37.6	0	0	0	114.9	V378 L383 L400	P376-V378 HydrophobicContact CB-CG2 4.14Å; P376-V378 HydrophobicContact CG-CG2 3.72Å; P376-V378 PolarHBondContact O-N 2.71Å; P376-L383 HydrophobicContact CG-CD1 4.36Å; P376-L383 HydrophobicContact CG-CD2 4.36Å; P376-L400 HydrophobicContact CG-CD2 4.05Å
377	G	98.1	Very high	98.2	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	64	37.5	-176.2	0	0	0	0	0	113.7	H375 E510 K517	H375-G377 VanDerWaalsContact C-N 3.31Å; H375-G377 PolarHBondContact ND1-N 3.42Å; H375-G377 VanDerWaalsContact ND1-N 3.2Å; H375-G377 PolarHBondContact O-N 2.72Å; G377-E510 VanDerWaalsContact CA-OE1 3.27Å; G377-E510 WeakPolarHBondContact CA-OE1 3.35Å; G377-K517 PolarHBondContact O-NZ 2.69Å
378	V	98.4	Very high	98.1	Very high	8 Å²	8	28 Å²	28	5%	0.048	16%	0.155	C	C	.	.	S	Bend	trans	-155.6	143.8	174.6	-70.2	0	0	0	0	110.3	P376 F382 L383 Q514 K517	P376-V378 HydrophobicContact CB-CG2 4.14Å; P376-V378 HydrophobicContact CG-CG2 3.72Å; P376-V378 PolarHBondContact O-N 2.71Å; V378-F382 HydrophobicContact CB-CB 4.17Å; V378-F382 HydrophobicContact CB-CD1 3.54Å; V378-F382 HydrophobicContact CB-CE1 4.09Å; V378-F382 HydrophobicContact CB-CG 3.92Å; V378-F382 HydrophobicContact CG1-CD1 3.75Å; V378-F382 HydrophobicContact CG1-CE1 3.82Å; V378-F382 HydrophobicContact CG1-CG 4.11Å; V378-F382 HydrophobicContact CG1-CZ 4.24Å; V378-F382 HydrophobicContact CG2-CD1 3.57Å; V378-F382 HydrophobicContact CG2-CE1 3.97Å; V378-F382 HydrophobicContact CG2-CG 4.42Å; V378-L383 HydrophobicContact CG2-CD2 3.87Å; V378-L383 HydrophobicContact CG2-CG 4.21Å; V378-Q514 HydrophobicContact CB-CG 4.42Å; V378-Q514 HydrophobicContact CG1-CB 4.24Å; V378-Q514 HydrophobicContact CG1-CG 3.95Å; V378-K517 HydrophobicContact CG1-CD 3.53Å
379	S	98.4	Very high	98	Very high	45 Å²	45	34.3 Å²	34.3	32%	0.315	18%	0.184	S	C	.	.			trans	-66.4	159.2	-176.9	58.8	0	0	0	0	115.6	Q381 F382 L383 Q514	S379-Q381 VanDerWaalsContact C-N 3.25Å; S379-Q381 PolarHBondContact O-N 3.46Å; S379-F382 WeakPolarHBondContact O-CB 3.26Å; S379-F382 PolarHBondContact O-N 3.49Å; S379-F382 PolarHBondContact OG-N 2.94Å; S379-L383 PolarHBondContact O-N 3.03Å; S379-L383 VanDerWaalsContact O-N 3.08Å; S379-Q514 PolarHBondContact OG-NE2 3.13Å; S379-Q514 PolarHBondContact OG-OE1 3.29Å
380	N	97.9	Very high	97.8	Very high	28 Å²	28	35.5 Å²	35.5	15%	0.15	19%	0.19	C	C	.	.	H	α-helix	trans	-46.2	-46.8	169.1	-82.6	-35.5	0	0	0	112.3	F382 L383 I384 V399 L400 E401	N380-F382 PolarHBondContact O-N 3.37Å; N380-L383 WeakPolarHBondContact O-CB 3.48Å; N380-L383 PolarHBondContact O-N 3.02Å; N380-I384 WeakPolarHBondContact O-CD1 3.45Å; N380-I384 VanDerWaalsContact O-CG1 3.28Å; N380-I384 WeakPolarHBondContact O-CG1 3.36Å; N380-I384 PolarHBondContact O-N 2.8Å; N380-V399 WeakPolarHBondContact OD1-CB 3.28Å; N380-V399 PolarHBondContact OD1-N 2.91Å; N380-L400 WeakPolarHBondContact OD1-CB 3.47Å; N380-L400 VanDerWaalsContact OD1-CG 3.23Å; N380-L400 WeakPolarHBondContact OD1-CG 3.29Å; N380-L400 PolarHBondContact OD1-N 3.18Å; N380-E401 PolarHBondContact ND2-OE1 3.15Å; N380-E401 PolarHBondContact ND2-OE2 3.05Å
381	Q	98	Very high	97.7	Very high	105 Å²	105	35.6 Å²	35.6	49%	0.491	19%	0.191	S	C	.	.	H	α-helix	trans	-65.7	-36.5	-178.8	-168.6	63.1	63.2	0	0	112.8	S379 I384 N385	S379-Q381 VanDerWaalsContact C-N 3.25Å; S379-Q381 PolarHBondContact O-N 3.46Å; Q381-I384 PolarHBondContact O-N 3.31Å; Q381-N385 PolarHBondContact NE2-OD1 3.29Å; Q381-N385 VanDerWaalsContact O-CB 3.31Å; Q381-N385 WeakPolarHBondContact O-CB 3.39Å; Q381-N385 PolarHBondContact O-N 3.22Å; Q381-N385 PolarHBondContact O-ND2 3.16Å; Q381-N385 PolarHBondContact O-OD1 2.97Å
382	F	98.3	Very high	97.5	Very high	8 Å²	8	41.1 Å²	41.1	4%	0.035	22%	0.22	C	C	.	.	H	α-helix	trans	-64.6	-42.2	173.2	177.7	-83.1	0	0	0	111.4	V378 S379 N380 I384 N385 T386 Q514 K517 E518 M523	V378-F382 HydrophobicContact CB-CB 4.17Å; V378-F382 HydrophobicContact CB-CD1 3.54Å; V378-F382 HydrophobicContact CB-CE1 4.09Å; V378-F382 HydrophobicContact CB-CG 3.92Å; V378-F382 HydrophobicContact CG1-CD1 3.75Å; V378-F382 HydrophobicContact CG1-CE1 3.82Å; V378-F382 HydrophobicContact CG1-CG 4.11Å; V378-F382 HydrophobicContact CG1-CZ 4.24Å; V378-F382 HydrophobicContact CG2-CD1 3.57Å; V378-F382 HydrophobicContact CG2-CE1 3.97Å; V378-F382 HydrophobicContact CG2-CG 4.42Å; S379-F382 WeakPolarHBondContact O-CB 3.26Å; S379-F382 PolarHBondContact O-N 3.49Å; S379-F382 PolarHBondContact OG-N 2.94Å; N380-F382 PolarHBondContact O-N 3.37Å; F382-I384 VanDerWaalsContact C-N 3.32Å; F382-I384 PolarHBondContact O-N 3.32Å; F382-N385 PolarHBondContact O-N 2.9Å; F382-T386 HydrophobicContact CD1-CG2 4.18Å; F382-T386 HydrophobicContact CD2-CG2 4.46Å; F382-T386 HydrophobicContact CE1-CG2 3.82Å; F382-T386 HydrophobicContact CE2-CG2 4.12Å; F382-T386 HydrophobicContact CG-CG2 4.49Å; F382-T386 HydrophobicContact CZ-CG2 3.79Å; F382-T386 WeakPolarHBondContact O-CB 3.25Å; F382-T386 WeakPolarHBondContact O-CG2 3.17Å; F382-T386 PolarHBondContact O-N 3.37Å; F382-T386 PolarHBondContact O-OG1 3.47Å; F382-Q514 HydrophobicContact CB-CG 4.48Å; F382-Q514 HydrophobicContact CD2-CG 3.88Å; F382-Q514 HydrophobicContact CE2-CG 4.44Å; F382-Q514 HydrophobicContact CG-CG 4.3Å; F382-K517 HydrophobicContact CE2-CB 4.13Å; F382-K517 HydrophobicContact CZ-CB 4.03Å; F382-E518 HydrophobicContact CD2-CG 3.59Å; F382-E518 HydrophobicContact CE2-CG 3.61Å; F382-M523 HydrophobicContact CD2-CE 4.17Å; F382-M523 HydrophobicContact CE2-CE 4.36Å; F382-M523 HydrophobicContact CE2-SD 4.33Å
383	L	98	Very high	97.3	Very high	12 Å²	12	44.1 Å²	44.1	6%	0.063	23%	0.234	C	C	.	.	H	α-helix	trans	-63.3	-36	178	-69.9	178.6	0	0	0	112.9	P376 V378 S379 N380 T386 N387 S388 L390 A391 V399 L400	P376-L383 HydrophobicContact CG-CD1 4.36Å; P376-L383 HydrophobicContact CG-CD2 4.36Å; V378-L383 HydrophobicContact CG2-CD2 3.87Å; V378-L383 HydrophobicContact CG2-CG 4.21Å; S379-L383 PolarHBondContact O-N 3.03Å; S379-L383 VanDerWaalsContact O-N 3.08Å; N380-L383 WeakPolarHBondContact O-CB 3.48Å; N380-L383 PolarHBondContact O-N 3.02Å; L383-T386 PolarHBondContact O-OG1 2.64Å; L383-N387 PolarHBondContact O-N 2.88Å; L383-S388 WeakPolarHBondContact CB-OG 3.48Å; L383-S388 WeakPolarHBondContact O-CB 3.02Å; L383-S388 PolarHBondContact O-N 3.31Å; L383-S388 PolarHBondContact O-OG 2.89Å; L383-L390 HydrophobicContact CD1-CD1 4.2Å; L383-A391 WeakPolarHBondContact O-CB 3.42Å; L383-V399 HydrophobicContact CD1-CG1 4.17Å; L383-L400 HydrophobicContact CD1-CD1 4.42Å; L383-L400 HydrophobicContact CD1-CD2 3.64Å; L383-L400 HydrophobicContact CD1-CG 3.83Å
384	I	97.8	Very high	97.2	Very high	39 Å²	39	46.1 Å²	46.1	20%	0.2	24%	0.242	C	C	.	.	H	α-helix	trans	-70.6	-54.1	174.1	-64.3	161.8	0	0	0	110	N380 Q381 F382 T386 N387 A391 D396 V399	N380-I384 WeakPolarHBondContact O-CD1 3.45Å; N380-I384 VanDerWaalsContact O-CG1 3.28Å; N380-I384 WeakPolarHBondContact O-CG1 3.36Å; N380-I384 PolarHBondContact O-N 2.8Å; Q381-I384 PolarHBondContact O-N 3.31Å; F382-I384 VanDerWaalsContact C-N 3.32Å; F382-I384 PolarHBondContact O-N 3.32Å; I384-T386 PolarHBondContact O-N 3.32Å; I384-T386 VanDerWaalsContact O-N 3.16Å; I384-N387 PolarHBondContact O-N 3.48Å; I384-A391 HydrophobicContact CG1-CB 4.14Å; I384-D396 HydrophobicContact CD1-CB 3.96Å; I384-D396 HydrophobicContact CG1-CB 3.95Å; I384-D396 HydrophobicContact CG2-CB 4.38Å; I384-V399 HydrophobicContact CG1-CG2 4.42Å
385	N	97.3	Very high	97.1	Very high	85 Å²	85	51.4 Å²	51.4	46%	0.455	27%	0.27	S	S	.	.	H	α-helix	trans	-56.9	-35.1	-179.2	-70.4	-5	0	0	0	112.5	Q381 F382 N387 M523	Q381-N385 PolarHBondContact NE2-OD1 3.29Å; Q381-N385 VanDerWaalsContact O-CB 3.31Å; Q381-N385 WeakPolarHBondContact O-CB 3.39Å; Q381-N385 PolarHBondContact O-N 3.22Å; Q381-N385 PolarHBondContact O-ND2 3.16Å; Q381-N385 PolarHBondContact O-OD1 2.97Å; F382-N385 PolarHBondContact O-N 2.9Å; N385-N387 PolarHBondContact O-ND2 3.09Å; N385-M523 HydrophobicContact CB-CE 3.8Å
386	T	97	Very high	97	Very high	46 Å²	46	55.2 Å²	55.2	28%	0.282	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	1.2	177.9	56.6	0	0	0	0	114.7	F382 L383 I384 S388 M523	F382-T386 HydrophobicContact CD1-CG2 4.18Å; F382-T386 HydrophobicContact CD2-CG2 4.46Å; F382-T386 HydrophobicContact CE1-CG2 3.82Å; F382-T386 HydrophobicContact CE2-CG2 4.12Å; F382-T386 HydrophobicContact CG-CG2 4.49Å; F382-T386 HydrophobicContact CZ-CG2 3.79Å; F382-T386 WeakPolarHBondContact O-CB 3.25Å; F382-T386 WeakPolarHBondContact O-CG2 3.17Å; F382-T386 PolarHBondContact O-N 3.37Å; F382-T386 PolarHBondContact O-OG1 3.47Å; L383-T386 PolarHBondContact O-OG1 2.64Å; I384-T386 PolarHBondContact O-N 3.32Å; I384-T386 VanDerWaalsContact O-N 3.16Å; T386-S388 VanDerWaalsContact C-N 3.29Å; T386-S388 PolarHBondContact O-N 3.15Å; T386-M523 HydrophobicContact CG2-CE 4.14Å; T386-M523 HydrophobicContact CG2-SD 3.78Å
387	N	96.3	Very high	96.9	Very high	117 Å²	117	58.9 Å²	58.9	63%	0.626	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	43.4	-179.1	-66.9	-116.4	0	0	0	112.4	L383 I384 N385	L383-N387 PolarHBondContact O-N 2.88Å; I384-N387 PolarHBondContact O-N 3.48Å; N385-N387 PolarHBondContact O-ND2 3.09Å
388	S	96.6	Very high	96.8	Very high	22 Å²	22	59.6 Å²	59.6	15%	0.154	31%	0.31	C	S	.	.			trans	-65.7	157.7	-175.8	67	0	0	0	0	113.7	L383 T386 L390 A391 L392	L383-S388 WeakPolarHBondContact CB-OG 3.48Å; L383-S388 WeakPolarHBondContact O-CB 3.02Å; L383-S388 PolarHBondContact O-N 3.31Å; L383-S388 PolarHBondContact O-OG 2.89Å; T386-S388 VanDerWaalsContact C-N 3.29Å; T386-S388 PolarHBondContact O-N 3.15Å; S388-L390 PolarHBondContact O-N 2.9Å; S388-A391 PolarHBondContact O-N 3.32Å; S388-A391 WeakPolarHBondContact OG-CB 3.49Å; S388-A391 PolarHBondContact OG-N 2.74Å; S388-L392 WeakPolarHBondContact O-CG 3.24Å; S388-L392 PolarHBondContact O-N 3.35Å
389	E	96.1	Very high	96.8	Very high	132 Å²	132	59.2 Å²	59.2	62%	0.617	31%	0.308	S	S	*	.	H	α-helix	trans	-56.8	-32.5	174.6	-69.6	-168.9	-171.4	0	0	112.4	S234 M393	S234-E389 WeakPolarHBondContact CB-OE2 3.24Å; S234-E389 PolarHBondContact OG-OE2 2.81Å; E389-M393 WeakPolarHBondContact O-CB 3.49Å; E389-M393 PolarHBondContact O-N 3.21Å
390	L	95.6	Very high	96.9	Very high	26 Å²	26	57.5 Å²	57.5	14%	0.136	30%	0.295	C	S	.	.	H	α-helix	trans	-69.5	-49.3	176.8	-59.1	-175.6	0	0	0	111.5	L383 S388 L392 M393 Y394 V399	L383-L390 HydrophobicContact CD1-CD1 4.2Å; S388-L390 PolarHBondContact O-N 2.9Å; L390-L392 VanDerWaalsContact C-N 3.34Å; L390-L392 PolarHBondContact O-N 2.92Å; L390-M393 HydrophobicContact CD2-CE 3.67Å; L390-M393 PolarHBondContact O-N 3.4Å; L390-M393 VanDerWaalsContact O-N 3.09Å; L390-Y394 VanDerWaalsContact O-CD2 3.28Å; L390-Y394 WeakPolarHBondContact O-CD2 3.29Å; L390-Y394 PolarHBondContact O-N 3.45Å; L390-V399 VanDerWaalsContact C-CG1 3.46Å; L390-V399 HydrophobicContact CB-CG1 3.68Å
391	A	96.4	Very high	96.9	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.008	29%	0.291	C	S	.	.	H	α-helix	trans	-60	-44.4	179.2	0	0	0	0	0	111.6	L383 I384 S388 M393 Y394 N395 D396 V399	L383-A391 WeakPolarHBondContact O-CB 3.42Å; I384-A391 HydrophobicContact CG1-CB 4.14Å; S388-A391 PolarHBondContact O-N 3.32Å; S388-A391 WeakPolarHBondContact OG-CB 3.49Å; S388-A391 PolarHBondContact OG-N 2.74Å; A391-M393 VanDerWaalsContact C-N 3.31Å; A391-M393 PolarHBondContact O-N 3.22Å; A391-Y394 PolarHBondContact O-N 3.46Å; A391-N395 WeakPolarHBondContact O-CA 3.21Å; A391-N395 PolarHBondContact O-N 2.84Å; A391-D396 PolarHBondContact O-N 3.08Å; A391-V399 HydrophobicContact CB-CG1 4.38Å; A391-V399 HydrophobicContact CB-CG2 4.42Å
392	L	94.7	Very high	96.9	Very high	117 Å²	117	54.4 Å²	54.4	61%	0.613	28%	0.281	S	S	*	.	H	α-helix	trans	-65.6	-29.7	175	-65	173.9	0	0	0	113.6	S388 L390	S388-L392 WeakPolarHBondContact O-CG 3.24Å; S388-L392 PolarHBondContact O-N 3.35Å; L390-L392 VanDerWaalsContact C-N 3.34Å; L390-L392 PolarHBondContact O-N 2.92Å
393	M	95.1	Very high	96.9	Very high	77 Å²	77	54.1 Å²	54.1	38%	0.379	28%	0.28	S	S	.	.	H	α-helix	trans	-77.2	-37.6	177.5	173.4	161.5	51.1	0	0	112.5	E389 L390 A391 N395	E389-M393 WeakPolarHBondContact O-CB 3.49Å; E389-M393 PolarHBondContact O-N 3.21Å; L390-M393 HydrophobicContact CD2-CE 3.67Å; L390-M393 PolarHBondContact O-N 3.4Å; L390-M393 VanDerWaalsContact O-N 3.09Å; A391-M393 VanDerWaalsContact C-N 3.31Å; A391-M393 PolarHBondContact O-N 3.22Å; M393-N395 PolarHBondContact O-ND2 2.79Å
394	Y	96.6	Very high	97	Very high	41 Å²	41	53.7 Å²	53.7	16%	0.161	28%	0.278	C	S	.	.	H	α-helix	trans	-98.4	-5.2	-177.5	-63	-62.2	0	0	0	114.2	L390 A391 V399 N402 H403 A406	L390-Y394 VanDerWaalsContact O-CD2 3.28Å; L390-Y394 WeakPolarHBondContact O-CD2 3.29Å; L390-Y394 PolarHBondContact O-N 3.45Å; A391-Y394 PolarHBondContact O-N 3.46Å; Y394-V399 HydrophobicContact CD2-CG1 4.19Å; Y394-V399 VanDerWaalsContact CD2-O 3.24Å; Y394-V399 WeakPolarHBondContact CD2-O 3.46Å; Y394-N402 HydrophobicContact CD1-CB 3.44Å; Y394-N402 VanDerWaalsContact CD1-CB 3.44Å; Y394-N402 HydrophobicContact CD2-CB 4.36Å; Y394-N402 HydrophobicContact CE1-CB 3.6Å; Y394-N402 HydrophobicContact CE2-CB 4.5Å; Y394-N402 HydrophobicContact CG-CB 3.86Å; Y394-H403 HydrophobicContact CE2-CB 3.73Å; Y394-A406 VanDerWaalsContact OH-CB 3.32Å; Y394-A406 WeakPolarHBondContact OH-CB 3.28Å
395	N	96.6	Very high	97	Very high	124 Å²	124	52.2 Å²	52.2	66%	0.663	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	46.3	176.4	-42.3	-100.8	0	0	0	111.9	A391 M393 E397	A391-N395 WeakPolarHBondContact O-CA 3.21Å; A391-N395 PolarHBondContact O-N 2.84Å; M393-N395 PolarHBondContact O-ND2 2.79Å; N395-E397 PolarHBondContact O-N 2.68Å
396	D	96.6	Very high	97	Very high	89 Å²	89	49.5 Å²	49.5	48%	0.476	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	-3.2	175.7	-50.1	-33.7	0	0	0	116.9	I384 A391	I384-D396 HydrophobicContact CD1-CB 3.96Å; I384-D396 HydrophobicContact CG1-CB 3.95Å; I384-D396 HydrophobicContact CG2-CB 4.38Å; A391-D396 PolarHBondContact O-N 3.08Å
397	E	95.1	Very high	97.1	Very high	115 Å²	115	47.3 Å²	47.3	54%	0.537	25%	0.246	S	C	.	.	S	Bend	trans	-98.7	114.2	178.9	-73.2	-89.1	-174.7	0	0	111.6	N395 V399 N402	N395-E397 PolarHBondContact O-N 2.68Å; E397-V399 PolarHBondContact O-N 3Å; E397-N402 PolarHBondContact O-ND2 2.72Å
398	S	97.3	Very high	97.2	Very high	15 Å²	15	41.7 Å²	41.7	11%	0.105	22%	0.216	C	C	.	.	S	Bend	trans	46.8	56.1	178.2	-53	0	0	0	0	112.6	E401 N402 D443 K446	S398-E401 WeakPolarHBondContact CA-OE2 3.39Å; S398-E401 WeakPolarHBondContact CB-OE2 3.39Å; S398-N402 WeakPolarHBondContact O-CB 3.39Å; S398-N402 PolarHBondContact O-N 2.9Å; S398-N402 VanDerWaalsContact O-N 3.09Å; S398-N402 PolarHBondContact O-ND2 3.42Å; S398-D443 WeakPolarHBondContact CB-OD2 3.41Å; S398-D443 PolarHBondContact OG-OD2 3.21Å; S398-K446 PolarHBondContact OG-NZ 2.85Å
399	V	98.4	Very high	97.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.7	-46.8	-165.7	173.9	0	0	0	0	111.8	N380 L383 I384 L390 A391 Y394 E397 E401 H403	N380-V399 WeakPolarHBondContact OD1-CB 3.28Å; N380-V399 PolarHBondContact OD1-N 2.91Å; L383-V399 HydrophobicContact CD1-CG1 4.17Å; I384-V399 HydrophobicContact CG1-CG2 4.42Å; L390-V399 VanDerWaalsContact C-CG1 3.46Å; L390-V399 HydrophobicContact CB-CG1 3.68Å; A391-V399 HydrophobicContact CB-CG1 4.38Å; A391-V399 HydrophobicContact CB-CG2 4.42Å; Y394-V399 HydrophobicContact CD2-CG1 4.19Å; Y394-V399 VanDerWaalsContact CD2-O 3.24Å; Y394-V399 WeakPolarHBondContact CD2-O 3.46Å; E397-V399 PolarHBondContact O-N 3Å; V399-E401 PolarHBondContact N-OE2 3.15Å; V399-H403 PolarHBondContact O-N 3.42Å
400	L	98.6	Very high	97.3	Very high	8 Å²	8	38.2 Å²	38.2	4%	0.042	20%	0.196	C	C	.	.	H	α-helix	trans	-68.7	-47.1	178.9	-77.4	169	0	0	0	111.4	P376 N380 L383 N402 H403 H404	P376-L400 HydrophobicContact CG-CD2 4.05Å; N380-L400 WeakPolarHBondContact OD1-CB 3.47Å; N380-L400 VanDerWaalsContact OD1-CG 3.23Å; N380-L400 WeakPolarHBondContact OD1-CG 3.29Å; N380-L400 PolarHBondContact OD1-N 3.18Å; L383-L400 HydrophobicContact CD1-CD1 4.42Å; L383-L400 HydrophobicContact CD1-CD2 3.64Å; L383-L400 HydrophobicContact CD1-CG 3.83Å; L400-N402 VanDerWaalsContact C-N 3.34Å; L400-N402 PolarHBondContact O-N 3.23Å; L400-H403 CarbonylContact O-C 3.2Å; L400-H403 WeakPolarHBondContact O-CA 3.16Å; L400-H403 VanDerWaalsContact O-CB 3.24Å; L400-H403 WeakPolarHBondContact O-CB 3.38Å; L400-H403 PolarHBondContact O-N 3.24Å; L400-H404 PolarHBondContact O-CD2 3.31Å; L400-H404 PolarHBondContact O-N 3.42Å; L400-H404 PolarHBondContact O-NE2 3.47Å
401	E	98.8	Very high	97.3	Very high	16 Å²	16	37 Å²	37	8%	0.075	19%	0.19	C	C	.	.	H	α-helix	trans	-69.7	-34.3	-171.6	-52.6	79.2	-169.6	0	0	111.3	N380 S398 V399 L405 V439 L440 D443	N380-E401 PolarHBondContact ND2-OE1 3.15Å; N380-E401 PolarHBondContact ND2-OE2 3.05Å; S398-E401 WeakPolarHBondContact CA-OE2 3.39Å; S398-E401 WeakPolarHBondContact CB-OE2 3.39Å; V399-E401 PolarHBondContact N-OE2 3.15Å; E401-L405 WeakPolarHBondContact O-CB 3.15Å; E401-L405 WeakPolarHBondContact O-CG 3.42Å; E401-L405 PolarHBondContact O-N 3.4Å; E401-V439 HydrophobicContact CB-CG1 4.45Å; E401-L440 HydrophobicContact CB-CD2 4.08Å; E401-D443 HydrophobicContact CG-CB 3.78Å
402	N	98.5	Very high	97.3	Very high	53 Å²	53	37.5 Å²	37.5	28%	0.283	19%	0.193	S	C	.	.	H	α-helix	trans	-66.9	-34.8	167.5	-81.1	-75.5	0	0	0	112.9	Y394 E397 S398 L400 A406	Y394-N402 HydrophobicContact CD1-CB 3.44Å; Y394-N402 VanDerWaalsContact CD1-CB 3.44Å; Y394-N402 HydrophobicContact CD2-CB 4.36Å; Y394-N402 HydrophobicContact CE1-CB 3.6Å; Y394-N402 HydrophobicContact CE2-CB 4.5Å; Y394-N402 HydrophobicContact CG-CB 3.86Å; E397-N402 PolarHBondContact O-ND2 2.72Å; S398-N402 WeakPolarHBondContact O-CB 3.39Å; S398-N402 PolarHBondContact O-N 2.9Å; S398-N402 VanDerWaalsContact O-N 3.09Å; S398-N402 PolarHBondContact O-ND2 3.42Å; L400-N402 VanDerWaalsContact C-N 3.34Å; L400-N402 PolarHBondContact O-N 3.23Å; N402-A406 VanDerWaalsContact O-CB 3.29Å; N402-A406 WeakPolarHBondContact O-CB 3.47Å; N402-A406 PolarHBondContact O-N 2.76Å
403	H	98.6	Very high	97.3	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.009	19%	0.19	C	C	.	.	H	α-helix	trans	-68.3	-48.1	176.3	-172.9	61.3	0	0	0	111.7	D374 Y394 V399 L400 L405 A406 V407	D374-H403 IonicContact OD2-CD2 2.67Å; D374-H403 IonicContact OD2-CE1 3.78Å; D374-H403 IonicContact OD2-NE2 2.8Å; D374-H403 PolarHBondContact OD2-NE2 2.96Å; Y394-H403 HydrophobicContact CE2-CB 3.73Å; V399-H403 PolarHBondContact O-N 3.42Å; L400-H403 CarbonylContact O-C 3.2Å; L400-H403 WeakPolarHBondContact O-CA 3.16Å; L400-H403 VanDerWaalsContact O-CB 3.24Å; L400-H403 WeakPolarHBondContact O-CB 3.38Å; L400-H403 PolarHBondContact O-N 3.24Å; H403-L405 VanDerWaalsContact C-N 3.33Å; H403-L405 PolarHBondContact O-N 2.76Å; H403-A406 CarbonylContact O-C 3.57Å; H403-A406 WeakPolarHBondContact O-CA 3.37Å; H403-A406 WeakPolarHBondContact O-CB 3.2Å; H403-A406 PolarHBondContact O-N 3.34Å; H403-V407 WeakPolarHBondContact O-CG2 3.32Å; H403-V407 PolarHBondContact O-N 3.31Å
404	H	98.7	Very high	97.1	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.009	19%	0.187	C	C	.	.	H	α-helix	trans	-57.1	-45.1	177.1	-56.3	-36.1	0	0	0	111.4	H371 D372 V373 H375 L400 A406 V407 G408 V439	H371-H404 WeakPolarHBondContact O-CB 3.22Å; H371-H404 PolarHBondContact O-CD2 3.21Å; D372-H404 VanDerWaalsContact C-ND1 3.29Å; V373-H404 HydrophobicContact CG1-CB 4.46Å; V373-H404 WeakPolarHBondContact CG1-O 3.48Å; V373-H404 PolarHBondContact N-ND1 2.92Å; V373-H404 PolarHBondContact O-ND1 3.11Å; H375-H404 AromaticContact CD2-NE2 3.83Å; L400-H404 PolarHBondContact O-CD2 3.31Å; L400-H404 PolarHBondContact O-N 3.42Å; L400-H404 PolarHBondContact O-NE2 3.47Å; H404-A406 PolarHBondContact O-N 2.91Å; H404-V407 PolarHBondContact O-N 3.06Å; H404-G408 PolarHBondContact O-N 2.96Å; H404-V439 HydrophobicContact CB-CG1 4.42Å
405	L	98.8	Very high	96.8	Very high	8 Å²	8	42.4 Å²	42.4	4%	0.042	21%	0.213	C	C	.	.	H	α-helix	trans	-61.2	-41.9	170.4	-79.3	168.6	0	0	0	113.4	I370 E401 H403 F409 V435 I436 V439 L440	I370-L405 HydrophobicContact CD1-CD2 4.27Å; E401-L405 WeakPolarHBondContact O-CB 3.15Å; E401-L405 WeakPolarHBondContact O-CG 3.42Å; E401-L405 PolarHBondContact O-N 3.4Å; H403-L405 VanDerWaalsContact C-N 3.33Å; H403-L405 PolarHBondContact O-N 2.76Å; L405-F409 HydrophobicContact CD2-CD2 4.24Å; L405-F409 HydrophobicContact CD2-CE2 3.95Å; L405-F409 WeakPolarHBondContact O-CB 3.22Å; L405-F409 WeakPolarHBondContact O-CD2 3.32Å; L405-F409 PolarHBondContact O-N 3.29Å; L405-V435 HydrophobicContact CD2-CG1 3.96Å; L405-I436 HydrophobicContact CD1-CB 4.28Å; L405-I436 HydrophobicContact CD1-CG1 4.18Å; L405-I436 HydrophobicContact CD1-CG2 4.17Å; L405-I436 HydrophobicContact CD2-CB 4.49Å; L405-I436 HydrophobicContact CD2-CG1 3.98Å; L405-V439 HydrophobicContact CD1-CB 4.01Å; L405-V439 HydrophobicContact CD1-CG1 4.3Å; L405-V439 HydrophobicContact CD2-CB 3.81Å; L405-V439 HydrophobicContact CD2-CG1 4.37Å; L405-V439 HydrophobicContact CD2-CG2 3.95Å; L405-V439 HydrophobicContact CG-CB 3.73Å; L405-V439 HydrophobicContact CG-CG1 3.84Å; L405-V439 HydrophobicContact CG-CG2 4.33Å; L405-L440 HydrophobicContact CD1-CD2 3.89Å; L405-L440 HydrophobicContact CD1-CG 3.73Å
