A0A087XDB7_POEFO Loading...

Nuclear receptor subfamily 1, group H, member 3

AlphaFold DB , UniProt , Accession A0A087XDB7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 464 aa.

Structure Viewer

Loading PAE data...

(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	32.7	Very low	35.4	Very low	239 Å²	239	138.5 Å²	138.5	100%	1.177	80%	0.795	S	S	*	*				0	128	0	-84.4	176	165.7	0	0	108.2
2	S	32.7	Very low	35.1	Very low	114 Å²	114	138.2 Å²	138.2	80%	0.797	80%	0.796	S	S	*	*			trans	73	95	154.1	-47.7	0	0	0	0	120.4
3	T	38.4	Very low	34.6	Very low	124 Å²	124	132.5 Å²	132.5	76%	0.761	79%	0.786	S	S	*	*			trans	1.2	155.8	137.1	56.5	0	0	0	0	123.6
4	L	34.9	Very low	34.5	Very low	164 Å²	164	135.8 Å²	135.8	86%	0.859	79%	0.789	S	S	*	*			trans	102.4	138.5	155.5	-58.4	172.4	0	0	0	114.7
5	S	35.3	Very low	34.1	Very low	90 Å²	90	135.3 Å²	135.3	63%	0.629	78%	0.782	S	S	*	*			cis	-176.2	127.9	-6.2	46.8	0	0	0	0	106.9
6	V	41.2	Very low	34	Very low	129 Å²	129	137.1 Å²	137.1	78%	0.782	78%	0.781	S	S	*	*				86.1	141.2	101.2	-178	0	0	0	0	116.4
7	T	34.4	Very low	33.7	Very low	114 Å²	114	135.6 Å²	135.6	70%	0.699	78%	0.781	S	S	*	*			trans	89.2	137	171.4	65.8	0	0	0	0	117.2
8	D	32.6	Very low	33.5	Very low	132 Å²	132	139.2 Å²	139.2	71%	0.706	79%	0.786	S	S	*	*			cis	-166.2	121.4	-14.1	-100	-35.9	0	0	0	108.5
9	I	32.3	Very low	33.2	Very low	150 Å²	150	138.1 Å²	138.1	77%	0.769	78%	0.782	S	S	*	*			trans	10.2	155.5	139.7	-37.6	170.1	0	0	0	119.3
10	P	46.4	Very low	32.7	Very low	113 Å²	113	139.8 Å²	139.8	73%	0.734	78%	0.781	S	S	*	*				-136	175.1	-56.7	38	-20.2	0	0	0	113.5
11	D	28	Very low	32.4	Very low	155 Å²	155	139.8 Å²	139.8	83%	0.829	78%	0.779	S	S	*	*			trans	-153.6	153.5	139.6	-150.1	3.4	0	0	0	112.6
12	V	32.4	Very low	32	Very low	134 Å²	134	131.5 Å²	131.5	81%	0.812	76%	0.756	S	S	*	*			trans	-35	143.5	-170	170.5	0	0	0	0	119.4
13	G	28.8	Very low	31.7	Very low	64 Å²	64	130.7 Å²	130.7	66%	0.66	76%	0.755	S	S	*	*			trans	-156.3	127.5	163.6	0	0	0	0	0	114.1
14	H	32.3	Very low	31.2	Very low	179 Å²	179	129.7 Å²	129.7	83%	0.829	75%	0.754	S	S	*	*			trans	41.2	120.4	145.8	-76.8	-75.8	0	0	0	120.4
15	D	29.6	Very low	30.8	Very low	128 Å²	128	128.8 Å²	128.8	68%	0.684	75%	0.745	S	S	*	*				93.4	128.7	64	-161.8	36.6	0	0	0	113.7
16	E	31.9	Very low	30.4	Very low	164 Å²	164	131.8 Å²	131.8	77%	0.766	75%	0.753	S	S	*	*			trans	36.5	121.2	167.2	-78.1	-173.3	131.2	0	0	122.6
17	S	28.9	Very low	29.6	Very low	113 Å²	113	132.7 Å²	132.7	79%	0.79	75%	0.749	S	S	*	*				171.9	112	108.9	-76.5	0	0	0	0	113.7
18	K	30.1	Very low	29.2	Very low	200 Å²	200	133.6 Å²	133.6	87%	0.87	75%	0.749	S	S	*	*				53.4	127.1	117.9	-123	-178.3	-165	174.8	0	120.6
19	V	27.4	Very low	28.8	Very low	117 Å²	117	132.7 Å²	132.7	71%	0.709	74%	0.744	S	S	*	*			trans	114.7	127.1	136.3	-170.8	0	0	0	0	118.7
20	F	24.3	Very low	28.4	Very low	173 Å²	173	131.1 Å²	131.1	76%	0.759	75%	0.745	S	S	*	*			trans	97.1	134.9	147.1	-105.1	-125.6	0	0	0	123.9
21	D	26.5	Very low	27.4	Very low	139 Å²	139	133.3 Å²	133.3	74%	0.743	75%	0.75	S	S	*	*			trans	39.3	137.7	144.6	-77.3	-10.5	0	0	0	119.4
22	G	24	Very low	27.3	Very low	66 Å²	66	130.3 Å²	130.3	68%	0.68	75%	0.747	S	S	*	*			cis	132	122.9	31.4	0	0	0	0	0	107.2
23	A	25.9	Very low	26.9	Very low	96 Å²	96	133.6 Å²	133.6	79%	0.793	75%	0.753	S	S	*	*			trans	60.5	132.9	150	0	0	0	0	0	123
24	S	28	Very low	26.8	Very low	104 Å²	104	139.8 Å²	139.8	73%	0.727	77%	0.765	S	S	*	*			trans	79.6	147.2	139.7	-65	0	0	0	0	118.8
25	E	26.9	Very low	26.4	Very low	145 Å²	145	137.1 Å²	137.1	68%	0.678	77%	0.767	S	S	*	*			cis	-165.4	154.8	13.6	-117.6	161.5	127	0	0	104.9
26	L	26.2	Very low	26.1	Very low	152 Å²	152	134.9 Å²	134.9	80%	0.796	77%	0.774	S	S	*	*				171.4	115.4	92.4	-77.5	168.7	0	0	0	104.8
27	Q	25	Very low	25.7	Very low	149 Å²	149	130.8 Å²	130.8	70%	0.696	78%	0.775	S	S	*	*				60.6	114.9	65.4	-123.5	175.9	-44.4	0	0	113.4
28	L	25.4	Very low	25.6	Very low	133 Å²	133	133.9 Å²	133.9	70%	0.696	78%	0.783	S	S	*	*				169	156.8	92.3	-119.9	75.3	0	0	0	105.3
29	D	25.2	Very low	25.3	Very low	113 Å²	113	128 Å²	128	60%	0.604	77%	0.772	S	S	*	*			cis	-172.7	154.7	5.2	-127.6	-10.4	0	0	0	108.9
30	C	23.2	Very low	25.3	Very low	117 Å²	117	129.7 Å²	129.7	79%	0.791	78%	0.782	S	S	*	*				164.2	87.5	125.6	-92.1	0	0	0	0	113.2
31	L	26.4	Very low	25.3	Very low	158 Å²	158	130 Å²	130	83%	0.827	79%	0.788	S	S	*	*				48.5	116.9	126.9	-57.5	175.7	0	0	0	121.3
32	A	24.9	Very low	25.3	Very low	93 Å²	93	132.7 Å²	132.7	77%	0.769	79%	0.793	S	S	*	*			trans	-91	151.2	152	0	0	0	0	0	110.6
33	E	24.7	Very low	25.6	Very low	203 Å²	203	134.7 Å²	134.7	95%	0.949	79%	0.794	S	S	*	*			trans	-105.9	126.9	154.3	-73.3	-153.9	141.2	0	0	109.1
34	E	26	Very low	25.7	Very low	193 Å²	193	138.1 Å²	138.1	90%	0.902	80%	0.8	S	S	*	*			trans	-88.3	142.6	168.1	-77.7	-156.5	133.4	0	0	111
35	S	24.2	Very low	25.6	Very low	124 Å²	124	136.9 Å²	136.9	87%	0.867	80%	0.803	S	S	*	*			trans	-132.9	127.7	144.9	70.7	0	0	0	0	108.7
36	G	22.8	Very low	25.7	Very low	81 Å²	81	136.9 Å²	136.9	84%	0.835	81%	0.807	S	S	*	*			trans	-74.9	158.5	-164.9	0	0	0	0	0	115.9
37	G	23.6	Very low	25.8	Very low	77 Å²	77	136.6 Å²	136.6	79%	0.794	81%	0.806	S	S	*	*			trans	-164.4	106.4	169.4	0	0	0	0	0	109.7	A39	G37-A39 PolarHBondContact O-N 2.82Å
38	N	26	Very low	26	Very low	178 Å²	178	132.8 Å²	132.8	95%	0.952	80%	0.795	S	S	*	*			trans	-68.5	117.5	-176.5	-148.9	12.8	0	0	0	110.6
39	A	24.6	Very low	26.6	Very low	78 Å²	78	128.4 Å²	128.4	65%	0.645	77%	0.772	S	S	*	*			trans	-157.3	118.8	163.7	0	0	0	0	0	111.6	G37 M41	G37-A39 PolarHBondContact O-N 2.82Å; A39-M41 PolarHBondContact O-N 2.66Å
40	T	27.9	Very low	27.2	Very low	151 Å²	151	127.2 Å²	127.2	93%	0.926	77%	0.769	S	S	*	*			trans	-55.4	114.3	171.7	11	0	0	0	0	111.4
41	M	23.8	Very low	27.7	Very low	179 Å²	179	127 Å²	127	88%	0.882	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-99.8	116.8	173.1	-79.9	-99.9	140.2	0	0	110	A39	A39-M41 PolarHBondContact O-N 2.66Å
42	K	26.8	Very low	28.2	Very low	196 Å²	196	122 Å²	122	85%	0.852	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-73.1	141.5	162.6	-73.3	176.7	175	177.4	0	108.8
43	P	29.5	Very low	28.6	Very low	108 Å²	108	122.2 Å²	122.2	70%	0.701	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-80	139.4	163.1	34.5	-28.2	0	0	0	108.3
44	D	28.6	Very low	28.9	Very low	169 Å²	169	121.4 Å²	121.4	90%	0.904	73%	0.726	S	S	*	*			trans	156.3	108.3	145.5	-76.2	-21.1	0	0	0	109.2
45	G	25.6	Very low	29.2	Very low	78 Å²	78	118.2 Å²	118.2	80%	0.804	72%	0.722	S	S	*	*			trans	-150	67.5	176.4	0	0	0	0	0	109.1
46	L	29.8	Very low	29.4	Very low	145 Å²	145	120.5 Å²	120.5	76%	0.759	73%	0.725	S	S	*	*			trans	-99.5	106	167.5	-160.6	80.2	0	0	0	106.8	S48	L46-S48 PolarHBondContact O-N 3.37Å
47	L	28.1	Very low	29.7	Very low	146 Å²	146	123.7 Å²	123.7	76%	0.764	72%	0.722	S	S	*	*			trans	-73.8	117	178.2	-64	171.5	0	0	0	109.2	D51	L47-D51 WeakPolarHBondContact CD2-OD2 3.48Å
48	S	29.1	Very low	29.7	Very low	68 Å²	68	129.6 Å²	129.6	48%	0.476	73%	0.726	S	S	.	*			trans	-80.4	150.7	176.8	167.5	0	0	0	0	110.5	L46 T50 D51	L46-S48 PolarHBondContact O-N 3.37Å; S48-T50 WeakPolarHBondContact CB-OG1 3.43Å; S48-T50 PolarHBondContact O-N 3.02Å; S48-T50 PolarHBondContact OG-N 3.25Å; S48-T50 PolarHBondContact OG-OG1 3.21Å; S48-D51 PolarHBondContact O-N 3.4Å
49	L	38.1	Very low	30	Very low	42 Å²	42	126.8 Å²	126.8	22%	0.22	72%	0.718	C	S	.	*	G	3₁₀ helix	trans	-56.5	-7.4	174.2	-92.5	149.8	0	0	0	114.1	D51 V286 L455 I459	L49-D51 PolarHBondContact O-N 3.11Å; L49-V286 HydrophobicContact CD1-CG2 4.36Å; L49-L455 HydrophobicContact CD1-CD1 3.38Å; L49-I459 HydrophobicContact CD1-CD1 4.31Å
50	T	36.7	Very low	30.1	Very low	88 Å²	88	129.5 Å²	129.5	54%	0.54	73%	0.726	S	S	.	*	G	3₁₀ helix	trans	-64.5	-15.7	170.9	47.7	0	0	0	0	115.1	S48 L52	S48-T50 WeakPolarHBondContact CB-OG1 3.43Å; S48-T50 PolarHBondContact O-N 3.02Å; S48-T50 PolarHBondContact OG-N 3.25Å; S48-T50 PolarHBondContact OG-OG1 3.21Å; T50-L52 PolarHBondContact O-N 2.82Å
51	D	35.1	Very low	30	Very low	112 Å²	112	127.1 Å²	127.1	60%	0.599	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-76.6	1.5	-179	-91.3	-11.2	0	0	0	115.1	L47 S48 L49	L47-D51 WeakPolarHBondContact CD2-OD2 3.48Å; S48-D51 PolarHBondContact O-N 3.4Å; L49-D51 PolarHBondContact O-N 3.11Å
52	L	36.2	Very low	30.1	Very low	54 Å²	54	123.1 Å²	123.1	28%	0.283	71%	0.712	S	S	.	*	G	3₁₀ helix	trans	-92.4	1.1	175.5	-66.4	173.4	0	0	0	113.6	T50 R300 I304	T50-L52 PolarHBondContact O-N 2.82Å; L52-R300 HydrophobicContact CD2-CB 4.49Å; L52-R300 HydrophobicContact CD2-CG 3.96Å; L52-I304 HydrophobicContact CB-CD1 4.18Å; L52-I304 HydrophobicContact CD1-CD1 3.88Å; L52-I304 HydrophobicContact CD1-CG1 3.79Å
53	S	33	Very low	30.2	Very low	96 Å²	96	123.2 Å²	123.2	67%	0.671	72%	0.715	S	S	*	*			trans	-128.4	87	-175.1	-55.8	0	0	0	0	112.7
54	Q	30.9	Very low	30.1	Very low	187 Å²	187	125.8 Å²	125.8	87%	0.874	72%	0.722	S	S	*	*			trans	-167.3	133.4	143.8	-108.3	172.1	8	0	0	111.2
55	P	32.8	Very low	29.9	Very low	125 Å²	125	121.1 Å²	121.1	81%	0.812	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-95.1	149.8	170.7	35	-28.6	0	0	0	111.9
56	D	29.4	Very low	30.3	Very low	173 Å²	173	123.9 Å²	123.9	93%	0.925	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-66.4	138.4	170.6	-76.7	-53.3	0	0	0	112
57	D	27.3	Very low	30.1	Very low	147 Å²	147	122.1 Å²	122.1	79%	0.786	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-58.8	145.2	175.5	-87.1	-50.6	0	0	0	114.2
58	F	25.3	Very low	30.1	Very low	201 Å²	201	123.6 Å²	123.6	88%	0.882	73%	0.726	S	S	*	*			trans	173.8	155.3	130.9	-95.6	-60.7	0	0	0	111.6
59	P	30.7	Very low	29.9	Very low	119 Å²	119	123.9 Å²	123.9	77%	0.773	73%	0.733	S	S	*	*				-107.2	167.9	-89.9	36.1	-21.2	0	0	0	115.2
60	V	26.6	Very low	29.3	Very low	135 Å²	135	128.9 Å²	128.9	82%	0.818	76%	0.759	S	S	*	*			trans	-58.2	139.6	178.8	176.6	0	0	0	0	114.4
61	A	26	Very low	28.9	Very low	102 Å²	102	133 Å²	133	84%	0.843	77%	0.774	S	S	*	*			trans	-128.2	118.2	153.3	0	0	0	0	0	110.4
62	S	25.8	Very low	28.5	Very low	94 Å²	94	132.6 Å²	132.6	66%	0.657	78%	0.781	S	S	*	*			trans	-66.8	143.5	177.8	-57.9	0	0	0	0	113.2
63	H	29.3	Very low	27.9	Very low	198 Å²	198	135.7 Å²	135.7	92%	0.917	81%	0.807	S	S	*	*			trans	-152.6	139.1	142	-92.6	-65.1	0	0	0	112.1
64	N	28	Very low	27.5	Very low	162 Å²	162	136.9 Å²	136.9	87%	0.866	81%	0.81	S	S	*	*			trans	-79.8	130.8	-169.2	-71	-36.7	0	0	0	114.8
65	G	24	Very low	27.2	Very low	72 Å²	72	135.5 Å²	135.5	74%	0.742	81%	0.808	S	S	*	*			trans	47.5	178.8	140.8	0	0	0	0	0	122.8
66	P	34.5	Very low	27.2	Very low	135 Å²	135	134.6 Å²	134.6	88%	0.877	80%	0.802	S	S	*	*			cis	-129.6	176.3	-11.2	38.5	-20.4	0	0	0	115.7
67	S	25.8	Very low	26.9	Very low	108 Å²	108	132.3 Å²	132.3	76%	0.755	79%	0.794	S	S	*	*			trans	-57.7	151.7	176.7	175.4	0	0	0	0	116.5
68	L	27.6	Very low	26.6	Very low	177 Å²	177	133.5 Å²	133.5	93%	0.927	80%	0.795	S	S	*	*			trans	-151.7	137.9	150.3	-107.1	158.9	0	0	0	111.3
69	A	25	Very low	27.1	Very low	75 Å²	75	128.6 Å²	128.6	62%	0.62	78%	0.784	S	S	*	*			trans	-88.3	166.2	-170.1	0	0	0	0	0	114.4
70	D	25.4	Very low	26.9	Very low	146 Å²	146	128.2 Å²	128.2	78%	0.781	78%	0.784	S	S	*	*			trans	54.7	135	153	-74.4	-28.1	0	0	0	119.9
71	M	28	Very low	26.7	Very low	174 Å²	174	129.4 Å²	129.4	86%	0.857	79%	0.786	S	S	*	*				-174.8	109.1	122.5	-90	-78.1	99.5	0	0	109.4
72	S	26.1	Very low	26.8	Very low	104 Å²	104	132.6 Å²	132.6	73%	0.727	79%	0.786	S	S	*	*			trans	-66.8	142.3	162.8	172.6	0	0	0	0	110.6
73	S	25.4	Very low	26.8	Very low	120 Å²	120	137.3 Å²	137.3	84%	0.839	80%	0.795	S	S	*	*			trans	-150.1	105.1	154.5	40.4	0	0	0	0	110.7
74	T	23.8	Very low	26.5	Very low	121 Å²	121	135.9 Å²	135.9	74%	0.742	79%	0.793	S	S	*	*			trans	-98.7	162.7	159.9	-33.7	0	0	0	0	108
75	L	23.7	Very low	26.3	Very low	157 Å²	157	135.5 Å²	135.5	82%	0.822	79%	0.792	S	S	*	*			trans	131	157.8	156	-69.1	-174.6	0	0	0	112.6
76	P	32.7	Very low	27.1	Very low	107 Å²	107	137.1 Å²	137.1	70%	0.695	79%	0.789	S	S	*	*				-142.1	-163.6	-71.7	35.6	-12.7	0	0	0	113.2
77	V	23.4	Very low	26.5	Very low	124 Å²	124	136.6 Å²	136.6	75%	0.752	79%	0.787	S	S	*	*			trans	111.1	91.2	152.3	-166.8	0	0	0	0	118.5
78	E	22.4	Very low	26.6	Very low	172 Å²	172	136.7 Å²	136.7	80%	0.804	79%	0.794	S	S	*	*				27.3	172.8	111.1	-62.5	-69.2	117.1	0	0	121.7
79	P	35.1	Very low	26.5	Very low	99 Å²	99	132 Å²	132	64%	0.643	79%	0.788	S	S	*	*			cis	-136.3	-176.7	-42.7	34.9	-15.5	0	0	0	113.2
80	S	26.1	Very low	26.6	Very low	111 Å²	111	136.6 Å²	136.6	78%	0.776	80%	0.803	S	S	*	*				152.2	119.6	123.3	-75.2	0	0	0	0	116.2
81	D	22.9	Very low	26.8	Very low	160 Å²	160	133.9 Å²	133.9	86%	0.856	80%	0.8	S	S	*	*			trans	-73.1	144.2	162.2	-66.4	-63.9	0	0	0	113.1
82	I	27.2	Very low	27.3	Very low	168 Å²	168	131.5 Å²	131.5	86%	0.862	80%	0.801	S	S	*	*			trans	-139.1	123.6	152.9	-59.8	-179.2	0	0	0	109.3
83	K	25.5	Very low	27.4	Very low	194 Å²	194	130.7 Å²	130.7	84%	0.843	81%	0.809	S	S	*	*			trans	-111.7	125.5	177.4	-179.7	-174.3	-172.2	179.1	0	108.8
84	L	23.6	Very low	27.5	Very low	167 Å²	167	128.4 Å²	128.4	87%	0.874	80%	0.804	S	S	*	*			trans	-153.4	131.9	158.6	-76.7	179.8	0	0	0	111.2
85	D	23.8	Very low	28.1	Very low	155 Å²	155	129.6 Å²	129.6	83%	0.829	81%	0.811	S	S	*	*			trans	-130.8	172.3	166.4	-105.3	-33.5	0	0	0	106
86	P	40.2	Very low	28.4	Very low	106 Å²	106	129.7 Å²	129.7	69%	0.688	81%	0.812	S	S	*	*			cis	-135.7	169.3	-22.9	35.6	-17.2	0	0	0	113.7
87	C	23.8	Very low	28.5	Very low	123 Å²	123	127.8 Å²	127.8	83%	0.831	81%	0.812	S	S	*	*				158.9	125.7	127.9	-85.8	0	0	0	0	115.6
88	A	26.9	Very low	28.9	Very low	110 Å²	110	129.9 Å²	129.9	91%	0.909	81%	0.814	S	S	*	*			trans	56.6	121	138.8	0	0	0	0	0	122.4
89	G	26.3	Very low	29.5	Very low	78 Å²	78	127.4 Å²	127.4	80%	0.804	81%	0.813	S	S	*	*			trans	164.7	97.6	158.1	0	0	0	0	0	113.1
90	D	27.2	Very low	29.7	Very low	172 Å²	172	128.9 Å²	128.9	92%	0.92	82%	0.82	S	S	*	*			trans	-54.2	135.9	175.9	-86.2	-42.7	0	0	0	114.4
91	A	29.3	Very low	30.1	Very low	89 Å²	89	133.1 Å²	133.1	74%	0.736	82%	0.824	S	S	*	*			trans	179.2	97.8	134.1	0	0	0	0	0	111.5
92	S	38.5	Very low	31.1	Very low	125 Å²	125	136.7 Å²	136.7	87%	0.874	83%	0.826	S	S	*	*			trans	23.8	109.5	145.2	56.2	0	0	0	0	120.2
93	G	27.7	Very low	31.6	Very low	87 Å²	87	138.5 Å²	138.5	90%	0.897	83%	0.827	S	S	*	*			trans	164.5	118.4	154.8	0	0	0	0	0	114.8
94	G	26.6	Very low	32.5	Very low	71 Å²	71	139.9 Å²	139.9	73%	0.732	83%	0.833	S	S	*	*			trans	151.5	97.3	162.8	0	0	0	0	0	117.7
95	V	36.4	Very low	33.4	Very low	147 Å²	147	134.5 Å²	134.5	89%	0.891	82%	0.818	S	S	*	*			trans	37.8	117.9	135.6	-165	0	0	0	0	120.2
96	D	30.9	Very low	34.6	Very low	158 Å²	158	133.3 Å²	133.3	85%	0.845	82%	0.819	S	S	*	*				-150.7	127.2	125.8	-156.4	-3	0	0	0	111.2
97	G	34.3	Very low	35	Very low	67 Å²	67	132.5 Å²	132.5	69%	0.691	82%	0.821	S	S	*	*			trans	-110.1	81.2	-169.2	0	0	0	0	0	111.6
98	Q	32.9	Very low	36.5	Very low	168 Å²	168	132.1 Å²	132.1	79%	0.785	82%	0.817	S	S	*	*			trans	-79	132	162.2	-92.5	179.7	-2.5	0	0	110.5	V100	Q98-V100 PolarHBondContact O-N 3.02Å
99	P	34.3	Very low	38	Very low	120 Å²	120	136.3 Å²	136.3	78%	0.779	81%	0.814	S	S	*	*			trans	-73	105.7	172.5	28.6	-29.3	0	0	0	109	K101	P99-K101 PolarHBondContact O-N 3.35Å; P99-K101 VanDerWaalsContact O-N 3.09Å
100	V	39.5	Very low	39.8	Very low	130 Å²	130	136.4 Å²	136.4	79%	0.788	80%	0.795	S	S	*	*			trans	-58.2	113.6	172.3	179.9	0	0	0	0	109.1	Q98 R102	Q98-V100 PolarHBondContact O-N 3.02Å; V100-R102 PolarHBondContact O-N 3.35Å
101	K	34.4	Very low	41.5	Very low	200 Å²	200	135.8 Å²	135.8	87%	0.87	79%	0.791	S	S	*	*			trans	-59.7	108.1	173.6	-70.9	179.9	178.7	175.4	0	109.4	P99 K103	P99-K101 PolarHBondContact O-N 3.35Å; P99-K101 VanDerWaalsContact O-N 3.09Å; K101-K103 PolarHBondContact O-N 2.9Å
102	R	44.9	Very low	43.3	Very low	236 Å²	236	133.5 Å²	133.5	89%	0.891	78%	0.776	S	S	*	*			trans	-69.9	121.6	173.1	-66.5	178.1	105.4	175.6	5.1	109.2	V100 K104	V100-R102 PolarHBondContact O-N 3.35Å; R102-K104 PolarHBondContact O-N 3.19Å
103	K	37.4	Very low	45.2	Very low	206 Å²	206	134.8 Å²	134.8	90%	0.896	77%	0.773	S	S	*	*			trans	-57.9	131.6	171.1	-69.8	176.6	175.6	178.3	0	109.4	K101 G105	K101-K103 PolarHBondContact O-N 2.9Å; K103-G105 VanDerWaalsContact C-N 3.35Å; K103-G105 PolarHBondContact O-N 3.25Å
104	K	42.7	Very low	48.1	Very low	223 Å²	223	133.7 Å²	133.7	97%	0.97	75%	0.745	S	S	*	*			trans	-64.1	91.2	172.6	-87.2	174.1	173.4	174.3	0	109.4	R102	R102-K104 PolarHBondContact O-N 3.19Å
105	G	43.7	Very low	51.3	Low	54 Å²	54	134.6 Å²	134.6	56%	0.557	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-95.4	168.8	160.7	0	0	0	0	0	110.9	K103	K103-G105 VanDerWaalsContact C-N 3.35Å; K103-G105 PolarHBondContact O-N 3.25Å
106	P	49.8	Very low	54.2	Low	130 Å²	130	127.7 Å²	127.7	84%	0.844	69%	0.694	S	S	*	*	S	Bend	trans	-53.8	142.7	171.7	-18.5	30.1	0	0	0	110.5
107	A	48.1	Very low	57.3	Low	88 Å²	88	123.1 Å²	123.1	73%	0.727	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-49.3	129.5	-178.6	0	0	0	0	0	111.1	K109	A107-K109 PolarHBondContact O-N 2.88Å
108	P	55.7	Low	60.3	Low	116 Å²	116	120 Å²	120	75%	0.753	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-58.7	127.3	179.9	-20.2	30.3	0	0	0	110.2	M110	P108-M110 PolarHBondContact O-N 3.04Å; P108-M110 VanDerWaalsContact O-N 3.15Å
109	K	58	Low	63.3	Low	197 Å²	197	112.1 Å²	112.1	86%	0.857	61%	0.606	S	S	*	*			trans	-65.9	113.1	171.9	-71	-178.8	178.4	178.4	0	108.1	A107 L111	A107-K109 PolarHBondContact O-N 2.88Å; K109-L111 PolarHBondContact O-N 3.11Å
110	M	62.5	Low	66.1	Low	81 Å²	81	108.6 Å²	108.6	40%	0.399	59%	0.591	S	S	.	*			trans	-61.7	123.2	176.2	-57.4	-120	79.1	0	0	109.1	P108 G112 E114 F126 L131	P108-M110 PolarHBondContact O-N 3.04Å; P108-M110 VanDerWaalsContact O-N 3.15Å; M110-G112 PolarHBondContact O-N 3.25Å; M110-G112 VanDerWaalsContact O-N 3.11Å; M110-E114 WeakPolarHBondContact CB-OE2 3.16Å; M110-E114 WeakPolarHBondContact CE-OE1 3.36Å; M110-E114 WeakPolarHBondContact CE-OE2 3.4Å; M110-E114 VanDerWaalsContact SD-OE2 3.38Å; M110-F126 HydrophobicContact CE-CD2 4.42Å; M110-F126 HydrophobicContact CE-CE2 3.76Å; M110-F126 HydrophobicContact SD-CD2 4.35Å; M110-F126 HydrophobicContact SD-CE2 4.26Å; M110-L131 HydrophobicContact CE-CD1 4.15Å; M110-L131 HydrophobicContact SD-CD1 4.2Å
111	L	64.2	Low	68.8	Low	158 Å²	158	104.2 Å²	104.2	83%	0.827	56%	0.563	S	S	*	*			trans	-75.1	8.3	-176.9	-87.8	94.3	0	0	0	113.9	K109 N113	K109-L111 PolarHBondContact O-N 3.11Å; L111-N113 PolarHBondContact O-N 2.91Å
112	G	66	Low	71.7	Confident	41 Å²	41	101.8 Å²	101.8	42%	0.423	55%	0.552	S	S	.	*	S	Bend	trans	73.8	-7.7	170.4	0	0	0	0	0	116.5	M110	M110-G112 PolarHBondContact O-N 3.25Å; M110-G112 VanDerWaalsContact O-N 3.11Å
113	N	78.6	Confident	74.1	Confident	153 Å²	153	91.3 Å²	91.3	82%	0.818	52%	0.516	S	S	*	.			trans	-102.1	12.2	179.8	-72.6	2.8	0	0	0	113.7	L111	L111-N113 PolarHBondContact O-N 2.91Å
114	E	88.9	Confident	76.7	Confident	63 Å²	63	84.6 Å²	84.6	29%	0.294	50%	0.495	S	S	.	.			trans	-81	143.1	-173.5	-68	160.7	141.2	0	0	111.8	M110 A123 L131	M110-E114 WeakPolarHBondContact CB-OE2 3.16Å; M110-E114 WeakPolarHBondContact CE-OE1 3.36Å; M110-E114 WeakPolarHBondContact CE-OE2 3.4Å; M110-E114 VanDerWaalsContact SD-OE2 3.38Å; E114-A123 HydrophobicContact CB-CB 4.29Å; E114-A123 VanDerWaalsContact O-CB 3.31Å; E114-A123 WeakPolarHBondContact O-CB 3.34Å; E114-A123 PolarHBondContact O-N 3.37Å; E114-L131 HydrophobicContact CB-CD1 4.38Å; E114-L131 HydrophobicContact CB-CD2 3.72Å; E114-L131 HydrophobicContact CB-CG 4.49Å; E114-L131 HydrophobicContact CG-CD2 4.25Å
115	V	95	Very high	79	Confident	90 Å²	90	74.5 Å²	74.5	55%	0.545	46%	0.455	S	S	.	.	B	Isolated β-bridge	trans	-106.9	148.9	-176.3	-65.7	0	0	0	0	111.4	S117	V115-S117 PolarHBondContact O-N 3.35Å
116	C	96.8	Very high	81.4	Confident	2 Å²	2	78.2 Å²	78.2	1%	0.014	46%	0.456	C	S	.	.			trans	-68	121.1	178.7	173.3	0	0	0	0	110.5	V118 C119 G120 D121 C133	C116-V118 PolarHBondContact O-N 2.71Å; C116-C119 PolarHBondContact O-N 3.41Å; C116-G120 WeakPolarHBondContact O-CA 3.49Å; C116-G120 PolarHBondContact O-N 2.99Å; C116-D121 WeakPolarHBondContact CB-O 3.49Å; C116-D121 PolarHBondContact N-O 2.91Å; C116-C133 HydrophobicContact CB-CB 3.91Å; C116-C133 PolarHBondContact SG-N 2.75Å; C116-C133 VanDerWaalsContact SG-SG 3.66Å
117	S	95.9	Very high	83.4	Confident	63 Å²	63	73.3 Å²	73.3	44%	0.441	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-15	-178.8	-48.4	0	0	0	0	114.1	V115 L131	V115-S117 PolarHBondContact O-N 3.35Å; S117-L131 PolarHBondContact N-O 3.09Å; S117-L131 PolarHBondContact OG-O 3.2Å; S117-L131 VanDerWaalsContact OG-O 3.07Å
118	V	97.1	Very high	85.6	Confident	1 Å²	1	71 Å²	71	1%	0.006	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-45.8	179.4	-178.3	0	0	0	0	112.4	C116 C136 M160 K175 A179 M181	C116-V118 PolarHBondContact O-N 2.71Å; V118-C136 HydrophobicContact CB-CB 4.27Å; V118-C136 HydrophobicContact CG1-CB 4.46Å; V118-C136 HydrophobicContact CG2-CB 4.45Å; V118-M160 VanDerWaalsContact O-CB 3.31Å; V118-M160 WeakPolarHBondContact O-CB 3.4Å; V118-K175 HydrophobicContact CG1-CB 4.33Å; V118-K175 HydrophobicContact CG1-CG 4.36Å; V118-K175 WeakPolarHBondContact O-CD 3.43Å; V118-K175 WeakPolarHBondContact O-CE 3.41Å; V118-K175 PolarHBondContact O-NZ 3.23Å; V118-K175 VanDerWaalsContact O-NZ 3.09Å; V118-A179 HydrophobicContact CG2-CB 4.1Å; V118-M181 HydrophobicContact CG2-CE 4.17Å
119	C	95.9	Very high	87.3	Confident	3 Å²	3	71 Å²	71	2%	0.02	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.4	4.1	-167.6	69.8	0	0	0	0	115.4	C116 D121 D161 M162 R165	C116-C119 PolarHBondContact O-N 3.41Å; C119-D121 PolarHBondContact O-N 3.49Å; C119-D121 VanDerWaalsContact O-N 3.11Å; C119-D121 VanDerWaalsContact SG-CB 3.59Å; C119-D161 CarbonylContact O-C 3.38Å; C119-D161 WeakPolarHBondContact O-CA 3.22Å; C119-M162 PolarHBondContact O-N 3.16Å; C119-R165 HydrophobicContact CB-CB 4.27Å; C119-R165 PolarHBondContact SG-NH1 3.43Å; C119-R165 VanDerWaalsContact SG-NH1 3.41Å
120	G	93.8	Very high	89	Confident	45 Å²	45	62 Å²	62	46%	0.464	35%	0.35	S	S	.	.	S	Bend	trans	73.9	-7.8	179	0	0	0	0	0	115.8	C116	C116-G120 WeakPolarHBondContact O-CA 3.49Å; C116-G120 PolarHBondContact O-N 2.99Å
121	D	95.3	Very high	90.6	Very high	38 Å²	38	59.6 Å²	59.6	20%	0.203	34%	0.338	C	S	.	.	S	Bend	trans	-63.4	162.5	174.6	-162.5	1	0	0	0	112	C116 C119 A123 C133 M162 R165	C116-D121 WeakPolarHBondContact CB-O 3.49Å; C116-D121 PolarHBondContact N-O 2.91Å; C119-D121 PolarHBondContact O-N 3.49Å; C119-D121 VanDerWaalsContact O-N 3.11Å; C119-D121 VanDerWaalsContact SG-CB 3.59Å; D121-A123 PolarHBondContact O-N 3.1Å; D121-C133 HydrophobicContact CB-CB 4.16Å; D121-M162 HydrophobicContact CB-CE 4.49Å; D121-M162 HydrophobicContact CB-CG 4.07Å; D121-R165 IonicContact OD2-CZ 3.31Å; D121-R165 IonicContact OD2-NH1 2.71Å; D121-R165 PolarHBondContact OD2-NH1 3Å; D121-R165 IonicContact OD2-NH2 2.82Å; D121-R165 PolarHBondContact OD2-NH2 3.17Å
122	K	94.9	Very high	92.1	Very high	150 Å²	150	52 Å²	52	65%	0.652	30%	0.298	S	S	*	.	B	Isolated β-bridge	trans	-55.9	122.9	179.8	-172.4	174	-177.1	175.5	0	111.1	C133	K122-C133 WeakPolarHBondContact O-CB 3.46Å
123	A	94.9	Very high	93.5	Very high	16 Å²	16	50.2 Å²	50.2	13%	0.132	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-72.4	138.6	177.1	0	0	0	0	0	110.3	E114 D121 L131	E114-A123 HydrophobicContact CB-CB 4.29Å; E114-A123 VanDerWaalsContact O-CB 3.31Å; E114-A123 WeakPolarHBondContact O-CB 3.34Å; E114-A123 PolarHBondContact O-N 3.37Å; D121-A123 PolarHBondContact O-N 3.1Å; A123-L131 HydrophobicContact CB-CD1 3.67Å; A123-L131 HydrophobicContact CB-CD2 4.46Å; A123-L131 HydrophobicContact CB-CG 3.77Å
124	S	93	Very high	94.4	Very high	64 Å²	64	47.7 Å²	47.7	45%	0.448	26%	0.263	S	S	.	.			trans	-98.8	-5.5	173	55.5	0	0	0	0	112.6	H127 S132 E134	S124-H127 PolarHBondContact OG-NE2 3.47Å; S124-S132 PolarHBondContact N-O 3.11Å; S124-S132 PolarHBondContact OG-O 3.38Å; S124-E134 WeakPolarHBondContact CB-OE1 3.27Å; S124-E134 PolarHBondContact OG-N 3.33Å; S124-E134 PolarHBondContact OG-OE1 3.03Å
125	G	90.9	Very high	94.7	Very high	12 Å²	12	46.2 Å²	46.2	12%	0.124	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	141	-167.8	179.2	0	0	0	0	0	112.1	H127 L131 S132	G125-H127 PolarHBondContact O-CD2 3.04Å; G125-L131 WeakPolarHBondContact O-CA 2.86Å; G125-S132 PolarHBondContact O-N 2.93Å
126	F	93	Very high	94.9	Very high	131 Å²	131	42 Å²	42	58%	0.575	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	119	174.5	-73.4	-94.1	0	0	0	110.5	M110 V130 L131	M110-F126 HydrophobicContact CE-CD2 4.42Å; M110-F126 HydrophobicContact CE-CE2 3.76Å; M110-F126 HydrophobicContact SD-CD2 4.35Å; M110-F126 HydrophobicContact SD-CE2 4.26Å; F126-V130 WeakPolarHBondContact CA-O 3.31Å; F126-L131 HydrophobicContact CD1-CB 4.36Å; F126-L131 HydrophobicContact CD2-CD1 4.45Å; F126-L131 HydrophobicContact CE1-CB 4.1Å; F126-L131 HydrophobicContact CE2-CD1 4.33Å; F126-L131 HydrophobicContact CZ-CB 4.26Å
127	H	93.6	Very high	94.9	Very high	27 Å²	27	44.5 Å²	44.5	13%	0.125	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	127.9	173.2	-53.2	-74.8	0	0	0	109.1	S124 G125 N129 V130 S132 E134 K137	S124-H127 PolarHBondContact OG-NE2 3.47Å; G125-H127 PolarHBondContact O-CD2 3.04Å; H127-N129 PolarHBondContact O-N 3.36Å; H127-V130 PolarHBondContact N-O 3.5Å; H127-V130 PolarHBondContact O-N 3.46Å; H127-V130 VanDerWaalsContact O-O 3.1Å; H127-S132 WeakPolarHBondContact CB-OG 3.4Å; H127-S132 PolarHBondContact CD2-O 3.39Å; H127-S132 PolarHBondContact CD2-OG 2.94Å; H127-E134 IonicContact CE1-OE1 2.91Å; H127-E134 PolarHBondContact CE1-OE1 3.42Å; H127-E134 IonicContact NE2-OE1 3.17Å; H127-E134 PolarHBondContact NE2-OE1 3.31Å; H127-K137 HydrophobicContact CB-CB 3.96Å; H127-K137 HydrophobicContact CB-CD 4.34Å; H127-K137 HydrophobicContact CB-CG 3.85Å; H127-K137 WeakPolarHBondContact ND1-CD 3.15Å; H127-K137 VanDerWaalsContact ND1-CE 3.33Å; H127-K137 WeakPolarHBondContact ND1-CE 3.25Å
128	Y	93.8	Very high	94.8	Very high	40 Å²	40	42 Å²	42	16%	0.157	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	42.2	-177.5	-46.2	-64.3	0	0	0	112.6	V130 K137 F140 R141 M181 L182 C185 V186	Y128-V130 VanDerWaalsContact C-N 3.31Å; Y128-V130 PolarHBondContact O-N 3.13Å; Y128-K137 HydrophobicContact CE2-CB 4.5Å; Y128-K137 HydrophobicContact CE2-CG 3.89Å; Y128-F140 AromaticContact CD2-CD1 3.69Å; Y128-F140 HydrophobicContact CD2-CD1 3.69Å; Y128-F140 HydrophobicContact CD2-CE1 4.39Å; Y128-F140 HydrophobicContact CE2-CD1 4.18Å; Y128-F140 HydrophobicContact CG-CD1 4.04Å; Y128-F140 HydrophobicContact CG-CE1 4.29Å; Y128-R141 HydrophobicContact CE2-CB 4.39Å; Y128-R141 WeakPolarHBondContact OH-CB 3.3Å; Y128-R141 WeakPolarHBondContact OH-CD 3.1Å; Y128-M181 WeakPolarHBondContact O-CA 3.48Å; Y128-L182 PolarHBondContact O-N 2.9Å; Y128-L182 VanDerWaalsContact O-N 3.13Å; Y128-C185 HydrophobicContact CD1-CB 3.85Å; Y128-V186 HydrophobicContact CD1-CG2 3.84Å; Y128-V186 HydrophobicContact CE1-CB 4.45Å; Y128-V186 HydrophobicContact CE1-CG2 3.67Å; Y128-V186 HydrophobicContact CG-CG2 4.42Å
129	N	91.2	Very high	94.9	Very high	117 Å²	117	42.4 Å²	42.4	63%	0.626	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.1	6.3	-177.5	-158.4	48.2	0	0	0	116.4	H127 L182	H127-N129 PolarHBondContact O-N 3.36Å; N129-L182 HydrophobicContact CB-CD1 4Å; N129-L182 HydrophobicContact CB-CG 4.26Å
130	V	94	Very high	94.9	Very high	8 Å²	8	42.3 Å²	42.3	5%	0.048	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	132.5	-178.2	-178.2	0	0	0	0	111.6	F126 H127 Y128 S132 A179 G180 M181	F126-V130 WeakPolarHBondContact CA-O 3.31Å; H127-V130 PolarHBondContact N-O 3.5Å; H127-V130 PolarHBondContact O-N 3.46Å; H127-V130 VanDerWaalsContact O-O 3.1Å; Y128-V130 VanDerWaalsContact C-N 3.31Å; Y128-V130 PolarHBondContact O-N 3.13Å; V130-S132 PolarHBondContact O-N 3.26Å; V130-S132 PolarHBondContact O-OG 3.07Å; V130-S132 VanDerWaalsContact O-OG 3.05Å; V130-A179 HydrophobicContact CG1-CB 4.05Å; V130-A179 WeakPolarHBondContact CG2-O 3.36Å; V130-G180 WeakPolarHBondContact CG2-O 3.16Å; V130-M181 HydrophobicContact CB-CE 4.25Å; V130-M181 HydrophobicContact CB-CG 3.87Å; V130-M181 HydrophobicContact CG1-CE 4.46Å; V130-M181 HydrophobicContact CG2-CB 4.32Å; V130-M181 HydrophobicContact CG2-CG 3.67Å; V130-M181 VanDerWaalsContact CG2-N 3.32Å
131	L	94.9	Very high	95	Very high	29 Å²	29	45.9 Å²	45.9	15%	0.152	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	109.4	170	-177.5	67.3	0	0	0	109.8	M110 E114 S117 A123 G125 F126	M110-L131 HydrophobicContact CE-CD1 4.15Å; M110-L131 HydrophobicContact SD-CD1 4.2Å; E114-L131 HydrophobicContact CB-CD1 4.38Å; E114-L131 HydrophobicContact CB-CD2 3.72Å; E114-L131 HydrophobicContact CB-CG 4.49Å; E114-L131 HydrophobicContact CG-CD2 4.25Å; S117-L131 PolarHBondContact N-O 3.09Å; S117-L131 PolarHBondContact OG-O 3.2Å; S117-L131 VanDerWaalsContact OG-O 3.07Å; A123-L131 HydrophobicContact CB-CD1 3.67Å; A123-L131 HydrophobicContact CB-CD2 4.46Å; A123-L131 HydrophobicContact CB-CG 3.77Å; G125-L131 WeakPolarHBondContact O-CA 2.86Å; F126-L131 HydrophobicContact CD1-CB 4.36Å; F126-L131 HydrophobicContact CD2-CD1 4.45Å; F126-L131 HydrophobicContact CE1-CB 4.1Å; F126-L131 HydrophobicContact CE2-CD1 4.33Å; F126-L131 HydrophobicContact CZ-CB 4.26Å
132	S	96.3	Very high	94.9	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	165.5	-169.4	58.3	0	0	0	0	113.3	S124 G125 H127 V130 M181	S124-S132 PolarHBondContact N-O 3.11Å; S124-S132 PolarHBondContact OG-O 3.38Å; G125-S132 PolarHBondContact O-N 2.93Å; H127-S132 WeakPolarHBondContact CB-OG 3.4Å; H127-S132 PolarHBondContact CD2-O 3.39Å; H127-S132 PolarHBondContact CD2-OG 2.94Å; V130-S132 PolarHBondContact O-N 3.26Å; V130-S132 PolarHBondContact O-OG 3.07Å; V130-S132 VanDerWaalsContact O-OG 3.05Å; S132-M181 VanDerWaalsContact CB-CE 3.41Å; S132-M181 VanDerWaalsContact OG-CE 3.28Å; S132-M181 WeakPolarHBondContact OG-CE 3.46Å
133	C	96.7	Very high	94.9	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.02	22%	0.218	C	C	.	.			trans	-89.3	160.3	176	69.1	0	0	0	0	111.5	C116 D121 K122 G135 C136 K137	C116-C133 HydrophobicContact CB-CB 3.91Å; C116-C133 PolarHBondContact SG-N 2.75Å; C116-C133 VanDerWaalsContact SG-SG 3.66Å; D121-C133 HydrophobicContact CB-CB 4.16Å; K122-C133 WeakPolarHBondContact O-CB 3.46Å; C133-G135 PolarHBondContact O-N 3.18Å; C133-G135 VanDerWaalsContact O-N 3.1Å; C133-C136 PolarHBondContact O-N 3.35Å; C133-C136 VanDerWaalsContact O-N 3.07Å; C133-C136 PolarHBondContact SG-N 3.06Å; C133-K137 PolarHBondContact O-N 3.07Å
134	E	96.1	Very high	94.8	Very high	100 Å²	100	43.9 Å²	43.9	47%	0.467	22%	0.22	S	C	.	.	H	α-helix	trans	-54.8	-32.7	176.3	-70.6	-55.1	127	0	0	112.9	S124 H127 K137 G138	S124-E134 WeakPolarHBondContact CB-OE1 3.27Å; S124-E134 PolarHBondContact OG-N 3.33Å; S124-E134 PolarHBondContact OG-OE1 3.03Å; H127-E134 IonicContact CE1-OE1 2.91Å; H127-E134 PolarHBondContact CE1-OE1 3.42Å; H127-E134 IonicContact NE2-OE1 3.17Å; H127-E134 PolarHBondContact NE2-OE1 3.31Å; E134-K137 IonicContact OE1-NZ 3.61Å; E134-K137 PolarHBondContact OE1-NZ 2.88Å; E134-K137 WeakPolarHBondContact OE2-CD 3.22Å; E134-K137 IonicContact OE2-NZ 3.38Å; E134-K137 PolarHBondContact OE2-NZ 3.22Å; E134-G138 PolarHBondContact O-N 3.49Å
135	G	96.7	Very high	94.5	Very high	32 Å²	32	43.2 Å²	43.2	33%	0.33	21%	0.21	S	C	.	.	H	α-helix	trans	-63.6	-44.4	177.6	0	0	0	0	0	113.2	C133 F139 R172	C133-G135 PolarHBondContact O-N 3.18Å; C133-G135 VanDerWaalsContact O-N 3.1Å; G135-F139 WeakPolarHBondContact O-CB 3.43Å; G135-F139 PolarHBondContact O-N 3.43Å; G135-R172 PolarHBondContact O-NH2 2.81Å
136	C	97.6	Very high	94.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-79.3	-36.3	-179.3	-72.4	0	0	0	0	112.2	V118 C133 F139 F140 R172 M181	V118-C136 HydrophobicContact CB-CB 4.27Å; V118-C136 HydrophobicContact CG1-CB 4.46Å; V118-C136 HydrophobicContact CG2-CB 4.45Å; C133-C136 PolarHBondContact O-N 3.35Å; C133-C136 VanDerWaalsContact O-N 3.07Å; C133-C136 PolarHBondContact SG-N 3.06Å; C136-F139 PolarHBondContact O-N 2.96Å; C136-F140 WeakPolarHBondContact O-CB 3.31Å; C136-F140 PolarHBondContact O-N 3.35Å; C136-R172 PolarHBondContact SG-NH2 3.39Å; C136-R172 VanDerWaalsContact SG-NH2 3.42Å; C136-M181 HydrophobicContact CB-CE 4.45Å
