A0A087Y1K0_POEFO Loading...

dual-specificity kinase

AlphaFold DB , UniProt , Accession A0A087Y1K0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 595 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.7	Very low	32.9	Very low	239 Å²	239	163.9 Å²	163.9	100%	1.177	85%	0.852	S	S	*	*				0	136.2	0	-70.3	178.4	-177	0	0	107.4
2	L	32.4	Very low	33.8	Very low	173 Å²	173	159.3 Å²	159.3	91%	0.906	84%	0.84	S	S	*	*			trans	57	108.2	169.4	-64.2	169	0	0	0	118.5
3	P	44.6	Very low	33.3	Very low	109 Å²	109	161.9 Å²	161.9	71%	0.708	85%	0.845	S	S	*	*			trans	-100.3	143	169.5	37	-30.7	0	0	0	114.5
4	E	32.3	Very low	32.9	Very low	172 Å²	172	156.4 Å²	156.4	80%	0.804	83%	0.834	S	S	*	*				48.7	116.9	123.5	-54.8	179	152.2	0	0	119.8
5	I	37.9	Very low	32.6	Very low	150 Å²	150	158.6 Å²	158.6	77%	0.769	83%	0.834	S	S	*	*				67.1	114.3	63.2	-55.4	162.5	0	0	0	110.8
6	N	29.7	Very low	33	Very low	151 Å²	151	156.4 Å²	156.4	81%	0.807	83%	0.832	S	S	*	*				-172.9	172.2	60.9	-147.8	-15.8	0	0	0	114.8
7	N	34.3	Very low	32.8	Very low	140 Å²	140	157.3 Å²	157.3	75%	0.749	83%	0.83	S	S	*	*			trans	-76.9	150.9	164.1	-85	-51.9	0	0	0	113.4
8	K	29.5	Very low	33.2	Very low	214 Å²	214	155 Å²	155	93%	0.93	83%	0.826	S	S	*	*				176.3	163.6	116.5	-97.7	176.5	-179.1	-178.3	0	113.9
9	A	32.6	Very low	33.1	Very low	91 Å²	91	157.1 Å²	157.1	75%	0.752	83%	0.83	S	S	*	*			trans	-94.7	160.9	-172.7	0	0	0	0	0	114.4
10	S	27.6	Very low	32.9	Very low	124 Å²	124	160.4 Å²	160.4	87%	0.867	83%	0.83	S	S	*	*				170.2	153.3	128.5	-74.5	0	0	0	0	113.9
11	R	30.3	Very low	32.7	Very low	240 Å²	240	159.5 Å²	159.5	91%	0.906	83%	0.826	S	S	*	*			trans	-79.4	-178.7	164.5	-99	-178	177.7	-176.6	-0.6	110.7
12	P	43.9	Very low	33.3	Very low	109 Å²	109	153.3 Å²	153.3	71%	0.708	80%	0.804	S	S	*	*			cis	-132.7	-171.3	-14.4	32.5	-10.8	0	0	0	113.6
13	E	27.2	Very low	33.3	Very low	193 Å²	193	150.4 Å²	150.4	90%	0.902	79%	0.793	S	S	*	*			trans	155.8	175.5	131	-80.6	-152.4	147.4	0	0	113.7
14	A	28	Very low	32.5	Very low	84 Å²	84	154.4 Å²	154.4	69%	0.694	80%	0.802	S	S	*	*			trans	-135.8	158.1	-153.2	0	0	0	0	0	116.4
15	F	28.6	Very low	32.2	Very low	190 Å²	190	149.5 Å²	149.5	83%	0.833	80%	0.798	S	S	*	*			trans	57.7	146.8	164.8	-72.6	-71.5	0	0	0	119.8
16	P	38.3	Very low	31.7	Very low	123 Å²	123	147.6 Å²	147.6	80%	0.799	80%	0.798	S	S	*	*				-143.4	165.3	100.8	35.9	-20.1	0	0	0	116.5
17	H	30.2	Very low	31.6	Very low	172 Å²	172	150.6 Å²	150.6	80%	0.796	80%	0.798	S	S	*	*			trans	-88.6	171	168.5	-75.5	-34.2	0	0	0	112.9
18	P	40.1	Very low	31.2	Very low	116 Å²	116	151.6 Å²	151.6	75%	0.753	80%	0.801	S	S	*	*			trans	-119.1	123.5	151.7	34	-21.4	0	0	0	115
19	H	29.8	Very low	31	Very low	195 Å²	195	145 Å²	145	90%	0.903	79%	0.794	S	S	*	*			trans	26.2	164.6	147.9	-64	-74.7	0	0	0	126.3
20	R	28.9	Very low	30.6	Very low	223 Å²	223	144.9 Å²	144.9	84%	0.842	79%	0.793	S	S	*	*			trans	-123.4	142.5	-159.5	-98	-178.2	162.5	-170.7	-1	114.1
21	L	30.2	Very low	30.4	Very low	141 Å²	141	146.7 Å²	146.7	74%	0.738	79%	0.793	S	S	*	*			trans	64.5	173.5	133.2	-61.4	179	0	0	0	118.5
22	P	43	Very low	30.2	Very low	110 Å²	110	146.6 Å²	146.6	71%	0.714	79%	0.793	S	S	*	*			cis	-150.7	179.4	18.3	38.1	-12.6	0	0	0	121.6
23	V	31.5	Very low	29.8	Very low	112 Å²	112	147.3 Å²	147.3	68%	0.679	80%	0.797	S	S	*	*			trans	94.4	121	149.9	-164.7	0	0	0	0	123
24	E	28.4	Very low	29.5	Very low	192 Å²	192	143.8 Å²	143.8	90%	0.897	79%	0.793	S	S	*	*			trans	40.5	154.5	147.8	-61.5	162.2	176.9	0	0	124.1
25	G	26.8	Very low	29.2	Very low	70 Å²	70	144.6 Å²	144.6	72%	0.722	79%	0.793	S	S	*	*			cis	169.7	160.8	-7.2	0	0	0	0	0	115.9
26	S	26.5	Very low	29.1	Very low	109 Å²	109	144.2 Å²	144.2	76%	0.762	79%	0.794	S	S	*	*			trans	59.4	116.9	153.9	-71.5	0	0	0	0	125.1
27	R	27.8	Very low	28.5	Very low	215 Å²	215	146.8 Å²	146.8	81%	0.811	79%	0.793	S	S	*	*				81.6	124.4	123.6	-68.9	-179	-178.2	-158.5	0.5	123.7
28	I	26.7	Very low	28.3	Very low	160 Å²	160	147.1 Å²	147.1	82%	0.821	79%	0.792	S	S	*	*				62.4	130.9	129.8	-54.5	166	0	0	0	119.4
29	G	23.8	Very low	27.5	Very low	75 Å²	75	146 Å²	146	77%	0.773	79%	0.787	S	S	*	*			trans	161.9	116.7	154.8	0	0	0	0	0	116.6
30	A	25.1	Very low	27.4	Very low	89 Å²	89	142.2 Å²	142.2	74%	0.736	78%	0.783	S	S	*	*			trans	-84.2	174.5	-174.7	0	0	0	0	0	116.3
31	N	24.1	Very low	27.3	Very low	162 Å²	162	135 Å²	135	87%	0.866	78%	0.778	S	S	*	*			trans	87.4	130.4	153	-64	-22.9	0	0	0	121.9
32	R	25.8	Very low	27.2	Very low	239 Å²	239	137.1 Å²	137.1	90%	0.902	79%	0.789	S	S	*	*			trans	-66.4	174.2	160.9	-68	-179.5	174	-174.4	-1.1	110.7
33	P	34.1	Very low	26.4	Very low	123 Å²	123	135.7 Å²	135.7	80%	0.799	79%	0.794	S	S	*	*			cis	-144.5	-156	20.5	43.8	-22.3	0	0	0	116.1
34	C	21.5	Very low	26.1	Very low	120 Å²	120	135.8 Å²	135.8	81%	0.811	80%	0.8	S	S	*	*			trans	85.8	131.9	172.1	-139.1	0	0	0	0	115.1
35	S	22.2	Very low	26	Very low	101 Å²	101	134.5 Å²	134.5	71%	0.706	80%	0.798	S	S	*	*			cis	146.9	105.3	-20.2	-86.9	0	0	0	0	107.6
36	Q	26.2	Very low	26.1	Very low	182 Å²	182	136.5 Å²	136.5	85%	0.85	80%	0.798	S	S	*	*			trans	174.5	117.3	149	-96.7	162.5	33.1	0	0	107.1
37	K	25.3	Very low	26.1	Very low	177 Å²	177	140.6 Å²	140.6	77%	0.77	81%	0.806	S	S	*	*				59.5	120.3	86.1	-72.2	-176.7	175.1	-176.8	0	111.2
38	F	25.6	Very low	26.1	Very low	178 Å²	178	138.2 Å²	138.2	78%	0.781	81%	0.808	S	S	*	*			cis	-157.4	163.8	26.2	-113.4	-73.8	0	0	0	113.3
39	S	24.6	Very low	25.9	Very low	92 Å²	92	139 Å²	139	64%	0.643	81%	0.808	S	S	*	*			trans	49	102.7	149.2	59.5	0	0	0	0	119.6
40	S	26.8	Very low	26.2	Very low	117 Å²	117	141.8 Å²	141.8	82%	0.818	81%	0.811	S	S	*	*				77.4	128	86.3	72.6	0	0	0	0	115.5
41	G	26.6	Very low	26.4	Very low	71 Å²	71	142.9 Å²	142.9	73%	0.732	81%	0.81	S	S	*	*			cis	170.5	145.7	-5.9	0	0	0	0	0	111.7
42	L	27.9	Very low	26.5	Very low	185 Å²	185	142.1 Å²	142.1	97%	0.969	81%	0.811	S	S	*	*			trans	-160.2	110.4	167.2	-109.9	151.3	0	0	0	107.3
43	G	27.1	Very low	26.5	Very low	81 Å²	81	136.1 Å²	136.1	84%	0.835	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-83.2	133	-169.2	0	0	0	0	0	113.5
44	S	25.5	Very low	26.1	Very low	114 Å²	114	138.6 Å²	138.6	80%	0.797	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-76.9	160.9	169	51.1	0	0	0	0	112.5
45	L	25.6	Very low	26.2	Very low	164 Å²	164	138.8 Å²	138.8	86%	0.859	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-55.8	148.3	-180	-64.3	93.5	0	0	0	113.7
46	P	28.6	Very low	26.4	Very low	112 Å²	112	138.6 Å²	138.6	73%	0.727	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-84.7	133.2	160.6	33.2	-30	0	0	0	111.6
47	Q	27.7	Very low	26.4	Very low	196 Å²	196	135.5 Å²	135.5	92%	0.916	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-71.3	149.6	155.3	-72.8	172.9	-61.9	0	0	109.7
48	L	26.6	Very low	26.4	Very low	165 Å²	165	132.1 Å²	132.1	86%	0.864	79%	0.785	S	S	*	*			trans	-151.7	126.4	165	-104	138.8	0	0	0	109.2
49	E	22.6	Very low	26.6	Very low	176 Å²	176	131.1 Å²	131.1	82%	0.822	79%	0.788	S	S	*	*			trans	-106.9	133.3	174.8	-79.9	-169.4	137.2	0	0	111.2
50	T	29.6	Very low	26.8	Very low	134 Å²	134	131.6 Å²	131.6	82%	0.822	80%	0.797	S	S	*	*			trans	64.9	161	155.4	63.6	0	0	0	0	119.1
51	P	30.2	Very low	26.8	Very low	111 Å²	111	135.4 Å²	135.4	72%	0.721	80%	0.799	S	S	*	*			cis	-115.8	175.4	-4.1	39.7	-27.5	0	0	0	114.2
52	V	26.8	Very low	26.7	Very low	146 Å²	146	140.2 Å²	140.2	89%	0.885	81%	0.808	S	S	*	*			trans	-81.5	128.4	173.5	176.4	0	0	0	0	110.1
53	V	24.7	Very low	26.6	Very low	113 Å²	113	140.5 Å²	140.5	69%	0.685	81%	0.805	S	S	*	*			trans	-119.5	129.1	168.5	179.3	0	0	0	0	108.6	V55	V53-V55 PolarHBondContact O-N 3.34Å
54	Q	26.6	Very low	26.5	Very low	176 Å²	176	145.7 Å²	145.7	82%	0.822	81%	0.807	S	S	*	*			trans	-61.8	122.8	170.2	-84.5	166.7	-79	0	0	109.9
55	V	23.8	Very low	26.6	Very low	123 Å²	123	149.7 Å²	149.7	75%	0.745	81%	0.813	S	S	*	*			trans	-100.8	99.3	170.8	179.4	0	0	0	0	108.5	V53	V53-V55 PolarHBondContact O-N 3.34Å
56	V	25.3	Very low	26.4	Very low	97 Å²	97	151.1 Å²	151.1	59%	0.588	82%	0.815	S	S	*	*			trans	-72.3	122.6	166.8	-179.5	0	0	0	0	108	S58	V56-S58 PolarHBondContact O-N 3.37Å
57	V	27.7	Very low	26.2	Very low	118 Å²	118	151.1 Å²	151.1	72%	0.715	82%	0.818	S	S	*	*			trans	-87.4	102.2	-178.2	179.4	0	0	0	0	110
58	S	25.3	Very low	26	Very low	106 Å²	106	148.4 Å²	148.4	74%	0.741	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-75.6	125.6	173.3	-46.1	0	0	0	0	111.5	V56 A60	V56-S58 PolarHBondContact O-N 3.37Å; S58-A60 PolarHBondContact O-N 3.35Å
59	N	29.2	Very low	25.9	Very low	156 Å²	156	147.3 Å²	147.3	83%	0.834	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-69.1	121.7	173.3	-79.9	-39.1	0	0	0	111.3
60	A	27.8	Very low	26	Very low	102 Å²	102	147 Å²	147	84%	0.843	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-73.7	133	-176.2	0	0	0	0	0	113	S58	S58-A60 PolarHBondContact O-N 3.35Å
61	K	26.7	Very low	25.7	Very low	198 Å²	198	146.8 Å²	146.8	86%	0.861	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-86.4	135.9	169.8	-68.5	175.3	178	173.8	0	109.9
62	N	25.9	Very low	25.5	Very low	171 Å²	171	147.6 Å²	147.6	91%	0.914	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-67.8	131.4	166.2	-82.3	-23.5	0	0	0	110.2
63	Q	26	Very low	25.4	Very low	192 Å²	192	148 Å²	148	90%	0.897	80%	0.798	S	S	*	*			trans	-118.5	142.4	162.5	-81.5	-172.3	-11.2	0	0	110.3
64	Q	24.8	Very low	25.4	Very low	189 Å²	189	150 Å²	150	88%	0.883	80%	0.803	S	S	*	*			trans	-75.9	147.2	174.2	-68.5	155.4	-79.6	0	0	110.7
65	Q	26.7	Very low	25.3	Very low	199 Å²	199	148 Å²	148	93%	0.93	80%	0.803	S	S	*	*			trans	-131.7	143.1	152.4	-78.6	-171.2	-13.6	0	0	110.1
66	Q	22.4	Very low	25.3	Very low	193 Å²	193	149.5 Å²	149.5	90%	0.902	81%	0.807	S	S	*	*			trans	-96.4	150.4	177.5	-61	163.7	-65.7	0	0	109.7
67	S	24.6	Very low	25.4	Very low	112 Å²	112	155.1 Å²	155.1	78%	0.783	82%	0.823	S	S	*	*			trans	-170.4	111.6	139.9	50.1	0	0	0	0	112.2
68	D	23.6	Very low	25.2	Very low	140 Å²	140	153.3 Å²	153.3	75%	0.749	83%	0.828	S	S	*	*			trans	44.5	111.8	141	-58.6	-48.9	0	0	0	123.9
69	N	23.3	Very low	25.1	Very low	142 Å²	142	151.8 Å²	151.8	76%	0.759	83%	0.829	S	S	*	*				34.8	124.8	117.8	-64.9	-48.9	0	0	0	120.7
70	I	25.1	Very low	24.8	Very low	169 Å²	169	152.8 Å²	152.8	87%	0.867	83%	0.829	S	S	*	*				-162.1	137.2	114.6	-96	149	0	0	0	109.1
71	L	23.8	Very low	24.7	Very low	130 Å²	130	154.2 Å²	154.2	68%	0.681	82%	0.823	S	S	*	*			trans	-109.2	163.2	172.8	-123.3	104.7	0	0	0	109.6	Q73	L71-Q73 HydrophobicContact CD2-CG 3.91Å
72	P	26.6	Very low	24.5	Very low	127 Å²	127	151.2 Å²	151.2	83%	0.825	82%	0.816	S	S	*	*				-138.1	155.6	106.6	31.5	-16.7	0	0	0	115.6
73	Q	23.9	Very low	24.4	Very low	156 Å²	156	153.7 Å²	153.7	73%	0.729	81%	0.814	S	S	*	*			trans	-76.1	160.1	176	-70.6	-92.9	-16.5	0	0	112.2	L71	L71-Q73 HydrophobicContact CD2-CG 3.91Å
74	I	24.3	Very low	24.3	Very low	153 Å²	153	152.4 Å²	152.4	79%	0.785	81%	0.808	S	S	*	*			trans	-161.7	117.3	135.7	-106	154.3	0	0	0	113.9
75	T	23.8	Very low	24.3	Very low	135 Å²	135	148.4 Å²	148.4	83%	0.828	81%	0.808	S	S	*	*			trans	67.9	146.5	152.2	64	0	0	0	0	123.2
76	N	25.3	Very low	24.2	Very low	155 Å²	155	145 Å²	145	83%	0.829	80%	0.8	S	S	*	*			trans	-136.9	129.6	-168.6	-172.6	8.8	0	0	0	110.2
77	K	25.8	Very low	24.4	Very low	214 Å²	214	145.1 Å²	145.1	93%	0.93	80%	0.801	S	S	*	*			trans	-161.4	137.8	162.1	-68.5	-168.6	-178.8	179	0	106.6
78	G	23.8	Very low	24.3	Very low	80 Å²	80	151.3 Å²	151.3	83%	0.825	81%	0.807	S	S	*	*			cis	154.5	132.7	-5.1	0	0	0	0	0	109.7
79	G	23.4	Very low	24.3	Very low	74 Å²	74	149.5 Å²	149.5	76%	0.763	81%	0.805	S	S	*	*			trans	114.2	100.4	167.1	0	0	0	0	0	118.4
80	Q	24.2	Very low	24.3	Very low	177 Å²	177	152.2 Å²	152.2	83%	0.827	81%	0.81	S	S	*	*				12.4	145.6	124.7	-72.2	168.8	-13.6	0	0	119.2
81	N	24.9	Very low	24.2	Very low	133 Å²	133	148.9 Å²	148.9	71%	0.711	80%	0.802	S	S	*	*			cis	-162.8	158.1	25.8	-115.2	-18.5	0	0	0	114.2
82	N	22.3	Very low	24.3	Very low	134 Å²	134	149.3 Å²	149.3	72%	0.717	81%	0.81	S	S	*	*			trans	26.7	135.7	151.5	-84	-14.1	0	0	0	123.2
83	Y	24.4	Very low	24.1	Very low	223 Å²	223	152 Å²	152	88%	0.875	81%	0.812	S	S	*	*				-157.4	160.4	106.5	-101.9	-69.1	0	0	0	112.4
84	Q	24.1	Very low	24.3	Very low	165 Å²	165	152.6 Å²	152.6	77%	0.771	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-80.5	143.5	-161.6	-65.1	153	-49.5	0	0	114.7
85	A	24.9	Very low	24.2	Very low	106 Å²	106	154.9 Å²	154.9	88%	0.876	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-84.3	123.4	163.2	0	0	0	0	0	110.3
86	V	24.6	Very low	24.3	Very low	128 Å²	128	154.1 Å²	154.1	78%	0.776	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-101.5	116.3	174.7	174.4	0	0	0	0	109
87	E	25.2	Very low	24.3	Very low	194 Å²	194	154.1 Å²	154.1	91%	0.907	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-63	134.3	168.3	-66.7	-170.6	136.2	0	0	110.5
88	R	22.8	Very low	24.2	Very low	242 Å²	242	155 Å²	155	91%	0.913	81%	0.809	S	S	*	*			trans	-143	123.8	164.8	-143.1	176.4	-167.3	-169.7	5.4	112.4
89	S	23.7	Very low	24.5	Very low	102 Å²	102	162.1 Å²	162.1	71%	0.713	81%	0.813	S	S	*	*			trans	-80.1	168.1	-179.6	51.8	0	0	0	0	113.3
90	K	24.4	Very low	24.5	Very low	199 Å²	199	162.7 Å²	162.7	87%	0.865	82%	0.818	S	S	*	*			trans	107	142.3	178	-65	168	-176.3	-177.1	0	113.2
91	S	22.5	Very low	24.6	Very low	99 Å²	99	159.1 Å²	159.1	69%	0.692	82%	0.819	S	S	*	*			cis	-170	120.3	-13.5	47.9	0	0	0	0	108.9	Q93	S91-Q93 PolarHBondContact O-N 3.46Å
92	T	24.8	Very low	24.7	Very low	140 Å²	140	157.2 Å²	157.2	86%	0.859	82%	0.821	S	S	*	*			trans	-81.1	110.9	-178.9	-51.5	0	0	0	0	111.2	Q94	T92-Q94 PolarHBondContact O-N 3.47Å
93	Q	24.2	Very low	24.9	Very low	183 Å²	183	156.5 Å²	156.5	86%	0.855	82%	0.822	S	S	*	*			trans	-78.4	108.5	168.7	-74.5	-173.8	-13.8	0	0	109.9	S91	S91-Q93 PolarHBondContact O-N 3.46Å
94	Q	26.7	Very low	25	Very low	169 Å²	169	153.5 Å²	153.5	79%	0.79	82%	0.821	S	S	*	*			trans	-74.8	132.3	166.8	-73.6	177.1	-28.8	0	0	110.1	T92	T92-Q94 PolarHBondContact O-N 3.47Å
95	F	23.4	Very low	25.1	Very low	200 Å²	200	155.5 Å²	155.5	88%	0.877	83%	0.827	S	S	*	*			trans	-106.3	90.9	176.4	-152.4	-85.2	0	0	0	109.3
96	T	25	Very low	25.2	Very low	119 Å²	119	155.1 Å²	155.1	73%	0.73	83%	0.825	S	S	*	*			trans	-95.2	112.5	-174.2	-44.9	0	0	0	0	110.9
97	M	25.7	Very low	25.3	Very low	156 Å²	156	154.2 Å²	154.2	77%	0.768	83%	0.831	S	S	*	*			trans	-81.2	129	168.5	-84.2	-74.7	-79.3	0	0	110.3
98	R	24.1	Very low	25.4	Very low	231 Å²	231	153.5 Å²	153.5	87%	0.872	83%	0.829	S	S	*	*			trans	-73.3	131.9	177.5	-78	174.1	164.5	171.3	-6.6	111.3
99	Y	28.6	Very low	25.6	Very low	231 Å²	231	148 Å²	148	91%	0.906	83%	0.828	S	S	*	*			trans	-117.4	139.8	135.8	-85.1	-84.7	0	0	0	107.9
100	G	23.4	Very low	25.9	Very low	85 Å²	85	153.3 Å²	153.3	88%	0.876	83%	0.832	S	S	*	*			trans	-88	135.5	-173.3	0	0	0	0	0	112.5
101	A	27.2	Very low	26	Very low	103 Å²	103	151.8 Å²	151.8	85%	0.851	83%	0.834	S	S	*	*			trans	-126.5	138.8	156.3	0	0	0	0	0	107.2
102	A	26.4	Very low	26.6	Very low	92 Å²	92	150.5 Å²	150.5	76%	0.76	84%	0.836	S	S	*	*			trans	-79.7	156.7	-177.8	0	0	0	0	0	111.9
103	T	27.1	Very low	27	Very low	119 Å²	119	154 Å²	154	73%	0.73	84%	0.839	S	S	*	*			trans	0.8	134.6	153.7	50	0	0	0	0	117.6
104	D	26.7	Very low	27.3	Very low	161 Å²	161	149 Å²	149	86%	0.861	83%	0.829	S	S	*	*				-140.3	165.3	53.3	-89.3	-48.1	0	0	0	117.5
105	K	26.7	Very low	27.5	Very low	206 Å²	206	148.3 Å²	148.3	90%	0.896	83%	0.83	S	S	*	*			trans	-108.9	138.4	175.8	-76.9	178	173.8	177.3	0	111.5
106	A	25.8	Very low	27.9	Very low	99 Å²	99	142 Å²	142	82%	0.818	82%	0.821	S	S	*	*			trans	-148.7	120.7	152.2	0	0	0	0	0	113.1
107	A	27	Very low	28.2	Very low	109 Å²	109	143.1 Å²	143.1	90%	0.901	82%	0.823	S	S	*	*			trans	49.8	141	153	0	0	0	0	0	123
108	M	27.1	Very low	28.6	Very low	179 Å²	179	142.1 Å²	142.1	88%	0.882	81%	0.814	S	S	*	*			trans	-95.7	156.2	174.8	-51.7	170.7	75.9	0	0	111.6
109	S	26.8	Very low	29.1	Very low	126 Å²	126	139.3 Å²	139.3	88%	0.881	81%	0.813	S	S	*	*			trans	-150.1	161	139.2	-162.2	0	0	0	0	112.2
110	R	30.4	Very low	29.7	Very low	213 Å²	213	136.6 Å²	136.6	80%	0.804	81%	0.809	S	S	*	*			trans	-103.8	137.6	-166	-55.1	168.9	-174.8	162.1	1.1	110.8
111	N	27.2	Very low	30.6	Very low	168 Å²	168	141.2 Å²	141.2	90%	0.898	81%	0.805	S	S	*	*				-176.8	102	129.5	-97.5	-14.9	0	0	0	111.9
112	G	35.2	Very low	31.6	Very low	71 Å²	71	143 Å²	143	73%	0.732	80%	0.795	S	S	*	*			trans	-97.6	101.6	169.1	0	0	0	0	0	110.8
113	K	32.3	Very low	32.8	Very low	214 Å²	214	146 Å²	146	93%	0.93	79%	0.787	S	S	*	*			trans	-168.3	51.8	165.1	-109.6	173.8	-170.7	-174.5	0	111.5
114	A	30.6	Very low	34.2	Very low	78 Å²	78	143.1 Å²	143.1	65%	0.645	78%	0.775	S	S	*	*			trans	-151.7	17.9	-179.1	0	0	0	0	0	115.1
115	L	31.2	Very low	36.1	Very low	154 Å²	154	137 Å²	137	81%	0.806	74%	0.74	S	S	*	*			trans	-91.7	-4.9	-174.7	-87.6	96.9	0	0	0	115.7
116	G	30.6	Very low	38	Very low	68 Å²	68	132.8 Å²	132.8	70%	0.701	72%	0.724	S	S	*	*	S	Bend	trans	-72.6	-39.4	177.1	0	0	0	0	0	114
117	N	33.1	Very low	40.1	Very low	142 Å²	142	131.1 Å²	131.1	76%	0.759	72%	0.716	S	S	*	*	S	Bend	trans	-105.9	10.6	-167.9	-63.8	18.1	0	0	0	113.6
118	K	34.2	Very low	42.4	Very low	135 Å²	135	128.7 Å²	128.7	59%	0.587	69%	0.686	S	S	*	*	S	Bend	trans	-86.4	-28.4	-174.9	-144.2	-175.1	-178.2	-159	0	113.4	E120 K121	K118-E120 PolarHBondContact O-N 3.08Å; K118-K121 PolarHBondContact O-N 2.88Å
119	M	34.7	Very low	45.3	Very low	172 Å²	172	130.8 Å²	130.8	85%	0.847	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-25	-175.8	-97	-179.9	147.4	0	0	115.2
120	E	41.1	Very low	48.3	Very low	175 Å²	175	125.7 Å²	125.7	82%	0.818	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-18.6	176.5	-68.2	-171.7	132.7	0	0	113	K118 E122	K118-E120 PolarHBondContact O-N 3.08Å; E120-E122 PolarHBondContact O-N 3.16Å
121	K	41.5	Very low	51.4	Low	181 Å²	181	118.1 Å²	118.1	79%	0.787	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	1	-165.6	-137.6	178.8	-175.7	-176.5	0	115.3	K118	K118-K121 PolarHBondContact O-N 2.88Å
122	E	47.5	Very low	54.7	Low	140 Å²	140	110.2 Å²	110.2	65%	0.654	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	6.8	-175.4	-69.4	176.1	175.4	0	0	113.6	E120	E120-E122 PolarHBondContact O-N 3.16Å
123	R	52.9	Low	57.6	Low	156 Å²	156	108.9 Å²	108.9	59%	0.589	56%	0.562	S	S	*	*			trans	-98.6	33.9	176.9	-64	-173.1	178.9	178.4	-0.7	113.9	L130	R123-L130 PolarHBondContact O-N 3.16Å
124	A	56.2	Low	60.6	Low	58 Å²	58	99.7 Å²	99.7	48%	0.479	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	104	-174.3	0	0	0	0	0	111.3	E126 Q128	A124-E126 PolarHBondContact O-N 3.28Å; A124-Q128 VanDerWaalsContact CA-O 3.27Å; A124-Q128 WeakPolarHBondContact CA-O 2.92Å
125	Y	65.8	Low	63.7	Low	34 Å²	34	99.3 Å²	99.3	13%	0.133	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	106.8	171.4	-167.8	-91.3	0	0	0	108.7	G127 Q128 M132 F141 F161 L162 L164	Y125-G127 PolarHBondContact O-N 3.4Å; Y125-Q128 PolarHBondContact N-O 3.29Å; Y125-Q128 VanDerWaalsContact N-O 3.09Å; Y125-Q128 VanDerWaalsContact O-CB 3.32Å; Y125-Q128 WeakPolarHBondContact O-CB 3.28Å; Y125-Q128 PolarHBondContact O-N 2.62Å; Y125-M132 HydrophobicContact CD1-CE 4.29Å; Y125-F141 HydrophobicContact CD1-CE2 4.4Å; Y125-F141 HydrophobicContact CD1-CZ 4.19Å; Y125-F141 HydrophobicContact CE1-CZ 4.48Å; Y125-F161 HydrophobicContact CD2-CD2 4.4Å; Y125-F161 AromaticContact CE2-CD2 3.82Å; Y125-F161 HydrophobicContact CE2-CD2 3.82Å; Y125-F161 HydrophobicContact CE2-CE2 4.04Å; Y125-L162 HydrophobicContact CE1-CB 4.34Å; Y125-L162 HydrophobicContact CE1-CD1 4.26Å; Y125-L164 HydrophobicContact CE1-CD1 3.75Å; Y125-L164 HydrophobicContact CE1-CG 4.16Å; Y125-L164 WeakPolarHBondContact OH-CG 3.39Å; Y125-L164 PolarHBondContact OH-N 2.8Å
126	E	68	Low	66.8	Low	117 Å²	117	96.3 Å²	96.3	55%	0.547	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	50	31.4	-172.8	-60.8	-173.2	-178.3	0	0	113.6	A124 F141 R144	A124-E126 PolarHBondContact O-N 3.28Å; E126-F141 HydrophobicContact CB-CE1 4.46Å; E126-F141 HydrophobicContact CB-CZ 4.47Å; E126-F141 WeakPolarHBondContact OE2-CE1 3.4Å; E126-R144 VanDerWaalsContact CD-NH1 3.27Å; E126-R144 IonicContact OE1-CZ 2.7Å; E126-R144 IonicContact OE1-NH1 3.5Å; E126-R144 PolarHBondContact OE1-NH1 3.43Å; E126-R144 IonicContact OE1-NH2 3.09Å; E126-R144 PolarHBondContact OE1-NH2 2.97Å; E126-R144 IonicContact OE2-NH1 3.38Å; E126-R144 PolarHBondContact OE2-NH1 3.22Å
127	G	69.6	Low	69.9	Low	64 Å²	64	93 Å²	93	66%	0.66	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.3	-11.5	-177.2	0	0	0	0	0	115.5	Y125	Y125-G127 PolarHBondContact O-N 3.4Å
128	Q	75.4	Confident	72.9	Confident	58 Å²	58	87.8 Å²	87.8	27%	0.271	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	142	177.7	-62.9	-66.1	-3.8	0	0	112.5	A124 Y125 M132 N140 F141	A124-Q128 VanDerWaalsContact CA-O 3.27Å; A124-Q128 WeakPolarHBondContact CA-O 2.92Å; Y125-Q128 PolarHBondContact N-O 3.29Å; Y125-Q128 VanDerWaalsContact N-O 3.09Å; Y125-Q128 VanDerWaalsContact O-CB 3.32Å; Y125-Q128 WeakPolarHBondContact O-CB 3.28Å; Y125-Q128 PolarHBondContact O-N 2.62Å; Q128-M132 HydrophobicContact CB-CG 4.2Å; Q128-M132 HydrophobicContact CB-SD 3.55Å; Q128-M132 VanDerWaalsContact CB-SD 3.55Å; Q128-M132 HydrophobicContact CG-SD 3.91Å; Q128-N140 VanDerWaalsContact NE2-CG 3.33Å; Q128-N140 PolarHBondContact NE2-OD1 2.93Å; Q128-N140 VanDerWaalsContact NE2-OD1 3.08Å; Q128-F141 HydrophobicContact CG-CE2 4.23Å; Q128-F141 HydrophobicContact CG-CZ 4.03Å
129	R	86.1	Confident	75.8	Confident	222 Å²	222	86.2 Å²	86.2	84%	0.838	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	126.8	177.4	-177	-178.9	-178.1	177.7	2.1	110.5	P131	R129-P131 CarbonylContact O-C 3.58Å
130	L	91.4	Very high	78.6	Confident	20 Å²	20	81.7 Å²	81.7	11%	0.105	43%	0.427	C	S	.	.	S	Bend	trans	-90.3	147.1	174.8	-62.7	179.1	0	0	0	113.2	R123 M132 W160	R123-L130 PolarHBondContact O-N 3.16Å; L130-M132 HydrophobicContact CD2-CE 3.95Å; L130-M132 HydrophobicContact CD2-CG 4.21Å; L130-W160 HydrophobicContact CB-CE3 3.94Å; L130-W160 HydrophobicContact CB-CZ3 4.08Å; L130-W160 WeakPolarHBondContact CD1-O 3.17Å
131	P	95.4	Very high	81.1	Confident	53 Å²	53	74.1 Å²	74.1	34%	0.344	39%	0.391	S	S	.	.	S	Bend	cis	-72.9	147.8	-8.8	30.1	-30.2	0	0	0	111.4	R129 E158 V159 W160	R129-P131 CarbonylContact O-C 3.58Å; P131-E158 HydrophobicContact CB-CB 3.86Å; P131-E158 HydrophobicContact CB-CG 4.18Å; P131-E158 HydrophobicContact CG-CB 4.42Å; P131-E158 HydrophobicContact CG-CG 4.19Å; P131-V159 WeakPolarHBondContact CA-O 3.26Å; P131-W160 HydrophobicContact CB-CD2 3.97Å; P131-W160 HydrophobicContact CB-CE3 4.38Å; P131-W160 HydrophobicContact CB-CG 4.46Å; P131-W160 HydrophobicContact CB-CH2 4.16Å; P131-W160 HydrophobicContact CB-CZ2 3.7Å; P131-W160 HydrophobicContact CB-CZ3 4.48Å; P131-W160 HydrophobicContact CG-CH2 3.99Å; P131-W160 HydrophobicContact CG-CZ2 3.65Å
132	M	95.2	Very high	83.7	Confident	3 Å²	3	72.1 Å²	72.1	2%	0.015	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-84.8	152.8	167.2	-65.5	176.1	-65.7	0	0	109.9	Y125 Q128 L130 E136 F141 V159 L162	Y125-M132 HydrophobicContact CD1-CE 4.29Å; Q128-M132 HydrophobicContact CB-CG 4.2Å; Q128-M132 HydrophobicContact CB-SD 3.55Å; Q128-M132 VanDerWaalsContact CB-SD 3.55Å; Q128-M132 HydrophobicContact CG-SD 3.91Å; L130-M132 HydrophobicContact CD2-CE 3.95Å; L130-M132 HydrophobicContact CD2-CG 4.21Å; M132-E136 HydrophobicContact CB-CB 4.28Å; M132-F141 HydrophobicContact CE-CE2 4.06Å; M132-F141 HydrophobicContact SD-CE2 3.79Å; M132-V159 HydrophobicContact CB-CB 4.24Å; M132-V159 HydrophobicContact CE-CG1 4Å; M132-V159 PolarHBondContact N-O 3.24Å; M132-V159 PolarHBondContact O-N 3.08Å; M132-L162 HydrophobicContact CE-CD1 3.8Å
133	S	96.2	Very high	85.9	Confident	42 Å²	42	74.8 Å²	74.8	29%	0.294	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-76.2	159.3	162.4	64.8	0	0	0	0	111.2	A135 E136 A137	S133-A135 PolarHBondContact O-N 3.18Å; S133-E136 VanDerWaalsContact CB-OE2 3.28Å; S133-E136 WeakPolarHBondContact CB-OE2 3.29Å; S133-E136 PolarHBondContact N-OE2 3.27Å; S133-E136 PolarHBondContact O-N 3.13Å; S133-E136 VanDerWaalsContact O-N 3.16Å; S133-E136 VanDerWaalsContact OG-CD 3.31Å; S133-E136 WeakPolarHBondContact OG-CG 3.27Å; S133-E136 PolarHBondContact OG-N 3.02Å; S133-E136 PolarHBondContact OG-OE2 3.02Å; S133-A137 PolarHBondContact O-N 3.31Å
134	P	96.5	Very high	87.9	Confident	22 Å²	22	72.5 Å²	72.5	14%	0.143	38%	0.383	C	S	.	.	H	α-helix	trans	-56.2	-36.5	171.7	-29.2	37.6	0	0	0	113.5	A137 L138 V153 Y156	P134-A137 PolarHBondContact O-N 3.11Å; P134-L138 WeakPolarHBondContact O-CB 3.43Å; P134-L138 WeakPolarHBondContact O-CG 3.19Å; P134-L138 PolarHBondContact O-N 3.37Å; P134-V153 HydrophobicContact CB-CG1 4.47Å; P134-V153 HydrophobicContact CB-CG2 4.23Å; P134-V153 WeakPolarHBondContact CB-O 3.44Å; P134-V153 VanDerWaalsContact CG-O 3.26Å; P134-V153 WeakPolarHBondContact CG-O 3.36Å; P134-Y156 WeakPolarHBondContact CG-O 3.46Å
135	A	96.3	Very high	89.7	Confident	69 Å²	69	70.2 Å²	70.2	57%	0.57	36%	0.362	S	S	*	.	H	α-helix	trans	-64.2	-40.8	177.5	0	0	0	0	0	111.9	S133 S139	S133-A135 PolarHBondContact O-N 3.18Å; A135-S139 WeakPolarHBondContact O-CB 3.42Å; A135-S139 PolarHBondContact O-N 2.89Å
136	E	95.3	Very high	91.2	Very high	91 Å²	91	69 Å²	69	43%	0.425	36%	0.358	S	S	.	.	H	α-helix	trans	-68.7	-40.1	173.1	-71	159	133	0	0	111.5	M132 S133 S139 N140	M132-E136 HydrophobicContact CB-CB 4.28Å; S133-E136 VanDerWaalsContact CB-OE2 3.28Å; S133-E136 WeakPolarHBondContact CB-OE2 3.29Å; S133-E136 PolarHBondContact N-OE2 3.27Å; S133-E136 PolarHBondContact O-N 3.13Å; S133-E136 VanDerWaalsContact O-N 3.16Å; S133-E136 VanDerWaalsContact OG-CD 3.31Å; S133-E136 WeakPolarHBondContact OG-CG 3.27Å; S133-E136 PolarHBondContact OG-N 3.02Å; S133-E136 PolarHBondContact OG-OE2 3.02Å; E136-S139 PolarHBondContact O-N 2.77Å; E136-N140 WeakPolarHBondContact O-CB 3.46Å; E136-N140 PolarHBondContact O-N 2.81Å; E136-N140 PolarHBondContact O-ND2 2.86Å
137	A	95.3	Very high	92.5	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-60.7	-46.9	176.5	0	0	0	0	0	111.6	S133 P134 F141 V153 V159 L162	S133-A137 PolarHBondContact O-N 3.31Å; P134-A137 PolarHBondContact O-N 3.11Å; A137-F141 WeakPolarHBondContact O-CA 3.27Å; A137-F141 WeakPolarHBondContact O-CB 3.32Å; A137-F141 PolarHBondContact O-N 3.3Å; A137-V153 HydrophobicContact CB-CG2 4.31Å; A137-V159 HydrophobicContact CB-CB 4.44Å; A137-V159 HydrophobicContact CB-CG1 4.16Å; A137-V159 HydrophobicContact CB-CG2 4.15Å; A137-L162 HydrophobicContact CB-CD1 4.32Å; A137-L162 HydrophobicContact CB-CD2 4.3Å
138	L	96.1	Very high	93.8	Very high	31 Å²	31	69.8 Å²	69.8	16%	0.162	34%	0.344	C	S	.	.	H	α-helix	trans	-64.9	-45.6	174.8	-70.3	170.7	0	0	0	112	P134 N140 R142 L145 Q150 V153	P134-L138 WeakPolarHBondContact O-CB 3.43Å; P134-L138 WeakPolarHBondContact O-CG 3.19Å; P134-L138 PolarHBondContact O-N 3.37Å; L138-N140 VanDerWaalsContact C-N 3.27Å; L138-N140 PolarHBondContact O-N 2.89Å; L138-R142 WeakPolarHBondContact O-CB 3.44Å; L138-R142 PolarHBondContact O-N 3.24Å; L138-R142 VanDerWaalsContact O-N 3.07Å; L138-L145 HydrophobicContact CD2-CD1 4.46Å; L138-Q150 HydrophobicContact CD2-CB 4.02Å; L138-Q150 HydrophobicContact CD2-CG 4.17Å; L138-V153 HydrophobicContact CD1-CG1 4.05Å; L138-V153 HydrophobicContact CD2-CG1 3.8Å; L138-V153 HydrophobicContact CG-CG1 3.8Å
139	S	95.4	Very high	94.8	Very high	102 Å²	102	67 Å²	67	71%	0.713	33%	0.331	S	S	*	.	H	α-helix	trans	-64.5	-29.6	-177.6	-173.7	0	0	0	0	113.6	A135 E136	A135-S139 WeakPolarHBondContact O-CB 3.42Å; A135-S139 PolarHBondContact O-N 2.89Å; E136-S139 PolarHBondContact O-N 2.77Å
140	N	93	Very high	95.3	Very high	77 Å²	77	58.9 Å²	58.9	41%	0.412	30%	0.303	S	S	.	.	H	α-helix	trans	-100.7	-26.9	-177.6	-66.8	-75.9	0	0	0	113.3	Q128 E136 L138	Q128-N140 VanDerWaalsContact NE2-CG 3.33Å; Q128-N140 PolarHBondContact NE2-OD1 2.93Å; Q128-N140 VanDerWaalsContact NE2-OD1 3.08Å; E136-N140 WeakPolarHBondContact O-CB 3.46Å; E136-N140 PolarHBondContact O-N 2.81Å; E136-N140 PolarHBondContact O-ND2 2.86Å; L138-N140 VanDerWaalsContact C-N 3.27Å; L138-N140 PolarHBondContact O-N 2.89Å
141	F	95	Very high	95.5	Very high	16 Å²	16	64 Å²	64	7%	0.07	33%	0.326	C	S	.	.	H	α-helix	trans	-133.8	7.9	-167.1	-50.7	-67.4	0	0	0	115.3	Y125 E126 Q128 M132 A137 E143 R144 L145 L162 L164	Y125-F141 HydrophobicContact CD1-CE2 4.4Å; Y125-F141 HydrophobicContact CD1-CZ 4.19Å; Y125-F141 HydrophobicContact CE1-CZ 4.48Å; E126-F141 HydrophobicContact CB-CE1 4.46Å; E126-F141 HydrophobicContact CB-CZ 4.47Å; E126-F141 WeakPolarHBondContact OE2-CE1 3.4Å; Q128-F141 HydrophobicContact CG-CE2 4.23Å; Q128-F141 HydrophobicContact CG-CZ 4.03Å; M132-F141 HydrophobicContact CE-CE2 4.06Å; M132-F141 HydrophobicContact SD-CE2 3.79Å; A137-F141 WeakPolarHBondContact O-CA 3.27Å; A137-F141 WeakPolarHBondContact O-CB 3.32Å; A137-F141 PolarHBondContact O-N 3.3Å; F141-E143 VanDerWaalsContact C-N 3.26Å; F141-E143 PolarHBondContact O-N 3.44Å; F141-E143 VanDerWaalsContact O-N 3.12Å; F141-R144 WeakPolarHBondContact O-CA 3.26Å; F141-R144 PolarHBondContact O-N 3.38Å; F141-L145 PolarHBondContact O-N 3.48Å; F141-L162 HydrophobicContact CB-CD1 4.31Å; F141-L162 HydrophobicContact CD2-CD1 3.46Å; F141-L162 VanDerWaalsContact CD2-CD1 3.46Å; F141-L162 HydrophobicContact CE2-CD1 4.03Å; F141-L162 HydrophobicContact CG-CD1 4.07Å; F141-L164 HydrophobicContact CB-CD1 3.89Å; F141-L164 HydrophobicContact CB-CD2 4.33Å; F141-L164 HydrophobicContact CD1-CD1 3.4Å; F141-L164 VanDerWaalsContact CD1-CD1 3.4Å; F141-L164 HydrophobicContact CD2-CD1 4.43Å; F141-L164 HydrophobicContact CE1-CD1 4Å; F141-L164 HydrophobicContact CG-CD1 3.65Å
142	R	94.8	Very high	95.6	Very high	139 Å²	139	62.4 Å²	62.4	53%	0.525	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-44.8	-46.1	179.5	159.4	173.2	-83.2	167.8	-2.2	113.8	L138 R144 L145 Q150	L138-R142 WeakPolarHBondContact O-CB 3.44Å; L138-R142 PolarHBondContact O-N 3.24Å; L138-R142 VanDerWaalsContact O-N 3.07Å; R142-R144 PolarHBondContact O-N 3.01Å; R142-R144 VanDerWaalsContact O-N 3.15Å; R142-L145 PolarHBondContact O-N 3.28Å; R142-Q150 HydrophobicContact CG-CG 4.49Å; R142-Q150 PolarHBondContact O-NE2 3.02Å
143	E	94	Very high	95.7	Very high	196 Å²	196	62.2 Å²	62.2	92%	0.916	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-67.2	-11.3	-178.4	-61.8	-178.4	176.5	0	0	114.3	F141	F141-E143 VanDerWaalsContact C-N 3.26Å; F141-E143 PolarHBondContact O-N 3.44Å; F141-E143 VanDerWaalsContact O-N 3.12Å
144	R	94.3	Very high	95.7	Very high	109 Å²	109	63.8 Å²	63.8	41%	0.411	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-112.2	7.7	178.8	-62.8	175.4	66.2	-166.9	0.6	112.7	E126 F141 R142 L164	E126-R144 VanDerWaalsContact CD-NH1 3.27Å; E126-R144 IonicContact OE1-CZ 2.7Å; E126-R144 IonicContact OE1-NH1 3.5Å; E126-R144 PolarHBondContact OE1-NH1 3.43Å; E126-R144 IonicContact OE1-NH2 3.09Å; E126-R144 PolarHBondContact OE1-NH2 2.97Å; E126-R144 IonicContact OE2-NH1 3.38Å; E126-R144 PolarHBondContact OE2-NH1 3.22Å; F141-R144 WeakPolarHBondContact O-CA 3.26Å; F141-R144 PolarHBondContact O-N 3.38Å; R142-R144 PolarHBondContact O-N 3.01Å; R142-R144 VanDerWaalsContact O-N 3.15Å; R144-L164 HydrophobicContact CB-CD1 4.47Å; R144-L164 HydrophobicContact CB-CD2 3.89Å; R144-L164 PolarHBondContact NH2-O 3.15Å
145	L	95.8	Very high	95.7	Very high	10 Å²	10	68.6 Å²	68.6	5%	0.052	35%	0.349	C	S	.	.	S	Bend	trans	-110.4	139.2	174.1	-64.5	176.7	0	0	0	109.5	L138 F141 R142 E149 Q150 L162 L164	L138-L145 HydrophobicContact CD2-CD1 4.46Å; F141-L145 PolarHBondContact O-N 3.48Å; R142-L145 PolarHBondContact O-N 3.28Å; L145-E149 HydrophobicContact CB-CB 4.05Å; L145-E149 HydrophobicContact CD2-CB 4.39Å; L145-Q150 HydrophobicContact CB-CG 3.97Å; L145-Q150 PolarHBondContact O-NE2 3.48Å; L145-L162 HydrophobicContact CD1-CD2 4.31Å; L145-L162 HydrophobicContact CD2-CD2 3.87Å; L145-L164 HydrophobicContact CD2-CD2 3.67Å; L145-L164 HydrophobicContact CG-CD2 4.33Å
146	T	96.5	Very high	95.8	Very high	8 Å²	8	67.6 Å²	67.6	5%	0.049	33%	0.331	C	S	.	.			trans	-62	157.6	174.4	63.9	0	0	0	0	110.3	F148 E149 Q150 K168 E170	T146-F148 PolarHBondContact O-N 3.07Å; T146-E149 PolarHBondContact N-OE2 3.06Å; T146-E149 PolarHBondContact O-N 3.43Å; T146-E149 WeakPolarHBondContact OG1-CB 3.29Å; T146-E149 VanDerWaalsContact OG1-CG 3.29Å; T146-E149 WeakPolarHBondContact OG1-CG 3.18Å; T146-E149 PolarHBondContact OG1-N 3.17Å; T146-Q150 WeakPolarHBondContact O-CG 3.45Å; T146-Q150 PolarHBondContact O-N 3.15Å; T146-K168 HydrophobicContact CG2-CB 3.83Å; T146-K168 HydrophobicContact CG2-CD 4.05Å; T146-E170 WeakPolarHBondContact CB-OE2 3.05Å; T146-E170 VanDerWaalsContact CG2-OE2 3.27Å; T146-E170 WeakPolarHBondContact CG2-OE2 3.37Å
147	E	95.3	Very high	95.8	Very high	161 Å²	161	67.7 Å²	67.7	75%	0.752	35%	0.347	S	S	*	.	H	α-helix	trans	-55.1	-41	178.9	-64.5	-173.7	157.3	0	0	111.4	E149 Q150 E151	E147-E149 PolarHBondContact O-N 3.23Å; E147-Q150 PolarHBondContact O-N 2.98Å; E147-E151 PolarHBondContact O-N 2.64Å
148	F	96.1	Very high	95.9	Very high	36 Å²	36	71.4 Å²	71.4	16%	0.158	36%	0.364	C	S	.	.	H	α-helix	trans	-59.2	-42.4	174	-166.6	-88.5	0	0	0	113.1	T146 Q150 E151 E152 N179 Y181 R272	T146-F148 PolarHBondContact O-N 3.07Å; F148-Q150 VanDerWaalsContact C-N 3.34Å; F148-E151 PolarHBondContact O-N 3.42Å; F148-E152 HydrophobicContact CD1-CB 4.2Å; F148-E152 HydrophobicContact CE1-CB 4.14Å; F148-E152 HydrophobicContact CE1-CG 4.36Å; F148-E152 VanDerWaalsContact O-CB 3.26Å; F148-E152 WeakPolarHBondContact O-CB 3.47Å; F148-E152 PolarHBondContact O-N 3.31Å; F148-N179 HydrophobicContact CE2-CB 4.2Å; F148-N179 WeakPolarHBondContact CE2-ND2 3.49Å; F148-Y181 AromaticContact CD1-CE2 3.63Å; F148-Y181 HydrophobicContact CD1-CE2 3.63Å; F148-Y181 AromaticContact CD1-CZ 3.91Å; F148-Y181 WeakPolarHBondContact CD1-OH 3.21Å; F148-Y181 HydrophobicContact CD2-CE2 4.24Å; F148-Y181 AromaticContact CE1-CE2 3.68Å; F148-Y181 HydrophobicContact CE1-CE2 3.68Å; F148-Y181 HydrophobicContact CE2-CE2 4.28Å; F148-Y181 AromaticContact CG-CE2 3.93Å; F148-Y181 HydrophobicContact CG-CE2 3.93Å; F148-Y181 HydrophobicContact CZ-CE2 4.02Å; F148-R272 HydrophobicContact CE1-CG 4.35Å
149	E	97.3	Very high	95.9	Very high	0 Å²	0	70 Å²	70	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-70.8	-28	178.7	-77	171.8	171.2	0	0	113.3	L145 T146 E147 E151 V153 K168 H195 Y198 R272	L145-E149 HydrophobicContact CB-CB 4.05Å; L145-E149 HydrophobicContact CD2-CB 4.39Å; T146-E149 PolarHBondContact N-OE2 3.06Å; T146-E149 PolarHBondContact O-N 3.43Å; T146-E149 WeakPolarHBondContact OG1-CB 3.29Å; T146-E149 VanDerWaalsContact OG1-CG 3.29Å; T146-E149 WeakPolarHBondContact OG1-CG 3.18Å; T146-E149 PolarHBondContact OG1-N 3.17Å; E147-E149 PolarHBondContact O-N 3.23Å; E149-E151 PolarHBondContact O-N 2.9Å; E149-V153 VanDerWaalsContact O-CB 3.27Å; E149-V153 WeakPolarHBondContact O-CB 3.5Å; E149-V153 VanDerWaalsContact O-CG1 3.29Å; E149-V153 WeakPolarHBondContact O-CG1 3.48Å; E149-V153 PolarHBondContact O-N 3.34Å; E149-K168 IonicContact OE1-NZ 3.92Å; E149-K168 PolarHBondContact OE1-NZ 3.3Å; E149-K168 VanDerWaalsContact OE2-CD 3.27Å; E149-K168 WeakPolarHBondContact OE2-CD 3.49Å; E149-K168 WeakPolarHBondContact OE2-CE 3.32Å; E149-K168 IonicContact OE2-NZ 3.23Å; E149-K168 PolarHBondContact OE2-NZ 3.17Å; E149-H195 IonicContact OE1-CE1 2.64Å; E149-H195 IonicContact OE1-NE2 3.98Å; E149-H195 PolarHBondContact OE1-NE2 3.06Å; E149-Y198 WeakPolarHBondContact CA-OH 3.22Å; E149-Y198 PolarHBondContact O-OH 3.43Å; E149-Y198 VanDerWaalsContact O-OH 3.13Å; E149-R272 IonicContact OE1-CZ 3.95Å; E149-R272 IonicContact OE1-NH1 2.77Å; E149-R272 IonicContact OE1-NH2 3.97Å; E149-R272 PolarHBondContact OE1-NH2 3.24Å
150	Q	96.3	Very high	96	Very high	52 Å²	52	65.9 Å²	65.9	24%	0.243	33%	0.326	C	S	.	.	H	α-helix	trans	-67.6	-27.8	176.6	-67.4	176.8	47.5	0	0	112.2	L138 R142 L145 T146 E147 F148	L138-Q150 HydrophobicContact CD2-CB 4.02Å; L138-Q150 HydrophobicContact CD2-CG 4.17Å; R142-Q150 HydrophobicContact CG-CG 4.49Å; R142-Q150 PolarHBondContact O-NE2 3.02Å; L145-Q150 HydrophobicContact CB-CG 3.97Å; L145-Q150 PolarHBondContact O-NE2 3.48Å; T146-Q150 WeakPolarHBondContact O-CG 3.45Å; T146-Q150 PolarHBondContact O-N 3.15Å; E147-Q150 PolarHBondContact O-N 2.98Å; F148-Q150 VanDerWaalsContact C-N 3.34Å
151	E	95.3	Very high	96.2	Very high	128 Å²	128	62.9 Å²	62.9	60%	0.598	31%	0.309	S	S	*	.	H	α-helix	trans	-84.7	-54.9	169.9	-60.8	-172.2	170.6	0	0	111	E147 F148 E149 V153 S154	E147-E151 PolarHBondContact O-N 2.64Å; F148-E151 PolarHBondContact O-N 3.42Å; E149-E151 PolarHBondContact O-N 2.9Å; E151-V153 VanDerWaalsContact C-N 3.27Å; E151-V153 PolarHBondContact O-N 2.89Å; E151-V153 VanDerWaalsContact O-N 3.16Å; E151-S154 WeakPolarHBondContact O-CB 3.44Å; E151-S154 PolarHBondContact O-N 3.37Å; E151-S154 VanDerWaalsContact O-N 3.08Å; E151-S154 PolarHBondContact O-OG 2.97Å
152	E	96.9	Very high	96.3	Very high	18 Å²	18	62.1 Å²	62.1	8%	0.084	31%	0.306	C	S	.	.	H	α-helix	trans	-55.1	-36.2	-174.6	-178.6	-178.8	-143.2	0	0	113	F148 S154 D155 Y156 Y198 R272	F148-E152 HydrophobicContact CD1-CB 4.2Å; F148-E152 HydrophobicContact CE1-CB 4.14Å; F148-E152 HydrophobicContact CE1-CG 4.36Å; F148-E152 VanDerWaalsContact O-CB 3.26Å; F148-E152 WeakPolarHBondContact O-CB 3.47Å; F148-E152 PolarHBondContact O-N 3.31Å; E152-S154 PolarHBondContact O-N 3.03Å; E152-S154 VanDerWaalsContact O-N 3.11Å; E152-D155 PolarHBondContact O-N 3Å; E152-D155 VanDerWaalsContact O-N 3.13Å; E152-Y156 HydrophobicContact CG-CE2 3.88Å; E152-Y156 VanDerWaalsContact O-CD2 3.27Å; E152-Y156 WeakPolarHBondContact O-CD2 3.49Å; E152-Y156 WeakPolarHBondContact O-CE2 3.5Å; E152-Y198 HydrophobicContact CG-CE2 4.11Å; E152-R272 WeakPolarHBondContact OE1-CG 3.29Å; E152-R272 IonicContact OE1-NE 3.62Å; E152-R272 PolarHBondContact OE1-NE 3.19Å; E152-R272 IonicContact OE2-CZ 3.49Å; E152-R272 VanDerWaalsContact OE2-CZ 3.22Å; E152-R272 IonicContact OE2-NE 3.03Å; E152-R272 PolarHBondContact OE2-NE 3.46Å; E152-R272 IonicContact OE2-NH2 3.22Å; E152-R272 PolarHBondContact OE2-NH2 3.38Å
153	V	97.4	Very high	96.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-60.3	-26.1	-178.4	71.6	0	0	0	0	113	P134 A137 L138 E149 E151 D155 Y156 V159 Y198	P134-V153 HydrophobicContact CB-CG1 4.47Å; P134-V153 HydrophobicContact CB-CG2 4.23Å; P134-V153 WeakPolarHBondContact CB-O 3.44Å; P134-V153 VanDerWaalsContact CG-O 3.26Å; P134-V153 WeakPolarHBondContact CG-O 3.36Å; A137-V153 HydrophobicContact CB-CG2 4.31Å; L138-V153 HydrophobicContact CD1-CG1 4.05Å; L138-V153 HydrophobicContact CD2-CG1 3.8Å; L138-V153 HydrophobicContact CG-CG1 3.8Å; E149-V153 VanDerWaalsContact O-CB 3.27Å; E149-V153 WeakPolarHBondContact O-CB 3.5Å; E149-V153 VanDerWaalsContact O-CG1 3.29Å; E149-V153 WeakPolarHBondContact O-CG1 3.48Å; E149-V153 PolarHBondContact O-N 3.34Å; E151-V153 VanDerWaalsContact C-N 3.27Å; E151-V153 PolarHBondContact O-N 2.89Å; E151-V153 VanDerWaalsContact O-N 3.16Å; V153-D155 PolarHBondContact O-N 2.83Å; V153-Y156 PolarHBondContact O-N 3.08Å; V153-V159 HydrophobicContact CG2-CG2 3.67Å; V153-Y198 HydrophobicContact CB-CE1 3.87Å; V153-Y198 HydrophobicContact CB-CE2 4.14Å; V153-Y198 HydrophobicContact CG2-CD1 4.03Å; V153-Y198 HydrophobicContact CG2-CE1 3.75Å; V153-Y198 HydrophobicContact CG2-CE2 4.33Å; V153-Y198 HydrophobicContact CG2-CG 4.42Å; V153-Y198 PolarHBondContact N-OH 3.15Å
