A0A087YDE7_POEFO Loading...

Alpha-ketoglutarate-dependent dioxygenase FTO

AlphaFold DB , UniProt , Accession A0A087YDE7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 462 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	36.9	Very low	34.7	Very low	235 Å²	235	146.5 Å²	146.5	100%	1.158	79%	0.786	S	S	*	*				0	115.5	0	-73.4	171.6	171.6	0	0	105.8
2	K	34.3	Very low	34.4	Very low	190 Å²	190	149.9 Å²	149.9	83%	0.826	79%	0.793	S	S	*	*				59.9	129.6	99.4	-84.6	-160.1	168.9	-149.6	0	112.3	E4	K2-E4 IonicContact NZ-OE1 3.66Å
3	A	36.6	Very low	33.9	Very low	70 Å²	70	143.5 Å²	143.5	58%	0.579	78%	0.784	S	S	*	*			cis	-144.7	145.8	17.1	0	0	0	0	0	110
4	E	38.4	Very low	33.7	Very low	168 Å²	168	146.8 Å²	146.8	79%	0.785	79%	0.792	S	S	*	*				65.9	127.5	102.9	-61.6	160.2	-157.5	0	0	113.3	K2	K2-E4 IonicContact NZ-OE1 3.66Å
5	G	33.6	Very low	33.8	Very low	65 Å²	65	144.7 Å²	144.7	67%	0.67	79%	0.786	S	S	*	*			cis	168.1	167.5	-3.1	0	0	0	0	0	111.2
6	E	37.8	Very low	33.7	Very low	201 Å²	201	147.3 Å²	147.3	94%	0.939	79%	0.791	S	S	*	*			trans	60.9	138.7	157.2	-60	-166.8	146.1	0	0	118.8
7	A	32.8	Very low	34.1	Very low	87 Å²	87	143.9 Å²	143.9	72%	0.719	78%	0.782	S	S	*	*			cis	-154.3	163.2	3	0	0	0	0	0	112.5
8	K	34.3	Very low	34.4	Very low	186 Å²	186	145.2 Å²	145.2	81%	0.809	78%	0.779	S	S	*	*			trans	13.4	144.5	136.6	-68.2	-176.6	169.7	-178	0	118.9
9	L	32.7	Very low	34.5	Very low	138 Å²	138	145.8 Å²	145.8	72%	0.723	78%	0.776	S	S	*	*			cis	-169.6	159.6	12.3	-112.1	159.6	0	0	0	108.7
10	V	31.2	Very low	34.7	Very low	119 Å²	119	143.2 Å²	143.2	72%	0.721	77%	0.77	S	S	*	*			trans	67.5	139.2	148.4	159.1	0	0	0	0	118.2
11	E	32.9	Very low	34.7	Very low	153 Å²	153	143.4 Å²	143.4	72%	0.715	77%	0.771	S	S	*	*			cis	-171.2	157.3	-20.4	-159	170.9	-178	0	0	106.7
12	E	30.7	Very low	34.4	Very low	187 Å²	187	139.8 Å²	139.8	87%	0.874	76%	0.756	S	S	*	*			trans	62.4	143.8	172.2	-43.9	-172.1	146.7	0	0	116.4
13	G	28.1	Very low	34.5	Very low	66 Å²	66	135.2 Å²	135.2	68%	0.68	75%	0.748	S	S	*	*			cis	170	140.3	-6.3	0	0	0	0	0	109.5
14	E	31.8	Very low	34.4	Very low	190 Å²	190	141.5 Å²	141.5	89%	0.888	76%	0.762	S	S	*	*			trans	64.1	151	167	-54.3	-172.5	156.3	0	0	118
15	T	34.3	Very low	34	Very low	116 Å²	116	141.1 Å²	141.1	71%	0.712	77%	0.766	S	S	*	*			cis	-163.2	166.9	-27.7	24.9	0	0	0	0	107.6
16	E	32.5	Very low	33.9	Very low	185 Å²	185	143.1 Å²	143.1	86%	0.864	77%	0.77	S	S	*	*			trans	67.8	154.6	165.3	-66.9	-168.1	162.9	0	0	118.9
17	S	41.3	Very low	33.5	Very low	90 Å²	90	142.7 Å²	142.7	63%	0.629	77%	0.767	S	S	*	*			cis	-166.4	174.1	-24.2	59	0	0	0	0	111.1
18	K	38.8	Very low	33.2	Very low	168 Å²	168	142.4 Å²	142.4	73%	0.73	77%	0.773	S	S	*	*			trans	95.7	135.4	144	-92.5	173.7	168.6	-175.9	0	124.9
19	H	36.5	Very low	32.9	Very low	156 Å²	156	137.2 Å²	137.2	72%	0.722	77%	0.772	S	S	*	*			trans	73.1	145.1	152.1	-64.6	-48.9	0	0	0	119.4
20	S	38.3	Very low	32.7	Very low	93 Å²	93	138 Å²	138	65%	0.65	78%	0.778	S	S	*	*			cis	-165.1	154.5	-0.3	40	0	0	0	0	112.9
21	D	34.9	Very low	32.7	Very low	149 Å²	149	137.6 Å²	137.6	80%	0.797	78%	0.78	S	S	*	*			trans	36	135.9	144.3	-47.5	-36.7	0	0	0	123.1
22	D	30.7	Very low	32.4	Very low	158 Å²	158	140.1 Å²	140.1	85%	0.845	79%	0.791	S	S	*	*				-173.6	171.5	91.6	-138.7	-27.6	0	0	0	115
23	S	36.8	Very low	32.3	Very low	94 Å²	94	136.6 Å²	136.6	66%	0.657	79%	0.787	S	S	*	*			trans	-102.6	150.4	-149.6	-41.6	0	0	0	0	117.1
24	K	33.5	Very low	32.4	Very low	202 Å²	202	145.2 Å²	145.2	88%	0.878	80%	0.799	S	S	*	*				155.1	150.4	120.4	-90.4	174.6	176.7	170.5	0	117.2
25	N	30.2	Very low	32.3	Very low	161 Å²	161	145.6 Å²	145.6	86%	0.861	80%	0.801	S	S	*	*			trans	-65.4	174.6	177.1	-43.6	-18.4	0	0	0	112.3
26	S	30.9	Very low	32.1	Very low	107 Å²	107	145.4 Å²	145.4	75%	0.748	80%	0.804	S	S	*	*			cis	-151.9	-176.9	14.2	49.4	0	0	0	0	108.8
27	E	29.5	Very low	31.9	Very low	191 Å²	191	145.4 Å²	145.4	89%	0.893	80%	0.804	S	S	*	*			cis	-137.5	-166.7	15.7	-60.4	172.6	112.1	0	0	111
28	G	28.3	Very low	31.3	Very low	81 Å²	81	150.2 Å²	150.2	84%	0.835	82%	0.817	S	S	*	*			trans	-139.6	165.5	174.6	0	0	0	0	0	111.9
29	G	27.4	Very low	30.6	Very low	77 Å²	77	145.8 Å²	145.8	79%	0.794	82%	0.819	S	S	*	*			trans	-138.5	179.8	-171	0	0	0	0	0	116.4
30	D	27.8	Very low	30.1	Very low	156 Å²	156	146.1 Å²	146.1	83%	0.834	83%	0.826	S	S	*	*			trans	70.2	113	162	-69.9	-21.6	0	0	0	122.4
31	S	32.3	Very low	29.6	Very low	109 Å²	109	148.2 Å²	148.2	76%	0.762	84%	0.835	S	S	*	*				77	95.6	125.4	-59.6	0	0	0	0	119.7
32	E	25.6	Very low	29.2	Very low	206 Å²	206	149 Å²	149	96%	0.963	83%	0.834	S	S	*	*			trans	-75.7	136.4	163.9	-65.2	-179.5	121.4	0	0	112.5
33	S	29.4	Very low	29.1	Very low	113 Å²	113	146.7 Å²	146.7	79%	0.79	83%	0.83	S	S	*	*			trans	-120.2	138.7	171.5	54.3	0	0	0	0	111
34	R	29.8	Very low	28.7	Very low	247 Å²	247	150.6 Å²	150.6	93%	0.932	84%	0.835	S	S	*	*			trans	-55	134.9	-178	-59.3	166.6	174.5	167.1	-4.9	113.4
35	Q	28.8	Very low	28.6	Very low	199 Å²	199	149.8 Å²	149.8	93%	0.93	83%	0.834	S	S	*	*			trans	-137.2	166.5	147.3	-72.8	-162.8	-94.2	0	0	110.7
36	S	30.2	Very low	28.7	Very low	111 Å²	111	147.5 Å²	147.5	78%	0.776	83%	0.831	S	S	*	*			trans	-131.5	128.4	-170.9	51.4	0	0	0	0	109.5
37	E	28.3	Very low	28.8	Very low	185 Å²	185	148.9 Å²	148.9	86%	0.864	83%	0.825	S	S	*	*			trans	-129.8	118.6	166.3	-73.8	166.1	129.6	0	0	104.4
38	E	28.2	Very low	28.9	Very low	192 Å²	192	148 Å²	148	90%	0.897	82%	0.822	S	S	*	*				67.4	129.9	80.3	-66.8	-161.2	173.1	0	0	111.9
39	G	25.7	Very low	29.2	Very low	75 Å²	75	153.9 Å²	153.9	77%	0.773	82%	0.819	S	S	*	*			trans	-107.4	127.5	-158.4	0	0	0	0	0	113.1
40	D	25.8	Very low	29.3	Very low	162 Å²	162	157.1 Å²	157.1	87%	0.866	82%	0.818	S	S	*	*			trans	-78.9	128.6	173.4	-71.7	-49.7	0	0	0	112.2	E42	D40-E42 PolarHBondContact O-N 2.87Å
41	T	27.9	Very low	29.4	Very low	138 Å²	138	156.5 Å²	156.5	85%	0.847	81%	0.813	S	S	*	*			trans	-81.5	92.7	167.4	48.6	0	0	0	0	109.6	S43	T41-S43 PolarHBondContact O-N 2.96Å
42	E	25.7	Very low	29.3	Very low	166 Å²	166	158.6 Å²	158.6	78%	0.776	81%	0.811	S	S	*	*			trans	-74.7	104.9	-177.4	-152.6	179.8	-152.6	0	0	111.9	D40 K44	D40-E42 PolarHBondContact O-N 2.87Å; E42-K44 PolarHBondContact O-N 3.18Å
43	S	28.3	Very low	29.5	Very low	108 Å²	108	153.3 Å²	153.3	76%	0.755	80%	0.796	S	S	*	*			trans	-69	108	168.5	-76.5	0	0	0	0	110.2	T41 H45	T41-S43 PolarHBondContact O-N 2.96Å; S43-H45 PolarHBondContact O-N 3.4Å
44	K	29.7	Very low	29.5	Very low	176 Å²	176	155.2 Å²	155.2	77%	0.765	79%	0.79	S	S	*	*			trans	-75.9	92	-177.3	-66	179.9	179.5	178.6	0	112.2	E42	E42-K44 PolarHBondContact O-N 3.18Å
45	H	31.5	Very low	29.4	Very low	186 Å²	186	151.9 Å²	151.9	86%	0.861	79%	0.785	S	S	*	*			trans	-101.6	110.9	156	-77.3	-71.5	0	0	0	109.4	S43	S43-H45 PolarHBondContact O-N 3.4Å
46	S	30.6	Very low	29.4	Very low	113 Å²	113	147.9 Å²	147.9	79%	0.79	78%	0.779	S	S	*	*			trans	-108.6	82.4	-177.9	-58.1	0	0	0	0	110.6
47	E	34.8	Very low	29.2	Very low	135 Å²	135	151.5 Å²	151.5	63%	0.631	78%	0.784	S	S	*	*			trans	-132.6	101	166.2	-75.7	-163.1	179.6	0	0	111.3	W49	E47-W49 PolarHBondContact O-N 3.03Å; E47-W49 PolarHBondContact OE2-NE1 3.36Å
48	E	29.7	Very low	29.3	Very low	174 Å²	174	151.9 Å²	151.9	81%	0.813	79%	0.786	S	S	*	*			trans	-79.7	102.3	174	-178.2	-173.2	164.4	0	0	109.8
49	W	36.6	Very low	29	Very low	203 Å²	203	146.6 Å²	146.6	77%	0.769	78%	0.782	S	S	*	*			trans	-113.9	63.7	174.4	-69.5	108.3	0	0	0	111.6	E47 I51	E47-W49 PolarHBondContact O-N 3.03Å; E47-W49 PolarHBondContact OE2-NE1 3.36Å; W49-I51 PolarHBondContact O-N 3.35Å
50	D	29.4	Very low	28.9	Very low	146 Å²	146	149.4 Å²	149.4	78%	0.781	79%	0.789	S	S	*	*			trans	-70.6	112.6	172.7	-97.6	-10.7	0	0	0	111.3
51	I	30.1	Very low	29	Very low	143 Å²	143	147.8 Å²	147.8	73%	0.733	79%	0.79	S	S	*	*			trans	-108.6	87.6	169.9	-56.4	-179.8	0	0	0	109	W49 S53	W49-I51 PolarHBondContact O-N 3.35Å; I51-S53 PolarHBondContact O-N 3.02Å
52	E	29	Very low	28.9	Very low	152 Å²	152	144.9 Å²	144.9	71%	0.71	79%	0.788	S	S	*	*			trans	-65	95.6	163.7	-94.9	-157.3	133.8	0	0	110.1	K54	E52-K54 PolarHBondContact O-N 3.34Å; E52-K54 VanDerWaalsContact O-N 3.08Å; E52-K54 WeakPolarHBondContact OE1-CE 3.2Å; E52-K54 IonicContact OE1-NZ 3.91Å; E52-K54 PolarHBondContact OE1-NZ 2.69Å; E52-K54 IonicContact OE2-NZ 2.69Å; E52-K54 PolarHBondContact OE2-NZ 3.44Å
53	S	29.8	Very low	28.8	Very low	95 Å²	95	142.6 Å²	142.6	66%	0.664	79%	0.79	S	S	*	*			trans	-76.5	92.1	170.4	-68.2	0	0	0	0	110.6	I51	I51-S53 PolarHBondContact O-N 3.02Å
54	K	29.5	Very low	28.8	Very low	153 Å²	153	145.9 Å²	145.9	67%	0.665	79%	0.791	S	S	*	*			trans	-90.9	107.4	170.1	-80.3	172.6	178.7	144.3	0	110.6	E52	E52-K54 PolarHBondContact O-N 3.34Å; E52-K54 VanDerWaalsContact O-N 3.08Å; E52-K54 WeakPolarHBondContact OE1-CE 3.2Å; E52-K54 IonicContact OE1-NZ 3.91Å; E52-K54 PolarHBondContact OE1-NZ 2.69Å; E52-K54 IonicContact OE2-NZ 2.69Å; E52-K54 PolarHBondContact OE2-NZ 3.44Å
55	H	27.2	Very low	28.5	Very low	178 Å²	178	145.3 Å²	145.3	82%	0.824	79%	0.791	S	S	*	*			trans	-61.7	131	169.9	-67.6	-91.4	0	0	0	111
56	S	29.4	Very low	28.2	Very low	114 Å²	114	145.6 Å²	145.6	80%	0.797	79%	0.792	S	S	*	*			trans	-137.2	97	159.2	60.9	0	0	0	0	109.2	E58	S56-E58 PolarHBondContact O-N 2.86Å
57	E	26.8	Very low	28	Very low	188 Å²	188	144.4 Å²	144.4	88%	0.879	79%	0.79	S	S	*	*			trans	-73.3	110.7	169.5	-62.6	-174.2	148.5	0	0	109.9
58	E	28.7	Very low	27.3	Very low	193 Å²	193	141.5 Å²	141.5	90%	0.902	80%	0.796	S	S	*	*			trans	-133.3	109.7	151.1	-77	-159.5	147.9	0	0	108.8	S56	S56-E58 PolarHBondContact O-N 2.86Å
59	G	23.2	Very low	27.2	Very low	80 Å²	80	144.6 Å²	144.6	83%	0.825	80%	0.8	S	S	*	*			trans	-81.6	145.5	-178.9	0	0	0	0	0	112.3
60	C	24.3	Very low	26.4	Very low	134 Å²	134	143.2 Å²	143.2	91%	0.905	80%	0.802	S	S	*	*			trans	-138.5	119.4	160.3	-120.9	0	0	0	0	110.6
61	S	25.9	Very low	26.2	Very low	128 Å²	128	141.9 Å²	141.9	90%	0.895	80%	0.799	S	S	*	*			trans	-72.1	129.7	-177	53.7	0	0	0	0	112.4
62	G	26.6	Very low	25.9	Very low	78 Å²	78	143.6 Å²	143.6	80%	0.804	80%	0.804	S	S	*	*			trans	-148.2	84.6	176.6	0	0	0	0	0	112.6
63	S	24.7	Very low	25.6	Very low	117 Å²	117	145.7 Å²	145.7	82%	0.818	81%	0.814	S	S	*	*			trans	-70.2	132.6	177	56.2	0	0	0	0	112.8
64	K	26.9	Very low	25.4	Very low	178 Å²	178	145 Å²	145	77%	0.774	82%	0.821	S	S	*	*				-175.3	132.2	127.8	-107.9	179.1	175.9	-172.7	0	116.6
65	Q	25	Very low	25.1	Very low	163 Å²	163	146.8 Å²	146.8	76%	0.762	83%	0.832	S	S	*	*			trans	62.3	113.2	142.1	-73.5	178.8	-100.9	0	0	121.3
66	E	24.1	Very low	25	Very low	192 Å²	192	142.4 Å²	142.4	90%	0.897	82%	0.822	S	S	*	*			trans	-52.1	148.3	150.2	-54.2	166.2	136	0	0	112.6
67	A	25.6	Very low	24.9	Very low	89 Å²	89	142.9 Å²	142.9	74%	0.736	83%	0.825	S	S	*	*			trans	-151.4	99.3	151.8	0	0	0	0	0	108.4
68	G	21.9	Very low	24.8	Very low	73 Å²	73	142.6 Å²	142.6	75%	0.753	82%	0.824	S	S	*	*			trans	-82.4	150.7	173.5	0	0	0	0	0	112
69	W	25.6	Very low	24.6	Very low	240 Å²	240	140.3 Å²	140.3	91%	0.909	82%	0.823	S	S	*	*			trans	-144.2	98.3	168.2	-72.1	102.8	0	0	0	110.5
70	E	21.2	Very low	24.8	Very low	173 Å²	173	145.9 Å²	145.9	81%	0.808	82%	0.824	S	S	*	*			trans	-95.8	164.1	141.4	-52.8	-176.6	157.7	0	0	106
71	T	24.2	Very low	25.3	Very low	118 Å²	118	145.2 Å²	145.2	72%	0.724	82%	0.818	S	S	*	*			cis	-156.1	-164.1	15.7	-27.2	0	0	0	0	109.3
72	E	23.9	Very low	25.2	Very low	179 Å²	179	144.6 Å²	144.6	84%	0.836	81%	0.814	S	S	*	*			trans	85.7	102	172	-53.9	-165.2	168.3	0	0	115.2
73	E	23.9	Very low	25.1	Very low	197 Å²	197	150.4 Å²	150.4	92%	0.921	82%	0.82	S	S	*	*				72.5	126.6	63.2	-66.3	-150	155.5	0	0	114.7
74	G	25.2	Very low	25.1	Very low	79 Å²	79	148.6 Å²	148.6	81%	0.814	82%	0.82	S	S	*	*			trans	-176.8	61.1	-170.1	0	0	0	0	0	113.3
75	E	23.6	Very low	25	Very low	191 Å²	191	145.5 Å²	145.5	89%	0.893	82%	0.821	S	S	*	*			trans	-52.1	158.9	155.2	-83.5	-164.4	115.1	0	0	111
76	S	24.5	Very low	25	Very low	86 Å²	86	148.3 Å²	148.3	60%	0.601	83%	0.831	S	S	*	*			cis	-170.5	158.6	-2.4	158	0	0	0	0	107
77	S	27.3	Very low	25	Very low	125 Å²	125	143.9 Å²	143.9	87%	0.874	83%	0.827	S	S	*	*			trans	-165.7	116.1	144	-86.3	0	0	0	0	112.7
78	Q	24.9	Very low	24.9	Very low	181 Å²	181	142.9 Å²	142.9	85%	0.846	83%	0.826	S	S	*	*			trans	-73.7	147.1	170.5	-61.9	169.2	-25.6	0	0	111.8
79	V	24.9	Very low	25	Very low	146 Å²	146	146.4 Å²	146.4	89%	0.885	83%	0.832	S	S	*	*			trans	-135.9	130.6	143.6	-176.4	0	0	0	0	108.7
80	K	26.5	Very low	25	Very low	196 Å²	196	139.1 Å²	139.1	85%	0.852	82%	0.818	S	S	*	*			trans	-127.4	172.2	173.7	-113.9	-161.7	174.8	178.4	0	109.3
81	P	36.1	Very low	25.3	Very low	121 Å²	121	138.8 Å²	138.8	79%	0.786	82%	0.816	S	S	*	*				-99	174.3	-126.2	39.9	-39	0	0	0	114.6
82	S	22.8	Very low	25.4	Very low	115 Å²	115	141.7 Å²	141.7	80%	0.804	82%	0.821	S	S	*	*			trans	-123	123.6	165.9	58.4	0	0	0	0	111.2
83	E	25	Very low	25.5	Very low	200 Å²	200	138.9 Å²	138.9	94%	0.935	82%	0.822	S	S	*	*			trans	-74.9	157.7	169.3	-62.3	179.2	131.9	0	0	111.6
84	G	24.4	Very low	25.6	Very low	79 Å²	79	138.9 Å²	138.9	81%	0.814	82%	0.821	S	S	*	*			trans	-177.8	79.9	177.7	0	0	0	0	0	113.5
85	S	24.2	Very low	25.7	Very low	112 Å²	112	138.9 Å²	138.9	78%	0.783	82%	0.822	S	S	*	*			trans	-77.8	135.1	177.7	-45.1	0	0	0	0	112.3
86	F	25.1	Very low	25.8	Very low	222 Å²	222	139.6 Å²	139.6	97%	0.974	82%	0.822	S	S	*	*			trans	-166	158.8	140.3	-107.7	-70.5	0	0	0	110.6
87	A	24.9	Very low	25.9	Very low	100 Å²	100	141.1 Å²	141.1	83%	0.826	83%	0.831	S	S	*	*			trans	-109	157.7	-163	0	0	0	0	0	114.6
88	G	23.2	Very low	26	Very low	68 Å²	68	141.5 Å²	141.5	70%	0.701	83%	0.831	S	S	*	*			trans	124.8	113.7	139.1	0	0	0	0	0	119.7
89	V	24.5	Very low	26	Very low	146 Å²	146	136.3 Å²	136.3	89%	0.885	83%	0.826	S	S	*	*			trans	80.8	121.7	130.4	178.2	0	0	0	0	121.2
90	S	25.6	Very low	26.1	Very low	88 Å²	88	141.8 Å²	141.8	62%	0.615	83%	0.831	S	S	*	*			trans	85.6	126.9	147.7	-116.1	0	0	0	0	124.8
91	E	27.1	Very low	26	Very low	165 Å²	165	138.4 Å²	138.4	77%	0.771	83%	0.827	S	S	*	*			trans	75.2	120.1	133	-77.9	163.3	138.5	0	0	124
92	H	25.3	Very low	25.5	Very low	179 Å²	179	139.4 Å²	139.4	83%	0.829	83%	0.831	S	S	*	*			trans	23.8	122.7	142	-69.8	-74.6	0	0	0	120.9
93	S	26.1	Very low	25.7	Very low	121 Å²	121	142.1 Å²	142.1	85%	0.846	83%	0.831	S	S	*	*			trans	-148.2	134.9	132.7	48.2	0	0	0	0	111.7
94	E	27.6	Very low	25.6	Very low	196 Å²	196	137.4 Å²	137.4	92%	0.916	83%	0.826	S	S	*	*			trans	-83.1	125.2	176.7	-64.1	177.8	123.1	0	0	110.8
95	G	26.5	Very low	25.6	Very low	80 Å²	80	143.3 Å²	143.3	83%	0.825	83%	0.83	S	S	*	*			trans	-91.5	105	175.5	0	0	0	0	0	112.3
96	K	26	Very low	25.7	Very low	206 Å²	206	143.6 Å²	143.6	90%	0.896	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-86.4	129.3	-174.7	-148	170.8	-170.5	170.6	0	111.9
97	C	25.6	Very low	25.7	Very low	117 Å²	117	136.4 Å²	136.4	79%	0.791	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-81.1	147.9	168.2	-68.2	0	0	0	0	111.2
98	P	30.2	Very low	25.7	Very low	134 Å²	134	138.4 Å²	138.4	87%	0.87	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-80.4	124.2	-177.4	31.4	-33.1	0	0	0	112
99	G	25.5	Very low	26	Very low	72 Å²	72	142.6 Å²	142.6	74%	0.742	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-90.2	139	172.6	0	0	0	0	0	112.2
100	W	25.3	Very low	26.2	Very low	261 Å²	261	141.8 Å²	141.8	99%	0.989	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-70.9	136.8	173.7	-130.8	-46	0	0	0	110.6
101	T	24.8	Very low	26.2	Very low	124 Å²	124	144.6 Å²	144.6	76%	0.761	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-84.4	149.9	176.9	41	0	0	0	0	112.4
102	T	26.6	Very low	27.2	Very low	143 Å²	143	141.7 Å²	141.7	88%	0.877	82%	0.818	S	S	*	*			trans	-142.8	124.7	159.4	-53.3	0	0	0	0	108
103	E	26.4	Very low	27.1	Very low	172 Å²	172	140.6 Å²	140.6	80%	0.804	82%	0.823	S	S	*	*			trans	-78.7	149.1	-175.7	-63.8	-173.8	140.2	0	0	112.1
104	A	23.6	Very low	27.1	Very low	101 Å²	101	137.7 Å²	137.7	84%	0.835	81%	0.812	S	S	*	*			trans	-104.3	130.7	174.2	0	0	0	0	0	110.9
105	F	24.2	Very low	27	Very low	203 Å²	203	136.7 Å²	136.7	89%	0.89	81%	0.812	S	S	*	*			trans	-105.7	149.8	167.2	-103.6	-89.1	0	0	0	111
106	S	26.7	Very low	26.8	Very low	118 Å²	118	141.9 Å²	141.9	83%	0.825	82%	0.815	S	S	*	*			trans	-124.5	153.2	-161.2	57.5	0	0	0	0	115
107	G	24.5	Very low	26.9	Very low	71 Å²	71	136.5 Å²	136.5	73%	0.732	81%	0.809	S	S	*	*			trans	103.2	143	169.7	0	0	0	0	0	114.5
108	T	25	Very low	26.9	Very low	142 Å²	142	140.5 Å²	140.5	87%	0.871	82%	0.816	S	S	*	*			cis	-156.1	154.5	10.7	-53.6	0	0	0	0	111.2
109	K	29.4	Very low	26.7	Very low	156 Å²	156	142.7 Å²	142.7	68%	0.678	82%	0.815	S	S	*	*			trans	-63.2	159	172	-97.2	-167.8	174	-172.3	0	113.4	E111	K109-E111 IonicContact NZ-OE1 3.7Å; K109-E111 PolarHBondContact NZ-OE1 3.4Å
110	P	27.4	Very low	27	Very low	128 Å²	128	148.4 Å²	148.4	83%	0.831	82%	0.819	S	S	*	*				-133.3	178.2	109	37.2	-27.4	0	0	0	114.4
111	E	26.6	Very low	27.4	Very low	148 Å²	148	141.7 Å²	141.7	69%	0.692	81%	0.809	S	S	*	*			trans	-134.6	-175.4	-170.4	-131.9	-169.3	-112.7	0	0	111.1	K109	K109-E111 IonicContact NZ-OE1 3.7Å; K109-E111 PolarHBondContact NZ-OE1 3.4Å
112	P	48.6	Very low	28	Very low	104 Å²	104	142.8 Å²	142.8	68%	0.675	82%	0.815	S	S	*	*				-128	166.5	-114	42.3	-25.6	0	0	0	116.7
113	V	23.7	Very low	28.1	Very low	155 Å²	155	139.9 Å²	139.9	94%	0.939	81%	0.806	S	S	*	*			trans	-154.7	136.5	158.5	-169.9	0	0	0	0	107.6
114	G	24.3	Very low	28.1	Very low	60 Å²	60	140.5 Å²	140.5	62%	0.619	81%	0.809	S	S	*	*			cis	163.4	136.9	-10.7	0	0	0	0	0	111.3
115	L	25.3	Very low	28.3	Very low	175 Å²	175	143.9 Å²	143.9	92%	0.916	81%	0.812	S	S	*	*			trans	61.8	143.2	164.4	-56	167.4	0	0	0	116.5
116	E	23.7	Very low	28.7	Very low	190 Å²	190	143.1 Å²	143.1	89%	0.888	81%	0.808	S	S	*	*			cis	-146.9	167	30	-138	166.9	-148.8	0	0	111.6
117	A	27.8	Very low	28.8	Very low	92 Å²	92	145.9 Å²	145.9	76%	0.76	81%	0.808	S	S	*	*			trans	-114.4	154.8	-172.7	0	0	0	0	0	113.2
118	Q	24.4	Very low	28.8	Very low	201 Å²	201	147.1 Å²	147.1	94%	0.939	81%	0.805	S	S	*	*			trans	-153.5	109.1	151.1	-115.8	178.3	41.2	0	0	112.7
119	E	27.3	Very low	28.9	Very low	180 Å²	180	148.1 Å²	148.1	84%	0.841	80%	0.804	S	S	*	*			trans	-97.6	149.9	155.9	-65.9	-176.4	134.9	0	0	109.5
120	K	30.7	Very low	28.8	Very low	193 Å²	193	145 Å²	145	84%	0.839	80%	0.802	S	S	*	*			trans	157.1	165.2	139.6	-87.8	179	179.2	180	0	111.8
121	P	34.4	Very low	28.8	Very low	120 Å²	120	145.4 Å²	145.4	78%	0.779	80%	0.797	S	S	*	*				-135.5	-169.3	-87	33.6	-8.9	0	0	0	113.7
122	V	36.6	Very low	28.8	Very low	146 Å²	146	149.9 Å²	149.9	89%	0.885	81%	0.81	S	S	*	*			trans	-53.9	127.6	174	178.1	0	0	0	0	113.8
123	A	28.5	Very low	27.8	Very low	83 Å²	83	152.6 Å²	152.6	69%	0.686	81%	0.813	S	S	*	*			trans	-178.2	160.8	133.7	0	0	0	0	0	113
124	Q	27.2	Very low	28.2	Very low	184 Å²	184	152.1 Å²	152.1	86%	0.86	80%	0.804	S	S	*	*			trans	76.8	88	164.5	-54.9	-175.8	-0.1	0	0	119.1
125	L	28.8	Very low	28.5	Very low	173 Å²	173	156.8 Å²	156.8	91%	0.906	81%	0.809	S	S	*	*				-156.5	102.2	123.6	-109.1	143.3	0	0	0	109.7
126	K	31.1	Very low	28.6	Very low	186 Å²	186	155.7 Å²	155.7	81%	0.809	80%	0.804	S	S	*	*			trans	-118.4	157.4	166.6	-86.7	-169.9	173.1	-173.7	0	107.8
127	H	28.5	Very low	28.8	Very low	177 Å²	177	155.9 Å²	155.9	82%	0.819	80%	0.797	S	S	*	*			trans	70.9	136.7	-170	-44.9	-77.5	0	0	0	112.3
128	S	25.7	Very low	29	Very low	97 Å²	97	159.6 Å²	159.6	68%	0.678	80%	0.798	S	S	*	*			cis	-147.7	147.3	-1.6	-157.2	0	0	0	0	105.9
129	L	27.5	Very low	29.2	Very low	162 Å²	162	156.4 Å²	156.4	85%	0.848	78%	0.784	S	S	*	*				-162.4	136.7	69.8	-82	158.3	0	0	0	110.1
130	S	26.3	Very low	29.3	Very low	91 Å²	91	156.2 Å²	156.2	64%	0.636	78%	0.782	S	S	*	*			trans	-78.9	160.3	156.3	55.2	0	0	0	0	110.1
131	D	27.6	Very low	29.2	Very low	136 Å²	136	151.8 Å²	151.8	73%	0.727	78%	0.782	S	S	*	*			trans	147.5	78.1	133.7	-73.2	-0.2	0	0	0	111.8
132	Y	27.1	Very low	28.9	Very low	242 Å²	242	150.1 Å²	150.1	95%	0.949	79%	0.787	S	S	*	*			trans	-153	101.7	142.4	-84.3	-64.8	0	0	0	107.9
133	H	27.1	Very low	28.5	Very low	162 Å²	162	146.6 Å²	146.6	75%	0.75	78%	0.78	S	S	*	*			trans	-110.2	105.2	176	-173	53	0	0	0	108
134	I	33.2	Very low	28.7	Very low	144 Å²	144	151.4 Å²	151.4	74%	0.738	79%	0.793	S	S	*	*			trans	-91.7	125.3	165.9	-62.4	177.9	0	0	0	106.2	D136	I134-D136 PolarHBondContact O-N 3.2Å
135	Q	28.9	Very low	29.5	Very low	159 Å²	159	146.5 Å²	146.5	74%	0.743	79%	0.791	S	S	*	*			trans	-85.6	103.7	175.2	-74.8	-179.8	-44.1	0	0	109.1	R137	Q135-R137 PolarHBondContact O-N 3.05Å
136	D	28.3	Very low	29.6	Very low	151 Å²	151	144.1 Å²	144.1	81%	0.807	79%	0.788	S	S	*	*			trans	-75.6	121.7	160.7	-73.1	-38.1	0	0	0	109	I134	I134-D136 PolarHBondContact O-N 3.2Å
137	R	27.2	Very low	30.1	Very low	194 Å²	194	140.7 Å²	140.7	73%	0.732	79%	0.787	S	S	*	*			trans	-101.9	91.5	-170.9	-176.7	176.8	179.4	-106.7	-13.5	108.2	Q135 E139	Q135-R137 PolarHBondContact O-N 3.05Å; R137-E139 IonicContact CZ-OE1 3.78Å; R137-E139 VanDerWaalsContact NH1-CD 3.35Å; R137-E139 IonicContact NH1-OE1 2.72Å; R137-E139 PolarHBondContact NH1-OE1 3.18Å; R137-E139 IonicContact NH1-OE2 3.68Å; R137-E139 IonicContact NH2-OE1 3.5Å; R137-E139 PolarHBondContact NH2-OE1 3.05Å; R137-E139 PolarHBondContact O-N 3.09Å
138	E	32	Very low	30.2	Very low	170 Å²	170	141.3 Å²	141.3	79%	0.794	79%	0.79	S	S	*	*			trans	-64.9	93.5	173.1	-71.8	-173.6	156.3	0	0	110.7	H140	E138-H140 PolarHBondContact O-N 3.15Å
139	E	29	Very low	30.9	Very low	134 Å²	134	142.8 Å²	142.8	63%	0.626	80%	0.796	S	S	*	*			trans	-78.2	106.6	162.9	-75.4	-171.1	154.6	0	0	109.1	R137 A141	R137-E139 IonicContact CZ-OE1 3.78Å; R137-E139 VanDerWaalsContact NH1-CD 3.35Å; R137-E139 IonicContact NH1-OE1 2.72Å; R137-E139 PolarHBondContact NH1-OE1 3.18Å; R137-E139 IonicContact NH1-OE2 3.68Å; R137-E139 IonicContact NH2-OE1 3.5Å; R137-E139 PolarHBondContact NH2-OE1 3.05Å; R137-E139 PolarHBondContact O-N 3.09Å; E139-A141 PolarHBondContact O-N 3.14Å
140	H	30.2	Very low	31.7	Very low	176 Å²	176	140 Å²	140	82%	0.815	79%	0.79	S	S	*	*			trans	-65.6	110.8	168.6	-74.3	20.7	0	0	0	110.2	E138	E138-H140 PolarHBondContact O-N 3.15Å
141	A	28.1	Very low	33	Very low	100 Å²	100	141.1 Å²	141.1	83%	0.826	80%	0.795	S	S	*	*			trans	-116.4	113	160.9	0	0	0	0	0	108.2	E139	E139-A141 PolarHBondContact O-N 3.14Å
142	G	27.7	Very low	34.5	Very low	86 Å²	86	139.1 Å²	139.1	89%	0.887	79%	0.789	S	S	*	*			trans	-89.2	149.8	179.4	0	0	0	0	0	112.2
143	G	28.3	Very low	36.3	Very low	71 Å²	71	133.1 Å²	133.1	73%	0.732	77%	0.77	S	S	*	*			trans	160.5	127.9	169.1	0	0	0	0	0	113.4
144	L	33.1	Very low	38.5	Very low	185 Å²	185	128.5 Å²	128.5	97%	0.969	75%	0.753	S	S	*	*			trans	73.8	131.5	165.9	-56.8	166.2	0	0	0	116.6
145	G	43.1	Very low	40.3	Very low	80 Å²	80	123.6 Å²	123.6	83%	0.825	73%	0.731	S	S	*	*			trans	-91.8	134.1	-178.2	0	0	0	0	0	111.3
146	C	31.7	Very low	42	Very low	123 Å²	123	122.4 Å²	122.4	83%	0.831	74%	0.735	S	S	*	*			trans	-127.6	150.9	158.2	-72	0	0	0	0	107.3	Q148	C146-Q148 PolarHBondContact O-N 3.43Å