406	A	98	Very high	96.7	Very high	28 Å²	28	42.6 Å²	42.6	23%	0.231	21%	0.209	C	C	.	.	H	α-helix	trans	-65.6	-43.9	179.8	0	0	0	0	0	111.5	I233 Y394 N402 H403 H404 K410	I233-A406 HydrophobicContact CD1-CB 3.88Å; Y394-A406 VanDerWaalsContact OH-CB 3.32Å; Y394-A406 WeakPolarHBondContact OH-CB 3.28Å; N402-A406 VanDerWaalsContact O-CB 3.29Å; N402-A406 WeakPolarHBondContact O-CB 3.47Å; N402-A406 PolarHBondContact O-N 2.76Å; H403-A406 CarbonylContact O-C 3.57Å; H403-A406 WeakPolarHBondContact O-CA 3.37Å; H403-A406 WeakPolarHBondContact O-CB 3.2Å; H403-A406 PolarHBondContact O-N 3.34Å; H404-A406 PolarHBondContact O-N 2.91Å; A406-K410 WeakPolarHBondContact O-CB 3.35Å; A406-K410 PolarHBondContact O-N 3.36Å
407	V	98	Very high	96.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-67.9	-55.6	177.3	174.2	0	0	0	0	111	V236 V373 D374 H403 H404 F409 K410 L411	V236-V407 HydrophobicContact CG2-CG2 4.02Å; V373-V407 HydrophobicContact CG1-CB 3.97Å; V373-V407 HydrophobicContact CG1-CG1 3.86Å; V373-V407 HydrophobicContact CG2-CG1 4Å; D374-V407 HydrophobicContact CB-CG1 4.3Å; D374-V407 HydrophobicContact CB-CG2 4.13Å; H403-V407 WeakPolarHBondContact O-CG2 3.32Å; H403-V407 PolarHBondContact O-N 3.31Å; H404-V407 PolarHBondContact O-N 3.06Å; V407-F409 VanDerWaalsContact C-N 3.31Å; V407-F409 PolarHBondContact O-N 3.2Å; V407-K410 WeakPolarHBondContact O-CA 3.13Å; V407-K410 WeakPolarHBondContact O-CB 3.33Å; V407-K410 PolarHBondContact O-N 2.9Å; V407-L411 HydrophobicContact CG1-CD1 4.34Å; V407-L411 HydrophobicContact CG1-CG 4.33Å; V407-L411 WeakPolarHBondContact O-CG 3.44Å; V407-L411 PolarHBondContact O-N 3.08Å
408	G	97.9	Very high	96.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-55.5	-41.8	-177	0	0	0	0	0	113.4	Y316 H404	Y316-G408 PolarHBondContact OH-O 3.36Å; H404-G408 PolarHBondContact O-N 2.96Å
409	F	98.4	Very high	96.8	Very high	25 Å²	25	34.3 Å²	34.3	11%	0.11	17%	0.168	C	C	.	.	H	α-helix	trans	-78.7	-20	173.3	-80.4	-79.5	0	0	0	114.6	F366 I370 L405 V407 L412 L431 R432 V435	F366-F409 HydrophobicContact CE1-CE1 4.33Å; F366-F409 HydrophobicContact CE1-CE2 4.36Å; F366-F409 HydrophobicContact CE1-CZ 4.08Å; I370-F409 HydrophobicContact CD1-CD2 4.39Å; I370-F409 HydrophobicContact CD1-CE2 4.39Å; L405-F409 HydrophobicContact CD2-CD2 4.24Å; L405-F409 HydrophobicContact CD2-CE2 3.95Å; L405-F409 WeakPolarHBondContact O-CB 3.22Å; L405-F409 WeakPolarHBondContact O-CD2 3.32Å; L405-F409 PolarHBondContact O-N 3.29Å; V407-F409 VanDerWaalsContact C-N 3.31Å; V407-F409 PolarHBondContact O-N 3.2Å; F409-L412 HydrophobicContact CD1-CD1 3.76Å; F409-L412 HydrophobicContact CE1-CD1 4.37Å; F409-L431 HydrophobicContact CE1-CD2 4.46Å; F409-L431 HydrophobicContact CZ-CD2 4.5Å; F409-R432 HydrophobicContact CE1-CB 4.08Å; F409-R432 HydrophobicContact CE1-CG 4.04Å; F409-R432 HydrophobicContact CE2-CG 4.43Å; F409-R432 HydrophobicContact CZ-CB 4.1Å; F409-R432 HydrophobicContact CZ-CG 3.94Å; F409-V435 HydrophobicContact CE2-CB 4Å; F409-V435 HydrophobicContact CE2-CG1 3.56Å; F409-V435 HydrophobicContact CZ-CB 3.84Å; F409-V435 HydrophobicContact CZ-CG1 3.8Å; F409-V435 HydrophobicContact CZ-CG2 4.31Å
410	K	96.9	Very high	96.8	Very high	55 Å²	55	34.5 Å²	34.5	24%	0.239	17%	0.168	C	C	.	.	H	α-helix	trans	-74	-38.2	174	168.6	59.9	-155	160.5	0	111.5	I233 V236 A406 V407 L412 Q413 E414	I233-K410 HydrophobicContact CD1-CB 4.13Å; I233-K410 HydrophobicContact CD1-CG 4.27Å; V236-K410 HydrophobicContact CG2-CG 4.39Å; A406-K410 WeakPolarHBondContact O-CB 3.35Å; A406-K410 PolarHBondContact O-N 3.36Å; V407-K410 WeakPolarHBondContact O-CA 3.13Å; V407-K410 WeakPolarHBondContact O-CB 3.33Å; V407-K410 PolarHBondContact O-N 2.9Å; K410-L412 PolarHBondContact O-N 3.37Å; K410-Q413 VanDerWaalsContact O-CB 3.29Å; K410-Q413 WeakPolarHBondContact O-CB 3.41Å; K410-Q413 WeakPolarHBondContact O-CG 2.99Å; K410-Q413 PolarHBondContact O-N 3.44Å; K410-E414 IonicContact NZ-OE1 3.75Å; K410-E414 PolarHBondContact NZ-OE1 2.79Å
411	L	96.1	Very high	96.8	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-61.7	-29.8	-179.5	-63.1	-176.5	0	0	0	113.2	V236 Y316 T319 L320 H323 V407 Q413 E414 C417	V236-L411 HydrophobicContact CG1-CD2 4.24Å; Y316-L411 HydrophobicContact CD2-CB 4.46Å; Y316-L411 HydrophobicContact CE2-CB 3.83Å; T319-L411 HydrophobicContact CG2-CD1 4.45Å; T319-L411 HydrophobicContact CG2-CD2 4.19Å; L320-L411 HydrophobicContact CB-CD1 4.37Å; L320-L411 HydrophobicContact CD1-CD1 4.02Å; H323-L411 HydrophobicContact CB-CD1 4.35Å; V407-L411 HydrophobicContact CG1-CD1 4.34Å; V407-L411 HydrophobicContact CG1-CG 4.33Å; V407-L411 WeakPolarHBondContact O-CG 3.44Å; V407-L411 PolarHBondContact O-N 3.08Å; L411-Q413 PolarHBondContact O-N 3.04Å; L411-E414 PolarHBondContact O-N 2.63Å; L411-E414 VanDerWaalsContact O-N 3.11Å; L411-C417 WeakPolarHBondContact O-CB 3.32Å
412	L	95.7	Very high	96.7	Very high	11 Å²	11	42.1 Å²	42.1	6%	0.058	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-14.5	171.9	-64.8	169.8	0	0	0	114.1	Y316 F366 F409 K410 D418 I419 F420	Y316-L412 HydrophobicContact CD2-CD2 3.78Å; Y316-L412 HydrophobicContact CD2-CG 4.4Å; Y316-L412 HydrophobicContact CE2-CD2 3.51Å; Y316-L412 HydrophobicContact CE2-CG 3.77Å; F366-L412 HydrophobicContact CZ-CD1 4.49Å; F409-L412 HydrophobicContact CD1-CD1 3.76Å; F409-L412 HydrophobicContact CE1-CD1 4.37Å; K410-L412 PolarHBondContact O-N 3.37Å; L412-D418 WeakPolarHBondContact O-CB 3.28Å; L412-I419 HydrophobicContact CD2-CD1 4.45Å; L412-I419 HydrophobicContact CD2-CG1 3.59Å; L412-F420 HydrophobicContact CD1-CD2 3.73Å; L412-F420 HydrophobicContact CD1-CE2 4Å; L412-F420 HydrophobicContact CD2-CD2 4.11Å; L412-F420 HydrophobicContact CD2-CE2 4.34Å
413	Q	93.9	Very high	96.7	Very high	120 Å²	120	40.2 Å²	40.2	56%	0.561	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-10.2	-178.5	-55.5	175.7	15.5	0	0	113.8	K410 L411	K410-Q413 VanDerWaalsContact O-CB 3.29Å; K410-Q413 WeakPolarHBondContact O-CB 3.41Å; K410-Q413 WeakPolarHBondContact O-CG 2.99Å; K410-Q413 PolarHBondContact O-N 3.44Å; L411-Q413 PolarHBondContact O-N 3.04Å
414	E	91.8	Very high	96.6	Very high	66 Å²	66	44 Å²	44	31%	0.308	22%	0.221	S	C	.	.	S	Bend	trans	-76.1	172.3	177.3	-62.3	-52.9	128.8	0	0	111.7	K410 L411 H416 C417	K410-E414 IonicContact NZ-OE1 3.75Å; K410-E414 PolarHBondContact NZ-OE1 2.79Å; L411-E414 PolarHBondContact O-N 2.63Å; L411-E414 VanDerWaalsContact O-N 3.11Å; E414-H416 PolarHBondContact O-N 3.03Å; E414-C417 HydrophobicContact CB-CB 4.31Å; E414-C417 PolarHBondContact O-N 2.84Å
415	E	91	Very high	96.5	Very high	151 Å²	151	48.6 Å²	48.6	71%	0.706	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.5	125.4	-171.1	-170.5	147.2	-133.7	0	0	111.6	C417	E415-C417 PolarHBondContact O-N 3.06Å
416	H	94.2	Very high	96.3	Very high	129 Å²	129	55.5 Å²	55.5	60%	0.597	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	17.4	-173.4	-61.7	-72.7	0	0	0	116.7	T312 T315 E414	T312-H416 WeakPolarHBondContact CA-O 3.43Å; T312-H416 WeakPolarHBondContact CG2-O 3.48Å; T315-H416 HydrophobicContact CG2-CB 4.37Å; E414-H416 PolarHBondContact O-N 3.03Å
417	C	95.8	Very high	96.3	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.014	27%	0.274	C	S	.	.			trans	-96	-7.4	-177.8	-71.7	0	0	0	0	116.8	Y316 L411 E414 E415 I419	Y316-C417 HydrophobicContact CD2-CB 4.15Å; Y316-C417 VanDerWaalsContact CD2-O 3.3Å; Y316-C417 WeakPolarHBondContact CD2-O 3.38Å; L411-C417 WeakPolarHBondContact O-CB 3.32Å; E414-C417 HydrophobicContact CB-CB 4.31Å; E414-C417 PolarHBondContact O-N 2.84Å; E415-C417 PolarHBondContact O-N 3.06Å; C417-I419 PolarHBondContact O-N 3.48Å
418	D	97.6	Very high	96.3	Very high	37 Å²	37	61.1 Å²	61.1	20%	0.198	29%	0.289	C	S	.	.			trans	-79.8	78.4	-174.9	-169.6	8.9	0	0	0	113.1	L412 F420 M421 R428	L412-D418 WeakPolarHBondContact O-CB 3.28Å; D418-F420 PolarHBondContact O-N 2.87Å; D418-F420 PolarHBondContact OD1-N 3Å; D418-M421 HydrophobicContact CB-CB 4.12Å; D418-M421 WeakPolarHBondContact O-CB 3.18Å; D418-M421 VanDerWaalsContact O-CE 3.27Å; D418-M421 WeakPolarHBondContact O-CE 3.43Å; D418-M421 PolarHBondContact O-N 3.44Å; D418-M421 PolarHBondContact OD1-N 2.84Å; D418-M421 WeakPolarHBondContact OD2-CA 3.41Å; D418-R428 VanDerWaalsContact CG-NH2 3.32Å; D418-R428 IonicContact OD1-CZ 3.91Å; D418-R428 IonicContact OD1-NH1 3.27Å; D418-R428 PolarHBondContact OD1-NH1 3.37Å; D418-R428 IonicContact OD1-NH2 2.75Å; D418-R428 PolarHBondContact OD1-NH2 2.87Å; D418-R428 IonicContact OD2-CZ 2.77Å; D418-R428 IonicContact OD2-NH1 3.74Å; D418-R428 PolarHBondContact OD2-NH1 2.86Å; D418-R428 IonicContact OD2-NH2 3.11Å; D418-R428 PolarHBondContact OD2-NH2 2.72Å
419	I	98.2	Very high	96.2	Very high	5 Å²	5	63.1 Å²	63.1	3%	0.026	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-16.2	174.7	57.1	163.1	0	0	0	113.6	I308 T312 F313 Y316 F366 L412 C417	I308-I419 WeakPolarHBondContact CG1-O 3.49Å; I308-I419 HydrophobicContact CG2-CB 3.94Å; I308-I419 HydrophobicContact CG2-CG2 3.95Å; T312-I419 HydrophobicContact CG2-CG2 3.89Å; F313-I419 HydrophobicContact CB-CG2 4.38Å; F313-I419 HydrophobicContact CD2-CG2 4.25Å; Y316-I419 HydrophobicContact CD1-CD1 4.02Å; Y316-I419 HydrophobicContact CD1-CG1 4.41Å; Y316-I419 HydrophobicContact CD1-CG2 4.44Å; Y316-I419 HydrophobicContact CE1-CD1 4.22Å; Y316-I419 HydrophobicContact CG-CG1 4.46Å; Y316-I419 HydrophobicContact CG-CG2 4.18Å; F366-I419 HydrophobicContact CD2-CD1 3.97Å; F366-I419 HydrophobicContact CE2-CD1 3.87Å; L412-I419 HydrophobicContact CD2-CD1 4.45Å; L412-I419 HydrophobicContact CD2-CG1 3.59Å; C417-I419 PolarHBondContact O-N 3.48Å
420	F	98.2	Very high	96.1	Very high	4 Å²	4	64.2 Å²	64.2	2%	0.018	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	11.8	178.6	-57.2	-38.7	0	0	0	113.4	L362 F366 L412 D418 N422 L423 R428 L431	L362-F420 HydrophobicContact CD1-CE1 4.26Å; L362-F420 HydrophobicContact CD2-CD1 4.39Å; L362-F420 HydrophobicContact CD2-CE1 3.94Å; L362-F420 HydrophobicContact CG-CE1 4.22Å; F366-F420 HydrophobicContact CB-CZ 4.41Å; F366-F420 HydrophobicContact CD1-CE2 4.24Å; F366-F420 HydrophobicContact CD1-CZ 4.06Å; F366-F420 HydrophobicContact CD2-CE2 4.12Å; F366-F420 AromaticContact CD2-CZ 3.57Å; F366-F420 HydrophobicContact CD2-CZ 3.57Å; F366-F420 AromaticContact CE1-CE2 3.93Å; F366-F420 HydrophobicContact CE1-CE2 3.93Å; F366-F420 HydrophobicContact CE1-CZ 4.19Å; F366-F420 AromaticContact CE2-CE2 3.8Å; F366-F420 HydrophobicContact CE2-CE2 3.8Å; F366-F420 AromaticContact CE2-CZ 3.72Å; F366-F420 HydrophobicContact CE2-CZ 3.72Å; F366-F420 HydrophobicContact CG-CE2 4.32Å; F366-F420 AromaticContact CG-CZ 3.75Å; F366-F420 HydrophobicContact CG-CZ 3.75Å; F366-F420 AromaticContact CZ-CE2 3.7Å; F366-F420 HydrophobicContact CZ-CE2 3.7Å; F366-F420 HydrophobicContact CZ-CZ 4.03Å; L412-F420 HydrophobicContact CD1-CD2 3.73Å; L412-F420 HydrophobicContact CD1-CE2 4Å; L412-F420 HydrophobicContact CD2-CD2 4.11Å; L412-F420 HydrophobicContact CD2-CE2 4.34Å; D418-F420 PolarHBondContact O-N 2.87Å; D418-F420 PolarHBondContact OD1-N 3Å; F420-N422 PolarHBondContact O-N 2.85Å; F420-N422 VanDerWaalsContact O-N 3.17Å; F420-L423 HydrophobicContact CB-CD1 3.92Å; F420-L423 HydrophobicContact CB-CG 4.23Å; F420-L423 HydrophobicContact CD1-CD1 3.78Å; F420-L423 HydrophobicContact CD1-CG 4.49Å; F420-L423 HydrophobicContact CG-CD1 4.04Å; F420-L423 PolarHBondContact O-N 2.94Å; F420-R428 WeakPolarHBondContact O-CD 3.33Å; F420-R428 PolarHBondContact O-NE 3.48Å; F420-R428 PolarHBondContact O-NH1 2.89Å; F420-R428 VanDerWaalsContact O-NH1 3.13Å; F420-L431 HydrophobicContact CD1-CD1 4.28Å; F420-L431 HydrophobicContact CD2-CD2 4.11Å; F420-L431 HydrophobicContact CE1-CD1 3.84Å; F420-L431 HydrophobicContact CE1-CD2 4.4Å; F420-L431 HydrophobicContact CE2-CD2 3.62Å; F420-L431 HydrophobicContact CZ-CD1 3.96Å; F420-L431 HydrophobicContact CZ-CD2 3.78Å
421	M	97.1	Very high	96.2	Very high	92 Å²	92	61.7 Å²	61.7	45%	0.453	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-31.9	-176.2	74.8	176.2	83.8	0	0	114.1	T312 D418	T312-M421 HydrophobicContact CG2-CE 3.84Å; D418-M421 HydrophobicContact CB-CB 4.12Å; D418-M421 WeakPolarHBondContact O-CB 3.18Å; D418-M421 VanDerWaalsContact O-CE 3.27Å; D418-M421 WeakPolarHBondContact O-CE 3.43Å; D418-M421 PolarHBondContact O-N 3.44Å; D418-M421 PolarHBondContact OD1-N 2.84Å; D418-M421 WeakPolarHBondContact OD2-CA 3.41Å
422	N	97.3	Very high	96.3	Very high	93 Å²	93	66 Å²	66	50%	0.497	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-2.5	-175.5	-71.3	-40.9	0	0	0	114.1	R307 F420	R307-N422 HydrophobicContact CB-CB 4.23Å; R307-N422 PolarHBondContact O-ND2 2.91Å; F420-N422 PolarHBondContact O-N 2.85Å; F420-N422 VanDerWaalsContact O-N 3.17Å
423	L	97.8	Very high	96.3	Very high	13 Å²	13	68.6 Å²	68.6	7%	0.068	32%	0.323	C	S	.	.	S	Bend	trans	-74.3	143.6	173.1	-61.6	-169.7	0	0	0	111.1	F306 L359 L362 F420 Q427 R428 L431	F306-L423 HydrophobicContact CB-CD2 4.05Å; F306-L423 HydrophobicContact CD1-CD2 3.29Å; F306-L423 HydrophobicContact CE1-CD2 4.03Å; F306-L423 HydrophobicContact CG-CD2 3.99Å; L359-L423 HydrophobicContact CD1-CD1 4.37Å; L362-L423 HydrophobicContact CD2-CD1 4.49Å; F420-L423 HydrophobicContact CB-CD1 3.92Å; F420-L423 HydrophobicContact CB-CG 4.23Å; F420-L423 HydrophobicContact CD1-CD1 3.78Å; F420-L423 HydrophobicContact CD1-CG 4.49Å; F420-L423 HydrophobicContact CG-CD1 4.04Å; F420-L423 PolarHBondContact O-N 2.94Å; L423-Q427 HydrophobicContact CB-CB 4.09Å; L423-R428 HydrophobicContact CB-CG 3.51Å; L423-R428 HydrophobicContact CD1-CG 4.23Å; L423-R428 HydrophobicContact CG-CG 4.43Å; L423-L431 HydrophobicContact CD1-CD1 4.08Å
424	T	97.8	Very high	96.6	Very high	82 Å²	82	63 Å²	63	50%	0.503	30%	0.297	S	S	.	.			trans	-63.7	157.1	171.5	63.3	0	0	0	0	111.6	K426 Q427 R428	T424-K426 PolarHBondContact O-N 3.04Å; T424-Q427 PolarHBondContact O-N 3.49Å; T424-Q427 WeakPolarHBondContact OG1-CG 3.39Å; T424-Q427 PolarHBondContact OG1-N 3.05Å; T424-Q427 PolarHBondContact OG1-OE1 3.14Å; T424-R428 PolarHBondContact O-N 3.02Å
425	K	95.9	Very high	96.9	Very high	97 Å²	97	59.9 Å²	59.9	42%	0.422	28%	0.282	S	S	.	.	H	α-helix	trans	-50	-46.4	177.5	-169.7	-154.6	170.1	-162.8	0	111.6	E212 R428 Q429	E212-K425 IonicContact OE1-NZ 3.41Å; E212-K425 PolarHBondContact OE1-NZ 2.83Å; K425-R428 PolarHBondContact O-N 2.99Å; K425-Q429 WeakPolarHBondContact O-CG 3.45Å; K425-Q429 PolarHBondContact O-N 3.48Å; K425-Q429 PolarHBondContact O-OE1 2.78Å
426	K	95.6	Very high	97.3	Very high	153 Å²	153	54.8 Å²	54.8	67%	0.665	26%	0.26	S	S	*	.	H	α-helix	trans	-62.2	-47.1	178	-172.3	173.8	-178.7	178.1	0	111.9	T424 R428 Q429 T430	T424-K426 PolarHBondContact O-N 3.04Å; K426-R428 VanDerWaalsContact C-N 3.33Å; K426-R428 PolarHBondContact O-N 3.35Å; K426-Q429 PolarHBondContact O-N 3.44Å; K426-Q429 VanDerWaalsContact O-N 3.16Å; K426-T430 PolarHBondContact O-N 2.78Å; K426-T430 PolarHBondContact O-OG1 2.63Å; K426-T430 VanDerWaalsContact O-OG1 3.14Å
427	Q	97.4	Very high	97.4	Very high	63 Å²	63	49.6 Å²	49.6	29%	0.294	24%	0.236	S	C	.	.	H	α-helix	trans	-59	-41.9	175.8	-74.7	165.5	-58.2	0	0	112.2	L359 L423 T424 Q429 T430 L431	L359-Q427 HydrophobicContact CD1-CB 4.1Å; L359-Q427 HydrophobicContact CD1-CG 4.33Å; L359-Q427 HydrophobicContact CD2-CB 4.21Å; L359-Q427 HydrophobicContact CD2-CG 4.11Å; L423-Q427 HydrophobicContact CB-CB 4.09Å; T424-Q427 PolarHBondContact O-N 3.49Å; T424-Q427 WeakPolarHBondContact OG1-CG 3.39Å; T424-Q427 PolarHBondContact OG1-N 3.05Å; T424-Q427 PolarHBondContact OG1-OE1 3.14Å; Q427-Q429 PolarHBondContact O-N 2.78Å; Q427-T430 PolarHBondContact O-N 3.49Å; Q427-L431 VanDerWaalsContact O-CB 3.23Å; Q427-L431 WeakPolarHBondContact O-CB 3.44Å; Q427-L431 PolarHBondContact O-N 2.98Å
428	R	97.6	Very high	97.6	Very high	83 Å²	83	49.5 Å²	49.5	31%	0.313	24%	0.236	S	C	.	.	H	α-helix	trans	-65.4	-36.4	175.8	-63.5	-170	75.9	152.2	4.6	112.7	D418 F420 L423 T424 K425 K426 R432	D418-R428 VanDerWaalsContact CG-NH2 3.32Å; D418-R428 IonicContact OD1-CZ 3.91Å; D418-R428 IonicContact OD1-NH1 3.27Å; D418-R428 PolarHBondContact OD1-NH1 3.37Å; D418-R428 IonicContact OD1-NH2 2.75Å; D418-R428 PolarHBondContact OD1-NH2 2.87Å; D418-R428 IonicContact OD2-CZ 2.77Å; D418-R428 IonicContact OD2-NH1 3.74Å; D418-R428 PolarHBondContact OD2-NH1 2.86Å; D418-R428 IonicContact OD2-NH2 3.11Å; D418-R428 PolarHBondContact OD2-NH2 2.72Å; F420-R428 WeakPolarHBondContact O-CD 3.33Å; F420-R428 PolarHBondContact O-NE 3.48Å; F420-R428 PolarHBondContact O-NH1 2.89Å; F420-R428 VanDerWaalsContact O-NH1 3.13Å; L423-R428 HydrophobicContact CB-CG 3.51Å; L423-R428 HydrophobicContact CD1-CG 4.23Å; L423-R428 HydrophobicContact CG-CG 4.43Å; T424-R428 PolarHBondContact O-N 3.02Å; K425-R428 PolarHBondContact O-N 2.99Å; K426-R428 VanDerWaalsContact C-N 3.33Å; K426-R428 PolarHBondContact O-N 3.35Å; R428-R432 WeakPolarHBondContact O-CB 3.28Å; R428-R432 PolarHBondContact O-N 3.16Å
429	Q	95.6	Very high	97.6	Very high	42 Å²	42	47.8 Å²	47.8	20%	0.196	23%	0.226	C	C	.	.	H	α-helix	trans	-67.6	-48	174.6	-72.3	174.7	-96.5	0	0	111.6	D210 V211 K425 K426 Q427 R432 K433	D210-Q429 PolarHBondContact OD1-NE2 3.04Å; V211-Q429 PolarHBondContact O-NE2 2.97Å; K425-Q429 WeakPolarHBondContact O-CG 3.45Å; K425-Q429 PolarHBondContact O-N 3.48Å; K425-Q429 PolarHBondContact O-OE1 2.78Å; K426-Q429 PolarHBondContact O-N 3.44Å; K426-Q429 VanDerWaalsContact O-N 3.16Å; Q427-Q429 PolarHBondContact O-N 2.78Å; Q429-R432 PolarHBondContact O-N 3.35Å; Q429-K433 PolarHBondContact O-N 3.43Å
430	T	96.8	Very high	97.7	Very high	49 Å²	49	50.2 Å²	50.2	30%	0.301	24%	0.239	S	C	.	.	H	α-helix	trans	-63.9	-48.5	178.4	-55.9	0	0	0	0	111.6	L359 K426 Q427 R432 K433 M434	L359-T430 HydrophobicContact CD2-CG2 4.18Å; K426-T430 PolarHBondContact O-N 2.78Å; K426-T430 PolarHBondContact O-OG1 2.63Å; K426-T430 VanDerWaalsContact O-OG1 3.14Å; Q427-T430 PolarHBondContact O-N 3.49Å; T430-R432 PolarHBondContact O-N 3.27Å; T430-K433 PolarHBondContact O-N 2.84Å; T430-M434 HydrophobicContact CG2-CE 4.01Å; T430-M434 HydrophobicContact CG2-SD 4.04Å; T430-M434 WeakPolarHBondContact O-CG 3.39Å; T430-M434 PolarHBondContact O-N 3.43Å
431	L	98.5	Very high	97.7	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-58.4	-47.2	174.7	-179.3	150.3	0	0	0	111.2	L359 L362 A363 F409 F420 L423 Q427 K433 M434 V435	L359-L431 HydrophobicContact CD1-CB 4.21Å; L359-L431 HydrophobicContact CD1-CD1 4.11Å; L359-L431 HydrophobicContact CG-CB 4.48Å; L362-L431 HydrophobicContact CD2-CD1 3.53Å; L362-L431 HydrophobicContact CG-CD1 3.8Å; A363-L431 HydrophobicContact CB-CG 4.15Å; F409-L431 HydrophobicContact CE1-CD2 4.46Å; F409-L431 HydrophobicContact CZ-CD2 4.5Å; F420-L431 HydrophobicContact CD1-CD1 4.28Å; F420-L431 HydrophobicContact CD2-CD2 4.11Å; F420-L431 HydrophobicContact CE1-CD1 3.84Å; F420-L431 HydrophobicContact CE1-CD2 4.4Å; F420-L431 HydrophobicContact CE2-CD2 3.62Å; F420-L431 HydrophobicContact CZ-CD1 3.96Å; F420-L431 HydrophobicContact CZ-CD2 3.78Å; L423-L431 HydrophobicContact CD1-CD1 4.08Å; Q427-L431 VanDerWaalsContact O-CB 3.23Å; Q427-L431 WeakPolarHBondContact O-CB 3.44Å; Q427-L431 PolarHBondContact O-N 2.98Å; L431-K433 VanDerWaalsContact C-N 3.31Å; L431-K433 PolarHBondContact O-N 3.19Å; L431-M434 PolarHBondContact O-N 3.45Å; L431-V435 HydrophobicContact CD2-CG2 3.93Å; L431-V435 HydrophobicContact CG-CG2 4.25Å; L431-V435 VanDerWaalsContact O-CG2 3.25Å; L431-V435 WeakPolarHBondContact O-CG2 3.38Å; L431-V435 PolarHBondContact O-N 3.2Å
432	R	98.3	Very high	97.7	Very high	92 Å²	92	46.3 Å²	46.3	35%	0.347	22%	0.221	S	C	.	.	H	α-helix	trans	-60.4	-40.2	177.8	178.3	168.7	174.2	74.8	3	112.1	F409 R428 Q429 T430 I436	F409-R432 HydrophobicContact CE1-CB 4.08Å; F409-R432 HydrophobicContact CE1-CG 4.04Å; F409-R432 HydrophobicContact CE2-CG 4.43Å; F409-R432 HydrophobicContact CZ-CB 4.1Å; F409-R432 HydrophobicContact CZ-CG 3.94Å; R428-R432 WeakPolarHBondContact O-CB 3.28Å; R428-R432 PolarHBondContact O-N 3.16Å; Q429-R432 PolarHBondContact O-N 3.35Å; T430-R432 PolarHBondContact O-N 3.27Å; R432-I436 HydrophobicContact CG-CD1 3.69Å; R432-I436 HydrophobicContact CG-CG1 4.4Å; R432-I436 WeakPolarHBondContact O-CB 3.27Å; R432-I436 WeakPolarHBondContact O-CD1 3.37Å; R432-I436 WeakPolarHBondContact O-CG1 3.4Å; R432-I436 PolarHBondContact O-N 2.79Å; R432-I436 VanDerWaalsContact O-N 3.08Å