137	K	96.6	Very high	94.1	Very high	55 Å²	55	48.8 Å²	48.8	24%	0.239	24%	0.244	C	C	.	.	H	α-helix	trans	-52.6	-56	168.1	172.2	-160	-171	176	0	111.7	H127 Y128 C133 E134 F139 F140 R141	H127-K137 HydrophobicContact CB-CB 3.96Å; H127-K137 HydrophobicContact CB-CD 4.34Å; H127-K137 HydrophobicContact CB-CG 3.85Å; H127-K137 WeakPolarHBondContact ND1-CD 3.15Å; H127-K137 VanDerWaalsContact ND1-CE 3.33Å; H127-K137 WeakPolarHBondContact ND1-CE 3.25Å; Y128-K137 HydrophobicContact CE2-CB 4.5Å; Y128-K137 HydrophobicContact CE2-CG 3.89Å; C133-K137 PolarHBondContact O-N 3.07Å; E134-K137 IonicContact OE1-NZ 3.61Å; E134-K137 PolarHBondContact OE1-NZ 2.88Å; E134-K137 WeakPolarHBondContact OE2-CD 3.22Å; E134-K137 IonicContact OE2-NZ 3.38Å; E134-K137 PolarHBondContact OE2-NZ 3.22Å; K137-F139 VanDerWaalsContact C-N 3.3Å; K137-F139 PolarHBondContact O-N 3.06Å; K137-F140 PolarHBondContact O-N 3.05Å; K137-R141 WeakPolarHBondContact O-CB 3.33Å; K137-R141 PolarHBondContact O-N 2.86Å; K137-R141 VanDerWaalsContact O-N 3.07Å
138	G	95.6	Very high	93.9	Very high	12 Å²	12	48.6 Å²	48.6	12%	0.124	25%	0.247	C	C	.	.	H	α-helix	trans	-65.9	-34.4	-177.6	0	0	0	0	0	112.9	E134 R142	E134-G138 PolarHBondContact O-N 3.49Å; G138-R142 WeakPolarHBondContact O-CG 3.46Å; G138-R142 PolarHBondContact O-N 3.37Å; G138-R142 PolarHBondContact O-NH1 3.17Å
139	F	97.6	Very high	93.8	Very high	9 Å²	9	55.7 Å²	55.7	4%	0.039	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-54.6	175	173.6	-99.3	0	0	0	111.4	G135 C136 K137 R141 R142 S143 Y150 Q169 R172 L173	G135-F139 WeakPolarHBondContact O-CB 3.43Å; G135-F139 PolarHBondContact O-N 3.43Å; C136-F139 PolarHBondContact O-N 2.96Å; K137-F139 VanDerWaalsContact C-N 3.3Å; K137-F139 PolarHBondContact O-N 3.06Å; F139-R141 VanDerWaalsContact C-N 3.34Å; F139-R141 PolarHBondContact O-N 2.99Å; F139-R142 PolarHBondContact O-N 3.39Å; F139-R142 VanDerWaalsContact O-N 3.17Å; F139-S143 PolarHBondContact O-N 3.47Å; F139-S143 PolarHBondContact O-OG 3.25Å; F139-S143 VanDerWaalsContact O-OG 3.05Å; F139-Y150 HydrophobicContact CE2-CE2 4.03Å; F139-Y150 HydrophobicContact CZ-CD2 4.35Å; F139-Y150 AromaticContact CZ-CE2 3.75Å; F139-Y150 HydrophobicContact CZ-CE2 3.75Å; F139-Q169 HydrophobicContact CE2-CB 4.04Å; F139-Q169 HydrophobicContact CE2-CG 4.08Å; F139-Q169 HydrophobicContact CZ-CB 4.11Å; F139-Q169 WeakPolarHBondContact CZ-O 3.1Å; F139-R172 HydrophobicContact CD1-CB 4.42Å; F139-R172 HydrophobicContact CD1-CG 3.69Å; F139-R172 HydrophobicContact CE1-CB 3.75Å; F139-R172 HydrophobicContact CE1-CG 3.51Å; F139-R172 HydrophobicContact CG-CG 4.4Å; F139-R172 HydrophobicContact CZ-CB 3.96Å; F139-R172 HydrophobicContact CZ-CG 4.1Å; F139-L173 HydrophobicContact CE1-CB 3.84Å; F139-L173 HydrophobicContact CE1-CD1 4.33Å; F139-L173 HydrophobicContact CZ-CB 4.05Å
140	F	96.9	Very high	94	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-56.3	-47.4	-179.8	-173.2	-105.2	0	0	0	111.8	Y128 C136 K137 R142 S143 V144 L173 C176 R177 M181 E183 V186	Y128-F140 AromaticContact CD2-CD1 3.69Å; Y128-F140 HydrophobicContact CD2-CD1 3.69Å; Y128-F140 HydrophobicContact CD2-CE1 4.39Å; Y128-F140 HydrophobicContact CE2-CD1 4.18Å; Y128-F140 HydrophobicContact CG-CD1 4.04Å; Y128-F140 HydrophobicContact CG-CE1 4.29Å; C136-F140 WeakPolarHBondContact O-CB 3.31Å; C136-F140 PolarHBondContact O-N 3.35Å; K137-F140 PolarHBondContact O-N 3.05Å; F140-R142 PolarHBondContact O-N 2.67Å; F140-S143 PolarHBondContact O-N 2.8Å; F140-V144 HydrophobicContact CD1-CG2 4.18Å; F140-V144 HydrophobicContact CD2-CG2 4.32Å; F140-V144 HydrophobicContact CE1-CG2 3.87Å; F140-V144 HydrophobicContact CE2-CG2 4.03Å; F140-V144 HydrophobicContact CG-CG2 4.4Å; F140-V144 HydrophobicContact CZ-CG2 3.8Å; F140-V144 WeakPolarHBondContact O-CG2 3.21Å; F140-V144 PolarHBondContact O-N 3.38Å; F140-L173 HydrophobicContact CD2-CD1 3.9Å; F140-L173 HydrophobicContact CE2-CD1 4.26Å; F140-C176 HydrophobicContact CD2-CB 3.5Å; F140-C176 HydrophobicContact CE2-CB 4.04Å; F140-C176 HydrophobicContact CG-CB 4.36Å; F140-R177 HydrophobicContact CE2-CG 4.19Å; F140-M181 HydrophobicContact CB-SD 3.71Å; F140-M181 HydrophobicContact CD1-CB 3.96Å; F140-M181 HydrophobicContact CD1-SD 4.06Å; F140-M181 HydrophobicContact CD2-CB 3.98Å; F140-M181 HydrophobicContact CD2-SD 3.97Å; F140-M181 HydrophobicContact CE1-CB 3.65Å; F140-M181 HydrophobicContact CE2-CB 3.67Å; F140-M181 HydrophobicContact CG-CB 4.11Å; F140-M181 HydrophobicContact CG-SD 3.64Å; F140-M181 HydrophobicContact CZ-CB 3.49Å; F140-M181 VanDerWaalsContact CZ-CB 3.49Å; F140-M181 VanDerWaalsContact CZ-O 3.27Å; F140-M181 WeakPolarHBondContact CZ-O 3.27Å; F140-E183 HydrophobicContact CE1-CG 4.48Å; F140-E183 HydrophobicContact CZ-CG 3.76Å; F140-V186 HydrophobicContact CD1-CG2 4.03Å; F140-V186 HydrophobicContact CE1-CG2 3.88Å
141	R	94.6	Very high	94	Very high	121 Å²	121	57.6 Å²	57.6	46%	0.457	30%	0.296	S	S	.	.	H	α-helix	trans	-53.8	-49.1	176.4	-171	179	69.2	179.1	0.9	112.8	Y128 K137 F139 S143 I145 V186	Y128-R141 HydrophobicContact CE2-CB 4.39Å; Y128-R141 WeakPolarHBondContact OH-CB 3.3Å; Y128-R141 WeakPolarHBondContact OH-CD 3.1Å; K137-R141 WeakPolarHBondContact O-CB 3.33Å; K137-R141 PolarHBondContact O-N 2.86Å; K137-R141 VanDerWaalsContact O-N 3.07Å; F139-R141 VanDerWaalsContact C-N 3.34Å; F139-R141 PolarHBondContact O-N 2.99Å; R141-S143 VanDerWaalsContact C-N 3.34Å; R141-I145 HydrophobicContact CG-CD1 3.73Å; R141-I145 WeakPolarHBondContact O-CB 3.37Å; R141-I145 VanDerWaalsContact O-CG1 3.27Å; R141-I145 WeakPolarHBondContact O-CG1 2.95Å; R141-I145 PolarHBondContact O-N 3.15Å; R141-V186 HydrophobicContact CG-CG1 4.05Å
142	R	94.3	Very high	94	Very high	130 Å²	130	57 Å²	57	49%	0.491	29%	0.294	S	S	.	.	H	α-helix	trans	-67.8	-36.2	-178.8	-73.1	-173.6	-59.7	-91	-1.1	112.1	G138 F139 F140 K146	G138-R142 WeakPolarHBondContact O-CG 3.46Å; G138-R142 PolarHBondContact O-N 3.37Å; G138-R142 PolarHBondContact O-NH1 3.17Å; F139-R142 PolarHBondContact O-N 3.39Å; F139-R142 VanDerWaalsContact O-N 3.17Å; F140-R142 PolarHBondContact O-N 2.67Å; R142-K146 WeakPolarHBondContact O-CB 3.19Å; R142-K146 WeakPolarHBondContact O-CG 3.49Å; R142-K146 PolarHBondContact O-N 3.42Å
143	S	94.9	Very high	93.9	Very high	3 Å²	3	66.9 Å²	66.9	2%	0.021	34%	0.337	C	S	.	.	H	α-helix	trans	-69.7	-39.3	179.8	-58.9	0	0	0	0	112	F139 F140 R141 S147 A148 Y150	F139-S143 PolarHBondContact O-N 3.47Å; F139-S143 PolarHBondContact O-OG 3.25Å; F139-S143 VanDerWaalsContact O-OG 3.05Å; F140-S143 PolarHBondContact O-N 2.8Å; R141-S143 VanDerWaalsContact C-N 3.34Å; S143-S147 PolarHBondContact O-N 2.91Å; S143-A148 PolarHBondContact O-N 3.02Å; S143-Y150 WeakPolarHBondContact OG-CE2 3.3Å; S143-Y150 PolarHBondContact OG-OH 3.01Å
144	V	92.2	Very high	93.5	Very high	28 Å²	28	72 Å²	72	17%	0.17	36%	0.364	C	S	.	.	H	α-helix	trans	-71.5	-49.6	177.2	175.8	0	0	0	0	111.4	F140 K146 S147 E183 V186	F140-V144 HydrophobicContact CD1-CG2 4.18Å; F140-V144 HydrophobicContact CD2-CG2 4.32Å; F140-V144 HydrophobicContact CE1-CG2 3.87Å; F140-V144 HydrophobicContact CE2-CG2 4.03Å; F140-V144 HydrophobicContact CG-CG2 4.4Å; F140-V144 HydrophobicContact CZ-CG2 3.8Å; F140-V144 WeakPolarHBondContact O-CG2 3.21Å; F140-V144 PolarHBondContact O-N 3.38Å; V144-K146 VanDerWaalsContact C-N 3.29Å; V144-K146 PolarHBondContact O-N 2.65Å; V144-S147 PolarHBondContact O-N 3.35Å; V144-S147 VanDerWaalsContact O-N 3.07Å; V144-E183 HydrophobicContact CG1-CB 4.01Å; V144-E183 HydrophobicContact CG1-CG 4.28Å; V144-E183 HydrophobicContact CG2-CB 4.36Å; V144-E183 HydrophobicContact CG2-CG 3.8Å; V144-V186 HydrophobicContact CB-CB 4.42Å; V144-V186 HydrophobicContact CB-CG1 4.29Å; V144-V186 HydrophobicContact CB-CG2 4.24Å; V144-V186 HydrophobicContact CG1-CB 4Å; V144-V186 HydrophobicContact CG1-CG1 4.14Å; V144-V186 HydrophobicContact CG1-CG2 4.2Å; V144-V186 HydrophobicContact CG2-CG2 4.38Å
145	I	87.1	Confident	93.3	Very high	50 Å²	50	73.9 Å²	73.9	26%	0.256	38%	0.377	S	S	.	.	H	α-helix	trans	-58.4	-41.6	-179	-69.9	171.9	0	0	0	111.7	R141 S147 V186 E189 I192	R141-I145 HydrophobicContact CG-CD1 3.73Å; R141-I145 WeakPolarHBondContact O-CB 3.37Å; R141-I145 VanDerWaalsContact O-CG1 3.27Å; R141-I145 WeakPolarHBondContact O-CG1 2.95Å; R141-I145 PolarHBondContact O-N 3.15Å; I145-S147 VanDerWaalsContact C-N 3.31Å; I145-V186 HydrophobicContact CD1-CG1 4.21Å; I145-V186 HydrophobicContact CG1-CG1 3.77Å; I145-E189 HydrophobicContact CG2-CG 3.82Å; I145-I192 HydrophobicContact CD1-CD1 4.35Å
146	K	88.3	Confident	93	Very high	160 Å²	160	72.8 Å²	72.8	70%	0.696	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	4.1	-178.2	-63.2	-171.6	173.7	-165.2	0	113.5	R142 V144 A148	R142-K146 WeakPolarHBondContact O-CB 3.19Å; R142-K146 WeakPolarHBondContact O-CG 3.49Å; R142-K146 PolarHBondContact O-N 3.42Å; V144-K146 VanDerWaalsContact C-N 3.29Å; V144-K146 PolarHBondContact O-N 2.65Å; K146-A148 PolarHBondContact O-N 3.3Å; K146-A148 VanDerWaalsContact O-N 3.1Å
147	S	86.6	Confident	92.8	Very high	100 Å²	100	83 Å²	83	70%	0.699	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.7	45.6	-170.8	-62.5	0	0	0	0	112.1	S143 V144 I145 Q149	S143-S147 PolarHBondContact O-N 2.91Å; V144-S147 PolarHBondContact O-N 3.35Å; V144-S147 VanDerWaalsContact O-N 3.07Å; I145-S147 VanDerWaalsContact C-N 3.31Å; S147-Q149 PolarHBondContact O-N 2.87Å
148	A	89.3	Confident	92.7	Very high	24 Å²	24	81.2 Å²	81.2	20%	0.198	40%	0.399	C	S	.	.			trans	-69.7	125	-165	0	0	0	0	0	111.6	S143 K146 Y150	S143-A148 PolarHBondContact O-N 3.02Å; K146-A148 PolarHBondContact O-N 3.3Å; K146-A148 VanDerWaalsContact O-N 3.1Å; A148-Y150 HydrophobicContact CB-CE1 3.89Å; A148-Y150 HydrophobicContact CB-CE2 3.95Å; A148-Y150 VanDerWaalsContact CB-CZ 3.48Å; A148-Y150 WeakPolarHBondContact CB-OH 3.27Å
149	Q	92.5	Very high	92.7	Very high	188 Å²	188	88.5 Å²	88.5	88%	0.879	43%	0.43	S	S	*	.			trans	-96.2	119.8	173.4	-62.3	-174.6	7.4	0	0	109.7	S147	S147-Q149 PolarHBondContact O-N 2.87Å
150	Y	95.5	Very high	92.6	Very high	60 Å²	60	88.5 Å²	88.5	24%	0.235	43%	0.43	C	S	.	.			trans	-113.8	146.8	177.8	-55.5	-56.1	0	0	0	110.5	F139 S143 A148 Q169 Q170 L173	F139-Y150 HydrophobicContact CE2-CE2 4.03Å; F139-Y150 HydrophobicContact CZ-CD2 4.35Å; F139-Y150 AromaticContact CZ-CE2 3.75Å; F139-Y150 HydrophobicContact CZ-CE2 3.75Å; S143-Y150 WeakPolarHBondContact OG-CE2 3.3Å; S143-Y150 PolarHBondContact OG-OH 3.01Å; A148-Y150 HydrophobicContact CB-CE1 3.89Å; A148-Y150 HydrophobicContact CB-CE2 3.95Å; A148-Y150 VanDerWaalsContact CB-CZ 3.48Å; A148-Y150 WeakPolarHBondContact CB-OH 3.27Å; Y150-Q169 HydrophobicContact CD1-CB 3.73Å; Y150-Q169 HydrophobicContact CD2-CB 3.71Å; Y150-Q169 HydrophobicContact CE1-CB 4.06Å; Y150-Q169 HydrophobicContact CE2-CB 4.02Å; Y150-Q169 HydrophobicContact CG-CB 3.55Å; Y150-Q170 VanDerWaalsContact O-CG 3.3Å; Y150-Q170 WeakPolarHBondContact O-CG 3.39Å; Y150-Q170 PolarHBondContact O-NE2 2.86Å; Y150-L173 HydrophobicContact CD2-CB 4.31Å; Y150-L173 HydrophobicContact CD2-CD2 4.03Å; Y150-L173 HydrophobicContact CE2-CB 4.49Å; Y150-L173 HydrophobicContact CE2-CD2 4.06Å
151	S	93.8	Very high	92.5	Very high	106 Å²	106	92 Å²	92	74%	0.741	45%	0.449	S	S	*	.			trans	-112.5	136.5	172	-174.4	0	0	0	0	110.8
152	C	95.7	Very high	92.4	Very high	16 Å²	16	91.2 Å²	91.2	11%	0.108	45%	0.452	C	S	.	.			trans	-83.8	139.1	172.6	-176.8	0	0	0	0	109.8	N154 G156 C158 Q170	C152-N154 PolarHBondContact SG-N 3.29Å; C152-G156 PolarHBondContact SG-N 2.94Å; C152-C158 VanDerWaalsContact SG-SG 3.66Å; C152-Q170 HydrophobicContact CB-CB 4.18Å; C152-Q170 VanDerWaalsContact N-OE1 3.15Å
153	K	92.8	Very high	92.3	Very high	208 Å²	208	92 Å²	92	90%	0.904	46%	0.456	S	S	*	.	S	Bend	trans	-88.5	-3.2	175.9	-60.6	-174.5	179.1	-174.8	0	113.7
154	N	89.9	Confident	92.2	Very high	110 Å²	110	94.2 Å²	94.2	59%	0.588	47%	0.466	S	S	*	.	S	Bend	trans	-114.3	-144.9	176.9	-61.6	65.4	0	0	0	107.9	C152 G156	C152-N154 PolarHBondContact SG-N 3.29Å; N154-G156 VanDerWaalsContact C-N 3.31Å; N154-G156 PolarHBondContact O-N 3.49Å
155	N	90.6	Very high	92.3	Very high	139 Å²	139	94 Å²	94	74%	0.743	46%	0.463	S	S	*	.	S	Bend	trans	-95.1	24.5	-175.5	-61.9	-2.8	0	0	0	113.3	R157	N155-R157 PolarHBondContact O-N 2.9Å
156	G	90.4	Very high	92.7	Very high	10 Å²	10	100.8 Å²	100.8	10%	0.103	49%	0.485	C	S	.	.	S	Bend	trans	65.5	6	-175.2	0	0	0	0	0	114.9	C152 N154 C171 R174	C152-G156 PolarHBondContact SG-N 2.94Å; N154-G156 VanDerWaalsContact C-N 3.31Å; N154-G156 PolarHBondContact O-N 3.49Å; G156-C171 PolarHBondContact O-SG 3.03Å; G156-R174 PolarHBondContact O-NH1 3.25Å; G156-R174 PolarHBondContact O-NH2 3.13Å
157	R	93.3	Very high	93	Very high	213 Å²	213	99.3 Å²	99.3	80%	0.804	48%	0.478	S	S	*	.			trans	-116.5	40.9	-177.6	-68.9	-171.3	-83.4	-113.7	1.6	112.4	N155 E159	N155-R157 PolarHBondContact O-N 2.9Å; R157-E159 PolarHBondContact O-N 3.38Å
158	C	95.5	Very high	93.5	Very high	18 Å²	18	95 Å²	95	12%	0.122	45%	0.448	C	S	.	.			trans	-67.8	125.2	175.9	-59.3	0	0	0	0	110	C152 M164 C168 C171	C152-C158 VanDerWaalsContact SG-SG 3.66Å; C158-M164 HydrophobicContact CB-CE 4.23Å; C158-C168 HydrophobicContact CB-CB 4.11Å; C158-C171 HydrophobicContact CB-CB 3.79Å; C158-C171 PolarHBondContact N-SG 3.27Å
159	E	94.3	Very high	93.8	Very high	165 Å²	165	98.7 Å²	98.7	77%	0.771	46%	0.461	S	S	*	.			trans	-68.6	136.2	170.4	-167.6	175.4	-179.3	0	0	109.9	R157 M164	R157-E159 PolarHBondContact O-N 3.38Å; E159-M164 WeakPolarHBondContact O-CB 3.39Å
160	M	95.7	Very high	94.1	Very high	9 Å²	9	92.6 Å²	92.6	4%	0.044	43%	0.433	C	S	.	.			trans	-102.9	111.2	-172.1	-56.5	-56.2	-51.5	0	0	110.9	V118 R165 C171 R172 K175	V118-M160 VanDerWaalsContact O-CB 3.31Å; V118-M160 WeakPolarHBondContact O-CB 3.4Å; M160-R165 HydrophobicContact CE-CB 3.91Å; M160-C171 HydrophobicContact SD-CB 3.83Å; M160-R172 HydrophobicContact CE-CB 3.41Å; M160-R172 VanDerWaalsContact CE-CB 3.41Å; M160-R172 HydrophobicContact CE-CG 3.72Å; M160-R172 HydrophobicContact SD-CB 4.29Å; M160-K175 HydrophobicContact CB-CD 3.45Å; M160-K175 VanDerWaalsContact CB-CD 3.45Å; M160-K175 HydrophobicContact CG-CB 3.96Å; M160-K175 HydrophobicContact CG-CD 3.36Å; M160-K175 HydrophobicContact CG-CG 4.3Å; M160-K175 PolarHBondContact O-NZ 3.3Å
161	D	94.8	Very high	94.1	Very high	73 Å²	73	90 Å²	90	39%	0.39	42%	0.423	S	S	.	.	S	Bend	trans	-125	-169.4	172.6	66	18.1	0	0	0	110.8	C119 Y163 M164 R165	C119-D161 CarbonylContact O-C 3.38Å; C119-D161 WeakPolarHBondContact O-CA 3.22Å; D161-Y163 PolarHBondContact O-N 3.28Å; D161-Y163 WeakPolarHBondContact OD1-CA 3.36Å; D161-Y163 WeakPolarHBondContact OD1-CB 3.17Å; D161-Y163 PolarHBondContact OD1-N 3.43Å; D161-M164 WeakPolarHBondContact OD1-CB 3.27Å; D161-M164 PolarHBondContact OD1-N 3Å; D161-R165 VanDerWaalsContact O-CB 3.27Å; D161-R165 WeakPolarHBondContact O-CB 3.47Å; D161-R165 WeakPolarHBondContact O-CG 3.47Å; D161-R165 PolarHBondContact O-N 3.07Å
162	M	92.4	Very high	94.3	Very high	106 Å²	106	86 Å²	86	52%	0.522	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-22.1	179.3	-66.2	179.3	69	0	0	114	C119 D121 R165	C119-M162 PolarHBondContact O-N 3.16Å; D121-M162 HydrophobicContact CB-CE 4.49Å; D121-M162 HydrophobicContact CB-CG 4.07Å; M162-R165 WeakPolarHBondContact O-CG 3.43Å; M162-R165 PolarHBondContact O-NE 3.4Å; M162-R165 VanDerWaalsContact O-NE 3.11Å
163	Y	93.1	Very high	94.4	Very high	147 Å²	147	85.9 Å²	85.9	58%	0.576	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-56.7	-178.3	-179.7	-96.6	0	0	0	112.1	D161 R165 R166 K167	D161-Y163 PolarHBondContact O-N 3.28Å; D161-Y163 WeakPolarHBondContact OD1-CA 3.36Å; D161-Y163 WeakPolarHBondContact OD1-CB 3.17Å; D161-Y163 PolarHBondContact OD1-N 3.43Å; Y163-R165 PolarHBondContact O-N 2.97Å; Y163-R166 PolarHBondContact O-N 2.98Å; Y163-K167 HydrophobicContact CD1-CG 4.37Å; Y163-K167 HydrophobicContact CE1-CD 4.45Å; Y163-K167 HydrophobicContact CE1-CG 4.04Å; Y163-K167 WeakPolarHBondContact OH-CE 3.38Å; Y163-K167 PolarHBondContact OH-NZ 3.05Å
164	M	92.8	Very high	94.6	Very high	49 Å²	49	80.6 Å²	80.6	24%	0.241	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-63.4	-23	-178.8	-73.9	-54	-73.9	0	0	113.4	C158 E159 D161 R166 K167 C168	C158-M164 HydrophobicContact CB-CE 4.23Å; E159-M164 WeakPolarHBondContact O-CB 3.39Å; D161-M164 WeakPolarHBondContact OD1-CB 3.27Å; D161-M164 PolarHBondContact OD1-N 3Å; M164-R166 PolarHBondContact O-N 3.37Å; M164-K167 HydrophobicContact CE-CB 4.04Å; M164-K167 PolarHBondContact O-N 3.17Å; M164-K167 HydrophobicContact SD-CB 3.91Å; M164-K167 HydrophobicContact SD-CG 3.86Å; M164-C168 PolarHBondContact O-N 3.26Å
165	R	94.7	Very high	94.9	Very high	24 Å²	24	78.3 Å²	78.3	9%	0.091	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-57.4	-18.6	169.3	74.4	-178.9	-177.9	168.7	-3	114.9	C119 D121 M160 D161 M162 Y163 R172	C119-R165 HydrophobicContact CB-CB 4.27Å; C119-R165 PolarHBondContact SG-NH1 3.43Å; C119-R165 VanDerWaalsContact SG-NH1 3.41Å; D121-R165 IonicContact OD2-CZ 3.31Å; D121-R165 IonicContact OD2-NH1 2.71Å; D121-R165 PolarHBondContact OD2-NH1 3Å; D121-R165 IonicContact OD2-NH2 2.82Å; D121-R165 PolarHBondContact OD2-NH2 3.17Å; M160-R165 HydrophobicContact CE-CB 3.91Å; D161-R165 VanDerWaalsContact O-CB 3.27Å; D161-R165 WeakPolarHBondContact O-CB 3.47Å; D161-R165 WeakPolarHBondContact O-CG 3.47Å; D161-R165 PolarHBondContact O-N 3.07Å; M162-R165 WeakPolarHBondContact O-CG 3.43Å; M162-R165 PolarHBondContact O-NE 3.4Å; M162-R165 VanDerWaalsContact O-NE 3.11Å; Y163-R165 PolarHBondContact O-N 2.97Å; R165-R172 VanDerWaalsContact O-CD 3.25Å; R165-R172 WeakPolarHBondContact O-CD 3.33Å; R165-R172 PolarHBondContact O-NH1 2.91Å
166	R	94.2	Very high	95.2	Very high	192 Å²	192	71.7 Å²	71.7	73%	0.725	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-97	-14.1	175	-60	-176.1	-180	-177.2	1	112.9	Y163 M164	Y163-R166 PolarHBondContact O-N 2.98Å; M164-R166 PolarHBondContact O-N 3.37Å
167	K	95	Very high	95.5	Very high	129 Å²	129	77.7 Å²	77.7	56%	0.561	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-38.7	-173.6	-59.6	-62	-173.9	173	0	113.1	Y163 M164	Y163-K167 HydrophobicContact CD1-CG 4.37Å; Y163-K167 HydrophobicContact CE1-CD 4.45Å; Y163-K167 HydrophobicContact CE1-CG 4.04Å; Y163-K167 WeakPolarHBondContact OH-CE 3.38Å; Y163-K167 PolarHBondContact OH-NZ 3.05Å; M164-K167 HydrophobicContact CE-CB 4.04Å; M164-K167 PolarHBondContact O-N 3.17Å; M164-K167 HydrophobicContact SD-CB 3.91Å; M164-K167 HydrophobicContact SD-CG 3.86Å
168	C	96.8	Very high	95.6	Very high	10 Å²	10	74 Å²	74	7%	0.068	33%	0.325	C	S	.	.			trans	-126.2	105.7	-178.8	-168.9	0	0	0	0	112.3	C158 M164 C171 R172	C158-C168 HydrophobicContact CB-CB 4.11Å; M164-C168 PolarHBondContact O-N 3.26Å; C168-C171 HydrophobicContact CB-CB 4.29Å; C168-C171 PolarHBondContact SG-N 3.34Å; C168-R172 VanDerWaalsContact O-CB 3.3Å; C168-R172 WeakPolarHBondContact O-CB 3.28Å; C168-R172 PolarHBondContact O-N 2.65Å
169	Q	96.9	Very high	95.5	Very high	101 Å²	101	74.9 Å²	74.9	47%	0.472	33%	0.334	S	S	.	.	H	α-helix	trans	-73.9	-34.9	178.7	-64	172.3	-6.1	0	0	111.9	F139 Y150 R172 L173	F139-Q169 HydrophobicContact CE2-CB 4.04Å; F139-Q169 HydrophobicContact CE2-CG 4.08Å; F139-Q169 HydrophobicContact CZ-CB 4.11Å; F139-Q169 WeakPolarHBondContact CZ-O 3.1Å; Y150-Q169 HydrophobicContact CD1-CB 3.73Å; Y150-Q169 HydrophobicContact CD2-CB 3.71Å; Y150-Q169 HydrophobicContact CE1-CB 4.06Å; Y150-Q169 HydrophobicContact CE2-CB 4.02Å; Y150-Q169 HydrophobicContact CG-CB 3.55Å; Q169-R172 PolarHBondContact O-N 3.34Å; Q169-L173 WeakPolarHBondContact O-CB 3.41Å; Q169-L173 PolarHBondContact O-N 2.7Å
170	Q	97.3	Very high	95.5	Very high	59 Å²	59	68.4 Å²	68.4	28%	0.276	31%	0.311	S	S	.	.	H	α-helix	trans	-62.6	-53.7	178.8	-169.5	-171.6	61.9	0	0	111.9	Y150 C152 R172 L173 R174	Y150-Q170 VanDerWaalsContact O-CG 3.3Å; Y150-Q170 WeakPolarHBondContact O-CG 3.39Å; Y150-Q170 PolarHBondContact O-NE2 2.86Å; C152-Q170 HydrophobicContact CB-CB 4.18Å; C152-Q170 VanDerWaalsContact N-OE1 3.15Å; Q170-R172 VanDerWaalsContact C-N 3.27Å; Q170-R172 PolarHBondContact O-N 2.93Å; Q170-L173 PolarHBondContact O-N 2.85Å; Q170-R174 PolarHBondContact O-N 3.1Å
171	C	96.9	Very high	95.5	Very high	6 Å²	6	68.3 Å²	68.3	4%	0.041	31%	0.311	C	S	.	.	H	α-helix	trans	-65.4	-32.6	178.7	-62.9	0	0	0	0	111.8	G156 C158 M160 C168 K175	G156-C171 PolarHBondContact O-SG 3.03Å; C158-C171 HydrophobicContact CB-CB 3.79Å; C158-C171 PolarHBondContact N-SG 3.27Å; M160-C171 HydrophobicContact SD-CB 3.83Å; C168-C171 HydrophobicContact CB-CB 4.29Å; C168-C171 PolarHBondContact SG-N 3.34Å; C171-K175 WeakPolarHBondContact O-CB 3.49Å; C171-K175 PolarHBondContact O-N 3.43Å
172	R	97.8	Very high	95.3	Very high	22 Å²	22	67.4 Å²	67.4	8%	0.083	31%	0.306	C	S	.	.	H	α-helix	trans	-63.3	-47.3	174	-169.6	174.9	-175.1	-175.6	-5.2	112.6	G135 C136 F139 M160 R165 C168 Q169 Q170 R174 K175 C176	G135-R172 PolarHBondContact O-NH2 2.81Å; C136-R172 PolarHBondContact SG-NH2 3.39Å; C136-R172 VanDerWaalsContact SG-NH2 3.42Å; F139-R172 HydrophobicContact CD1-CB 4.42Å; F139-R172 HydrophobicContact CD1-CG 3.69Å; F139-R172 HydrophobicContact CE1-CB 3.75Å; F139-R172 HydrophobicContact CE1-CG 3.51Å; F139-R172 HydrophobicContact CG-CG 4.4Å; F139-R172 HydrophobicContact CZ-CB 3.96Å; F139-R172 HydrophobicContact CZ-CG 4.1Å; M160-R172 HydrophobicContact CE-CB 3.41Å; M160-R172 VanDerWaalsContact CE-CB 3.41Å; M160-R172 HydrophobicContact CE-CG 3.72Å; M160-R172 HydrophobicContact SD-CB 4.29Å; R165-R172 VanDerWaalsContact O-CD 3.25Å; R165-R172 WeakPolarHBondContact O-CD 3.33Å; R165-R172 PolarHBondContact O-NH1 2.91Å; C168-R172 VanDerWaalsContact O-CB 3.3Å; C168-R172 WeakPolarHBondContact O-CB 3.28Å; C168-R172 PolarHBondContact O-N 2.65Å; Q169-R172 PolarHBondContact O-N 3.34Å; Q170-R172 VanDerWaalsContact C-N 3.27Å; Q170-R172 PolarHBondContact O-N 2.93Å; R172-R174 VanDerWaalsContact C-N 3.32Å; R172-K175 PolarHBondContact O-N 2.94Å; R172-C176 PolarHBondContact O-N 3.28Å; R172-C176 PolarHBondContact O-SG 2.79Å; R172-C176 VanDerWaalsContact O-SG 3.4Å
173	L	97.2	Very high	95.1	Very high	14 Å²	14	66 Å²	66	7%	0.073	30%	0.298	C	S	.	.	H	α-helix	trans	-66.2	-39.9	-179.6	-178	59.7	0	0	0	110.8	F139 F140 Y150 Q169 Q170 C176 R177	F139-L173 HydrophobicContact CE1-CB 3.84Å; F139-L173 HydrophobicContact CE1-CD1 4.33Å; F139-L173 HydrophobicContact CZ-CB 4.05Å; F140-L173 HydrophobicContact CD2-CD1 3.9Å; F140-L173 HydrophobicContact CE2-CD1 4.26Å; Y150-L173 HydrophobicContact CD2-CB 4.31Å; Y150-L173 HydrophobicContact CD2-CD2 4.03Å; Y150-L173 HydrophobicContact CE2-CB 4.49Å; Y150-L173 HydrophobicContact CE2-CD2 4.06Å; Q169-L173 WeakPolarHBondContact O-CB 3.41Å; Q169-L173 PolarHBondContact O-N 2.7Å; Q170-L173 PolarHBondContact O-N 2.85Å; L173-C176 WeakPolarHBondContact O-CB 3.33Å; L173-C176 PolarHBondContact O-N 3.05Å; L173-R177 PolarHBondContact O-N 2.82Å; L173-R177 VanDerWaalsContact O-N 3.16Å
174	R	96.1	Very high	94.6	Very high	97 Å²	97	66.1 Å²	66.1	37%	0.366	30%	0.304	S	S	.	.	H	α-helix	trans	-59.4	-49.5	173.4	-163.5	-171.8	-56.1	155.9	8.6	111.6	G156 Q170 R172 C176 R177 E178	G156-R174 PolarHBondContact O-NH1 3.25Å; G156-R174 PolarHBondContact O-NH2 3.13Å; Q170-R174 PolarHBondContact O-N 3.1Å; R172-R174 VanDerWaalsContact C-N 3.32Å; R174-C176 VanDerWaalsContact C-N 3.27Å; R174-C176 PolarHBondContact O-N 3.23Å; R174-R177 WeakPolarHBondContact O-CB 3.41Å; R174-R177 PolarHBondContact O-N 3.07Å; R174-E178 WeakPolarHBondContact CD-OE1 3.49Å; R174-E178 HydrophobicContact CG-CG 4.34Å; R174-E178 VanDerWaalsContact CG-OE1 3.27Å; R174-E178 WeakPolarHBondContact CG-OE1 3.37Å; R174-E178 WeakPolarHBondContact O-CG 3.38Å; R174-E178 PolarHBondContact O-N 3.33Å
175	K	97.1	Very high	94.1	Very high	61 Å²	61	66.8 Å²	66.8	27%	0.265	31%	0.313	S	S	.	.	H	α-helix	trans	-64.3	-30.1	178.5	-164.1	173.8	180	-178.7	0	113.1	V118 M160 C171 R172 A179	V118-K175 HydrophobicContact CG1-CB 4.33Å; V118-K175 HydrophobicContact CG1-CG 4.36Å; V118-K175 WeakPolarHBondContact O-CD 3.43Å; V118-K175 WeakPolarHBondContact O-CE 3.41Å; V118-K175 PolarHBondContact O-NZ 3.23Å; V118-K175 VanDerWaalsContact O-NZ 3.09Å; M160-K175 HydrophobicContact CB-CD 3.45Å; M160-K175 VanDerWaalsContact CB-CD 3.45Å; M160-K175 HydrophobicContact CG-CB 3.96Å; M160-K175 HydrophobicContact CG-CD 3.36Å; M160-K175 HydrophobicContact CG-CG 4.3Å; M160-K175 PolarHBondContact O-NZ 3.3Å; C171-K175 WeakPolarHBondContact O-CB 3.49Å; C171-K175 PolarHBondContact O-N 3.43Å; R172-K175 PolarHBondContact O-N 2.94Å; K175-A179 WeakPolarHBondContact O-CB 3.27Å; K175-A179 PolarHBondContact O-N 3.43Å
176	C	97.3	Very high	93.6	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.5	-45.7	169.7	-76.3	0	0	0	0	112	F140 R172 L173 R174 A179 G180 M181	F140-C176 HydrophobicContact CD2-CB 3.5Å; F140-C176 HydrophobicContact CE2-CB 4.04Å; F140-C176 HydrophobicContact CG-CB 4.36Å; R172-C176 PolarHBondContact O-N 3.28Å; R172-C176 PolarHBondContact O-SG 2.79Å; R172-C176 VanDerWaalsContact O-SG 3.4Å; L173-C176 WeakPolarHBondContact O-CB 3.33Å; L173-C176 PolarHBondContact O-N 3.05Å; R174-C176 VanDerWaalsContact C-N 3.27Å; R174-C176 PolarHBondContact O-N 3.23Å; C176-A179 PolarHBondContact O-N 3.4Å; C176-G180 PolarHBondContact O-N 3.37Å; C176-M181 HydrophobicContact CB-CB 4.47Å; C176-M181 HydrophobicContact CB-CG 4.38Å; C176-M181 HydrophobicContact CB-SD 3.73Å; C176-M181 VanDerWaalsContact O-CB 3.27Å; C176-M181 WeakPolarHBondContact O-CB 3.49Å; C176-M181 WeakPolarHBondContact O-CG 3.44Å; C176-M181 PolarHBondContact O-N 2.9Å
177	R	95.6	Very high	93	Very high	136 Å²	136	60.5 Å²	60.5	51%	0.513	30%	0.295	S	S	.	.	H	α-helix	trans	-68	-44.4	177.7	-68.1	176.7	173.6	168.5	-2.8	111.9	F140 L173 R174 A179 G180 E183	F140-R177 HydrophobicContact CE2-CG 4.19Å; L173-R177 PolarHBondContact O-N 2.82Å; L173-R177 VanDerWaalsContact O-N 3.16Å; R174-R177 WeakPolarHBondContact O-CB 3.41Å; R174-R177 PolarHBondContact O-N 3.07Å; R177-A179 VanDerWaalsContact C-N 3.28Å; R177-A179 PolarHBondContact O-N 3.33Å; R177-G180 WeakPolarHBondContact O-CA 3.46Å; R177-G180 PolarHBondContact O-N 3Å; R177-E183 IonicContact CZ-OE1 3.17Å; R177-E183 IonicContact NE-OE1 2.8Å; R177-E183 PolarHBondContact NE-OE1 3.31Å; R177-E183 IonicContact NH2-OE1 2.65Å; R177-E183 PolarHBondContact NH2-OE1 3.41Å
178	E	95.3	Very high	92	Very high	136 Å²	136	57 Å²	57	64%	0.636	29%	0.287	S	S	*	.	H	α-helix	trans	-62	-34.9	176.3	-69.5	166.6	176.6	0	0	112.1	R174 G180	R174-E178 WeakPolarHBondContact CD-OE1 3.49Å; R174-E178 HydrophobicContact CG-CG 4.34Å; R174-E178 VanDerWaalsContact CG-OE1 3.27Å; R174-E178 WeakPolarHBondContact CG-OE1 3.37Å; R174-E178 WeakPolarHBondContact O-CG 3.38Å; R174-E178 PolarHBondContact O-N 3.33Å; E178-G180 PolarHBondContact O-N 2.95Å
179	A	94.6	Very high	90.8	Very high	36 Å²	36	63.1 Å²	63.1	30%	0.298	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-7.6	173.3	0	0	0	0	0	113.4	V118 V130 K175 C176 R177	V118-A179 HydrophobicContact CG2-CB 4.1Å; V130-A179 HydrophobicContact CG1-CB 4.05Å; V130-A179 WeakPolarHBondContact CG2-O 3.36Å; K175-A179 WeakPolarHBondContact O-CB 3.27Å; K175-A179 PolarHBondContact O-N 3.43Å; C176-A179 PolarHBondContact O-N 3.4Å; R177-A179 VanDerWaalsContact C-N 3.28Å; R177-A179 PolarHBondContact O-N 3.33Å
180	G	94.3	Very high	89.6	Confident	29 Å²	29	62.5 Å²	62.5	30%	0.299	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.3	20.2	176	0	0	0	0	0	115.5	V130 C176 R177 E178 L182	V130-G180 WeakPolarHBondContact CG2-O 3.16Å; C176-G180 PolarHBondContact O-N 3.37Å; R177-G180 WeakPolarHBondContact O-CA 3.46Å; R177-G180 PolarHBondContact O-N 3Å; E178-G180 PolarHBondContact O-N 2.95Å; G180-L182 PolarHBondContact O-N 3.47Å
181	M	95.9	Very high	88.5	Confident	7 Å²	7	64.1 Å²	64.1	3%	0.034	32%	0.32	C	S	.	.			trans	-69	123.4	176.1	-70.8	-171.7	167.5	0	0	110.5	V118 Y128 V130 S132 C136 F140 C176	V118-M181 HydrophobicContact CG2-CE 4.17Å; Y128-M181 WeakPolarHBondContact O-CA 3.48Å; V130-M181 HydrophobicContact CB-CE 4.25Å; V130-M181 HydrophobicContact CB-CG 3.87Å; V130-M181 HydrophobicContact CG1-CE 4.46Å; V130-M181 HydrophobicContact CG2-CB 4.32Å; V130-M181 HydrophobicContact CG2-CG 3.67Å; V130-M181 VanDerWaalsContact CG2-N 3.32Å; S132-M181 VanDerWaalsContact CB-CE 3.41Å; S132-M181 VanDerWaalsContact OG-CE 3.28Å; S132-M181 WeakPolarHBondContact OG-CE 3.46Å; C136-M181 HydrophobicContact CB-CE 4.45Å; F140-M181 HydrophobicContact CB-SD 3.71Å; F140-M181 HydrophobicContact CD1-CB 3.96Å; F140-M181 HydrophobicContact CD1-SD 4.06Å; F140-M181 HydrophobicContact CD2-CB 3.98Å; F140-M181 HydrophobicContact CD2-SD 3.97Å; F140-M181 HydrophobicContact CE1-CB 3.65Å; F140-M181 HydrophobicContact CE2-CB 3.67Å; F140-M181 HydrophobicContact CG-CB 4.11Å; F140-M181 HydrophobicContact CG-SD 3.64Å; F140-M181 HydrophobicContact CZ-CB 3.49Å; F140-M181 VanDerWaalsContact CZ-CB 3.49Å; F140-M181 VanDerWaalsContact CZ-O 3.27Å; F140-M181 WeakPolarHBondContact CZ-O 3.27Å; C176-M181 HydrophobicContact CB-CB 4.47Å; C176-M181 HydrophobicContact CB-CG 4.38Å; C176-M181 HydrophobicContact CB-SD 3.73Å; C176-M181 VanDerWaalsContact O-CB 3.27Å; C176-M181 WeakPolarHBondContact O-CB 3.49Å; C176-M181 WeakPolarHBondContact O-CG 3.44Å; C176-M181 PolarHBondContact O-N 2.9Å
182	L	89.3	Confident	87.4	Confident	55 Å²	55	66.6 Å²	66.6	29%	0.288	33%	0.332	S	S	.	.			trans	-90.7	122.7	-174.8	-64.2	179.5	0	0	0	112	Y128 N129 G180 Q184 C185	Y128-L182 PolarHBondContact O-N 2.9Å; Y128-L182 VanDerWaalsContact O-N 3.13Å; N129-L182 HydrophobicContact CB-CD1 4Å; N129-L182 HydrophobicContact CB-CG 4.26Å; G180-L182 PolarHBondContact O-N 3.47Å; L182-Q184 VanDerWaalsContact C-N 3.32Å; L182-Q184 HydrophobicContact CB-CG 4.39Å; L182-C185 HydrophobicContact CB-CB 4.32Å; L182-C185 PolarHBondContact O-N 3.36Å
183	E	89	Confident	86.5	Confident	75 Å²	75	72.3 Å²	72.3	35%	0.35	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-67.5	-34	177.8	-59.6	-170.8	169.8	0	0	111.4	F140 V144 R177 C185 V186	F140-E183 HydrophobicContact CE1-CG 4.48Å; F140-E183 HydrophobicContact CZ-CG 3.76Å; V144-E183 HydrophobicContact CG1-CB 4.01Å; V144-E183 HydrophobicContact CG1-CG 4.28Å; V144-E183 HydrophobicContact CG2-CB 4.36Å; V144-E183 HydrophobicContact CG2-CG 3.8Å; R177-E183 IonicContact CZ-OE1 3.17Å; R177-E183 IonicContact NE-OE1 2.8Å; R177-E183 PolarHBondContact NE-OE1 3.31Å; R177-E183 IonicContact NH2-OE1 2.65Å; R177-E183 PolarHBondContact NH2-OE1 3.41Å; E183-C185 PolarHBondContact O-N 3.37Å; E183-C185 VanDerWaalsContact O-N 3.13Å; E183-V186 WeakPolarHBondContact O-CB 3.5Å; E183-V186 PolarHBondContact O-N 3.21Å
184	Q	82.4	Confident	85.5	Confident	150 Å²	150	76.2 Å²	76.2	70%	0.701	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-64.7	-16.1	175.8	68	-93.4	32.2	0	0	114.1	L182 V186	L182-Q184 VanDerWaalsContact C-N 3.32Å; L182-Q184 HydrophobicContact CB-CG 4.39Å; Q184-V186 VanDerWaalsContact C-N 3.32Å
185	C	82.9	Confident	84.6	Confident	63 Å²	63	78 Å²	78	43%	0.426	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-86	-5	173.5	-63.6	0	0	0	0	112.7	Y128 L182 E183	Y128-C185 HydrophobicContact CD1-CB 3.85Å; L182-C185 HydrophobicContact CB-CB 4.32Å; L182-C185 PolarHBondContact O-N 3.36Å; E183-C185 PolarHBondContact O-N 3.37Å; E183-C185 VanDerWaalsContact O-N 3.13Å
186	V	83.6	Confident	83.8	Confident	15 Å²	15	81.5 Å²	81.5	9%	0.091	40%	0.399	C	S	.	.	S	Bend	trans	-90.3	114.5	174	-178.3	0	0	0	0	108.4	Y128 F140 R141 V144 I145 E183 Q184 S188	Y128-V186 HydrophobicContact CD1-CG2 3.84Å; Y128-V186 HydrophobicContact CE1-CB 4.45Å; Y128-V186 HydrophobicContact CE1-CG2 3.67Å; Y128-V186 HydrophobicContact CG-CG2 4.42Å; F140-V186 HydrophobicContact CD1-CG2 4.03Å; F140-V186 HydrophobicContact CE1-CG2 3.88Å; R141-V186 HydrophobicContact CG-CG1 4.05Å; V144-V186 HydrophobicContact CB-CB 4.42Å; V144-V186 HydrophobicContact CB-CG1 4.29Å; V144-V186 HydrophobicContact CB-CG2 4.24Å; V144-V186 HydrophobicContact CG1-CB 4Å; V144-V186 HydrophobicContact CG1-CG1 4.14Å; V144-V186 HydrophobicContact CG1-CG2 4.2Å; V144-V186 HydrophobicContact CG2-CG2 4.38Å; I145-V186 HydrophobicContact CD1-CG1 4.21Å; I145-V186 HydrophobicContact CG1-CG1 3.77Å; E183-V186 WeakPolarHBondContact O-CB 3.5Å; E183-V186 PolarHBondContact O-N 3.21Å; Q184-V186 VanDerWaalsContact C-N 3.32Å; V186-S188 PolarHBondContact O-N 3.47Å
187	L	81.4	Confident	82.8	Confident	69 Å²	69	85.9 Å²	85.9	36%	0.361	42%	0.422	S	S	.	.			trans	-63.2	135.9	178.1	-61.4	172.6	0	0	0	110.8	Q191 I192 K195	L187-Q191 VanDerWaalsContact CA-OE1 3.28Å; L187-Q191 HydrophobicContact CB-CB 4.18Å; L187-Q191 HydrophobicContact CD2-CB 4.34Å; L187-I192 HydrophobicContact CB-CD1 4.5Å; L187-I192 HydrophobicContact CB-CG1 4.02Å; L187-K195 HydrophobicContact CD1-CD 4.2Å