154	S	96.9	Very high	96.4	Very high	75 Å²	75	47 Å²	47	52%	0.524	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-68.5	-20.8	-179.4	-59.1	0	0	0	0	113.4	E151 E152 Y156	E151-S154 WeakPolarHBondContact O-CB 3.44Å; E151-S154 PolarHBondContact O-N 3.37Å; E151-S154 VanDerWaalsContact O-N 3.08Å; E151-S154 PolarHBondContact O-OG 2.97Å; E152-S154 PolarHBondContact O-N 3.03Å; E152-S154 VanDerWaalsContact O-N 3.11Å; S154-Y156 VanDerWaalsContact C-N 3.27Å; S154-Y156 PolarHBondContact O-N 2.82Å
155	D	96.7	Very high	96.2	Very high	123 Å²	123	45.5 Å²	45.5	66%	0.658	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-77.4	-10.8	176.9	-72.2	-22.7	0	0	0	113.1	E152 V153	E152-D155 PolarHBondContact O-N 3Å; E152-D155 VanDerWaalsContact O-N 3.13Å; V153-D155 PolarHBondContact O-N 2.83Å
156	Y	97.3	Very high	96.2	Very high	48 Å²	48	46 Å²	46	19%	0.188	26%	0.264	C	S	.	.			trans	-105.2	125.7	-174	-65.7	-97.9	0	0	0	111.9	P134 E152 V153 S154 E158 A197 Y198 F271	P134-Y156 WeakPolarHBondContact CG-O 3.46Å; E152-Y156 HydrophobicContact CG-CE2 3.88Å; E152-Y156 VanDerWaalsContact O-CD2 3.27Å; E152-Y156 WeakPolarHBondContact O-CD2 3.49Å; E152-Y156 WeakPolarHBondContact O-CE2 3.5Å; V153-Y156 PolarHBondContact O-N 3.08Å; S154-Y156 VanDerWaalsContact C-N 3.27Å; S154-Y156 PolarHBondContact O-N 2.82Å; Y156-E158 VanDerWaalsContact C-N 3.32Å; Y156-E158 PolarHBondContact O-N 2.97Å; Y156-A197 HydrophobicContact CD1-CB 4.49Å; Y156-A197 HydrophobicContact CE1-CB 3.73Å; Y156-Y198 HydrophobicContact CD1-CD2 4.01Å; Y156-Y198 AromaticContact CD2-CD2 3.44Å; Y156-Y198 HydrophobicContact CD2-CD2 3.44Å; Y156-Y198 VanDerWaalsContact CD2-CD2 3.44Å; Y156-Y198 AromaticContact CD2-CE2 3.51Å; Y156-Y198 HydrophobicContact CD2-CE2 3.51Å; Y156-Y198 HydrophobicContact CE1-CD2 4.26Å; Y156-Y198 AromaticContact CE2-CD2 3.74Å; Y156-Y198 HydrophobicContact CE2-CD2 3.74Å; Y156-Y198 AromaticContact CE2-CE2 3.6Å; Y156-Y198 HydrophobicContact CE2-CE2 3.6Å; Y156-Y198 AromaticContact CG-CD2 3.6Å; Y156-Y198 HydrophobicContact CG-CD2 3.6Å; Y156-Y198 HydrophobicContact CG-CE2 4.17Å; Y156-F271 WeakPolarHBondContact OH-CD2 3.1Å
157	A	96.4	Very high	96.1	Very high	93 Å²	93	54.2 Å²	54.2	77%	0.769	30%	0.302	S	S	*	.	S	Bend	trans	-73.1	-21.3	-178.8	0	0	0	0	0	114.5
158	E	96.6	Very high	96.1	Very high	78 Å²	78	48.1 Å²	48.1	36%	0.364	27%	0.273	S	S	.	.			trans	-140.3	126.2	-178.3	-63.8	179	147	0	0	110	P131 Y156 W160 K221	P131-E158 HydrophobicContact CB-CB 3.86Å; P131-E158 HydrophobicContact CB-CG 4.18Å; P131-E158 HydrophobicContact CG-CB 4.42Å; P131-E158 HydrophobicContact CG-CG 4.19Å; Y156-E158 VanDerWaalsContact C-N 3.32Å; Y156-E158 PolarHBondContact O-N 2.97Å; E158-W160 PolarHBondContact OE2-NE1 3.42Å; E158-K221 IonicContact OE1-NZ 3.8Å; E158-K221 PolarHBondContact OE1-NZ 3.49Å; E158-K221 IonicContact OE2-NZ 3.48Å; E158-K221 PolarHBondContact OE2-NZ 2.81Å
159	V	97.4	Very high	96.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-103	117.2	172.2	176	0	0	0	0	108.8	P131 M132 A137 V153 L162	P131-V159 WeakPolarHBondContact CA-O 3.26Å; M132-V159 HydrophobicContact CB-CB 4.24Å; M132-V159 HydrophobicContact CE-CG1 4Å; M132-V159 PolarHBondContact N-O 3.24Å; M132-V159 PolarHBondContact O-N 3.08Å; A137-V159 HydrophobicContact CB-CB 4.44Å; A137-V159 HydrophobicContact CB-CG1 4.16Å; A137-V159 HydrophobicContact CB-CG2 4.15Å; V153-V159 HydrophobicContact CG2-CG2 3.67Å; V159-L162 HydrophobicContact CG1-CD1 4.22Å; V159-L162 HydrophobicContact CG1-CD2 3.72Å; V159-L162 HydrophobicContact CG1-CG 3.74Å
160	W	97.2	Very high	95.9	Very high	17 Å²	17	54.8 Å²	54.8	6%	0.064	31%	0.306	C	S	.	.			trans	-108.7	-30.7	179.5	-66	89.6	0	0	0	112.7	L130 P131 E158 Y198 R199 H220 K221	L130-W160 HydrophobicContact CB-CE3 3.94Å; L130-W160 HydrophobicContact CB-CZ3 4.08Å; L130-W160 WeakPolarHBondContact CD1-O 3.17Å; P131-W160 HydrophobicContact CB-CD2 3.97Å; P131-W160 HydrophobicContact CB-CE3 4.38Å; P131-W160 HydrophobicContact CB-CG 4.46Å; P131-W160 HydrophobicContact CB-CH2 4.16Å; P131-W160 HydrophobicContact CB-CZ2 3.7Å; P131-W160 HydrophobicContact CB-CZ3 4.48Å; P131-W160 HydrophobicContact CG-CH2 3.99Å; P131-W160 HydrophobicContact CG-CZ2 3.65Å; E158-W160 PolarHBondContact OE2-NE1 3.42Å; W160-Y198 CarbonylContact C-O 3.57Å; W160-Y198 WeakPolarHBondContact CA-O 3.43Å; W160-Y198 PolarHBondContact N-O 3.19Å; W160-R199 HydrophobicContact CB-CB 4.26Å; W160-R199 HydrophobicContact CB-CG 4.35Å; W160-R199 HydrophobicContact CG-CG 4.47Å; W160-H220 HydrophobicContact CB-CB 4.14Å; W160-K221 HydrophobicContact CD2-CB 3.77Å; W160-K221 HydrophobicContact CD2-CG 4.08Å; W160-K221 HydrophobicContact CE3-CB 4.16Å; W160-K221 HydrophobicContact CE3-CG 4.47Å; W160-K221 HydrophobicContact CG-CB 4.11Å; W160-K221 HydrophobicContact CH2-CG 4.04Å; W160-K221 HydrophobicContact CZ2-CB 4.25Å; W160-K221 HydrophobicContact CZ2-CD 3.87Å; W160-K221 HydrophobicContact CZ2-CG 3.61Å; W160-K221 HydrophobicContact CZ3-CG 4.45Å
161	F	97.3	Very high	95.6	Very high	14 Å²	14	52.8 Å²	52.8	6%	0.061	30%	0.299	C	S	.	.			trans	-153.3	132.9	-178.3	-177.7	-104	0	0	0	111.7	Y125 G163 H193 H195 Y198 E201 H220	Y125-F161 HydrophobicContact CD2-CD2 4.4Å; Y125-F161 AromaticContact CE2-CD2 3.82Å; Y125-F161 HydrophobicContact CE2-CD2 3.82Å; Y125-F161 HydrophobicContact CE2-CE2 4.04Å; F161-G163 VanDerWaalsContact CE1-CA 3.47Å; F161-H193 WeakPolarHBondContact CE1-O 3.49Å; F161-H193 WeakPolarHBondContact CZ-O 3.11Å; F161-H195 HydrophobicContact CD1-CB 3.77Å; F161-H195 HydrophobicContact CE1-CB 4.29Å; F161-Y198 PolarHBondContact N-O 2.89Å; F161-Y198 CarbonylContact O-C 3.54Å; F161-Y198 VanDerWaalsContact O-CA 3.25Å; F161-Y198 WeakPolarHBondContact O-CA 3.37Å; F161-E201 HydrophobicContact CD1-CB 3.89Å; F161-E201 HydrophobicContact CE1-CB 3.54Å; F161-E201 HydrophobicContact CE1-CG 3.67Å; F161-E201 HydrophobicContact CE2-CB 4.28Å; F161-E201 HydrophobicContact CE2-CG 4.29Å; F161-E201 HydrophobicContact CG-CB 4.41Å; F161-E201 HydrophobicContact CZ-CB 3.75Å; F161-E201 HydrophobicContact CZ-CG 3.53Å; F161-H220 HydrophobicContact CB-CB 4.1Å; F161-H220 AromaticContact CD2-CD2 3.67Å; F161-H220 AromaticContact CD2-CE1 3.49Å; F161-H220 VanDerWaalsContact CD2-CE1 3.49Å; F161-H220 WeakPolarHBondContact CD2-CE1 3.22Å; F161-H220 AromaticContact CD2-ND1 3.93Å; F161-H220 AromaticContact CD2-NE2 3.31Å; F161-H220 VanDerWaalsContact CD2-NE2 3.31Å; F161-H220 WeakPolarHBondContact CD2-NE2 3.28Å; F161-H220 AromaticContact CE2-CE1 3.88Å; F161-H220 AromaticContact CE2-NE2 3.64Å; F161-H220 AromaticContact CG-CD2 3.65Å; F161-H220 AromaticContact CG-NE2 3.74Å
162	L	96.8	Very high	95.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	30%	0.295	C	S	.	.			trans	-111	-9.4	-174	-73.1	162.3	0	0	0	114.7	Y125 M132 A137 F141 L145 V159 L164 K168 H195 Y198	Y125-L162 HydrophobicContact CE1-CB 4.34Å; Y125-L162 HydrophobicContact CE1-CD1 4.26Å; M132-L162 HydrophobicContact CE-CD1 3.8Å; A137-L162 HydrophobicContact CB-CD1 4.32Å; A137-L162 HydrophobicContact CB-CD2 4.3Å; F141-L162 HydrophobicContact CB-CD1 4.31Å; F141-L162 HydrophobicContact CD2-CD1 3.46Å; F141-L162 VanDerWaalsContact CD2-CD1 3.46Å; F141-L162 HydrophobicContact CE2-CD1 4.03Å; F141-L162 HydrophobicContact CG-CD1 4.07Å; L145-L162 HydrophobicContact CD1-CD2 4.31Å; L145-L162 HydrophobicContact CD2-CD2 3.87Å; V159-L162 HydrophobicContact CG1-CD1 4.22Å; V159-L162 HydrophobicContact CG1-CD2 3.72Å; V159-L162 HydrophobicContact CG1-CG 3.74Å; L162-L164 HydrophobicContact CB-CD1 4.41Å; L162-L164 HydrophobicContact CB-CD2 3.67Å; L162-L164 HydrophobicContact CB-CG 3.69Å; L162-L164 HydrophobicContact CD1-CD1 4.42Å; L162-L164 HydrophobicContact CD1-CD2 4.49Å; L162-L164 PolarHBondContact O-N 3Å; L162-K168 WeakPolarHBondContact O-CE 3.46Å; L162-K168 PolarHBondContact O-NZ 3.13Å; L162-H195 PolarHBondContact O-CD2 3.21Å; L162-Y198 HydrophobicContact CD2-CD1 3.74Å; L162-Y198 HydrophobicContact CD2-CE1 4Å
163	G	96.1	Very high	94.7	Very high	2 Å²	2	56.5 Å²	56.5	2%	0.021	33%	0.325	C	S	.	.			trans	62	25.1	179	0	0	0	0	0	115.2	F161 G165 S166 H193	F161-G163 VanDerWaalsContact CE1-CA 3.47Å; G163-G165 PolarHBondContact O-N 3.13Å; G163-S166 WeakPolarHBondContact O-CB 3.36Å; G163-S166 PolarHBondContact O-N 2.89Å; G163-S166 PolarHBondContact O-OG 3.22Å; G163-H193 WeakPolarHBondContact CA-O 3.49Å
164	L	94.4	Very high	94	Very high	16 Å²	16	59.8 Å²	59.8	8%	0.084	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	2.9	-170.4	-54.3	-178.4	0	0	0	116.5	Y125 F141 R144 L145 L162	Y125-L164 HydrophobicContact CE1-CD1 3.75Å; Y125-L164 HydrophobicContact CE1-CG 4.16Å; Y125-L164 WeakPolarHBondContact OH-CG 3.39Å; Y125-L164 PolarHBondContact OH-N 2.8Å; F141-L164 HydrophobicContact CB-CD1 3.89Å; F141-L164 HydrophobicContact CB-CD2 4.33Å; F141-L164 HydrophobicContact CD1-CD1 3.4Å; F141-L164 VanDerWaalsContact CD1-CD1 3.4Å; F141-L164 HydrophobicContact CD2-CD1 4.43Å; F141-L164 HydrophobicContact CE1-CD1 4Å; F141-L164 HydrophobicContact CG-CD1 3.65Å; R144-L164 HydrophobicContact CB-CD1 4.47Å; R144-L164 HydrophobicContact CB-CD2 3.89Å; R144-L164 PolarHBondContact NH2-O 3.15Å; L145-L164 HydrophobicContact CD2-CD2 3.67Å; L145-L164 HydrophobicContact CG-CD2 4.33Å; L162-L164 HydrophobicContact CB-CD1 4.41Å; L162-L164 HydrophobicContact CB-CD2 3.67Å; L162-L164 HydrophobicContact CB-CG 3.69Å; L162-L164 HydrophobicContact CD1-CD1 4.42Å; L162-L164 HydrophobicContact CD1-CD2 4.49Å; L162-L164 PolarHBondContact O-N 3Å
165	G	91	Very high	93.6	Very high	77 Å²	77	58.2 Å²	58.2	79%	0.794	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.8	2.7	173.1	0	0	0	0	0	113.6	G163	G163-G165 PolarHBondContact O-N 3.13Å
166	S	94.2	Very high	93.3	Very high	20 Å²	20	56.1 Å²	56.1	14%	0.14	35%	0.35	C	S	.	.	S	Bend	trans	-90.5	155.7	-179.1	68.2	0	0	0	0	112.2	G163 K168 L192 D194	G163-S166 WeakPolarHBondContact O-CB 3.36Å; G163-S166 PolarHBondContact O-N 2.89Å; G163-S166 PolarHBondContact O-OG 3.22Å; S166-K168 VanDerWaalsContact C-N 3.31Å; S166-K168 PolarHBondContact O-N 3.49Å; S166-K168 VanDerWaalsContact O-N 3.1Å; S166-K168 WeakPolarHBondContact OG-CG 3.45Å; S166-L192 WeakPolarHBondContact CB-O 3.5Å; S166-D194 WeakPolarHBondContact OG-CA 3.38Å; S166-D194 WeakPolarHBondContact OG-CB 3.45Å; S166-D194 PolarHBondContact OG-OD1 3.3Å
167	Q	94.9	Very high	93.1	Very high	181 Å²	181	59 Å²	59	85%	0.846	37%	0.365	S	S	*	.			trans	-83.3	79.3	172.6	-69.1	-179.7	-11.4	0	0	109.1	V191	Q167-V191 WeakPolarHBondContact O-CG1 3.36Å
168	K	96	Very high	93	Very high	32 Å²	32	55.6 Å²	55.6	14%	0.139	33%	0.334	C	S	.	.			trans	-60.9	156.3	-175.8	-67.7	176.1	170.6	-73.4	0	112.4	T146 E149 L162 S166 D194	T146-K168 HydrophobicContact CG2-CB 3.83Å; T146-K168 HydrophobicContact CG2-CD 4.05Å; E149-K168 IonicContact OE1-NZ 3.92Å; E149-K168 PolarHBondContact OE1-NZ 3.3Å; E149-K168 VanDerWaalsContact OE2-CD 3.27Å; E149-K168 WeakPolarHBondContact OE2-CD 3.49Å; E149-K168 WeakPolarHBondContact OE2-CE 3.32Å; E149-K168 IonicContact OE2-NZ 3.23Å; E149-K168 PolarHBondContact OE2-NZ 3.17Å; L162-K168 WeakPolarHBondContact O-CE 3.46Å; L162-K168 PolarHBondContact O-NZ 3.13Å; S166-K168 VanDerWaalsContact C-N 3.31Å; S166-K168 PolarHBondContact O-N 3.49Å; S166-K168 VanDerWaalsContact O-N 3.1Å; S166-K168 WeakPolarHBondContact OG-CG 3.45Å; K168-D194 IonicContact NZ-OD1 2.68Å; K168-D194 PolarHBondContact NZ-OD1 3.25Å
169	I	95.3	Very high	92.9	Very high	36 Å²	36	53.2 Å²	53.2	19%	0.185	32%	0.324	C	S	.	.			trans	-85.8	123.4	169.3	-64.9	168	0	0	0	108.2	G171 Y181 V189 V191	I169-G171 VanDerWaalsContact C-N 3.3Å; I169-G171 PolarHBondContact O-N 2.9Å; I169-Y181 HydrophobicContact CB-CD1 4.06Å; I169-Y181 HydrophobicContact CB-CE1 3.82Å; I169-Y181 HydrophobicContact CD1-CD1 4.26Å; I169-Y181 HydrophobicContact CG2-CD1 3.99Å; I169-Y181 HydrophobicContact CG2-CE1 3.94Å; I169-Y181 PolarHBondContact O-OH 2.87Å; I169-V189 HydrophobicContact CD1-CB 3.63Å; I169-V189 HydrophobicContact CD1-CG1 3.7Å; I169-V189 WeakPolarHBondContact CD1-O 3.44Å; I169-V191 HydrophobicContact CD1-CG2 4.13Å; I169-V191 HydrophobicContact CG1-CG2 3.96Å
170	E	93.4	Very high	92.8	Very high	140 Å²	140	54.7 Å²	54.7	65%	0.654	34%	0.339	S	S	*	.			trans	-71.1	86	170.8	-61.7	-58.9	164.9	0	0	109.7	T146	T146-E170 WeakPolarHBondContact CB-OE2 3.05Å; T146-E170 VanDerWaalsContact CG2-OE2 3.27Å; T146-E170 WeakPolarHBondContact CG2-OE2 3.37Å
171	G	89.6	Confident	92.8	Very high	10 Å²	10	53.9 Å²	53.9	10%	0.103	34%	0.336	C	S	.	.			trans	-68.9	135.4	178.1	0	0	0	0	0	111.3	I169 N179	I169-G171 VanDerWaalsContact C-N 3.3Å; I169-G171 PolarHBondContact O-N 2.9Å; G171-N179 VanDerWaalsContact CA-O 3.26Å; G171-N179 WeakPolarHBondContact CA-O 3.3Å
172	S	89.4	Confident	92.8	Very high	75 Å²	75	53.6 Å²	53.6	52%	0.524	34%	0.335	S	S	.	.			trans	-124.4	121	179.1	-175	0	0	0	0	110.6	G174 A175 N179	S172-G174 PolarHBondContact O-N 2.82Å; S172-A175 WeakPolarHBondContact O-CB 3.19Å; S172-A175 PolarHBondContact O-N 3.21Å; S172-N179 PolarHBondContact N-O 3.04Å; S172-N179 VanDerWaalsContact O-CA 3.29Å; S172-N179 WeakPolarHBondContact O-CA 3.29Å; S172-N179 WeakPolarHBondContact O-CB 3.49Å; S172-N179 PolarHBondContact O-OD1 3.38Å
173	Q	85.2	Confident	92.8	Very high	149 Å²	149	56.1 Å²	56.1	70%	0.696	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	123.9	-171.2	-165.8	179.4	26.2	0	0	111.6	A175	Q173-A175 VanDerWaalsContact C-N 3.32Å
174	G	82.3	Confident	92.7	Very high	70 Å²	70	62.8 Å²	62.8	72%	0.722	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	-2.6	-176	0	0	0	0	0	114.5	S172 N179	S172-G174 PolarHBondContact O-N 2.82Å; G174-N179 PolarHBondContact N-OD1 2.82Å
175	A	87.4	Confident	92.7	Very high	42 Å²	42	66.7 Å²	66.7	35%	0.347	40%	0.397	S	S	.	.			trans	-64.8	155.5	170.6	0	0	0	0	0	111.6	S172 Q173 N179	S172-A175 WeakPolarHBondContact O-CB 3.19Å; S172-A175 PolarHBondContact O-N 3.21Å; Q173-A175 VanDerWaalsContact C-N 3.32Å; A175-N179 PolarHBondContact O-N 3.01Å
176	A	90.4	Very high	92.9	Very high	79 Å²	79	63.2 Å²	63.2	65%	0.653	36%	0.361	S	S	*	.	H	α-helix	trans	-57.3	162	177.1	0	0	0	0	0	111.8	N178 G180	A176-N178 PolarHBondContact O-N 3.07Å; A176-G180 PolarHBondContact O-N 2.93Å; A176-G180 VanDerWaalsContact O-N 3.09Å
177	Q	93.4	Very high	93	Very high	107 Å²	107	62.8 Å²	62.8	50%	0.5	36%	0.358	S	S	.	.	H	α-helix	trans	53.4	55.6	176.4	-58.6	163.5	-46	0	0	112.4	G180 Y181 D182	Q177-G180 CarbonylContact O-C 3.55Å; Q177-G180 PolarHBondContact O-N 2.77Å; Q177-G180 VanDerWaalsContact O-N 3.14Å; Q177-Y181 PolarHBondContact O-N 2.77Å; Q177-D182 HydrophobicContact CB-CB 4.28Å; Q177-D182 WeakPolarHBondContact CB-O 3.27Å; Q177-D182 PolarHBondContact O-N 3.03Å
178	N	95.2	Very high	93.1	Very high	23 Å²	23	54.7 Å²	54.7	12%	0.123	32%	0.319	C	S	.	.	H	α-helix	trans	57.2	56.1	175.7	-171.1	30.6	0	0	0	112.6	A176 G180 Y181 D182 R272 N273	A176-N178 PolarHBondContact O-N 3.07Å; N178-G180 PolarHBondContact O-N 2.82Å; N178-Y181 WeakPolarHBondContact O-CB 2.94Å; N178-Y181 WeakPolarHBondContact O-CD2 3.35Å; N178-Y181 PolarHBondContact O-N 2.76Å; N178-D182 HydrophobicContact CB-CB 3.91Å; N178-D182 VanDerWaalsContact CB-OD1 3.32Å; N178-D182 WeakPolarHBondContact CB-OD1 3.32Å; N178-D182 WeakPolarHBondContact CB-OD2 3.46Å; N178-D182 PolarHBondContact ND2-OD1 3.29Å; N178-R272 PolarHBondContact ND2-O 2.69Å; N178-N273 PolarHBondContact OD1-ND2 3.33Å
179	N	95	Very high	93.1	Very high	28 Å²	28	55.6 Å²	55.6	15%	0.15	33%	0.328	C	S	.	.	H	α-helix	trans	61.8	19.7	-177.2	-47.9	-42.9	0	0	0	114	F148 G171 S172 G174 A175 Y181	F148-N179 HydrophobicContact CE2-CB 4.2Å; F148-N179 WeakPolarHBondContact CE2-ND2 3.49Å; G171-N179 VanDerWaalsContact CA-O 3.26Å; G171-N179 WeakPolarHBondContact CA-O 3.3Å; S172-N179 PolarHBondContact N-O 3.04Å; S172-N179 VanDerWaalsContact O-CA 3.29Å; S172-N179 WeakPolarHBondContact O-CA 3.29Å; S172-N179 WeakPolarHBondContact O-CB 3.49Å; S172-N179 PolarHBondContact O-OD1 3.38Å; G174-N179 PolarHBondContact N-OD1 2.82Å; A175-N179 PolarHBondContact O-N 3.01Å; N179-Y181 HydrophobicContact CB-CD2 4.19Å; N179-Y181 HydrophobicContact CB-CE2 4.43Å
180	G	95.1	Very high	93.1	Very high	30 Å²	30	58.7 Å²	58.7	31%	0.309	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.7	-0.6	-173.4	0	0	0	0	0	115.3	A176 Q177 N178	A176-G180 PolarHBondContact O-N 2.93Å; A176-G180 VanDerWaalsContact O-N 3.09Å; Q177-G180 CarbonylContact O-C 3.55Å; Q177-G180 PolarHBondContact O-N 2.77Å; Q177-G180 VanDerWaalsContact O-N 3.14Å; N178-G180 PolarHBondContact O-N 2.82Å
181	Y	97.3	Very high	93.2	Very high	0 Å²	0	53 Å²	53	0%	0	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-12.3	179.9	-69.3	-64.9	0	0	0	114.8	F148 I169 Q177 N178 N179 Y188 V189 R272	F148-Y181 AromaticContact CD1-CE2 3.63Å; F148-Y181 HydrophobicContact CD1-CE2 3.63Å; F148-Y181 AromaticContact CD1-CZ 3.91Å; F148-Y181 WeakPolarHBondContact CD1-OH 3.21Å; F148-Y181 HydrophobicContact CD2-CE2 4.24Å; F148-Y181 AromaticContact CE1-CE2 3.68Å; F148-Y181 HydrophobicContact CE1-CE2 3.68Å; F148-Y181 HydrophobicContact CE2-CE2 4.28Å; F148-Y181 AromaticContact CG-CE2 3.93Å; F148-Y181 HydrophobicContact CG-CE2 3.93Å; F148-Y181 HydrophobicContact CZ-CE2 4.02Å; I169-Y181 HydrophobicContact CB-CD1 4.06Å; I169-Y181 HydrophobicContact CB-CE1 3.82Å; I169-Y181 HydrophobicContact CD1-CD1 4.26Å; I169-Y181 HydrophobicContact CG2-CD1 3.99Å; I169-Y181 HydrophobicContact CG2-CE1 3.94Å; I169-Y181 PolarHBondContact O-OH 2.87Å; Q177-Y181 PolarHBondContact O-N 2.77Å; N178-Y181 WeakPolarHBondContact O-CB 2.94Å; N178-Y181 WeakPolarHBondContact O-CD2 3.35Å; N178-Y181 PolarHBondContact O-N 2.76Å; N179-Y181 HydrophobicContact CB-CD2 4.19Å; N179-Y181 HydrophobicContact CB-CE2 4.43Å; Y181-Y188 HydrophobicContact CD1-CE2 4.03Å; Y181-Y188 HydrophobicContact CG-CE2 4.16Å; Y181-Y188 CarbonylContact O-C 3.6Å; Y181-Y188 WeakPolarHBondContact O-CA 3.38Å; Y181-V189 PolarHBondContact O-N 3.49Å; Y181-R272 HydrophobicContact CD2-CG 4.49Å; Y181-R272 VanDerWaalsContact CE1-NH1 3.26Å
182	D	97.4	Very high	93.6	Very high	9 Å²	9	56.8 Å²	56.8	5%	0.048	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-107.2	152	179.8	-69.6	9.5	0	0	0	112.4	Q177 N178 S187 N233 H274	Q177-D182 HydrophobicContact CB-CB 4.28Å; Q177-D182 WeakPolarHBondContact CB-O 3.27Å; Q177-D182 PolarHBondContact O-N 3.03Å; N178-D182 HydrophobicContact CB-CB 3.91Å; N178-D182 VanDerWaalsContact CB-OD1 3.32Å; N178-D182 WeakPolarHBondContact CB-OD1 3.32Å; N178-D182 WeakPolarHBondContact CB-OD2 3.46Å; N178-D182 PolarHBondContact ND2-OD1 3.29Å; D182-S187 WeakPolarHBondContact CA-O 3.34Å; D182-N233 VanDerWaalsContact OD2-CB 3.3Å; D182-N233 WeakPolarHBondContact OD2-CB 3.25Å; D182-N233 PolarHBondContact OD2-ND2 2.78Å; D182-H274 IonicContact OD1-CE1 3.29Å; D182-H274 IonicContact OD1-NE2 2.74Å; D182-H274 PolarHBondContact OD1-NE2 2.94Å
183	D	95.1	Very high	94	Very high	53 Å²	53	57.7 Å²	57.7	28%	0.283	33%	0.325	S	S	.	.			trans	-73.4	172.1	159.1	69.2	24.8	0	0	0	111.7	H185 G186 S187 V189	D183-H185 PolarHBondContact O-N 3.44Å; D183-H185 VanDerWaalsContact OD1-C 3.24Å; D183-H185 VanDerWaalsContact OD1-CA 3.23Å; D183-H185 WeakPolarHBondContact OD1-CA 3.43Å; D183-H185 VanDerWaalsContact OD1-CB 3.31Å; D183-H185 WeakPolarHBondContact OD1-CB 3.26Å; D183-H185 PolarHBondContact OD1-N 3.12Å; D183-G186 PolarHBondContact O-N 3.14Å; D183-G186 PolarHBondContact OD1-N 3.26Å; D183-S187 PolarHBondContact N-O 3.4Å; D183-S187 PolarHBondContact OD1-N 3.2Å; D183-S187 PolarHBondContact OD1-OG 3.4Å; D183-S187 WeakPolarHBondContact OD2-CB 3.27Å; D183-S187 PolarHBondContact OD2-OG 3.09Å; D183-V189 HydrophobicContact CB-CG2 4.48Å
184	E	94.4	Very high	94.6	Very high	142 Å²	142	50.7 Å²	50.7	66%	0.664	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-24.6	175.1	51.7	173	-149.6	0	0	114.4
185	H	93.9	Very high	95.4	Very high	98 Å²	98	47.4 Å²	47.4	45%	0.454	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-0.6	177.2	-50.6	-32.5	0	0	0	113.3	D183 R232 K234	D183-H185 PolarHBondContact O-N 3.44Å; D183-H185 VanDerWaalsContact OD1-C 3.24Å; D183-H185 VanDerWaalsContact OD1-CA 3.23Å; D183-H185 WeakPolarHBondContact OD1-CA 3.43Å; D183-H185 VanDerWaalsContact OD1-CB 3.31Å; D183-H185 WeakPolarHBondContact OD1-CB 3.26Å; D183-H185 PolarHBondContact OD1-N 3.12Å; H185-R232 WeakPolarHBondContact O-CD 3.26Å; H185-R232 WeakPolarHBondContact O-CG 3.49Å; H185-R232 PolarHBondContact O-NE 2.98Å; H185-K234 VanDerWaalsContact C-CE 3.41Å; H185-K234 WeakPolarHBondContact O-CE 3.26Å
186	G	95.4	Very high	95.9	Very high	3 Å²	3	45.4 Å²	45.4	3%	0.031	24%	0.242	C	C	.	.	S	Bend	trans	79.9	21.5	-177.4	0	0	0	0	0	114.3	D183 R232 N233 H274	D183-G186 PolarHBondContact O-N 3.14Å; D183-G186 PolarHBondContact OD1-N 3.26Å; G186-R232 CarbonylContact O-C 3.59Å; G186-R232 VanDerWaalsContact O-CG 3.28Å; G186-R232 WeakPolarHBondContact O-CG 3.09Å; G186-N233 WeakPolarHBondContact O-CB 3.49Å; G186-N233 PolarHBondContact O-N 3.37Å; G186-H274 PolarHBondContact O-CE1 3.05Å
187	S	96.4	Very high	96.3	Very high	12 Å²	12	42.3 Å²	42.3	8%	0.084	22%	0.216	C	C	.	.			trans	-93.6	134.4	175.6	-13.9	0	0	0	0	109.9	D182 D183 V189 R232	D182-S187 WeakPolarHBondContact CA-O 3.34Å; D183-S187 PolarHBondContact N-O 3.4Å; D183-S187 PolarHBondContact OD1-N 3.2Å; D183-S187 PolarHBondContact OD1-OG 3.4Å; D183-S187 WeakPolarHBondContact OD2-CB 3.27Å; D183-S187 PolarHBondContact OD2-OG 3.09Å; S187-V189 PolarHBondContact O-N 2.93Å; S187-R232 PolarHBondContact OG-NE 2.95Å; S187-R232 PolarHBondContact OG-NH2 2.72Å
188	Y	97.3	Very high	96.5	Very high	10 Å²	10	37.2 Å²	37.2	4%	0.039	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-58.1	128.9	-179.1	-171.4	-106.9	0	0	0	112.5	Y181 R190 Q213 M230 F271 R272 H274	Y181-Y188 HydrophobicContact CD1-CE2 4.03Å; Y181-Y188 HydrophobicContact CG-CE2 4.16Å; Y181-Y188 CarbonylContact O-C 3.6Å; Y181-Y188 WeakPolarHBondContact O-CA 3.38Å; Y188-R190 VanDerWaalsContact C-N 3.3Å; Y188-R190 HydrophobicContact CD1-CB 4.28Å; Y188-R190 PolarHBondContact O-N 3.01Å; Y188-Q213 PolarHBondContact O-NE2 2.82Å; Y188-M230 HydrophobicContact CD1-CE 3.64Å; Y188-M230 HydrophobicContact CD1-SD 3.73Å; Y188-M230 HydrophobicContact CD2-CE 3.91Å; Y188-M230 HydrophobicContact CE1-CE 4.3Å; Y188-M230 HydrophobicContact CE1-SD 4.44Å; Y188-M230 HydrophobicContact CG-CE 3.42Å; Y188-M230 VanDerWaalsContact CG-CE 3.42Å; Y188-M230 HydrophobicContact CG-SD 4.06Å; Y188-F271 HydrophobicContact CE1-CE1 4.49Å; Y188-F271 HydrophobicContact CE2-CE1 4.3Å; Y188-F271 AromaticContact CZ-CE1 3.88Å; Y188-R272 HydrophobicContact CE2-CB 4.19Å; Y188-R272 PolarHBondContact OH-NH1 3.17Å; Y188-R272 VanDerWaalsContact OH-NH1 3.07Å; Y188-H274 WeakPolarHBondContact CB-NE2 3.43Å; Y188-H274 AromaticContact CD2-CD2 3.61Å; Y188-H274 AromaticContact CD2-NE2 3.62Å; Y188-H274 PolarHBondContact N-CE1 2.83Å
189	V	96.7	Very high	96.6	Very high	52 Å²	52	37.7 Å²	37.7	32%	0.315	19%	0.192	S	C	.	.			trans	-77.5	83.3	174	-172.7	0	0	0	0	108.7	I169 Y181 D183 S187	I169-V189 HydrophobicContact CD1-CB 3.63Å; I169-V189 HydrophobicContact CD1-CG1 3.7Å; I169-V189 WeakPolarHBondContact CD1-O 3.44Å; Y181-V189 PolarHBondContact O-N 3.49Å; D183-V189 HydrophobicContact CB-CG2 4.48Å; S187-V189 PolarHBondContact O-N 2.93Å
190	R	93.9	Very high	96.8	Very high	100 Å²	100	36.4 Å²	36.4	38%	0.377	19%	0.185	S	C	.	.			trans	-59.1	134	175.7	79.2	-56.5	168.9	-142.2	-7.4	112.8	Y188 V205 L215	Y188-R190 VanDerWaalsContact C-N 3.3Å; Y188-R190 HydrophobicContact CD1-CB 4.28Å; Y188-R190 PolarHBondContact O-N 3.01Å; R190-V205 HydrophobicContact CG-CG2 4.05Å; R190-L215 HydrophobicContact CB-CD1 4.32Å; R190-L215 HydrophobicContact CB-CD2 4.28Å; R190-L215 HydrophobicContact CG-CD2 4.14Å
191	V	97.4	Very high	97	Very high	22 Å²	22	36.4 Å²	36.4	13%	0.133	18%	0.177	C	C	.	.			trans	-107.9	138.5	168.5	176.6	0	0	0	0	108	Q167 I169 D194 V202	Q167-V191 WeakPolarHBondContact O-CG1 3.36Å; I169-V191 HydrophobicContact CD1-CG2 4.13Å; I169-V191 HydrophobicContact CG1-CG2 3.96Å; V191-D194 HydrophobicContact CB-CB 3.75Å; V191-D194 HydrophobicContact CG1-CB 3.86Å; V191-V202 WeakPolarHBondContact O-CB 3.19Å
192	L	97.3	Very high	97	Very high	88 Å²	88	36.5 Å²	36.5	46%	0.461	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	142.6	176.1	-61.7	-176.8	0	0	0	110.6	S166 D194 V202	S166-L192 WeakPolarHBondContact CB-O 3.5Å; L192-D194 PolarHBondContact O-N 3.08Å; L192-V202 HydrophobicContact CD2-CG1 4.13Å
193	H	97.5	Very high	97.1	Very high	94 Å²	94	38.2 Å²	38.2	44%	0.435	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	7.4	-173.4	-51.6	-72.1	0	0	0	115.7	F161 G163 E201 V202	F161-H193 WeakPolarHBondContact CE1-O 3.49Å; F161-H193 WeakPolarHBondContact CZ-O 3.11Å; G163-H193 WeakPolarHBondContact CA-O 3.49Å; H193-E201 IonicContact CE1-OE1 3.26Å; H193-E201 IonicContact CG-OE1 3.7Å; H193-E201 IonicContact ND1-OE1 3.27Å; H193-E201 PolarHBondContact ND1-OE1 3.32Å; H193-V202 PolarHBondContact N-O 2.91Å
194	D	98.3	Very high	97.2	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.016	19%	0.192	C	C	.	.			trans	-82.3	166.5	169.2	-164.7	18.4	0	0	0	111.1	S166 K168 V191 L192 V202	S166-D194 WeakPolarHBondContact OG-CA 3.38Å; S166-D194 WeakPolarHBondContact OG-CB 3.45Å; S166-D194 PolarHBondContact OG-OD1 3.3Å; K168-D194 IonicContact NZ-OD1 2.68Å; K168-D194 PolarHBondContact NZ-OD1 3.25Å; V191-D194 HydrophobicContact CB-CB 3.75Å; V191-D194 HydrophobicContact CG1-CB 3.86Å; L192-D194 PolarHBondContact O-N 3.08Å; D194-V202 PolarHBondContact O-N 3.05Å
195	H	98.2	Very high	97.3	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	151.4	-178.9	75.7	63.7	0	0	0	113.5	E149 F161 L162 Y198 F200 F271	E149-H195 IonicContact OE1-CE1 2.64Å; E149-H195 IonicContact OE1-NE2 3.98Å; E149-H195 PolarHBondContact OE1-NE2 3.06Å; F161-H195 HydrophobicContact CD1-CB 3.77Å; F161-H195 HydrophobicContact CE1-CB 4.29Å; L162-H195 PolarHBondContact O-CD2 3.21Å; H195-Y198 AromaticContact CD2-CD1 3.81Å; H195-Y198 AromaticContact CD2-CE1 3.86Å; H195-Y198 AromaticContact CE1-CD1 3.81Å; H195-Y198 AromaticContact CE1-CE1 3.57Å; H195-Y198 AromaticContact CE1-CE2 3.88Å; H195-Y198 AromaticContact CE1-CZ 3.59Å; H195-Y198 AromaticContact NE2-CD1 3.49Å; H195-Y198 WeakPolarHBondContact NE2-CD1 3.46Å; H195-Y198 AromaticContact NE2-CE1 3.11Å; H195-Y198 WeakPolarHBondContact NE2-CE1 3.21Å; H195-Y198 AromaticContact NE2-CZ 3.55Å; H195-F200 CarbonylContact C-O 3.52Å; H195-F200 WeakPolarHBondContact CA-O 3.39Å; H195-F271 AromaticContact CE1-CE2 3.97Å; H195-F271 AromaticContact CE1-CZ 3.95Å; H195-F271 AromaticContact ND1-CE2 3.95Å; H195-F271 AromaticContact ND1-CZ 3.76Å; H195-F271 WeakPolarHBondContact O-CZ 3.2Å
196	I	98.5	Very high	97.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.7	156.7	-68.1	169.9	0	0	0	107.1	Y198 R199 F200 V202 L215 M230 F269 F271	I196-Y198 PolarHBondContact O-N 3.41Å; I196-Y198 VanDerWaalsContact O-N 3.15Å; I196-R199 PolarHBondContact O-N 2.83Å; I196-R199 VanDerWaalsContact O-N 3.09Å; I196-F200 HydrophobicContact CB-CB 4.23Å; I196-F200 HydrophobicContact CG2-CD2 4.42Å; I196-F200 PolarHBondContact N-O 3.33Å; I196-F200 PolarHBondContact O-N 2.88Å; I196-V202 HydrophobicContact CD1-CG2 3.62Å; I196-V202 HydrophobicContact CG1-CG2 3.88Å; I196-L215 HydrophobicContact CD1-CD1 3.68Å; I196-M230 HydrophobicContact CD1-SD 3.8Å; I196-F269 HydrophobicContact CG2-CE2 3.6Å; I196-F269 HydrophobicContact CG2-CZ 3.8Å; I196-F271 HydrophobicContact CB-CD1 4.2Å; I196-F271 HydrophobicContact CB-CE1 4.24Å; I196-F271 HydrophobicContact CG1-CD1 4.14Å; I196-F271 HydrophobicContact CG1-CE1 4Å; I196-F271 HydrophobicContact CG2-CB 4.23Å; I196-F271 HydrophobicContact CG2-CD1 3.8Å; I196-F271 HydrophobicContact CG2-CE1 4.34Å; I196-F271 HydrophobicContact CG2-CG 4.02Å
197	A	98.2	Very high	97.1	Very high	13 Å²	13	35.3 Å²	35.3	11%	0.107	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	49	39.7	178.4	0	0	0	0	0	114.1	Y156 R199 F269 F271	Y156-A197 HydrophobicContact CD1-CB 4.49Å; Y156-A197 HydrophobicContact CE1-CB 3.73Å; A197-R199 WeakPolarHBondContact O-CB 3.48Å; A197-R199 PolarHBondContact O-N 2.88Å; A197-F269 HydrophobicContact CB-CD2 3.93Å; A197-F269 HydrophobicContact CB-CE2 3.66Å; A197-F269 HydrophobicContact CB-CZ 4.4Å; A197-F271 HydrophobicContact CB-CD2 4.31Å; A197-F271 VanDerWaalsContact N-CD2 3.29Å
198	Y	98.3	Very high	96.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	28.7	-177.2	-60.6	-85.4	0	0	0	115.4	E149 E152 V153 Y156 W160 F161 L162 H195 I196	E149-Y198 WeakPolarHBondContact CA-OH 3.22Å; E149-Y198 PolarHBondContact O-OH 3.43Å; E149-Y198 VanDerWaalsContact O-OH 3.13Å; E152-Y198 HydrophobicContact CG-CE2 4.11Å; V153-Y198 HydrophobicContact CB-CE1 3.87Å; V153-Y198 HydrophobicContact CB-CE2 4.14Å; V153-Y198 HydrophobicContact CG2-CD1 4.03Å; V153-Y198 HydrophobicContact CG2-CE1 3.75Å; V153-Y198 HydrophobicContact CG2-CE2 4.33Å; V153-Y198 HydrophobicContact CG2-CG 4.42Å; V153-Y198 PolarHBondContact N-OH 3.15Å; Y156-Y198 HydrophobicContact CD1-CD2 4.01Å; Y156-Y198 AromaticContact CD2-CD2 3.44Å; Y156-Y198 HydrophobicContact CD2-CD2 3.44Å; Y156-Y198 VanDerWaalsContact CD2-CD2 3.44Å; Y156-Y198 AromaticContact CD2-CE2 3.51Å; Y156-Y198 HydrophobicContact CD2-CE2 3.51Å; Y156-Y198 HydrophobicContact CE1-CD2 4.26Å; Y156-Y198 AromaticContact CE2-CD2 3.74Å; Y156-Y198 HydrophobicContact CE2-CD2 3.74Å; Y156-Y198 AromaticContact CE2-CE2 3.6Å; Y156-Y198 HydrophobicContact CE2-CE2 3.6Å; Y156-Y198 AromaticContact CG-CD2 3.6Å; Y156-Y198 HydrophobicContact CG-CD2 3.6Å; Y156-Y198 HydrophobicContact CG-CE2 4.17Å; W160-Y198 CarbonylContact C-O 3.57Å; W160-Y198 WeakPolarHBondContact CA-O 3.43Å; W160-Y198 PolarHBondContact N-O 3.19Å; F161-Y198 PolarHBondContact N-O 2.89Å; F161-Y198 CarbonylContact O-C 3.54Å; F161-Y198 VanDerWaalsContact O-CA 3.25Å; F161-Y198 WeakPolarHBondContact O-CA 3.37Å; L162-Y198 HydrophobicContact CD2-CD1 3.74Å; L162-Y198 HydrophobicContact CD2-CE1 4Å; H195-Y198 AromaticContact CD2-CD1 3.81Å; H195-Y198 AromaticContact CD2-CE1 3.86Å; H195-Y198 AromaticContact CE1-CD1 3.81Å; H195-Y198 AromaticContact CE1-CE1 3.57Å; H195-Y198 AromaticContact CE1-CE2 3.88Å; H195-Y198 AromaticContact CE1-CZ 3.59Å; H195-Y198 AromaticContact NE2-CD1 3.49Å; H195-Y198 WeakPolarHBondContact NE2-CD1 3.46Å; H195-Y198 AromaticContact NE2-CE1 3.11Å; H195-Y198 WeakPolarHBondContact NE2-CE1 3.21Å; H195-Y198 AromaticContact NE2-CZ 3.55Å; I196-Y198 PolarHBondContact O-N 3.41Å; I196-Y198 VanDerWaalsContact O-N 3.15Å
199	R	98.1	Very high	96.3	Very high	33 Å²	33	41.7 Å²	41.7	13%	0.125	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-144.1	-40	-172.6	173.2	177.8	166.1	-159.5	-6.2	115.4	W160 I196 A197 D219 H220 K221 E267	W160-R199 HydrophobicContact CB-CB 4.26Å; W160-R199 HydrophobicContact CB-CG 4.35Å; W160-R199 HydrophobicContact CG-CG 4.47Å; I196-R199 PolarHBondContact O-N 2.83Å; I196-R199 VanDerWaalsContact O-N 3.09Å; A197-R199 WeakPolarHBondContact O-CB 3.48Å; A197-R199 PolarHBondContact O-N 2.88Å; R199-D219 IonicContact CZ-OD1 3.29Å; R199-D219 IonicContact CZ-OD2 2.82Å; R199-D219 IonicContact NE-OD1 3.86Å; R199-D219 PolarHBondContact NE-OD1 3.27Å; R199-D219 IonicContact NE-OD2 3.7Å; R199-D219 IonicContact NH2-OD1 2.76Å; R199-D219 PolarHBondContact NH2-OD1 3.46Å; R199-D219 IonicContact NH2-OD2 3.01Å; R199-D219 PolarHBondContact NH2-OD2 3.43Å; R199-H220 WeakPolarHBondContact O-CB 3.18Å; R199-H220 PolarHBondContact O-N 3.09Å; R199-K221 HydrophobicContact CG-CB 4.13Å; R199-E267 IonicContact CZ-OE1 2.66Å; R199-E267 VanDerWaalsContact CZ-OE1 3.29Å; R199-E267 IonicContact CZ-OE2 2.77Å; R199-E267 VanDerWaalsContact NH1-CD 3.27Å; R199-E267 IonicContact NH1-OE1 3.43Å; R199-E267 PolarHBondContact NH1-OE1 3.41Å; R199-E267 VanDerWaalsContact NH1-OE1 3.09Å; R199-E267 IonicContact NH1-OE2 3.66Å; R199-E267 PolarHBondContact NH1-OE2 3.11Å; R199-E267 IonicContact NH2-OE1 3.46Å; R199-E267 PolarHBondContact NH2-OE1 2.94Å; R199-E267 IonicContact NH2-OE2 2.74Å
200	F	98.6	Very high	95.8	Very high	1 Å²	1	40.3 Å²	40.3	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	122.1	-175	-54.7	-83.7	0	0	0	109.6	H195 I196 C217 L218 D219 V226 I228 F269	H195-F200 CarbonylContact C-O 3.52Å; H195-F200 WeakPolarHBondContact CA-O 3.39Å; I196-F200 HydrophobicContact CB-CB 4.23Å; I196-F200 HydrophobicContact CG2-CD2 4.42Å; I196-F200 PolarHBondContact N-O 3.33Å; I196-F200 PolarHBondContact O-N 2.88Å; F200-C217 HydrophobicContact CB-CB 3.99Å; F200-L218 CarbonylContact C-O 3.42Å; F200-L218 WeakPolarHBondContact CA-O 3.3Å; F200-D219 HydrophobicContact CD1-CB 3.75Å; F200-D219 HydrophobicContact CE1-CB 3.75Å; F200-D219 VanDerWaalsContact CE1-CG 3.47Å; F200-D219 WeakPolarHBondContact CE1-OD2 3.39Å; F200-V226 HydrophobicContact CD1-CG2 3.92Å; F200-V226 HydrophobicContact CE1-CG2 4.14Å; F200-I228 HydrophobicContact CB-CD1 3.58Å; F200-I228 HydrophobicContact CD1-CD1 3.69Å; F200-I228 HydrophobicContact CD2-CD1 3.84Å; F200-I228 HydrophobicContact CE1-CD1 4.27Å; F200-I228 HydrophobicContact CE2-CD1 4.42Å; F200-I228 HydrophobicContact CG-CD1 3.43Å; F200-I228 VanDerWaalsContact CG-CD1 3.43Å; F200-F269 HydrophobicContact CD2-CE1 4.23Å; F200-F269 AromaticContact CD2-CZ 3.8Å; F200-F269 HydrophobicContact CD2-CZ 3.8Å; F200-F269 HydrophobicContact CE2-CD1 4.42Å; F200-F269 AromaticContact CE2-CE1 3.47Å; F200-F269 HydrophobicContact CE2-CE1 3.47Å; F200-F269 VanDerWaalsContact CE2-CE1 3.47Å; F200-F269 HydrophobicContact CE2-CE2 4.47Å; F200-F269 AromaticContact CE2-CZ 3.5Å; F200-F269 HydrophobicContact CE2-CZ 3.5Å; F200-F269 HydrophobicContact CZ-CE1 4.03Å; F200-F269 HydrophobicContact CZ-CZ 4.42Å
201	E	98.4	Very high	95.4	Very high	30 Å²	30	36.6 Å²	36.6	14%	0.14	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	128.8	173.2	177.4	-175.3	167.2	0	0	109.8	F161 H193 L203 C217 L218 H220	F161-E201 HydrophobicContact CD1-CB 3.89Å; F161-E201 HydrophobicContact CE1-CB 3.54Å; F161-E201 HydrophobicContact CE1-CG 3.67Å; F161-E201 HydrophobicContact CE2-CB 4.28Å; F161-E201 HydrophobicContact CE2-CG 4.29Å; F161-E201 HydrophobicContact CG-CB 4.41Å; F161-E201 HydrophobicContact CZ-CB 3.75Å; F161-E201 HydrophobicContact CZ-CG 3.53Å; H193-E201 IonicContact CE1-OE1 3.26Å; H193-E201 IonicContact CG-OE1 3.7Å; H193-E201 IonicContact ND1-OE1 3.27Å; H193-E201 PolarHBondContact ND1-OE1 3.32Å; E201-L203 HydrophobicContact CG-CD2 3.97Å; E201-L203 WeakPolarHBondContact OE1-CD2 3.34Å; E201-C217 CarbonylContact O-C 3.57Å; E201-C217 WeakPolarHBondContact O-CA 3.49Å; E201-C217 WeakPolarHBondContact O-CB 3.25Å; E201-L218 HydrophobicContact CB-CB 4.36Å; E201-L218 PolarHBondContact N-O 3.01Å; E201-L218 PolarHBondContact O-N 2.97Å; E201-H220 WeakPolarHBondContact CB-NE2 3.48Å; E201-H220 IonicContact OE2-CE1 3.52Å; E201-H220 IonicContact OE2-NE2 3.5Å; E201-H220 PolarHBondContact OE2-NE2 3.05Å
202	V	98.4	Very high	95.2	Very high	2 Å²	2	36 Å²	36	1%	0.012	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	118.3	178.2	-179	0	0	0	0	111	V191 L192 H193 D194 I196 L215	V191-V202 WeakPolarHBondContact O-CB 3.19Å; L192-V202 HydrophobicContact CD2-CG1 4.13Å; H193-V202 PolarHBondContact N-O 2.91Å; D194-V202 PolarHBondContact O-N 3.05Å; I196-V202 HydrophobicContact CD1-CG2 3.62Å; I196-V202 HydrophobicContact CG1-CG2 3.88Å; V202-L215 HydrophobicContact CG1-CD1 4.14Å; V202-L215 HydrophobicContact CG1-CD2 4.38Å; V202-L215 HydrophobicContact CG2-CD1 4.16Å
203	L	98.2	Very high	95.1	Very high	46 Å²	46	32.5 Å²	32.5	24%	0.241	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-47.7	-176.2	-59.3	178	0	0	0	113.7	E201 K216 L218 L225	E201-L203 HydrophobicContact CG-CD2 3.97Å; E201-L203 WeakPolarHBondContact OE1-CD2 3.34Å; L203-K216 WeakPolarHBondContact CB-O 3.37Å; L203-K216 PolarHBondContact N-O 2.87Å; L203-L218 HydrophobicContact CD1-CB 4.14Å; L203-L225 HydrophobicContact CD1-CD2 3.52Å
204	E	97.3	Very high	95.1	Very high	85 Å²	85	30 Å²	30	40%	0.397	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	157.2	-179.7	69.3	-163.1	-151.7	0	0	110.5	I206 L215 K216	E204-I206 HydrophobicContact CG-CG2 3.7Å; E204-I206 WeakPolarHBondContact OE1-CG2 3.47Å; E204-L215 WeakPolarHBondContact O-CA 3.33Å; E204-K216 HydrophobicContact CG-CB 3.83Å; E204-K216 HydrophobicContact CG-CD 3.67Å; E204-K216 HydrophobicContact CG-CG 4.37Å; E204-K216 PolarHBondContact N-O 3.38Å; E204-K216 PolarHBondContact O-N 3.43Å; E204-K216 WeakPolarHBondContact OE1-CD 3.46Å; E204-K216 IonicContact OE1-NZ 3.52Å; E204-K216 PolarHBondContact OE1-NZ 3.34Å; E204-K216 IonicContact OE2-NZ 2.92Å; E204-K216 PolarHBondContact OE2-NZ 3.09Å
205	V	96.3	Very high	95.1	Very high	48 Å²	48	29.9 Å²	29.9	29%	0.291	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	115	170.7	-171.5	0	0	0	0	108.6	R190 G207 K208 L215	R190-V205 HydrophobicContact CG-CG2 4.05Å; V205-G207 WeakPolarHBondContact CG1-O 3.42Å; V205-K208 HydrophobicContact CG1-CD 4.37Å; V205-K208 HydrophobicContact CG1-CG 3.74Å; V205-L215 HydrophobicContact CB-CD2 4.29Å; V205-L215 HydrophobicContact CG1-CD2 4.24Å; V205-L215 HydrophobicContact CG2-CD2 3.77Å
206	I	94.6	Very high	95.1	Very high	76 Å²	76	31.7 Å²	31.7	39%	0.39	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-11.4	-179.2	62.2	173.1	0	0	0	113.5	E204 V214 K216 A227 L281	E204-I206 HydrophobicContact CG-CG2 3.7Å; E204-I206 WeakPolarHBondContact OE1-CG2 3.47Å; I206-V214 HydrophobicContact CD1-CG1 3.8Å; I206-V214 HydrophobicContact CG1-CB 3.99Å; I206-V214 HydrophobicContact CG1-CG1 3.7Å; I206-V214 WeakPolarHBondContact CG1-O 3.45Å; I206-V214 PolarHBondContact N-O 3.45Å; I206-K216 HydrophobicContact CD1-CB 4.29Å; I206-K216 HydrophobicContact CG2-CB 3.72Å; I206-A227 HydrophobicContact CD1-CB 3.85Å; I206-L281 HydrophobicContact CD1-CD1 3.89Å
207	G	92.1	Very high	95.1	Very high	25 Å²	25	31.7 Å²	31.7	26%	0.258	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	150	174.2	0	0	0	0	0	113	V205 Q213 V214	V205-G207 WeakPolarHBondContact CG1-O 3.42Å; G207-Q213 CarbonylContact O-C 3.52Å; G207-Q213 WeakPolarHBondContact O-CA 3.32Å; G207-V214 PolarHBondContact N-O 3.07Å; G207-V214 VanDerWaalsContact N-O 3.1Å; G207-V214 PolarHBondContact O-N 3.35Å