433	K	97	Very high	97.8	Very high	65 Å²	65	42.3 Å²	42.3	28%	0.283	20%	0.2	S	C	.	.	H	α-helix	trans	-62.9	-49.3	175.1	175.4	168.2	165.6	45.9	0	111.3	N209 Q429 T430 L431 V435 I436 D437	N209-K433 WeakPolarHBondContact OD1-CE 3.41Å; Q429-K433 PolarHBondContact O-N 3.43Å; T430-K433 PolarHBondContact O-N 2.84Å; L431-K433 VanDerWaalsContact C-N 3.31Å; L431-K433 PolarHBondContact O-N 3.19Å; K433-V435 PolarHBondContact O-N 3.12Å; K433-I436 PolarHBondContact O-N 3.43Å; K433-D437 WeakPolarHBondContact CE-OD2 3.41Å; K433-D437 WeakPolarHBondContact CG-OD2 3.36Å; K433-D437 IonicContact NZ-OD1 2.79Å; K433-D437 PolarHBondContact NZ-OD1 3.06Å; K433-D437 IonicContact NZ-OD2 2.7Å; K433-D437 PolarHBondContact NZ-OD2 3.19Å; K433-D437 WeakPolarHBondContact O-CB 3.18Å; K433-D437 VanDerWaalsContact O-CG 3.27Å; K433-D437 PolarHBondContact O-N 3.47Å
434	M	98.6	Very high	97.6	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.015	22%	0.216	C	C	.	.	H	α-helix	trans	-62.8	-42.2	-178.1	-66.1	-178.7	-47.5	0	0	112.1	L359 E360 A363 T430 L431 D437 M438 Y474 I478	L359-M434 HydrophobicContact CD2-CE 4.4Å; L359-M434 HydrophobicContact CG-CE 4.18Å; L359-M434 WeakPolarHBondContact O-CE 3.49Å; E360-M434 HydrophobicContact CG-CE 3.91Å; E360-M434 HydrophobicContact CG-SD 3.54Å; E360-M434 VanDerWaalsContact CG-SD 3.54Å; A363-M434 HydrophobicContact CB-CB 4.01Å; A363-M434 HydrophobicContact CB-CE 3.75Å; T430-M434 HydrophobicContact CG2-CE 4.01Å; T430-M434 HydrophobicContact CG2-SD 4.04Å; T430-M434 WeakPolarHBondContact O-CG 3.39Å; T430-M434 PolarHBondContact O-N 3.43Å; L431-M434 PolarHBondContact O-N 3.45Å; M434-D437 PolarHBondContact O-N 3.15Å; M434-M438 HydrophobicContact CB-CE 4.03Å; M434-M438 WeakPolarHBondContact O-CE 3.45Å; M434-M438 WeakPolarHBondContact O-CG 3.39Å; M434-M438 PolarHBondContact O-N 3.48Å; M434-Y474 HydrophobicContact CG-CE2 3.75Å; M434-Y474 WeakPolarHBondContact CG-OH 3.42Å; M434-Y474 HydrophobicContact SD-CE2 4.07Å; M434-I478 HydrophobicContact CB-CD1 4.01Å; M434-I478 HydrophobicContact CG-CD1 4.13Å
435	V	98.9	Very high	97.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-42.4	176.6	176.6	0	0	0	0	111.7	A363 F366 A367 I370 L405 F409 L431 K433 M438 V439	A363-V435 HydrophobicContact CB-CG2 3.95Å; F366-V435 HydrophobicContact CD1-CB 4.47Å; F366-V435 HydrophobicContact CD1-CG1 3.87Å; F366-V435 HydrophobicContact CD1-CG2 3.74Å; F366-V435 HydrophobicContact CE1-CG1 4.07Å; F366-V435 HydrophobicContact CE1-CG2 4.43Å; A367-V435 HydrophobicContact CB-CG1 4.12Å; I370-V435 HydrophobicContact CD1-CG1 3.91Å; L405-V435 HydrophobicContact CD2-CG1 3.96Å; F409-V435 HydrophobicContact CE2-CB 4Å; F409-V435 HydrophobicContact CE2-CG1 3.56Å; F409-V435 HydrophobicContact CZ-CB 3.84Å; F409-V435 HydrophobicContact CZ-CG1 3.8Å; F409-V435 HydrophobicContact CZ-CG2 4.31Å; L431-V435 HydrophobicContact CD2-CG2 3.93Å; L431-V435 HydrophobicContact CG-CG2 4.25Å; L431-V435 VanDerWaalsContact O-CG2 3.25Å; L431-V435 WeakPolarHBondContact O-CG2 3.38Å; L431-V435 PolarHBondContact O-N 3.2Å; K433-V435 PolarHBondContact O-N 3.12Å; V435-M438 PolarHBondContact O-N 3.27Å; V435-V439 HydrophobicContact CG1-CG2 4.37Å; V435-V439 PolarHBondContact O-N 3.29Å
436	I	98.6	Very high	97.3	Very high	45 Å²	45	44.3 Å²	44.3	23%	0.231	22%	0.215	C	C	.	.	H	α-helix	trans	-63	-44.4	173.6	-69	166.7	0	0	0	110.7	L405 R432 K433 M438 L440	L405-I436 HydrophobicContact CD1-CB 4.28Å; L405-I436 HydrophobicContact CD1-CG1 4.18Å; L405-I436 HydrophobicContact CD1-CG2 4.17Å; L405-I436 HydrophobicContact CD2-CB 4.49Å; L405-I436 HydrophobicContact CD2-CG1 3.98Å; R432-I436 HydrophobicContact CG-CD1 3.69Å; R432-I436 HydrophobicContact CG-CG1 4.4Å; R432-I436 WeakPolarHBondContact O-CB 3.27Å; R432-I436 WeakPolarHBondContact O-CD1 3.37Å; R432-I436 WeakPolarHBondContact O-CG1 3.4Å; R432-I436 PolarHBondContact O-N 2.79Å; R432-I436 VanDerWaalsContact O-N 3.08Å; K433-I436 PolarHBondContact O-N 3.43Å; I436-M438 PolarHBondContact O-N 3.1Å; I436-L440 HydrophobicContact CG2-CD1 3.73Å; I436-L440 HydrophobicContact CG2-CG 4.3Å; I436-L440 WeakPolarHBondContact O-CB 3.4Å; I436-L440 WeakPolarHBondContact O-CG 3.31Å; I436-L440 PolarHBondContact O-N 2.91Å; I436-L440 VanDerWaalsContact O-N 3.16Å
437	D	97.9	Very high	97.2	Very high	20 Å²	20	37.2 Å²	37.2	11%	0.107	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-31.7	177.5	-76	-30	0	0	0	111.8	K433 M434 Y474 I478 R482	K433-D437 WeakPolarHBondContact CE-OD2 3.41Å; K433-D437 WeakPolarHBondContact CG-OD2 3.36Å; K433-D437 IonicContact NZ-OD1 2.79Å; K433-D437 PolarHBondContact NZ-OD1 3.06Å; K433-D437 IonicContact NZ-OD2 2.7Å; K433-D437 PolarHBondContact NZ-OD2 3.19Å; K433-D437 WeakPolarHBondContact O-CB 3.18Å; K433-D437 VanDerWaalsContact O-CG 3.27Å; K433-D437 PolarHBondContact O-N 3.47Å; M434-D437 PolarHBondContact O-N 3.15Å; D437-Y474 PolarHBondContact OD2-OH 2.98Å; D437-I478 HydrophobicContact CB-CD1 3.91Å; D437-I478 HydrophobicContact CB-CG1 3.59Å; D437-R482 VanDerWaalsContact O-CG 3.31Å; D437-R482 WeakPolarHBondContact O-CG 3.16Å; D437-R482 PolarHBondContact O-NE 2.89Å; D437-R482 IonicContact OD1-NH2 3.18Å; D437-R482 PolarHBondContact OD1-NH2 3.03Å
438	M	98.8	Very high	96.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-85	-47.4	179.9	-76.3	-179.9	-77.2	0	0	114	A363 A364 A367 M434 V435 I436 L440 A441 I478 L481 R482 V485	A363-M438 HydrophobicContact CB-CE 3.83Å; A364-M438 HydrophobicContact CB-CE 4.29Å; A364-M438 HydrophobicContact CB-SD 3.91Å; A367-M438 HydrophobicContact CB-CB 3.91Å; A367-M438 HydrophobicContact CB-CE 4.14Å; A367-M438 HydrophobicContact CB-SD 4.36Å; M434-M438 HydrophobicContact CB-CE 4.03Å; M434-M438 WeakPolarHBondContact O-CE 3.45Å; M434-M438 WeakPolarHBondContact O-CG 3.39Å; M434-M438 PolarHBondContact O-N 3.48Å; V435-M438 PolarHBondContact O-N 3.27Å; I436-M438 PolarHBondContact O-N 3.1Å; M438-L440 PolarHBondContact O-N 3.25Å; M438-A441 WeakPolarHBondContact O-CA 3.4Å; M438-A441 VanDerWaalsContact O-CB 3.23Å; M438-A441 WeakPolarHBondContact O-CB 3.39Å; M438-A441 PolarHBondContact O-N 3.15Å; M438-I478 HydrophobicContact CE-CD1 4.49Å; M438-I478 HydrophobicContact CG-CD1 4.06Å; M438-L481 HydrophobicContact CG-CB 4.41Å; M438-L481 HydrophobicContact SD-CB 3.75Å; M438-R482 HydrophobicContact CG-CG 4.28Å; M438-V485 HydrophobicContact SD-CG2 4.04Å
439	V	98.9	Very high	96.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-70.7	-31.6	-178.7	-179.7	0	0	0	0	111.5	A367 I370 H371 E401 H404 L405 V435 A441 T442	A367-V439 HydrophobicContact CB-CG2 3.98Å; I370-V439 HydrophobicContact CG1-CG2 4.25Å; H371-V439 HydrophobicContact CB-CG1 4.24Å; H371-V439 HydrophobicContact CB-CG2 4.25Å; E401-V439 HydrophobicContact CB-CG1 4.45Å; H404-V439 HydrophobicContact CB-CG1 4.42Å; L405-V439 HydrophobicContact CD1-CB 4.01Å; L405-V439 HydrophobicContact CD1-CG1 4.3Å; L405-V439 HydrophobicContact CD2-CB 3.81Å; L405-V439 HydrophobicContact CD2-CG1 4.37Å; L405-V439 HydrophobicContact CD2-CG2 3.95Å; L405-V439 HydrophobicContact CG-CB 3.73Å; L405-V439 HydrophobicContact CG-CG1 3.84Å; L405-V439 HydrophobicContact CG-CG2 4.33Å; V435-V439 HydrophobicContact CG1-CG2 4.37Å; V435-V439 PolarHBondContact O-N 3.29Å; V439-A441 PolarHBondContact O-N 2.9Å; V439-A441 VanDerWaalsContact O-N 3.11Å; V439-T442 PolarHBondContact O-N 3.18Å; V439-T442 PolarHBondContact O-OG1 2.92Å
440	L	98.5	Very high	96.2	Very high	56 Å²	56	37.8 Å²	37.8	29%	0.293	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-1.8	169.6	-64.7	-179.8	0	0	0	113.7	E401 L405 I436 M438	E401-L440 HydrophobicContact CB-CD2 4.08Å; L405-L440 HydrophobicContact CD1-CD2 3.89Å; L405-L440 HydrophobicContact CD1-CG 3.73Å; I436-L440 HydrophobicContact CG2-CD1 3.73Å; I436-L440 HydrophobicContact CG2-CG 4.3Å; I436-L440 WeakPolarHBondContact O-CB 3.4Å; I436-L440 WeakPolarHBondContact O-CG 3.31Å; I436-L440 PolarHBondContact O-N 2.91Å; I436-L440 VanDerWaalsContact O-N 3.16Å; M438-L440 PolarHBondContact O-N 3.25Å
441	A	98.1	Very high	95.8	Very high	4 Å²	4	36.2 Å²	36.2	3%	0.033	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-20.8	173.3	0	0	0	0	0	113	M438 V439 D443 L450 R482 H486	M438-A441 WeakPolarHBondContact O-CA 3.4Å; M438-A441 VanDerWaalsContact O-CB 3.23Å; M438-A441 WeakPolarHBondContact O-CB 3.39Å; M438-A441 PolarHBondContact O-N 3.15Å; V439-A441 PolarHBondContact O-N 2.9Å; V439-A441 VanDerWaalsContact O-N 3.11Å; A441-D443 PolarHBondContact O-N 2.86Å; A441-L450 HydrophobicContact CB-CD1 3.89Å; A441-L450 HydrophobicContact CB-CD2 4.06Å; A441-L450 WeakPolarHBondContact O-CD1 3.43Å; A441-R482 HydrophobicContact CB-CB 3.96Å; A441-R482 HydrophobicContact CB-CG 3.81Å; A441-H486 PolarHBondContact O-ND1 3.42Å
442	T	98.5	Very high	95.1	Very high	10 Å²	10	38.6 Å²	38.6	6%	0.061	21%	0.21	C	C	.	.			trans	-74.5	-7.2	175	60.4	0	0	0	0	112.9	V439 M444 V485	V439-T442 PolarHBondContact O-N 3.18Å; V439-T442 PolarHBondContact O-OG1 2.92Å; T442-M444 PolarHBondContact O-N 3.01Å; T442-V485 HydrophobicContact CG2-CG1 3.94Å
443	D	98.3	Very high	94.6	Very high	10 Å²	10	36.5 Å²	36.5	5%	0.053	21%	0.205	C	C	.	.			trans	-60.1	109.9	166.2	179	-7.1	0	0	0	109.9	S398 E401 A441 S445 K446	S398-D443 WeakPolarHBondContact CB-OD2 3.41Å; S398-D443 PolarHBondContact OG-OD2 3.21Å; E401-D443 HydrophobicContact CG-CB 3.78Å; A441-D443 PolarHBondContact O-N 2.86Å; D443-S445 PolarHBondContact O-N 2.77Å; D443-S445 VanDerWaalsContact OD1-CB 3.24Å; D443-S445 WeakPolarHBondContact OD1-CB 3.49Å; D443-S445 PolarHBondContact OD1-N 2.83Å; D443-K446 HydrophobicContact CB-CG 3.89Å; D443-K446 WeakPolarHBondContact O-CA 3.33Å; D443-K446 VanDerWaalsContact O-CB 3.28Å; D443-K446 WeakPolarHBondContact O-CB 3.36Å; D443-K446 WeakPolarHBondContact O-CG 3.39Å; D443-K446 PolarHBondContact O-N 3.39Å; D443-K446 IonicContact OD2-NZ 3.6Å; D443-K446 PolarHBondContact OD2-NZ 3.05Å
444	M	94.7	Very high	94.2	Very high	84 Å²	84	33.4 Å²	33.4	41%	0.414	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-60.2	-18.6	-177.3	-65.4	-65.4	154.6	0	0	113.8	T442 K446 H447 D489 L490	T442-M444 PolarHBondContact O-N 3.01Å; M444-K446 PolarHBondContact O-N 3.46Å; M444-H447 PolarHBondContact O-N 3.01Å; M444-D489 WeakPolarHBondContact CE-OD2 3.41Å; M444-L490 HydrophobicContact CE-CD1 4.34Å; M444-L490 HydrophobicContact CE-CD2 3.78Å; M444-L490 HydrophobicContact CE-CG 3.99Å; M444-L490 HydrophobicContact SD-CD1 4.21Å; M444-L490 HydrophobicContact SD-CD2 4.08Å; M444-L490 HydrophobicContact SD-CG 4.42Å
445	S	93.7	Very high	93.6	Very high	92 Å²	92	37.5 Å²	37.5	64%	0.643	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-61.2	-19.8	168	149.7	0	0	0	0	113.1	D443	D443-S445 PolarHBondContact O-N 2.77Å; D443-S445 VanDerWaalsContact OD1-CB 3.24Å; D443-S445 WeakPolarHBondContact OD1-CB 3.49Å; D443-S445 PolarHBondContact OD1-N 2.83Å
446	K	92.4	Very high	93	Very high	57 Å²	57	41.2 Å²	41.2	25%	0.248	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-100	-12.2	-173.5	-48	-58.8	-179.5	-76.9	0	113.1	S398 D443 M444 M448 S449 L450	S398-K446 PolarHBondContact OG-NZ 2.85Å; D443-K446 HydrophobicContact CB-CG 3.89Å; D443-K446 WeakPolarHBondContact O-CA 3.33Å; D443-K446 VanDerWaalsContact O-CB 3.28Å; D443-K446 WeakPolarHBondContact O-CB 3.36Å; D443-K446 WeakPolarHBondContact O-CG 3.39Å; D443-K446 PolarHBondContact O-N 3.39Å; D443-K446 IonicContact OD2-NZ 3.6Å; D443-K446 PolarHBondContact OD2-NZ 3.05Å; M444-K446 PolarHBondContact O-N 3.46Å; K446-M448 VanDerWaalsContact C-N 3.35Å; K446-M448 PolarHBondContact O-N 2.61Å; K446-S449 WeakPolarHBondContact O-CA 3.5Å; K446-S449 WeakPolarHBondContact O-CB 3.34Å; K446-S449 PolarHBondContact O-N 3.28Å; K446-L450 PolarHBondContact O-N 2.99Å; K446-L450 VanDerWaalsContact O-N 3.15Å
447	H	94.8	Very high	92.4	Very high	5 Å²	5	39.8 Å²	39.8	2%	0.023	23%	0.225	C	C	.	.	H	α-helix	trans	-45.2	-49.5	-177.1	164.7	65.6	0	0	0	114.3	M444 S449 L450 L451 H486	M444-H447 PolarHBondContact O-N 3.01Å; H447-S449 VanDerWaalsContact C-N 3.27Å; H447-S449 PolarHBondContact O-N 3.15Å; H447-L450 WeakPolarHBondContact O-CB 3.28Å; H447-L450 PolarHBondContact O-N 3.46Å; H447-L450 VanDerWaalsContact O-N 3.1Å; H447-L451 WeakPolarHBondContact O-CB 3.47Å; H447-L451 PolarHBondContact O-N 3.23Å; H447-H486 AromaticContact CG-NE2 3.95Å; H447-H486 AromaticContact ND1-CD2 3.95Å; H447-H486 AromaticContact ND1-NE2 3.45Å; H447-H486 PolarHBondContact ND1-NE2 2.82Å
448	M	87.1	Confident	91.9	Very high	114 Å²	114	40.2 Å²	40.2	56%	0.562	23%	0.228	S	C	*	.	H	α-helix	trans	-66.4	-26.6	-179.1	-68.4	-65.8	172	0	0	113.5	K446 L451 A452 I547	K446-M448 VanDerWaalsContact C-N 3.35Å; K446-M448 PolarHBondContact O-N 2.61Å; M448-L451 HydrophobicContact SD-CD2 4.36Å; M448-A452 WeakPolarHBondContact O-CB 3.3Å; M448-A452 PolarHBondContact O-N 3.32Å; M448-A452 VanDerWaalsContact O-N 3.17Å; M448-I547 HydrophobicContact CE-CD1 4.11Å
449	S	89.4	Confident	91.4	Very high	75 Å²	75	48 Å²	48	52%	0.524	26%	0.264	S	S	.	.	H	α-helix	trans	-74.8	-37.4	172.5	-166.8	0	0	0	0	111.6	K446 H447 A452 D453	K446-S449 WeakPolarHBondContact O-CA 3.5Å; K446-S449 WeakPolarHBondContact O-CB 3.34Å; K446-S449 PolarHBondContact O-N 3.28Å; H447-S449 VanDerWaalsContact C-N 3.27Å; H447-S449 PolarHBondContact O-N 3.15Å; S449-A452 PolarHBondContact O-N 3.09Å; S449-D453 PolarHBondContact O-N 2.74Å
450	L	91.6	Very high	90.6	Very high	11 Å²	11	52.4 Å²	52.4	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-67.9	-41.2	177.3	-63.7	169.7	0	0	0	111.2	A441 K446 H447 D453 L454 R482 N483 H486	A441-L450 HydrophobicContact CB-CD1 3.89Å; A441-L450 HydrophobicContact CB-CD2 4.06Å; A441-L450 WeakPolarHBondContact O-CD1 3.43Å; K446-L450 PolarHBondContact O-N 2.99Å; K446-L450 VanDerWaalsContact O-N 3.15Å; H447-L450 WeakPolarHBondContact O-CB 3.28Å; H447-L450 PolarHBondContact O-N 3.46Å; H447-L450 VanDerWaalsContact O-N 3.1Å; L450-D453 PolarHBondContact O-N 3.5Å; L450-L454 VanDerWaalsContact O-CB 3.3Å; L450-L454 WeakPolarHBondContact O-CB 3.27Å; L450-L454 PolarHBondContact O-N 3.06Å; L450-R482 HydrophobicContact CD2-CB 4.19Å; L450-N483 PolarHBondContact O-ND2 2.91Å; L450-N483 PolarHBondContact O-OD1 3.22Å; L450-H486 HydrophobicContact CD1-CB 4.38Å
451	L	88.5	Confident	89.9	Confident	16 Å²	16	53.1 Å²	53.1	8%	0.084	29%	0.293	C	S	.	.	H	α-helix	trans	-63.6	-40	174.7	-176.4	57.9	0	0	0	112.3	H447 M448 L454 K455 P550 T554	H447-L451 WeakPolarHBondContact O-CB 3.47Å; H447-L451 PolarHBondContact O-N 3.23Å; M448-L451 HydrophobicContact SD-CD2 4.36Å; L451-L454 PolarHBondContact O-N 2.94Å; L451-K455 WeakPolarHBondContact O-CG 3.42Å; L451-K455 PolarHBondContact O-N 2.92Å; L451-P550 WeakPolarHBondContact CD1-O 3.41Å; L451-P550 HydrophobicContact CD2-CB 4.16Å; L451-T554 HydrophobicContact CD1-CG2 4.38Å; L451-T554 WeakPolarHBondContact CD1-OG1 3.4Å
452	A	85.4	Confident	89.2	Confident	51 Å²	51	58.3 Å²	58.3	42%	0.421	31%	0.314	S	S	.	.	H	α-helix	trans	-66.9	-43.1	175.1	0	0	0	0	0	112.5	M448 S449 L454 T456	M448-A452 WeakPolarHBondContact O-CB 3.3Å; M448-A452 PolarHBondContact O-N 3.32Å; M448-A452 VanDerWaalsContact O-N 3.17Å; S449-A452 PolarHBondContact O-N 3.09Å; A452-L454 VanDerWaalsContact C-N 3.31Å; A452-L454 PolarHBondContact O-N 3.36Å; A452-T456 WeakPolarHBondContact O-CB 3.36Å; A452-T456 PolarHBondContact O-N 3.21Å; A452-T456 PolarHBondContact O-OG1 3Å
453	D	86.3	Confident	88.6	Confident	48 Å²	48	61.1 Å²	61.1	26%	0.257	33%	0.331	S	S	.	.	H	α-helix	trans	-59	-43.1	171.9	-85.2	10.5	0	0	0	111	S449 L450 T456 M457 Q479	S449-D453 PolarHBondContact O-N 2.74Å; L450-D453 PolarHBondContact O-N 3.5Å; D453-T456 PolarHBondContact O-N 3.25Å; D453-M457 PolarHBondContact O-N 3.17Å; D453-Q479 PolarHBondContact OD2-NE2 3.1Å
454	L	89.5	Confident	87.9	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.005	34%	0.341	C	S	.	.	H	α-helix	trans	-67.9	-44.6	-179.2	-167.2	67.3	0	0	0	112	L450 L451 A452 M457 V458 N483 L551 T554 W555 L558	L450-L454 VanDerWaalsContact O-CB 3.3Å; L450-L454 WeakPolarHBondContact O-CB 3.27Å; L450-L454 PolarHBondContact O-N 3.06Å; L451-L454 PolarHBondContact O-N 2.94Å; A452-L454 VanDerWaalsContact C-N 3.31Å; A452-L454 PolarHBondContact O-N 3.36Å; L454-M457 WeakPolarHBondContact O-CA 3.35Å; L454-M457 WeakPolarHBondContact O-CB 3.37Å; L454-M457 PolarHBondContact O-N 2.99Å; L454-M457 VanDerWaalsContact O-N 3.1Å; L454-V458 WeakPolarHBondContact O-CG2 3.33Å; L454-V458 PolarHBondContact O-N 2.94Å; L454-N483 HydrophobicContact CD1-CB 3.92Å; L454-N483 HydrophobicContact CD2-CB 4.27Å; L454-L551 HydrophobicContact CD2-CD1 4.3Å; L454-T554 HydrophobicContact CB-CG2 4.1Å; L454-T554 HydrophobicContact CD2-CG2 3.79Å; L454-T554 HydrophobicContact CG-CG2 3.72Å; L454-W555 HydrophobicContact CD2-CB 4.49Å; L454-L558 HydrophobicContact CD1-CD2 3.85Å
455	K	86.2	Confident	87.2	Confident	89 Å²	89	65.4 Å²	65.4	39%	0.387	37%	0.368	S	S	.	.	H	α-helix	trans	-60.6	-45.4	174.3	-74.9	-169	175.3	-160.9	0	111.7	L451 M457 V458 E459 T554	L451-K455 WeakPolarHBondContact O-CG 3.42Å; L451-K455 PolarHBondContact O-N 2.92Å; K455-M457 PolarHBondContact O-N 2.93Å; K455-V458 PolarHBondContact O-N 3Å; K455-V458 VanDerWaalsContact O-N 3.12Å; K455-E459 WeakPolarHBondContact O-CG 3.21Å; K455-E459 PolarHBondContact O-N 3Å; K455-T554 HydrophobicContact CB-CG2 4.31Å; K455-T554 WeakPolarHBondContact CE-OG1 3.43Å; K455-T554 HydrophobicContact CG-CG2 3.44Å; K455-T554 VanDerWaalsContact CG-CG2 3.44Å
456	T	85.4	Confident	86.7	Confident	78 Å²	78	65.4 Å²	65.4	48%	0.479	37%	0.369	S	S	.	.	H	α-helix	trans	-56.9	-36.7	173.7	-52.9	0	0	0	0	111.9	A452 D453 T460	A452-T456 WeakPolarHBondContact O-CB 3.36Å; A452-T456 PolarHBondContact O-N 3.21Å; A452-T456 PolarHBondContact O-OG1 3Å; D453-T456 PolarHBondContact O-N 3.25Å; T456-T460 WeakPolarHBondContact O-CB 3.26Å; T456-T460 WeakPolarHBondContact O-CG2 3.49Å; T456-T460 PolarHBondContact O-N 3.38Å; T456-T460 PolarHBondContact O-OG1 3.42Å
457	M	87.1	Confident	86.3	Confident	15 Å²	15	64.5 Å²	64.5	7%	0.074	38%	0.375	C	S	.	.	H	α-helix	trans	-73.3	-38.5	176.7	-168.6	175.4	-60.9	0	0	113	D453 L454 K455 T460 K461 L471 D476 Q479 V480 L558	D453-M457 PolarHBondContact O-N 3.17Å; L454-M457 WeakPolarHBondContact O-CA 3.35Å; L454-M457 WeakPolarHBondContact O-CB 3.37Å; L454-M457 PolarHBondContact O-N 2.99Å; L454-M457 VanDerWaalsContact O-N 3.1Å; K455-M457 PolarHBondContact O-N 2.93Å; M457-T460 CarbonylContact O-C 3.52Å; M457-T460 PolarHBondContact O-N 2.9Å; M457-K461 WeakPolarHBondContact O-CA 3.43Å; M457-K461 WeakPolarHBondContact O-CB 3.4Å; M457-K461 PolarHBondContact O-N 3.03Å; M457-L471 HydrophobicContact SD-CD2 4.04Å; M457-D476 HydrophobicContact CE-CB 4.11Å; M457-D476 WeakPolarHBondContact CE-O 3.28Å; M457-Q479 HydrophobicContact CE-CB 3.54Å; M457-V480 HydrophobicContact CE-CG2 4.04Å; M457-V480 HydrophobicContact SD-CG2 3.28Å; M457-V480 WeakPolarHBondContact SD-CG2 3.29Å; M457-L558 HydrophobicContact CG-CD1 4.24Å; M457-L558 HydrophobicContact SD-CD1 4.49Å; M457-L558 HydrophobicContact SD-CD2 4.5Å
458	V	87.4	Confident	86	Confident	28 Å²	28	65.6 Å²	65.6	17%	0.17	38%	0.382	C	S	.	.	H	α-helix	trans	-59.2	-48.5	173.2	169	0	0	0	0	110.5	L454 K455 T460 K461 T554 D557 L558	L454-V458 WeakPolarHBondContact O-CG2 3.33Å; L454-V458 PolarHBondContact O-N 2.94Å; K455-V458 PolarHBondContact O-N 3Å; K455-V458 VanDerWaalsContact O-N 3.12Å; V458-T460 PolarHBondContact O-N 2.94Å; V458-K461 VanDerWaalsContact O-CG 3.31Å; V458-K461 WeakPolarHBondContact O-CG 3.26Å; V458-K461 PolarHBondContact O-N 2.88Å; V458-T554 HydrophobicContact CG2-CG2 3.94Å; V458-T554 WeakPolarHBondContact CG2-O 3.33Å; V458-D557 HydrophobicContact CG1-CB 3.89Å; V458-D557 HydrophobicContact CG2-CB 4.23Å; V458-L558 HydrophobicContact CG2-CB 3.89Å; V458-L558 HydrophobicContact CG2-CD1 4.24Å
459	E	86.6	Confident	86	Confident	163 Å²	163	60.3 Å²	60.3	76%	0.762	36%	0.356	S	S	*	.	H	α-helix	trans	-61.1	-31.8	178.5	-71.3	174.1	-167.7	0	0	113.2	K455	K455-E459 WeakPolarHBondContact O-CG 3.21Å; K455-E459 PolarHBondContact O-N 3Å
460	T	83.1	Confident	85.8	Confident	94 Å²	94	60.5 Å²	60.5	58%	0.577	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	7.4	-177.6	58.9	0	0	0	0	114	T456 M457 V458 K462	T456-T460 WeakPolarHBondContact O-CB 3.26Å; T456-T460 WeakPolarHBondContact O-CG2 3.49Å; T456-T460 PolarHBondContact O-N 3.38Å; T456-T460 PolarHBondContact O-OG1 3.42Å; M457-T460 CarbonylContact O-C 3.52Å; M457-T460 PolarHBondContact O-N 2.9Å; V458-T460 PolarHBondContact O-N 2.94Å; T460-K462 PolarHBondContact O-N 2.86Å