188	S	73.3	Confident	82	Confident	55 Å²	55	85.7 Å²	85.7	39%	0.385	43%	0.425	S	S	.	.			trans	-68.7	162.1	174.9	68.7	0	0	0	0	111.9	V186 E190 Q191 I192	V186-S188 PolarHBondContact O-N 3.47Å; S188-E190 PolarHBondContact O-N 3.05Å; S188-Q191 PolarHBondContact O-N 2.92Å; S188-Q191 VanDerWaalsContact O-N 3.14Å; S188-Q191 WeakPolarHBondContact OG-CG 3.31Å; S188-Q191 PolarHBondContact OG-N 3.09Å; S188-I192 WeakPolarHBondContact O-CG1 3.37Å; S188-I192 PolarHBondContact O-N 3.13Å
189	E	71.8	Confident	81.1	Confident	139 Å²	139	84.7 Å²	84.7	65%	0.65	42%	0.419	S	S	*	.	H	α-helix	trans	-56.7	-36.2	176.4	-65.6	-166.2	156	0	0	111.8	I145 I192 R193	I145-E189 HydrophobicContact CG2-CG 3.82Å; E189-I192 PolarHBondContact O-N 3.48Å; E189-R193 WeakPolarHBondContact O-CB 3.3Å; E189-R193 PolarHBondContact O-N 3.35Å
190	E	72.5	Confident	80.2	Confident	89 Å²	89	88.4 Å²	88.4	42%	0.416	43%	0.43	S	S	.	.	H	α-helix	trans	-67	-43.2	176.3	-174.1	57	-162.4	0	0	112.3	S188 I192 R193 L194	S188-E190 PolarHBondContact O-N 3.05Å; E190-I192 VanDerWaalsContact C-N 3.28Å; E190-I192 PolarHBondContact O-N 3.36Å; E190-R193 WeakPolarHBondContact O-CB 3.43Å; E190-R193 PolarHBondContact O-N 3.09Å; E190-R193 IonicContact OE1-CZ 2.86Å; E190-R193 IonicContact OE1-NE 2.92Å; E190-R193 IonicContact OE1-NH2 3.95Å; E190-R193 PolarHBondContact OE1-NH2 3.5Å; E190-R193 IonicContact OE2-CZ 2.6Å; E190-R193 IonicContact OE2-NE 3.18Å; E190-R193 PolarHBondContact OE2-NE 3.14Å; E190-R193 IonicContact OE2-NH2 2.64Å; E190-R193 PolarHBondContact OE2-NH2 2.99Å; E190-L194 HydrophobicContact CG-CD1 4.3Å; E190-L194 VanDerWaalsContact O-CG 3.32Å; E190-L194 WeakPolarHBondContact O-CG 3.3Å; E190-L194 PolarHBondContact O-N 3.05Å
191	Q	73.6	Confident	79.1	Confident	93 Å²	93	92.9 Å²	92.9	44%	0.435	44%	0.443	S	S	.	.	H	α-helix	trans	-65	-33.1	175.7	-71.7	171.8	-21.7	0	0	112.5	L187 S188 K195	L187-Q191 VanDerWaalsContact CA-OE1 3.28Å; L187-Q191 HydrophobicContact CB-CB 4.18Å; L187-Q191 HydrophobicContact CD2-CB 4.34Å; S188-Q191 PolarHBondContact O-N 2.92Å; S188-Q191 VanDerWaalsContact O-N 3.14Å; S188-Q191 WeakPolarHBondContact OG-CG 3.31Å; S188-Q191 PolarHBondContact OG-N 3.09Å; Q191-K195 PolarHBondContact O-N 3.25Å; Q191-K195 VanDerWaalsContact O-N 3.09Å
192	I	75.1	Confident	77.9	Confident	58 Å²	58	97.8 Å²	97.8	30%	0.297	47%	0.466	S	S	.	.	H	α-helix	trans	-70.5	-40.8	174.2	-65.8	167.3	0	0	0	110.4	I145 L187 S188 E189 E190 K195 K196	I145-I192 HydrophobicContact CD1-CD1 4.35Å; L187-I192 HydrophobicContact CB-CD1 4.5Å; L187-I192 HydrophobicContact CB-CG1 4.02Å; S188-I192 WeakPolarHBondContact O-CG1 3.37Å; S188-I192 PolarHBondContact O-N 3.13Å; E189-I192 PolarHBondContact O-N 3.48Å; E190-I192 VanDerWaalsContact C-N 3.28Å; E190-I192 PolarHBondContact O-N 3.36Å; I192-K195 PolarHBondContact O-N 3.18Å; I192-K196 HydrophobicContact CG2-CD 4.42Å; I192-K196 WeakPolarHBondContact O-CB 3.37Å; I192-K196 WeakPolarHBondContact O-CG 3.43Å; I192-K196 PolarHBondContact O-N 3.44Å
193	R	77.8	Confident	77.1	Confident	142 Å²	142	99.9 Å²	99.9	54%	0.536	47%	0.474	S	S	.	.	H	α-helix	trans	-60.4	-48.1	175.8	-168.4	178.1	74.9	116.1	5.1	110.8	E189 E190 K195 K196 L197	E189-R193 WeakPolarHBondContact O-CB 3.3Å; E189-R193 PolarHBondContact O-N 3.35Å; E190-R193 WeakPolarHBondContact O-CB 3.43Å; E190-R193 PolarHBondContact O-N 3.09Å; E190-R193 IonicContact OE1-CZ 2.86Å; E190-R193 IonicContact OE1-NE 2.92Å; E190-R193 IonicContact OE1-NH2 3.95Å; E190-R193 PolarHBondContact OE1-NH2 3.5Å; E190-R193 IonicContact OE2-CZ 2.6Å; E190-R193 IonicContact OE2-NE 3.18Å; E190-R193 PolarHBondContact OE2-NE 3.14Å; E190-R193 IonicContact OE2-NH2 2.64Å; E190-R193 PolarHBondContact OE2-NH2 2.99Å; R193-K195 PolarHBondContact O-N 3.44Å; R193-K196 PolarHBondContact O-N 2.85Å; R193-K196 VanDerWaalsContact O-N 3.16Å; R193-L197 PolarHBondContact O-N 3.16Å
194	L	77.3	Confident	75.8	Confident	96 Å²	96	102.9 Å²	102.9	50%	0.503	49%	0.488	S	S	.	.	H	α-helix	trans	-60.7	-42.3	177	-69.1	169.1	0	0	0	112.2	E190 L197 K198	E190-L194 HydrophobicContact CG-CD1 4.3Å; E190-L194 VanDerWaalsContact O-CG 3.32Å; E190-L194 WeakPolarHBondContact O-CG 3.3Å; E190-L194 PolarHBondContact O-N 3.05Å; L194-L197 PolarHBondContact O-N 2.91Å; L194-K198 WeakPolarHBondContact O-CB 3.32Å; L194-K198 PolarHBondContact O-N 2.9Å
195	K	77.3	Confident	74.6	Confident	134 Å²	134	100.3 Å²	100.3	58%	0.583	48%	0.483	S	S	*	.	H	α-helix	trans	-66.9	-35.3	174.7	-80.6	-172.5	175.3	-178.1	0	113.3	L187 Q191 I192 R193 K199	L187-K195 HydrophobicContact CD1-CD 4.2Å; Q191-K195 PolarHBondContact O-N 3.25Å; Q191-K195 VanDerWaalsContact O-N 3.09Å; I192-K195 PolarHBondContact O-N 3.18Å; R193-K195 PolarHBondContact O-N 3.44Å; K195-K199 WeakPolarHBondContact O-CB 3.45Å; K195-K199 PolarHBondContact O-N 3.37Å
196	K	78.9	Confident	73.4	Confident	135 Å²	135	100.4 Å²	100.4	59%	0.587	49%	0.488	S	S	*	.	H	α-helix	trans	-70.2	-40.4	174.8	-79.3	-176.6	176.9	-176.9	0	111.9	I192 R193 K198 K199 Q200	I192-K196 HydrophobicContact CG2-CD 4.42Å; I192-K196 WeakPolarHBondContact O-CB 3.37Å; I192-K196 WeakPolarHBondContact O-CG 3.43Å; I192-K196 PolarHBondContact O-N 3.44Å; R193-K196 PolarHBondContact O-N 2.85Å; R193-K196 VanDerWaalsContact O-N 3.16Å; K196-K198 VanDerWaalsContact C-N 3.31Å; K196-K199 PolarHBondContact O-N 2.82Å; K196-Q200 WeakPolarHBondContact O-CB 3.45Å; K196-Q200 VanDerWaalsContact O-CG 3.31Å; K196-Q200 WeakPolarHBondContact O-CG 3.33Å; K196-Q200 PolarHBondContact O-N 3.39Å
197	L	77.1	Confident	72	Confident	92 Å²	92	110 Å²	110	48%	0.482	52%	0.523	S	S	.	.	H	α-helix	trans	-60.7	-44.9	174.9	-135.6	88.4	0	0	0	110.4	R193 L194 Q200 Q201	R193-L197 PolarHBondContact O-N 3.16Å; L194-L197 PolarHBondContact O-N 2.91Å; L197-Q200 PolarHBondContact O-N 2.89Å; L197-Q201 PolarHBondContact O-N 2.99Å
198	K	78.3	Confident	70.7	Confident	131 Å²	131	112.5 Å²	112.5	57%	0.57	54%	0.541	S	S	*	.	H	α-helix	trans	-63.8	-43.6	177.1	-167.9	173	-179.7	174.5	0	112.4	L194 K196 Q201 E202	L194-K198 WeakPolarHBondContact O-CB 3.32Å; L194-K198 PolarHBondContact O-N 2.9Å; K196-K198 VanDerWaalsContact C-N 3.31Å; K198-Q201 PolarHBondContact O-N 2.97Å; K198-E202 WeakPolarHBondContact O-CB 3.38Å; K198-E202 VanDerWaalsContact O-CG 3.25Å; K198-E202 WeakPolarHBondContact O-CG 3.25Å; K198-E202 PolarHBondContact O-N 3.31Å
199	K	77.1	Confident	69.5	Low	115 Å²	115	114.2 Å²	114.2	50%	0.5	55%	0.553	S	S	.	*	H	α-helix	trans	-68.1	-34	175.9	-165.4	175.2	-170.8	-97	0	112.7	K195 K196 E202 E203	K195-K199 WeakPolarHBondContact O-CB 3.45Å; K195-K199 PolarHBondContact O-N 3.37Å; K196-K199 PolarHBondContact O-N 2.82Å; K199-E202 PolarHBondContact O-N 3.36Å; K199-E203 WeakPolarHBondContact CE-OE1 3.22Å; K199-E203 HydrophobicContact CG-CG 4.46Å; K199-E203 IonicContact NZ-OE1 3.37Å; K199-E203 PolarHBondContact NZ-OE1 2.89Å; K199-E203 VanDerWaalsContact O-CB 3.3Å; K199-E203 WeakPolarHBondContact O-CB 3.35Å; K199-E203 VanDerWaalsContact O-CG 3.3Å; K199-E203 WeakPolarHBondContact O-CG 3.32Å; K199-E203 PolarHBondContact O-N 3.24Å
200	Q	74.4	Confident	68.1	Low	115 Å²	115	113.5 Å²	113.5	54%	0.537	56%	0.558	S	S	.	*	H	α-helix	trans	-68.5	-42.5	174	-79.6	175.6	-12.6	0	0	111	K196 L197 E202 E203 E204	K196-Q200 WeakPolarHBondContact O-CB 3.45Å; K196-Q200 VanDerWaalsContact O-CG 3.31Å; K196-Q200 WeakPolarHBondContact O-CG 3.33Å; K196-Q200 PolarHBondContact O-N 3.39Å; L197-Q200 PolarHBondContact O-N 2.89Å; Q200-E202 VanDerWaalsContact C-N 3.34Å; Q200-E202 PolarHBondContact O-N 2.92Å; Q200-E203 PolarHBondContact O-N 3.28Å; Q200-E204 WeakPolarHBondContact O-CB 3.33Å; Q200-E204 PolarHBondContact O-N 3.34Å
201	Q	72.5	Confident	66.7	Low	122 Å²	122	115 Å²	115	57%	0.57	57%	0.573	S	S	*	*	H	α-helix	trans	-59.2	-44.2	169.7	-87.6	176.8	-17.9	0	0	111.5	L197 K198 T205	L197-Q201 PolarHBondContact O-N 2.99Å; K198-Q201 PolarHBondContact O-N 2.97Å; Q201-T205 WeakPolarHBondContact O-CB 3.14Å; Q201-T205 PolarHBondContact O-N 3.48Å; Q201-T205 PolarHBondContact O-OG1 2.6Å
202	E	71.4	Confident	65.5	Low	111 Å²	111	117.6 Å²	117.6	52%	0.519	60%	0.595	S	S	.	*	H	α-helix	trans	-64.1	-39.9	176.5	-72.7	165.4	-175	0	0	112.4	K198 K199 Q200 A206	K198-E202 WeakPolarHBondContact O-CB 3.38Å; K198-E202 VanDerWaalsContact O-CG 3.25Å; K198-E202 WeakPolarHBondContact O-CG 3.25Å; K198-E202 PolarHBondContact O-N 3.31Å; K199-E202 PolarHBondContact O-N 3.36Å; Q200-E202 VanDerWaalsContact C-N 3.34Å; Q200-E202 PolarHBondContact O-N 2.92Å; E202-A206 WeakPolarHBondContact O-CB 3.26Å; E202-A206 PolarHBondContact O-N 2.91Å
203	E	70.9	Confident	63.8	Low	98 Å²	98	120.3 Å²	120.3	46%	0.458	61%	0.614	S	S	.	*	H	α-helix	trans	-76	-32.2	178.5	-77	174.6	179.4	0	0	113.2	K199 Q200 A206 R207	K199-E203 WeakPolarHBondContact CE-OE1 3.22Å; K199-E203 HydrophobicContact CG-CG 4.46Å; K199-E203 IonicContact NZ-OE1 3.37Å; K199-E203 PolarHBondContact NZ-OE1 2.89Å; K199-E203 VanDerWaalsContact O-CB 3.3Å; K199-E203 WeakPolarHBondContact O-CB 3.35Å; K199-E203 VanDerWaalsContact O-CG 3.3Å; K199-E203 WeakPolarHBondContact O-CG 3.32Å; K199-E203 PolarHBondContact O-N 3.24Å; Q200-E203 PolarHBondContact O-N 3.28Å; E203-A206 PolarHBondContact O-N 3.04Å; E203-R207 PolarHBondContact O-N 3.06Å
204	E	62.6	Low	62.2	Low	138 Å²	138	119.1 Å²	119.1	65%	0.645	63%	0.625	S	S	*	*	H	α-helix	trans	-70.8	-37.2	172.9	-163.8	165.3	-150.4	0	0	110.2	Q200 A206 R207 T208	Q200-E204 WeakPolarHBondContact O-CB 3.33Å; Q200-E204 PolarHBondContact O-N 3.34Å; E204-A206 VanDerWaalsContact C-N 3.32Å; E204-A206 PolarHBondContact O-N 3.07Å; E204-R207 PolarHBondContact O-N 3.11Å; E204-T208 PolarHBondContact O-N 2.88Å; E204-T208 PolarHBondContact O-OG1 2.76Å
205	T	57.5	Low	60.6	Low	97 Å²	97	120.9 Å²	120.9	60%	0.595	64%	0.64	S	S	*	*	H	α-helix	trans	-65	-35.6	169.8	-49.2	0	0	0	0	111.6	Q201	Q201-T205 WeakPolarHBondContact O-CB 3.14Å; Q201-T205 PolarHBondContact O-N 3.48Å; Q201-T205 PolarHBondContact O-OG1 2.6Å
206	A	56.3	Low	58.9	Low	64 Å²	64	120 Å²	120	53%	0.529	65%	0.648	S	S	.	*	H	α-helix	trans	-74.6	-32.5	177.6	0	0	0	0	0	113.7	E202 E203 E204 S209	E202-A206 WeakPolarHBondContact O-CB 3.26Å; E202-A206 PolarHBondContact O-N 2.91Å; E203-A206 PolarHBondContact O-N 3.04Å; E204-A206 VanDerWaalsContact C-N 3.32Å; E204-A206 PolarHBondContact O-N 3.07Å; A206-S209 PolarHBondContact O-N 2.89Å
207	R	55.7	Low	57.1	Low	218 Å²	218	121.3 Å²	121.3	82%	0.823	66%	0.661	S	S	*	*	H	α-helix	trans	-73.6	-24.1	177.2	-90.9	-178.5	173.2	-178.1	-1.6	113.9	E203 E204 S209	E203-R207 PolarHBondContact O-N 3.06Å; E204-R207 PolarHBondContact O-N 3.11Å; R207-S209 PolarHBondContact O-N 3.1Å
208	T	52.8	Low	55.8	Low	120 Å²	120	126.2 Å²	126.2	74%	0.736	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-4.3	175.4	-40.2	0	0	0	0	112.7	E204	E204-T208 PolarHBondContact O-N 2.88Å; E204-T208 PolarHBondContact O-OG1 2.76Å
209	S	47.8	Very low	54.6	Low	92 Å²	92	128.8 Å²	128.8	64%	0.643	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	22.5	-175.3	-69.6	0	0	0	0	116	A206 R207	A206-S209 PolarHBondContact O-N 2.89Å; R207-S209 PolarHBondContact O-N 3.1Å
210	T	43.6	Very low	53.9	Low	123 Å²	123	127.1 Å²	127.1	76%	0.755	70%	0.703	S	S	*	*			trans	-99.7	37.7	175.4	56	0	0	0	0	114.8
211	V	42.9	Very low	53.9	Low	121 Å²	121	125.2 Å²	125.2	73%	0.733	71%	0.706	S	S	*	*	S	Bend	trans	-123.4	117.9	158.6	-177.9	0	0	0	0	108.2	T213	V211-T213 PolarHBondContact O-N 3.16Å
212	V	48.4	Very low	54.5	Low	148 Å²	148	125.2 Å²	125.2	90%	0.897	72%	0.715	S	S	*	*			trans	-68.5	107.4	179.3	177	0	0	0	0	108.9
213	T	39.6	Very low	55.4	Low	114 Å²	114	121.1 Å²	121.1	70%	0.699	70%	0.696	S	S	*	*			trans	-150	149.7	163.6	-1.1	0	0	0	0	107.6	V211 T215	V211-T213 PolarHBondContact O-N 3.16Å; T213-T215 PolarHBondContact O-N 3.1Å
214	P	42.9	Very low	56.4	Low	117 Å²	117	120.1 Å²	120.1	76%	0.76	69%	0.694	S	S	*	*			trans	-64.1	138.2	-160.4	27.8	-31.9	0	0	0	111.2
215	T	43.7	Very low	57.9	Low	134 Å²	134	118.3 Å²	118.3	82%	0.822	69%	0.694	S	S	*	*			trans	-36.7	120.2	177.6	-30.1	0	0	0	0	112.4	T213	T213-T215 PolarHBondContact O-N 3.1Å
216	P	42.6	Very low	59.6	Low	114 Å²	114	120.8 Å²	120.8	74%	0.74	70%	0.699	S	S	*	*			trans	-70.2	130.6	155.9	-3.5	20.7	0	0	0	107	Q218	P216-Q218 PolarHBondContact O-N 3.09Å
217	L	41	Very low	61.5	Low	164 Å²	164	119.5 Å²	119.5	86%	0.859	68%	0.683	S	S	*	*			trans	-41	127.2	165.8	-70	153.8	0	0	0	108.8	E219	L217-E219 PolarHBondContact O-N 2.65Å
218	Q	49.2	Very low	63.3	Low	194 Å²	194	112.4 Å²	112.4	91%	0.907	66%	0.659	S	S	*	*			trans	-51.4	107.4	176.4	-161.2	164.6	13	0	0	107.7	P216 A220	P216-Q218 PolarHBondContact O-N 3.09Å; Q218-A220 PolarHBondContact O-N 3.22Å
219	E	53.8	Low	65.4	Low	185 Å²	185	113 Å²	113	86%	0.864	65%	0.653	S	S	*	*			trans	-53.7	119.7	176.9	-78.8	174.5	162	0	0	106.8	L217 A221	L217-E219 PolarHBondContact O-N 2.65Å; E219-A221 PolarHBondContact O-N 3.05Å
220	A	62.3	Low	67.7	Low	81 Å²	81	110.8 Å²	110.8	67%	0.669	63%	0.633	S	S	*	*			trans	-52.3	129.4	175.8	0	0	0	0	0	107.2	Q218 T222	Q218-A220 PolarHBondContact O-N 3.22Å; A220-T222 WeakPolarHBondContact O-CG2 3.47Å; A220-T222 PolarHBondContact O-N 2.71Å
221	A	74.9	Confident	70.3	Confident	74 Å²	74	105.2 Å²	105.2	61%	0.612	60%	0.599	S	S	*	*			trans	-55.8	109.9	175.4	0	0	0	0	0	108.1	E219 I412	E219-A221 PolarHBondContact O-N 3.05Å; A221-I412 HydrophobicContact CB-CG1 4.1Å; A221-I412 WeakPolarHBondContact O-CG1 3.42Å; A221-I412 WeakPolarHBondContact O-CG2 3.5Å
222	T	84.8	Confident	72.8	Confident	122 Å²	122	104.8 Å²	104.8	75%	0.748	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-94.3	152	179.8	48.8	0	0	0	0	110.1	A220	A220-T222 WeakPolarHBondContact O-CG2 3.47Å; A220-T222 PolarHBondContact O-N 2.71Å
223	L	89.9	Confident	75.1	Confident	25 Å²	25	103 Å²	103	13%	0.131	57%	0.569	C	S	.	*	P	Polyproline II helix	trans	-65.9	146.9	169.9	-76	158.7	0	0	0	109.4	Q228 I231 Y409 I412	L223-Q228 HydrophobicContact CB-CB 4.35Å; L223-I231 HydrophobicContact CD1-CD1 4.4Å; L223-Y409 HydrophobicContact CD1-CD2 3.6Å; L223-Y409 HydrophobicContact CD1-CE2 4.15Å; L223-I412 HydrophobicContact CB-CD1 4.39Å; L223-I412 HydrophobicContact CD2-CD1 3.74Å; L223-I412 HydrophobicContact CG-CD1 3.64Å
224	D	92.3	Very high	77.8	Confident	77 Å²	77	97.6 Å²	97.6	41%	0.412	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-57.3	137.4	167.8	173.2	79.1	0	0	0	109.2	Q226 Q227 Q228	D224-Q226 PolarHBondContact O-N 2.79Å; D224-Q226 VanDerWaalsContact O-N 3.14Å; D224-Q226 WeakPolarHBondContact OD2-CA 3.49Å; D224-Q226 WeakPolarHBondContact OD2-CB 3.3Å; D224-Q226 PolarHBondContact OD2-N 2.98Å; D224-Q227 HydrophobicContact CB-CB 4.26Å; D224-Q227 HydrophobicContact CB-CG 3.96Å; D224-Q227 WeakPolarHBondContact O-CA 3.44Å; D224-Q227 WeakPolarHBondContact O-CB 3.45Å; D224-Q227 PolarHBondContact O-N 3.21Å; D224-Q227 PolarHBondContact OD2-N 3.44Å; D224-Q228 PolarHBondContact O-N 2.88Å
225	P	94.4	Very high	80.4	Confident	100 Å²	100	93.1 Å²	93.1	65%	0.649	51%	0.506	S	S	*	.	H	α-helix	trans	-54.9	-34.6	-176.4	-28.6	36	0	0	0	113.9	Q228 E229	P225-Q228 PolarHBondContact O-N 3.34Å; P225-E229 WeakPolarHBondContact O-CB 3.37Å; P225-E229 PolarHBondContact O-N 3.24Å
226	Q	93.6	Very high	82.8	Confident	149 Å²	149	89.3 Å²	89.3	70%	0.696	49%	0.488	S	S	*	.	H	α-helix	trans	-71.5	-37.9	177.9	-54.6	-179.1	-13.6	0	0	111.2	D224 M230	D224-Q226 PolarHBondContact O-N 2.79Å; D224-Q226 VanDerWaalsContact O-N 3.14Å; D224-Q226 WeakPolarHBondContact OD2-CA 3.49Å; D224-Q226 WeakPolarHBondContact OD2-CB 3.3Å; D224-Q226 PolarHBondContact OD2-N 2.98Å; Q226-M230 WeakPolarHBondContact O-CB 3.41Å; Q226-M230 PolarHBondContact O-N 3.13Å
227	Q	94.6	Very high	85.2	Confident	38 Å²	38	84.2 Å²	84.2	18%	0.178	46%	0.455	C	S	.	.	H	α-helix	trans	-63.8	-42.6	173.5	-65.7	-173.7	-42.7	0	0	111.2	D224 M230 I231 A405 S408	D224-Q227 HydrophobicContact CB-CB 4.26Å; D224-Q227 HydrophobicContact CB-CG 3.96Å; D224-Q227 WeakPolarHBondContact O-CA 3.44Å; D224-Q227 WeakPolarHBondContact O-CB 3.45Å; D224-Q227 PolarHBondContact O-N 3.21Å; D224-Q227 PolarHBondContact OD2-N 3.44Å; Q227-M230 PolarHBondContact O-N 3.4Å; Q227-I231 VanDerWaalsContact O-CG1 3.25Å; Q227-I231 WeakPolarHBondContact O-CG1 3.46Å; Q227-I231 PolarHBondContact O-N 3.36Å; Q227-A405 HydrophobicContact CG-CB 4.45Å; Q227-S408 PolarHBondContact NE2-OG 3.42Å; Q227-S408 PolarHBondContact OE1-OG 3.46Å
228	Q	95.3	Very high	87.5	Confident	68 Å²	68	76.9 Å²	76.9	32%	0.318	42%	0.416	S	S	.	.	H	α-helix	trans	-61.9	-49.1	177.5	-176.3	63.5	25.7	0	0	111.3	L223 D224 P225 M230 I231 E232	L223-Q228 HydrophobicContact CB-CB 4.35Å; D224-Q228 PolarHBondContact O-N 2.88Å; P225-Q228 PolarHBondContact O-N 3.34Å; Q228-M230 VanDerWaalsContact C-N 3.34Å; Q228-M230 PolarHBondContact O-N 3.1Å; Q228-I231 PolarHBondContact O-N 3.03Å; Q228-E232 PolarHBondContact NE2-OE1 2.92Å; Q228-E232 WeakPolarHBondContact O-CG 3.35Å; Q228-E232 PolarHBondContact O-N 3.49Å
229	E	95.9	Very high	89.4	Confident	134 Å²	134	73.7 Å²	73.7	63%	0.626	40%	0.399	S	S	*	.	H	α-helix	trans	-59.2	-44.1	177.7	-175.2	-175.7	173.2	0	0	111.7	P225 I231 E232 K233	P225-E229 WeakPolarHBondContact O-CB 3.37Å; P225-E229 PolarHBondContact O-N 3.24Å; E229-I231 PolarHBondContact O-N 3.22Å; E229-E232 PolarHBondContact O-N 3.01Å; E229-K233 WeakPolarHBondContact O-CB 3.45Å; E229-K233 PolarHBondContact O-N 3.41Å
230	M	96.8	Very high	91	Very high	44 Å²	44	69.1 Å²	69.1	22%	0.217	38%	0.378	C	S	.	.	H	α-helix	trans	-57.6	-49.8	176	-179.6	-175	-66.6	0	0	111.3	Q226 Q227 Q228 K233 L234 P401 Y402 A405	Q226-M230 WeakPolarHBondContact O-CB 3.41Å; Q226-M230 PolarHBondContact O-N 3.13Å; Q227-M230 PolarHBondContact O-N 3.4Å; Q228-M230 VanDerWaalsContact C-N 3.34Å; Q228-M230 PolarHBondContact O-N 3.1Å; M230-K233 PolarHBondContact O-N 3.39Å; M230-L234 HydrophobicContact CG-CD1 4.32Å; M230-L234 VanDerWaalsContact O-CG 3.28Å; M230-L234 WeakPolarHBondContact O-CG 3.45Å; M230-L234 PolarHBondContact O-N 3.26Å; M230-P401 HydrophobicContact CE-CB 3.89Å; M230-Y402 HydrophobicContact CG-CE1 4.27Å; M230-Y402 HydrophobicContact SD-CD1 3.73Å; M230-Y402 HydrophobicContact SD-CE1 3.79Å; M230-A405 HydrophobicContact SD-CB 4.48Å
231	I	97.2	Very high	92.1	Very high	7 Å²	7	65.5 Å²	65.5	4%	0.036	35%	0.348	C	S	.	.	H	α-helix	trans	-62.8	-45.2	-178.8	-68.6	171.2	0	0	0	111	L223 Q227 Q228 E229 K233 L234 V235 A371 L375 A405 Y409	L223-I231 HydrophobicContact CD1-CD1 4.4Å; Q227-I231 VanDerWaalsContact O-CG1 3.25Å; Q227-I231 WeakPolarHBondContact O-CG1 3.46Å; Q227-I231 PolarHBondContact O-N 3.36Å; Q228-I231 PolarHBondContact O-N 3.03Å; E229-I231 PolarHBondContact O-N 3.22Å; I231-K233 VanDerWaalsContact C-N 3.33Å; I231-K233 PolarHBondContact O-N 2.95Å; I231-L234 PolarHBondContact O-N 2.76Å; I231-V235 WeakPolarHBondContact O-CG2 3.49Å; I231-V235 PolarHBondContact O-N 3.35Å; I231-A371 HydrophobicContact CG2-CB 3.5Å; I231-L375 HydrophobicContact CD1-CD1 4.05Å; I231-L375 HydrophobicContact CG1-CD1 4Å; I231-L375 HydrophobicContact CG1-CD2 4.26Å; I231-L375 HydrophobicContact CG1-CG 4.39Å; I231-A405 HydrophobicContact CD1-CB 4.44Å; I231-Y409 HydrophobicContact CD1-CD2 3.6Å; I231-Y409 HydrophobicContact CD1-CE2 4.39Å; I231-Y409 HydrophobicContact CD1-CG 4.17Å
232	E	96.3	Very high	92.4	Very high	112 Å²	112	64.4 Å²	64.4	52%	0.523	33%	0.331	S	S	.	.	H	α-helix	trans	-60.3	-43.6	177.6	-74	177.1	-174.7	0	0	111.7	Q228 E229 V235 A236	Q228-E232 PolarHBondContact NE2-OE1 2.92Å; Q228-E232 WeakPolarHBondContact O-CG 3.35Å; Q228-E232 PolarHBondContact O-N 3.49Å; E229-E232 PolarHBondContact O-N 3.01Å; E232-V235 PolarHBondContact O-N 2.91Å; E232-A236 VanDerWaalsContact O-CB 3.31Å; E232-A236 WeakPolarHBondContact O-CB 3.28Å; E232-A236 PolarHBondContact O-N 3.03Å
233	K	96.3	Very high	92.2	Very high	109 Å²	109	66.1 Å²	66.1	47%	0.474	33%	0.329	S	S	.	.	H	α-helix	trans	-61.6	-45.8	176.1	-172.2	179.5	178.9	-179.3	0	111.6	E229 M230 I231 V235 A236 M237	E229-K233 WeakPolarHBondContact O-CB 3.45Å; E229-K233 PolarHBondContact O-N 3.41Å; M230-K233 PolarHBondContact O-N 3.39Å; I231-K233 VanDerWaalsContact C-N 3.33Å; I231-K233 PolarHBondContact O-N 2.95Å; K233-V235 PolarHBondContact O-N 3.42Å; K233-A236 PolarHBondContact O-N 3.32Å; K233-M237 HydrophobicContact CD-SD 4.49Å; K233-M237 HydrophobicContact CG-CG 4.46Å; K233-M237 HydrophobicContact CG-SD 3.89Å; K233-M237 WeakPolarHBondContact O-CB 3.44Å; K233-M237 WeakPolarHBondContact O-CG 3.31Å; K233-M237 PolarHBondContact O-N 3.45Å
234	L	96.9	Very high	91.6	Very high	2 Å²	2	70.5 Å²	70.5	1%	0.01	34%	0.343	C	S	.	.	H	α-helix	trans	-59.9	-46.5	177.6	-70.1	178.5	0	0	0	112	M230 I231 A236 M237 Q238 F288 L292 A374 L375 Y402	M230-L234 HydrophobicContact CG-CD1 4.32Å; M230-L234 VanDerWaalsContact O-CG 3.28Å; M230-L234 WeakPolarHBondContact O-CG 3.45Å; M230-L234 PolarHBondContact O-N 3.26Å; I231-L234 PolarHBondContact O-N 2.76Å; L234-A236 VanDerWaalsContact C-N 3.34Å; L234-A236 PolarHBondContact O-N 2.91Å; L234-M237 HydrophobicContact CD2-CE 4.38Å; L234-M237 PolarHBondContact O-N 3.25Å; L234-Q238 PolarHBondContact O-N 3.44Å; L234-F288 HydrophobicContact CD2-CZ 4.14Å; L234-L292 HydrophobicContact CD2-CD2 3.23Å; L234-A374 HydrophobicContact CB-CB 3.96Å; L234-L375 HydrophobicContact CD1-CD2 3.76Å; L234-L375 HydrophobicContact CD1-CG 4.3Å; L234-Y402 HydrophobicContact CD1-CD1 3.96Å; L234-Y402 HydrophobicContact CD1-CE1 3.98Å; L234-Y402 HydrophobicContact CD2-CE1 4.22Å
235	V	96.3	Very high	90.8	Very high	22 Å²	22	67.3 Å²	67.3	13%	0.133	33%	0.327	C	S	.	.	H	α-helix	trans	-65	-39.7	178.1	173.1	0	0	0	0	111.1	I231 E232 K233 Q238 K239 E370 A371	I231-V235 WeakPolarHBondContact O-CG2 3.49Å; I231-V235 PolarHBondContact O-N 3.35Å; E232-V235 PolarHBondContact O-N 2.91Å; K233-V235 PolarHBondContact O-N 3.42Å; V235-Q238 PolarHBondContact O-N 3.39Å; V235-K239 HydrophobicContact CG1-CD 4.2Å; V235-K239 WeakPolarHBondContact O-CG 3.26Å; V235-K239 PolarHBondContact O-N 3.05Å; V235-E370 HydrophobicContact CG1-CB 4.19Å; V235-E370 HydrophobicContact CG2-CB 4.35Å; V235-A371 HydrophobicContact CG2-CB 4.04Å
236	A	94.9	Very high	90	Very high	55 Å²	55	66.5 Å²	66.5	46%	0.455	31%	0.313	S	S	.	.	H	α-helix	trans	-63.5	-45	176	0	0	0	0	0	111.8	E232 K233 L234 K239 Q240	E232-A236 VanDerWaalsContact O-CB 3.31Å; E232-A236 WeakPolarHBondContact O-CB 3.28Å; E232-A236 PolarHBondContact O-N 3.03Å; K233-A236 PolarHBondContact O-N 3.32Å; L234-A236 VanDerWaalsContact C-N 3.34Å; L234-A236 PolarHBondContact O-N 2.91Å; A236-K239 PolarHBondContact O-N 2.82Å; A236-Q240 WeakPolarHBondContact O-CB 3.22Å; A236-Q240 PolarHBondContact O-N 3.14Å
237	M	92.3	Very high	89.3	Confident	7 Å²	7	65.5 Å²	65.5	3%	0.034	31%	0.312	C	S	.	.	H	α-helix	trans	-59.3	-47.5	175.9	-73.4	165.9	40.2	0	0	111.7	K233 L234 K239 Q240 C241 F288 Q291 L292	K233-M237 HydrophobicContact CD-SD 4.49Å; K233-M237 HydrophobicContact CG-CG 4.46Å; K233-M237 HydrophobicContact CG-SD 3.89Å; K233-M237 WeakPolarHBondContact O-CB 3.44Å; K233-M237 WeakPolarHBondContact O-CG 3.31Å; K233-M237 PolarHBondContact O-N 3.45Å; L234-M237 HydrophobicContact CD2-CE 4.38Å; L234-M237 PolarHBondContact O-N 3.25Å; M237-K239 VanDerWaalsContact C-N 3.35Å; M237-K239 PolarHBondContact O-N 2.76Å; M237-Q240 PolarHBondContact O-N 3.09Å; M237-C241 PolarHBondContact O-N 3.25Å; M237-C241 PolarHBondContact O-SG 3.03Å; M237-F288 HydrophobicContact CB-CD2 4.08Å; M237-F288 HydrophobicContact CB-CE2 4.07Å; M237-F288 HydrophobicContact CE-CD2 4.02Å; M237-F288 HydrophobicContact CE-CE2 3.95Å; M237-F288 HydrophobicContact CE-CZ 4.48Å; M237-F288 WeakPolarHBondContact CE-O 3.19Å; M237-Q291 VanDerWaalsContact CE-C 3.48Å; M237-Q291 HydrophobicContact CE-CB 3.28Å; M237-Q291 HydrophobicContact CG-CB 4.27Å; M237-Q291 HydrophobicContact SD-CB 3.84Å; M237-L292 HydrophobicContact CE-CD2 4.07Å; M237-L292 HydrophobicContact CE-CG 4.45Å
238	Q	89.8	Confident	88.6	Confident	9 Å²	9	66 Å²	66	4%	0.042	32%	0.316	C	S	.	.	H	α-helix	trans	-60.4	-44.3	178.6	-168.5	-176.6	26.5	0	0	111.4	L234 V235 Q240 C241 N242 F288 E318	L234-Q238 PolarHBondContact O-N 3.44Å; V235-Q238 PolarHBondContact O-N 3.39Å; Q238-Q240 VanDerWaalsContact C-N 3.34Å; Q238-Q240 PolarHBondContact O-N 3.35Å; Q238-C241 PolarHBondContact O-N 3.38Å; Q238-N242 WeakPolarHBondContact O-CB 3.4Å; Q238-N242 PolarHBondContact O-N 3.03Å; Q238-F288 HydrophobicContact CB-CD2 4.43Å; Q238-F288 HydrophobicContact CB-CE2 4.11Å; Q238-E318 PolarHBondContact NE2-OE1 3.41Å
239	K	88.6	Confident	87.9	Confident	128 Å²	128	66.3 Å²	66.3	56%	0.557	31%	0.314	S	S	*	.	H	α-helix	trans	-62.5	-39.6	175.7	-74.8	175.1	180	175.5	0	112.5	V235 A236 M237 K243	V235-K239 HydrophobicContact CG1-CD 4.2Å; V235-K239 WeakPolarHBondContact O-CG 3.26Å; V235-K239 PolarHBondContact O-N 3.05Å; A236-K239 PolarHBondContact O-N 2.82Å; M237-K239 VanDerWaalsContact C-N 3.35Å; M237-K239 PolarHBondContact O-N 2.76Å; K239-K243 PolarHBondContact O-N 2.97Å
240	Q	88.6	Confident	87.3	Confident	89 Å²	89	65.5 Å²	65.5	42%	0.416	32%	0.32	S	S	.	.	H	α-helix	trans	-66	-44.8	178.4	178.6	175.4	-16.6	0	0	111.9	A236 M237 Q238 N242 K243 R244	A236-Q240 WeakPolarHBondContact O-CB 3.22Å; A236-Q240 PolarHBondContact O-N 3.14Å; M237-Q240 PolarHBondContact O-N 3.09Å; Q238-Q240 VanDerWaalsContact C-N 3.34Å; Q238-Q240 PolarHBondContact O-N 3.35Å; Q240-N242 VanDerWaalsContact C-N 3.35Å; Q240-K243 PolarHBondContact O-N 2.89Å; Q240-R244 PolarHBondContact O-N 2.83Å
241	C	84.3	Confident	86.8	Confident	5 Å²	5	70.9 Å²	70.9	3%	0.034	34%	0.343	C	S	.	.	H	α-helix	trans	-61	-45.6	177	-60.3	0	0	0	0	110.6	M237 Q238 K243 R244 S245 E284	M237-C241 PolarHBondContact O-N 3.25Å; M237-C241 PolarHBondContact O-SG 3.03Å; Q238-C241 PolarHBondContact O-N 3.38Å; C241-K243 VanDerWaalsContact C-N 3.3Å; C241-K243 PolarHBondContact O-N 3.49Å; C241-R244 PolarHBondContact O-N 3.41Å; C241-S245 PolarHBondContact O-N 3.47Å; C241-E284 HydrophobicContact CB-CB 4.47Å; C241-E284 HydrophobicContact CB-CG 4.49Å
242	N	81.4	Confident	86.5	Confident	50 Å²	50	71 Å²	71	27%	0.267	34%	0.344	S	S	.	.	H	α-helix	trans	-60.5	-37.2	176.8	-169.4	-95.5	0	0	0	113.2	Q238 Q240 F246	Q238-N242 WeakPolarHBondContact O-CB 3.4Å; Q238-N242 PolarHBondContact O-N 3.03Å; Q240-N242 VanDerWaalsContact C-N 3.35Å; N242-F246 PolarHBondContact O-N 2.99Å
243	K	81.4	Confident	86.3	Confident	159 Å²	159	67.4 Å²	67.4	69%	0.691	33%	0.33	S	S	*	.	H	α-helix	trans	-66.8	-37.9	178.5	-172.2	179	179.6	-178	0	112.2	K239 Q240 C241 F246	K239-K243 PolarHBondContact O-N 2.97Å; Q240-K243 PolarHBondContact O-N 2.89Å; C241-K243 VanDerWaalsContact C-N 3.3Å; C241-K243 PolarHBondContact O-N 3.49Å; K243-F246 WeakPolarHBondContact O-CB 3.2Å; K243-F246 PolarHBondContact O-N 3.43Å
244	R	77.2	Confident	86.2	Confident	117 Å²	117	66.8 Å²	66.8	44%	0.442	34%	0.337	S	S	.	.	H	α-helix	trans	-64	-49	178.8	-73.8	-178.1	179.3	167.3	0.1	111.2	Q240 C241 F246 L247 D287	Q240-R244 PolarHBondContact O-N 2.83Å; C241-R244 PolarHBondContact O-N 3.41Å; R244-F246 PolarHBondContact O-N 2.99Å; R244-L247 VanDerWaalsContact O-CB 3.28Å; R244-L247 WeakPolarHBondContact O-CB 3.45Å; R244-L247 PolarHBondContact O-N 3.23Å; R244-D287 IonicContact NH1-OD2 2.68Å; R244-D287 PolarHBondContact NH1-OD2 3.01Å
245	S	75.5	Confident	86	Confident	9 Å²	9	69.7 Å²	69.7	6%	0.063	35%	0.348	C	S	.	.	H	α-helix	trans	-62.6	-27	179.6	-63	0	0	0	0	114.2	C241 L247 D248 R249 M280 E284	C241-S245 PolarHBondContact O-N 3.47Å; S245-L247 PolarHBondContact O-N 3.27Å; S245-D248 PolarHBondContact O-N 3.26Å; S245-R249 PolarHBondContact O-N 3.18Å; S245-M280 WeakPolarHBondContact O-CE 3.5Å; S245-E284 WeakPolarHBondContact CB-OE1 3.43Å; S245-E284 WeakPolarHBondContact OG-CG 3.37Å; S245-E284 PolarHBondContact OG-OE1 3.18Å
246	F	77.8	Confident	85.8	Confident	83 Å²	83	69.1 Å²	69.1	36%	0.364	34%	0.344	S	S	.	.	H	α-helix	trans	-61.9	-31.4	172.7	-171.7	-99.2	0	0	0	112.6	N242 K243 R244 D248 R249 K334	N242-F246 PolarHBondContact O-N 2.99Å; K243-F246 WeakPolarHBondContact O-CB 3.2Å; K243-F246 PolarHBondContact O-N 3.43Å; R244-F246 PolarHBondContact O-N 2.99Å; F246-D248 VanDerWaalsContact C-N 3.31Å; F246-R249 VanDerWaalsContact O-CB 3.26Å; F246-R249 WeakPolarHBondContact O-CB 3.32Å; F246-R249 PolarHBondContact O-N 3.12Å; F246-K334 HydrophobicContact CD2-CD 4.46Å; F246-K334 HydrophobicContact CE2-CD 4.38Å
247	L	77.9	Confident	85.4	Confident	129 Å²	129	75.7 Å²	75.7	68%	0.675	37%	0.366	S	S	*	.	H	α-helix	trans	-71.4	-28.1	177.2	-58.4	175	0	0	0	112.4	R244 S245 R249 P250	R244-L247 VanDerWaalsContact O-CB 3.28Å; R244-L247 WeakPolarHBondContact O-CB 3.45Å; R244-L247 PolarHBondContact O-N 3.23Å; S245-L247 PolarHBondContact O-N 3.27Å; L247-R249 VanDerWaalsContact C-N 3.3Å; L247-P250 VanDerWaalsContact O-CD 3.24Å; L247-P250 WeakPolarHBondContact O-CD 3.35Å
248	D	79.5	Confident	85	Confident	48 Å²	48	78.1 Å²	78.1	26%	0.257	38%	0.383	S	S	.	.	H	α-helix	trans	-85.1	-3.5	179.8	-71	-41.4	0	0	0	113.3	S245 F246 P250 K251 M280	S245-D248 PolarHBondContact O-N 3.26Å; F246-D248 VanDerWaalsContact C-N 3.31Å; D248-P250 VanDerWaalsContact C-N 3.33Å; D248-K251 HydrophobicContact CB-CD 4.24Å; D248-K251 VanDerWaalsContact O-CB 3.25Å; D248-K251 WeakPolarHBondContact O-CB 3.49Å; D248-K251 PolarHBondContact O-N 2.93Å; D248-K251 VanDerWaalsContact OD1-CE 3.3Å; D248-K251 WeakPolarHBondContact OD1-CE 3.29Å; D248-K251 IonicContact OD1-NZ 3.32Å; D248-K251 PolarHBondContact OD1-NZ 3.16Å; D248-M280 HydrophobicContact CB-CE 3.59Å
249	R	81.3	Confident	84.6	Confident	74 Å²	74	85.7 Å²	85.7	28%	0.279	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-47.1	-43.8	176.7	177.3	-173.6	172.7	-173.8	5.3	114.6	S245 F246 L247 K251 V252 L333 D335 F336	S245-R249 PolarHBondContact O-N 3.18Å; F246-R249 VanDerWaalsContact O-CB 3.26Å; F246-R249 WeakPolarHBondContact O-CB 3.32Å; F246-R249 PolarHBondContact O-N 3.12Å; L247-R249 VanDerWaalsContact C-N 3.3Å; R249-K251 PolarHBondContact O-N 3.32Å; R249-K251 VanDerWaalsContact O-N 3.16Å; R249-V252 PolarHBondContact O-N 3.18Å; R249-L333 HydrophobicContact CB-CD1 4.15Å; R249-L333 HydrophobicContact CG-CD1 4.24Å; R249-D335 IonicContact CZ-OD2 2.62Å; R249-D335 IonicContact NH1-OD2 2.71Å; R249-D335 PolarHBondContact NH1-OD2 2.9Å; R249-D335 VanDerWaalsContact NH2-CB 3.32Å; R249-D335 IonicContact NH2-OD2 2.69Å; R249-D335 PolarHBondContact NH2-OD2 2.77Å; R249-F336 HydrophobicContact CG-CE2 3.98Å; R249-F336 HydrophobicContact CG-CZ 4.32Å
250	P	83.7	Confident	84.4	Confident	117 Å²	117	83.4 Å²	83.4	76%	0.76	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-65.9	-15	-179.4	-20.8	34.6	0	0	0	114	L247 D248 V252	L247-P250 VanDerWaalsContact O-CD 3.24Å; L247-P250 WeakPolarHBondContact O-CD 3.35Å; D248-P250 VanDerWaalsContact C-N 3.33Å; P250-V252 VanDerWaalsContact C-N 3.33Å
251	K	85.8	Confident	83.7	Confident	157 Å²	157	83.5 Å²	83.5	68%	0.683	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-81.2	-14.4	178.6	-57.2	175.2	178.4	169.5	0	112.5	D248 R249	D248-K251 HydrophobicContact CB-CD 4.24Å; D248-K251 VanDerWaalsContact O-CB 3.25Å; D248-K251 WeakPolarHBondContact O-CB 3.49Å; D248-K251 PolarHBondContact O-N 2.93Å; D248-K251 VanDerWaalsContact OD1-CE 3.3Å; D248-K251 WeakPolarHBondContact OD1-CE 3.29Å; D248-K251 IonicContact OD1-NZ 3.32Å; D248-K251 PolarHBondContact OD1-NZ 3.16Å; R249-K251 PolarHBondContact O-N 3.32Å; R249-K251 VanDerWaalsContact O-N 3.16Å
252	V	91.3	Very high	83.4	Confident	11 Å²	11	91 Å²	91	7%	0.067	45%	0.45	C	S	.	.	S	Bend	trans	-76.2	128.9	-178.6	-175.1	0	0	0	0	110.4	R249 P250 H273 E276 L277 M280 L333	R249-V252 PolarHBondContact O-N 3.18Å; P250-V252 VanDerWaalsContact C-N 3.33Å; V252-H273 WeakPolarHBondContact CG1-ND1 3.47Å; V252-E276 VanDerWaalsContact CA-OE2 3.3Å; V252-E276 WeakPolarHBondContact CA-OE2 3.45Å; V252-E276 HydrophobicContact CG1-CB 4.36Å; V252-L277 HydrophobicContact CG1-CD2 4.08Å; V252-L277 HydrophobicContact CG1-CG 4.23Å; V252-L277 HydrophobicContact CG2-CD2 4.14Å; V252-M280 HydrophobicContact CG2-SD 3.44Å; V252-M280 WeakPolarHBondContact CG2-SD 3.13Å; V252-L333 HydrophobicContact CG2-CD1 4.12Å
253	T	92.8	Very high	83.7	Confident	36 Å²	36	91 Å²	91	22%	0.221	45%	0.45	C	S	.	.			trans	-45.7	122	172.9	-76.1	0	0	0	0	109.4	Q269 A272 H273 E276	T253-Q269 HydrophobicContact CG2-CG 3.75Å; T253-A272 HydrophobicContact CG2-CB 4.38Å; T253-H273 PolarHBondContact O-ND1 3.4Å; T253-E276 WeakPolarHBondContact CB-OE2 3.49Å; T253-E276 PolarHBondContact N-OE2 2.85Å; T253-E276 VanDerWaalsContact OG1-CD 3.3Å; T253-E276 PolarHBondContact OG1-OE1 2.86Å; T253-E276 PolarHBondContact OG1-OE2 3.2Å
254	P	92.4	Very high	84	Confident	96 Å²	96	93 Å²	93	62%	0.623	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-61.5	143.6	-177	-25.3	34	0	0	0	112.6	Q269	P254-Q269 PolarHBondContact O-NE2 2.64Å