208	K	89.8	Confident	95.1	Very high	125 Å²	125	32.7 Å²	32.7	54%	0.543	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	145.1	172.3	-66.1	-173.8	179.1	-177.7	0	109.4	V205 Q213	V205-K208 HydrophobicContact CG1-CD 4.37Å; V205-K208 HydrophobicContact CG1-CG 3.74Å; K208-Q213 HydrophobicContact CG-CB 4.41Å
209	G	86.3	Confident	95.1	Very high	31 Å²	31	32.8 Å²	32.8	32%	0.32	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	-173.6	177.5	0	0	0	0	0	112.6	F211 G212	G209-F211 PolarHBondContact O-N 3.09Å; G209-G212 PolarHBondContact N-O 3.5Å; G209-G212 PolarHBondContact O-N 2.71Å; G209-G212 VanDerWaalsContact O-N 3.11Å; G209-G212 VanDerWaalsContact O-O 3.05Å
210	S	85.6	Confident	95.1	Very high	23 Å²	23	33.5 Å²	33.5	16%	0.161	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-35.1	179.1	50.5	0	0	0	0	113.3	G212 R232 F237	S210-G212 VanDerWaalsContact C-N 3.29Å; S210-G212 PolarHBondContact O-N 2.74Å; S210-R232 PolarHBondContact O-NH1 2.7Å; S210-F237 WeakPolarHBondContact O-CE1 3.31Å; S210-F237 WeakPolarHBondContact O-CZ 3.38Å
211	F	86.4	Confident	94.9	Very high	23 Å²	23	37.1 Å²	37.1	10%	0.101	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-16.8	178.9	-65.8	-85.3	0	0	0	114.9	G209 I231 R232 F237 Q240	G209-F211 PolarHBondContact O-N 3.09Å; F211-I231 WeakPolarHBondContact O-CA 3.48Å; F211-R232 WeakPolarHBondContact O-CB 3.27Å; F211-R232 PolarHBondContact O-N 3.37Å; F211-F237 HydrophobicContact CD1-CD1 4.02Å; F211-Q240 HydrophobicContact CE1-CG 4.12Å
212	G	93	Very high	94.8	Very high	10 Å²	10	38.3 Å²	38.3	10%	0.103	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	128	-138.2	-170.6	0	0	0	0	0	112	G209 S210	G209-G212 PolarHBondContact N-O 3.5Å; G209-G212 PolarHBondContact O-N 2.71Å; G209-G212 VanDerWaalsContact O-N 3.11Å; G209-G212 VanDerWaalsContact O-O 3.05Å; S210-G212 VanDerWaalsContact C-N 3.29Å; S210-G212 PolarHBondContact O-N 2.74Å
213	Q	95.8	Very high	94.7	Very high	14 Å²	14	44 Å²	44	7%	0.065	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	153.8	-175.1	66	-166	-22.9	0	0	112.5	Y188 G207 K208 L215 K229 M230	Y188-Q213 PolarHBondContact O-NE2 2.82Å; G207-Q213 CarbonylContact O-C 3.52Å; G207-Q213 WeakPolarHBondContact O-CA 3.32Å; K208-Q213 HydrophobicContact CG-CB 4.41Å; Q213-L215 HydrophobicContact CG-CD2 4.08Å; Q213-L215 HydrophobicContact CG-CG 4.23Å; Q213-K229 WeakPolarHBondContact O-CA 3.23Å; Q213-M230 HydrophobicContact CG-CB 4.25Å; Q213-M230 PolarHBondContact N-O 3.23Å; Q213-M230 PolarHBondContact O-N 3.44Å
214	V	97.6	Very high	94.6	Very high	41 Å²	41	46 Å²	46	25%	0.248	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	120.6	170.8	-168.7	0	0	0	0	107.9	I206 G207 A227 I228 K229	I206-V214 HydrophobicContact CD1-CG1 3.8Å; I206-V214 HydrophobicContact CG1-CB 3.99Å; I206-V214 HydrophobicContact CG1-CG1 3.7Å; I206-V214 WeakPolarHBondContact CG1-O 3.45Å; I206-V214 PolarHBondContact N-O 3.45Å; G207-V214 PolarHBondContact N-O 3.07Å; G207-V214 VanDerWaalsContact N-O 3.1Å; G207-V214 PolarHBondContact O-N 3.35Å; V214-A227 HydrophobicContact CG1-CB 4.1Å; V214-I228 WeakPolarHBondContact CA-O 3.31Å; V214-K229 HydrophobicContact CG2-CB 4.33Å; V214-K229 HydrophobicContact CG2-CG 4.2Å
215	L	98.3	Very high	94.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	140.2	179.5	-54.5	176	0	0	0	108.4	R190 I196 V202 E204 V205 Q213 A227 I228 M230	R190-L215 HydrophobicContact CB-CD1 4.32Å; R190-L215 HydrophobicContact CB-CD2 4.28Å; R190-L215 HydrophobicContact CG-CD2 4.14Å; I196-L215 HydrophobicContact CD1-CD1 3.68Å; V202-L215 HydrophobicContact CG1-CD1 4.14Å; V202-L215 HydrophobicContact CG1-CD2 4.38Å; V202-L215 HydrophobicContact CG2-CD1 4.16Å; E204-L215 WeakPolarHBondContact O-CA 3.33Å; V205-L215 HydrophobicContact CB-CD2 4.29Å; V205-L215 HydrophobicContact CG1-CD2 4.24Å; V205-L215 HydrophobicContact CG2-CD2 3.77Å; Q213-L215 HydrophobicContact CG-CD2 4.08Å; Q213-L215 HydrophobicContact CG-CG 4.23Å; L215-A227 CarbonylContact O-C 3.47Å; L215-A227 WeakPolarHBondContact O-CA 3.39Å; L215-I228 PolarHBondContact N-O 3.45Å; L215-I228 PolarHBondContact O-N 2.93Å; L215-M230 HydrophobicContact CD1-CG 4.34Å; L215-M230 HydrophobicContact CD1-SD 3.8Å
216	K	98.4	Very high	94.7	Very high	39 Å²	39	43.6 Å²	43.6	17%	0.17	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	130.8	161.3	164.8	-163.6	179.5	-169.4	0	107.5	L203 E204 I206 V226 L281	L203-K216 WeakPolarHBondContact CB-O 3.37Å; L203-K216 PolarHBondContact N-O 2.87Å; E204-K216 HydrophobicContact CG-CB 3.83Å; E204-K216 HydrophobicContact CG-CD 3.67Å; E204-K216 HydrophobicContact CG-CG 4.37Å; E204-K216 PolarHBondContact N-O 3.38Å; E204-K216 PolarHBondContact O-N 3.43Å; E204-K216 WeakPolarHBondContact OE1-CD 3.46Å; E204-K216 IonicContact OE1-NZ 3.52Å; E204-K216 PolarHBondContact OE1-NZ 3.34Å; E204-K216 IonicContact OE2-NZ 2.92Å; E204-K216 PolarHBondContact OE2-NZ 3.09Å; I206-K216 HydrophobicContact CD1-CB 4.29Å; I206-K216 HydrophobicContact CG2-CB 3.72Å; K216-V226 WeakPolarHBondContact CA-O 3.39Å; K216-L281 HydrophobicContact CB-CD1 4.17Å; K216-L281 HydrophobicContact CD-CD1 4.48Å; K216-L281 HydrophobicContact CD-CD2 3.98Å; K216-L281 HydrophobicContact CG-CD1 4.08Å; K216-L281 HydrophobicContact CG-CD2 3.92Å
217	C	98.6	Very high	94.9	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	154.1	-176.7	-61.9	0	0	0	0	111.2	F200 E201 L225 V226 I228	F200-C217 HydrophobicContact CB-CB 3.99Å; E201-C217 CarbonylContact O-C 3.57Å; E201-C217 WeakPolarHBondContact O-CA 3.49Å; E201-C217 WeakPolarHBondContact O-CB 3.25Å; C217-L225 WeakPolarHBondContact O-CA 3.44Å; C217-V226 HydrophobicContact CB-CG2 4.08Å; C217-V226 PolarHBondContact N-O 3.45Å; C217-V226 PolarHBondContact O-N 2.78Å; C217-I228 HydrophobicContact CB-CD1 3.92Å; C217-I228 HydrophobicContact CB-CG1 4.32Å
218	L	98.3	Very high	95.2	Very high	35 Å²	35	39.2 Å²	39.2	18%	0.183	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	120.9	162	177.6	60.4	0	0	0	108.7	F200 E201 L203 H220 L225	F200-L218 CarbonylContact C-O 3.42Å; F200-L218 WeakPolarHBondContact CA-O 3.3Å; E201-L218 HydrophobicContact CB-CB 4.36Å; E201-L218 PolarHBondContact N-O 3.01Å; E201-L218 PolarHBondContact O-N 2.97Å; L203-L218 HydrophobicContact CD1-CB 4.14Å; L218-H220 PolarHBondContact O-N 2.88Å; L218-L225 HydrophobicContact CB-CD2 4.29Å; L218-L225 HydrophobicContact CD1-CD2 4.34Å
219	D	98.2	Very high	95.6	Very high	2 Å²	2	34 Å²	34	1%	0.011	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	103	170.6	-177.7	-11.5	0	0	0	109.3	R199 F200 K221 S222 N223 E224 V226	R199-D219 IonicContact CZ-OD1 3.29Å; R199-D219 IonicContact CZ-OD2 2.82Å; R199-D219 IonicContact NE-OD1 3.86Å; R199-D219 PolarHBondContact NE-OD1 3.27Å; R199-D219 IonicContact NE-OD2 3.7Å; R199-D219 IonicContact NH2-OD1 2.76Å; R199-D219 PolarHBondContact NH2-OD1 3.46Å; R199-D219 IonicContact NH2-OD2 3.01Å; R199-D219 PolarHBondContact NH2-OD2 3.43Å; F200-D219 HydrophobicContact CD1-CB 3.75Å; F200-D219 HydrophobicContact CE1-CB 3.75Å; F200-D219 VanDerWaalsContact CE1-CG 3.47Å; F200-D219 WeakPolarHBondContact CE1-OD2 3.39Å; D219-K221 PolarHBondContact O-N 3.05Å; D219-K221 VanDerWaalsContact OD1-CB 3.3Å; D219-K221 WeakPolarHBondContact OD1-CB 3.43Å; D219-K221 PolarHBondContact OD1-N 2.87Å; D219-S222 PolarHBondContact O-N 2.89Å; D219-S222 PolarHBondContact OD1-N 2.82Å; D219-S222 PolarHBondContact OD2-OG 2.8Å; D219-N223 WeakPolarHBondContact O-CA 3.38Å; D219-N223 PolarHBondContact O-N 3.4Å; D219-E224 WeakPolarHBondContact CB-O 3.37Å; D219-E224 PolarHBondContact N-O 2.96Å; D219-E224 PolarHBondContact O-N 3.09Å; D219-V226 HydrophobicContact CB-CG1 4.31Å; D219-V226 HydrophobicContact CB-CG2 4.28Å
220	H	96.7	Very high	96.1	Very high	47 Å²	47	32.6 Å²	32.6	22%	0.218	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-13.4	-178.5	-76.6	-98	0	0	0	113.5	W160 F161 R199 E201 L218	W160-H220 HydrophobicContact CB-CB 4.14Å; F161-H220 HydrophobicContact CB-CB 4.1Å; F161-H220 AromaticContact CD2-CD2 3.67Å; F161-H220 AromaticContact CD2-CE1 3.49Å; F161-H220 VanDerWaalsContact CD2-CE1 3.49Å; F161-H220 WeakPolarHBondContact CD2-CE1 3.22Å; F161-H220 AromaticContact CD2-ND1 3.93Å; F161-H220 AromaticContact CD2-NE2 3.31Å; F161-H220 VanDerWaalsContact CD2-NE2 3.31Å; F161-H220 WeakPolarHBondContact CD2-NE2 3.28Å; F161-H220 AromaticContact CE2-CE1 3.88Å; F161-H220 AromaticContact CE2-NE2 3.64Å; F161-H220 AromaticContact CG-CD2 3.65Å; F161-H220 AromaticContact CG-NE2 3.74Å; R199-H220 WeakPolarHBondContact O-CB 3.18Å; R199-H220 PolarHBondContact O-N 3.09Å; E201-H220 WeakPolarHBondContact CB-NE2 3.48Å; E201-H220 IonicContact OE2-CE1 3.52Å; E201-H220 IonicContact OE2-NE2 3.5Å; E201-H220 PolarHBondContact OE2-NE2 3.05Å; L218-H220 PolarHBondContact O-N 2.88Å
221	K	95.9	Very high	96.7	Very high	78 Å²	78	31.6 Å²	31.6	34%	0.339	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-43.2	174.2	-178.6	167.9	-171.3	161.8	0	112.4	E158 W160 R199 D219	E158-K221 IonicContact OE1-NZ 3.8Å; E158-K221 PolarHBondContact OE1-NZ 3.49Å; E158-K221 IonicContact OE2-NZ 3.48Å; E158-K221 PolarHBondContact OE2-NZ 2.81Å; W160-K221 HydrophobicContact CD2-CB 3.77Å; W160-K221 HydrophobicContact CD2-CG 4.08Å; W160-K221 HydrophobicContact CE3-CB 4.16Å; W160-K221 HydrophobicContact CE3-CG 4.47Å; W160-K221 HydrophobicContact CG-CB 4.11Å; W160-K221 HydrophobicContact CH2-CG 4.04Å; W160-K221 HydrophobicContact CZ2-CB 4.25Å; W160-K221 HydrophobicContact CZ2-CD 3.87Å; W160-K221 HydrophobicContact CZ2-CG 3.61Å; W160-K221 HydrophobicContact CZ3-CG 4.45Å; R199-K221 HydrophobicContact CG-CB 4.13Å; D219-K221 PolarHBondContact O-N 3.05Å; D219-K221 VanDerWaalsContact OD1-CB 3.3Å; D219-K221 WeakPolarHBondContact OD1-CB 3.43Å; D219-K221 PolarHBondContact OD1-N 2.87Å
222	S	95.9	Very high	97.2	Very high	54 Å²	54	32.6 Å²	32.6	38%	0.378	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-12.9	179.7	71.7	0	0	0	0	114.1	D219 E224	D219-S222 PolarHBondContact O-N 2.89Å; D219-S222 PolarHBondContact OD1-N 2.82Å; D219-S222 PolarHBondContact OD2-OG 2.8Å; S222-E224 VanDerWaalsContact C-N 3.33Å; S222-E224 WeakPolarHBondContact OG-CB 3.48Å; S222-E224 PolarHBondContact OG-N 3.45Å
223	N	95.4	Very high	97.4	Very high	123 Å²	123	34.9 Å²	34.9	66%	0.658	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	46.1	-166.4	-163	23.4	0	0	0	112.6	D219	D219-N223 WeakPolarHBondContact O-CA 3.38Å; D219-N223 PolarHBondContact O-N 3.4Å
224	E	96.3	Very high	97.4	Very high	88 Å²	88	38.9 Å²	38.9	41%	0.411	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.9	177.6	-62.8	-168.6	137.8	0	0	111.5	D219 S222 K266	D219-E224 WeakPolarHBondContact CB-O 3.37Å; D219-E224 PolarHBondContact N-O 2.96Å; D219-E224 PolarHBondContact O-N 3.09Å; S222-E224 VanDerWaalsContact C-N 3.33Å; S222-E224 WeakPolarHBondContact OG-CB 3.48Å; S222-E224 PolarHBondContact OG-N 3.45Å; E224-K266 IonicContact OE2-NZ 2.96Å; E224-K266 PolarHBondContact OE2-NZ 2.86Å
225	L	97.8	Very high	97.2	Very high	82 Å²	82	46.3 Å²	46.3	43%	0.429	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	132.1	168.3	-66.2	174.2	0	0	0	110.4	L203 C217 L218 L281	L203-L225 HydrophobicContact CD1-CD2 3.52Å; C217-L225 WeakPolarHBondContact O-CA 3.44Å; L218-L225 HydrophobicContact CB-CD2 4.29Å; L218-L225 HydrophobicContact CD1-CD2 4.34Å; L225-L281 HydrophobicContact CB-CD2 3.79Å; L225-L281 HydrophobicContact CD1-CD2 4.29Å
226	V	98.1	Very high	96.9	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	160	-178.3	-65.4	0	0	0	0	111	F200 K216 C217 D219 I228 K266 F279	F200-V226 HydrophobicContact CD1-CG2 3.92Å; F200-V226 HydrophobicContact CE1-CG2 4.14Å; K216-V226 WeakPolarHBondContact CA-O 3.39Å; C217-V226 HydrophobicContact CB-CG2 4.08Å; C217-V226 PolarHBondContact N-O 3.45Å; C217-V226 PolarHBondContact O-N 2.78Å; D219-V226 HydrophobicContact CB-CG1 4.31Å; D219-V226 HydrophobicContact CB-CG2 4.28Å; V226-I228 HydrophobicContact CG2-CD1 4.36Å; V226-I228 HydrophobicContact CG2-CG1 4.12Å; V226-K266 HydrophobicContact CG1-CD 3.89Å; V226-F279 WeakPolarHBondContact CB-O 3.39Å
227	A	98.4	Very high	96.7	Very high	9 Å²	9	52.3 Å²	52.3	7%	0.074	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	128.3	166.8	0	0	0	0	0	109.4	I206 V214 L215 S278 F279 L281	I206-A227 HydrophobicContact CD1-CB 3.85Å; V214-A227 HydrophobicContact CG1-CB 4.1Å; L215-A227 CarbonylContact O-C 3.47Å; L215-A227 WeakPolarHBondContact O-CA 3.39Å; A227-S278 CarbonylContact O-C 3.55Å; A227-S278 WeakPolarHBondContact O-CA 3.14Å; A227-F279 HydrophobicContact CB-CB 4.41Å; A227-F279 PolarHBondContact N-O 2.92Å; A227-F279 VanDerWaalsContact N-O 3.11Å; A227-F279 PolarHBondContact O-N 2.92Å; A227-L281 HydrophobicContact CB-CD1 4.2Å
228	I	98.5	Very high	96.5	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	113.5	177.2	-56.9	-175.4	0	0	0	109	F200 V214 L215 C217 V226 M230 C276 I277	F200-I228 HydrophobicContact CB-CD1 3.58Å; F200-I228 HydrophobicContact CD1-CD1 3.69Å; F200-I228 HydrophobicContact CD2-CD1 3.84Å; F200-I228 HydrophobicContact CE1-CD1 4.27Å; F200-I228 HydrophobicContact CE2-CD1 4.42Å; F200-I228 HydrophobicContact CG-CD1 3.43Å; F200-I228 VanDerWaalsContact CG-CD1 3.43Å; V214-I228 WeakPolarHBondContact CA-O 3.31Å; L215-I228 PolarHBondContact N-O 3.45Å; L215-I228 PolarHBondContact O-N 2.93Å; C217-I228 HydrophobicContact CB-CD1 3.92Å; C217-I228 HydrophobicContact CB-CG1 4.32Å; V226-I228 HydrophobicContact CG2-CD1 4.36Å; V226-I228 HydrophobicContact CG2-CG1 4.12Å; I228-M230 HydrophobicContact CG2-CG 4.28Å; I228-M230 PolarHBondContact O-N 3.04Å; I228-C276 HydrophobicContact CG2-CB 4.15Å; I228-I277 WeakPolarHBondContact CA-O 3.41Å
229	K	98.1	Very high	96.2	Very high	14 Å²	14	60 Å²	60	6%	0.061	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	107	170.1	-171.3	179.7	-168.9	-178	0	107.9	Q213 V214 I231 E244 C276 I277 F279 D346	Q213-K229 WeakPolarHBondContact O-CA 3.23Å; V214-K229 HydrophobicContact CG2-CB 4.33Å; V214-K229 HydrophobicContact CG2-CG 4.2Å; K229-I231 HydrophobicContact CD-CD1 4.02Å; K229-I231 HydrophobicContact CG-CD1 3.95Å; K229-E244 IonicContact NZ-OE1 2.67Å; K229-E244 PolarHBondContact NZ-OE1 3.49Å; K229-E244 IonicContact NZ-OE2 2.99Å; K229-E244 PolarHBondContact NZ-OE2 3.18Å; K229-C276 WeakPolarHBondContact O-CA 3.29Å; K229-I277 HydrophobicContact CB-CB 4.5Å; K229-I277 PolarHBondContact N-O 2.8Å; K229-I277 PolarHBondContact O-N 3.04Å; K229-F279 HydrophobicContact CB-CE2 3.91Å; K229-F279 HydrophobicContact CD-CE2 4.43Å; K229-D346 IonicContact NZ-OD1 2.71Å; K229-D346 PolarHBondContact NZ-OD1 2.76Å
230	M	97.9	Very high	95.9	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	115.1	170.1	-70.9	-168.8	75.5	0	0	109.2	Y188 I196 Q213 L215 I228 F271 H274	Y188-M230 HydrophobicContact CD1-CE 3.64Å; Y188-M230 HydrophobicContact CD1-SD 3.73Å; Y188-M230 HydrophobicContact CD2-CE 3.91Å; Y188-M230 HydrophobicContact CE1-CE 4.3Å; Y188-M230 HydrophobicContact CE1-SD 4.44Å; Y188-M230 HydrophobicContact CG-CE 3.42Å; Y188-M230 VanDerWaalsContact CG-CE 3.42Å; Y188-M230 HydrophobicContact CG-SD 4.06Å; I196-M230 HydrophobicContact CD1-SD 3.8Å; Q213-M230 HydrophobicContact CG-CB 4.25Å; Q213-M230 PolarHBondContact N-O 3.23Å; Q213-M230 PolarHBondContact O-N 3.44Å; L215-M230 HydrophobicContact CD1-CG 4.34Å; L215-M230 HydrophobicContact CD1-SD 3.8Å; I228-M230 HydrophobicContact CG2-CG 4.28Å; I228-M230 PolarHBondContact O-N 3.04Å; M230-F271 HydrophobicContact CE-CD1 4.28Å; M230-H274 HydrophobicContact CE-CB 3.75Å
231	I	98	Very high	95.8	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	133	179.9	-55.4	-62.8	0	0	0	109.8	F211 K229 N233 F237 A241 H274 L275	F211-I231 WeakPolarHBondContact O-CA 3.48Å; K229-I231 HydrophobicContact CD-CD1 4.02Å; K229-I231 HydrophobicContact CG-CD1 3.95Å; I231-N233 PolarHBondContact O-N 2.91Å; I231-F237 HydrophobicContact CG2-CB 3.96Å; I231-A241 HydrophobicContact CB-CB 4.38Å; I231-A241 HydrophobicContact CD1-CB 3.81Å; I231-A241 HydrophobicContact CG1-CB 3.68Å; I231-A241 HydrophobicContact CG2-CB 3.92Å; I231-H274 PolarHBondContact O-ND1 2.88Å; I231-L275 HydrophobicContact CB-CB 4.19Å; I231-L275 WeakPolarHBondContact CB-O 3.19Å; I231-L275 HydrophobicContact CG1-CB 4.23Å; I231-L275 HydrophobicContact CG1-CG 4.35Å; I231-L275 WeakPolarHBondContact CG1-O 3.39Å; I231-L275 PolarHBondContact N-O 3.37Å
232	R	96.9	Very high	95.8	Very high	45 Å²	45	57.8 Å²	57.8	17%	0.17	27%	0.274	C	S	.	.			trans	-55.9	133.5	176.6	-177.3	174.4	-94.3	177	-11.8	111.4	H185 G186 S187 S210 F211 K234 F237	H185-R232 WeakPolarHBondContact O-CD 3.26Å; H185-R232 WeakPolarHBondContact O-CG 3.49Å; H185-R232 PolarHBondContact O-NE 2.98Å; G186-R232 CarbonylContact O-C 3.59Å; G186-R232 VanDerWaalsContact O-CG 3.28Å; G186-R232 WeakPolarHBondContact O-CG 3.09Å; S187-R232 PolarHBondContact OG-NE 2.95Å; S187-R232 PolarHBondContact OG-NH2 2.72Å; S210-R232 PolarHBondContact O-NH1 2.7Å; F211-R232 WeakPolarHBondContact O-CB 3.27Å; F211-R232 PolarHBondContact O-N 3.37Å; R232-K234 HydrophobicContact CG-CG 4.2Å; R232-K234 PolarHBondContact O-N 3.34Å; R232-F237 HydrophobicContact CB-CB 4.49Å; R232-F237 HydrophobicContact CB-CD2 3.9Å; R232-F237 HydrophobicContact CB-CG 4.38Å; R232-F237 HydrophobicContact CG-CD2 3.99Å; R232-F237 HydrophobicContact CG-CE2 4.35Å
233	N	96.6	Very high	95.7	Very high	57 Å²	57	57.1 Å²	57.1	31%	0.305	27%	0.268	S	S	.	.	S	Bend	trans	-74.2	67.3	-177.8	-175.8	13.8	0	0	0	111.7	D182 G186 I231	D182-N233 VanDerWaalsContact OD2-CB 3.3Å; D182-N233 WeakPolarHBondContact OD2-CB 3.25Å; D182-N233 PolarHBondContact OD2-ND2 2.78Å; G186-N233 WeakPolarHBondContact O-CB 3.49Å; G186-N233 PolarHBondContact O-N 3.37Å; I231-N233 PolarHBondContact O-N 2.91Å
234	K	95.6	Very high	95.7	Very high	98 Å²	98	51.4 Å²	51.4	43%	0.426	24%	0.238	S	C	.	.	S	Bend	trans	-140.1	139	169.7	-54.4	-73.1	179.6	-173.4	0	108.8	H185 R232 R236 F237 H238	H185-K234 VanDerWaalsContact C-CE 3.41Å; H185-K234 WeakPolarHBondContact O-CE 3.26Å; R232-K234 HydrophobicContact CG-CG 4.2Å; R232-K234 PolarHBondContact O-N 3.34Å; K234-R236 PolarHBondContact O-N 2.8Å; K234-F237 HydrophobicContact CB-CD2 4.05Å; K234-F237 HydrophobicContact CG-CD2 4.43Å; K234-F237 PolarHBondContact O-N 2.95Å; K234-H238 PolarHBondContact O-N 2.88Å; K234-H238 VanDerWaalsContact O-N 3.08Å
235	K	93.9	Very high	95.7	Very high	197 Å²	197	47.7 Å²	47.7	86%	0.857	22%	0.22	S	C	*	.	H	α-helix	trans	-48.1	-39.8	-175.4	-67.3	-179.3	178.2	179.2	0	114.1	H239	K235-H239 WeakPolarHBondContact O-CB 3.3Å; K235-H239 PolarHBondContact O-N 2.86Å
236	R	91.4	Very high	95.7	Very high	130 Å²	130	49.9 Å²	49.9	49%	0.491	23%	0.226	S	C	.	.	H	α-helix	trans	-61.4	-52.7	177.7	-179.8	178.9	173.3	170	1.4	112.8	K234 H239 Q240	K234-R236 PolarHBondContact O-N 2.8Å; R236-H239 PolarHBondContact O-N 3.35Å; R236-Q240 WeakPolarHBondContact O-CB 3.3Å; R236-Q240 PolarHBondContact O-N 3.06Å; R236-Q240 VanDerWaalsContact O-N 3.09Å
237	F	93.9	Very high	95.6	Very high	36 Å²	36	49.9 Å²	49.9	16%	0.158	23%	0.226	C	C	.	.	H	α-helix	trans	-68.3	-37.2	-178.8	-63.7	-61.1	0	0	0	111.5	S210 F211 I231 R232 K234 Q240 A241	S210-F237 WeakPolarHBondContact O-CE1 3.31Å; S210-F237 WeakPolarHBondContact O-CZ 3.38Å; F211-F237 HydrophobicContact CD1-CD1 4.02Å; I231-F237 HydrophobicContact CG2-CB 3.96Å; R232-F237 HydrophobicContact CB-CB 4.49Å; R232-F237 HydrophobicContact CB-CD2 3.9Å; R232-F237 HydrophobicContact CB-CG 4.38Å; R232-F237 HydrophobicContact CG-CD2 3.99Å; R232-F237 HydrophobicContact CG-CE2 4.35Å; K234-F237 HydrophobicContact CB-CD2 4.05Å; K234-F237 HydrophobicContact CG-CD2 4.43Å; K234-F237 PolarHBondContact O-N 2.95Å; F237-Q240 PolarHBondContact O-N 2.68Å; F237-A241 WeakPolarHBondContact O-CB 3.43Å; F237-A241 PolarHBondContact O-N 2.71Å
238	H	95.1	Very high	95.5	Very high	68 Å²	68	49.6 Å²	49.6	32%	0.315	22%	0.223	S	C	.	.	H	α-helix	trans	-58.8	-51.7	172.6	177.1	99.8	0	0	0	111.9	K234 Q240 A241 L242 Y270	K234-H238 PolarHBondContact O-N 2.88Å; K234-H238 VanDerWaalsContact O-N 3.08Å; H238-Q240 VanDerWaalsContact C-N 3.3Å; H238-Q240 PolarHBondContact O-N 3.37Å; H238-A241 PolarHBondContact O-N 2.95Å; H238-L242 WeakPolarHBondContact O-CG 3.45Å; H238-L242 PolarHBondContact O-N 2.86Å; H238-Y270 AromaticContact CE1-CE1 3.68Å; H238-Y270 AromaticContact CE1-CZ 3.83Å; H238-Y270 PolarHBondContact CE1-OH 2.87Å
239	H	92.3	Very high	95.4	Very high	127 Å²	127	54.1 Å²	54.1	59%	0.588	25%	0.245	S	C	*	.	H	α-helix	trans	-59.2	-41.4	178.3	-176.1	81.6	0	0	0	112.3	K235 R236 L242 V243	K235-H239 WeakPolarHBondContact O-CB 3.3Å; K235-H239 PolarHBondContact O-N 2.86Å; R236-H239 PolarHBondContact O-N 3.35Å; H239-L242 PolarHBondContact O-N 2.79Å; H239-V243 PolarHBondContact O-N 3.1Å
240	Q	91.4	Very high	95.2	Very high	20 Å²	20	55.3 Å²	55.3	9%	0.093	25%	0.253	C	S	.	.	H	α-helix	trans	-66.5	-39.1	177.4	-171.7	165.2	4.1	0	0	112.3	F211 R236 F237 H238 L242 V243 E244 G348	F211-Q240 HydrophobicContact CE1-CG 4.12Å; R236-Q240 WeakPolarHBondContact O-CB 3.3Å; R236-Q240 PolarHBondContact O-N 3.06Å; R236-Q240 VanDerWaalsContact O-N 3.09Å; F237-Q240 PolarHBondContact O-N 2.68Å; H238-Q240 VanDerWaalsContact C-N 3.3Å; H238-Q240 PolarHBondContact O-N 3.37Å; Q240-L242 VanDerWaalsContact C-N 3.32Å; Q240-L242 PolarHBondContact O-N 3.45Å; Q240-V243 WeakPolarHBondContact O-CB 3.2Å; Q240-V243 PolarHBondContact O-N 3.38Å; Q240-V243 VanDerWaalsContact O-N 3.07Å; Q240-E244 PolarHBondContact O-N 3.1Å; Q240-G348 WeakPolarHBondContact CG-O 3.4Å; Q240-G348 PolarHBondContact NE2-O 2.88Å
241	A	95.3	Very high	95	Very high	3 Å²	3	55.4 Å²	55.4	3%	0.025	25%	0.253	C	S	.	.	H	α-helix	trans	-66.6	-29.7	174.3	0	0	0	0	0	113.3	I231 F237 H238 V243 E244 L245 L275	I231-A241 HydrophobicContact CB-CB 4.38Å; I231-A241 HydrophobicContact CD1-CB 3.81Å; I231-A241 HydrophobicContact CG1-CB 3.68Å; I231-A241 HydrophobicContact CG2-CB 3.92Å; F237-A241 WeakPolarHBondContact O-CB 3.43Å; F237-A241 PolarHBondContact O-N 2.71Å; H238-A241 PolarHBondContact O-N 2.95Å; A241-V243 VanDerWaalsContact C-N 3.27Å; A241-V243 PolarHBondContact O-N 3.29Å; A241-E244 PolarHBondContact O-N 2.93Å; A241-L245 WeakPolarHBondContact O-CG 3.3Å; A241-L245 PolarHBondContact O-N 3.49Å; A241-L275 HydrophobicContact CB-CD2 3.79Å
242	L	95.6	Very high	94.8	Very high	58 Å²	58	59.5 Å²	59.5	30%	0.304	27%	0.271	S	S	.	.	H	α-helix	trans	-67.6	-26.2	170.5	-64.7	178.8	0	0	0	112.8	H238 H239 Q240 L245 K246 L275	H238-L242 WeakPolarHBondContact O-CG 3.45Å; H238-L242 PolarHBondContact O-N 2.86Å; H239-L242 PolarHBondContact O-N 2.79Å; Q240-L242 VanDerWaalsContact C-N 3.32Å; Q240-L242 PolarHBondContact O-N 3.45Å; L242-L245 HydrophobicContact CD2-CD1 4.28Å; L242-K246 WeakPolarHBondContact O-CD 3.29Å; L242-K246 VanDerWaalsContact O-CG 3.32Å; L242-K246 WeakPolarHBondContact O-CG 3.44Å; L242-K246 PolarHBondContact O-N 2.97Å; L242-L275 HydrophobicContact CD2-CD2 4.17Å
243	V	93.7	Very high	94.6	Very high	41 Å²	41	64.7 Å²	64.7	25%	0.248	30%	0.295	C	S	.	.	H	α-helix	trans	-74.7	-44.4	170.7	180	0	0	0	0	110.2	H239 Q240 A241 L245 K246 I247	H239-V243 PolarHBondContact O-N 3.1Å; Q240-V243 WeakPolarHBondContact O-CB 3.2Å; Q240-V243 PolarHBondContact O-N 3.38Å; Q240-V243 VanDerWaalsContact O-N 3.07Å; A241-V243 VanDerWaalsContact C-N 3.27Å; A241-V243 PolarHBondContact O-N 3.29Å; V243-L245 PolarHBondContact O-N 3.01Å; V243-K246 PolarHBondContact O-N 2.88Å; V243-I247 HydrophobicContact CG1-CD1 4.01Å; V243-I247 WeakPolarHBondContact O-CG1 3.41Å; V243-I247 PolarHBondContact O-N 2.87Å
244	E	95.5	Very high	94.4	Very high	3 Å²	3	66.8 Å²	66.8	1%	0.014	30%	0.302	C	S	.	.	H	α-helix	trans	-55.4	-46.9	173.8	179.1	172.5	-163.3	0	0	111.7	K229 Q240 A241 K246 I247 L248 F347 G348	K229-E244 IonicContact NZ-OE1 2.67Å; K229-E244 PolarHBondContact NZ-OE1 3.49Å; K229-E244 IonicContact NZ-OE2 2.99Å; K229-E244 PolarHBondContact NZ-OE2 3.18Å; Q240-E244 PolarHBondContact O-N 3.1Å; A241-E244 PolarHBondContact O-N 2.93Å; E244-K246 PolarHBondContact O-N 2.85Å; E244-I247 PolarHBondContact O-N 2.86Å; E244-L248 HydrophobicContact CG-CD1 3.72Å; E244-L248 HydrophobicContact CG-CG 4.26Å; E244-L248 WeakPolarHBondContact O-CB 3.47Å; E244-L248 VanDerWaalsContact O-CG 3.29Å; E244-L248 WeakPolarHBondContact O-CG 3.21Å; E244-L248 PolarHBondContact O-N 2.81Å; E244-F347 HydrophobicContact CG-CB 4.02Å; E244-F347 PolarHBondContact OE1-N 3.07Å; E244-G348 VanDerWaalsContact CD-N 3.31Å; E244-G348 PolarHBondContact OE1-N 3.22Å; E244-G348 VanDerWaalsContact OE2-CA 3.3Å; E244-G348 WeakPolarHBondContact OE2-CA 3.3Å
245	L	96.5	Very high	94.3	Very high	9 Å²	9	62.1 Å²	62.1	5%	0.047	28%	0.281	C	S	.	.	H	α-helix	trans	-56.8	-49.1	176.2	-77.7	179.1	0	0	0	112.7	A241 L242 V243 I247 L248 E249 M265 H268 L275 I277	A241-L245 WeakPolarHBondContact O-CG 3.3Å; A241-L245 PolarHBondContact O-N 3.49Å; L242-L245 HydrophobicContact CD2-CD1 4.28Å; V243-L245 PolarHBondContact O-N 3.01Å; L245-I247 VanDerWaalsContact C-N 3.26Å; L245-I247 PolarHBondContact O-N 3.47Å; L245-L248 PolarHBondContact O-N 3.25Å; L245-E249 WeakPolarHBondContact O-CG 3.46Å; L245-E249 PolarHBondContact O-N 2.76Å; L245-M265 HydrophobicContact CD2-CE 4.37Å; L245-M265 HydrophobicContact CD2-SD 3.37Å; L245-M265 WeakPolarHBondContact CD2-SD 3.19Å; L245-H268 HydrophobicContact CD1-CB 4.32Å; L245-H268 HydrophobicContact CD2-CB 3.72Å; L245-L275 HydrophobicContact CD1-CD1 4.19Å; L245-L275 HydrophobicContact CD1-CD2 3.88Å; L245-I277 HydrophobicContact CD2-CD1 3.68Å; L245-I277 HydrophobicContact CD2-CG1 3.89Å; L245-I277 HydrophobicContact CD2-CG2 3.99Å; L245-I277 HydrophobicContact CG-CD1 3.94Å; L245-I277 HydrophobicContact CG-CG1 4.47Å
246	K	96.1	Very high	94	Very high	129 Å²	129	61.3 Å²	61.3	56%	0.561	28%	0.278	S	S	*	.	H	α-helix	trans	-60.4	-37	178.5	-71	169.9	-175.9	178.8	0	112.2	L242 V243 E244 V250	L242-K246 WeakPolarHBondContact O-CD 3.29Å; L242-K246 VanDerWaalsContact O-CG 3.32Å; L242-K246 WeakPolarHBondContact O-CG 3.44Å; L242-K246 PolarHBondContact O-N 2.97Å; V243-K246 PolarHBondContact O-N 2.88Å; E244-K246 PolarHBondContact O-N 2.85Å; K246-V250 WeakPolarHBondContact O-CG2 3.33Å; K246-V250 PolarHBondContact O-N 3.33Å
247	I	96.7	Very high	93.8	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-68.2	-47.3	175.7	-74.6	172.6	0	0	0	110.5	V243 E244 L245 E249 V250 I251 I322 F347 Y352	V243-I247 HydrophobicContact CG1-CD1 4.01Å; V243-I247 WeakPolarHBondContact O-CG1 3.41Å; V243-I247 PolarHBondContact O-N 2.87Å; E244-I247 PolarHBondContact O-N 2.86Å; L245-I247 VanDerWaalsContact C-N 3.26Å; L245-I247 PolarHBondContact O-N 3.47Å; I247-E249 VanDerWaalsContact C-N 3.34Å; I247-E249 PolarHBondContact O-N 3.5Å; I247-V250 PolarHBondContact O-N 3.43Å; I247-I251 HydrophobicContact CG2-CD1 3.62Å; I247-I251 HydrophobicContact CG2-CG1 4.48Å; I247-I251 VanDerWaalsContact O-CG1 3.3Å; I247-I251 WeakPolarHBondContact O-CG1 3.43Å; I247-I251 PolarHBondContact O-N 2.8Å; I247-I322 HydrophobicContact CD1-CG2 4.43Å; I247-I322 HydrophobicContact CG2-CD1 4.2Å; I247-I322 HydrophobicContact CG2-CG2 4.13Å; I247-F347 HydrophobicContact CG2-CB 4.24Å; I247-F347 HydrophobicContact CG2-CD1 3.72Å; I247-F347 HydrophobicContact CG2-CG 4.24Å; I247-Y352 HydrophobicContact CG1-CE2 3.95Å
248	L	96.6	Very high	93.6	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-63.1	-35.6	178.6	-71	169.6	0	0	0	112.9	E244 L245 I251 K252 I263 M265 I277 F279 F347	E244-L248 HydrophobicContact CG-CD1 3.72Å; E244-L248 HydrophobicContact CG-CG 4.26Å; E244-L248 WeakPolarHBondContact O-CB 3.47Å; E244-L248 VanDerWaalsContact O-CG 3.29Å; E244-L248 WeakPolarHBondContact O-CG 3.21Å; E244-L248 PolarHBondContact O-N 2.81Å; L245-L248 PolarHBondContact O-N 3.25Å; L248-I251 PolarHBondContact O-N 3.27Å; L248-K252 VanDerWaalsContact O-CB 3.26Å; L248-K252 WeakPolarHBondContact O-CB 3.44Å; L248-K252 PolarHBondContact O-N 3.39Å; L248-I263 HydrophobicContact CD2-CG2 4.16Å; L248-M265 HydrophobicContact CB-CB 4.29Å; L248-M265 HydrophobicContact CD1-CB 4.41Å; L248-I277 HydrophobicContact CD1-CG2 4.46Å; L248-F279 HydrophobicContact CD1-CE1 3.72Å; L248-F279 HydrophobicContact CD1-CZ 3.81Å; L248-F279 HydrophobicContact CD2-CE1 4.22Å; L248-F347 HydrophobicContact CD2-CB 4.42Å; L248-F347 HydrophobicContact CD2-CD2 3.99Å; L248-F347 HydrophobicContact CD2-CG 4.33Å
249	E	95.6	Very high	93.2	Very high	95 Å²	95	60.1 Å²	60.1	44%	0.444	29%	0.285	S	S	.	.	H	α-helix	trans	-65	-43.7	173.9	-75.6	177.4	176.8	0	0	112.4	L245 I247 K252 K253 M265 H268	L245-E249 WeakPolarHBondContact O-CG 3.46Å; L245-E249 PolarHBondContact O-N 2.76Å; I247-E249 VanDerWaalsContact C-N 3.34Å; I247-E249 PolarHBondContact O-N 3.5Å; E249-K252 PolarHBondContact O-N 3.46Å; E249-K253 WeakPolarHBondContact O-CB 3.2Å; E249-K253 PolarHBondContact O-N 3.35Å; E249-M265 HydrophobicContact CG-CE 3.83Å; E249-H268 IonicContact OE1-CE1 3.5Å
250	V	94.7	Very high	93.2	Very high	40 Å²	40	55.1 Å²	55.1	24%	0.242	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-46.5	174.5	170.3	0	0	0	0	110.5	K246 I247 K252 K253 K254 E320	K246-V250 WeakPolarHBondContact O-CG2 3.33Å; K246-V250 PolarHBondContact O-N 3.33Å; I247-V250 PolarHBondContact O-N 3.43Å; V250-K252 PolarHBondContact O-N 2.76Å; V250-K253 WeakPolarHBondContact O-CB 3.32Å; V250-K253 PolarHBondContact O-N 3.1Å; V250-K254 HydrophobicContact CG1-CG 4.38Å; V250-K254 VanDerWaalsContact O-CG 3.26Å; V250-K254 WeakPolarHBondContact O-CG 3.21Å; V250-K254 PolarHBondContact O-N 3.13Å; V250-E320 HydrophobicContact CG1-CG 4.38Å
251	I	93.8	Very high	93.3	Very high	3 Å²	3	54.3 Å²	54.3	2%	0.015	26%	0.258	C	S	.	.	H	α-helix	trans	-56.1	-52.6	176	-72.9	166.2	0	0	0	110.8	I247 L248 K253 K254 D255 V262 M316 L317 I322 F347	I247-I251 HydrophobicContact CG2-CD1 3.62Å; I247-I251 HydrophobicContact CG2-CG1 4.48Å; I247-I251 VanDerWaalsContact O-CG1 3.3Å; I247-I251 WeakPolarHBondContact O-CG1 3.43Å; I247-I251 PolarHBondContact O-N 2.8Å; L248-I251 PolarHBondContact O-N 3.27Å; I251-K253 PolarHBondContact O-N 2.97Å; I251-K254 PolarHBondContact O-N 2.77Å; I251-D255 PolarHBondContact O-N 3.4Å; I251-V262 HydrophobicContact CD1-CG1 4.24Å; I251-V262 HydrophobicContact CG2-CB 4.01Å; I251-V262 HydrophobicContact CG2-CG1 3.71Å; I251-M316 HydrophobicContact CB-CE 4.38Å; I251-M316 HydrophobicContact CG1-CE 3.87Å; I251-M316 HydrophobicContact CG2-CE 4.01Å; I251-L317 HydrophobicContact CD1-CD2 4.11Å; I251-L317 HydrophobicContact CG1-CD2 4.4Å; I251-I322 HydrophobicContact CG1-CD1 4.41Å; I251-F347 HydrophobicContact CD1-CD1 3.8Å; I251-F347 HydrophobicContact CD1-CE1 3.52Å; I251-F347 HydrophobicContact CD1-CE2 4.36Å; I251-F347 HydrophobicContact CD1-CG 4.32Å; I251-F347 HydrophobicContact CD1-CZ 3.85Å
252	K	93.4	Very high	93.3	Very high	89 Å²	89	54.2 Å²	54.2	39%	0.387	26%	0.257	S	S	.	.	H	α-helix	trans	-59.9	-32.8	178.8	-174.3	176.6	-176.8	173.1	0	112.8	L248 E249 V250 M265 K266	L248-K252 VanDerWaalsContact O-CB 3.26Å; L248-K252 WeakPolarHBondContact O-CB 3.44Å; L248-K252 PolarHBondContact O-N 3.39Å; E249-K252 PolarHBondContact O-N 3.46Å; V250-K252 PolarHBondContact O-N 2.76Å; K252-M265 WeakPolarHBondContact CD-O 3.43Å; K252-M265 VanDerWaalsContact CE-O 3.31Å; K252-M265 WeakPolarHBondContact CE-O 3.41Å; K252-M265 PolarHBondContact NZ-O 2.87Å; K252-K266 PolarHBondContact NZ-O 2.85Å
253	K	93.6	Very high	93.2	Very high	154 Å²	154	51.9 Å²	51.9	67%	0.67	24%	0.244	S	C	*	.	H	α-helix	trans	-73.3	-26.9	175.7	-176.2	175.6	178.4	178.8	0	113.1	E249 V250 I251 K256	E249-K253 WeakPolarHBondContact O-CB 3.2Å; E249-K253 PolarHBondContact O-N 3.35Å; V250-K253 WeakPolarHBondContact O-CB 3.32Å; V250-K253 PolarHBondContact O-N 3.1Å; I251-K253 PolarHBondContact O-N 2.97Å; K253-K256 VanDerWaalsContact O-CE 3.25Å; K253-K256 WeakPolarHBondContact O-CE 3.47Å; K253-K256 WeakPolarHBondContact O-CG 3.34Å
254	K	92.9	Very high	93.1	Very high	101 Å²	101	51.8 Å²	51.8	44%	0.439	24%	0.241	S	C	.	.	H	α-helix	trans	-95.1	-41	-176.7	-64.8	-73.1	180	126.8	0	112.8	V250 I251 K256 E320	V250-K254 HydrophobicContact CG1-CG 4.38Å; V250-K254 VanDerWaalsContact O-CG 3.26Å; V250-K254 WeakPolarHBondContact O-CG 3.21Å; V250-K254 PolarHBondContact O-N 3.13Å; I251-K254 PolarHBondContact O-N 2.77Å; K254-K256 VanDerWaalsContact C-N 3.28Å; K254-K256 PolarHBondContact O-N 3.49Å; K254-E320 WeakPolarHBondContact CD-OE1 3.34Å; K254-E320 WeakPolarHBondContact CE-OE1 3.16Å; K254-E320 WeakPolarHBondContact CE-OE2 3.3Å; K254-E320 HydrophobicContact CG-CG 4.31Å; K254-E320 IonicContact NZ-OE1 3.7Å; K254-E320 PolarHBondContact NZ-OE1 3.38Å; K254-E320 IonicContact NZ-OE2 3.59Å; K254-E320 PolarHBondContact NZ-OE2 3.38Å
255	D	91.8	Very high	93.2	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.243	C	C	.	.			trans	-89.4	47.1	-178.9	-168.8	34	0	0	0	112.8	I251 D257 N258 L259 H260 H264 M316	I251-D255 PolarHBondContact O-N 3.4Å; D255-D257 PolarHBondContact O-N 3.03Å; D255-N258 PolarHBondContact O-N 3.42Å; D255-N258 VanDerWaalsContact O-N 3.08Å; D255-N258 WeakPolarHBondContact OD1-CA 3.45Å; D255-N258 PolarHBondContact OD1-N 3.22Å; D255-L259 PolarHBondContact OD1-N 3.44Å; D255-H260 HydrophobicContact CB-CB 4.38Å; D255-H260 WeakPolarHBondContact OD1-CB 3.14Å; D255-H260 IonicContact OD1-CE1 2.68Å; D255-H260 IonicContact OD1-CG 2.88Å; D255-H260 PolarHBondContact OD1-N 3.35Å; D255-H260 IonicContact OD1-ND1 2.71Å; D255-H260 PolarHBondContact OD1-ND1 2.73Å; D255-H264 PolarHBondContact O-CE1 3.24Å; D255-H264 VanDerWaalsContact O-CE1 3.28Å; D255-H264 IonicContact OD2-CD2 3.58Å; D255-H264 IonicContact OD2-CE1 2.88Å; D255-H264 IonicContact OD2-NE2 2.82Å; D255-H264 PolarHBondContact OD2-NE2 3.38Å; D255-M316 HydrophobicContact CB-SD 4.05Å
256	K	88.6	Confident	93.1	Very high	180 Å²	180	54.6 Å²	54.6	78%	0.783	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-26.2	-176.1	-66.3	-175.6	179	-177.5	0	113.9	K253 K254	K253-K256 VanDerWaalsContact O-CE 3.25Å; K253-K256 WeakPolarHBondContact O-CE 3.47Å; K253-K256 WeakPolarHBondContact O-CG 3.34Å; K254-K256 VanDerWaalsContact C-N 3.28Å; K254-K256 PolarHBondContact O-N 3.49Å
257	D	88	Confident	93.1	Very high	92 Å²	92	51.5 Å²	51.5	49%	0.492	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-3.9	179.1	56.8	2	0	0	0	112.9	D255 L259 H260	D255-D257 PolarHBondContact O-N 3.03Å; D257-L259 VanDerWaalsContact C-N 3.28Å; D257-L259 HydrophobicContact CB-CD1 4.17Å; D257-L259 HydrophobicContact CB-CG 3.92Å; D257-L259 PolarHBondContact O-N 3.26Å; D257-L259 PolarHBondContact OD1-N 2.78Å; D257-L259 WeakPolarHBondContact OD2-CD1 3.44Å; D257-H260 IonicContact OD1-CE1 3.46Å; D257-H260 IonicContact OD1-ND1 2.79Å
258	N	88	Confident	93.1	Very high	39 Å²	39	55.3 Å²	55.3	21%	0.209	26%	0.259	C	S	.	.	S	Bend	trans	57.8	38.3	179.7	-166.9	28.6	0	0	0	112.6	D255 H264 K343	D255-N258 PolarHBondContact O-N 3.42Å; D255-N258 VanDerWaalsContact O-N 3.08Å; D255-N258 WeakPolarHBondContact OD1-CA 3.45Å; D255-N258 PolarHBondContact OD1-N 3.22Å; N258-H264 PolarHBondContact OD1-CE1 2.92Å; N258-K343 WeakPolarHBondContact OD1-CE 3.31Å; N258-K343 PolarHBondContact OD1-NZ 3.31Å
259	L	88.3	Confident	93.2	Very high	77 Å²	77	56.9 Å²	56.9	40%	0.403	27%	0.265	S	S	.	.			trans	-105.1	-3.9	-177	-61.5	-171.5	0	0	0	114.2	D255 D257 P339	D255-L259 PolarHBondContact OD1-N 3.44Å; D257-L259 VanDerWaalsContact C-N 3.28Å; D257-L259 HydrophobicContact CB-CD1 4.17Å; D257-L259 HydrophobicContact CB-CG 3.92Å; D257-L259 PolarHBondContact O-N 3.26Å; D257-L259 PolarHBondContact OD1-N 2.78Å; D257-L259 WeakPolarHBondContact OD2-CD1 3.44Å; L259-P339 HydrophobicContact CD2-CG 4.06Å
260	H	90.7	Very high	93.3	Very high	23 Å²	23	57.5 Å²	57.5	11%	0.106	26%	0.264	C	S	.	.	S	Bend	trans	-99.6	3.6	-178.5	-57.3	84.4	0	0	0	113.7	D255 D257 V262 R312 C313 M316	D255-H260 HydrophobicContact CB-CB 4.38Å; D255-H260 WeakPolarHBondContact OD1-CB 3.14Å; D255-H260 IonicContact OD1-CE1 2.68Å; D255-H260 IonicContact OD1-CG 2.88Å; D255-H260 PolarHBondContact OD1-N 3.35Å; D255-H260 IonicContact OD1-ND1 2.71Å; D255-H260 PolarHBondContact OD1-ND1 2.73Å; D257-H260 IonicContact OD1-CE1 3.46Å; D257-H260 IonicContact OD1-ND1 2.79Å; H260-V262 WeakPolarHBondContact O-CG2 3.49Å; H260-V262 PolarHBondContact O-N 2.7Å; H260-R312 PolarHBondContact NE2-NH2 2.72Å; H260-C313 WeakPolarHBondContact O-CA 3.46Å; H260-C313 VanDerWaalsContact O-CB 3.24Å; H260-C313 WeakPolarHBondContact O-CB 3.45Å; H260-C313 PolarHBondContact O-N 2.81Å; H260-M316 HydrophobicContact CB-CB 4.11Å; H260-M316 HydrophobicContact CB-CE 4.49Å; H260-M316 HydrophobicContact CB-CG 4.4Å; H260-M316 HydrophobicContact CB-SD 3.7Å
261	N	93.9	Very high	93.5	Very high	3 Å²	3	55.7 Å²	55.7	2%	0.016	25%	0.253	C	S	.	.			trans	58.1	46.5	173.3	-58.8	-43.7	0	0	0	113.7	A309 P339 I342 K343 V344	N261-A309 VanDerWaalsContact ND2-CA 3.33Å; N261-A309 WeakPolarHBondContact ND2-CA 3.35Å; N261-A309 VanDerWaalsContact ND2-CB 3.35Å; N261-A309 WeakPolarHBondContact ND2-CB 3.49Å; N261-A309 PolarHBondContact ND2-O 2.72Å; N261-A309 VanDerWaalsContact ND2-O 3.1Å; N261-P339 PolarHBondContact ND2-O 3.45Å; N261-P339 WeakPolarHBondContact OD1-CD 3.38Å; N261-P339 PolarHBondContact OD1-O 2.84Å; N261-P339 VanDerWaalsContact OD1-O 3.06Å; N261-I342 WeakPolarHBondContact CB-O 3.44Å; N261-K343 CarbonylContact O-C 3.57Å; N261-K343 VanDerWaalsContact O-CA 3.27Å; N261-K343 WeakPolarHBondContact O-CA 3.25Å; N261-V344 PolarHBondContact O-N 3.42Å
262	V	94.6	Very high	93.7	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-120	146.3	176.4	-169.3	0	0	0	0	110.5	I251 H260 H264 C313 M316 K343 F347	I251-V262 HydrophobicContact CD1-CG1 4.24Å; I251-V262 HydrophobicContact CG2-CB 4.01Å; I251-V262 HydrophobicContact CG2-CG1 3.71Å; H260-V262 WeakPolarHBondContact O-CG2 3.49Å; H260-V262 PolarHBondContact O-N 2.7Å; V262-H264 PolarHBondContact O-CD2 3.06Å; V262-H264 VanDerWaalsContact O-CD2 3.24Å; V262-H264 PolarHBondContact O-N 2.84Å; V262-C313 HydrophobicContact CG2-CB 4.06Å; V262-C313 VanDerWaalsContact CG2-SG 3.57Å; V262-M316 HydrophobicContact CB-CE 4.38Å; V262-M316 HydrophobicContact CG2-CE 3.58Å; V262-K343 WeakPolarHBondContact O-CD 3.36Å; V262-K343 WeakPolarHBondContact O-CE 3.41Å; V262-K343 PolarHBondContact O-NZ 2.92Å; V262-F347 HydrophobicContact CG1-CE2 3.39Å; V262-F347 HydrophobicContact CG1-CZ 3.38Å