461	K	83.4	Confident	85.6	Confident	71 Å²	71	60.8 Å²	60.8	31%	0.309	35%	0.352	S	S	.	.			trans	-62.7	130.8	-169.8	77.2	-176.1	-175.7	170	0	112.5	M457 V458 V463 L469 D557 L558	M457-K461 WeakPolarHBondContact O-CA 3.43Å; M457-K461 WeakPolarHBondContact O-CB 3.4Å; M457-K461 PolarHBondContact O-N 3.03Å; V458-K461 VanDerWaalsContact O-CG 3.31Å; V458-K461 WeakPolarHBondContact O-CG 3.26Å; V458-K461 PolarHBondContact O-N 2.88Å; K461-V463 HydrophobicContact CD-CG2 4.48Å; K461-V463 HydrophobicContact CG-CG2 4.25Å; K461-L469 HydrophobicContact CB-CD1 3.95Å; K461-D557 PolarHBondContact NZ-O 3.13Å; K461-L558 HydrophobicContact CB-CD1 4.38Å; K461-L558 HydrophobicContact CD-CD1 4.44Å
462	K	83.1	Confident	85.2	Confident	112 Å²	112	65.1 Å²	65.1	49%	0.487	38%	0.376	S	S	.	.			trans	-102.7	128.2	172.5	-62.1	173.9	-158.2	168.1	0	108.3	T460 L470 D472	T460-K462 PolarHBondContact O-N 2.86Å; K462-L470 HydrophobicContact CB-CB 3.94Å; K462-L470 HydrophobicContact CB-CD1 4.38Å; K462-L470 PolarHBondContact O-N 3.3Å; K462-D472 IonicContact NZ-OD2 3.71Å; K462-D472 PolarHBondContact NZ-OD2 3.36Å
463	V	85.6	Confident	85.2	Confident	69 Å²	69	66.1 Å²	66.1	42%	0.418	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-121.7	140	-178.8	-170.8	0	0	0	0	109.1	K461 G467 V468	K461-V463 HydrophobicContact CD-CG2 4.48Å; K461-V463 HydrophobicContact CG-CG2 4.25Å; V463-G467 WeakPolarHBondContact CG1-O 3.44Å; V463-V468 CarbonylContact C-O 3.57Å; V463-V468 WeakPolarHBondContact CA-O 3.3Å
464	T	84.4	Confident	85.3	Confident	43 Å²	43	66.5 Å²	66.5	26%	0.264	37%	0.372	S	S	.	.			trans	-68.8	168.2	174.5	66.7	0	0	0	0	111.5	S466 G467 V468 L470	T464-S466 PolarHBondContact O-N 3.16Å; T464-S466 PolarHBondContact OG1-N 2.82Å; T464-S466 VanDerWaalsContact OG1-N 3.08Å; T464-S466 PolarHBondContact OG1-OG 3.34Å; T464-G467 PolarHBondContact O-N 2.98Å; T464-G467 VanDerWaalsContact O-N 3.13Å; T464-G467 PolarHBondContact OG1-N 3.22Å; T464-V468 HydrophobicContact CG2-CB 4.3Å; T464-V468 PolarHBondContact N-O 2.98Å; T464-V468 PolarHBondContact OG1-N 3.19Å; T464-V468 VanDerWaalsContact OG1-N 3.07Å; T464-V468 PolarHBondContact OG1-O 3.02Å; T464-L470 HydrophobicContact CG2-CD1 4.07Å; T464-L470 HydrophobicContact CG2-CD2 3.67Å; T464-L470 HydrophobicContact CG2-CG 3.75Å
465	S	80.3	Confident	85.1	Confident	141 Å²	141	70 Å²	70	99%	0.986	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	1.6	166.9	60.3	0	0	0	0	114.5
466	S	82.3	Confident	85.2	Confident	93 Å²	93	67.5 Å²	67.5	65%	0.65	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	8.8	174.7	67.9	0	0	0	0	113.4	T464	T464-S466 PolarHBondContact O-N 3.16Å; T464-S466 PolarHBondContact OG1-N 2.82Å; T464-S466 VanDerWaalsContact OG1-N 3.08Å; T464-S466 PolarHBondContact OG1-OG 3.34Å
467	G	84	Confident	85.7	Confident	37 Å²	37	65.7 Å²	65.7	38%	0.381	37%	0.369	S	S	.	.	S	Bend	trans	85.1	1.9	179	0	0	0	0	0	115.6	V463 T464	V463-G467 WeakPolarHBondContact CG1-O 3.44Å; T464-G467 PolarHBondContact O-N 2.98Å; T464-G467 VanDerWaalsContact O-N 3.13Å; T464-G467 PolarHBondContact OG1-N 3.22Å
468	V	89.1	Confident	86.1	Confident	28 Å²	28	65.3 Å²	65.3	17%	0.17	37%	0.367	C	S	.	.			trans	-88.5	139.3	-175.9	177.7	0	0	0	0	111.1	T351 D353 V355 V463 T464	T351-V468 WeakPolarHBondContact O-CA 3.38Å; D353-V468 WeakPolarHBondContact O-CG1 3.35Å; V355-V468 HydrophobicContact CG2-CG1 3.56Å; V463-V468 CarbonylContact C-O 3.57Å; V463-V468 WeakPolarHBondContact CA-O 3.3Å; T464-V468 HydrophobicContact CG2-CB 4.3Å; T464-V468 PolarHBondContact N-O 2.98Å; T464-V468 PolarHBondContact OG1-N 3.19Å; T464-V468 VanDerWaalsContact OG1-N 3.07Å; T464-V468 PolarHBondContact OG1-O 3.02Å
469	L	87.7	Confident	86.4	Confident	3 Å²	3	65.7 Å²	65.7	2%	0.016	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-72.2	129.2	-179.9	-173.7	65.4	0	0	0	112.1	T351 L352 V355 K461 L471 V480 L558	T351-L469 HydrophobicContact CG2-CB 4.13Å; T351-L469 WeakPolarHBondContact O-CB 3.47Å; T351-L469 PolarHBondContact O-N 3.39Å; L352-L469 HydrophobicContact CD2-CB 4.17Å; L352-L469 HydrophobicContact CD2-CD2 3.73Å; V355-L469 VanDerWaalsContact CG2-O 3.27Å; V355-L469 WeakPolarHBondContact CG2-O 3.49Å; K461-L469 HydrophobicContact CB-CD1 3.95Å; L469-L471 HydrophobicContact CD2-CD1 4.32Å; L469-L471 HydrophobicContact CD2-CD2 3.79Å; L469-L471 HydrophobicContact CD2-CG 4.13Å; L469-L471 HydrophobicContact CG-CD2 3.86Å; L469-L471 HydrophobicContact CG-CG 4.12Å; L469-V480 HydrophobicContact CD2-CG2 4.47Å; L469-L558 HydrophobicContact CD1-CD1 4.11Å; L469-L558 HydrophobicContact CD2-CD1 3.93Å; L469-L558 HydrophobicContact CD2-CD2 4.19Å; L469-L558 HydrophobicContact CD2-CG 4.04Å
470	L	85.8	Confident	86.9	Confident	80 Å²	80	57.9 Å²	57.9	42%	0.419	33%	0.33	S	S	.	.			trans	-96	104.3	177.1	-70.7	173.2	0	0	0	111.1	K462 T464	K462-L470 HydrophobicContact CB-CB 3.94Å; K462-L470 HydrophobicContact CB-CD1 4.38Å; K462-L470 PolarHBondContact O-N 3.3Å; T464-L470 HydrophobicContact CG2-CD1 4.07Å; T464-L470 HydrophobicContact CG2-CD2 3.67Å; T464-L470 HydrophobicContact CG2-CG 3.75Å
471	L	87.6	Confident	87.6	Confident	16 Å²	16	53.5 Å²	53.5	8%	0.084	30%	0.303	C	S	.	.			trans	-103.3	95	174.8	-56.7	-179.1	0	0	0	109.9	V355 F356 M457 L469 N473 D476 R477 V480	V355-L471 HydrophobicContact CG1-CB 4.29Å; V355-L471 HydrophobicContact CG1-CD1 3.7Å; V355-L471 HydrophobicContact CG1-CG 4.02Å; F356-L471 HydrophobicContact CE1-CD1 4.09Å; F356-L471 HydrophobicContact CZ-CD1 4.02Å; M457-L471 HydrophobicContact SD-CD2 4.04Å; L469-L471 HydrophobicContact CD2-CD1 4.32Å; L469-L471 HydrophobicContact CD2-CD2 3.79Å; L469-L471 HydrophobicContact CD2-CG 4.13Å; L469-L471 HydrophobicContact CG-CD2 3.86Å; L469-L471 HydrophobicContact CG-CG 4.12Å; L471-N473 PolarHBondContact O-N 2.91Å; L471-D476 HydrophobicContact CB-CB 4.28Å; L471-D476 HydrophobicContact CD2-CB 3.96Å; L471-R477 HydrophobicContact CB-CG 3.57Å; L471-R477 HydrophobicContact CD1-CG 4.19Å; L471-V480 HydrophobicContact CD1-CB 4.12Å; L471-V480 HydrophobicContact CD1-CG2 3.66Å; L471-V480 HydrophobicContact CD2-CG2 4.05Å
472	D	79.1	Confident	88.4	Confident	107 Å²	107	53 Å²	53	57%	0.572	30%	0.3	S	S	*	.			trans	-70.3	-28.4	-168	-73.4	-40.2	0	0	0	113.8	K462 D476	K462-D472 IonicContact NZ-OD2 3.71Å; K462-D472 PolarHBondContact NZ-OD2 3.36Å; D472-D476 PolarHBondContact N-OD2 3.47Å
473	N	85.5	Confident	89.1	Confident	72 Å²	72	47.7 Å²	47.7	39%	0.385	28%	0.277	S	S	.	.	S	Bend	trans	-141.2	170.5	-174.8	82.6	90.3	0	0	0	114.4	L471 T475 D476 R477	L471-N473 PolarHBondContact O-N 2.91Å; N473-T475 PolarHBondContact O-N 2.67Å; N473-T475 WeakPolarHBondContact OD1-CB 3.48Å; N473-T475 PolarHBondContact OD1-N 2.81Å; N473-T475 PolarHBondContact OD1-OG1 3.49Å; N473-D476 PolarHBondContact N-OD2 3.05Å; N473-D476 PolarHBondContact ND2-OD1 3.1Å; N473-D476 PolarHBondContact ND2-OD2 3.06Å; N473-D476 PolarHBondContact O-N 2.87Å; N473-R477 WeakPolarHBondContact O-CD 3.38Å; N473-R477 WeakPolarHBondContact O-CG 3.31Å; N473-R477 PolarHBondContact O-N 3.1Å
474	Y	87.6	Confident	89.7	Confident	57 Å²	57	44.4 Å²	44.4	22%	0.224	26%	0.257	C	S	.	.	H	α-helix	trans	-55.5	-36	-177.1	178.3	-91.9	0	0	0	113.7	M434 D437 R477 I478	M434-Y474 HydrophobicContact CG-CE2 3.75Å; M434-Y474 WeakPolarHBondContact CG-OH 3.42Å; M434-Y474 HydrophobicContact SD-CE2 4.07Å; D437-Y474 PolarHBondContact OD2-OH 2.98Å; Y474-R477 PolarHBondContact O-N 3.23Å; Y474-I478 HydrophobicContact CD1-CG2 4.11Å; Y474-I478 HydrophobicContact CE1-CB 3.98Å; Y474-I478 HydrophobicContact CE1-CG1 4.41Å; Y474-I478 HydrophobicContact CE1-CG2 3.67Å; Y474-I478 WeakPolarHBondContact O-CG2 3.33Å; Y474-I478 PolarHBondContact O-N 2.89Å
475	T	86.9	Confident	90.4	Very high	73 Å²	73	42.4 Å²	42.4	45%	0.448	24%	0.244	S	C	.	.	H	α-helix	trans	-64.9	-53	-175	-41	0	0	0	0	110.4	N473 R477 I478 Q479	N473-T475 PolarHBondContact O-N 2.67Å; N473-T475 WeakPolarHBondContact OD1-CB 3.48Å; N473-T475 PolarHBondContact OD1-N 2.81Å; N473-T475 PolarHBondContact OD1-OG1 3.49Å; T475-R477 VanDerWaalsContact C-N 3.28Å; T475-R477 PolarHBondContact O-N 3.28Å; T475-I478 WeakPolarHBondContact O-CG2 3.44Å; T475-I478 PolarHBondContact O-N 3.38Å; T475-Q479 WeakPolarHBondContact O-CB 3.31Å; T475-Q479 WeakPolarHBondContact O-CG 3.12Å; T475-Q479 PolarHBondContact O-N 3.47Å
476	D	88.4	Confident	91.2	Very high	37 Å²	37	35.7 Å²	35.7	20%	0.198	20%	0.197	C	C	.	.	H	α-helix	trans	-57.5	-44.9	176.8	-23.2	-32.9	0	0	0	110.1	M457 L471 D472 N473 Q479 V480	M457-D476 HydrophobicContact CE-CB 4.11Å; M457-D476 WeakPolarHBondContact CE-O 3.28Å; L471-D476 HydrophobicContact CB-CB 4.28Å; L471-D476 HydrophobicContact CD2-CB 3.96Å; D472-D476 PolarHBondContact N-OD2 3.47Å; N473-D476 PolarHBondContact N-OD2 3.05Å; N473-D476 PolarHBondContact ND2-OD1 3.1Å; N473-D476 PolarHBondContact ND2-OD2 3.06Å; N473-D476 PolarHBondContact O-N 2.87Å; D476-Q479 PolarHBondContact O-N 2.9Å; D476-V480 PolarHBondContact O-N 3.5Å
477	R	94.7	Very high	92	Very high	41 Å²	41	31.2 Å²	31.2	16%	0.155	17%	0.166	C	C	.	.	H	α-helix	trans	-63.2	-45.8	-178.9	-63.9	167.5	75.8	79.5	3	112.3	V355 E360 L471 N473 Y474 T475 L481	V355-R477 PolarHBondContact O-NH1 2.87Å; V355-R477 PolarHBondContact O-NH2 3.17Å; E360-R477 VanDerWaalsContact CD-NH2 3.29Å; E360-R477 IonicContact OE1-CZ 3.78Å; E360-R477 IonicContact OE1-NE 2.64Å; E360-R477 PolarHBondContact OE1-NE 3.39Å; E360-R477 IonicContact OE1-NH2 3.85Å; E360-R477 PolarHBondContact OE1-NH2 2.92Å; E360-R477 VanDerWaalsContact OE1-NH2 3.11Å; E360-R477 IonicContact OE2-CZ 3.2Å; E360-R477 IonicContact OE2-NE 2.63Å; E360-R477 IonicContact OE2-NH2 3.54Å; E360-R477 PolarHBondContact OE2-NH2 3.37Å; L471-R477 HydrophobicContact CB-CG 3.57Å; L471-R477 HydrophobicContact CD1-CG 4.19Å; N473-R477 WeakPolarHBondContact O-CD 3.38Å; N473-R477 WeakPolarHBondContact O-CG 3.31Å; N473-R477 PolarHBondContact O-N 3.1Å; Y474-R477 PolarHBondContact O-N 3.23Å; T475-R477 VanDerWaalsContact C-N 3.28Å; T475-R477 PolarHBondContact O-N 3.28Å; R477-L481 VanDerWaalsContact O-CG 3.28Å; R477-L481 WeakPolarHBondContact O-CG 3.42Å; R477-L481 PolarHBondContact O-N 3.07Å; R477-L481 VanDerWaalsContact O-N 3.09Å
478	I	95.8	Very high	92.7	Very high	6 Å²	6	29.5 Å²	29.5	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-74.3	-27.8	178.2	-161.2	58.3	0	0	0	112.3	M434 D437 M438 Y474 T475 L481 R482	M434-I478 HydrophobicContact CB-CD1 4.01Å; M434-I478 HydrophobicContact CG-CD1 4.13Å; D437-I478 HydrophobicContact CB-CD1 3.91Å; D437-I478 HydrophobicContact CB-CG1 3.59Å; M438-I478 HydrophobicContact CE-CD1 4.49Å; M438-I478 HydrophobicContact CG-CD1 4.06Å; Y474-I478 HydrophobicContact CD1-CG2 4.11Å; Y474-I478 HydrophobicContact CE1-CB 3.98Å; Y474-I478 HydrophobicContact CE1-CG1 4.41Å; Y474-I478 HydrophobicContact CE1-CG2 3.67Å; Y474-I478 WeakPolarHBondContact O-CG2 3.33Å; Y474-I478 PolarHBondContact O-N 2.89Å; T475-I478 WeakPolarHBondContact O-CG2 3.44Å; T475-I478 PolarHBondContact O-N 3.38Å; I478-L481 HydrophobicContact CD1-CB 4.37Å; I478-L481 PolarHBondContact O-N 2.82Å; I478-R482 HydrophobicContact CG1-CG 4.46Å; I478-R482 VanDerWaalsContact O-CB 3.29Å; I478-R482 WeakPolarHBondContact O-CB 3.47Å; I478-R482 WeakPolarHBondContact O-CD 3.46Å; I478-R482 WeakPolarHBondContact O-CG 3.49Å; I478-R482 PolarHBondContact O-N 3.08Å
479	Q	93.9	Very high	93.2	Very high	36 Å²	36	28.8 Å²	28.8	17%	0.168	14%	0.143	C	C	.	.	H	α-helix	trans	-65.4	-42.4	171.9	-82.2	172.4	-38.5	0	0	112.1	D453 M457 T475 D476 N483	D453-Q479 PolarHBondContact OD2-NE2 3.1Å; M457-Q479 HydrophobicContact CE-CB 3.54Å; T475-Q479 WeakPolarHBondContact O-CB 3.31Å; T475-Q479 WeakPolarHBondContact O-CG 3.12Å; T475-Q479 PolarHBondContact O-N 3.47Å; D476-Q479 PolarHBondContact O-N 2.9Å; Q479-N483 PolarHBondContact O-N 3.01Å; Q479-N483 VanDerWaalsContact O-N 3.12Å; Q479-N483 PolarHBondContact O-ND2 3.24Å
480	V	96.9	Very high	93.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.7	-46.7	172.4	-180	0	0	0	0	110.9	F356 M457 L469 L471 D476 R482 N483 M484 W555 L558	F356-V480 HydrophobicContact CZ-CB 4.13Å; F356-V480 HydrophobicContact CZ-CG1 3.81Å; M457-V480 HydrophobicContact CE-CG2 4.04Å; M457-V480 HydrophobicContact SD-CG2 3.28Å; M457-V480 WeakPolarHBondContact SD-CG2 3.29Å; L469-V480 HydrophobicContact CD2-CG2 4.47Å; L471-V480 HydrophobicContact CD1-CB 4.12Å; L471-V480 HydrophobicContact CD1-CG2 3.66Å; L471-V480 HydrophobicContact CD2-CG2 4.05Å; D476-V480 PolarHBondContact O-N 3.5Å; V480-R482 PolarHBondContact O-N 2.84Å; V480-N483 PolarHBondContact O-N 3.12Å; V480-M484 VanDerWaalsContact O-CB 3.31Å; V480-M484 WeakPolarHBondContact O-CB 3.5Å; V480-M484 PolarHBondContact O-N 2.72Å; V480-W555 HydrophobicContact CG1-CH2 4.06Å; V480-W555 HydrophobicContact CG1-CZ3 4.09Å; V480-L558 HydrophobicContact CG1-CD2 4.44Å; V480-L558 HydrophobicContact CG2-CD2 4.12Å
481	L	98.5	Very high	94.3	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-65.6	-36	-177.9	-67.5	170	0	0	0	113	L347 F356 E360 A364 M438 R477 I478 M484 V485	L347-L481 HydrophobicContact CD2-CD2 4.09Å; F356-L481 HydrophobicContact CD1-CD1 3.97Å; F356-L481 HydrophobicContact CD1-CD2 3.83Å; F356-L481 HydrophobicContact CD1-CG 4.01Å; F356-L481 HydrophobicContact CD2-CD2 4.28Å; F356-L481 HydrophobicContact CE1-CD1 3.94Å; F356-L481 HydrophobicContact CE1-CD2 3.65Å; F356-L481 HydrophobicContact CE1-CG 3.58Å; F356-L481 HydrophobicContact CE2-CD2 4.11Å; F356-L481 HydrophobicContact CG-CD2 4.15Å; F356-L481 HydrophobicContact CZ-CD2 3.8Å; F356-L481 HydrophobicContact CZ-CG 4.03Å; E360-L481 HydrophobicContact CB-CD1 3.92Å; E360-L481 HydrophobicContact CG-CD1 4.14Å; A364-L481 HydrophobicContact CB-CD2 4.19Å; M438-L481 HydrophobicContact CG-CB 4.41Å; M438-L481 HydrophobicContact SD-CB 3.75Å; R477-L481 VanDerWaalsContact O-CG 3.28Å; R477-L481 WeakPolarHBondContact O-CG 3.42Å; R477-L481 PolarHBondContact O-N 3.07Å; R477-L481 VanDerWaalsContact O-N 3.09Å; I478-L481 HydrophobicContact CD1-CB 4.37Å; I478-L481 PolarHBondContact O-N 2.82Å; L481-M484 PolarHBondContact O-N 3.4Å; L481-V485 PolarHBondContact O-N 2.83Å; L481-V485 VanDerWaalsContact O-N 3.15Å
482	R	98.2	Very high	94.9	Very high	62 Å²	62	25.1 Å²	25.1	23%	0.234	12%	0.124	C	C	.	.	H	α-helix	trans	-59.1	-54.6	169.7	-79.5	168.9	168.6	174.4	-0.9	111.6	D437 M438 A441 L450 I478 V480 M484 V485 H486	D437-R482 VanDerWaalsContact O-CG 3.31Å; D437-R482 WeakPolarHBondContact O-CG 3.16Å; D437-R482 PolarHBondContact O-NE 2.89Å; D437-R482 IonicContact OD1-NH2 3.18Å; D437-R482 PolarHBondContact OD1-NH2 3.03Å; M438-R482 HydrophobicContact CG-CG 4.28Å; A441-R482 HydrophobicContact CB-CB 3.96Å; A441-R482 HydrophobicContact CB-CG 3.81Å; L450-R482 HydrophobicContact CD2-CB 4.19Å; I478-R482 HydrophobicContact CG1-CG 4.46Å; I478-R482 VanDerWaalsContact O-CB 3.29Å; I478-R482 WeakPolarHBondContact O-CB 3.47Å; I478-R482 WeakPolarHBondContact O-CD 3.46Å; I478-R482 WeakPolarHBondContact O-CG 3.49Å; I478-R482 PolarHBondContact O-N 3.08Å; V480-R482 PolarHBondContact O-N 2.84Å; R482-M484 VanDerWaalsContact C-N 3.27Å; R482-M484 PolarHBondContact O-N 2.73Å; R482-V485 PolarHBondContact O-N 3.5Å; R482-H486 WeakPolarHBondContact O-CB 3.35Å; R482-H486 PolarHBondContact O-N 2.84Å
483	N	98.1	Very high	95.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62.9	-34.8	179.6	-81.6	-77.5	0	0	0	111.8	L450 L454 Q479 V480 H486 C487 W555	L450-N483 PolarHBondContact O-ND2 2.91Å; L450-N483 PolarHBondContact O-OD1 3.22Å; L454-N483 HydrophobicContact CD1-CB 3.92Å; L454-N483 HydrophobicContact CD2-CB 4.27Å; Q479-N483 PolarHBondContact O-N 3.01Å; Q479-N483 VanDerWaalsContact O-N 3.12Å; Q479-N483 PolarHBondContact O-ND2 3.24Å; V480-N483 PolarHBondContact O-N 3.12Å; N483-H486 PolarHBondContact O-N 2.84Å; N483-C487 WeakPolarHBondContact O-CB 3.41Å; N483-C487 PolarHBondContact O-N 3.05Å; N483-C487 PolarHBondContact O-SG 3.3Å; N483-W555 HydrophobicContact CB-CE3 4.49Å; N483-W555 HydrophobicContact CB-CZ3 4.4Å
484	M	98.6	Very high	96.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-61.9	-46.4	176.6	-174.7	-176.6	-76.5	0	0	112.3	T343 L346 L347 L352 F356 V480 L481 R482 C487 A488 W555	T343-M484 HydrophobicContact CG2-SD 4.49Å; L346-M484 HydrophobicContact CB-CE 4.16Å; L346-M484 HydrophobicContact CB-CG 3.6Å; L346-M484 HydrophobicContact CB-SD 3.91Å; L346-M484 HydrophobicContact CD1-CG 3.89Å; L346-M484 HydrophobicContact CG-CG 4.42Å; L346-M484 WeakPolarHBondContact O-CE 3.3Å; L347-M484 HydrophobicContact CB-SD 4.46Å; L347-M484 HydrophobicContact CD2-CE 4.01Å; L347-M484 HydrophobicContact CD2-SD 3.52Å; L347-M484 VanDerWaalsContact CD2-SD 3.52Å; L347-M484 HydrophobicContact CG-CE 4.4Å; L347-M484 HydrophobicContact CG-SD 3.55Å; L347-M484 VanDerWaalsContact CG-SD 3.55Å; L352-M484 HydrophobicContact CD1-CE 3.46Å; L352-M484 VanDerWaalsContact CD1-CE 3.46Å; F356-M484 HydrophobicContact CE2-CE 4.16Å; V480-M484 VanDerWaalsContact O-CB 3.31Å; V480-M484 WeakPolarHBondContact O-CB 3.5Å; V480-M484 PolarHBondContact O-N 2.72Å; L481-M484 PolarHBondContact O-N 3.4Å; R482-M484 VanDerWaalsContact C-N 3.27Å; R482-M484 PolarHBondContact O-N 2.73Å; M484-C487 PolarHBondContact O-N 3.43Å; M484-A488 WeakPolarHBondContact O-CB 3.44Å; M484-A488 PolarHBondContact O-N 3.18Å; M484-W555 HydrophobicContact CB-CH2 3.68Å; M484-W555 HydrophobicContact CB-CZ3 3.98Å; M484-W555 HydrophobicContact CE-CH2 3.73Å; M484-W555 HydrophobicContact CE-CZ2 4.15Å; M484-W555 HydrophobicContact CG-CH2 3.92Å; M484-W555 HydrophobicContact CG-CZ2 4.36Å
485	V	98.8	Very high	97	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-68	-38.3	175.6	178.1	0	0	0	0	110.5	T343 M438 T442 L481 R482 C487 A488 D489	T343-V485 HydrophobicContact CG2-CG2 4.21Å; M438-V485 HydrophobicContact SD-CG2 4.04Å; T442-V485 HydrophobicContact CG2-CG1 3.94Å; L481-V485 PolarHBondContact O-N 2.83Å; L481-V485 VanDerWaalsContact O-N 3.15Å; R482-V485 PolarHBondContact O-N 3.5Å; V485-C487 PolarHBondContact O-N 3.4Å; V485-A488 WeakPolarHBondContact O-CB 3.48Å; V485-A488 PolarHBondContact O-N 3.07Å; V485-A488 VanDerWaalsContact O-N 3.16Å; V485-D489 WeakPolarHBondContact O-CB 3.47Å; V485-D489 PolarHBondContact O-N 2.85Å
486	H	98.7	Very high	97.5	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-64.1	-37.7	176	-159.5	75.3	0	0	0	113.2	A441 H447 L450 R482 N483 L490	A441-H486 PolarHBondContact O-ND1 3.42Å; H447-H486 AromaticContact CG-NE2 3.95Å; H447-H486 AromaticContact ND1-CD2 3.95Å; H447-H486 AromaticContact ND1-NE2 3.45Å; H447-H486 PolarHBondContact ND1-NE2 2.82Å; L450-H486 HydrophobicContact CD1-CB 4.38Å; R482-H486 WeakPolarHBondContact O-CB 3.35Å; R482-H486 PolarHBondContact O-N 2.84Å; N483-H486 PolarHBondContact O-N 2.84Å; H486-L490 VanDerWaalsContact NE2-CD1 3.27Å; H486-L490 WeakPolarHBondContact NE2-CD1 3.4Å; H486-L490 WeakPolarHBondContact O-CB 3.5Å; H486-L490 PolarHBondContact O-N 2.95Å
487	C	98.8	Very high	98	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-68.8	-38.8	170.8	-68.6	0	0	0	0	111.5	L346 N483 M484 V485 L490 S491 W552	L346-C487 HydrophobicContact CD1-CB 4.26Å; N483-C487 WeakPolarHBondContact O-CB 3.41Å; N483-C487 PolarHBondContact O-N 3.05Å; N483-C487 PolarHBondContact O-SG 3.3Å; M484-C487 PolarHBondContact O-N 3.43Å; V485-C487 PolarHBondContact O-N 3.4Å; C487-L490 CarbonylContact O-C 3.49Å; C487-L490 PolarHBondContact O-N 3.11Å; C487-S491 WeakPolarHBondContact O-CA 3.42Å; C487-S491 WeakPolarHBondContact O-CB 3.35Å; C487-S491 PolarHBondContact O-N 2.69Å; C487-W552 HydrophobicContact CB-CH2 4.05Å; C487-W552 HydrophobicContact CB-CZ2 3.85Å; C487-W552 HydrophobicContact CB-CZ3 4.49Å; C487-W552 WeakPolarHBondContact O-CZ2 3.42Å
488	A	98.8	Very high	98.2	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66.9	-35	178.4	0	0	0	0	0	113	V339 T343 L346 M484 V485 S491	V339-A488 HydrophobicContact CG1-CB 3.96Å; T343-A488 VanDerWaalsContact OG1-CB 3.24Å; T343-A488 WeakPolarHBondContact OG1-CB 3.32Å; L346-A488 HydrophobicContact CD1-CB 4.37Å; M484-A488 WeakPolarHBondContact O-CB 3.44Å; M484-A488 PolarHBondContact O-N 3.18Å; V485-A488 WeakPolarHBondContact O-CB 3.48Å; V485-A488 PolarHBondContact O-N 3.07Å; V485-A488 VanDerWaalsContact O-N 3.16Å; A488-S491 WeakPolarHBondContact O-CB 3.37Å; A488-S491 PolarHBondContact O-OG 3.16Å
489	D	98.8	Very high	98.3	Very high	13 Å²	13	18.1 Å²	18.1	7%	0.07	9%	0.091	C	C	.	.	H	α-helix	trans	-63.8	-58.8	168	173.2	-1.6	0	0	0	110.2	H335 V339 M444 V485 S491	H335-D489 IonicContact NE2-OD1 3.89Å; V339-D489 HydrophobicContact CG1-CB 4.46Å; M444-D489 WeakPolarHBondContact CE-OD2 3.41Å; V485-D489 WeakPolarHBondContact O-CB 3.47Å; V485-D489 PolarHBondContact O-N 2.85Å; D489-S491 PolarHBondContact O-N 3.32Å