255	W	92.5	Very high	84.6	Confident	63 Å²	63	93.6 Å²	93.6	24%	0.239	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-65.9	129.6	172.1	-173.7	-104.1	0	0	0	110.7	R270 H273 F274 Y338 D342	W255-R270 HydrophobicContact CD2-CG 4.46Å; W255-R270 VanDerWaalsContact CE2-NH1 3.3Å; W255-R270 HydrophobicContact CE3-CB 4.4Å; W255-R270 HydrophobicContact CE3-CG 4.11Å; W255-R270 HydrophobicContact CH2-CB 4.14Å; W255-R270 HydrophobicContact CH2-CG 3.88Å; W255-R270 HydrophobicContact CZ2-CG 4.27Å; W255-R270 HydrophobicContact CZ3-CB 3.8Å; W255-R270 HydrophobicContact CZ3-CG 3.78Å; W255-H273 HydrophobicContact CE3-CB 4.35Å; W255-H273 AromaticContact CE3-CD2 3.8Å; W255-F274 AromaticContact CH2-CE2 3.72Å; W255-F274 HydrophobicContact CH2-CE2 3.72Å; W255-F274 AromaticContact CH2-CZ 3.97Å; W255-F274 HydrophobicContact CH2-CZ 3.97Å; W255-F274 HydrophobicContact CZ3-CD2 4.17Å; W255-F274 AromaticContact CZ3-CE2 3.54Å; W255-F274 HydrophobicContact CZ3-CE2 3.54Å; W255-F274 AromaticContact CZ3-CZ 3.86Å; W255-F274 HydrophobicContact CZ3-CZ 3.86Å; W255-Y338 AromaticContact CD2-CE1 3.77Å; W255-Y338 HydrophobicContact CD2-CE1 3.77Å; W255-Y338 AromaticContact CE2-CE1 3.89Å; W255-Y338 AromaticContact CE3-CE1 3.8Å; W255-Y338 HydrophobicContact CE3-CE1 3.8Å; W255-Y338 HydrophobicContact CG-CE1 4.31Å; W255-Y338 HydrophobicContact CH2-CD1 4.12Å; W255-Y338 HydrophobicContact CH2-CE1 4.06Å; W255-Y338 HydrophobicContact CZ2-CD1 4.11Å; W255-Y338 AromaticContact CZ2-CE1 4Å; W255-Y338 HydrophobicContact CZ2-CE1 4Å; W255-Y338 HydrophobicContact CZ3-CD1 4.39Å; W255-Y338 AromaticContact CZ3-CE1 3.97Å; W255-Y338 HydrophobicContact CZ3-CE1 3.97Å; W255-D342 HydrophobicContact CH2-CB 3.97Å; W255-D342 HydrophobicContact CZ2-CB 3.85Å
256	P	92.5	Very high	85.4	Confident	9 Å²	9	93.8 Å²	93.8	6%	0.058	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-70.1	134.3	-178.2	25.7	-31.5	0	0	0	111.8	S258 V266 Q269 R270	P256-S258 VanDerWaalsContact C-N 3.33Å; P256-V266 HydrophobicContact CB-CG1 4.1Å; P256-V266 HydrophobicContact CG-CG1 3.88Å; P256-Q269 HydrophobicContact CG-CB 4.4Å; P256-Q269 HydrophobicContact CG-CG 4.41Å; P256-R270 HydrophobicContact CG-CG 3.52Å
257	Q	86.7	Confident	86	Confident	194 Å²	194	94.7 Å²	94.7	91%	0.907	46%	0.463	S	S	*	.			trans	-73.3	-25.7	175.8	-65.7	-179.1	-6.9	0	0	112.8	Q259	Q257-Q259 PolarHBondContact O-N 3.04Å
258	S	85.3	Confident	86.7	Confident	57 Å²	57	93 Å²	93	40%	0.399	45%	0.451	S	S	.	.			trans	-64.9	129.9	177.5	-179.3	0	0	0	0	111.1	P256 D260 R270	P256-S258 VanDerWaalsContact C-N 3.33Å; S258-D260 PolarHBondContact OG-N 3.39Å; S258-R270 PolarHBondContact O-NH2 3.25Å
259	Q	81.4	Confident	87.4	Confident	168 Å²	168	94.2 Å²	94.2	79%	0.785	46%	0.455	S	S	*	.			trans	-92.4	3	175.8	-62.3	-169.6	-0.5	0	0	113.2	Q257 L261	Q257-Q259 PolarHBondContact O-N 3.04Å; Q259-L261 PolarHBondContact O-N 3.19Å
260	D	83.5	Confident	88	Confident	80 Å²	80	91 Å²	91	43%	0.428	44%	0.443	S	S	.	.			trans	-65.4	109.3	179.2	-175.3	-1.7	0	0	0	111	S258 Q262 N263	S258-D260 PolarHBondContact OG-N 3.39Å; D260-Q262 VanDerWaalsContact C-N 3.34Å; D260-Q262 PolarHBondContact OD1-N 3.31Å; D260-N263 HydrophobicContact CB-CB 4.05Å; D260-N263 PolarHBondContact OD1-N 3.31Å
261	L	73.1	Confident	88.5	Confident	91 Å²	91	86 Å²	86	48%	0.476	41%	0.41	S	S	.	.	S	Bend	trans	-78.4	-19.1	-177.3	-59.1	-176.2	0	0	0	113.3	Q259 R267 K345	Q259-L261 PolarHBondContact O-N 3.19Å; L261-R267 PolarHBondContact O-NH2 2.61Å; L261-K345 HydrophobicContact CD2-CB 4.39Å; L261-K345 HydrophobicContact CD2-CD 3.93Å; L261-K345 HydrophobicContact CD2-CG 3.58Å
262	Q	78.6	Confident	88.9	Confident	163 Å²	163	79.9 Å²	79.9	76%	0.762	39%	0.388	S	S	*	.	S	Bend	trans	-87.8	-15.6	179.9	-58.7	-57.2	-20.9	0	0	111.9	D260 R264	D260-Q262 VanDerWaalsContact C-N 3.34Å; D260-Q262 PolarHBondContact OD1-N 3.31Å; Q262-R264 PolarHBondContact O-N 3.44Å
263	N	87.6	Confident	89.1	Confident	51 Å²	51	79.4 Å²	79.4	27%	0.273	39%	0.386	S	S	.	.			trans	-71.9	113.9	176.4	-172.2	-55.2	0	0	0	111	D260 E265 V266 R267	D260-N263 HydrophobicContact CB-CB 4.05Å; D260-N263 PolarHBondContact OD1-N 3.31Å; N263-E265 VanDerWaalsContact C-N 3.33Å; N263-E265 PolarHBondContact O-N 3.44Å; N263-E265 WeakPolarHBondContact OD1-CA 3.46Å; N263-E265 WeakPolarHBondContact OD1-CB 3.45Å; N263-E265 PolarHBondContact OD1-N 2.91Å; N263-E265 PolarHBondContact OD1-OE2 2.6Å; N263-V266 HydrophobicContact CB-CB 4.03Å; N263-V266 HydrophobicContact CB-CG2 3.88Å; N263-V266 PolarHBondContact O-N 3.49Å; N263-V266 WeakPolarHBondContact OD1-CG2 3.41Å; N263-V266 PolarHBondContact OD1-N 2.91Å; N263-R267 PolarHBondContact O-N 2.86Å
264	R	87.5	Confident	89.3	Confident	200 Å²	200	78.8 Å²	78.8	76%	0.755	38%	0.38	S	S	*	.	H	α-helix	trans	-66.1	-37.6	-176.9	-175.1	-179.4	176.7	-173.3	-0.4	111.4	Q262 R267 Q268	Q262-R264 PolarHBondContact O-N 3.44Å; R264-R267 PolarHBondContact O-N 2.9Å; R264-Q268 WeakPolarHBondContact O-CB 3.28Å; R264-Q268 PolarHBondContact O-N 3.01Å
265	E	89.8	Confident	89.4	Confident	129 Å²	129	74.8 Å²	74.8	60%	0.603	35%	0.353	S	S	*	.	H	α-helix	trans	-66.8	-42.7	-179.4	-62.4	66.9	-146.1	0	0	110.8	N263 R267 Q268 Q269	N263-E265 VanDerWaalsContact C-N 3.33Å; N263-E265 PolarHBondContact O-N 3.44Å; N263-E265 WeakPolarHBondContact OD1-CA 3.46Å; N263-E265 WeakPolarHBondContact OD1-CB 3.45Å; N263-E265 PolarHBondContact OD1-N 2.91Å; N263-E265 PolarHBondContact OD1-OE2 2.6Å; E265-R267 PolarHBondContact O-N 3.41Å; E265-Q268 PolarHBondContact O-N 2.92Å; E265-Q269 WeakPolarHBondContact O-CB 3.2Å; E265-Q269 PolarHBondContact O-N 2.88Å
266	V	91.8	Very high	89.5	Confident	14 Å²	14	74.4 Å²	74.4	9%	0.085	35%	0.354	C	S	.	.	H	α-helix	trans	-61.5	-44.2	175.1	171.1	0	0	0	0	111	P256 N263 Q269 R270	P256-V266 HydrophobicContact CB-CG1 4.1Å; P256-V266 HydrophobicContact CG-CG1 3.88Å; N263-V266 HydrophobicContact CB-CB 4.03Å; N263-V266 HydrophobicContact CB-CG2 3.88Å; N263-V266 PolarHBondContact O-N 3.49Å; N263-V266 WeakPolarHBondContact OD1-CG2 3.41Å; N263-V266 PolarHBondContact OD1-N 2.91Å; V266-Q269 PolarHBondContact O-N 3.14Å; V266-R270 WeakPolarHBondContact O-CG 3.27Å; V266-R270 PolarHBondContact O-N 2.86Å; V266-R270 VanDerWaalsContact O-N 3.08Å
267	R	90.8	Very high	89.5	Confident	102 Å²	102	74.5 Å²	74.5	39%	0.385	35%	0.354	S	S	.	.	H	α-helix	trans	-62.6	-42.9	175.6	-173.8	-179.7	-56.9	165.8	5.9	111.6	L261 N263 R264 E265 Q269 R270 F271 K345	L261-R267 PolarHBondContact O-NH2 2.61Å; N263-R267 PolarHBondContact O-N 2.86Å; R264-R267 PolarHBondContact O-N 2.9Å; E265-R267 PolarHBondContact O-N 3.41Å; R267-Q269 VanDerWaalsContact C-N 3.33Å; R267-Q269 PolarHBondContact O-N 2.92Å; R267-R270 PolarHBondContact O-N 2.98Å; R267-F271 PolarHBondContact O-N 3.14Å; R267-K345 WeakPolarHBondContact CG-O 3.44Å
268	Q	92	Very high	89.9	Confident	92 Å²	92	65.9 Å²	65.9	43%	0.43	32%	0.316	S	S	.	.	H	α-helix	trans	-63.2	-39.5	177.9	-172.6	61.4	43.2	0	0	111.7	R264 E265 F271 A272	R264-Q268 WeakPolarHBondContact O-CB 3.28Å; R264-Q268 PolarHBondContact O-N 3.01Å; E265-Q268 PolarHBondContact O-N 2.92Å; Q268-F271 PolarHBondContact O-N 3.46Å; Q268-A272 WeakPolarHBondContact O-CB 3.21Å; Q268-A272 PolarHBondContact O-N 3.11Å
269	Q	94.4	Very high	90.4	Very high	74 Å²	74	64.8 Å²	64.8	35%	0.346	31%	0.305	S	S	.	.	H	α-helix	trans	-65.5	-41.6	176.2	-172.1	176.8	-2.1	0	0	112.2	T253 P254 P256 E265 V266 R267 F271 A272 H273	T253-Q269 HydrophobicContact CG2-CG 3.75Å; P254-Q269 PolarHBondContact O-NE2 2.64Å; P256-Q269 HydrophobicContact CG-CB 4.4Å; P256-Q269 HydrophobicContact CG-CG 4.41Å; E265-Q269 WeakPolarHBondContact O-CB 3.2Å; E265-Q269 PolarHBondContact O-N 2.88Å; V266-Q269 PolarHBondContact O-N 3.14Å; R267-Q269 VanDerWaalsContact C-N 3.33Å; R267-Q269 PolarHBondContact O-N 2.92Å; Q269-F271 VanDerWaalsContact C-N 3.31Å; Q269-F271 PolarHBondContact O-N 3.11Å; Q269-A272 PolarHBondContact O-N 3.42Å; Q269-H273 WeakPolarHBondContact O-CB 3.25Å; Q269-H273 PolarHBondContact O-N 3.1Å
270	R	94.9	Very high	90.9	Very high	8 Å²	8	57.4 Å²	57.4	3%	0.03	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-41.3	173.6	-67.2	170.6	-171.4	-97.6	-3.4	111.6	W255 P256 S258 V266 R267 H273 F274 K345 A346	W255-R270 HydrophobicContact CD2-CG 4.46Å; W255-R270 VanDerWaalsContact CE2-NH1 3.3Å; W255-R270 HydrophobicContact CE3-CB 4.4Å; W255-R270 HydrophobicContact CE3-CG 4.11Å; W255-R270 HydrophobicContact CH2-CB 4.14Å; W255-R270 HydrophobicContact CH2-CG 3.88Å; W255-R270 HydrophobicContact CZ2-CG 4.27Å; W255-R270 HydrophobicContact CZ3-CB 3.8Å; W255-R270 HydrophobicContact CZ3-CG 3.78Å; P256-R270 HydrophobicContact CG-CG 3.52Å; S258-R270 PolarHBondContact O-NH2 3.25Å; V266-R270 WeakPolarHBondContact O-CG 3.27Å; V266-R270 PolarHBondContact O-N 2.86Å; V266-R270 VanDerWaalsContact O-N 3.08Å; R267-R270 PolarHBondContact O-N 2.98Å; R270-H273 WeakPolarHBondContact O-CB 3.48Å; R270-H273 PolarHBondContact O-N 3.17Å; R270-F274 WeakPolarHBondContact O-CD2 3.38Å; R270-F274 PolarHBondContact O-N 3.36Å; R270-F274 VanDerWaalsContact O-N 3.14Å; R270-K345 WeakPolarHBondContact CD-O 3.38Å; R270-A346 HydrophobicContact CB-CB 3.9Å
271	F	94.4	Very high	91.4	Very high	11 Å²	11	54.1 Å²	54.1	5%	0.048	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-46.7	175.8	-176.2	-102.3	0	0	0	111.6	R267 Q268 Q269 H273 F274 T275 L348 L445 K450 L452	R267-F271 PolarHBondContact O-N 3.14Å; Q268-F271 PolarHBondContact O-N 3.46Å; Q269-F271 VanDerWaalsContact C-N 3.31Å; Q269-F271 PolarHBondContact O-N 3.11Å; F271-H273 VanDerWaalsContact C-N 3.34Å; F271-H273 PolarHBondContact O-N 3.38Å; F271-F274 PolarHBondContact O-N 3.34Å; F271-T275 WeakPolarHBondContact O-CB 3.39Å; F271-T275 PolarHBondContact O-N 3.4Å; F271-T275 PolarHBondContact O-OG1 3.49Å; F271-L348 HydrophobicContact CE2-CD2 4.47Å; F271-L445 HydrophobicContact CE2-CD1 3.97Å; F271-L445 HydrophobicContact CE2-CD2 3.66Å; F271-L445 HydrophobicContact CE2-CG 4.49Å; F271-L445 HydrophobicContact CZ-CD1 4.01Å; F271-L445 HydrophobicContact CZ-CD2 3.99Å; F271-K450 HydrophobicContact CE1-CD 4.46Å; F271-K450 HydrophobicContact CE2-CD 4.49Å; F271-K450 HydrophobicContact CZ-CD 4.36Å; F271-L452 HydrophobicContact CE1-CD2 4.37Å; F271-L452 HydrophobicContact CZ-CD2 3.85Å
272	A	94.5	Very high	92.4	Very high	29 Å²	29	49.8 Å²	49.8	24%	0.24	23%	0.232	C	C	.	.	H	α-helix	trans	-57.7	-45.7	175.2	0	0	0	0	0	111.7	T253 Q268 Q269 F274 T275 E276	T253-A272 HydrophobicContact CG2-CB 4.38Å; Q268-A272 WeakPolarHBondContact O-CB 3.21Å; Q268-A272 PolarHBondContact O-N 3.11Å; Q269-A272 PolarHBondContact O-N 3.42Å; A272-F274 PolarHBondContact O-N 2.92Å; A272-T275 PolarHBondContact O-N 2.92Å; A272-T275 VanDerWaalsContact O-N 3.15Å; A272-E276 WeakPolarHBondContact O-CG 3.48Å; A272-E276 PolarHBondContact O-N 3.41Å
273	H	95	Very high	93.1	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-52.8	-53.4	175.2	178.4	82.7	0	0	0	112.4	V252 T253 W255 Q269 R270 F271 T275 E276 L277 Y338	V252-H273 WeakPolarHBondContact CG1-ND1 3.47Å; T253-H273 PolarHBondContact O-ND1 3.4Å; W255-H273 HydrophobicContact CE3-CB 4.35Å; W255-H273 AromaticContact CE3-CD2 3.8Å; Q269-H273 WeakPolarHBondContact O-CB 3.25Å; Q269-H273 PolarHBondContact O-N 3.1Å; R270-H273 WeakPolarHBondContact O-CB 3.48Å; R270-H273 PolarHBondContact O-N 3.17Å; F271-H273 VanDerWaalsContact C-N 3.34Å; F271-H273 PolarHBondContact O-N 3.38Å; H273-T275 VanDerWaalsContact C-N 3.3Å; H273-T275 PolarHBondContact O-N 3.27Å; H273-E276 PolarHBondContact O-N 2.97Å; H273-L277 VanDerWaalsContact NE2-CD1 3.32Å; H273-L277 WeakPolarHBondContact NE2-CD1 3.2Å; H273-L277 WeakPolarHBondContact O-CG 3.48Å; H273-L277 PolarHBondContact O-N 3.03Å; H273-L277 VanDerWaalsContact O-N 3.1Å; H273-Y338 AromaticContact CD2-CZ 3.94Å; H273-Y338 PolarHBondContact CD2-OH 2.72Å; H273-Y338 PolarHBondContact CE1-OH 2.78Å; H273-Y338 AromaticContact NE2-CE2 3.62Å; H273-Y338 AromaticContact NE2-CZ 3.43Å; H273-Y338 PolarHBondContact NE2-OH 3.49Å
274	F	95.8	Very high	93.4	Very high	23 Å²	23	44.2 Å²	44.2	10%	0.101	20%	0.204	C	C	.	.	H	α-helix	trans	-65.9	-34	179	-77.9	-57.7	0	0	0	113.2	W255 R270 F271 A272 L277 A278 Y338 F343 A346	W255-F274 AromaticContact CH2-CE2 3.72Å; W255-F274 HydrophobicContact CH2-CE2 3.72Å; W255-F274 AromaticContact CH2-CZ 3.97Å; W255-F274 HydrophobicContact CH2-CZ 3.97Å; W255-F274 HydrophobicContact CZ3-CD2 4.17Å; W255-F274 AromaticContact CZ3-CE2 3.54Å; W255-F274 HydrophobicContact CZ3-CE2 3.54Å; W255-F274 AromaticContact CZ3-CZ 3.86Å; W255-F274 HydrophobicContact CZ3-CZ 3.86Å; R270-F274 WeakPolarHBondContact O-CD2 3.38Å; R270-F274 PolarHBondContact O-N 3.36Å; R270-F274 VanDerWaalsContact O-N 3.14Å; F271-F274 PolarHBondContact O-N 3.34Å; A272-F274 PolarHBondContact O-N 2.92Å; F274-L277 HydrophobicContact CD1-CD1 4.29Å; F274-L277 PolarHBondContact O-N 2.87Å; F274-A278 WeakPolarHBondContact O-CB 3.05Å; F274-A278 PolarHBondContact O-N 3.18Å; F274-Y338 AromaticContact CE1-CD2 3.48Å; F274-Y338 HydrophobicContact CE1-CD2 3.48Å; F274-Y338 VanDerWaalsContact CE1-CD2 3.48Å; F274-Y338 AromaticContact CE1-CE2 3.83Å; F274-Y338 HydrophobicContact CE1-CE2 3.83Å; F274-Y338 AromaticContact CE1-CG 3.91Å; F274-Y338 HydrophobicContact CE1-CG 3.91Å; F274-Y338 HydrophobicContact CZ-CD1 4.21Å; F274-Y338 AromaticContact CZ-CD2 3.87Å; F274-Y338 HydrophobicContact CZ-CD2 3.87Å; F274-Y338 HydrophobicContact CZ-CE2 4.3Å; F274-Y338 AromaticContact CZ-CG 3.8Å; F274-Y338 HydrophobicContact CZ-CG 3.8Å; F274-F343 HydrophobicContact CD1-CD1 4.39Å; F274-F343 HydrophobicContact CD1-CE1 4.03Å; F274-F343 AromaticContact CE1-CD1 3.93Å; F274-F343 HydrophobicContact CE1-CD1 3.93Å; F274-F343 AromaticContact CE1-CE1 3.57Å; F274-F343 HydrophobicContact CE1-CE1 3.57Å; F274-F343 HydrophobicContact CE1-CZ 4.06Å; F274-F343 HydrophobicContact CE2-CD1 4.15Å; F274-F343 AromaticContact CZ-CD1 3.8Å; F274-F343 HydrophobicContact CZ-CD1 3.8Å; F274-F343 AromaticContact CZ-CE1 3.91Å; F274-F343 HydrophobicContact CZ-CE1 3.91Å; F274-F343 HydrophobicContact CZ-CG 4.23Å; F274-F343 HydrophobicContact CZ-CZ 4.4Å; F274-A346 HydrophobicContact CD2-CB 3.53Å; F274-A346 HydrophobicContact CE2-CB 3.76Å
275	T	95	Very high	93.7	Very high	11 Å²	11	35.1 Å²	35.1	7%	0.067	17%	0.17	C	C	.	.	H	α-helix	trans	-68.9	-37.7	-179.8	-53.5	0	0	0	0	111.4	F271 A272 H273 A278 I279 L452 P453 L456	F271-T275 WeakPolarHBondContact O-CB 3.39Å; F271-T275 PolarHBondContact O-N 3.4Å; F271-T275 PolarHBondContact O-OG1 3.49Å; A272-T275 PolarHBondContact O-N 2.92Å; A272-T275 VanDerWaalsContact O-N 3.15Å; H273-T275 VanDerWaalsContact C-N 3.3Å; H273-T275 PolarHBondContact O-N 3.27Å; T275-A278 WeakPolarHBondContact O-CB 3.41Å; T275-A278 PolarHBondContact O-N 2.91Å; T275-I279 WeakPolarHBondContact O-CG1 3.44Å; T275-I279 PolarHBondContact O-N 2.85Å; T275-L452 HydrophobicContact CG2-CD2 4.38Å; T275-P453 HydrophobicContact CG2-CG 3.42Å; T275-P453 VanDerWaalsContact CG2-CG 3.42Å; T275-L456 HydrophobicContact CG2-CD1 3.38Å
276	E	94.2	Very high	94	Very high	55 Å²	55	29.4 Å²	29.4	26%	0.257	14%	0.144	S	C	.	.	H	α-helix	trans	-69.7	-39.3	173.6	-71.4	171.8	-160.3	0	0	112.3	V252 T253 A272 H273 A278 I279 M280	V252-E276 VanDerWaalsContact CA-OE2 3.3Å; V252-E276 WeakPolarHBondContact CA-OE2 3.45Å; V252-E276 HydrophobicContact CG1-CB 4.36Å; T253-E276 WeakPolarHBondContact CB-OE2 3.49Å; T253-E276 PolarHBondContact N-OE2 2.85Å; T253-E276 VanDerWaalsContact OG1-CD 3.3Å; T253-E276 PolarHBondContact OG1-OE1 2.86Å; T253-E276 PolarHBondContact OG1-OE2 3.2Å; A272-E276 WeakPolarHBondContact O-CG 3.48Å; A272-E276 PolarHBondContact O-N 3.41Å; H273-E276 PolarHBondContact O-N 2.97Å; E276-A278 VanDerWaalsContact C-N 3.26Å; E276-A278 PolarHBondContact O-N 3.4Å; E276-I279 WeakPolarHBondContact O-CB 3.37Å; E276-I279 PolarHBondContact O-N 3.32Å; E276-M280 WeakPolarHBondContact O-CG 3.42Å; E276-M280 PolarHBondContact O-N 2.74Å
277	L	94.1	Very high	94.1	Very high	12 Å²	12	31.4 Å²	31.4	6%	0.063	16%	0.155	C	C	.	.	H	α-helix	trans	-59.7	-38.1	169.9	-69.4	-179.9	0	0	0	111.9	V252 H273 F274 M280 S281 F332 L333 Y338	V252-L277 HydrophobicContact CG1-CD2 4.08Å; V252-L277 HydrophobicContact CG1-CG 4.23Å; V252-L277 HydrophobicContact CG2-CD2 4.14Å; H273-L277 VanDerWaalsContact NE2-CD1 3.32Å; H273-L277 WeakPolarHBondContact NE2-CD1 3.2Å; H273-L277 WeakPolarHBondContact O-CG 3.48Å; H273-L277 PolarHBondContact O-N 3.03Å; H273-L277 VanDerWaalsContact O-N 3.1Å; F274-L277 HydrophobicContact CD1-CD1 4.29Å; F274-L277 PolarHBondContact O-N 2.87Å; L277-M280 PolarHBondContact O-N 3.19Å; L277-S281 PolarHBondContact O-N 2.88Å; L277-F332 HydrophobicContact CD1-CB 3.94Å; L277-F332 HydrophobicContact CD1-CD1 4.36Å; L277-F332 HydrophobicContact CD1-CD2 4.44Å; L277-F332 HydrophobicContact CD1-CG 4.01Å; L277-F332 HydrophobicContact CD2-CB 4.43Å; L277-L333 HydrophobicContact CD2-CD1 3.54Å; L277-L333 HydrophobicContact CD2-CG 4.02Å; L277-Y338 HydrophobicContact CD1-CE2 4.24Å
278	A	95.3	Very high	94.4	Very high	13 Å²	13	27 Å²	27	11%	0.107	14%	0.138	C	C	.	.	H	α-helix	trans	-65.1	-44.7	175.3	0	0	0	0	0	111.7	F274 T275 E276 M280 S281 V282 M315 L456 W460	F274-A278 WeakPolarHBondContact O-CB 3.05Å; F274-A278 PolarHBondContact O-N 3.18Å; T275-A278 WeakPolarHBondContact O-CB 3.41Å; T275-A278 PolarHBondContact O-N 2.91Å; E276-A278 VanDerWaalsContact C-N 3.26Å; E276-A278 PolarHBondContact O-N 3.4Å; A278-M280 VanDerWaalsContact C-N 3.31Å; A278-M280 PolarHBondContact O-N 3.24Å; A278-S281 WeakPolarHBondContact O-CB 3.31Å; A278-S281 PolarHBondContact O-N 3.5Å; A278-S281 VanDerWaalsContact O-N 3.12Å; A278-V282 WeakPolarHBondContact O-CG2 3.26Å; A278-V282 PolarHBondContact O-N 2.9Å; A278-M315 HydrophobicContact CB-CE 3.71Å; A278-L456 HydrophobicContact CB-CD1 4.02Å; A278-L456 HydrophobicContact CB-CD2 4.34Å; A278-W460 HydrophobicContact CB-CH2 4.43Å
279	I	93.9	Very high	94.6	Very high	33 Å²	33	22.7 Å²	22.7	17%	0.169	12%	0.118	C	C	.	.	H	α-helix	trans	-54.5	-47.7	174.6	-73.5	159.9	0	0	0	111.1	T275 E276 S281 V282 Q283 P453 L455 L456	T275-I279 WeakPolarHBondContact O-CG1 3.44Å; T275-I279 PolarHBondContact O-N 2.85Å; E276-I279 WeakPolarHBondContact O-CB 3.37Å; E276-I279 PolarHBondContact O-N 3.32Å; I279-S281 VanDerWaalsContact C-N 3.33Å; I279-S281 PolarHBondContact O-N 3.49Å; I279-V282 WeakPolarHBondContact O-CB 3.28Å; I279-V282 PolarHBondContact O-N 2.93Å; I279-Q283 WeakPolarHBondContact O-CG 3.35Å; I279-Q283 PolarHBondContact O-N 3.08Å; I279-P453 HydrophobicContact CD1-CB 3.74Å; I279-P453 HydrophobicContact CD1-CG 3.89Å; I279-L455 HydrophobicContact CB-CD2 4.46Å; I279-L455 HydrophobicContact CG1-CD2 4.44Å; I279-L455 HydrophobicContact CG2-CD2 3.93Å; I279-L456 HydrophobicContact CG1-CD1 4.13Å; I279-L456 HydrophobicContact CG1-CD2 4.35Å; I279-L456 HydrophobicContact CG1-CG 3.97Å
280	M	92	Very high	94.6	Very high	14 Å²	14	24 Å²	24	7%	0.069	12%	0.123	C	C	.	.	H	α-helix	trans	-61.2	-43.8	177.9	-65.4	176.5	67.6	0	0	111.3	S245 D248 V252 E276 L277 A278 V282 Q283 E284 L333	S245-M280 WeakPolarHBondContact O-CE 3.5Å; D248-M280 HydrophobicContact CB-CE 3.59Å; V252-M280 HydrophobicContact CG2-SD 3.44Å; V252-M280 WeakPolarHBondContact CG2-SD 3.13Å; E276-M280 WeakPolarHBondContact O-CG 3.42Å; E276-M280 PolarHBondContact O-N 2.74Å; L277-M280 PolarHBondContact O-N 3.19Å; A278-M280 VanDerWaalsContact C-N 3.31Å; A278-M280 PolarHBondContact O-N 3.24Å; M280-V282 VanDerWaalsContact C-N 3.33Å; M280-V282 PolarHBondContact O-N 2.91Å; M280-Q283 PolarHBondContact O-N 3.25Å; M280-E284 WeakPolarHBondContact O-CG 3.49Å; M280-E284 PolarHBondContact O-N 3.28Å; M280-L333 HydrophobicContact CE-CD1 3.95Å; M280-L333 HydrophobicContact CE-CD2 3.98Å; M280-L333 HydrophobicContact SD-CD1 4.13Å
281	S	93.9	Very high	94.7	Very high	11 Å²	11	26.6 Å²	26.6	8%	0.077	14%	0.135	C	C	.	.	H	α-helix	trans	-62	-39.7	176.8	-165.3	0	0	0	0	112.3	L277 A278 I279 E284 I285	L277-S281 PolarHBondContact O-N 2.88Å; A278-S281 WeakPolarHBondContact O-CB 3.31Å; A278-S281 PolarHBondContact O-N 3.5Å; A278-S281 VanDerWaalsContact O-N 3.12Å; I279-S281 VanDerWaalsContact C-N 3.33Å; I279-S281 PolarHBondContact O-N 3.49Å; S281-E284 PolarHBondContact O-N 2.63Å; S281-I285 WeakPolarHBondContact O-CD1 3.42Å; S281-I285 WeakPolarHBondContact O-CG1 3.4Å; S281-I285 PolarHBondContact O-N 3.28Å; S281-I285 VanDerWaalsContact O-N 3.07Å
282	V	95.1	Very high	94.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.6	-46.3	175.8	167	0	0	0	0	110.8	A278 I279 M280 E284 I285 V286 T311 M315 L455 L456 I459	A278-V282 WeakPolarHBondContact O-CG2 3.26Å; A278-V282 PolarHBondContact O-N 2.9Å; I279-V282 WeakPolarHBondContact O-CB 3.28Å; I279-V282 PolarHBondContact O-N 2.93Å; M280-V282 VanDerWaalsContact C-N 3.33Å; M280-V282 PolarHBondContact O-N 2.91Å; V282-E284 VanDerWaalsContact C-N 3.33Å; V282-E284 PolarHBondContact O-N 3.45Å; V282-I285 WeakPolarHBondContact O-CB 3.06Å; V282-I285 PolarHBondContact O-N 3.29Å; V282-I285 VanDerWaalsContact O-N 3.15Å; V282-V286 HydrophobicContact CG1-CG2 4.48Å; V282-V286 WeakPolarHBondContact O-CG2 3.49Å; V282-V286 PolarHBondContact O-N 3.41Å; V282-T311 HydrophobicContact CG2-CG2 3.71Å; V282-M315 HydrophobicContact CG2-SD 4.04Å; V282-L455 HydrophobicContact CB-CD2 4.22Å; V282-L455 HydrophobicContact CG1-CD1 4.19Å; V282-L455 HydrophobicContact CG1-CD2 3.8Å; V282-L455 HydrophobicContact CG1-CG 4.06Å; V282-L456 HydrophobicContact CG2-CD2 3.75Å; V282-I459 HydrophobicContact CB-CD1 4.4Å; V282-I459 HydrophobicContact CG1-CD1 3.19Å; V282-I459 HydrophobicContact CG2-CD1 4.34Å
283	Q	93.1	Very high	94.9	Very high	65 Å²	65	27.5 Å²	27.5	30%	0.304	14%	0.139	S	C	.	.	H	α-helix	trans	-61.8	-41.8	179.1	-71.3	170.8	-24.7	0	0	111.4	I279 M280 I285 V286 D287 L455	I279-Q283 WeakPolarHBondContact O-CG 3.35Å; I279-Q283 PolarHBondContact O-N 3.08Å; M280-Q283 PolarHBondContact O-N 3.25Å; Q283-I285 VanDerWaalsContact C-N 3.32Å; Q283-I285 PolarHBondContact O-N 3.03Å; Q283-V286 PolarHBondContact O-N 2.98Å; Q283-D287 WeakPolarHBondContact O-CB 3.35Å; Q283-D287 PolarHBondContact O-N 2.91Å; Q283-L455 HydrophobicContact CG-CD2 4.2Å
284	E	93.1	Very high	94.9	Very high	31 Å²	31	28 Å²	28	15%	0.145	14%	0.144	C	C	.	.	H	α-helix	trans	-58.1	-43.6	172.5	-74.8	176.7	-134.3	0	0	112.5	C241 S245 M280 S281 V282 D287 F288	C241-E284 HydrophobicContact CB-CB 4.47Å; C241-E284 HydrophobicContact CB-CG 4.49Å; S245-E284 WeakPolarHBondContact CB-OE1 3.43Å; S245-E284 WeakPolarHBondContact OG-CG 3.37Å; S245-E284 PolarHBondContact OG-OE1 3.18Å; M280-E284 WeakPolarHBondContact O-CG 3.49Å; M280-E284 PolarHBondContact O-N 3.28Å; S281-E284 PolarHBondContact O-N 2.63Å; V282-E284 VanDerWaalsContact C-N 3.33Å; V282-E284 PolarHBondContact O-N 3.45Å; E284-D287 PolarHBondContact O-N 3.45Å; E284-F288 VanDerWaalsContact O-CB 3.3Å; E284-F288 WeakPolarHBondContact O-CB 3.44Å; E284-F288 PolarHBondContact O-N 2.93Å
285	I	95.4	Very high	95	Very high	9 Å²	9	26.9 Å²	26.9	5%	0.046	14%	0.14	C	C	.	.	H	α-helix	trans	-64.9	-44.6	-179.2	-70.1	163.9	0	0	0	110.6	S281 V282 Q283 F288 A289 L307 T311 I314 M315	S281-I285 WeakPolarHBondContact O-CD1 3.42Å; S281-I285 WeakPolarHBondContact O-CG1 3.4Å; S281-I285 PolarHBondContact O-N 3.28Å; S281-I285 VanDerWaalsContact O-N 3.07Å; V282-I285 WeakPolarHBondContact O-CB 3.06Å; V282-I285 PolarHBondContact O-N 3.29Å; V282-I285 VanDerWaalsContact O-N 3.15Å; Q283-I285 VanDerWaalsContact C-N 3.32Å; Q283-I285 PolarHBondContact O-N 3.03Å; I285-F288 PolarHBondContact O-N 3.37Å; I285-A289 WeakPolarHBondContact O-CB 3.47Å; I285-A289 PolarHBondContact O-N 3.37Å; I285-L307 HydrophobicContact CG2-CD2 4.43Å; I285-T311 HydrophobicContact CD1-CG2 4.27Å; I285-I314 HydrophobicContact CD1-CB 3.91Å; I285-I314 HydrophobicContact CD1-CG2 3.77Å; I285-I314 HydrophobicContact CG1-CB 4.26Å; I285-I314 HydrophobicContact CG1-CG2 3.66Å; I285-I314 HydrophobicContact CG2-CB 4.48Å; I285-I314 HydrophobicContact CG2-CD1 3.71Å; I285-I314 HydrophobicContact CG2-CG2 4.35Å; I285-M315 HydrophobicContact CD1-CB 4.49Å; I285-M315 HydrophobicContact CD1-CG 3.54Å
286	V	95.2	Very high	95.1	Very high	9 Å²	9	32 Å²	32	6%	0.055	17%	0.166	C	C	.	.	H	α-helix	trans	-63.8	-44.6	177.5	173.8	0	0	0	0	110.8	L49 V282 Q283 F288 A289 K290 L307	L49-V286 HydrophobicContact CD1-CG2 4.36Å; V282-V286 HydrophobicContact CG1-CG2 4.48Å; V282-V286 WeakPolarHBondContact O-CG2 3.49Å; V282-V286 PolarHBondContact O-N 3.41Å; Q283-V286 PolarHBondContact O-N 2.98Å; V286-F288 VanDerWaalsContact C-N 3.32Å; V286-F288 PolarHBondContact O-N 3.38Å; V286-A289 PolarHBondContact O-N 3.41Å; V286-K290 HydrophobicContact CG1-CD 4.15Å; V286-K290 WeakPolarHBondContact O-CG 3.32Å; V286-K290 PolarHBondContact O-N 3.47Å; V286-L307 HydrophobicContact CG2-CD1 4.38Å; V286-L307 HydrophobicContact CG2-CD2 4.42Å
287	D	94	Very high	95.3	Very high	57 Å²	57	36 Å²	36	31%	0.305	19%	0.185	S	C	.	.	H	α-helix	trans	-62	-40	176.6	-90.2	9.2	0	0	0	111.9	R244 Q283 E284 Q291	R244-D287 IonicContact NH1-OD2 2.68Å; R244-D287 PolarHBondContact NH1-OD2 3.01Å; Q283-D287 WeakPolarHBondContact O-CB 3.35Å; Q283-D287 PolarHBondContact O-N 2.91Å; E284-D287 PolarHBondContact O-N 3.45Å; D287-Q291 WeakPolarHBondContact O-CG 3.32Å; D287-Q291 PolarHBondContact O-NE2 3.01Å
288	F	96.3	Very high	95.5	Very high	10 Å²	10	35.8 Å²	35.8	4%	0.044	18%	0.183	C	C	.	.	H	α-helix	trans	-66	-48.8	176	179	-97	0	0	0	111.4	L234 M237 Q238 E284 I285 V286 K290 Q291 L292 I377 I381	L234-F288 HydrophobicContact CD2-CZ 4.14Å; M237-F288 HydrophobicContact CB-CD2 4.08Å; M237-F288 HydrophobicContact CB-CE2 4.07Å; M237-F288 HydrophobicContact CE-CD2 4.02Å; M237-F288 HydrophobicContact CE-CE2 3.95Å; M237-F288 HydrophobicContact CE-CZ 4.48Å; M237-F288 WeakPolarHBondContact CE-O 3.19Å; Q238-F288 HydrophobicContact CB-CD2 4.43Å; Q238-F288 HydrophobicContact CB-CE2 4.11Å; E284-F288 VanDerWaalsContact O-CB 3.3Å; E284-F288 WeakPolarHBondContact O-CB 3.44Å; E284-F288 PolarHBondContact O-N 2.93Å; I285-F288 PolarHBondContact O-N 3.37Å; V286-F288 VanDerWaalsContact C-N 3.32Å; V286-F288 PolarHBondContact O-N 3.38Å; F288-K290 PolarHBondContact O-N 3.24Å; F288-Q291 PolarHBondContact O-N 3.36Å; F288-Q291 VanDerWaalsContact O-N 3.1Å; F288-L292 HydrophobicContact CD1-CD1 4.46Å; F288-L292 HydrophobicContact CD1-CD2 4.49Å; F288-L292 HydrophobicContact CD1-CG 4.45Å; F288-L292 HydrophobicContact CE1-CD1 4.15Å; F288-L292 HydrophobicContact CE1-CD2 3.78Å; F288-L292 HydrophobicContact CE1-CG 4.16Å; F288-L292 HydrophobicContact CZ-CD2 3.92Å; F288-L292 PolarHBondContact O-N 3.25Å; F288-I377 HydrophobicContact CD1-CG2 4.07Å; F288-I377 HydrophobicContact CE1-CB 4.49Å; F288-I377 HydrophobicContact CE1-CG2 3.69Å; F288-I381 HydrophobicContact CD1-CD1 4.07Å; F288-I381 HydrophobicContact CE1-CD1 4.23Å
289	A	97.3	Very high	95.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.8	-44.4	-178.6	0	0	0	0	0	112.1	I285 V286 Q291 L292 F295 L307 I381	I285-A289 WeakPolarHBondContact O-CB 3.47Å; I285-A289 PolarHBondContact O-N 3.37Å; V286-A289 PolarHBondContact O-N 3.41Å; A289-Q291 PolarHBondContact O-N 2.95Å; A289-Q291 VanDerWaalsContact O-N 3.09Å; A289-L292 WeakPolarHBondContact O-CB 3.43Å; A289-L292 PolarHBondContact O-N 3.03Å; A289-F295 HydrophobicContact CB-CD2 4.46Å; A289-F295 HydrophobicContact CB-CE1 4.25Å; A289-F295 HydrophobicContact CB-CE2 4.21Å; A289-F295 HydrophobicContact CB-CZ 4.11Å; A289-F295 VanDerWaalsContact O-CB 3.25Å; A289-F295 WeakPolarHBondContact O-CB 3.33Å; A289-F295 WeakPolarHBondContact O-CD1 3.32Å; A289-F295 VanDerWaalsContact O-CG 3.22Å; A289-F295 WeakPolarHBondContact O-CG 3.5Å; A289-L307 HydrophobicContact CB-CD2 3.71Å; A289-I381 HydrophobicContact CB-CD1 4.11Å
290	K	95.3	Very high	95.8	Very high	102 Å²	102	43 Å²	43	44%	0.443	21%	0.213	S	C	.	.	H	α-helix	trans	-58.3	-24.3	177.1	-75.5	174.3	178.4	175.7	0	114.1	V286 F288 L296	V286-K290 HydrophobicContact CG1-CD 4.15Å; V286-K290 WeakPolarHBondContact O-CG 3.32Å; V286-K290 PolarHBondContact O-N 3.47Å; F288-K290 PolarHBondContact O-N 3.24Å; K290-L296 HydrophobicContact CG-CD2 4.49Å
291	Q	95.7	Very high	96	Very high	63 Å²	63	48 Å²	48	29%	0.294	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-8.5	-179.7	-72.4	174.3	80.3	0	0	112.9	M237 D287 F288 A289	M237-Q291 VanDerWaalsContact CE-C 3.48Å; M237-Q291 HydrophobicContact CE-CB 3.28Å; M237-Q291 HydrophobicContact CG-CB 4.27Å; M237-Q291 HydrophobicContact SD-CB 3.84Å; D287-Q291 WeakPolarHBondContact O-CG 3.32Å; D287-Q291 PolarHBondContact O-NE2 3.01Å; F288-Q291 PolarHBondContact O-N 3.36Å; F288-Q291 VanDerWaalsContact O-N 3.1Å; A289-Q291 PolarHBondContact O-N 2.95Å; A289-Q291 VanDerWaalsContact O-N 3.09Å
292	L	97.3	Very high	96.2	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.021	23%	0.233	C	C	.	.	S	Bend	trans	-66.9	131.4	178.1	-70	175.9	0	0	0	110.4	L234 M237 F288 A289 G294 F295 A378 I381 F382	L234-L292 HydrophobicContact CD2-CD2 3.23Å; M237-L292 HydrophobicContact CE-CD2 4.07Å; M237-L292 HydrophobicContact CE-CG 4.45Å; F288-L292 HydrophobicContact CD1-CD1 4.46Å; F288-L292 HydrophobicContact CD1-CD2 4.49Å; F288-L292 HydrophobicContact CD1-CG 4.45Å; F288-L292 HydrophobicContact CE1-CD1 4.15Å; F288-L292 HydrophobicContact CE1-CD2 3.78Å; F288-L292 HydrophobicContact CE1-CG 4.16Å; F288-L292 HydrophobicContact CZ-CD2 3.92Å; F288-L292 PolarHBondContact O-N 3.25Å; A289-L292 WeakPolarHBondContact O-CB 3.43Å; A289-L292 PolarHBondContact O-N 3.03Å; L292-G294 PolarHBondContact O-N 3.42Å; L292-F295 HydrophobicContact CB-CB 4.03Å; L292-F295 WeakPolarHBondContact O-CB 3.41Å; L292-F295 PolarHBondContact O-N 2.76Å; L292-F295 VanDerWaalsContact O-N 3.1Å; L292-A378 HydrophobicContact CD1-CB 4.41Å; L292-A378 HydrophobicContact CD2-CB 4.13Å; L292-I381 HydrophobicContact CD1-CB 4.37Å; L292-I381 HydrophobicContact CD1-CD1 3.58Å; L292-I381 HydrophobicContact CD1-CG2 4.21Å; L292-F382 HydrophobicContact CB-CE2 4.12Å; L292-F382 HydrophobicContact CB-CZ 4.11Å; L292-F382 HydrophobicContact CD1-CE2 3.82Å; L292-F382 HydrophobicContact CD1-CZ 4.29Å
293	P	96.1	Very high	96.4	Very high	54 Å²	54	48.8 Å²	48.8	35%	0.351	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	129.2	169.5	-28.3	34	0	0	0	112	F295 Y402	P293-F295 VanDerWaalsContact C-N 3.3Å; P293-F295 PolarHBondContact O-N 2.99Å; P293-Y402 WeakPolarHBondContact CD-OH 3.4Å; P293-Y402 PolarHBondContact O-OH 3.43Å; P293-Y402 VanDerWaalsContact O-OH 3.06Å
294	G	95.3	Very high	96.6	Very high	11 Å²	11	48.4 Å²	48.4	11%	0.113	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.9	-17.2	-179.7	0	0	0	0	0	116.3	L292 L296 E297 L398	L292-G294 PolarHBondContact O-N 3.42Å; G294-L296 VanDerWaalsContact C-N 3.34Å; G294-L296 PolarHBondContact O-N 2.99Å; G294-E297 WeakPolarHBondContact O-CB 3.36Å; G294-E297 PolarHBondContact O-N 3.43Å; G294-L398 VanDerWaalsContact O-CD1 3.3Å; G294-L398 WeakPolarHBondContact O-CD1 3.44Å
295	F	98.1	Very high	96.8	Very high	1 Å²	1	47.3 Å²	47.3	0%	0.004	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-63.2	-39.8	-176.9	-173.2	-95.6	0	0	0	112.8	A289 L292 P293 E297 L298 Q303 L307 I381 F382	A289-F295 HydrophobicContact CB-CD2 4.46Å; A289-F295 HydrophobicContact CB-CE1 4.25Å; A289-F295 HydrophobicContact CB-CE2 4.21Å; A289-F295 HydrophobicContact CB-CZ 4.11Å; A289-F295 VanDerWaalsContact O-CB 3.25Å; A289-F295 WeakPolarHBondContact O-CB 3.33Å; A289-F295 WeakPolarHBondContact O-CD1 3.32Å; A289-F295 VanDerWaalsContact O-CG 3.22Å; A289-F295 WeakPolarHBondContact O-CG 3.5Å; L292-F295 HydrophobicContact CB-CB 4.03Å; L292-F295 WeakPolarHBondContact O-CB 3.41Å; L292-F295 PolarHBondContact O-N 2.76Å; L292-F295 VanDerWaalsContact O-N 3.1Å; P293-F295 VanDerWaalsContact C-N 3.3Å; P293-F295 PolarHBondContact O-N 2.99Å; F295-E297 PolarHBondContact O-N 3.49Å; F295-L298 HydrophobicContact CD2-CD1 4.24Å; F295-L298 WeakPolarHBondContact O-CB 3.25Å; F295-L298 PolarHBondContact O-N 3.28Å; F295-Q303 HydrophobicContact CD1-CG 4.24Å; F295-Q303 HydrophobicContact CE1-CB 4Å; F295-Q303 HydrophobicContact CE1-CG 3.71Å; F295-Q303 HydrophobicContact CE2-CG 4.48Å; F295-Q303 HydrophobicContact CZ-CB 3.82Å; F295-Q303 HydrophobicContact CZ-CG 3.84Å; F295-L307 HydrophobicContact CE1-CD1 4.36Å; F295-L307 HydrophobicContact CZ-CD1 3.86Å; F295-L307 HydrophobicContact CZ-CD2 4.41Å; F295-L307 HydrophobicContact CZ-CG 3.89Å; F295-I381 HydrophobicContact CD2-CG2 4.01Å; F295-I381 HydrophobicContact CE2-CG2 3.88Å; F295-F382 HydrophobicContact CB-CE1 4.21Å; F295-F382 HydrophobicContact CB-CZ 3.91Å; F295-F382 AromaticContact CD2-CE1 3.94Å; F295-F382 HydrophobicContact CD2-CE1 3.94Å; F295-F382 HydrophobicContact CD2-CZ 4.15Å
296	L	97.5	Very high	96.9	Very high	117 Å²	117	46.9 Å²	46.9	61%	0.613	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-76.2	-5.1	177.9	-60.1	-180	0	0	0	113.7	K290 G294	K290-L296 HydrophobicContact CG-CD2 4.49Å; G294-L296 VanDerWaalsContact C-N 3.34Å; G294-L296 PolarHBondContact O-N 2.99Å