263	I	94.9	Very high	93.8	Very high	9 Å²	9	56.8 Å²	56.8	5%	0.046	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-57.5	135	173.9	-167.1	72.1	0	0	0	111.4	L248 F279 E280 L282 V344 V345 F347	L248-I263 HydrophobicContact CD2-CG2 4.16Å; I263-F279 HydrophobicContact CD1-CB 4.21Å; I263-F279 HydrophobicContact CG1-CB 4.07Å; I263-F279 HydrophobicContact CG1-CD1 3.53Å; I263-F279 HydrophobicContact CG1-CE1 4.25Å; I263-F279 HydrophobicContact CG1-CG 4.07Å; I263-F279 HydrophobicContact CG2-CD1 4.36Å; I263-F279 HydrophobicContact CG2-CE1 4.28Å; I263-E280 HydrophobicContact CD1-CG 3.6Å; I263-L282 HydrophobicContact CD1-CD1 3.53Å; I263-L282 HydrophobicContact CD1-CG 3.88Å; I263-V344 PolarHBondContact N-O 3.4Å; I263-V345 HydrophobicContact CB-CB 4.46Å; I263-V345 HydrophobicContact CB-CG1 4.12Å; I263-V345 HydrophobicContact CD1-CG1 4.3Å; I263-V345 HydrophobicContact CG1-CG1 4.47Å; I263-V345 HydrophobicContact CG2-CB 4.45Å; I263-F347 HydrophobicContact CG2-CD2 4.26Å; I263-F347 HydrophobicContact CG2-CE2 4.2Å
264	H	92.1	Very high	94	Very high	39 Å²	39	49.5 Å²	49.5	18%	0.181	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-100.9	119.7	173.9	-68.8	-177.9	0	0	0	110.5	D255 N258 V262 K266 E280	D255-H264 PolarHBondContact O-CE1 3.24Å; D255-H264 VanDerWaalsContact O-CE1 3.28Å; D255-H264 IonicContact OD2-CD2 3.58Å; D255-H264 IonicContact OD2-CE1 2.88Å; D255-H264 IonicContact OD2-NE2 2.82Å; D255-H264 PolarHBondContact OD2-NE2 3.38Å; N258-H264 PolarHBondContact OD1-CE1 2.92Å; V262-H264 PolarHBondContact O-CD2 3.06Å; V262-H264 VanDerWaalsContact O-CD2 3.24Å; V262-H264 PolarHBondContact O-N 2.84Å; H264-K266 PolarHBondContact O-N 3.18Å; H264-E280 PolarHBondContact N-OE1 3.45Å; H264-E280 VanDerWaalsContact N-OE1 3.08Å
265	M	95.8	Very high	94.3	Very high	9 Å²	9	44.8 Å²	44.8	4%	0.044	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	129.3	167.3	177.5	-178.2	70.5	0	0	109.5	L245 L248 E249 K252 H268 I277 F279	L245-M265 HydrophobicContact CD2-CE 4.37Å; L245-M265 HydrophobicContact CD2-SD 3.37Å; L245-M265 WeakPolarHBondContact CD2-SD 3.19Å; L248-M265 HydrophobicContact CB-CB 4.29Å; L248-M265 HydrophobicContact CD1-CB 4.41Å; E249-M265 HydrophobicContact CG-CE 3.83Å; K252-M265 WeakPolarHBondContact CD-O 3.43Å; K252-M265 VanDerWaalsContact CE-O 3.31Å; K252-M265 WeakPolarHBondContact CE-O 3.41Å; K252-M265 PolarHBondContact NZ-O 2.87Å; M265-H268 HydrophobicContact SD-CB 4.34Å; M265-I277 HydrophobicContact CG-CG2 3.73Å; M265-I277 HydrophobicContact SD-CG2 3.68Å; M265-F279 HydrophobicContact CB-CD1 4.25Å; M265-F279 HydrophobicContact CB-CE1 4.07Å
266	K	95.6	Very high	94.6	Very high	62 Å²	62	44.8 Å²	44.8	27%	0.27	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	-66.3	170	-82.6	-175	161.2	-165.3	0	109.8	E224 V226 K252 H264 S278	E224-K266 IonicContact OE2-NZ 2.96Å; E224-K266 PolarHBondContact OE2-NZ 2.86Å; V226-K266 HydrophobicContact CG1-CD 3.89Å; K252-K266 PolarHBondContact NZ-O 2.85Å; H264-K266 PolarHBondContact O-N 3.18Å; K266-S278 WeakPolarHBondContact CB-OG 3.43Å; K266-S278 PolarHBondContact N-O 3.48Å
267	E	95.4	Very high	95.1	Very high	65 Å²	65	36.2 Å²	36.2	30%	0.304	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	170.6	-177.4	59.2	-166.6	108.5	0	0	110.9	R199 S278	R199-E267 IonicContact CZ-OE1 2.66Å; R199-E267 VanDerWaalsContact CZ-OE1 3.29Å; R199-E267 IonicContact CZ-OE2 2.77Å; R199-E267 VanDerWaalsContact NH1-CD 3.27Å; R199-E267 IonicContact NH1-OE1 3.43Å; R199-E267 PolarHBondContact NH1-OE1 3.41Å; R199-E267 VanDerWaalsContact NH1-OE1 3.09Å; R199-E267 IonicContact NH1-OE2 3.66Å; R199-E267 PolarHBondContact NH1-OE2 3.11Å; R199-E267 IonicContact NH2-OE1 3.46Å; R199-E267 PolarHBondContact NH2-OE1 2.94Å; R199-E267 IonicContact NH2-OE2 2.74Å; E267-S278 WeakPolarHBondContact CG-OG 3.4Å; E267-S278 PolarHBondContact N-OG 3.04Å; E267-S278 PolarHBondContact O-N 3.23Å; E267-S278 PolarHBondContact O-OG 3.18Å
268	H	97.9	Very high	95.6	Very high	80 Å²	80	31.9 Å²	31.9	37%	0.37	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	151.7	171	69.6	-101.4	0	0	0	109.9	L245 E249 M265 C276 I277	L245-H268 HydrophobicContact CD1-CB 4.32Å; L245-H268 HydrophobicContact CD2-CB 3.72Å; E249-H268 IonicContact OE1-CE1 3.5Å; M265-H268 HydrophobicContact SD-CB 4.34Å; H268-C276 CarbonylContact C-O 3.55Å; H268-C276 WeakPolarHBondContact CA-O 3.47Å; H268-C276 WeakPolarHBondContact CB-O 3.39Å; H268-I277 HydrophobicContact CB-CG1 4.49Å
269	F	98.1	Very high	96	Very high	34 Å²	34	30.8 Å²	30.8	15%	0.149	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	171.1	-178.1	56.5	-88.9	0	0	0	110.4	I196 A197 F200 F271 C276	I196-F269 HydrophobicContact CG2-CE2 3.6Å; I196-F269 HydrophobicContact CG2-CZ 3.8Å; A197-F269 HydrophobicContact CB-CD2 3.93Å; A197-F269 HydrophobicContact CB-CE2 3.66Å; A197-F269 HydrophobicContact CB-CZ 4.4Å; F200-F269 HydrophobicContact CD2-CE1 4.23Å; F200-F269 AromaticContact CD2-CZ 3.8Å; F200-F269 HydrophobicContact CD2-CZ 3.8Å; F200-F269 HydrophobicContact CE2-CD1 4.42Å; F200-F269 AromaticContact CE2-CE1 3.47Å; F200-F269 HydrophobicContact CE2-CE1 3.47Å; F200-F269 VanDerWaalsContact CE2-CE1 3.47Å; F200-F269 HydrophobicContact CE2-CE2 4.47Å; F200-F269 AromaticContact CE2-CZ 3.5Å; F200-F269 HydrophobicContact CE2-CZ 3.5Å; F200-F269 HydrophobicContact CZ-CE1 4.03Å; F200-F269 HydrophobicContact CZ-CZ 4.42Å; F269-F271 HydrophobicContact CD2-CB 4.35Å; F269-F271 HydrophobicContact CE2-CB 4.16Å; F269-C276 HydrophobicContact CD1-CB 4.34Å; F269-C276 HydrophobicContact CD2-CB 3.78Å; F269-C276 HydrophobicContact CE1-CB 4.03Å; F269-C276 HydrophobicContact CE2-CB 3.42Å; F269-C276 VanDerWaalsContact CE2-CB 3.42Å; F269-C276 HydrophobicContact CG-CB 4.22Å; F269-C276 HydrophobicContact CZ-CB 3.56Å; F269-C276 PolarHBondContact N-O 2.8Å; F269-C276 WeakPolarHBondContact O-CB 3.48Å; F269-C276 PolarHBondContact O-N 3.18Å
270	Y	98.2	Very high	96.3	Very high	109 Å²	109	29 Å²	29	43%	0.427	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	142.7	170.4	-70.8	-88.2	0	0	0	110.5	H238 H274 L275	H238-Y270 AromaticContact CE1-CE1 3.68Å; H238-Y270 AromaticContact CE1-CZ 3.83Å; H238-Y270 PolarHBondContact CE1-OH 2.87Å; Y270-H274 VanDerWaalsContact CA-O 3.29Å; Y270-H274 WeakPolarHBondContact CA-O 3.46Å; Y270-L275 HydrophobicContact CD1-CB 4.24Å; Y270-L275 HydrophobicContact CE1-CB 3.72Å; Y270-L275 HydrophobicContact CE1-CD1 4.05Å; Y270-L275 HydrophobicContact CE1-CG 4.39Å; Y270-L275 HydrophobicContact CE2-CD1 4.12Å
271	F	98.2	Very high	96.6	Very high	1 Å²	1	30.6 Å²	30.6	0%	0.004	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	124.5	172.5	177.7	-115.8	0	0	0	108.6	Y156 Y188 H195 I196 A197 M230 F269 N273 H274	Y156-F271 WeakPolarHBondContact OH-CD2 3.1Å; Y188-F271 HydrophobicContact CE1-CE1 4.49Å; Y188-F271 HydrophobicContact CE2-CE1 4.3Å; Y188-F271 AromaticContact CZ-CE1 3.88Å; H195-F271 AromaticContact CE1-CE2 3.97Å; H195-F271 AromaticContact CE1-CZ 3.95Å; H195-F271 AromaticContact ND1-CE2 3.95Å; H195-F271 AromaticContact ND1-CZ 3.76Å; H195-F271 WeakPolarHBondContact O-CZ 3.2Å; I196-F271 HydrophobicContact CB-CD1 4.2Å; I196-F271 HydrophobicContact CB-CE1 4.24Å; I196-F271 HydrophobicContact CG1-CD1 4.14Å; I196-F271 HydrophobicContact CG1-CE1 4Å; I196-F271 HydrophobicContact CG2-CB 4.23Å; I196-F271 HydrophobicContact CG2-CD1 3.8Å; I196-F271 HydrophobicContact CG2-CE1 4.34Å; I196-F271 HydrophobicContact CG2-CG 4.02Å; A197-F271 HydrophobicContact CB-CD2 4.31Å; A197-F271 VanDerWaalsContact N-CD2 3.29Å; M230-F271 HydrophobicContact CE-CD1 4.28Å; F269-F271 HydrophobicContact CD2-CB 4.35Å; F269-F271 HydrophobicContact CE2-CB 4.16Å; F271-N273 VanDerWaalsContact C-N 3.32Å; F271-N273 PolarHBondContact O-N 3.03Å; F271-H274 PolarHBondContact N-O 3.34Å; F271-H274 WeakPolarHBondContact O-CB 3.45Å; F271-H274 PolarHBondContact O-N 3.36Å
272	R	97.1	Very high	96.7	Very high	13 Å²	13	31.9 Å²	31.9	5%	0.049	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	43.2	53.9	-179.8	-61.5	179.4	-179.4	165	-1	112.9	F148 E149 E152 N178 Y181 Y188 H274	F148-R272 HydrophobicContact CE1-CG 4.35Å; E149-R272 IonicContact OE1-CZ 3.95Å; E149-R272 IonicContact OE1-NH1 2.77Å; E149-R272 IonicContact OE1-NH2 3.97Å; E149-R272 PolarHBondContact OE1-NH2 3.24Å; E152-R272 WeakPolarHBondContact OE1-CG 3.29Å; E152-R272 IonicContact OE1-NE 3.62Å; E152-R272 PolarHBondContact OE1-NE 3.19Å; E152-R272 IonicContact OE2-CZ 3.49Å; E152-R272 VanDerWaalsContact OE2-CZ 3.22Å; E152-R272 IonicContact OE2-NE 3.03Å; E152-R272 PolarHBondContact OE2-NE 3.46Å; E152-R272 IonicContact OE2-NH2 3.22Å; E152-R272 PolarHBondContact OE2-NH2 3.38Å; N178-R272 PolarHBondContact ND2-O 2.69Å; Y181-R272 HydrophobicContact CD2-CG 4.49Å; Y181-R272 VanDerWaalsContact CE1-NH1 3.26Å; Y188-R272 HydrophobicContact CE2-CB 4.19Å; Y188-R272 PolarHBondContact OH-NH1 3.17Å; Y188-R272 VanDerWaalsContact OH-NH1 3.07Å; R272-H274 PolarHBondContact O-CD2 2.93Å; R272-H274 PolarHBondContact O-N 3.12Å; R272-H274 VanDerWaalsContact O-N 3.13Å
273	N	96.7	Very high	96.7	Very high	103 Å²	103	33.9 Å²	33.9	55%	0.551	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.2	0.4	-176.4	-63.3	-51	0	0	0	117.9	N178 F271	N178-N273 PolarHBondContact OD1-ND2 3.33Å; F271-N273 VanDerWaalsContact C-N 3.32Å; F271-N273 PolarHBondContact O-N 3.03Å
274	H	98.3	Very high	96.7	Very high	1 Å²	1	36 Å²	36	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	140	170.2	-63.5	-81	0	0	0	111.8	D182 G186 Y188 M230 I231 Y270 F271 R272	D182-H274 IonicContact OD1-CE1 3.29Å; D182-H274 IonicContact OD1-NE2 2.74Å; D182-H274 PolarHBondContact OD1-NE2 2.94Å; G186-H274 PolarHBondContact O-CE1 3.05Å; Y188-H274 WeakPolarHBondContact CB-NE2 3.43Å; Y188-H274 AromaticContact CD2-CD2 3.61Å; Y188-H274 AromaticContact CD2-NE2 3.62Å; Y188-H274 PolarHBondContact N-CE1 2.83Å; M230-H274 HydrophobicContact CE-CB 3.75Å; I231-H274 PolarHBondContact O-ND1 2.88Å; Y270-H274 VanDerWaalsContact CA-O 3.29Å; Y270-H274 WeakPolarHBondContact CA-O 3.46Å; F271-H274 PolarHBondContact N-O 3.34Å; F271-H274 WeakPolarHBondContact O-CB 3.45Å; F271-H274 PolarHBondContact O-N 3.36Å; R272-H274 PolarHBondContact O-CD2 2.93Å; R272-H274 PolarHBondContact O-N 3.12Å; R272-H274 VanDerWaalsContact O-N 3.13Å
275	L	98.4	Very high	96.9	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	124.2	161.3	176.1	55.3	0	0	0	108.4	I231 A241 L242 L245 Y270 I277	I231-L275 HydrophobicContact CB-CB 4.19Å; I231-L275 WeakPolarHBondContact CB-O 3.19Å; I231-L275 HydrophobicContact CG1-CB 4.23Å; I231-L275 HydrophobicContact CG1-CG 4.35Å; I231-L275 WeakPolarHBondContact CG1-O 3.39Å; I231-L275 PolarHBondContact N-O 3.37Å; A241-L275 HydrophobicContact CB-CD2 3.79Å; L242-L275 HydrophobicContact CD2-CD2 4.17Å; L245-L275 HydrophobicContact CD1-CD1 4.19Å; L245-L275 HydrophobicContact CD1-CD2 3.88Å; Y270-L275 HydrophobicContact CD1-CB 4.24Å; Y270-L275 HydrophobicContact CE1-CB 3.72Å; Y270-L275 HydrophobicContact CE1-CD1 4.05Å; Y270-L275 HydrophobicContact CE1-CG 4.39Å; Y270-L275 HydrophobicContact CE2-CD1 4.12Å; L275-I277 HydrophobicContact CG-CG1 4.43Å
276	C	98.5	Very high	97.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.2	178.6	-64.3	0	0	0	0	109.5	I228 K229 H268 F269	I228-C276 HydrophobicContact CG2-CB 4.15Å; K229-C276 WeakPolarHBondContact O-CA 3.29Å; H268-C276 CarbonylContact C-O 3.55Å; H268-C276 WeakPolarHBondContact CA-O 3.47Å; H268-C276 WeakPolarHBondContact CB-O 3.39Å; F269-C276 HydrophobicContact CD1-CB 4.34Å; F269-C276 HydrophobicContact CD2-CB 3.78Å; F269-C276 HydrophobicContact CE1-CB 4.03Å; F269-C276 HydrophobicContact CE2-CB 3.42Å; F269-C276 VanDerWaalsContact CE2-CB 3.42Å; F269-C276 HydrophobicContact CG-CB 4.22Å; F269-C276 HydrophobicContact CZ-CB 3.56Å; F269-C276 PolarHBondContact N-O 2.8Å; F269-C276 WeakPolarHBondContact O-CB 3.48Å; F269-C276 PolarHBondContact O-N 3.18Å
277	I	98.4	Very high	97.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	122.2	176.1	-45.8	178.1	0	0	0	108	I228 K229 L245 L248 M265 H268 L275 F279	I228-I277 WeakPolarHBondContact CA-O 3.41Å; K229-I277 HydrophobicContact CB-CB 4.5Å; K229-I277 PolarHBondContact N-O 2.8Å; K229-I277 PolarHBondContact O-N 3.04Å; L245-I277 HydrophobicContact CD2-CD1 3.68Å; L245-I277 HydrophobicContact CD2-CG1 3.89Å; L245-I277 HydrophobicContact CD2-CG2 3.99Å; L245-I277 HydrophobicContact CG-CD1 3.94Å; L245-I277 HydrophobicContact CG-CG1 4.47Å; L248-I277 HydrophobicContact CD1-CG2 4.46Å; M265-I277 HydrophobicContact CG-CG2 3.73Å; M265-I277 HydrophobicContact SD-CG2 3.68Å; H268-I277 HydrophobicContact CB-CG1 4.49Å; L275-I277 HydrophobicContact CG-CG1 4.43Å; I277-F279 HydrophobicContact CB-CE2 3.86Å; I277-F279 HydrophobicContact CB-CZ 4.09Å; I277-F279 HydrophobicContact CG2-CD2 4.45Å; I277-F279 HydrophobicContact CG2-CE1 4.12Å; I277-F279 HydrophobicContact CG2-CE2 3.62Å; I277-F279 HydrophobicContact CG2-CZ 3.44Å; I277-F279 VanDerWaalsContact CG2-CZ 3.44Å
278	S	98.1	Very high	97.2	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	145.9	179.8	77	0	0	0	0	112.3	A227 K266 E267	A227-S278 CarbonylContact O-C 3.55Å; A227-S278 WeakPolarHBondContact O-CA 3.14Å; K266-S278 WeakPolarHBondContact CB-OG 3.43Å; K266-S278 PolarHBondContact N-O 3.48Å; E267-S278 WeakPolarHBondContact CG-OG 3.4Å; E267-S278 PolarHBondContact N-OG 3.04Å; E267-S278 PolarHBondContact O-N 3.23Å; E267-S278 PolarHBondContact O-OG 3.18Å
279	F	97.6	Very high	97.2	Very high	16 Å²	16	34.1 Å²	34.1	7%	0.07	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	163.1	-174.4	-59.1	-85.6	0	0	0	110.8	V226 A227 K229 L248 I263 M265 I277	V226-F279 WeakPolarHBondContact CB-O 3.39Å; A227-F279 HydrophobicContact CB-CB 4.41Å; A227-F279 PolarHBondContact N-O 2.92Å; A227-F279 VanDerWaalsContact N-O 3.11Å; A227-F279 PolarHBondContact O-N 2.92Å; K229-F279 HydrophobicContact CB-CE2 3.91Å; K229-F279 HydrophobicContact CD-CE2 4.43Å; L248-F279 HydrophobicContact CD1-CE1 3.72Å; L248-F279 HydrophobicContact CD1-CZ 3.81Å; L248-F279 HydrophobicContact CD2-CE1 4.22Å; I263-F279 HydrophobicContact CD1-CB 4.21Å; I263-F279 HydrophobicContact CG1-CB 4.07Å; I263-F279 HydrophobicContact CG1-CD1 3.53Å; I263-F279 HydrophobicContact CG1-CE1 4.25Å; I263-F279 HydrophobicContact CG1-CG 4.07Å; I263-F279 HydrophobicContact CG2-CD1 4.36Å; I263-F279 HydrophobicContact CG2-CE1 4.28Å; M265-F279 HydrophobicContact CB-CD1 4.25Å; M265-F279 HydrophobicContact CB-CE1 4.07Å; I277-F279 HydrophobicContact CB-CE2 3.86Å; I277-F279 HydrophobicContact CB-CZ 4.09Å; I277-F279 HydrophobicContact CG2-CD2 4.45Å; I277-F279 HydrophobicContact CG2-CE1 4.12Å; I277-F279 HydrophobicContact CG2-CE2 3.62Å; I277-F279 HydrophobicContact CG2-CZ 3.44Å; I277-F279 VanDerWaalsContact CG2-CZ 3.44Å
280	E	94.9	Very high	97.2	Very high	39 Å²	39	32.5 Å²	32.5	18%	0.182	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	138.7	161.2	65.4	-168.9	129	0	0	110.7	I263 H264 L282 K343	I263-E280 HydrophobicContact CD1-CG 3.6Å; H264-E280 PolarHBondContact N-OE1 3.45Å; H264-E280 VanDerWaalsContact N-OE1 3.08Å; E280-L282 HydrophobicContact CG-CD2 3.95Å; E280-L282 HydrophobicContact CG-CG 4.3Å; E280-L282 PolarHBondContact O-N 3.28Å; E280-K343 WeakPolarHBondContact OE1-CE 3.42Å; E280-K343 IonicContact OE1-NZ 2.76Å; E280-K343 PolarHBondContact OE1-NZ 3.24Å; E280-K343 IonicContact OE2-NZ 2.7Å
281	L	95.9	Very high	97.2	Very high	58 Å²	58	31.4 Å²	31.4	30%	0.304	17%	0.165	S	C	.	.	P	Polyproline II helix	trans	-77.4	123.4	173.3	-174.8	70.1	0	0	0	109.8	I206 K216 L225 A227	I206-L281 HydrophobicContact CD1-CD1 3.89Å; K216-L281 HydrophobicContact CB-CD1 4.17Å; K216-L281 HydrophobicContact CD-CD1 4.48Å; K216-L281 HydrophobicContact CD-CD2 3.98Å; K216-L281 HydrophobicContact CG-CD1 4.08Å; K216-L281 HydrophobicContact CG-CD2 3.92Å; L225-L281 HydrophobicContact CB-CD2 3.79Å; L225-L281 HydrophobicContact CD1-CD2 4.29Å; A227-L281 HydrophobicContact CB-CD1 4.2Å
282	L	96	Very high	97.1	Very high	29 Å²	29	37.9 Å²	37.9	15%	0.152	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-103	173.4	176.2	-62.1	-175.5	0	0	0	112.1	I263 E280 L333 K343 V345	I263-L282 HydrophobicContact CD1-CD1 3.53Å; I263-L282 HydrophobicContact CD1-CG 3.88Å; E280-L282 HydrophobicContact CG-CD2 3.95Å; E280-L282 HydrophobicContact CG-CG 4.3Å; E280-L282 PolarHBondContact O-N 3.28Å; L282-L333 HydrophobicContact CB-CB 3.89Å; L282-L333 HydrophobicContact CB-CD2 3.89Å; L282-L333 HydrophobicContact CD1-CB 3.82Å; L282-L333 HydrophobicContact CD1-CD2 4.43Å; L282-K343 HydrophobicContact CD1-CB 3.78Å; L282-K343 HydrophobicContact CD1-CD 4.25Å; L282-K343 HydrophobicContact CD1-CG 4.49Å; L282-K343 HydrophobicContact CD2-CD 4.25Å; L282-V345 HydrophobicContact CD1-CG1 3.95Å
283	G	95	Very high	97.1	Very high	42 Å²	42	40.1 Å²	40.1	43%	0.433	21%	0.206	S	C	.	.			trans	-81	-166.9	174.3	0	0	0	0	0	113.3	L334	G283-L334 WeakPolarHBondContact CA-O 3.47Å; G283-L334 PolarHBondContact N-O 3.16Å
284	V	94.9	Very high	97.1	Very high	55 Å²	55	40.9 Å²	40.9	33%	0.333	21%	0.21	S	C	.	.			trans	-61.2	151.4	179.6	-62.3	0	0	0	0	112.7	E288 L334	V284-E288 HydrophobicContact CB-CB 4.35Å; V284-L334 HydrophobicContact CG2-CD1 3.85Å; V284-L334 HydrophobicContact CG2-CG 4.49Å; V284-L334 WeakPolarHBondContact O-CG 3.42Å; V284-L334 PolarHBondContact O-N 2.99Å
285	N	97.1	Very high	97.1	Very high	36 Å²	36	43.9 Å²	43.9	19%	0.193	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-74	166.4	172.6	68.4	38.9	0	0	0	112.7	Y287 E288 L289 E330 I332 L333	N285-Y287 VanDerWaalsContact C-N 3.31Å; N285-Y287 PolarHBondContact O-N 2.79Å; N285-Y287 PolarHBondContact OD1-N 3.5Å; N285-E288 PolarHBondContact O-N 2.86Å; N285-E288 PolarHBondContact OD1-N 3.24Å; N285-L289 PolarHBondContact O-N 3.23Å; N285-L289 VanDerWaalsContact O-N 3.11Å; N285-E330 VanDerWaalsContact CB-O 3.24Å; N285-E330 WeakPolarHBondContact CB-O 3.45Å; N285-I332 CarbonylContact C-O 3.6Å; N285-I332 VanDerWaalsContact CA-O 3.24Å; N285-I332 WeakPolarHBondContact CA-O 3.49Å; N285-L333 HydrophobicContact CB-CD1 3.73Å; N285-L333 HydrophobicContact CB-CG 4.06Å
286	L	97.9	Very high	97.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-68.8	-26.7	-178.1	-66.9	-172.2	0	0	0	113.1	L289 I290 F306 P329 I332 L334 I342 L393	L286-L289 HydrophobicContact CD2-CD2 3.9Å; L286-L289 WeakPolarHBondContact O-CB 3.36Å; L286-L289 PolarHBondContact O-N 2.77Å; L286-I290 WeakPolarHBondContact O-CG1 3.43Å; L286-I290 PolarHBondContact O-N 2.97Å; L286-F306 HydrophobicContact CD1-CD2 4.4Å; L286-F306 HydrophobicContact CD2-CD2 4.45Å; L286-F306 HydrophobicContact CD2-CE1 4.37Å; L286-F306 HydrophobicContact CD2-CE2 3.92Å; L286-F306 HydrophobicContact CD2-CZ 3.87Å; L286-P329 HydrophobicContact CB-CB 4.07Å; L286-P329 PolarHBondContact N-O 3.46Å; L286-I332 HydrophobicContact CD1-CB 3.88Å; L286-I332 HydrophobicContact CD1-CD1 4.24Å; L286-I332 HydrophobicContact CD1-CG2 3.51Å; L286-I332 HydrophobicContact CG-CB 4.01Å; L286-I332 HydrophobicContact CG-CG2 3.82Å; L286-I332 PolarHBondContact N-O 3.32Å; L286-L334 HydrophobicContact CD2-CD2 4.07Å; L286-I342 HydrophobicContact CD2-CG2 4.25Å; L286-L393 HydrophobicContact CB-CD2 4.27Å; L286-L393 HydrophobicContact CD1-CD1 4.1Å; L286-L393 HydrophobicContact CD1-CD2 4.19Å
287	Y	97.8	Very high	97	Very high	82 Å²	82	50.5 Å²	50.5	32%	0.322	26%	0.257	S	S	.	.	H	α-helix	trans	-64	-49.6	173.4	-177.8	-105.1	0	0	0	111.9	N285 L289 I290 K291 P329 E330	N285-Y287 VanDerWaalsContact C-N 3.31Å; N285-Y287 PolarHBondContact O-N 2.79Å; N285-Y287 PolarHBondContact OD1-N 3.5Å; Y287-L289 PolarHBondContact O-N 2.87Å; Y287-I290 WeakPolarHBondContact O-CB 3.45Å; Y287-I290 PolarHBondContact O-N 3.49Å; Y287-I290 VanDerWaalsContact O-N 3.11Å; Y287-K291 WeakPolarHBondContact O-CB 3.33Å; Y287-K291 PolarHBondContact O-N 3.08Å; Y287-P329 PolarHBondContact N-O 3.22Å; Y287-E330 HydrophobicContact CG-CG 4.33Å
288	E	97.3	Very high	97	Very high	57 Å²	57	51.6 Å²	51.6	27%	0.266	26%	0.262	S	S	.	.	H	α-helix	trans	-64.5	-26.1	174.8	-71.9	-62	136.3	0	0	111.8	V284 N285 K291 K292	V284-E288 HydrophobicContact CB-CB 4.35Å; N285-E288 PolarHBondContact O-N 2.86Å; N285-E288 PolarHBondContact OD1-N 3.24Å; E288-K291 VanDerWaalsContact CD-NZ 3.3Å; E288-K291 IonicContact OE1-NZ 3.85Å; E288-K291 PolarHBondContact OE1-NZ 2.67Å; E288-K291 IonicContact OE2-NZ 2.69Å; E288-K291 PolarHBondContact OE2-NZ 3.35Å; E288-K292 VanDerWaalsContact O-CB 3.31Å; E288-K292 WeakPolarHBondContact O-CB 3.2Å; E288-K292 WeakPolarHBondContact O-CG 3.35Å; E288-K292 PolarHBondContact O-N 2.68Å
289	L	96.6	Very high	96.9	Very high	39 Å²	39	55.3 Å²	55.3	20%	0.204	29%	0.288	C	S	.	.	H	α-helix	trans	-69	-44	170.3	-168.7	65.9	0	0	0	112.3	N285 L286 Y287 K291 K292 N293 F298 F306 L334	N285-L289 PolarHBondContact O-N 3.23Å; N285-L289 VanDerWaalsContact O-N 3.11Å; L286-L289 HydrophobicContact CD2-CD2 3.9Å; L286-L289 WeakPolarHBondContact O-CB 3.36Å; L286-L289 PolarHBondContact O-N 2.77Å; Y287-L289 PolarHBondContact O-N 2.87Å; L289-K291 VanDerWaalsContact C-N 3.33Å; L289-K291 PolarHBondContact O-N 3.37Å; L289-K292 PolarHBondContact O-N 3.13Å; L289-N293 WeakPolarHBondContact O-CB 3.49Å; L289-N293 PolarHBondContact O-N 3.19Å; L289-F298 HydrophobicContact CB-CZ 4.38Å; L289-F298 HydrophobicContact CD2-CZ 4.11Å; L289-F298 HydrophobicContact CG-CE1 4.33Å; L289-F298 HydrophobicContact CG-CE2 4.49Å; L289-F298 HydrophobicContact CG-CZ 3.75Å; L289-F306 HydrophobicContact CD2-CE2 4.37Å; L289-F306 HydrophobicContact CD2-CZ 4.19Å; L289-L334 HydrophobicContact CD1-CD1 4.26Å; L289-L334 HydrophobicContact CD2-CD1 4.31Å; L289-L334 HydrophobicContact CD2-CD2 4.29Å
290	I	98.1	Very high	96.9	Very high	1 Å²	1	56 Å²	56	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-58.5	-47.2	174.5	-66.7	160.1	0	0	0	110.2	L286 Y287 N293 N294 F295 F298 E392 L393	L286-I290 WeakPolarHBondContact O-CG1 3.43Å; L286-I290 PolarHBondContact O-N 2.97Å; Y287-I290 WeakPolarHBondContact O-CB 3.45Å; Y287-I290 PolarHBondContact O-N 3.49Å; Y287-I290 VanDerWaalsContact O-N 3.11Å; I290-N293 CarbonylContact O-C 3.48Å; I290-N293 WeakPolarHBondContact O-CA 3.44Å; I290-N293 PolarHBondContact O-N 3.28Å; I290-N293 VanDerWaalsContact O-N 3.12Å; I290-N294 PolarHBondContact O-N 3.11Å; I290-F295 HydrophobicContact CG2-CD1 3.68Å; I290-F295 HydrophobicContact CG2-CE1 4.26Å; I290-F295 HydrophobicContact CG2-CG 4.39Å; I290-F295 PolarHBondContact O-N 2.89Å; I290-F298 HydrophobicContact CB-CE2 4.49Å; I290-F298 HydrophobicContact CG1-CE2 3.67Å; I290-F298 HydrophobicContact CG1-CZ 4.29Å; I290-E392 HydrophobicContact CD1-CG 3.93Å; I290-L393 HydrophobicContact CD1-CD2 4.03Å; I290-L393 HydrophobicContact CG1-CD2 4.08Å
291	K	97.9	Very high	96.9	Very high	86 Å²	86	57 Å²	57	37%	0.374	31%	0.306	S	S	.	.	H	α-helix	trans	-62.6	-44.3	178.7	-179.6	179.5	163.1	-151.6	0	112.4	Y287 E288 L289 N293 N294 F295	Y287-K291 WeakPolarHBondContact O-CB 3.33Å; Y287-K291 PolarHBondContact O-N 3.08Å; E288-K291 VanDerWaalsContact CD-NZ 3.3Å; E288-K291 IonicContact OE1-NZ 3.85Å; E288-K291 PolarHBondContact OE1-NZ 2.67Å; E288-K291 IonicContact OE2-NZ 2.69Å; E288-K291 PolarHBondContact OE2-NZ 3.35Å; L289-K291 VanDerWaalsContact C-N 3.33Å; L289-K291 PolarHBondContact O-N 3.37Å; K291-N293 PolarHBondContact O-N 3.3Å; K291-N294 WeakPolarHBondContact O-CA 3.41Å; K291-N294 PolarHBondContact O-N 3.49Å; K291-F295 HydrophobicContact CB-CE1 4.34Å; K291-F295 HydrophobicContact CB-CE2 4.4Å; K291-F295 HydrophobicContact CB-CZ 3.89Å; K291-F295 HydrophobicContact CG-CE2 4.23Å; K291-F295 HydrophobicContact CG-CZ 3.92Å
292	K	96.9	Very high	96.8	Very high	136 Å²	136	55.9 Å²	55.9	59%	0.591	30%	0.301	S	S	*	.	H	α-helix	trans	-62.6	-27.3	172.8	-77.4	175.5	-177.1	-170.5	0	113.1	E288 L289 N294	E288-K292 VanDerWaalsContact O-CB 3.31Å; E288-K292 WeakPolarHBondContact O-CB 3.2Å; E288-K292 WeakPolarHBondContact O-CG 3.35Å; E288-K292 PolarHBondContact O-N 2.68Å; L289-K292 PolarHBondContact O-N 3.13Å; K292-N294 PolarHBondContact O-N 2.64Å
293	N	96.8	Very high	96.9	Very high	60 Å²	60	54.5 Å²	54.5	32%	0.321	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	19.4	171.8	-166.4	51.3	0	0	0	112.9	L289 I290 K291 F295 Q296 G297 F298	L289-N293 WeakPolarHBondContact O-CB 3.49Å; L289-N293 PolarHBondContact O-N 3.19Å; I290-N293 CarbonylContact O-C 3.48Å; I290-N293 WeakPolarHBondContact O-CA 3.44Å; I290-N293 PolarHBondContact O-N 3.28Å; I290-N293 VanDerWaalsContact O-N 3.12Å; K291-N293 PolarHBondContact O-N 3.3Å; N293-F295 PolarHBondContact O-N 3.06Å; N293-F295 VanDerWaalsContact O-N 3.08Å; N293-Q296 WeakPolarHBondContact O-CB 3.31Å; N293-Q296 WeakPolarHBondContact O-CG 3.35Å; N293-Q296 PolarHBondContact O-N 2.97Å; N293-Q296 VanDerWaalsContact O-N 3.08Å; N293-G297 PolarHBondContact ND2-O 2.67Å; N293-F298 HydrophobicContact CB-CE1 3.65Å; N293-F298 HydrophobicContact CB-CZ 3.98Å; N293-F298 WeakPolarHBondContact ND2-CE1 3.47Å
294	N	97.8	Very high	96.9	Very high	119 Å²	119	54 Å²	54	64%	0.636	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	35.4	177.2	-60.4	-54.5	0	0	0	114	I290 K291 K292 Q296	I290-N294 PolarHBondContact O-N 3.11Å; K291-N294 WeakPolarHBondContact O-CA 3.41Å; K291-N294 PolarHBondContact O-N 3.49Å; K292-N294 PolarHBondContact O-N 2.64Å; N294-Q296 HydrophobicContact CB-CG 4.39Å; N294-Q296 PolarHBondContact O-N 3.41Å; N294-Q296 VanDerWaalsContact O-N 3.13Å; N294-Q296 PolarHBondContact O-NE2 3.28Å
295	F	97.8	Very high	96.9	Very high	65 Å²	65	56 Å²	56	29%	0.285	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	28.7	-179.6	-49.4	-90.1	0	0	0	113.8	I290 K291 N293 G297 G396 Y397	I290-F295 HydrophobicContact CG2-CD1 3.68Å; I290-F295 HydrophobicContact CG2-CE1 4.26Å; I290-F295 HydrophobicContact CG2-CG 4.39Å; I290-F295 PolarHBondContact O-N 2.89Å; K291-F295 HydrophobicContact CB-CE1 4.34Å; K291-F295 HydrophobicContact CB-CE2 4.4Å; K291-F295 HydrophobicContact CB-CZ 3.89Å; K291-F295 HydrophobicContact CG-CE2 4.23Å; K291-F295 HydrophobicContact CG-CZ 3.92Å; N293-F295 PolarHBondContact O-N 3.06Å; N293-F295 VanDerWaalsContact O-N 3.08Å; F295-G297 VanDerWaalsContact C-N 3.29Å; F295-G297 PolarHBondContact O-N 2.86Å; F295-G396 WeakPolarHBondContact CD1-O 3.48Å; F295-Y397 HydrophobicContact CB-CE1 4.23Å; F295-Y397 HydrophobicContact CB-CE2 4.07Å
296	Q	97.6	Very high	96.9	Very high	128 Å²	128	54.6 Å²	54.6	60%	0.598	27%	0.273	S	S	*	.			trans	-83.1	-2	178.9	-61.2	-52.7	-73.3	0	0	114.1	N293 N294	N293-Q296 WeakPolarHBondContact O-CB 3.31Å; N293-Q296 WeakPolarHBondContact O-CG 3.35Å; N293-Q296 PolarHBondContact O-N 2.97Å; N293-Q296 VanDerWaalsContact O-N 3.08Å; N294-Q296 HydrophobicContact CB-CG 4.39Å; N294-Q296 PolarHBondContact O-N 3.41Å; N294-Q296 VanDerWaalsContact O-N 3.13Å; N294-Q296 PolarHBondContact O-NE2 3.28Å
297	G	97.1	Very high	96.9	Very high	12 Å²	12	54.6 Å²	54.6	12%	0.124	27%	0.273	C	S	.	.			trans	72.7	169.2	-173.8	0	0	0	0	0	113.8	N293 F295 Y394	N293-G297 PolarHBondContact ND2-O 2.67Å; F295-G297 VanDerWaalsContact C-N 3.29Å; F295-G297 PolarHBondContact O-N 2.86Å; G297-Y394 VanDerWaalsContact CA-O 3.28Å; G297-Y394 WeakPolarHBondContact CA-O 3.29Å
298	F	97.6	Very high	96.9	Very high	24 Å²	24	54 Å²	54	11%	0.105	27%	0.272	C	S	.	.			trans	-113.8	160.2	-177.7	-62.5	-60.5	0	0	0	112.8	L289 I290 N293 L302 I303 L393	L289-F298 HydrophobicContact CB-CZ 4.38Å; L289-F298 HydrophobicContact CD2-CZ 4.11Å; L289-F298 HydrophobicContact CG-CE1 4.33Å; L289-F298 HydrophobicContact CG-CE2 4.49Å; L289-F298 HydrophobicContact CG-CZ 3.75Å; I290-F298 HydrophobicContact CB-CE2 4.49Å; I290-F298 HydrophobicContact CG1-CE2 3.67Å; I290-F298 HydrophobicContact CG1-CZ 4.29Å; N293-F298 HydrophobicContact CB-CE1 3.65Å; N293-F298 HydrophobicContact CB-CZ 3.98Å; N293-F298 WeakPolarHBondContact ND2-CE1 3.47Å; F298-L302 HydrophobicContact CB-CD2 4.06Å; F298-L302 HydrophobicContact CD1-CD2 3.84Å; F298-L302 HydrophobicContact CG-CD2 3.95Å; F298-I303 HydrophobicContact CB-CD1 3.99Å; F298-I303 HydrophobicContact CB-CG1 3.82Å; F298-I303 VanDerWaalsContact O-CD1 3.28Å; F298-I303 WeakPolarHBondContact O-CD1 3.25Å; F298-L393 WeakPolarHBondContact CB-O 3.43Å; F298-L393 HydrophobicContact CD2-CB 4.23Å; F298-L393 HydrophobicContact CD2-CD2 3.8Å; F298-L393 VanDerWaalsContact CD2-O 3.29Å; F298-L393 WeakPolarHBondContact CD2-O 3.39Å; F298-L393 HydrophobicContact CE2-CD2 3.76Å; F298-L393 PolarHBondContact N-O 3.17Å
299	S	96.9	Very high	96.8	Very high	78 Å²	78	51.3 Å²	51.3	55%	0.545	26%	0.26	S	S	.	.			trans	-66.9	142.6	173.7	68.3	0	0	0	0	111.2	A301 L302 I303	S299-A301 PolarHBondContact O-N 3Å; S299-L302 WeakPolarHBondContact O-CB 3.4Å; S299-L302 PolarHBondContact O-N 3.06Å; S299-I303 WeakPolarHBondContact O-CG1 3.42Å; S299-I303 PolarHBondContact O-N 2.88Å
300	L	96.2	Very high	96.9	Very high	30 Å²	30	49.5 Å²	49.5	16%	0.157	25%	0.25	C	S	.	.	H	α-helix	trans	-55.1	-27.6	176.5	-68.5	171.8	0	0	0	112.6	I303 R304 Y394 D466 F469 W495	L300-I303 PolarHBondContact O-N 2.77Å; L300-R304 WeakPolarHBondContact O-CB 3.29Å; L300-R304 PolarHBondContact O-N 2.9Å; L300-Y394 HydrophobicContact CD1-CE2 4.25Å; L300-Y394 HydrophobicContact CD2-CD2 3.51Å; L300-Y394 HydrophobicContact CD2-CE2 3.64Å; L300-Y394 HydrophobicContact CD2-CG 4.31Å; L300-Y394 HydrophobicContact CG-CD2 3.99Å; L300-Y394 HydrophobicContact CG-CE2 3.66Å; L300-D466 HydrophobicContact CD1-CB 3.99Å; L300-D466 VanDerWaalsContact CD1-OD2 3.3Å; L300-D466 WeakPolarHBondContact CD1-OD2 3.49Å; L300-F469 HydrophobicContact CD2-CB 4.32Å; L300-F469 HydrophobicContact CD2-CD1 3.61Å; L300-F469 HydrophobicContact CD2-CD2 4.03Å; L300-F469 HydrophobicContact CD2-CE1 3.82Å; L300-F469 HydrophobicContact CD2-CE2 4.21Å; L300-F469 HydrophobicContact CD2-CG 3.72Å; L300-F469 HydrophobicContact CD2-CZ 4.11Å; L300-W495 HydrophobicContact CD2-CZ2 4.42Å
301	A	94.9	Very high	96.9	Very high	59 Å²	59	49.4 Å²	49.4	49%	0.488	25%	0.25	S	S	.	.	H	α-helix	trans	-68.1	-34.1	174.8	0	0	0	0	0	113.6	S299	S299-A301 PolarHBondContact O-N 3Å
302	L	95	Very high	96.8	Very high	36 Å²	36	48.4 Å²	48.4	19%	0.188	24%	0.244	C	C	.	.	H	α-helix	trans	-74.3	-46.4	171.8	177.1	59.9	0	0	0	110.7	F298 S299 R304 R305 F306	F298-L302 HydrophobicContact CB-CD2 4.06Å; F298-L302 HydrophobicContact CD1-CD2 3.84Å; F298-L302 HydrophobicContact CG-CD2 3.95Å; S299-L302 WeakPolarHBondContact O-CB 3.4Å; S299-L302 PolarHBondContact O-N 3.06Å; L302-R304 VanDerWaalsContact C-N 3.32Å; L302-R304 PolarHBondContact O-N 2.9Å; L302-R305 VanDerWaalsContact CD1-NH2 3.25Å; L302-R305 WeakPolarHBondContact O-CB 3.42Å; L302-R305 PolarHBondContact O-N 3.02Å; L302-F306 HydrophobicContact CD1-CD2 4.37Å; L302-F306 HydrophobicContact CD1-CE1 4.09Å; L302-F306 HydrophobicContact CD1-CE2 3.76Å; L302-F306 HydrophobicContact CD1-CZ 3.62Å; L302-F306 HydrophobicContact CD2-CE2 4.04Å; L302-F306 HydrophobicContact CD2-CZ 4.39Å; L302-F306 HydrophobicContact CG-CD2 4.17Å; L302-F306 HydrophobicContact CG-CE2 3.66Å; L302-F306 HydrophobicContact CG-CZ 4.05Å; L302-F306 PolarHBondContact O-N 2.96Å; L302-F306 VanDerWaalsContact O-N 3.13Å
303	I	97.1	Very high	96.8	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.6	-39.9	-177.7	-60.8	168.3	0	0	0	110.9	F298 S299 L300 R305 F306 A307 L390 L393 Y394 F469 W495	F298-I303 HydrophobicContact CB-CD1 3.99Å; F298-I303 HydrophobicContact CB-CG1 3.82Å; F298-I303 VanDerWaalsContact O-CD1 3.28Å; F298-I303 WeakPolarHBondContact O-CD1 3.25Å; S299-I303 WeakPolarHBondContact O-CG1 3.42Å; S299-I303 PolarHBondContact O-N 2.88Å; L300-I303 PolarHBondContact O-N 2.77Å; I303-R305 VanDerWaalsContact C-N 3.3Å; I303-R305 PolarHBondContact O-N 3.02Å; I303-F306 CarbonylContact O-C 3.36Å; I303-F306 PolarHBondContact O-N 3.46Å; I303-A307 WeakPolarHBondContact O-CB 3.07Å; I303-A307 PolarHBondContact O-N 3.35Å; I303-L390 HydrophobicContact CG2-CB 4.27Å; I303-L390 HydrophobicContact CG2-CD2 3.77Å; I303-L393 HydrophobicContact CD1-CB 4.28Å; I303-L393 HydrophobicContact CG1-CB 4.08Å; I303-L393 HydrophobicContact CG2-CB 4.46Å; I303-Y394 VanDerWaalsContact CD1-CA 3.41Å; I303-Y394 HydrophobicContact CD1-CD2 3.72Å; I303-Y394 HydrophobicContact CD1-CG 4.2Å; I303-F469 HydrophobicContact CG2-CE2 4.49Å; I303-W495 HydrophobicContact CG2-CH2 4.14Å; I303-W495 HydrophobicContact CG2-CZ2 4.45Å
304	R	96.5	Very high	96.9	Very high	30 Å²	30	39.4 Å²	39.4	11%	0.113	20%	0.202	C	C	.	.	H	α-helix	trans	-62.1	-33.3	174.4	-170.9	-175.5	-68.2	114.6	-7.2	113.2	L300 L302 H308 W495 I496 G499	L300-R304 WeakPolarHBondContact O-CB 3.29Å; L300-R304 PolarHBondContact O-N 2.9Å; L302-R304 VanDerWaalsContact C-N 3.32Å; L302-R304 PolarHBondContact O-N 2.9Å; R304-H308 WeakPolarHBondContact O-CB 3.37Å; R304-H308 PolarHBondContact O-N 3.42Å; R304-W495 HydrophobicContact CB-CH2 4.15Å; R304-W495 HydrophobicContact CB-CZ2 3.93Å; R304-W495 WeakPolarHBondContact CD-O 3.39Å; R304-W495 HydrophobicContact CG-CZ2 4.42Å; R304-W495 PolarHBondContact NE-O 3.41Å; R304-I496 HydrophobicContact CG-CD1 4.15Å; R304-G499 VanDerWaalsContact CD-CA 3.43Å
305	R	94.8	Very high	96.8	Very high	98 Å²	98	34.4 Å²	34.4	37%	0.37	18%	0.175	S	C	.	.	H	α-helix	trans	-67	-45.6	172.1	-75.8	-170	-63.2	144.6	-4.1	111.4	L302 I303 H308 A309 F501	L302-R305 VanDerWaalsContact CD1-NH2 3.25Å; L302-R305 WeakPolarHBondContact O-CB 3.42Å; L302-R305 PolarHBondContact O-N 3.02Å; I303-R305 VanDerWaalsContact C-N 3.3Å; I303-R305 PolarHBondContact O-N 3.02Å; R305-H308 PolarHBondContact O-N 3.49Å; R305-A309 WeakPolarHBondContact O-CB 3.01Å; R305-A309 PolarHBondContact O-N 2.77Å; R305-F501 HydrophobicContact CB-CZ 4.35Å; R305-F501 HydrophobicContact CG-CD1 4.21Å; R305-F501 HydrophobicContact CG-CE1 3.3Å; R305-F501 HydrophobicContact CG-CE2 4.36Å; R305-F501 HydrophobicContact CG-CZ 3.4Å; R305-F501 VanDerWaalsContact CG-CZ 3.4Å
306	F	97	Very high	96.7	Very high	7 Å²	7	31.7 Å²	31.7	3%	0.031	16%	0.163	C	C	.	.	H	α-helix	trans	-63.5	-43.6	175.1	-63.9	-32.5	0	0	0	111.5	L286 L289 L302 I303 H308 A309 L310 L334 I342 L393	L286-F306 HydrophobicContact CD1-CD2 4.4Å; L286-F306 HydrophobicContact CD2-CD2 4.45Å; L286-F306 HydrophobicContact CD2-CE1 4.37Å; L286-F306 HydrophobicContact CD2-CE2 3.92Å; L286-F306 HydrophobicContact CD2-CZ 3.87Å; L289-F306 HydrophobicContact CD2-CE2 4.37Å; L289-F306 HydrophobicContact CD2-CZ 4.19Å; L302-F306 HydrophobicContact CD1-CD2 4.37Å; L302-F306 HydrophobicContact CD1-CE1 4.09Å; L302-F306 HydrophobicContact CD1-CE2 3.76Å; L302-F306 HydrophobicContact CD1-CZ 3.62Å; L302-F306 HydrophobicContact CD2-CE2 4.04Å; L302-F306 HydrophobicContact CD2-CZ 4.39Å; L302-F306 HydrophobicContact CG-CD2 4.17Å; L302-F306 HydrophobicContact CG-CE2 3.66Å; L302-F306 HydrophobicContact CG-CZ 4.05Å; L302-F306 PolarHBondContact O-N 2.96Å; L302-F306 VanDerWaalsContact O-N 3.13Å; I303-F306 CarbonylContact O-C 3.36Å; I303-F306 PolarHBondContact O-N 3.46Å; F306-H308 PolarHBondContact O-N 3.49Å; F306-A309 PolarHBondContact O-N 3.1Å; F306-L310 WeakPolarHBondContact O-CB 3.06Å; F306-L310 VanDerWaalsContact O-CG 3.26Å; F306-L310 WeakPolarHBondContact O-CG 3.47Å; F306-L310 PolarHBondContact O-N 2.83Å; F306-L334 HydrophobicContact CE1-CD2 4.28Å; F306-L334 HydrophobicContact CZ-CD2 4.21Å; F306-I342 HydrophobicContact CB-CD1 4.28Å; F306-I342 HydrophobicContact CD1-CD1 4.14Å; F306-I342 HydrophobicContact CD1-CG1 4.33Å; F306-I342 HydrophobicContact CD1-CG2 3.65Å; F306-I342 HydrophobicContact CE1-CG2 3.55Å; F306-I342 HydrophobicContact CZ-CG2 4.46Å; F306-L393 HydrophobicContact CD2-CD1 4.25Å
307	A	97.9	Very high	96.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-57.2	-50.6	175.6	0	0	0	0	0	112	I303 A309 L310 L311 L390 W495 I496	I303-A307 WeakPolarHBondContact O-CB 3.07Å; I303-A307 PolarHBondContact O-N 3.35Å; A307-A309 VanDerWaalsContact C-N 3.32Å; A307-A309 PolarHBondContact O-N 2.88Å; A307-L310 PolarHBondContact O-N 2.89Å; A307-L311 WeakPolarHBondContact O-CB 3.43Å; A307-L311 WeakPolarHBondContact O-CG 3.36Å; A307-L311 PolarHBondContact O-N 3.43Å; A307-L390 HydrophobicContact CB-CD1 3.7Å; A307-L390 HydrophobicContact CB-CD2 3.71Å; A307-L390 HydrophobicContact CB-CG 4.37Å; A307-W495 HydrophobicContact CB-CH2 3.81Å; A307-W495 HydrophobicContact CB-CZ3 3.57Å; A307-I496 HydrophobicContact CB-CD1 3.79Å
308	H	96.6	Very high	96.7	Very high	68 Å²	68	27.3 Å²	27.3	32%	0.315	14%	0.14	S	C	.	.	H	α-helix	trans	-59.2	-43	175.9	-177.5	-74.1	0	0	0	111.9	R304 R305 F306 R312 I496	R304-H308 WeakPolarHBondContact O-CB 3.37Å; R304-H308 PolarHBondContact O-N 3.42Å; R305-H308 PolarHBondContact O-N 3.49Å; F306-H308 PolarHBondContact O-N 3.49Å; H308-R312 WeakPolarHBondContact O-CG 3.45Å; H308-R312 PolarHBondContact O-N 2.86Å; H308-R312 VanDerWaalsContact O-N 3.11Å; H308-I496 HydrophobicContact CB-CG2 4.44Å
309	A	95.9	Very high	96.7	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-66.6	-38.6	179	0	0	0	0	0	113.2	N261 R305 F306 A307 R312 C313 I342	N261-A309 VanDerWaalsContact ND2-CA 3.33Å; N261-A309 WeakPolarHBondContact ND2-CA 3.35Å; N261-A309 VanDerWaalsContact ND2-CB 3.35Å; N261-A309 WeakPolarHBondContact ND2-CB 3.49Å; N261-A309 PolarHBondContact ND2-O 2.72Å; N261-A309 VanDerWaalsContact ND2-O 3.1Å; R305-A309 WeakPolarHBondContact O-CB 3.01Å; R305-A309 PolarHBondContact O-N 2.77Å; F306-A309 PolarHBondContact O-N 3.1Å; A307-A309 VanDerWaalsContact C-N 3.32Å; A307-A309 PolarHBondContact O-N 2.88Å; A309-R312 PolarHBondContact O-N 3.04Å; A309-C313 PolarHBondContact O-N 3.5Å; A309-I342 HydrophobicContact CB-CD1 3.73Å; A309-I342 HydrophobicContact CB-CG1 3.64Å
310	L	98.1	Very high	96.6	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-69	-43.7	174.2	-69.5	169.7	0	0	0	111.9	F306 A307 R312 C313 L314 I332 I342 V344 L386	F306-L310 WeakPolarHBondContact O-CB 3.06Å; F306-L310 VanDerWaalsContact O-CG 3.26Å; F306-L310 WeakPolarHBondContact O-CG 3.47Å; F306-L310 PolarHBondContact O-N 2.83Å; A307-L310 PolarHBondContact O-N 2.89Å; L310-R312 PolarHBondContact O-N 2.98Å; L310-C313 WeakPolarHBondContact O-CA 3.38Å; L310-C313 WeakPolarHBondContact O-CB 3.48Å; L310-C313 PolarHBondContact O-N 3.14Å; L310-L314 WeakPolarHBondContact O-CG 3.48Å; L310-L314 PolarHBondContact O-N 3.44Å; L310-I332 HydrophobicContact CD1-CD1 3.93Å; L310-I332 HydrophobicContact CD2-CD1 3.62Å; L310-I332 HydrophobicContact CD2-CG1 3.84Å; L310-I332 HydrophobicContact CD2-CG2 4.04Å; L310-I332 HydrophobicContact CG-CD1 4.43Å; L310-I342 HydrophobicContact CD2-CD1 3.9Å; L310-I342 HydrophobicContact CG-CD1 3.77Å; L310-V344 HydrophobicContact CD2-CG2 3.68Å; L310-L386 HydrophobicContact CB-CD1 3.79Å; L310-L386 HydrophobicContact CD1-CD1 3.54Å; L310-L386 HydrophobicContact CG-CD1 4.3Å