490	L	98.6	Very high	98.5	Very high	10 Å²	10	16.5 Å²	16.5	5%	0.052	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	33.7	176.2	-60.9	177.8	0	0	0	113.8	M444 H486 C487 F543 I547 L551 W552	M444-L490 HydrophobicContact CE-CD1 4.34Å; M444-L490 HydrophobicContact CE-CD2 3.78Å; M444-L490 HydrophobicContact CE-CG 3.99Å; M444-L490 HydrophobicContact SD-CD1 4.21Å; M444-L490 HydrophobicContact SD-CD2 4.08Å; M444-L490 HydrophobicContact SD-CG 4.42Å; H486-L490 VanDerWaalsContact NE2-CD1 3.27Å; H486-L490 WeakPolarHBondContact NE2-CD1 3.4Å; H486-L490 WeakPolarHBondContact O-CB 3.5Å; H486-L490 PolarHBondContact O-N 2.95Å; C487-L490 CarbonylContact O-C 3.49Å; C487-L490 PolarHBondContact O-N 3.11Å; L490-F543 HydrophobicContact CD2-CE2 4.23Å; L490-F543 HydrophobicContact CD2-CZ 3.75Å; L490-I547 HydrophobicContact CD1-CG2 4.06Å; L490-L551 HydrophobicContact CB-CD2 4.18Å; L490-L551 HydrophobicContact CD1-CD2 3.66Å; L490-W552 PolarHBondContact O-NE1 3.28Å
491	S	98.8	Very high	98.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-20.6	-175.4	67.6	0	0	0	0	114.4	C487 A488 D489 P493 T494 K495	C487-S491 WeakPolarHBondContact O-CA 3.42Å; C487-S491 WeakPolarHBondContact O-CB 3.35Å; C487-S491 PolarHBondContact O-N 2.69Å; A488-S491 WeakPolarHBondContact O-CB 3.37Å; A488-S491 PolarHBondContact O-OG 3.16Å; D489-S491 PolarHBondContact O-N 3.32Å; S491-P493 VanDerWaalsContact C-CD 3.49Å; S491-P493 VanDerWaalsContact C-N 3.35Å; S491-T494 PolarHBondContact O-N 3.46Å; S491-T494 PolarHBondContact O-OG1 3.04Å; S491-K495 PolarHBondContact O-N 3.34Å; S491-K495 WeakPolarHBondContact OG-CE 3.3Å; S491-K495 PolarHBondContact OG-NZ 3.33Å
492	N	98.7	Very high	98.6	Very high	13 Å²	13	25 Å²	25	7%	0.07	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-53	-43.1	-172.4	-50.1	-36.6	0	0	0	114	Y330 T494 K495 Y500 W503	Y330-N492 WeakPolarHBondContact CE2-ND2 3.22Å; Y330-N492 PolarHBondContact OH-ND2 3.47Å; N492-T494 PolarHBondContact O-N 3.26Å; N492-K495 WeakPolarHBondContact O-CB 3.33Å; N492-K495 PolarHBondContact O-N 2.87Å; N492-K495 VanDerWaalsContact O-N 3.16Å; N492-Y500 HydrophobicContact CB-CD2 4.12Å; N492-Y500 VanDerWaalsContact O-CB 3.3Å; N492-Y500 WeakPolarHBondContact O-CB 3.42Å; N492-Y500 WeakPolarHBondContact O-CD2 3.47Å; N492-W503 HydrophobicContact CB-CB 3.83Å; N492-W503 HydrophobicContact CB-CG 3.97Å; N492-W503 VanDerWaalsContact OD1-CD1 3.24Å; N492-W503 PolarHBondContact OD1-NE1 3.41Å
493	P	98.8	Very high	98.7	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.006	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-69.5	-10	179.5	-20.1	36.2	0	0	0	114.7	S491 Y500 F543 I544 V548 L570 N573	S491-P493 VanDerWaalsContact C-CD 3.49Å; S491-P493 VanDerWaalsContact C-N 3.35Å; P493-Y500 HydrophobicContact CB-CD1 4.32Å; P493-Y500 HydrophobicContact CB-CD2 4.4Å; P493-Y500 HydrophobicContact CB-CE1 3.75Å; P493-Y500 HydrophobicContact CB-CE2 3.92Å; P493-Y500 HydrophobicContact CG-CD2 4.36Å; P493-Y500 HydrophobicContact CG-CE1 4.41Å; P493-Y500 HydrophobicContact CG-CE2 3.7Å; P493-F543 HydrophobicContact CG-CD1 4.32Å; P493-F543 HydrophobicContact CG-CE1 4Å; P493-I544 HydrophobicContact CB-CD1 4.08Å; P493-I544 HydrophobicContact CB-CG1 3.94Å; P493-I544 HydrophobicContact CG-CG1 4.47Å; P493-V548 HydrophobicContact CB-CG1 4.22Å; P493-V548 HydrophobicContact CG-CG1 4.12Å; P493-V548 HydrophobicContact CG-CG2 4.26Å; P493-L570 HydrophobicContact CB-CD1 3.6Å; P493-L570 WeakPolarHBondContact O-CD1 3.37Å; P493-N573 PolarHBondContact O-ND2 2.87Å
494	T	98.8	Very high	98.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-105.7	2	176.1	81.8	0	0	0	0	113	W273 S491 N492 W552 I566 T569 L570	W273-T494 VanDerWaalsContact CZ2-OG1 3.31Å; W273-T494 WeakPolarHBondContact CZ2-OG1 3.49Å; W273-T494 PolarHBondContact NE1-O 3.33Å; W273-T494 PolarHBondContact NE1-OG1 3.39Å; S491-T494 PolarHBondContact O-N 3.46Å; S491-T494 PolarHBondContact O-OG1 3.04Å; N492-T494 PolarHBondContact O-N 3.26Å; T494-W552 HydrophobicContact CG2-CD2 4.01Å; T494-W552 HydrophobicContact CG2-CG 3.92Å; T494-W552 HydrophobicContact CG2-CZ2 4.39Å; T494-I566 HydrophobicContact CG2-CG2 3.91Å; T494-I566 VanDerWaalsContact OG1-CG2 3.28Å; T494-I566 WeakPolarHBondContact OG1-CG2 3.15Å; T494-T569 WeakPolarHBondContact O-CG2 3.45Å; T494-L570 HydrophobicContact CG2-CB 4.06Å; T494-L570 HydrophobicContact CG2-CD1 4.07Å; T494-L570 HydrophobicContact CG2-CD2 4.09Å; T494-L570 HydrophobicContact CG2-CG 4.3Å
495	K	98.6	Very high	98.7	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	-78.8	168.4	167.1	-54.2	-66.4	164.7	65.8	0	109.6	W273 D338 S342 S491 N492 L499 T569 N573	W273-K495 HydrophobicContact CZ2-CD 4.4Å; D338-K495 IonicContact OD1-NZ 2.64Å; D338-K495 PolarHBondContact OD1-NZ 3.23Å; D338-K495 IonicContact OD2-NZ 2.61Å; D338-K495 PolarHBondContact OD2-NZ 3.26Å; S342-K495 WeakPolarHBondContact OG-CE 3.46Å; S342-K495 PolarHBondContact OG-NZ 3.17Å; S491-K495 PolarHBondContact O-N 3.34Å; S491-K495 WeakPolarHBondContact OG-CE 3.3Å; S491-K495 PolarHBondContact OG-NZ 3.33Å; N492-K495 WeakPolarHBondContact O-CB 3.33Å; N492-K495 PolarHBondContact O-N 2.87Å; N492-K495 VanDerWaalsContact O-N 3.16Å; K495-L499 HydrophobicContact CB-CB 3.98Å; K495-L499 HydrophobicContact CB-CD1 4.28Å; K495-T569 WeakPolarHBondContact O-CG2 3.44Å; K495-N573 PolarHBondContact O-ND2 3.31Å
496	S	98.6	Very high	98.6	Very high	57 Å²	57	30.8 Å²	30.8	40%	0.399	15%	0.148	S	C	.	.			trans	-58.4	148	173.3	63.9	0	0	0	0	111.5	E498 L499 Y500	S496-E498 PolarHBondContact O-N 2.79Å; S496-L499 PolarHBondContact O-N 2.8Å; S496-Y500 PolarHBondContact O-N 3Å
497	L	98.5	Very high	98.6	Very high	50 Å²	50	32 Å²	32	26%	0.262	15%	0.154	S	C	.	.	H	α-helix	trans	-53.3	-31.9	-174.1	-176.5	62.5	0	0	0	114.1	R501 N573 W576	L497-R501 HydrophobicContact CD1-CG 3.93Å; L497-R501 HydrophobicContact CG-CG 4.33Å; L497-R501 WeakPolarHBondContact O-CB 3.39Å; L497-R501 VanDerWaalsContact O-CG 3.26Å; L497-R501 WeakPolarHBondContact O-CG 3.47Å; L497-R501 PolarHBondContact O-N 2.72Å; L497-N573 WeakPolarHBondContact CA-OD1 3.44Å; L497-N573 WeakPolarHBondContact CB-OD1 3.45Å; L497-N573 WeakPolarHBondContact CD1-OD1 3.35Å; L497-W576 HydrophobicContact CD1-CB 4.41Å; L497-W576 HydrophobicContact CD1-CD2 3.82Å; L497-W576 HydrophobicContact CD1-CE3 3.69Å; L497-W576 HydrophobicContact CD1-CG 4.12Å; L497-W576 HydrophobicContact CD1-CZ3 4.29Å; L497-W576 HydrophobicContact CD2-CB 4.38Å; L497-W576 HydrophobicContact CD2-CD2 3.78Å; L497-W576 HydrophobicContact CD2-CE3 4.46Å; L497-W576 HydrophobicContact CD2-CG 3.69Å; L497-W576 HydrophobicContact CG-CD2 4.4Å
498	E	98.4	Very high	98.6	Very high	131 Å²	131	32.5 Å²	32.5	61%	0.612	16%	0.156	S	C	*	.	H	α-helix	trans	-65	-41	175.6	-173.8	-175.9	148.8	0	0	112.6	S496 Q502	S496-E498 PolarHBondContact O-N 2.79Å; E498-Q502 WeakPolarHBondContact O-CG 3.44Å; E498-Q502 PolarHBondContact O-NE2 3.18Å
499	L	98.6	Very high	98.6	Very high	6 Å²	6	37.3 Å²	37.3	3%	0.031	18%	0.179	C	C	.	.	H	α-helix	trans	-75.6	-44.7	176.5	-59.9	176	0	0	0	110.4	G274 N276 F278 K495 S496 R501 Q502 W503	G274-L499 WeakPolarHBondContact O-CD1 3.28Å; N276-L499 HydrophobicContact CB-CD2 4.26Å; F278-L499 HydrophobicContact CD2-CD2 3.58Å; F278-L499 HydrophobicContact CE2-CB 4.33Å; F278-L499 HydrophobicContact CE2-CD2 3.69Å; K495-L499 HydrophobicContact CB-CB 3.98Å; K495-L499 HydrophobicContact CB-CD1 4.28Å; S496-L499 PolarHBondContact O-N 2.8Å; L499-R501 PolarHBondContact O-N 2.95Å; L499-Q502 PolarHBondContact O-N 3.46Å; L499-W503 PolarHBondContact O-N 3.41Å; L499-W503 VanDerWaalsContact O-N 3.08Å
500	Y	98.8	Very high	98.6	Very high	3 Å²	3	37 Å²	37	1%	0.012	18%	0.177	C	C	.	.	H	α-helix	trans	-60	-45.5	-179.1	-179.1	-157.7	0	0	0	111.6	N492 P493 S496 Q502 W503 T504 Q540 I544 N573 Y577	N492-Y500 HydrophobicContact CB-CD2 4.12Å; N492-Y500 VanDerWaalsContact O-CB 3.3Å; N492-Y500 WeakPolarHBondContact O-CB 3.42Å; N492-Y500 WeakPolarHBondContact O-CD2 3.47Å; P493-Y500 HydrophobicContact CB-CD1 4.32Å; P493-Y500 HydrophobicContact CB-CD2 4.4Å; P493-Y500 HydrophobicContact CB-CE1 3.75Å; P493-Y500 HydrophobicContact CB-CE2 3.92Å; P493-Y500 HydrophobicContact CG-CD2 4.36Å; P493-Y500 HydrophobicContact CG-CE1 4.41Å; P493-Y500 HydrophobicContact CG-CE2 3.7Å; S496-Y500 PolarHBondContact O-N 3Å; Y500-Q502 VanDerWaalsContact C-N 3.35Å; Y500-Q502 PolarHBondContact O-N 2.88Å; Y500-W503 CarbonylContact O-C 3.57Å; Y500-W503 WeakPolarHBondContact O-CA 3.43Å; Y500-W503 WeakPolarHBondContact O-CB 3.43Å; Y500-W503 PolarHBondContact O-N 2.99Å; Y500-T504 VanDerWaalsContact CE2-OG1 3.26Å; Y500-T504 WeakPolarHBondContact CE2-OG1 3.33Å; Y500-T504 PolarHBondContact O-N 2.95Å; Y500-T504 PolarHBondContact O-OG1 2.92Å; Y500-Q540 VanDerWaalsContact CE2-OE1 3.31Å; Y500-Q540 PolarHBondContact OH-OE1 2.97Å; Y500-I544 HydrophobicContact CE1-CD1 4.17Å; Y500-N573 HydrophobicContact CD1-CB 3.83Å; Y500-N573 HydrophobicContact CE1-CB 4.03Å; Y500-Y577 HydrophobicContact CD1-CD2 4.36Å; Y500-Y577 AromaticContact CD1-CE2 3.77Å; Y500-Y577 HydrophobicContact CD1-CE2 3.77Å; Y500-Y577 AromaticContact CE1-CD2 3.68Å; Y500-Y577 HydrophobicContact CE1-CD2 3.68Å; Y500-Y577 AromaticContact CE1-CE2 3.34Å; Y500-Y577 HydrophobicContact CE1-CE2 3.34Å; Y500-Y577 HydrophobicContact CE2-CE2 4.45Å; Y500-Y577 HydrophobicContact CG-CE2 4.5Å; Y500-Y577 AromaticContact CZ-CE2 3.7Å
501	R	98.5	Very high	98.6	Very high	112 Å²	112	39.8 Å²	39.8	42%	0.423	19%	0.189	S	C	.	.	H	α-helix	trans	-60.5	-41.1	177.8	-74.5	179.3	61.8	-151.1	-11	113	L497 L499 W503 T504 D505 W576	L497-R501 HydrophobicContact CD1-CG 3.93Å; L497-R501 HydrophobicContact CG-CG 4.33Å; L497-R501 WeakPolarHBondContact O-CB 3.39Å; L497-R501 VanDerWaalsContact O-CG 3.26Å; L497-R501 WeakPolarHBondContact O-CG 3.47Å; L497-R501 PolarHBondContact O-N 2.72Å; L499-R501 PolarHBondContact O-N 2.95Å; R501-W503 VanDerWaalsContact C-N 3.26Å; R501-W503 PolarHBondContact O-N 3.37Å; R501-T504 PolarHBondContact O-N 2.94Å; R501-D505 VanDerWaalsContact O-CG 3.31Å; R501-D505 PolarHBondContact O-N 3.31Å; R501-W576 HydrophobicContact CG-CH2 4.36Å; R501-W576 HydrophobicContact CG-CZ3 4.13Å
502	Q	98.6	Very high	98.5	Very high	67 Å²	67	42 Å²	42	31%	0.313	20%	0.199	S	C	.	.	H	α-helix	trans	-63.5	-32.1	174.6	-72.3	174.5	89.4	0	0	112.4	F278 E498 L499 Y500 R506	F278-Q502 HydrophobicContact CE1-CB 3.93Å; F278-Q502 HydrophobicContact CE2-CB 3.93Å; F278-Q502 HydrophobicContact CZ-CB 3.55Å; E498-Q502 WeakPolarHBondContact O-CG 3.44Å; E498-Q502 PolarHBondContact O-NE2 3.18Å; L499-Q502 PolarHBondContact O-N 3.46Å; Y500-Q502 VanDerWaalsContact C-N 3.35Å; Y500-Q502 PolarHBondContact O-N 2.88Å; Q502-R506 WeakPolarHBondContact O-CD 3.34Å; Q502-R506 VanDerWaalsContact O-CG 3.26Å; Q502-R506 WeakPolarHBondContact O-CG 3.36Å; Q502-R506 PolarHBondContact O-N 3.12Å
503	W	98.8	Very high	98.5	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.008	21%	0.207	C	C	.	.	H	α-helix	trans	-72.3	-41.8	171.5	-75	134.5	0	0	0	113	I277 F278 Y330 L334 H335 D338 N492 L499 Y500 R501 R506 I507	I277-W503 HydrophobicContact CG2-CZ2 3.93Å; F278-W503 HydrophobicContact CE1-CZ2 4.46Å; F278-W503 AromaticContact CZ-CD2 3.89Å; F278-W503 HydrophobicContact CZ-CD2 3.89Å; F278-W503 AromaticContact CZ-CE2 3.71Å; F278-W503 HydrophobicContact CZ-CE3 4.39Å; F278-W503 HydrophobicContact CZ-CG 4.26Å; F278-W503 HydrophobicContact CZ-CH2 4.47Å; F278-W503 HydrophobicContact CZ-CZ2 4.02Å; Y330-W503 AromaticContact CD2-CE3 3.66Å; Y330-W503 HydrophobicContact CD2-CE3 3.66Å; Y330-W503 HydrophobicContact CD2-CZ3 4.14Å; Y330-W503 HydrophobicContact CE2-CB 4.49Å; Y330-W503 HydrophobicContact CE2-CD2 4.29Å; Y330-W503 AromaticContact CE2-CE3 3.71Å; Y330-W503 HydrophobicContact CE2-CE3 3.71Å; Y330-W503 HydrophobicContact CE2-CZ3 4.32Å; L334-W503 HydrophobicContact CB-CH2 4.14Å; L334-W503 HydrophobicContact CD2-CH2 3.82Å; L334-W503 HydrophobicContact CD2-CZ3 4.28Å; L334-W503 HydrophobicContact CG-CH2 3.7Å; L334-W503 HydrophobicContact CG-CZ2 4.3Å; H335-W503 HydrophobicContact CB-CH2 3.84Å; H335-W503 HydrophobicContact CB-CZ3 4.02Å; D338-W503 HydrophobicContact CB-CZ2 3.86Å; D338-W503 PolarHBondContact OD2-NE1 3.15Å; N492-W503 HydrophobicContact CB-CB 3.83Å; N492-W503 HydrophobicContact CB-CG 3.97Å; N492-W503 VanDerWaalsContact OD1-CD1 3.24Å; N492-W503 PolarHBondContact OD1-NE1 3.41Å; L499-W503 PolarHBondContact O-N 3.41Å; L499-W503 VanDerWaalsContact O-N 3.08Å; Y500-W503 CarbonylContact O-C 3.57Å; Y500-W503 WeakPolarHBondContact O-CA 3.43Å; Y500-W503 WeakPolarHBondContact O-CB 3.43Å; Y500-W503 PolarHBondContact O-N 2.99Å; R501-W503 VanDerWaalsContact C-N 3.26Å; R501-W503 PolarHBondContact O-N 3.37Å; W503-R506 PolarHBondContact O-N 3.18Å; W503-I507 WeakPolarHBondContact O-CG2 3.47Å; W503-I507 PolarHBondContact O-N 2.83Å
504	T	98.6	Very high	98.5	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-59.5	-46.4	174.4	-57.7	0	0	0	0	111.6	Y500 R501 R506 I507 M508 V536 Q540 Y577	Y500-T504 VanDerWaalsContact CE2-OG1 3.26Å; Y500-T504 WeakPolarHBondContact CE2-OG1 3.33Å; Y500-T504 PolarHBondContact O-N 2.95Å; Y500-T504 PolarHBondContact O-OG1 2.92Å; R501-T504 PolarHBondContact O-N 2.94Å; T504-R506 VanDerWaalsContact C-N 3.28Å; T504-R506 PolarHBondContact O-N 3.46Å; T504-I507 WeakPolarHBondContact O-CG2 3.32Å; T504-I507 PolarHBondContact O-N 3.42Å; T504-M508 HydrophobicContact CG2-CG 4.27Å; T504-M508 WeakPolarHBondContact O-CB 3.43Å; T504-M508 WeakPolarHBondContact O-CG 3.4Å; T504-M508 PolarHBondContact O-N 2.98Å; T504-V536 HydrophobicContact CG2-CG1 3.56Å; T504-Q540 HydrophobicContact CG2-CG 3.7Å; T504-Q540 PolarHBondContact OG1-OE1 3.11Å; T504-Y577 WeakPolarHBondContact CB-OH 3.43Å; T504-Y577 HydrophobicContact CG2-CE1 4.5Å; T504-Y577 WeakPolarHBondContact CG2-OH 3.33Å; T504-Y577 PolarHBondContact OG1-OH 3.3Å
505	D	98.3	Very high	98.4	Very high	102 Å²	102	44.2 Å²	44.2	55%	0.545	21%	0.208	S	C	.	.	H	α-helix	trans	-59	-41.3	178.6	-69.7	-24.6	0	0	0	111	R501 E509	R501-D505 VanDerWaalsContact O-CG 3.31Å; R501-D505 PolarHBondContact O-N 3.31Å; D505-E509 WeakPolarHBondContact O-CB 3.48Å; D505-E509 PolarHBondContact O-N 3.01Å
506	R	98.7	Very high	98.4	Very high	78 Å²	78	46.6 Å²	46.6	29%	0.294	22%	0.221	S	C	.	.	H	α-helix	trans	-69	-46.6	179.3	-76	172.4	175.1	-83.4	1.4	114.3	A329 Y330 Q502 W503 T504 M508 E509 E510	A329-R506 WeakPolarHBondContact O-CG 3.4Å; A329-R506 PolarHBondContact O-NH1 3.15Å; Y330-R506 HydrophobicContact CD2-CB 4.28Å; Q502-R506 WeakPolarHBondContact O-CD 3.34Å; Q502-R506 VanDerWaalsContact O-CG 3.26Å; Q502-R506 WeakPolarHBondContact O-CG 3.36Å; Q502-R506 PolarHBondContact O-N 3.12Å; W503-R506 PolarHBondContact O-N 3.18Å; T504-R506 VanDerWaalsContact C-N 3.28Å; T504-R506 PolarHBondContact O-N 3.46Å; R506-M508 VanDerWaalsContact C-N 3.3Å; R506-M508 PolarHBondContact O-N 3.05Å; R506-E509 PolarHBondContact O-N 3.29Å; R506-E510 PolarHBondContact O-N 3.23Å
507	I	98.4	Very high	98.3	Very high	27 Å²	27	46.2 Å²	46.2	14%	0.138	21%	0.213	C	C	.	.	H	α-helix	trans	-68.3	-34.7	180	-169.7	61.9	0	0	0	111	Y330 W503 T504 E510 F511	Y330-I507 HydrophobicContact CD1-CD1 3.81Å; Y330-I507 HydrophobicContact CD2-CB 3.76Å; Y330-I507 HydrophobicContact CD2-CD1 4.29Å; Y330-I507 HydrophobicContact CE1-CD1 4.3Å; Y330-I507 HydrophobicContact CE2-CB 4.28Å; Y330-I507 HydrophobicContact CG-CB 4.05Å; Y330-I507 HydrophobicContact CG-CD1 3.81Å; Y330-I507 HydrophobicContact CG-CG1 4.48Å; W503-I507 WeakPolarHBondContact O-CG2 3.47Å; W503-I507 PolarHBondContact O-N 2.83Å; T504-I507 WeakPolarHBondContact O-CG2 3.32Å; T504-I507 PolarHBondContact O-N 3.42Å; I507-E510 PolarHBondContact O-N 2.96Å; I507-F511 HydrophobicContact CD1-CD1 4.09Å; I507-F511 HydrophobicContact CD1-CE1 3.53Å; I507-F511 HydrophobicContact CD1-CZ 3.87Å; I507-F511 HydrophobicContact CG1-CD1 4.28Å; I507-F511 HydrophobicContact CG1-CD2 4.5Å; I507-F511 HydrophobicContact CG1-CE1 3.77Å; I507-F511 HydrophobicContact CG1-CE2 4.02Å; I507-F511 HydrophobicContact CG1-CZ 3.63Å; I507-F511 WeakPolarHBondContact O-CB 3.43Å; I507-F511 VanDerWaalsContact O-CG 3.28Å; I507-F511 WeakPolarHBondContact O-CG 3.38Å; I507-F511 PolarHBondContact O-N 2.68Å
508	M	98.1	Very high	98.3	Very high	9 Å²	9	43.9 Å²	43.9	4%	0.044	20%	0.2	C	C	.	.	H	α-helix	trans	-67.6	-41.7	173.1	-66.1	-67.2	155	0	0	111.5	T504 R506 E510 F511 F512 M528 V536	T504-M508 HydrophobicContact CG2-CG 4.27Å; T504-M508 WeakPolarHBondContact O-CB 3.43Å; T504-M508 WeakPolarHBondContact O-CG 3.4Å; T504-M508 PolarHBondContact O-N 2.98Å; R506-M508 VanDerWaalsContact C-N 3.3Å; R506-M508 PolarHBondContact O-N 3.05Å; M508-E510 VanDerWaalsContact C-N 3.32Å; M508-E510 PolarHBondContact O-N 2.88Å; M508-F511 PolarHBondContact O-N 2.88Å; M508-F511 HydrophobicContact SD-CD2 4.44Å; M508-F512 HydrophobicContact CB-CE2 4Å; M508-F512 HydrophobicContact CB-CZ 4.04Å; M508-F512 WeakPolarHBondContact O-CB 3.45Å; M508-F512 WeakPolarHBondContact O-CD1 3.29Å; M508-F512 WeakPolarHBondContact O-CD2 3.44Å; M508-F512 WeakPolarHBondContact O-CG 3.49Å; M508-F512 PolarHBondContact O-N 3.23Å; M508-F512 HydrophobicContact SD-CZ 4.48Å; M508-M528 HydrophobicContact CE-CE 4.07Å; M508-M528 HydrophobicContact SD-CE 3.96Å; M508-V536 HydrophobicContact CE-CG1 4.26Å; M508-V536 HydrophobicContact CG-CG1 3.97Å; M508-V536 HydrophobicContact CG-CG2 4.05Å; M508-V536 HydrophobicContact SD-CG1 4.34Å; M508-V536 HydrophobicContact SD-CG2 4.04Å
509	E	98.4	Very high	98.2	Very high	102 Å²	102	42.1 Å²	42.1	48%	0.477	19%	0.188	S	C	.	.	H	α-helix	trans	-56.1	-47.2	171.7	-168.9	-170.2	160	0	0	111.2	A329 D505 R506 F512 Q513	A329-E509 HydrophobicContact CB-CB 3.95Å; A329-E509 HydrophobicContact CB-CG 4.08Å; D505-E509 WeakPolarHBondContact O-CB 3.48Å; D505-E509 PolarHBondContact O-N 3.01Å; R506-E509 PolarHBondContact O-N 3.29Å; E509-F512 PolarHBondContact O-N 2.83Å; E509-Q513 WeakPolarHBondContact O-CG 2.99Å; E509-Q513 PolarHBondContact O-N 3.39Å; E509-Q513 PolarHBondContact OE1-NE2 3.31Å
510	E	98.6	Very high	98.2	Very high	6 Å²	6	49.4 Å²	49.4	3%	0.028	22%	0.222	C	C	.	.	H	α-helix	trans	-66.2	-40.9	-179.1	-156.2	-179.4	124.2	0	0	113	V328 A329 Y330 H331 H375 G377 R506 I507 M508 F512 Q513 Q514	V328-E510 VanDerWaalsContact CG1-CD 3.49Å; V328-E510 HydrophobicContact CG1-CG 4.32Å; V328-E510 WeakPolarHBondContact CG1-OE2 3.47Å; A329-E510 HydrophobicContact CB-CB 4.23Å; Y330-E510 WeakPolarHBondContact CA-OE2 3.32Å; Y330-E510 WeakPolarHBondContact CB-OE2 3.16Å; Y330-E510 PolarHBondContact N-OE2 3.3Å; H331-E510 IonicContact CE1-OE1 2.61Å; H331-E510 IonicContact CG-OE1 2.69Å; H331-E510 PolarHBondContact N-OE2 2.84Å; H331-E510 VanDerWaalsContact ND1-CD 3.3Å; H331-E510 IonicContact ND1-OE1 3.78Å; H331-E510 PolarHBondContact ND1-OE1 3.19Å; H331-E510 IonicContact ND1-OE2 2.72Å; H331-E510 PolarHBondContact ND1-OE2 3.27Å; H375-E510 IonicContact CE1-OE1 3.43Å; H375-E510 PolarHBondContact CE1-OE1 2.91Å; H375-E510 IonicContact ND1-OE1 2.58Å; G377-E510 VanDerWaalsContact CA-OE1 3.27Å; G377-E510 WeakPolarHBondContact CA-OE1 3.35Å; R506-E510 PolarHBondContact O-N 3.23Å; I507-E510 PolarHBondContact O-N 2.96Å; M508-E510 VanDerWaalsContact C-N 3.32Å; M508-E510 PolarHBondContact O-N 2.88Å; E510-F512 VanDerWaalsContact C-N 3.31Å; E510-F512 PolarHBondContact O-N 3.37Å; E510-Q513 WeakPolarHBondContact O-CB 3.25Å; E510-Q513 PolarHBondContact O-N 3.09Å; E510-Q514 PolarHBondContact O-N 3.39Å
511	F	98.3	Very high	98.1	Very high	69 Å²	69	55.6 Å²	55.6	30%	0.303	25%	0.245	S	C	.	.	H	α-helix	trans	-60.6	-40.9	172.1	-71.3	-4.9	0	0	0	111.5	I507 M508 Q513 Q514 G515 M528 C529	I507-F511 HydrophobicContact CD1-CD1 4.09Å; I507-F511 HydrophobicContact CD1-CE1 3.53Å; I507-F511 HydrophobicContact CD1-CZ 3.87Å; I507-F511 HydrophobicContact CG1-CD1 4.28Å; I507-F511 HydrophobicContact CG1-CD2 4.5Å; I507-F511 HydrophobicContact CG1-CE1 3.77Å; I507-F511 HydrophobicContact CG1-CE2 4.02Å; I507-F511 HydrophobicContact CG1-CZ 3.63Å; I507-F511 WeakPolarHBondContact O-CB 3.43Å; I507-F511 VanDerWaalsContact O-CG 3.28Å; I507-F511 WeakPolarHBondContact O-CG 3.38Å; I507-F511 PolarHBondContact O-N 2.68Å; M508-F511 PolarHBondContact O-N 2.88Å; M508-F511 HydrophobicContact SD-CD2 4.44Å; F511-Q513 VanDerWaalsContact C-N 3.34Å; F511-Q513 PolarHBondContact O-N 2.84Å; F511-Q514 PolarHBondContact O-N 2.64Å; F511-Q514 VanDerWaalsContact O-N 3.15Å; F511-G515 PolarHBondContact O-N 2.99Å; F511-M528 HydrophobicContact CD2-CB 4.08Å; F511-C529 WeakPolarHBondContact O-CA 3.25Å; F511-C529 VanDerWaalsContact O-CB 3.25Å; F511-C529 WeakPolarHBondContact O-CB 3.35Å