147	S	41.3	Very low	44	Very low	114 Å²	114	117.4 Å²	117.4	80%	0.797	72%	0.719	S	S	*	*			trans	-47.9	125.3	179	-52.8	0	0	0	0	110.6	T149	S147-T149 VanDerWaalsContact C-N 3.3Å; S147-T149 PolarHBondContact O-N 3.29Å
148	Q	31.9	Very low	46.1	Very low	190 Å²	190	113.3 Å²	113.3	89%	0.888	72%	0.718	S	S	*	*			trans	-68	91.4	176.7	-71.9	-172.7	-3.7	0	0	109.4	C146 S150	C146-Q148 PolarHBondContact O-N 3.43Å; Q148-S150 PolarHBondContact O-N 3.42Å; Q148-S150 VanDerWaalsContact O-N 3.12Å
149	T	38.5	Very low	48.6	Very low	129 Å²	129	108.8 Å²	108.8	79%	0.791	70%	0.701	S	S	*	*			trans	-58.5	114.1	159.2	50.4	0	0	0	0	106.9	S147	S147-T149 VanDerWaalsContact C-N 3.3Å; S147-T149 PolarHBondContact O-N 3.29Å
150	S	46.1	Very low	51.6	Low	104 Å²	104	110 Å²	110	73%	0.727	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-50.2	138.4	172.7	-62.9	0	0	0	0	109.3	Q148	Q148-S150 PolarHBondContact O-N 3.42Å; Q148-S150 VanDerWaalsContact O-N 3.12Å
151	P	53.3	Low	54.8	Low	113 Å²	113	105.4 Å²	105.4	73%	0.734	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-55.4	143.9	176.3	24.1	-33.7	0	0	0	109.5	Q153	P151-Q153 PolarHBondContact O-N 3.49Å
152	P	59	Low	58	Low	94 Å²	94	104.1 Å²	104.1	61%	0.61	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-52.3	131.6	-173.5	20.5	-33	0	0	0	110.1	V154	P152-V154 WeakPolarHBondContact O-CG2 3.32Å; P152-V154 PolarHBondContact O-N 3.3Å
153	Q	64.5	Low	61.4	Low	116 Å²	116	103.6 Å²	103.6	54%	0.542	64%	0.641	S	S	.	*			trans	-68.8	110	-172.3	-169.1	169.8	-4.9	0	0	109.1	P151 I199 T200	P151-Q153 PolarHBondContact O-N 3.49Å; Q153-I199 HydrophobicContact CB-CD1 3.9Å; Q153-I199 HydrophobicContact CG-CD1 4.02Å; Q153-I199 VanDerWaalsContact O-CG2 3.29Å; Q153-I199 WeakPolarHBondContact O-CG2 3.48Å; Q153-T200 WeakPolarHBondContact O-CB 3.42Å; Q153-T200 PolarHBondContact O-N 3.27Å
154	V	72.9	Confident	64.7	Low	66 Å²	66	102.7 Å²	102.7	40%	0.4	62%	0.621	S	S	.	*	B	Isolated β-bridge	trans	-90.3	132.9	179.1	-175.4	0	0	0	0	110	P152 T156 T200	P152-V154 WeakPolarHBondContact O-CG2 3.32Å; P152-V154 PolarHBondContact O-N 3.3Å; V154-T156 HydrophobicContact CB-CG2 4.2Å; V154-T156 HydrophobicContact CG1-CG2 3.98Å; V154-T156 PolarHBondContact O-N 2.97Å; V154-T156 PolarHBondContact O-OG1 2.74Å; V154-T200 HydrophobicContact CG2-CG2 4.41Å
155	C	71.9	Confident	67.8	Low	40 Å²	40	98 Å²	98	27%	0.27	60%	0.597	S	S	.	*			trans	-69.9	85.9	177.4	-168.9	0	0	0	0	112.1	I199 T200	C155-I199 HydrophobicContact CB-CG2 4.05Å; C155-T200 PolarHBondContact N-O 3.49Å
156	T	64.8	Low	70.4	Confident	134 Å²	134	100 Å²	100	82%	0.822	59%	0.588	S	S	*	*			trans	-103.5	13.4	-175.9	49.8	0	0	0	0	114.4	V154	V154-T156 HydrophobicContact CB-CG2 4.2Å; V154-T156 HydrophobicContact CG1-CG2 3.98Å; V154-T156 PolarHBondContact O-N 2.97Å; V154-T156 PolarHBondContact O-OG1 2.74Å
157	G	68.4	Low	73.6	Confident	46 Å²	46	97.2 Å²	97.2	47%	0.474	57%	0.565	S	S	.	*	S	Bend	trans	-141.2	-171.2	-173.2	0	0	0	0	0	114.2	V159	G157-V159 PolarHBondContact O-N 3.2Å
158	P	72.4	Confident	76.3	Confident	109 Å²	109	97.5 Å²	97.5	71%	0.708	55%	0.549	S	S	*	.	S	Bend	trans	-61.1	135.7	176.5	26.4	-34.3	0	0	0	110.8	K160	P158-K160 PolarHBondContact O-N 3.09Å
159	V	85	Confident	79.4	Confident	74 Å²	74	89.2 Å²	89.2	45%	0.448	51%	0.51	S	S	.	.			trans	-61.5	126.1	-176.5	-176	0	0	0	0	110.5	G157 F161 P203 V282	G157-V159 PolarHBondContact O-N 3.2Å; V159-F161 HydrophobicContact CG1-CD1 4.25Å; V159-F161 HydrophobicContact CG1-CD2 4.07Å; V159-F161 HydrophobicContact CG1-CE1 3.9Å; V159-F161 HydrophobicContact CG1-CE2 3.7Å; V159-F161 HydrophobicContact CG1-CG 4.33Å; V159-F161 HydrophobicContact CG1-CZ 3.61Å; V159-P203 HydrophobicContact CB-CG 4.27Å; V159-P203 HydrophobicContact CG1-CG 3.51Å; V159-P203 HydrophobicContact CG2-CG 3.67Å; V159-V282 HydrophobicContact CG1-CG2 4.34Å
160	K	91.5	Very high	82.1	Confident	159 Å²	159	84.5 Å²	84.5	69%	0.691	48%	0.481	S	S	*	.			trans	-126.3	85.1	177.7	-68.9	176.9	-175.7	178.3	0	109.4	P158 N162	P158-K160 PolarHBondContact O-N 3.09Å; K160-N162 PolarHBondContact O-N 3.02Å
161	F	96.5	Very high	84.3	Confident	80 Å²	80	80.5 Å²	80.5	35%	0.351	45%	0.452	S	S	.	.			trans	-58.8	123.3	170	-60.1	-65.6	0	0	0	109.2	V159 P203 A205 H280 R281 V282	V159-F161 HydrophobicContact CG1-CD1 4.25Å; V159-F161 HydrophobicContact CG1-CD2 4.07Å; V159-F161 HydrophobicContact CG1-CE1 3.9Å; V159-F161 HydrophobicContact CG1-CE2 3.7Å; V159-F161 HydrophobicContact CG1-CG 4.33Å; V159-F161 HydrophobicContact CG1-CZ 3.61Å; F161-P203 HydrophobicContact CE1-CG 4.37Å; F161-P203 WeakPolarHBondContact CE1-O 3.32Å; F161-P203 HydrophobicContact CZ-CG 4.34Å; F161-A205 HydrophobicContact CE1-CB 4.13Å; F161-A205 HydrophobicContact CE2-CB 4.03Å; F161-A205 HydrophobicContact CZ-CB 3.5Å; F161-A205 VanDerWaalsContact CZ-CB 3.5Å; F161-H280 HydrophobicContact CB-CB 4.2Å; F161-H280 HydrophobicContact CD1-CB 3.77Å; F161-H280 HydrophobicContact CD2-CB 4.17Å; F161-H280 HydrophobicContact CE1-CB 4.12Å; F161-H280 WeakPolarHBondContact CE1-O 3.45Å; F161-H280 HydrophobicContact CG-CB 3.79Å; F161-H280 HydrophobicContact CZ-CB 4.49Å; F161-R281 VanDerWaalsContact CA-O 3.31Å; F161-R281 WeakPolarHBondContact CA-O 3.35Å; F161-V282 HydrophobicContact CD1-CG2 4Å; F161-V282 HydrophobicContact CE1-CG2 4.41Å
162	N	96.6	Very high	86.2	Confident	74 Å²	74	79.1 Å²	79.1	40%	0.396	45%	0.45	S	S	.	.			trans	-103.6	-21.3	-178.2	57.8	-0.3	0	0	0	112.2	K160 R281 V282 A283	K160-N162 PolarHBondContact O-N 3.02Å; N162-R281 PolarHBondContact N-O 3.1Å; N162-R281 VanDerWaalsContact N-O 3.11Å; N162-R281 PolarHBondContact OD1-O 3.07Å; N162-R281 VanDerWaalsContact OD1-O 3.1Å; N162-V282 WeakPolarHBondContact OD1-CA 3.42Å; N162-A283 PolarHBondContact ND2-O 3.18Å; N162-A283 PolarHBondContact OD1-N 2.78Å
163	V	97.9	Very high	87.8	Confident	74 Å²	74	82 Å²	82	45%	0.448	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	163	175.6	-58.6	0	0	0	0	111.4	R281 A283	V163-R281 HydrophobicContact CG2-CB 3.95Å; V163-R281 PolarHBondContact O-N 3.48Å; V163-A283 HydrophobicContact CG2-CB 3.99Å
164	T	98.4	Very high	89	Confident	52 Å²	52	81.3 Å²	81.3	32%	0.319	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	136.2	160.2	176.5	0	0	0	0	109.4	L166 S278 T279	T164-L166 HydrophobicContact CG2-CD1 3.8Å; T164-S278 PolarHBondContact OG1-OG 3.06Å; T164-T279 VanDerWaalsContact CA-O 3.31Å; T164-T279 WeakPolarHBondContact CA-O 3.47Å; T164-T279 PolarHBondContact OG1-N 2.83Å; T164-T279 PolarHBondContact OG1-O 3.01Å
165	L	98.3	Very high	89.6	Confident	87 Å²	87	81.7 Å²	81.7	46%	0.455	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	114.7	168.9	-179.5	59.8	0	0	0	108	T279	L165-T279 PolarHBondContact N-O 2.76Å; L165-T279 WeakPolarHBondContact O-CB 3.49Å; L165-T279 PolarHBondContact O-N 3.32Å
166	L	98	Very high	90.6	Very high	123 Å²	123	88.5 Å²	88.5	64%	0.644	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	126.9	174.4	-71	87.8	0	0	0	109.4	T164 S277	T164-L166 HydrophobicContact CG2-CD1 3.8Å; L166-S277 WeakPolarHBondContact CA-O 3.14Å
167	N	98.1	Very high	92	Very high	64 Å²	64	83.6 Å²	83.6	34%	0.342	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	145.9	172.7	-51.7	-61.7	0	0	0	109.7	F276 S277	N167-F276 CarbonylContact O-C 3.49Å; N167-F276 VanDerWaalsContact O-CA 3.27Å; N167-F276 WeakPolarHBondContact O-CA 3.41Å; N167-S277 WeakPolarHBondContact CB-OG 3.44Å; N167-S277 PolarHBondContact N-O 3.36Å; N167-S277 PolarHBondContact ND2-OG 2.88Å; N167-S277 VanDerWaalsContact ND2-OG 3.16Å; N167-S277 PolarHBondContact O-N 3.34Å
168	Y	97.5	Very high	93.3	Very high	119 Å²	119	89.5 Å²	89.5	47%	0.467	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	140.2	169	170.4	-106.9	0	0	0	109.4	A274 R275 F276	Y168-A274 HydrophobicContact CE2-CB 4.04Å; Y168-R275 WeakPolarHBondContact CA-O 3.31Å; Y168-R275 VanDerWaalsContact CD2-O 3.3Å; Y168-R275 WeakPolarHBondContact CD2-O 3.33Å; Y168-F276 AromaticContact CD2-CD1 3.72Å; Y168-F276 HydrophobicContact CD2-CD1 3.72Å; Y168-F276 AromaticContact CD2-CD2 3.86Å; Y168-F276 HydrophobicContact CD2-CD2 3.86Å; Y168-F276 AromaticContact CD2-CE1 3.36Å; Y168-F276 HydrophobicContact CD2-CE1 3.36Å; Y168-F276 AromaticContact CD2-CE2 3.51Å; Y168-F276 HydrophobicContact CD2-CE2 3.51Å; Y168-F276 AromaticContact CD2-CG 3.96Å; Y168-F276 HydrophobicContact CD2-CG 3.96Å; Y168-F276 AromaticContact CD2-CZ 3.25Å; Y168-F276 HydrophobicContact CD2-CZ 3.25Å; Y168-F276 HydrophobicContact CE2-CD2 4.28Å; Y168-F276 HydrophobicContact CE2-CE1 4.12Å; Y168-F276 AromaticContact CE2-CE2 3.61Å; Y168-F276 HydrophobicContact CE2-CE2 3.61Å; Y168-F276 AromaticContact CE2-CZ 3.53Å; Y168-F276 HydrophobicContact CE2-CZ 3.53Å; Y168-F276 HydrophobicContact CG-CD1 4.16Å; Y168-F276 AromaticContact CG-CE1 3.76Å; Y168-F276 HydrophobicContact CG-CE1 3.76Å; Y168-F276 HydrophobicContact CG-CZ 4.03Å
169	M	97.1	Very high	94.5	Very high	16 Å²	16	89.7 Å²	89.7	8%	0.079	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	138.3	169.9	-165.4	-175.3	102.1	0	0	110.3	P171 M174 L177 A189 W229 A270 A274 R275	M169-P171 HydrophobicContact CE-CB 4.22Å; M169-P171 HydrophobicContact CE-CG 3.88Å; M169-M174 HydrophobicContact CG-CB 4.33Å; M169-M174 HydrophobicContact CG-CE 4.28Å; M169-M174 HydrophobicContact CG-SD 3.89Å; M169-M174 HydrophobicContact SD-SD 3.93Å; M169-L177 HydrophobicContact CE-CD1 3.61Å; M169-L177 HydrophobicContact CE-CD2 3.88Å; M169-L177 HydrophobicContact CE-CG 4.36Å; M169-L177 HydrophobicContact SD-CD2 3.98Å; M169-A189 HydrophobicContact CE-CB 3.88Å; M169-A189 HydrophobicContact SD-CB 3.51Å; M169-A189 VanDerWaalsContact SD-CB 3.51Å; M169-W229 HydrophobicContact CB-CH2 4.1Å; M169-W229 HydrophobicContact CE-CH2 3.64Å; M169-W229 HydrophobicContact CE-CZ2 4.2Å; M169-W229 HydrophobicContact SD-CH2 4.19Å; M169-A270 HydrophobicContact CE-CB 3.99Å; M169-A274 WeakPolarHBondContact O-CA 3.48Å; M169-R275 PolarHBondContact N-O 2.86Å; M169-R275 PolarHBondContact O-N 3.5Å
170	D	95.7	Very high	95.2	Very high	31 Å²	31	86.5 Å²	86.5	17%	0.166	44%	0.44	C	S	.	.			trans	-110.1	108.6	166	-177.1	-11.6	0	0	0	109	A172 Q173 M174 A274	D170-A172 PolarHBondContact O-N 2.91Å; D170-A172 WeakPolarHBondContact OD1-CB 3.09Å; D170-A172 PolarHBondContact OD1-N 3.22Å; D170-Q173 HydrophobicContact CB-CB 4.16Å; D170-Q173 HydrophobicContact CB-CG 4.21Å; D170-Q173 PolarHBondContact O-N 2.68Å; D170-Q173 PolarHBondContact OD2-NE2 3.01Å; D170-M174 PolarHBondContact O-N 2.75Å; D170-A274 HydrophobicContact CB-CB 4.02Å
171	P	93.6	Very high	95.4	Very high	20 Å²	20	82.9 Å²	82.9	13%	0.13	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-24.7	177.8	-22.2	31.7	0	0	0	114.4	M169 W229 G271 T273	M169-P171 HydrophobicContact CE-CB 4.22Å; M169-P171 HydrophobicContact CE-CG 3.88Å; P171-W229 HydrophobicContact CG-CZ2 3.77Å; P171-G271 WeakPolarHBondContact CG-O 3.27Å; P171-T273 VanDerWaalsContact CD-O 3.29Å; P171-T273 WeakPolarHBondContact CD-O 3.27Å
172	A	91.5	Very high	95.5	Very high	84 Å²	84	85 Å²	85	69%	0.694	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-28.8	177.3	0	0	0	0	0	112.4	D170	D170-A172 PolarHBondContact O-N 2.91Å; D170-A172 WeakPolarHBondContact OD1-CB 3.09Å; D170-A172 PolarHBondContact OD1-N 3.22Å
173	Q	92.4	Very high	95.5	Very high	153 Å²	153	84.2 Å²	84.2	72%	0.715	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-33.9	176.6	-63.2	-179.9	57.4	0	0	112	D170	D170-Q173 HydrophobicContact CB-CB 4.16Å; D170-Q173 HydrophobicContact CB-CG 4.21Å; D170-Q173 PolarHBondContact O-N 2.68Å; D170-Q173 PolarHBondContact OD2-NE2 3.01Å
174	M	90.7	Very high	95.4	Very high	103 Å²	103	83.9 Å²	83.9	51%	0.507	44%	0.442	S	S	.	.			trans	-111.9	77.3	179.7	-169.1	-170.7	-66.5	0	0	110.6	M169 D170 L177	M169-M174 HydrophobicContact CG-CB 4.33Å; M169-M174 HydrophobicContact CG-CE 4.28Å; M169-M174 HydrophobicContact CG-SD 3.89Å; M169-M174 HydrophobicContact SD-SD 3.93Å; D170-M174 PolarHBondContact O-N 2.75Å; M174-L177 HydrophobicContact CG-CD2 4.47Å; M174-L177 HydrophobicContact SD-CD2 4.47Å
175	S	85.1	Confident	95.3	Very high	73 Å²	73	82.1 Å²	82.1	51%	0.51	43%	0.43	S	S	.	.			trans	-85.2	-12.2	-174.5	62.2	0	0	0	0	115.1	L177	S175-L177 PolarHBondContact O-N 2.73Å
176	H	92.8	Very high	95.2	Very high	183 Å²	183	79.1 Å²	79.1	85%	0.847	42%	0.42	S	S	*	.			trans	-78.9	55.5	-177.8	-62.7	-70.3	0	0	0	113.2
177	L	95.1	Very high	95.1	Very high	32 Å²	32	77.9 Å²	77.9	17%	0.168	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-94.5	138.7	-178.9	-53.1	179.3	0	0	0	111.3	M169 M174 S175 K187 A270	M169-L177 HydrophobicContact CE-CD1 3.61Å; M169-L177 HydrophobicContact CE-CD2 3.88Å; M169-L177 HydrophobicContact CE-CG 4.36Å; M169-L177 HydrophobicContact SD-CD2 3.98Å; M174-L177 HydrophobicContact CG-CD2 4.47Å; M174-L177 HydrophobicContact SD-CD2 4.47Å; S175-L177 PolarHBondContact O-N 2.73Å; L177-K187 HydrophobicContact CB-CB 4.02Å; L177-K187 HydrophobicContact CB-CD 4.25Å; L177-K187 HydrophobicContact CB-CG 4.37Å; L177-K187 HydrophobicContact CD1-CB 4.19Å; L177-A270 HydrophobicContact CD1-CB 3.59Å
178	K	96.1	Very high	95.1	Very high	169 Å²	169	75.8 Å²	75.8	74%	0.735	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	144	174.3	-64	-177.4	179.2	-178	0	110.2	K187 M188	K178-K187 WeakPolarHBondContact O-CA 3.3Å; K178-M188 HydrophobicContact CB-CE 4.35Å; K178-M188 PolarHBondContact O-N 3.43Å
179	E	97.6	Very high	95.1	Very high	113 Å²	113	71.5 Å²	71.5	53%	0.528	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	146.5	169.2	-64.6	-62.7	160.6	0	0	110.7	G186 K187	E179-G186 VanDerWaalsContact OE2-CA 3.25Å; E179-G186 WeakPolarHBondContact OE2-CA 3.33Å; E179-K187 WeakPolarHBondContact OE1-CE 3.43Å; E179-K187 WeakPolarHBondContact OE1-CG 3.36Å; E179-K187 PolarHBondContact OE2-N 2.98Å
180	E	97.9	Very high	95.1	Very high	8 Å²	8	73.7 Å²	73.7	4%	0.037	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-67.5	125	174.9	-169	-77.6	130.8	0	0	110.8	Y182 Y183 G184 M185 G186 M188 W192 L269	E180-Y182 WeakPolarHBondContact OE1-CB 3.3Å; E180-Y182 PolarHBondContact OE1-N 3.07Å; E180-Y183 PolarHBondContact OE1-N 3.08Å; E180-Y183 WeakPolarHBondContact OE2-CA 3.34Å; E180-Y183 PolarHBondContact OE2-N 3.17Å; E180-G184 PolarHBondContact OE2-N 2.87Å; E180-M185 HydrophobicContact CB-CB 3.87Å; E180-M185 HydrophobicContact CG-CB 3.82Å; E180-M185 HydrophobicContact CG-CG 4.21Å; E180-M185 HydrophobicContact CG-SD 4.48Å; E180-M185 WeakPolarHBondContact OE2-CG 3.49Å; E180-M185 PolarHBondContact OE2-N 3.1Å; E180-M185 VanDerWaalsContact OE2-N 3.09Å; E180-G186 VanDerWaalsContact CB-O 3.24Å; E180-G186 WeakPolarHBondContact CB-O 3.36Å; E180-G186 PolarHBondContact N-O 2.7Å; E180-M188 HydrophobicContact CB-CG 3.89Å; E180-M188 HydrophobicContact CB-SD 3.95Å; E180-M188 HydrophobicContact CG-CG 4.32Å; E180-M188 HydrophobicContact CG-SD 3.9Å; E180-W192 HydrophobicContact CG-CZ2 4.09Å; E180-W192 PolarHBondContact OE1-NE1 3.49Å; E180-L269 HydrophobicContact CB-CD2 4.29Å
181	P	97.6	Very high	95.2	Very high	83 Å²	83	73.8 Å²	73.8	54%	0.539	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-17.5	-161.6	31.6	-37.2	0	0	0	116.1
182	Y	97.5	Very high	95.4	Very high	123 Å²	123	74.5 Å²	74.5	48%	0.482	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-39.7	-166.1	-53.3	-53.6	0	0	0	114.4	E180 W192 K234 I239	E180-Y182 WeakPolarHBondContact OE1-CB 3.3Å; E180-Y182 PolarHBondContact OE1-N 3.07Å; Y182-W192 AromaticContact CD2-CD1 3.74Å; Y182-W192 AromaticContact CD2-NE1 3.59Å; Y182-W192 AromaticContact CE2-CD1 3.64Å; Y182-W192 HydrophobicContact CE2-CG 4.45Å; Y182-W192 AromaticContact CE2-NE1 4Å; Y182-K234 HydrophobicContact CD2-CD 4.45Å; Y182-I239 HydrophobicContact CD1-CG2 3.77Å; Y182-I239 HydrophobicContact CD2-CG2 4.06Å; Y182-I239 HydrophobicContact CE1-CG2 4.15Å; Y182-I239 HydrophobicContact CE2-CG2 4.42Å; Y182-I239 HydrophobicContact CG-CB 4.47Å; Y182-I239 HydrophobicContact CG-CG2 3.72Å
183	Y	97.1	Very high	95.7	Very high	59 Å²	59	73 Å²	73	23%	0.231	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	-3	-169.8	-51.2	-77.7	0	0	0	113.3	E180 M185 W192 K234 D238 T241 G243	E180-Y183 PolarHBondContact OE1-N 3.08Å; E180-Y183 WeakPolarHBondContact OE2-CA 3.34Å; E180-Y183 PolarHBondContact OE2-N 3.17Å; Y183-M185 HydrophobicContact CD2-CE 3.83Å; Y183-M185 HydrophobicContact CG-CE 4.04Å; Y183-W192 AromaticContact CD2-CZ2 3.99Å; Y183-W192 HydrophobicContact CD2-CZ2 3.99Å; Y183-W192 HydrophobicContact CE2-CZ2 4.05Å; Y183-K234 HydrophobicContact CE2-CB 3.95Å; Y183-K234 HydrophobicContact CE2-CD 4.12Å; Y183-D238 PolarHBondContact OH-O 3.31Å; Y183-T241 VanDerWaalsContact CE1-O 3.29Å; Y183-T241 WeakPolarHBondContact CE1-O 3.37Å; Y183-T241 PolarHBondContact OH-O 2.69Å; Y183-T241 VanDerWaalsContact OH-O 3.07Å; Y183-G243 VanDerWaalsContact CE1-N 3.31Å
184	G	95.9	Very high	96	Very high	67 Å²	67	68.5 Å²	68.5	69%	0.691	37%	0.367	S	S	*	.			trans	72.5	33.3	-178.5	0	0	0	0	0	112.6	E180 G186	E180-G184 PolarHBondContact OE2-N 2.87Å; G184-G186 PolarHBondContact O-N 2.9Å
185	M	96.3	Very high	96.3	Very high	14 Å²	14	64.1 Å²	64.1	7%	0.069	35%	0.346	C	S	.	.			trans	-71.8	-8.7	-176.1	-64.4	-170.3	174.4	0	0	114.9	E180 Y183 W192 M245 L269	E180-M185 HydrophobicContact CB-CB 3.87Å; E180-M185 HydrophobicContact CG-CB 3.82Å; E180-M185 HydrophobicContact CG-CG 4.21Å; E180-M185 HydrophobicContact CG-SD 4.48Å; E180-M185 WeakPolarHBondContact OE2-CG 3.49Å; E180-M185 PolarHBondContact OE2-N 3.1Å; E180-M185 VanDerWaalsContact OE2-N 3.09Å; Y183-M185 HydrophobicContact CD2-CE 3.83Å; Y183-M185 HydrophobicContact CG-CE 4.04Å; M185-W192 HydrophobicContact CE-CH2 4.37Å; M185-W192 HydrophobicContact CE-CZ2 4.35Å; M185-W192 HydrophobicContact SD-CH2 4.08Å; M185-W192 HydrophobicContact SD-CZ2 3.88Å; M185-M245 HydrophobicContact CB-CE 3.53Å; M185-M245 HydrophobicContact CE-CB 4.44Å; M185-M245 HydrophobicContact CG-CE 3.63Å; M185-M245 HydrophobicContact SD-CB 4.4Å; M185-M245 HydrophobicContact SD-CE 4.45Å; M185-L269 HydrophobicContact CB-CD1 3.78Å; M185-L269 HydrophobicContact CB-CD2 3.63Å; M185-L269 HydrophobicContact CB-CG 4.36Å; M185-L269 HydrophobicContact CG-CD1 4.41Å; M185-L269 HydrophobicContact SD-CD1 4.03Å
186	G	95.3	Very high	96.8	Very high	24 Å²	24	68.4 Å²	68.4	25%	0.247	36%	0.358	C	S	.	.			trans	92.4	-162.6	-177.5	0	0	0	0	0	113.2	E179 E180 G184 M188	E179-G186 VanDerWaalsContact OE2-CA 3.25Å; E179-G186 WeakPolarHBondContact OE2-CA 3.33Å; E180-G186 VanDerWaalsContact CB-O 3.24Å; E180-G186 WeakPolarHBondContact CB-O 3.36Å; E180-G186 PolarHBondContact N-O 2.7Å; G184-G186 PolarHBondContact O-N 2.9Å; G186-M188 PolarHBondContact O-N 2.86Å
187	K	96.6	Very high	97	Very high	97 Å²	97	65 Å²	65	42%	0.422	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	131.4	-171.9	-68.1	-177.8	174.5	-169.5	0	113.4	L177 K178 E179 L269 A270	L177-K187 HydrophobicContact CB-CB 4.02Å; L177-K187 HydrophobicContact CB-CD 4.25Å; L177-K187 HydrophobicContact CB-CG 4.37Å; L177-K187 HydrophobicContact CD1-CB 4.19Å; K178-K187 WeakPolarHBondContact O-CA 3.3Å; E179-K187 WeakPolarHBondContact OE1-CE 3.43Å; E179-K187 WeakPolarHBondContact OE1-CG 3.36Å; E179-K187 PolarHBondContact OE2-N 2.98Å; K187-L269 CarbonylContact O-C 3.57Å; K187-L269 WeakPolarHBondContact O-CA 3.41Å; K187-A270 HydrophobicContact CB-CB 4.45Å; K187-A270 PolarHBondContact O-N 3.19Å
188	M	97.6	Very high	97	Very high	20 Å²	20	64.9 Å²	64.9	10%	0.099	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	126.4	175	-63.3	-176.8	-61.5	0	0	110.9	K178 E180 G186 C267 V268 L269	K178-M188 HydrophobicContact CB-CE 4.35Å; K178-M188 PolarHBondContact O-N 3.43Å; E180-M188 HydrophobicContact CB-CG 3.89Å; E180-M188 HydrophobicContact CB-SD 3.95Å; E180-M188 HydrophobicContact CG-CG 4.32Å; E180-M188 HydrophobicContact CG-SD 3.9Å; G186-M188 PolarHBondContact O-N 2.86Å; M188-C267 HydrophobicContact SD-CB 4.19Å; M188-V268 CarbonylContact C-O 3.55Å; M188-V268 WeakPolarHBondContact CA-O 3.43Å; M188-L269 HydrophobicContact CG-CD2 4.05Å
189	A	97	Very high	96.9	Very high	30 Å²	30	57.5 Å²	57.5	25%	0.248	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	-35	162.5	0	0	0	0	0	111.4	M169 W229 V268 A270	M169-A189 HydrophobicContact CE-CB 3.88Å; M169-A189 HydrophobicContact SD-CB 3.51Å; M169-A189 VanDerWaalsContact SD-CB 3.51Å; A189-W229 HydrophobicContact CB-CH2 3.99Å; A189-W229 HydrophobicContact CB-CZ3 3.65Å; A189-V268 HydrophobicContact CB-CB 4.32Å; A189-V268 HydrophobicContact CB-CG1 3.99Å; A189-V268 PolarHBondContact N-O 3.34Å; A189-A270 HydrophobicContact CB-CB 4.34Å
190	V	97.9	Very high	96.6	Very high	61 Å²	61	54.2 Å²	54.2	37%	0.37	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	130.4	172.8	-173.6	0	0	0	0	107.6	C267 V268	V190-C267 WeakPolarHBondContact O-CB 3.48Å; V190-V268 HydrophobicContact CB-CB 3.96Å; V190-V268 HydrophobicContact CB-CG2 4.03Å; V190-V268 HydrophobicContact CG2-CB 4.09Å; V190-V268 HydrophobicContact CG2-CG2 4.09Å; V190-V268 PolarHBondContact N-O 3.06Å; V190-V268 PolarHBondContact O-N 3.48Å
191	G	97.8	Very high	96.3	Very high	33 Å²	33	57.4 Å²	57.4	34%	0.34	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	177.1	-178.6	0	0	0	0	0	114.2	H193	G191-H193 PolarHBondContact O-N 2.86Å; G191-H193 PolarHBondContact O-ND1 3.44Å
192	W	98.3	Very high	96.1	Very high	35 Å²	35	53.7 Å²	53.7	13%	0.133	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	116.9	172.2	-69.9	116.6	0	0	0	111	E180 Y182 Y183 M185 K234 Q265 H266 C267	E180-W192 HydrophobicContact CG-CZ2 4.09Å; E180-W192 PolarHBondContact OE1-NE1 3.49Å; Y182-W192 AromaticContact CD2-CD1 3.74Å; Y182-W192 AromaticContact CD2-NE1 3.59Å; Y182-W192 AromaticContact CE2-CD1 3.64Å; Y182-W192 HydrophobicContact CE2-CG 4.45Å; Y182-W192 AromaticContact CE2-NE1 4Å; Y183-W192 AromaticContact CD2-CZ2 3.99Å; Y183-W192 HydrophobicContact CD2-CZ2 3.99Å; Y183-W192 HydrophobicContact CE2-CZ2 4.05Å; M185-W192 HydrophobicContact CE-CH2 4.37Å; M185-W192 HydrophobicContact CE-CZ2 4.35Å; M185-W192 HydrophobicContact SD-CH2 4.08Å; M185-W192 HydrophobicContact SD-CZ2 3.88Å; W192-K234 HydrophobicContact CD2-CD 3.5Å; W192-K234 HydrophobicContact CD2-CG 4.09Å; W192-K234 HydrophobicContact CE3-CD 3.62Å; W192-K234 HydrophobicContact CE3-CG 3.64Å; W192-K234 HydrophobicContact CG-CD 4.01Å; W192-K234 HydrophobicContact CH2-CB 4.01Å; W192-K234 HydrophobicContact CH2-CD 4.12Å; W192-K234 HydrophobicContact CH2-CG 3.98Å; W192-K234 HydrophobicContact CZ2-CD 4.02Å; W192-K234 HydrophobicContact CZ2-CG 4.39Å; W192-K234 HydrophobicContact CZ3-CB 4.02Å; W192-K234 HydrophobicContact CZ3-CD 3.93Å; W192-K234 HydrophobicContact CZ3-CG 3.59Å; W192-Q265 HydrophobicContact CE3-CB 4.14Å; W192-Q265 WeakPolarHBondContact CZ3-O 3.5Å; W192-H266 WeakPolarHBondContact CA-O 3.27Å; W192-C267 HydrophobicContact CD2-CB 3.74Å; W192-C267 HydrophobicContact CE3-CB 3.66Å; W192-C267 HydrophobicContact CG-CB 4.21Å; W192-C267 HydrophobicContact CH2-CB 4.49Å; W192-C267 VanDerWaalsContact CH2-SG 3.56Å; W192-C267 VanDerWaalsContact CZ2-SG 3.59Å; W192-C267 HydrophobicContact CZ3-CB 4.06Å