311	L	98	Very high	96.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-58.6	-34.9	175.1	-74.5	166.2	0	0	0	112	A307 L314 Q315 M383 L386 F472 P487 L491 I496	A307-L311 WeakPolarHBondContact O-CB 3.43Å; A307-L311 WeakPolarHBondContact O-CG 3.36Å; A307-L311 PolarHBondContact O-N 3.43Å; L311-L314 PolarHBondContact O-N 2.98Å; L311-Q315 WeakPolarHBondContact O-CB 3.47Å; L311-Q315 PolarHBondContact O-N 3.25Å; L311-M383 HydrophobicContact CD2-CE 3.89Å; L311-M383 HydrophobicContact CD2-SD 4.08Å; L311-L386 HydrophobicContact CD2-CD2 3.75Å; L311-L386 HydrophobicContact CG-CD2 4.09Å; L311-F472 HydrophobicContact CD1-CE2 4.26Å; L311-F472 HydrophobicContact CD1-CZ 4Å; L311-F472 HydrophobicContact CD2-CZ 4.42Å; L311-P487 HydrophobicContact CD2-CB 4.48Å; L311-L491 HydrophobicContact CB-CD1 4.49Å; L311-L491 HydrophobicContact CB-CD2 3.64Å; L311-L491 HydrophobicContact CB-CG 3.82Å; L311-L491 HydrophobicContact CD1-CD2 4.08Å; L311-L491 HydrophobicContact CD1-CG 4.29Å; L311-I496 HydrophobicContact CD1-CD1 4.02Å; L311-I496 HydrophobicContact CD1-CG1 3.98Å
312	R	95.6	Very high	96.8	Very high	65 Å²	65	31.3 Å²	31.3	25%	0.245	13%	0.132	C	C	.	.	H	α-helix	trans	-66.3	-36.8	173.9	-73	-67.8	-61.2	174.4	-3.8	113.3	H260 H308 A309 L310 M316 L491	H260-R312 PolarHBondContact NE2-NH2 2.72Å; H308-R312 WeakPolarHBondContact O-CG 3.45Å; H308-R312 PolarHBondContact O-N 2.86Å; H308-R312 VanDerWaalsContact O-N 3.11Å; A309-R312 PolarHBondContact O-N 3.04Å; L310-R312 PolarHBondContact O-N 2.98Å; R312-M316 PolarHBondContact O-N 3.41Å; R312-L491 HydrophobicContact CG-CD2 4.34Å
313	C	97.2	Very high	97	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.9	-55.1	169.5	169	0	0	0	0	110.6	H260 V262 A309 L310 Q315 M316 L317 V344	H260-C313 WeakPolarHBondContact O-CA 3.46Å; H260-C313 VanDerWaalsContact O-CB 3.24Å; H260-C313 WeakPolarHBondContact O-CB 3.45Å; H260-C313 PolarHBondContact O-N 2.81Å; V262-C313 HydrophobicContact CG2-CB 4.06Å; V262-C313 VanDerWaalsContact CG2-SG 3.57Å; A309-C313 PolarHBondContact O-N 3.5Å; L310-C313 WeakPolarHBondContact O-CA 3.38Å; L310-C313 WeakPolarHBondContact O-CB 3.48Å; L310-C313 PolarHBondContact O-N 3.14Å; C313-Q315 VanDerWaalsContact C-N 3.28Å; C313-Q315 PolarHBondContact O-N 2.79Å; C313-M316 WeakPolarHBondContact O-CB 3.39Å; C313-M316 PolarHBondContact O-N 3.23Å; C313-L317 PolarHBondContact O-N 3.31Å; C313-V344 HydrophobicContact CB-CG2 4.02Å
314	L	98.3	Very high	97	Very high	7 Å²	7	29.6 Å²	29.6	4%	0.037	12%	0.123	C	C	.	.	H	α-helix	trans	-61.7	-34.3	-177.3	-62.5	-177.9	0	0	0	112.5	L310 L311 M316 L317 H318 L327 D382 M383 L386 P487	L310-L314 WeakPolarHBondContact O-CG 3.48Å; L310-L314 PolarHBondContact O-N 3.44Å; L311-L314 PolarHBondContact O-N 2.98Å; L314-M316 VanDerWaalsContact C-N 3.33Å; L314-M316 PolarHBondContact O-N 2.71Å; L314-L317 HydrophobicContact CD2-CD1 4.35Å; L314-L317 PolarHBondContact O-N 2.77Å; L314-H318 WeakPolarHBondContact O-CB 3.41Å; L314-H318 PolarHBondContact O-N 3.08Å; L314-L327 HydrophobicContact CD1-CD2 4.38Å; L314-L327 HydrophobicContact CD2-CD2 4.34Å; L314-D382 HydrophobicContact CD2-CB 3.81Å; L314-M383 HydrophobicContact CD1-SD 3.7Å; L314-L386 HydrophobicContact CD1-CB 4.26Å; L314-L386 HydrophobicContact CD1-CD2 4.09Å; L314-P487 HydrophobicContact CB-CB 3.93Å; L314-P487 HydrophobicContact CB-CG 3.65Å
315	Q	97.1	Very high	97.1	Very high	14 Å²	14	28.2 Å²	28.2	7%	0.065	12%	0.118	C	C	.	.	H	α-helix	trans	-62	-37.4	173.4	-179.9	180	58.6	0	0	112.3	L311 C313 R319 P487 D488 L491	L311-Q315 WeakPolarHBondContact O-CB 3.47Å; L311-Q315 PolarHBondContact O-N 3.25Å; C313-Q315 VanDerWaalsContact C-N 3.28Å; C313-Q315 PolarHBondContact O-N 2.79Å; Q315-R319 VanDerWaalsContact CD-NH2 3.26Å; Q315-R319 WeakPolarHBondContact O-CD 3.39Å; Q315-R319 VanDerWaalsContact O-CG 3.29Å; Q315-R319 WeakPolarHBondContact O-CG 3.36Å; Q315-R319 PolarHBondContact O-N 3.45Å; Q315-P487 HydrophobicContact CB-CB 4.04Å; Q315-D488 PolarHBondContact NE2-OD1 2.94Å; Q315-L491 HydrophobicContact CB-CD1 4.29Å; Q315-L491 VanDerWaalsContact CD-CD1 3.44Å; Q315-L491 HydrophobicContact CG-CD1 4.4Å
316	M	96	Very high	97.2	Very high	7 Å²	7	23.8 Å²	23.8	3%	0.034	10%	0.101	C	C	.	.	H	α-helix	trans	-70	-48.7	174.5	-175.6	-164.8	68	0	0	111	I251 D255 H260 V262 R312 C313 L314 H318 R319 E320	I251-M316 HydrophobicContact CB-CE 4.38Å; I251-M316 HydrophobicContact CG1-CE 3.87Å; I251-M316 HydrophobicContact CG2-CE 4.01Å; D255-M316 HydrophobicContact CB-SD 4.05Å; H260-M316 HydrophobicContact CB-CB 4.11Å; H260-M316 HydrophobicContact CB-CE 4.49Å; H260-M316 HydrophobicContact CB-CG 4.4Å; H260-M316 HydrophobicContact CB-SD 3.7Å; V262-M316 HydrophobicContact CB-CE 4.38Å; V262-M316 HydrophobicContact CG2-CE 3.58Å; R312-M316 PolarHBondContact O-N 3.41Å; C313-M316 WeakPolarHBondContact O-CB 3.39Å; C313-M316 PolarHBondContact O-N 3.23Å; L314-M316 VanDerWaalsContact C-N 3.33Å; L314-M316 PolarHBondContact O-N 2.71Å; M316-H318 VanDerWaalsContact C-N 3.27Å; M316-H318 PolarHBondContact O-N 3.4Å; M316-R319 PolarHBondContact O-N 2.99Å; M316-R319 VanDerWaalsContact O-N 3.12Å; M316-E320 PolarHBondContact O-N 3.26Å; M316-E320 VanDerWaalsContact O-N 3.1Å
317	L	97.6	Very high	97.3	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.016	10%	0.1	C	C	.	.	H	α-helix	trans	-59.3	-39.7	178.4	-59.2	-176.6	0	0	0	111.6	I251 C313 L314 R319 E320 K321 I322 H324 F347	I251-L317 HydrophobicContact CD1-CD2 4.11Å; I251-L317 HydrophobicContact CG1-CD2 4.4Å; C313-L317 PolarHBondContact O-N 3.31Å; L314-L317 HydrophobicContact CD2-CD1 4.35Å; L314-L317 PolarHBondContact O-N 2.77Å; L317-R319 VanDerWaalsContact C-N 3.3Å; L317-R319 PolarHBondContact O-N 3.4Å; L317-E320 CarbonylContact O-C 3.51Å; L317-E320 PolarHBondContact O-N 2.81Å; L317-K321 PolarHBondContact O-N 3.06Å; L317-I322 HydrophobicContact CB-CB 4.29Å; L317-I322 HydrophobicContact CD2-CB 4.12Å; L317-I322 HydrophobicContact CD2-CD1 4.31Å; L317-I322 HydrophobicContact CD2-CG2 4.01Å; L317-I322 PolarHBondContact O-N 3.47Å; L317-H324 HydrophobicContact CD1-CB 4.22Å; L317-F347 HydrophobicContact CD1-CE1 3.99Å; L317-F347 HydrophobicContact CD1-CZ 4.42Å; L317-F347 HydrophobicContact CD2-CE1 3.8Å; L317-F347 HydrophobicContact CD2-CZ 4.38Å
318	H	97	Very high	97.3	Very high	45 Å²	45	24.1 Å²	24.1	21%	0.208	10%	0.103	C	C	.	.	H	α-helix	trans	-61.7	-33.7	176.7	-175.3	-117.7	0	0	0	113.8	L314 M316 K321 M379 P487 D488	L314-H318 WeakPolarHBondContact O-CB 3.41Å; L314-H318 PolarHBondContact O-N 3.08Å; M316-H318 VanDerWaalsContact C-N 3.27Å; M316-H318 PolarHBondContact O-N 3.4Å; H318-K321 PolarHBondContact O-NZ 2.74Å; H318-M379 HydrophobicContact CB-SD 4.42Å; H318-M379 VanDerWaalsContact CD2-CE 3.41Å; H318-M379 WeakPolarHBondContact CD2-CE 3.44Å; H318-M379 VanDerWaalsContact CD2-SD 3.53Å; H318-P487 HydrophobicContact CB-CG 4.23Å; H318-D488 IonicContact ND1-OD2 3.39Å
319	R	96	Very high	97.4	Very high	134 Å²	134	20.9 Å²	20.9	51%	0.506	9%	0.088	S	C	.	.	H	α-helix	trans	-75.6	-40.3	176.3	-72.1	168	-174.5	176.3	2.2	112.3	Q315 M316 L317 K321 D488	Q315-R319 VanDerWaalsContact CD-NH2 3.26Å; Q315-R319 WeakPolarHBondContact O-CD 3.39Å; Q315-R319 VanDerWaalsContact O-CG 3.29Å; Q315-R319 WeakPolarHBondContact O-CG 3.36Å; Q315-R319 PolarHBondContact O-N 3.45Å; M316-R319 PolarHBondContact O-N 2.99Å; M316-R319 VanDerWaalsContact O-N 3.12Å; L317-R319 VanDerWaalsContact C-N 3.3Å; L317-R319 PolarHBondContact O-N 3.4Å; R319-K321 VanDerWaalsContact C-N 3.27Å; R319-K321 PolarHBondContact O-N 3.47Å; R319-D488 IonicContact NH2-OD1 3.44Å; R319-D488 PolarHBondContact NH2-OD1 3.06Å
320	E	96.4	Very high	97.5	Very high	50 Å²	50	23.3 Å²	23.3	23%	0.234	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	3.5	178.3	-55.8	-56	132.2	0	0	113.5	V250 K254 M316 L317 I322	V250-E320 HydrophobicContact CG1-CG 4.38Å; K254-E320 WeakPolarHBondContact CD-OE1 3.34Å; K254-E320 WeakPolarHBondContact CE-OE1 3.16Å; K254-E320 WeakPolarHBondContact CE-OE2 3.3Å; K254-E320 HydrophobicContact CG-CG 4.31Å; K254-E320 IonicContact NZ-OE1 3.7Å; K254-E320 PolarHBondContact NZ-OE1 3.38Å; K254-E320 IonicContact NZ-OE2 3.59Å; K254-E320 PolarHBondContact NZ-OE2 3.38Å; M316-E320 PolarHBondContact O-N 3.26Å; M316-E320 VanDerWaalsContact O-N 3.1Å; L317-E320 CarbonylContact O-C 3.51Å; L317-E320 PolarHBondContact O-N 2.81Å; E320-I322 VanDerWaalsContact C-N 3.29Å; E320-I322 HydrophobicContact CB-CD1 3.77Å; E320-I322 HydrophobicContact CB-CG1 4.2Å; E320-I322 PolarHBondContact O-N 3.23Å
321	K	97.1	Very high	97.4	Very high	92 Å²	92	23.9 Å²	23.9	40%	0.4	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	36.9	-179.3	-55.6	-58.9	176.9	-167.8	0	114.1	L317 H318 R319 Y352 E353 M379	L317-K321 PolarHBondContact O-N 3.06Å; H318-K321 PolarHBondContact O-NZ 2.74Å; R319-K321 VanDerWaalsContact C-N 3.27Å; R319-K321 PolarHBondContact O-N 3.47Å; K321-Y352 CarbonylContact O-C 3.51Å; K321-Y352 VanDerWaalsContact O-CA 3.3Å; K321-Y352 WeakPolarHBondContact O-CA 3.31Å; K321-E353 PolarHBondContact O-N 2.76Å; K321-M379 HydrophobicContact CD-CE 3.85Å; K321-M379 HydrophobicContact CD-SD 3.84Å
322	I	97.5	Very high	97.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	135.4	175.9	-62.4	160.8	0	0	0	108.9	I247 I251 L317 E320 Y352	I247-I322 HydrophobicContact CD1-CG2 4.43Å; I247-I322 HydrophobicContact CG2-CD1 4.2Å; I247-I322 HydrophobicContact CG2-CG2 4.13Å; I251-I322 HydrophobicContact CG1-CD1 4.41Å; L317-I322 HydrophobicContact CB-CB 4.29Å; L317-I322 HydrophobicContact CD2-CB 4.12Å; L317-I322 HydrophobicContact CD2-CD1 4.31Å; L317-I322 HydrophobicContact CD2-CG2 4.01Å; L317-I322 PolarHBondContact O-N 3.47Å; E320-I322 VanDerWaalsContact C-N 3.29Å; E320-I322 HydrophobicContact CB-CD1 3.77Å; E320-I322 HydrophobicContact CB-CG1 4.2Å; E320-I322 PolarHBondContact O-N 3.23Å; I322-Y352 HydrophobicContact CD1-CE1 4.19Å; I322-Y352 HydrophobicContact CG1-CD1 3.87Å; I322-Y352 HydrophobicContact CG1-CE1 3.63Å
323	I	98.3	Very high	97.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	128.3	170.1	-47.5	175.9	0	0	0	107.1	C325 S350 C351 E353 Y377 M379 I381 D382	I323-C325 VanDerWaalsContact CG2-SG 3.51Å; I323-S350 WeakPolarHBondContact O-CA 3.45Å; I323-S350 WeakPolarHBondContact O-CB 3.28Å; I323-C351 PolarHBondContact N-O 2.74Å; I323-C351 PolarHBondContact O-N 2.83Å; I323-C351 VanDerWaalsContact O-N 3.13Å; I323-E353 HydrophobicContact CD1-CB 4.14Å; I323-E353 HydrophobicContact CD1-CG 4.42Å; I323-E353 HydrophobicContact CG1-CB 4.34Å; I323-Y377 HydrophobicContact CD1-CD2 3.9Å; I323-Y377 HydrophobicContact CD1-CE2 3.77Å; I323-M379 HydrophobicContact CG1-CG 3.78Å; I323-I381 HydrophobicContact CG2-CD1 3.58Å; I323-I381 HydrophobicContact CG2-CG1 3.67Å; I323-D382 WeakPolarHBondContact CG2-OD2 3.11Å
324	H	98.1	Very high	97.5	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	11%	0.112	C	C	.	.			trans	-69.5	-39.8	-179.4	-171.8	-94.7	0	0	0	111.6	L317 D326 L327 V344 V345 F347 S350 D382	L317-H324 HydrophobicContact CD1-CB 4.22Å; H324-D326 PolarHBondContact CE1-O 3.19Å; H324-D326 VanDerWaalsContact ND1-C 3.27Å; H324-D326 PolarHBondContact O-N 2.89Å; H324-L327 PolarHBondContact ND1-N 2.99Å; H324-L327 VanDerWaalsContact ND1-N 3.16Å; H324-V344 WeakPolarHBondContact NE2-CG1 3.24Å; H324-V345 PolarHBondContact NE2-O 3.05Å; H324-F347 AromaticContact CD2-CD1 3.95Å; H324-F347 AromaticContact CD2-CE1 3.63Å; H324-F347 AromaticContact CD2-CZ 3.78Å; H324-S350 WeakPolarHBondContact CA-OG 3.24Å; H324-S350 WeakPolarHBondContact O-CA 3.5Å; H324-S350 PolarHBondContact O-N 3.43Å; H324-S350 PolarHBondContact O-OG 2.84Å; H324-D382 PolarHBondContact N-OD2 3.06Å
325	C	97.9	Very high	97.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	11%	0.113	C	C	.	.	S	Bend	trans	66.7	-9.2	175.6	-59.9	0	0	0	0	116.8	I323 S349 I361 Q362 D382	I323-C325 VanDerWaalsContact CG2-SG 3.51Å; C325-S349 WeakPolarHBondContact CB-O 3.49Å; C325-I361 HydrophobicContact CB-CB 4.48Å; C325-I361 HydrophobicContact CB-CD1 4.25Å; C325-Q362 WeakPolarHBondContact O-CA 3.07Å; C325-Q362 VanDerWaalsContact O-CG 3.29Å; C325-Q362 WeakPolarHBondContact O-CG 3.45Å; C325-Q362 PolarHBondContact O-N 3.19Å; C325-D382 PolarHBondContact N-OD1 3.26Å; C325-D382 VanDerWaalsContact N-OD1 3.13Å
326	D	97.4	Very high	96.4	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.027	15%	0.154	C	C	.	.			trans	-146.4	50.9	171.8	-163	33.2	0	0	0	113	H324 K328 N331 S363	H324-D326 PolarHBondContact CE1-O 3.19Å; H324-D326 VanDerWaalsContact ND1-C 3.27Å; H324-D326 PolarHBondContact O-N 2.89Å; D326-K328 PolarHBondContact O-N 2.89Å; D326-K328 IonicContact OD1-NZ 3.64Å; D326-K328 IonicContact OD2-NZ 2.67Å; D326-K328 PolarHBondContact OD2-NZ 2.66Å; D326-N331 PolarHBondContact O-ND2 2.86Å; D326-S363 VanDerWaalsContact OD1-CB 3.26Å; D326-S363 WeakPolarHBondContact OD1-CB 3.29Å; D326-S363 PolarHBondContact OD1-N 2.68Å; D326-S363 PolarHBondContact OD1-OG 3.34Å
327	L	98.6	Very high	95.3	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	18%	0.184	C	C	.	.			trans	-75.3	123.5	175.9	-167.2	74.5	0	0	0	110	L314 H324 I332 V344 S385 I389	L314-L327 HydrophobicContact CD1-CD2 4.38Å; L314-L327 HydrophobicContact CD2-CD2 4.34Å; H324-L327 PolarHBondContact ND1-N 2.99Å; H324-L327 VanDerWaalsContact ND1-N 3.16Å; L327-I332 HydrophobicContact CD1-CD1 4.45Å; L327-I332 HydrophobicContact CD1-CG1 4.36Å; L327-V344 HydrophobicContact CD1-CG1 3.81Å; L327-V344 HydrophobicContact CD1-CG2 4.21Å; L327-S385 WeakPolarHBondContact O-CB 3.11Å; L327-I389 HydrophobicContact CB-CD1 4.43Å; L327-I389 HydrophobicContact CD2-CD1 3.94Å; L327-I389 HydrophobicContact CG-CD1 3.71Å
328	K	98.5	Very high	93.6	Very high	13 Å²	13	43.1 Å²	43.1	6%	0.057	20%	0.199	C	C	.	.			trans	-160.4	163.8	-176.9	63.6	-169.3	-175.8	-152.6	0	111	D326 E330 N331 S363 Y366	D326-K328 PolarHBondContact O-N 2.89Å; D326-K328 IonicContact OD1-NZ 3.64Å; D326-K328 IonicContact OD2-NZ 2.67Å; D326-K328 PolarHBondContact OD2-NZ 2.66Å; K328-E330 WeakPolarHBondContact CB-OE2 3.13Å; K328-E330 HydrophobicContact CD-CB 4.47Å; K328-E330 HydrophobicContact CG-CB 4.23Å; K328-E330 VanDerWaalsContact CG-OE2 3.28Å; K328-E330 WeakPolarHBondContact CG-OE2 3.34Å; K328-E330 PolarHBondContact O-N 3.36Å; K328-N331 WeakPolarHBondContact CE-ND2 3.34Å; K328-N331 HydrophobicContact CG-CB 3.97Å; K328-N331 PolarHBondContact O-N 3.41Å; K328-S363 WeakPolarHBondContact CD-OG 3.42Å; K328-S363 PolarHBondContact NZ-OG 3.25Å; K328-Y366 HydrophobicContact CB-CD2 3.52Å; K328-Y366 HydrophobicContact CB-CE2 3.5Å; K328-Y366 VanDerWaalsContact CB-CE2 3.5Å; K328-Y366 HydrophobicContact CB-CG 4.17Å
329	P	98.6	Very high	91.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-58.9	-29	-178.7	-23.4	35.4	0	0	0	114.1	L286 Y287 N331 I332 Y366 I389	L286-P329 HydrophobicContact CB-CB 4.07Å; L286-P329 PolarHBondContact N-O 3.46Å; Y287-P329 PolarHBondContact N-O 3.22Å; P329-N331 VanDerWaalsContact C-N 3.32Å; P329-I332 PolarHBondContact O-N 3.05Å; P329-Y366 WeakPolarHBondContact CD-OH 3.42Å; P329-Y366 HydrophobicContact CG-CE1 4.08Å; P329-I389 HydrophobicContact CG-CG1 4.26Å; P329-I389 HydrophobicContact CG-CG2 4.45Å
330	E	97.3	Very high	90.6	Very high	53 Å²	53	38.2 Å²	38.2	25%	0.248	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-68.8	-28.8	175.1	-54.8	95.3	128.2	0	0	113	N285 Y287 K328 I332 L333	N285-E330 VanDerWaalsContact CB-O 3.24Å; N285-E330 WeakPolarHBondContact CB-O 3.45Å; Y287-E330 HydrophobicContact CG-CG 4.33Å; K328-E330 WeakPolarHBondContact CB-OE2 3.13Å; K328-E330 HydrophobicContact CD-CB 4.47Å; K328-E330 HydrophobicContact CG-CB 4.23Å; K328-E330 VanDerWaalsContact CG-OE2 3.28Å; K328-E330 WeakPolarHBondContact CG-OE2 3.34Å; K328-E330 PolarHBondContact O-N 3.36Å; E330-I332 VanDerWaalsContact C-N 3.35Å; E330-L333 WeakPolarHBondContact O-CD1 3.27Å
331	N	98	Very high	90.1	Very high	13 Å²	13	39.9 Å²	39.9	7%	0.07	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-95.7	15.8	-179.2	-72.8	-1.4	0	0	0	112.7	D326 K328 P329 V345	D326-N331 PolarHBondContact O-ND2 2.86Å; K328-N331 WeakPolarHBondContact CE-ND2 3.34Å; K328-N331 HydrophobicContact CG-CB 3.97Å; K328-N331 PolarHBondContact O-N 3.41Å; P329-N331 VanDerWaalsContact C-N 3.32Å; N331-V345 HydrophobicContact CB-CG2 4.38Å; N331-V345 PolarHBondContact O-N 3.38Å
332	I	98.4	Very high	90.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	110	173.9	-56.9	160	0	0	0	107.6	N285 L286 L310 L327 P329 E330 I342 I389	N285-I332 CarbonylContact C-O 3.6Å; N285-I332 VanDerWaalsContact CA-O 3.24Å; N285-I332 WeakPolarHBondContact CA-O 3.49Å; L286-I332 HydrophobicContact CD1-CB 3.88Å; L286-I332 HydrophobicContact CD1-CD1 4.24Å; L286-I332 HydrophobicContact CD1-CG2 3.51Å; L286-I332 HydrophobicContact CG-CB 4.01Å; L286-I332 HydrophobicContact CG-CG2 3.82Å; L286-I332 PolarHBondContact N-O 3.32Å; L310-I332 HydrophobicContact CD1-CD1 3.93Å; L310-I332 HydrophobicContact CD2-CD1 3.62Å; L310-I332 HydrophobicContact CD2-CG1 3.84Å; L310-I332 HydrophobicContact CD2-CG2 4.04Å; L310-I332 HydrophobicContact CG-CD1 4.43Å; L327-I332 HydrophobicContact CD1-CD1 4.45Å; L327-I332 HydrophobicContact CD1-CG1 4.36Å; P329-I332 PolarHBondContact O-N 3.05Å; E330-I332 VanDerWaalsContact C-N 3.35Å; I332-I342 HydrophobicContact CG2-CB 3.98Å; I332-I342 HydrophobicContact CG2-CD1 3.82Å; I332-I342 HydrophobicContact CG2-CG1 4.5Å; I332-I342 HydrophobicContact CG2-CG2 4.15Å; I332-I389 HydrophobicContact CD1-CD1 4.04Å; I332-I389 HydrophobicContact CD1-CG2 4.07Å
333	L	97.6	Very high	90	Very high	38 Å²	38	35.6 Å²	35.6	20%	0.199	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	142.8	-174	-82.1	64	0	0	0	111.4	L282 N285 E330 S335 I342 K343 V345	L282-L333 HydrophobicContact CB-CB 3.89Å; L282-L333 HydrophobicContact CB-CD2 3.89Å; L282-L333 HydrophobicContact CD1-CB 3.82Å; L282-L333 HydrophobicContact CD1-CD2 4.43Å; N285-L333 HydrophobicContact CB-CD1 3.73Å; N285-L333 HydrophobicContact CB-CG 4.06Å; E330-L333 WeakPolarHBondContact O-CD1 3.27Å; L333-S335 PolarHBondContact O-N 3.27Å; L333-I342 CarbonylContact O-C 3.45Å; L333-I342 WeakPolarHBondContact O-CA 3.34Å; L333-K343 PolarHBondContact N-O 3.01Å; L333-K343 PolarHBondContact O-N 3.32Å; L333-V345 HydrophobicContact CB-CG1 4.29Å; L333-V345 HydrophobicContact CD1-CB 4.45Å; L333-V345 HydrophobicContact CD1-CG1 3.94Å; L333-V345 HydrophobicContact CD1-CG2 3.56Å; L333-V345 HydrophobicContact CD2-CG1 4.29Å; L333-V345 HydrophobicContact CG-CG1 4.39Å
334	L	95.9	Very high	90	Very high	46 Å²	46	35.7 Å²	35.7	24%	0.241	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	132.8	171.9	-67.8	-178.8	0	0	0	110.3	G283 V284 L286 L289 F306 N341 I342	G283-L334 WeakPolarHBondContact CA-O 3.47Å; G283-L334 PolarHBondContact N-O 3.16Å; V284-L334 HydrophobicContact CG2-CD1 3.85Å; V284-L334 HydrophobicContact CG2-CG 4.49Å; V284-L334 WeakPolarHBondContact O-CG 3.42Å; V284-L334 PolarHBondContact O-N 2.99Å; L286-L334 HydrophobicContact CD2-CD2 4.07Å; L289-L334 HydrophobicContact CD1-CD1 4.26Å; L289-L334 HydrophobicContact CD2-CD1 4.31Å; L289-L334 HydrophobicContact CD2-CD2 4.29Å; F306-L334 HydrophobicContact CE1-CD2 4.28Å; F306-L334 HydrophobicContact CZ-CD2 4.21Å; L334-N341 CarbonylContact C-O 3.18Å; L334-N341 WeakPolarHBondContact CA-O 3.37Å; L334-I342 HydrophobicContact CD2-CG2 3.97Å
335	S	92.4	Very high	90	Very high	8 Å²	8	36.7 Å²	36.7	6%	0.056	19%	0.191	C	C	.	.			trans	-115.7	139.1	175.6	-177	0	0	0	0	111	L333 R337 N341	L333-S335 PolarHBondContact O-N 3.27Å; S335-R337 WeakPolarHBondContact CB-O 3.32Å; S335-R337 PolarHBondContact OG-N 2.94Å; S335-R337 PolarHBondContact OG-O 3.4Å; S335-N341 PolarHBondContact N-O 3.07Å; S335-N341 WeakPolarHBondContact O-CA 3.44Å; S335-N341 WeakPolarHBondContact O-CB 3.24Å
336	Q	80.7	Confident	89.9	Confident	200 Å²	200	38.4 Å²	38.4	94%	0.935	20%	0.2	S	C	*	.	S	Bend	trans	-75.9	-14	169	-62.7	-175.6	0.8	0	0	112.6
337	R	71.3	Confident	89.8	Confident	174 Å²	174	38.1 Å²	38.1	66%	0.657	20%	0.199	S	C	*	.	S	Bend	trans	-128.4	137	-174.3	-59.3	179.2	-178.1	176.3	1.8	110.4	S335	S335-R337 WeakPolarHBondContact CB-O 3.32Å; S335-R337 PolarHBondContact OG-N 2.94Å; S335-R337 PolarHBondContact OG-O 3.4Å
338	G	63	Low	89.5	Confident	33 Å²	33	38.2 Å²	38.2	34%	0.34	20%	0.199	S	C	.	.	S	Bend	trans	104.3	165.6	175.1	0	0	0	0	0	115.2	G340	G338-G340 PolarHBondContact O-N 2.91Å
339	P	60.1	Low	89.3	Confident	58 Å²	58	38.9 Å²	38.9	38%	0.377	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	107.4	-169.2	30.4	-35.1	0	0	0	113.5	L259 N261	L259-P339 HydrophobicContact CD2-CG 4.06Å; N261-P339 PolarHBondContact ND2-O 3.45Å; N261-P339 WeakPolarHBondContact OD1-CD 3.38Å; N261-P339 PolarHBondContact OD1-O 2.84Å; N261-P339 VanDerWaalsContact OD1-O 3.06Å
340	G	69.7	Low	89.2	Confident	19 Å²	19	39.2 Å²	39.2	20%	0.196	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	104.8	2.4	177.6	0	0	0	0	0	114.3	G338 I342	G338-G340 PolarHBondContact O-N 2.91Å; G340-I342 VanDerWaalsContact C-N 3.25Å; G340-I342 PolarHBondContact O-N 3.14Å
341	N	86.9	Confident	89	Confident	84 Å²	84	37.3 Å²	37.3	45%	0.449	20%	0.2	S	C	.	.	S	Bend	trans	59.8	28	171.4	-54.8	13.3	0	0	0	114.5	L334 S335	L334-N341 CarbonylContact C-O 3.18Å; L334-N341 WeakPolarHBondContact CA-O 3.37Å; S335-N341 PolarHBondContact N-O 3.07Å; S335-N341 WeakPolarHBondContact O-CA 3.44Å; S335-N341 WeakPolarHBondContact O-CB 3.24Å
342	I	95.7	Very high	88.9	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	157.7	171.4	55.2	164.6	0	0	0	111.3	N261 L286 F306 A309 L310 I332 L333 L334 G340	N261-I342 WeakPolarHBondContact CB-O 3.44Å; L286-I342 HydrophobicContact CD2-CG2 4.25Å; F306-I342 HydrophobicContact CB-CD1 4.28Å; F306-I342 HydrophobicContact CD1-CD1 4.14Å; F306-I342 HydrophobicContact CD1-CG1 4.33Å; F306-I342 HydrophobicContact CD1-CG2 3.65Å; F306-I342 HydrophobicContact CE1-CG2 3.55Å; F306-I342 HydrophobicContact CZ-CG2 4.46Å; A309-I342 HydrophobicContact CB-CD1 3.73Å; A309-I342 HydrophobicContact CB-CG1 3.64Å; L310-I342 HydrophobicContact CD2-CD1 3.9Å; L310-I342 HydrophobicContact CG-CD1 3.77Å; I332-I342 HydrophobicContact CG2-CB 3.98Å; I332-I342 HydrophobicContact CG2-CD1 3.82Å; I332-I342 HydrophobicContact CG2-CG1 4.5Å; I332-I342 HydrophobicContact CG2-CG2 4.15Å; L333-I342 CarbonylContact O-C 3.45Å; L333-I342 WeakPolarHBondContact O-CA 3.34Å; L334-I342 HydrophobicContact CD2-CG2 3.97Å; G340-I342 VanDerWaalsContact C-N 3.25Å; G340-I342 PolarHBondContact O-N 3.14Å
343	K	96.8	Very high	88.6	Confident	1 Å²	1	41.1 Å²	41.1	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	144.6	163.6	-73.3	-173.9	162.3	-141.9	0	110.9	N258 N261 V262 E280 L282 L333	N258-K343 WeakPolarHBondContact OD1-CE 3.31Å; N258-K343 PolarHBondContact OD1-NZ 3.31Å; N261-K343 CarbonylContact O-C 3.57Å; N261-K343 VanDerWaalsContact O-CA 3.27Å; N261-K343 WeakPolarHBondContact O-CA 3.25Å; V262-K343 WeakPolarHBondContact O-CD 3.36Å; V262-K343 WeakPolarHBondContact O-CE 3.41Å; V262-K343 PolarHBondContact O-NZ 2.92Å; E280-K343 WeakPolarHBondContact OE1-CE 3.42Å; E280-K343 IonicContact OE1-NZ 2.76Å; E280-K343 PolarHBondContact OE1-NZ 3.24Å; E280-K343 IonicContact OE2-NZ 2.7Å; L282-K343 HydrophobicContact CD1-CB 3.78Å; L282-K343 HydrophobicContact CD1-CD 4.25Å; L282-K343 HydrophobicContact CD1-CG 4.49Å; L282-K343 HydrophobicContact CD2-CD 4.25Å; L333-K343 PolarHBondContact N-O 3.01Å; L333-K343 PolarHBondContact O-N 3.32Å
344	V	97.9	Very high	88.3	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.012	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	137.3	169.2	-178.8	0	0	0	0	109.5	N261 I263 L310 C313 H324 L327 F347	N261-V344 PolarHBondContact O-N 3.42Å; I263-V344 PolarHBondContact N-O 3.4Å; L310-V344 HydrophobicContact CD2-CG2 3.68Å; C313-V344 HydrophobicContact CB-CG2 4.02Å; H324-V344 WeakPolarHBondContact NE2-CG1 3.24Å; L327-V344 HydrophobicContact CD1-CG1 3.81Å; L327-V344 HydrophobicContact CD1-CG2 4.21Å; V344-F347 HydrophobicContact CG1-CE2 4.46Å; V344-F347 HydrophobicContact CG1-CZ 4.36Å
345	V	97.1	Very high	88	Confident	21 Å²	21	51.4 Å²	51.4	13%	0.127	26%	0.262	C	S	.	.			trans	-130.2	171.6	-177.4	-44.3	0	0	0	0	111.6	I263 L282 H324 N331 L333	I263-V345 HydrophobicContact CB-CB 4.46Å; I263-V345 HydrophobicContact CB-CG1 4.12Å; I263-V345 HydrophobicContact CD1-CG1 4.3Å; I263-V345 HydrophobicContact CG1-CG1 4.47Å; I263-V345 HydrophobicContact CG2-CB 4.45Å; L282-V345 HydrophobicContact CD1-CG1 3.95Å; H324-V345 PolarHBondContact NE2-O 3.05Å; N331-V345 HydrophobicContact CB-CG2 4.38Å; N331-V345 PolarHBondContact O-N 3.38Å; L333-V345 HydrophobicContact CB-CG1 4.29Å; L333-V345 HydrophobicContact CD1-CB 4.45Å; L333-V345 HydrophobicContact CD1-CG1 3.94Å; L333-V345 HydrophobicContact CD1-CG2 3.56Å; L333-V345 HydrophobicContact CD2-CG1 4.29Å; L333-V345 HydrophobicContact CG-CG1 4.39Å
346	D	95.2	Very high	87.7	Confident	36 Å²	36	56.3 Å²	56.3	19%	0.193	28%	0.279	C	S	.	.			trans	64.2	72.4	175.3	-166.3	27.1	0	0	0	115.4	K229 G348	K229-D346 IonicContact NZ-OD1 2.71Å; K229-D346 PolarHBondContact NZ-OD1 2.76Å; D346-G348 PolarHBondContact O-N 2.82Å; D346-G348 PolarHBondContact OD1-N 3.43Å
347	F	96	Very high	87.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-80.7	13.3	174.1	-72.2	-98	0	0	0	112.7	E244 I247 L248 I251 V262 I263 L317 H324 V344 S349 S350	E244-F347 HydrophobicContact CG-CB 4.02Å; E244-F347 PolarHBondContact OE1-N 3.07Å; I247-F347 HydrophobicContact CG2-CB 4.24Å; I247-F347 HydrophobicContact CG2-CD1 3.72Å; I247-F347 HydrophobicContact CG2-CG 4.24Å; L248-F347 HydrophobicContact CD2-CB 4.42Å; L248-F347 HydrophobicContact CD2-CD2 3.99Å; L248-F347 HydrophobicContact CD2-CG 4.33Å; I251-F347 HydrophobicContact CD1-CD1 3.8Å; I251-F347 HydrophobicContact CD1-CE1 3.52Å; I251-F347 HydrophobicContact CD1-CE2 4.36Å; I251-F347 HydrophobicContact CD1-CG 4.32Å; I251-F347 HydrophobicContact CD1-CZ 3.85Å; V262-F347 HydrophobicContact CG1-CE2 3.39Å; V262-F347 HydrophobicContact CG1-CZ 3.38Å; I263-F347 HydrophobicContact CG2-CD2 4.26Å; I263-F347 HydrophobicContact CG2-CE2 4.2Å; L317-F347 HydrophobicContact CD1-CE1 3.99Å; L317-F347 HydrophobicContact CD1-CZ 4.42Å; L317-F347 HydrophobicContact CD2-CE1 3.8Å; L317-F347 HydrophobicContact CD2-CZ 4.38Å; H324-F347 AromaticContact CD2-CD1 3.95Å; H324-F347 AromaticContact CD2-CE1 3.63Å; H324-F347 AromaticContact CD2-CZ 3.78Å; V344-F347 HydrophobicContact CG1-CE2 4.46Å; V344-F347 HydrophobicContact CG1-CZ 4.36Å; F347-S349 PolarHBondContact O-N 3.29Å; F347-S350 VanDerWaalsContact CA-OG 3.31Å; F347-S350 WeakPolarHBondContact CA-OG 3.46Å; F347-S350 WeakPolarHBondContact CD1-OG 3.48Å; F347-S350 VanDerWaalsContact O-CB 3.3Å; F347-S350 WeakPolarHBondContact O-CB 3.37Å; F347-S350 PolarHBondContact O-N 3.3Å; F347-S350 PolarHBondContact O-OG 3.24Å
348	G	93.1	Very high	88.3	Confident	2 Å²	2	47.3 Å²	47.3	2%	0.021	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-63	-26.9	-178.5	0	0	0	0	0	113.9	Q240 E244 D346	Q240-G348 WeakPolarHBondContact CG-O 3.4Å; Q240-G348 PolarHBondContact NE2-O 2.88Å; E244-G348 VanDerWaalsContact CD-N 3.31Å; E244-G348 PolarHBondContact OE1-N 3.22Å; E244-G348 VanDerWaalsContact OE2-CA 3.3Å; E244-G348 WeakPolarHBondContact OE2-CA 3.3Å; D346-G348 PolarHBondContact O-N 2.82Å; D346-G348 PolarHBondContact OD1-N 3.43Å
349	S	93.5	Very high	89.6	Confident	27 Å²	27	51.6 Å²	51.6	19%	0.189	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-94.3	-5.8	174.4	-61.6	0	0	0	0	113.7	C325 F347	C325-S349 WeakPolarHBondContact CB-O 3.49Å; F347-S349 PolarHBondContact O-N 3.29Å
350	S	95.6	Very high	91.1	Very high	7 Å²	7	51.6 Å²	51.6	5%	0.049	26%	0.262	C	S	.	.			trans	-74.7	150.8	-170.9	-54.7	0	0	0	0	112.7	I323 H324 F347	I323-S350 WeakPolarHBondContact O-CA 3.45Å; I323-S350 WeakPolarHBondContact O-CB 3.28Å; H324-S350 WeakPolarHBondContact CA-OG 3.24Å; H324-S350 WeakPolarHBondContact O-CA 3.5Å; H324-S350 PolarHBondContact O-N 3.43Å; H324-S350 PolarHBondContact O-OG 2.84Å; F347-S350 VanDerWaalsContact CA-OG 3.31Å; F347-S350 WeakPolarHBondContact CA-OG 3.46Å; F347-S350 WeakPolarHBondContact CD1-OG 3.48Å; F347-S350 VanDerWaalsContact O-CB 3.3Å; F347-S350 WeakPolarHBondContact O-CB 3.37Å; F347-S350 PolarHBondContact O-N 3.3Å; F347-S350 PolarHBondContact O-OG 3.24Å
351	C	94.9	Very high	92.4	Very high	13 Å²	13	51.3 Å²	51.3	9%	0.088	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	163	174.8	56.7	0	0	0	0	111.2	I323	I323-C351 PolarHBondContact N-O 2.74Å; I323-C351 PolarHBondContact O-N 2.83Å; I323-C351 VanDerWaalsContact O-N 3.13Å
352	Y	95.3	Very high	92.9	Very high	52 Å²	52	47.8 Å²	47.8	20%	0.204	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	143.7	164.2	-65.9	-77.8	0	0	0	109.6	I247 K321 I322 Q354 Q355	I247-Y352 HydrophobicContact CG1-CE2 3.95Å; K321-Y352 CarbonylContact O-C 3.51Å; K321-Y352 VanDerWaalsContact O-CA 3.3Å; K321-Y352 WeakPolarHBondContact O-CA 3.31Å; I322-Y352 HydrophobicContact CD1-CE1 4.19Å; I322-Y352 HydrophobicContact CG1-CD1 3.87Å; I322-Y352 HydrophobicContact CG1-CE1 3.63Å; Y352-Q354 PolarHBondContact O-N 3.23Å; Y352-Q354 VanDerWaalsContact O-N 3.08Å; Y352-Q355 CarbonylContact O-C 3.59Å; Y352-Q355 WeakPolarHBondContact O-CA 3.33Å; Y352-Q355 PolarHBondContact O-N 3.49Å
353	E	92.6	Very high	93	Very high	41 Å²	41	49.1 Å²	49.1	19%	0.192	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-30.6	-178	176	170.1	-119.5	0	0	113.6	K321 I323 Q355 R356 S378 M379	K321-E353 PolarHBondContact O-N 2.76Å; I323-E353 HydrophobicContact CD1-CB 4.14Å; I323-E353 HydrophobicContact CD1-CG 4.42Å; I323-E353 HydrophobicContact CG1-CB 4.34Å; E353-Q355 VanDerWaalsContact C-N 3.35Å; E353-R356 WeakPolarHBondContact O-CD 3.06Å; E353-R356 WeakPolarHBondContact O-CG 3.34Å; E353-R356 PolarHBondContact O-NE 2.98Å; E353-R356 VanDerWaalsContact O-NE 3.1Å; E353-R356 PolarHBondContact O-NH1 2.98Å; E353-R356 PolarHBondContact O-NH2 3.35Å; E353-S378 WeakPolarHBondContact OE1-CB 3.42Å; E353-M379 WeakPolarHBondContact OE1-CE 3.45Å; E353-M379 WeakPolarHBondContact OE2-CE 3.28Å
354	Q	90.5	Very high	93	Very high	178 Å²	178	52.2 Å²	52.2	83%	0.832	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-9.7	177.1	-63.9	178.5	-10.7	0	0	113.6	Y352	Y352-Q354 PolarHBondContact O-N 3.23Å; Y352-Q354 VanDerWaalsContact O-N 3.08Å
355	Q	89.9	Confident	93.1	Very high	122 Å²	122	55.5 Å²	55.5	57%	0.57	27%	0.272	S	S	*	.			trans	-122.7	45.4	-173.1	-60	179.5	3.7	0	0	111.1	Y352 E353 V357	Y352-Q355 CarbonylContact O-C 3.59Å; Y352-Q355 WeakPolarHBondContact O-CA 3.33Å; Y352-Q355 PolarHBondContact O-N 3.49Å; E353-Q355 VanDerWaalsContact C-N 3.35Å; Q355-V357 PolarHBondContact O-N 2.91Å
356	R	86.2	Confident	93.1	Very high	112 Å²	112	54.9 Å²	54.9	42%	0.423	27%	0.267	S	S	.	.			trans	-72.7	119.1	177.5	-66.5	170.3	-67.4	-131.5	-14.5	110.2	E353 Y377	E353-R356 WeakPolarHBondContact O-CD 3.06Å; E353-R356 WeakPolarHBondContact O-CG 3.34Å; E353-R356 PolarHBondContact O-NE 2.98Å; E353-R356 VanDerWaalsContact O-NE 3.1Å; E353-R356 PolarHBondContact O-NH1 2.98Å; E353-R356 PolarHBondContact O-NH2 3.35Å; R356-Y377 HydrophobicContact CB-CE1 4.19Å; R356-Y377 WeakPolarHBondContact CB-OH 3.26Å; R356-Y377 WeakPolarHBondContact CD-O 3.38Å; R356-Y377 HydrophobicContact CG-CE1 4.19Å; R356-Y377 HydrophobicContact CG-CE2 3.79Å; R356-Y377 PolarHBondContact NH1-O 2.75Å
357	V	79.1	Confident	93.3	Very high	111 Å²	111	53.5 Å²	53.5	67%	0.673	26%	0.259	S	S	*	.			trans	-105	-36.2	-177.8	-178	0	0	0	0	112.6	Q355	Q355-V357 PolarHBondContact O-N 2.91Å
358	Y	85.9	Confident	93.4	Very high	74 Å²	74	53.5 Å²	53.5	29%	0.29	26%	0.259	S	S	.	.			trans	-112.2	133.8	-169.2	-58.3	-57.6	0	0	0	112.1	Y377	Y358-Y377 WeakPolarHBondContact O-CE1 3.26Å; Y358-Y377 PolarHBondContact O-OH 3.2Å
359	T	89.1	Confident	93.7	Very high	122 Å²	122	53.4 Å²	53.4	75%	0.748	26%	0.258	S	S	*	.	S	Bend	trans	-87.9	-23.4	175.4	51.1	0	0	0	0	113.2
360	Y	92.8	Very high	93.9	Very high	59 Å²	59	52.1 Å²	52.1	23%	0.231	25%	0.249	C	C	.	.	S	Bend	trans	-107.3	99	176.9	-172.8	-84.3	0	0	0	109.2	R367 E405 P577 H579	Y360-R367 PolarHBondContact OH-NH1 3.21Å; Y360-R367 PolarHBondContact OH-NH2 3.04Å; Y360-E405 HydrophobicContact CE2-CG 4.07Å; Y360-P577 HydrophobicContact CD1-CB 4.4Å; Y360-P577 HydrophobicContact CD1-CG 3.59Å; Y360-P577 HydrophobicContact CE1-CG 4.22Å; Y360-P577 HydrophobicContact CG-CG 3.89Å; Y360-H579 PolarHBondContact OH-CE1 2.96Å; Y360-H579 PolarHBondContact OH-NE2 3.15Å
361	I	95.5	Very high	94.1	Very high	13 Å²	13	51.9 Å²	51.9	7%	0.067	25%	0.247	C	C	.	.			trans	-135.6	174.9	-175.8	58.2	166.8	0	0	0	110.9	C325 R367 V371 Y377 I381	C325-I361 HydrophobicContact CB-CB 4.48Å; C325-I361 HydrophobicContact CB-CD1 4.25Å; I361-R367 PolarHBondContact O-NE 2.61Å; I361-R367 PolarHBondContact O-NH2 3.06Å; I361-V371 HydrophobicContact CD1-CG2 4.06Å; I361-V371 HydrophobicContact CG1-CG1 3.79Å; I361-V371 HydrophobicContact CG1-CG2 3.89Å; I361-Y377 HydrophobicContact CD1-CD1 4.13Å; I361-Y377 HydrophobicContact CD1-CD2 3.75Å; I361-Y377 HydrophobicContact CD1-CE1 3.85Å; I361-Y377 HydrophobicContact CD1-CE2 3.42Å; I361-Y377 VanDerWaalsContact CD1-CE2 3.42Å; I361-Y377 HydrophobicContact CD1-CG 4.09Å; I361-Y377 VanDerWaalsContact CD1-CZ 3.48Å; I361-I381 HydrophobicContact CD1-CD1 3.4Å; I361-I381 HydrophobicContact CG1-CD1 4.46Å
362	Q	97.9	Very high	94.2	Very high	10 Å²	10	51.2 Å²	51.2	5%	0.047	24%	0.243	C	C	.	.	S	Bend	trans	62.7	141	-173.8	-50.4	175.8	-79.5	0	0	114.1	C325 Y366 R367 S368 I381 S385	C325-Q362 WeakPolarHBondContact O-CA 3.07Å; C325-Q362 VanDerWaalsContact O-CG 3.29Å; C325-Q362 WeakPolarHBondContact O-CG 3.45Å; C325-Q362 PolarHBondContact O-N 3.19Å; Q362-Y366 PolarHBondContact NE2-O 2.82Å; Q362-R367 HydrophobicContact CB-CB 3.98Å; Q362-R367 HydrophobicContact CB-CG 4.14Å; Q362-R367 PolarHBondContact O-NE 3Å; Q362-R367 PolarHBondContact O-NH2 3.38Å; Q362-S368 PolarHBondContact OE1-OG 3.35Å; Q362-I381 HydrophobicContact CG-CD1 4.06Å; Q362-I381 PolarHBondContact NE2-O 3.31Å; Q362-S385 PolarHBondContact NE2-OG 2.88Å
363	S	97.3	Very high	94.3	Very high	29 Å²	29	48.8 Å²	48.8	20%	0.203	23%	0.233	C	C	.	.			trans	-64.2	136	167.2	-66.3	0	0	0	0	110.4	D326 K328 F365 Y366 R367	D326-S363 VanDerWaalsContact OD1-CB 3.26Å; D326-S363 WeakPolarHBondContact OD1-CB 3.29Å; D326-S363 PolarHBondContact OD1-N 2.68Å; D326-S363 PolarHBondContact OD1-OG 3.34Å; K328-S363 WeakPolarHBondContact CD-OG 3.42Å; K328-S363 PolarHBondContact NZ-OG 3.25Å; S363-F365 PolarHBondContact O-N 2.99Å; S363-F365 VanDerWaalsContact O-N 3.15Å; S363-Y366 CarbonylContact O-C 3.59Å; S363-Y366 PolarHBondContact O-N 2.67Å; S363-R367 PolarHBondContact O-N 3.29Å
364	R	98.2	Very high	94.5	Very high	65 Å²	65	48 Å²	48	25%	0.245	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-51.6	-46.1	-158.3	-168.1	-169.7	-66.5	118.9	-4.3	114.9	Y366 R367 G402 E403 Q408 H579	R364-Y366 PolarHBondContact O-N 3.02Å; R364-R367 VanDerWaalsContact O-CB 3.28Å; R364-R367 WeakPolarHBondContact O-CB 3.34Å; R364-R367 PolarHBondContact O-N 3.46Å; R364-G402 WeakPolarHBondContact CD-O 3.45Å; R364-E403 PolarHBondContact NH1-O 2.97Å; R364-E403 PolarHBondContact NH2-O 2.89Å; R364-Q408 HydrophobicContact CG-CB 4.21Å; R364-Q408 HydrophobicContact CG-CG 4.12Å; R364-Q408 PolarHBondContact O-NE2 3.23Å; R364-H579 PolarHBondContact NH2-CE1 3.2Å
365	F	98.6	Very high	94.8	Very high	71 Å²	71	40.8 Å²	40.8	31%	0.311	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-65.7	-23.2	-177.1	-54.9	-28	0	0	0	113.7	S363 P398 F400 P401 G402	S363-F365 PolarHBondContact O-N 2.99Å; S363-F365 VanDerWaalsContact O-N 3.15Å; F365-P398 HydrophobicContact CB-CB 4.24Å; F365-P398 HydrophobicContact CD2-CB 3.91Å; F365-P398 HydrophobicContact CD2-CG 3.84Å; F365-P398 HydrophobicContact CE2-CG 4.14Å; F365-P398 HydrophobicContact CG-CB 4.17Å; F365-F400 WeakPolarHBondContact CD1-O 3.29Å; F365-P401 HydrophobicContact CE1-CB 4.4Å; F365-G402 WeakPolarHBondContact CE1-O 3.07Å
366	Y	98.8	Very high	95.1	Very high	8 Å²	8	40.3 Å²	40.3	3%	0.031	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-106.9	6.9	-179.3	-39.2	-77.7	0	0	0	112	K328 P329 Q362 S363 R364 S385 C388 I389 E392	K328-Y366 HydrophobicContact CB-CD2 3.52Å; K328-Y366 HydrophobicContact CB-CE2 3.5Å; K328-Y366 VanDerWaalsContact CB-CE2 3.5Å; K328-Y366 HydrophobicContact CB-CG 4.17Å; P329-Y366 WeakPolarHBondContact CD-OH 3.42Å; P329-Y366 HydrophobicContact CG-CE1 4.08Å; Q362-Y366 PolarHBondContact NE2-O 2.82Å; S363-Y366 CarbonylContact O-C 3.59Å; S363-Y366 PolarHBondContact O-N 2.67Å; R364-Y366 PolarHBondContact O-N 3.02Å; Y366-S385 PolarHBondContact O-OG 3.39Å; Y366-C388 HydrophobicContact CD1-CB 3.78Å; Y366-I389 HydrophobicContact CD1-CG1 3.85Å; Y366-I389 HydrophobicContact CE1-CG1 4.09Å; Y366-E392 VanDerWaalsContact CE1-OE2 3.28Å; Y366-E392 WeakPolarHBondContact CE1-OE2 3.2Å; Y366-E392 PolarHBondContact OH-OE2 3.15Å
367	R	98.8	Very high	95.6	Very high	7 Å²	7	35.7 Å²	35.7	3%	0.026	19%	0.192	C	C	.	.			trans	-77.9	133.3	-177.7	-173.5	179	-66.9	162	3.5	111.2	Y360 I361 Q362 S363 R364 V371 I372 W384 E405	Y360-R367 PolarHBondContact OH-NH1 3.21Å; Y360-R367 PolarHBondContact OH-NH2 3.04Å; I361-R367 PolarHBondContact O-NE 2.61Å; I361-R367 PolarHBondContact O-NH2 3.06Å; Q362-R367 HydrophobicContact CB-CB 3.98Å; Q362-R367 HydrophobicContact CB-CG 4.14Å; Q362-R367 PolarHBondContact O-NE 3Å; Q362-R367 PolarHBondContact O-NH2 3.38Å; S363-R367 PolarHBondContact O-N 3.29Å; R364-R367 VanDerWaalsContact O-CB 3.28Å; R364-R367 WeakPolarHBondContact O-CB 3.34Å; R364-R367 PolarHBondContact O-N 3.46Å; R367-V371 HydrophobicContact CG-CB 4.07Å; R367-V371 HydrophobicContact CG-CG1 3.88Å; R367-I372 HydrophobicContact CG-CD1 4.35Å; R367-I372 HydrophobicContact CG-CG1 3.88Å; R367-W384 PolarHBondContact O-NE1 3.38Å; R367-E405 IonicContact NH1-OE1 2.86Å; R367-E405 PolarHBondContact NH1-OE1 3.29Å
368	S	98.8	Very high	96.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.171	C	C	.	.			trans	-74.1	152	-179.4	61.8	0	0	0	0	113	Q362 E370 V371 I372 I381	Q362-S368 PolarHBondContact OE1-OG 3.35Å; S368-E370 VanDerWaalsContact C-N 3.33Å; S368-E370 WeakPolarHBondContact CB-OE2 3.35Å; S368-E370 PolarHBondContact O-N 2.67Å; S368-V371 PolarHBondContact O-N 3.44Å; S368-V371 VanDerWaalsContact OG-CG2 3.25Å; S368-V371 WeakPolarHBondContact OG-CG2 3.17Å; S368-I372 WeakPolarHBondContact O-CG1 3.33Å; S368-I372 PolarHBondContact O-N 3.44Å; S368-I381 VanDerWaalsContact OG-CG2 3.24Å; S368-I381 WeakPolarHBondContact OG-CG2 3.48Å
369	P	98.4	Very high	97	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66	-33.7	-178.5	26.7	-34.8	0	0	0	112.4	V371 I372 L373 W384 I409 F423 W479	P369-V371 VanDerWaalsContact C-N 3.33Å; P369-V371 PolarHBondContact O-N 3.35Å; P369-I372 PolarHBondContact O-N 3.45Å; P369-L373 VanDerWaalsContact O-CB 3.3Å; P369-L373 WeakPolarHBondContact O-CB 3.33Å; P369-L373 VanDerWaalsContact O-CG 3.25Å; P369-L373 WeakPolarHBondContact O-CG 3.46Å; P369-L373 PolarHBondContact O-N 3.42Å; P369-W384 VanDerWaalsContact CD-CE3 3.47Å; P369-W384 HydrophobicContact CG-CE3 4.1Å; P369-W384 HydrophobicContact CG-CH2 4.01Å; P369-W384 HydrophobicContact CG-CZ3 3.75Å; P369-I409 HydrophobicContact CB-CD1 4.06Å; P369-F423 HydrophobicContact CB-CE1 4.39Å; P369-W479 HydrophobicContact CB-CE3 3.67Å; P369-W479 HydrophobicContact CB-CZ3 3.5Å; P369-W479 HydrophobicContact CG-CE3 3.87Å; P369-W479 HydrophobicContact CG-CZ3 4.17Å