512	F	98.1	Very high	98	Very high	46 Å²	46	53.7 Å²	53.7	20%	0.202	26%	0.26	C	S	.	.	H	α-helix	trans	-68.5	-33	176	-57.6	-22.5	0	0	0	112.4	M508 E509 E510 G515 D516 M528 C529 K531 A534	M508-F512 HydrophobicContact CB-CE2 4Å; M508-F512 HydrophobicContact CB-CZ 4.04Å; M508-F512 WeakPolarHBondContact O-CB 3.45Å; M508-F512 WeakPolarHBondContact O-CD1 3.29Å; M508-F512 WeakPolarHBondContact O-CD2 3.44Å; M508-F512 WeakPolarHBondContact O-CG 3.49Å; M508-F512 PolarHBondContact O-N 3.23Å; M508-F512 HydrophobicContact SD-CZ 4.48Å; E509-F512 PolarHBondContact O-N 2.83Å; E510-F512 VanDerWaalsContact C-N 3.31Å; E510-F512 PolarHBondContact O-N 3.37Å; F512-G515 PolarHBondContact O-N 3.29Å; F512-D516 WeakPolarHBondContact O-CB 3.31Å; F512-D516 PolarHBondContact O-N 3.34Å; F512-M528 WeakPolarHBondContact CE1-O 3.39Å; F512-C529 WeakPolarHBondContact CA-O 3.1Å; F512-K531 HydrophobicContact CB-CB 4.14Å; F512-K531 HydrophobicContact CB-CD 4.39Å; F512-K531 HydrophobicContact CD1-CB 3.75Å; F512-K531 HydrophobicContact CD2-CB 3.71Å; F512-K531 HydrophobicContact CE1-CB 4.06Å; F512-K531 HydrophobicContact CE2-CB 4.02Å; F512-K531 HydrophobicContact CG-CB 3.58Å; F512-K531 HydrophobicContact CZ-CB 4.18Å; F512-A534 HydrophobicContact CE1-CB 3.77Å; F512-A534 HydrophobicContact CZ-CB 4.09Å
513	Q	98.1	Very high	97.9	Very high	50 Å²	50	52.9 Å²	52.9	23%	0.234	26%	0.257	C	S	.	.	H	α-helix	trans	-65.8	-37.2	169	-67.9	179.2	18.8	0	0	111.7	E509 E510 F511 K517	E509-Q513 WeakPolarHBondContact O-CG 2.99Å; E509-Q513 PolarHBondContact O-N 3.39Å; E509-Q513 PolarHBondContact OE1-NE2 3.31Å; E510-Q513 WeakPolarHBondContact O-CB 3.25Å; E510-Q513 PolarHBondContact O-N 3.09Å; F511-Q513 VanDerWaalsContact C-N 3.34Å; F511-Q513 PolarHBondContact O-N 2.84Å; Q513-K517 WeakPolarHBondContact O-CD 3.48Å; Q513-K517 WeakPolarHBondContact O-CG 3.32Å; Q513-K517 PolarHBondContact O-N 3.34Å; Q513-K517 VanDerWaalsContact O-N 3.08Å
514	Q	98.3	Very high	97.7	Very high	10 Å²	10	61.5 Å²	61.5	5%	0.047	30%	0.297	C	S	.	.	H	α-helix	trans	-64.2	-46.2	170.5	-173.1	-178.6	-66	0	0	111.2	V378 S379 F382 E510 F511 D516 K517 E518 S526	V378-Q514 HydrophobicContact CB-CG 4.42Å; V378-Q514 HydrophobicContact CG1-CB 4.24Å; V378-Q514 HydrophobicContact CG1-CG 3.95Å; S379-Q514 PolarHBondContact OG-NE2 3.13Å; S379-Q514 PolarHBondContact OG-OE1 3.29Å; F382-Q514 HydrophobicContact CB-CG 4.48Å; F382-Q514 HydrophobicContact CD2-CG 3.88Å; F382-Q514 HydrophobicContact CE2-CG 4.44Å; F382-Q514 HydrophobicContact CG-CG 4.3Å; E510-Q514 PolarHBondContact O-N 3.39Å; F511-Q514 PolarHBondContact O-N 2.64Å; F511-Q514 VanDerWaalsContact O-N 3.15Å; Q514-D516 VanDerWaalsContact C-N 3.32Å; Q514-D516 PolarHBondContact O-N 3.35Å; Q514-K517 CarbonylContact O-C 3.5Å; Q514-K517 WeakPolarHBondContact O-CA 3.09Å; Q514-K517 WeakPolarHBondContact O-CB 3.41Å; Q514-K517 PolarHBondContact O-N 2.94Å; Q514-E518 HydrophobicContact CG-CG 4.28Å; Q514-E518 PolarHBondContact NE2-OE1 2.83Å; Q514-E518 WeakPolarHBondContact O-CG 3.33Å; Q514-E518 PolarHBondContact O-N 2.72Å; Q514-S526 PolarHBondContact NE2-OG 3Å
515	G	97.9	Very high	97.6	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-65.1	-33.5	-179	0	0	0	0	0	113.8	F511 F512 E518 R519 C529	F511-G515 PolarHBondContact O-N 2.99Å; F512-G515 PolarHBondContact O-N 3.29Å; G515-E518 PolarHBondContact O-N 3.18Å; G515-R519 WeakPolarHBondContact O-CB 3.27Å; G515-R519 PolarHBondContact O-N 2.92Å; G515-C529 WeakPolarHBondContact CA-O 3.47Å
516	D	97.8	Very high	97.3	Very high	51 Å²	51	60 Å²	60	27%	0.273	29%	0.291	S	S	.	.	H	α-helix	trans	-65.8	-45.6	169	-74.1	-9.2	0	0	0	111.1	F512 Q514 E518 R519 E520 K531	F512-D516 WeakPolarHBondContact O-CB 3.31Å; F512-D516 PolarHBondContact O-N 3.34Å; Q514-D516 VanDerWaalsContact C-N 3.32Å; Q514-D516 PolarHBondContact O-N 3.35Å; D516-E518 VanDerWaalsContact C-N 3.28Å; D516-E518 PolarHBondContact O-N 2.86Å; D516-R519 PolarHBondContact O-N 3.15Å; D516-R519 IonicContact OD1-CZ 3.03Å; D516-R519 IonicContact OD1-NH1 2.86Å; D516-R519 PolarHBondContact OD1-NH1 2.93Å; D516-E520 WeakPolarHBondContact O-CG 3.38Å; D516-E520 PolarHBondContact O-N 3.38Å; D516-K531 WeakPolarHBondContact OD1-CE 3.48Å; D516-K531 IonicContact OD1-NZ 2.73Å; D516-K531 PolarHBondContact OD1-NZ 3.36Å; D516-K531 IonicContact OD2-NZ 2.74Å; D516-K531 PolarHBondContact OD2-NZ 2.85Å
517	K	97.6	Very high	96.9	Very high	49 Å²	49	62.1 Å²	62.1	21%	0.213	32%	0.315	C	S	.	.	H	α-helix	trans	-58.8	-35.3	174.1	-68.8	162.9	-160.7	172.9	0	112.3	G377 V378 F382 Q513 Q514 R521	G377-K517 PolarHBondContact O-NZ 2.69Å; V378-K517 HydrophobicContact CG1-CD 3.53Å; F382-K517 HydrophobicContact CE2-CB 4.13Å; F382-K517 HydrophobicContact CZ-CB 4.03Å; Q513-K517 WeakPolarHBondContact O-CD 3.48Å; Q513-K517 WeakPolarHBondContact O-CG 3.32Å; Q513-K517 PolarHBondContact O-N 3.34Å; Q513-K517 VanDerWaalsContact O-N 3.08Å; Q514-K517 CarbonylContact O-C 3.5Å; Q514-K517 WeakPolarHBondContact O-CA 3.09Å; Q514-K517 WeakPolarHBondContact O-CB 3.41Å; Q514-K517 PolarHBondContact O-N 2.94Å; K517-R521 VanDerWaalsContact O-CD 3.31Å; K517-R521 WeakPolarHBondContact O-CD 3.49Å; K517-R521 WeakPolarHBondContact O-CG 3.33Å; K517-R521 PolarHBondContact O-NH1 3.1Å
518	E	98.3	Very high	96.5	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-71.7	-47.6	176.2	-72	168.2	160.5	0	0	111.5	F382 Q514 G515 D516 E520 R521 G522 M523 I525 S526	F382-E518 HydrophobicContact CD2-CG 3.59Å; F382-E518 HydrophobicContact CE2-CG 3.61Å; Q514-E518 HydrophobicContact CG-CG 4.28Å; Q514-E518 PolarHBondContact NE2-OE1 2.83Å; Q514-E518 WeakPolarHBondContact O-CG 3.33Å; Q514-E518 PolarHBondContact O-N 2.72Å; G515-E518 PolarHBondContact O-N 3.18Å; D516-E518 VanDerWaalsContact C-N 3.28Å; D516-E518 PolarHBondContact O-N 2.86Å; E518-E520 VanDerWaalsContact C-N 3.32Å; E518-E520 PolarHBondContact O-N 2.86Å; E518-R521 PolarHBondContact O-N 3.41Å; E518-G522 PolarHBondContact O-N 3.12Å; E518-M523 HydrophobicContact CB-CB 4.18Å; E518-M523 HydrophobicContact CG-CE 4.28Å; E518-M523 PolarHBondContact O-N 2.68Å; E518-I525 HydrophobicContact CB-CG1 4.43Å; E518-I525 WeakPolarHBondContact OE2-CA 3.33Å; E518-S526 WeakPolarHBondContact OE1-CB 3.21Å; E518-S526 PolarHBondContact OE1-OG 3.15Å; E518-S526 PolarHBondContact OE2-N 3.06Å
519	R	96.8	Very high	96.2	Very high	95 Å²	95	63 Å²	63	36%	0.358	32%	0.32	S	S	.	.	H	α-helix	trans	-60.5	-40	178.6	-163	-175.8	-61.1	108.1	-4.8	112	G515 D516 R521 G522 I525 D530	G515-R519 WeakPolarHBondContact O-CB 3.27Å; G515-R519 PolarHBondContact O-N 2.92Å; D516-R519 PolarHBondContact O-N 3.15Å; D516-R519 IonicContact OD1-CZ 3.03Å; D516-R519 IonicContact OD1-NH1 2.86Å; D516-R519 PolarHBondContact OD1-NH1 2.93Å; R519-R521 VanDerWaalsContact C-N 3.26Å; R519-R521 PolarHBondContact O-N 3.32Å; R519-G522 PolarHBondContact O-N 2.93Å; R519-I525 HydrophobicContact CB-CD1 3.96Å; R519-I525 HydrophobicContact CB-CG1 4.32Å; R519-I525 HydrophobicContact CG-CD1 4.1Å; R519-D530 IonicContact CZ-OD2 3.54Å; R519-D530 IonicContact NE-OD2 2.78Å; R519-D530 IonicContact NH2-OD1 2.83Å; R519-D530 PolarHBondContact NH2-OD1 3.04Å; R519-D530 IonicContact NH2-OD2 3.14Å; R519-D530 PolarHBondContact NH2-OD2 2.85Å
520	E	97.3	Very high	95.9	Very high	159 Å²	159	59.5 Å²	59.5	74%	0.743	30%	0.304	S	S	*	.	H	α-helix	trans	-61	-32	173.3	-76.5	-178.2	164	0	0	113.5	D516 E518 G522	D516-E520 WeakPolarHBondContact O-CG 3.38Å; D516-E520 PolarHBondContact O-N 3.38Å; E518-E520 VanDerWaalsContact C-N 3.32Å; E518-E520 PolarHBondContact O-N 2.86Å; E520-G522 VanDerWaalsContact C-N 3.34Å
521	R	96.7	Very high	95.5	Very high	133 Å²	133	63.4 Å²	63.4	50%	0.502	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-5.7	179.3	-71.4	166.5	176.9	66.8	-0.4	113.1	K517 E518 R519 M523	K517-R521 VanDerWaalsContact O-CD 3.31Å; K517-R521 WeakPolarHBondContact O-CD 3.49Å; K517-R521 WeakPolarHBondContact O-CG 3.33Å; K517-R521 PolarHBondContact O-NH1 3.1Å; E518-R521 PolarHBondContact O-N 3.41Å; R519-R521 VanDerWaalsContact C-N 3.26Å; R519-R521 PolarHBondContact O-N 3.32Å; R521-M523 HydrophobicContact CB-CG 3.84Å; R521-M523 HydrophobicContact CB-SD 3.77Å; R521-M523 HydrophobicContact CG-SD 4.39Å; R521-M523 PolarHBondContact O-N 3.04Å
522	G	96.3	Very high	95.1	Very high	71 Å²	71	66.9 Å²	66.9	73%	0.732	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	25.1	-172.2	0	0	0	0	0	113.3	E518 R519 E520	E518-G522 PolarHBondContact O-N 3.12Å; R519-G522 PolarHBondContact O-N 2.93Å; E520-G522 VanDerWaalsContact C-N 3.34Å
523	M	96.7	Very high	94.6	Very high	50 Å²	50	70.2 Å²	70.2	25%	0.246	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-80.7	160.1	174.4	-65.9	168.2	59.8	0	0	110.4	F382 N385 T386 E518 R521	F382-M523 HydrophobicContact CD2-CE 4.17Å; F382-M523 HydrophobicContact CE2-CE 4.36Å; F382-M523 HydrophobicContact CE2-SD 4.33Å; N385-M523 HydrophobicContact CB-CE 3.8Å; T386-M523 HydrophobicContact CG2-CE 4.14Å; T386-M523 HydrophobicContact CG2-SD 3.78Å; E518-M523 HydrophobicContact CB-CB 4.18Å; E518-M523 HydrophobicContact CG-CE 4.28Å; E518-M523 PolarHBondContact O-N 2.68Å; R521-M523 HydrophobicContact CB-CG 3.84Å; R521-M523 HydrophobicContact CB-SD 3.77Å; R521-M523 HydrophobicContact CG-SD 4.39Å; R521-M523 PolarHBondContact O-N 3.04Å
524	E	95.3	Very high	94.1	Very high	183 Å²	183	69.1 Å²	69.1	86%	0.855	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-63.7	133.9	160.3	-174.7	165.3	-158.3	0	0	108.5
525	I	95.8	Very high	93.8	Very high	44 Å²	44	70.4 Å²	70.4	23%	0.226	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-79.7	128.6	-177.7	-59.6	170.5	0	0	0	108.1	E518 R519 C529 D530	E518-I525 HydrophobicContact CB-CG1 4.43Å; E518-I525 WeakPolarHBondContact OE2-CA 3.33Å; R519-I525 HydrophobicContact CB-CD1 3.96Å; R519-I525 HydrophobicContact CB-CG1 4.32Å; R519-I525 HydrophobicContact CG-CD1 4.1Å; I525-C529 HydrophobicContact CG2-CB 3.94Å; I525-D530 HydrophobicContact CD1-CB 4.46Å; I525-D530 WeakPolarHBondContact CD1-OD2 3.42Å; I525-D530 HydrophobicContact CG2-CB 3.94Å
526	S	93.3	Very high	93.6	Very high	29 Å²	29	72 Å²	72	20%	0.203	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-59.3	149.2	-178.7	-71.8	0	0	0	0	111.4	Q514 E518 M528 C529	Q514-S526 PolarHBondContact NE2-OG 3Å; E518-S526 WeakPolarHBondContact OE1-CB 3.21Å; E518-S526 PolarHBondContact OE1-OG 3.15Å; E518-S526 PolarHBondContact OE2-N 3.06Å; S526-M528 PolarHBondContact O-N 3.36Å; S526-C529 VanDerWaalsContact O-CB 3.28Å; S526-C529 WeakPolarHBondContact O-CB 3.42Å; S526-C529 PolarHBondContact O-N 2.91Å
527	P	90.1	Very high	93.4	Very high	121 Å²	121	72 Å²	72	79%	0.786	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	143.1	170.9	-27.9	35.8	0	0	0	111.8	C529	P527-C529 PolarHBondContact O-N 3.45Å; P527-C529 PolarHBondContact O-SG 3.31Å
528	M	88.3	Confident	93.2	Very high	50 Å²	50	74.9 Å²	74.9	25%	0.246	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	-8.2	-172.1	-61.8	-53.7	-60	0	0	117.4	M508 F511 F512 S526 A534 S539	M508-M528 HydrophobicContact CE-CE 4.07Å; M508-M528 HydrophobicContact SD-CE 3.96Å; F511-M528 HydrophobicContact CD2-CB 4.08Å; F512-M528 WeakPolarHBondContact CE1-O 3.39Å; S526-M528 PolarHBondContact O-N 3.36Å; M528-A534 HydrophobicContact CE-CB 3.81Å; M528-S539 VanDerWaalsContact CE-CB 3.48Å; M528-S539 VanDerWaalsContact CE-OG 3.31Å; M528-S539 WeakPolarHBondContact CE-OG 3.44Å; M528-S539 PolarHBondContact SD-OG 3.28Å
529	C	93.4	Very high	92.9	Very high	6 Å²	6	76.8 Å²	76.8	4%	0.041	41%	0.405	C	S	.	.			trans	-86.7	-12.4	-176.4	-60.6	0	0	0	0	114	F511 F512 G515 I525 S526 P527	F511-C529 WeakPolarHBondContact O-CA 3.25Å; F511-C529 VanDerWaalsContact O-CB 3.25Å; F511-C529 WeakPolarHBondContact O-CB 3.35Å; F512-C529 WeakPolarHBondContact CA-O 3.1Å; G515-C529 WeakPolarHBondContact CA-O 3.47Å; I525-C529 HydrophobicContact CG2-CB 3.94Å; S526-C529 VanDerWaalsContact O-CB 3.28Å; S526-C529 WeakPolarHBondContact O-CB 3.42Å; S526-C529 PolarHBondContact O-N 2.91Å; P527-C529 PolarHBondContact O-N 3.45Å; P527-C529 PolarHBondContact O-SG 3.31Å
530	D	92.1	Very high	92.9	Very high	28 Å²	28	72.8 Å²	72.8	15%	0.15	39%	0.391	C	S	.	.			trans	-91.6	106.8	171.6	-157	-34.3	0	0	0	113	R519 I525 H532 T533 A534	R519-D530 IonicContact CZ-OD2 3.54Å; R519-D530 IonicContact NE-OD2 2.78Å; R519-D530 IonicContact NH2-OD1 2.83Å; R519-D530 PolarHBondContact NH2-OD1 3.04Å; R519-D530 IonicContact NH2-OD2 3.14Å; R519-D530 PolarHBondContact NH2-OD2 2.85Å; I525-D530 HydrophobicContact CD1-CB 4.46Å; I525-D530 WeakPolarHBondContact CD1-OD2 3.42Å; I525-D530 HydrophobicContact CG2-CB 3.94Å; D530-H532 PolarHBondContact O-N 3.28Å; D530-H532 WeakPolarHBondContact OD1-CB 3.48Å; D530-H532 IonicContact OD1-CD2 3.77Å; D530-H532 PolarHBondContact OD1-CD2 2.9Å; D530-H532 IonicContact OD1-CG 2.71Å; D530-H532 PolarHBondContact OD1-N 3.35Å; D530-T533 PolarHBondContact O-N 3.47Å; D530-A534 WeakPolarHBondContact O-CB 3.34Å; D530-A534 PolarHBondContact O-N 3.47Å
531	K	90.3	Very high	92.8	Very high	88 Å²	88	65.6 Å²	65.6	38%	0.383	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-13	171.7	68.8	-156.5	179.4	-163.6	0	116	F512 D516	F512-K531 HydrophobicContact CB-CB 4.14Å; F512-K531 HydrophobicContact CB-CD 4.39Å; F512-K531 HydrophobicContact CD1-CB 3.75Å; F512-K531 HydrophobicContact CD2-CB 3.71Å; F512-K531 HydrophobicContact CE1-CB 4.06Å; F512-K531 HydrophobicContact CE2-CB 4.02Å; F512-K531 HydrophobicContact CG-CB 3.58Å; F512-K531 HydrophobicContact CZ-CB 4.18Å; D516-K531 WeakPolarHBondContact OD1-CE 3.48Å; D516-K531 IonicContact OD1-NZ 2.73Å; D516-K531 PolarHBondContact OD1-NZ 3.36Å; D516-K531 IonicContact OD2-NZ 2.74Å; D516-K531 PolarHBondContact OD2-NZ 2.85Å
532	H	89	Confident	92.5	Very high	141 Å²	141	60.2 Å²	60.2	65%	0.653	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-10.7	176.8	-58.1	-60.2	0	0	0	113.8	D530	D530-H532 PolarHBondContact O-N 3.28Å; D530-H532 WeakPolarHBondContact OD1-CB 3.48Å; D530-H532 IonicContact OD1-CD2 3.77Å; D530-H532 PolarHBondContact OD1-CD2 2.9Å; D530-H532 IonicContact OD1-CG 2.71Å; D530-H532 PolarHBondContact OD1-N 3.35Å
533	T	88.6	Confident	92.5	Very high	116 Å²	116	60.3 Å²	60.3	71%	0.712	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.2	-15.7	-178.3	63.9	0	0	0	0	114.5	D530 S535	D530-T533 PolarHBondContact O-N 3.47Å; T533-S535 PolarHBondContact O-N 3.48Å
534	A	87.2	Confident	92.5	Very high	28 Å²	28	57.9 Å²	57.9	23%	0.231	31%	0.313	C	S	.	.			trans	-61	130.1	176.2	0	0	0	0	0	112.6	F512 M528 D530	F512-A534 HydrophobicContact CE1-CB 3.77Å; F512-A534 HydrophobicContact CZ-CB 4.09Å; M528-A534 HydrophobicContact CE-CB 3.81Å; D530-A534 WeakPolarHBondContact O-CB 3.34Å; D530-A534 PolarHBondContact O-N 3.47Å
535	S	91.4	Very high	92.4	Very high	36 Å²	36	51.8 Å²	51.8	25%	0.252	29%	0.286	S	S	.	.			trans	-105.8	96.2	166.8	-178.9	0	0	0	0	108.1	T533 E537 K538 S539	T533-S535 PolarHBondContact O-N 3.48Å; S535-E537 VanDerWaalsContact C-N 3.31Å; S535-E537 PolarHBondContact O-N 3.45Å; S535-E537 PolarHBondContact OG-OE2 3.14Å; S535-K538 PolarHBondContact O-N 2.94Å; S535-K538 WeakPolarHBondContact OG-CG 3.47Å; S535-S539 PolarHBondContact O-N 3.06Å; S535-S539 PolarHBondContact O-OG 2.75Å
536	V	93.3	Very high	92	Very high	34 Å²	34	57.8 Å²	57.8	21%	0.206	31%	0.307	C	S	.	.	H	α-helix	trans	-55.7	-47	-172.3	177.2	0	0	0	0	111	T504 M508 S539 Q540	T504-V536 HydrophobicContact CG2-CG1 3.56Å; M508-V536 HydrophobicContact CE-CG1 4.26Å; M508-V536 HydrophobicContact CG-CG1 3.97Å; M508-V536 HydrophobicContact CG-CG2 4.05Å; M508-V536 HydrophobicContact SD-CG1 4.34Å; M508-V536 HydrophobicContact SD-CG2 4.04Å; V536-S539 PolarHBondContact O-N 2.71Å; V536-Q540 HydrophobicContact CG1-CG 4.35Å; V536-Q540 WeakPolarHBondContact O-CG 3.25Å; V536-Q540 PolarHBondContact O-N 3.01Å
537	E	94.1	Very high	92.1	Very high	50 Å²	50	58.4 Å²	58.4	23%	0.234	31%	0.307	C	S	.	.	H	α-helix	trans	-66.7	-45.2	-172.6	-45.7	77.7	-172.6	0	0	111.6	S535 S539 Q540 V541 Y577 M580 I581	S535-E537 VanDerWaalsContact C-N 3.31Å; S535-E537 PolarHBondContact O-N 3.45Å; S535-E537 PolarHBondContact OG-OE2 3.14Å; E537-S539 VanDerWaalsContact C-N 3.27Å; E537-S539 PolarHBondContact O-N 2.9Å; E537-Q540 PolarHBondContact O-N 3.29Å; E537-V541 WeakPolarHBondContact O-CG2 3.22Å; E537-V541 PolarHBondContact O-N 2.76Å; E537-Y577 HydrophobicContact CB-CD1 4.21Å; E537-Y577 HydrophobicContact CG-CD1 4.41Å; E537-M580 HydrophobicContact CG-CB 4.16Å; E537-I581 HydrophobicContact CB-CG1 3.62Å
538	K	92.2	Very high	92.5	Very high	111 Å²	111	52.7 Å²	52.7	48%	0.483	27%	0.27	S	S	.	.	H	α-helix	trans	-60.9	-39.4	175.7	-69.7	-177.4	-177.2	176.8	0	111.5	S535 V541 G542 I581	S535-K538 PolarHBondContact O-N 2.94Å; S535-K538 WeakPolarHBondContact OG-CG 3.47Å; K538-V541 PolarHBondContact O-N 2.85Å; K538-G542 PolarHBondContact O-N 3.21Å; K538-I581 HydrophobicContact CB-CD1 4.47Å; K538-I581 HydrophobicContact CD-CG2 4.37Å; K538-I581 VanDerWaalsContact CE-CG2 3.45Å; K538-I581 HydrophobicContact CG-CD1 3.78Å; K538-I581 HydrophobicContact CG-CG1 3.81Å; K538-I581 HydrophobicContact CG-CG2 3.92Å
539	S	92.4	Very high	92.9	Very high	39 Å²	39	52.4 Å²	52.4	27%	0.273	27%	0.268	S	S	.	.	H	α-helix	trans	-78.3	-27.7	-178.9	-62	0	0	0	0	113.1	M528 S535 V536 E537 F543	M528-S539 VanDerWaalsContact CE-CB 3.48Å; M528-S539 VanDerWaalsContact CE-OG 3.31Å; M528-S539 WeakPolarHBondContact CE-OG 3.44Å; M528-S539 PolarHBondContact SD-OG 3.28Å; S535-S539 PolarHBondContact O-N 3.06Å; S535-S539 PolarHBondContact O-OG 2.75Å; V536-S539 PolarHBondContact O-N 2.71Å; E537-S539 VanDerWaalsContact C-N 3.27Å; E537-S539 PolarHBondContact O-N 2.9Å; S539-F543 WeakPolarHBondContact O-CB 3.46Å; S539-F543 PolarHBondContact O-N 2.97Å
540	Q	97.1	Very high	93	Very high	11 Å²	11	53.4 Å²	53.4	5%	0.051	28%	0.275	C	S	.	.	H	α-helix	trans	-66.3	-44.7	166.7	-67.3	-51	-96.9	0	0	111.3	Y500 T504 V536 E537 F543 I544 Y577	Y500-Q540 VanDerWaalsContact CE2-OE1 3.31Å; Y500-Q540 PolarHBondContact OH-OE1 2.97Å; T504-Q540 HydrophobicContact CG2-CG 3.7Å; T504-Q540 PolarHBondContact OG1-OE1 3.11Å; V536-Q540 HydrophobicContact CG1-CG 4.35Å; V536-Q540 WeakPolarHBondContact O-CG 3.25Å; V536-Q540 PolarHBondContact O-N 3.01Å; E537-Q540 PolarHBondContact O-N 3.29Å; Q540-F543 PolarHBondContact O-N 3.29Å; Q540-I544 WeakPolarHBondContact O-CG1 3.45Å; Q540-I544 PolarHBondContact O-N 3.31Å; Q540-Y577 HydrophobicContact CB-CD1 4.01Å; Q540-Y577 HydrophobicContact CB-CD2 4.01Å; Q540-Y577 HydrophobicContact CB-CE1 4.3Å; Q540-Y577 HydrophobicContact CB-CE2 4.29Å; Q540-Y577 HydrophobicContact CB-CG 3.86Å; Q540-Y577 HydrophobicContact CG-CD1 4.14Å; Q540-Y577 HydrophobicContact CG-CD2 4.4Å; Q540-Y577 HydrophobicContact CG-CE1 3.92Å; Q540-Y577 HydrophobicContact CG-CE2 4.19Å; Q540-Y577 HydrophobicContact CG-CG 4.37Å
541	V	96.2	Very high	93.3	Very high	8 Å²	8	52.1 Å²	52.1	5%	0.048	27%	0.267	C	S	.	.	H	α-helix	trans	-59.5	-50.4	174.9	174.6	0	0	0	0	111.4	E537 K538 F543 I544 D545 R574 Q578 I581	E537-V541 WeakPolarHBondContact O-CG2 3.22Å; E537-V541 PolarHBondContact O-N 2.76Å; K538-V541 PolarHBondContact O-N 2.85Å; V541-F543 VanDerWaalsContact C-N 3.35Å; V541-F543 PolarHBondContact O-N 2.87Å; V541-I544 PolarHBondContact O-N 3.45Å; V541-D545 VanDerWaalsContact O-CG 3.29Å; V541-D545 PolarHBondContact O-N 3.05Å; V541-R574 VanDerWaalsContact CG1-NH2 3.29Å; V541-Q578 HydrophobicContact CG2-CB 3.95Å; V541-I581 HydrophobicContact CG2-CD1 4.13Å
542	G	89.7	Confident	93.7	Very high	21 Å²	21	48 Å²	48	22%	0.216	25%	0.25	C	C	.	.	H	α-helix	trans	-64.1	-35.1	178.9	0	0	0	0	0	114	K538 Y546	K538-G542 PolarHBondContact O-N 3.21Å; G542-Y546 WeakPolarHBondContact O-CB 3.31Å; G542-Y546 WeakPolarHBondContact O-CD2 3.33Å; G542-Y546 PolarHBondContact O-N 3.41Å
543	F	96.4	Very high	94.1	Very high	72 Å²	72	45.2 Å²	45.2	32%	0.316	24%	0.237	S	C	.	.	H	α-helix	trans	-65.1	-39.5	173.6	177	-122	0	0	0	111.8	L490 P493 S539 Q540 V541 I547 V548	L490-F543 HydrophobicContact CD2-CE2 4.23Å; L490-F543 HydrophobicContact CD2-CZ 3.75Å; P493-F543 HydrophobicContact CG-CD1 4.32Å; P493-F543 HydrophobicContact CG-CE1 4Å; S539-F543 WeakPolarHBondContact O-CB 3.46Å; S539-F543 PolarHBondContact O-N 2.97Å; Q540-F543 PolarHBondContact O-N 3.29Å; V541-F543 VanDerWaalsContact C-N 3.35Å; V541-F543 PolarHBondContact O-N 2.87Å; F543-I547 HydrophobicContact CD2-CB 4.09Å; F543-I547 HydrophobicContact CD2-CG1 4.25Å; F543-I547 HydrophobicContact CD2-CG2 4.39Å; F543-I547 HydrophobicContact CE2-CB 4.26Å; F543-I547 HydrophobicContact CE2-CG2 4.05Å; F543-I547 WeakPolarHBondContact O-CB 3.4Å; F543-I547 PolarHBondContact O-N 3.34Å; F543-I547 VanDerWaalsContact O-N 3.15Å; F543-V548 HydrophobicContact CD1-CG2 3.8Å; F543-V548 HydrophobicContact CD2-CG2 4.24Å; F543-V548 HydrophobicContact CE1-CG2 3.51Å; F543-V548 HydrophobicContact CE2-CG2 3.97Å; F543-V548 HydrophobicContact CG-CG2 4.18Å; F543-V548 HydrophobicContact CZ-CG2 3.62Å; F543-V548 PolarHBondContact O-N 3.12Å; F543-V548 VanDerWaalsContact O-N 3.1Å