193	H	98.1	Very high	96.1	Very high	54 Å²	54	48.7 Å²	48.7	25%	0.25	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	169.9	-178.6	68	-64.1	0	0	0	112.4	G191 D195 Q265 H266	G191-H193 PolarHBondContact O-N 2.86Å; G191-H193 PolarHBondContact O-ND1 3.44Å; H193-D195 IonicContact NE2-OD1 3.51Å; H193-Q265 WeakPolarHBondContact O-CA 3.49Å; H193-H266 AromaticContact CD2-CE1 3.9Å; H193-H266 AromaticContact CE1-CD2 3.83Å; H193-H266 AromaticContact CE1-CE1 3.52Å; H193-H266 AromaticContact CE1-NE2 3.38Å; H193-H266 PolarHBondContact CE1-NE2 3.31Å; H193-H266 PolarHBondContact N-O 2.97Å; H193-H266 PolarHBondContact ND1-O 3.31Å; H193-H266 AromaticContact NE2-CE1 3.33Å; H193-H266 PolarHBondContact NE2-CE1 3.39Å; H193-H266 VanDerWaalsContact NE2-CE1 3.33Å; H193-H266 AromaticContact NE2-NE2 3.41Å; H193-H266 PolarHBondContact NE2-NE2 3.23Å; H193-H266 PolarHBondContact O-N 3.17Å; H193-H266 PolarHBondContact O-ND1 2.92Å
194	H	97.8	Very high	96.1	Very high	57 Å²	57	45.9 Å²	45.9	26%	0.264	26%	0.264	S	S	.	.			trans	-104.6	146.4	162.3	-62	-80.1	0	0	0	107.9	E196 N261 H264 Q265	H194-E196 PolarHBondContact O-N 3.06Å; H194-N261 PolarHBondContact ND1-O 3.02Å; H194-H264 PolarHBondContact CE1-O 3.25Å; H194-H264 VanDerWaalsContact CE1-O 3.28Å; H194-H264 PolarHBondContact ND1-O 2.75Å; H194-H264 VanDerWaalsContact ND1-O 3.09Å; H194-Q265 VanDerWaalsContact NE2-CG 3.33Å; H194-Q265 WeakPolarHBondContact NE2-CG 3.2Å
195	D	97.5	Very high	96.2	Very high	12 Å²	12	43.1 Å²	43.1	6%	0.064	24%	0.235	C	C	.	.			trans	-72.2	123.5	170	-84	-33.6	0	0	0	110.4	H193 L198 M256 N261 H266 R281	H193-D195 IonicContact NE2-OD1 3.51Å; D195-L198 HydrophobicContact CB-CD1 3.56Å; D195-L198 HydrophobicContact CB-CG 4.21Å; D195-M256 WeakPolarHBondContact OD2-CE 3.43Å; D195-N261 WeakPolarHBondContact CB-OD1 3.47Å; D195-N261 PolarHBondContact N-ND2 3.23Å; D195-N261 PolarHBondContact N-OD1 3.22Å; D195-N261 PolarHBondContact O-ND2 3.07Å; D195-H266 IonicContact OD1-CE1 2.92Å; D195-H266 IonicContact OD2-CE1 2.74Å; D195-R281 VanDerWaalsContact CG-NH2 3.33Å; D195-R281 IonicContact OD1-CZ 2.68Å; D195-R281 IonicContact OD1-NH1 3.8Å; D195-R281 PolarHBondContact OD1-NH1 2.77Å; D195-R281 IonicContact OD1-NH2 2.76Å; D195-R281 PolarHBondContact OD1-NH2 2.77Å; D195-R281 IonicContact OD2-CZ 3.45Å; D195-R281 IonicContact OD2-NH1 3.12Å; D195-R281 IonicContact OD2-NH2 3.58Å; D195-R281 PolarHBondContact OD2-NH2 2.91Å
196	E	95.7	Very high	96.3	Very high	163 Å²	163	42.6 Å²	42.6	76%	0.762	23%	0.232	S	C	*	.			trans	-88.9	166.6	-179.7	-62.2	-174.7	170.2	0	0	113.3	H194 L198	H194-E196 PolarHBondContact O-N 3.06Å; E196-L198 VanDerWaalsContact C-N 3.3Å; E196-L198 PolarHBondContact O-N 3.36Å
197	N	95.8	Very high	96.5	Very high	112 Å²	112	46.4 Å²	46.4	60%	0.599	24%	0.24	S	C	*	.	S	Bend	trans	52.9	41.9	175.9	-163.5	11.9	0	0	0	114	A283 E284	N197-A283 CarbonylContact O-C 3.59Å; N197-A283 VanDerWaalsContact O-CA 3.24Å; N197-A283 WeakPolarHBondContact O-CA 3.46Å; N197-E284 PolarHBondContact O-N 2.87Å; N197-E284 PolarHBondContact OD1-O 2.81Å; N197-E284 VanDerWaalsContact OD1-O 3.11Å
198	L	95.1	Very high	96.5	Very high	28 Å²	28	41.8 Å²	41.8	15%	0.147	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-106.8	147.2	176.9	-62.5	-173	0	0	0	112	D195 E196 V204 R281	D195-L198 HydrophobicContact CB-CD1 3.56Å; D195-L198 HydrophobicContact CB-CG 4.21Å; E196-L198 VanDerWaalsContact C-N 3.3Å; E196-L198 PolarHBondContact O-N 3.36Å; L198-V204 HydrophobicContact CD1-CG2 3.46Å; L198-V204 VanDerWaalsContact CD1-CG2 3.46Å; L198-R281 HydrophobicContact CD2-CB 3.72Å; L198-R281 HydrophobicContact CD2-CG 3.96Å
199	I	94	Very high	96.5	Very high	15 Å²	15	45.9 Å²	45.9	8%	0.077	24%	0.235	C	C	.	.			trans	-56.3	138.8	166.3	-69.1	-69.6	0	0	0	109.3	Q153 C155 H201 S202 V282 E284	Q153-I199 HydrophobicContact CB-CD1 3.9Å; Q153-I199 HydrophobicContact CG-CD1 4.02Å; Q153-I199 VanDerWaalsContact O-CG2 3.29Å; Q153-I199 WeakPolarHBondContact O-CG2 3.48Å; C155-I199 HydrophobicContact CB-CG2 4.05Å; I199-H201 PolarHBondContact O-N 2.85Å; I199-S202 WeakPolarHBondContact O-CB 3.28Å; I199-S202 PolarHBondContact O-N 2.98Å; I199-S202 PolarHBondContact O-OG 3.18Å; I199-V282 HydrophobicContact CB-CB 4.4Å; I199-V282 HydrophobicContact CB-CG1 4.08Å; I199-V282 HydrophobicContact CG1-CB 4.42Å; I199-V282 HydrophobicContact CG1-CG1 3.72Å; I199-V282 PolarHBondContact N-O 3.09Å; I199-E284 HydrophobicContact CD1-CB 4.16Å; I199-E284 HydrophobicContact CD1-CG 4.47Å; I199-E284 VanDerWaalsContact CD1-OE2 3.26Å; I199-E284 WeakPolarHBondContact CD1-OE2 3.46Å; I199-E284 HydrophobicContact CG1-CB 4.49Å
200	T	91.3	Very high	96.4	Very high	44 Å²	44	44.8 Å²	44.8	27%	0.27	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-61.9	128.4	-175.2	-63.4	0	0	0	0	111	Q153 V154 C155 S202	Q153-T200 WeakPolarHBondContact O-CB 3.42Å; Q153-T200 PolarHBondContact O-N 3.27Å; V154-T200 HydrophobicContact CG2-CG2 4.41Å; C155-T200 PolarHBondContact N-O 3.49Å; T200-S202 PolarHBondContact O-N 3.2Å
201	H	92.2	Very high	96	Very high	74 Å²	74	43.6 Å²	43.6	34%	0.343	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	18.9	-175	-55.4	-176	0	0	0	114.5	I199 D258	I199-H201 PolarHBondContact O-N 2.85Å; H201-D258 WeakPolarHBondContact CA-O 3.35Å; H201-D258 IonicContact CG-OD1 2.85Å; H201-D258 IonicContact ND1-OD1 3.67Å; H201-D258 PolarHBondContact ND1-OD1 2.98Å
202	S	94.4	Very high	95.1	Very high	6 Å²	6	47.7 Å²	47.7	4%	0.042	23%	0.229	C	C	.	.			trans	-72.5	144.3	172	68.1	0	0	0	0	111.2	I199 T200	I199-S202 WeakPolarHBondContact O-CB 3.28Å; I199-S202 PolarHBondContact O-N 2.98Å; I199-S202 PolarHBondContact O-OG 3.18Å; T200-S202 PolarHBondContact O-N 3.2Å
203	P	96	Very high	93.3	Very high	17 Å²	17	51.6 Å²	51.6	11%	0.11	25%	0.253	C	S	.	.			trans	-77.5	157.6	178.2	33.1	-35.7	0	0	0	111.5	V159 F161 M256 R257	V159-P203 HydrophobicContact CB-CG 4.27Å; V159-P203 HydrophobicContact CG1-CG 3.51Å; V159-P203 HydrophobicContact CG2-CG 3.67Å; F161-P203 HydrophobicContact CE1-CG 4.37Å; F161-P203 WeakPolarHBondContact CE1-O 3.32Å; F161-P203 HydrophobicContact CZ-CG 4.34Å; P203-M256 CarbonylContact C-O 3.56Å; P203-M256 WeakPolarHBondContact CA-O 3.38Å; P203-M256 VanDerWaalsContact CB-O 3.28Å; P203-M256 WeakPolarHBondContact CB-O 3.33Å; P203-R257 HydrophobicContact CB-CG 4.49Å
204	V	97.8	Very high	91	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.3	166.7	-178.8	0	0	0	0	107.7	L198 V206 Y255 M256 T279 R281	L198-V204 HydrophobicContact CD1-CG2 3.46Å; L198-V204 VanDerWaalsContact CD1-CG2 3.46Å; V204-V206 HydrophobicContact CG1-CG2 4.14Å; V204-Y255 CarbonylContact O-C 3.4Å; V204-Y255 WeakPolarHBondContact O-CA 3.27Å; V204-M256 HydrophobicContact CB-CB 4.3Å; V204-M256 HydrophobicContact CB-CE 3.78Å; V204-M256 HydrophobicContact CG1-CE 3.98Å; V204-M256 HydrophobicContact CG2-CE 4.05Å; V204-M256 PolarHBondContact N-O 2.69Å; V204-M256 PolarHBondContact O-N 2.87Å; V204-T279 HydrophobicContact CG1-CG2 3.59Å; V204-R281 HydrophobicContact CG1-CG 4.46Å
205	A	98.2	Very high	88.6	Confident	8 Å²	8	63.5 Å²	63.5	7%	0.066	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.5	177.9	0	0	0	0	0	110.1	F161 Y255 H280	F161-A205 HydrophobicContact CE1-CB 4.13Å; F161-A205 HydrophobicContact CE2-CB 4.03Å; F161-A205 HydrophobicContact CZ-CB 3.5Å; F161-A205 VanDerWaalsContact CZ-CB 3.5Å; A205-Y255 HydrophobicContact CB-CD1 3.52Å; A205-Y255 HydrophobicContact CB-CE1 3.48Å; A205-Y255 VanDerWaalsContact CB-CE1 3.48Å; A205-H280 HydrophobicContact CB-CB 4.33Å; A205-H280 PolarHBondContact N-O 3.36Å; A205-H280 VanDerWaalsContact N-O 3.08Å; A205-H280 WeakPolarHBondContact O-CB 3.5Å; A205-H280 PolarHBondContact O-N 3.24Å
206	V	98.6	Very high	86	Confident	4 Å²	4	65.7 Å²	65.7	2%	0.024	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	121	-175.7	-172	0	0	0	0	110	V204 C253 Y254 S278 T279	V204-V206 HydrophobicContact CG1-CG2 4.14Å; V206-C253 VanDerWaalsContact O-CA 3.27Å; V206-C253 WeakPolarHBondContact O-CA 3.38Å; V206-Y254 HydrophobicContact CB-CD1 3.9Å; V206-Y254 HydrophobicContact CB-CD2 4.34Å; V206-Y254 HydrophobicContact CB-CE1 3.51Å; V206-Y254 HydrophobicContact CB-CE2 3.98Å; V206-Y254 HydrophobicContact CB-CG 4.3Å; V206-Y254 HydrophobicContact CG1-CD1 4.34Å; V206-Y254 HydrophobicContact CG1-CE1 3.62Å; V206-Y254 HydrophobicContact CG2-CD2 4.29Å; V206-Y254 HydrophobicContact CG2-CE1 4.02Å; V206-Y254 HydrophobicContact CG2-CE2 3.64Å; V206-Y254 VanDerWaalsContact CG2-CZ 3.48Å; V206-Y254 PolarHBondContact N-O 3.06Å; V206-Y254 PolarHBondContact O-N 2.95Å; V206-S278 WeakPolarHBondContact CA-O 3.49Å; V206-T279 HydrophobicContact CG2-CG2 3.91Å
207	Y	98.7	Very high	83.3	Confident	104 Å²	104	66.6 Å²	66.6	41%	0.408	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	129.3	165.8	177.2	-101.4	0	0	0	109.5	S277 S278	Y207-S277 CarbonylContact O-C 3.58Å; Y207-S277 VanDerWaalsContact O-CA 3.23Å; Y207-S277 WeakPolarHBondContact O-CA 3.31Å; Y207-S278 PolarHBondContact N-O 3.45Å; Y207-S278 PolarHBondContact O-N 3.2Å
208	N	97.4	Very high	80.6	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	132	-179.3	-172	74.6	0	0	0	111.5	S210 L248 E249 G251 D252 R275	N208-S210 PolarHBondContact ND2-OG 3.36Å; N208-L248 HydrophobicContact CB-CB 4.39Å; N208-L248 PolarHBondContact ND2-O 2.71Å; N208-E249 PolarHBondContact ND2-O 3Å; N208-G251 WeakPolarHBondContact O-CA 3.3Å; N208-G251 PolarHBondContact O-N 3.47Å; N208-D252 HydrophobicContact CB-CB 4.34Å; N208-D252 VanDerWaalsContact CB-O 3.24Å; N208-D252 WeakPolarHBondContact CB-O 3.42Å; N208-D252 PolarHBondContact N-O 3.4Å; N208-R275 VanDerWaalsContact OD1-CZ 3.23Å; N208-R275 PolarHBondContact OD1-NE 3.2Å; N208-R275 PolarHBondContact OD1-NH2 3.05Å
209	Y	97.3	Very high	78	Confident	105 Å²	105	70.8 Å²	70.8	41%	0.412	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	97.2	171.8	-178.7	-112.1	0	0	0	111.1	S250 R275 F276	Y209-S250 WeakPolarHBondContact CD2-OG 3.39Å; Y209-S250 WeakPolarHBondContact CE2-OG 3.44Å; Y209-R275 WeakPolarHBondContact O-CA 3.28Å; Y209-F276 HydrophobicContact CD1-CB 4.33Å; Y209-F276 AromaticContact CD1-CD2 3.96Å; Y209-F276 HydrophobicContact CD1-CD2 3.96Å; Y209-F276 HydrophobicContact CE1-CD2 4.43Å; Y209-F276 PolarHBondContact N-O 3.34Å; Y209-F276 PolarHBondContact O-N 2.87Å
210	S	94	Very high	75.8	Confident	8 Å²	8	79.5 Å²	79.5	6%	0.056	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	129.5	169.6	-60.3	0	0	0	0	109.4	N208 S250	N208-S210 PolarHBondContact ND2-OG 3.36Å; S210-S250 PolarHBondContact N-OG 2.94Å; S210-S250 WeakPolarHBondContact O-CB 3.4Å; S210-S250 PolarHBondContact O-OG 3.48Å
211	C	90	Very high	73.4	Confident	35 Å²	35	81.3 Å²	81.3	24%	0.236	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-73.4	131.5	174.6	-61.2	0	0	0	0	109.4	T273 A274	C211-T273 WeakPolarHBondContact O-CB 3.47Å; C211-T273 PolarHBondContact O-OG1 3.16Å; C211-A274 HydrophobicContact CB-CB 4.41Å; C211-A274 VanDerWaalsContact CB-O 3.32Å; C211-A274 WeakPolarHBondContact CB-O 3.47Å; C211-A274 PolarHBondContact N-O 3.36Å
212	H	79.5	Confident	71	Confident	119 Å²	119	82.2 Å²	82.2	55%	0.551	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-99.4	137.2	170	-68.5	-75.2	0	0	0	110	D214 S250	H212-D214 PolarHBondContact O-N 3.45Å; H212-S250 WeakPolarHBondContact NE2-CB 3.37Å
213	D	59.6	Low	68.5	Low	117 Å²	117	87.8 Å²	87.8	63%	0.626	50%	0.501	S	S	*	.			trans	-78.5	93	166.5	-76.4	-47.7	0	0	0	109.8	K215 G216	D213-K215 PolarHBondContact O-N 3.35Å; D213-G216 PolarHBondContact O-N 3.06Å
214	D	50.8	Low	66.1	Low	161 Å²	161	92.3 Å²	92.3	86%	0.861	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	3.4	171.1	-73.3	-23.3	0	0	0	113.7	H212	H212-D214 PolarHBondContact O-N 3.45Å
215	K	46.7	Very low	64.1	Low	201 Å²	201	101 Å²	101	87%	0.874	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	5.1	178.5	-67.3	-171.5	178	178.2	0	114.3	D213	D213-K215 PolarHBondContact O-N 3.35Å
216	G	43.6	Very low	62.5	Low	58 Å²	58	106.8 Å²	106.8	60%	0.598	59%	0.592	S	S	*	*			trans	-91.3	92.1	170.2	0	0	0	0	0	111.8	D213 C218	D213-G216 PolarHBondContact O-N 3.06Å; G216-C218 PolarHBondContact O-N 2.9Å
217	E	38.2	Very low	61.5	Low	182 Å²	182	108.2 Å²	108.2	85%	0.85	61%	0.605	S	S	*	*			trans	-54.8	137.5	161.1	-71	-174.1	149.5	0	0	109.2	S219	E217-S219 VanDerWaalsContact C-N 3.3Å; E217-S219 PolarHBondContact O-N 3.39Å; E217-S219 PolarHBondContact O-OG 3.41Å
218	C	38.7	Very low	61.1	Low	126 Å²	126	105.2 Å²	105.2	85%	0.851	60%	0.598	S	S	*	*			trans	-58.4	89.4	179.9	-69.7	0	0	0	0	111.5	G216 E220	G216-C218 PolarHBondContact O-N 2.9Å; C218-E220 VanDerWaalsContact C-N 3.3Å; C218-E220 PolarHBondContact O-N 3.36Å
219	S	41.3	Very low	61	Low	101 Å²	101	105.5 Å²	105.5	71%	0.706	60%	0.599	S	S	*	*			trans	-75.7	86.6	169.8	-64.4	0	0	0	0	107.9	E217 G221	E217-S219 VanDerWaalsContact C-N 3.3Å; E217-S219 PolarHBondContact O-N 3.39Å; E217-S219 PolarHBondContact O-OG 3.41Å; S219-G221 PolarHBondContact O-N 2.86Å
220	E	46.6	Very low	61	Low	199 Å²	199	103.3 Å²	103.3	93%	0.93	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.5	100.5	171.1	-65.9	-173	149.9	0	0	109.6	C218	C218-E220 VanDerWaalsContact C-N 3.3Å; C218-E220 PolarHBondContact O-N 3.36Å
221	G	42.8	Very low	61.2	Low	81 Å²	81	103.5 Å²	103.5	84%	0.835	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	160.7	-21.5	175.5	0	0	0	0	0	118.6	S219	S219-G221 PolarHBondContact O-N 2.86Å
222	S	40.1	Very low	61.6	Low	94 Å²	94	101.9 Å²	101.9	66%	0.657	58%	0.579	S	S	*	*			trans	-134	83.5	178.3	66.3	0	0	0	0	113	V224	S222-V224 PolarHBondContact O-N 3.48Å
223	S	42.4	Very low	62.5	Low	122 Å²	122	98 Å²	98	85%	0.853	56%	0.562	S	S	*	*			trans	-74.4	62.6	166.7	62.7	0	0	0	0	111	E225	S223-E225 PolarHBondContact O-N 2.98Å
224	V	46.5	Very low	64.4	Low	113 Å²	113	92.8 Å²	92.8	69%	0.685	53%	0.534	S	S	*	.			trans	-70.1	107.8	152.1	-178.7	0	0	0	0	104.1	S222 K226	S222-V224 PolarHBondContact O-N 3.48Å; V224-K226 PolarHBondContact O-N 2.76Å
225	E	54.9	Low	66.6	Low	182 Å²	182	87.7 Å²	87.7	85%	0.85	51%	0.509	S	S	*	.			trans	-61.1	100.2	175	-69.9	-179.5	164.3	0	0	107.7	S223 A227	S223-E225 PolarHBondContact O-N 2.98Å; E225-A227 PolarHBondContact O-N 2.82Å
226	K	64	Low	69	Low	130 Å²	130	78.7 Å²	78.7	57%	0.565	47%	0.472	S	S	*	.			trans	-54.3	129.1	178	-68.9	-164.2	173.4	-173.4	0	108.4	V224 C228 E272	V224-K226 PolarHBondContact O-N 2.76Å; K226-C228 PolarHBondContact O-N 2.79Å; K226-E272 WeakPolarHBondContact CA-OE1 3.17Å; K226-E272 WeakPolarHBondContact CB-OE2 3.28Å; K226-E272 VanDerWaalsContact CG-OE2 3.3Å; K226-E272 WeakPolarHBondContact CG-OE2 3.29Å
227	A	77.6	Confident	71.5	Confident	35 Å²	35	87.3 Å²	87.3	29%	0.289	49%	0.487	S	S	.	.			trans	-58.3	113.7	-179.2	0	0	0	0	0	109.7	E225 G271 E272	E225-A227 PolarHBondContact O-N 2.82Å; A227-G271 CarbonylContact O-C 3.56Å; A227-G271 WeakPolarHBondContact O-CA 3.42Å; A227-E272 HydrophobicContact CB-CG 4.15Å; A227-E272 PolarHBondContact N-OE1 3.2Å; A227-E272 PolarHBondContact O-N 3.15Å
228	C	90.7	Very high	74.4	Confident	41 Å²	41	80.5 Å²	80.5	28%	0.277	46%	0.456	S	S	.	.			trans	-76.1	153.4	175.3	63	0	0	0	0	110.7	K226 R230	K226-C228 PolarHBondContact O-N 2.79Å; C228-R230 VanDerWaalsContact O-CZ 3.3Å; C228-R230 PolarHBondContact O-NE 3.22Å; C228-R230 PolarHBondContact O-NH2 3Å
229	W	96.6	Very high	77.2	Confident	6 Å²	6	78.4 Å²	78.4	2%	0.023	44%	0.436	C	S	.	.			trans	-68.1	138.7	170.8	-78.4	89.5	0	0	0	109.9	M169 P171 A189 L248 V268 L269 A270 G271 T273 R275	M169-W229 HydrophobicContact CB-CH2 4.1Å; M169-W229 HydrophobicContact CE-CH2 3.64Å; M169-W229 HydrophobicContact CE-CZ2 4.2Å; M169-W229 HydrophobicContact SD-CH2 4.19Å; P171-W229 HydrophobicContact CG-CZ2 3.77Å; A189-W229 HydrophobicContact CB-CH2 3.99Å; A189-W229 HydrophobicContact CB-CZ3 3.65Å; W229-L248 WeakPolarHBondContact O-CB 3.45Å; W229-L248 PolarHBondContact O-N 3.48Å; W229-V268 HydrophobicContact CE3-CG1 3.95Å; W229-V268 HydrophobicContact CZ3-CG1 3.74Å; W229-L269 VanDerWaalsContact CE3-O 3.26Å; W229-A270 HydrophobicContact CH2-CB 4.42Å; W229-A270 HydrophobicContact CZ3-CB 4.39Å; W229-G271 VanDerWaalsContact CD2-N 3.32Å; W229-T273 PolarHBondContact NE1-O 3.42Å; W229-R275 HydrophobicContact CD2-CB 3.94Å; W229-R275 HydrophobicContact CD2-CG 4.17Å; W229-R275 VanDerWaalsContact CE2-CB 3.4Å; W229-R275 HydrophobicContact CG-CB 4.32Å; W229-R275 HydrophobicContact CG-CG 4.44Å; W229-R275 HydrophobicContact CH2-CB 4.16Å; W229-R275 HydrophobicContact CZ2-CB 3.54Å; W229-R275 HydrophobicContact CZ2-CG 4.44Å
230	R	97.5	Very high	79.9	Confident	59 Å²	59	81.7 Å²	81.7	22%	0.223	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	151.1	-173.9	-77.1	156	-68.3	-166.8	6.6	111.5	C228 M245 L246 P247 L269	C228-R230 VanDerWaalsContact O-CZ 3.3Å; C228-R230 PolarHBondContact O-NE 3.22Å; C228-R230 PolarHBondContact O-NH2 3Å; R230-M245 HydrophobicContact CB-CG 4.06Å; R230-M245 HydrophobicContact CG-CG 4.14Å; R230-L246 CarbonylContact C-O 3.59Å; R230-L246 WeakPolarHBondContact CA-O 3.47Å; R230-L246 WeakPolarHBondContact CB-O 3.4Å; R230-L246 WeakPolarHBondContact CG-O 3.34Å; R230-P247 HydrophobicContact CG-CB 4.48Å; R230-L269 HydrophobicContact CB-CB 3.94Å; R230-L269 HydrophobicContact CB-CD1 3.96Å; R230-L269 PolarHBondContact N-O 2.69Å; R230-L269 VanDerWaalsContact N-O 3.14Å; R230-L269 PolarHBondContact O-N 2.95Å
231	I	98	Very high	82.3	Confident	12 Å²	12	75.5 Å²	75.5	6%	0.062	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	125.8	168.4	-178.8	62.3	0	0	0	108.4	L246 L248 Y254 H266 C267	I231-L246 HydrophobicContact CG2-CB 3.78Å; I231-L246 HydrophobicContact CG2-CD1 4.41Å; I231-L246 PolarHBondContact N-O 3.39Å; I231-L246 PolarHBondContact O-N 2.96Å; I231-L248 HydrophobicContact CB-CD1 4.09Å; I231-L248 HydrophobicContact CB-CG 4.44Å; I231-L248 HydrophobicContact CG2-CD1 4.36Å; I231-L248 HydrophobicContact CG2-CD2 4.01Å; I231-L248 HydrophobicContact CG2-CG 4.21Å; I231-Y254 HydrophobicContact CB-CE1 4.44Å; I231-Y254 HydrophobicContact CD1-CE2 4.26Å; I231-Y254 HydrophobicContact CG1-CE1 4.42Å; I231-Y254 HydrophobicContact CG1-CE2 4.16Å; I231-H266 HydrophobicContact CD1-CB 4.14Å; I231-C267 WeakPolarHBondContact CD1-O 3.33Å
232	G	98.1	Very high	85	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	140.7	170.1	0	0	0	0	0	110.4	L244 H266 C267	G232-L244 CarbonylContact C-O 3.57Å; G232-L244 VanDerWaalsContact CA-O 3.31Å; G232-L244 WeakPolarHBondContact CA-O 3.48Å; G232-H266 VanDerWaalsContact O-CA 3.23Å; G232-H266 WeakPolarHBondContact O-CA 3.36Å; G232-H266 WeakPolarHBondContact O-CB 3.44Å; G232-C267 PolarHBondContact N-O 2.79Å; G232-C267 PolarHBondContact O-N 2.98Å
233	L	98.5	Very high	87.7	Confident	37 Å²	37	73 Å²	73	19%	0.194	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	131.8	175.3	-171.8	74.6	0	0	0	110.2	G243 L244 H264 H266	L233-G243 CarbonylContact O-C 3.4Å; L233-G243 WeakPolarHBondContact O-CA 3.41Å; L233-L244 HydrophobicContact CB-CB 4.41Å; L233-L244 PolarHBondContact N-O 3.31Å; L233-L244 PolarHBondContact O-N 3.31Å; L233-H264 HydrophobicContact CD1-CB 3.76Å; L233-H264 HydrophobicContact CG-CB 4.28Å; L233-H266 HydrophobicContact CD1-CB 4.2Å
234	K	98.4	Very high	90.3	Very high	8 Å²	8	72 Å²	72	4%	0.035	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	153.5	175.1	66.1	-178.9	-66.6	-60.6	0	110.9	Y182 Y183 W192 D238 H264 Q265	Y182-K234 HydrophobicContact CD2-CD 4.45Å; Y183-K234 HydrophobicContact CE2-CB 3.95Å; Y183-K234 HydrophobicContact CE2-CD 4.12Å; W192-K234 HydrophobicContact CD2-CD 3.5Å; W192-K234 HydrophobicContact CD2-CG 4.09Å; W192-K234 HydrophobicContact CE3-CD 3.62Å; W192-K234 HydrophobicContact CE3-CG 3.64Å; W192-K234 HydrophobicContact CG-CD 4.01Å; W192-K234 HydrophobicContact CH2-CB 4.01Å; W192-K234 HydrophobicContact CH2-CD 4.12Å; W192-K234 HydrophobicContact CH2-CG 3.98Å; W192-K234 HydrophobicContact CZ2-CD 4.02Å; W192-K234 HydrophobicContact CZ2-CG 4.39Å; W192-K234 HydrophobicContact CZ3-CB 4.02Å; W192-K234 HydrophobicContact CZ3-CD 3.93Å; W192-K234 HydrophobicContact CZ3-CG 3.59Å; K234-D238 WeakPolarHBondContact CE-O 3.48Å; K234-D238 PolarHBondContact NZ-O 3.3Å; K234-H264 CarbonylContact O-C 3.58Å; K234-H264 WeakPolarHBondContact O-CA 3.21Å; K234-H264 WeakPolarHBondContact O-CB 3.35Å; K234-Q265 HydrophobicContact CD-CB 4.29Å; K234-Q265 HydrophobicContact CG-CB 3.84Å; K234-Q265 PolarHBondContact N-O 3.45Å; K234-Q265 PolarHBondContact O-N 3.33Å
235	V	98.3	Very high	92.7	Very high	54 Å²	54	70.2 Å²	70.2	33%	0.327	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	138.7	167.8	179.2	0	0	0	0	108.6	D238 T241	V235-D238 HydrophobicContact CB-CB 4.06Å; V235-D238 HydrophobicContact CG1-CB 4.15Å; V235-D238 PolarHBondContact O-N 3.23Å; V235-T241 HydrophobicContact CG2-CG2 4.49Å
236	A	96.6	Very high	94.7	Very high	13 Å²	13	66 Å²	66	11%	0.107	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	142.6	177.3	0	0	0	0	0	110.5	D238 T263 Q265	A236-D238 PolarHBondContact O-N 3.33Å; A236-T263 WeakPolarHBondContact CB-O 3.41Å; A236-T263 PolarHBondContact N-O 3.14Å; A236-Q265 HydrophobicContact CB-CG 4.34Å
237	W	96.6	Very high	96.3	Very high	238 Å²	238	63.5 Å²	63.5	90%	0.902	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	-1.9	-179.7	-42.3	102.7	0	0	0	116.9
238	D	97.8	Very high	97.1	Very high	39 Å²	39	62.2 Å²	62.2	21%	0.209	32%	0.324	C	S	.	.			trans	-110.4	136.1	178.1	-174.4	1.8	0	0	0	111	Y183 K234 V235 A236 H240 T241	Y183-D238 PolarHBondContact OH-O 3.31Å; K234-D238 WeakPolarHBondContact CE-O 3.48Å; K234-D238 PolarHBondContact NZ-O 3.3Å; V235-D238 HydrophobicContact CB-CB 4.06Å; V235-D238 HydrophobicContact CG1-CB 4.15Å; V235-D238 PolarHBondContact O-N 3.23Å; A236-D238 PolarHBondContact O-N 3.33Å; D238-H240 WeakPolarHBondContact OD1-CA 3.49Å; D238-H240 PolarHBondContact OD1-N 3.25Å; D238-T241 PolarHBondContact OD1-N 3.47Å; D238-T241 VanDerWaalsContact OD1-N 3.08Å; D238-T241 WeakPolarHBondContact OD2-CB 3.38Å; D238-T241 PolarHBondContact OD2-N 3.46Å; D238-T241 PolarHBondContact OD2-OG1 3.05Å
239	I	97.8	Very high	97.3	Very high	83 Å²	83	65.2 Å²	65.2	43%	0.426	33%	0.334	S	S	.	.	S	Bend	trans	-125.8	1.3	172.6	61.6	168.3	0	0	0	112.5	Y182	Y182-I239 HydrophobicContact CD1-CG2 3.77Å; Y182-I239 HydrophobicContact CD2-CG2 4.06Å; Y182-I239 HydrophobicContact CE1-CG2 4.15Å; Y182-I239 HydrophobicContact CE2-CG2 4.42Å; Y182-I239 HydrophobicContact CG-CB 4.47Å; Y182-I239 HydrophobicContact CG-CG2 3.72Å
240	H	97.7	Very high	97.2	Very high	169 Å²	169	66.9 Å²	66.9	78%	0.782	35%	0.346	S	S	*	.	S	Bend	trans	-93.9	-35.9	178.8	-61.7	-49.5	0	0	0	112	D238 P242	D238-H240 WeakPolarHBondContact OD1-CA 3.49Å; D238-H240 PolarHBondContact OD1-N 3.25Å; H240-P242 WeakPolarHBondContact O-CD 3.37Å