370	E	98.4	Very high	97.4	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.4	-39.9	175.2	59.5	-92.4	-144.8	0	0	112.6	S368 G374 H375 I381 F423 R484	S368-E370 VanDerWaalsContact C-N 3.33Å; S368-E370 WeakPolarHBondContact CB-OE2 3.35Å; S368-E370 PolarHBondContact O-N 2.67Å; E370-G374 PolarHBondContact O-N 2.8Å; E370-H375 HydrophobicContact CB-CB 3.79Å; E370-H375 PolarHBondContact O-N 3.11Å; E370-I381 HydrophobicContact CG-CG2 4.06Å; E370-I381 WeakPolarHBondContact OE1-CG2 3.38Å; E370-F423 HydrophobicContact CB-CZ 4.22Å; E370-R484 IonicContact OE1-CZ 2.75Å; E370-R484 IonicContact OE1-NH1 2.73Å; E370-R484 PolarHBondContact OE1-NH1 3.5Å; E370-R484 IonicContact OE1-NH2 3.97Å; E370-R484 PolarHBondContact OE1-NH2 3.37Å; E370-R484 IonicContact OE2-CZ 3.9Å; E370-R484 IonicContact OE2-NH1 2.72Å; E370-R484 PolarHBondContact OE2-NH1 2.95Å; E370-R484 IonicContact OE2-NH2 3.57Å; E370-R484 PolarHBondContact OE2-NH2 3.21Å
371	V	98.3	Very high	97.7	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.012	12%	0.121	C	C	.	.	H	α-helix	trans	-67.8	-43.3	176.3	172	0	0	0	0	110.7	I361 R367 S368 P369 L373 G374 Y377 I381	I361-V371 HydrophobicContact CD1-CG2 4.06Å; I361-V371 HydrophobicContact CG1-CG1 3.79Å; I361-V371 HydrophobicContact CG1-CG2 3.89Å; R367-V371 HydrophobicContact CG-CB 4.07Å; R367-V371 HydrophobicContact CG-CG1 3.88Å; S368-V371 PolarHBondContact O-N 3.44Å; S368-V371 VanDerWaalsContact OG-CG2 3.25Å; S368-V371 WeakPolarHBondContact OG-CG2 3.17Å; P369-V371 VanDerWaalsContact C-N 3.33Å; P369-V371 PolarHBondContact O-N 3.35Å; V371-L373 PolarHBondContact O-N 2.89Å; V371-G374 PolarHBondContact O-N 3.1Å; V371-Y377 HydrophobicContact CG2-CD1 4.44Å; V371-Y377 HydrophobicContact CG2-CG 4.25Å; V371-I381 HydrophobicContact CG2-CG2 4.08Å
372	I	98.3	Very high	97.9	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.6	-45.2	178.1	-62.6	166.3	0	0	0	110.8	R367 S368 P369 G374 E405 Q408 I409 I412 R429 F433	R367-I372 HydrophobicContact CG-CD1 4.35Å; R367-I372 HydrophobicContact CG-CG1 3.88Å; S368-I372 WeakPolarHBondContact O-CG1 3.33Å; S368-I372 PolarHBondContact O-N 3.44Å; P369-I372 PolarHBondContact O-N 3.45Å; I372-G374 VanDerWaalsContact C-N 3.29Å; I372-G374 PolarHBondContact O-N 3.28Å; I372-E405 HydrophobicContact CG2-CB 4.49Å; I372-Q408 HydrophobicContact CD1-CB 4.16Å; I372-Q408 HydrophobicContact CD1-CG 3.68Å; I372-I409 HydrophobicContact CG2-CB 4.21Å; I372-I412 HydrophobicContact CD1-CD1 4.1Å; I372-R429 WeakPolarHBondContact O-CD 3.41Å; I372-R429 PolarHBondContact O-NH1 3.37Å; I372-F433 HydrophobicContact CG2-CE1 3.72Å; I372-F433 HydrophobicContact CG2-CE2 4.03Å; I372-F433 HydrophobicContact CG2-CZ 3.44Å; I372-F433 VanDerWaalsContact CG2-CZ 3.44Å; I372-F433 VanDerWaalsContact O-CE2 3.31Å; I372-F433 WeakPolarHBondContact O-CE2 3.34Å; I372-F433 WeakPolarHBondContact O-CZ 3.48Å
373	L	97.6	Very high	97.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-79.4	-7.6	-177.5	-63.7	177.5	0	0	0	113.9	P369 V371 F423 A427 S428 R429 F433 F434	P369-L373 VanDerWaalsContact O-CB 3.3Å; P369-L373 WeakPolarHBondContact O-CB 3.33Å; P369-L373 VanDerWaalsContact O-CG 3.25Å; P369-L373 WeakPolarHBondContact O-CG 3.46Å; P369-L373 PolarHBondContact O-N 3.42Å; V371-L373 PolarHBondContact O-N 2.89Å; L373-F423 HydrophobicContact CD1-CD1 4.01Å; L373-F423 HydrophobicContact CD1-CE1 3.63Å; L373-A427 HydrophobicContact CB-CB 3.85Å; L373-S428 PolarHBondContact O-N 3.43Å; L373-R429 WeakPolarHBondContact O-CB 3.28Å; L373-R429 PolarHBondContact O-N 3.22Å; L373-F433 HydrophobicContact CD2-CB 4.45Å; L373-F433 HydrophobicContact CD2-CD2 3.57Å; L373-F433 HydrophobicContact CD2-CE2 4.08Å; L373-F433 HydrophobicContact CD2-CG 4.17Å; L373-F434 HydrophobicContact CD2-CE2 3.87Å
374	G	96.8	Very high	98	Very high	24 Å²	24	19.4 Å²	19.4	25%	0.247	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	38	177.1	0	0	0	0	0	113.6	E370 V371 I372 S428	E370-G374 PolarHBondContact O-N 2.8Å; V371-G374 PolarHBondContact O-N 3.1Å; I372-G374 VanDerWaalsContact C-N 3.29Å; I372-G374 PolarHBondContact O-N 3.28Å; G374-S428 WeakPolarHBondContact CA-OG 3.46Å; G374-S428 PolarHBondContact O-OG 3.48Å
375	H	96.8	Very high	98	Very high	28 Å²	28	16.3 Å²	16.3	13%	0.13	10%	0.097	C	C	.	.			trans	-83.7	159.2	167.9	-79.7	-54.4	0	0	0	111.3	E370 Y377 F423 S426 A427	E370-H375 HydrophobicContact CB-CB 3.79Å; E370-H375 PolarHBondContact O-N 3.11Å; H375-Y377 PolarHBondContact O-N 3.06Å; H375-F423 AromaticContact CD2-CD2 3.95Å; H375-F423 AromaticContact CD2-CE2 3.47Å; H375-F423 VanDerWaalsContact CD2-CE2 3.47Å; H375-F423 WeakPolarHBondContact CD2-CE2 3.24Å; H375-F423 AromaticContact CD2-CZ 3.62Å; H375-F423 PolarHBondContact CE1-O 3.44Å; H375-F423 AromaticContact NE2-CD2 3.6Å; H375-F423 AromaticContact NE2-CE2 3.64Å; H375-F423 AromaticContact NE2-CG 3.93Å; H375-F423 PolarHBondContact NE2-O 3.47Å; H375-S426 VanDerWaalsContact CE1-C 3.48Å; H375-S426 PolarHBondContact CE1-OG 3.31Å; H375-S426 VanDerWaalsContact CE1-OG 3.28Å; H375-A427 VanDerWaalsContact CE1-CA 3.42Å; H375-A427 WeakPolarHBondContact CE1-CA 3.32Å; H375-A427 PolarHBondContact CE1-N 3.27Å; H375-A427 VanDerWaalsContact CE1-N 3.3Å
376	P	95	Very high	98.1	Very high	111 Å²	111	12.9 Å²	12.9	72%	0.721	8%	0.082	S	C	*	.			trans	-58.4	127.9	163.1	-19.3	32.4	0	0	0	110.1
377	Y	96.8	Very high	98.1	Very high	15 Å²	15	12.5 Å²	12.5	6%	0.059	8%	0.08	C	C	.	.			trans	-104.6	157.7	-178.8	69.6	-93.9	0	0	0	112.1	I323 R356 Y358 I361 V371 H375 I381	I323-Y377 HydrophobicContact CD1-CD2 3.9Å; I323-Y377 HydrophobicContact CD1-CE2 3.77Å; R356-Y377 HydrophobicContact CB-CE1 4.19Å; R356-Y377 WeakPolarHBondContact CB-OH 3.26Å; R356-Y377 WeakPolarHBondContact CD-O 3.38Å; R356-Y377 HydrophobicContact CG-CE1 4.19Å; R356-Y377 HydrophobicContact CG-CE2 3.79Å; R356-Y377 PolarHBondContact NH1-O 2.75Å; Y358-Y377 WeakPolarHBondContact O-CE1 3.26Å; Y358-Y377 PolarHBondContact O-OH 3.2Å; I361-Y377 HydrophobicContact CD1-CD1 4.13Å; I361-Y377 HydrophobicContact CD1-CD2 3.75Å; I361-Y377 HydrophobicContact CD1-CE1 3.85Å; I361-Y377 HydrophobicContact CD1-CE2 3.42Å; I361-Y377 VanDerWaalsContact CD1-CE2 3.42Å; I361-Y377 HydrophobicContact CD1-CG 4.09Å; I361-Y377 VanDerWaalsContact CD1-CZ 3.48Å; V371-Y377 HydrophobicContact CG2-CD1 4.44Å; V371-Y377 HydrophobicContact CG2-CG 4.25Å; H375-Y377 PolarHBondContact O-N 3.06Å; Y377-I381 HydrophobicContact CD2-CD1 3.84Å; Y377-I381 HydrophobicContact CD2-CG2 4.43Å; Y377-I381 HydrophobicContact CE2-CD1 4.27Å; Y377-I381 HydrophobicContact CG-CG2 4.49Å
378	S	97	Very high	98.1	Very high	32 Å²	32	12.2 Å²	12.2	22%	0.224	8%	0.079	C	C	.	.			trans	-134.5	-172.3	-178	66.5	0	0	0	0	110.6	E353 A380 I381	E353-S378 WeakPolarHBondContact OE1-CB 3.42Å; S378-A380 PolarHBondContact O-N 3.02Å; S378-A380 WeakPolarHBondContact OG-CB 3.36Å; S378-A380 PolarHBondContact OG-N 3.1Å; S378-I381 PolarHBondContact O-N 3.02Å
379	M	97.8	Very high	98.1	Very high	21 Å²	21	12.2 Å²	12.2	10%	0.103	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-16.2	171.2	-58.7	160.4	-64.6	0	0	113.2	H318 K321 I323 E353 I381 D382	H318-M379 HydrophobicContact CB-SD 4.42Å; H318-M379 VanDerWaalsContact CD2-CE 3.41Å; H318-M379 WeakPolarHBondContact CD2-CE 3.44Å; H318-M379 VanDerWaalsContact CD2-SD 3.53Å; K321-M379 HydrophobicContact CD-CE 3.85Å; K321-M379 HydrophobicContact CD-SD 3.84Å; I323-M379 HydrophobicContact CG1-CG 3.78Å; E353-M379 WeakPolarHBondContact OE1-CE 3.45Å; E353-M379 WeakPolarHBondContact OE2-CE 3.28Å; M379-I381 PolarHBondContact O-N 3.27Å; M379-D382 PolarHBondContact O-N 3.18Å
380	A	98.6	Very high	98.1	Very high	15 Å²	15	12.2 Å²	12.2	12%	0.124	8%	0.079	C	C	.	.	H	α-helix	trans	-61.8	-20.4	176.2	0	0	0	0	0	113.7	S378 D382 M383 W384 P481 R484	S378-A380 PolarHBondContact O-N 3.02Å; S378-A380 WeakPolarHBondContact OG-CB 3.36Å; S378-A380 PolarHBondContact OG-N 3.1Å; A380-D382 VanDerWaalsContact C-N 3.28Å; A380-D382 PolarHBondContact O-N 3.08Å; A380-M383 PolarHBondContact O-N 2.84Å; A380-W384 PolarHBondContact O-N 2.82Å; A380-P481 HydrophobicContact CB-CB 3.85Å; A380-R484 WeakPolarHBondContact O-CD 3.2Å; A380-R484 PolarHBondContact O-NH1 3.17Å
381	I	98.8	Very high	98.1	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-66.2	-31.1	177.9	73.4	177.2	0	0	0	112.5	I323 I361 Q362 S368 E370 V371 Y377 S378 M379 W384 S385	I323-I381 HydrophobicContact CG2-CD1 3.58Å; I323-I381 HydrophobicContact CG2-CG1 3.67Å; I361-I381 HydrophobicContact CD1-CD1 3.4Å; I361-I381 HydrophobicContact CG1-CD1 4.46Å; Q362-I381 HydrophobicContact CG-CD1 4.06Å; Q362-I381 PolarHBondContact NE2-O 3.31Å; S368-I381 VanDerWaalsContact OG-CG2 3.24Å; S368-I381 WeakPolarHBondContact OG-CG2 3.48Å; E370-I381 HydrophobicContact CG-CG2 4.06Å; E370-I381 WeakPolarHBondContact OE1-CG2 3.38Å; V371-I381 HydrophobicContact CG2-CG2 4.08Å; Y377-I381 HydrophobicContact CD2-CD1 3.84Å; Y377-I381 HydrophobicContact CD2-CG2 4.43Å; Y377-I381 HydrophobicContact CE2-CD1 4.27Å; Y377-I381 HydrophobicContact CG-CG2 4.49Å; S378-I381 PolarHBondContact O-N 3.02Å; M379-I381 PolarHBondContact O-N 3.27Å; I381-W384 WeakPolarHBondContact O-CB 3.41Å; I381-W384 PolarHBondContact O-N 2.85Å; I381-S385 PolarHBondContact O-N 3.25Å; I381-S385 PolarHBondContact O-OG 2.64Å
382	D	98.8	Very high	98.1	Very high	4 Å²	4	12.3 Å²	12.3	2%	0.021	8%	0.08	C	C	.	.	H	α-helix	trans	-77.3	-28.2	-179.1	-61.2	-40.5	0	0	0	111	L314 I323 H324 C325 M379 A380 S385 L386	L314-D382 HydrophobicContact CD2-CB 3.81Å; I323-D382 WeakPolarHBondContact CG2-OD2 3.11Å; H324-D382 PolarHBondContact N-OD2 3.06Å; C325-D382 PolarHBondContact N-OD1 3.26Å; C325-D382 VanDerWaalsContact N-OD1 3.13Å; M379-D382 PolarHBondContact O-N 3.18Å; A380-D382 VanDerWaalsContact C-N 3.28Å; A380-D382 PolarHBondContact O-N 3.08Å; D382-S385 PolarHBondContact O-N 3.01Å; D382-L386 WeakPolarHBondContact O-CB 3.27Å; D382-L386 PolarHBondContact O-N 3.06Å
383	M	98.9	Very high	98.2	Very high	4 Å²	4	12.3 Å²	12.3	2%	0.02	8%	0.08	C	C	.	.	H	α-helix	trans	-68.9	-33.6	169.3	-73.8	-61	-66.6	0	0	112.2	L311 L314 A380 L386 G387 C476 M485 P487	L311-M383 HydrophobicContact CD2-CE 3.89Å; L311-M383 HydrophobicContact CD2-SD 4.08Å; L314-M383 HydrophobicContact CD1-SD 3.7Å; A380-M383 PolarHBondContact O-N 2.84Å; M383-L386 HydrophobicContact CE-CD2 4.06Å; M383-L386 WeakPolarHBondContact O-CB 3.47Å; M383-L386 PolarHBondContact O-N 3.14Å; M383-L386 HydrophobicContact SD-CD2 3.91Å; M383-G387 PolarHBondContact O-N 2.92Å; M383-G387 VanDerWaalsContact O-N 3.11Å; M383-C476 WeakPolarHBondContact O-CB 3.5Å; M383-M485 HydrophobicContact CE-CE 4.33Å; M383-M485 HydrophobicContact CE-CG 4.32Å; M383-M485 WeakPolarHBondContact CE-O 3.44Å; M383-M485 WeakPolarHBondContact CG-O 3.45Å; M383-P487 HydrophobicContact CG-CG 4.18Å; M383-P487 HydrophobicContact SD-CB 4.34Å; M383-P487 HydrophobicContact SD-CG 3.83Å
384	W	98.9	Very high	98.2	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63.5	-49.4	169	176.4	-80.5	0	0	0	111.3	R367 P369 A380 I381 L386 G387 C388 F400 I412 L416 L477	R367-W384 PolarHBondContact O-NE1 3.38Å; P369-W384 VanDerWaalsContact CD-CE3 3.47Å; P369-W384 HydrophobicContact CG-CE3 4.1Å; P369-W384 HydrophobicContact CG-CH2 4.01Å; P369-W384 HydrophobicContact CG-CZ3 3.75Å; A380-W384 PolarHBondContact O-N 2.82Å; I381-W384 WeakPolarHBondContact O-CB 3.41Å; I381-W384 PolarHBondContact O-N 2.85Å; W384-L386 VanDerWaalsContact C-N 3.28Å; W384-L386 PolarHBondContact O-N 3.11Å; W384-G387 PolarHBondContact O-N 2.79Å; W384-C388 PolarHBondContact O-N 3.46Å; W384-C388 VanDerWaalsContact O-N 3.14Å; W384-F400 HydrophobicContact CH2-CE2 4.38Å; W384-F400 HydrophobicContact CZ2-CD2 4.22Å; W384-F400 AromaticContact CZ2-CE2 3.81Å; W384-F400 HydrophobicContact CZ2-CE2 3.81Å; W384-I412 HydrophobicContact CH2-CD1 4.25Å; W384-I412 HydrophobicContact CH2-CG1 4.38Å; W384-I412 HydrophobicContact CH2-CG2 3.66Å; W384-I412 HydrophobicContact CZ2-CD1 3.63Å; W384-I412 HydrophobicContact CZ2-CG1 3.89Å; W384-I412 HydrophobicContact CZ2-CG2 4.04Å; W384-L416 HydrophobicContact CH2-CD1 3.67Å; W384-L416 HydrophobicContact CZ3-CD1 4.13Å; W384-L477 HydrophobicContact CD2-CD2 3.71Å; W384-L477 HydrophobicContact CE3-CB 4.34Å; W384-L477 HydrophobicContact CE3-CD2 3.86Å; W384-L477 HydrophobicContact CG-CD2 4.22Å; W384-L477 HydrophobicContact CH2-CB 4.41Å; W384-L477 HydrophobicContact CH2-CD2 4.2Å; W384-L477 HydrophobicContact CZ2-CD2 4.07Å; W384-L477 HydrophobicContact CZ3-CB 4.05Å; W384-L477 HydrophobicContact CZ3-CD2 4.12Å; W384-L477 VanDerWaalsContact CZ3-O 3.28Å; W384-L477 WeakPolarHBondContact CZ3-O 3.42Å
385	S	98.9	Very high	98.3	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-57.3	-41.4	176	-59.6	0	0	0	0	111.9	L327 Q362 Y366 I381 D382 G387 C388 I389	L327-S385 WeakPolarHBondContact O-CB 3.11Å; Q362-S385 PolarHBondContact NE2-OG 2.88Å; Y366-S385 PolarHBondContact O-OG 3.39Å; I381-S385 PolarHBondContact O-N 3.25Å; I381-S385 PolarHBondContact O-OG 2.64Å; D382-S385 PolarHBondContact O-N 3.01Å; S385-G387 VanDerWaalsContact C-N 3.34Å; S385-G387 PolarHBondContact O-N 2.9Å; S385-C388 PolarHBondContact O-N 3.34Å; S385-I389 WeakPolarHBondContact O-CB 3.47Å; S385-I389 VanDerWaalsContact O-CD1 3.3Å; S385-I389 WeakPolarHBondContact O-CD1 3.48Å; S385-I389 WeakPolarHBondContact O-CG1 3.39Å; S385-I389 PolarHBondContact O-N 3.47Å
386	L	98.9	Very high	98.3	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-56.1	-46.3	173.3	177.7	65.8	0	0	0	111.8	L310 L311 L314 D382 M383 W384 C388 I389 L390	L310-L386 HydrophobicContact CB-CD1 3.79Å; L310-L386 HydrophobicContact CD1-CD1 3.54Å; L310-L386 HydrophobicContact CG-CD1 4.3Å; L311-L386 HydrophobicContact CD2-CD2 3.75Å; L311-L386 HydrophobicContact CG-CD2 4.09Å; L314-L386 HydrophobicContact CD1-CB 4.26Å; L314-L386 HydrophobicContact CD1-CD2 4.09Å; D382-L386 WeakPolarHBondContact O-CB 3.27Å; D382-L386 PolarHBondContact O-N 3.06Å; M383-L386 HydrophobicContact CE-CD2 4.06Å; M383-L386 WeakPolarHBondContact O-CB 3.47Å; M383-L386 PolarHBondContact O-N 3.14Å; M383-L386 HydrophobicContact SD-CD2 3.91Å; W384-L386 VanDerWaalsContact C-N 3.28Å; W384-L386 PolarHBondContact O-N 3.11Å; L386-C388 PolarHBondContact O-N 3.48Å; L386-I389 PolarHBondContact O-N 2.83Å; L386-L390 HydrophobicContact CD1-CD1 3.94Å; L386-L390 HydrophobicContact CD1-CD2 4.2Å; L386-L390 HydrophobicContact CD1-CG 3.88Å; L386-L390 HydrophobicContact CG-CD1 3.99Å; L386-L390 HydrophobicContact CG-CG 4.27Å; L386-L390 VanDerWaalsContact O-CG 3.31Å; L386-L390 WeakPolarHBondContact O-CG 3.44Å; L386-L390 PolarHBondContact O-N 2.99Å
387	G	98.9	Very high	98.5	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-55	-50.4	175.5	0	0	0	0	0	112.4	M383 W384 S385 I389 L390 A391	M383-G387 PolarHBondContact O-N 2.92Å; M383-G387 VanDerWaalsContact O-N 3.11Å; W384-G387 PolarHBondContact O-N 2.79Å; S385-G387 VanDerWaalsContact C-N 3.34Å; S385-G387 PolarHBondContact O-N 2.9Å; G387-I389 PolarHBondContact O-N 2.98Å; G387-L390 PolarHBondContact O-N 3.26Å; G387-A391 WeakPolarHBondContact O-CB 3.3Å; G387-A391 PolarHBondContact O-N 2.91Å; G387-A391 VanDerWaalsContact O-N 3.11Å
388	C	98.9	Very high	98.6	Very high	1 Å²	1	15 Å²	15	1%	0.007	8%	0.075	C	C	.	.	H	α-helix	trans	-60.4	-42.6	176.1	-67.1	0	0	0	0	113	Y366 W384 S385 L386 A391 E392	Y366-C388 HydrophobicContact CD1-CB 3.78Å; W384-C388 PolarHBondContact O-N 3.46Å; W384-C388 VanDerWaalsContact O-N 3.14Å; S385-C388 PolarHBondContact O-N 3.34Å; L386-C388 PolarHBondContact O-N 3.48Å; C388-A391 WeakPolarHBondContact O-CB 3.18Å; C388-A391 PolarHBondContact O-N 2.93Å; C388-E392 PolarHBondContact O-N 3.49Å
389	I	98.9	Very high	98.6	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-65.1	-45.3	-179.6	-69.7	158.6	0	0	0	111.3	L327 P329 I332 Y366 S385 L386 G387 A391 E392 L393	L327-I389 HydrophobicContact CB-CD1 4.43Å; L327-I389 HydrophobicContact CD2-CD1 3.94Å; L327-I389 HydrophobicContact CG-CD1 3.71Å; P329-I389 HydrophobicContact CG-CG1 4.26Å; P329-I389 HydrophobicContact CG-CG2 4.45Å; I332-I389 HydrophobicContact CD1-CD1 4.04Å; I332-I389 HydrophobicContact CD1-CG2 4.07Å; Y366-I389 HydrophobicContact CD1-CG1 3.85Å; Y366-I389 HydrophobicContact CE1-CG1 4.09Å; S385-I389 WeakPolarHBondContact O-CB 3.47Å; S385-I389 VanDerWaalsContact O-CD1 3.3Å; S385-I389 WeakPolarHBondContact O-CD1 3.48Å; S385-I389 WeakPolarHBondContact O-CG1 3.39Å; S385-I389 PolarHBondContact O-N 3.47Å; L386-I389 PolarHBondContact O-N 2.83Å; G387-I389 PolarHBondContact O-N 2.98Å; I389-A391 VanDerWaalsContact C-N 3.32Å; I389-A391 PolarHBondContact O-N 3.19Å; I389-E392 PolarHBondContact O-N 3.2Å; I389-L393 HydrophobicContact CG2-CD1 3.79Å; I389-L393 HydrophobicContact CG2-CG 4.34Å; I389-L393 WeakPolarHBondContact O-CB 3.3Å; I389-L393 VanDerWaalsContact O-CG 3.24Å; I389-L393 WeakPolarHBondContact O-CG 3.28Å; I389-L393 PolarHBondContact O-N 3.42Å
390	L	98.9	Very high	98.7	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-67.5	-35.4	-179.9	-64.4	179.6	0	0	0	111.8	I303 A307 L386 G387 L393 Y394 F469 F472 I473 W495	I303-L390 HydrophobicContact CG2-CB 4.27Å; I303-L390 HydrophobicContact CG2-CD2 3.77Å; A307-L390 HydrophobicContact CB-CD1 3.7Å; A307-L390 HydrophobicContact CB-CD2 3.71Å; A307-L390 HydrophobicContact CB-CG 4.37Å; L386-L390 HydrophobicContact CD1-CD1 3.94Å; L386-L390 HydrophobicContact CD1-CD2 4.2Å; L386-L390 HydrophobicContact CD1-CG 3.88Å; L386-L390 HydrophobicContact CG-CD1 3.99Å; L386-L390 HydrophobicContact CG-CG 4.27Å; L386-L390 VanDerWaalsContact O-CG 3.31Å; L386-L390 WeakPolarHBondContact O-CG 3.44Å; L386-L390 PolarHBondContact O-N 2.99Å; G387-L390 PolarHBondContact O-N 3.26Å; L390-L393 HydrophobicContact CD2-CD1 4.27Å; L390-Y394 PolarHBondContact O-N 2.93Å; L390-Y394 VanDerWaalsContact O-N 3.12Å; L390-F469 HydrophobicContact CB-CE2 4.37Å; L390-F472 HydrophobicContact CD1-CD1 4.1Å; L390-F472 HydrophobicContact CD1-CE1 3.53Å; L390-F472 HydrophobicContact CD1-CZ 4.44Å; L390-I473 HydrophobicContact CB-CD1 3.72Å; L390-I473 HydrophobicContact CD1-CD1 4.48Å; L390-W495 HydrophobicContact CD1-CH2 4.39Å; L390-W495 HydrophobicContact CD1-CZ3 4.19Å
391	A	98.8	Very high	98.6	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-61.5	-47.2	171.3	0	0	0	0	0	112.1	G387 C388 I389 Y394 T395 L399 L462	G387-A391 WeakPolarHBondContact O-CB 3.3Å; G387-A391 PolarHBondContact O-N 2.91Å; G387-A391 VanDerWaalsContact O-N 3.11Å; C388-A391 WeakPolarHBondContact O-CB 3.18Å; C388-A391 PolarHBondContact O-N 2.93Å; I389-A391 VanDerWaalsContact C-N 3.32Å; I389-A391 PolarHBondContact O-N 3.19Å; A391-Y394 WeakPolarHBondContact O-CB 3.48Å; A391-Y394 PolarHBondContact O-N 3.25Å; A391-Y394 VanDerWaalsContact O-N 3.13Å; A391-T395 WeakPolarHBondContact O-CG2 3.16Å; A391-T395 PolarHBondContact O-N 3.1Å; A391-T395 PolarHBondContact O-OG1 3.36Å; A391-L399 HydrophobicContact CB-CB 3.9Å; A391-L399 HydrophobicContact CB-CD1 4.47Å; A391-L399 HydrophobicContact CB-CD2 3.83Å; A391-L399 HydrophobicContact CB-CG 4.28Å; A391-L462 HydrophobicContact CB-CD2 3.38Å
392	E	98.8	Very high	98.5	Very high	4 Å²	4	15.5 Å²	15.5	2%	0.019	8%	0.076	C	C	.	.	H	α-helix	trans	-67.5	-38.7	178.5	175.8	167.8	-172	0	0	113.1	I290 Y366 C388 I389 Y394 T395 G396 Y397	I290-E392 HydrophobicContact CD1-CG 3.93Å; Y366-E392 VanDerWaalsContact CE1-OE2 3.28Å; Y366-E392 WeakPolarHBondContact CE1-OE2 3.2Å; Y366-E392 PolarHBondContact OH-OE2 3.15Å; C388-E392 PolarHBondContact O-N 3.49Å; I389-E392 PolarHBondContact O-N 3.2Å; E392-Y394 PolarHBondContact O-N 2.92Å; E392-T395 PolarHBondContact O-N 3.41Å; E392-G396 VanDerWaalsContact O-CA 3.23Å; E392-G396 WeakPolarHBondContact O-CA 3.36Å; E392-G396 PolarHBondContact O-N 2.86Å; E392-Y397 WeakPolarHBondContact CA-O 3.24Å
393	L	98.6	Very high	98.3	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-61.1	-29.8	171.3	-71.7	167.6	0	0	0	112	L286 I290 F298 I303 F306 I389 L390	L286-L393 HydrophobicContact CB-CD2 4.27Å; L286-L393 HydrophobicContact CD1-CD1 4.1Å; L286-L393 HydrophobicContact CD1-CD2 4.19Å; I290-L393 HydrophobicContact CD1-CD2 4.03Å; I290-L393 HydrophobicContact CG1-CD2 4.08Å; F298-L393 WeakPolarHBondContact CB-O 3.43Å; F298-L393 HydrophobicContact CD2-CB 4.23Å; F298-L393 HydrophobicContact CD2-CD2 3.8Å; F298-L393 VanDerWaalsContact CD2-O 3.29Å; F298-L393 WeakPolarHBondContact CD2-O 3.39Å; F298-L393 HydrophobicContact CE2-CD2 3.76Å; F298-L393 PolarHBondContact N-O 3.17Å; I303-L393 HydrophobicContact CD1-CB 4.28Å; I303-L393 HydrophobicContact CG1-CB 4.08Å; I303-L393 HydrophobicContact CG2-CB 4.46Å; F306-L393 HydrophobicContact CD2-CD1 4.25Å; I389-L393 HydrophobicContact CG2-CD1 3.79Å; I389-L393 HydrophobicContact CG2-CG 4.34Å; I389-L393 WeakPolarHBondContact O-CB 3.3Å; I389-L393 VanDerWaalsContact O-CG 3.24Å; I389-L393 WeakPolarHBondContact O-CG 3.28Å; I389-L393 PolarHBondContact O-N 3.42Å; L390-L393 HydrophobicContact CD2-CD1 4.27Å
394	Y	98.6	Very high	98.1	Very high	56 Å²	56	21 Å²	21	22%	0.22	11%	0.107	C	C	.	.	H	α-helix	trans	-80.6	-45.4	177.5	-173.4	-107.9	0	0	0	113.5	G297 L300 I303 L390 A391 E392 L462 T464 F469	G297-Y394 VanDerWaalsContact CA-O 3.28Å; G297-Y394 WeakPolarHBondContact CA-O 3.29Å; L300-Y394 HydrophobicContact CD1-CE2 4.25Å; L300-Y394 HydrophobicContact CD2-CD2 3.51Å; L300-Y394 HydrophobicContact CD2-CE2 3.64Å; L300-Y394 HydrophobicContact CD2-CG 4.31Å; L300-Y394 HydrophobicContact CG-CD2 3.99Å; L300-Y394 HydrophobicContact CG-CE2 3.66Å; I303-Y394 VanDerWaalsContact CD1-CA 3.41Å; I303-Y394 HydrophobicContact CD1-CD2 3.72Å; I303-Y394 HydrophobicContact CD1-CG 4.2Å; L390-Y394 PolarHBondContact O-N 2.93Å; L390-Y394 VanDerWaalsContact O-N 3.12Å; A391-Y394 WeakPolarHBondContact O-CB 3.48Å; A391-Y394 PolarHBondContact O-N 3.25Å; A391-Y394 VanDerWaalsContact O-N 3.13Å; E392-Y394 PolarHBondContact O-N 2.92Å; Y394-L462 VanDerWaalsContact CD1-O 3.25Å; Y394-L462 WeakPolarHBondContact CD1-O 3.22Å; Y394-L462 WeakPolarHBondContact CE1-O 3.47Å; Y394-T464 HydrophobicContact CD1-CG2 4.49Å; Y394-T464 HydrophobicContact CE1-CG2 3.95Å; Y394-F469 HydrophobicContact CD1-CE1 4.01Å; Y394-F469 HydrophobicContact CD2-CE1 4.33Å; Y394-F469 AromaticContact CG-CE1 3.79Å; Y394-F469 HydrophobicContact CG-CE1 3.79Å; Y394-F469 HydrophobicContact CG-CZ 4.3Å
395	T	98.3	Very high	97.9	Very high	21 Å²	21	22.5 Å²	22.5	13%	0.129	11%	0.114	C	C	.	.	H	α-helix	trans	-89	-21.3	-174.9	63.8	0	0	0	0	113.8	A391 E392 Y397 L462	A391-T395 WeakPolarHBondContact O-CG2 3.16Å; A391-T395 PolarHBondContact O-N 3.1Å; A391-T395 PolarHBondContact O-OG1 3.36Å; E392-T395 PolarHBondContact O-N 3.41Å; T395-Y397 VanDerWaalsContact C-N 3.35Å; T395-Y397 WeakPolarHBondContact O-CD2 3.31Å; T395-Y397 PolarHBondContact OG1-N 2.92Å; T395-Y397 PolarHBondContact OG1-O 2.8Å; T395-L462 HydrophobicContact CG2-CD2 4.3Å; T395-L462 WeakPolarHBondContact CG2-O 3.1Å
396	G	98.2	Very high	97.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.127	C	C	.	.	S	Bend	trans	82.5	1.3	-166.8	0	0	0	0	0	114.9	F295 E392	F295-G396 WeakPolarHBondContact CD1-O 3.48Å; E392-G396 VanDerWaalsContact O-CA 3.23Å; E392-G396 WeakPolarHBondContact O-CA 3.36Å; E392-G396 PolarHBondContact O-N 2.86Å
397	Y	98.2	Very high	97.5	Very high	124 Å²	124	24.9 Å²	24.9	49%	0.486	13%	0.128	S	C	.	.	S	Bend	trans	-140.6	146.6	-174.4	-62.2	-88	0	0	0	112.2	F295 E392 T395 L399	F295-Y397 HydrophobicContact CB-CE1 4.23Å; F295-Y397 HydrophobicContact CB-CE2 4.07Å; E392-Y397 WeakPolarHBondContact CA-O 3.24Å; T395-Y397 VanDerWaalsContact C-N 3.35Å; T395-Y397 WeakPolarHBondContact O-CD2 3.31Å; T395-Y397 PolarHBondContact OG1-N 2.92Å; T395-Y397 PolarHBondContact OG1-O 2.8Å; Y397-L399 PolarHBondContact O-N 3.44Å
398	P	98.4	Very high	97.5	Very high	34 Å²	34	24.9 Å²	24.9	22%	0.221	13%	0.128	C	C	.	.			trans	-56.3	131.3	177.5	-23.7	31.1	0	0	0	112.2	F365 F400 P401	F365-P398 HydrophobicContact CB-CB 4.24Å; F365-P398 HydrophobicContact CD2-CB 3.91Å; F365-P398 HydrophobicContact CD2-CG 3.84Å; F365-P398 HydrophobicContact CE2-CG 4.14Å; F365-P398 HydrophobicContact CG-CB 4.17Å; P398-F400 VanDerWaalsContact C-N 3.34Å; P398-F400 PolarHBondContact O-N 2.85Å; P398-P401 HydrophobicContact CB-CB 4.36Å
399	L	98.4	Very high	97.4	Very high	23 Å²	23	25 Å²	25	12%	0.12	13%	0.128	C	C	.	.	S	Bend	trans	-62.9	-39.3	-179.1	-178.5	62	0	0	0	112.4	A391 Y397 P401 A461 L462 L477	A391-L399 HydrophobicContact CB-CB 3.9Å; A391-L399 HydrophobicContact CB-CD1 4.47Å; A391-L399 HydrophobicContact CB-CD2 3.83Å; A391-L399 HydrophobicContact CB-CG 4.28Å; Y397-L399 PolarHBondContact O-N 3.44Å; L399-P401 WeakPolarHBondContact O-CD 3.06Å; L399-A461 HydrophobicContact CD1-CB 4.06Å; L399-L462 HydrophobicContact CD1-CD2 4.03Å; L399-L477 HydrophobicContact CD2-CD1 3.57Å
400	F	98.1	Very high	97.3	Very high	1 Å²	1	25.4 Å²	25.4	0%	0.004	13%	0.132	C	C	.	.	S	Bend	trans	-124.2	81.5	-179.1	-55.5	-53	0	0	0	110.6	F365 W384 P398 G402 Q408 C411 I412 V415 L416 L477	F365-F400 WeakPolarHBondContact CD1-O 3.29Å; W384-F400 HydrophobicContact CH2-CE2 4.38Å; W384-F400 HydrophobicContact CZ2-CD2 4.22Å; W384-F400 AromaticContact CZ2-CE2 3.81Å; W384-F400 HydrophobicContact CZ2-CE2 3.81Å; P398-F400 VanDerWaalsContact C-N 3.34Å; P398-F400 PolarHBondContact O-N 2.85Å; F400-G402 PolarHBondContact O-N 2.88Å; F400-Q408 PolarHBondContact O-NE2 2.99Å; F400-Q408 PolarHBondContact O-OE1 3.48Å; F400-C411 HydrophobicContact CB-CB 4.17Å; F400-C411 HydrophobicContact CD1-CB 4.31Å; F400-C411 WeakPolarHBondContact CD1-O 3.37Å; F400-I412 HydrophobicContact CB-CG1 4.34Å; F400-I412 HydrophobicContact CD1-CG1 4.12Å; F400-I412 HydrophobicContact CD2-CG1 3.86Å; F400-I412 HydrophobicContact CE1-CG1 4.38Å; F400-I412 HydrophobicContact CE2-CG1 4.13Å; F400-I412 HydrophobicContact CG-CG1 3.85Å; F400-I412 HydrophobicContact CZ-CG1 4.38Å; F400-V415 HydrophobicContact CE1-CB 4.02Å; F400-V415 HydrophobicContact CE1-CG2 3.98Å; F400-L416 HydrophobicContact CZ-CD1 4.37Å; F400-L416 HydrophobicContact CZ-CG 4.38Å; F400-L477 HydrophobicContact CE2-CD1 4Å; F400-L477 HydrophobicContact CE2-CD2 4.25Å; F400-L477 HydrophobicContact CZ-CD1 4.1Å
401	P	96.9	Very high	97.2	Very high	54 Å²	54	25.6 Å²	25.6	35%	0.351	13%	0.133	S	C	.	.			trans	-89.3	66.6	-175.8	36	-35	0	0	0	111.6	F365 P398 L399	F365-P401 HydrophobicContact CE1-CB 4.4Å; P398-P401 HydrophobicContact CB-CB 4.36Å; L399-P401 WeakPolarHBondContact O-CD 3.06Å
402	G	96.2	Very high	97.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.133	C	C	.	.			trans	-80	135.9	178	0	0	0	0	0	113.4	R364 F365 F400	R364-G402 WeakPolarHBondContact CD-O 3.45Å; F365-G402 WeakPolarHBondContact CE1-O 3.07Å; F400-G402 PolarHBondContact O-N 2.88Å
403	E	94.9	Very high	97.1	Very high	75 Å²	75	25.7 Å²	25.7	35%	0.35	13%	0.134	S	C	.	.	S	Bend	trans	-72.8	-33.9	178.1	-66.6	164.9	-179.8	0	0	111.8	R364 E407 S446	R364-E403 PolarHBondContact NH1-O 2.97Å; R364-E403 PolarHBondContact NH2-O 2.89Å; E403-E407 WeakPolarHBondContact CB-OE2 3.34Å; E403-E407 VanDerWaalsContact CG-OE2 3.31Å; E403-E407 WeakPolarHBondContact CG-OE2 3.31Å; E403-E407 PolarHBondContact N-OE2 2.87Å; E403-S446 VanDerWaalsContact CD-OG 3.27Å; E403-S446 WeakPolarHBondContact OE1-CB 3.25Å; E403-S446 PolarHBondContact OE1-OG 3.21Å; E403-S446 VanDerWaalsContact OE2-CB 3.27Å; E403-S446 WeakPolarHBondContact OE2-CB 3.47Å; E403-S446 PolarHBondContact OE2-N 2.96Å; E403-S446 PolarHBondContact OE2-OG 3.39Å
404	S	94.9	Very high	97	Very high	48 Å²	48	26.2 Å²	26.2	34%	0.336	14%	0.136	S	C	.	.	S	Bend	trans	-127.9	171.7	178.2	67.9	0	0	0	0	111.6	V406 E407 Q408	S404-V406 PolarHBondContact O-N 3.45Å; S404-V406 PolarHBondContact OG-N 2.84Å; S404-E407 PolarHBondContact O-N 3.34Å; S404-E407 PolarHBondContact OG-N 3.29Å; S404-E407 VanDerWaalsContact OG-N 3.07Å; S404-Q408 VanDerWaalsContact O-CB 3.29Å; S404-Q408 WeakPolarHBondContact O-CB 3.43Å; S404-Q408 PolarHBondContact O-N 2.81Å
405	E	95.1	Very high	97	Very high	32 Å²	32	24.3 Å²	24.3	15%	0.15	13%	0.13	C	C	.	.	H	α-helix	trans	-58.6	-32.3	170.4	-70.4	-170.3	105.9	0	0	112.6	Y360 R367 I372 Q408 I409 R429 F433	Y360-E405 HydrophobicContact CE2-CG 4.07Å; R367-E405 IonicContact NH1-OE1 2.86Å; R367-E405 PolarHBondContact NH1-OE1 3.29Å; I372-E405 HydrophobicContact CG2-CB 4.49Å; E405-Q408 PolarHBondContact O-N 3.36Å; E405-I409 PolarHBondContact O-N 3.4Å; E405-R429 IonicContact OE1-CZ 2.93Å; E405-R429 IonicContact OE1-NH1 3.37Å; E405-R429 PolarHBondContact OE1-NH1 2.94Å; E405-R429 IonicContact OE1-NH2 2.76Å; E405-R429 IonicContact OE2-CZ 3.54Å; E405-R429 IonicContact OE2-NH1 2.78Å; E405-R429 PolarHBondContact OE2-NH1 3.45Å; E405-R429 IonicContact OE2-NH2 3.54Å; E405-R429 PolarHBondContact OE2-NH2 3.19Å; E405-F433 HydrophobicContact CB-CE1 4.33Å
406	V	94.4	Very high	96.9	Very high	46 Å²	46	25 Å²	25	28%	0.279	13%	0.133	S	C	.	.	H	α-helix	trans	-76.3	-40.4	-177.9	-145.5	0	0	0	0	110.5	S404 Q408 I409 A410 F433 I443	S404-V406 PolarHBondContact O-N 3.45Å; S404-V406 PolarHBondContact OG-N 2.84Å; V406-Q408 VanDerWaalsContact C-N 3.34Å; V406-I409 VanDerWaalsContact O-CG2 3.31Å; V406-I409 WeakPolarHBondContact O-CG2 3.46Å; V406-A410 PolarHBondContact O-N 3.4Å; V406-F433 HydrophobicContact CB-CD1 4.31Å; V406-F433 HydrophobicContact CB-CE1 4.33Å; V406-F433 HydrophobicContact CG1-CD1 3.69Å; V406-F433 HydrophobicContact CG1-CE1 4.17Å; V406-F433 HydrophobicContact CG2-CE1 4.31Å; V406-I443 HydrophobicContact CB-CD1 3.76Å; V406-I443 HydrophobicContact CG1-CD1 3.39Å; V406-I443 HydrophobicContact CG1-CG1 4.32Å; V406-I443 WeakPolarHBondContact O-CD1 3.32Å
407	E	95.4	Very high	96.9	Very high	4 Å²	4	25.5 Å²	25.5	2%	0.019	14%	0.138	C	C	.	.	H	α-helix	trans	-69.6	-33.5	169.8	-157.6	-158.9	172.9	0	0	111.4	E403 S404 I409 A410 C411 N445 R451	E403-E407 WeakPolarHBondContact CB-OE2 3.34Å; E403-E407 VanDerWaalsContact CG-OE2 3.31Å; E403-E407 WeakPolarHBondContact CG-OE2 3.31Å; E403-E407 PolarHBondContact N-OE2 2.87Å; S404-E407 PolarHBondContact O-N 3.34Å; S404-E407 PolarHBondContact OG-N 3.29Å; S404-E407 VanDerWaalsContact OG-N 3.07Å; E407-I409 PolarHBondContact O-N 3.35Å; E407-A410 CarbonylContact O-C 3.57Å; E407-A410 WeakPolarHBondContact O-CA 3.38Å; E407-A410 WeakPolarHBondContact O-CB 3.36Å; E407-A410 PolarHBondContact O-N 3.19Å; E407-C411 PolarHBondContact O-N 3.01Å; E407-C411 PolarHBondContact O-SG 2.98Å; E407-N445 VanDerWaalsContact CD-CB 3.48Å; E407-N445 HydrophobicContact CG-CB 4.34Å; E407-N445 VanDerWaalsContact OE1-CB 3.29Å; E407-N445 WeakPolarHBondContact OE1-CB 3.49Å; E407-N445 PolarHBondContact OE1-ND2 3.07Å; E407-R451 IonicContact OE1-CZ 3.81Å; E407-R451 IonicContact OE1-NE 2.72Å; E407-R451 PolarHBondContact OE1-NE 3.37Å; E407-R451 IonicContact OE1-NH2 3.66Å; E407-R451 PolarHBondContact OE1-NH2 2.86Å
408	Q	97.8	Very high	96.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-57	-48.6	178.7	-170.7	64.1	26.5	0	0	111.4	R364 I372 F400 S404 E405 V406 A410 C411 I412	R364-Q408 HydrophobicContact CG-CB 4.21Å; R364-Q408 HydrophobicContact CG-CG 4.12Å; R364-Q408 PolarHBondContact O-NE2 3.23Å; I372-Q408 HydrophobicContact CD1-CB 4.16Å; I372-Q408 HydrophobicContact CD1-CG 3.68Å; F400-Q408 PolarHBondContact O-NE2 2.99Å; F400-Q408 PolarHBondContact O-OE1 3.48Å; S404-Q408 VanDerWaalsContact O-CB 3.29Å; S404-Q408 WeakPolarHBondContact O-CB 3.43Å; S404-Q408 PolarHBondContact O-N 2.81Å; E405-Q408 PolarHBondContact O-N 3.36Å; V406-Q408 VanDerWaalsContact C-N 3.34Å; Q408-A410 VanDerWaalsContact C-N 3.29Å; Q408-A410 PolarHBondContact O-N 3.31Å; Q408-C411 PolarHBondContact O-N 3.47Å; Q408-I412 HydrophobicContact CG-CD1 4.48Å; Q408-I412 VanDerWaalsContact O-CG1 3.3Å; Q408-I412 WeakPolarHBondContact O-CG1 3.28Å; Q408-I412 PolarHBondContact O-N 3.02Å; Q408-I412 VanDerWaalsContact O-N 3.1Å
409	I	97.3	Very high	96.7	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-67	-31.2	176.7	-160.1	66.8	0	0	0	112.1	P369 I372 E405 V406 E407 I412 M413 F433 W479	P369-I409 HydrophobicContact CB-CD1 4.06Å; I372-I409 HydrophobicContact CG2-CB 4.21Å; E405-I409 PolarHBondContact O-N 3.4Å; V406-I409 VanDerWaalsContact O-CG2 3.31Å; V406-I409 WeakPolarHBondContact O-CG2 3.46Å; E407-I409 PolarHBondContact O-N 3.35Å; I409-I412 HydrophobicContact CD1-CD1 4.22Å; I409-I412 PolarHBondContact O-N 3.5Å; I409-M413 HydrophobicContact CG1-CE 4.25Å; I409-M413 HydrophobicContact CG2-CE 4.16Å; I409-M413 WeakPolarHBondContact O-CE 3.44Å; I409-M413 WeakPolarHBondContact O-CG 3.28Å; I409-M413 PolarHBondContact O-N 3.46Å; I409-F433 HydrophobicContact CB-CD1 4.47Å; I409-F433 HydrophobicContact CG2-CB 4.17Å; I409-F433 HydrophobicContact CG2-CD1 3.48Å; I409-F433 VanDerWaalsContact CG2-CD1 3.48Å; I409-F433 HydrophobicContact CG2-CE1 4.16Å; I409-F433 HydrophobicContact CG2-CG 4.05Å; I409-W479 HydrophobicContact CD1-CH2 3.98Å; I409-W479 HydrophobicContact CD1-CZ3 3.81Å
410	A	96.4	Very high	96.5	Very high	10 Å²	10	23.8 Å²	23.8	8%	0.083	14%	0.142	C	C	.	.	H	α-helix	trans	-71.4	-35.9	175.9	0	0	0	0	0	113.3	V406 E407 Q408 I412 M413 E414 I443 R451	V406-A410 PolarHBondContact O-N 3.4Å; E407-A410 CarbonylContact O-C 3.57Å; E407-A410 WeakPolarHBondContact O-CA 3.38Å; E407-A410 WeakPolarHBondContact O-CB 3.36Å; E407-A410 PolarHBondContact O-N 3.19Å; Q408-A410 VanDerWaalsContact C-N 3.29Å; Q408-A410 PolarHBondContact O-N 3.31Å; A410-I412 VanDerWaalsContact C-N 3.33Å; A410-M413 PolarHBondContact O-N 2.95Å; A410-E414 WeakPolarHBondContact O-CB 3.43Å; A410-E414 PolarHBondContact O-N 3.39Å; A410-I443 HydrophobicContact CB-CD1 4.07Å; A410-R451 HydrophobicContact CB-CB 4Å; A410-R451 HydrophobicContact CB-CG 4.18Å
411	C	97	Very high	96.3	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.02	17%	0.171	C	C	.	.	H	α-helix	trans	-63.5	-38.8	169.7	-72.6	0	0	0	0	111.7	F400 E407 Q408 E414 R451	F400-C411 HydrophobicContact CB-CB 4.17Å; F400-C411 HydrophobicContact CD1-CB 4.31Å; F400-C411 WeakPolarHBondContact CD1-O 3.37Å; E407-C411 PolarHBondContact O-N 3.01Å; E407-C411 PolarHBondContact O-SG 2.98Å; Q408-C411 PolarHBondContact O-N 3.47Å; C411-E414 PolarHBondContact O-N 3.4Å; C411-R451 PolarHBondContact SG-NH2 3.48Å; C411-R451 VanDerWaalsContact SG-NH2 3.45Å
412	I	98.3	Very high	96.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.4	-49.4	174.8	-64.9	166.9	0	0	0	110.2	I372 W384 F400 Q408 I409 A410 E414 V415 L416 W479	I372-I412 HydrophobicContact CD1-CD1 4.1Å; W384-I412 HydrophobicContact CH2-CD1 4.25Å; W384-I412 HydrophobicContact CH2-CG1 4.38Å; W384-I412 HydrophobicContact CH2-CG2 3.66Å; W384-I412 HydrophobicContact CZ2-CD1 3.63Å; W384-I412 HydrophobicContact CZ2-CG1 3.89Å; W384-I412 HydrophobicContact CZ2-CG2 4.04Å; F400-I412 HydrophobicContact CB-CG1 4.34Å; F400-I412 HydrophobicContact CD1-CG1 4.12Å; F400-I412 HydrophobicContact CD2-CG1 3.86Å; F400-I412 HydrophobicContact CE1-CG1 4.38Å; F400-I412 HydrophobicContact CE2-CG1 4.13Å; F400-I412 HydrophobicContact CG-CG1 3.85Å; F400-I412 HydrophobicContact CZ-CG1 4.38Å; Q408-I412 HydrophobicContact CG-CD1 4.48Å; Q408-I412 VanDerWaalsContact O-CG1 3.3Å; Q408-I412 WeakPolarHBondContact O-CG1 3.28Å; Q408-I412 PolarHBondContact O-N 3.02Å; Q408-I412 VanDerWaalsContact O-N 3.1Å; I409-I412 HydrophobicContact CD1-CD1 4.22Å; I409-I412 PolarHBondContact O-N 3.5Å; A410-I412 VanDerWaalsContact C-N 3.33Å; I412-E414 VanDerWaalsContact C-N 3.27Å; I412-E414 PolarHBondContact O-N 3.1Å; I412-V415 PolarHBondContact O-N 3.21Å; I412-L416 HydrophobicContact CG2-CD1 3.71Å; I412-L416 HydrophobicContact CG2-CG 4.28Å; I412-L416 WeakPolarHBondContact O-CB 3.31Å; I412-L416 PolarHBondContact O-N 3.19Å; I412-W479 HydrophobicContact CB-CH2 4.28Å; I412-W479 HydrophobicContact CG2-CH2 3.45Å; I412-W479 VanDerWaalsContact CG2-CH2 3.45Å; I412-W479 HydrophobicContact CG2-CZ2 3.7Å; I412-W479 HydrophobicContact CG2-CZ3 4.04Å
413	M	97.6	Very high	96.1	Very high	6 Å²	6	33.8 Å²	33.8	3%	0.03	19%	0.192	C	C	.	.	H	α-helix	trans	-64.2	-30.1	179.7	-71	-177.3	-69.6	0	0	113.4	I409 A410 V415 G417 F434 P440 P453 D454 W479	I409-M413 HydrophobicContact CG1-CE 4.25Å; I409-M413 HydrophobicContact CG2-CE 4.16Å; I409-M413 WeakPolarHBondContact O-CE 3.44Å; I409-M413 WeakPolarHBondContact O-CG 3.28Å; I409-M413 PolarHBondContact O-N 3.46Å; A410-M413 PolarHBondContact O-N 2.95Å; M413-V415 PolarHBondContact O-N 2.86Å; M413-G417 VanDerWaalsContact CA-O 3.23Å; M413-G417 WeakPolarHBondContact CA-O 3.48Å; M413-G417 WeakPolarHBondContact CB-O 3.49Å; M413-G417 WeakPolarHBondContact CG-O 3.23Å; M413-G417 WeakPolarHBondContact O-CA 3.48Å; M413-G417 PolarHBondContact O-N 3.14Å; M413-G417 VanDerWaalsContact O-N 3.12Å; M413-F434 HydrophobicContact SD-CE1 4.04Å; M413-F434 HydrophobicContact SD-CZ 4.13Å; M413-P440 HydrophobicContact CE-CB 3.87Å; M413-P440 HydrophobicContact CE-CG 4.23Å; M413-P440 HydrophobicContact SD-CB 4.07Å; M413-P440 HydrophobicContact SD-CG 3.73Å; M413-P453 HydrophobicContact CB-CB 4.23Å; M413-P453 HydrophobicContact CB-CG 4.33Å; M413-P453 CarbonylContact O-C 3.33Å; M413-P453 VanDerWaalsContact O-CA 3.23Å; M413-P453 WeakPolarHBondContact O-CA 3.33Å; M413-D454 PolarHBondContact O-N 2.86Å; M413-W479 HydrophobicContact CG-CH2 3.75Å; M413-W479 HydrophobicContact CG-CZ2 3.86Å
414	E	96.6	Very high	96.1	Very high	12 Å²	12	30.8 Å²	30.8	6%	0.056	18%	0.178	C	C	.	.	H	α-helix	trans	-57.1	-30.5	176.2	-174.4	172.7	-122.4	0	0	112.8	A410 C411 I412 K449 R451 K452 S455 V456	A410-E414 WeakPolarHBondContact O-CB 3.43Å; A410-E414 PolarHBondContact O-N 3.39Å; C411-E414 PolarHBondContact O-N 3.4Å; I412-E414 VanDerWaalsContact C-N 3.27Å; I412-E414 PolarHBondContact O-N 3.1Å; E414-K449 VanDerWaalsContact CD-NZ 3.28Å; E414-K449 WeakPolarHBondContact OE1-CE 3.5Å; E414-K449 IonicContact OE1-NZ 3.1Å; E414-K449 PolarHBondContact OE1-NZ 3.13Å; E414-K449 IonicContact OE2-NZ 2.81Å; E414-K449 PolarHBondContact OE2-NZ 2.77Å; E414-K449 VanDerWaalsContact OE2-NZ 3.1Å; E414-R451 VanDerWaalsContact CD-CD 3.46Å; E414-R451 VanDerWaalsContact OE1-CD 3.28Å; E414-R451 WeakPolarHBondContact OE1-CD 3.48Å; E414-R451 IonicContact OE1-NH1 3.28Å; E414-R451 VanDerWaalsContact OE2-CD 3.28Å; E414-R451 WeakPolarHBondContact OE2-CD 3.44Å; E414-R451 IonicContact OE2-CZ 2.86Å; E414-R451 IonicContact OE2-NE 3.57Å; E414-R451 IonicContact OE2-NH1 3.57Å; E414-R451 PolarHBondContact OE2-NH1 3.21Å; E414-K452 WeakPolarHBondContact CA-O 3.32Å; E414-S455 PolarHBondContact O-N 2.76Å; E414-S455 VanDerWaalsContact O-N 3.12Å; E414-V456 HydrophobicContact CG-CB 4.23Å; E414-V456 HydrophobicContact CG-CG2 3.78Å; E414-V456 PolarHBondContact O-N 3.19Å