297	E	96.7	Very high	97	Very high	140 Å²	140	47.3 Å²	47.3	65%	0.654	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-82.7	-18.7	173.7	-58.7	173.4	-159.5	0	0	111.9	G294 F295	G294-E297 WeakPolarHBondContact O-CB 3.36Å; G294-E297 PolarHBondContact O-N 3.43Å; F295-E297 PolarHBondContact O-N 3.49Å
298	L	98.2	Very high	97	Very high	7 Å²	7	47.2 Å²	47.2	4%	0.037	23%	0.231	C	C	.	.	S	Bend	trans	-71	156	176.4	-66	168.9	0	0	0	111.7	F295 D302 Q303 L306 F382 L394 V395 L398	F295-L298 HydrophobicContact CD2-CD1 4.24Å; F295-L298 WeakPolarHBondContact O-CB 3.25Å; F295-L298 PolarHBondContact O-N 3.28Å; L298-D302 HydrophobicContact CB-CB 4.21Å; L298-D302 HydrophobicContact CD2-CB 4.48Å; L298-Q303 HydrophobicContact CB-CG 3.9Å; L298-Q303 PolarHBondContact O-NE2 3.33Å; L298-L306 HydrophobicContact CD1-CD1 3.54Å; L298-F382 HydrophobicContact CD1-CD1 4.36Å; L298-F382 HydrophobicContact CD1-CE1 4.04Å; L298-L394 HydrophobicContact CD2-CD2 3.81Å; L298-L394 HydrophobicContact CD2-CG 3.88Å; L298-V395 HydrophobicContact CD2-CG2 3.8Å; L298-L398 HydrophobicContact CD1-CD1 4.28Å; L298-L398 HydrophobicContact CD2-CD1 3.9Å; L298-L398 HydrophobicContact CG-CD1 3.89Å
299	T	98.3	Very high	96.9	Very high	63 Å²	63	48 Å²	48	39%	0.387	24%	0.237	S	C	.	.			trans	-61.3	158.3	170.7	68.7	0	0	0	0	111.1	E301 D302 Q303	T299-E301 PolarHBondContact O-N 3.1Å; T299-D302 PolarHBondContact O-N 3.33Å; T299-D302 WeakPolarHBondContact OG1-CB 3.47Å; T299-D302 PolarHBondContact OG1-N 3.36Å; T299-D302 VanDerWaalsContact OG1-N 3.08Å; T299-D302 PolarHBondContact OG1-OD2 3.3Å; T299-Q303 VanDerWaalsContact O-CG 3.31Å; T299-Q303 WeakPolarHBondContact O-CG 3.37Å; T299-Q303 PolarHBondContact O-N 2.75Å
300	R	97.1	Very high	96.9	Very high	134 Å²	134	48 Å²	48	51%	0.506	24%	0.237	S	C	.	.	H	α-helix	trans	-63.1	-38.3	178	-73.1	-178.2	174.2	174.8	1.4	110.9	L52 Q303 I304	L52-R300 HydrophobicContact CD2-CB 4.49Å; L52-R300 HydrophobicContact CD2-CG 3.96Å; R300-Q303 PolarHBondContact O-N 3.27Å; R300-I304 VanDerWaalsContact O-CG1 3.25Å; R300-I304 WeakPolarHBondContact O-CG1 3.39Å; R300-I304 PolarHBondContact O-N 3.29Å
301	E	97.6	Very high	97	Very high	120 Å²	120	43.2 Å²	43.2	56%	0.561	22%	0.216	S	C	*	.	H	α-helix	trans	-59.2	-47.7	176.7	-64.9	73.5	-165.2	0	0	110.8	T299 I304 A305	T299-E301 PolarHBondContact O-N 3.1Å; E301-I304 PolarHBondContact O-N 2.84Å; E301-A305 WeakPolarHBondContact O-CB 3.27Å; E301-A305 PolarHBondContact O-N 3.04Å
302	D	98.3	Very high	97.1	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-66.4	-42.5	176.9	-69.1	-33.5	0	0	0	111.9	L298 T299 I304 A305 L306 V389 Q390	L298-D302 HydrophobicContact CB-CB 4.21Å; L298-D302 HydrophobicContact CD2-CB 4.48Å; T299-D302 PolarHBondContact O-N 3.33Å; T299-D302 WeakPolarHBondContact OG1-CB 3.47Å; T299-D302 PolarHBondContact OG1-N 3.36Å; T299-D302 VanDerWaalsContact OG1-N 3.08Å; T299-D302 PolarHBondContact OG1-OD2 3.3Å; D302-I304 VanDerWaalsContact C-N 3.3Å; D302-I304 PolarHBondContact O-N 3.3Å; D302-A305 PolarHBondContact O-N 3.17Å; D302-L306 WeakPolarHBondContact O-CB 3.36Å; D302-L306 WeakPolarHBondContact O-CG 3.11Å; D302-L306 PolarHBondContact O-N 3.18Å; D302-V389 WeakPolarHBondContact OD1-CA 3.3Å; D302-Q390 PolarHBondContact OD1-N 3.27Å
303	Q	98.4	Very high	97.2	Very high	27 Å²	27	40.7 Å²	40.7	13%	0.126	21%	0.205	C	C	.	.	H	α-helix	trans	-58.1	-43.7	175.8	-70.6	177.7	44.2	0	0	111.3	F295 L298 T299 R300 L307	F295-Q303 HydrophobicContact CD1-CG 4.24Å; F295-Q303 HydrophobicContact CE1-CB 4Å; F295-Q303 HydrophobicContact CE1-CG 3.71Å; F295-Q303 HydrophobicContact CE2-CG 4.48Å; F295-Q303 HydrophobicContact CZ-CB 3.82Å; F295-Q303 HydrophobicContact CZ-CG 3.84Å; L298-Q303 HydrophobicContact CB-CG 3.9Å; L298-Q303 PolarHBondContact O-NE2 3.33Å; T299-Q303 VanDerWaalsContact O-CG 3.31Å; T299-Q303 WeakPolarHBondContact O-CG 3.37Å; T299-Q303 PolarHBondContact O-N 2.75Å; R300-Q303 PolarHBondContact O-N 3.27Å; Q303-L307 WeakPolarHBondContact O-CB 3.46Å; Q303-L307 VanDerWaalsContact O-CG 3.31Å; Q303-L307 WeakPolarHBondContact O-CG 3.49Å; Q303-L307 PolarHBondContact O-N 3.4Å
304	I	96.8	Very high	97.3	Very high	56 Å²	56	38.2 Å²	38.2	29%	0.287	19%	0.188	S	C	.	.	H	α-helix	trans	-65.2	-48.6	176.4	-68.2	165.1	0	0	0	110.6	L52 R300 E301 D302 L306 L307 K308	L52-I304 HydrophobicContact CB-CD1 4.18Å; L52-I304 HydrophobicContact CD1-CD1 3.88Å; L52-I304 HydrophobicContact CD1-CG1 3.79Å; R300-I304 VanDerWaalsContact O-CG1 3.25Å; R300-I304 WeakPolarHBondContact O-CG1 3.39Å; R300-I304 PolarHBondContact O-N 3.29Å; E301-I304 PolarHBondContact O-N 2.84Å; D302-I304 VanDerWaalsContact C-N 3.3Å; D302-I304 PolarHBondContact O-N 3.3Å; I304-L306 PolarHBondContact O-N 3.39Å; I304-L307 PolarHBondContact O-N 3.35Å; I304-K308 HydrophobicContact CG2-CD 4.08Å; I304-K308 HydrophobicContact CG2-CG 4.15Å; I304-K308 WeakPolarHBondContact O-CB 3.37Å; I304-K308 WeakPolarHBondContact O-CG 3.44Å; I304-K308 PolarHBondContact O-N 2.81Å
305	A	97	Very high	97.4	Very high	9 Å²	9	38.8 Å²	38.8	7%	0.074	19%	0.188	C	C	.	.	H	α-helix	trans	-59.2	-46.1	-179	0	0	0	0	0	112	E301 D302 T309 N388 V389	E301-A305 WeakPolarHBondContact O-CB 3.27Å; E301-A305 PolarHBondContact O-N 3.04Å; D302-A305 PolarHBondContact O-N 3.17Å; A305-T309 WeakPolarHBondContact O-CB 3.11Å; A305-T309 VanDerWaalsContact O-CG2 3.31Å; A305-T309 WeakPolarHBondContact O-CG2 3.19Å; A305-T309 PolarHBondContact O-N 3.26Å; A305-T309 PolarHBondContact O-OG1 3.43Å; A305-N388 HydrophobicContact CB-CB 4.33Å; A305-V389 HydrophobicContact CB-CG2 4.15Å
306	L	98.3	Very high	97.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65	-44.2	177.3	-66.3	177.9	0	0	0	111.6	L298 D302 I304 T309 S310 I381 S383 R386 V389 V395	L298-L306 HydrophobicContact CD1-CD1 3.54Å; D302-L306 WeakPolarHBondContact O-CB 3.36Å; D302-L306 WeakPolarHBondContact O-CG 3.11Å; D302-L306 PolarHBondContact O-N 3.18Å; I304-L306 PolarHBondContact O-N 3.39Å; L306-T309 PolarHBondContact O-OG1 3.48Å; L306-S310 VanDerWaalsContact O-CB 3.23Å; L306-S310 WeakPolarHBondContact O-CB 3.19Å; L306-S310 PolarHBondContact O-N 3.23Å; L306-S310 PolarHBondContact O-OG 3.36Å; L306-I381 WeakPolarHBondContact CD2-O 3.39Å; L306-S383 WeakPolarHBondContact CD2-O 3.31Å; L306-R386 HydrophobicContact CD2-CB 4.24Å; L306-R386 HydrophobicContact CD2-CG 3.87Å; L306-V389 HydrophobicContact CD2-CG2 3.81Å; L306-V389 HydrophobicContact CG-CG2 4.35Å; L306-V395 HydrophobicContact CD1-CG1 4.43Å; L306-V395 HydrophobicContact CD1-CG2 4.16Å; L306-V395 HydrophobicContact CD2-CG1 4.26Å
307	L	97.6	Very high	97.4	Very high	17 Å²	17	33.5 Å²	33.5	9%	0.089	16%	0.161	C	C	.	.	H	α-helix	trans	-67	-48.9	179.7	-78	170.5	0	0	0	112.3	I285 V286 A289 F295 Q303 I304 T309 S310 T311	I285-L307 HydrophobicContact CG2-CD2 4.43Å; V286-L307 HydrophobicContact CG2-CD1 4.38Å; V286-L307 HydrophobicContact CG2-CD2 4.42Å; A289-L307 HydrophobicContact CB-CD2 3.71Å; F295-L307 HydrophobicContact CE1-CD1 4.36Å; F295-L307 HydrophobicContact CZ-CD1 3.86Å; F295-L307 HydrophobicContact CZ-CD2 4.41Å; F295-L307 HydrophobicContact CZ-CG 3.89Å; Q303-L307 WeakPolarHBondContact O-CB 3.46Å; Q303-L307 VanDerWaalsContact O-CG 3.31Å; Q303-L307 WeakPolarHBondContact O-CG 3.49Å; Q303-L307 PolarHBondContact O-N 3.4Å; I304-L307 PolarHBondContact O-N 3.35Å; L307-T309 PolarHBondContact O-N 2.72Å; L307-S310 PolarHBondContact O-N 2.77Å; L307-T311 VanDerWaalsContact O-CB 3.27Å; L307-T311 WeakPolarHBondContact O-CB 3.37Å; L307-T311 PolarHBondContact O-N 3.43Å; L307-T311 PolarHBondContact O-OG1 3.46Å
308	K	94.5	Very high	97.4	Very high	55 Å²	55	27.8 Å²	27.8	24%	0.239	13%	0.134	C	C	.	.	H	α-helix	trans	-53.5	-43.5	-179.7	-80.1	-166.1	169.6	-161.6	0	111.9	I304 E458 D461	I304-K308 HydrophobicContact CG2-CD 4.08Å; I304-K308 HydrophobicContact CG2-CG 4.15Å; I304-K308 WeakPolarHBondContact O-CB 3.37Å; I304-K308 WeakPolarHBondContact O-CG 3.44Å; I304-K308 PolarHBondContact O-N 2.81Å; K308-E458 WeakPolarHBondContact CE-O 3.24Å; K308-E458 PolarHBondContact NZ-O 2.84Å; K308-D461 IonicContact NZ-OD1 3.28Å; K308-D461 PolarHBondContact NZ-OD1 3.23Å
309	T	93.5	Very high	97.3	Very high	28 Å²	28	28.2 Å²	28.2	17%	0.172	14%	0.137	C	C	.	.	H	α-helix	trans	-86.6	-29.1	-172.5	58	0	0	0	0	113.9	A305 L306 L307 R386 P387	A305-T309 WeakPolarHBondContact O-CB 3.11Å; A305-T309 VanDerWaalsContact O-CG2 3.31Å; A305-T309 WeakPolarHBondContact O-CG2 3.19Å; A305-T309 PolarHBondContact O-N 3.26Å; A305-T309 PolarHBondContact O-OG1 3.43Å; L306-T309 PolarHBondContact O-OG1 3.48Å; L307-T309 PolarHBondContact O-N 2.72Å; T309-R386 HydrophobicContact CG2-CB 4.38Å; T309-R386 PolarHBondContact O-NH1 3.19Å; T309-R386 WeakPolarHBondContact OG1-CB 3.26Å; T309-R386 WeakPolarHBondContact OG1-CD 3.49Å; T309-R386 WeakPolarHBondContact OG1-CG 3.3Å; T309-P387 HydrophobicContact CG2-CG 3.55Å
310	S	97.6	Very high	97.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-89	-22.4	178.4	64.3	0	0	0	0	114	L306 L307 I312 E313 I314	L306-S310 VanDerWaalsContact O-CB 3.23Å; L306-S310 WeakPolarHBondContact O-CB 3.19Å; L306-S310 PolarHBondContact O-N 3.23Å; L306-S310 PolarHBondContact O-OG 3.36Å; L307-S310 PolarHBondContact O-N 2.77Å; S310-I312 PolarHBondContact O-N 3.28Å; S310-E313 WeakPolarHBondContact O-CB 3.43Å; S310-E313 PolarHBondContact O-N 3.41Å; S310-I314 WeakPolarHBondContact O-CG1 3.42Å; S310-I314 PolarHBondContact O-N 3.38Å
311	T	97.9	Very high	97.1	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.006	11%	0.106	C	C	.	.	H	α-helix	trans	-52.9	-49.3	-172.1	-71.8	0	0	0	0	113.1	V282 I285 L307 E313 I314 M315 I459	V282-T311 HydrophobicContact CG2-CG2 3.71Å; I285-T311 HydrophobicContact CD1-CG2 4.27Å; L307-T311 VanDerWaalsContact O-CB 3.27Å; L307-T311 WeakPolarHBondContact O-CB 3.37Å; L307-T311 PolarHBondContact O-N 3.43Å; L307-T311 PolarHBondContact O-OG1 3.46Å; T311-E313 VanDerWaalsContact C-N 3.33Å; T311-E313 PolarHBondContact O-N 2.9Å; T311-I314 PolarHBondContact O-N 3.28Å; T311-M315 HydrophobicContact CG2-CG 4.45Å; T311-M315 HydrophobicContact CG2-SD 4.1Å; T311-M315 VanDerWaalsContact O-CG 3.26Å; T311-M315 WeakPolarHBondContact O-CG 3.33Å; T311-M315 PolarHBondContact O-N 2.99Å; T311-I459 HydrophobicContact CG2-CG2 4.09Å
312	I	97.8	Very high	96.9	Very high	12 Å²	12	18.3 Å²	18.3	6%	0.062	9%	0.088	C	C	.	.	H	α-helix	trans	-65.1	-37.9	179.4	-176.5	60.7	0	0	0	112.2	S310 I314 M315 L316 S435 H438	S310-I312 PolarHBondContact O-N 3.28Å; I312-I314 VanDerWaalsContact C-N 3.34Å; I312-I314 PolarHBondContact O-N 3.21Å; I312-M315 WeakPolarHBondContact O-CB 3.27Å; I312-M315 PolarHBondContact O-N 3.22Å; I312-L316 HydrophobicContact CD1-CD1 4.48Å; I312-L316 HydrophobicContact CD1-CG 4.37Å; I312-L316 HydrophobicContact CG1-CD1 4.09Å; I312-L316 HydrophobicContact CG1-CG 4.45Å; I312-L316 WeakPolarHBondContact O-CB 3.48Å; I312-L316 WeakPolarHBondContact O-CG 3.48Å; I312-L316 PolarHBondContact O-N 3.46Å; I312-S435 WeakPolarHBondContact CG2-OG 3.37Å; I312-H438 HydrophobicContact CD1-CB 4.25Å; I312-H438 VanDerWaalsContact CD1-CD2 3.4Å; I312-H438 WeakPolarHBondContact CD1-CD2 3.26Å; I312-H438 HydrophobicContact CG1-CB 3.83Å; I312-H438 VanDerWaalsContact CG1-CG 3.49Å
313	E	98.4	Very high	96.9	Very high	2 Å²	2	19 Å²	19	1%	0.009	9%	0.09	C	C	.	.	H	α-helix	trans	-65.8	-40.1	179.6	-61.1	-176.2	-166.6	0	0	111.2	S310 T311 L316 L317 N380 R386 L431 R432	S310-E313 WeakPolarHBondContact O-CB 3.43Å; S310-E313 PolarHBondContact O-N 3.41Å; T311-E313 VanDerWaalsContact C-N 3.33Å; T311-E313 PolarHBondContact O-N 2.9Å; E313-L316 PolarHBondContact O-N 3.48Å; E313-L317 PolarHBondContact O-N 3.31Å; E313-N380 PolarHBondContact OE2-ND2 3.42Å; E313-R386 VanDerWaalsContact CD-NH1 3.3Å; E313-R386 IonicContact OE1-CZ 3.43Å; E313-R386 IonicContact OE1-NH1 2.77Å; E313-R386 PolarHBondContact OE1-NH1 3.06Å; E313-R386 IonicContact OE1-NH2 3.27Å; E313-R386 IonicContact OE2-CZ 2.76Å; E313-R386 IonicContact OE2-NH1 2.76Å; E313-R386 PolarHBondContact OE2-NH1 3.5Å; E313-R386 IonicContact OE2-NH2 3.25Å; E313-R386 PolarHBondContact OE2-NH2 3.01Å; E313-L431 HydrophobicContact CB-CB 3.98Å; E313-L431 HydrophobicContact CB-CD1 4.09Å; E313-L431 HydrophobicContact CB-CD2 4.43Å; E313-L431 HydrophobicContact CB-CG 4.39Å; E313-L431 HydrophobicContact CG-CB 3.91Å; E313-R432 WeakPolarHBondContact OE1-CD 3.48Å; E313-R432 IonicContact OE1-NE 2.71Å; E313-R432 IonicContact OE2-NE 3.47Å
314	I	98.3	Very high	96.7	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-69.1	-41.9	175.6	-58.8	161.7	0	0	0	110.6	I285 S310 T311 I312 L316 L317 E318 I377 I381	I285-I314 HydrophobicContact CD1-CB 3.91Å; I285-I314 HydrophobicContact CD1-CG2 3.77Å; I285-I314 HydrophobicContact CG1-CB 4.26Å; I285-I314 HydrophobicContact CG1-CG2 3.66Å; I285-I314 HydrophobicContact CG2-CB 4.48Å; I285-I314 HydrophobicContact CG2-CD1 3.71Å; I285-I314 HydrophobicContact CG2-CG2 4.35Å; S310-I314 WeakPolarHBondContact O-CG1 3.42Å; S310-I314 PolarHBondContact O-N 3.38Å; T311-I314 PolarHBondContact O-N 3.28Å; I312-I314 VanDerWaalsContact C-N 3.34Å; I312-I314 PolarHBondContact O-N 3.21Å; I314-L316 PolarHBondContact O-N 2.74Å; I314-L317 PolarHBondContact O-N 3.13Å; I314-E318 HydrophobicContact CG2-CG 4.43Å; I314-E318 WeakPolarHBondContact O-CB 3.44Å; I314-E318 PolarHBondContact O-N 3.37Å; I314-I377 HydrophobicContact CD1-CG2 4.34Å; I314-I377 HydrophobicContact CG1-CG2 4.18Å; I314-I377 HydrophobicContact CG2-CD1 4.31Å; I314-I377 HydrophobicContact CG2-CG1 4.17Å; I314-I377 HydrophobicContact CG2-CG2 3.76Å; I314-I381 HydrophobicContact CD1-CD1 3.91Å; I314-I381 HydrophobicContact CD1-CG1 3.4Å; I314-I381 VanDerWaalsContact CD1-CG1 3.4Å; I314-I381 HydrophobicContact CG1-CG1 4.46Å
315	M	97.8	Very high	96.6	Very high	23 Å²	23	21.1 Å²	21.1	11%	0.113	11%	0.107	C	C	.	.	H	α-helix	trans	-56.6	-40.3	173.3	-74.1	178	67.5	0	0	111.5	A278 V282 I285 T311 I312 T319 W460	A278-M315 HydrophobicContact CB-CE 3.71Å; V282-M315 HydrophobicContact CG2-SD 4.04Å; I285-M315 HydrophobicContact CD1-CB 4.49Å; I285-M315 HydrophobicContact CD1-CG 3.54Å; T311-M315 HydrophobicContact CG2-CG 4.45Å; T311-M315 HydrophobicContact CG2-SD 4.1Å; T311-M315 VanDerWaalsContact O-CG 3.26Å; T311-M315 WeakPolarHBondContact O-CG 3.33Å; T311-M315 PolarHBondContact O-N 2.99Å; I312-M315 WeakPolarHBondContact O-CB 3.27Å; I312-M315 PolarHBondContact O-N 3.22Å; M315-T319 WeakPolarHBondContact O-CB 3.22Å; M315-T319 PolarHBondContact O-N 2.93Å; M315-T319 PolarHBondContact O-OG1 2.95Å; M315-W460 HydrophobicContact SD-CZ2 4.29Å
316	L	98.3	Very high	96.5	Very high	7 Å²	7	24.9 Å²	24.9	4%	0.037	14%	0.138	C	C	.	.	H	α-helix	trans	-70.9	-39.7	177.8	-70.3	167.7	0	0	0	112.6	I312 E313 I314 T319 S320 I356 L431 L434	I312-L316 HydrophobicContact CD1-CD1 4.48Å; I312-L316 HydrophobicContact CD1-CG 4.37Å; I312-L316 HydrophobicContact CG1-CD1 4.09Å; I312-L316 HydrophobicContact CG1-CG 4.45Å; I312-L316 WeakPolarHBondContact O-CB 3.48Å; I312-L316 WeakPolarHBondContact O-CG 3.48Å; I312-L316 PolarHBondContact O-N 3.46Å; E313-L316 PolarHBondContact O-N 3.48Å; I314-L316 PolarHBondContact O-N 2.74Å; L316-T319 PolarHBondContact O-N 2.89Å; L316-S320 WeakPolarHBondContact O-CB 3.5Å; L316-S320 PolarHBondContact O-N 2.94Å; L316-I356 HydrophobicContact CD2-CB 4.38Å; L316-I356 HydrophobicContact CD2-CD1 4.02Å; L316-I356 HydrophobicContact CD2-CG1 3.68Å; L316-I356 HydrophobicContact CD2-CG2 4.01Å; L316-L431 HydrophobicContact CB-CD2 3.79Å; L316-L431 HydrophobicContact CD1-CD2 4.35Å; L316-L434 HydrophobicContact CD1-CB 3.54Å; L316-L434 HydrophobicContact CD1-CD1 4.05Å; L316-L434 HydrophobicContact CD1-CG 4.4Å
317	L	98	Very high	96.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.9	-49.6	171.1	-81.1	171.5	0	0	0	111.3	E313 I314 T319 S320 R321 F359 M363 I377 L428 L431	E313-L317 PolarHBondContact O-N 3.31Å; I314-L317 PolarHBondContact O-N 3.13Å; L317-T319 VanDerWaalsContact C-N 3.29Å; L317-T319 PolarHBondContact O-N 3.26Å; L317-S320 PolarHBondContact O-N 2.9Å; L317-S320 VanDerWaalsContact O-N 3.17Å; L317-S320 PolarHBondContact O-OG 3.33Å; L317-R321 PolarHBondContact O-N 2.86Å; L317-F359 HydrophobicContact CD2-CE1 4.33Å; L317-F359 HydrophobicContact CD2-CZ 4.01Å; L317-M363 HydrophobicContact CD2-CE 3.66Å; L317-M363 HydrophobicContact CD2-SD 4.4Å; L317-I377 HydrophobicContact CD1-CG1 4.16Å; L317-L428 HydrophobicContact CD1-CD2 4.44Å; L317-L431 HydrophobicContact CD1-CD1 3.62Å; L317-L431 HydrophobicContact CD2-CD1 4.02Å; L317-L431 HydrophobicContact CG-CD1 3.56Å; L317-L431 HydrophobicContact CG-CD2 4.27Å
318	E	95.6	Very high	96.1	Very high	19 Å²	19	33.5 Å²	33.5	9%	0.089	18%	0.18	C	C	.	.	H	α-helix	trans	-65.6	-33	178.6	-76.9	-68.1	172.4	0	0	112.7	Q238 I314 R321 R322 I377	Q238-E318 PolarHBondContact NE2-OE1 3.41Å; I314-E318 HydrophobicContact CG2-CG 4.43Å; I314-E318 WeakPolarHBondContact O-CB 3.44Å; I314-E318 PolarHBondContact O-N 3.37Å; E318-R321 IonicContact OE1-NH2 2.72Å; E318-R321 IonicContact OE2-CZ 2.89Å; E318-R321 VanDerWaalsContact OE2-CZ 3.27Å; E318-R321 IonicContact OE2-NE 3.81Å; E318-R321 PolarHBondContact OE2-NE 2.95Å; E318-R321 IonicContact OE2-NH2 3.79Å; E318-R321 PolarHBondContact OE2-NH2 3.12Å; E318-R322 WeakPolarHBondContact O-CG 3.35Å; E318-R322 PolarHBondContact O-NE 2.92Å; E318-I377 HydrophobicContact CG-CD1 4.14Å; E318-I377 WeakPolarHBondContact OE1-CD1 3.18Å
319	T	95.9	Very high	96.2	Very high	16 Å²	16	31.1 Å²	31.1	10%	0.098	17%	0.17	C	C	.	.	H	α-helix	trans	-64.3	-46.2	172.1	-69.3	0	0	0	0	110.7	M315 L316 L317 R321 R322 Y323 I330 I356	M315-T319 WeakPolarHBondContact O-CB 3.22Å; M315-T319 PolarHBondContact O-N 2.93Å; M315-T319 PolarHBondContact O-OG1 2.95Å; L316-T319 PolarHBondContact O-N 2.89Å; L317-T319 VanDerWaalsContact C-N 3.29Å; L317-T319 PolarHBondContact O-N 3.26Å; T319-R321 VanDerWaalsContact C-N 3.29Å; T319-R321 PolarHBondContact O-N 2.9Å; T319-R322 PolarHBondContact O-N 3.22Å; T319-Y323 PolarHBondContact O-N 3.48Å; T319-I330 HydrophobicContact CG2-CD1 3.53Å; T319-I330 HydrophobicContact CG2-CG1 4.14Å; T319-I330 HydrophobicContact CG2-CG2 3.87Å; T319-I356 HydrophobicContact CG2-CG2 3.99Å
320	S	97.4	Very high	96.3	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-63.2	-34.4	179.4	74.7	0	0	0	0	113.2	L316 L317 R322 Y323 S360 M363	L316-S320 WeakPolarHBondContact O-CB 3.5Å; L316-S320 PolarHBondContact O-N 2.94Å; L317-S320 PolarHBondContact O-N 2.9Å; L317-S320 VanDerWaalsContact O-N 3.17Å; L317-S320 PolarHBondContact O-OG 3.33Å; S320-R322 PolarHBondContact O-N 3.4Å; S320-Y323 WeakPolarHBondContact O-CB 3.45Å; S320-Y323 PolarHBondContact O-N 3.31Å; S320-S360 WeakPolarHBondContact CA-OG 3.47Å; S320-M363 WeakPolarHBondContact OG-CG 3.22Å
321	R	94.9	Very high	96.1	Very high	58 Å²	58	31.2 Å²	31.2	22%	0.219	17%	0.171	C	C	.	.	H	α-helix	trans	-62.5	-27.4	175	-170.3	172.5	68.9	112.7	-10.2	112.9	L317 E318 T319 E370 Y373	L317-R321 PolarHBondContact O-N 2.86Å; E318-R321 IonicContact OE1-NH2 2.72Å; E318-R321 IonicContact OE2-CZ 2.89Å; E318-R321 VanDerWaalsContact OE2-CZ 3.27Å; E318-R321 IonicContact OE2-NE 3.81Å; E318-R321 PolarHBondContact OE2-NE 2.95Å; E318-R321 IonicContact OE2-NH2 3.79Å; E318-R321 PolarHBondContact OE2-NH2 3.12Å; T319-R321 VanDerWaalsContact C-N 3.29Å; T319-R321 PolarHBondContact O-N 2.9Å; R321-E370 IonicContact CZ-OE1 2.85Å; R321-E370 IonicContact CZ-OE2 3.87Å; R321-E370 IonicContact NH1-OE1 3Å; R321-E370 PolarHBondContact NH1-OE1 2.87Å; R321-E370 IonicContact NH1-OE2 2.78Å; R321-E370 PolarHBondContact NH1-OE2 3.34Å; R321-Y373 HydrophobicContact CB-CD1 4.21Å; R321-Y373 HydrophobicContact CB-CD2 4.46Å; R321-Y373 HydrophobicContact CB-CE1 3.76Å; R321-Y373 HydrophobicContact CB-CE2 4.03Å; R321-Y373 HydrophobicContact CG-CD1 4.43Å; R321-Y373 HydrophobicContact CG-CD2 3.9Å; R321-Y373 HydrophobicContact CG-CE1 4.25Å; R321-Y373 HydrophobicContact CG-CE2 3.69Å; R321-Y373 HydrophobicContact CG-CG 4.28Å
322	R	93.7	Very high	95.8	Very high	48 Å²	48	32.2 Å²	32.2	18%	0.181	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	7.9	-177.6	-66.3	178.1	-100.9	174.3	-9.5	113.5	E318 T319 S320 I330 T331	E318-R322 WeakPolarHBondContact O-CG 3.35Å; E318-R322 PolarHBondContact O-NE 2.92Å; T319-R322 PolarHBondContact O-N 3.22Å; S320-R322 PolarHBondContact O-N 3.4Å; R322-I330 HydrophobicContact CB-CG2 4.25Å; R322-T331 WeakPolarHBondContact CB-O 3.43Å; R322-T331 WeakPolarHBondContact CD-O 3.28Å; R322-T331 PolarHBondContact O-N 3Å
323	Y	96.9	Very high	95.1	Very high	16 Å²	16	32.7 Å²	32.7	6%	0.063	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	130.9	179.7	176.2	-112.5	0	0	0	111.4	T319 S320 P325 S329 I330 F357 K361 N364	T319-Y323 PolarHBondContact O-N 3.48Å; S320-Y323 WeakPolarHBondContact O-CB 3.45Å; S320-Y323 PolarHBondContact O-N 3.31Å; Y323-P325 HydrophobicContact CE1-CB 3.97Å; Y323-S329 WeakPolarHBondContact CD2-O 3.28Å; Y323-I330 HydrophobicContact CD2-CG1 4.25Å; Y323-F357 HydrophobicContact CD2-CD1 4.33Å; Y323-F357 AromaticContact CE2-CD1 3.91Å; Y323-F357 HydrophobicContact CE2-CD1 3.91Å; Y323-F357 HydrophobicContact CE2-CE1 4.24Å; Y323-K361 HydrophobicContact CE1-CB 4.46Å; Y323-K361 HydrophobicContact CE1-CG 3.65Å; Y323-K361 WeakPolarHBondContact OH-CE 3.47Å; Y323-K361 WeakPolarHBondContact OH-CG 3.31Å; Y323-N364 HydrophobicContact CD1-CB 4.17Å
324	N	94.3	Very high	94.1	Very high	61 Å²	61	39.4 Å²	39.4	33%	0.326	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	111.4	174.1	-173.9	-22.8	0	0	0	110	A326 I327 E328 S329	N324-A326 VanDerWaalsContact C-N 3.29Å; N324-A326 PolarHBondContact O-N 2.89Å; N324-A326 WeakPolarHBondContact OD1-CB 3.34Å; N324-A326 PolarHBondContact OD1-N 2.9Å; N324-I327 HydrophobicContact CB-CD1 4.46Å; N324-I327 HydrophobicContact CB-CG1 3.94Å; N324-E328 WeakPolarHBondContact O-CA 3.44Å; N324-E328 PolarHBondContact O-N 2.84Å; N324-S329 PolarHBondContact N-O 3.47Å; N324-S329 PolarHBondContact O-N 3.3Å
325	P	94.9	Very high	93.2	Very high	67 Å²	67	43.5 Å²	43.5	44%	0.435	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-22.1	-179.2	27.5	-34.7	0	0	0	113.8	Y323	Y323-P325 HydrophobicContact CE1-CB 3.97Å
326	A	94	Very high	92.8	Very high	88 Å²	88	44.7 Å²	44.7	73%	0.727	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-33.1	-176.3	0	0	0	0	0	113.1	N324	N324-A326 VanDerWaalsContact C-N 3.29Å; N324-A326 PolarHBondContact O-N 2.89Å; N324-A326 WeakPolarHBondContact OD1-CB 3.34Å; N324-A326 PolarHBondContact OD1-N 2.9Å
327	I	93.3	Very high	92.6	Very high	101 Å²	101	46.9 Å²	46.9	52%	0.518	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.1	6.9	-179.6	57	169.6	0	0	0	112.4	N324 S329	N324-I327 HydrophobicContact CB-CD1 4.46Å; N324-I327 HydrophobicContact CB-CG1 3.94Å; I327-S329 VanDerWaalsContact C-N 3.27Å; I327-S329 WeakPolarHBondContact CD1-OG 3.17Å; I327-S329 VanDerWaalsContact CG1-OG 3.25Å; I327-S329 WeakPolarHBondContact CG1-OG 3.37Å; I327-S329 PolarHBondContact O-N 3.22Å
328	E	94.9	Very high	92.5	Very high	97 Å²	97	47.3 Å²	47.3	45%	0.453	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.8	48.2	-177.6	-58.7	-160.3	129.9	0	0	113.7	N324 F357 K361	N324-E328 WeakPolarHBondContact O-CA 3.44Å; N324-E328 PolarHBondContact O-N 2.84Å; E328-F357 WeakPolarHBondContact O-CE1 3.48Å; E328-K361 IonicContact OE1-NZ 2.76Å; E328-K361 PolarHBondContact OE1-NZ 2.99Å
329	S	96.7	Very high	92.5	Very high	5 Å²	5	49.1 Å²	49.1	4%	0.035	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	162.2	-176.8	75.4	0	0	0	0	112.4	Y323 N324 I327 Y338	Y323-S329 WeakPolarHBondContact CD2-O 3.28Å; N324-S329 PolarHBondContact N-O 3.47Å; N324-S329 PolarHBondContact O-N 3.3Å; I327-S329 VanDerWaalsContact C-N 3.27Å; I327-S329 WeakPolarHBondContact CD1-OG 3.17Å; I327-S329 VanDerWaalsContact CG1-OG 3.25Å; I327-S329 WeakPolarHBondContact CG1-OG 3.37Å; I327-S329 PolarHBondContact O-N 3.22Å; S329-Y338 CarbonylContact C-O 3.48Å; S329-Y338 VanDerWaalsContact CA-O 3.24Å; S329-Y338 WeakPolarHBondContact CA-O 3.28Å; S329-Y338 VanDerWaalsContact CB-O 3.31Å; S329-Y338 WeakPolarHBondContact CB-O 3.22Å
330	I	96.6	Very high	92.6	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	130.7	172.5	-63.7	156.2	0	0	0	108.3	T319 R322 Y323 F332 S337 Y338 F343 I356 F357	T319-I330 HydrophobicContact CG2-CD1 3.53Å; T319-I330 HydrophobicContact CG2-CG1 4.14Å; T319-I330 HydrophobicContact CG2-CG2 3.87Å; R322-I330 HydrophobicContact CB-CG2 4.25Å; Y323-I330 HydrophobicContact CD2-CG1 4.25Å; I330-F332 HydrophobicContact CB-CE2 4Å; I330-F332 HydrophobicContact CB-CZ 4.45Å; I330-F332 HydrophobicContact CG2-CD2 4.09Å; I330-F332 HydrophobicContact CG2-CE1 4.35Å; I330-F332 HydrophobicContact CG2-CE2 3.41Å; I330-F332 VanDerWaalsContact CG2-CE2 3.41Å; I330-F332 HydrophobicContact CG2-CZ 3.55Å; I330-S337 WeakPolarHBondContact O-CA 3.38Å; I330-Y338 PolarHBondContact N-O 3.07Å; I330-Y338 PolarHBondContact O-N 3.17Å; I330-F343 HydrophobicContact CD1-CE2 4.08Å; I330-F343 HydrophobicContact CD1-CZ 4.19Å; I330-I356 HydrophobicContact CD1-CG2 4.44Å; I330-F357 HydrophobicContact CD1-CD2 4.35Å; I330-F357 HydrophobicContact CD1-CE1 4.05Å; I330-F357 HydrophobicContact CD1-CE2 3.83Å; I330-F357 HydrophobicContact CD1-CZ 3.68Å; I330-F357 HydrophobicContact CG1-CE1 4.23Å; I330-F357 HydrophobicContact CG1-CZ 4.21Å
331	T	92.3	Very high	92.5	Very high	30 Å²	30	54.9 Å²	54.9	18%	0.184	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	113.4	-177.2	-54.4	0	0	0	0	112.6	R322 K334 F336 S337	R322-T331 WeakPolarHBondContact CB-O 3.43Å; R322-T331 WeakPolarHBondContact CD-O 3.28Å; R322-T331 PolarHBondContact O-N 3Å; T331-K334 WeakPolarHBondContact CG2-O 3.18Å; T331-F336 CarbonylContact C-O 3.49Å; T331-F336 VanDerWaalsContact CA-O 3.3Å; T331-F336 WeakPolarHBondContact CA-O 3.24Å; T331-S337 WeakPolarHBondContact CG2-OG 3.44Å; T331-S337 PolarHBondContact OG1-OG 3.37Å
332	F	90.7	Very high	92.5	Very high	22 Å²	22	53.2 Å²	53.2	10%	0.096	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	144.5	175.1	-58.7	-97.5	0	0	0	111.2	L277 I330 K334 D335 F336 Y338 F343	L277-F332 HydrophobicContact CD1-CB 3.94Å; L277-F332 HydrophobicContact CD1-CD1 4.36Å; L277-F332 HydrophobicContact CD1-CD2 4.44Å; L277-F332 HydrophobicContact CD1-CG 4.01Å; L277-F332 HydrophobicContact CD2-CB 4.43Å; I330-F332 HydrophobicContact CB-CE2 4Å; I330-F332 HydrophobicContact CB-CZ 4.45Å; I330-F332 HydrophobicContact CG2-CD2 4.09Å; I330-F332 HydrophobicContact CG2-CE1 4.35Å; I330-F332 HydrophobicContact CG2-CE2 3.41Å; I330-F332 VanDerWaalsContact CG2-CE2 3.41Å; I330-F332 HydrophobicContact CG2-CZ 3.55Å; F332-K334 PolarHBondContact O-N 3.05Å; F332-D335 PolarHBondContact O-N 3.17Å; F332-F336 HydrophobicContact CB-CB 4.32Å; F332-F336 PolarHBondContact N-O 2.73Å; F332-F336 WeakPolarHBondContact O-CB 3.19Å; F332-F336 PolarHBondContact O-N 2.89Å; F332-Y338 AromaticContact CD2-CD2 3.75Å; F332-Y338 HydrophobicContact CD2-CD2 3.75Å; F332-Y338 HydrophobicContact CD2-CE2 4.19Å; F332-Y338 HydrophobicContact CE2-CD2 4.07Å; F332-F343 AromaticContact CE2-CZ 3.85Å; F332-F343 HydrophobicContact CE2-CZ 3.85Å; F332-F343 HydrophobicContact CZ-CE1 4.48Å; F332-F343 HydrophobicContact CZ-CZ 4.04Å
333	L	84.4	Confident	92.6	Very high	21 Å²	21	52.1 Å²	52.1	11%	0.11	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	34.2	177.8	-54.7	178.4	0	0	0	114	R249 V252 L277 M280 D335 F336	R249-L333 HydrophobicContact CB-CD1 4.15Å; R249-L333 HydrophobicContact CG-CD1 4.24Å; V252-L333 HydrophobicContact CG2-CD1 4.12Å; L277-L333 HydrophobicContact CD2-CD1 3.54Å; L277-L333 HydrophobicContact CD2-CG 4.02Å; M280-L333 HydrophobicContact CE-CD1 3.95Å; M280-L333 HydrophobicContact CE-CD2 3.98Å; M280-L333 HydrophobicContact SD-CD1 4.13Å; L333-D335 PolarHBondContact O-N 3.4Å; L333-F336 HydrophobicContact CB-CD2 4.11Å; L333-F336 HydrophobicContact CB-CE2 4.43Å; L333-F336 HydrophobicContact CD1-CD2 4.31Å; L333-F336 HydrophobicContact CD1-CE2 4.17Å
334	K	76.4	Confident	92.5	Very high	143 Å²	143	52.6 Å²	52.6	62%	0.622	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	-17.8	-179.1	-59.5	-178.9	178.8	177.6	0	117.5	F246 T331 F332	F246-K334 HydrophobicContact CD2-CD 4.46Å; F246-K334 HydrophobicContact CE2-CD 4.38Å; T331-K334 WeakPolarHBondContact CG2-O 3.18Å; F332-K334 PolarHBondContact O-N 3.05Å
335	D	80.1	Confident	92.5	Very high	88 Å²	88	52.6 Å²	52.6	47%	0.471	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.6	-19.3	-170.2	-67.4	10.7	0	0	0	113.6	R249 F332 L333 S337	R249-D335 IonicContact CZ-OD2 2.62Å; R249-D335 IonicContact NH1-OD2 2.71Å; R249-D335 PolarHBondContact NH1-OD2 2.9Å; R249-D335 VanDerWaalsContact NH2-CB 3.32Å; R249-D335 IonicContact NH2-OD2 2.69Å; R249-D335 PolarHBondContact NH2-OD2 2.77Å; F332-D335 PolarHBondContact O-N 3.17Å; L333-D335 PolarHBondContact O-N 3.4Å; D335-S337 PolarHBondContact O-N 2.8Å
336	F	88.6	Confident	92.4	Very high	48 Å²	48	49.4 Å²	49.4	21%	0.211	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	95.6	-175.8	-61.7	-53.6	0	0	0	110.7	R249 T331 F332 L333 Y338	R249-F336 HydrophobicContact CG-CE2 3.98Å; R249-F336 HydrophobicContact CG-CZ 4.32Å; T331-F336 CarbonylContact C-O 3.49Å; T331-F336 VanDerWaalsContact CA-O 3.3Å; T331-F336 WeakPolarHBondContact CA-O 3.24Å; F332-F336 HydrophobicContact CB-CB 4.32Å; F332-F336 PolarHBondContact N-O 2.73Å; F332-F336 WeakPolarHBondContact O-CB 3.19Å; F332-F336 PolarHBondContact O-N 2.89Å; L333-F336 HydrophobicContact CB-CD2 4.11Å; L333-F336 HydrophobicContact CB-CE2 4.43Å; L333-F336 HydrophobicContact CD1-CD2 4.31Å; L333-F336 HydrophobicContact CD1-CE2 4.17Å; F336-Y338 HydrophobicContact CB-CE2 3.6Å
337	S	94.2	Very high	92.3	Very high	53 Å²	53	46 Å²	46	37%	0.371	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124.7	-179.8	-60.7	0	0	0	0	111.5	I330 T331 D335	I330-S337 WeakPolarHBondContact O-CA 3.38Å; T331-S337 WeakPolarHBondContact CG2-OG 3.44Å; T331-S337 PolarHBondContact OG1-OG 3.37Å; D335-S337 PolarHBondContact O-N 2.8Å
338	Y	96.3	Very high	92.4	Very high	10 Å²	10	42.5 Å²	42.5	4%	0.039	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	132.1	-176.4	-58.6	-61.6	0	0	0	111.6	W255 H273 F274 L277 S329 I330 F332 F336 D342	W255-Y338 AromaticContact CD2-CE1 3.77Å; W255-Y338 HydrophobicContact CD2-CE1 3.77Å; W255-Y338 AromaticContact CE2-CE1 3.89Å; W255-Y338 AromaticContact CE3-CE1 3.8Å; W255-Y338 HydrophobicContact CE3-CE1 3.8Å; W255-Y338 HydrophobicContact CG-CE1 4.31Å; W255-Y338 HydrophobicContact CH2-CD1 4.12Å; W255-Y338 HydrophobicContact CH2-CE1 4.06Å; W255-Y338 HydrophobicContact CZ2-CD1 4.11Å; W255-Y338 AromaticContact CZ2-CE1 4Å; W255-Y338 HydrophobicContact CZ2-CE1 4Å; W255-Y338 HydrophobicContact CZ3-CD1 4.39Å; W255-Y338 AromaticContact CZ3-CE1 3.97Å; W255-Y338 HydrophobicContact CZ3-CE1 3.97Å; H273-Y338 AromaticContact CD2-CZ 3.94Å; H273-Y338 PolarHBondContact CD2-OH 2.72Å; H273-Y338 PolarHBondContact CE1-OH 2.78Å; H273-Y338 AromaticContact NE2-CE2 3.62Å; H273-Y338 AromaticContact NE2-CZ 3.43Å; H273-Y338 PolarHBondContact NE2-OH 3.49Å; F274-Y338 AromaticContact CE1-CD2 3.48Å; F274-Y338 HydrophobicContact CE1-CD2 3.48Å; F274-Y338 VanDerWaalsContact CE1-CD2 3.48Å; F274-Y338 AromaticContact CE1-CE2 3.83Å; F274-Y338 HydrophobicContact CE1-CE2 3.83Å; F274-Y338 AromaticContact CE1-CG 3.91Å; F274-Y338 HydrophobicContact CE1-CG 3.91Å; F274-Y338 HydrophobicContact CZ-CD1 4.21Å; F274-Y338 AromaticContact CZ-CD2 3.87Å; F274-Y338 HydrophobicContact CZ-CD2 3.87Å; F274-Y338 HydrophobicContact CZ-CE2 4.3Å; F274-Y338 AromaticContact CZ-CG 3.8Å; F274-Y338 HydrophobicContact CZ-CG 3.8Å; L277-Y338 HydrophobicContact CD1-CE2 4.24Å; S329-Y338 CarbonylContact C-O 3.48Å; S329-Y338 VanDerWaalsContact CA-O 3.24Å; S329-Y338 WeakPolarHBondContact CA-O 3.28Å; S329-Y338 VanDerWaalsContact CB-O 3.31Å; S329-Y338 WeakPolarHBondContact CB-O 3.22Å; I330-Y338 PolarHBondContact N-O 3.07Å; I330-Y338 PolarHBondContact O-N 3.17Å; F332-Y338 AromaticContact CD2-CD2 3.75Å; F332-Y338 HydrophobicContact CD2-CD2 3.75Å; F332-Y338 HydrophobicContact CD2-CE2 4.19Å; F332-Y338 HydrophobicContact CE2-CD2 4.07Å; F336-Y338 HydrophobicContact CB-CE2 3.6Å; Y338-D342 HydrophobicContact CD1-CB 3.99Å; Y338-D342 HydrophobicContact CG-CB 4.44Å