544	I	97.3	Very high	94.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.204	C	C	.	.	I	π-helix	trans	-66.3	-53.7	173.7	-64.1	166.7	0	0	0	110.5	P493 Y500 Q540 V541 Y546 V548 H549 L570 R574	P493-I544 HydrophobicContact CB-CD1 4.08Å; P493-I544 HydrophobicContact CB-CG1 3.94Å; P493-I544 HydrophobicContact CG-CG1 4.47Å; Y500-I544 HydrophobicContact CE1-CD1 4.17Å; Q540-I544 WeakPolarHBondContact O-CG1 3.45Å; Q540-I544 PolarHBondContact O-N 3.31Å; V541-I544 PolarHBondContact O-N 3.45Å; I544-Y546 VanDerWaalsContact C-N 3.33Å; I544-Y546 PolarHBondContact O-N 2.84Å; I544-V548 PolarHBondContact O-N 3.21Å; I544-H549 HydrophobicContact CG2-CB 4.04Å; I544-H549 VanDerWaalsContact O-CB 3.25Å; I544-H549 WeakPolarHBondContact O-CB 3.46Å; I544-H549 PolarHBondContact O-N 2.97Å; I544-L570 HydrophobicContact CB-CD1 4.45Å; I544-L570 HydrophobicContact CD1-CD1 4.11Å; I544-L570 HydrophobicContact CG1-CD1 3.98Å; I544-L570 HydrophobicContact CG2-CD1 3.64Å; I544-L570 HydrophobicContact CG2-CD2 4.37Å; I544-L570 HydrophobicContact CG2-CG 3.96Å; I544-R574 HydrophobicContact CB-CB 4.48Å; I544-R574 HydrophobicContact CB-CG 4.17Å; I544-R574 HydrophobicContact CD1-CB 3.81Å; I544-R574 HydrophobicContact CD1-CG 4.22Å; I544-R574 HydrophobicContact CG2-CB 3.98Å; I544-R574 HydrophobicContact CG2-CG 3.86Å
545	D	91.7	Very high	94.9	Very high	54 Å²	54	38.6 Å²	38.6	29%	0.289	19%	0.193	S	C	.	.	I	π-helix	trans	-59.2	-38.8	-174.7	-69.8	-8.5	0	0	0	113.4	V541 R574	V541-D545 VanDerWaalsContact O-CG 3.29Å; V541-D545 PolarHBondContact O-N 3.05Å; D545-R574 IonicContact OD1-CZ 3.41Å; D545-R574 IonicContact OD1-NE 3.22Å; D545-R574 PolarHBondContact OD1-NE 2.97Å; D545-R574 IonicContact OD1-NH2 3.94Å; D545-R574 PolarHBondContact OD1-NH2 3.07Å; D545-R574 VanDerWaalsContact OD1-NH2 3.14Å; D545-R574 IonicContact OD2-CZ 3.86Å; D545-R574 IonicContact OD2-NE 3.37Å; D545-R574 IonicContact OD2-NH2 3.74Å; D545-R574 PolarHBondContact OD2-NH2 3.41Å
546	Y	88.6	Confident	95.1	Very high	171 Å²	171	37.3 Å²	37.3	67%	0.671	19%	0.185	S	C	*	.	I	π-helix	trans	-104	-16.5	-171.1	-59.5	-54	0	0	0	115.7	G542 I544	G542-Y546 WeakPolarHBondContact O-CB 3.31Å; G542-Y546 WeakPolarHBondContact O-CD2 3.33Å; G542-Y546 PolarHBondContact O-N 3.41Å; I544-Y546 VanDerWaalsContact C-N 3.33Å; I544-Y546 PolarHBondContact O-N 2.84Å
547	I	95.3	Very high	95.1	Very high	42 Å²	42	39.4 Å²	39.4	22%	0.215	20%	0.195	C	C	.	.	I	π-helix	trans	-128	-56.3	-174.5	-56.5	-66.1	0	0	0	111.5	M448 L490 F543 L551	M448-I547 HydrophobicContact CE-CD1 4.11Å; L490-I547 HydrophobicContact CD1-CG2 4.06Å; F543-I547 HydrophobicContact CD2-CB 4.09Å; F543-I547 HydrophobicContact CD2-CG1 4.25Å; F543-I547 HydrophobicContact CD2-CG2 4.39Å; F543-I547 HydrophobicContact CE2-CB 4.26Å; F543-I547 HydrophobicContact CE2-CG2 4.05Å; F543-I547 WeakPolarHBondContact O-CB 3.4Å; F543-I547 PolarHBondContact O-N 3.34Å; F543-I547 VanDerWaalsContact O-N 3.15Å; I547-L551 WeakPolarHBondContact O-CB 3.44Å
548	V	98.1	Very high	95.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.184	C	C	.	.	I	π-helix	trans	-82	-43.5	-166.9	-175.1	0	0	0	0	112.1	P493 F543 I544 L551 W552 L570	P493-V548 HydrophobicContact CB-CG1 4.22Å; P493-V548 HydrophobicContact CG-CG1 4.12Å; P493-V548 HydrophobicContact CG-CG2 4.26Å; F543-V548 HydrophobicContact CD1-CG2 3.8Å; F543-V548 HydrophobicContact CD2-CG2 4.24Å; F543-V548 HydrophobicContact CE1-CG2 3.51Å; F543-V548 HydrophobicContact CE2-CG2 3.97Å; F543-V548 HydrophobicContact CG-CG2 4.18Å; F543-V548 HydrophobicContact CZ-CG2 3.62Å; F543-V548 PolarHBondContact O-N 3.12Å; F543-V548 VanDerWaalsContact O-N 3.1Å; I544-V548 PolarHBondContact O-N 3.21Å; V548-L551 PolarHBondContact O-N 2.81Å; V548-W552 PolarHBondContact O-N 3.17Å; V548-L570 HydrophobicContact CG1-CD1 4.19Å; V548-L570 HydrophobicContact CG1-CD2 4.24Å
549	H	96	Very high	95.2	Very high	45 Å²	45	31.8 Å²	31.8	21%	0.208	16%	0.161	C	C	.	.	H	α-helix	trans	-64.5	-49.1	177.9	-169.5	-62.7	0	0	0	112.5	I544 L551 W552 E553 L570	I544-H549 HydrophobicContact CG2-CB 4.04Å; I544-H549 VanDerWaalsContact O-CB 3.25Å; I544-H549 WeakPolarHBondContact O-CB 3.46Å; I544-H549 PolarHBondContact O-N 2.97Å; H549-L551 PolarHBondContact O-N 3.22Å; H549-W552 PolarHBondContact O-N 3.44Å; H549-E553 WeakPolarHBondContact O-CB 3.31Å; H549-E553 PolarHBondContact O-N 3.32Å; H549-L570 HydrophobicContact CB-CD2 4.11Å
550	P	96.8	Very high	95.1	Very high	27 Å²	27	36 Å²	36	18%	0.175	18%	0.177	C	C	.	.	H	α-helix	trans	-60.5	-30.8	178.7	-24.2	35.7	0	0	0	113.5	L451 T554	L451-P550 WeakPolarHBondContact CD1-O 3.41Å; L451-P550 HydrophobicContact CD2-CB 4.16Å; P550-T554 WeakPolarHBondContact O-CB 3.48Å; P550-T554 PolarHBondContact O-N 2.95Å; P550-T554 PolarHBondContact O-OG1 2.84Å
551	L	97.3	Very high	94.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-70.8	-54.2	174.8	178.4	64.9	0	0	0	112	L454 L490 I547 V548 H549 E553 T554 W555	L454-L551 HydrophobicContact CD2-CD1 4.3Å; L490-L551 HydrophobicContact CB-CD2 4.18Å; L490-L551 HydrophobicContact CD1-CD2 3.66Å; I547-L551 WeakPolarHBondContact O-CB 3.44Å; V548-L551 PolarHBondContact O-N 2.81Å; H549-L551 PolarHBondContact O-N 3.22Å; L551-E553 VanDerWaalsContact C-N 3.34Å; L551-E553 PolarHBondContact O-N 3.36Å; L551-T554 PolarHBondContact O-N 2.99Å; L551-W555 WeakPolarHBondContact O-CB 3.31Å; L551-W555 PolarHBondContact O-N 2.9Å
552	W	98.4	Very high	94.8	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.008	22%	0.215	C	C	.	.	H	α-helix	trans	-69.3	-32	-177.1	-82.5	100.9	0	0	0	112.8	W273 L346 C487 L490 T494 V548 H549 W555 A556 I566 L567 L570	W273-W552 AromaticContact CH2-CH2 3.54Å; W273-W552 HydrophobicContact CH2-CH2 3.54Å; W273-W552 AromaticContact CH2-CZ2 3.94Å; W273-W552 HydrophobicContact CH2-CZ2 3.94Å; W273-W552 AromaticContact CZ2-CH2 3.62Å; W273-W552 HydrophobicContact CZ2-CH2 3.62Å; W273-W552 AromaticContact CZ2-CZ2 3.82Å; W273-W552 HydrophobicContact CZ2-CZ2 3.82Å; L346-W552 HydrophobicContact CD1-CH2 4.16Å; L346-W552 HydrophobicContact CD2-CH2 4.14Å; L346-W552 HydrophobicContact CD2-CZ3 4.19Å; C487-W552 HydrophobicContact CB-CH2 4.05Å; C487-W552 HydrophobicContact CB-CZ2 3.85Å; C487-W552 HydrophobicContact CB-CZ3 4.49Å; C487-W552 WeakPolarHBondContact O-CZ2 3.42Å; L490-W552 PolarHBondContact O-NE1 3.28Å; T494-W552 HydrophobicContact CG2-CD2 4.01Å; T494-W552 HydrophobicContact CG2-CG 3.92Å; T494-W552 HydrophobicContact CG2-CZ2 4.39Å; V548-W552 PolarHBondContact O-N 3.17Å; H549-W552 PolarHBondContact O-N 3.44Å; W552-W555 HydrophobicContact CE3-CB 4.48Å; W552-W555 AromaticContact CE3-CD1 3.8Å; W552-W555 HydrophobicContact CE3-CG 4.33Å; W552-W555 AromaticContact CZ3-CD1 3.7Å; W552-W555 HydrophobicContact CZ3-CG 4.43Å; W552-W555 PolarHBondContact O-N 2.68Å; W552-A556 VanDerWaalsContact O-CB 3.29Å; W552-A556 WeakPolarHBondContact O-CB 3.48Å; W552-A556 PolarHBondContact O-N 3.14Å; W552-I566 HydrophobicContact CD2-CG2 4.22Å; W552-I566 HydrophobicContact CE3-CG2 3.78Å; W552-I566 HydrophobicContact CH2-CG2 4.11Å; W552-I566 HydrophobicContact CZ3-CD1 4.07Å; W552-I566 HydrophobicContact CZ3-CG2 3.74Å; W552-L567 HydrophobicContact CB-CD2 3.91Å; W552-L570 HydrophobicContact CB-CD2 4.21Å
553	E	97.1	Very high	95	Very high	83 Å²	83	41.5 Å²	41.5	39%	0.388	21%	0.207	S	C	.	.	H	α-helix	trans	-58.2	-53.1	169.2	177.4	-177.1	-135	0	0	110.3	H549 L551 W555 A556 D557	H549-E553 WeakPolarHBondContact O-CB 3.31Å; H549-E553 PolarHBondContact O-N 3.32Å; L551-E553 VanDerWaalsContact C-N 3.34Å; L551-E553 PolarHBondContact O-N 3.36Å; E553-W555 VanDerWaalsContact C-N 3.31Å; E553-W555 PolarHBondContact O-N 3.39Å; E553-A556 PolarHBondContact O-N 3.48Å; E553-D557 PolarHBondContact O-N 2.96Å
554	T	94.8	Very high	95	Very high	4 Å²	4	42.3 Å²	42.3	3%	0.025	21%	0.212	C	C	.	.	H	α-helix	trans	-64.2	-35.5	178.3	-49.9	0	0	0	0	112.2	L451 L454 K455 V458 P550 L551 L558	L451-T554 HydrophobicContact CD1-CG2 4.38Å; L451-T554 WeakPolarHBondContact CD1-OG1 3.4Å; L454-T554 HydrophobicContact CB-CG2 4.1Å; L454-T554 HydrophobicContact CD2-CG2 3.79Å; L454-T554 HydrophobicContact CG-CG2 3.72Å; K455-T554 HydrophobicContact CB-CG2 4.31Å; K455-T554 WeakPolarHBondContact CE-OG1 3.43Å; K455-T554 HydrophobicContact CG-CG2 3.44Å; K455-T554 VanDerWaalsContact CG-CG2 3.44Å; V458-T554 HydrophobicContact CG2-CG2 3.94Å; V458-T554 WeakPolarHBondContact CG2-O 3.33Å; P550-T554 WeakPolarHBondContact O-CB 3.48Å; P550-T554 PolarHBondContact O-N 2.95Å; P550-T554 PolarHBondContact O-OG1 2.84Å; L551-T554 PolarHBondContact O-N 2.99Å; T554-L558 PolarHBondContact O-N 3.42Å; T554-L558 VanDerWaalsContact O-N 3.09Å
555	W	97.7	Very high	95	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.9	-45.9	174.5	178.3	-93.7	0	0	0	111.6	L346 L352 L454 V480 N483 M484 L551 W552 E553 D557 L558 V559	L346-W555 HydrophobicContact CB-CZ2 4.33Å; L346-W555 HydrophobicContact CD1-CZ2 4.49Å; L346-W555 HydrophobicContact CD2-CZ2 4.23Å; L352-W555 HydrophobicContact CD1-CH2 4.16Å; L352-W555 HydrophobicContact CD1-CZ2 4.18Å; L454-W555 HydrophobicContact CD2-CB 4.49Å; V480-W555 HydrophobicContact CG1-CH2 4.06Å; V480-W555 HydrophobicContact CG1-CZ3 4.09Å; N483-W555 HydrophobicContact CB-CE3 4.49Å; N483-W555 HydrophobicContact CB-CZ3 4.4Å; M484-W555 HydrophobicContact CB-CH2 3.68Å; M484-W555 HydrophobicContact CB-CZ3 3.98Å; M484-W555 HydrophobicContact CE-CH2 3.73Å; M484-W555 HydrophobicContact CE-CZ2 4.15Å; M484-W555 HydrophobicContact CG-CH2 3.92Å; M484-W555 HydrophobicContact CG-CZ2 4.36Å; L551-W555 WeakPolarHBondContact O-CB 3.31Å; L551-W555 PolarHBondContact O-N 2.9Å; W552-W555 HydrophobicContact CE3-CB 4.48Å; W552-W555 AromaticContact CE3-CD1 3.8Å; W552-W555 HydrophobicContact CE3-CG 4.33Å; W552-W555 AromaticContact CZ3-CD1 3.7Å; W552-W555 HydrophobicContact CZ3-CG 4.43Å; W552-W555 PolarHBondContact O-N 2.68Å; E553-W555 VanDerWaalsContact C-N 3.31Å; E553-W555 PolarHBondContact O-N 3.39Å; W555-D557 VanDerWaalsContact C-N 3.33Å; W555-D557 PolarHBondContact O-N 3.47Å; W555-L558 WeakPolarHBondContact O-CB 3.29Å; W555-L558 PolarHBondContact O-N 2.69Å; W555-V559 HydrophobicContact CZ2-CG1 4.2Å; W555-V559 WeakPolarHBondContact O-CG2 3.44Å; W555-V559 PolarHBondContact O-N 2.86Å
556	A	96.6	Very high	95.3	Very high	10 Å²	10	46.9 Å²	46.9	8%	0.083	24%	0.236	C	C	.	.	H	α-helix	trans	-63.3	-38.6	176.4	0	0	0	0	0	111.9	W552 E553 L558 V559 Q560 A563 L567	W552-A556 VanDerWaalsContact O-CB 3.29Å; W552-A556 WeakPolarHBondContact O-CB 3.48Å; W552-A556 PolarHBondContact O-N 3.14Å; E553-A556 PolarHBondContact O-N 3.48Å; A556-L558 VanDerWaalsContact C-N 3.27Å; A556-L558 PolarHBondContact O-N 3.23Å; A556-V559 CarbonylContact O-C 3.59Å; A556-V559 PolarHBondContact O-N 2.88Å; A556-Q560 VanDerWaalsContact O-CA 3.25Å; A556-Q560 WeakPolarHBondContact O-CA 3.38Å; A556-Q560 WeakPolarHBondContact O-CB 3.46Å; A556-Q560 PolarHBondContact O-N 3.21Å; A556-A563 HydrophobicContact CB-CB 3.93Å; A556-L567 HydrophobicContact CB-CD1 3.58Å; A556-L567 HydrophobicContact CB-CG 4.09Å
557	D	94	Very high	95.8	Very high	78 Å²	78	39.7 Å²	39.7	42%	0.417	21%	0.209	S	C	.	.	H	α-helix	trans	-60.9	-33.7	170.8	-94.9	-17.3	0	0	0	112.3	V458 K461 E553 W555	V458-D557 HydrophobicContact CG1-CB 3.89Å; V458-D557 HydrophobicContact CG2-CB 4.23Å; K461-D557 PolarHBondContact NZ-O 3.13Å; E553-D557 PolarHBondContact O-N 2.96Å; W555-D557 VanDerWaalsContact C-N 3.33Å; W555-D557 PolarHBondContact O-N 3.47Å
558	L	93.4	Very high	95.9	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-68.2	-49	174.2	-173.5	64.9	0	0	0	111.4	L454 M457 V458 K461 L469 V480 T554 W555 A556	L454-L558 HydrophobicContact CD1-CD2 3.85Å; M457-L558 HydrophobicContact CG-CD1 4.24Å; M457-L558 HydrophobicContact SD-CD1 4.49Å; M457-L558 HydrophobicContact SD-CD2 4.5Å; V458-L558 HydrophobicContact CG2-CB 3.89Å; V458-L558 HydrophobicContact CG2-CD1 4.24Å; K461-L558 HydrophobicContact CB-CD1 4.38Å; K461-L558 HydrophobicContact CD-CD1 4.44Å; L469-L558 HydrophobicContact CD1-CD1 4.11Å; L469-L558 HydrophobicContact CD2-CD1 3.93Å; L469-L558 HydrophobicContact CD2-CD2 4.19Å; L469-L558 HydrophobicContact CD2-CG 4.04Å; V480-L558 HydrophobicContact CG1-CD2 4.44Å; V480-L558 HydrophobicContact CG2-CD2 4.12Å; T554-L558 PolarHBondContact O-N 3.42Å; T554-L558 VanDerWaalsContact O-N 3.09Å; W555-L558 WeakPolarHBondContact O-CB 3.29Å; W555-L558 PolarHBondContact O-N 2.69Å; A556-L558 VanDerWaalsContact C-N 3.27Å; A556-L558 PolarHBondContact O-N 3.23Å
559	V	95.2	Very high	95.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.233	C	C	.	.	S	Bend	trans	-101.5	21.2	-172	-53.4	0	0	0	0	115.2	T349 T351 L352 W555 A556 D562 A563	T349-V559 HydrophobicContact CG2-CB 3.69Å; T349-V559 HydrophobicContact CG2-CG1 3.99Å; T349-V559 HydrophobicContact CG2-CG2 3.97Å; T351-V559 HydrophobicContact CG2-CB 4.37Å; T351-V559 PolarHBondContact OG1-O 2.87Å; L352-V559 HydrophobicContact CD1-CG1 4.15Å; L352-V559 HydrophobicContact CD2-CG1 4.39Å; L352-V559 HydrophobicContact CG-CG1 4.17Å; W555-V559 HydrophobicContact CZ2-CG1 4.2Å; W555-V559 WeakPolarHBondContact O-CG2 3.44Å; W555-V559 PolarHBondContact O-N 2.86Å; A556-V559 CarbonylContact O-C 3.59Å; A556-V559 PolarHBondContact O-N 2.88Å; V559-D562 HydrophobicContact CG2-CB 4.42Å; V559-D562 WeakPolarHBondContact O-CB 3.31Å; V559-D562 PolarHBondContact O-N 3.26Å; V559-A563 HydrophobicContact CG2-CB 3.93Å
560	Q	90.2	Very high	96.1	Very high	127 Å²	127	41.7 Å²	41.7	59%	0.593	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	128.1	-174.8	-171.8	-176	52.2	0	0	112.1	A556	A556-Q560 VanDerWaalsContact O-CA 3.25Å; A556-Q560 WeakPolarHBondContact O-CA 3.38Å; A556-Q560 WeakPolarHBondContact O-CB 3.46Å; A556-Q560 PolarHBondContact O-N 3.21Å
561	P	93.1	Very high	96.1	Very high	93 Å²	93	44.9 Å²	44.9	60%	0.604	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	cis	-98.8	6	12.6	39.7	-36.6	0	0	0	115.2	A563 Q564	P561-A563 PolarHBondContact O-N 2.96Å; P561-Q564 PolarHBondContact O-N 3.16Å
562	D	92.6	Very high	96.2	Very high	58 Å²	58	50.7 Å²	50.7	31%	0.31	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-11.7	-156	-60.8	-36.3	0	0	0	115.9	T349 P350 T351 V559	T349-D562 HydrophobicContact CG2-CB 3.67Å; T349-D562 WeakPolarHBondContact CG2-OD2 3.43Å; P350-D562 WeakPolarHBondContact CD-OD2 3.5Å; T351-D562 VanDerWaalsContact CB-OD2 3.29Å; T351-D562 WeakPolarHBondContact CB-OD2 3.41Å; T351-D562 PolarHBondContact N-OD2 3.15Å; T351-D562 PolarHBondContact OG1-OD2 3.49Å; V559-D562 HydrophobicContact CG2-CB 4.42Å; V559-D562 WeakPolarHBondContact O-CB 3.31Å; V559-D562 PolarHBondContact O-N 3.26Å
563	A	95.3	Very high	96.2	Very high	4 Å²	4	50.8 Å²	50.8	3%	0.033	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	10.5	-176.8	0	0	0	0	0	114.4	A556 V559 P561 D565 I566 L567	A556-A563 HydrophobicContact CB-CB 3.93Å; V559-A563 HydrophobicContact CG2-CB 3.93Å; P561-A563 PolarHBondContact O-N 2.96Å; A563-D565 PolarHBondContact O-N 3.38Å; A563-I566 HydrophobicContact CB-CD1 4.35Å; A563-I566 WeakPolarHBondContact O-CB 3.38Å; A563-I566 PolarHBondContact O-N 3.16Å; A563-I566 VanDerWaalsContact O-N 3.12Å; A563-L567 PolarHBondContact O-N 3.37Å
564	Q	96.4	Very high	96.3	Very high	90 Å²	90	49.2 Å²	49.2	42%	0.421	26%	0.258	S	S	.	.	H	α-helix	trans	-59.2	-48.5	-176.5	-170.2	63.5	57.9	0	0	112.6	P561 I566 L567 D568	P561-Q564 PolarHBondContact O-N 3.16Å; Q564-I566 PolarHBondContact O-N 3.26Å; Q564-L567 WeakPolarHBondContact O-CA 3.29Å; Q564-L567 WeakPolarHBondContact O-CB 3.44Å; Q564-L567 PolarHBondContact O-N 3Å; Q564-D568 PolarHBondContact NE2-OD1 3.03Å; Q564-D568 PolarHBondContact O-N 2.94Å
565	D	96.9	Very high	96.4	Very high	131 Å²	131	52.7 Å²	52.7	70%	0.701	28%	0.276	S	S	*	.	H	α-helix	trans	-55.7	-26.2	177.9	-60	4.7	0	0	0	113	A563 T569	A563-D565 PolarHBondContact O-N 3.38Å; D565-T569 WeakPolarHBondContact O-CB 3.5Å; D565-T569 PolarHBondContact O-N 3.42Å; D565-T569 PolarHBondContact O-OG1 2.93Å
566	I	98.1	Very high	96.5	Very high	19 Å²	19	56.1 Å²	56.1	10%	0.097	29%	0.289	C	S	.	.	H	α-helix	trans	-77.4	-36.8	178.4	-54.4	-178.4	0	0	0	110.7	W273 T494 W552 A563 Q564 L570	W273-I566 HydrophobicContact CD2-CD1 4.11Å; W273-I566 HydrophobicContact CE3-CD1 4.49Å; W273-I566 HydrophobicContact CG-CD1 4.35Å; W273-I566 HydrophobicContact CG-CG1 4.39Å; W273-I566 HydrophobicContact CZ2-CG2 4.37Å; T494-I566 HydrophobicContact CG2-CG2 3.91Å; T494-I566 VanDerWaalsContact OG1-CG2 3.28Å; T494-I566 WeakPolarHBondContact OG1-CG2 3.15Å; W552-I566 HydrophobicContact CD2-CG2 4.22Å; W552-I566 HydrophobicContact CE3-CG2 3.78Å; W552-I566 HydrophobicContact CH2-CG2 4.11Å; W552-I566 HydrophobicContact CZ3-CD1 4.07Å; W552-I566 HydrophobicContact CZ3-CG2 3.74Å; A563-I566 HydrophobicContact CB-CD1 4.35Å; A563-I566 WeakPolarHBondContact O-CB 3.38Å; A563-I566 PolarHBondContact O-N 3.16Å; A563-I566 VanDerWaalsContact O-N 3.12Å; Q564-I566 PolarHBondContact O-N 3.26Å; I566-L570 WeakPolarHBondContact O-CB 3.39Å; I566-L570 PolarHBondContact O-N 2.67Å; I566-L570 VanDerWaalsContact O-N 3.15Å
567	L	97.9	Very high	96.5	Very high	20 Å²	20	56.1 Å²	56.1	11%	0.105	29%	0.287	C	S	.	.	H	α-helix	trans	-70.4	-46.7	171.9	-72	-179.1	0	0	0	111.9	W552 A556 A563 Q564 T569 L570 E571	W552-L567 HydrophobicContact CB-CD2 3.91Å; A556-L567 HydrophobicContact CB-CD1 3.58Å; A556-L567 HydrophobicContact CB-CG 4.09Å; A563-L567 PolarHBondContact O-N 3.37Å; Q564-L567 WeakPolarHBondContact O-CA 3.29Å; Q564-L567 WeakPolarHBondContact O-CB 3.44Å; Q564-L567 PolarHBondContact O-N 3Å; L567-T569 PolarHBondContact O-N 3.37Å; L567-L570 WeakPolarHBondContact O-CA 3.42Å; L567-L570 WeakPolarHBondContact O-CB 3.33Å; L567-L570 PolarHBondContact O-N 2.92Å; L567-E571 PolarHBondContact O-N 2.9Å
568	D	98	Very high	96.7	Very high	82 Å²	82	56.4 Å²	56.4	44%	0.439	29%	0.286	S	S	.	.	H	α-helix	trans	-57.1	-42.2	178.7	-67.2	18.2	0	0	0	110.3	Q564 E571 D572	Q564-D568 PolarHBondContact NE2-OD1 3.03Å; Q564-D568 PolarHBondContact O-N 2.94Å; D568-E571 PolarHBondContact O-N 3Å; D568-D572 PolarHBondContact O-N 3.26Å
569	T	98.6	Very high	96.8	Very high	46 Å²	46	60.5 Å²	60.5	28%	0.282	32%	0.315	S	S	.	.	H	α-helix	trans	-65.2	-36.7	174.2	-57.6	0	0	0	0	112.7	T494 K495 D565 L567 N573	T494-T569 WeakPolarHBondContact O-CG2 3.45Å; K495-T569 WeakPolarHBondContact O-CG2 3.44Å; D565-T569 WeakPolarHBondContact O-CB 3.5Å; D565-T569 PolarHBondContact O-N 3.42Å; D565-T569 PolarHBondContact O-OG1 2.93Å; L567-T569 PolarHBondContact O-N 3.37Å; T569-N573 WeakPolarHBondContact O-CB 3.41Å; T569-N573 VanDerWaalsContact O-CG 3.28Å; T569-N573 PolarHBondContact O-N 3.27Å; T569-N573 PolarHBondContact O-ND2 3.18Å
570	L	98.7	Very high	96.8	Very high	0 Å²	0	65 Å²	65	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-66.8	-43.7	176.9	-179	57	0	0	0	111.7	P493 T494 I544 V548 H549 W552 I566 L567 N573 R574	P493-L570 HydrophobicContact CB-CD1 3.6Å; P493-L570 WeakPolarHBondContact O-CD1 3.37Å; T494-L570 HydrophobicContact CG2-CB 4.06Å; T494-L570 HydrophobicContact CG2-CD1 4.07Å; T494-L570 HydrophobicContact CG2-CD2 4.09Å; T494-L570 HydrophobicContact CG2-CG 4.3Å; I544-L570 HydrophobicContact CB-CD1 4.45Å; I544-L570 HydrophobicContact CD1-CD1 4.11Å; I544-L570 HydrophobicContact CG1-CD1 3.98Å; I544-L570 HydrophobicContact CG2-CD1 3.64Å; I544-L570 HydrophobicContact CG2-CD2 4.37Å; I544-L570 HydrophobicContact CG2-CG 3.96Å; V548-L570 HydrophobicContact CG1-CD1 4.19Å; V548-L570 HydrophobicContact CG1-CD2 4.24Å; H549-L570 HydrophobicContact CB-CD2 4.11Å; W552-L570 HydrophobicContact CB-CD2 4.21Å; I566-L570 WeakPolarHBondContact O-CB 3.39Å; I566-L570 PolarHBondContact O-N 2.67Å; I566-L570 VanDerWaalsContact O-N 3.15Å; L567-L570 WeakPolarHBondContact O-CA 3.42Å; L567-L570 WeakPolarHBondContact O-CB 3.33Å; L567-L570 PolarHBondContact O-N 2.92Å; L570-N573 PolarHBondContact O-N 3.28Å; L570-R574 VanDerWaalsContact O-CB 3.22Å; L570-R574 WeakPolarHBondContact O-CB 3.48Å; L570-R574 PolarHBondContact O-N 3.44Å
571	E	98.3	Very high	96.9	Very high	95 Å²	95	60.5 Å²	60.5	44%	0.444	32%	0.317	S	S	.	.	H	α-helix	trans	-61.8	-47.2	174.9	-74.4	-166.7	-147.3	0	0	111.5	L567 D568 N573 R574 N575	L567-E571 PolarHBondContact O-N 2.9Å; D568-E571 PolarHBondContact O-N 3Å; E571-N573 PolarHBondContact O-N 3.44Å; E571-R574 PolarHBondContact O-N 2.56Å; E571-N575 VanDerWaalsContact O-CB 3.31Å; E571-N575 WeakPolarHBondContact O-CB 3.24Å; E571-N575 PolarHBondContact O-N 3.32Å; E571-N575 PolarHBondContact O-ND2 3.44Å
572	D	98.6	Very high	96.6	Very high	121 Å²	121	60 Å²	60	65%	0.647	31%	0.314	S	S	*	.	H	α-helix	trans	-60	-45.4	177.2	-97.2	-8.8	0	0	0	112	D568 N575 W576	D568-D572 PolarHBondContact O-N 3.26Å; D572-N575 PolarHBondContact O-N 2.91Å; D572-W576 WeakPolarHBondContact O-CB 3.36Å; D572-W576 PolarHBondContact O-N 3.48Å