415	V	97.8	Very high	96.1	Very high	15 Å²	15	34.5 Å²	34.5	9%	0.091	19%	0.191	C	C	.	.	H	α-helix	trans	-110.6	-28.7	-176.1	-170.4	0	0	0	0	113.9	F400 I412 M413 V456 M458 A461	F400-V415 HydrophobicContact CE1-CB 4.02Å; F400-V415 HydrophobicContact CE1-CG2 3.98Å; I412-V415 PolarHBondContact O-N 3.21Å; M413-V415 PolarHBondContact O-N 2.86Å; V415-V456 WeakPolarHBondContact CA-O 3.43Å; V415-V456 HydrophobicContact CG2-CB 4.47Å; V415-M458 HydrophobicContact CG1-CB 4.31Å; V415-M458 HydrophobicContact CG1-CE 3.82Å; V415-M458 HydrophobicContact CG1-SD 4.01Å; V415-A461 HydrophobicContact CG1-CB 4.08Å; V415-A461 HydrophobicContact CG2-CB 4.32Å
416	L	97.8	Very high	96.1	Very high	36 Å²	36	36.8 Å²	36.8	19%	0.188	21%	0.21	C	C	.	.	H	α-helix	trans	-109.6	11.7	-175.3	-55.7	-174.5	0	0	0	114.1	W384 F400 I412 M458 L477 W479	W384-L416 HydrophobicContact CH2-CD1 3.67Å; W384-L416 HydrophobicContact CZ3-CD1 4.13Å; F400-L416 HydrophobicContact CZ-CD1 4.37Å; F400-L416 HydrophobicContact CZ-CG 4.38Å; I412-L416 HydrophobicContact CG2-CD1 3.71Å; I412-L416 HydrophobicContact CG2-CG 4.28Å; I412-L416 WeakPolarHBondContact O-CB 3.31Å; I412-L416 PolarHBondContact O-N 3.19Å; L416-M458 HydrophobicContact CD2-CE 3.41Å; L416-M458 VanDerWaalsContact CD2-CE 3.41Å; L416-L477 HydrophobicContact CD1-CB 4.11Å; L416-L477 WeakPolarHBondContact CD1-O 3.36Å; L416-W479 HydrophobicContact CB-CZ2 4.13Å; L416-W479 PolarHBondContact O-NE1 3.49Å
417	G	96.9	Very high	96.2	Very high	10 Å²	10	34.6 Å²	34.6	10%	0.103	20%	0.197	C	C	.	.			trans	62.2	-165.4	-171.3	0	0	0	0	0	113.1	M413 W479	M413-G417 VanDerWaalsContact CA-O 3.23Å; M413-G417 WeakPolarHBondContact CA-O 3.48Å; M413-G417 WeakPolarHBondContact CB-O 3.49Å; M413-G417 WeakPolarHBondContact CG-O 3.23Å; M413-G417 WeakPolarHBondContact O-CA 3.48Å; M413-G417 PolarHBondContact O-N 3.14Å; M413-G417 VanDerWaalsContact O-N 3.12Å; G417-W479 WeakPolarHBondContact O-CZ2 3.39Å
418	T	96	Very high	96.2	Very high	76 Å²	76	38.5 Å²	38.5	47%	0.466	23%	0.225	S	C	.	.	S	Bend	trans	-79.4	144.2	175.7	52.1	0	0	0	0	111.8	P440 P453	T418-P440 HydrophobicContact CG2-CG 3.83Å; T418-P453 HydrophobicContact CG2-CB 3.83Å; T418-P453 HydrophobicContact CG2-CG 3.96Å
419	P	96.3	Very high	96.1	Very high	4 Å²	4	41.5 Å²	41.5	3%	0.026	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-59	153.2	171.8	20.4	-29.7	0	0	0	112.3	F423 V424 F434 W479	P419-F423 HydrophobicContact CB-CD1 4.02Å; P419-V424 HydrophobicContact CB-CG2 3.96Å; P419-V424 HydrophobicContact CG-CG2 3.52Å; P419-F434 HydrophobicContact CG-CE1 4.22Å; P419-F434 HydrophobicContact CG-CZ 3.69Å; P419-W479 HydrophobicContact CB-CD2 3.8Å; P419-W479 HydrophobicContact CB-CE3 3.69Å; P419-W479 HydrophobicContact CB-CG 4.4Å; P419-W479 HydrophobicContact CB-CH2 4.16Å; P419-W479 HydrophobicContact CB-CZ2 4.28Å; P419-W479 HydrophobicContact CB-CZ3 3.86Å; P419-W479 HydrophobicContact CG-CE3 4.43Å; P419-W479 HydrophobicContact CG-CH2 4.08Å; P419-W479 HydrophobicContact CG-CZ2 4.39Å; P419-W479 HydrophobicContact CG-CZ3 4.09Å
420	P	95.8	Very high	96.1	Very high	65 Å²	65	46.3 Å²	46.3	42%	0.422	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-55.4	140.4	174.1	-25.1	34.4	0	0	0	112.6	D422 F423 V424	P420-D422 VanDerWaalsContact C-N 3.31Å; P420-D422 PolarHBondContact O-N 2.95Å; P420-F423 HydrophobicContact CB-CB 4.36Å; P420-F423 WeakPolarHBondContact O-CB 3.48Å; P420-F423 PolarHBondContact O-N 3.11Å; P420-V424 PolarHBondContact O-N 3.44Å; P420-V424 VanDerWaalsContact O-N 3.14Å
421	N	94.1	Very high	96	Very high	116 Å²	116	53.5 Å²	53.5	62%	0.62	28%	0.283	S	S	*	.	H	α-helix	trans	-53.5	-44.8	-175.7	-75.4	-19.8	0	0	0	113	F423 V424 Q425	N421-F423 VanDerWaalsContact C-N 3.27Å; N421-F423 PolarHBondContact O-N 3.46Å; N421-V424 PolarHBondContact O-N 2.93Å; N421-Q425 WeakPolarHBondContact O-CG 3.49Å; N421-Q425 PolarHBondContact O-N 3.24Å
422	D	93.8	Very high	95.9	Very high	126 Å²	126	57.7 Å²	57.7	67%	0.674	31%	0.305	S	S	*	.	H	α-helix	trans	-62.8	-35.4	-178.9	-54.1	-21.5	0	0	0	111.9	P420 Q425 S426	P420-D422 VanDerWaalsContact C-N 3.31Å; P420-D422 PolarHBondContact O-N 2.95Å; D422-Q425 PolarHBondContact O-N 3.47Å; D422-S426 WeakPolarHBondContact O-CB 3.41Å; D422-S426 PolarHBondContact O-N 2.88Å; D422-S426 PolarHBondContact O-OG 3.01Å
423	F	95.1	Very high	95.7	Very high	24 Å²	24	57.8 Å²	57.8	11%	0.105	31%	0.305	C	S	.	.	H	α-helix	trans	-69.8	-32	175.8	-172.1	-107.9	0	0	0	111.9	P369 E370 L373 H375 P419 P420 N421 W479	P369-F423 HydrophobicContact CB-CE1 4.39Å; E370-F423 HydrophobicContact CB-CZ 4.22Å; L373-F423 HydrophobicContact CD1-CD1 4.01Å; L373-F423 HydrophobicContact CD1-CE1 3.63Å; H375-F423 AromaticContact CD2-CD2 3.95Å; H375-F423 AromaticContact CD2-CE2 3.47Å; H375-F423 VanDerWaalsContact CD2-CE2 3.47Å; H375-F423 WeakPolarHBondContact CD2-CE2 3.24Å; H375-F423 AromaticContact CD2-CZ 3.62Å; H375-F423 PolarHBondContact CE1-O 3.44Å; H375-F423 AromaticContact NE2-CD2 3.6Å; H375-F423 AromaticContact NE2-CE2 3.64Å; H375-F423 AromaticContact NE2-CG 3.93Å; H375-F423 PolarHBondContact NE2-O 3.47Å; P419-F423 HydrophobicContact CB-CD1 4.02Å; P420-F423 HydrophobicContact CB-CB 4.36Å; P420-F423 WeakPolarHBondContact O-CB 3.48Å; P420-F423 PolarHBondContact O-N 3.11Å; N421-F423 VanDerWaalsContact C-N 3.27Å; N421-F423 PolarHBondContact O-N 3.46Å; F423-W479 HydrophobicContact CE1-CE3 4.17Å; F423-W479 VanDerWaalsContact CZ-O 3.27Å; F423-W479 WeakPolarHBondContact CZ-O 3.4Å
424	V	95.1	Very high	95.6	Very high	11 Å²	11	57.8 Å²	57.8	7%	0.067	31%	0.305	C	S	.	.	H	α-helix	trans	-75	-42.9	172.1	-179.8	0	0	0	0	111.4	P419 P420 N421 A427 R430 F434	P419-V424 HydrophobicContact CB-CG2 3.96Å; P419-V424 HydrophobicContact CG-CG2 3.52Å; P420-V424 PolarHBondContact O-N 3.44Å; P420-V424 VanDerWaalsContact O-N 3.14Å; N421-V424 PolarHBondContact O-N 2.93Å; V424-A427 WeakPolarHBondContact O-CB 3.38Å; V424-A427 PolarHBondContact O-N 3.11Å; V424-R430 HydrophobicContact CG1-CB 4.32Å; V424-R430 WeakPolarHBondContact O-CB 3.19Å; V424-R430 WeakPolarHBondContact O-CD 3.49Å; V424-F434 HydrophobicContact CG1-CB 4.46Å; V424-F434 HydrophobicContact CG1-CD1 4.22Å; V424-F434 HydrophobicContact CG1-CD2 3.64Å; V424-F434 HydrophobicContact CG1-CE1 4.42Å; V424-F434 HydrophobicContact CG1-CE2 3.88Å; V424-F434 HydrophobicContact CG1-CG 3.84Å; V424-F434 HydrophobicContact CG1-CZ 4.29Å; V424-F434 HydrophobicContact CG2-CE1 4.21Å; V424-F434 HydrophobicContact CG2-CE2 4.14Å; V424-F434 HydrophobicContact CG2-CZ 3.9Å
425	Q	93.8	Very high	95.4	Very high	127 Å²	127	60 Å²	60	59%	0.593	32%	0.317	S	S	*	.	H	α-helix	trans	-67.4	-38.8	-175.8	-72.4	-177.5	20.2	0	0	112.5	N421 D422 A427 R430	N421-Q425 WeakPolarHBondContact O-CG 3.49Å; N421-Q425 PolarHBondContact O-N 3.24Å; D422-Q425 PolarHBondContact O-N 3.47Å; Q425-A427 VanDerWaalsContact C-N 3.3Å; Q425-A427 PolarHBondContact O-N 3.27Å; Q425-R430 VanDerWaalsContact O-CZ 3.28Å; Q425-R430 PolarHBondContact O-NH1 3.04Å
426	S	94.9	Very high	94.9	Very high	80 Å²	80	65.3 Å²	65.3	56%	0.559	36%	0.355	S	S	*	.	S	Bend	trans	-74.3	-16.9	176.5	50.6	0	0	0	0	113.7	H375 D422	H375-S426 VanDerWaalsContact CE1-C 3.48Å; H375-S426 PolarHBondContact CE1-OG 3.31Å; H375-S426 VanDerWaalsContact CE1-OG 3.28Å; D422-S426 WeakPolarHBondContact O-CB 3.41Å; D422-S426 PolarHBondContact O-N 2.88Å; D422-S426 PolarHBondContact O-OG 3.01Å
427	A	96.1	Very high	94.4	Very high	0 Å²	0	72 Å²	72	0%	0	38%	0.383	C	S	.	.			trans	-68.4	132.8	-178.9	0	0	0	0	0	113.1	L373 H375 V424 Q425 R430	L373-A427 HydrophobicContact CB-CB 3.85Å; H375-A427 VanDerWaalsContact CE1-CA 3.42Å; H375-A427 WeakPolarHBondContact CE1-CA 3.32Å; H375-A427 PolarHBondContact CE1-N 3.27Å; H375-A427 VanDerWaalsContact CE1-N 3.3Å; V424-A427 WeakPolarHBondContact O-CB 3.38Å; V424-A427 PolarHBondContact O-N 3.11Å; Q425-A427 VanDerWaalsContact C-N 3.3Å; Q425-A427 PolarHBondContact O-N 3.27Å; A427-R430 HydrophobicContact CB-CB 4.09Å; A427-R430 WeakPolarHBondContact O-CG 3.31Å; A427-R430 PolarHBondContact O-NH1 3.32Å
428	S	96.6	Very high	93.8	Very high	86 Å²	86	73.3 Å²	73.3	60%	0.601	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-38.1	180	66.9	0	0	0	0	112.7	L373 G374	L373-S428 PolarHBondContact O-N 3.43Å; G374-S428 WeakPolarHBondContact CA-OG 3.46Å; G374-S428 PolarHBondContact O-OG 3.48Å
429	R	96.2	Very high	93.6	Very high	63 Å²	63	73.6 Å²	73.6	24%	0.238	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	6.4	-177.9	-58.1	176.6	70.4	-161.4	5	113.8	I372 L373 E405 K431 L432 F433	I372-R429 WeakPolarHBondContact O-CD 3.41Å; I372-R429 PolarHBondContact O-NH1 3.37Å; L373-R429 WeakPolarHBondContact O-CB 3.28Å; L373-R429 PolarHBondContact O-N 3.22Å; E405-R429 IonicContact OE1-CZ 2.93Å; E405-R429 IonicContact OE1-NH1 3.37Å; E405-R429 PolarHBondContact OE1-NH1 2.94Å; E405-R429 IonicContact OE1-NH2 2.76Å; E405-R429 IonicContact OE2-CZ 3.54Å; E405-R429 IonicContact OE2-NH1 2.78Å; E405-R429 PolarHBondContact OE2-NH1 3.45Å; E405-R429 IonicContact OE2-NH2 3.54Å; E405-R429 PolarHBondContact OE2-NH2 3.19Å; R429-K431 PolarHBondContact O-N 2.93Å; R429-L432 HydrophobicContact CB-CD1 4.39Å; R429-L432 WeakPolarHBondContact O-CD1 3.49Å; R429-L432 PolarHBondContact O-N 3.45Å; R429-F433 HydrophobicContact CB-CE2 3.89Å; R429-F433 WeakPolarHBondContact O-CD2 3.4Å
430	R	95.4	Very high	93.4	Very high	103 Å²	103	75 Å²	75	39%	0.389	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-49.2	-36.6	-171.7	70	-175.8	-179.1	-95.6	12.9	115	V424 Q425 A427 L432 F433 F434	V424-R430 HydrophobicContact CG1-CB 4.32Å; V424-R430 WeakPolarHBondContact O-CB 3.19Å; V424-R430 WeakPolarHBondContact O-CD 3.49Å; Q425-R430 VanDerWaalsContact O-CZ 3.28Å; Q425-R430 PolarHBondContact O-NH1 3.04Å; A427-R430 HydrophobicContact CB-CB 4.09Å; A427-R430 WeakPolarHBondContact O-CG 3.31Å; A427-R430 PolarHBondContact O-NH1 3.32Å; R430-L432 PolarHBondContact O-N 3.36Å; R430-L432 VanDerWaalsContact O-N 3.15Å; R430-F433 PolarHBondContact O-N 3.5Å; R430-F434 HydrophobicContact CB-CD2 4.4Å; R430-F434 PolarHBondContact O-N 3.17Å
431	K	94.8	Very high	93.1	Very high	161 Å²	161	77.6 Å²	77.6	70%	0.7	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-60.7	-25	-177.2	-63.9	-176.8	-179	178.7	0	113.8	R429 F433 R441	R429-K431 PolarHBondContact O-N 2.93Å; K431-F433 VanDerWaalsContact C-N 3.34Å; K431-R441 PolarHBondContact O-NE 3.39Å; K431-R441 PolarHBondContact O-NH2 2.92Å
432	L	94.7	Very high	92.6	Very high	90 Å²	90	79.6 Å²	79.6	47%	0.471	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-72.3	-28.7	177.1	-76.2	75.3	0	0	0	112.3	R429 R430 R441	R429-L432 HydrophobicContact CB-CD1 4.39Å; R429-L432 WeakPolarHBondContact O-CD1 3.49Å; R429-L432 PolarHBondContact O-N 3.45Å; R430-L432 PolarHBondContact O-N 3.36Å; R430-L432 VanDerWaalsContact O-N 3.15Å; L432-R441 WeakPolarHBondContact O-CD 3.47Å
433	F	95.3	Very high	92.1	Very high	3 Å²	3	75.4 Å²	75.4	1%	0.013	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-27.1	-168.7	-50.7	-71.9	0	0	0	112.8	I372 L373 E405 V406 I409 R429 R430 K431 R441	I372-F433 HydrophobicContact CG2-CE1 3.72Å; I372-F433 HydrophobicContact CG2-CE2 4.03Å; I372-F433 HydrophobicContact CG2-CZ 3.44Å; I372-F433 VanDerWaalsContact CG2-CZ 3.44Å; I372-F433 VanDerWaalsContact O-CE2 3.31Å; I372-F433 WeakPolarHBondContact O-CE2 3.34Å; I372-F433 WeakPolarHBondContact O-CZ 3.48Å; L373-F433 HydrophobicContact CD2-CB 4.45Å; L373-F433 HydrophobicContact CD2-CD2 3.57Å; L373-F433 HydrophobicContact CD2-CE2 4.08Å; L373-F433 HydrophobicContact CD2-CG 4.17Å; E405-F433 HydrophobicContact CB-CE1 4.33Å; V406-F433 HydrophobicContact CB-CD1 4.31Å; V406-F433 HydrophobicContact CB-CE1 4.33Å; V406-F433 HydrophobicContact CG1-CD1 3.69Å; V406-F433 HydrophobicContact CG1-CE1 4.17Å; V406-F433 HydrophobicContact CG2-CE1 4.31Å; I409-F433 HydrophobicContact CB-CD1 4.47Å; I409-F433 HydrophobicContact CG2-CB 4.17Å; I409-F433 HydrophobicContact CG2-CD1 3.48Å; I409-F433 VanDerWaalsContact CG2-CD1 3.48Å; I409-F433 HydrophobicContact CG2-CE1 4.16Å; I409-F433 HydrophobicContact CG2-CG 4.05Å; R429-F433 HydrophobicContact CB-CE2 3.89Å; R429-F433 WeakPolarHBondContact O-CD2 3.4Å; R430-F433 PolarHBondContact O-N 3.5Å; K431-F433 VanDerWaalsContact C-N 3.34Å; F433-R441 WeakPolarHBondContact O-CB 3.47Å; F433-R441 WeakPolarHBondContact O-CG 3.47Å; F433-R441 PolarHBondContact O-N 2.88Å
434	F	95.1	Very high	91.6	Very high	6 Å²	6	77.9 Å²	77.9	3%	0.026	41%	0.41	C	S	.	.	B	Isolated β-bridge	trans	-122.3	154.2	-177.9	-56.5	-88.2	0	0	0	111.6	L373 M413 P419 V424 R430 G438 N439 P440 R441	L373-F434 HydrophobicContact CD2-CE2 3.87Å; M413-F434 HydrophobicContact SD-CE1 4.04Å; M413-F434 HydrophobicContact SD-CZ 4.13Å; P419-F434 HydrophobicContact CG-CE1 4.22Å; P419-F434 HydrophobicContact CG-CZ 3.69Å; V424-F434 HydrophobicContact CG1-CB 4.46Å; V424-F434 HydrophobicContact CG1-CD1 4.22Å; V424-F434 HydrophobicContact CG1-CD2 3.64Å; V424-F434 HydrophobicContact CG1-CE1 4.42Å; V424-F434 HydrophobicContact CG1-CE2 3.88Å; V424-F434 HydrophobicContact CG1-CG 3.84Å; V424-F434 HydrophobicContact CG1-CZ 4.29Å; V424-F434 HydrophobicContact CG2-CE1 4.21Å; V424-F434 HydrophobicContact CG2-CE2 4.14Å; V424-F434 HydrophobicContact CG2-CZ 3.9Å; R430-F434 HydrophobicContact CB-CD2 4.4Å; R430-F434 PolarHBondContact O-N 3.17Å; F434-G438 WeakPolarHBondContact CD1-O 3.46Å; F434-N439 CarbonylContact C-O 3.51Å; F434-N439 WeakPolarHBondContact CA-O 3.3Å; F434-P440 HydrophobicContact CD1-CG 4.26Å; F434-P440 HydrophobicContact CE1-CB 4.48Å; F434-P440 HydrophobicContact CE1-CG 4.01Å; F434-R441 PolarHBondContact O-NE 3.02Å; F434-R441 PolarHBondContact O-NH2 3.43Å
435	D	92.1	Very high	91.2	Very high	57 Å²	57	78.3 Å²	78.3	31%	0.305	41%	0.412	S	S	.	.			trans	-79.8	-176.4	172.1	78.1	4.5	0	0	0	112.3	K437 G438 N439	D435-K437 PolarHBondContact O-N 3.35Å; D435-K437 VanDerWaalsContact OD1-CA 3.29Å; D435-K437 WeakPolarHBondContact OD1-CA 3.29Å; D435-K437 WeakPolarHBondContact OD1-CB 3.31Å; D435-K437 PolarHBondContact OD1-N 2.93Å; D435-G438 PolarHBondContact O-N 2.94Å; D435-G438 PolarHBondContact OD1-N 2.79Å; D435-N439 PolarHBondContact N-O 3.04Å; D435-N439 PolarHBondContact OD1-N 2.97Å; D435-N439 PolarHBondContact OD1-ND2 2.88Å; D435-N439 PolarHBondContact OD2-ND2 3.45Å
436	S	88.3	Confident	90.8	Very high	127 Å²	127	76.6 Å²	76.6	89%	0.888	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-14.2	178.4	52.1	0	0	0	0	114.6
437	K	86.1	Confident	90.4	Very high	177 Å²	177	79.4 Å²	79.4	77%	0.77	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-3.2	176.9	-60.2	178.9	-179.6	-178.6	0	112.2	D435 N439	D435-K437 PolarHBondContact O-N 3.35Å; D435-K437 VanDerWaalsContact OD1-CA 3.29Å; D435-K437 WeakPolarHBondContact OD1-CA 3.29Å; D435-K437 WeakPolarHBondContact OD1-CB 3.31Å; D435-K437 PolarHBondContact OD1-N 2.93Å; K437-N439 WeakPolarHBondContact CB-ND2 3.5Å
438	G	84.9	Confident	90	Very high	37 Å²	37	81.8 Å²	81.8	38%	0.381	44%	0.441	S	S	.	.	S	Bend	trans	87.8	5.3	-177	0	0	0	0	0	114.6	F434 D435	F434-G438 WeakPolarHBondContact CD1-O 3.46Å; D435-G438 PolarHBondContact O-N 2.94Å; D435-G438 PolarHBondContact OD1-N 2.79Å
439	N	90.4	Very high	89.5	Confident	82 Å²	82	81.9 Å²	81.9	44%	0.439	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-75.6	142.4	177.5	-53.3	-63.8	0	0	0	110.7	F434 D435 K437 R441	F434-N439 CarbonylContact C-O 3.51Å; F434-N439 WeakPolarHBondContact CA-O 3.3Å; D435-N439 PolarHBondContact N-O 3.04Å; D435-N439 PolarHBondContact OD1-N 2.97Å; D435-N439 PolarHBondContact OD1-ND2 2.88Å; D435-N439 PolarHBondContact OD2-ND2 3.45Å; K437-N439 WeakPolarHBondContact CB-ND2 3.5Å; N439-R441 PolarHBondContact O-N 3.44Å
440	P	92.9	Very high	89.2	Confident	33 Å²	33	85.7 Å²	85.7	21%	0.214	45%	0.449	C	S	.	.	B	Isolated β-bridge	trans	-54.8	136.8	168.2	-26.5	35.8	0	0	0	111.8	M413 T418 F434 P453	M413-P440 HydrophobicContact CE-CB 3.87Å; M413-P440 HydrophobicContact CE-CG 4.23Å; M413-P440 HydrophobicContact SD-CB 4.07Å; M413-P440 HydrophobicContact SD-CG 3.73Å; T418-P440 HydrophobicContact CG2-CG 3.83Å; F434-P440 HydrophobicContact CD1-CG 4.26Å; F434-P440 HydrophobicContact CE1-CB 4.48Å; F434-P440 HydrophobicContact CE1-CG 4.01Å; P440-P453 HydrophobicContact CB-CG 4.4Å; P440-P453 HydrophobicContact CG-CG 3.92Å
441	R	90.6	Very high	88.9	Confident	121 Å²	121	82.6 Å²	82.6	46%	0.457	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-70.5	136.1	174	-70.2	174.9	-179.7	-86.7	1.5	110.1	K431 L432 F433 F434 N439 I443	K431-R441 PolarHBondContact O-NE 3.39Å; K431-R441 PolarHBondContact O-NH2 2.92Å; L432-R441 WeakPolarHBondContact O-CD 3.47Å; F433-R441 WeakPolarHBondContact O-CB 3.47Å; F433-R441 WeakPolarHBondContact O-CG 3.47Å; F433-R441 PolarHBondContact O-N 2.88Å; F434-R441 PolarHBondContact O-NE 3.02Å; F434-R441 PolarHBondContact O-NH2 3.43Å; N439-R441 PolarHBondContact O-N 3.44Å; R441-I443 PolarHBondContact O-N 2.6Å
442	N	83.3	Confident	88.8	Confident	158 Å²	158	81.8 Å²	81.8	85%	0.845	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-68.9	124.4	176.1	-75.3	-40	0	0	0	110.6
443	I	81.8	Confident	88.8	Confident	38 Å²	38	80 Å²	80	20%	0.195	43%	0.428	C	S	.	.			trans	-123.6	138.1	179.2	-58.2	165.7	0	0	0	108.4	V406 A410 R441 K450	V406-I443 HydrophobicContact CB-CD1 3.76Å; V406-I443 HydrophobicContact CG1-CD1 3.39Å; V406-I443 HydrophobicContact CG1-CG1 4.32Å; V406-I443 WeakPolarHBondContact O-CD1 3.32Å; A410-I443 HydrophobicContact CB-CD1 4.07Å; R441-I443 PolarHBondContact O-N 2.6Å; I443-K450 WeakPolarHBondContact O-CA 3.27Å
444	T	85.4	Confident	88.8	Confident	75 Å²	75	85.9 Å²	85.9	46%	0.46	46%	0.459	S	S	.	.	B	Isolated β-bridge	trans	-115.6	126.5	169.7	-48.2	0	0	0	0	106.4	G448 K449 K450	T444-G448 VanDerWaalsContact CG2-C 3.46Å; T444-G448 WeakPolarHBondContact CG2-O 3.27Å; T444-K449 WeakPolarHBondContact CA-O 3.32Å; T444-K450 HydrophobicContact CG2-CG 4.16Å; T444-K450 VanDerWaalsContact OG1-CE 3.3Å; T444-K450 WeakPolarHBondContact OG1-CE 3.49Å; T444-K450 WeakPolarHBondContact OG1-CG 3.47Å
445	N	86	Confident	88.8	Confident	20 Å²	20	88.7 Å²	88.7	11%	0.107	48%	0.479	C	S	.	.			trans	-82.8	177.7	179.5	75.8	2.8	0	0	0	112.3	E407 K447 G448 K449	E407-N445 VanDerWaalsContact CD-CB 3.48Å; E407-N445 HydrophobicContact CG-CB 4.34Å; E407-N445 VanDerWaalsContact OE1-CB 3.29Å; E407-N445 WeakPolarHBondContact OE1-CB 3.49Å; E407-N445 PolarHBondContact OE1-ND2 3.07Å; N445-K447 PolarHBondContact O-N 2.88Å; N445-K447 PolarHBondContact OD1-N 3.29Å; N445-K447 VanDerWaalsContact OD1-N 3.11Å; N445-G448 PolarHBondContact O-N 2.93Å; N445-G448 PolarHBondContact OD1-N 3.02Å; N445-K449 PolarHBondContact N-O 3.36Å; N445-K449 WeakPolarHBondContact OD1-CB 3.39Å; N445-K449 PolarHBondContact OD1-N 3.19Å
446	S	85.8	Confident	88.9	Confident	91 Å²	91	88 Å²	88	64%	0.636	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-24.5	-178.8	70	0	0	0	0	114.5	E403	E403-S446 VanDerWaalsContact CD-OG 3.27Å; E403-S446 WeakPolarHBondContact OE1-CB 3.25Å; E403-S446 PolarHBondContact OE1-OG 3.21Å; E403-S446 VanDerWaalsContact OE2-CB 3.27Å; E403-S446 WeakPolarHBondContact OE2-CB 3.47Å; E403-S446 PolarHBondContact OE2-N 2.96Å; E403-S446 PolarHBondContact OE2-OG 3.39Å
447	K	86.7	Confident	89.3	Confident	139 Å²	139	88.6 Å²	88.6	60%	0.604	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	12.3	-178.1	-60	176.4	-175.7	173.5	0	113.3	N445 K449	N445-K447 PolarHBondContact O-N 2.88Å; N445-K447 PolarHBondContact OD1-N 3.29Å; N445-K447 VanDerWaalsContact OD1-N 3.11Å; K447-K449 PolarHBondContact O-N 3.13Å
448	G	87	Confident	89.8	Confident	51 Å²	51	80.7 Å²	80.7	53%	0.526	43%	0.432	S	S	.	.	S	Bend	trans	75.6	2.1	-179.1	0	0	0	0	0	114.8	T444 N445 K450	T444-G448 VanDerWaalsContact CG2-C 3.46Å; T444-G448 WeakPolarHBondContact CG2-O 3.27Å; N445-G448 PolarHBondContact O-N 2.93Å; N445-G448 PolarHBondContact OD1-N 3.02Å; G448-K450 PolarHBondContact O-N 2.97Å
449	K	87.6	Confident	90.4	Very high	87 Å²	87	80.2 Å²	80.2	38%	0.378	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-75.2	126.2	179.6	-174.4	-179.3	175.6	-168.1	0	109.9	E414 T444 N445 K447 R451	E414-K449 VanDerWaalsContact CD-NZ 3.28Å; E414-K449 WeakPolarHBondContact OE1-CE 3.5Å; E414-K449 IonicContact OE1-NZ 3.1Å; E414-K449 PolarHBondContact OE1-NZ 3.13Å; E414-K449 IonicContact OE2-NZ 2.81Å; E414-K449 PolarHBondContact OE2-NZ 2.77Å; E414-K449 VanDerWaalsContact OE2-NZ 3.1Å; T444-K449 WeakPolarHBondContact CA-O 3.32Å; N445-K449 PolarHBondContact N-O 3.36Å; N445-K449 WeakPolarHBondContact OD1-CB 3.39Å; N445-K449 PolarHBondContact OD1-N 3.19Å; K447-K449 PolarHBondContact O-N 3.13Å; K449-R451 VanDerWaalsContact NZ-NH1 3.14Å
450	K	88.9	Confident	90.7	Very high	144 Å²	144	79.3 Å²	79.3	63%	0.626	43%	0.427	S	S	*	.	B	Isolated β-bridge	trans	-92.6	124.5	166.4	-66.6	179.1	-178	177.7	0	109.3	I443 T444 G448	I443-K450 WeakPolarHBondContact O-CA 3.27Å; T444-K450 HydrophobicContact CG2-CG 4.16Å; T444-K450 VanDerWaalsContact OG1-CE 3.3Å; T444-K450 WeakPolarHBondContact OG1-CE 3.49Å; T444-K450 WeakPolarHBondContact OG1-CG 3.47Å; G448-K450 PolarHBondContact O-N 2.97Å
451	R	89.6	Confident	90.8	Very high	38 Å²	38	79 Å²	79	14%	0.143	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-82.6	137.2	173.5	-54.8	-66.6	177.3	154.8	9.1	108.7	E407 A410 C411 E414 K449	E407-R451 IonicContact OE1-CZ 3.81Å; E407-R451 IonicContact OE1-NE 2.72Å; E407-R451 PolarHBondContact OE1-NE 3.37Å; E407-R451 IonicContact OE1-NH2 3.66Å; E407-R451 PolarHBondContact OE1-NH2 2.86Å; A410-R451 HydrophobicContact CB-CB 4Å; A410-R451 HydrophobicContact CB-CG 4.18Å; C411-R451 PolarHBondContact SG-NH2 3.48Å; C411-R451 VanDerWaalsContact SG-NH2 3.45Å; E414-R451 VanDerWaalsContact CD-CD 3.46Å; E414-R451 VanDerWaalsContact OE1-CD 3.28Å; E414-R451 WeakPolarHBondContact OE1-CD 3.48Å; E414-R451 IonicContact OE1-NH1 3.28Å; E414-R451 VanDerWaalsContact OE2-CD 3.28Å; E414-R451 WeakPolarHBondContact OE2-CD 3.44Å; E414-R451 IonicContact OE2-CZ 2.86Å; E414-R451 IonicContact OE2-NE 3.57Å; E414-R451 IonicContact OE2-NH1 3.57Å; E414-R451 PolarHBondContact OE2-NH1 3.21Å; K449-R451 VanDerWaalsContact NZ-NH1 3.14Å
452	K	92	Very high	91.1	Very high	144 Å²	144	73.3 Å²	73.3	63%	0.626	41%	0.406	S	S	*	.			trans	-120.2	137	170.7	-68.2	-177	-179.1	-179.5	0	108.6	E414 S455	E414-K452 WeakPolarHBondContact CA-O 3.32Å; K452-S455 WeakPolarHBondContact O-CB 3.17Å; K452-S455 PolarHBondContact O-OG 3.13Å
453	P	94.7	Very high	91.7	Very high	52 Å²	52	73 Å²	73	34%	0.338	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	146.1	172.8	-22.4	32.2	0	0	0	111.7	M413 T418 P440 S455	M413-P453 HydrophobicContact CB-CB 4.23Å; M413-P453 HydrophobicContact CB-CG 4.33Å; M413-P453 CarbonylContact O-C 3.33Å; M413-P453 VanDerWaalsContact O-CA 3.23Å; M413-P453 WeakPolarHBondContact O-CA 3.33Å; T418-P453 HydrophobicContact CG2-CB 3.83Å; T418-P453 HydrophobicContact CG2-CG 3.96Å; P440-P453 HydrophobicContact CB-CG 4.4Å; P440-P453 HydrophobicContact CG-CG 3.92Å; P453-S455 PolarHBondContact O-N 3.17Å
454	D	94.9	Very high	92.3	Very high	127 Å²	127	71.8 Å²	71.8	68%	0.679	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	34	174	-151.2	35.3	0	0	0	114	M413	M413-D454 PolarHBondContact O-N 2.86Å
455	S	95.4	Very high	92.7	Very high	64 Å²	64	75 Å²	75	45%	0.448	41%	0.406	S	S	.	.			trans	-105.2	-3.7	-177.2	64.5	0	0	0	0	114.1	E414 K452 P453	E414-S455 PolarHBondContact O-N 2.76Å; E414-S455 VanDerWaalsContact O-N 3.12Å; K452-S455 WeakPolarHBondContact O-CB 3.17Å; K452-S455 PolarHBondContact O-OG 3.13Å; P453-S455 PolarHBondContact O-N 3.17Å
456	V	95.9	Very high	93.3	Very high	43 Å²	43	76 Å²	76	26%	0.261	41%	0.411	S	S	.	.	S	Bend	trans	-138.8	116.3	175.5	179.5	0	0	0	0	109.3	E414 V415 A460 A461	E414-V456 HydrophobicContact CG-CB 4.23Å; E414-V456 HydrophobicContact CG-CG2 3.78Å; E414-V456 PolarHBondContact O-N 3.19Å; V415-V456 WeakPolarHBondContact CA-O 3.43Å; V415-V456 HydrophobicContact CG2-CB 4.47Å; V456-A460 HydrophobicContact CG1-CB 4.49Å; V456-A461 HydrophobicContact CG1-CB 4Å
457	E	96.1	Very high	93.8	Very high	140 Å²	140	76 Å²	76	65%	0.654	41%	0.409	S	S	*	.			trans	-66.6	149.2	174.2	-67.4	-155.2	158.3	0	0	112.7	S459 A460 A461	E457-S459 VanDerWaalsContact C-N 3.25Å; E457-S459 PolarHBondContact O-N 3.17Å; E457-S459 PolarHBondContact OE2-OG 3.42Å; E457-A460 WeakPolarHBondContact O-CB 3.3Å; E457-A460 PolarHBondContact O-N 3.05Å; E457-A461 PolarHBondContact O-N 3.07Å
458	M	96.2	Very high	94.3	Very high	10 Å²	10	71.4 Å²	71.4	5%	0.049	39%	0.39	C	S	.	.	H	α-helix	trans	-54.9	-39.1	176.8	-175.9	62.5	74.6	0	0	113	V415 L416 A460 A461 L462 L470 I473 Q474 L477	V415-M458 HydrophobicContact CG1-CB 4.31Å; V415-M458 HydrophobicContact CG1-CE 3.82Å; V415-M458 HydrophobicContact CG1-SD 4.01Å; L416-M458 HydrophobicContact CD2-CE 3.41Å; L416-M458 VanDerWaalsContact CD2-CE 3.41Å; M458-A460 PolarHBondContact O-N 3.28Å; M458-A461 PolarHBondContact O-N 2.76Å; M458-L462 HydrophobicContact CG-CD1 3.87Å; M458-L462 HydrophobicContact CG-CG 4.47Å; M458-L462 WeakPolarHBondContact O-CB 3.43Å; M458-L462 WeakPolarHBondContact O-CG 3.37Å; M458-L462 PolarHBondContact O-N 3.15Å; M458-L462 HydrophobicContact SD-CD1 3.63Å; M458-L462 HydrophobicContact SD-CG 3.95Å; M458-L470 HydrophobicContact CG-CD2 3.97Å; M458-I473 HydrophobicContact CE-CG2 4.41Å; M458-I473 HydrophobicContact SD-CG2 4.14Å; M458-Q474 HydrophobicContact CE-CG 4.41Å; M458-Q474 HydrophobicContact CG-CG 4.24Å; M458-L477 HydrophobicContact CE-CD1 4Å
459	S	96.9	Very high	94.9	Very high	27 Å²	27	69 Å²	69	19%	0.189	37%	0.365	C	S	.	.	H	α-helix	trans	-58.7	-43.7	175	53.7	0	0	0	0	112.1	E457 K463 T464	E457-S459 VanDerWaalsContact C-N 3.25Å; E457-S459 PolarHBondContact O-N 3.17Å; E457-S459 PolarHBondContact OE2-OG 3.42Å; S459-K463 VanDerWaalsContact O-CA 3.29Å; S459-K463 WeakPolarHBondContact O-CA 3.32Å; S459-K463 PolarHBondContact O-N 3.26Å; S459-T464 PolarHBondContact O-N 2.92Å; S459-T464 VanDerWaalsContact O-N 3.09Å
460	A	96.7	Very high	95.4	Very high	64 Å²	64	66 Å²	66	53%	0.529	35%	0.354	S	S	.	.	H	α-helix	trans	-73.9	-39.7	178	0	0	0	0	0	112.5	V456 E457 M458 K463	V456-A460 HydrophobicContact CG1-CB 4.49Å; E457-A460 WeakPolarHBondContact O-CB 3.3Å; E457-A460 PolarHBondContact O-N 3.05Å; M458-A460 PolarHBondContact O-N 3.28Å; A460-K463 PolarHBondContact O-N 3.48Å
461	A	96.1	Very high	95.8	Very high	27 Å²	27	61.4 Å²	61.4	22%	0.223	34%	0.336	C	S	.	.	H	α-helix	trans	-61.3	-44.6	175.1	0	0	0	0	0	111.7	L399 V415 V456 E457 M458	L399-A461 HydrophobicContact CD1-CB 4.06Å; V415-A461 HydrophobicContact CG1-CB 4.08Å; V415-A461 HydrophobicContact CG2-CB 4.32Å; V456-A461 HydrophobicContact CG1-CB 4Å; E457-A461 PolarHBondContact O-N 3.07Å; M458-A461 PolarHBondContact O-N 2.76Å
462	L	95.9	Very high	96.3	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-84.5	-15.5	178.9	-65	175.8	0	0	0	113.8	A391 Y394 T395 L399 M458 T464 L470 I473	A391-L462 HydrophobicContact CB-CD2 3.38Å; Y394-L462 VanDerWaalsContact CD1-O 3.25Å; Y394-L462 WeakPolarHBondContact CD1-O 3.22Å; Y394-L462 WeakPolarHBondContact CE1-O 3.47Å; T395-L462 HydrophobicContact CG2-CD2 4.3Å; T395-L462 WeakPolarHBondContact CG2-O 3.1Å; L399-L462 HydrophobicContact CD1-CD2 4.03Å; M458-L462 HydrophobicContact CG-CD1 3.87Å; M458-L462 HydrophobicContact CG-CG 4.47Å; M458-L462 WeakPolarHBondContact O-CB 3.43Å; M458-L462 WeakPolarHBondContact O-CG 3.37Å; M458-L462 PolarHBondContact O-N 3.15Å; M458-L462 HydrophobicContact SD-CD1 3.63Å; M458-L462 HydrophobicContact SD-CG 3.95Å; L462-T464 HydrophobicContact CB-CG2 3.78Å; L462-L470 HydrophobicContact CD1-CD2 3.85Å; L462-I473 HydrophobicContact CD1-CB 4.33Å; L462-I473 HydrophobicContact CD1-CG1 4.3Å; L462-I473 HydrophobicContact CD1-CG2 4.12Å
463	K	95.3	Very high	96.6	Very high	153 Å²	153	52.8 Å²	52.8	67%	0.665	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	41.7	-175.8	-50.7	171.3	-172.8	167.8	0	112.8	S459 A460	S459-K463 VanDerWaalsContact O-CA 3.29Å; S459-K463 WeakPolarHBondContact O-CA 3.32Å; S459-K463 PolarHBondContact O-N 3.26Å; A460-K463 PolarHBondContact O-N 3.48Å
464	T	95.3	Very high	96.8	Very high	12 Å²	12	55 Å²	55	7%	0.074	31%	0.305	C	S	.	.			trans	-145.2	151.9	-178.8	-173.1	0	0	0	0	112.7	Y394 S459 L462 D466 F469 L470	Y394-T464 HydrophobicContact CD1-CG2 4.49Å; Y394-T464 HydrophobicContact CE1-CG2 3.95Å; S459-T464 PolarHBondContact O-N 2.92Å; S459-T464 VanDerWaalsContact O-N 3.09Å; L462-T464 HydrophobicContact CB-CG2 3.78Å; T464-D466 PolarHBondContact OG1-N 3.27Å; T464-F469 HydrophobicContact CG2-CD1 4.03Å; T464-L470 HydrophobicContact CG2-CD2 3.97Å; T464-L470 HydrophobicContact CG2-CG 4.26Å
465	N	94.8	Very high	97	Very high	143 Å²	143	54.7 Å²	54.7	77%	0.765	30%	0.295	S	S	*	.			trans	-117.2	13.8	174.1	-61.4	-30.3	0	0	0	111.9	P467	N465-P467 WeakPolarHBondContact O-CD 3.44Å
466	D	96.8	Very high	97.1	Very high	39 Å²	39	51.7 Å²	51.7	21%	0.209	27%	0.273	C	S	.	.			trans	-68.5	108	172.2	-178.9	-43.9	0	0	0	108.8	L300 T464 L468 F469 L470	L300-D466 HydrophobicContact CD1-CB 3.99Å; L300-D466 VanDerWaalsContact CD1-OD2 3.3Å; L300-D466 WeakPolarHBondContact CD1-OD2 3.49Å; T464-D466 PolarHBondContact OG1-N 3.27Å; D466-L468 VanDerWaalsContact C-N 3.28Å; D466-L468 PolarHBondContact O-N 3.42Å; D466-L468 PolarHBondContact OD1-N 3.2Å; D466-F469 HydrophobicContact CB-CB 4.05Å; D466-F469 PolarHBondContact O-N 2.75Å; D466-F469 PolarHBondContact OD1-N 3.31Å; D466-L470 WeakPolarHBondContact O-CB 3.41Å; D466-L470 VanDerWaalsContact O-CG 3.25Å; D466-L470 WeakPolarHBondContact O-CG 3.39Å; D466-L470 PolarHBondContact O-N 2.69Å
467	P	97.2	Very high	97.3	Very high	92 Å²	92	49.8 Å²	49.8	60%	0.597	26%	0.262	S	S	*	.	H	α-helix	trans	-69.7	-28.3	-169.8	29.2	-34.9	0	0	0	112	N465 D471	N465-P467 WeakPolarHBondContact O-CD 3.44Å; P467-D471 WeakPolarHBondContact O-CB 3.49Å; P467-D471 PolarHBondContact O-N 3.03Å
468	L	97.9	Very high	97.4	Very high	42 Å²	42	44.2 Å²	44.2	22%	0.22	24%	0.24	C	C	.	.	H	α-helix	trans	-78.8	-36.1	-178.1	-61.6	-178.2	0	0	0	111.2	D466 F472 H493 Q494 W495 E498	D466-L468 VanDerWaalsContact C-N 3.28Å; D466-L468 PolarHBondContact O-N 3.42Å; D466-L468 PolarHBondContact OD1-N 3.2Å; L468-F472 WeakPolarHBondContact O-CB 3.29Å; L468-F472 PolarHBondContact O-N 2.98Å; L468-H493 PolarHBondContact O-CE1 3Å; L468-Q494 HydrophobicContact CD1-CB 4.36Å; L468-Q494 HydrophobicContact CD2-CB 4.16Å; L468-W495 HydrophobicContact CB-CB 3.85Å; L468-W495 HydrophobicContact CB-CG 4.37Å; L468-W495 WeakPolarHBondContact O-CB 3.5Å; L468-E498 HydrophobicContact CD1-CG 4.17Å; L468-E498 WeakPolarHBondContact CD1-OE1 3.46Å; L468-E498 WeakPolarHBondContact CD1-OE2 3.28Å
469	F	98.2	Very high	97.5	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-67.8	-42.2	171.4	-175.3	-126.8	0	0	0	111.3	L300 I303 L390 Y394 T464 D466 F472 I473 W495	L300-F469 HydrophobicContact CD2-CB 4.32Å; L300-F469 HydrophobicContact CD2-CD1 3.61Å; L300-F469 HydrophobicContact CD2-CD2 4.03Å; L300-F469 HydrophobicContact CD2-CE1 3.82Å; L300-F469 HydrophobicContact CD2-CE2 4.21Å; L300-F469 HydrophobicContact CD2-CG 3.72Å; L300-F469 HydrophobicContact CD2-CZ 4.11Å; I303-F469 HydrophobicContact CG2-CE2 4.49Å; L390-F469 HydrophobicContact CB-CE2 4.37Å; Y394-F469 HydrophobicContact CD1-CE1 4.01Å; Y394-F469 HydrophobicContact CD2-CE1 4.33Å; Y394-F469 AromaticContact CG-CE1 3.79Å; Y394-F469 HydrophobicContact CG-CE1 3.79Å; Y394-F469 HydrophobicContact CG-CZ 4.3Å; T464-F469 HydrophobicContact CG2-CD1 4.03Å; D466-F469 HydrophobicContact CB-CB 4.05Å; D466-F469 PolarHBondContact O-N 2.75Å; D466-F469 PolarHBondContact OD1-N 3.31Å; F469-F472 PolarHBondContact O-N 2.91Å; F469-I473 HydrophobicContact CD2-CD1 4.49Å; F469-I473 HydrophobicContact CD2-CG1 4.07Å; F469-I473 HydrophobicContact CE1-CG1 4.3Å; F469-I473 HydrophobicContact CE2-CD1 3.76Å; F469-I473 HydrophobicContact CE2-CG1 3.74Å; F469-I473 HydrophobicContact CZ-CD1 3.94Å; F469-I473 HydrophobicContact CZ-CG1 3.87Å; F469-I473 WeakPolarHBondContact O-CG1 3.46Å; F469-I473 PolarHBondContact O-N 2.98Å; F469-W495 HydrophobicContact CD2-CD2 4.06Å; F469-W495 AromaticContact CD2-CE2 3.45Å; F469-W495 VanDerWaalsContact CD2-CE2 3.45Å; F469-W495 HydrophobicContact CD2-CE3 4.45Å; F469-W495 AromaticContact CD2-CH2 3.8Å; F469-W495 HydrophobicContact CD2-CH2 3.8Å; F469-W495 AromaticContact CD2-CZ2 3.33Å; F469-W495 HydrophobicContact CD2-CZ2 3.33Å; F469-W495 HydrophobicContact CD2-CZ3 4.32Å; F469-W495 AromaticContact CD2-NE1 3.78Å; F469-W495 AromaticContact CE2-CH2 3.81Å; F469-W495 HydrophobicContact CE2-CH2 3.81Å; F469-W495 AromaticContact CE2-CZ2 3.68Å; F469-W495 HydrophobicContact CE2-CZ2 3.68Å; F469-W495 HydrophobicContact CE2-CZ3 4.5Å; F469-W495 HydrophobicContact CG-CZ2 4.29Å
470	L	98.4	Very high	97.5	Very high	25 Å²	25	45.8 Å²	45.8	13%	0.131	24%	0.244	C	C	.	.	H	α-helix	trans	-59.5	-48.8	175.6	-70.7	170.2	0	0	0	111.7	M458 L462 T464 D466 F472 I473 Q474	M458-L470 HydrophobicContact CG-CD2 3.97Å; L462-L470 HydrophobicContact CD1-CD2 3.85Å; T464-L470 HydrophobicContact CG2-CD2 3.97Å; T464-L470 HydrophobicContact CG2-CG 4.26Å; D466-L470 WeakPolarHBondContact O-CB 3.41Å; D466-L470 VanDerWaalsContact O-CG 3.25Å; D466-L470 WeakPolarHBondContact O-CG 3.39Å; D466-L470 PolarHBondContact O-N 2.69Å; L470-F472 PolarHBondContact O-N 3.31Å; L470-I473 PolarHBondContact O-N 3.47Å; L470-Q474 WeakPolarHBondContact O-CB 3.23Å; L470-Q474 VanDerWaalsContact O-CG 3.3Å; L470-Q474 WeakPolarHBondContact O-CG 3.37Å; L470-Q474 PolarHBondContact O-N 3.33Å
471	D	98.5	Very high	97.5	Very high	48 Å²	48	44.1 Å²	44.1	26%	0.257	23%	0.228	S	C	.	.	H	α-helix	trans	-58.7	-45.4	175.5	-174	28.1	0	0	0	111.6	P467 I473 Q474 R475 H493	P467-D471 WeakPolarHBondContact O-CB 3.49Å; P467-D471 PolarHBondContact O-N 3.03Å; D471-I473 PolarHBondContact O-N 3.33Å; D471-Q474 PolarHBondContact O-N 3.41Å; D471-R475 VanDerWaalsContact CG-NE 3.25Å; D471-R475 WeakPolarHBondContact O-CB 3.45Å; D471-R475 VanDerWaalsContact O-CG 3.28Å; D471-R475 WeakPolarHBondContact O-CG 3.23Å; D471-R475 PolarHBondContact O-N 3.38Å; D471-R475 IonicContact OD1-CZ 2.68Å; D471-R475 IonicContact OD1-NE 3.85Å; D471-R475 PolarHBondContact OD1-NE 2.86Å; D471-R475 IonicContact OD1-NH2 2.8Å; D471-R475 PolarHBondContact OD1-NH2 3.04Å; D471-R475 IonicContact OD2-CZ 3.45Å; D471-R475 IonicContact OD2-NE 2.67Å; D471-R475 PolarHBondContact OD2-NE 3.49Å; D471-R475 IonicContact OD2-NH2 3.84Å; D471-R475 PolarHBondContact OD2-NH2 3.49Å; D471-H493 IonicContact OD2-CE1 3.61Å; D471-H493 IonicContact OD2-NE2 3.88Å; D471-H493 PolarHBondContact OD2-NE2 3.31Å
472	F	98.8	Very high	97.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-58.6	-47	177.4	-171.9	-82.1	0	0	0	112.2	L311 L390 L468 F469 L470 R475 C476 M485 H493 W495 I496	L311-F472 HydrophobicContact CD1-CE2 4.26Å; L311-F472 HydrophobicContact CD1-CZ 4Å; L311-F472 HydrophobicContact CD2-CZ 4.42Å; L390-F472 HydrophobicContact CD1-CD1 4.1Å; L390-F472 HydrophobicContact CD1-CE1 3.53Å; L390-F472 HydrophobicContact CD1-CZ 4.44Å; L468-F472 WeakPolarHBondContact O-CB 3.29Å; L468-F472 PolarHBondContact O-N 2.98Å; F469-F472 PolarHBondContact O-N 2.91Å; L470-F472 PolarHBondContact O-N 3.31Å; F472-R475 PolarHBondContact O-N 3.05Å; F472-C476 PolarHBondContact O-N 3.46Å; F472-C476 VanDerWaalsContact O-N 3.1Å; F472-M485 HydrophobicContact CD1-CE 4.16Å; F472-M485 HydrophobicContact CD2-CE 3.68Å; F472-M485 HydrophobicContact CD2-SD 4.45Å; F472-M485 HydrophobicContact CE1-CE 4.01Å; F472-M485 HydrophobicContact CE2-CE 3.54Å; F472-M485 HydrophobicContact CE2-SD 4.35Å; F472-M485 HydrophobicContact CG-CE 3.99Å; F472-M485 HydrophobicContact CZ-CE 3.7Å; F472-H493 HydrophobicContact CD2-CB 3.76Å; F472-H493 AromaticContact CD2-CG 3.58Å; F472-H493 AromaticContact CD2-ND1 3.61Å; F472-H493 HydrophobicContact CE2-CB 4.03Å; F472-W495 HydrophobicContact CB-CB 4.31Å; F472-W495 HydrophobicContact CB-CD2 4.4Å; F472-W495 HydrophobicContact CB-CE3 4.03Å; F472-W495 AromaticContact CD1-CE3 3.93Å; F472-W495 HydrophobicContact CD1-CE3 3.93Å; F472-W495 AromaticContact CD1-CZ3 3.93Å; F472-W495 HydrophobicContact CD1-CZ3 3.93Å; F472-W495 AromaticContact CD2-CE3 3.68Å; F472-W495 HydrophobicContact CD2-CE3 3.68Å; F472-W495 HydrophobicContact CD2-CZ3 4.34Å; F472-W495 HydrophobicContact CE1-CE3 4.37Å; F472-W495 HydrophobicContact CE1-CZ3 4.1Å; F472-W495 HydrophobicContact CE2-CE3 4.13Å; F472-W495 HydrophobicContact CE2-CZ3 4.48Å; F472-W495 HydrophobicContact CG-CD2 4.41Å; F472-W495 AromaticContact CG-CE3 3.58Å; F472-W495 HydrophobicContact CG-CE3 3.58Å; F472-W495 HydrophobicContact CG-CZ3 4.08Å; F472-W495 HydrophobicContact CZ-CE3 4.47Å; F472-W495 HydrophobicContact CZ-CZ3 4.37Å; F472-I496 HydrophobicContact CD2-CG1 4.27Å; F472-I496 HydrophobicContact CE2-CD1 4.2Å; F472-I496 HydrophobicContact CE2-CG1 3.75Å; F472-I496 HydrophobicContact CZ-CG1 4.48Å
473	I	98.8	Very high	97.6	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.9	-43.7	179.5	-63.9	-66.5	0	0	0	111	L390 M458 L462 F469 L470 D471 R475 C476 L477	L390-I473 HydrophobicContact CB-CD1 3.72Å; L390-I473 HydrophobicContact CD1-CD1 4.48Å; M458-I473 HydrophobicContact CE-CG2 4.41Å; M458-I473 HydrophobicContact SD-CG2 4.14Å; L462-I473 HydrophobicContact CD1-CB 4.33Å; L462-I473 HydrophobicContact CD1-CG1 4.3Å; L462-I473 HydrophobicContact CD1-CG2 4.12Å; F469-I473 HydrophobicContact CD2-CD1 4.49Å; F469-I473 HydrophobicContact CD2-CG1 4.07Å; F469-I473 HydrophobicContact CE1-CG1 4.3Å; F469-I473 HydrophobicContact CE2-CD1 3.76Å; F469-I473 HydrophobicContact CE2-CG1 3.74Å; F469-I473 HydrophobicContact CZ-CD1 3.94Å; F469-I473 HydrophobicContact CZ-CG1 3.87Å; F469-I473 WeakPolarHBondContact O-CG1 3.46Å; F469-I473 PolarHBondContact O-N 2.98Å; L470-I473 PolarHBondContact O-N 3.47Å; D471-I473 PolarHBondContact O-N 3.33Å; I473-R475 VanDerWaalsContact C-N 3.31Å; I473-R475 PolarHBondContact O-N 3.38Å; I473-C476 WeakPolarHBondContact O-CB 3.4Å; I473-C476 PolarHBondContact O-N 3.12Å; I473-L477 HydrophobicContact CG2-CD1 3.63Å; I473-L477 HydrophobicContact CG2-CG 4.26Å; I473-L477 WeakPolarHBondContact O-CB 3.36Å; I473-L477 VanDerWaalsContact O-CG 3.32Å; I473-L477 WeakPolarHBondContact O-CG 3.43Å; I473-L477 PolarHBondContact O-N 3.12Å
474	Q	98.4	Very high	97.7	Very high	99 Å²	99	48 Å²	48	46%	0.463	26%	0.258	S	S	.	.	H	α-helix	trans	-59.5	-40.9	177	-74.7	173.9	-12.3	0	0	112.1	M458 L470 D471 L477 A478	M458-Q474 HydrophobicContact CE-CG 4.41Å; M458-Q474 HydrophobicContact CG-CG 4.24Å; L470-Q474 WeakPolarHBondContact O-CB 3.23Å; L470-Q474 VanDerWaalsContact O-CG 3.3Å; L470-Q474 WeakPolarHBondContact O-CG 3.37Å; L470-Q474 PolarHBondContact O-N 3.33Å; D471-Q474 PolarHBondContact O-N 3.41Å; Q474-L477 CarbonylContact O-C 3.54Å; Q474-L477 PolarHBondContact O-N 2.93Å; Q474-L477 VanDerWaalsContact O-N 3.14Å; Q474-A478 PolarHBondContact O-N 2.81Å