241	T	98.2	Very high	97.1	Very high	69 Å²	69	65.6 Å²	65.6	42%	0.423	35%	0.352	S	S	.	.	S	Bend	trans	-64.7	123.9	165.8	-63.1	0	0	0	0	108.7	Y183 V235 D238 G243	Y183-T241 VanDerWaalsContact CE1-O 3.29Å; Y183-T241 WeakPolarHBondContact CE1-O 3.37Å; Y183-T241 PolarHBondContact OH-O 2.69Å; Y183-T241 VanDerWaalsContact OH-O 3.07Å; V235-T241 HydrophobicContact CG2-CG2 4.49Å; D238-T241 PolarHBondContact OD1-N 3.47Å; D238-T241 VanDerWaalsContact OD1-N 3.08Å; D238-T241 WeakPolarHBondContact OD2-CB 3.38Å; D238-T241 PolarHBondContact OD2-N 3.46Å; D238-T241 PolarHBondContact OD2-OG1 3.05Å; T241-G243 PolarHBondContact O-N 2.96Å
242	P	97.9	Very high	97	Very high	105 Å²	105	68.3 Å²	68.3	68%	0.682	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-58.8	124.4	-180	-25.3	35	0	0	0	111.7	H240	H240-P242 WeakPolarHBondContact O-CD 3.37Å
243	G	97.3	Very high	97	Very high	19 Å²	19	71.4 Å²	71.4	20%	0.196	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-64.8	148.1	174.5	0	0	0	0	0	111.9	Y183 L233 T241	Y183-G243 VanDerWaalsContact CE1-N 3.31Å; L233-G243 CarbonylContact O-C 3.4Å; L233-G243 WeakPolarHBondContact O-CA 3.41Å; T241-G243 PolarHBondContact O-N 2.96Å
244	L	98.1	Very high	97	Very high	100 Å²	100	71.5 Å²	71.5	52%	0.524	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	140.5	173.3	-60.2	-179.5	0	0	0	110.1	G232 L233	G232-L244 CarbonylContact C-O 3.57Å; G232-L244 VanDerWaalsContact CA-O 3.31Å; G232-L244 WeakPolarHBondContact CA-O 3.48Å; L233-L244 HydrophobicContact CB-CB 4.41Å; L233-L244 PolarHBondContact N-O 3.31Å; L233-L244 PolarHBondContact O-N 3.31Å
245	M	96.7	Very high	97	Very high	76 Å²	76	78 Å²	78	37%	0.374	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	115.5	172.8	176.2	-161.5	-66.2	0	0	107.2	M185 R230 L269	M185-M245 HydrophobicContact CB-CE 3.53Å; M185-M245 HydrophobicContact CE-CB 4.44Å; M185-M245 HydrophobicContact CG-CE 3.63Å; M185-M245 HydrophobicContact SD-CB 4.4Å; M185-M245 HydrophobicContact SD-CE 4.45Å; R230-M245 HydrophobicContact CB-CG 4.06Å; R230-M245 HydrophobicContact CG-CG 4.14Å; M245-L269 HydrophobicContact CE-CD1 4.18Å; M245-L269 HydrophobicContact CG-CD1 3.8Å
246	L	96.6	Very high	96.9	Very high	93 Å²	93	75.9 Å²	75.9	49%	0.487	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	131.3	-176.9	-57	171.3	0	0	0	110.1	R230 I231	R230-L246 CarbonylContact C-O 3.59Å; R230-L246 WeakPolarHBondContact CA-O 3.47Å; R230-L246 WeakPolarHBondContact CB-O 3.4Å; R230-L246 WeakPolarHBondContact CG-O 3.34Å; I231-L246 HydrophobicContact CG2-CB 3.78Å; I231-L246 HydrophobicContact CG2-CD1 4.41Å; I231-L246 PolarHBondContact N-O 3.39Å; I231-L246 PolarHBondContact O-N 2.96Å
247	P	96.6	Very high	96.8	Very high	77 Å²	77	84 Å²	84	50%	0.5	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	149.8	174.5	29.5	-34.7	0	0	0	111.2	R230	R230-P247 HydrophobicContact CG-CB 4.48Å
248	L	95.6	Very high	96.6	Very high	9 Å²	9	77.4 Å²	77.4	5%	0.047	41%	0.407	C	S	.	.			trans	-127.8	97.6	175.5	-63.7	178.2	0	0	0	109.2	N208 W229 I231 Y254	N208-L248 HydrophobicContact CB-CB 4.39Å; N208-L248 PolarHBondContact ND2-O 2.71Å; W229-L248 WeakPolarHBondContact O-CB 3.45Å; W229-L248 PolarHBondContact O-N 3.48Å; I231-L248 HydrophobicContact CB-CD1 4.09Å; I231-L248 HydrophobicContact CB-CG 4.44Å; I231-L248 HydrophobicContact CG2-CD1 4.36Å; I231-L248 HydrophobicContact CG2-CD2 4.01Å; I231-L248 HydrophobicContact CG2-CG 4.21Å; L248-Y254 HydrophobicContact CD1-CD1 4.44Å; L248-Y254 HydrophobicContact CD1-CE1 4.07Å; L248-Y254 HydrophobicContact CD2-CD1 3.74Å; L248-Y254 HydrophobicContact CD2-CE1 4.2Å
249	E	93.7	Very high	96.5	Very high	104 Å²	104	79 Å²	79	49%	0.486	42%	0.416	S	S	.	.			trans	-75.5	166	173.7	-63.6	-60.3	157.9	0	0	111.3	N208 G251 D252	N208-E249 PolarHBondContact ND2-O 3Å; E249-G251 PolarHBondContact O-N 3.01Å; E249-D252 WeakPolarHBondContact CB-OD2 3.18Å; E249-D252 PolarHBondContact N-OD2 3.25Å; E249-D252 WeakPolarHBondContact O-CB 3.34Å; E249-D252 PolarHBondContact O-N 3.21Å; E249-D252 VanDerWaalsContact O-N 3.15Å
250	S	94.3	Very high	96.5	Very high	40 Å²	40	77.2 Å²	77.2	28%	0.28	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	119.5	179.9	-156.5	0	0	0	0	111.2	Y209 S210 H212	Y209-S250 WeakPolarHBondContact CD2-OG 3.39Å; Y209-S250 WeakPolarHBondContact CE2-OG 3.44Å; S210-S250 PolarHBondContact N-OG 2.94Å; S210-S250 WeakPolarHBondContact O-CB 3.4Å; S210-S250 PolarHBondContact O-OG 3.48Å; H212-S250 WeakPolarHBondContact NE2-CB 3.37Å
251	G	95.4	Very high	96.4	Very high	33 Å²	33	69.7 Å²	69.7	34%	0.34	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.1	-6.2	-174.8	0	0	0	0	0	115.2	N208 E249	N208-G251 WeakPolarHBondContact O-CA 3.3Å; N208-G251 PolarHBondContact O-N 3.47Å; E249-G251 PolarHBondContact O-N 3.01Å
252	D	97.7	Very high	96.2	Very high	68 Å²	68	70.7 Å²	70.7	36%	0.364	38%	0.375	S	S	.	.			trans	-63.9	149.6	178.2	-82.6	-16	0	0	0	112.6	N208 E249	N208-D252 HydrophobicContact CB-CB 4.34Å; N208-D252 VanDerWaalsContact CB-O 3.24Å; N208-D252 WeakPolarHBondContact CB-O 3.42Å; N208-D252 PolarHBondContact N-O 3.4Å; E249-D252 WeakPolarHBondContact CB-OD2 3.18Å; E249-D252 PolarHBondContact N-OD2 3.25Å; E249-D252 WeakPolarHBondContact O-CB 3.34Å; E249-D252 PolarHBondContact O-N 3.21Å; E249-D252 VanDerWaalsContact O-N 3.15Å
253	C	98.3	Very high	96.2	Very high	66 Å²	66	68.1 Å²	68.1	45%	0.446	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.7	173.9	-68.1	0	0	0	0	110.5	V206 Y255	V206-C253 VanDerWaalsContact O-CA 3.27Å; V206-C253 WeakPolarHBondContact O-CA 3.38Å; C253-Y255 HydrophobicContact CB-CE2 4.02Å
254	Y	97.9	Very high	96.3	Very high	38 Å²	38	69.5 Å²	69.5	15%	0.149	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	157	168	72.9	-94.1	0	0	0	112.1	V206 I231 L248 M256	V206-Y254 HydrophobicContact CB-CD1 3.9Å; V206-Y254 HydrophobicContact CB-CD2 4.34Å; V206-Y254 HydrophobicContact CB-CE1 3.51Å; V206-Y254 HydrophobicContact CB-CE2 3.98Å; V206-Y254 HydrophobicContact CB-CG 4.3Å; V206-Y254 HydrophobicContact CG1-CD1 4.34Å; V206-Y254 HydrophobicContact CG1-CE1 3.62Å; V206-Y254 HydrophobicContact CG2-CD2 4.29Å; V206-Y254 HydrophobicContact CG2-CE1 4.02Å; V206-Y254 HydrophobicContact CG2-CE2 3.64Å; V206-Y254 VanDerWaalsContact CG2-CZ 3.48Å; V206-Y254 PolarHBondContact N-O 3.06Å; V206-Y254 PolarHBondContact O-N 2.95Å; I231-Y254 HydrophobicContact CB-CE1 4.44Å; I231-Y254 HydrophobicContact CD1-CE2 4.26Å; I231-Y254 HydrophobicContact CG1-CE1 4.42Å; I231-Y254 HydrophobicContact CG1-CE2 4.16Å; L248-Y254 HydrophobicContact CD1-CD1 4.44Å; L248-Y254 HydrophobicContact CD1-CE1 4.07Å; L248-Y254 HydrophobicContact CD2-CD1 3.74Å; L248-Y254 HydrophobicContact CD2-CE1 4.2Å; Y254-M256 HydrophobicContact CE2-CG 4.41Å
255	Y	97.6	Very high	96.3	Very high	145 Å²	145	66.4 Å²	66.4	57%	0.569	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.9	118.2	-173.2	-61.3	-91.9	0	0	0	110	V204 A205 C253	V204-Y255 CarbonylContact O-C 3.4Å; V204-Y255 WeakPolarHBondContact O-CA 3.27Å; A205-Y255 HydrophobicContact CB-CD1 3.52Å; A205-Y255 HydrophobicContact CB-CE1 3.48Å; A205-Y255 VanDerWaalsContact CB-CE1 3.48Å; C253-Y255 HydrophobicContact CB-CE2 4.02Å
256	M	96.8	Very high	96.4	Very high	10 Å²	10	63.1 Å²	63.1	5%	0.049	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	135.1	162.7	-55.4	-169.8	-65.9	0	0	107.4	D195 P203 V204 Y254 L260 H266	D195-M256 WeakPolarHBondContact OD2-CE 3.43Å; P203-M256 CarbonylContact C-O 3.56Å; P203-M256 WeakPolarHBondContact CA-O 3.38Å; P203-M256 VanDerWaalsContact CB-O 3.28Å; P203-M256 WeakPolarHBondContact CB-O 3.33Å; V204-M256 HydrophobicContact CB-CB 4.3Å; V204-M256 HydrophobicContact CB-CE 3.78Å; V204-M256 HydrophobicContact CG1-CE 3.98Å; V204-M256 HydrophobicContact CG2-CE 4.05Å; V204-M256 PolarHBondContact N-O 2.69Å; V204-M256 PolarHBondContact O-N 2.87Å; Y254-M256 HydrophobicContact CE2-CG 4.41Å; M256-L260 HydrophobicContact CB-CD2 4.04Å; M256-L260 HydrophobicContact CG-CD2 4.15Å; M256-H266 HydrophobicContact SD-CB 4.41Å
257	R	94.8	Very high	96.5	Very high	184 Å²	184	58.7 Å²	58.7	69%	0.694	30%	0.302	S	S	*	.			trans	-136	150.5	-170.5	-65.1	-173.3	62.9	-174.7	-4.2	111	P203 D259 L260	P203-R257 HydrophobicContact CB-CG 4.49Å; R257-D259 PolarHBondContact O-N 3.41Å; R257-L260 WeakPolarHBondContact O-CB 3.35Å; R257-L260 PolarHBondContact O-N 3.31Å; R257-L260 VanDerWaalsContact O-N 3.12Å
258	D	92.8	Very high	96.5	Very high	99 Å²	99	55.7 Å²	55.7	53%	0.529	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	-133.3	174.6	-146.7	-22.9	0	0	0	110.8	H201 L260	H201-D258 WeakPolarHBondContact CA-O 3.35Å; H201-D258 IonicContact CG-OD1 2.85Å; H201-D258 IonicContact ND1-OD1 3.67Å; H201-D258 PolarHBondContact ND1-OD1 2.98Å; D258-L260 VanDerWaalsContact C-N 3.26Å; D258-L260 PolarHBondContact O-N 2.85Å
259	D	94.9	Very high	96.6	Very high	72 Å²	72	55.3 Å²	55.3	39%	0.385	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	3.6	178.3	72.7	-11.2	0	0	0	115.2	R257 N261 N262 T263	R257-D259 PolarHBondContact O-N 3.41Å; D259-N261 VanDerWaalsContact C-N 3.29Å; D259-N261 PolarHBondContact O-N 3.04Å; D259-N262 WeakPolarHBondContact O-CA 3.49Å; D259-N262 WeakPolarHBondContact O-CB 3.38Å; D259-N262 PolarHBondContact O-N 3.16Å; D259-T263 HydrophobicContact CB-CG2 4.18Å; D259-T263 PolarHBondContact O-N 2.8Å; D259-T263 PolarHBondContact O-OG1 3.32Å; D259-T263 VanDerWaalsContact O-OG1 3.06Å; D259-T263 WeakPolarHBondContact OD2-CG2 3.26Å
260	L	96.8	Very high	96.8	Very high	45 Å²	45	50.9 Å²	50.9	24%	0.236	26%	0.262	C	S	.	.	H	α-helix	trans	-57.6	-40.4	-173.7	-169.1	75.8	0	0	0	112.5	M256 R257 D258 N262 T263 H264	M256-L260 HydrophobicContact CB-CD2 4.04Å; M256-L260 HydrophobicContact CG-CD2 4.15Å; R257-L260 WeakPolarHBondContact O-CB 3.35Å; R257-L260 PolarHBondContact O-N 3.31Å; R257-L260 VanDerWaalsContact O-N 3.12Å; D258-L260 VanDerWaalsContact C-N 3.26Å; D258-L260 PolarHBondContact O-N 2.85Å; L260-N262 PolarHBondContact O-N 2.75Å; L260-T263 PolarHBondContact O-N 2.77Å; L260-H264 HydrophobicContact CD1-CB 4.34Å; L260-H264 HydrophobicContact CG-CB 4.49Å; L260-H264 WeakPolarHBondContact O-CA 3.19Å; L260-H264 WeakPolarHBondContact O-CB 3.43Å; L260-H264 PolarHBondContact O-N 2.69Å
261	N	96.5	Very high	96.7	Very high	11 Å²	11	49.4 Å²	49.4	6%	0.059	25%	0.252	C	S	.	.	H	α-helix	trans	-68	-19.5	176.9	-175.7	66	0	0	0	113.3	H194 D195 D259	H194-N261 PolarHBondContact ND1-O 3.02Å; D195-N261 WeakPolarHBondContact CB-OD1 3.47Å; D195-N261 PolarHBondContact N-ND2 3.23Å; D195-N261 PolarHBondContact N-OD1 3.22Å; D195-N261 PolarHBondContact O-ND2 3.07Å; D259-N261 VanDerWaalsContact C-N 3.29Å; D259-N261 PolarHBondContact O-N 3.04Å
262	N	95	Very high	96.5	Very high	91 Å²	91	52.1 Å²	52.1	49%	0.487	26%	0.256	S	S	.	.	H	α-helix	trans	-92.3	-38.2	177.8	-63.4	-8.8	0	0	0	111.4	D259 L260	D259-N262 WeakPolarHBondContact O-CA 3.49Å; D259-N262 WeakPolarHBondContact O-CB 3.38Å; D259-N262 PolarHBondContact O-N 3.16Å; L260-N262 PolarHBondContact O-N 2.75Å
263	T	97.4	Very high	96.3	Very high	50 Å²	50	50.4 Å²	50.4	31%	0.307	25%	0.248	S	C	.	.	H	α-helix	trans	-87.6	-20.9	-175.9	56.2	0	0	0	0	113.6	A236 D259 L260	A236-T263 WeakPolarHBondContact CB-O 3.41Å; A236-T263 PolarHBondContact N-O 3.14Å; D259-T263 HydrophobicContact CB-CG2 4.18Å; D259-T263 PolarHBondContact O-N 2.8Å; D259-T263 PolarHBondContact O-OG1 3.32Å; D259-T263 VanDerWaalsContact O-OG1 3.06Å; D259-T263 WeakPolarHBondContact OD2-CG2 3.26Å; L260-T263 PolarHBondContact O-N 2.77Å
264	H	98.4	Very high	96.2	Very high	48 Å²	48	48 Å²	48	22%	0.222	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	149.6	-178.9	-63.9	65.9	0	0	0	111.1	H194 L233 K234 L260	H194-H264 PolarHBondContact CE1-O 3.25Å; H194-H264 VanDerWaalsContact CE1-O 3.28Å; H194-H264 PolarHBondContact ND1-O 2.75Å; H194-H264 VanDerWaalsContact ND1-O 3.09Å; L233-H264 HydrophobicContact CD1-CB 3.76Å; L233-H264 HydrophobicContact CG-CB 4.28Å; K234-H264 CarbonylContact O-C 3.58Å; K234-H264 WeakPolarHBondContact O-CA 3.21Å; K234-H264 WeakPolarHBondContact O-CB 3.35Å; L260-H264 HydrophobicContact CD1-CB 4.34Å; L260-H264 HydrophobicContact CG-CB 4.49Å; L260-H264 WeakPolarHBondContact O-CA 3.19Å; L260-H264 WeakPolarHBondContact O-CB 3.43Å; L260-H264 PolarHBondContact O-N 2.69Å
265	Q	98.5	Very high	96.1	Very high	35 Å²	35	46.9 Å²	46.9	16%	0.164	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	148.7	167.5	-64.3	170.6	-63	0	0	108.8	W192 H193 H194 K234 A236	W192-Q265 HydrophobicContact CE3-CB 4.14Å; W192-Q265 WeakPolarHBondContact CZ3-O 3.5Å; H193-Q265 WeakPolarHBondContact O-CA 3.49Å; H194-Q265 VanDerWaalsContact NE2-CG 3.33Å; H194-Q265 WeakPolarHBondContact NE2-CG 3.2Å; K234-Q265 HydrophobicContact CD-CB 4.29Å; K234-Q265 HydrophobicContact CG-CB 3.84Å; K234-Q265 PolarHBondContact N-O 3.45Å; K234-Q265 PolarHBondContact O-N 3.33Å; A236-Q265 HydrophobicContact CB-CG 4.34Å
266	H	98.5	Very high	96.1	Very high	8 Å²	8	44.3 Å²	44.3	4%	0.037	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	154.3	175.1	73.8	-70.4	0	0	0	111.6	W192 H193 D195 I231 G232 L233 M256	W192-H266 WeakPolarHBondContact CA-O 3.27Å; H193-H266 AromaticContact CD2-CE1 3.9Å; H193-H266 AromaticContact CE1-CD2 3.83Å; H193-H266 AromaticContact CE1-CE1 3.52Å; H193-H266 AromaticContact CE1-NE2 3.38Å; H193-H266 PolarHBondContact CE1-NE2 3.31Å; H193-H266 PolarHBondContact N-O 2.97Å; H193-H266 PolarHBondContact ND1-O 3.31Å; H193-H266 AromaticContact NE2-CE1 3.33Å; H193-H266 PolarHBondContact NE2-CE1 3.39Å; H193-H266 VanDerWaalsContact NE2-CE1 3.33Å; H193-H266 AromaticContact NE2-NE2 3.41Å; H193-H266 PolarHBondContact NE2-NE2 3.23Å; H193-H266 PolarHBondContact O-N 3.17Å; H193-H266 PolarHBondContact O-ND1 2.92Å; D195-H266 IonicContact OD1-CE1 2.92Å; D195-H266 IonicContact OD2-CE1 2.74Å; I231-H266 HydrophobicContact CD1-CB 4.14Å; G232-H266 VanDerWaalsContact O-CA 3.23Å; G232-H266 WeakPolarHBondContact O-CA 3.36Å; G232-H266 WeakPolarHBondContact O-CB 3.44Å; L233-H266 HydrophobicContact CD1-CB 4.2Å; M256-H266 HydrophobicContact SD-CB 4.41Å
267	C	98.4	Very high	96.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	153.2	175.9	72.6	0	0	0	0	110.6	M188 V190 W192 I231 G232	M188-C267 HydrophobicContact SD-CB 4.19Å; V190-C267 WeakPolarHBondContact O-CB 3.48Å; W192-C267 HydrophobicContact CD2-CB 3.74Å; W192-C267 HydrophobicContact CE3-CB 3.66Å; W192-C267 HydrophobicContact CG-CB 4.21Å; W192-C267 HydrophobicContact CH2-CB 4.49Å; W192-C267 VanDerWaalsContact CH2-SG 3.56Å; W192-C267 VanDerWaalsContact CZ2-SG 3.59Å; W192-C267 HydrophobicContact CZ3-CB 4.06Å; I231-C267 WeakPolarHBondContact CD1-O 3.33Å; G232-C267 PolarHBondContact N-O 2.79Å; G232-C267 PolarHBondContact O-N 2.98Å
268	V	98.3	Very high	96.4	Very high	14 Å²	14	36.4 Å²	36.4	9%	0.085	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	117.1	176.8	-179.8	0	0	0	0	108.7	M188 A189 V190 W229	M188-V268 CarbonylContact C-O 3.55Å; M188-V268 WeakPolarHBondContact CA-O 3.43Å; A189-V268 HydrophobicContact CB-CB 4.32Å; A189-V268 HydrophobicContact CB-CG1 3.99Å; A189-V268 PolarHBondContact N-O 3.34Å; V190-V268 HydrophobicContact CB-CB 3.96Å; V190-V268 HydrophobicContact CB-CG2 4.03Å; V190-V268 HydrophobicContact CG2-CB 4.09Å; V190-V268 HydrophobicContact CG2-CG2 4.09Å; V190-V268 PolarHBondContact N-O 3.06Å; V190-V268 PolarHBondContact O-N 3.48Å; W229-V268 HydrophobicContact CE3-CG1 3.95Å; W229-V268 HydrophobicContact CZ3-CG1 3.74Å
269	L	97.7	Very high	96.7	Very high	1 Å²	1	32 Å²	32	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.5	179	-61.1	164.9	0	0	0	109.4	E180 M185 K187 M188 W229 R230 M245	E180-L269 HydrophobicContact CB-CD2 4.29Å; M185-L269 HydrophobicContact CB-CD1 3.78Å; M185-L269 HydrophobicContact CB-CD2 3.63Å; M185-L269 HydrophobicContact CB-CG 4.36Å; M185-L269 HydrophobicContact CG-CD1 4.41Å; M185-L269 HydrophobicContact SD-CD1 4.03Å; K187-L269 CarbonylContact O-C 3.57Å; K187-L269 WeakPolarHBondContact O-CA 3.41Å; M188-L269 HydrophobicContact CG-CD2 4.05Å; W229-L269 VanDerWaalsContact CE3-O 3.26Å; R230-L269 HydrophobicContact CB-CB 3.94Å; R230-L269 HydrophobicContact CB-CD1 3.96Å; R230-L269 PolarHBondContact N-O 2.69Å; R230-L269 VanDerWaalsContact N-O 3.14Å; R230-L269 PolarHBondContact O-N 2.95Å; M245-L269 HydrophobicContact CE-CD1 4.18Å; M245-L269 HydrophobicContact CG-CD1 3.8Å
270	A	96.4	Very high	96.8	Very high	11 Å²	11	31.7 Å²	31.7	9%	0.091	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-71	137.9	-175	0	0	0	0	0	111.8	M169 L177 K187 A189 W229	M169-A270 HydrophobicContact CE-CB 3.99Å; L177-A270 HydrophobicContact CD1-CB 3.59Å; K187-A270 HydrophobicContact CB-CB 4.45Å; K187-A270 PolarHBondContact O-N 3.19Å; A189-A270 HydrophobicContact CB-CB 4.34Å; W229-A270 HydrophobicContact CH2-CB 4.42Å; W229-A270 HydrophobicContact CZ3-CB 4.39Å
271	G	93.8	Very high	96.9	Very high	8 Å²	8	31.2 Å²	31.2	8%	0.082	16%	0.162	C	C	.	.			trans	-91	-165.8	163.6	0	0	0	0	0	111.8	P171 A227 W229	P171-G271 WeakPolarHBondContact CG-O 3.27Å; A227-G271 CarbonylContact O-C 3.56Å; A227-G271 WeakPolarHBondContact O-CA 3.42Å; W229-G271 VanDerWaalsContact CD2-N 3.32Å
272	E	90.9	Very high	96.9	Very high	91 Å²	91	31.4 Å²	31.4	43%	0.425	16%	0.164	S	C	.	.	S	Bend	trans	-88.8	-29.5	174.7	-81.3	167.3	-143.5	0	0	114.3	K226 A227	K226-E272 WeakPolarHBondContact CA-OE1 3.17Å; K226-E272 WeakPolarHBondContact CB-OE2 3.28Å; K226-E272 VanDerWaalsContact CG-OE2 3.3Å; K226-E272 WeakPolarHBondContact CG-OE2 3.29Å; A227-E272 HydrophobicContact CB-CG 4.15Å; A227-E272 PolarHBondContact N-OE1 3.2Å; A227-E272 PolarHBondContact O-N 3.15Å
273	T	93.3	Very high	96.9	Very high	32 Å²	32	28 Å²	28	20%	0.196	15%	0.148	C	C	.	.	S	Bend	trans	-95.1	161.2	-175.7	64.7	0	0	0	0	112.3	P171 C211 W229	P171-T273 VanDerWaalsContact CD-O 3.29Å; P171-T273 WeakPolarHBondContact CD-O 3.27Å; C211-T273 WeakPolarHBondContact O-CB 3.47Å; C211-T273 PolarHBondContact O-OG1 3.16Å; W229-T273 PolarHBondContact NE1-O 3.42Å
274	A	95.5	Very high	96.8	Very high	16 Å²	16	27.8 Å²	27.8	13%	0.132	14%	0.144	C	C	.	.			trans	-61.2	148.9	170.6	0	0	0	0	0	111.7	Y168 M169 D170 C211	Y168-A274 HydrophobicContact CE2-CB 4.04Å; M169-A274 WeakPolarHBondContact O-CA 3.48Å; D170-A274 HydrophobicContact CB-CB 4.02Å; C211-A274 HydrophobicContact CB-CB 4.41Å; C211-A274 VanDerWaalsContact CB-O 3.32Å; C211-A274 WeakPolarHBondContact CB-O 3.47Å; C211-A274 PolarHBondContact N-O 3.36Å
275	R	96.4	Very high	96.5	Very high	14 Å²	14	27.7 Å²	27.7	5%	0.053	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	145.1	-176.9	171.4	-176.5	179.9	-118.3	5.9	112	Y168 M169 N208 Y209 W229	Y168-R275 WeakPolarHBondContact CA-O 3.31Å; Y168-R275 VanDerWaalsContact CD2-O 3.3Å; Y168-R275 WeakPolarHBondContact CD2-O 3.33Å; M169-R275 PolarHBondContact N-O 2.86Å; M169-R275 PolarHBondContact O-N 3.5Å; N208-R275 VanDerWaalsContact OD1-CZ 3.23Å; N208-R275 PolarHBondContact OD1-NE 3.2Å; N208-R275 PolarHBondContact OD1-NH2 3.05Å; Y209-R275 WeakPolarHBondContact O-CA 3.28Å; W229-R275 HydrophobicContact CD2-CB 3.94Å; W229-R275 HydrophobicContact CD2-CG 4.17Å; W229-R275 VanDerWaalsContact CE2-CB 3.4Å; W229-R275 HydrophobicContact CG-CB 4.32Å; W229-R275 HydrophobicContact CG-CG 4.44Å; W229-R275 HydrophobicContact CH2-CB 4.16Å; W229-R275 HydrophobicContact CZ2-CB 3.54Å; W229-R275 HydrophobicContact CZ2-CG 4.44Å
276	F	98.2	Very high	96.3	Very high	91 Å²	91	29.5 Å²	29.5	40%	0.399	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	153.7	161.4	-63.6	-95.7	0	0	0	111.1	N167 Y168 Y209	N167-F276 CarbonylContact O-C 3.49Å; N167-F276 VanDerWaalsContact O-CA 3.27Å; N167-F276 WeakPolarHBondContact O-CA 3.41Å; Y168-F276 AromaticContact CD2-CD1 3.72Å; Y168-F276 HydrophobicContact CD2-CD1 3.72Å; Y168-F276 AromaticContact CD2-CD2 3.86Å; Y168-F276 HydrophobicContact CD2-CD2 3.86Å; Y168-F276 AromaticContact CD2-CE1 3.36Å; Y168-F276 HydrophobicContact CD2-CE1 3.36Å; Y168-F276 AromaticContact CD2-CE2 3.51Å; Y168-F276 HydrophobicContact CD2-CE2 3.51Å; Y168-F276 AromaticContact CD2-CG 3.96Å; Y168-F276 HydrophobicContact CD2-CG 3.96Å; Y168-F276 AromaticContact CD2-CZ 3.25Å; Y168-F276 HydrophobicContact CD2-CZ 3.25Å; Y168-F276 HydrophobicContact CE2-CD2 4.28Å; Y168-F276 HydrophobicContact CE2-CE1 4.12Å; Y168-F276 AromaticContact CE2-CE2 3.61Å; Y168-F276 HydrophobicContact CE2-CE2 3.61Å; Y168-F276 AromaticContact CE2-CZ 3.53Å; Y168-F276 HydrophobicContact CE2-CZ 3.53Å; Y168-F276 HydrophobicContact CG-CD1 4.16Å; Y168-F276 AromaticContact CG-CE1 3.76Å; Y168-F276 HydrophobicContact CG-CE1 3.76Å; Y168-F276 HydrophobicContact CG-CZ 4.03Å; Y209-F276 HydrophobicContact CD1-CB 4.33Å; Y209-F276 AromaticContact CD1-CD2 3.96Å; Y209-F276 HydrophobicContact CD1-CD2 3.96Å; Y209-F276 HydrophobicContact CE1-CD2 4.43Å; Y209-F276 PolarHBondContact N-O 3.34Å; Y209-F276 PolarHBondContact O-N 2.87Å
277	S	98.3	Very high	96.1	Very high	6 Å²	6	35.3 Å²	35.3	4%	0.042	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	141.9	164.2	68.3	0	0	0	0	111.3	L166 N167 Y207	L166-S277 WeakPolarHBondContact CA-O 3.14Å; N167-S277 WeakPolarHBondContact CB-OG 3.44Å; N167-S277 PolarHBondContact N-O 3.36Å; N167-S277 PolarHBondContact ND2-OG 2.88Å; N167-S277 VanDerWaalsContact ND2-OG 3.16Å; N167-S277 PolarHBondContact O-N 3.34Å; Y207-S277 CarbonylContact O-C 3.58Å; Y207-S277 VanDerWaalsContact O-CA 3.23Å; Y207-S277 WeakPolarHBondContact O-CA 3.31Å
278	S	98.7	Very high	95.9	Very high	21 Å²	21	37.6 Å²	37.6	15%	0.147	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	108.9	169.1	179.8	0	0	0	0	109.1	T164 V206 Y207 H280	T164-S278 PolarHBondContact OG1-OG 3.06Å; V206-S278 WeakPolarHBondContact CA-O 3.49Å; Y207-S278 PolarHBondContact N-O 3.45Å; Y207-S278 PolarHBondContact O-N 3.2Å; S278-H280 PolarHBondContact O-CD2 3.15Å; S278-H280 PolarHBondContact OG-CD2 3.14Å; S278-H280 PolarHBondContact OG-NE2 3.33Å
279	T	98.5	Very high	95.9	Very high	7 Å²	7	39.4 Å²	39.4	4%	0.043	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	93.8	-177.4	-58.8	0	0	0	0	110	T164 L165 V204 V206 R281	T164-T279 VanDerWaalsContact CA-O 3.31Å; T164-T279 WeakPolarHBondContact CA-O 3.47Å; T164-T279 PolarHBondContact OG1-N 2.83Å; T164-T279 PolarHBondContact OG1-O 3.01Å; L165-T279 PolarHBondContact N-O 2.76Å; L165-T279 WeakPolarHBondContact O-CB 3.49Å; L165-T279 PolarHBondContact O-N 3.32Å; V204-T279 HydrophobicContact CG1-CG2 3.59Å; V206-T279 HydrophobicContact CG2-CG2 3.91Å; T279-R281 HydrophobicContact CG2-CG 4.26Å