339	N	96.4	Very high	92.4	Very high	57 Å²	57	41.5 Å²	41.5	31%	0.305	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	178.4	172.4	70.1	24.2	0	0	0	111	D341 D342 F343	N339-D341 VanDerWaalsContact C-N 3.26Å; N339-D341 PolarHBondContact O-N 2.98Å; N339-D341 WeakPolarHBondContact OD1-CA 3.28Å; N339-D341 WeakPolarHBondContact OD1-CB 3.35Å; N339-D341 PolarHBondContact OD1-N 3.41Å; N339-D342 PolarHBondContact N-OD2 2.94Å; N339-D342 PolarHBondContact O-N 3.49Å; N339-D342 VanDerWaalsContact O-N 3.11Å; N339-D342 PolarHBondContact OD1-N 2.96Å; N339-D342 PolarHBondContact OD1-OD2 2.88Å; N339-F343 VanDerWaalsContact O-CD2 3.24Å; N339-F343 WeakPolarHBondContact O-CD2 3.31Å; N339-F343 PolarHBondContact O-N 3.29Å
340	K	96.9	Very high	92.4	Very high	52 Å²	52	45.8 Å²	45.8	23%	0.226	23%	0.233	C	C	.	.	H	α-helix	trans	-53.2	-42.3	178.8	-69.5	-175.4	171	-162.2	0	113.2	D342 F343 A344 I353 N354 F357	K340-D342 VanDerWaalsContact C-N 3.29Å; K340-D342 PolarHBondContact O-N 3.28Å; K340-F343 PolarHBondContact O-N 3.44Å; K340-A344 PolarHBondContact O-N 3.49Å; K340-A344 VanDerWaalsContact O-N 3.11Å; K340-I353 HydrophobicContact CB-CG2 4.08Å; K340-I353 HydrophobicContact CG-CG2 4.07Å; K340-N354 PolarHBondContact NZ-OD1 3.29Å; K340-F357 HydrophobicContact CB-CE2 4.4Å; K340-F357 HydrophobicContact CD-CD2 4.45Å; K340-F357 HydrophobicContact CD-CG 4.28Å; K340-F357 HydrophobicContact CG-CB 4.46Å; K340-F357 HydrophobicContact CG-CD1 3.88Å; K340-F357 HydrophobicContact CG-CD2 3.61Å; K340-F357 HydrophobicContact CG-CE1 3.93Å; K340-F357 HydrophobicContact CG-CE2 3.66Å; K340-F357 HydrophobicContact CG-CG 3.71Å; K340-F357 HydrophobicContact CG-CZ 3.81Å
341	D	95	Very high	92.5	Very high	87 Å²	87	52.1 Å²	52.1	47%	0.465	26%	0.263	S	S	.	.	H	α-helix	trans	-66	-35.6	-178.2	-62.2	-30.2	0	0	0	111.1	N339 F343 A344 K345	N339-D341 VanDerWaalsContact C-N 3.26Å; N339-D341 PolarHBondContact O-N 2.98Å; N339-D341 WeakPolarHBondContact OD1-CA 3.28Å; N339-D341 WeakPolarHBondContact OD1-CB 3.35Å; N339-D341 PolarHBondContact OD1-N 3.41Å; D341-F343 VanDerWaalsContact C-N 3.35Å; D341-F343 PolarHBondContact O-N 3.32Å; D341-A344 CarbonylContact O-C 3.6Å; D341-A344 WeakPolarHBondContact O-CB 3.47Å; D341-A344 PolarHBondContact O-N 3.07Å; D341-A344 VanDerWaalsContact O-N 3.17Å; D341-K345 WeakPolarHBondContact O-CG 3.05Å; D341-K345 PolarHBondContact O-N 3.36Å
342	D	95.6	Very high	92.7	Very high	24 Å²	24	51.9 Å²	51.9	13%	0.128	26%	0.259	C	S	.	.	H	α-helix	trans	-65.5	-37.3	178.6	-64.7	-38.3	0	0	0	112.6	W255 Y338 N339 K340 K345 A346	W255-D342 HydrophobicContact CH2-CB 3.97Å; W255-D342 HydrophobicContact CZ2-CB 3.85Å; Y338-D342 HydrophobicContact CD1-CB 3.99Å; Y338-D342 HydrophobicContact CG-CB 4.44Å; N339-D342 PolarHBondContact N-OD2 2.94Å; N339-D342 PolarHBondContact O-N 3.49Å; N339-D342 VanDerWaalsContact O-N 3.11Å; N339-D342 PolarHBondContact OD1-N 2.96Å; N339-D342 PolarHBondContact OD1-OD2 2.88Å; K340-D342 VanDerWaalsContact C-N 3.29Å; K340-D342 PolarHBondContact O-N 3.28Å; D342-K345 PolarHBondContact O-N 3.36Å; D342-K345 IonicContact OD1-NZ 2.61Å; D342-K345 PolarHBondContact OD1-NZ 2.91Å; D342-A346 PolarHBondContact O-N 3.08Å
343	F	96	Very high	93.1	Very high	25 Å²	25	50.9 Å²	50.9	11%	0.11	26%	0.255	C	S	.	.	H	α-helix	trans	-64.3	-42.8	169.9	-71.5	-81.8	0	0	0	111.6	F274 I330 F332 N339 K340 D341 K345 A346 L348 I353 F357	F274-F343 HydrophobicContact CD1-CD1 4.39Å; F274-F343 HydrophobicContact CD1-CE1 4.03Å; F274-F343 AromaticContact CE1-CD1 3.93Å; F274-F343 HydrophobicContact CE1-CD1 3.93Å; F274-F343 AromaticContact CE1-CE1 3.57Å; F274-F343 HydrophobicContact CE1-CE1 3.57Å; F274-F343 HydrophobicContact CE1-CZ 4.06Å; F274-F343 HydrophobicContact CE2-CD1 4.15Å; F274-F343 AromaticContact CZ-CD1 3.8Å; F274-F343 HydrophobicContact CZ-CD1 3.8Å; F274-F343 AromaticContact CZ-CE1 3.91Å; F274-F343 HydrophobicContact CZ-CE1 3.91Å; F274-F343 HydrophobicContact CZ-CG 4.23Å; F274-F343 HydrophobicContact CZ-CZ 4.4Å; I330-F343 HydrophobicContact CD1-CE2 4.08Å; I330-F343 HydrophobicContact CD1-CZ 4.19Å; F332-F343 AromaticContact CE2-CZ 3.85Å; F332-F343 HydrophobicContact CE2-CZ 3.85Å; F332-F343 HydrophobicContact CZ-CE1 4.48Å; F332-F343 HydrophobicContact CZ-CZ 4.04Å; N339-F343 VanDerWaalsContact O-CD2 3.24Å; N339-F343 WeakPolarHBondContact O-CD2 3.31Å; N339-F343 PolarHBondContact O-N 3.29Å; K340-F343 PolarHBondContact O-N 3.44Å; D341-F343 VanDerWaalsContact C-N 3.35Å; D341-F343 PolarHBondContact O-N 3.32Å; F343-K345 VanDerWaalsContact C-N 3.3Å; F343-K345 PolarHBondContact O-N 2.92Å; F343-A346 WeakPolarHBondContact O-CB 3.25Å; F343-A346 PolarHBondContact O-N 2.9Å; F343-A346 VanDerWaalsContact O-N 3.08Å; F343-L348 HydrophobicContact CB-CD1 4.28Å; F343-L348 HydrophobicContact CD1-CD1 3.94Å; F343-L348 PolarHBondContact O-N 3.36Å; F343-I353 HydrophobicContact CB-CD1 3.72Å; F343-I353 HydrophobicContact CB-CG1 3.82Å; F343-I353 HydrophobicContact CB-CG2 4.26Å; F343-F357 AromaticContact CD2-CE2 3.77Å; F343-F357 HydrophobicContact CD2-CE2 3.77Å; F343-F357 HydrophobicContact CD2-CZ 4.02Å; F343-F357 AromaticContact CE2-CE2 3.81Å; F343-F357 HydrophobicContact CE2-CE2 3.81Å; F343-F357 AromaticContact CE2-CZ 3.82Å; F343-F357 HydrophobicContact CE2-CZ 3.82Å
344	A	95.1	Very high	93.7	Very high	25 Å²	25	52.3 Å²	52.3	21%	0.207	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-36.4	177.2	0	0	0	0	0	112	K340 D341 A346 G347 F350 I353	K340-A344 PolarHBondContact O-N 3.49Å; K340-A344 VanDerWaalsContact O-N 3.11Å; D341-A344 CarbonylContact O-C 3.6Å; D341-A344 WeakPolarHBondContact O-CB 3.47Å; D341-A344 PolarHBondContact O-N 3.07Å; D341-A344 VanDerWaalsContact O-N 3.17Å; A344-A346 PolarHBondContact O-N 3.02Å; A344-G347 WeakPolarHBondContact O-CA 3.2Å; A344-G347 PolarHBondContact O-N 3.39Å; A344-F350 HydrophobicContact CB-CE1 3.88Å; A344-F350 HydrophobicContact CB-CE2 3.98Å; A344-F350 HydrophobicContact CB-CZ 3.51Å; A344-I353 HydrophobicContact CB-CD1 3.89Å
345	K	93.7	Very high	94.8	Very high	62 Å²	62	47.2 Å²	47.2	27%	0.27	24%	0.244	S	C	.	.	H	α-helix	trans	-64.3	-20.5	174.4	-69	171.6	-159.1	155	0	113.4	L261 R267 R270 D341 D342 F343	L261-K345 HydrophobicContact CD2-CB 4.39Å; L261-K345 HydrophobicContact CD2-CD 3.93Å; L261-K345 HydrophobicContact CD2-CG 3.58Å; R267-K345 WeakPolarHBondContact CG-O 3.44Å; R270-K345 WeakPolarHBondContact CD-O 3.38Å; D341-K345 WeakPolarHBondContact O-CG 3.05Å; D341-K345 PolarHBondContact O-N 3.36Å; D342-K345 PolarHBondContact O-N 3.36Å; D342-K345 IonicContact OD1-NZ 2.61Å; D342-K345 PolarHBondContact OD1-NZ 2.91Å; F343-K345 VanDerWaalsContact C-N 3.3Å; F343-K345 PolarHBondContact O-N 2.92Å
346	A	93	Very high	95.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-2.4	170.2	0	0	0	0	0	113.2	R270 F274 D342 F343 A344	R270-A346 HydrophobicContact CB-CB 3.9Å; F274-A346 HydrophobicContact CD2-CB 3.53Å; F274-A346 HydrophobicContact CE2-CB 3.76Å; D342-A346 PolarHBondContact O-N 3.08Å; F343-A346 WeakPolarHBondContact O-CB 3.25Å; F343-A346 PolarHBondContact O-N 2.9Å; F343-A346 VanDerWaalsContact O-N 3.08Å; A344-A346 PolarHBondContact O-N 3.02Å
347	G	91.9	Very high	96.1	Very high	17 Å²	17	41.8 Å²	41.8	18%	0.175	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.1	23.5	-179.2	0	0	0	0	0	113.9	A344	A344-G347 WeakPolarHBondContact O-CA 3.2Å; A344-G347 PolarHBondContact O-N 3.39Å
348	L	94.8	Very high	96.3	Very high	26 Å²	26	45.2 Å²	45.2	14%	0.136	23%	0.227	C	C	.	.			trans	-82.6	146.5	167.7	-57.7	179.6	0	0	0	110	F271 F343 F352 I353 Q441	F271-L348 HydrophobicContact CE2-CD2 4.47Å; F343-L348 HydrophobicContact CB-CD1 4.28Å; F343-L348 HydrophobicContact CD1-CD1 3.94Å; F343-L348 PolarHBondContact O-N 3.36Å; L348-F352 HydrophobicContact CB-CD1 4.42Å; L348-F352 HydrophobicContact CD1-CD1 4.45Å; L348-F352 HydrophobicContact CD1-CE1 4.25Å; L348-I353 HydrophobicContact CB-CD1 3.99Å; L348-I353 HydrophobicContact CB-CG1 4.08Å; L348-I353 WeakPolarHBondContact O-CD1 3.26Å; L348-Q441 HydrophobicContact CD2-CG 4.32Å
349	Q	96.1	Very high	96.4	Very high	77 Å²	77	45.4 Å²	45.4	36%	0.36	23%	0.228	S	C	.	.			trans	-79.5	145.6	-176.4	-68	178.1	-21	0	0	111.3	E351 F352 I353	Q349-E351 PolarHBondContact O-N 3.24Å; Q349-F352 WeakPolarHBondContact O-CB 3.48Å; Q349-F352 PolarHBondContact O-N 2.7Å; Q349-I353 WeakPolarHBondContact O-CD1 3.32Å; Q349-I353 VanDerWaalsContact O-CG1 3.26Å; Q349-I353 WeakPolarHBondContact O-CG1 3.43Å; Q349-I353 PolarHBondContact O-N 2.92Å
350	F	97.2	Very high	96.5	Very high	94 Å²	94	42.7 Å²	42.7	41%	0.412	21%	0.214	S	C	.	.	H	α-helix	trans	-66.4	-28.3	179	-79.7	-71.5	0	0	0	112.4	A344 F352 I353 N354	A344-F350 HydrophobicContact CB-CE1 3.88Å; A344-F350 HydrophobicContact CB-CE2 3.98Å; A344-F350 HydrophobicContact CB-CZ 3.51Å; F350-F352 PolarHBondContact O-N 3.31Å; F350-I353 HydrophobicContact CD1-CD1 4.38Å; F350-I353 PolarHBondContact O-N 3.41Å; F350-N354 VanDerWaalsContact O-CB 3.27Å; F350-N354 WeakPolarHBondContact O-CB 3.33Å; F350-N354 PolarHBondContact O-N 3.16Å; F350-N354 PolarHBondContact O-ND2 3.26Å
351	E	97.1	Very high	96.6	Very high	133 Å²	133	43.8 Å²	43.8	62%	0.621	22%	0.218	S	C	*	.	H	α-helix	trans	-61	-29.3	172.8	-65.6	73.6	-165.1	0	0	111.6	Q349 P355 V437	Q349-E351 PolarHBondContact O-N 3.24Å; E351-P355 WeakPolarHBondContact O-CD 3.4Å; E351-P355 WeakPolarHBondContact O-CG 3.5Å; E351-V437 WeakPolarHBondContact O-CG1 3.31Å
352	F	97.5	Very high	96.7	Very high	25 Å²	25	40.4 Å²	40.4	11%	0.11	20%	0.204	C	C	.	.	H	α-helix	trans	-87.1	-43.6	171.3	174.8	-116	0	0	0	112.3	L348 Q349 F350 I356 V437 H438 Q441	L348-F352 HydrophobicContact CB-CD1 4.42Å; L348-F352 HydrophobicContact CD1-CD1 4.45Å; L348-F352 HydrophobicContact CD1-CE1 4.25Å; Q349-F352 WeakPolarHBondContact O-CB 3.48Å; Q349-F352 PolarHBondContact O-N 2.7Å; F350-F352 PolarHBondContact O-N 3.31Å; F352-I356 HydrophobicContact CD1-CD1 4.15Å; F352-I356 HydrophobicContact CD2-CD1 4.21Å; F352-I356 HydrophobicContact CE1-CD1 3.74Å; F352-I356 HydrophobicContact CE2-CD1 3.78Å; F352-I356 HydrophobicContact CG-CD1 4.39Å; F352-I356 HydrophobicContact CZ-CD1 3.55Å; F352-I356 WeakPolarHBondContact O-CD1 3.43Å; F352-I356 WeakPolarHBondContact O-CG1 3.47Å; F352-V437 HydrophobicContact CB-CG1 4.31Å; F352-V437 HydrophobicContact CD2-CG1 4.13Å; F352-H438 HydrophobicContact CD2-CB 4.49Å; F352-H438 HydrophobicContact CE2-CB 3.78Å; F352-H438 AromaticContact CE2-CD2 3.86Å; F352-H438 AromaticContact CZ-CD2 3.84Å; F352-Q441 HydrophobicContact CB-CB 4.01Å; F352-Q441 HydrophobicContact CB-CG 4.18Å; F352-Q441 HydrophobicContact CD1-CB 4.19Å; F352-Q441 HydrophobicContact CD1-CG 3.68Å; F352-Q441 HydrophobicContact CD2-CB 3.91Å; F352-Q441 HydrophobicContact CD2-CG 4.31Å; F352-Q441 HydrophobicContact CE1-CG 4.08Å; F352-Q441 HydrophobicContact CE2-CB 4.43Å; F352-Q441 HydrophobicContact CG-CB 3.77Å; F352-Q441 HydrophobicContact CG-CG 3.79Å
353	I	98.3	Very high	96.8	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-67.6	-46.7	-175	-62.3	160.2	0	0	0	112	K340 F343 A344 L348 Q349 F350 I356 F357	K340-I353 HydrophobicContact CB-CG2 4.08Å; K340-I353 HydrophobicContact CG-CG2 4.07Å; F343-I353 HydrophobicContact CB-CD1 3.72Å; F343-I353 HydrophobicContact CB-CG1 3.82Å; F343-I353 HydrophobicContact CB-CG2 4.26Å; A344-I353 HydrophobicContact CB-CD1 3.89Å; L348-I353 HydrophobicContact CB-CD1 3.99Å; L348-I353 HydrophobicContact CB-CG1 4.08Å; L348-I353 WeakPolarHBondContact O-CD1 3.26Å; Q349-I353 WeakPolarHBondContact O-CD1 3.32Å; Q349-I353 VanDerWaalsContact O-CG1 3.26Å; Q349-I353 WeakPolarHBondContact O-CG1 3.43Å; Q349-I353 PolarHBondContact O-N 2.92Å; F350-I353 HydrophobicContact CD1-CD1 4.38Å; F350-I353 PolarHBondContact O-N 3.41Å; I353-I356 WeakPolarHBondContact O-CB 3.41Å; I353-I356 PolarHBondContact O-N 2.93Å; I353-F357 HydrophobicContact CG2-CD2 3.84Å; I353-F357 HydrophobicContact CG2-CE2 3.84Å; I353-F357 WeakPolarHBondContact O-CD2 3.47Å; I353-F357 PolarHBondContact O-N 2.86Å
354	N	98.1	Very high	96.9	Very high	52 Å²	52	40.4 Å²	40.4	28%	0.278	21%	0.206	S	C	.	.	H	α-helix	trans	-61	-47.9	-172.5	-76	-34.9	0	0	0	112.9	K340 F350 I356 F357 E358	K340-N354 PolarHBondContact NZ-OD1 3.29Å; F350-N354 VanDerWaalsContact O-CB 3.27Å; F350-N354 WeakPolarHBondContact O-CB 3.33Å; F350-N354 PolarHBondContact O-N 3.16Å; F350-N354 PolarHBondContact O-ND2 3.26Å; N354-I356 VanDerWaalsContact C-N 3.26Å; N354-I356 PolarHBondContact O-N 3.23Å; N354-F357 PolarHBondContact O-N 2.95Å; N354-E358 WeakPolarHBondContact O-CG 3.4Å; N354-E358 PolarHBondContact O-N 2.72Å
355	P	98.6	Very high	96.9	Very high	36 Å²	36	44.7 Å²	44.7	23%	0.234	23%	0.225	C	C	.	.	H	α-helix	trans	-57.3	-35.2	176	-29.4	38.5	0	0	0	114.1	E351 E358 F359 L434	E351-P355 WeakPolarHBondContact O-CD 3.4Å; E351-P355 WeakPolarHBondContact O-CG 3.5Å; P355-E358 PolarHBondContact O-N 3.33Å; P355-F359 VanDerWaalsContact O-CB 3.26Å; P355-F359 WeakPolarHBondContact O-CB 3.44Å; P355-F359 PolarHBondContact O-N 3.17Å; P355-L434 HydrophobicContact CB-CD2 3.32Å
356	I	98.4	Very high	97	Very high	18 Å²	18	42.2 Å²	42.2	9%	0.092	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-46.7	177.5	-61	171.8	0	0	0	110.7	L316 T319 I330 F352 I353 N354 F359 S360	L316-I356 HydrophobicContact CD2-CB 4.38Å; L316-I356 HydrophobicContact CD2-CD1 4.02Å; L316-I356 HydrophobicContact CD2-CG1 3.68Å; L316-I356 HydrophobicContact CD2-CG2 4.01Å; T319-I356 HydrophobicContact CG2-CG2 3.99Å; I330-I356 HydrophobicContact CD1-CG2 4.44Å; F352-I356 HydrophobicContact CD1-CD1 4.15Å; F352-I356 HydrophobicContact CD2-CD1 4.21Å; F352-I356 HydrophobicContact CE1-CD1 3.74Å; F352-I356 HydrophobicContact CE2-CD1 3.78Å; F352-I356 HydrophobicContact CG-CD1 4.39Å; F352-I356 HydrophobicContact CZ-CD1 3.55Å; F352-I356 WeakPolarHBondContact O-CD1 3.43Å; F352-I356 WeakPolarHBondContact O-CG1 3.47Å; I353-I356 WeakPolarHBondContact O-CB 3.41Å; I353-I356 PolarHBondContact O-N 2.93Å; N354-I356 VanDerWaalsContact C-N 3.26Å; N354-I356 PolarHBondContact O-N 3.23Å; I356-F359 PolarHBondContact O-N 3.11Å; I356-S360 WeakPolarHBondContact O-CB 3.43Å; I356-S360 PolarHBondContact O-N 2.96Å; I356-S360 PolarHBondContact O-OG 3.32Å
357	F	98.4	Very high	97.1	Very high	3 Å²	3	48.8 Å²	48.8	1%	0.013	25%	0.245	C	C	.	.	H	α-helix	trans	-69.7	-36	178.5	-83.6	-97.5	0	0	0	112	Y323 E328 I330 K340 F343 I353 N354 S360 K361	Y323-F357 HydrophobicContact CD2-CD1 4.33Å; Y323-F357 AromaticContact CE2-CD1 3.91Å; Y323-F357 HydrophobicContact CE2-CD1 3.91Å; Y323-F357 HydrophobicContact CE2-CE1 4.24Å; E328-F357 WeakPolarHBondContact O-CE1 3.48Å; I330-F357 HydrophobicContact CD1-CD2 4.35Å; I330-F357 HydrophobicContact CD1-CE1 4.05Å; I330-F357 HydrophobicContact CD1-CE2 3.83Å; I330-F357 HydrophobicContact CD1-CZ 3.68Å; I330-F357 HydrophobicContact CG1-CE1 4.23Å; I330-F357 HydrophobicContact CG1-CZ 4.21Å; K340-F357 HydrophobicContact CB-CE2 4.4Å; K340-F357 HydrophobicContact CD-CD2 4.45Å; K340-F357 HydrophobicContact CD-CG 4.28Å; K340-F357 HydrophobicContact CG-CB 4.46Å; K340-F357 HydrophobicContact CG-CD1 3.88Å; K340-F357 HydrophobicContact CG-CD2 3.61Å; K340-F357 HydrophobicContact CG-CE1 3.93Å; K340-F357 HydrophobicContact CG-CE2 3.66Å; K340-F357 HydrophobicContact CG-CG 3.71Å; K340-F357 HydrophobicContact CG-CZ 3.81Å; F343-F357 AromaticContact CD2-CE2 3.77Å; F343-F357 HydrophobicContact CD2-CE2 3.77Å; F343-F357 HydrophobicContact CD2-CZ 4.02Å; F343-F357 AromaticContact CE2-CE2 3.81Å; F343-F357 HydrophobicContact CE2-CE2 3.81Å; F343-F357 AromaticContact CE2-CZ 3.82Å; F343-F357 HydrophobicContact CE2-CZ 3.82Å; I353-F357 HydrophobicContact CG2-CD2 3.84Å; I353-F357 HydrophobicContact CG2-CE2 3.84Å; I353-F357 WeakPolarHBondContact O-CD2 3.47Å; I353-F357 PolarHBondContact O-N 2.86Å; N354-F357 PolarHBondContact O-N 2.95Å; F357-S360 PolarHBondContact O-N 3.21Å; F357-K361 WeakPolarHBondContact O-CG 3.48Å; F357-K361 PolarHBondContact O-N 2.88Å
358	E	98.3	Very high	97.4	Very high	125 Å²	125	49 Å²	49	58%	0.584	24%	0.242	S	C	*	.	H	α-helix	trans	-64.6	-44.5	174.4	-74.3	174.9	-166	0	0	111.8	N354 P355 S360 K361 G362	N354-E358 WeakPolarHBondContact O-CG 3.4Å; N354-E358 PolarHBondContact O-N 2.72Å; P355-E358 PolarHBondContact O-N 3.33Å; E358-S360 VanDerWaalsContact C-N 3.31Å; E358-S360 PolarHBondContact O-N 3.44Å; E358-K361 PolarHBondContact O-N 2.8Å; E358-G362 PolarHBondContact O-N 3.24Å
359	F	98.6	Very high	97.5	Very high	15 Å²	15	50 Å²	50	7%	0.066	25%	0.247	C	C	.	.	H	α-helix	trans	-59.7	-44.2	172	179	-99.3	0	0	0	111.3	L317 P355 I356 K361 G362 M363 K427 L431 L434	L317-F359 HydrophobicContact CD2-CE1 4.33Å; L317-F359 HydrophobicContact CD2-CZ 4.01Å; P355-F359 VanDerWaalsContact O-CB 3.26Å; P355-F359 WeakPolarHBondContact O-CB 3.44Å; P355-F359 PolarHBondContact O-N 3.17Å; I356-F359 PolarHBondContact O-N 3.11Å; F359-K361 PolarHBondContact O-N 3.43Å; F359-G362 CarbonylContact O-C 3.6Å; F359-G362 PolarHBondContact O-N 2.91Å; F359-G362 VanDerWaalsContact O-N 3.14Å; F359-M363 HydrophobicContact CD1-CG 3.98Å; F359-M363 HydrophobicContact CE1-CG 3.55Å; F359-M363 HydrophobicContact CE1-SD 4.27Å; F359-M363 HydrophobicContact CE2-CG 4.16Å; F359-M363 HydrophobicContact CE2-SD 4.27Å; F359-M363 HydrophobicContact CG-CG 4.45Å; F359-M363 HydrophobicContact CZ-CG 3.65Å; F359-M363 HydrophobicContact CZ-SD 3.8Å; F359-M363 WeakPolarHBondContact O-CG 3.37Å; F359-M363 PolarHBondContact O-N 2.62Å; F359-K427 HydrophobicContact CE2-CB 4.14Å; F359-K427 HydrophobicContact CE2-CD 4.03Å; F359-K427 HydrophobicContact CZ-CB 4.41Å; F359-L431 HydrophobicContact CE1-CD2 3.82Å; F359-L431 HydrophobicContact CE2-CD2 4.05Å; F359-L431 HydrophobicContact CE2-CG 4.19Å; F359-L431 HydrophobicContact CZ-CD2 3.5Å; F359-L431 VanDerWaalsContact CZ-CD2 3.5Å; F359-L431 HydrophobicContact CZ-CG 3.89Å; F359-L434 HydrophobicContact CB-CD1 3.67Å; F359-L434 HydrophobicContact CD1-CD1 4.02Å; F359-L434 HydrophobicContact CD2-CD1 3.8Å; F359-L434 HydrophobicContact CE2-CD1 4.45Å; F359-L434 HydrophobicContact CG-CD1 3.55Å
360	S	98.5	Very high	97.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.7	-43.9	178.9	-59.7	0	0	0	0	112.8	S320 I356 F357 E358 G362 M363 N364	S320-S360 WeakPolarHBondContact CA-OG 3.47Å; I356-S360 WeakPolarHBondContact O-CB 3.43Å; I356-S360 PolarHBondContact O-N 2.96Å; I356-S360 PolarHBondContact O-OG 3.32Å; F357-S360 PolarHBondContact O-N 3.21Å; E358-S360 VanDerWaalsContact C-N 3.31Å; E358-S360 PolarHBondContact O-N 3.44Å; S360-G362 VanDerWaalsContact C-N 3.35Å; S360-G362 PolarHBondContact O-N 2.97Å; S360-M363 PolarHBondContact O-N 3.01Å; S360-N364 WeakPolarHBondContact O-CB 3.32Å; S360-N364 PolarHBondContact O-N 3.47Å
361	K	97.8	Very high	97.4	Very high	74 Å²	74	45.3 Å²	45.3	32%	0.322	23%	0.228	S	C	.	.	H	α-helix	trans	-57.3	-49.3	171.2	-73.6	175.8	177.4	-166.6	0	110.8	Y323 E328 F357 E358 F359 M363 N364 D365	Y323-K361 HydrophobicContact CE1-CB 4.46Å; Y323-K361 HydrophobicContact CE1-CG 3.65Å; Y323-K361 WeakPolarHBondContact OH-CE 3.47Å; Y323-K361 WeakPolarHBondContact OH-CG 3.31Å; E328-K361 IonicContact OE1-NZ 2.76Å; E328-K361 PolarHBondContact OE1-NZ 2.99Å; F357-K361 WeakPolarHBondContact O-CG 3.48Å; F357-K361 PolarHBondContact O-N 2.88Å; E358-K361 PolarHBondContact O-N 2.8Å; F359-K361 PolarHBondContact O-N 3.43Å; K361-M363 VanDerWaalsContact C-N 3.26Å; K361-M363 PolarHBondContact O-N 3.4Å; K361-N364 WeakPolarHBondContact O-CB 3.48Å; K361-N364 PolarHBondContact O-N 3.33Å; K361-D365 PolarHBondContact O-N 3.11Å; K361-D365 VanDerWaalsContact O-N 3.12Å
362	G	97.7	Very high	97.5	Very high	16 Å²	16	39 Å²	39	17%	0.165	20%	0.198	C	C	.	.	H	α-helix	trans	-67.2	-20.8	179.4	0	0	0	0	0	115	E358 F359 S360 K427	E358-G362 PolarHBondContact O-N 3.24Å; F359-G362 CarbonylContact O-C 3.6Å; F359-G362 PolarHBondContact O-N 2.91Å; F359-G362 VanDerWaalsContact O-N 3.14Å; S360-G362 VanDerWaalsContact C-N 3.35Å; S360-G362 PolarHBondContact O-N 2.97Å; G362-K427 VanDerWaalsContact O-CE 3.29Å; G362-K427 WeakPolarHBondContact O-CE 3.47Å; G362-K427 PolarHBondContact O-NZ 3.46Å
363	M	98.3	Very high	97.5	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-81.6	-40.4	171.4	-74.9	-63.9	-67.6	0	0	111.1	L317 S320 F359 S360 K361 D365 L366 L368 Y373 K427	L317-M363 HydrophobicContact CD2-CE 3.66Å; L317-M363 HydrophobicContact CD2-SD 4.4Å; S320-M363 WeakPolarHBondContact OG-CG 3.22Å; F359-M363 HydrophobicContact CD1-CG 3.98Å; F359-M363 HydrophobicContact CE1-CG 3.55Å; F359-M363 HydrophobicContact CE1-SD 4.27Å; F359-M363 HydrophobicContact CE2-CG 4.16Å; F359-M363 HydrophobicContact CE2-SD 4.27Å; F359-M363 HydrophobicContact CG-CG 4.45Å; F359-M363 HydrophobicContact CZ-CG 3.65Å; F359-M363 HydrophobicContact CZ-SD 3.8Å; F359-M363 WeakPolarHBondContact O-CG 3.37Å; F359-M363 PolarHBondContact O-N 2.62Å; S360-M363 PolarHBondContact O-N 3.01Å; K361-M363 VanDerWaalsContact C-N 3.26Å; K361-M363 PolarHBondContact O-N 3.4Å; M363-D365 PolarHBondContact O-N 2.99Å; M363-L366 WeakPolarHBondContact O-CB 3.49Å; M363-L366 PolarHBondContact O-N 2.82Å; M363-L366 HydrophobicContact SD-CD1 4.21Å; M363-L368 HydrophobicContact CE-CD1 3.68Å; M363-Y373 HydrophobicContact CE-CD1 4.49Å; M363-Y373 HydrophobicContact CE-CE1 3.58Å; M363-K427 HydrophobicContact SD-CB 3.85Å; M363-K427 HydrophobicContact SD-CD 3.69Å; M363-K427 HydrophobicContact SD-CG 3.49Å; M363-K427 WeakPolarHBondContact SD-CG 3.45Å
364	N	96.9	Very high	97.5	Very high	49 Å²	49	38.2 Å²	38.2	26%	0.262	20%	0.195	S	C	.	.	H	α-helix	trans	-58.2	-36.8	175.1	-179.4	77.7	0	0	0	112.1	Y323 S360 K361 L366 H367	Y323-N364 HydrophobicContact CD1-CB 4.17Å; S360-N364 WeakPolarHBondContact O-CB 3.32Å; S360-N364 PolarHBondContact O-N 3.47Å; K361-N364 WeakPolarHBondContact O-CB 3.48Å; K361-N364 PolarHBondContact O-N 3.33Å; N364-L366 PolarHBondContact O-N 3.27Å; N364-H367 PolarHBondContact O-CE1 3.42Å; N364-H367 PolarHBondContact O-N 2.69Å; N364-H367 VanDerWaalsContact O-N 3.16Å; N364-H367 PolarHBondContact O-ND1 3.41Å
365	D	95.7	Very high	97.5	Very high	114 Å²	114	35.7 Å²	35.7	61%	0.61	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-17.6	176.3	-66.2	-16.8	0	0	0	114.3	K361 M363	K361-D365 PolarHBondContact O-N 3.11Å; K361-D365 VanDerWaalsContact O-N 3.12Å; M363-D365 PolarHBondContact O-N 2.99Å
366	L	96.3	Very high	97.5	Very high	11 Å²	11	34 Å²	34	6%	0.058	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-19.2	177.7	-61.8	-179.5	0	0	0	112.7	M363 N364 L368 M420 R423 M424 K427	M363-L366 WeakPolarHBondContact O-CB 3.49Å; M363-L366 PolarHBondContact O-N 2.82Å; M363-L366 HydrophobicContact SD-CD1 4.21Å; N364-L366 PolarHBondContact O-N 3.27Å; L366-L368 VanDerWaalsContact C-N 3.31Å; L366-L368 HydrophobicContact CB-CD2 3.74Å; L366-L368 HydrophobicContact CB-CG 3.82Å; L366-L368 HydrophobicContact CD1-CD1 4.37Å; L366-L368 HydrophobicContact CD1-CD2 4.46Å; L366-L368 HydrophobicContact CD1-CG 4.48Å; L366-L368 PolarHBondContact O-N 2.98Å; L366-M420 HydrophobicContact CB-SD 4.44Å; L366-M420 HydrophobicContact CD2-SD 4.2Å; L366-M420 WeakPolarHBondContact O-CE 3.49Å; L366-R423 HydrophobicContact CD2-CB 4.29Å; L366-M424 HydrophobicContact CD1-CG 4.32Å; L366-K427 HydrophobicContact CD1-CD 4.44Å; L366-K427 HydrophobicContact CD1-CG 3.92Å
367	H	95.6	Very high	97.5	Very high	138 Å²	138	33.3 Å²	33.3	64%	0.639	17%	0.167	S	C	*	.			trans	48.1	51.6	-176.1	-56.4	-61.5	0	0	0	112.7	N364 R414	N364-H367 PolarHBondContact O-CE1 3.42Å; N364-H367 PolarHBondContact O-N 2.69Å; N364-H367 VanDerWaalsContact O-N 3.16Å; N364-H367 PolarHBondContact O-ND1 3.41Å; H367-R414 PolarHBondContact O-NH2 3.18Å
368	L	97.4	Very high	97.5	Very high	21 Å²	21	33.2 Å²	33.2	11%	0.11	17%	0.166	C	C	.	.			trans	-72.6	144	176.2	-55	-173.4	0	0	0	110.4	M363 L366 E372 Y373 L376 M420 M424	M363-L368 HydrophobicContact CE-CD1 3.68Å; L366-L368 VanDerWaalsContact C-N 3.31Å; L366-L368 HydrophobicContact CB-CD2 3.74Å; L366-L368 HydrophobicContact CB-CG 3.82Å; L366-L368 HydrophobicContact CD1-CD1 4.37Å; L366-L368 HydrophobicContact CD1-CD2 4.46Å; L366-L368 HydrophobicContact CD1-CG 4.48Å; L366-L368 PolarHBondContact O-N 2.98Å; L368-E372 WeakPolarHBondContact CA-OE2 3.3Å; L368-E372 HydrophobicContact CB-CB 3.96Å; L368-E372 HydrophobicContact CD2-CB 4.32Å; L368-Y373 HydrophobicContact CB-CD2 3.85Å; L368-Y373 HydrophobicContact CB-CE2 3.61Å; L368-Y373 HydrophobicContact CD1-CE2 4.41Å; L368-L376 HydrophobicContact CD1-CD1 3.71Å; L368-M420 HydrophobicContact CD2-SD 4.3Å; L368-M424 HydrophobicContact CD1-CE 3.94Å; L368-M424 HydrophobicContact CD1-CG 4.45Å; L368-M424 HydrophobicContact CD2-CE 3.71Å; L368-M424 HydrophobicContact CD2-CG 3.87Å; L368-M424 HydrophobicContact CD2-SD 3.57Å; L368-M424 VanDerWaalsContact CD2-SD 3.57Å; L368-M424 HydrophobicContact CG-CE 4.42Å
369	D	96.3	Very high	97.5	Very high	46 Å²	46	27.4 Å²	27.4	25%	0.246	14%	0.139	C	C	.	.			trans	-94.3	-178.3	169.3	73.1	3.2	0	0	0	112.9	A371 E372 Y373 Y409 K413	D369-A371 VanDerWaalsContact C-N 3.31Å; D369-A371 PolarHBondContact O-N 2.85Å; D369-A371 PolarHBondContact OD1-N 2.99Å; D369-A371 VanDerWaalsContact OD1-N 3.14Å; D369-E372 PolarHBondContact N-OE2 3.06Å; D369-E372 PolarHBondContact O-N 3.09Å; D369-E372 WeakPolarHBondContact OD1-CB 3.23Å; D369-E372 VanDerWaalsContact OD1-CG 3.27Å; D369-E372 WeakPolarHBondContact OD1-CG 3.43Å; D369-E372 PolarHBondContact OD1-N 3.39Å; D369-Y373 WeakPolarHBondContact O-CD2 3.33Å; D369-Y373 PolarHBondContact O-N 3.29Å; D369-Y409 PolarHBondContact OD2-OH 3.32Å; D369-K413 IonicContact OD1-NZ 3.51Å; D369-K413 IonicContact OD2-NZ 3.83Å; D369-K413 PolarHBondContact OD2-NZ 2.97Å
370	E	95.4	Very high	97.5	Very high	66 Å²	66	26.8 Å²	26.8	31%	0.308	14%	0.137	S	C	.	.	H	α-helix	trans	-59.1	-39.1	-179.1	-59.5	-68.4	112.6	0	0	112.8	V235 R321 Y373 A374	V235-E370 HydrophobicContact CG1-CB 4.19Å; V235-E370 HydrophobicContact CG2-CB 4.35Å; R321-E370 IonicContact CZ-OE1 2.85Å; R321-E370 IonicContact CZ-OE2 3.87Å; R321-E370 IonicContact NH1-OE1 3Å; R321-E370 PolarHBondContact NH1-OE1 2.87Å; R321-E370 IonicContact NH1-OE2 2.78Å; R321-E370 PolarHBondContact NH1-OE2 3.34Å; E370-Y373 PolarHBondContact O-N 2.85Å; E370-A374 VanDerWaalsContact O-CB 3.31Å; E370-A374 WeakPolarHBondContact O-CB 3.39Å; E370-A374 PolarHBondContact O-N 3.25Å
371	A	97.2	Very high	97.5	Very high	7 Å²	7	26.8 Å²	26.8	6%	0.058	14%	0.137	C	C	.	.	H	α-helix	trans	-65	-43.8	178.8	0	0	0	0	0	111.1	I231 V235 D369 A374 L375 Y409	I231-A371 HydrophobicContact CG2-CB 3.5Å; V235-A371 HydrophobicContact CG2-CB 4.04Å; D369-A371 VanDerWaalsContact C-N 3.31Å; D369-A371 PolarHBondContact O-N 2.85Å; D369-A371 PolarHBondContact OD1-N 2.99Å; D369-A371 VanDerWaalsContact OD1-N 3.14Å; A371-A374 PolarHBondContact O-N 3.29Å; A371-L375 WeakPolarHBondContact O-CB 3.26Å; A371-L375 VanDerWaalsContact O-CG 3.32Å; A371-L375 WeakPolarHBondContact O-CG 3.32Å; A371-L375 PolarHBondContact O-N 2.96Å; A371-Y409 HydrophobicContact CB-CE1 4.09Å; A371-Y409 HydrophobicContact CB-CE2 4.15Å
372	E	98.1	Very high	97.6	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-63.9	-41.6	177.7	-72.5	175.9	114.5	0	0	112.6	L368 D369 L376 L406 Y409 K413 R414 M424	L368-E372 WeakPolarHBondContact CA-OE2 3.3Å; L368-E372 HydrophobicContact CB-CB 3.96Å; L368-E372 HydrophobicContact CD2-CB 4.32Å; D369-E372 PolarHBondContact N-OE2 3.06Å; D369-E372 PolarHBondContact O-N 3.09Å; D369-E372 WeakPolarHBondContact OD1-CB 3.23Å; D369-E372 VanDerWaalsContact OD1-CG 3.27Å; D369-E372 WeakPolarHBondContact OD1-CG 3.43Å; D369-E372 PolarHBondContact OD1-N 3.39Å; E372-L376 WeakPolarHBondContact O-CB 3.48Å; E372-L376 WeakPolarHBondContact O-CG 3.17Å; E372-L376 PolarHBondContact O-N 2.76Å; E372-L406 HydrophobicContact CG-CD1 4.45Å; E372-Y409 HydrophobicContact CG-CD1 3.96Å; E372-Y409 HydrophobicContact CG-CE1 3.88Å; E372-K413 IonicContact OE2-NZ 3.59Å; E372-K413 PolarHBondContact OE2-NZ 3.34Å; E372-R414 VanDerWaalsContact CD-NH1 3.28Å; E372-R414 IonicContact OE1-CZ 3.62Å; E372-R414 IonicContact OE1-NH1 3.55Å; E372-R414 PolarHBondContact OE1-NH1 3.1Å; E372-R414 IonicContact OE1-NH2 3.59Å; E372-R414 PolarHBondContact OE1-NH2 3.06Å; E372-R414 IonicContact OE2-CZ 3.34Å; E372-R414 IonicContact OE2-NH1 3.57Å; E372-R414 PolarHBondContact OE2-NH1 2.98Å; E372-R414 IonicContact OE2-NH2 2.88Å; E372-R414 PolarHBondContact OE2-NH2 3.44Å; E372-M424 HydrophobicContact CB-CE 3.74Å; E372-M424 HydrophobicContact CG-CE 4.09Å
373	Y	98.1	Very high	97.6	Very high	10 Å²	10	22.8 Å²	22.8	4%	0.039	12%	0.115	C	C	.	.	H	α-helix	trans	-64.7	-48.1	173	-87.5	-77.5	0	0	0	111.9	R321 M363 L368 D369 E370 L375 L376 I377	R321-Y373 HydrophobicContact CB-CD1 4.21Å; R321-Y373 HydrophobicContact CB-CD2 4.46Å; R321-Y373 HydrophobicContact CB-CE1 3.76Å; R321-Y373 HydrophobicContact CB-CE2 4.03Å; R321-Y373 HydrophobicContact CG-CD1 4.43Å; R321-Y373 HydrophobicContact CG-CD2 3.9Å; R321-Y373 HydrophobicContact CG-CE1 4.25Å; R321-Y373 HydrophobicContact CG-CE2 3.69Å; R321-Y373 HydrophobicContact CG-CG 4.28Å; M363-Y373 HydrophobicContact CE-CD1 4.49Å; M363-Y373 HydrophobicContact CE-CE1 3.58Å; L368-Y373 HydrophobicContact CB-CD2 3.85Å; L368-Y373 HydrophobicContact CB-CE2 3.61Å; L368-Y373 HydrophobicContact CD1-CE2 4.41Å; D369-Y373 WeakPolarHBondContact O-CD2 3.33Å; D369-Y373 PolarHBondContact O-N 3.29Å; E370-Y373 PolarHBondContact O-N 2.85Å; Y373-L375 VanDerWaalsContact C-N 3.31Å; Y373-L375 PolarHBondContact O-N 3.1Å; Y373-L376 PolarHBondContact O-N 3.44Å; Y373-I377 VanDerWaalsContact O-CG1 3.28Å; Y373-I377 WeakPolarHBondContact O-CG1 3.36Å; Y373-I377 PolarHBondContact O-N 3.34Å
374	A	98	Very high	97.6	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.9	-39.6	-177.6	0	0	0	0	0	112.1	L234 E370 A371 I377 A378	L234-A374 HydrophobicContact CB-CB 3.96Å; E370-A374 VanDerWaalsContact O-CB 3.31Å; E370-A374 WeakPolarHBondContact O-CB 3.39Å; E370-A374 PolarHBondContact O-N 3.25Å; A371-A374 PolarHBondContact O-N 3.29Å; A374-I377 PolarHBondContact O-N 3.06Å; A374-A378 PolarHBondContact O-N 3.43Å
375	L	98.5	Very high	97.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-67	-43.5	173.7	-73.6	167.4	0	0	0	112.2	I231 L234 A371 Y373 I377 A378 I379 Y402 A405 L406	I231-L375 HydrophobicContact CD1-CD1 4.05Å; I231-L375 HydrophobicContact CG1-CD1 4Å; I231-L375 HydrophobicContact CG1-CD2 4.26Å; I231-L375 HydrophobicContact CG1-CG 4.39Å; L234-L375 HydrophobicContact CD1-CD2 3.76Å; L234-L375 HydrophobicContact CD1-CG 4.3Å; A371-L375 WeakPolarHBondContact O-CB 3.26Å; A371-L375 VanDerWaalsContact O-CG 3.32Å; A371-L375 WeakPolarHBondContact O-CG 3.32Å; A371-L375 PolarHBondContact O-N 2.96Å; Y373-L375 VanDerWaalsContact C-N 3.31Å; Y373-L375 PolarHBondContact O-N 3.1Å; L375-I377 VanDerWaalsContact C-N 3.3Å; L375-I377 PolarHBondContact O-N 3.41Å; L375-A378 PolarHBondContact O-N 3.44Å; L375-I379 WeakPolarHBondContact O-CB 3.36Å; L375-I379 WeakPolarHBondContact O-CD1 3.25Å; L375-I379 WeakPolarHBondContact O-CG1 3.22Å; L375-I379 PolarHBondContact O-N 3.46Å; L375-Y402 HydrophobicContact CD2-CD1 4.28Å; L375-A405 HydrophobicContact CD2-CB 3.99Å; L375-L406 HydrophobicContact CB-CB 4.21Å; L375-L406 HydrophobicContact CB-CD1 4.01Å; L375-L406 HydrophobicContact CD1-CB 3.99Å; L375-L406 HydrophobicContact CD1-CD1 3.84Å
376	L	98.4	Very high	97.5	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-61.2	-38.7	175.7	-82.7	178.2	0	0	0	112.5	L368 E372 Y373 N380 L406 M424 L428	L368-L376 HydrophobicContact CD1-CD1 3.71Å; E372-L376 WeakPolarHBondContact O-CB 3.48Å; E372-L376 WeakPolarHBondContact O-CG 3.17Å; E372-L376 PolarHBondContact O-N 2.76Å; Y373-L376 PolarHBondContact O-N 3.44Å; L376-N380 VanDerWaalsContact O-CB 3.28Å; L376-N380 WeakPolarHBondContact O-CB 3.33Å; L376-N380 PolarHBondContact O-N 3.49Å; L376-L406 HydrophobicContact CD2-CD2 3.98Å; L376-L406 HydrophobicContact CG-CD2 4.32Å; L376-M424 HydrophobicContact CD1-CB 4.27Å; L376-M424 HydrophobicContact CD1-CE 3.62Å; L376-M424 HydrophobicContact CD2-CB 4.21Å; L376-M424 HydrophobicContact CD2-CE 4.4Å; L376-M424 HydrophobicContact CG-CE 3.84Å; L376-L428 HydrophobicContact CD2-CD1 4.4Å; L376-L428 HydrophobicContact CD2-CD2 4.21Å; L376-L428 HydrophobicContact CD2-CG 4.32Å
377	I	98.3	Very high	97.4	Very high	4 Å²	4	23.9 Å²	23.9	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-65.3	-46.8	175.8	-68.6	167.8	0	0	0	110.3	F288 I314 L317 E318 Y373 A374 L375 I379 N380 I381	F288-I377 HydrophobicContact CD1-CG2 4.07Å; F288-I377 HydrophobicContact CE1-CB 4.49Å; F288-I377 HydrophobicContact CE1-CG2 3.69Å; I314-I377 HydrophobicContact CD1-CG2 4.34Å; I314-I377 HydrophobicContact CG1-CG2 4.18Å; I314-I377 HydrophobicContact CG2-CD1 4.31Å; I314-I377 HydrophobicContact CG2-CG1 4.17Å; I314-I377 HydrophobicContact CG2-CG2 3.76Å; L317-I377 HydrophobicContact CD1-CG1 4.16Å; E318-I377 HydrophobicContact CG-CD1 4.14Å; E318-I377 WeakPolarHBondContact OE1-CD1 3.18Å; Y373-I377 VanDerWaalsContact O-CG1 3.28Å; Y373-I377 WeakPolarHBondContact O-CG1 3.36Å; Y373-I377 PolarHBondContact O-N 3.34Å; A374-I377 PolarHBondContact O-N 3.06Å; L375-I377 VanDerWaalsContact C-N 3.3Å; L375-I377 PolarHBondContact O-N 3.41Å; I377-I379 PolarHBondContact O-N 3.06Å; I377-N380 WeakPolarHBondContact O-CB 3.35Å; I377-N380 PolarHBondContact O-N 3.18Å; I377-N380 VanDerWaalsContact O-N 3.13Å; I377-I381 HydrophobicContact CG2-CD1 3.92Å; I377-I381 WeakPolarHBondContact O-CG1 3.24Å; I377-I381 PolarHBondContact O-N 3.2Å