475	R	98.7	Very high	97.9	Very high	121 Å²	121	48 Å²	48	46%	0.457	26%	0.257	S	S	.	.	H	α-helix	trans	-68.4	-33.4	176.2	-71.4	179.2	-164.4	-128.6	11.5	114	D471 F472 I473 L477 R484 M485 H493	D471-R475 VanDerWaalsContact CG-NE 3.25Å; D471-R475 WeakPolarHBondContact O-CB 3.45Å; D471-R475 VanDerWaalsContact O-CG 3.28Å; D471-R475 WeakPolarHBondContact O-CG 3.23Å; D471-R475 PolarHBondContact O-N 3.38Å; D471-R475 IonicContact OD1-CZ 2.68Å; D471-R475 IonicContact OD1-NE 3.85Å; D471-R475 PolarHBondContact OD1-NE 2.86Å; D471-R475 IonicContact OD1-NH2 2.8Å; D471-R475 PolarHBondContact OD1-NH2 3.04Å; D471-R475 IonicContact OD2-CZ 3.45Å; D471-R475 IonicContact OD2-NE 2.67Å; D471-R475 PolarHBondContact OD2-NE 3.49Å; D471-R475 IonicContact OD2-NH2 3.84Å; D471-R475 PolarHBondContact OD2-NH2 3.49Å; F472-R475 PolarHBondContact O-N 3.05Å; I473-R475 VanDerWaalsContact C-N 3.31Å; I473-R475 PolarHBondContact O-N 3.38Å; R475-L477 VanDerWaalsContact C-N 3.32Å; R475-R484 WeakPolarHBondContact O-CG 3.28Å; R475-M485 HydrophobicContact CB-CB 3.84Å; R475-M485 HydrophobicContact CB-CE 3.93Å; R475-M485 HydrophobicContact CB-SD 4.04Å; R475-M485 PolarHBondContact O-N 3.12Å; R475-M485 VanDerWaalsContact O-N 3.08Å; R475-H493 PolarHBondContact NE-NE2 2.91Å
476	C	98.8	Very high	98.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-68.6	-30.9	169	-74.9	0	0	0	0	112.4	M383 F472 I473 R484 M485	M383-C476 WeakPolarHBondContact O-CB 3.5Å; F472-C476 PolarHBondContact O-N 3.46Å; F472-C476 VanDerWaalsContact O-N 3.1Å; I473-C476 WeakPolarHBondContact O-CB 3.4Å; I473-C476 PolarHBondContact O-N 3.12Å; C476-R484 WeakPolarHBondContact O-CD 3.45Å; C476-R484 VanDerWaalsContact O-CG 3.28Å; C476-R484 WeakPolarHBondContact O-CG 3.13Å; C476-M485 WeakPolarHBondContact SG-CE 3.39Å
477	L	98.8	Very high	98.2	Very high	3 Å²	3	42 Å²	42	2%	0.016	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	24.4	-175.4	-60.6	179.1	0	0	0	113.4	W384 L399 F400 L416 M458 I473 Q474 R475 W479	W384-L477 HydrophobicContact CD2-CD2 3.71Å; W384-L477 HydrophobicContact CE3-CB 4.34Å; W384-L477 HydrophobicContact CE3-CD2 3.86Å; W384-L477 HydrophobicContact CG-CD2 4.22Å; W384-L477 HydrophobicContact CH2-CB 4.41Å; W384-L477 HydrophobicContact CH2-CD2 4.2Å; W384-L477 HydrophobicContact CZ2-CD2 4.07Å; W384-L477 HydrophobicContact CZ3-CB 4.05Å; W384-L477 HydrophobicContact CZ3-CD2 4.12Å; W384-L477 VanDerWaalsContact CZ3-O 3.28Å; W384-L477 WeakPolarHBondContact CZ3-O 3.42Å; L399-L477 HydrophobicContact CD2-CD1 3.57Å; F400-L477 HydrophobicContact CE2-CD1 4Å; F400-L477 HydrophobicContact CE2-CD2 4.25Å; F400-L477 HydrophobicContact CZ-CD1 4.1Å; L416-L477 HydrophobicContact CD1-CB 4.11Å; L416-L477 WeakPolarHBondContact CD1-O 3.36Å; M458-L477 HydrophobicContact CE-CD1 4Å; I473-L477 HydrophobicContact CG2-CD1 3.63Å; I473-L477 HydrophobicContact CG2-CG 4.26Å; I473-L477 WeakPolarHBondContact O-CB 3.36Å; I473-L477 VanDerWaalsContact O-CG 3.32Å; I473-L477 WeakPolarHBondContact O-CG 3.43Å; I473-L477 PolarHBondContact O-N 3.12Å; Q474-L477 CarbonylContact O-C 3.54Å; Q474-L477 PolarHBondContact O-N 2.93Å; Q474-L477 VanDerWaalsContact O-N 3.14Å; R475-L477 VanDerWaalsContact C-N 3.32Å; L477-W479 PolarHBondContact O-N 3.13Å
478	A	98.4	Very high	98.2	Very high	23 Å²	23	40.1 Å²	40.1	19%	0.19	21%	0.212	C	C	.	.			trans	-62	131.4	173.5	0	0	0	0	0	111.1	Q474 D480 R484	Q474-A478 PolarHBondContact O-N 2.81Å; A478-D480 PolarHBondContact O-N 2.94Å; A478-R484 HydrophobicContact CB-CB 4.05Å; A478-R484 HydrophobicContact CB-CG 4.31Å; A478-R484 PolarHBondContact O-NE 3.29Å; A478-R484 PolarHBondContact O-NH2 3.06Å
479	W	98.1	Very high	98.2	Very high	27 Å²	27	43.3 Å²	43.3	10%	0.102	23%	0.226	C	C	.	.	S	Bend	trans	-54.7	-49.4	177	-80.6	111.9	0	0	0	112.5	P369 I409 I412 M413 L416 G417 P419 F423 L477 P481	P369-W479 HydrophobicContact CB-CE3 3.67Å; P369-W479 HydrophobicContact CB-CZ3 3.5Å; P369-W479 HydrophobicContact CG-CE3 3.87Å; P369-W479 HydrophobicContact CG-CZ3 4.17Å; I409-W479 HydrophobicContact CD1-CH2 3.98Å; I409-W479 HydrophobicContact CD1-CZ3 3.81Å; I412-W479 HydrophobicContact CB-CH2 4.28Å; I412-W479 HydrophobicContact CG2-CH2 3.45Å; I412-W479 VanDerWaalsContact CG2-CH2 3.45Å; I412-W479 HydrophobicContact CG2-CZ2 3.7Å; I412-W479 HydrophobicContact CG2-CZ3 4.04Å; M413-W479 HydrophobicContact CG-CH2 3.75Å; M413-W479 HydrophobicContact CG-CZ2 3.86Å; L416-W479 HydrophobicContact CB-CZ2 4.13Å; L416-W479 PolarHBondContact O-NE1 3.49Å; G417-W479 WeakPolarHBondContact O-CZ2 3.39Å; P419-W479 HydrophobicContact CB-CD2 3.8Å; P419-W479 HydrophobicContact CB-CE3 3.69Å; P419-W479 HydrophobicContact CB-CG 4.4Å; P419-W479 HydrophobicContact CB-CH2 4.16Å; P419-W479 HydrophobicContact CB-CZ2 4.28Å; P419-W479 HydrophobicContact CB-CZ3 3.86Å; P419-W479 HydrophobicContact CG-CE3 4.43Å; P419-W479 HydrophobicContact CG-CH2 4.08Å; P419-W479 HydrophobicContact CG-CZ2 4.39Å; P419-W479 HydrophobicContact CG-CZ3 4.09Å; F423-W479 HydrophobicContact CE1-CE3 4.17Å; F423-W479 VanDerWaalsContact CZ-O 3.27Å; F423-W479 WeakPolarHBondContact CZ-O 3.4Å; L477-W479 PolarHBondContact O-N 3.13Å; W479-P481 WeakPolarHBondContact O-CD 3.28Å
480	D	96.9	Very high	98.2	Very high	43 Å²	43	43.3 Å²	43.3	23%	0.23	23%	0.226	C	C	.	.	S	Bend	trans	-81	113.4	179.6	-179.4	-12.5	0	0	0	109.7	A478 A482 K483 R484	A478-D480 PolarHBondContact O-N 2.94Å; D480-A482 PolarHBondContact O-N 3.11Å; D480-A482 WeakPolarHBondContact OD1-CB 3.46Å; D480-A482 PolarHBondContact OD1-N 3.21Å; D480-K483 HydrophobicContact CB-CB 4.25Å; D480-K483 HydrophobicContact CB-CD 4.07Å; D480-K483 HydrophobicContact CB-CG 4.26Å; D480-K483 PolarHBondContact O-N 3.03Å; D480-K483 WeakPolarHBondContact OD2-CD 3.44Å; D480-K483 WeakPolarHBondContact OD2-CE 3.46Å; D480-K483 IonicContact OD2-NZ 3.2Å; D480-K483 PolarHBondContact OD2-NZ 2.85Å; D480-R484 PolarHBondContact O-N 3.41Å
481	P	97.6	Very high	98.2	Very high	29 Å²	29	42.8 Å²	42.8	19%	0.188	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-19.5	-177	26.7	-34.5	0	0	0	113.5	A380 W479 K483	A380-P481 HydrophobicContact CB-CB 3.85Å; W479-P481 WeakPolarHBondContact O-CD 3.28Å; P481-K483 VanDerWaalsContact C-N 3.33Å
482	A	96.6	Very high	98.2	Very high	95 Å²	95	46.8 Å²	46.8	79%	0.785	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-16.6	174.7	0	0	0	0	0	113.1	D480	D480-A482 PolarHBondContact O-N 3.11Å; D480-A482 WeakPolarHBondContact OD1-CB 3.46Å; D480-A482 PolarHBondContact OD1-N 3.21Å
483	K	97.1	Very high	98.1	Very high	160 Å²	160	47.4 Å²	47.4	70%	0.696	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-4.7	174.7	-62.9	174.5	-172.5	134	0	112.9	D480 P481	D480-K483 HydrophobicContact CB-CB 4.25Å; D480-K483 HydrophobicContact CB-CD 4.07Å; D480-K483 HydrophobicContact CB-CG 4.26Å; D480-K483 PolarHBondContact O-N 3.03Å; D480-K483 WeakPolarHBondContact OD2-CD 3.44Å; D480-K483 WeakPolarHBondContact OD2-CE 3.46Å; D480-K483 IonicContact OD2-NZ 3.2Å; D480-K483 PolarHBondContact OD2-NZ 2.85Å; P481-K483 VanDerWaalsContact C-N 3.33Å
484	R	98.4	Very high	98	Very high	8 Å²	8	52.8 Å²	52.8	3%	0.03	27%	0.268	C	S	.	.	S	Bend	trans	-73.1	134.6	178.8	-166.5	178.4	-63.7	148.6	9	109.7	E370 A380 R475 C476 A478 D480 T486	E370-R484 IonicContact OE1-CZ 2.75Å; E370-R484 IonicContact OE1-NH1 2.73Å; E370-R484 PolarHBondContact OE1-NH1 3.5Å; E370-R484 IonicContact OE1-NH2 3.97Å; E370-R484 PolarHBondContact OE1-NH2 3.37Å; E370-R484 IonicContact OE2-CZ 3.9Å; E370-R484 IonicContact OE2-NH1 2.72Å; E370-R484 PolarHBondContact OE2-NH1 2.95Å; E370-R484 IonicContact OE2-NH2 3.57Å; E370-R484 PolarHBondContact OE2-NH2 3.21Å; A380-R484 WeakPolarHBondContact O-CD 3.2Å; A380-R484 PolarHBondContact O-NH1 3.17Å; R475-R484 WeakPolarHBondContact O-CG 3.28Å; C476-R484 WeakPolarHBondContact O-CD 3.45Å; C476-R484 VanDerWaalsContact O-CG 3.28Å; C476-R484 WeakPolarHBondContact O-CG 3.13Å; A478-R484 HydrophobicContact CB-CB 4.05Å; A478-R484 HydrophobicContact CB-CG 4.31Å; A478-R484 PolarHBondContact O-NE 3.29Å; A478-R484 PolarHBondContact O-NH2 3.06Å; D480-R484 PolarHBondContact O-N 3.41Å; R484-T486 PolarHBondContact O-N 2.96Å
485	M	98.6	Very high	98	Very high	11 Å²	11	48.1 Å²	48.1	5%	0.054	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-57	131.2	-178.5	173.2	171.5	67.4	0	0	111.4	M383 F472 R475 C476 E489 H493	M383-M485 HydrophobicContact CE-CE 4.33Å; M383-M485 HydrophobicContact CE-CG 4.32Å; M383-M485 WeakPolarHBondContact CE-O 3.44Å; M383-M485 WeakPolarHBondContact CG-O 3.45Å; F472-M485 HydrophobicContact CD1-CE 4.16Å; F472-M485 HydrophobicContact CD2-CE 3.68Å; F472-M485 HydrophobicContact CD2-SD 4.45Å; F472-M485 HydrophobicContact CE1-CE 4.01Å; F472-M485 HydrophobicContact CE2-CE 3.54Å; F472-M485 HydrophobicContact CE2-SD 4.35Å; F472-M485 HydrophobicContact CG-CE 3.99Å; F472-M485 HydrophobicContact CZ-CE 3.7Å; R475-M485 HydrophobicContact CB-CB 3.84Å; R475-M485 HydrophobicContact CB-CE 3.93Å; R475-M485 HydrophobicContact CB-SD 4.04Å; R475-M485 PolarHBondContact O-N 3.12Å; R475-M485 VanDerWaalsContact O-N 3.08Å; C476-M485 WeakPolarHBondContact SG-CE 3.39Å; M485-E489 HydrophobicContact CG-CB 3.84Å; M485-H493 HydrophobicContact SD-CB 4.43Å
486	T	98.8	Very high	97.9	Very high	48 Å²	48	42.6 Å²	42.6	29%	0.294	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-79.3	164.5	175.5	63	0	0	0	0	111.6	R484 D488 E489 G490	R484-T486 PolarHBondContact O-N 2.96Å; T486-D488 VanDerWaalsContact C-N 3.3Å; T486-D488 PolarHBondContact O-N 3.06Å; T486-E489 WeakPolarHBondContact CB-OE2 3.37Å; T486-E489 WeakPolarHBondContact CG2-OE2 3.49Å; T486-E489 PolarHBondContact N-OE2 2.86Å; T486-E489 PolarHBondContact O-N 3.33Å; T486-E489 VanDerWaalsContact OG1-CD 3.27Å; T486-E489 VanDerWaalsContact OG1-CG 3.29Å; T486-E489 WeakPolarHBondContact OG1-CG 3.3Å; T486-E489 PolarHBondContact OG1-N 2.66Å; T486-E489 PolarHBondContact OG1-OE2 2.69Å; T486-G490 PolarHBondContact O-N 3.28Å
487	P	98.5	Very high	97.7	Very high	9 Å²	9	45.4 Å²	45.4	6%	0.058	24%	0.24	C	C	.	.	H	α-helix	trans	-61.3	-35.9	176.3	-24.4	34.8	0	0	0	113.8	L311 L314 Q315 H318 M383 G490 L491	L311-P487 HydrophobicContact CD2-CB 4.48Å; L314-P487 HydrophobicContact CB-CB 3.93Å; L314-P487 HydrophobicContact CB-CG 3.65Å; Q315-P487 HydrophobicContact CB-CB 4.04Å; H318-P487 HydrophobicContact CB-CG 4.23Å; M383-P487 HydrophobicContact CG-CG 4.18Å; M383-P487 HydrophobicContact SD-CB 4.34Å; M383-P487 HydrophobicContact SD-CG 3.83Å; P487-G490 PolarHBondContact O-N 3.1Å; P487-L491 WeakPolarHBondContact O-CG 3.13Å; P487-L491 PolarHBondContact O-N 2.89Å; P487-L491 VanDerWaalsContact O-N 3.1Å
488	D	98.3	Very high	97.2	Very high	51 Å²	51	51 Å²	51	27%	0.273	27%	0.267	S	S	.	.	H	α-helix	trans	-66.5	-44.1	177.8	-68.7	-82	0	0	0	111.3	Q315 H318 R319 T486 L491 Q492	Q315-D488 PolarHBondContact NE2-OD1 2.94Å; H318-D488 IonicContact ND1-OD2 3.39Å; R319-D488 IonicContact NH2-OD1 3.44Å; R319-D488 PolarHBondContact NH2-OD1 3.06Å; T486-D488 VanDerWaalsContact C-N 3.3Å; T486-D488 PolarHBondContact O-N 3.06Å; D488-L491 PolarHBondContact O-N 3.31Å; D488-Q492 PolarHBondContact O-N 3.12Å
489	E	98.4	Very high	95.8	Very high	110 Å²	110	50.9 Å²	50.9	51%	0.514	27%	0.267	S	S	.	.	H	α-helix	trans	-65.6	-39.9	173.4	-69.4	164.2	134.9	0	0	112.1	M485 T486 L491 Q492 H493	M485-E489 HydrophobicContact CG-CB 3.84Å; T486-E489 WeakPolarHBondContact CB-OE2 3.37Å; T486-E489 WeakPolarHBondContact CG2-OE2 3.49Å; T486-E489 PolarHBondContact N-OE2 2.86Å; T486-E489 PolarHBondContact O-N 3.33Å; T486-E489 VanDerWaalsContact OG1-CD 3.27Å; T486-E489 VanDerWaalsContact OG1-CG 3.29Å; T486-E489 WeakPolarHBondContact OG1-CG 3.3Å; T486-E489 PolarHBondContact OG1-N 2.66Å; T486-E489 PolarHBondContact OG1-OE2 2.69Å; E489-L491 VanDerWaalsContact C-N 3.29Å; E489-L491 PolarHBondContact O-N 2.67Å; E489-Q492 CarbonylContact O-C 3.59Å; E489-Q492 WeakPolarHBondContact O-CA 3.25Å; E489-Q492 PolarHBondContact O-N 3.44Å; E489-H493 PolarHBondContact O-N 3.39Å
490	G	98.3	Very high	94.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-58.3	-39.3	176.2	0	0	0	0	0	112.7	T486 P487 Q492 H493 I496	T486-G490 PolarHBondContact O-N 3.28Å; P487-G490 PolarHBondContact O-N 3.1Å; G490-Q492 VanDerWaalsContact C-N 3.27Å; G490-Q492 PolarHBondContact O-N 3.04Å; G490-H493 VanDerWaalsContact O-CB 3.32Å; G490-H493 WeakPolarHBondContact O-CB 3.49Å; G490-H493 PolarHBondContact O-N 3.28Å; G490-I496 VanDerWaalsContact O-CG1 3.31Å; G490-I496 WeakPolarHBondContact O-CG1 3.25Å
491	L	97.3	Very high	92.3	Very high	14 Å²	14	57 Å²	57	7%	0.073	30%	0.296	C	S	.	.	H	α-helix	trans	-67.8	-24.5	174.7	-72.2	166.4	0	0	0	113.4	L311 R312 Q315 P487 D488 E489	L311-L491 HydrophobicContact CB-CD1 4.49Å; L311-L491 HydrophobicContact CB-CD2 3.64Å; L311-L491 HydrophobicContact CB-CG 3.82Å; L311-L491 HydrophobicContact CD1-CD2 4.08Å; L311-L491 HydrophobicContact CD1-CG 4.29Å; R312-L491 HydrophobicContact CG-CD2 4.34Å; Q315-L491 HydrophobicContact CB-CD1 4.29Å; Q315-L491 VanDerWaalsContact CD-CD1 3.44Å; Q315-L491 HydrophobicContact CG-CD1 4.4Å; P487-L491 WeakPolarHBondContact O-CG 3.13Å; P487-L491 PolarHBondContact O-N 2.89Å; P487-L491 VanDerWaalsContact O-N 3.1Å; D488-L491 PolarHBondContact O-N 3.31Å; E489-L491 VanDerWaalsContact C-N 3.29Å; E489-L491 PolarHBondContact O-N 2.67Å
492	Q	97.8	Very high	89.8	Confident	132 Å²	132	62.2 Å²	62.2	62%	0.617	32%	0.323	S	S	*	.	H	α-helix	trans	-93.4	-1	175.2	-57.7	-52.9	-44.7	0	0	113.3	D488 E489 G490 L497	D488-Q492 PolarHBondContact O-N 3.12Å; E489-Q492 CarbonylContact O-C 3.59Å; E489-Q492 WeakPolarHBondContact O-CA 3.25Å; E489-Q492 PolarHBondContact O-N 3.44Å; G490-Q492 VanDerWaalsContact C-N 3.27Å; G490-Q492 PolarHBondContact O-N 3.04Å; Q492-L497 VanDerWaalsContact O-CD1 3.25Å; Q492-L497 WeakPolarHBondContact O-CD1 3.49Å
493	H	98.3	Very high	87.4	Confident	12 Å²	12	66.1 Å²	66.1	6%	0.056	32%	0.322	C	S	.	.	S	Bend	trans	-67.8	137.8	-179.3	-164.5	-87.1	0	0	0	111.3	L468 D471 F472 R475 M485 E489 G490 W495 I496 L497	L468-H493 PolarHBondContact O-CE1 3Å; D471-H493 IonicContact OD2-CE1 3.61Å; D471-H493 IonicContact OD2-NE2 3.88Å; D471-H493 PolarHBondContact OD2-NE2 3.31Å; F472-H493 HydrophobicContact CD2-CB 3.76Å; F472-H493 AromaticContact CD2-CG 3.58Å; F472-H493 AromaticContact CD2-ND1 3.61Å; F472-H493 HydrophobicContact CE2-CB 4.03Å; R475-H493 PolarHBondContact NE-NE2 2.91Å; M485-H493 HydrophobicContact SD-CB 4.43Å; E489-H493 PolarHBondContact O-N 3.39Å; G490-H493 VanDerWaalsContact O-CB 3.32Å; G490-H493 WeakPolarHBondContact O-CB 3.49Å; G490-H493 PolarHBondContact O-N 3.28Å; H493-W495 VanDerWaalsContact C-N 3.26Å; H493-W495 WeakPolarHBondContact ND1-CB 3.28Å; H493-W495 PolarHBondContact ND1-N 2.87Å; H493-W495 PolarHBondContact O-N 3.01Å; H493-W495 VanDerWaalsContact O-N 3.17Å; H493-I496 WeakPolarHBondContact O-CA 3.41Å; H493-I496 WeakPolarHBondContact O-CB 3.36Å; H493-I496 PolarHBondContact O-N 3.46Å; H493-L497 PolarHBondContact O-N 3.11Å
494	Q	96.9	Very high	84.7	Confident	114 Å²	114	64.8 Å²	64.8	53%	0.533	33%	0.327	S	S	.	.	H	α-helix	trans	-54.9	-40.9	-175.3	-68.2	-59.6	-31.4	0	0	112.6	L468 I496 L497 E498	L468-Q494 HydrophobicContact CD1-CB 4.36Å; L468-Q494 HydrophobicContact CD2-CB 4.16Å; Q494-I496 VanDerWaalsContact C-N 3.25Å; Q494-I496 PolarHBondContact O-N 2.95Å; Q494-L497 PolarHBondContact O-N 3.13Å; Q494-L497 VanDerWaalsContact O-N 3.13Å; Q494-E498 WeakPolarHBondContact O-CG 3.49Å; Q494-E498 PolarHBondContact O-N 3.03Å
495	W	97.4	Very high	81.9	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-52.9	-38.4	173.4	-176.5	68.9	0	0	0	114	L300 I303 R304 A307 L390 L468 F469 F472 H493	L300-W495 HydrophobicContact CD2-CZ2 4.42Å; I303-W495 HydrophobicContact CG2-CH2 4.14Å; I303-W495 HydrophobicContact CG2-CZ2 4.45Å; R304-W495 HydrophobicContact CB-CH2 4.15Å; R304-W495 HydrophobicContact CB-CZ2 3.93Å; R304-W495 WeakPolarHBondContact CD-O 3.39Å; R304-W495 HydrophobicContact CG-CZ2 4.42Å; R304-W495 PolarHBondContact NE-O 3.41Å; A307-W495 HydrophobicContact CB-CH2 3.81Å; A307-W495 HydrophobicContact CB-CZ3 3.57Å; L390-W495 HydrophobicContact CD1-CH2 4.39Å; L390-W495 HydrophobicContact CD1-CZ3 4.19Å; L468-W495 HydrophobicContact CB-CB 3.85Å; L468-W495 HydrophobicContact CB-CG 4.37Å; L468-W495 WeakPolarHBondContact O-CB 3.5Å; F469-W495 HydrophobicContact CD2-CD2 4.06Å; F469-W495 AromaticContact CD2-CE2 3.45Å; F469-W495 VanDerWaalsContact CD2-CE2 3.45Å; F469-W495 HydrophobicContact CD2-CE3 4.45Å; F469-W495 AromaticContact CD2-CH2 3.8Å; F469-W495 HydrophobicContact CD2-CH2 3.8Å; F469-W495 AromaticContact CD2-CZ2 3.33Å; F469-W495 HydrophobicContact CD2-CZ2 3.33Å; F469-W495 HydrophobicContact CD2-CZ3 4.32Å; F469-W495 AromaticContact CD2-NE1 3.78Å; F469-W495 AromaticContact CE2-CH2 3.81Å; F469-W495 HydrophobicContact CE2-CH2 3.81Å; F469-W495 AromaticContact CE2-CZ2 3.68Å; F469-W495 HydrophobicContact CE2-CZ2 3.68Å; F469-W495 HydrophobicContact CE2-CZ3 4.5Å; F469-W495 HydrophobicContact CG-CZ2 4.29Å; F472-W495 HydrophobicContact CB-CB 4.31Å; F472-W495 HydrophobicContact CB-CD2 4.4Å; F472-W495 HydrophobicContact CB-CE3 4.03Å; F472-W495 AromaticContact CD1-CE3 3.93Å; F472-W495 HydrophobicContact CD1-CE3 3.93Å; F472-W495 AromaticContact CD1-CZ3 3.93Å; F472-W495 HydrophobicContact CD1-CZ3 3.93Å; F472-W495 AromaticContact CD2-CE3 3.68Å; F472-W495 HydrophobicContact CD2-CE3 3.68Å; F472-W495 HydrophobicContact CD2-CZ3 4.34Å; F472-W495 HydrophobicContact CE1-CE3 4.37Å; F472-W495 HydrophobicContact CE1-CZ3 4.1Å; F472-W495 HydrophobicContact CE2-CE3 4.13Å; F472-W495 HydrophobicContact CE2-CZ3 4.48Å; F472-W495 HydrophobicContact CG-CD2 4.41Å; F472-W495 AromaticContact CG-CE3 3.58Å; F472-W495 HydrophobicContact CG-CE3 3.58Å; F472-W495 HydrophobicContact CG-CZ3 4.08Å; F472-W495 HydrophobicContact CZ-CE3 4.47Å; F472-W495 HydrophobicContact CZ-CZ3 4.37Å; H493-W495 VanDerWaalsContact C-N 3.26Å; H493-W495 WeakPolarHBondContact ND1-CB 3.28Å; H493-W495 PolarHBondContact ND1-N 2.87Å; H493-W495 PolarHBondContact O-N 3.01Å; H493-W495 VanDerWaalsContact O-N 3.17Å
496	I	96.9	Very high	79	Confident	6 Å²	6	79.8 Å²	79.8	3%	0.031	40%	0.399	C	S	.	.	H	α-helix	trans	-76.1	-46.5	176.3	-63.8	-62.8	0	0	0	110.1	R304 A307 H308 L311 F472 G490 H493 Q494 E498 G499	R304-I496 HydrophobicContact CG-CD1 4.15Å; A307-I496 HydrophobicContact CB-CD1 3.79Å; H308-I496 HydrophobicContact CB-CG2 4.44Å; L311-I496 HydrophobicContact CD1-CD1 4.02Å; L311-I496 HydrophobicContact CD1-CG1 3.98Å; F472-I496 HydrophobicContact CD2-CG1 4.27Å; F472-I496 HydrophobicContact CE2-CD1 4.2Å; F472-I496 HydrophobicContact CE2-CG1 3.75Å; F472-I496 HydrophobicContact CZ-CG1 4.48Å; G490-I496 VanDerWaalsContact O-CG1 3.31Å; G490-I496 WeakPolarHBondContact O-CG1 3.25Å; H493-I496 WeakPolarHBondContact O-CA 3.41Å; H493-I496 WeakPolarHBondContact O-CB 3.36Å; H493-I496 PolarHBondContact O-N 3.46Å; Q494-I496 VanDerWaalsContact C-N 3.25Å; Q494-I496 PolarHBondContact O-N 2.95Å; I496-E498 PolarHBondContact O-N 3.04Å; I496-G499 PolarHBondContact O-N 3.07Å; I496-G499 VanDerWaalsContact O-N 3.17Å
497	L	94.5	Very high	76.2	Confident	59 Å²	59	88.8 Å²	88.8	31%	0.309	43%	0.427	S	S	.	.	H	α-helix	trans	-63.8	-35.2	-176.7	-63.8	-179	0	0	0	113.7	Q492 H493 Q494 G499 N500	Q492-L497 VanDerWaalsContact O-CD1 3.25Å; Q492-L497 WeakPolarHBondContact O-CD1 3.49Å; H493-L497 PolarHBondContact O-N 3.11Å; Q494-L497 PolarHBondContact O-N 3.13Å; Q494-L497 VanDerWaalsContact O-N 3.13Å; L497-G499 PolarHBondContact O-N 3.33Å; L497-N500 VanDerWaalsContact O-CB 3.27Å; L497-N500 WeakPolarHBondContact O-CB 3.48Å; L497-N500 PolarHBondContact O-N 2.89Å; L497-N500 VanDerWaalsContact O-N 3.15Å
498	E	87.3	Confident	73.5	Confident	121 Å²	121	94.4 Å²	94.4	57%	0.565	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-30	175.6	-79.5	-162.9	158.9	0	0	113.1	L468 Q494 I496 N500	L468-E498 HydrophobicContact CD1-CG 4.17Å; L468-E498 WeakPolarHBondContact CD1-OE1 3.46Å; L468-E498 WeakPolarHBondContact CD1-OE2 3.28Å; Q494-E498 WeakPolarHBondContact O-CG 3.49Å; Q494-E498 PolarHBondContact O-N 3.03Å; I496-E498 PolarHBondContact O-N 3.04Å; E498-N500 PolarHBondContact O-N 3.42Å
499	G	69.8	Low	70.5	Confident	19 Å²	19	101 Å²	101	20%	0.196	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	0.7	177.2	0	0	0	0	0	115.1	R304 I496 L497 F501	R304-G499 VanDerWaalsContact CD-CA 3.43Å; I496-G499 PolarHBondContact O-N 3.07Å; I496-G499 VanDerWaalsContact O-N 3.17Å; L497-G499 PolarHBondContact O-N 3.33Å; G499-F501 VanDerWaalsContact O-CD1 3.32Å; G499-F501 WeakPolarHBondContact O-CD1 3.22Å; G499-F501 WeakPolarHBondContact O-CE1 3.29Å; G499-F501 PolarHBondContact O-N 2.89Å
500	N	62.8	Low	67.6	Low	87 Å²	87	101.9 Å²	101.9	47%	0.465	50%	0.503	S	S	.	.			trans	-35.1	97.8	-165.4	-136.5	-36.8	0	0	0	114.3	L497 E498 N502 K503	L497-N500 VanDerWaalsContact O-CB 3.27Å; L497-N500 WeakPolarHBondContact O-CB 3.48Å; L497-N500 PolarHBondContact O-N 2.89Å; L497-N500 VanDerWaalsContact O-N 3.15Å; E498-N500 PolarHBondContact O-N 3.42Å; N500-N502 PolarHBondContact O-N 3.25Å; N500-K503 PolarHBondContact O-N 2.95Å; N500-K503 VanDerWaalsContact O-N 3.13Å
501	F	58.7	Low	64.8	Low	111 Å²	111	108.4 Å²	108.4	49%	0.487	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-10.8	-173.9	-52.7	-67.3	0	0	0	113.4	R305 G499	R305-F501 HydrophobicContact CB-CZ 4.35Å; R305-F501 HydrophobicContact CG-CD1 4.21Å; R305-F501 HydrophobicContact CG-CE1 3.3Å; R305-F501 HydrophobicContact CG-CE2 4.36Å; R305-F501 HydrophobicContact CG-CZ 3.4Å; R305-F501 VanDerWaalsContact CG-CZ 3.4Å; G499-F501 VanDerWaalsContact O-CD1 3.32Å; G499-F501 WeakPolarHBondContact O-CD1 3.22Å; G499-F501 WeakPolarHBondContact O-CE1 3.29Å; G499-F501 PolarHBondContact O-N 2.89Å
502	N	44.4	Very low	61.9	Low	140 Å²	140	112.3 Å²	112.3	75%	0.749	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	9.4	179.5	-70.6	-18.3	0	0	0	114.6	N500 V504	N500-N502 PolarHBondContact O-N 3.25Å; N502-V504 PolarHBondContact O-N 3.49Å
503	K	46.7	Very low	59	Low	176 Å²	176	116.1 Å²	116.1	77%	0.765	59%	0.592	S	S	*	*			trans	-69.4	75.2	163	-82.7	-176.8	178.9	170.8	0	110	N500 R505	N500-K503 PolarHBondContact O-N 2.95Å; N500-K503 VanDerWaalsContact O-N 3.13Å; K503-R505 PolarHBondContact O-N 2.83Å
504	V	41.2	Very low	56	Low	133 Å²	133	127.2 Å²	127.2	81%	0.806	63%	0.633	S	S	*	*			trans	-51.2	109.8	156.5	175.4	0	0	0	0	106	N502 S506	N502-V504 PolarHBondContact O-N 3.49Å; V504-S506 PolarHBondContact O-N 3.03Å
505	R	40.1	Very low	52.9	Low	233 Å²	233	125.3 Å²	125.3	88%	0.879	65%	0.645	S	S	*	*			trans	-56.8	108.5	178.6	-144.3	178.6	-173.5	-179.3	1.2	106.6	K503 R507	K503-R505 PolarHBondContact O-N 2.83Å; R505-R507 PolarHBondContact O-N 2.8Å
506	S	35.8	Very low	49.8	Very low	101 Å²	101	129.5 Å²	129.5	71%	0.706	68%	0.68	S	S	*	*			trans	-58.7	111.1	174.7	51.4	0	0	0	0	106.6	V504 T508	V504-S506 PolarHBondContact O-N 3.03Å; S506-T508 PolarHBondContact O-N 3.39Å
507	R	41	Very low	46.7	Very low	236 Å²	236	138.1 Å²	138.1	89%	0.891	72%	0.72	S	S	*	*			trans	-65.7	93	172.8	-90.2	178.4	143.2	-177.9	-5.9	106.7	R505 K509	R505-R507 PolarHBondContact O-N 2.8Å; R507-K509 PolarHBondContact O-N 3.5Å
508	T	41.4	Very low	43.5	Very low	128 Å²	128	140.5 Å²	140.5	79%	0.785	74%	0.741	S	S	*	*			trans	-53.8	108.5	159.6	31.6	0	0	0	0	106.6	S506	S506-T508 PolarHBondContact O-N 3.39Å
509	K	36.2	Very low	40.7	Very low	190 Å²	190	139.9 Å²	139.9	83%	0.826	75%	0.749	S	S	*	*			trans	-58.4	132.1	176.4	-73	177.9	176.3	175.7	0	107.4	R507 T511	R507-K509 PolarHBondContact O-N 3.5Å; K509-T511 PolarHBondContact O-N 3.13Å; K509-T511 VanDerWaalsContact O-N 3.16Å
510	P	37.5	Very low	38.7	Very low	127 Å²	127	144.7 Å²	144.7	83%	0.825	78%	0.78	S	S	*	*			trans	-61.5	121.2	168.3	-12.5	25.8	0	0	0	107.7	A512	P510-A512 PolarHBondContact O-N 3.08Å
511	T	38.5	Very low	37	Very low	137 Å²	137	144.3 Å²	144.3	84%	0.84	80%	0.796	S	S	*	*			trans	-66.3	114.4	170.3	36.1	0	0	0	0	108.4	K509 K513	K509-T511 PolarHBondContact O-N 3.13Å; K509-T511 VanDerWaalsContact O-N 3.16Å; T511-K513 PolarHBondContact O-N 3.08Å; T511-K513 VanDerWaalsContact O-N 3.15Å
512	A	36.2	Very low	35.7	Very low	97 Å²	97	143.3 Å²	143.3	80%	0.802	81%	0.808	S	S	*	*			trans	-66.2	113.6	178.7	0	0	0	0	0	109.9	P510 R514	P510-A512 PolarHBondContact O-N 3.08Å; A512-R514 PolarHBondContact O-N 2.87Å
513	K	36.8	Very low	35	Very low	212 Å²	212	144.1 Å²	144.1	92%	0.922	81%	0.813	S	S	*	*			trans	-69.7	107.3	162.8	-77.6	-173.3	173.1	-175.6	0	108.5	T511	T511-K513 PolarHBondContact O-N 3.08Å; T511-K513 VanDerWaalsContact O-N 3.15Å
514	R	36.3	Very low	34.2	Very low	244 Å²	244	141.5 Å²	141.5	92%	0.921	82%	0.816	S	S	*	*			trans	-75.1	142.5	152.4	-77.3	-177.1	170.8	-179.7	-3.8	107.9	A512	A512-R514 PolarHBondContact O-N 2.87Å
515	G	31.3	Very low	33.7	Very low	75 Å²	75	146.4 Å²	146.4	77%	0.773	82%	0.82	S	S	*	*			trans	-109.3	-164.5	-178.9	0	0	0	0	0	113.6
516	A	32.5	Very low	33.9	Very low	88 Å²	88	141.2 Å²	141.2	73%	0.727	82%	0.817	S	S	*	*			trans	87.5	103.7	174.7	0	0	0	0	0	118
517	E	31	Very low	33.7	Very low	187 Å²	187	140.4 Å²	140.4	87%	0.874	82%	0.816	S	S	*	*				62.1	118.7	123.9	-64.2	164.6	-159.2	0	0	121
518	S	28.5	Very low	33.1	Very low	108 Å²	108	138 Å²	138	76%	0.755	82%	0.815	S	S	*	*				164.3	155.2	84.5	-161.8	0	0	0	0	114.9
519	C	27.4	Very low	32.7	Very low	109 Å²	109	141.2 Å²	141.2	74%	0.736	82%	0.818	S	S	*	*			trans	63.9	110.2	152.3	-82.6	0	0	0	0	124.6
520	S	28.7	Very low	32.5	Very low	120 Å²	120	138.8 Å²	138.8	84%	0.839	82%	0.819	S	S	*	*				63.2	133.9	122.2	67.5	0	0	0	0	123.3
521	G	27.7	Very low	32.2	Very low	78 Å²	78	135.7 Å²	135.7	80%	0.804	81%	0.81	S	S	*	*			trans	151.9	82.3	148.6	0	0	0	0	0	119.6
522	A	30.5	Very low	31.9	Very low	90 Å²	90	134 Å²	134	74%	0.744	81%	0.81	S	S	*	*			trans	39.3	135.8	145.2	0	0	0	0	0	124.9
523	N	29.8	Very low	31.6	Very low	158 Å²	158	137 Å²	137	85%	0.845	81%	0.808	S	S	*	*			trans	51.2	123	141.5	-63.3	-8	0	0	0	120.4
524	S	30.3	Very low	31.4	Very low	120 Å²	120	135.2 Å²	135.2	84%	0.839	80%	0.802	S	S	*	*				-175.5	158.7	64.9	38.7	0	0	0	0	114
525	R	30.6	Very low	31.1	Very low	237 Å²	237	126.8 Å²	126.8	89%	0.894	79%	0.791	S	S	*	*			trans	-113.3	161.4	163.8	-90.3	-174.5	179.3	-171.4	0.8	107.3
526	P	43.9	Very low	31.1	Very low	123 Å²	123	128.8 Å²	128.8	80%	0.799	79%	0.793	S	S	*	*			cis	-130.9	171.1	47.2	18.4	7.7	0	0	0	113.9
527	A	31.4	Very low	31	Very low	85 Å²	85	131.7 Å²	131.7	70%	0.702	80%	0.797	S	S	*	*			cis	109.8	110.5	15.8	0	0	0	0	0	115.2
528	E	29.7	Very low	31	Very low	185 Å²	185	130.3 Å²	130.3	86%	0.864	80%	0.795	S	S	*	*			trans	-144.1	127.1	151.9	-80.1	-169.3	132.4	0	0	106.2
529	K	32.4	Very low	31.2	Very low	196 Å²	196	133.9 Å²	133.9	85%	0.852	80%	0.797	S	S	*	*				60.6	133.8	73.4	-73	-168.7	172.7	-178.4	0	112.3
530	V	32.6	Very low	31.3	Very low	139 Å²	139	137 Å²	137	84%	0.842	81%	0.806	S	S	*	*			cis	-156.3	155.6	-4.9	139.9	0	0	0	0	105.4
531	G	29.2	Very low	31.4	Very low	62 Å²	62	140 Å²	140	64%	0.639	80%	0.804	S	S	*	*			cis	140.1	157	0.9	0	0	0	0	0	111.4
532	A	32.5	Very low	31.5	Very low	102 Å²	102	146.4 Å²	146.4	84%	0.843	80%	0.804	S	S	*	*			trans	71.2	146.9	167.5	0	0	0	0	0	118.2
533	E	30.5	Very low	31.4	Very low	160 Å²	160	148 Å²	148	75%	0.748	80%	0.8	S	S	*	*			cis	-172.1	-176.1	-17.3	-150.4	174.6	-125.3	0	0	110
534	H	33.2	Very low	31.3	Very low	174 Å²	174	144.1 Å²	144.1	81%	0.806	80%	0.796	S	S	*	*			trans	70.2	147.4	170.6	-67.4	49.4	0	0	0	117.8
535	G	29.4	Very low	31.2	Very low	67 Å²	67	144.5 Å²	144.5	69%	0.691	80%	0.799	S	S	*	*			cis	159.3	105	-8	0	0	0	0	0	114.7
536	S	31	Very low	31.2	Very low	117 Å²	117	142.7 Å²	142.7	82%	0.818	80%	0.801	S	S	*	*			trans	57.3	132.8	152.3	-65.1	0	0	0	0	123.9
537	N	31.1	Very low	30.5	Very low	149 Å²	149	142 Å²	142	80%	0.797	81%	0.805	S	S	*	*			trans	41.4	131.7	136.9	-72	-11.7	0	0	0	121.6
538	D	30	Very low	30.3	Very low	157 Å²	157	141.7 Å²	141.7	84%	0.84	81%	0.811	S	S	*	*				-151.7	158.8	92.3	-135.7	-20.5	0	0	0	115.4
539	K	33.7	Very low	30.2	Very low	183 Å²	183	138.2 Å²	138.2	80%	0.796	81%	0.807	S	S	*	*			trans	-101.9	156.1	168.9	-74.1	170.4	174.7	166.4	0	109
540	L	29.1	Very low	29.9	Very low	175 Å²	175	138.1 Å²	138.1	92%	0.916	81%	0.807	S	S	*	*			trans	-153.2	141	137.8	-110.8	163.6	0	0	0	112.1
541	K	29.8	Very low	29.8	Very low	183 Å²	183	141 Å²	141	80%	0.796	81%	0.813	S	S	*	*			trans	-96.2	154.6	172.4	-73	176	164.3	-173.4	0	109
542	R	30.8	Very low	29.7	Very low	213 Å²	213	142.6 Å²	142.6	80%	0.804	82%	0.821	S	S	*	*				176.9	140.5	102.3	-95.4	-170.3	133.1	143	-1.9	113.2
543	D	28.7	Very low	29.5	Very low	124 Å²	124	143.2 Å²	143.2	66%	0.663	82%	0.818	S	S	*	*				35.9	133.5	125	-40	-16.9	0	0	0	117.9
544	G	27.4	Very low	29.4	Very low	75 Å²	75	139.2 Å²	139.2	77%	0.773	82%	0.82	S	S	*	*			cis	132.3	128.6	3	0	0	0	0	0	111.7
545	S	28	Very low	29.2	Very low	129 Å²	129	138.9 Å²	138.9	90%	0.902	82%	0.819	S	S	*	*			trans	-170.3	146.3	159.8	41.6	0	0	0	0	111.7
546	E	31.1	Very low	29.2	Very low	198 Å²	198	146.6 Å²	146.6	93%	0.925	83%	0.827	S	S	*	*			trans	-99.4	152.9	-171.4	-58.7	167.4	111.4	0	0	112.6
547	A	29.3	Very low	29.1	Very low	108 Å²	108	148.4 Å²	148.4	89%	0.893	83%	0.827	S	S	*	*			trans	-154.2	109.3	144.7	0	0	0	0	0	108.6
548	G	26	Very low	29.2	Very low	80 Å²	80	152.1 Å²	152.1	83%	0.825	83%	0.83	S	S	*	*			trans	-93.5	152.6	-176	0	0	0	0	0	113.8
549	S	27.4	Very low	29.1	Very low	112 Å²	112	149.7 Å²	149.7	78%	0.783	82%	0.823	S	S	*	*			trans	-154.3	118.4	150.7	-166.4	0	0	0	0	112.3
550	K	27.4	Very low	28.8	Very low	194 Å²	194	148.7 Å²	148.7	84%	0.843	83%	0.825	S	S	*	*			trans	26.8	117.2	151	-63.9	176.7	178.4	177.7	0	119	A552	K550-A552 PolarHBondContact O-N 3.47Å
551	M	30.1	Very low	28.6	Very low	199 Å²	199	143.6 Å²	143.6	98%	0.98	82%	0.815	S	S	*	*			trans	-56.8	131.9	154.2	-62.6	-178.3	-171	0	0	110.3
552	A	27.1	Very low	28.5	Very low	96 Å²	96	139.3 Å²	139.3	79%	0.793	81%	0.814	S	S	*	*			trans	-106.5	129	158.7	0	0	0	0	0	108.5	K550 G554	K550-A552 PolarHBondContact O-N 3.47Å; A552-G554 PolarHBondContact O-N 3.3Å
553	S	29.1	Very low	28.3	Very low	114 Å²	114	134.3 Å²	134.3	80%	0.797	81%	0.811	S	S	*	*			trans	-64.6	111.6	173.5	47.6	0	0	0	0	110.3	E555	S553-E555 PolarHBondContact O-N 2.81Å; S553-E555 VanDerWaalsContact O-N 3.15Å
554	G	27.5	Very low	28.1	Very low	76 Å²	76	132.7 Å²	132.7	78%	0.784	82%	0.816	S	S	*	*			trans	-65.3	111.4	171.6	0	0	0	0	0	110.6	A552 R556	A552-G554 PolarHBondContact O-N 3.3Å; G554-R556 PolarHBondContact O-N 2.91Å
555	E	29.8	Very low	28.1	Very low	168 Å²	168	138.2 Å²	138.2	79%	0.785	82%	0.821	S	S	*	*			trans	-60.2	121.5	179.5	-69.7	-178	117.7	0	0	111.1	S553 L557	S553-E555 PolarHBondContact O-N 2.81Å; S553-E555 VanDerWaalsContact O-N 3.15Å; E555-L557 VanDerWaalsContact C-N 3.26Å; E555-L557 PolarHBondContact O-N 3.17Å
556	R	29.5	Very low	28.2	Very low	229 Å²	229	140.8 Å²	140.8	86%	0.864	82%	0.819	S	S	*	*			trans	-79.8	75.2	-179.5	-161.9	179.4	-163.1	178	5.1	109.8	G554 R558	G554-R556 PolarHBondContact O-N 2.91Å; R556-R558 PolarHBondContact O-N 3.31Å
557	L	29.1	Very low	27.9	Very low	154 Å²	154	140.8 Å²	140.8	81%	0.806	82%	0.819	S	S	*	*			trans	-55.8	125.8	-178.6	-75.2	171.4	0	0	0	111.6	E555	E555-L557 VanDerWaalsContact C-N 3.26Å; E555-L557 PolarHBondContact O-N 3.17Å
558	R	32	Very low	27.9	Very low	227 Å²	227	141.8 Å²	141.8	86%	0.857	81%	0.814	S	S	*	*			trans	-72.2	138.5	177.9	-58.8	175	-177.1	173.7	0.5	109.3	R556 L560	R556-R558 PolarHBondContact O-N 3.31Å; R558-L560 PolarHBondContact O-N 2.9Å
559	P	27.7	Very low	27.7	Very low	107 Å²	107	143.7 Å²	143.7	70%	0.695	81%	0.813	S	S	*	*			trans	-69.2	100.2	164.4	-14.4	29.5	0	0	0	109.2	G561	P559-G561 PolarHBondContact O-N 3.09Å
560	L	27.3	Very low	27.7	Very low	161 Å²	161	147.4 Å²	147.4	84%	0.843	82%	0.818	S	S	*	*			trans	-60.6	127.8	159.6	-80	158	0	0	0	108	R558	R558-L560 PolarHBondContact O-N 2.9Å
561	G	26.4	Very low	27.6	Very low	69 Å²	69	143.6 Å²	143.6	71%	0.711	82%	0.816	S	S	*	*			trans	-103.9	116.7	178.4	0	0	0	0	0	110.4	P559 S563	P559-G561 PolarHBondContact O-N 3.09Å; G561-S563 PolarHBondContact O-N 3.24Å
562	A	26.5	Very low	27.6	Very low	92 Å²	92	143.8 Å²	143.8	76%	0.76	82%	0.815	S	S	*	*			trans	15.6	88.2	160.2	0	0	0	0	0	118
563	S	26	Very low	27.9	Very low	108 Å²	108	143.3 Å²	143.3	76%	0.755	82%	0.819	S	S	*	*				-97.2	106.8	129.9	-78.6	0	0	0	0	106.8	G561	G561-S563 PolarHBondContact O-N 3.24Å
564	A	25.6	Very low	27.8	Very low	91 Å²	91	140.9 Å²	140.9	75%	0.752	81%	0.812	S	S	*	*			trans	-111.7	116	157.1	0	0	0	0	0	105.4
565	E	28.1	Very low	28.2	Very low	190 Å²	190	147.1 Å²	147.1	89%	0.888	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-78.3	122.6	174.9	-64.2	170	159.6	0	0	107.2
566	E	28.9	Very low	28.2	Very low	183 Å²	183	149.5 Å²	149.5	86%	0.855	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-101.6	118.4	168.1	-74.4	-171.9	160.4	0	0	108.1
567	E	25.3	Very low	28.4	Very low	198 Å²	198	141.3 Å²	141.3	93%	0.925	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-62.8	137.1	170.1	-72.6	-171.6	135.1	0	0	110.5	C569	E567-C569 PolarHBondContact O-N 2.97Å
568	V	28.1	Very low	28.6	Very low	129 Å²	129	140.2 Å²	140.2	78%	0.782	80%	0.798	S	S	*	*			trans	-84.3	110.6	178.6	179.6	0	0	0	0	109.5	E570	V568-E570 HydrophobicContact CG1-CG 4.29Å
569	C	23.1	Very low	28.8	Very low	121 Å²	121	134.2 Å²	134.2	82%	0.818	78%	0.78	S	S	*	*			trans	-100.7	117.1	155.8	-88.9	0	0	0	0	109	E567	E567-C569 PolarHBondContact O-N 2.97Å
570	E	27.6	Very low	28.9	Very low	189 Å²	189	132.2 Å²	132.2	88%	0.883	76%	0.763	S	S	*	*			trans	-67.6	131.6	177.8	-63.6	-174.9	137.7	0	0	111.1	V568	V568-E570 HydrophobicContact CG1-CG 4.29Å
571	S	25.8	Very low	29	Very low	115 Å²	115	131 Å²	131	80%	0.804	76%	0.755	S	S	*	*			trans	-142	131.4	160.8	45.7	0	0	0	0	108.4
572	E	29.8	Very low	29.3	Very low	203 Å²	203	133.7 Å²	133.7	95%	0.949	75%	0.752	S	S	*	*			trans	-70.4	148.4	-169.8	-60.3	-175.2	129.6	0	0	112.7
573	G	32.5	Very low	29.4	Very low	86 Å²	86	137.1 Å²	137.1	89%	0.887	75%	0.75	S	S	*	*			trans	95.2	75.1	162.8	0	0	0	0	0	116.6
574	G	26.3	Very low	29.6	Very low	63 Å²	63	137.6 Å²	137.6	65%	0.649	75%	0.75	S	S	*	*			trans	168.4	106.3	162.5	0	0	0	0	0	114.4	R576	G574-R576 PolarHBondContact O-N 3.15Å
575	E	37.1	Very low	29.9	Very low	206 Å²	206	142.5 Å²	142.5	96%	0.963	76%	0.758	S	S	*	*			trans	-61.4	126	177.2	-63.5	-170.4	138.8	0	0	111.9
576	R	29.4	Very low	30	Very low	219 Å²	219	142.4 Å²	142.4	83%	0.826	76%	0.757	S	S	*	*			trans	-127.5	141.6	172.6	-63.1	-175.1	-173.6	-178.5	5.1	110.6	G574	G574-R576 PolarHBondContact O-N 3.15Å
577	P	34.8	Very low	30.1	Very low	56 Å²	56	142.8 Å²	142.8	36%	0.364	76%	0.759	S	S	.	*	P	Polyproline II helix	trans	-74.6	132.8	175.7	29.7	-32.9	0	0	0	111.5	Y360	Y360-P577 HydrophobicContact CD1-CB 4.4Å; Y360-P577 HydrophobicContact CD1-CG 3.59Å; Y360-P577 HydrophobicContact CE1-CG 4.22Å; Y360-P577 HydrophobicContact CG-CG 3.89Å
578	V	33.2	Very low	30.3	Very low	131 Å²	131	141.9 Å²	141.9	79%	0.794	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-78.7	138.2	178.7	-179.2	0	0	0	0	110.7
579	H	34.4	Very low	30.4	Very low	101 Å²	101	140.9 Å²	140.9	47%	0.468	76%	0.756	S	S	.	*	P	Polyproline II helix	trans	-72.8	152.8	-175.2	-87.6	-84.8	0	0	0	114.5	Y360 R364	Y360-H579 PolarHBondContact OH-CE1 2.96Å; Y360-H579 PolarHBondContact OH-NE2 3.15Å; R364-H579 PolarHBondContact NH2-CE1 3.2Å
580	I	30.5	Very low	30.9	Very low	66 Å²	66	141.1 Å²	141.1	34%	0.338	75%	0.754	S	S	.	*	P	Polyproline II helix	trans	-89.8	124.7	164.5	-63.1	168.7	0	0	0	108	I582	I580-I582 HydrophobicContact CG2-CG1 4.49Å
581	I	30.1	Very low	31.1	Very low	135 Å²	135	140.6 Å²	140.6	69%	0.692	75%	0.751	S	S	*	*			trans	-130.4	122.1	169.9	-59	177.2	0	0	0	107.3	K583	I581-K583 HydrophobicContact CG2-CG 4.16Å
582	I	31.9	Very low	31.4	Very low	125 Å²	125	146 Å²	146	64%	0.641	75%	0.754	S	S	*	*			trans	-101.1	107.7	170.3	-61.8	169.5	0	0	0	107.2	I580	I580-I582 HydrophobicContact CG2-CG1 4.49Å
583	K	28	Very low	31.7	Very low	164 Å²	164	145.7 Å²	145.7	71%	0.713	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-85.9	135.8	170.4	-69.4	-173.2	176.6	-175.5	0	109.6	I581	I581-K583 HydrophobicContact CG2-CG 4.16Å
584	P	30.2	Very low	32.1	Very low	118 Å²	118	148.6 Å²	148.6	77%	0.766	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-64.4	146.8	163.7	-11.7	26.7	0	0	0	110.1
585	Q	32.3	Very low	32.6	Very low	195 Å²	195	153.1 Å²	153.1	91%	0.911	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-74	141.3	163	-81.8	-177.3	-97.7	0	0	109.7
586	E	31.6	Very low	32.4	Very low	188 Å²	188	150.5 Å²	150.5	88%	0.879	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-77.2	135.1	165.6	-65.1	178.3	150.1	0	0	109.2	M588	E586-M588 PolarHBondContact O-N 3.16Å
587	E	30.3	Very low	32.6	Very low	190 Å²	190	146.9 Å²	146.9	89%	0.888	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-77	118.8	169	-72.4	-176.8	158.4	0	0	108.9	S589	E587-S589 PolarHBondContact O-N 3.19Å
588	M	29.8	Very low	32.4	Very low	179 Å²	179	151.9 Å²	151.9	88%	0.882	80%	0.804	S	S	*	*			trans	-65.3	101.7	169.2	-111.4	169.4	43.2	0	0	109.4	E586 T590	E586-M588 PolarHBondContact O-N 3.16Å; M588-T590 PolarHBondContact O-N 3.15Å
589	S	29.5	Very low	32.4	Very low	109 Å²	109	153.2 Å²	153.2	76%	0.762	81%	0.805	S	S	*	*			trans	-70.4	108.1	170.8	54.7	0	0	0	0	110.1	E587 E591	E587-S589 PolarHBondContact O-N 3.19Å; S589-E591 PolarHBondContact O-N 3.19Å; S589-E591 VanDerWaalsContact O-N 3.13Å
590	T	32.9	Very low	32.3	Very low	126 Å²	126	156.4 Å²	156.4	77%	0.773	83%	0.826	S	S	*	*			trans	-67.8	105.3	168.5	49.2	0	0	0	0	109.8	M588 R592	M588-T590 PolarHBondContact O-N 3.15Å; T590-R592 PolarHBondContact O-N 3.44Å
591	E	32.6	Very low	32.4	Very low	178 Å²	178	162.5 Å²	162.5	83%	0.832	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-62.7	122.4	168.2	-70.3	-172.3	144.5	0	0	109.9	S589	S589-E591 PolarHBondContact O-N 3.19Å; S589-E591 VanDerWaalsContact O-N 3.13Å
592	R	32	Very low	32.5	Very low	229 Å²	229	164.4 Å²	164.4	86%	0.864	87%	0.87	S	S	*	*	P	Polyproline II helix	trans	-79.7	119.7	163.2	-71	-175.5	179.1	-175.8	-1.1	108.3	T590	T590-R592 PolarHBondContact O-N 3.44Å
593	K	37.2	Very low	32.6	Very low	195 Å²	195	167.5 Å²	167.5	85%	0.848	89%	0.888	S	S	*	*	P	Polyproline II helix	trans	-83.2	117.7	159.3	-72.7	-174.4	175.7	-177	0	108.6
594	D	40.2	Very low	33	Very low	148 Å²	148	167.8 Å²	167.8	79%	0.791	90%	0.902	S	S	*	*			trans	-149	124.5	162.8	-79.7	-51.7	0	0	0	107.4
595	G	37.1	Very low	33.2	Very low	158 Å²	158	172.3 Å²	172.3	100%	1.629	91%	0.914	S	S	*	*			trans	99.1	0	175.5	0	0	0	0	0	115.2

Retrieved 595 of 595 residues in 771.3 ms (Link to these results)

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