280	H	98.5	Very high	95.9	Very high	65 Å²	65	40.3 Å²	40.3	30%	0.301	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	128.4	-179.9	-61.5	-100.3	0	0	0	110.9	F161 A205 S278	F161-H280 HydrophobicContact CB-CB 4.2Å; F161-H280 HydrophobicContact CD1-CB 3.77Å; F161-H280 HydrophobicContact CD2-CB 4.17Å; F161-H280 HydrophobicContact CE1-CB 4.12Å; F161-H280 WeakPolarHBondContact CE1-O 3.45Å; F161-H280 HydrophobicContact CG-CB 3.79Å; F161-H280 HydrophobicContact CZ-CB 4.49Å; A205-H280 HydrophobicContact CB-CB 4.33Å; A205-H280 PolarHBondContact N-O 3.36Å; A205-H280 VanDerWaalsContact N-O 3.08Å; A205-H280 WeakPolarHBondContact O-CB 3.5Å; A205-H280 PolarHBondContact O-N 3.24Å; S278-H280 PolarHBondContact O-CD2 3.15Å; S278-H280 PolarHBondContact OG-CD2 3.14Å; S278-H280 PolarHBondContact OG-NE2 3.33Å
281	R	98	Very high	96	Very high	35 Å²	35	45.1 Å²	45.1	13%	0.132	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	155.9	-171.4	-65.3	170.2	-172.7	-104.6	-14.1	111.2	F161 N162 V163 D195 L198 V204 T279	F161-R281 VanDerWaalsContact CA-O 3.31Å; F161-R281 WeakPolarHBondContact CA-O 3.35Å; N162-R281 PolarHBondContact N-O 3.1Å; N162-R281 VanDerWaalsContact N-O 3.11Å; N162-R281 PolarHBondContact OD1-O 3.07Å; N162-R281 VanDerWaalsContact OD1-O 3.1Å; V163-R281 HydrophobicContact CG2-CB 3.95Å; V163-R281 PolarHBondContact O-N 3.48Å; D195-R281 VanDerWaalsContact CG-NH2 3.33Å; D195-R281 IonicContact OD1-CZ 2.68Å; D195-R281 IonicContact OD1-NH1 3.8Å; D195-R281 PolarHBondContact OD1-NH1 2.77Å; D195-R281 IonicContact OD1-NH2 2.76Å; D195-R281 PolarHBondContact OD1-NH2 2.77Å; D195-R281 IonicContact OD2-CZ 3.45Å; D195-R281 IonicContact OD2-NH1 3.12Å; D195-R281 IonicContact OD2-NH2 3.58Å; D195-R281 PolarHBondContact OD2-NH2 2.91Å; L198-R281 HydrophobicContact CD2-CB 3.72Å; L198-R281 HydrophobicContact CD2-CG 3.96Å; V204-R281 HydrophobicContact CG1-CG 4.46Å; T279-R281 HydrophobicContact CG2-CG 4.26Å
282	V	96.6	Very high	96.2	Very high	16 Å²	16	47.1 Å²	47.1	10%	0.097	26%	0.263	C	S	.	.			trans	-106.5	83.7	163.7	-166.3	0	0	0	0	106.9	V159 F161 N162 I199	V159-V282 HydrophobicContact CG1-CG2 4.34Å; F161-V282 HydrophobicContact CD1-CG2 4Å; F161-V282 HydrophobicContact CE1-CG2 4.41Å; N162-V282 WeakPolarHBondContact OD1-CA 3.42Å; I199-V282 HydrophobicContact CB-CB 4.4Å; I199-V282 HydrophobicContact CB-CG1 4.08Å; I199-V282 HydrophobicContact CG1-CB 4.42Å; I199-V282 HydrophobicContact CG1-CG1 3.72Å; I199-V282 PolarHBondContact N-O 3.09Å
283	A	95.4	Very high	96.6	Very high	18 Å²	18	42.8 Å²	42.8	15%	0.149	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-64.8	139.5	-178.9	0	0	0	0	0	111.1	N162 V163 N197 C285	N162-A283 PolarHBondContact ND2-O 3.18Å; N162-A283 PolarHBondContact OD1-N 2.78Å; V163-A283 HydrophobicContact CG2-CB 3.99Å; N197-A283 CarbonylContact O-C 3.59Å; N197-A283 VanDerWaalsContact O-CA 3.24Å; N197-A283 WeakPolarHBondContact O-CA 3.46Å; A283-C285 VanDerWaalsContact C-N 3.28Å; A283-C285 PolarHBondContact O-N 2.73Å
284	E	94.3	Very high	96.9	Very high	47 Å²	47	44.8 Å²	44.8	22%	0.22	25%	0.249	C	C	.	.			trans	-74.9	82.2	173.3	173.7	48.8	-85.7	0	0	109.4	N197 I199 S286	N197-E284 PolarHBondContact O-N 2.87Å; N197-E284 PolarHBondContact OD1-O 2.81Å; N197-E284 VanDerWaalsContact OD1-O 3.11Å; I199-E284 HydrophobicContact CD1-CB 4.16Å; I199-E284 HydrophobicContact CD1-CG 4.47Å; I199-E284 VanDerWaalsContact CD1-OE2 3.26Å; I199-E284 WeakPolarHBondContact CD1-OE2 3.46Å; I199-E284 HydrophobicContact CG1-CB 4.49Å; E284-S286 WeakPolarHBondContact OE1-CB 3.45Å; E284-S286 PolarHBondContact OE1-N 2.62Å; E284-S286 PolarHBondContact OE1-OG 2.93Å
285	C	93.3	Very high	97	Very high	46 Å²	46	46.8 Å²	46.8	31%	0.311	26%	0.262	S	S	.	.			trans	-97.1	17.8	-173.4	71.5	0	0	0	0	113.8	A283 K287 G288 T289	A283-C285 VanDerWaalsContact C-N 3.28Å; A283-C285 PolarHBondContact O-N 2.73Å; C285-K287 PolarHBondContact O-N 3.28Å; C285-G288 PolarHBondContact O-N 2.84Å; C285-G288 VanDerWaalsContact O-N 3.11Å; C285-T289 HydrophobicContact CB-CG2 3.95Å; C285-T289 WeakPolarHBondContact O-CG2 3.36Å
286	S	93.6	Very high	97.1	Very high	72 Å²	72	47.3 Å²	47.3	50%	0.503	27%	0.265	S	S	.	.	S	Bend	trans	-54.3	-37.4	177.6	52.3	0	0	0	0	113.3	E284	E284-S286 WeakPolarHBondContact OE1-CB 3.45Å; E284-S286 PolarHBondContact OE1-N 2.62Å; E284-S286 PolarHBondContact OE1-OG 2.93Å
287	K	94.3	Very high	97.1	Very high	131 Å²	131	43 Å²	43	57%	0.57	25%	0.246	S	C	*	.	S	Bend	trans	-105.8	-7.9	170.2	-59	-167.2	177.1	-170.8	0	114.5	C285 T289 Y292	C285-K287 PolarHBondContact O-N 3.28Å; K287-T289 PolarHBondContact O-N 3.1Å; K287-Y292 HydrophobicContact CB-CD1 4.08Å; K287-Y292 HydrophobicContact CB-CE1 3.62Å; K287-Y292 HydrophobicContact CD-CE1 4.43Å; K287-Y292 HydrophobicContact CG-CE1 3.95Å; K287-Y292 HydrophobicContact CG-CE2 4.19Å; K287-Y292 WeakPolarHBondContact O-CD1 3.48Å; K287-Y292 WeakPolarHBondContact O-CE1 3.18Å
288	G	95	Very high	97.1	Very high	48 Å²	48	48.8 Å²	48.8	50%	0.495	27%	0.272	S	S	.	.	S	Bend	trans	-95.9	31.1	-172.3	0	0	0	0	0	115.3	C285	C285-G288 PolarHBondContact O-N 2.84Å; C285-G288 VanDerWaalsContact O-N 3.11Å
289	T	97.8	Very high	97.1	Very high	51 Å²	51	51.3 Å²	51.3	31%	0.313	28%	0.282	S	S	.	.	S	Bend	trans	-125.9	147.6	-179.3	58.6	0	0	0	0	112.8	C285 K287 T291 Y292 I293 W337	C285-T289 HydrophobicContact CB-CG2 3.95Å; C285-T289 WeakPolarHBondContact O-CG2 3.36Å; K287-T289 PolarHBondContact O-N 3.1Å; T289-T291 VanDerWaalsContact C-N 3.25Å; T289-T291 PolarHBondContact O-N 3.32Å; T289-Y292 WeakPolarHBondContact O-CB 3.28Å; T289-Y292 PolarHBondContact O-N 3.24Å; T289-Y292 WeakPolarHBondContact OG1-CB 3.45Å; T289-Y292 PolarHBondContact OG1-N 3.4Å; T289-I293 PolarHBondContact O-N 3.18Å; T289-W337 WeakPolarHBondContact O-CH2 3.41Å
290	L	98.1	Very high	97.1	Very high	20 Å²	20	51 Å²	51	11%	0.105	28%	0.28	C	S	.	.	H	α-helix	trans	-56.3	-41.4	179.3	179.3	62.5	0	0	0	111.9	Y292 I293 Q294 W354 W355 P358 L362	L290-Y292 VanDerWaalsContact C-N 3.28Å; L290-Y292 PolarHBondContact O-N 2.88Å; L290-I293 HydrophobicContact CD1-CG2 4.2Å; L290-I293 WeakPolarHBondContact O-CG2 3.37Å; L290-I293 PolarHBondContact O-N 3.41Å; L290-Q294 HydrophobicContact CD1-CG 3.9Å; L290-Q294 HydrophobicContact CG-CG 4.2Å; L290-Q294 WeakPolarHBondContact O-CB 3.38Å; L290-Q294 VanDerWaalsContact O-CG 3.28Å; L290-Q294 WeakPolarHBondContact O-CG 3.46Å; L290-Q294 PolarHBondContact O-N 2.78Å; L290-W354 HydrophobicContact CB-CH2 4.31Å; L290-W354 HydrophobicContact CD2-CH2 3.51Å; L290-W354 HydrophobicContact CD2-CZ2 4.39Å; L290-W354 HydrophobicContact CD2-CZ3 3.92Å; L290-W355 HydrophobicContact CB-CZ3 4.32Å; L290-W355 HydrophobicContact CD1-CZ3 4.49Å; L290-P358 HydrophobicContact CD1-CB 3.82Å; L290-P358 HydrophobicContact CD2-CB 3.65Å; L290-P358 HydrophobicContact CD2-CG 3.63Å; L290-P358 HydrophobicContact CG-CB 4.41Å; L290-L362 HydrophobicContact CD1-CD1 4.23Å
291	T	98.1	Very high	97.1	Very high	112 Å²	112	49.1 Å²	49.1	69%	0.687	27%	0.272	S	S	*	.	H	α-helix	trans	-61.6	-36.4	177.4	-50.2	0	0	0	0	112.4	T289 S295	T289-T291 VanDerWaalsContact C-N 3.25Å; T289-T291 PolarHBondContact O-N 3.32Å; T291-S295 PolarHBondContact O-N 3.13Å; T291-S295 VanDerWaalsContact O-N 3.15Å
292	Y	98.4	Very high	97.1	Very high	51 Å²	51	51.5 Å²	51.5	20%	0.2	29%	0.294	C	S	.	.	H	α-helix	trans	-63.4	-59.9	174.7	170.1	-98.8	0	0	0	110.4	K287 T289 L290 Q294 S295 R296 E332	K287-Y292 HydrophobicContact CB-CD1 4.08Å; K287-Y292 HydrophobicContact CB-CE1 3.62Å; K287-Y292 HydrophobicContact CD-CE1 4.43Å; K287-Y292 HydrophobicContact CG-CE1 3.95Å; K287-Y292 HydrophobicContact CG-CE2 4.19Å; K287-Y292 WeakPolarHBondContact O-CD1 3.48Å; K287-Y292 WeakPolarHBondContact O-CE1 3.18Å; T289-Y292 WeakPolarHBondContact O-CB 3.28Å; T289-Y292 PolarHBondContact O-N 3.24Å; T289-Y292 WeakPolarHBondContact OG1-CB 3.45Å; T289-Y292 PolarHBondContact OG1-N 3.4Å; L290-Y292 VanDerWaalsContact C-N 3.28Å; L290-Y292 PolarHBondContact O-N 2.88Å; Y292-Q294 VanDerWaalsContact C-N 3.26Å; Y292-Q294 PolarHBondContact O-N 3.18Å; Y292-S295 WeakPolarHBondContact O-CA 3.24Å; Y292-S295 VanDerWaalsContact O-CB 3.27Å; Y292-S295 WeakPolarHBondContact O-CB 3.38Å; Y292-S295 PolarHBondContact O-N 3.23Å; Y292-R296 HydrophobicContact CD1-CG 4.09Å; Y292-R296 HydrophobicContact CD2-CG 4.38Å; Y292-R296 HydrophobicContact CE1-CG 3.73Å; Y292-R296 HydrophobicContact CE2-CG 4.01Å; Y292-R296 HydrophobicContact CG-CG 4.42Å; Y292-R296 WeakPolarHBondContact O-CG 3.37Å; Y292-R296 PolarHBondContact O-N 3.39Å; Y292-E332 WeakPolarHBondContact CE1-OE1 3.25Å; Y292-E332 PolarHBondContact OH-OE1 2.88Å
293	I	98.6	Very high	97.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63	-32.9	-175.9	-170.8	64.8	0	0	0	112.5	T289 L290 S295 R296 C297 E332 V333 W337 L362	T289-I293 PolarHBondContact O-N 3.18Å; L290-I293 HydrophobicContact CD1-CG2 4.2Å; L290-I293 WeakPolarHBondContact O-CG2 3.37Å; L290-I293 PolarHBondContact O-N 3.41Å; I293-S295 VanDerWaalsContact C-N 3.34Å; I293-S295 PolarHBondContact O-N 2.97Å; I293-R296 HydrophobicContact CD1-CB 4.23Å; I293-R296 WeakPolarHBondContact O-CB 3.33Å; I293-R296 PolarHBondContact O-N 2.85Å; I293-C297 PolarHBondContact O-N 2.91Å; I293-C297 PolarHBondContact O-SG 2.92Å; I293-E332 HydrophobicContact CD1-CG 3.98Å; I293-V333 HydrophobicContact CD1-CB 4.05Å; I293-V333 HydrophobicContact CD1-CG2 4.41Å; I293-V333 HydrophobicContact CG1-CB 4.38Å; I293-V333 HydrophobicContact CG1-CG2 4.18Å; I293-W337 HydrophobicContact CB-CD2 3.96Å; I293-W337 HydrophobicContact CB-CG 4.34Å; I293-W337 HydrophobicContact CB-CZ2 3.83Å; I293-W337 HydrophobicContact CD1-CG 4.36Å; I293-W337 HydrophobicContact CG1-CD2 4Å; I293-W337 HydrophobicContact CG1-CG 3.85Å; I293-W337 HydrophobicContact CG2-CD2 3.65Å; I293-W337 HydrophobicContact CG2-CE3 3.8Å; I293-W337 HydrophobicContact CG2-CG 4.35Å; I293-W337 HydrophobicContact CG2-CH2 3.88Å; I293-W337 HydrophobicContact CG2-CZ2 3.68Å; I293-W337 HydrophobicContact CG2-CZ3 3.91Å; I293-L362 HydrophobicContact CG1-CD2 4.1Å; I293-L362 HydrophobicContact CG2-CD1 4.08Å; I293-L362 HydrophobicContact CG2-CD2 4.05Å
294	Q	98.4	Very high	97.3	Very high	73 Å²	73	51.4 Å²	51.4	34%	0.341	29%	0.29	S	S	.	.	H	α-helix	trans	-65.9	-35.3	173.2	-74.4	-179.9	-29.8	0	0	112.5	L290 Y292 Q298 L362	L290-Q294 HydrophobicContact CD1-CG 3.9Å; L290-Q294 HydrophobicContact CG-CG 4.2Å; L290-Q294 WeakPolarHBondContact O-CB 3.38Å; L290-Q294 VanDerWaalsContact O-CG 3.28Å; L290-Q294 WeakPolarHBondContact O-CG 3.46Å; L290-Q294 PolarHBondContact O-N 2.78Å; Y292-Q294 VanDerWaalsContact C-N 3.26Å; Y292-Q294 PolarHBondContact O-N 3.18Å; Q294-Q298 WeakPolarHBondContact O-CB 3.23Å; Q294-Q298 PolarHBondContact O-N 2.72Å; Q294-L362 HydrophobicContact CG-CD2 4.28Å
295	S	98.5	Very high	97.4	Very high	58 Å²	58	53.2 Å²	53.2	41%	0.406	30%	0.298	S	S	.	.	H	α-helix	trans	-63.4	-48.2	170.1	-166.5	0	0	0	0	110.9	T291 Y292 I293 C297 Q298 E299	T291-S295 PolarHBondContact O-N 3.13Å; T291-S295 VanDerWaalsContact O-N 3.15Å; Y292-S295 WeakPolarHBondContact O-CA 3.24Å; Y292-S295 VanDerWaalsContact O-CB 3.27Å; Y292-S295 WeakPolarHBondContact O-CB 3.38Å; Y292-S295 PolarHBondContact O-N 3.23Å; I293-S295 VanDerWaalsContact C-N 3.34Å; I293-S295 PolarHBondContact O-N 2.97Å; S295-C297 PolarHBondContact O-N 2.74Å; S295-Q298 CarbonylContact O-C 3.56Å; S295-Q298 PolarHBondContact O-N 3.5Å; S295-Q298 VanDerWaalsContact O-N 3.11Å; S295-E299 WeakPolarHBondContact CB-OE1 3.4Å; S295-E299 VanDerWaalsContact O-CG 3.25Å; S295-E299 WeakPolarHBondContact O-CG 3.47Å; S295-E299 PolarHBondContact O-N 3.24Å; S295-E299 PolarHBondContact OG-OE1 3.17Å
296	R	98.6	Very high	97.5	Very high	26 Å²	26	54.3 Å²	54.3	10%	0.098	30%	0.304	C	S	.	.	H	α-helix	trans	-55.5	-50.5	176.7	-57.5	-65.8	-71.6	134.3	1.1	111.2	Y292 I293 Q298 E299 A300 H325 I329 E332	Y292-R296 HydrophobicContact CD1-CG 4.09Å; Y292-R296 HydrophobicContact CD2-CG 4.38Å; Y292-R296 HydrophobicContact CE1-CG 3.73Å; Y292-R296 HydrophobicContact CE2-CG 4.01Å; Y292-R296 HydrophobicContact CG-CG 4.42Å; Y292-R296 WeakPolarHBondContact O-CG 3.37Å; Y292-R296 PolarHBondContact O-N 3.39Å; I293-R296 HydrophobicContact CD1-CB 4.23Å; I293-R296 WeakPolarHBondContact O-CB 3.33Å; I293-R296 PolarHBondContact O-N 2.85Å; R296-Q298 VanDerWaalsContact C-N 3.31Å; R296-Q298 PolarHBondContact O-N 3.24Å; R296-E299 IonicContact CZ-OE2 2.79Å; R296-E299 IonicContact NH1-OE2 3.95Å; R296-E299 PolarHBondContact NH1-OE2 2.89Å; R296-E299 WeakPolarHBondContact O-CB 3.41Å; R296-E299 PolarHBondContact O-N 3.39Å; R296-E299 VanDerWaalsContact O-N 3.13Å; R296-A300 PolarHBondContact O-N 3.4Å; R296-H325 PolarHBondContact NH1-CE1 3.11Å; R296-H325 PolarHBondContact NH1-NE2 2.92Å; R296-H325 PolarHBondContact NH2-CE1 3.02Å; R296-I329 HydrophobicContact CB-CG1 4.38Å; R296-I329 HydrophobicContact CB-CG2 4.11Å; R296-I329 VanDerWaalsContact CZ-CG1 3.41Å; R296-I329 WeakPolarHBondContact O-CG2 3.04Å; R296-E332 IonicContact CZ-OE2 3.12Å; R296-E332 IonicContact NE-OE2 3.4Å; R296-E332 PolarHBondContact NE-OE2 2.71Å; R296-E332 IonicContact NH2-OE2 2.76Å; R296-E332 PolarHBondContact NH2-OE2 2.8Å
297	C	98.7	Very high	97.6	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-57.8	-44	176.3	-67.6	0	0	0	0	111.9	I293 S295 E299 A300 L301 D365 M369	I293-C297 PolarHBondContact O-N 2.91Å; I293-C297 PolarHBondContact O-SG 2.92Å; S295-C297 PolarHBondContact O-N 2.74Å; C297-E299 VanDerWaalsContact C-N 3.34Å; C297-E299 PolarHBondContact O-N 2.92Å; C297-A300 PolarHBondContact O-N 2.98Å; C297-L301 WeakPolarHBondContact O-CB 3.42Å; C297-L301 WeakPolarHBondContact O-CG 3.49Å; C297-L301 PolarHBondContact O-N 2.97Å; C297-D365 HydrophobicContact CB-CB 4.08Å; C297-M369 HydrophobicContact CB-CE 3.79Å
298	Q	98.3	Very high	97.5	Very high	127 Å²	127	52.4 Å²	52.4	59%	0.593	30%	0.3	S	S	*	.	H	α-helix	trans	-67.8	-31.8	178	-174.2	58.3	90.8	0	0	113	Q294 S295 R296 S302	Q294-Q298 WeakPolarHBondContact O-CB 3.23Å; Q294-Q298 PolarHBondContact O-N 2.72Å; S295-Q298 CarbonylContact O-C 3.56Å; S295-Q298 PolarHBondContact O-N 3.5Å; S295-Q298 VanDerWaalsContact O-N 3.11Å; R296-Q298 VanDerWaalsContact C-N 3.31Å; R296-Q298 PolarHBondContact O-N 3.24Å; Q298-S302 PolarHBondContact O-N 3.13Å; Q298-S302 VanDerWaalsContact O-N 3.11Å
299	E	98.1	Very high	97.4	Very high	75 Å²	75	58.5 Å²	58.5	35%	0.35	32%	0.316	S	S	.	.	H	α-helix	trans	-63.6	-51	172.4	-71	150.7	-147.2	0	0	110.6	S295 R296 C297 S302 I329	S295-E299 WeakPolarHBondContact CB-OE1 3.4Å; S295-E299 VanDerWaalsContact O-CG 3.25Å; S295-E299 WeakPolarHBondContact O-CG 3.47Å; S295-E299 PolarHBondContact O-N 3.24Å; S295-E299 PolarHBondContact OG-OE1 3.17Å; R296-E299 IonicContact CZ-OE2 2.79Å; R296-E299 IonicContact NH1-OE2 3.95Å; R296-E299 PolarHBondContact NH1-OE2 2.89Å; R296-E299 WeakPolarHBondContact O-CB 3.41Å; R296-E299 PolarHBondContact O-N 3.39Å; R296-E299 VanDerWaalsContact O-N 3.13Å; C297-E299 VanDerWaalsContact C-N 3.34Å; C297-E299 PolarHBondContact O-N 2.92Å; E299-S302 WeakPolarHBondContact O-CB 3.36Å; E299-S302 PolarHBondContact O-N 3.34Å; E299-S302 PolarHBondContact O-OG 3.05Å; E299-I329 HydrophobicContact CB-CD1 4.37Å
300	A	98.4	Very high	97.2	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.008	33%	0.33	C	S	.	.	H	α-helix	trans	-60.7	-50.7	175.9	0	0	0	0	0	112	R296 C297 S302 N303 C326 I329 M369 M372	R296-A300 PolarHBondContact O-N 3.4Å; C297-A300 PolarHBondContact O-N 2.98Å; A300-S302 PolarHBondContact O-N 3.43Å; A300-S302 VanDerWaalsContact O-N 3.09Å; A300-N303 WeakPolarHBondContact O-CB 2.97Å; A300-N303 PolarHBondContact O-N 2.95Å; A300-C326 HydrophobicContact CB-CB 4.48Å; A300-I329 HydrophobicContact CB-CB 3.99Å; A300-I329 HydrophobicContact CB-CD1 3.73Å; A300-I329 HydrophobicContact CB-CG1 4.46Å; A300-I329 HydrophobicContact CB-CG2 3.75Å; A300-M369 HydrophobicContact CB-CE 4.08Å; A300-M369 HydrophobicContact CB-SD 4.31Å; A300-M372 WeakPolarHBondContact O-CE 3.1Å
301	L	98.4	Very high	96.8	Very high	24 Å²	24	62 Å²	62	13%	0.126	35%	0.347	C	S	.	.	H	α-helix	trans	-65	-14.3	-178.8	-66.5	175.6	0	0	0	113.5	C297 N303 L304 D365 L368 M369 M372	C297-L301 WeakPolarHBondContact O-CB 3.42Å; C297-L301 WeakPolarHBondContact O-CG 3.49Å; C297-L301 PolarHBondContact O-N 2.97Å; L301-N303 PolarHBondContact O-N 3.1Å; L301-L304 HydrophobicContact CD2-CD2 4.17Å; L301-L304 PolarHBondContact O-N 3.23Å; L301-D365 HydrophobicContact CD1-CB 3.9Å; L301-L368 HydrophobicContact CD1-CD1 4.36Å; L301-L368 HydrophobicContact CD2-CB 3.55Å; L301-L368 HydrophobicContact CD2-CD1 4.13Å; L301-M369 HydrophobicContact CD2-CG 4.32Å; L301-M369 HydrophobicContact CG-CE 4.34Å; L301-M372 HydrophobicContact CD2-SD 3.98Å
302	S	97.9	Very high	96.6	Very high	86 Å²	86	59.8 Å²	59.8	60%	0.601	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-20.1	170.2	78.6	0	0	0	0	113.4	Q298 E299 A300 L304	Q298-S302 PolarHBondContact O-N 3.13Å; Q298-S302 VanDerWaalsContact O-N 3.11Å; E299-S302 WeakPolarHBondContact O-CB 3.36Å; E299-S302 PolarHBondContact O-N 3.34Å; E299-S302 PolarHBondContact O-OG 3.05Å; A300-S302 PolarHBondContact O-N 3.43Å; A300-S302 VanDerWaalsContact O-N 3.09Å; S302-L304 VanDerWaalsContact C-N 3.35Å
303	N	98.1	Very high	96.5	Very high	8 Å²	8	60.4 Å²	60.4	4%	0.043	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-2.4	172.8	-166.1	23.1	0	0	0	113.3	A300 L301 L315 V316 T317 M372	A300-N303 WeakPolarHBondContact O-CB 2.97Å; A300-N303 PolarHBondContact O-N 2.95Å; L301-N303 PolarHBondContact O-N 3.1Å; N303-L315 CarbonylContact O-C 3.5Å; N303-L315 WeakPolarHBondContact O-CA 3.43Å; N303-V316 PolarHBondContact O-N 2.67Å; N303-V316 PolarHBondContact OD1-N 2.94Å; N303-T317 PolarHBondContact ND2-O 2.8Å; N303-T317 WeakPolarHBondContact OD1-CG2 3.27Å; N303-T317 PolarHBondContact OD1-N 3.25Å; N303-T317 PolarHBondContact OD1-O 3.08Å; N303-M372 HydrophobicContact CB-CE 4.08Å
304	L	97.8	Very high	96.4	Very high	23 Å²	23	62.9 Å²	62.9	12%	0.12	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	109.4	178.9	-175.1	60.6	0	0	0	111.2	L301 S302 H313 L368 M372 L375	L301-L304 HydrophobicContact CD2-CD2 4.17Å; L301-L304 PolarHBondContact O-N 3.23Å; S302-L304 VanDerWaalsContact C-N 3.35Å; L304-H313 HydrophobicContact CD1-CB 3.92Å; L304-L368 HydrophobicContact CD2-CB 3.92Å; L304-L368 HydrophobicContact CD2-CD2 4.14Å; L304-L368 HydrophobicContact CD2-CG 4.44Å; L304-M372 HydrophobicContact CB-CG 4.14Å; L304-M372 HydrophobicContact CB-SD 4.07Å; L304-M372 HydrophobicContact CD1-CG 3.9Å; L304-M372 HydrophobicContact CD2-CG 4.18Å; L304-M372 HydrophobicContact CD2-SD 4.44Å; L304-M372 HydrophobicContact CG-CG 4.3Å; L304-L375 HydrophobicContact CD1-CD1 4.17Å
305	H	96.8	Very high	96.4	Very high	85 Å²	85	60.8 Å²	60.8	39%	0.394	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	140.6	167.3	-179	-93.5	0	0	0	110.1	H313 S314 V316	H305-H313 WeakPolarHBondContact O-CA 3.48Å; H305-S314 PolarHBondContact N-O 2.86Å; H305-S314 PolarHBondContact O-N 2.86Å; H305-V316 HydrophobicContact CB-CG2 3.87Å
306	T	96.1	Very high	96.3	Very high	69 Å²	69	62.7 Å²	62.7	42%	0.423	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	117.9	170.4	-52	0	0	0	0	108.1	S312 H313	T306-S312 WeakPolarHBondContact CA-O 3.22Å; T306-H313 PolarHBondContact OG1-CE1 3.01Å; T306-H313 PolarHBondContact OG1-ND1 3.16Å
307	D	94.5	Very high	96.2	Very high	50 Å²	50	63.6 Å²	63.6	27%	0.267	37%	0.367	S	S	.	.			trans	-68.5	124.9	177.6	177.6	-81.9	0	0	0	110.1	E309 T310 G311 S312	D307-E309 VanDerWaalsContact C-N 3.32Å; D307-E309 PolarHBondContact O-N 3.3Å; D307-E309 PolarHBondContact OD1-N 3.25Å; D307-E309 VanDerWaalsContact OD1-N 3.08Å; D307-T310 WeakPolarHBondContact CB-OG1 3.46Å; D307-T310 WeakPolarHBondContact OD1-CB 3.4Å; D307-T310 PolarHBondContact OD1-N 3.26Å; D307-T310 PolarHBondContact OD1-OG1 2.91Å; D307-G311 VanDerWaalsContact O-CA 3.24Å; D307-G311 WeakPolarHBondContact O-CA 3.09Å; D307-G311 PolarHBondContact O-N 3.46Å; D307-S312 PolarHBondContact N-O 3.13Å
308	P	92.9	Very high	95.9	Very high	113 Å²	113	65.7 Å²	65.7	73%	0.734	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-17.5	-170.5	29.6	-35.9	0	0	0	114.3
309	E	93.1	Very high	95.7	Very high	177 Å²	177	65.2 Å²	65.2	83%	0.827	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-35.4	-178	-60.9	-66.2	145.8	0	0	111.6	D307	D307-E309 VanDerWaalsContact C-N 3.32Å; D307-E309 PolarHBondContact O-N 3.3Å; D307-E309 PolarHBondContact OD1-N 3.25Å; D307-E309 VanDerWaalsContact OD1-N 3.08Å
310	T	92.4	Very high	95.3	Very high	98 Å²	98	62.5 Å²	62.5	60%	0.601	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-19	-175.4	61.2	0	0	0	0	113.8	D307 S312	D307-T310 WeakPolarHBondContact CB-OG1 3.46Å; D307-T310 WeakPolarHBondContact OD1-CB 3.4Å; D307-T310 PolarHBondContact OD1-N 3.26Å; D307-T310 PolarHBondContact OD1-OG1 2.91Å; T310-S312 PolarHBondContact O-N 2.95Å; T310-S312 WeakPolarHBondContact OG1-CB 3.36Å; T310-S312 PolarHBondContact OG1-N 2.92Å; T310-S312 PolarHBondContact OG1-OG 3.38Å
311	G	91.5	Very high	95.1	Very high	46 Å²	46	67.1 Å²	67.1	47%	0.474	39%	0.393	S	S	.	.			trans	67.9	10.1	-169.6	0	0	0	0	0	113.8	D307	D307-G311 VanDerWaalsContact O-CA 3.24Å; D307-G311 WeakPolarHBondContact O-CA 3.09Å; D307-G311 PolarHBondContact O-N 3.46Å
312	S	93.1	Very high	95	Very high	66 Å²	66	67.2 Å²	67.2	46%	0.462	40%	0.397	S	S	.	.			trans	-75.8	143.2	-178.7	63	0	0	0	0	111.9	T306 D307 T310	T306-S312 WeakPolarHBondContact CA-O 3.22Å; D307-S312 PolarHBondContact N-O 3.13Å; T310-S312 PolarHBondContact O-N 2.95Å; T310-S312 WeakPolarHBondContact OG1-CB 3.36Å; T310-S312 PolarHBondContact OG1-N 2.92Å; T310-S312 PolarHBondContact OG1-OG 3.38Å
313	H	96.8	Very high	94.9	Very high	63 Å²	63	63.3 Å²	63.3	29%	0.292	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	141.7	-178.7	-69.6	-57.8	0	0	0	111.7	L304 H305 T306 T371 L375	L304-H313 HydrophobicContact CD1-CB 3.92Å; H305-H313 WeakPolarHBondContact O-CA 3.48Å; T306-H313 PolarHBondContact OG1-CE1 3.01Å; T306-H313 PolarHBondContact OG1-ND1 3.16Å; H313-T371 HydrophobicContact CB-CG2 4.2Å; H313-L375 HydrophobicContact CB-CD1 3.92Å
314	S	96.9	Very high	94.9	Very high	53 Å²	53	67.1 Å²	67.1	37%	0.371	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	154.4	173.3	58.3	0	0	0	0	111.4	H305	H305-S314 PolarHBondContact N-O 2.86Å; H305-S314 PolarHBondContact O-N 2.86Å
315	L	97.3	Very high	94.9	Very high	29 Å²	29	69.5 Å²	69.5	15%	0.152	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	134.4	176.2	-62	175.3	0	0	0	110.5	N303 L318 L323 M372 L375 F376	N303-L315 CarbonylContact O-C 3.5Å; N303-L315 WeakPolarHBondContact O-CA 3.43Å; L315-L318 HydrophobicContact CB-CD2 4.03Å; L315-L318 HydrophobicContact CD1-CD2 3.93Å; L315-L323 HydrophobicContact CD1-CD2 3.94Å; L315-M372 HydrophobicContact CD2-CB 4Å; L315-M372 HydrophobicContact CD2-CE 4.43Å; L315-M372 HydrophobicContact CD2-CG 4Å; L315-L375 HydrophobicContact CD1-CB 3.99Å; L315-L375 HydrophobicContact CD2-CB 4.47Å; L315-L375 HydrophobicContact CD2-CD1 4.44Å; L315-L375 HydrophobicContact CG-CB 3.9Å; L315-L375 HydrophobicContact CG-CD1 4.33Å; L315-F376 HydrophobicContact CD1-CB 4.06Å