378	A	98.4	Very high	97.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.2	-44.6	176.9	0	0	0	0	0	112	L292 A374 L375 N380 I381 F382 Y402	L292-A378 HydrophobicContact CD1-CB 4.41Å; L292-A378 HydrophobicContact CD2-CB 4.13Å; A374-A378 PolarHBondContact O-N 3.43Å; L375-A378 PolarHBondContact O-N 3.44Å; A378-N380 VanDerWaalsContact C-N 3.3Å; A378-N380 PolarHBondContact O-N 2.98Å; A378-I381 PolarHBondContact O-N 2.94Å; A378-F382 VanDerWaalsContact O-CD2 3.28Å; A378-F382 WeakPolarHBondContact O-CD2 3.47Å; A378-F382 PolarHBondContact O-N 3.04Å; A378-F382 VanDerWaalsContact O-N 3.12Å; A378-Y402 HydrophobicContact CB-CD1 3.64Å; A378-Y402 HydrophobicContact CB-CD2 4.36Å; A378-Y402 HydrophobicContact CB-CE1 3.91Å; A378-Y402 HydrophobicContact CB-CG 3.87Å
379	I	98.7	Very high	97.4	Very high	4 Å²	4	22.9 Å²	22.9	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-60.6	-40.7	174.8	-65.8	164.1	0	0	0	110.7	L375 I377 Q399 V403 L406 L428	L375-I379 WeakPolarHBondContact O-CB 3.36Å; L375-I379 WeakPolarHBondContact O-CD1 3.25Å; L375-I379 WeakPolarHBondContact O-CG1 3.22Å; L375-I379 PolarHBondContact O-N 3.46Å; I377-I379 PolarHBondContact O-N 3.06Å; I379-Q399 HydrophobicContact CG2-CG 4.24Å; I379-Q399 PolarHBondContact O-NE2 3.35Å; I379-V403 HydrophobicContact CD1-CG2 4.01Å; I379-V403 HydrophobicContact CG1-CG2 3.86Å; I379-V403 HydrophobicContact CG2-CG2 4.09Å; I379-L406 HydrophobicContact CD1-CB 4.16Å; I379-L406 HydrophobicContact CD1-CD2 3.6Å; I379-L428 HydrophobicContact CG2-CD1 3.71Å
380	N	98.6	Very high	97.5	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-66.4	-38.2	179.1	-172.2	-98	0	0	0	113.1	E313 L376 I377 A378 S383 R386 L428	E313-N380 PolarHBondContact OE2-ND2 3.42Å; L376-N380 VanDerWaalsContact O-CB 3.28Å; L376-N380 WeakPolarHBondContact O-CB 3.33Å; L376-N380 PolarHBondContact O-N 3.49Å; I377-N380 WeakPolarHBondContact O-CB 3.35Å; I377-N380 PolarHBondContact O-N 3.18Å; I377-N380 VanDerWaalsContact O-N 3.13Å; A378-N380 VanDerWaalsContact C-N 3.3Å; A378-N380 PolarHBondContact O-N 2.98Å; N380-S383 PolarHBondContact O-OG 3Å; N380-R386 PolarHBondContact ND2-NH2 2.88Å; N380-R386 PolarHBondContact O-NH2 3.07Å; N380-R386 PolarHBondContact OD1-NH2 3.01Å; N380-L428 HydrophobicContact CB-CD2 4.11Å
381	I	98.5	Very high	97.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.4	-52	176	-71.2	165.3	0	0	0	110.1	F288 A289 L292 F295 L306 I314 I377 A378 S383	F288-I381 HydrophobicContact CD1-CD1 4.07Å; F288-I381 HydrophobicContact CE1-CD1 4.23Å; A289-I381 HydrophobicContact CB-CD1 4.11Å; L292-I381 HydrophobicContact CD1-CB 4.37Å; L292-I381 HydrophobicContact CD1-CD1 3.58Å; L292-I381 HydrophobicContact CD1-CG2 4.21Å; F295-I381 HydrophobicContact CD2-CG2 4.01Å; F295-I381 HydrophobicContact CE2-CG2 3.88Å; L306-I381 WeakPolarHBondContact CD2-O 3.39Å; I314-I381 HydrophobicContact CD1-CD1 3.91Å; I314-I381 HydrophobicContact CD1-CG1 3.4Å; I314-I381 VanDerWaalsContact CD1-CG1 3.4Å; I314-I381 HydrophobicContact CG1-CG1 4.46Å; I377-I381 HydrophobicContact CG2-CD1 3.92Å; I377-I381 WeakPolarHBondContact O-CG1 3.24Å; I377-I381 PolarHBondContact O-N 3.2Å; A378-I381 PolarHBondContact O-N 2.94Å; I381-S383 PolarHBondContact O-N 3.39Å
382	F	98.6	Very high	97.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.	S	Bend	trans	-82.3	62.8	-179.2	-64.1	-68.2	0	0	0	112	L292 F295 L298 A378 V395 L398 Q399 Y402	L292-F382 HydrophobicContact CB-CE2 4.12Å; L292-F382 HydrophobicContact CB-CZ 4.11Å; L292-F382 HydrophobicContact CD1-CE2 3.82Å; L292-F382 HydrophobicContact CD1-CZ 4.29Å; F295-F382 HydrophobicContact CB-CE1 4.21Å; F295-F382 HydrophobicContact CB-CZ 3.91Å; F295-F382 AromaticContact CD2-CE1 3.94Å; F295-F382 HydrophobicContact CD2-CE1 3.94Å; F295-F382 HydrophobicContact CD2-CZ 4.15Å; L298-F382 HydrophobicContact CD1-CD1 4.36Å; L298-F382 HydrophobicContact CD1-CE1 4.04Å; A378-F382 VanDerWaalsContact O-CD2 3.28Å; A378-F382 WeakPolarHBondContact O-CD2 3.47Å; A378-F382 PolarHBondContact O-N 3.04Å; A378-F382 VanDerWaalsContact O-N 3.12Å; F382-V395 HydrophobicContact CB-CG1 4.29Å; F382-L398 HydrophobicContact CD1-CB 3.91Å; F382-L398 HydrophobicContact CD1-CD1 4.34Å; F382-L398 HydrophobicContact CE1-CB 4.01Å; F382-L398 HydrophobicContact CE1-CD1 3.91Å; F382-L398 HydrophobicContact CG-CB 4.34Å; F382-Q399 HydrophobicContact CB-CB 3.73Å; F382-Q399 HydrophobicContact CB-CG 3.98Å; F382-Q399 VanDerWaalsContact O-CB 3.31Å; F382-Q399 WeakPolarHBondContact O-CB 3.36Å; F382-Q399 WeakPolarHBondContact O-CG 3.41Å; F382-Q399 PolarHBondContact O-NE2 3.05Å; F382-Y402 AromaticContact CD2-CD2 3.92Å; F382-Y402 HydrophobicContact CD2-CD2 3.92Å; F382-Y402 AromaticContact CD2-CE2 3.56Å; F382-Y402 HydrophobicContact CD2-CE2 3.56Å; F382-Y402 HydrophobicContact CE2-CD2 4.17Å; F382-Y402 AromaticContact CE2-CE2 3.34Å; F382-Y402 HydrophobicContact CE2-CE2 3.34Å; F382-Y402 AromaticContact CE2-CZ 3.84Å; F382-Y402 HydrophobicContact CZ-CE2 4.35Å
383	S	98.3	Very high	97.7	Very high	6 Å²	6	36.3 Å²	36.3	4%	0.042	19%	0.191	C	C	.	.			trans	-102.8	116.5	175.6	-65	0	0	0	0	110.2	L306 N380 I381 D385 R386	L306-S383 WeakPolarHBondContact CD2-O 3.31Å; N380-S383 PolarHBondContact O-OG 3Å; I381-S383 PolarHBondContact O-N 3.39Å; S383-D385 WeakPolarHBondContact CB-OD1 3.42Å; S383-D385 PolarHBondContact O-N 3.48Å; S383-R386 VanDerWaalsContact O-CG 3.26Å; S383-R386 WeakPolarHBondContact O-CG 3.47Å
384	A	97.5	Very high	97.7	Very high	7 Å²	7	36.9 Å²	36.9	6%	0.058	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-16.9	-178.9	0	0	0	0	0	113.3	R386 H392 V395 E396	A384-R386 PolarHBondContact O-N 2.97Å; A384-H392 HydrophobicContact CB-CB 4.21Å; A384-H392 PolarHBondContact O-CE1 3.23Å; A384-H392 VanDerWaalsContact O-CE1 3.3Å; A384-H392 PolarHBondContact O-ND1 3.19Å; A384-V395 HydrophobicContact CB-CB 4.11Å; A384-V395 HydrophobicContact CB-CG1 4.05Å; A384-E396 HydrophobicContact CB-CG 3.55Å
385	D	95.8	Very high	97.7	Very high	102 Å²	102	36.9 Å²	36.9	55%	0.545	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	9.2	-178.9	69.2	-62.2	0	0	0	113.8	S383 R432	S383-D385 WeakPolarHBondContact CB-OD1 3.42Å; S383-D385 PolarHBondContact O-N 3.48Å; D385-R432 VanDerWaalsContact CG-NH2 3.29Å; D385-R432 IonicContact OD1-CZ 3.9Å; D385-R432 IonicContact OD1-NH2 2.65Å; D385-R432 PolarHBondContact OD1-NH2 3Å; D385-R432 IonicContact OD2-CZ 3.54Å; D385-R432 IonicContact OD2-NH1 2.72Å; D385-R432 PolarHBondContact OD2-NH1 3.24Å; D385-R432 IonicContact OD2-NH2 2.77Å; D385-R432 PolarHBondContact OD2-NH2 3.45Å
386	R	95.3	Very high	97.7	Very high	12 Å²	12	42.1 Å²	42.1	5%	0.045	22%	0.219	C	C	.	.	S	Bend	trans	-71.2	143.7	176.1	-59.4	-54.6	-167.9	174.2	-7.7	110.8	L306 T309 E313 N380 S383 A384 V389	L306-R386 HydrophobicContact CD2-CB 4.24Å; L306-R386 HydrophobicContact CD2-CG 3.87Å; T309-R386 HydrophobicContact CG2-CB 4.38Å; T309-R386 PolarHBondContact O-NH1 3.19Å; T309-R386 WeakPolarHBondContact OG1-CB 3.26Å; T309-R386 WeakPolarHBondContact OG1-CD 3.49Å; T309-R386 WeakPolarHBondContact OG1-CG 3.3Å; E313-R386 VanDerWaalsContact CD-NH1 3.3Å; E313-R386 IonicContact OE1-CZ 3.43Å; E313-R386 IonicContact OE1-NH1 2.77Å; E313-R386 PolarHBondContact OE1-NH1 3.06Å; E313-R386 IonicContact OE1-NH2 3.27Å; E313-R386 IonicContact OE2-CZ 2.76Å; E313-R386 IonicContact OE2-NH1 2.76Å; E313-R386 PolarHBondContact OE2-NH1 3.5Å; E313-R386 IonicContact OE2-NH2 3.25Å; E313-R386 PolarHBondContact OE2-NH2 3.01Å; N380-R386 PolarHBondContact ND2-NH2 2.88Å; N380-R386 PolarHBondContact O-NH2 3.07Å; N380-R386 PolarHBondContact OD1-NH2 3.01Å; S383-R386 VanDerWaalsContact O-CG 3.26Å; S383-R386 WeakPolarHBondContact O-CG 3.47Å; A384-R386 PolarHBondContact O-N 2.97Å; R386-V389 HydrophobicContact CB-CG2 3.78Å
387	P	94	Very high	97.7	Very high	78 Å²	78	49.6 Å²	49.6	51%	0.506	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	146	174.2	26.3	-35.6	0	0	0	110.9	T309 V389	T309-P387 HydrophobicContact CG2-CG 3.55Å; P387-V389 PolarHBondContact O-N 3.29Å
388	N	95.7	Very high	97.7	Very high	131 Å²	131	50.6 Å²	50.6	70%	0.701	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	8.7	176.2	-50.2	-39.1	0	0	0	116.4	A305 Q390	A305-N388 HydrophobicContact CB-CB 4.33Å; N388-Q390 PolarHBondContact O-NE2 2.86Å
389	V	97.8	Very high	97.7	Very high	7 Å²	7	52.7 Å²	52.7	4%	0.042	26%	0.263	C	S	.	.			trans	-67.6	135.9	166.4	173.8	0	0	0	0	109.6	D302 A305 L306 R386 P387 H392 V395	D302-V389 WeakPolarHBondContact OD1-CA 3.3Å; A305-V389 HydrophobicContact CB-CG2 4.15Å; L306-V389 HydrophobicContact CD2-CG2 3.81Å; L306-V389 HydrophobicContact CG-CG2 4.35Å; R386-V389 HydrophobicContact CB-CG2 3.78Å; P387-V389 PolarHBondContact O-N 3.29Å; V389-H392 PolarHBondContact O-NE2 3.36Å; V389-V395 HydrophobicContact CG1-CG2 4.05Å
390	Q	97.9	Very high	97.7	Very high	134 Å²	134	57.2 Å²	57.2	63%	0.626	28%	0.283	S	S	*	.	S	Bend	trans	-97.7	-52.1	-177.9	-53.6	-57.2	-55.4	0	0	111.3	D302 N388	D302-Q390 PolarHBondContact OD1-N 3.27Å; N388-Q390 PolarHBondContact O-NE2 2.86Å
391	D	98.1	Very high	97.7	Very high	61 Å²	61	59.9 Å²	59.9	33%	0.326	30%	0.301	S	S	.	.			trans	-102.5	80.5	-179.5	-167.7	-17	0	0	0	111.9	D393 L394 V395	D391-D393 VanDerWaalsContact C-N 3.32Å; D391-D393 PolarHBondContact O-N 2.88Å; D391-D393 PolarHBondContact OD1-N 2.95Å; D391-L394 HydrophobicContact CB-CB 4.12Å; D391-L394 PolarHBondContact O-N 3.38Å; D391-L394 WeakPolarHBondContact OD1-CB 3.47Å; D391-L394 PolarHBondContact OD1-N 3.08Å; D391-L394 WeakPolarHBondContact OD2-CB 3.45Å; D391-V395 WeakPolarHBondContact O-CG2 3.32Å; D391-V395 PolarHBondContact O-N 3.3Å
392	H	98.3	Very high	97.7	Very high	90 Å²	90	60 Å²	60	42%	0.417	30%	0.301	S	S	.	.	H	α-helix	trans	-59.6	-40.3	178.8	-62.5	-92.4	0	0	0	112.6	A384 V389 V395 E396	A384-H392 HydrophobicContact CB-CB 4.21Å; A384-H392 PolarHBondContact O-CE1 3.23Å; A384-H392 VanDerWaalsContact O-CE1 3.3Å; A384-H392 PolarHBondContact O-ND1 3.19Å; V389-H392 PolarHBondContact O-NE2 3.36Å; H392-V395 PolarHBondContact O-N 3.4Å; H392-E396 WeakPolarHBondContact O-CG 3.44Å; H392-E396 PolarHBondContact O-N 2.86Å
393	D	98.3	Very high	97.7	Very high	116 Å²	116	61.4 Å²	61.4	62%	0.62	31%	0.31	S	S	*	.	H	α-helix	trans	-67	-39.7	-176.6	-71.6	-32.5	0	0	0	111.7	D391 R397	D391-D393 VanDerWaalsContact C-N 3.32Å; D391-D393 PolarHBondContact O-N 2.88Å; D391-D393 PolarHBondContact OD1-N 2.95Å; D393-R397 WeakPolarHBondContact O-CB 3.39Å; D393-R397 VanDerWaalsContact O-CG 3.27Å; D393-R397 WeakPolarHBondContact O-CG 3.11Å; D393-R397 PolarHBondContact O-N 3.35Å; D393-R397 PolarHBondContact O-NE 2.95Å
394	L	98.4	Very high	97.7	Very high	22 Å²	22	64 Å²	64	12%	0.115	32%	0.323	C	S	.	.	H	α-helix	trans	-64.9	-44.2	173.7	177.3	57.6	0	0	0	111.3	L298 D391 E396 R397 L398	L298-L394 HydrophobicContact CD2-CD2 3.81Å; L298-L394 HydrophobicContact CD2-CG 3.88Å; D391-L394 HydrophobicContact CB-CB 4.12Å; D391-L394 PolarHBondContact O-N 3.38Å; D391-L394 WeakPolarHBondContact OD1-CB 3.47Å; D391-L394 PolarHBondContact OD1-N 3.08Å; D391-L394 WeakPolarHBondContact OD2-CB 3.45Å; L394-E396 PolarHBondContact O-N 3.24Å; L394-R397 PolarHBondContact O-N 3.4Å; L394-L398 HydrophobicContact CD1-CD1 4.12Å; L394-L398 HydrophobicContact CD1-CD2 4.47Å; L394-L398 HydrophobicContact CD1-CG 3.99Å; L394-L398 HydrophobicContact CG-CD1 4.17Å; L394-L398 HydrophobicContact CG-CG 4.43Å; L394-L398 WeakPolarHBondContact O-CG 3.36Å; L394-L398 PolarHBondContact O-N 3.04Å
395	V	98.7	Very high	97.7	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.9	-44.6	178.7	176.4	0	0	0	0	111.4	L298 L306 F382 A384 V389 D391 H392 R397 L398 Q399	L298-V395 HydrophobicContact CD2-CG2 3.8Å; L306-V395 HydrophobicContact CD1-CG1 4.43Å; L306-V395 HydrophobicContact CD1-CG2 4.16Å; L306-V395 HydrophobicContact CD2-CG1 4.26Å; F382-V395 HydrophobicContact CB-CG1 4.29Å; A384-V395 HydrophobicContact CB-CB 4.11Å; A384-V395 HydrophobicContact CB-CG1 4.05Å; V389-V395 HydrophobicContact CG1-CG2 4.05Å; D391-V395 WeakPolarHBondContact O-CG2 3.32Å; D391-V395 PolarHBondContact O-N 3.3Å; H392-V395 PolarHBondContact O-N 3.4Å; V395-R397 PolarHBondContact O-N 2.61Å; V395-L398 PolarHBondContact O-N 3.47Å; V395-Q399 WeakPolarHBondContact O-CB 3.45Å; V395-Q399 PolarHBondContact O-N 2.87Å
396	E	98.5	Very high	97.8	Very high	110 Å²	110	58.8 Å²	58.8	51%	0.514	29%	0.294	S	S	.	.	H	α-helix	trans	-62.9	-42.1	175.9	-69.1	-171.2	172.3	0	0	112.1	A384 H392 L394 L398 Q399 Q400	A384-E396 HydrophobicContact CB-CG 3.55Å; H392-E396 WeakPolarHBondContact O-CG 3.44Å; H392-E396 PolarHBondContact O-N 2.86Å; L394-E396 PolarHBondContact O-N 3.24Å; E396-L398 VanDerWaalsContact C-N 3.3Å; E396-L398 PolarHBondContact O-N 3.08Å; E396-Q399 PolarHBondContact O-N 3.33Å; E396-Q400 PolarHBondContact O-N 3.37Å
397	R	98.6	Very high	97.9	Very high	157 Å²	157	64.8 Å²	64.8	59%	0.592	32%	0.317	S	S	*	.	H	α-helix	trans	-61.6	-37.8	175.5	-77.3	-174.9	-61.8	119.1	-7.2	112.4	D393 L394 V395 P401	D393-R397 WeakPolarHBondContact O-CB 3.39Å; D393-R397 VanDerWaalsContact O-CG 3.27Å; D393-R397 WeakPolarHBondContact O-CG 3.11Å; D393-R397 PolarHBondContact O-N 3.35Å; D393-R397 PolarHBondContact O-NE 2.95Å; L394-R397 PolarHBondContact O-N 3.4Å; V395-R397 PolarHBondContact O-N 2.61Å; R397-P401 VanDerWaalsContact O-CD 3.28Å; R397-P401 WeakPolarHBondContact O-CD 3.47Å
398	L	98.5	Very high	98	Very high	24 Å²	24	62.9 Å²	62.9	13%	0.126	31%	0.305	C	S	.	.	H	α-helix	trans	-73.2	-31.5	176	-69.9	-179.7	0	0	0	112.3	G294 L298 F382 L394 V395 E396 P401 Y402	G294-L398 VanDerWaalsContact O-CD1 3.3Å; G294-L398 WeakPolarHBondContact O-CD1 3.44Å; L298-L398 HydrophobicContact CD1-CD1 4.28Å; L298-L398 HydrophobicContact CD2-CD1 3.9Å; L298-L398 HydrophobicContact CG-CD1 3.89Å; F382-L398 HydrophobicContact CD1-CB 3.91Å; F382-L398 HydrophobicContact CD1-CD1 4.34Å; F382-L398 HydrophobicContact CE1-CB 4.01Å; F382-L398 HydrophobicContact CE1-CD1 3.91Å; F382-L398 HydrophobicContact CG-CB 4.34Å; L394-L398 HydrophobicContact CD1-CD1 4.12Å; L394-L398 HydrophobicContact CD1-CD2 4.47Å; L394-L398 HydrophobicContact CD1-CG 3.99Å; L394-L398 HydrophobicContact CG-CD1 4.17Å; L394-L398 HydrophobicContact CG-CG 4.43Å; L394-L398 WeakPolarHBondContact O-CG 3.36Å; L394-L398 PolarHBondContact O-N 3.04Å; V395-L398 PolarHBondContact O-N 3.47Å; E396-L398 VanDerWaalsContact C-N 3.3Å; E396-L398 PolarHBondContact O-N 3.08Å; L398-P401 WeakPolarHBondContact O-CD 3.35Å; L398-Y402 WeakPolarHBondContact O-CD2 3.25Å; L398-Y402 WeakPolarHBondContact O-CE2 3.31Å
399	Q	98.7	Very high	98.1	Very high	45 Å²	45	58.5 Å²	58.5	21%	0.21	28%	0.279	C	S	.	.	H	α-helix	trans	-70.2	-38.6	176.8	-163.1	-171.8	48.2	0	0	112.5	I379 F382 V395 E396 Y402 V403	I379-Q399 HydrophobicContact CG2-CG 4.24Å; I379-Q399 PolarHBondContact O-NE2 3.35Å; F382-Q399 HydrophobicContact CB-CB 3.73Å; F382-Q399 HydrophobicContact CB-CG 3.98Å; F382-Q399 VanDerWaalsContact O-CB 3.31Å; F382-Q399 WeakPolarHBondContact O-CB 3.36Å; F382-Q399 WeakPolarHBondContact O-CG 3.41Å; F382-Q399 PolarHBondContact O-NE2 3.05Å; V395-Q399 WeakPolarHBondContact O-CB 3.45Å; V395-Q399 PolarHBondContact O-N 2.87Å; E396-Q399 PolarHBondContact O-N 3.33Å; Q399-Y402 PolarHBondContact O-N 3.12Å; Q399-Y402 VanDerWaalsContact O-N 3.08Å; Q399-V403 HydrophobicContact CG-CG2 4.08Å; Q399-V403 PolarHBondContact O-N 3.38Å
400	Q	98.4	Very high	98	Very high	98 Å²	98	58.3 Å²	58.3	46%	0.458	28%	0.278	S	S	.	.	H	α-helix	trans	-51.5	-47.5	-170.1	-178.6	66.2	38	0	0	114.4	E396 Y402 V403 D404	E396-Q400 PolarHBondContact O-N 3.37Å; Q400-Y402 VanDerWaalsContact C-N 3.28Å; Q400-Y402 PolarHBondContact O-N 3.41Å; Q400-V403 PolarHBondContact O-N 3.4Å; Q400-D404 PolarHBondContact NE2-OD1 2.91Å; Q400-D404 PolarHBondContact NE2-OD2 3.38Å; Q400-D404 PolarHBondContact O-N 3.15Å
401	P	98.2	Very high	97.8	Very high	57 Å²	57	57.6 Å²	57.6	37%	0.37	28%	0.276	S	S	.	.	H	α-helix	trans	-59.3	-35.5	179.4	-24.7	35.1	0	0	0	113.8	M230 R397 L398 A405	M230-P401 HydrophobicContact CE-CB 3.89Å; R397-P401 VanDerWaalsContact O-CD 3.28Å; R397-P401 WeakPolarHBondContact O-CD 3.47Å; L398-P401 WeakPolarHBondContact O-CD 3.35Å; P401-A405 VanDerWaalsContact O-CB 3.25Å; P401-A405 WeakPolarHBondContact O-CB 3.4Å; P401-A405 PolarHBondContact O-N 2.97Å
402	Y	98.5	Very high	97.5	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.016	28%	0.275	C	S	.	.	H	α-helix	trans	-71.1	-38.8	178.4	-57.7	-75.2	0	0	0	111.9	M230 L234 P293 L375 A378 F382 L398 Q399 Q400 L406	M230-Y402 HydrophobicContact CG-CE1 4.27Å; M230-Y402 HydrophobicContact SD-CD1 3.73Å; M230-Y402 HydrophobicContact SD-CE1 3.79Å; L234-Y402 HydrophobicContact CD1-CD1 3.96Å; L234-Y402 HydrophobicContact CD1-CE1 3.98Å; L234-Y402 HydrophobicContact CD2-CE1 4.22Å; P293-Y402 WeakPolarHBondContact CD-OH 3.4Å; P293-Y402 PolarHBondContact O-OH 3.43Å; P293-Y402 VanDerWaalsContact O-OH 3.06Å; L375-Y402 HydrophobicContact CD2-CD1 4.28Å; A378-Y402 HydrophobicContact CB-CD1 3.64Å; A378-Y402 HydrophobicContact CB-CD2 4.36Å; A378-Y402 HydrophobicContact CB-CE1 3.91Å; A378-Y402 HydrophobicContact CB-CG 3.87Å; F382-Y402 AromaticContact CD2-CD2 3.92Å; F382-Y402 HydrophobicContact CD2-CD2 3.92Å; F382-Y402 AromaticContact CD2-CE2 3.56Å; F382-Y402 HydrophobicContact CD2-CE2 3.56Å; F382-Y402 HydrophobicContact CE2-CD2 4.17Å; F382-Y402 AromaticContact CE2-CE2 3.34Å; F382-Y402 HydrophobicContact CE2-CE2 3.34Å; F382-Y402 AromaticContact CE2-CZ 3.84Å; F382-Y402 HydrophobicContact CZ-CE2 4.35Å; L398-Y402 WeakPolarHBondContact O-CD2 3.25Å; L398-Y402 WeakPolarHBondContact O-CE2 3.31Å; Q399-Y402 PolarHBondContact O-N 3.12Å; Q399-Y402 VanDerWaalsContact O-N 3.08Å; Q400-Y402 VanDerWaalsContact C-N 3.28Å; Q400-Y402 PolarHBondContact O-N 3.41Å; Y402-L406 WeakPolarHBondContact O-CB 3.38Å; Y402-L406 PolarHBondContact O-N 2.86Å
403	V	98.4	Very high	97.3	Very high	28 Å²	28	57.1 Å²	57.1	17%	0.17	27%	0.272	C	S	.	.	H	α-helix	trans	-64	-44.4	175.5	179.1	0	0	0	0	110.5	I379 Q399 Q400 L406 R407 F421	I379-V403 HydrophobicContact CD1-CG2 4.01Å; I379-V403 HydrophobicContact CG1-CG2 3.86Å; I379-V403 HydrophobicContact CG2-CG2 4.09Å; Q399-V403 HydrophobicContact CG-CG2 4.08Å; Q399-V403 PolarHBondContact O-N 3.38Å; Q400-V403 PolarHBondContact O-N 3.4Å; V403-L406 PolarHBondContact O-N 3.3Å; V403-R407 WeakPolarHBondContact O-CB 3.31Å; V403-R407 PolarHBondContact O-N 3.45Å; V403-F421 HydrophobicContact CG1-CE2 4.31Å; V403-F421 HydrophobicContact CG1-CZ 3.8Å
404	D	97.6	Very high	97.1	Very high	61 Å²	61	53.8 Å²	53.8	33%	0.326	25%	0.251	S	S	.	.	H	α-helix	trans	-66.9	-42.7	178.2	-72.4	-28.7	0	0	0	111.9	Q400 L406 R407 S408	Q400-D404 PolarHBondContact NE2-OD1 2.91Å; Q400-D404 PolarHBondContact NE2-OD2 3.38Å; Q400-D404 PolarHBondContact O-N 3.15Å; D404-L406 PolarHBondContact O-N 3.42Å; D404-R407 PolarHBondContact O-N 3.07Å; D404-S408 PolarHBondContact O-N 3.34Å; D404-S408 PolarHBondContact O-OG 2.68Å
405	A	98	Very high	96.7	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.9	-45.6	174.5	0	0	0	0	0	111.4	Q227 M230 I231 L375 P401 R407 S408 Y409	Q227-A405 HydrophobicContact CG-CB 4.45Å; M230-A405 HydrophobicContact SD-CB 4.48Å; I231-A405 HydrophobicContact CD1-CB 4.44Å; L375-A405 HydrophobicContact CD2-CB 3.99Å; P401-A405 VanDerWaalsContact O-CB 3.25Å; P401-A405 WeakPolarHBondContact O-CB 3.4Å; P401-A405 PolarHBondContact O-N 2.97Å; A405-R407 VanDerWaalsContact C-N 3.34Å; A405-R407 PolarHBondContact O-N 3.37Å; A405-S408 PolarHBondContact O-N 3.05Å; A405-Y409 WeakPolarHBondContact O-CB 3.27Å; A405-Y409 PolarHBondContact O-N 3.24Å
406	L	98.2	Very high	96.5	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.3	-43.1	177.1	-177.5	61.1	0	0	0	112.3	E372 L375 L376 I379 Y402 V403 D404 Y409 I410 F421 M424	E372-L406 HydrophobicContact CG-CD1 4.45Å; L375-L406 HydrophobicContact CB-CB 4.21Å; L375-L406 HydrophobicContact CB-CD1 4.01Å; L375-L406 HydrophobicContact CD1-CB 3.99Å; L375-L406 HydrophobicContact CD1-CD1 3.84Å; L376-L406 HydrophobicContact CD2-CD2 3.98Å; L376-L406 HydrophobicContact CG-CD2 4.32Å; I379-L406 HydrophobicContact CD1-CB 4.16Å; I379-L406 HydrophobicContact CD1-CD2 3.6Å; Y402-L406 WeakPolarHBondContact O-CB 3.38Å; Y402-L406 PolarHBondContact O-N 2.86Å; V403-L406 PolarHBondContact O-N 3.3Å; D404-L406 PolarHBondContact O-N 3.42Å; L406-Y409 PolarHBondContact O-N 3.46Å; L406-I410 HydrophobicContact CD1-CD1 3.76Å; L406-I410 HydrophobicContact CD1-CG1 4.16Å; L406-I410 HydrophobicContact CG-CD1 3.81Å; L406-I410 WeakPolarHBondContact O-CB 3.33Å; L406-I410 WeakPolarHBondContact O-CD1 3.33Å; L406-I410 VanDerWaalsContact O-CG1 3.26Å; L406-I410 WeakPolarHBondContact O-CG1 3.45Å; L406-I410 PolarHBondContact O-N 3.43Å; L406-F421 HydrophobicContact CB-CE2 4.36Å; L406-F421 HydrophobicContact CD2-CD2 4.3Å; L406-F421 HydrophobicContact CD2-CE2 4.22Å; L406-F421 HydrophobicContact CG-CD2 4.14Å; L406-F421 HydrophobicContact CG-CE2 4.21Å; L406-M424 HydrophobicContact CD1-CE 3.69Å; L406-M424 HydrophobicContact CD2-CE 4.17Å; L406-M424 HydrophobicContact CG-CE 4.43Å
407	R	97.2	Very high	96.2	Very high	137 Å²	137	60.6 Å²	60.6	52%	0.517	30%	0.295	S	S	.	.	H	α-helix	trans	-62	-50.1	177.8	-175.2	-179.4	177.4	-176.7	0.5	111.5	V403 D404 A405 Y409 I410 M411 F421	V403-R407 WeakPolarHBondContact O-CB 3.31Å; V403-R407 PolarHBondContact O-N 3.45Å; D404-R407 PolarHBondContact O-N 3.07Å; A405-R407 VanDerWaalsContact C-N 3.34Å; A405-R407 PolarHBondContact O-N 3.37Å; R407-Y409 VanDerWaalsContact C-N 3.35Å; R407-I410 PolarHBondContact O-N 3.03Å; R407-M411 HydrophobicContact CG-SD 4.16Å; R407-M411 WeakPolarHBondContact O-CB 3.44Å; R407-M411 VanDerWaalsContact O-CG 3.3Å; R407-M411 WeakPolarHBondContact O-CG 3.34Å; R407-M411 PolarHBondContact O-N 2.87Å; R407-F421 HydrophobicContact CB-CD2 4.02Å; R407-F421 HydrophobicContact CB-CE2 3.75Å; R407-F421 HydrophobicContact CB-CZ 4.07Å; R407-F421 HydrophobicContact CG-CD2 4.5Å; R407-F421 HydrophobicContact CG-CE2 4.47Å
408	S	96.2	Very high	95.9	Very high	38 Å²	38	60.3 Å²	60.3	27%	0.266	30%	0.3	S	S	.	.	H	α-helix	trans	-59.2	-46.9	177.1	-69.1	0	0	0	0	111.2	Q227 D404 A405 I410 M411 I412	Q227-S408 PolarHBondContact NE2-OG 3.42Å; Q227-S408 PolarHBondContact OE1-OG 3.46Å; D404-S408 PolarHBondContact O-N 3.34Å; D404-S408 PolarHBondContact O-OG 2.68Å; A405-S408 PolarHBondContact O-N 3.05Å; S408-I410 PolarHBondContact O-N 3.47Å; S408-M411 PolarHBondContact O-N 3.43Å; S408-I412 WeakPolarHBondContact O-CG1 3.39Å; S408-I412 PolarHBondContact O-N 2.94Å
409	Y	97.1	Very high	95.7	Very high	39 Å²	39	64.7 Å²	64.7	15%	0.153	32%	0.323	C	S	.	.	H	α-helix	trans	-57.1	-48.7	-179.2	-170.8	-94.4	0	0	0	112	L223 I231 D369 A371 E372 A405 L406 R407 I412 K413	L223-Y409 HydrophobicContact CD1-CD2 3.6Å; L223-Y409 HydrophobicContact CD1-CE2 4.15Å; I231-Y409 HydrophobicContact CD1-CD2 3.6Å; I231-Y409 HydrophobicContact CD1-CE2 4.39Å; I231-Y409 HydrophobicContact CD1-CG 4.17Å; D369-Y409 PolarHBondContact OD2-OH 3.32Å; A371-Y409 HydrophobicContact CB-CE1 4.09Å; A371-Y409 HydrophobicContact CB-CE2 4.15Å; E372-Y409 HydrophobicContact CG-CD1 3.96Å; E372-Y409 HydrophobicContact CG-CE1 3.88Å; A405-Y409 WeakPolarHBondContact O-CB 3.27Å; A405-Y409 PolarHBondContact O-N 3.24Å; L406-Y409 PolarHBondContact O-N 3.46Å; R407-Y409 VanDerWaalsContact C-N 3.35Å; Y409-I412 PolarHBondContact O-N 3.43Å; Y409-K413 HydrophobicContact CD1-CD 4.33Å; Y409-K413 HydrophobicContact CE1-CD 3.53Å; Y409-K413 VanDerWaalsContact O-CB 3.22Å; Y409-K413 WeakPolarHBondContact O-CB 3.48Å; Y409-K413 PolarHBondContact O-N 2.85Å
410	I	95.8	Very high	95.6	Very high	4 Å²	4	63 Å²	63	2%	0.021	32%	0.315	C	S	.	.	H	α-helix	trans	-66.5	-42.3	178.8	-67.7	165.9	0	0	0	111.4	L406 R407 S408 I412 K413 R414 M420 F421 M424	L406-I410 HydrophobicContact CD1-CD1 3.76Å; L406-I410 HydrophobicContact CD1-CG1 4.16Å; L406-I410 HydrophobicContact CG-CD1 3.81Å; L406-I410 WeakPolarHBondContact O-CB 3.33Å; L406-I410 WeakPolarHBondContact O-CD1 3.33Å; L406-I410 VanDerWaalsContact O-CG1 3.26Å; L406-I410 WeakPolarHBondContact O-CG1 3.45Å; L406-I410 PolarHBondContact O-N 3.43Å; R407-I410 PolarHBondContact O-N 3.03Å; S408-I410 PolarHBondContact O-N 3.47Å; I410-I412 VanDerWaalsContact C-N 3.25Å; I410-I412 PolarHBondContact O-N 2.54Å; I410-K413 PolarHBondContact O-N 2.98Å; I410-R414 CarbonylContact O-C 3.55Å; I410-R414 WeakPolarHBondContact O-CA 3.32Å; I410-R414 PolarHBondContact O-N 3.26Å; I410-M420 HydrophobicContact CD1-CG 4.44Å; I410-M420 HydrophobicContact CG2-CB 3.71Å; I410-M420 HydrophobicContact CG2-CG 3.9Å; I410-F421 HydrophobicContact CD1-CB 3.89Å; I410-F421 HydrophobicContact CD1-CD2 3.98Å; I410-F421 HydrophobicContact CD1-CG 4.46Å; I410-F421 HydrophobicContact CG2-CB 4.47Å; I410-M424 HydrophobicContact CD1-CE 4.15Å; I410-M424 HydrophobicContact CD1-SD 3.31Å; I410-M424 WeakPolarHBondContact CD1-SD 3.47Å; I410-M424 HydrophobicContact CG1-SD 4.13Å
411	M	93.3	Very high	95.6	Very high	118 Å²	118	60.3 Å²	60.3	58%	0.581	30%	0.302	S	S	*	.	H	α-helix	trans	-61.4	-36	-180	-77.6	-177.3	58.9	0	0	112.3	R407 S408 P415	R407-M411 HydrophobicContact CG-SD 4.16Å; R407-M411 WeakPolarHBondContact O-CB 3.44Å; R407-M411 VanDerWaalsContact O-CG 3.3Å; R407-M411 WeakPolarHBondContact O-CG 3.34Å; R407-M411 PolarHBondContact O-N 2.87Å; S408-M411 PolarHBondContact O-N 3.43Å; M411-P415 WeakPolarHBondContact O-CA 3.32Å
412	I	93.5	Very high	95.6	Very high	61 Å²	61	60.2 Å²	60.2	31%	0.313	30%	0.302	S	S	.	.	H	α-helix	trans	-77.5	-48	177.9	-69	165.8	0	0	0	110.9	A221 L223 S408 Y409 I410	A221-I412 HydrophobicContact CB-CG1 4.1Å; A221-I412 WeakPolarHBondContact O-CG1 3.42Å; A221-I412 WeakPolarHBondContact O-CG2 3.5Å; L223-I412 HydrophobicContact CB-CD1 4.39Å; L223-I412 HydrophobicContact CD2-CD1 3.74Å; L223-I412 HydrophobicContact CG-CD1 3.64Å; S408-I412 WeakPolarHBondContact O-CG1 3.39Å; S408-I412 PolarHBondContact O-N 2.94Å; Y409-I412 PolarHBondContact O-N 3.43Å; I410-I412 VanDerWaalsContact C-N 3.25Å; I410-I412 PolarHBondContact O-N 2.54Å
413	K	93.8	Very high	95.5	Very high	80 Å²	80	65 Å²	65	35%	0.348	32%	0.319	S	S	.	.	H	α-helix	trans	-72.1	-35	-176	-175.7	178.2	170.2	-170.4	0	113.2	D369 E372 Y409 I410	D369-K413 IonicContact OD1-NZ 3.51Å; D369-K413 IonicContact OD2-NZ 3.83Å; D369-K413 PolarHBondContact OD2-NZ 2.97Å; E372-K413 IonicContact OE2-NZ 3.59Å; E372-K413 PolarHBondContact OE2-NZ 3.34Å; Y409-K413 HydrophobicContact CD1-CD 4.33Å; Y409-K413 HydrophobicContact CE1-CD 3.53Å; Y409-K413 VanDerWaalsContact O-CB 3.22Å; Y409-K413 WeakPolarHBondContact O-CB 3.48Å; Y409-K413 PolarHBondContact O-N 2.85Å; I410-K413 PolarHBondContact O-N 2.98Å
414	R	93.1	Very high	95.5	Very high	46 Å²	46	63.6 Å²	63.6	17%	0.174	31%	0.311	C	S	.	.			trans	-130.7	68.3	-177.2	-61	-172.4	-169.9	76.1	-11.4	110.7	H367 E372 I410 N416 D417	H367-R414 PolarHBondContact O-NH2 3.18Å; E372-R414 VanDerWaalsContact CD-NH1 3.28Å; E372-R414 IonicContact OE1-CZ 3.62Å; E372-R414 IonicContact OE1-NH1 3.55Å; E372-R414 PolarHBondContact OE1-NH1 3.1Å; E372-R414 IonicContact OE1-NH2 3.59Å; E372-R414 PolarHBondContact OE1-NH2 3.06Å; E372-R414 IonicContact OE2-CZ 3.34Å; E372-R414 IonicContact OE2-NH1 3.57Å; E372-R414 PolarHBondContact OE2-NH1 2.98Å; E372-R414 IonicContact OE2-NH2 2.88Å; E372-R414 PolarHBondContact OE2-NH2 3.44Å; I410-R414 CarbonylContact O-C 3.55Å; I410-R414 WeakPolarHBondContact O-CA 3.32Å; I410-R414 PolarHBondContact O-N 3.26Å; R414-N416 PolarHBondContact O-N 3.34Å; R414-D417 HydrophobicContact CB-CB 4.15Å; R414-D417 PolarHBondContact O-N 3.35Å
415	P	91.3	Very high	95.5	Very high	75 Å²	75	62.9 Å²	62.9	49%	0.487	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-23.3	-174.7	25	-34.9	0	0	0	113.6	M411 H418	M411-P415 WeakPolarHBondContact O-CA 3.32Å; P415-H418 PolarHBondContact O-CE1 3.2Å
416	N	93.3	Very high	95.5	Very high	155 Å²	155	68.1 Å²	68.1	83%	0.829	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-7.6	-179.4	-62.8	-38.4	0	0	0	114.1	R414	R414-N416 PolarHBondContact O-N 3.34Å
417	D	93.3	Very high	95.5	Very high	45 Å²	45	70 Å²	70	24%	0.241	34%	0.341	C	S	.	.			trans	-113.6	74.1	-177.7	-167.4	-12.8	0	0	0	111.7	R414 L419 M420 R423	R414-D417 HydrophobicContact CB-CB 4.15Å; R414-D417 PolarHBondContact O-N 3.35Å; D417-L419 PolarHBondContact O-N 3.3Å; D417-L419 VanDerWaalsContact O-N 3.09Å; D417-L419 PolarHBondContact OD1-N 2.62Å; D417-M420 HydrophobicContact CB-CB 4.32Å; D417-M420 WeakPolarHBondContact O-CB 3.43Å; D417-M420 PolarHBondContact O-N 3.05Å; D417-M420 VanDerWaalsContact O-N 3.16Å; D417-M420 PolarHBondContact OD1-N 3.21Å; D417-M420 VanDerWaalsContact OD1-N 3.1Å; D417-R423 IonicContact OD1-CZ 2.81Å; D417-R423 IonicContact OD1-NH2 3.48Å; D417-R423 PolarHBondContact OD1-NH2 3Å; D417-R423 IonicContact OD2-CZ 3.13Å; D417-R423 IonicContact OD2-NH2 2.7Å; D417-R423 PolarHBondContact OD2-NH2 3.08Å
418	H	91.1	Very high	95.5	Very high	152 Å²	152	64.5 Å²	64.5	70%	0.704	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-11.6	178.8	-54.3	-51.6	0	0	0	114	P415	P415-H418 PolarHBondContact O-CE1 3.2Å
419	L	95.7	Very high	95.5	Very high	116 Å²	116	66.6 Å²	66.6	61%	0.607	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-1.6	179.3	-64.1	-179.3	0	0	0	112.7	D417 P422 R423	D417-L419 PolarHBondContact O-N 3.3Å; D417-L419 VanDerWaalsContact O-N 3.09Å; D417-L419 PolarHBondContact OD1-N 2.62Å; L419-P422 HydrophobicContact CD2-CG 4.34Å; L419-P422 WeakPolarHBondContact O-CD 3.47Å; L419-P422 WeakPolarHBondContact O-CG 2.88Å; L419-R423 VanDerWaalsContact O-CB 3.26Å; L419-R423 WeakPolarHBondContact O-CB 2.97Å; L419-R423 VanDerWaalsContact O-CG 3.22Å; L419-R423 WeakPolarHBondContact O-CG 3.41Å; L419-R423 PolarHBondContact O-N 2.71Å; L419-R423 VanDerWaalsContact O-N 3.1Å; L419-R423 PolarHBondContact O-NE 3.17Å; L419-R423 VanDerWaalsContact O-NE 3.11Å
420	M	96.9	Very high	95.6	Very high	8 Å²	8	67.2 Å²	67.2	4%	0.039	34%	0.343	C	S	.	.	H	α-helix	trans	-64.2	-52	178.8	-176.5	59.5	78.7	0	0	111.5	L366 L368 I410 D417 R423 M424	L366-M420 HydrophobicContact CB-SD 4.44Å; L366-M420 HydrophobicContact CD2-SD 4.2Å; L366-M420 WeakPolarHBondContact O-CE 3.49Å; L368-M420 HydrophobicContact CD2-SD 4.3Å; I410-M420 HydrophobicContact CD1-CG 4.44Å; I410-M420 HydrophobicContact CG2-CB 3.71Å; I410-M420 HydrophobicContact CG2-CG 3.9Å; D417-M420 HydrophobicContact CB-CB 4.32Å; D417-M420 WeakPolarHBondContact O-CB 3.43Å; D417-M420 PolarHBondContact O-N 3.05Å; D417-M420 VanDerWaalsContact O-N 3.16Å; D417-M420 PolarHBondContact OD1-N 3.21Å; D417-M420 VanDerWaalsContact OD1-N 3.1Å; M420-R423 PolarHBondContact O-N 3.23Å; M420-R423 VanDerWaalsContact O-N 3.13Å; M420-M424 HydrophobicContact CG-CG 4.4Å; M420-M424 HydrophobicContact CG-SD 3.87Å; M420-M424 WeakPolarHBondContact O-CG 3.47Å; M420-M424 PolarHBondContact O-N 3.38Å; M420-M424 HydrophobicContact SD-CG 4.14Å; M420-M424 HydrophobicContact SD-SD 4.18Å
421	F	97.8	Very high	95.7	Very high	42 Å²	42	67 Å²	67	18%	0.184	34%	0.342	C	S	.	.	H	α-helix	trans	-53.5	-54.2	178.4	177.7	-104.1	0	0	0	113.7	V403 L406 R407 I410 R423 M424 L425	V403-F421 HydrophobicContact CG1-CE2 4.31Å; V403-F421 HydrophobicContact CG1-CZ 3.8Å; L406-F421 HydrophobicContact CB-CE2 4.36Å; L406-F421 HydrophobicContact CD2-CD2 4.3Å; L406-F421 HydrophobicContact CD2-CE2 4.22Å; L406-F421 HydrophobicContact CG-CD2 4.14Å; L406-F421 HydrophobicContact CG-CE2 4.21Å; R407-F421 HydrophobicContact CB-CD2 4.02Å; R407-F421 HydrophobicContact CB-CE2 3.75Å; R407-F421 HydrophobicContact CB-CZ 4.07Å; R407-F421 HydrophobicContact CG-CD2 4.5Å; R407-F421 HydrophobicContact CG-CE2 4.47Å; I410-F421 HydrophobicContact CD1-CB 3.89Å; I410-F421 HydrophobicContact CD1-CD2 3.98Å; I410-F421 HydrophobicContact CD1-CG 4.46Å; I410-F421 HydrophobicContact CG2-CB 4.47Å; F421-R423 VanDerWaalsContact C-N 3.33Å; F421-R423 PolarHBondContact O-N 3.3Å; F421-M424 PolarHBondContact O-N 3.11Å; F421-L425 HydrophobicContact CD1-CD1 4.28Å; F421-L425 HydrophobicContact CE1-CD1 3.63Å; F421-L425 HydrophobicContact CE1-CG 4.47Å; F421-L425 HydrophobicContact CE2-CD1 4.26Å; F421-L425 HydrophobicContact CE2-CG 4.44Å; F421-L425 HydrophobicContact CZ-CD1 3.64Å; F421-L425 HydrophobicContact CZ-CG 4.3Å; F421-L425 PolarHBondContact O-N 3.25Å; F421-L425 VanDerWaalsContact O-N 3.1Å