573	N	98.7	Very high	95.8	Very high	5 Å²	5	66.1 Å²	66.1	3%	0.027	34%	0.341	C	S	.	.	H	α-helix	trans	-63.1	-42	176.1	-79.7	-24.4	0	0	0	112.5	P493 K495 L497 Y500 T569 L570 E571 W576 Y577	P493-N573 PolarHBondContact O-ND2 2.87Å; K495-N573 PolarHBondContact O-ND2 3.31Å; L497-N573 WeakPolarHBondContact CA-OD1 3.44Å; L497-N573 WeakPolarHBondContact CB-OD1 3.45Å; L497-N573 WeakPolarHBondContact CD1-OD1 3.35Å; Y500-N573 HydrophobicContact CD1-CB 3.83Å; Y500-N573 HydrophobicContact CE1-CB 4.03Å; T569-N573 WeakPolarHBondContact O-CB 3.41Å; T569-N573 VanDerWaalsContact O-CG 3.28Å; T569-N573 PolarHBondContact O-N 3.27Å; T569-N573 PolarHBondContact O-ND2 3.18Å; L570-N573 PolarHBondContact O-N 3.28Å; E571-N573 PolarHBondContact O-N 3.44Å; N573-W576 PolarHBondContact O-N 3.2Å; N573-Y577 PolarHBondContact O-N 2.92Å
574	R	98.4	Very high	94.2	Very high	49 Å²	49	70.6 Å²	70.6	19%	0.185	37%	0.371	C	S	.	.	H	α-helix	trans	-62.3	-44.5	175.8	-175.3	-119.1	177.7	-102	-13.1	111.2	V541 I544 D545 L570 E571 Y577 Q578	V541-R574 VanDerWaalsContact CG1-NH2 3.29Å; I544-R574 HydrophobicContact CB-CB 4.48Å; I544-R574 HydrophobicContact CB-CG 4.17Å; I544-R574 HydrophobicContact CD1-CB 3.81Å; I544-R574 HydrophobicContact CD1-CG 4.22Å; I544-R574 HydrophobicContact CG2-CB 3.98Å; I544-R574 HydrophobicContact CG2-CG 3.86Å; D545-R574 IonicContact OD1-CZ 3.41Å; D545-R574 IonicContact OD1-NE 3.22Å; D545-R574 PolarHBondContact OD1-NE 2.97Å; D545-R574 IonicContact OD1-NH2 3.94Å; D545-R574 PolarHBondContact OD1-NH2 3.07Å; D545-R574 VanDerWaalsContact OD1-NH2 3.14Å; D545-R574 IonicContact OD2-CZ 3.86Å; D545-R574 IonicContact OD2-NE 3.37Å; D545-R574 IonicContact OD2-NH2 3.74Å; D545-R574 PolarHBondContact OD2-NH2 3.41Å; L570-R574 VanDerWaalsContact O-CB 3.22Å; L570-R574 WeakPolarHBondContact O-CB 3.48Å; L570-R574 PolarHBondContact O-N 3.44Å; E571-R574 PolarHBondContact O-N 2.56Å; R574-Y577 PolarHBondContact O-N 2.9Å; R574-Q578 VanDerWaalsContact O-CB 3.25Å; R574-Q578 WeakPolarHBondContact O-CB 3.44Å; R574-Q578 PolarHBondContact O-N 3.05Å
575	N	98.2	Very high	92.1	Very high	77 Å²	77	72.2 Å²	72.2	41%	0.412	39%	0.39	S	S	.	.	H	α-helix	trans	-67.5	-35.3	177.4	-70.6	-34.9	0	0	0	112	E571 D572 Q578 S579	E571-N575 VanDerWaalsContact O-CB 3.31Å; E571-N575 WeakPolarHBondContact O-CB 3.24Å; E571-N575 PolarHBondContact O-N 3.32Å; E571-N575 PolarHBondContact O-ND2 3.44Å; D572-N575 PolarHBondContact O-N 2.91Å; N575-Q578 PolarHBondContact O-N 3.38Å; N575-S579 WeakPolarHBondContact O-CB 3.44Å; N575-S579 PolarHBondContact O-N 3.37Å
576	W	98.4	Very high	89.6	Confident	72 Å²	72	70.8 Å²	70.8	27%	0.273	39%	0.39	S	S	.	.	H	α-helix	trans	-61.9	-53.3	172.2	-173	85.3	0	0	0	111.6	L497 R501 D572 N573 Q578 S579 M580	L497-W576 HydrophobicContact CD1-CB 4.41Å; L497-W576 HydrophobicContact CD1-CD2 3.82Å; L497-W576 HydrophobicContact CD1-CE3 3.69Å; L497-W576 HydrophobicContact CD1-CG 4.12Å; L497-W576 HydrophobicContact CD1-CZ3 4.29Å; L497-W576 HydrophobicContact CD2-CB 4.38Å; L497-W576 HydrophobicContact CD2-CD2 3.78Å; L497-W576 HydrophobicContact CD2-CE3 4.46Å; L497-W576 HydrophobicContact CD2-CG 3.69Å; L497-W576 HydrophobicContact CG-CD2 4.4Å; R501-W576 HydrophobicContact CG-CH2 4.36Å; R501-W576 HydrophobicContact CG-CZ3 4.13Å; D572-W576 WeakPolarHBondContact O-CB 3.36Å; D572-W576 PolarHBondContact O-N 3.48Å; N573-W576 PolarHBondContact O-N 3.2Å; W576-Q578 VanDerWaalsContact C-N 3.31Å; W576-Q578 PolarHBondContact O-N 2.97Å; W576-S579 WeakPolarHBondContact O-CB 3.47Å; W576-S579 PolarHBondContact O-N 2.85Å; W576-S579 PolarHBondContact O-OG 2.73Å; W576-M580 HydrophobicContact CD2-CG 3.96Å; W576-M580 HydrophobicContact CE3-CG 4Å; W576-M580 HydrophobicContact CH2-CE 4.21Å; W576-M580 HydrophobicContact CH2-CG 3.73Å; W576-M580 HydrophobicContact CH2-SD 4.27Å; W576-M580 HydrophobicContact CZ2-CE 4.23Å; W576-M580 HydrophobicContact CZ2-CG 3.67Å; W576-M580 HydrophobicContact CZ2-SD 3.86Å; W576-M580 HydrophobicContact CZ3-CG 3.9Å; W576-M580 WeakPolarHBondContact O-CG 3.37Å; W576-M580 PolarHBondContact O-N 3.46Å; W576-M580 VanDerWaalsContact O-N 3.1Å
577	Y	97.7	Very high	87.3	Confident	11 Å²	11	75.2 Å²	75.2	4%	0.043	42%	0.42	C	S	.	.	H	α-helix	trans	-60.9	-39.1	176.7	-87.3	-69.3	0	0	0	112.4	Y500 T504 E537 Q540 N573 R574 S579 M580 I581	Y500-Y577 HydrophobicContact CD1-CD2 4.36Å; Y500-Y577 AromaticContact CD1-CE2 3.77Å; Y500-Y577 HydrophobicContact CD1-CE2 3.77Å; Y500-Y577 AromaticContact CE1-CD2 3.68Å; Y500-Y577 HydrophobicContact CE1-CD2 3.68Å; Y500-Y577 AromaticContact CE1-CE2 3.34Å; Y500-Y577 HydrophobicContact CE1-CE2 3.34Å; Y500-Y577 HydrophobicContact CE2-CE2 4.45Å; Y500-Y577 HydrophobicContact CG-CE2 4.5Å; Y500-Y577 AromaticContact CZ-CE2 3.7Å; T504-Y577 WeakPolarHBondContact CB-OH 3.43Å; T504-Y577 HydrophobicContact CG2-CE1 4.5Å; T504-Y577 WeakPolarHBondContact CG2-OH 3.33Å; T504-Y577 PolarHBondContact OG1-OH 3.3Å; E537-Y577 HydrophobicContact CB-CD1 4.21Å; E537-Y577 HydrophobicContact CG-CD1 4.41Å; Q540-Y577 HydrophobicContact CB-CD1 4.01Å; Q540-Y577 HydrophobicContact CB-CD2 4.01Å; Q540-Y577 HydrophobicContact CB-CE1 4.3Å; Q540-Y577 HydrophobicContact CB-CE2 4.29Å; Q540-Y577 HydrophobicContact CB-CG 3.86Å; Q540-Y577 HydrophobicContact CG-CD1 4.14Å; Q540-Y577 HydrophobicContact CG-CD2 4.4Å; Q540-Y577 HydrophobicContact CG-CE1 3.92Å; Q540-Y577 HydrophobicContact CG-CE2 4.19Å; Q540-Y577 HydrophobicContact CG-CG 4.37Å; N573-Y577 PolarHBondContact O-N 2.92Å; R574-Y577 PolarHBondContact O-N 2.9Å; Y577-S579 VanDerWaalsContact C-N 3.25Å; Y577-S579 PolarHBondContact O-N 3.39Å; Y577-M580 PolarHBondContact O-N 2.85Å; Y577-M580 VanDerWaalsContact O-N 3.12Å; Y577-I581 PolarHBondContact O-N 2.8Å
578	Q	97	Very high	85.1	Confident	83 Å²	83	79.6 Å²	79.6	39%	0.388	45%	0.45	S	S	.	.	H	α-helix	trans	-59.1	-34.4	173.7	175.9	63.8	84	0	0	112.9	V541 R574 N575 W576	V541-Q578 HydrophobicContact CG2-CB 3.95Å; R574-Q578 VanDerWaalsContact O-CB 3.25Å; R574-Q578 WeakPolarHBondContact O-CB 3.44Å; R574-Q578 PolarHBondContact O-N 3.05Å; N575-Q578 PolarHBondContact O-N 3.38Å; W576-Q578 VanDerWaalsContact C-N 3.31Å; W576-Q578 PolarHBondContact O-N 2.97Å
579	S	96.9	Very high	82.6	Confident	88 Å²	88	83.7 Å²	83.7	62%	0.615	47%	0.471	S	S	*	.	H	α-helix	trans	-77.2	-25.2	176.7	79	0	0	0	0	113.8	N575 W576 Y577	N575-S579 WeakPolarHBondContact O-CB 3.44Å; N575-S579 PolarHBondContact O-N 3.37Å; W576-S579 WeakPolarHBondContact O-CB 3.47Å; W576-S579 PolarHBondContact O-N 2.85Å; W576-S579 PolarHBondContact O-OG 2.73Å; Y577-S579 VanDerWaalsContact C-N 3.25Å; Y577-S579 PolarHBondContact O-N 3.39Å
580	M	95	Very high	80	Confident	94 Å²	94	89.3 Å²	89.3	46%	0.463	50%	0.499	S	S	.	.	H	α-helix	trans	-84	-14.4	-179.8	-70.9	-65.5	-62.2	0	0	113.8	E537 W576 Y577 P582	E537-M580 HydrophobicContact CG-CB 4.16Å; W576-M580 HydrophobicContact CD2-CG 3.96Å; W576-M580 HydrophobicContact CE3-CG 4Å; W576-M580 HydrophobicContact CH2-CE 4.21Å; W576-M580 HydrophobicContact CH2-CG 3.73Å; W576-M580 HydrophobicContact CH2-SD 4.27Å; W576-M580 HydrophobicContact CZ2-CE 4.23Å; W576-M580 HydrophobicContact CZ2-CG 3.67Å; W576-M580 HydrophobicContact CZ2-SD 3.86Å; W576-M580 HydrophobicContact CZ3-CG 3.9Å; W576-M580 WeakPolarHBondContact O-CG 3.37Å; W576-M580 PolarHBondContact O-N 3.46Å; W576-M580 VanDerWaalsContact O-N 3.1Å; Y577-M580 PolarHBondContact O-N 2.85Å; Y577-M580 VanDerWaalsContact O-N 3.12Å; M580-P582 WeakPolarHBondContact O-CD 3.48Å
581	I	92.8	Very high	77.4	Confident	33 Å²	33	97.4 Å²	97.4	17%	0.169	54%	0.537	C	S	.	.	S	Bend	trans	-56.1	121.4	176.5	-71.8	165.4	0	0	0	109.9	E537 K538 V541 Y577 Q583	E537-I581 HydrophobicContact CB-CG1 3.62Å; K538-I581 HydrophobicContact CB-CD1 4.47Å; K538-I581 HydrophobicContact CD-CG2 4.37Å; K538-I581 VanDerWaalsContact CE-CG2 3.45Å; K538-I581 HydrophobicContact CG-CD1 3.78Å; K538-I581 HydrophobicContact CG-CG1 3.81Å; K538-I581 HydrophobicContact CG-CG2 3.92Å; V541-I581 HydrophobicContact CG2-CD1 4.13Å; Y577-I581 PolarHBondContact O-N 2.8Å; I581-Q583 PolarHBondContact O-N 2.98Å
582	P	86.2	Confident	74.5	Confident	83 Å²	83	100.8 Å²	100.8	54%	0.539	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-58.5	125.1	178.3	-26.3	35.1	0	0	0	111.6	M580 S584	M580-P582 WeakPolarHBondContact O-CD 3.48Å; P582-S584 PolarHBondContact O-N 3.23Å
583	Q	75.2	Confident	71.9	Confident	186 Å²	186	102.8 Å²	102.8	87%	0.869	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-64.2	128.8	170.4	-65.7	-168.7	6.8	0	0	108.9	I581	I581-Q583 PolarHBondContact O-N 2.98Å
584	S	61.8	Low	69.3	Low	97 Å²	97	112.9 Å²	112.9	68%	0.678	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-52.3	135.3	169	-58.8	0	0	0	0	109	P582 S586	P582-S584 PolarHBondContact O-N 3.23Å; S584-S586 PolarHBondContact O-N 2.76Å; S584-S586 VanDerWaalsContact O-N 3.16Å
585	P	52.2	Low	66.6	Low	124 Å²	124	117.6 Å²	117.6	81%	0.805	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-56.9	126.7	176.2	24.6	-33.5	0	0	0	108.7
586	S	44.1	Very low	63.5	Low	101 Å²	101	119.8 Å²	119.8	71%	0.706	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-51.3	139.2	177	-52.9	0	0	0	0	109.6	S584	S584-S586 PolarHBondContact O-N 2.76Å; S584-S586 VanDerWaalsContact O-N 3.16Å
587	P	51.3	Low	60.6	Low	112 Å²	112	126.3 Å²	126.3	73%	0.727	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-53.9	136.9	169.6	25.3	-33.5	0	0	0	108.3	L589	P587-L589 PolarHBondContact O-N 3.34Å
588	P	50.5	Low	57.7	Low	113 Å²	113	129.3 Å²	129.3	73%	0.734	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-57.1	134.3	-178.3	24.4	-33.6	0	0	0	109.2	D590	P588-D590 PolarHBondContact O-N 2.95Å
589	L	45.8	Very low	54.6	Low	168 Å²	168	133.4 Å²	133.4	88%	0.88	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-61	120.5	173.4	-66.6	171.9	0	0	0	108	P587 E591	P587-L589 PolarHBondContact O-N 3.34Å; L589-E591 PolarHBondContact O-N 3.3Å
590	D	43.5	Very low	51.4	Low	163 Å²	163	138.4 Å²	138.4	87%	0.872	76%	0.757	S	S	*	*			trans	-60.7	97.6	-175.8	-79.2	-48.7	0	0	0	111.6	P588	P588-D590 PolarHBondContact O-N 2.95Å
591	E	45.4	Very low	48.7	Very low	171 Å²	171	143 Å²	143	80%	0.799	78%	0.778	S	S	*	*			trans	-69	133.1	157.7	-84.5	-148.5	149.5	0	0	109.6	L589	L589-E591 PolarHBondContact O-N 3.3Å
592	Q	37	Very low	46.2	Very low	165 Å²	165	150.5 Å²	150.5	77%	0.771	81%	0.809	S	S	*	*			trans	83.6	95.6	170.4	-54.7	175.5	42.6	0	0	116.7	R594	Q592-R594 PolarHBondContact O-N 3.22Å
593	N	44.7	Very low	43.6	Very low	164 Å²	164	156.5 Å²	156.5	88%	0.877	83%	0.827	S	S	*	*			trans	-33	99.8	132	-83.2	-88	0	0	0	112.2
594	R	42.3	Very low	41.3	Very low	217 Å²	217	156.7 Å²	156.7	82%	0.819	83%	0.828	S	S	*	*			trans	-173.6	130.9	138.4	-102.2	158.4	-167	-173	3.7	113.6	Q592	Q592-R594 PolarHBondContact O-N 3.22Å
595	D	43.4	Very low	39.6	Very low	148 Å²	148	161.4 Å²	161.4	79%	0.791	84%	0.837	S	S	*	*			trans	56.7	62.3	141.8	-48.9	-22.1	0	0	0	119.1
596	C	32.1	Very low	38.4	Very low	123 Å²	123	163.7 Å²	163.7	83%	0.831	84%	0.836	S	S	*	*			trans	-131.5	33.1	160.2	-110.9	0	0	0	0	114.1	G598	C596-G598 VanDerWaalsContact C-N 3.29Å; C596-G598 PolarHBondContact O-N 3.2Å
597	Q	37.3	Very low	37.5	Very low	209 Å²	209	165.7 Å²	165.7	98%	0.977	84%	0.838	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	73.8	177.4	-165.2	168.5	31.5	0	0	111.5
598	G	37.4	Very low	36.5	Very low	74 Å²	74	165.5 Å²	165.5	76%	0.763	84%	0.835	S	S	*	*	T	Hydrogen-bonded Turn	trans	-178.6	10.7	-178.1	0	0	0	0	0	118.8	C596	C596-G598 VanDerWaalsContact C-N 3.29Å; C596-G598 PolarHBondContact O-N 3.2Å
599	L	30.8	Very low	35.5	Very low	169 Å²	169	166.6 Å²	166.6	89%	0.885	84%	0.835	S	S	*	*			trans	-139.1	51	-177.8	-160.7	72.2	0	0	0	113.4
600	M	30.2	Very low	34.7	Very low	192 Å²	192	166.1 Å²	166.1	95%	0.946	83%	0.833	S	S	*	*			trans	-137.8	41.8	-178.3	-164.6	173.5	162.2	0	0	111.8
601	E	37.8	Very low	34.2	Very low	191 Å²	191	166.9 Å²	166.9	89%	0.893	83%	0.831	S	S	*	*	S	Bend	trans	-137.1	18.6	-173.3	-147	176.5	-123.3	0	0	113.5
602	K	40.5	Very low	33.6	Very low	190 Å²	190	168.3 Å²	168.3	83%	0.826	84%	0.838	S	S	*	*	S	Bend	trans	-142.7	149.3	168.2	-73.3	-168.2	175.5	178.7	0	110.5
603	F	31.6	Very low	33.2	Very low	210 Å²	210	168.1 Å²	168.1	92%	0.921	84%	0.842	S	S	*	*			trans	69.8	55	-171.2	-55.8	-75	0	0	0	115.1
604	Q	26.9	Very low	32.5	Very low	190 Å²	190	166.4 Å²	166.4	89%	0.888	84%	0.843	S	S	*	*			trans	-91.4	126.1	146	-169	167.6	2.8	0	0	107
605	F	26.9	Very low	32	Very low	196 Å²	196	165.3 Å²	165.3	86%	0.86	85%	0.847	S	S	*	*			trans	-96.8	115.4	177.6	-145.6	-86.6	0	0	0	107.8	L607	F605-L607 PolarHBondContact O-N 2.88Å
606	E	26.2	Very low	31.2	Very low	171 Å²	171	161.9 Å²	161.9	80%	0.799	85%	0.846	S	S	*	*			trans	-88.4	102.2	-171.8	-167.7	163.7	-138.8	0	0	109.5	T608	E606-T608 HydrophobicContact CG-CG2 4.49Å; E606-T608 PolarHBondContact O-N 3.39Å
607	L	26.9	Very low	31.5	Very low	143 Å²	143	162.4 Å²	162.4	75%	0.749	85%	0.848	S	S	*	*			trans	-90.4	92.8	176.5	-165	81.1	0	0	0	109	F605 L609	F605-L607 PolarHBondContact O-N 2.88Å; L607-L609 PolarHBondContact O-N 3.17Å; L607-L609 VanDerWaalsContact O-N 3.16Å
608	T	28.6	Very low	31.2	Very low	108 Å²	108	161.6 Å²	161.6	66%	0.663	84%	0.844	S	S	*	*			trans	-70.1	106.1	176.2	50.9	0	0	0	0	110.5	E606	E606-T608 HydrophobicContact CG-CG2 4.49Å; E606-T608 PolarHBondContact O-N 3.39Å
609	L	30	Very low	31	Very low	137 Å²	137	167.9 Å²	167.9	72%	0.717	85%	0.851	S	S	*	*			trans	-102.8	117	159.2	-71.2	171.8	0	0	0	107.3	L607 E611	L607-L609 PolarHBondContact O-N 3.17Å; L607-L609 VanDerWaalsContact O-N 3.16Å; L609-E611 PolarHBondContact O-N 3.04Å
610	D	29.8	Very low	31	Very low	158 Å²	158	169.5 Å²	169.5	85%	0.845	85%	0.854	S	S	*	*			trans	-84.1	103.8	174.5	-64.4	-53.5	0	0	0	109.1
611	E	32	Very low	30.9	Very low	178 Å²	178	164 Å²	164	83%	0.832	85%	0.846	S	S	*	*			trans	-106	122.9	166.7	-66.3	-172.7	162.6	0	0	108.7	L609	L609-E611 PolarHBondContact O-N 3.04Å
612	E	32.4	Very low	30.5	Very low	202 Å²	202	164.6 Å²	164.6	94%	0.944	85%	0.849	S	S	*	*			trans	-87.6	130.4	178.3	-69.7	-166.7	135	0	0	111.8
613	D	30	Very low	29.8	Very low	161 Å²	161	158.7 Å²	158.7	86%	0.861	84%	0.842	S	S	*	*			trans	-64	151.4	-177.4	-75.9	-60.5	0	0	0	115.3
614	S	29.8	Very low	29.7	Very low	127 Å²	127	158 Å²	158	89%	0.888	84%	0.841	S	S	*	*			trans	-154.5	131.4	149.6	-160.4	0	0	0	0	112.2
615	E	31.8	Very low	29.6	Very low	195 Å²	195	153.8 Å²	153.8	91%	0.911	83%	0.833	S	S	*	*			trans	-90.9	125.4	-163.5	-65.4	-174.2	119	0	0	116.7
616	G	27.1	Very low	29.5	Very low	75 Å²	75	154.8 Å²	154.8	77%	0.773	83%	0.833	S	S	*	*			trans	67.8	-171.4	137	0	0	0	0	0	120.3
617	P	37.8	Very low	29.5	Very low	134 Å²	134	156.3 Å²	156.3	87%	0.87	84%	0.837	S	S	*	*			cis	-123.6	-175.1	-8.1	41.8	-27.8	0	0	0	114.3
618	E	31.6	Very low	29.5	Very low	192 Å²	192	153.8 Å²	153.8	90%	0.897	83%	0.831	S	S	*	*			trans	-54.9	145	-174	-53.8	172.3	140.1	0	0	116.8
619	K	33	Very low	29.4	Very low	207 Å²	207	154.4 Å²	154.4	90%	0.9	84%	0.84	S	S	*	*			trans	-147.6	137.7	149.8	-80.1	-164.4	177.7	172.9	0	112.7
620	E	29.7	Very low	29.3	Very low	202 Å²	202	154 Å²	154	94%	0.944	84%	0.843	S	S	*	*			trans	-74.9	146.1	165.9	-57	175.2	127	0	0	110.8
621	G	28.5	Very low	29.3	Very low	76 Å²	76	156 Å²	156	78%	0.784	84%	0.844	S	S	*	*			trans	-177.3	126.1	176.4	0	0	0	0	0	113.2	G623	G621-G623 PolarHBondContact O-N 3.27Å
622	E	29.3	Very low	29	Very low	204 Å²	204	154 Å²	154	95%	0.953	85%	0.845	S	S	*	*			trans	-70.3	119.8	-168	-62.6	173.9	124.3	0	0	114.8
623	G	26.3	Very low	28.8	Very low	66 Å²	66	151.2 Å²	151.2	68%	0.68	84%	0.836	S	S	*	*			trans	45.4	123	130.1	0	0	0	0	0	122.2	G621	G621-G623 PolarHBondContact O-N 3.27Å
624	H	28.2	Very low	28.6	Very low	195 Å²	195	148.7 Å²	148.7	90%	0.903	83%	0.829	S	S	*	*			trans	-145.4	137.2	130.9	-103.4	-73.6	0	0	0	110
625	S	24.9	Very low	28.5	Very low	103 Å²	103	149.2 Å²	149.2	72%	0.72	83%	0.827	S	S	*	*			trans	-115.9	127.3	-175.1	174.4	0	0	0	0	111.7
626	Y	25.7	Very low	28.4	Very low	217 Å²	217	147.4 Å²	147.4	85%	0.851	82%	0.822	S	S	*	*			trans	-156	90.8	165.1	-88.5	-75.7	0	0	0	110.5
627	F	26.7	Very low	28.6	Very low	203 Å²	203	150.8 Å²	150.8	89%	0.89	82%	0.822	S	S	*	*				-173.6	171.4	120.8	-129.4	-104.1	0	0	0	114
628	S	27	Very low	28.7	Very low	90 Å²	90	149.8 Å²	149.8	63%	0.629	82%	0.816	S	S	*	*			trans	72.6	125.2	167.5	-155.4	0	0	0	0	117.9
629	S	25.8	Very low	28.7	Very low	120 Å²	120	149.1 Å²	149.1	84%	0.839	81%	0.812	S	S	*	*			trans	-158.3	70.7	169.2	-78	0	0	0	0	109.8	K631	S629-K631 PolarHBondContact O-N 2.92Å
630	T	28.5	Very low	28.4	Very low	130 Å²	130	144.9 Å²	144.9	80%	0.798	80%	0.8	S	S	*	*			trans	-65.9	115.5	165.3	26.4	0	0	0	0	109.7	T632	T630-T632 PolarHBondContact O-N 3.41Å
631	K	28.6	Very low	28.5	Very low	198 Å²	198	145.1 Å²	145.1	86%	0.861	79%	0.792	S	S	*	*			trans	-83.1	102.2	178.6	-93.2	-177.3	172.8	176	0	111.4	S629	S629-K631 PolarHBondContact O-N 2.92Å
632	T	27.4	Very low	28.5	Very low	137 Å²	137	147.9 Å²	147.9	84%	0.84	79%	0.789	S	S	*	*			trans	-80.2	137.5	153.7	-52.8	0	0	0	0	108.9	T630	T630-T632 PolarHBondContact O-N 3.41Å
633	L	26.3	Very low	28.6	Very low	144 Å²	144	143.9 Å²	143.9	75%	0.754	78%	0.783	S	S	*	*			trans	-144.6	153.6	178.3	-151.5	78.1	0	0	0	112.3
634	C	27.1	Very low	28.8	Very low	108 Å²	108	149.1 Å²	149.1	73%	0.73	80%	0.795	S	S	*	*			trans	72.5	87.8	168.4	-65.6	0	0	0	0	117.9
635	V	28.1	Very low	28.8	Very low	137 Å²	137	143.5 Å²	143.5	83%	0.83	79%	0.79	S	S	*	*			trans	-95	133.3	142.3	175	0	0	0	0	107.8
636	I	29.9	Very low	29.2	Very low	158 Å²	158	147.3 Å²	147.3	81%	0.81	80%	0.796	S	S	*	*			trans	-141.6	141.4	159.9	-62.6	-173.5	0	0	0	108.2
637	D	30	Very low	29.4	Very low	145 Å²	145	143.8 Å²	143.8	78%	0.775	80%	0.797	S	S	*	*			trans	-71.9	161.6	-174.8	-75.9	-66.1	0	0	0	115.8
638	P	40.5	Very low	29.6	Very low	114 Å²	114	141.6 Å²	141.6	74%	0.74	80%	0.795	S	S	*	*			trans	-92.3	143	174.6	35.8	-33	0	0	0	113.6
639	E	30.3	Very low	29.9	Very low	177 Å²	177	145 Å²	145	83%	0.827	81%	0.805	S	S	*	*			trans	-170.8	158.1	138.7	-118.5	-174.8	-151.5	0	0	114.7
640	N	28.6	Very low	30.1	Very low	119 Å²	119	146.7 Å²	146.7	64%	0.636	80%	0.804	S	S	*	*			trans	62.9	97.7	160	-72.4	-61.2	0	0	0	122.4
641	R	30	Very low	30.2	Very low	206 Å²	206	147.8 Å²	147.8	78%	0.777	80%	0.804	S	S	*	*				63.7	134.6	112.5	-91.4	-174	173.8	-167.6	-0.7	123
642	D	28.6	Very low	30.3	Very low	135 Å²	135	143.2 Å²	143.2	72%	0.722	80%	0.803	S	S	*	*			trans	65.1	139.3	146.7	-50.9	-25.2	0	0	0	117
643	S	31.2	Very low	30.5	Very low	119 Å²	119	143 Å²	143	83%	0.832	80%	0.801	S	S	*	*			cis	-151	170.5	13.6	46.2	0	0	0	0	112.7
644	L	31.2	Very low	30.8	Very low	177 Å²	177	145.4 Å²	145.4	93%	0.927	81%	0.809	S	S	*	*			trans	-65.8	152.7	-176.6	-70.6	153.7	0	0	0	115
645	G	28.8	Very low	31.1	Very low	77 Å²	77	147.1 Å²	147.1	79%	0.794	81%	0.811	S	S	*	*			trans	-141.9	126.8	159	0	0	0	0	0	109.4
646	E	32.6	Very low	31.4	Very low	182 Å²	182	150 Å²	150	85%	0.85	81%	0.812	S	S	*	*			trans	-85.1	147.6	-170.2	-59.5	164.4	136.2	0	0	113
647	T	31.3	Very low	31.8	Very low	143 Å²	143	147.2 Å²	147.2	88%	0.877	81%	0.806	S	S	*	*			trans	-160.9	113.4	143	23.8	0	0	0	0	109.8
648	D	30.6	Very low	33	Very low	158 Å²	158	145.5 Å²	145.5	85%	0.845	80%	0.803	S	S	*	*			trans	-76.7	140.2	167.6	-60.4	-59.6	0	0	0	111.3
649	I	31.7	Very low	33.1	Very low	162 Å²	162	146 Å²	146	83%	0.831	80%	0.803	S	S	*	*			trans	-143.5	129.1	145.7	-59.5	-172	0	0	0	107.6
650	D	30.4	Very low	33.5	Very low	155 Å²	155	144.6 Å²	144.6	83%	0.829	80%	0.802	S	S	*	*			trans	-63.8	145.4	-179.4	-63.5	-78.2	0	0	0	114.2
651	I	30.8	Very low	34	Very low	153 Å²	153	149 Å²	149	79%	0.785	83%	0.833	S	S	*	*			trans	-109.8	110.8	159.1	-63.3	178.1	0	0	0	107.9
652	A	31.4	Very low	34.2	Very low	102 Å²	102	146.2 Å²	146.2	84%	0.843	84%	0.836	S	S	*	*			trans	-78	119.6	171.7	0	0	0	0	0	110.4
653	T	31.9	Very low	34.5	Very low	131 Å²	131	146.7 Å²	146.7	80%	0.804	84%	0.842	S	S	*	*			trans	-99.7	119.5	169.9	41.5	0	0	0	0	110.2
654	E	32.5	Very low	34.7	Very low	196 Å²	196	148.3 Å²	148.3	92%	0.916	84%	0.843	S	S	*	*			trans	-96	114.9	162.4	-97.2	-167.5	165.3	0	0	109.7
655	D	32.5	Very low	34.9	Very low	144 Å²	144	146.6 Å²	146.6	77%	0.77	84%	0.838	S	S	*	*			trans	-80.5	152.9	176.4	-172.8	8.5	0	0	0	111
656	K	35.2	Very low	35.3	Very low	198 Å²	198	150.9 Å²	150.9	86%	0.861	84%	0.84	S	S	*	*			trans	-143.5	108.5	174.9	-94.2	-167.8	176.5	178	0	113.1
657	S	37.9	Very low	35.4	Very low	98 Å²	98	148.9 Å²	148.9	69%	0.685	84%	0.84	S	S	*	*			trans	-155.1	167.4	161.9	67.2	0	0	0	0	109.9
658	P	55.4	Low	35.7	Very low	109 Å²	109	149.3 Å²	149.3	71%	0.708	84%	0.837	S	S	*	*				-140.4	174.4	-62.1	37.9	-21.5	0	0	0	115.3
659	V	42.2	Very low	36.1	Very low	124 Å²	124	148.6 Å²	148.6	75%	0.752	84%	0.836	S	S	*	*			trans	73	159.9	160.8	-143.6	0	0	0	0	119.2
660	D	38.8	Very low	36.5	Very low	148 Å²	148	147.5 Å²	147.5	79%	0.791	84%	0.837	S	S	*	*			trans	61.3	121.4	172.1	-61.1	-34.1	0	0	0	117.1
661	T	39	Very low	37.1	Very low	212 Å²	212	146.8 Å²	146.8	100%	1.301	84%	0.838	S	S	*	*			cis	-147	0	32	-45.5	0	0	0	0	111.9

Retrieved 661 of 661 residues in 146.9 ms (Link to these results)

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