316	V	97	Very high	94.9	Very high	98 Å²	98	66 Å²	66	59%	0.594	38%	0.382	S	S	*	.	S	Bend	trans	-74.7	-40	-178.4	176.9	0	0	0	0	111.3	N303 H305	N303-V316 PolarHBondContact O-N 2.67Å; N303-V316 PolarHBondContact OD1-N 2.94Å; H305-V316 HydrophobicContact CB-CG2 3.87Å
317	T	95.4	Very high	95	Very high	44 Å²	44	62.9 Å²	62.9	27%	0.27	36%	0.363	S	S	.	.			trans	-131.1	141.4	177.5	-178.3	0	0	0	0	111.5	N303 Q319 A322	N303-T317 PolarHBondContact ND2-O 2.8Å; N303-T317 WeakPolarHBondContact OD1-CG2 3.27Å; N303-T317 PolarHBondContact OD1-N 3.25Å; N303-T317 PolarHBondContact OD1-O 3.08Å; T317-Q319 WeakPolarHBondContact OG1-CG 3.17Å; T317-Q319 PolarHBondContact OG1-N 3.37Å; T317-A322 HydrophobicContact CG2-CB 3.74Å
318	L	93.8	Very high	95.2	Very high	44 Å²	44	64.6 Å²	64.6	23%	0.23	37%	0.369	C	S	.	.			trans	-114.4	36.6	176.4	-61.9	174.6	0	0	0	110.2	L315 L323 T379 R389	L315-L318 HydrophobicContact CB-CD2 4.03Å; L315-L318 HydrophobicContact CD1-CD2 3.93Å; L318-L323 HydrophobicContact CD2-CD2 4.48Å; L318-T379 HydrophobicContact CD1-CG2 3.7Å; L318-T379 HydrophobicContact CD2-CG2 3.91Å; L318-T379 HydrophobicContact CG-CG2 4.37Å; L318-R389 PolarHBondContact O-NH2 3.15Å
319	Q	92.6	Very high	95.5	Very high	118 Å²	118	59.2 Å²	59.2	55%	0.551	33%	0.334	S	S	*	.			trans	-82.4	127.9	172.2	-75.2	-179.2	-5.6	0	0	109.1	T317 T321 A322 L323	T317-Q319 WeakPolarHBondContact OG1-CG 3.17Å; T317-Q319 PolarHBondContact OG1-N 3.37Å; Q319-T321 VanDerWaalsContact C-N 3.3Å; Q319-T321 PolarHBondContact O-N 3.32Å; Q319-A322 HydrophobicContact CB-CB 4.18Å; Q319-A322 WeakPolarHBondContact O-CB 3.46Å; Q319-A322 PolarHBondContact O-N 2.92Å; Q319-L323 WeakPolarHBondContact O-CG 3.46Å; Q319-L323 PolarHBondContact O-N 3.18Å
320	P	90.5	Very high	95.8	Very high	18 Å²	18	50.9 Å²	50.9	12%	0.117	30%	0.295	C	S	.	.	H	α-helix	trans	-51.9	-44.3	-176.6	-31.3	37.8	0	0	0	113.7	A322 L323 Q324 E392 M393	P320-A322 PolarHBondContact O-N 3.41Å; P320-L323 PolarHBondContact O-N 2.83Å; P320-Q324 WeakPolarHBondContact O-CB 3.09Å; P320-Q324 PolarHBondContact O-N 2.63Å; P320-E392 HydrophobicContact CB-CG 3.93Å; P320-E392 WeakPolarHBondContact CB-OE1 3.31Å; P320-E392 VanDerWaalsContact CG-CD 3.42Å; P320-E392 HydrophobicContact CG-CG 3.94Å; P320-E392 WeakPolarHBondContact CG-OE1 3.39Å; P320-M393 HydrophobicContact CG-CG 4.15Å
321	T	94.1	Very high	96.1	Very high	97 Å²	97	46.8 Å²	46.8	60%	0.595	27%	0.27	S	S	*	.	H	α-helix	trans	-62.1	-36.9	176.6	52.6	0	0	0	0	113.9	Q319 H325	Q319-T321 VanDerWaalsContact C-N 3.3Å; Q319-T321 PolarHBondContact O-N 3.32Å; T321-H325 WeakPolarHBondContact O-CB 3.44Å; T321-H325 PolarHBondContact O-N 2.92Å; T321-H325 VanDerWaalsContact O-N 3.14Å
322	A	95.8	Very high	96.4	Very high	27 Å²	27	46.2 Å²	46.2	22%	0.223	26%	0.255	C	S	.	.	H	α-helix	trans	-72.8	-36.9	176.8	0	0	0	0	0	111.6	T317 Q319 P320 H325 C326	T317-A322 HydrophobicContact CG2-CB 3.74Å; Q319-A322 HydrophobicContact CB-CB 4.18Å; Q319-A322 WeakPolarHBondContact O-CB 3.46Å; Q319-A322 PolarHBondContact O-N 2.92Å; P320-A322 PolarHBondContact O-N 3.41Å; A322-H325 PolarHBondContact O-N 3.09Å; A322-C326 PolarHBondContact O-N 3.12Å; A322-C326 VanDerWaalsContact O-N 3.09Å; A322-C326 PolarHBondContact O-SG 3.38Å
323	L	96.5	Very high	96.7	Very high	3 Å²	3	43 Å²	43	2%	0.016	23%	0.233	C	C	.	.	H	α-helix	trans	-69.1	-47.2	177.2	-66	165.7	0	0	0	111.2	L315 L318 Q319 P320 H325 C326 E327 F376 M393	L315-L323 HydrophobicContact CD1-CD2 3.94Å; L318-L323 HydrophobicContact CD2-CD2 4.48Å; Q319-L323 WeakPolarHBondContact O-CG 3.46Å; Q319-L323 PolarHBondContact O-N 3.18Å; P320-L323 PolarHBondContact O-N 2.83Å; L323-H325 VanDerWaalsContact C-N 3.26Å; L323-H325 PolarHBondContact O-N 3.4Å; L323-C326 WeakPolarHBondContact O-CB 3.43Å; L323-C326 PolarHBondContact O-N 3.01Å; L323-C326 VanDerWaalsContact O-N 3.14Å; L323-E327 WeakPolarHBondContact O-CG 3.44Å; L323-E327 PolarHBondContact O-N 3.08Å; L323-F376 HydrophobicContact CB-CD1 4.24Å; L323-F376 HydrophobicContact CB-CE1 3.77Å; L323-F376 HydrophobicContact CB-CE2 4.3Å; L323-F376 HydrophobicContact CB-CZ 3.81Å; L323-F376 HydrophobicContact CD1-CD2 3.98Å; L323-F376 HydrophobicContact CD1-CE2 3.66Å; L323-F376 HydrophobicContact CD1-CZ 3.99Å; L323-F376 HydrophobicContact CD2-CD1 4.31Å; L323-F376 HydrophobicContact CD2-CD2 4.22Å; L323-F376 HydrophobicContact CD2-CG 4.12Å; L323-F376 HydrophobicContact CG-CE2 4.4Å; L323-F376 HydrophobicContact CG-CZ 4.4Å; L323-M393 HydrophobicContact CD1-CE 3.78Å; L323-M393 HydrophobicContact CD1-CG 4.33Å; L323-M393 HydrophobicContact CD1-SD 4.42Å
324	Q	97.2	Very high	96.8	Very high	89 Å²	89	40 Å²	40	42%	0.416	22%	0.219	S	C	.	.	H	α-helix	trans	-50.5	-50.2	171.2	-175.4	-174.6	-20.8	0	0	110.4	P320 C326 E327 E328 T396	P320-Q324 WeakPolarHBondContact O-CB 3.09Å; P320-Q324 PolarHBondContact O-N 2.63Å; Q324-C326 VanDerWaalsContact C-N 3.33Å; Q324-C326 PolarHBondContact O-N 3.3Å; Q324-E327 PolarHBondContact O-N 3.26Å; Q324-E327 VanDerWaalsContact O-N 3.15Å; Q324-E328 HydrophobicContact CG-CG 4.39Å; Q324-E328 WeakPolarHBondContact CG-OE1 3.36Å; Q324-E328 PolarHBondContact NE2-OE1 2.98Å; Q324-E328 WeakPolarHBondContact O-CG 3.5Å; Q324-E328 PolarHBondContact O-N 3.33Å; Q324-T396 HydrophobicContact CB-CG2 3.56Å; Q324-T396 HydrophobicContact CG-CG2 4.19Å
325	H	97.9	Very high	96.9	Very high	72 Å²	72	37.6 Å²	37.6	33%	0.333	20%	0.202	S	C	.	.	H	α-helix	trans	-63.8	-35.6	-178	-161.5	57.1	0	0	0	113.6	R296 T321 A322 L323 E328 I329	R296-H325 PolarHBondContact NH1-CE1 3.11Å; R296-H325 PolarHBondContact NH1-NE2 2.92Å; R296-H325 PolarHBondContact NH2-CE1 3.02Å; T321-H325 WeakPolarHBondContact O-CB 3.44Å; T321-H325 PolarHBondContact O-N 2.92Å; T321-H325 VanDerWaalsContact O-N 3.14Å; A322-H325 PolarHBondContact O-N 3.09Å; L323-H325 VanDerWaalsContact C-N 3.26Å; L323-H325 PolarHBondContact O-N 3.4Å; H325-E328 IonicContact ND1-OE2 2.83Å; H325-E328 PolarHBondContact ND1-OE2 2.94Å; H325-I329 VanDerWaalsContact O-CD1 3.26Å; H325-I329 WeakPolarHBondContact O-CD1 3.22Å; H325-I329 WeakPolarHBondContact O-CG1 3.33Å; H325-I329 PolarHBondContact O-N 2.95Å; H325-I329 VanDerWaalsContact O-N 3.13Å
326	C	98.3	Very high	96.9	Very high	11 Å²	11	41.8 Å²	41.8	7%	0.074	22%	0.22	C	C	.	.	H	α-helix	trans	-64.8	-43.5	173.8	-65.4	0	0	0	0	111.4	A300 A322 L323 Q324 I329 H330 M372	A300-C326 HydrophobicContact CB-CB 4.48Å; A322-C326 PolarHBondContact O-N 3.12Å; A322-C326 VanDerWaalsContact O-N 3.09Å; A322-C326 PolarHBondContact O-SG 3.38Å; L323-C326 WeakPolarHBondContact O-CB 3.43Å; L323-C326 PolarHBondContact O-N 3.01Å; L323-C326 VanDerWaalsContact O-N 3.14Å; Q324-C326 VanDerWaalsContact C-N 3.33Å; Q324-C326 PolarHBondContact O-N 3.3Å; C326-I329 PolarHBondContact O-N 3.24Å; C326-H330 WeakPolarHBondContact O-CB 3.4Å; C326-H330 PolarHBondContact O-N 3.39Å; C326-M372 HydrophobicContact CB-CE 3.88Å
327	E	98.6	Very high	97	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.019	20%	0.196	C	C	.	.	H	α-helix	trans	-72	-32.5	-179.7	-63.4	-66.3	142.4	0	0	112.7	L323 Q324 H330 N331 T373 F376 A400 R404	L323-E327 WeakPolarHBondContact O-CG 3.44Å; L323-E327 PolarHBondContact O-N 3.08Å; Q324-E327 PolarHBondContact O-N 3.26Å; Q324-E327 VanDerWaalsContact O-N 3.15Å; E327-H330 WeakPolarHBondContact O-CB 3.44Å; E327-H330 PolarHBondContact O-N 2.8Å; E327-H330 IonicContact OE2-ND1 3.87Å; E327-N331 PolarHBondContact O-N 3.36Å; E327-N331 PolarHBondContact O-OD1 3.34Å; E327-T373 WeakPolarHBondContact OE1-CA 3.4Å; E327-T373 WeakPolarHBondContact OE1-CB 3.44Å; E327-T373 PolarHBondContact OE1-OG1 2.94Å; E327-T373 PolarHBondContact OE2-OG1 3.41Å; E327-F376 HydrophobicContact CG-CD1 4.03Å; E327-F376 HydrophobicContact CG-CE1 4.06Å; E327-A400 HydrophobicContact CB-CB 3.58Å; E327-A400 HydrophobicContact CG-CB 4.3Å; E327-R404 PolarHBondContact O-NH2 3.04Å; E327-R404 IonicContact OE2-CZ 2.75Å; E327-R404 IonicContact OE2-NH1 3.89Å; E327-R404 PolarHBondContact OE2-NH1 3.33Å; E327-R404 IonicContact OE2-NH2 3.11Å; E327-R404 PolarHBondContact OE2-NH2 3.11Å
328	E	98.6	Very high	97.1	Very high	87 Å²	87	36.2 Å²	36.2	41%	0.407	18%	0.184	S	C	.	.	H	α-helix	trans	-60.4	-47.2	169.2	-74.9	169.8	176.9	0	0	111.4	Q324 H325 H330 N331 E332	Q324-E328 HydrophobicContact CG-CG 4.39Å; Q324-E328 WeakPolarHBondContact CG-OE1 3.36Å; Q324-E328 PolarHBondContact NE2-OE1 2.98Å; Q324-E328 WeakPolarHBondContact O-CG 3.5Å; Q324-E328 PolarHBondContact O-N 3.33Å; H325-E328 IonicContact ND1-OE2 2.83Å; H325-E328 PolarHBondContact ND1-OE2 2.94Å; E328-H330 VanDerWaalsContact C-N 3.29Å; E328-H330 PolarHBondContact O-N 3.1Å; E328-N331 PolarHBondContact O-N 2.77Å; E328-E332 WeakPolarHBondContact O-CB 3.37Å; E328-E332 PolarHBondContact O-N 2.76Å
329	I	98.8	Very high	97.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.8	-37.8	176.6	-68	160.2	0	0	0	110.8	R296 E299 A300 H325 C326 E332 V333 M369	R296-I329 HydrophobicContact CB-CG1 4.38Å; R296-I329 HydrophobicContact CB-CG2 4.11Å; R296-I329 VanDerWaalsContact CZ-CG1 3.41Å; R296-I329 WeakPolarHBondContact O-CG2 3.04Å; E299-I329 HydrophobicContact CB-CD1 4.37Å; A300-I329 HydrophobicContact CB-CB 3.99Å; A300-I329 HydrophobicContact CB-CD1 3.73Å; A300-I329 HydrophobicContact CB-CG1 4.46Å; A300-I329 HydrophobicContact CB-CG2 3.75Å; H325-I329 VanDerWaalsContact O-CD1 3.26Å; H325-I329 WeakPolarHBondContact O-CD1 3.22Å; H325-I329 WeakPolarHBondContact O-CG1 3.33Å; H325-I329 PolarHBondContact O-N 2.95Å; H325-I329 VanDerWaalsContact O-N 3.13Å; C326-I329 PolarHBondContact O-N 3.24Å; I329-E332 PolarHBondContact O-N 3.35Å; I329-V333 WeakPolarHBondContact O-CG1 3.49Å; I329-V333 PolarHBondContact O-N 2.85Å; I329-M369 HydrophobicContact CG2-CE 3.96Å; I329-M369 HydrophobicContact CG2-SD 4.05Å
330	H	98.9	Very high	97.6	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-61.8	-43.6	177.6	-170.9	-170.9	0	0	0	111.3	C326 E327 E328 V333 E334 W366 M369 E370 T373 R404	C326-H330 WeakPolarHBondContact O-CB 3.4Å; C326-H330 PolarHBondContact O-N 3.39Å; E327-H330 WeakPolarHBondContact O-CB 3.44Å; E327-H330 PolarHBondContact O-N 2.8Å; E327-H330 IonicContact OE2-ND1 3.87Å; E328-H330 VanDerWaalsContact C-N 3.29Å; E328-H330 PolarHBondContact O-N 3.1Å; H330-V333 WeakPolarHBondContact O-CG1 3.36Å; H330-E334 WeakPolarHBondContact O-CB 3.35Å; H330-E334 PolarHBondContact O-N 3.38Å; H330-W366 AromaticContact CD2-CD1 3.5Å; H330-W366 VanDerWaalsContact CD2-CD1 3.5Å; H330-W366 AromaticContact CD2-NE1 3.8Å; H330-W366 AromaticContact NE2-CD1 3.5Å; H330-W366 AromaticContact NE2-NE1 3.38Å; H330-W366 PolarHBondContact NE2-NE1 2.74Å; H330-M369 HydrophobicContact CB-CB 4Å; H330-M369 HydrophobicContact CB-SD 3.99Å; H330-E370 PolarHBondContact CE1-N 3.46Å; H330-E370 IonicContact CE1-OE1 3.3Å; H330-E370 PolarHBondContact CE1-OE1 2.76Å; H330-E370 VanDerWaalsContact CE1-OE1 3.24Å; H330-E370 IonicContact NE2-OE1 2.74Å; H330-E370 PolarHBondContact NE2-OE1 2.76Å; H330-T373 PolarHBondContact ND1-OG1 3.38Å; H330-T373 VanDerWaalsContact ND1-OG1 3.15Å; H330-R404 VanDerWaalsContact ND1-CZ 3.32Å; H330-R404 PolarHBondContact ND1-NH1 3.38Å
331	N	98.8	Very high	97.8	Very high	12 Å²	12	32.3 Å²	32.3	6%	0.064	16%	0.162	C	C	.	.	H	α-helix	trans	-66.6	-44.6	172.6	-69.8	11.4	0	0	0	111.1	E327 E328 V333 E334 F335 A400 D403 R404	E327-N331 PolarHBondContact O-N 3.36Å; E327-N331 PolarHBondContact O-OD1 3.34Å; E328-N331 PolarHBondContact O-N 2.77Å; N331-V333 PolarHBondContact O-N 2.96Å; N331-E334 PolarHBondContact O-N 2.8Å; N331-F335 HydrophobicContact CB-CD2 3.92Å; N331-F335 HydrophobicContact CB-CE2 4.07Å; N331-F335 WeakPolarHBondContact O-CD2 3.45Å; N331-F335 PolarHBondContact O-N 2.9Å; N331-A400 PolarHBondContact ND2-O 3.09Å; N331-D403 PolarHBondContact ND2-OD2 2.89Å; N331-R404 PolarHBondContact OD1-NE 3.41Å; N331-R404 PolarHBondContact OD1-NH2 3.46Å
332	E	98.8	Very high	97.9	Very high	34 Å²	34	29.5 Å²	29.5	16%	0.159	14%	0.14	C	C	.	.	H	α-helix	trans	-55.3	-47.4	179.3	-175.2	168.9	-142.6	0	0	112	Y292 I293 R296 E328 I329 E336	Y292-E332 WeakPolarHBondContact CE1-OE1 3.25Å; Y292-E332 PolarHBondContact OH-OE1 2.88Å; I293-E332 HydrophobicContact CD1-CG 3.98Å; R296-E332 IonicContact CZ-OE2 3.12Å; R296-E332 IonicContact NE-OE2 3.4Å; R296-E332 PolarHBondContact NE-OE2 2.71Å; R296-E332 IonicContact NH2-OE2 2.76Å; R296-E332 PolarHBondContact NH2-OE2 2.8Å; E328-E332 WeakPolarHBondContact O-CB 3.37Å; E328-E332 PolarHBondContact O-N 2.76Å; I329-E332 PolarHBondContact O-N 3.35Å; E332-E336 WeakPolarHBondContact O-CB 3.47Å; E332-E336 PolarHBondContact O-N 3.34Å; E332-E336 VanDerWaalsContact O-N 3.11Å
333	V	98.8	Very high	98	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	14%	0.143	C	C	.	.	I	π-helix	trans	-72.8	-34.1	178.4	71.3	0	0	0	0	113.3	I293 I329 H330 N331 W337 L338 L362 W366 M369	I293-V333 HydrophobicContact CD1-CB 4.05Å; I293-V333 HydrophobicContact CD1-CG2 4.41Å; I293-V333 HydrophobicContact CG1-CB 4.38Å; I293-V333 HydrophobicContact CG1-CG2 4.18Å; I329-V333 WeakPolarHBondContact O-CG1 3.49Å; I329-V333 PolarHBondContact O-N 2.85Å; H330-V333 WeakPolarHBondContact O-CG1 3.36Å; N331-V333 PolarHBondContact O-N 2.96Å; V333-W337 WeakPolarHBondContact O-CB 3.4Å; V333-L338 WeakPolarHBondContact O-CG 3.44Å; V333-L338 PolarHBondContact O-N 3.49Å; V333-L362 HydrophobicContact CG2-CB 4.01Å; V333-L362 HydrophobicContact CG2-CD2 4.07Å; V333-L362 HydrophobicContact CG2-CG 4.44Å; V333-W366 HydrophobicContact CG1-CB 3.97Å; V333-W366 HydrophobicContact CG1-CG 4.45Å; V333-M369 HydrophobicContact CG1-CE 4.43Å; V333-M369 HydrophobicContact CG1-SD 4.06Å
334	E	98.8	Very high	97.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	15%	0.153	C	C	.	.	I	π-helix	trans	-68.3	-49.8	177.9	-170.3	172.7	149.9	0	0	111.5	H330 N331 L338 R339 W366 R408	H330-E334 WeakPolarHBondContact O-CB 3.35Å; H330-E334 PolarHBondContact O-N 3.38Å; N331-E334 PolarHBondContact O-N 2.8Å; E334-L338 PolarHBondContact O-N 2.91Å; E334-R339 HydrophobicContact CG-CG 4.4Å; E334-R339 WeakPolarHBondContact O-CB 3.25Å; E334-R339 WeakPolarHBondContact O-CG 3.41Å; E334-R339 PolarHBondContact O-N 3.38Å; E334-R339 IonicContact OE1-CZ 2.62Å; E334-R339 VanDerWaalsContact OE1-CZ 3.26Å; E334-R339 IonicContact OE1-NE 2.88Å; E334-R339 PolarHBondContact OE1-NE 3.28Å; E334-R339 IonicContact OE1-NH2 2.73Å; E334-R339 PolarHBondContact OE1-NH2 2.77Å; E334-W366 PolarHBondContact OE2-NE1 2.69Å; E334-R408 VanDerWaalsContact OE1-CG 3.28Å; E334-R408 WeakPolarHBondContact OE1-CG 3.44Å; E334-R408 IonicContact OE1-CZ 3.26Å; E334-R408 IonicContact OE1-NE 3.05Å; E334-R408 PolarHBondContact OE1-NE 3.1Å; E334-R408 IonicContact OE1-NH2 2.71Å; E334-R408 IonicContact OE2-CZ 3.78Å; E334-R408 IonicContact OE2-NE 3.19Å; E334-R408 PolarHBondContact OE2-NE 3.46Å; E334-R408 IonicContact OE2-NH2 2.8Å; E334-R408 PolarHBondContact OE2-NH2 2.74Å
335	F	98.6	Very high	97.6	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.009	13%	0.134	C	C	.	.	I	π-helix	trans	-94.8	-40.2	-165.8	-58.5	-61.6	0	0	0	114	N331 Q340 R404 Q407 R408 W411	N331-F335 HydrophobicContact CB-CD2 3.92Å; N331-F335 HydrophobicContact CB-CE2 4.07Å; N331-F335 WeakPolarHBondContact O-CD2 3.45Å; N331-F335 PolarHBondContact O-N 2.9Å; F335-Q340 VanDerWaalsContact O-CG 3.22Å; F335-Q340 WeakPolarHBondContact O-CG 3.47Å; F335-R404 HydrophobicContact CE2-CB 4.27Å; F335-R404 HydrophobicContact CE2-CG 3.98Å; F335-R404 HydrophobicContact CZ-CB 4.4Å; F335-R404 HydrophobicContact CZ-CG 3.86Å; F335-R404 WeakPolarHBondContact CZ-O 3.28Å; F335-Q407 HydrophobicContact CD1-CB 3.66Å; F335-Q407 HydrophobicContact CD2-CB 4.05Å; F335-Q407 HydrophobicContact CD2-CG 4.47Å; F335-Q407 HydrophobicContact CE1-CB 3.43Å; F335-Q407 VanDerWaalsContact CE1-CB 3.43Å; F335-Q407 HydrophobicContact CE2-CB 3.85Å; F335-Q407 HydrophobicContact CG-CB 3.99Å; F335-Q407 HydrophobicContact CZ-CB 3.55Å; F335-R408 HydrophobicContact CE1-CG 4.1Å; F335-R408 HydrophobicContact CZ-CG 4.05Å; F335-W411 AromaticContact CD1-CD1 3.49Å; F335-W411 VanDerWaalsContact CD1-CD1 3.49Å; F335-W411 AromaticContact CD1-NE1 3.63Å
336	E	98.2	Very high	97	Very high	117 Å²	117	31.4 Å²	31.4	55%	0.547	15%	0.145	S	C	.	.	I	π-helix	trans	-84.2	-15.4	-180	-63.4	-58.4	122.3	0	0	113.2	E332	E332-E336 WeakPolarHBondContact O-CB 3.47Å; E332-E336 PolarHBondContact O-N 3.34Å; E332-E336 VanDerWaalsContact O-N 3.11Å
337	W	98.4	Very high	96.5	Very high	24 Å²	24	35.8 Å²	35.8	9%	0.091	16%	0.159	C	C	.	.	I	π-helix	trans	-121.6	-66.8	-175.5	-66.4	81.7	0	0	0	113.4	T289 I293 V333 Y341 W355 M359 L362	T289-W337 WeakPolarHBondContact O-CH2 3.41Å; I293-W337 HydrophobicContact CB-CD2 3.96Å; I293-W337 HydrophobicContact CB-CG 4.34Å; I293-W337 HydrophobicContact CB-CZ2 3.83Å; I293-W337 HydrophobicContact CD1-CG 4.36Å; I293-W337 HydrophobicContact CG1-CD2 4Å; I293-W337 HydrophobicContact CG1-CG 3.85Å; I293-W337 HydrophobicContact CG2-CD2 3.65Å; I293-W337 HydrophobicContact CG2-CE3 3.8Å; I293-W337 HydrophobicContact CG2-CG 4.35Å; I293-W337 HydrophobicContact CG2-CH2 3.88Å; I293-W337 HydrophobicContact CG2-CZ2 3.68Å; I293-W337 HydrophobicContact CG2-CZ3 3.91Å; V333-W337 WeakPolarHBondContact O-CB 3.4Å; W337-Y341 VanDerWaalsContact O-CB 3.23Å; W337-Y341 WeakPolarHBondContact O-CB 3.11Å; W337-Y341 PolarHBondContact O-N 3.06Å; W337-W355 HydrophobicContact CZ3-CH2 4.16Å; W337-W355 AromaticContact CZ3-CZ3 4Å; W337-W355 HydrophobicContact CZ3-CZ3 4Å; W337-M359 HydrophobicContact CE3-CE 4.13Å; W337-L362 HydrophobicContact CB-CD1 4.17Å; W337-L362 HydrophobicContact CD2-CD1 4.42Å; W337-L362 HydrophobicContact CE3-CD1 4.1Å; W337-L362 HydrophobicContact CG-CD1 4.45Å
338	L	98.4	Very high	95.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	17%	0.174	C	C	.	.	I	π-helix	trans	-66.7	-55.3	-171.4	-67.8	173.5	0	0	0	111.8	V333 E334 Y341 W342 M359 L362 E363 W366 P433	V333-L338 WeakPolarHBondContact O-CG 3.44Å; V333-L338 PolarHBondContact O-N 3.49Å; E334-L338 PolarHBondContact O-N 2.91Å; L338-Y341 PolarHBondContact O-N 3.32Å; L338-W342 PolarHBondContact O-N 3.15Å; L338-M359 HydrophobicContact CD2-SD 4.36Å; L338-L362 HydrophobicContact CD2-CB 3.99Å; L338-E363 HydrophobicContact CD1-CB 4.43Å; L338-E363 HydrophobicContact CD2-CB 4.02Å; L338-W366 HydrophobicContact CD1-CB 3.69Å; L338-W366 HydrophobicContact CD1-CD2 4.14Å; L338-W366 HydrophobicContact CD1-CG 3.69Å; L338-P433 HydrophobicContact CD1-CG 4.5Å
339	R	98.3	Very high	94.8	Very high	5 Å²	5	37.9 Å²	37.9	2%	0.019	18%	0.176	C	C	.	.	I	π-helix	trans	-66.9	-40.4	-178.3	-68.7	-173.8	-174.9	-67.7	-16.1	112.4	E334 Y341 W342 F343 W411 D431 P433 F446	E334-R339 HydrophobicContact CG-CG 4.4Å; E334-R339 WeakPolarHBondContact O-CB 3.25Å; E334-R339 WeakPolarHBondContact O-CG 3.41Å; E334-R339 PolarHBondContact O-N 3.38Å; E334-R339 IonicContact OE1-CZ 2.62Å; E334-R339 VanDerWaalsContact OE1-CZ 3.26Å; E334-R339 IonicContact OE1-NE 2.88Å; E334-R339 PolarHBondContact OE1-NE 3.28Å; E334-R339 IonicContact OE1-NH2 2.73Å; E334-R339 PolarHBondContact OE1-NH2 2.77Å; R339-Y341 VanDerWaalsContact C-N 3.34Å; R339-Y341 PolarHBondContact O-N 2.84Å; R339-W342 PolarHBondContact O-N 3.11Å; R339-F343 WeakPolarHBondContact O-CB 3.42Å; R339-F343 PolarHBondContact O-N 3.41Å; R339-W411 HydrophobicContact CB-CD2 3.72Å; R339-W411 HydrophobicContact CB-CE3 4.03Å; R339-W411 HydrophobicContact CB-CG 4.06Å; R339-W411 HydrophobicContact CB-CZ2 4.27Å; R339-W411 HydrophobicContact CB-CZ3 4.45Å; R339-W411 HydrophobicContact CG-CG 4.4Å; R339-D431 IonicContact NH1-OD1 3.52Å; R339-D431 PolarHBondContact NH1-OD1 3.44Å; R339-P433 PolarHBondContact NH1-O 2.7Å; R339-P433 PolarHBondContact NH2-O 2.97Å; R339-F446 VanDerWaalsContact NH2-CE2 3.32Å
340	Q	97	Very high	94.1	Very high	72 Å²	72	44.7 Å²	44.7	34%	0.336	20%	0.201	S	C	.	.	H	α-helix	trans	-53.7	-49.9	170.7	-73.4	-78.1	6.6	0	0	111.6	F335 Q344 W411	F335-Q340 VanDerWaalsContact O-CG 3.22Å; F335-Q340 WeakPolarHBondContact O-CG 3.47Å; Q340-Q344 WeakPolarHBondContact O-CG 3.38Å; Q340-Q344 PolarHBondContact O-NE2 3.11Å; Q340-W411 HydrophobicContact CB-CH2 4.43Å; Q340-W411 VanDerWaalsContact CD-CH2 3.49Å; Q340-W411 HydrophobicContact CG-CH2 3.85Å; Q340-W411 HydrophobicContact CG-CZ2 3.87Å
341	Y	96.2	Very high	93.5	Very high	21 Å²	21	53 Å²	53	8%	0.082	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-48.6	-179.4	179.2	-98.4	0	0	0	112.5	W337 L338 R339 Q344 Y348 W355 M359	W337-Y341 VanDerWaalsContact O-CB 3.23Å; W337-Y341 WeakPolarHBondContact O-CB 3.11Å; W337-Y341 PolarHBondContact O-N 3.06Å; L338-Y341 PolarHBondContact O-N 3.32Å; R339-Y341 VanDerWaalsContact C-N 3.34Å; R339-Y341 PolarHBondContact O-N 2.84Å; Y341-Q344 PolarHBondContact O-N 3.09Å; Y341-Y348 HydrophobicContact CE2-CD2 4.29Å; Y341-W355 HydrophobicContact CD2-CB 4.42Å; Y341-W355 HydrophobicContact CE2-CB 3.55Å; Y341-W355 HydrophobicContact CE2-CG 4.13Å; Y341-M359 HydrophobicContact CD1-CB 4.18Å; Y341-M359 HydrophobicContact CD1-CG 3.65Å; Y341-M359 HydrophobicContact CD1-SD 4.16Å; Y341-M359 HydrophobicContact CD2-CE 3.85Å; Y341-M359 HydrophobicContact CD2-CG 4.02Å; Y341-M359 HydrophobicContact CD2-SD 4.36Å; Y341-M359 HydrophobicContact CE1-CB 4.16Å; Y341-M359 HydrophobicContact CE1-CG 3.82Å; Y341-M359 HydrophobicContact CE2-CG 4.17Å; Y341-M359 HydrophobicContact CG-CE 3.86Å; Y341-M359 HydrophobicContact CG-CG 3.75Å; Y341-M359 HydrophobicContact CG-SD 3.87Å
342	W	96.2	Very high	93	Very high	39 Å²	39	55.6 Å²	55.6	15%	0.148	26%	0.257	C	S	.	.	H	α-helix	trans	-75.6	-27.9	-175.7	-65.6	122.3	0	0	0	114.1	L338 R339 Q344 G345 V430 R432	L338-W342 PolarHBondContact O-N 3.15Å; R339-W342 PolarHBondContact O-N 3.11Å; W342-Q344 PolarHBondContact O-N 2.57Å; W342-Q344 VanDerWaalsContact O-N 3.17Å; W342-G345 PolarHBondContact O-N 3.48Å; W342-G345 VanDerWaalsContact O-N 3.09Å; W342-V430 CarbonylContact C-O 3.59Å; W342-V430 HydrophobicContact CB-CB 4.3Å; W342-V430 WeakPolarHBondContact CB-O 3.47Å; W342-V430 PolarHBondContact O-N 2.96Å; W342-R432 HydrophobicContact CB-CB 3.95Å; W342-R432 HydrophobicContact CD2-CB 4.35Å; W342-R432 HydrophobicContact CD2-CG 4.25Å; W342-R432 VanDerWaalsContact CE2-CD 3.5Å; W342-R432 HydrophobicContact CG-CB 3.76Å; W342-R432 HydrophobicContact CG-CG 3.99Å; W342-R432 VanDerWaalsContact CZ2-CZ 3.43Å
343	F	97	Very high	92.7	Very high	63 Å²	63	58.2 Å²	58.2	28%	0.276	28%	0.279	S	S	.	.	H	α-helix	trans	-60.3	-23	171.6	178.5	-102.7	0	0	0	113	R339 G345 W411 R414 P429	R339-F343 WeakPolarHBondContact O-CB 3.42Å; R339-F343 PolarHBondContact O-N 3.41Å; F343-G345 PolarHBondContact O-N 3.3Å; F343-W411 HydrophobicContact CB-CE3 4.18Å; F343-W411 HydrophobicContact CB-CH2 4.48Å; F343-W411 HydrophobicContact CB-CZ3 3.54Å; F343-W411 HydrophobicContact CD1-CZ3 4.1Å; F343-W411 HydrophobicContact CD2-CE3 4.25Å; F343-W411 HydrophobicContact CD2-CZ3 4.01Å; F343-W411 HydrophobicContact CG-CE3 4.28Å; F343-W411 AromaticContact CG-CZ3 3.62Å; F343-W411 HydrophobicContact CG-CZ3 3.62Å; F343-R414 HydrophobicContact CE2-CB 3.88Å; F343-R414 HydrophobicContact CZ-CB 4.49Å; F343-P429 HydrophobicContact CD2-CB 3.62Å; F343-P429 HydrophobicContact CD2-CG 3.9Å; F343-P429 HydrophobicContact CE2-CB 3.92Å; F343-P429 HydrophobicContact CE2-CG 3.73Å; F343-P429 HydrophobicContact CG-CB 4.31Å; F343-P429 HydrophobicContact CZ-CG 4.28Å; F343-P429 VanDerWaalsContact O-CA 3.3Å; F343-P429 WeakPolarHBondContact O-CA 3.32Å; F343-P429 WeakPolarHBondContact O-CB 3.27Å; F343-P429 WeakPolarHBondContact O-CG 3.26Å