422	P	97.5	Very high	95.8	Very high	55 Å²	55	65.3 Å²	65.3	36%	0.357	33%	0.329	S	S	.	.	H	α-helix	trans	-65.3	-34.6	177.5	24.9	-33.9	0	0	0	112.7	L419 M424 L425 M426	L419-P422 HydrophobicContact CD2-CG 4.34Å; L419-P422 WeakPolarHBondContact O-CD 3.47Å; L419-P422 WeakPolarHBondContact O-CG 2.88Å; P422-M424 VanDerWaalsContact C-N 3.31Å; P422-M424 PolarHBondContact O-N 3.46Å; P422-L425 PolarHBondContact O-N 2.81Å; P422-M426 VanDerWaalsContact O-CG 3.28Å; P422-M426 WeakPolarHBondContact O-CG 3.5Å; P422-M426 PolarHBondContact O-N 3.11Å
423	R	97.8	Very high	96	Very high	104 Å²	104	66.9 Å²	66.9	39%	0.392	34%	0.342	S	S	.	.	H	α-helix	trans	-61.8	-39.8	175	-81.9	-175.3	-74.2	170	-4.7	112.1	L366 D417 L419 M420 F421 M426 K427	L366-R423 HydrophobicContact CD2-CB 4.29Å; D417-R423 IonicContact OD1-CZ 2.81Å; D417-R423 IonicContact OD1-NH2 3.48Å; D417-R423 PolarHBondContact OD1-NH2 3Å; D417-R423 IonicContact OD2-CZ 3.13Å; D417-R423 IonicContact OD2-NH2 2.7Å; D417-R423 PolarHBondContact OD2-NH2 3.08Å; L419-R423 VanDerWaalsContact O-CB 3.26Å; L419-R423 WeakPolarHBondContact O-CB 2.97Å; L419-R423 VanDerWaalsContact O-CG 3.22Å; L419-R423 WeakPolarHBondContact O-CG 3.41Å; L419-R423 PolarHBondContact O-N 2.71Å; L419-R423 VanDerWaalsContact O-N 3.1Å; L419-R423 PolarHBondContact O-NE 3.17Å; L419-R423 VanDerWaalsContact O-NE 3.11Å; M420-R423 PolarHBondContact O-N 3.23Å; M420-R423 VanDerWaalsContact O-N 3.13Å; F421-R423 VanDerWaalsContact C-N 3.33Å; F421-R423 PolarHBondContact O-N 3.3Å; R423-M426 PolarHBondContact O-N 2.69Å; R423-K427 PolarHBondContact O-N 3.24Å
424	M	98.1	Very high	96.2	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-64.5	-45.4	175.8	-70.6	174.5	67.4	0	0	111.7	L366 L368 E372 L376 L406 I410 M420 F421 P422 M426 K427	L366-M424 HydrophobicContact CD1-CG 4.32Å; L368-M424 HydrophobicContact CD1-CE 3.94Å; L368-M424 HydrophobicContact CD1-CG 4.45Å; L368-M424 HydrophobicContact CD2-CE 3.71Å; L368-M424 HydrophobicContact CD2-CG 3.87Å; L368-M424 HydrophobicContact CD2-SD 3.57Å; L368-M424 VanDerWaalsContact CD2-SD 3.57Å; L368-M424 HydrophobicContact CG-CE 4.42Å; E372-M424 HydrophobicContact CB-CE 3.74Å; E372-M424 HydrophobicContact CG-CE 4.09Å; L376-M424 HydrophobicContact CD1-CB 4.27Å; L376-M424 HydrophobicContact CD1-CE 3.62Å; L376-M424 HydrophobicContact CD2-CB 4.21Å; L376-M424 HydrophobicContact CD2-CE 4.4Å; L376-M424 HydrophobicContact CG-CE 3.84Å; L406-M424 HydrophobicContact CD1-CE 3.69Å; L406-M424 HydrophobicContact CD2-CE 4.17Å; L406-M424 HydrophobicContact CG-CE 4.43Å; I410-M424 HydrophobicContact CD1-CE 4.15Å; I410-M424 HydrophobicContact CD1-SD 3.31Å; I410-M424 WeakPolarHBondContact CD1-SD 3.47Å; I410-M424 HydrophobicContact CG1-SD 4.13Å; M420-M424 HydrophobicContact CG-CG 4.4Å; M420-M424 HydrophobicContact CG-SD 3.87Å; M420-M424 WeakPolarHBondContact O-CG 3.47Å; M420-M424 PolarHBondContact O-N 3.38Å; M420-M424 HydrophobicContact SD-CG 4.14Å; M420-M424 HydrophobicContact SD-SD 4.18Å; F421-M424 PolarHBondContact O-N 3.11Å; P422-M424 VanDerWaalsContact C-N 3.31Å; P422-M424 PolarHBondContact O-N 3.46Å; M424-M426 VanDerWaalsContact C-N 3.29Å; M424-M426 PolarHBondContact O-N 3.44Å; M424-K427 VanDerWaalsContact O-CB 3.28Å; M424-K427 WeakPolarHBondContact O-CB 3.34Å; M424-K427 PolarHBondContact O-N 2.94Å
425	L	97.4	Very high	96.3	Very high	45 Å²	45	62.6 Å²	62.6	24%	0.236	33%	0.328	C	S	.	.	H	α-helix	trans	-62.9	-34.5	175.8	-64.5	-175.4	0	0	0	112.8	F421 P422 K427 L428	F421-L425 HydrophobicContact CD1-CD1 4.28Å; F421-L425 HydrophobicContact CE1-CD1 3.63Å; F421-L425 HydrophobicContact CE1-CG 4.47Å; F421-L425 HydrophobicContact CE2-CD1 4.26Å; F421-L425 HydrophobicContact CE2-CG 4.44Å; F421-L425 HydrophobicContact CZ-CD1 3.64Å; F421-L425 HydrophobicContact CZ-CG 4.3Å; F421-L425 PolarHBondContact O-N 3.25Å; F421-L425 VanDerWaalsContact O-N 3.1Å; P422-L425 PolarHBondContact O-N 2.81Å; L425-K427 PolarHBondContact O-N 3.2Å; L425-L428 HydrophobicContact CD2-CD1 4.2Å; L425-L428 VanDerWaalsContact O-CB 3.32Å; L425-L428 WeakPolarHBondContact O-CB 3.42Å; L425-L428 PolarHBondContact O-N 3.09Å
426	M	97.8	Very high	96.6	Very high	111 Å²	111	62.1 Å²	62.1	55%	0.547	33%	0.326	S	S	.	.	H	α-helix	trans	-65.8	-19.3	174.7	-68.7	-60.4	92.9	0	0	113.6	P422 R423 M424 L428 V429 S430	P422-M426 VanDerWaalsContact O-CG 3.28Å; P422-M426 WeakPolarHBondContact O-CG 3.5Å; P422-M426 PolarHBondContact O-N 3.11Å; R423-M426 PolarHBondContact O-N 2.69Å; M424-M426 VanDerWaalsContact C-N 3.29Å; M424-M426 PolarHBondContact O-N 3.44Å; M426-L428 VanDerWaalsContact C-N 3.32Å; M426-V429 HydrophobicContact CE-CG2 3.81Å; M426-V429 PolarHBondContact O-N 2.91Å; M426-V429 HydrophobicContact SD-CG2 4.29Å; M426-S430 PolarHBondContact O-N 3.27Å; M426-S430 PolarHBondContact O-OG 3.46Å; M426-S430 VanDerWaalsContact O-OG 3.09Å
427	K	98.1	Very high	96.8	Very high	38 Å²	38	56 Å²	56	17%	0.165	29%	0.294	C	S	.	.	H	α-helix	trans	-68.5	-33.3	170.5	-61.5	-64.9	-172.2	176.3	0	111.7	F359 G362 M363 L366 R423 M424 L425 V429 S430 L431	F359-K427 HydrophobicContact CE2-CB 4.14Å; F359-K427 HydrophobicContact CE2-CD 4.03Å; F359-K427 HydrophobicContact CZ-CB 4.41Å; G362-K427 VanDerWaalsContact O-CE 3.29Å; G362-K427 WeakPolarHBondContact O-CE 3.47Å; G362-K427 PolarHBondContact O-NZ 3.46Å; M363-K427 HydrophobicContact SD-CB 3.85Å; M363-K427 HydrophobicContact SD-CD 3.69Å; M363-K427 HydrophobicContact SD-CG 3.49Å; M363-K427 WeakPolarHBondContact SD-CG 3.45Å; L366-K427 HydrophobicContact CD1-CD 4.44Å; L366-K427 HydrophobicContact CD1-CG 3.92Å; R423-K427 PolarHBondContact O-N 3.24Å; M424-K427 VanDerWaalsContact O-CB 3.28Å; M424-K427 WeakPolarHBondContact O-CB 3.34Å; M424-K427 PolarHBondContact O-N 2.94Å; L425-K427 PolarHBondContact O-N 3.2Å; K427-V429 VanDerWaalsContact C-N 3.28Å; K427-V429 PolarHBondContact O-N 3.45Å; K427-S430 WeakPolarHBondContact O-CB 3.37Å; K427-S430 PolarHBondContact O-N 2.95Å; K427-S430 VanDerWaalsContact O-N 3.1Å; K427-L431 WeakPolarHBondContact O-CG 3.36Å; K427-L431 PolarHBondContact O-N 3.19Å
428	L	97.7	Very high	96.9	Very high	23 Å²	23	54.4 Å²	54.4	12%	0.12	29%	0.286	C	S	.	.	H	α-helix	trans	-63	-36.1	173.9	-54.9	-177.4	0	0	0	111.9	L317 L376 I379 N380 L425 M426 L431 R432	L317-L428 HydrophobicContact CD1-CD2 4.44Å; L376-L428 HydrophobicContact CD2-CD1 4.4Å; L376-L428 HydrophobicContact CD2-CD2 4.21Å; L376-L428 HydrophobicContact CD2-CG 4.32Å; I379-L428 HydrophobicContact CG2-CD1 3.71Å; N380-L428 HydrophobicContact CB-CD2 4.11Å; L425-L428 HydrophobicContact CD2-CD1 4.2Å; L425-L428 VanDerWaalsContact O-CB 3.32Å; L425-L428 WeakPolarHBondContact O-CB 3.42Å; L425-L428 PolarHBondContact O-N 3.09Å; M426-L428 VanDerWaalsContact C-N 3.32Å; L428-L431 HydrophobicContact CD2-CD1 3.96Å; L428-L431 WeakPolarHBondContact O-CB 3.37Å; L428-L431 PolarHBondContact O-N 3.1Å; L428-R432 PolarHBondContact O-N 3.48Å
429	V	96.2	Very high	97.1	Very high	82 Å²	82	50.5 Å²	50.5	50%	0.497	28%	0.275	S	S	.	.	H	α-helix	trans	-65.5	-41.4	173	-176.1	0	0	0	0	111	M426 K427 L431 R432	M426-V429 HydrophobicContact CE-CG2 3.81Å; M426-V429 PolarHBondContact O-N 2.91Å; M426-V429 HydrophobicContact SD-CG2 4.29Å; K427-V429 VanDerWaalsContact C-N 3.28Å; K427-V429 PolarHBondContact O-N 3.45Å; V429-L431 VanDerWaalsContact C-N 3.26Å; V429-L431 PolarHBondContact O-N 3.44Å; V429-R432 WeakPolarHBondContact O-CB 3.46Å; V429-R432 PolarHBondContact O-N 3.33Å; V429-R432 VanDerWaalsContact O-N 3.11Å
430	S	97.8	Very high	97.1	Very high	51 Å²	51	50.5 Å²	50.5	36%	0.357	27%	0.272	S	S	.	.	H	α-helix	trans	-63.2	-34.2	177.2	-52.1	0	0	0	0	112.1	M426 K427 R432 T433 L434	M426-S430 PolarHBondContact O-N 3.27Å; M426-S430 PolarHBondContact O-OG 3.46Å; M426-S430 VanDerWaalsContact O-OG 3.09Å; K427-S430 WeakPolarHBondContact O-CB 3.37Å; K427-S430 PolarHBondContact O-N 2.95Å; K427-S430 VanDerWaalsContact O-N 3.1Å; S430-R432 VanDerWaalsContact C-N 3.27Å; S430-R432 PolarHBondContact O-N 2.81Å; S430-T433 PolarHBondContact O-N 2.65Å; S430-L434 PolarHBondContact O-N 3.48Å; S430-L434 VanDerWaalsContact O-N 3.11Å
431	L	98.2	Very high	97.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62.8	-32.2	174.7	-69.1	169.4	0	0	0	112.4	E313 L316 L317 F359 K427 L428 V429 T433 L434 S435	E313-L431 HydrophobicContact CB-CB 3.98Å; E313-L431 HydrophobicContact CB-CD1 4.09Å; E313-L431 HydrophobicContact CB-CD2 4.43Å; E313-L431 HydrophobicContact CB-CG 4.39Å; E313-L431 HydrophobicContact CG-CB 3.91Å; L316-L431 HydrophobicContact CB-CD2 3.79Å; L316-L431 HydrophobicContact CD1-CD2 4.35Å; L317-L431 HydrophobicContact CD1-CD1 3.62Å; L317-L431 HydrophobicContact CD2-CD1 4.02Å; L317-L431 HydrophobicContact CG-CD1 3.56Å; L317-L431 HydrophobicContact CG-CD2 4.27Å; F359-L431 HydrophobicContact CE1-CD2 3.82Å; F359-L431 HydrophobicContact CE2-CD2 4.05Å; F359-L431 HydrophobicContact CE2-CG 4.19Å; F359-L431 HydrophobicContact CZ-CD2 3.5Å; F359-L431 VanDerWaalsContact CZ-CD2 3.5Å; F359-L431 HydrophobicContact CZ-CG 3.89Å; K427-L431 WeakPolarHBondContact O-CG 3.36Å; K427-L431 PolarHBondContact O-N 3.19Å; L428-L431 HydrophobicContact CD2-CD1 3.96Å; L428-L431 WeakPolarHBondContact O-CB 3.37Å; L428-L431 PolarHBondContact O-N 3.1Å; V429-L431 VanDerWaalsContact C-N 3.26Å; V429-L431 PolarHBondContact O-N 3.44Å; L431-T433 VanDerWaalsContact C-N 3.33Å; L431-T433 PolarHBondContact O-N 3.09Å; L431-L434 HydrophobicContact CD2-CD1 4.33Å; L431-L434 PolarHBondContact O-N 3.33Å; L431-S435 WeakPolarHBondContact O-CB 3.45Å; L431-S435 PolarHBondContact O-N 3.08Å
432	R	96.1	Very high	96.9	Very high	82 Å²	82	49 Å²	49	31%	0.309	27%	0.266	S	S	.	.	H	α-helix	trans	-62.6	-41.9	175.4	-54.8	-47.2	-172.6	82.7	0.9	111.5	E313 D385 L428 V429 S430 S435 S436	E313-R432 WeakPolarHBondContact OE1-CD 3.48Å; E313-R432 IonicContact OE1-NE 2.71Å; E313-R432 IonicContact OE2-NE 3.47Å; D385-R432 VanDerWaalsContact CG-NH2 3.29Å; D385-R432 IonicContact OD1-CZ 3.9Å; D385-R432 IonicContact OD1-NH2 2.65Å; D385-R432 PolarHBondContact OD1-NH2 3Å; D385-R432 IonicContact OD2-CZ 3.54Å; D385-R432 IonicContact OD2-NH1 2.72Å; D385-R432 PolarHBondContact OD2-NH1 3.24Å; D385-R432 IonicContact OD2-NH2 2.77Å; D385-R432 PolarHBondContact OD2-NH2 3.45Å; L428-R432 PolarHBondContact O-N 3.48Å; V429-R432 WeakPolarHBondContact O-CB 3.46Å; V429-R432 PolarHBondContact O-N 3.33Å; V429-R432 VanDerWaalsContact O-N 3.11Å; S430-R432 VanDerWaalsContact C-N 3.27Å; S430-R432 PolarHBondContact O-N 2.81Å; R432-S435 WeakPolarHBondContact O-CB 3.49Å; R432-S435 PolarHBondContact O-N 3.37Å; R432-S436 PolarHBondContact O-N 3.14Å
433	T	96.4	Very high	96.7	Very high	95 Å²	95	52.6 Å²	52.6	58%	0.583	28%	0.277	S	S	*	.	H	α-helix	trans	-64.1	-45.5	174.3	-54.1	0	0	0	0	111.3	S430 L431 S435 S436 V437	S430-T433 PolarHBondContact O-N 2.65Å; L431-T433 VanDerWaalsContact C-N 3.33Å; L431-T433 PolarHBondContact O-N 3.09Å; T433-S435 VanDerWaalsContact C-N 3.29Å; T433-S435 PolarHBondContact O-N 3.31Å; T433-S436 WeakPolarHBondContact O-CB 3.45Å; T433-S436 PolarHBondContact O-N 3.42Å; T433-S436 VanDerWaalsContact O-N 3.17Å; T433-V437 WeakPolarHBondContact O-CG2 3.39Å; T433-V437 PolarHBondContact O-N 2.92Å; T433-V437 VanDerWaalsContact O-N 3.1Å
434	L	97.8	Very high	96.5	Very high	12 Å²	12	48.1 Å²	48.1	6%	0.063	26%	0.262	C	S	.	.	H	α-helix	trans	-63.8	-34.4	177.5	-70.9	170.8	0	0	0	113	L316 P355 F359 S430 L431 S436 V437 H438	L316-L434 HydrophobicContact CD1-CB 3.54Å; L316-L434 HydrophobicContact CD1-CD1 4.05Å; L316-L434 HydrophobicContact CD1-CG 4.4Å; P355-L434 HydrophobicContact CB-CD2 3.32Å; F359-L434 HydrophobicContact CB-CD1 3.67Å; F359-L434 HydrophobicContact CD1-CD1 4.02Å; F359-L434 HydrophobicContact CD2-CD1 3.8Å; F359-L434 HydrophobicContact CE2-CD1 4.45Å; F359-L434 HydrophobicContact CG-CD1 3.55Å; S430-L434 PolarHBondContact O-N 3.48Å; S430-L434 VanDerWaalsContact O-N 3.11Å; L431-L434 HydrophobicContact CD2-CD1 4.33Å; L431-L434 PolarHBondContact O-N 3.33Å; L434-S436 VanDerWaalsContact C-N 3.33Å; L434-V437 PolarHBondContact O-N 3.34Å; L434-H438 WeakPolarHBondContact O-CB 3.42Å; L434-H438 PolarHBondContact O-N 3.48Å
435	S	96.8	Very high	96.2	Very high	24 Å²	24	48.5 Å²	48.5	17%	0.168	26%	0.264	C	S	.	.	H	α-helix	trans	-60.9	-42.7	173.8	-172.3	0	0	0	0	111	I312 L431 R432 T433 V437 H438 S439	I312-S435 WeakPolarHBondContact CG2-OG 3.37Å; L431-S435 WeakPolarHBondContact O-CB 3.45Å; L431-S435 PolarHBondContact O-N 3.08Å; R432-S435 WeakPolarHBondContact O-CB 3.49Å; R432-S435 PolarHBondContact O-N 3.37Å; T433-S435 VanDerWaalsContact C-N 3.29Å; T433-S435 PolarHBondContact O-N 3.31Å; S435-V437 PolarHBondContact O-N 2.88Å; S435-H438 WeakPolarHBondContact O-CB 3.02Å; S435-H438 PolarHBondContact O-N 2.96Å; S435-S439 PolarHBondContact O-N 3.33Å; S435-S439 PolarHBondContact O-OG 2.97Å
436	S	96	Very high	95.7	Very high	65 Å²	65	52.4 Å²	52.4	46%	0.455	28%	0.275	S	S	.	.	H	α-helix	trans	-60.8	-45.5	173	-170	0	0	0	0	112.5	R432 T433 L434 H438 S439 E440	R432-S436 PolarHBondContact O-N 3.14Å; T433-S436 WeakPolarHBondContact O-CB 3.45Å; T433-S436 PolarHBondContact O-N 3.42Å; T433-S436 VanDerWaalsContact O-N 3.17Å; L434-S436 VanDerWaalsContact C-N 3.33Å; S436-H438 VanDerWaalsContact C-N 3.27Å; S436-H438 PolarHBondContact O-N 3.43Å; S436-S439 WeakPolarHBondContact O-CB 3.44Å; S436-S439 PolarHBondContact O-N 3.44Å; S436-S439 VanDerWaalsContact O-N 3.16Å; S436-E440 PolarHBondContact O-N 3.15Å; S436-E440 VanDerWaalsContact O-N 3.08Å
437	V	97.7	Very high	95.3	Very high	26 Å²	26	53.8 Å²	53.8	16%	0.158	29%	0.285	C	S	.	.	H	α-helix	trans	-64.4	-35.5	177.5	-178.1	0	0	0	0	111	E351 F352 T433 L434 S435 E440 Q441	E351-V437 WeakPolarHBondContact O-CG1 3.31Å; F352-V437 HydrophobicContact CB-CG1 4.31Å; F352-V437 HydrophobicContact CD2-CG1 4.13Å; T433-V437 WeakPolarHBondContact O-CG2 3.39Å; T433-V437 PolarHBondContact O-N 2.92Å; T433-V437 VanDerWaalsContact O-N 3.1Å; L434-V437 PolarHBondContact O-N 3.34Å; S435-V437 PolarHBondContact O-N 2.88Å; V437-E440 PolarHBondContact O-N 3.41Å; V437-Q441 PolarHBondContact O-N 3.45Å
438	H	96.9	Very high	94.7	Very high	12 Å²	12	56.7 Å²	56.7	6%	0.056	30%	0.299	C	S	.	.	H	α-helix	trans	-62.8	-43.8	172.3	172.7	-99.3	0	0	0	111.9	I312 F352 L434 S435 S436 E440 Q441 V442 W460	I312-H438 HydrophobicContact CD1-CB 4.25Å; I312-H438 VanDerWaalsContact CD1-CD2 3.4Å; I312-H438 WeakPolarHBondContact CD1-CD2 3.26Å; I312-H438 HydrophobicContact CG1-CB 3.83Å; I312-H438 VanDerWaalsContact CG1-CG 3.49Å; F352-H438 HydrophobicContact CD2-CB 4.49Å; F352-H438 HydrophobicContact CE2-CB 3.78Å; F352-H438 AromaticContact CE2-CD2 3.86Å; F352-H438 AromaticContact CZ-CD2 3.84Å; L434-H438 WeakPolarHBondContact O-CB 3.42Å; L434-H438 PolarHBondContact O-N 3.48Å; S435-H438 WeakPolarHBondContact O-CB 3.02Å; S435-H438 PolarHBondContact O-N 2.96Å; S436-H438 VanDerWaalsContact C-N 3.27Å; S436-H438 PolarHBondContact O-N 3.43Å; H438-E440 VanDerWaalsContact C-N 3.29Å; H438-E440 PolarHBondContact O-N 3.24Å; H438-Q441 CarbonylContact O-C 3.51Å; H438-Q441 WeakPolarHBondContact O-CA 3.47Å; H438-Q441 WeakPolarHBondContact O-CB 3.37Å; H438-Q441 PolarHBondContact O-N 3.43Å; H438-Q441 VanDerWaalsContact O-N 3.07Å; H438-V442 VanDerWaalsContact CE1-CG2 3.44Å; H438-V442 WeakPolarHBondContact CE1-CG2 3.49Å; H438-V442 WeakPolarHBondContact O-CG2 3.28Å; H438-V442 PolarHBondContact O-N 3.48Å; H438-W460 AromaticContact CE1-CD1 3.63Å; H438-W460 AromaticContact CE1-CD2 3.51Å; H438-W460 AromaticContact CE1-CE2 3.45Å; H438-W460 VanDerWaalsContact CE1-CE2 3.45Å; H438-W460 AromaticContact CE1-CG 3.65Å; H438-W460 AromaticContact CE1-NE1 3.52Å; H438-W460 AromaticContact NE2-CD2 3.82Å; H438-W460 AromaticContact NE2-CE2 3.59Å; H438-W460 AromaticContact NE2-CH2 3.93Å; H438-W460 AromaticContact NE2-CZ2 3.67Å
439	S	95.4	Very high	94.1	Very high	70 Å²	70	62 Å²	62	49%	0.49	33%	0.327	S	S	.	.	H	α-helix	trans	-59	-40.2	175	-62.1	0	0	0	0	112.1	S435 S436 Q441 V442 F443	S435-S439 PolarHBondContact O-N 3.33Å; S435-S439 PolarHBondContact O-OG 2.97Å; S436-S439 WeakPolarHBondContact O-CB 3.44Å; S436-S439 PolarHBondContact O-N 3.44Å; S436-S439 VanDerWaalsContact O-N 3.16Å; S439-Q441 VanDerWaalsContact C-N 3.34Å; S439-Q441 PolarHBondContact O-N 2.79Å; S439-V442 PolarHBondContact O-N 2.93Å; S439-F443 WeakPolarHBondContact O-CB 3.44Å; S439-F443 PolarHBondContact O-N 3.41Å
440	E	95.8	Very high	93.5	Very high	116 Å²	116	59.7 Å²	59.7	54%	0.542	31%	0.31	S	S	.	.	H	α-helix	trans	-62	-40.7	172.8	-68.3	173.9	-166.2	0	0	112	S436 V437 H438 F443 A444	S436-E440 PolarHBondContact O-N 3.15Å; S436-E440 VanDerWaalsContact O-N 3.08Å; V437-E440 PolarHBondContact O-N 3.41Å; H438-E440 VanDerWaalsContact C-N 3.29Å; H438-E440 PolarHBondContact O-N 3.24Å; E440-F443 WeakPolarHBondContact O-CB 3.4Å; E440-F443 PolarHBondContact O-N 2.99Å; E440-A444 PolarHBondContact O-N 3.27Å
441	Q	95.9	Very high	92.9	Very high	5 Å²	5	65.8 Å²	65.8	2%	0.023	33%	0.33	C	S	.	.	H	α-helix	trans	-64.6	-42.8	174.9	177.7	60	87.2	0	0	112	L348 F352 V437 H438 S439 F443 A444 L445	L348-Q441 HydrophobicContact CD2-CG 4.32Å; F352-Q441 HydrophobicContact CB-CB 4.01Å; F352-Q441 HydrophobicContact CB-CG 4.18Å; F352-Q441 HydrophobicContact CD1-CB 4.19Å; F352-Q441 HydrophobicContact CD1-CG 3.68Å; F352-Q441 HydrophobicContact CD2-CB 3.91Å; F352-Q441 HydrophobicContact CD2-CG 4.31Å; F352-Q441 HydrophobicContact CE1-CG 4.08Å; F352-Q441 HydrophobicContact CE2-CB 4.43Å; F352-Q441 HydrophobicContact CG-CB 3.77Å; F352-Q441 HydrophobicContact CG-CG 3.79Å; V437-Q441 PolarHBondContact O-N 3.45Å; H438-Q441 CarbonylContact O-C 3.51Å; H438-Q441 WeakPolarHBondContact O-CA 3.47Å; H438-Q441 WeakPolarHBondContact O-CB 3.37Å; H438-Q441 PolarHBondContact O-N 3.43Å; H438-Q441 VanDerWaalsContact O-N 3.07Å; S439-Q441 VanDerWaalsContact C-N 3.34Å; S439-Q441 PolarHBondContact O-N 2.79Å; Q441-F443 VanDerWaalsContact C-N 3.32Å; Q441-F443 PolarHBondContact O-N 3.1Å; Q441-A444 PolarHBondContact O-N 3.19Å; Q441-L445 WeakPolarHBondContact O-CG 3.3Å; Q441-L445 PolarHBondContact O-N 3.18Å
442	V	94.3	Very high	92.5	Very high	12 Å²	12	66.8 Å²	66.8	7%	0.073	34%	0.336	C	S	.	.	H	α-helix	trans	-61.2	-43.4	175.5	171.6	0	0	0	0	110.4	H438 S439 A444 L445 R446 L452 W460 V462	H438-V442 VanDerWaalsContact CE1-CG2 3.44Å; H438-V442 WeakPolarHBondContact CE1-CG2 3.49Å; H438-V442 WeakPolarHBondContact O-CG2 3.28Å; H438-V442 PolarHBondContact O-N 3.48Å; S439-V442 PolarHBondContact O-N 2.93Å; V442-A444 PolarHBondContact O-N 3.16Å; V442-L445 WeakPolarHBondContact O-CB 3.49Å; V442-L445 PolarHBondContact O-N 3.33Å; V442-R446 PolarHBondContact O-N 2.69Å; V442-L452 HydrophobicContact CG1-CD1 4.45Å; V442-W460 HydrophobicContact CG1-CB 4.44Å; V442-W460 HydrophobicContact CG2-CB 4.33Å; V442-W460 HydrophobicContact CG2-CD2 4.34Å; V442-W460 HydrophobicContact CG2-CE3 4.03Å; V442-W460 HydrophobicContact CG2-CG 4.49Å; V442-V462 HydrophobicContact CG1-CG2 3.74Å
443	F	93.2	Very high	92.3	Very high	132 Å²	132	64.7 Å²	64.7	58%	0.579	33%	0.333	S	S	*	.	H	α-helix	trans	-59.9	-43.6	174.1	178.8	-98	0	0	0	112.2	S439 E440 Q441 L445 R446 L447	S439-F443 WeakPolarHBondContact O-CB 3.44Å; S439-F443 PolarHBondContact O-N 3.41Å; E440-F443 WeakPolarHBondContact O-CB 3.4Å; E440-F443 PolarHBondContact O-N 2.99Å; Q441-F443 VanDerWaalsContact C-N 3.32Å; Q441-F443 PolarHBondContact O-N 3.1Å; F443-L445 VanDerWaalsContact C-N 3.31Å; F443-L445 PolarHBondContact O-N 2.91Å; F443-R446 WeakPolarHBondContact O-CB 3.48Å; F443-R446 PolarHBondContact O-N 3.06Å; F443-L447 PolarHBondContact O-N 3.28Å
444	A	93.1	Very high	92.1	Very high	10 Å²	10	65.5 Å²	65.5	8%	0.083	34%	0.339	C	S	.	.	H	α-helix	trans	-62.4	-35.9	176	0	0	0	0	0	112.8	E440 Q441 V442 L447 Q448	E440-A444 PolarHBondContact O-N 3.27Å; Q441-A444 PolarHBondContact O-N 3.19Å; V442-A444 PolarHBondContact O-N 3.16Å; A444-L447 PolarHBondContact O-N 3.41Å; A444-Q448 VanDerWaalsContact O-CG 3.32Å; A444-Q448 WeakPolarHBondContact O-CG 3.43Å; A444-Q448 PolarHBondContact O-N 3.44Å
445	L	91.1	Very high	91.9	Very high	8 Å²	8	66.4 Å²	66.4	4%	0.042	34%	0.344	C	S	.	.	H	α-helix	trans	-66.6	-41	174.2	-66.6	170.8	0	0	0	111.5	F271 Q441 V442 F443 Q448 D449 K450 L452	F271-L445 HydrophobicContact CE2-CD1 3.97Å; F271-L445 HydrophobicContact CE2-CD2 3.66Å; F271-L445 HydrophobicContact CE2-CG 4.49Å; F271-L445 HydrophobicContact CZ-CD1 4.01Å; F271-L445 HydrophobicContact CZ-CD2 3.99Å; Q441-L445 WeakPolarHBondContact O-CG 3.3Å; Q441-L445 PolarHBondContact O-N 3.18Å; V442-L445 WeakPolarHBondContact O-CB 3.49Å; V442-L445 PolarHBondContact O-N 3.33Å; F443-L445 VanDerWaalsContact C-N 3.31Å; F443-L445 PolarHBondContact O-N 2.91Å; L445-Q448 CarbonylContact O-C 3.6Å; L445-Q448 PolarHBondContact O-N 2.99Å; L445-Q448 VanDerWaalsContact O-N 3.17Å; L445-D449 PolarHBondContact O-N 3.2Å; L445-K450 HydrophobicContact CB-CB 4.39Å; L445-K450 HydrophobicContact CD2-CD 3.56Å; L445-K450 PolarHBondContact O-N 3.44Å; L445-K450 VanDerWaalsContact O-N 3.08Å; L445-L452 HydrophobicContact CD1-CD2 4.44Å
446	R	87.8	Confident	91.7	Very high	126 Å²	126	65.3 Å²	65.3	48%	0.475	34%	0.336	S	S	.	.	H	α-helix	trans	-61.1	-43	175	-175.5	177.6	176.3	175.5	-0.1	111.6	V442 F443 Q448 D449 V462 E464	V442-R446 PolarHBondContact O-N 2.69Å; F443-R446 WeakPolarHBondContact O-CB 3.48Å; F443-R446 PolarHBondContact O-N 3.06Å; R446-Q448 PolarHBondContact O-N 3.03Å; R446-D449 PolarHBondContact O-N 3.04Å; R446-V462 PolarHBondContact NH1-O 3.45Å; R446-V462 VanDerWaalsContact NH1-O 3.11Å; R446-E464 PolarHBondContact NH1-OXT 3.43Å
447	L	88.8	Confident	91.5	Very high	141 Å²	141	63 Å²	63	74%	0.738	32%	0.32	S	S	*	.	H	α-helix	trans	-63.4	-28.9	176.6	-171	66.4	0	0	0	112.7	F443 A444 D449	F443-L447 PolarHBondContact O-N 3.28Å; A444-L447 PolarHBondContact O-N 3.41Å; L447-D449 PolarHBondContact O-N 3.4Å
448	Q	86.8	Confident	91.2	Very high	99 Å²	99	65.3 Å²	65.3	46%	0.463	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	5.1	175.2	-67.6	173.6	20.1	0	0	113.5	A444 L445 R446 K450	A444-Q448 VanDerWaalsContact O-CG 3.32Å; A444-Q448 WeakPolarHBondContact O-CG 3.43Å; A444-Q448 PolarHBondContact O-N 3.44Å; L445-Q448 CarbonylContact O-C 3.6Å; L445-Q448 PolarHBondContact O-N 2.99Å; L445-Q448 VanDerWaalsContact O-N 3.17Å; R446-Q448 PolarHBondContact O-N 3.03Å; Q448-K450 HydrophobicContact CB-CG 4.18Å; Q448-K450 PolarHBondContact O-N 3.39Å
449	D	83.5	Confident	90.9	Very high	134 Å²	134	65.2 Å²	65.2	72%	0.717	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	33	-174.4	-162.7	29.5	0	0	0	112.8	L445 R446 L447 K451	L445-D449 PolarHBondContact O-N 3.2Å; R446-D449 PolarHBondContact O-N 3.04Å; L447-D449 PolarHBondContact O-N 3.4Å; D449-K451 PolarHBondContact O-N 2.92Å
450	K	83.8	Confident	90.6	Very high	33 Å²	33	64.1 Å²	64.1	14%	0.143	31%	0.314	C	S	.	.			trans	-82.7	113.4	173.5	-75.2	-176.2	172.7	-177.6	0	109.2	F271 L445 Q448 L452	F271-K450 HydrophobicContact CE1-CD 4.46Å; F271-K450 HydrophobicContact CE2-CD 4.49Å; F271-K450 HydrophobicContact CZ-CD 4.36Å; L445-K450 HydrophobicContact CB-CB 4.39Å; L445-K450 HydrophobicContact CD2-CD 3.56Å; L445-K450 PolarHBondContact O-N 3.44Å; L445-K450 VanDerWaalsContact O-N 3.08Å; Q448-K450 HydrophobicContact CB-CG 4.18Å; Q448-K450 PolarHBondContact O-N 3.39Å; K450-L452 PolarHBondContact O-N 3.24Å
451	K	85.4	Confident	89.9	Confident	179 Å²	179	61.4 Å²	61.4	78%	0.778	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-74	123.7	175.4	-64.1	-173.9	178.6	-176.2	0	110.7	D449	D449-K451 PolarHBondContact O-N 2.92Å
452	L	90.4	Very high	88.5	Confident	21 Å²	21	61.9 Å²	61.9	11%	0.11	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-84.6	147.9	169.7	-72.2	169.2	0	0	0	110	F271 T275 V442 L445 K450 W460 V462	F271-L452 HydrophobicContact CE1-CD2 4.37Å; F271-L452 HydrophobicContact CZ-CD2 3.85Å; T275-L452 HydrophobicContact CG2-CD2 4.38Å; V442-L452 HydrophobicContact CG1-CD1 4.45Å; L445-L452 HydrophobicContact CD1-CD2 4.44Å; K450-L452 PolarHBondContact O-N 3.24Å; L452-W460 HydrophobicContact CD1-CE3 3.95Å; L452-W460 HydrophobicContact CD1-CZ3 4.27Å; L452-W460 HydrophobicContact CD2-CZ3 4.32Å; L452-V462 HydrophobicContact CD1-CG1 4.38Å; L452-V462 HydrophobicContact CD1-CG2 3.63Å
453	P	92.4	Very high	86.8	Confident	38 Å²	38	67.5 Å²	67.5	25%	0.247	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-57.8	153.1	172.1	-28.4	38	0	0	0	112.1	T275 I279 L455 L456 S457	T275-P453 HydrophobicContact CG2-CG 3.42Å; T275-P453 VanDerWaalsContact CG2-CG 3.42Å; I279-P453 HydrophobicContact CD1-CB 3.74Å; I279-P453 HydrophobicContact CD1-CG 3.89Å; P453-L455 VanDerWaalsContact C-N 3.34Å; P453-L455 PolarHBondContact O-N 3.18Å; P453-L456 PolarHBondContact O-N 2.91Å; P453-L456 VanDerWaalsContact O-N 3.09Å; P453-S457 PolarHBondContact O-N 3.25Å
454	P	92.1	Very high	84.7	Confident	112 Å²	112	70.1 Å²	70.1	73%	0.727	35%	0.351	S	S	*	.	H	α-helix	trans	-51	-47.4	-171	-29.5	35.5	0	0	0	114.2	L456 S457 E458	P454-L456 PolarHBondContact O-N 3.45Å; P454-S457 WeakPolarHBondContact O-CB 3.3Å; P454-S457 PolarHBondContact O-N 3.31Å; P454-E458 WeakPolarHBondContact O-CB 3.25Å; P454-E458 PolarHBondContact O-N 3.2Å
455	L	92.1	Very high	84.3	Confident	31 Å²	31	73.2 Å²	73.2	16%	0.162	36%	0.364	C	S	.	.	H	α-helix	trans	-58.4	-46.4	-179.3	177.7	63	0	0	0	112.9	L49 I279 V282 Q283 P453 E458 I459	L49-L455 HydrophobicContact CD1-CD1 3.38Å; I279-L455 HydrophobicContact CB-CD2 4.46Å; I279-L455 HydrophobicContact CG1-CD2 4.44Å; I279-L455 HydrophobicContact CG2-CD2 3.93Å; V282-L455 HydrophobicContact CB-CD2 4.22Å; V282-L455 HydrophobicContact CG1-CD1 4.19Å; V282-L455 HydrophobicContact CG1-CD2 3.8Å; V282-L455 HydrophobicContact CG1-CG 4.06Å; Q283-L455 HydrophobicContact CG-CD2 4.2Å; P453-L455 VanDerWaalsContact C-N 3.34Å; P453-L455 PolarHBondContact O-N 3.18Å; L455-E458 PolarHBondContact O-N 2.92Å; L455-I459 HydrophobicContact CD1-CD1 3.74Å; L455-I459 HydrophobicContact CD1-CG1 4.43Å; L455-I459 HydrophobicContact CG-CD1 4.12Å; L455-I459 WeakPolarHBondContact O-CG1 3.21Å; L455-I459 PolarHBondContact O-N 2.89Å; L455-I459 VanDerWaalsContact O-N 3.1Å
456	L	93.7	Very high	83.9	Confident	1 Å²	1	76.6 Å²	76.6	1%	0.005	38%	0.381	C	S	.	.	H	α-helix	trans	-73.4	-33.9	180	-60.7	-177.1	0	0	0	111.3	T275 A278 I279 V282 P453 P454 E458 W460	T275-L456 HydrophobicContact CG2-CD1 3.38Å; A278-L456 HydrophobicContact CB-CD1 4.02Å; A278-L456 HydrophobicContact CB-CD2 4.34Å; I279-L456 HydrophobicContact CG1-CD1 4.13Å; I279-L456 HydrophobicContact CG1-CD2 4.35Å; I279-L456 HydrophobicContact CG1-CG 3.97Å; V282-L456 HydrophobicContact CG2-CD2 3.75Å; P453-L456 PolarHBondContact O-N 2.91Å; P453-L456 VanDerWaalsContact O-N 3.09Å; P454-L456 PolarHBondContact O-N 3.45Å; L456-E458 VanDerWaalsContact C-N 3.29Å; L456-E458 PolarHBondContact O-N 2.87Å; L456-W460 HydrophobicContact CB-CD2 4.4Å; L456-W460 HydrophobicContact CB-CE3 3.87Å; L456-W460 HydrophobicContact CB-CH2 4.28Å; L456-W460 HydrophobicContact CB-CZ3 3.81Å; L456-W460 HydrophobicContact CD1-CH2 3.82Å; L456-W460 HydrophobicContact CD1-CZ3 3.83Å; L456-W460 HydrophobicContact CD2-CH2 3.88Å; L456-W460 HydrophobicContact CD2-CZ2 3.93Å; L456-W460 HydrophobicContact CD2-CZ3 4.3Å; L456-W460 HydrophobicContact CG-CH2 4.21Å; L456-W460 HydrophobicContact CG-CZ3 4.2Å; L456-W460 WeakPolarHBondContact O-CB 3.5Å; L456-W460 PolarHBondContact O-N 2.69Å
457	S	91.4	Very high	83.7	Confident	16 Å²	16	73.8 Å²	73.8	11%	0.112	38%	0.376	C	S	.	.	H	α-helix	trans	-63.2	-36.1	174.6	-171.7	0	0	0	0	112.5	P453 P454 D461 V462 N463	P453-S457 PolarHBondContact O-N 3.25Å; P454-S457 WeakPolarHBondContact O-CB 3.3Å; P454-S457 PolarHBondContact O-N 3.31Å; S457-D461 PolarHBondContact O-N 2.89Å; S457-V462 PolarHBondContact O-N 2.67Å; S457-V462 VanDerWaalsContact O-N 3.09Å; S457-N463 PolarHBondContact OG-ND2 2.68Å
458	E	91.3	Very high	83.4	Confident	75 Å²	75	69.9 Å²	69.9	35%	0.35	35%	0.354	S	S	.	.	H	α-helix	trans	-75.7	-41.2	178.3	-175.4	-173.4	156.6	0	0	112.3	K308 P454 L455 L456	K308-E458 WeakPolarHBondContact CE-O 3.24Å; K308-E458 PolarHBondContact NZ-O 2.84Å; P454-E458 WeakPolarHBondContact O-CB 3.25Å; P454-E458 PolarHBondContact O-N 3.2Å; L455-E458 PolarHBondContact O-N 2.92Å; L456-E458 VanDerWaalsContact C-N 3.29Å; L456-E458 PolarHBondContact O-N 2.87Å
459	I	89.9	Confident	83.2	Confident	11 Å²	11	68.1 Å²	68.1	6%	0.056	35%	0.348	C	S	.	.	H	α-helix	trans	-75.4	-35.4	-177.5	-71.3	173.3	0	0	0	112.2	L49 V282 T311 L455 D461	L49-I459 HydrophobicContact CD1-CD1 4.31Å; V282-I459 HydrophobicContact CB-CD1 4.4Å; V282-I459 HydrophobicContact CG1-CD1 3.19Å; V282-I459 HydrophobicContact CG2-CD1 4.34Å; T311-I459 HydrophobicContact CG2-CG2 4.09Å; L455-I459 HydrophobicContact CD1-CD1 3.74Å; L455-I459 HydrophobicContact CD1-CG1 4.43Å; L455-I459 HydrophobicContact CG-CD1 4.12Å; L455-I459 WeakPolarHBondContact O-CG1 3.21Å; L455-I459 PolarHBondContact O-N 2.89Å; L455-I459 VanDerWaalsContact O-N 3.1Å; I459-D461 VanDerWaalsContact C-N 3.33Å
460	W	89.7	Confident	83.2	Confident	46 Å²	46	63.7 Å²	63.7	17%	0.174	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	15.3	-179.3	-57	-29.2	0	0	0	113.2	A278 M315 H438 V442 L452 L456 V462	A278-W460 HydrophobicContact CB-CH2 4.43Å; M315-W460 HydrophobicContact SD-CZ2 4.29Å; H438-W460 AromaticContact CE1-CD1 3.63Å; H438-W460 AromaticContact CE1-CD2 3.51Å; H438-W460 AromaticContact CE1-CE2 3.45Å; H438-W460 VanDerWaalsContact CE1-CE2 3.45Å; H438-W460 AromaticContact CE1-CG 3.65Å; H438-W460 AromaticContact CE1-NE1 3.52Å; H438-W460 AromaticContact NE2-CD2 3.82Å; H438-W460 AromaticContact NE2-CE2 3.59Å; H438-W460 AromaticContact NE2-CH2 3.93Å; H438-W460 AromaticContact NE2-CZ2 3.67Å; V442-W460 HydrophobicContact CG1-CB 4.44Å; V442-W460 HydrophobicContact CG2-CB 4.33Å; V442-W460 HydrophobicContact CG2-CD2 4.34Å; V442-W460 HydrophobicContact CG2-CE3 4.03Å; V442-W460 HydrophobicContact CG2-CG 4.49Å; L452-W460 HydrophobicContact CD1-CE3 3.95Å; L452-W460 HydrophobicContact CD1-CZ3 4.27Å; L452-W460 HydrophobicContact CD2-CZ3 4.32Å; L456-W460 HydrophobicContact CB-CD2 4.4Å; L456-W460 HydrophobicContact CB-CE3 3.87Å; L456-W460 HydrophobicContact CB-CH2 4.28Å; L456-W460 HydrophobicContact CB-CZ3 3.81Å; L456-W460 HydrophobicContact CD1-CH2 3.82Å; L456-W460 HydrophobicContact CD1-CZ3 3.83Å; L456-W460 HydrophobicContact CD2-CH2 3.88Å; L456-W460 HydrophobicContact CD2-CZ2 3.93Å; L456-W460 HydrophobicContact CD2-CZ3 4.3Å; L456-W460 HydrophobicContact CG-CH2 4.21Å; L456-W460 HydrophobicContact CG-CZ3 4.2Å; L456-W460 WeakPolarHBondContact O-CB 3.5Å; L456-W460 PolarHBondContact O-N 2.69Å; W460-V462 HydrophobicContact CB-CG2 4.04Å; W460-V462 PolarHBondContact O-N 3.35Å
461	D	80.4	Confident	83.1	Confident	60 Å²	60	65.9 Å²	65.9	32%	0.321	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.4	42.5	174.6	-60.2	-42	0	0	0	113	K308 S457 I459 N463 E464	K308-D461 IonicContact NZ-OD1 3.28Å; K308-D461 PolarHBondContact NZ-OD1 3.23Å; S457-D461 PolarHBondContact O-N 2.89Å; I459-D461 VanDerWaalsContact C-N 3.33Å; D461-N463 PolarHBondContact O-N 2.93Å; D461-N463 VanDerWaalsContact O-N 3.11Å; D461-E464 HydrophobicContact CB-CB 4.4Å; D461-E464 PolarHBondContact O-N 3.29Å
462	V	68.3	Low	82.9	Confident	15 Å²	15	57.2 Å²	57.2	9%	0.091	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-20.8	-171.7	-176.1	0	0	0	0	112.2	V442 R446 L452 S457 W460	V442-V462 HydrophobicContact CG1-CG2 3.74Å; R446-V462 PolarHBondContact NH1-O 3.45Å; R446-V462 VanDerWaalsContact NH1-O 3.11Å; L452-V462 HydrophobicContact CD1-CG1 4.38Å; L452-V462 HydrophobicContact CD1-CG2 3.63Å; S457-V462 PolarHBondContact O-N 2.67Å; S457-V462 VanDerWaalsContact O-N 3.09Å; W460-V462 HydrophobicContact CB-CG2 4.04Å; W460-V462 PolarHBondContact O-N 3.35Å
463	N	58.1	Low	82.3	Confident	130 Å²	130	60.2 Å²	60.2	70%	0.695	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-8.9	-176.3	-60	-40.6	0	0	0	113.9	S457 D461	S457-N463 PolarHBondContact OG-ND2 2.68Å; D461-N463 PolarHBondContact O-N 2.93Å; D461-N463 VanDerWaalsContact O-N 3.11Å
464	E	48.5	Very low	81.4	Confident	187 Å²	187	62.2 Å²	62.2	87%	0.874	32%	0.324	S	S	*	.			trans	-84.2	0	165.5	-62.7	-174.4	169.1	0	0	109.5	R446 D461	R446-E464 PolarHBondContact NH1-OXT 3.43Å; D461-E464 HydrophobicContact CB-CB 4.4Å; D461-E464 PolarHBondContact O-N 3.29Å

Retrieved 464 of 464 residues in 92.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).