344	Q	94.2	Very high	92.5	Very high	47 Å²	47	65.2 Å²	65.2	22%	0.22	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	7.9	179.8	-64.3	172.6	92.6	0	0	113	Q340 Y341 W342 R347 Y348	Q340-Q344 WeakPolarHBondContact O-CG 3.38Å; Q340-Q344 PolarHBondContact O-NE2 3.11Å; Y341-Q344 PolarHBondContact O-N 3.09Å; W342-Q344 PolarHBondContact O-N 2.57Å; W342-Q344 VanDerWaalsContact O-N 3.17Å; Q344-R347 VanDerWaalsContact O-CD 3.25Å; Q344-R347 WeakPolarHBondContact O-CD 3.43Å; Q344-R347 VanDerWaalsContact O-CG 3.24Å; Q344-R347 WeakPolarHBondContact O-CG 3.37Å; Q344-Y348 HydrophobicContact CB-CD2 4.46Å; Q344-Y348 HydrophobicContact CB-CE2 3.77Å; Q344-Y348 HydrophobicContact CG-CE2 4.4Å; Q344-Y348 PolarHBondContact OE1-OH 2.91Å
345	G	91.9	Very high	92.3	Very high	3 Å²	3	69.2 Å²	69.2	3%	0.031	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	-152.1	177.8	0	0	0	0	0	113.2	W342 F343 R347 A428	W342-G345 PolarHBondContact O-N 3.48Å; W342-G345 VanDerWaalsContact O-N 3.09Å; F343-G345 PolarHBondContact O-N 3.3Å; G345-R347 VanDerWaalsContact C-N 3.34Å; G345-A428 VanDerWaalsContact CA-O 3.24Å; G345-A428 WeakPolarHBondContact CA-O 3.3Å
346	Q	85.1	Confident	92.1	Very high	118 Å²	118	71.5 Å²	71.5	55%	0.551	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	6.6	179.4	-58.2	-170.1	21.7	0	0	112.9	Y348 A349 E426	Q346-Y348 PolarHBondContact O-N 3.08Å; Q346-A349 WeakPolarHBondContact O-CB 3.41Å; Q346-A349 PolarHBondContact O-N 2.97Å; Q346-E426 CarbonylContact C-O 3.51Å; Q346-E426 WeakPolarHBondContact CA-O 3.29Å; Q346-E426 PolarHBondContact N-O 3.25Å
347	R	86.4	Confident	91.9	Very high	102 Å²	102	75.7 Å²	75.7	39%	0.385	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-37.1	-173.1	79.1	-174.1	-170.3	174.8	2.1	114	Q344 G345 F351 E426 E427	Q344-R347 VanDerWaalsContact O-CD 3.25Å; Q344-R347 WeakPolarHBondContact O-CD 3.43Å; Q344-R347 VanDerWaalsContact O-CG 3.24Å; Q344-R347 WeakPolarHBondContact O-CG 3.37Å; G345-R347 VanDerWaalsContact C-N 3.34Å; R347-F351 VanDerWaalsContact O-CD2 3.26Å; R347-F351 WeakPolarHBondContact O-CD2 3.35Å; R347-E426 PolarHBondContact N-O 2.86Å; R347-E427 HydrophobicContact CB-CG 4.22Å
348	Y	80.2	Confident	91.9	Very high	81 Å²	81	75.4 Å²	75.4	32%	0.318	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-37.4	-179.9	-65.3	-63	0	0	0	113.9	Y341 Q344 Q346 R350 F351 C352	Y341-Y348 HydrophobicContact CE2-CD2 4.29Å; Q344-Y348 HydrophobicContact CB-CD2 4.46Å; Q344-Y348 HydrophobicContact CB-CE2 3.77Å; Q344-Y348 HydrophobicContact CG-CE2 4.4Å; Q344-Y348 PolarHBondContact OE1-OH 2.91Å; Q346-Y348 PolarHBondContact O-N 3.08Å; Y348-R350 PolarHBondContact O-N 3.28Å; Y348-R350 VanDerWaalsContact O-N 3.14Å; Y348-F351 PolarHBondContact O-N 3.27Å; Y348-C352 PolarHBondContact O-N 3.48Å; Y348-C352 VanDerWaalsContact O-O 3.14Å
349	A	82	Confident	91.8	Very high	55 Å²	55	75.7 Å²	75.7	46%	0.455	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-25.7	-177.8	0	0	0	0	0	112.4	Q346 F351	Q346-A349 WeakPolarHBondContact O-CB 3.41Å; Q346-A349 PolarHBondContact O-N 2.97Å; A349-F351 VanDerWaalsContact C-N 3.3Å; A349-F351 PolarHBondContact O-N 3.49Å
350	R	84.2	Confident	91.8	Very high	142 Å²	142	79.5 Å²	79.5	54%	0.536	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-29.2	173.5	-61.1	174.3	64.4	-170	-0.5	113.6	Y348 E426 E427	Y348-R350 PolarHBondContact O-N 3.28Å; Y348-R350 VanDerWaalsContact O-N 3.14Å; R350-E426 WeakPolarHBondContact CD-OE2 3.34Å; R350-E427 IonicContact NH1-OE1 2.65Å
351	F	86.3	Confident	91.8	Very high	176 Å²	176	79.7 Å²	79.7	77%	0.772	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	-35.2	-175.8	-57.4	-75.5	0	0	0	113.2	R347 Y348 A349	R347-F351 VanDerWaalsContact O-CD2 3.26Å; R347-F351 WeakPolarHBondContact O-CD2 3.35Å; Y348-F351 PolarHBondContact O-N 3.27Å; A349-F351 VanDerWaalsContact C-N 3.3Å; A349-F351 PolarHBondContact O-N 3.49Å
352	C	88.3	Confident	92	Very high	67 Å²	67	78.7 Å²	78.7	45%	0.453	36%	0.363	S	S	.	.			trans	-156.9	122.9	-174.8	-163.9	0	0	0	0	112.3	Y348 W354	Y348-C352 PolarHBondContact O-N 3.48Å; Y348-C352 VanDerWaalsContact O-O 3.14Å; C352-W354 VanDerWaalsContact C-N 3.29Å; C352-W354 PolarHBondContact O-N 2.89Å; C352-W354 WeakPolarHBondContact SG-CB 3.29Å
353	S	91.9	Very high	92.1	Very high	89 Å²	89	79 Å²	79	62%	0.622	37%	0.366	S	S	*	.			trans	-86.6	9.8	174.5	54.8	0	0	0	0	114.2	W355 T356	S353-W355 VanDerWaalsContact C-N 3.29Å; S353-W355 PolarHBondContact O-N 3.17Å; S353-T356 WeakPolarHBondContact O-CB 3.45Å; S353-T356 PolarHBondContact O-N 3.26Å; S353-T356 PolarHBondContact O-OG1 3Å
354	W	95.2	Very high	92.1	Very high	146 Å²	146	81.2 Å²	81.2	55%	0.553	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-38	-175.7	-172.2	96.7	0	0	0	112.6	L290 C352 P358	L290-W354 HydrophobicContact CB-CH2 4.31Å; L290-W354 HydrophobicContact CD2-CH2 3.51Å; L290-W354 HydrophobicContact CD2-CZ2 4.39Å; L290-W354 HydrophobicContact CD2-CZ3 3.92Å; C352-W354 VanDerWaalsContact C-N 3.29Å; C352-W354 PolarHBondContact O-N 2.89Å; C352-W354 WeakPolarHBondContact SG-CB 3.29Å; W354-P358 HydrophobicContact CE3-CG 4.32Å; W354-P358 HydrophobicContact CZ3-CG 4.19Å; W354-P358 WeakPolarHBondContact O-CD 3.41Å; W354-P358 WeakPolarHBondContact O-CG 3.26Å
355	W	95.3	Very high	92.3	Very high	84 Å²	84	80 Å²	80	32%	0.318	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-14.6	-179.1	-71.6	106.9	0	0	0	114.9	L290 W337 Y341 S353 P358 M359	L290-W355 HydrophobicContact CB-CZ3 4.32Å; L290-W355 HydrophobicContact CD1-CZ3 4.49Å; W337-W355 HydrophobicContact CZ3-CH2 4.16Å; W337-W355 AromaticContact CZ3-CZ3 4Å; W337-W355 HydrophobicContact CZ3-CZ3 4Å; Y341-W355 HydrophobicContact CD2-CB 4.42Å; Y341-W355 HydrophobicContact CE2-CB 3.55Å; Y341-W355 HydrophobicContact CE2-CG 4.13Å; S353-W355 VanDerWaalsContact C-N 3.29Å; S353-W355 PolarHBondContact O-N 3.17Å; W355-P358 HydrophobicContact CE3-CB 4.25Å; W355-P358 WeakPolarHBondContact O-CD 3.42Å; W355-M359 HydrophobicContact CE3-CE 3.66Å; W355-M359 HydrophobicContact CZ3-CE 3.96Å; W355-M359 WeakPolarHBondContact O-CB 3.27Å; W355-M359 VanDerWaalsContact O-CG 3.29Å; W355-M359 WeakPolarHBondContact O-CG 3.16Å; W355-M359 PolarHBondContact O-N 3.48Å
356	T	92.8	Very high	92.7	Very high	51 Å²	51	80.1 Å²	80.1	31%	0.313	37%	0.37	S	S	.	.	H	α-helix	trans	-58.4	-55.9	-175.6	-53.3	0	0	0	0	112.2	S353 M359 E360	S353-T356 WeakPolarHBondContact O-CB 3.45Å; S353-T356 PolarHBondContact O-N 3.26Å; S353-T356 PolarHBondContact O-OG1 3Å; T356-M359 PolarHBondContact O-N 2.84Å; T356-E360 WeakPolarHBondContact O-CG 3.49Å; T356-E360 PolarHBondContact O-N 3.13Å
357	R	95.6	Very high	93.3	Very high	205 Å²	205	78.4 Å²	78.4	77%	0.774	36%	0.361	S	S	*	.	H	α-helix	trans	-67.4	-41.9	179.5	-69.5	-178.3	-179.5	176.2	0.2	113.8	M359 E360 Q361	R357-M359 PolarHBondContact O-N 3.47Å; R357-E360 PolarHBondContact O-N 2.81Å; R357-Q361 PolarHBondContact O-N 3.35Å
358	P	97.4	Very high	93.9	Very high	17 Å²	17	76.3 Å²	76.3	11%	0.11	36%	0.357	C	S	.	.	H	α-helix	trans	-51	-50.5	169.5	-33	37.7	0	0	0	113.8	L290 W354 W355 Q361 L362	L290-P358 HydrophobicContact CD1-CB 3.82Å; L290-P358 HydrophobicContact CD2-CB 3.65Å; L290-P358 HydrophobicContact CD2-CG 3.63Å; L290-P358 HydrophobicContact CG-CB 4.41Å; W354-P358 HydrophobicContact CE3-CG 4.32Å; W354-P358 HydrophobicContact CZ3-CG 4.19Å; W354-P358 WeakPolarHBondContact O-CD 3.41Å; W354-P358 WeakPolarHBondContact O-CG 3.26Å; W355-P358 HydrophobicContact CE3-CB 4.25Å; W355-P358 WeakPolarHBondContact O-CD 3.42Å; P358-Q361 PolarHBondContact O-N 3.11Å; P358-Q361 VanDerWaalsContact O-N 3.11Å; P358-L362 WeakPolarHBondContact O-CG 3.37Å; P358-L362 PolarHBondContact O-N 2.68Å
359	M	97.4	Very high	94.7	Very high	7 Å²	7	72.5 Å²	72.5	3%	0.034	34%	0.342	C	S	.	.	H	α-helix	trans	-70.4	-37.2	-177.5	-66.2	-66.4	169.4	0	0	112.1	W337 L338 Y341 W355 T356 R357 Q361 L362 E363	W337-M359 HydrophobicContact CE3-CE 4.13Å; L338-M359 HydrophobicContact CD2-SD 4.36Å; Y341-M359 HydrophobicContact CD1-CB 4.18Å; Y341-M359 HydrophobicContact CD1-CG 3.65Å; Y341-M359 HydrophobicContact CD1-SD 4.16Å; Y341-M359 HydrophobicContact CD2-CE 3.85Å; Y341-M359 HydrophobicContact CD2-CG 4.02Å; Y341-M359 HydrophobicContact CD2-SD 4.36Å; Y341-M359 HydrophobicContact CE1-CB 4.16Å; Y341-M359 HydrophobicContact CE1-CG 3.82Å; Y341-M359 HydrophobicContact CE2-CG 4.17Å; Y341-M359 HydrophobicContact CG-CE 3.86Å; Y341-M359 HydrophobicContact CG-CG 3.75Å; Y341-M359 HydrophobicContact CG-SD 3.87Å; W355-M359 HydrophobicContact CE3-CE 3.66Å; W355-M359 HydrophobicContact CZ3-CE 3.96Å; W355-M359 WeakPolarHBondContact O-CB 3.27Å; W355-M359 VanDerWaalsContact O-CG 3.29Å; W355-M359 WeakPolarHBondContact O-CG 3.16Å; W355-M359 PolarHBondContact O-N 3.48Å; T356-M359 PolarHBondContact O-N 2.84Å; R357-M359 PolarHBondContact O-N 3.47Å; M359-Q361 PolarHBondContact O-N 3.03Å; M359-L362 PolarHBondContact O-N 3.01Å; M359-L362 HydrophobicContact SD-CD1 4.08Å; M359-E363 WeakPolarHBondContact O-CB 3.4Å; M359-E363 PolarHBondContact O-N 3.23Å
360	E	96.8	Very high	95.5	Very high	85 Å²	85	69.9 Å²	69.9	40%	0.397	32%	0.32	S	S	.	.	H	α-helix	trans	-60.4	-27.4	169.1	-76	173.1	-167.8	0	0	113.7	T356 R357 K364	T356-E360 WeakPolarHBondContact O-CG 3.49Å; T356-E360 PolarHBondContact O-N 3.13Å; R357-E360 PolarHBondContact O-N 2.81Å; E360-K364 VanDerWaalsContact O-CD 3.26Å; E360-K364 WeakPolarHBondContact O-CD 3.32Å; E360-K364 VanDerWaalsContact O-CE 3.23Å; E360-K364 WeakPolarHBondContact O-CE 3.32Å; E360-K364 VanDerWaalsContact O-CG 3.27Å; E360-K364 WeakPolarHBondContact O-CG 3.46Å; E360-K364 PolarHBondContact O-NZ 3.34Å
361	Q	98.4	Very high	96.2	Very high	76 Å²	76	64.2 Å²	64.2	36%	0.355	30%	0.302	S	S	.	.	H	α-helix	trans	-81.2	-47.5	175.4	-173.1	58.4	46.1	0	0	110.9	R357 P358 M359 E363 K364 D365	R357-Q361 PolarHBondContact O-N 3.35Å; P358-Q361 PolarHBondContact O-N 3.11Å; P358-Q361 VanDerWaalsContact O-N 3.11Å; M359-Q361 PolarHBondContact O-N 3.03Å; Q361-E363 PolarHBondContact O-N 3.09Å; Q361-K364 WeakPolarHBondContact O-CB 3.19Å; Q361-K364 PolarHBondContact O-N 3.43Å; Q361-D365 PolarHBondContact NE2-OD1 2.98Å; Q361-D365 VanDerWaalsContact O-CG 3.26Å; Q361-D365 PolarHBondContact O-N 2.62Å
362	L	98.7	Very high	96.8	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57.7	-36	176.4	-67	178.4	0	0	0	112	L290 I293 Q294 V333 W337 L338 P358 M359 D365 W366	L290-L362 HydrophobicContact CD1-CD1 4.23Å; I293-L362 HydrophobicContact CG1-CD2 4.1Å; I293-L362 HydrophobicContact CG2-CD1 4.08Å; I293-L362 HydrophobicContact CG2-CD2 4.05Å; Q294-L362 HydrophobicContact CG-CD2 4.28Å; V333-L362 HydrophobicContact CG2-CB 4.01Å; V333-L362 HydrophobicContact CG2-CD2 4.07Å; V333-L362 HydrophobicContact CG2-CG 4.44Å; W337-L362 HydrophobicContact CB-CD1 4.17Å; W337-L362 HydrophobicContact CD2-CD1 4.42Å; W337-L362 HydrophobicContact CE3-CD1 4.1Å; W337-L362 HydrophobicContact CG-CD1 4.45Å; L338-L362 HydrophobicContact CD2-CB 3.99Å; P358-L362 WeakPolarHBondContact O-CG 3.37Å; P358-L362 PolarHBondContact O-N 2.68Å; M359-L362 PolarHBondContact O-N 3.01Å; M359-L362 HydrophobicContact SD-CD1 4.08Å; L362-D365 PolarHBondContact O-N 3.28Å; L362-W366 WeakPolarHBondContact O-CB 3.45Å; L362-W366 PolarHBondContact O-N 2.86Å
363	E	98.4	Very high	97.3	Very high	44 Å²	44	52.9 Å²	52.9	21%	0.206	24%	0.244	C	C	.	.	H	α-helix	trans	-70.5	-30.4	175.8	-166.5	174.7	125.2	0	0	113	L338 M359 Q361 W366 K367 R432	L338-E363 HydrophobicContact CD1-CB 4.43Å; L338-E363 HydrophobicContact CD2-CB 4.02Å; M359-E363 WeakPolarHBondContact O-CB 3.4Å; M359-E363 PolarHBondContact O-N 3.23Å; Q361-E363 PolarHBondContact O-N 3.09Å; E363-W366 HydrophobicContact CG-CE3 4.28Å; E363-K367 VanDerWaalsContact O-CB 3.27Å; E363-K367 WeakPolarHBondContact O-CB 3.43Å; E363-K367 PolarHBondContact O-N 3.3Å; E363-K367 VanDerWaalsContact O-N 3.09Å; E363-R432 IonicContact OE1-CZ 3.86Å; E363-R432 IonicContact OE1-NE 3.39Å; E363-R432 PolarHBondContact OE1-NE 2.84Å; E363-R432 IonicContact OE1-NH2 3.81Å; E363-R432 PolarHBondContact OE1-NH2 3.29Å; E363-R432 IonicContact OE2-CZ 3.24Å; E363-R432 IonicContact OE2-NE 3.91Å; E363-R432 PolarHBondContact OE2-NE 2.89Å; E363-R432 IonicContact OE2-NH2 3.76Å; E363-R432 PolarHBondContact OE2-NH2 3.08Å
364	K	98.3	Very high	97.5	Very high	110 Å²	110	51.7 Å²	51.7	48%	0.478	23%	0.23	S	C	.	.	H	α-helix	trans	-71.5	-42.6	171.6	-69.6	162	-165.2	149.2	0	111	E360 Q361 K367 L368	E360-K364 VanDerWaalsContact O-CD 3.26Å; E360-K364 WeakPolarHBondContact O-CD 3.32Å; E360-K364 VanDerWaalsContact O-CE 3.23Å; E360-K364 WeakPolarHBondContact O-CE 3.32Å; E360-K364 VanDerWaalsContact O-CG 3.27Å; E360-K364 WeakPolarHBondContact O-CG 3.46Å; E360-K364 PolarHBondContact O-NZ 3.34Å; Q361-K364 WeakPolarHBondContact O-CB 3.19Å; Q361-K364 PolarHBondContact O-N 3.43Å; K364-K367 PolarHBondContact O-N 3.44Å; K364-L368 PolarHBondContact O-N 3.42Å; K364-L368 VanDerWaalsContact O-N 3.11Å
365	D	98.6	Very high	97.7	Very high	22 Å²	22	46.2 Å²	46.2	12%	0.118	21%	0.211	C	C	.	.	H	α-helix	trans	-66	-46.3	-179.8	-61	-19.4	0	0	0	110.3	C297 L301 Q361 L362 K367 L368 M369	C297-D365 HydrophobicContact CB-CB 4.08Å; L301-D365 HydrophobicContact CD1-CB 3.9Å; Q361-D365 PolarHBondContact NE2-OD1 2.98Å; Q361-D365 VanDerWaalsContact O-CG 3.26Å; Q361-D365 PolarHBondContact O-N 2.62Å; L362-D365 PolarHBondContact O-N 3.28Å; D365-K367 VanDerWaalsContact C-N 3.34Å; D365-K367 PolarHBondContact O-N 2.84Å; D365-L368 WeakPolarHBondContact O-CB 3.27Å; D365-L368 PolarHBondContact O-N 2.98Å; D365-L368 VanDerWaalsContact O-N 3.15Å; D365-M369 HydrophobicContact CB-CE 4.43Å; D365-M369 WeakPolarHBondContact O-CG 3.24Å; D365-M369 PolarHBondContact O-N 3.42Å; D365-M369 VanDerWaalsContact O-N 3.1Å
366	W	98.8	Very high	97.7	Very high	6 Å²	6	42.3 Å²	42.3	2%	0.023	20%	0.196	C	C	.	.	H	α-helix	trans	-55	-44.1	170.6	166.1	85.3	0	0	0	112.3	H330 V333 E334 L338 L362 E363 L368 M369 E370 P433 W435 M442	H330-W366 AromaticContact CD2-CD1 3.5Å; H330-W366 VanDerWaalsContact CD2-CD1 3.5Å; H330-W366 AromaticContact CD2-NE1 3.8Å; H330-W366 AromaticContact NE2-CD1 3.5Å; H330-W366 AromaticContact NE2-NE1 3.38Å; H330-W366 PolarHBondContact NE2-NE1 2.74Å; V333-W366 HydrophobicContact CG1-CB 3.97Å; V333-W366 HydrophobicContact CG1-CG 4.45Å; E334-W366 PolarHBondContact OE2-NE1 2.69Å; L338-W366 HydrophobicContact CD1-CB 3.69Å; L338-W366 HydrophobicContact CD1-CD2 4.14Å; L338-W366 HydrophobicContact CD1-CG 3.69Å; L362-W366 WeakPolarHBondContact O-CB 3.45Å; L362-W366 PolarHBondContact O-N 2.86Å; E363-W366 HydrophobicContact CG-CE3 4.28Å; W366-L368 VanDerWaalsContact C-N 3.28Å; W366-L368 PolarHBondContact O-N 2.92Å; W366-M369 CarbonylContact O-C 3.55Å; W366-M369 WeakPolarHBondContact O-CA 3.33Å; W366-M369 WeakPolarHBondContact O-CB 3.44Å; W366-M369 PolarHBondContact O-N 2.98Å; W366-E370 HydrophobicContact CH2-CG 4.11Å; W366-E370 HydrophobicContact CZ2-CG 3.73Å; W366-E370 PolarHBondContact O-N 3.25Å; W366-P433 HydrophobicContact CD2-CG 3.99Å; W366-P433 HydrophobicContact CE3-CB 4.15Å; W366-P433 HydrophobicContact CE3-CG 4.06Å; W366-P433 HydrophobicContact CH2-CB 3.38Å; W366-P433 HydrophobicContact CH2-CG 3.56Å; W366-P433 HydrophobicContact CZ2-CB 3.82Å; W366-P433 HydrophobicContact CZ2-CG 3.42Å; W366-P433 VanDerWaalsContact CZ2-CG 3.42Å; W366-P433 HydrophobicContact CZ3-CB 3.55Å; W366-P433 HydrophobicContact CZ3-CG 3.86Å; W366-W435 HydrophobicContact CH2-CE3 4.1Å; W366-W435 AromaticContact CH2-CH2 3.73Å; W366-W435 HydrophobicContact CH2-CH2 3.73Å; W366-W435 AromaticContact CH2-CZ3 3.34Å; W366-W435 HydrophobicContact CH2-CZ3 3.34Å; W366-W435 AromaticContact CZ2-CH2 3.67Å; W366-W435 HydrophobicContact CZ2-CH2 3.67Å; W366-W435 AromaticContact CZ2-CZ3 3.56Å; W366-W435 HydrophobicContact CZ2-CZ3 3.56Å; W366-M442 HydrophobicContact CH2-CE 3.43Å; W366-M442 VanDerWaalsContact CH2-CE 3.43Å; W366-M442 HydrophobicContact CZ2-CE 4.34Å; W366-M442 HydrophobicContact CZ3-CE 3.87Å
367	K	98.3	Very high	97.9	Very high	82 Å²	82	40.2 Å²	40.2	36%	0.357	18%	0.183	S	C	.	.	H	α-helix	trans	-66	-28.6	178.5	-178.1	164.9	-179.1	147.1	0	113.6	E363 K364 D365 T371 G441 M442	E363-K367 VanDerWaalsContact O-CB 3.27Å; E363-K367 WeakPolarHBondContact O-CB 3.43Å; E363-K367 PolarHBondContact O-N 3.3Å; E363-K367 VanDerWaalsContact O-N 3.09Å; K364-K367 PolarHBondContact O-N 3.44Å; D365-K367 VanDerWaalsContact C-N 3.34Å; D365-K367 PolarHBondContact O-N 2.84Å; K367-T371 PolarHBondContact O-N 2.7Å; K367-T371 PolarHBondContact O-OG1 2.87Å; K367-G441 WeakPolarHBondContact CE-O 3.35Å; K367-G441 PolarHBondContact NZ-O 2.86Å; K367-M442 HydrophobicContact CD-SD 3.93Å; K367-M442 VanDerWaalsContact CE-SD 3.58Å; K367-M442 HydrophobicContact CG-SD 4.21Å; K367-M442 PolarHBondContact NZ-SD 2.77Å
368	L	98.3	Very high	97.9	Very high	57 Å²	57	32.9 Å²	32.9	30%	0.298	17%	0.167	S	C	.	.	H	α-helix	trans	-71.7	-33	169.3	-69	173.2	0	0	0	111.3	L301 L304 K364 D365 W366 T371 M372	L301-L368 HydrophobicContact CD1-CD1 4.36Å; L301-L368 HydrophobicContact CD2-CB 3.55Å; L301-L368 HydrophobicContact CD2-CD1 4.13Å; L304-L368 HydrophobicContact CD2-CB 3.92Å; L304-L368 HydrophobicContact CD2-CD2 4.14Å; L304-L368 HydrophobicContact CD2-CG 4.44Å; K364-L368 PolarHBondContact O-N 3.42Å; K364-L368 VanDerWaalsContact O-N 3.11Å; D365-L368 WeakPolarHBondContact O-CB 3.27Å; D365-L368 PolarHBondContact O-N 2.98Å; D365-L368 VanDerWaalsContact O-N 3.15Å; W366-L368 VanDerWaalsContact C-N 3.28Å; W366-L368 PolarHBondContact O-N 2.92Å; L368-T371 WeakPolarHBondContact O-CA 3.2Å; L368-T371 VanDerWaalsContact O-CB 3.28Å; L368-T371 WeakPolarHBondContact O-CB 3.43Å; L368-T371 PolarHBondContact O-N 3.25Å; L368-T371 VanDerWaalsContact O-N 3.13Å; L368-M372 WeakPolarHBondContact O-CG 3.28Å; L368-M372 PolarHBondContact O-N 3.37Å
369	M	98.7	Very high	97.8	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-69.1	-36.9	173.8	-60.7	176	-154.7	0	0	112.8	C297 A300 L301 I329 H330 V333 D365 W366 T371 M372 T373	C297-M369 HydrophobicContact CB-CE 3.79Å; A300-M369 HydrophobicContact CB-CE 4.08Å; A300-M369 HydrophobicContact CB-SD 4.31Å; L301-M369 HydrophobicContact CD2-CG 4.32Å; L301-M369 HydrophobicContact CG-CE 4.34Å; I329-M369 HydrophobicContact CG2-CE 3.96Å; I329-M369 HydrophobicContact CG2-SD 4.05Å; H330-M369 HydrophobicContact CB-CB 4Å; H330-M369 HydrophobicContact CB-SD 3.99Å; V333-M369 HydrophobicContact CG1-CE 4.43Å; V333-M369 HydrophobicContact CG1-SD 4.06Å; D365-M369 HydrophobicContact CB-CE 4.43Å; D365-M369 WeakPolarHBondContact O-CG 3.24Å; D365-M369 PolarHBondContact O-N 3.42Å; D365-M369 VanDerWaalsContact O-N 3.1Å; W366-M369 CarbonylContact O-C 3.55Å; W366-M369 WeakPolarHBondContact O-CA 3.33Å; W366-M369 WeakPolarHBondContact O-CB 3.44Å; W366-M369 PolarHBondContact O-N 2.98Å; M369-T371 PolarHBondContact O-N 3.07Å; M369-M372 HydrophobicContact CG-SD 4.13Å; M369-M372 CarbonylContact O-C 3.55Å; M369-M372 WeakPolarHBondContact O-CA 3.26Å; M369-M372 WeakPolarHBondContact O-CB 3.29Å; M369-M372 PolarHBondContact O-N 2.99Å; M369-T373 PolarHBondContact O-N 3.25Å; M369-T373 PolarHBondContact O-OG1 2.94Å
370	E	98.4	Very high	97.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-54.6	-36.8	166.9	-78.3	-79.7	120.3	0	0	111.9	H330 W366 M374 R408 W435 M442 P443	H330-E370 PolarHBondContact CE1-N 3.46Å; H330-E370 IonicContact CE1-OE1 3.3Å; H330-E370 PolarHBondContact CE1-OE1 2.76Å; H330-E370 VanDerWaalsContact CE1-OE1 3.24Å; H330-E370 IonicContact NE2-OE1 2.74Å; H330-E370 PolarHBondContact NE2-OE1 2.76Å; W366-E370 HydrophobicContact CH2-CG 4.11Å; W366-E370 HydrophobicContact CZ2-CG 3.73Å; W366-E370 PolarHBondContact O-N 3.25Å; E370-M374 PolarHBondContact O-N 2.94Å; E370-M374 VanDerWaalsContact O-N 3.16Å; E370-R408 IonicContact OE1-CZ 3.55Å; E370-R408 IonicContact OE1-NH1 2.69Å; E370-R408 IonicContact OE1-NH2 3.19Å; E370-R408 PolarHBondContact OE1-NH2 2.93Å; E370-W435 VanDerWaalsContact OE2-CZ2 3.31Å; E370-W435 WeakPolarHBondContact OE2-CZ2 3.35Å; E370-M442 HydrophobicContact CB-CE 4.35Å; E370-M442 HydrophobicContact CG-CE 3.99Å; E370-P443 HydrophobicContact CB-CG 3.87Å
371	T	98	Very high	97.4	Very high	23 Å²	23	32 Å²	32	14%	0.141	16%	0.162	C	C	.	.	H	α-helix	trans	-70.7	-37.5	174.3	-51.9	0	0	0	0	111.8	H313 K367 L368 M369 M374 L375	H313-T371 HydrophobicContact CB-CG2 4.2Å; K367-T371 PolarHBondContact O-N 2.7Å; K367-T371 PolarHBondContact O-OG1 2.87Å; L368-T371 WeakPolarHBondContact O-CA 3.2Å; L368-T371 VanDerWaalsContact O-CB 3.28Å; L368-T371 WeakPolarHBondContact O-CB 3.43Å; L368-T371 PolarHBondContact O-N 3.25Å; L368-T371 VanDerWaalsContact O-N 3.13Å; M369-T371 PolarHBondContact O-N 3.07Å; T371-M374 HydrophobicContact CG2-CE 4.28Å; T371-M374 PolarHBondContact O-N 2.99Å; T371-L375 HydrophobicContact CG2-CD1 4.5Å; T371-L375 WeakPolarHBondContact O-CG 3.13Å; T371-L375 PolarHBondContact O-N 2.86Å
372	M	98.5	Very high	96.9	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.02	17%	0.169	C	C	.	.	H	α-helix	trans	-63.2	-43.8	173.9	-66.7	165.4	70.2	0	0	111.9	A300 L301 N303 L304 L315 C326 L368 M369 M374 L375 F376	A300-M372 WeakPolarHBondContact O-CE 3.1Å; L301-M372 HydrophobicContact CD2-SD 3.98Å; N303-M372 HydrophobicContact CB-CE 4.08Å; L304-M372 HydrophobicContact CB-CG 4.14Å; L304-M372 HydrophobicContact CB-SD 4.07Å; L304-M372 HydrophobicContact CD1-CG 3.9Å; L304-M372 HydrophobicContact CD2-CG 4.18Å; L304-M372 HydrophobicContact CD2-SD 4.44Å; L304-M372 HydrophobicContact CG-CG 4.3Å; L315-M372 HydrophobicContact CD2-CB 4Å; L315-M372 HydrophobicContact CD2-CE 4.43Å; L315-M372 HydrophobicContact CD2-CG 4Å; C326-M372 HydrophobicContact CB-CE 3.88Å; L368-M372 WeakPolarHBondContact O-CG 3.28Å; L368-M372 PolarHBondContact O-N 3.37Å; M369-M372 HydrophobicContact CG-SD 4.13Å; M369-M372 CarbonylContact O-C 3.55Å; M369-M372 WeakPolarHBondContact O-CA 3.26Å; M369-M372 WeakPolarHBondContact O-CB 3.29Å; M369-M372 PolarHBondContact O-N 2.99Å; M372-M374 VanDerWaalsContact C-N 3.31Å; M372-M374 PolarHBondContact O-N 2.96Å; M372-L375 PolarHBondContact O-N 2.96Å; M372-F376 WeakPolarHBondContact O-CB 3.15Å; M372-F376 PolarHBondContact O-N 2.74Å
373	T	98.4	Very high	95.9	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.006	21%	0.211	C	C	.	.	H	α-helix	trans	-60.6	-40	175.8	-56.1	0	0	0	0	111.2	E327 H330 M369 F376 L377 L397 L401 R404 L444	E327-T373 WeakPolarHBondContact OE1-CA 3.4Å; E327-T373 WeakPolarHBondContact OE1-CB 3.44Å; E327-T373 PolarHBondContact OE1-OG1 2.94Å; E327-T373 PolarHBondContact OE2-OG1 3.41Å; H330-T373 PolarHBondContact ND1-OG1 3.38Å; H330-T373 VanDerWaalsContact ND1-OG1 3.15Å; M369-T373 PolarHBondContact O-N 3.25Å; M369-T373 PolarHBondContact O-OG1 2.94Å; T373-F376 PolarHBondContact O-N 2.84Å; T373-L377 WeakPolarHBondContact O-CB 3.24Å; T373-L377 PolarHBondContact O-N 3.42Å; T373-L397 HydrophobicContact CG2-CD1 4.12Å; T373-L401 HydrophobicContact CG2-CD2 3.82Å; T373-R404 PolarHBondContact OG1-NH1 3.29Å; T373-L444 HydrophobicContact CG2-CD1 3.69Å
374	M	97.7	Very high	94.9	Very high	63 Å²	63	43.7 Å²	43.7	31%	0.31	24%	0.237	S	C	.	.	H	α-helix	trans	-62.5	-44.9	174	-177.5	-79	-62.5	0	0	112.3	E370 T371 M372 F376 L377 A378 P443 L444	E370-M374 PolarHBondContact O-N 2.94Å; E370-M374 VanDerWaalsContact O-N 3.16Å; T371-M374 HydrophobicContact CG2-CE 4.28Å; T371-M374 PolarHBondContact O-N 2.99Å; M372-M374 VanDerWaalsContact C-N 3.31Å; M372-M374 PolarHBondContact O-N 2.96Å; M374-F376 VanDerWaalsContact C-N 3.33Å; M374-F376 PolarHBondContact O-N 2.88Å; M374-L377 PolarHBondContact O-N 3.29Å; M374-A378 PolarHBondContact O-N 3.06Å; M374-P443 HydrophobicContact CB-CB 4.13Å; M374-P443 HydrophobicContact CG-CB 4.26Å; M374-L444 HydrophobicContact CB-CD1 4.38Å; M374-L444 HydrophobicContact CB-CD2 3.82Å; M374-L444 HydrophobicContact CB-CG 3.97Å; M374-L444 HydrophobicContact CG-CD2 4.05Å
375	L	97.8	Very high	93.9	Very high	32 Å²	32	40.5 Å²	40.5	17%	0.168	22%	0.223	C	C	.	.	H	α-helix	trans	-65	-36.8	176.3	-67.8	168.4	0	0	0	112.3	L304 H313 L315 T371 M372 T379	L304-L375 HydrophobicContact CD1-CD1 4.17Å; H313-L375 HydrophobicContact CB-CD1 3.92Å; L315-L375 HydrophobicContact CD1-CB 3.99Å; L315-L375 HydrophobicContact CD2-CB 4.47Å; L315-L375 HydrophobicContact CD2-CD1 4.44Å; L315-L375 HydrophobicContact CG-CB 3.9Å; L315-L375 HydrophobicContact CG-CD1 4.33Å; T371-L375 HydrophobicContact CG2-CD1 4.5Å; T371-L375 WeakPolarHBondContact O-CG 3.13Å; T371-L375 PolarHBondContact O-N 2.86Å; M372-L375 PolarHBondContact O-N 2.96Å; L375-T379 PolarHBondContact O-N 2.92Å; L375-T379 PolarHBondContact O-OG1 3.09Å
376	F	97.3	Very high	93.3	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.009	24%	0.244	C	C	.	.	H	α-helix	trans	-65.9	-47.2	175.8	-177.2	-167.6	0	0	0	110.6	L315 L323 E327 M372 T373 M374 A378 T379 V380 M393 T396 L397	L315-F376 HydrophobicContact CD1-CB 4.06Å; L323-F376 HydrophobicContact CB-CD1 4.24Å; L323-F376 HydrophobicContact CB-CE1 3.77Å; L323-F376 HydrophobicContact CB-CE2 4.3Å; L323-F376 HydrophobicContact CB-CZ 3.81Å; L323-F376 HydrophobicContact CD1-CD2 3.98Å; L323-F376 HydrophobicContact CD1-CE2 3.66Å; L323-F376 HydrophobicContact CD1-CZ 3.99Å; L323-F376 HydrophobicContact CD2-CD1 4.31Å; L323-F376 HydrophobicContact CD2-CD2 4.22Å; L323-F376 HydrophobicContact CD2-CG 4.12Å; L323-F376 HydrophobicContact CG-CE2 4.4Å; L323-F376 HydrophobicContact CG-CZ 4.4Å; E327-F376 HydrophobicContact CG-CD1 4.03Å; E327-F376 HydrophobicContact CG-CE1 4.06Å; M372-F376 WeakPolarHBondContact O-CB 3.15Å; M372-F376 PolarHBondContact O-N 2.74Å; T373-F376 PolarHBondContact O-N 2.84Å; M374-F376 VanDerWaalsContact C-N 3.33Å; M374-F376 PolarHBondContact O-N 2.88Å; F376-A378 PolarHBondContact O-N 3.46Å; F376-T379 WeakPolarHBondContact O-CA 3.24Å; F376-T379 WeakPolarHBondContact O-CB 3.3Å; F376-T379 PolarHBondContact O-N 3.31Å; F376-V380 HydrophobicContact CD2-CG2 3.93Å; F376-V380 HydrophobicContact CE2-CG2 3.71Å; F376-V380 PolarHBondContact O-N 2.86Å; F376-M393 HydrophobicContact CD2-CE 3.99Å; F376-M393 HydrophobicContact CE2-CB 4.02Å; F376-M393 HydrophobicContact CE2-CE 3.76Å; F376-M393 HydrophobicContact CE2-CG 4.37Å; F376-M393 VanDerWaalsContact CZ-O 3.28Å; F376-M393 WeakPolarHBondContact CZ-O 3.44Å; F376-T396 HydrophobicContact CE1-CG2 4.24Å; F376-T396 HydrophobicContact CZ-CG2 4.11Å; F376-L397 HydrophobicContact CD1-CB 4.37Å; F376-L397 HydrophobicContact CD1-CD1 3.74Å; F376-L397 HydrophobicContact CD1-CG 4.45Å; F376-L397 HydrophobicContact CE1-CB 3.78Å; F376-L397 HydrophobicContact CE1-CD1 3.9Å; F376-L397 HydrophobicContact CE1-CG 4.33Å; F376-L397 HydrophobicContact CE2-CB 4.33Å; F376-L397 HydrophobicContact CG-CD1 4.36Å; F376-L397 HydrophobicContact CZ-CB 3.75Å
377	L	96.9	Very high	92.6	Very high	7 Å²	7	47.7 Å²	47.7	4%	0.037	27%	0.268	C	S	.	.	H	α-helix	trans	-55.9	-46.7	174	-179.7	62.8	0	0	0	112.2	T373 M374 T379 V380 E381 L397 L444 I451 V455	T373-L377 WeakPolarHBondContact O-CB 3.24Å; T373-L377 PolarHBondContact O-N 3.42Å; M374-L377 PolarHBondContact O-N 3.29Å; L377-T379 PolarHBondContact O-N 2.78Å; L377-V380 PolarHBondContact O-N 3.22Å; L377-V380 VanDerWaalsContact O-N 3.17Å; L377-E381 VanDerWaalsContact CD1-OE1 3.27Å; L377-E381 WeakPolarHBondContact CD1-OE1 3.35Å; L377-E381 WeakPolarHBondContact CG-OE1 3.46Å; L377-E381 WeakPolarHBondContact O-CG 3.25Å; L377-E381 PolarHBondContact O-N 2.91Å; L377-L397 HydrophobicContact CB-CD2 4.06Å; L377-L397 HydrophobicContact CD1-CD2 3.89Å; L377-L444 HydrophobicContact CD2-CD2 4.29Å; L377-I451 HydrophobicContact CD1-CG2 3.9Å; L377-I451 HydrophobicContact CD2-CD1 4.22Å; L377-I451 HydrophobicContact CD2-CG1 4.43Å; L377-I451 HydrophobicContact CD2-CG2 3.59Å; L377-I451 HydrophobicContact CG-CG2 4.41Å; L377-V455 HydrophobicContact CD1-CG2 3.56Å
378	A	95.6	Very high	92.1	Very high	51 Å²	51	51.6 Å²	51.6	42%	0.421	29%	0.287	S	S	.	.	H	α-helix	trans	-61.4	-32.2	175.2	0	0	0	0	0	113	M374 F376 E382	M374-A378 PolarHBondContact O-N 3.06Å; F376-A378 PolarHBondContact O-N 3.46Å; A378-E382 PolarHBondContact O-N 2.96Å
379	T	93.6	Very high	91.6	Very high	23 Å²	23	53.2 Å²	53.2	14%	0.141	29%	0.29	C	S	.	.	H	α-helix	trans	-73.8	-36.6	175.6	-50.7	0	0	0	0	112	L318 L375 F376 L377 E381 E382 M393	L318-T379 HydrophobicContact CD1-CG2 3.7Å; L318-T379 HydrophobicContact CD2-CG2 3.91Å; L318-T379 HydrophobicContact CG-CG2 4.37Å; L375-T379 PolarHBondContact O-N 2.92Å; L375-T379 PolarHBondContact O-OG1 3.09Å; F376-T379 WeakPolarHBondContact O-CA 3.24Å; F376-T379 WeakPolarHBondContact O-CB 3.3Å; F376-T379 PolarHBondContact O-N 3.31Å; L377-T379 PolarHBondContact O-N 2.78Å; T379-E381 VanDerWaalsContact C-N 3.29Å; T379-E382 PolarHBondContact O-N 3.47Å; T379-M393 HydrophobicContact CG2-CE 3.67Å
380	V	93.4	Very high	91.2	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-65	-36.6	173	169.9	0	0	0	0	110.7	F376 L377 E382 R390 M393 A394 L397 L458	F376-V380 HydrophobicContact CD2-CG2 3.93Å; F376-V380 HydrophobicContact CE2-CG2 3.71Å; F376-V380 PolarHBondContact O-N 2.86Å; L377-V380 PolarHBondContact O-N 3.22Å; L377-V380 VanDerWaalsContact O-N 3.17Å; V380-E382 VanDerWaalsContact C-N 3.34Å; V380-E382 PolarHBondContact O-N 3.11Å; V380-R390 WeakPolarHBondContact O-CD 3.4Å; V380-R390 VanDerWaalsContact O-CG 3.3Å; V380-R390 WeakPolarHBondContact O-CG 3.49Å; V380-R390 PolarHBondContact O-NE 3.19Å; V380-M393 HydrophobicContact CG2-CB 4.03Å; V380-M393 HydrophobicContact CG2-CE 4.45Å; V380-A394 HydrophobicContact CG1-CB 3.72Å; V380-L397 HydrophobicContact CB-CD2 4.49Å; V380-L397 HydrophobicContact CG2-CD2 4.06Å; V380-L458 HydrophobicContact CG1-CD1 3.89Å
381	E	92.3	Very high	90.9	Very high	66 Å²	66	59 Å²	59	31%	0.308	31%	0.312	S	S	.	.	S	Bend	trans	-77.5	-12.2	178.4	-75.8	165.7	-165.6	0	0	114.5	L377 T379 E383 R454 L458	L377-E381 VanDerWaalsContact CD1-OE1 3.27Å; L377-E381 WeakPolarHBondContact CD1-OE1 3.35Å; L377-E381 WeakPolarHBondContact CG-OE1 3.46Å; L377-E381 WeakPolarHBondContact O-CG 3.25Å; L377-E381 PolarHBondContact O-N 2.91Å; T379-E381 VanDerWaalsContact C-N 3.29Å; E381-E383 PolarHBondContact O-N 3.27Å; E381-E383 VanDerWaalsContact O-N 3.09Å; E381-R454 VanDerWaalsContact CD-NH2 3.35Å; E381-R454 IonicContact OE1-CZ 3.87Å; E381-R454 IonicContact OE1-NE 2.68Å; E381-R454 PolarHBondContact OE1-NE 2.8Å; E381-R454 IonicContact OE1-NH2 3.24Å; E381-R454 PolarHBondContact OE1-NH2 3.11Å; E381-R454 IonicContact OE2-CZ 3.94Å; E381-R454 IonicContact OE2-NE 2.99Å; E381-R454 IonicContact OE2-NH2 3.57Å; E381-R454 PolarHBondContact OE2-NH2 3.24Å; E381-L458 HydrophobicContact CG-CD1 3.83Å
382	E	89.9	Confident	90.7	Very high	104 Å²	104	62.4 Å²	62.4	49%	0.486	33%	0.326	S	S	.	.			trans	-67.2	108.1	-177	-172.5	-174.3	-145.3	0	0	112.2	A378 T379 V380 G384 Q385 R390	A378-E382 PolarHBondContact O-N 2.96Å; T379-E382 PolarHBondContact O-N 3.47Å; V380-E382 VanDerWaalsContact C-N 3.34Å; V380-E382 PolarHBondContact O-N 3.11Å; E382-G384 PolarHBondContact O-N 3.17Å; E382-Q385 HydrophobicContact CB-CG 4.46Å; E382-Q385 PolarHBondContact OE2-NE2 3.02Å; E382-R390 PolarHBondContact O-NE 2.98Å; E382-R390 PolarHBondContact O-NH2 3.3Å
383	E	77.4	Confident	90.5	Very high	189 Å²	189	62.3 Å²	62.3	88%	0.883	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	109.7	170.2	-65.3	-173.6	176.6	0	0	110.7	E381	E381-E383 PolarHBondContact O-N 3.27Å; E381-E383 VanDerWaalsContact O-N 3.09Å
384	G	75.9	Confident	90.3	Very high	73 Å²	73	62.3 Å²	62.3	75%	0.753	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	142.6	-27.2	-178.1	0	0	0	0	0	114.8	E382 R390	E382-G384 PolarHBondContact O-N 3.17Å; G384-R390 VanDerWaalsContact N-NH2 3.1Å
385	Q	78.4	Confident	90.2	Very high	42 Å²	42	64.2 Å²	64.2	20%	0.196	33%	0.333	C	S	.	.	S	Bend	trans	-58.7	151.2	168.4	-61.6	-76.2	-23.4	0	0	111.6	E382 R389 R390	E382-Q385 HydrophobicContact CB-CG 4.46Å; E382-Q385 PolarHBondContact OE2-NE2 3.02Å; Q385-R389 VanDerWaalsContact OE1-NH1 3.11Å; Q385-R390 HydrophobicContact CB-CB 4.44Å; Q385-R390 VanDerWaalsContact N-NH2 3.1Å; Q385-R390 PolarHBondContact O-NH2 2.96Å
386	A	85	Confident	90.1	Very high	67 Å²	67	63.8 Å²	63.8	55%	0.554	33%	0.332	S	S	*	.			trans	-63	134.5	172.5	0	0	0	0	0	111.1	E388 R389 R390	A386-E388 PolarHBondContact O-N 2.95Å; A386-R389 PolarHBondContact O-N 3.45Å; A386-R390 PolarHBondContact O-N 3.12Å
387	E	85.8	Confident	90.1	Very high	113 Å²	113	63.7 Å²	63.7	53%	0.528	33%	0.331	S	S	.	.	H	α-helix	trans	-57.8	-48.7	-170	-173.8	166.3	-120.8	0	0	113.8	R389 R390 R391 M462	E387-R389 PolarHBondContact O-N 3.24Å; E387-R390 PolarHBondContact O-N 2.94Å; E387-R391 PolarHBondContact O-N 3.42Å; E387-M462 HydrophobicContact CG-CB 3.92Å; E387-M462 HydrophobicContact CG-CG 4.12Å; E387-M462 HydrophobicContact CG-SD 4.43Å
388	E	87.5	Confident	90.1	Very high	163 Å²	163	64.8 Å²	64.8	76%	0.762	34%	0.337	S	S	*	.	H	α-helix	trans	-57.2	-45.6	177.1	-176.1	174.5	-152	0	0	112.3	A386 R391 E392	A386-E388 PolarHBondContact O-N 2.95Å; E388-R391 PolarHBondContact O-N 3.01Å; E388-E392 PolarHBondContact O-N 3.24Å
389	R	87	Confident	90.2	Very high	92 Å²	92	66.4 Å²	66.4	35%	0.347	35%	0.346	S	S	.	.	H	α-helix	trans	-68.1	-39.3	177.4	-173.6	-172.9	-179.5	-158.9	7.5	112.1	L318 Q385 A386 E387 R391 M393	L318-R389 PolarHBondContact O-NH2 3.15Å; Q385-R389 VanDerWaalsContact OE1-NH1 3.11Å; A386-R389 PolarHBondContact O-N 3.45Å; E387-R389 PolarHBondContact O-N 3.24Å; R389-R391 VanDerWaalsContact C-N 3.32Å; R389-M393 HydrophobicContact CG-SD 4.16Å; R389-M393 WeakPolarHBondContact O-CB 3.25Å; R389-M393 VanDerWaalsContact O-CG 3.3Å; R389-M393 WeakPolarHBondContact O-CG 3.24Å; R389-M393 PolarHBondContact O-N 3.39Å
390	R	90.7	Very high	90.4	Very high	36 Å²	36	66 Å²	66	14%	0.136	34%	0.344	C	S	.	.	H	α-helix	trans	-64.6	-39.2	175.7	-170.4	-169	-68.8	106.6	8.2	110.3	V380 E382 G384 Q385 A386 E387 M393 A394 M462	V380-R390 WeakPolarHBondContact O-CD 3.4Å; V380-R390 VanDerWaalsContact O-CG 3.3Å; V380-R390 WeakPolarHBondContact O-CG 3.49Å; V380-R390 PolarHBondContact O-NE 3.19Å; E382-R390 PolarHBondContact O-NE 2.98Å; E382-R390 PolarHBondContact O-NH2 3.3Å; G384-R390 VanDerWaalsContact N-NH2 3.1Å; Q385-R390 HydrophobicContact CB-CB 4.44Å; Q385-R390 VanDerWaalsContact N-NH2 3.1Å; Q385-R390 PolarHBondContact O-NH2 2.96Å; A386-R390 PolarHBondContact O-N 3.12Å; E387-R390 PolarHBondContact O-N 2.94Å; R390-M393 PolarHBondContact O-N 3.31Å; R390-A394 VanDerWaalsContact O-CB 3.27Å; R390-A394 WeakPolarHBondContact O-CB 3.23Å; R390-A394 PolarHBondContact O-N 3.48Å; R390-M462 HydrophobicContact CB-SD 3.78Å; R390-M462 VanDerWaalsContact CD-SD 3.59Å; R390-M462 HydrophobicContact CG-CE 4.26Å; R390-M462 HydrophobicContact CG-SD 3.79Å
391	R	92.3	Very high	90.6	Very high	88 Å²	88	66 Å²	66	33%	0.332	34%	0.344	S	S	.	.	H	α-helix	trans	-61.2	-53.2	174.7	-171.8	-174.6	-74.9	137.9	-4.8	111.5	E387 E388 R389 M393 A394 E395 L459 M462	E387-R391 PolarHBondContact O-N 3.42Å; E388-R391 PolarHBondContact O-N 3.01Å; R389-R391 VanDerWaalsContact C-N 3.32Å; R391-M393 VanDerWaalsContact C-N 3.3Å; R391-M393 PolarHBondContact O-N 2.7Å; R391-A394 PolarHBondContact O-N 2.95Å; R391-A394 VanDerWaalsContact O-N 3.07Å; R391-E395 WeakPolarHBondContact CD-OE1 3.23Å; R391-E395 HydrophobicContact CG-CG 4.45Å; R391-E395 WeakPolarHBondContact CG-OE1 3.37Å; R391-E395 WeakPolarHBondContact O-CG 3.46Å; R391-E395 PolarHBondContact O-N 3.43Å; R391-L459 HydrophobicContact CB-CD2 4.46Å; R391-L459 HydrophobicContact CG-CD2 3.7Å; R391-M462 HydrophobicContact CB-CE 4.06Å; R391-M462 HydrophobicContact CB-SD 4.43Å; R391-M462 PolarHBondContact NH2-O 3.44Å; R391-M462 PolarHBondContact NH2-OXT 2.65Å
392	E	93.1	Very high	90.9	Very high	94 Å²	94	65.9 Å²	65.9	44%	0.439	35%	0.348	S	S	.	.	H	α-helix	trans	-56	-44.1	177.8	-172.7	-173.4	179.7	0	0	112.1	P320 E388 E395 T396	P320-E392 HydrophobicContact CB-CG 3.93Å; P320-E392 WeakPolarHBondContact CB-OE1 3.31Å; P320-E392 VanDerWaalsContact CG-CD 3.42Å; P320-E392 HydrophobicContact CG-CG 3.94Å; P320-E392 WeakPolarHBondContact CG-OE1 3.39Å; E388-E392 PolarHBondContact O-N 3.24Å; E392-E395 PolarHBondContact O-N 2.69Å; E392-T396 PolarHBondContact O-N 3.19Å; E392-T396 VanDerWaalsContact O-N 3.07Å; E392-T396 PolarHBondContact O-OG1 3.24Å
393	M	93.8	Very high	91.3	Very high	2 Å²	2	64.2 Å²	64.2	1%	0.01	34%	0.343	C	S	.	.	H	α-helix	trans	-64	-40.5	175.5	-78.1	-179.4	62.2	0	0	112.9	P320 L323 F376 T379 V380 R389 R390 R391 L397	P320-M393 HydrophobicContact CG-CG 4.15Å; L323-M393 HydrophobicContact CD1-CE 3.78Å; L323-M393 HydrophobicContact CD1-CG 4.33Å; L323-M393 HydrophobicContact CD1-SD 4.42Å; F376-M393 HydrophobicContact CD2-CE 3.99Å; F376-M393 HydrophobicContact CE2-CB 4.02Å; F376-M393 HydrophobicContact CE2-CE 3.76Å; F376-M393 HydrophobicContact CE2-CG 4.37Å; F376-M393 VanDerWaalsContact CZ-O 3.28Å; F376-M393 WeakPolarHBondContact CZ-O 3.44Å; T379-M393 HydrophobicContact CG2-CE 3.67Å; V380-M393 HydrophobicContact CG2-CB 4.03Å; V380-M393 HydrophobicContact CG2-CE 4.45Å; R389-M393 HydrophobicContact CG-SD 4.16Å; R389-M393 WeakPolarHBondContact O-CB 3.25Å; R389-M393 VanDerWaalsContact O-CG 3.3Å; R389-M393 WeakPolarHBondContact O-CG 3.24Å; R389-M393 PolarHBondContact O-N 3.39Å; R390-M393 PolarHBondContact O-N 3.31Å; R391-M393 VanDerWaalsContact C-N 3.3Å; R391-M393 PolarHBondContact O-N 2.7Å; M393-L397 WeakPolarHBondContact O-CB 3.29Å; M393-L397 PolarHBondContact O-N 2.87Å
394	A	95.2	Very high	92.3	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-70	-37.8	177.3	0	0	0	0	0	112.5	V380 R390 R391 L397 L398 V455 L459 M462	V380-A394 HydrophobicContact CG1-CB 3.72Å; R390-A394 VanDerWaalsContact O-CB 3.27Å; R390-A394 WeakPolarHBondContact O-CB 3.23Å; R390-A394 PolarHBondContact O-N 3.48Å; R391-A394 PolarHBondContact O-N 2.95Å; R391-A394 VanDerWaalsContact O-N 3.07Å; A394-L397 PolarHBondContact O-N 2.87Å; A394-L398 WeakPolarHBondContact O-CB 3.42Å; A394-L398 PolarHBondContact O-N 3.24Å; A394-V455 HydrophobicContact CB-CG1 4.09Å; A394-V455 WeakPolarHBondContact O-CG1 3.47Å; A394-L459 HydrophobicContact CB-CD2 3.55Å; A394-L459 HydrophobicContact CB-CG 3.92Å; A394-M462 HydrophobicContact CB-CE 4.4Å
395	E	95.6	Very high	93.4	Very high	104 Å²	104	53.4 Å²	53.4	49%	0.486	27%	0.272	S	S	.	.	H	α-helix	trans	-62.8	-46	174.3	-73.2	169.9	-176.3	0	0	111.3	R391 E392 L398 S399 L459	R391-E395 WeakPolarHBondContact CD-OE1 3.23Å; R391-E395 HydrophobicContact CG-CG 4.45Å; R391-E395 WeakPolarHBondContact CG-OE1 3.37Å; R391-E395 WeakPolarHBondContact O-CG 3.46Å; R391-E395 PolarHBondContact O-N 3.43Å; E392-E395 PolarHBondContact O-N 2.69Å; E395-L398 PolarHBondContact O-N 3.5Å; E395-S399 PolarHBondContact O-N 2.98Å; E395-L459 HydrophobicContact CG-CD1 4.2Å; E395-L459 HydrophobicContact CG-CD2 3.8Å
396	T	95.8	Very high	94.4	Very high	22 Å²	22	57 Å²	57	14%	0.135	29%	0.289	C	S	.	.	H	α-helix	trans	-58.8	-48.3	174.5	-70.9	0	0	0	0	112	Q324 F376 E392 A400	Q324-T396 HydrophobicContact CB-CG2 3.56Å; Q324-T396 HydrophobicContact CG-CG2 4.19Å; F376-T396 HydrophobicContact CE1-CG2 4.24Å; F376-T396 HydrophobicContact CZ-CG2 4.11Å; E392-T396 PolarHBondContact O-N 3.19Å; E392-T396 VanDerWaalsContact O-N 3.07Å; E392-T396 PolarHBondContact O-OG1 3.24Å; T396-A400 PolarHBondContact O-N 2.86Å
397	L	97.1	Very high	95	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.2	-43.9	179.7	-178.4	58.3	0	0	0	111.6	T373 F376 L377 V380 M393 A394 S399 A400 L401 V455	T373-L397 HydrophobicContact CG2-CD1 4.12Å; F376-L397 HydrophobicContact CD1-CB 4.37Å; F376-L397 HydrophobicContact CD1-CD1 3.74Å; F376-L397 HydrophobicContact CD1-CG 4.45Å; F376-L397 HydrophobicContact CE1-CB 3.78Å; F376-L397 HydrophobicContact CE1-CD1 3.9Å; F376-L397 HydrophobicContact CE1-CG 4.33Å; F376-L397 HydrophobicContact CE2-CB 4.33Å; F376-L397 HydrophobicContact CG-CD1 4.36Å; F376-L397 HydrophobicContact CZ-CB 3.75Å; L377-L397 HydrophobicContact CB-CD2 4.06Å; L377-L397 HydrophobicContact CD1-CD2 3.89Å; V380-L397 HydrophobicContact CB-CD2 4.49Å; V380-L397 HydrophobicContact CG2-CD2 4.06Å; M393-L397 WeakPolarHBondContact O-CB 3.29Å; M393-L397 PolarHBondContact O-N 2.87Å; A394-L397 PolarHBondContact O-N 2.87Å; L397-S399 PolarHBondContact O-N 2.83Å; L397-A400 PolarHBondContact O-N 3.17Å; L397-L401 HydrophobicContact CD1-CD1 3.83Å; L397-L401 HydrophobicContact CD1-CD2 4.3Å; L397-L401 HydrophobicContact CD1-CG 3.8Å; L397-L401 HydrophobicContact CD2-CD1 4.36Å; L397-L401 HydrophobicContact CG-CD1 3.72Å; L397-L401 HydrophobicContact CG-CG 4.12Å; L397-L401 WeakPolarHBondContact O-CB 3.33Å; L397-L401 VanDerWaalsContact O-CG 3.28Å; L397-L401 WeakPolarHBondContact O-CG 3.23Å; L397-L401 PolarHBondContact O-N 3.17Å; L397-V455 HydrophobicContact CD2-CG2 4.2Å
398	L	97.7	Very high	95.6	Very high	30 Å²	30	51 Å²	51	16%	0.157	25%	0.25	C	C	.	.	H	α-helix	trans	-60.1	-45	179.9	179.1	59.7	0	0	0	111.9	A394 E395 A400 L401 T402 I452 V455 E456 L459	A394-L398 WeakPolarHBondContact O-CB 3.42Å; A394-L398 PolarHBondContact O-N 3.24Å; E395-L398 PolarHBondContact O-N 3.5Å; L398-A400 PolarHBondContact O-N 3.42Å; L398-L401 PolarHBondContact O-N 3.34Å; L398-T402 VanDerWaalsContact O-CB 3.3Å; L398-T402 WeakPolarHBondContact O-CB 3.33Å; L398-T402 PolarHBondContact O-N 3.09Å; L398-T402 PolarHBondContact O-OG1 2.88Å; L398-I452 HydrophobicContact CD1-CB 4.5Å; L398-I452 HydrophobicContact CD1-CG2 3.78Å; L398-V455 HydrophobicContact CB-CG1 3.96Å; L398-E456 HydrophobicContact CD1-CG 3.75Å; L398-E456 HydrophobicContact CD2-CG 3.78Å; L398-E456 HydrophobicContact CG-CG 4.45Å; L398-L459 HydrophobicContact CD2-CD1 3.59Å
399	S	97.1	Very high	96.1	Very high	86 Å²	86	45.7 Å²	45.7	60%	0.601	23%	0.225	S	C	*	.	H	α-helix	trans	-57.2	-50.5	177.8	-173.8	0	0	0	0	111.4	E395 L397 T402 D403	E395-S399 PolarHBondContact O-N 2.98Å; L397-S399 PolarHBondContact O-N 2.83Å; S399-T402 PolarHBondContact O-N 2.99Å; S399-D403 PolarHBondContact O-N 2.94Å
400	A	97.8	Very high	96.6	Very high	13 Å²	13	43.9 Å²	43.9	11%	0.107	22%	0.224	C	C	.	.	H	α-helix	trans	-68.9	-39.3	-178.4	0	0	0	0	0	113.7	E327 N331 T396 L397 L398 R404	E327-A400 HydrophobicContact CB-CB 3.58Å; E327-A400 HydrophobicContact CG-CB 4.3Å; N331-A400 PolarHBondContact ND2-O 3.09Å; T396-A400 PolarHBondContact O-N 2.86Å; L397-A400 PolarHBondContact O-N 3.17Å; L398-A400 PolarHBondContact O-N 3.42Å; A400-R404 VanDerWaalsContact O-CB 3.27Å; A400-R404 WeakPolarHBondContact O-CB 3.17Å; A400-R404 PolarHBondContact O-N 2.87Å
401	L	98.4	Very high	97	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-66.1	-38.8	176.5	-71.8	178.9	0	0	0	112.2	T373 L397 L398 R404 H405 L448 I451 I452 V455	T373-L401 HydrophobicContact CG2-CD2 3.82Å; L397-L401 HydrophobicContact CD1-CD1 3.83Å; L397-L401 HydrophobicContact CD1-CD2 4.3Å; L397-L401 HydrophobicContact CD1-CG 3.8Å; L397-L401 HydrophobicContact CD2-CD1 4.36Å; L397-L401 HydrophobicContact CG-CD1 3.72Å; L397-L401 HydrophobicContact CG-CG 4.12Å; L397-L401 WeakPolarHBondContact O-CB 3.33Å; L397-L401 VanDerWaalsContact O-CG 3.28Å; L397-L401 WeakPolarHBondContact O-CG 3.23Å; L397-L401 PolarHBondContact O-N 3.17Å; L398-L401 PolarHBondContact O-N 3.34Å; L401-R404 PolarHBondContact O-N 3.06Å; L401-H405 WeakPolarHBondContact O-CB 3.41Å; L401-H405 PolarHBondContact O-N 3Å; L401-L448 HydrophobicContact CD2-CD1 4.09Å; L401-I451 HydrophobicContact CD1-CG2 3.74Å; L401-I452 HydrophobicContact CB-CD1 4.43Å; L401-I452 HydrophobicContact CB-CG1 3.9Å; L401-V455 HydrophobicContact CD1-CG2 4.43Å
402	T	98.3	Very high	97.2	Very high	64 Å²	64	42 Å²	42	39%	0.393	22%	0.217	S	C	.	.	H	α-helix	trans	-65.3	-47.6	180	-56.9	0	0	0	0	110.9	L398 S399 H405 Q406	L398-T402 VanDerWaalsContact O-CB 3.3Å; L398-T402 WeakPolarHBondContact O-CB 3.33Å; L398-T402 PolarHBondContact O-N 3.09Å; L398-T402 PolarHBondContact O-OG1 2.88Å; S399-T402 PolarHBondContact O-N 2.99Å; T402-H405 PolarHBondContact O-N 3.24Å; T402-Q406 PolarHBondContact O-N 3.42Å
403	D	98.2	Very high	97.4	Very high	69 Å²	69	42.8 Å²	42.8	37%	0.369	22%	0.224	S	C	.	.	H	α-helix	trans	-58.3	-49.8	172.7	176.9	47.1	0	0	0	111.3	N331 S399 H405 Q406 Q407	N331-D403 PolarHBondContact ND2-OD2 2.89Å; S399-D403 PolarHBondContact O-N 2.94Å; D403-H405 VanDerWaalsContact C-N 3.32Å; D403-H405 PolarHBondContact O-N 3.28Å; D403-Q406 PolarHBondContact O-N 2.84Å; D403-Q407 VanDerWaalsContact CG-NE2 3.31Å; D403-Q407 WeakPolarHBondContact O-CB 3.19Å; D403-Q407 WeakPolarHBondContact O-CG 3.47Å; D403-Q407 PolarHBondContact O-N 2.95Å; D403-Q407 PolarHBondContact OD1-NE2 2.76Å; D403-Q407 PolarHBondContact OD2-NE2 3.03Å; D403-Q407 VanDerWaalsContact OD2-NE2 3.16Å
404	R	98.7	Very high	97.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-57.9	-41.5	178.2	-171	176.6	-58	138.1	16	112.7	E327 H330 N331 F335 T373 A400 L401 R408 L448	E327-R404 PolarHBondContact O-NH2 3.04Å; E327-R404 IonicContact OE2-CZ 2.75Å; E327-R404 IonicContact OE2-NH1 3.89Å; E327-R404 PolarHBondContact OE2-NH1 3.33Å; E327-R404 IonicContact OE2-NH2 3.11Å; E327-R404 PolarHBondContact OE2-NH2 3.11Å; H330-R404 VanDerWaalsContact ND1-CZ 3.32Å; H330-R404 PolarHBondContact ND1-NH1 3.38Å; N331-R404 PolarHBondContact OD1-NE 3.41Å; N331-R404 PolarHBondContact OD1-NH2 3.46Å; F335-R404 HydrophobicContact CE2-CB 4.27Å; F335-R404 HydrophobicContact CE2-CG 3.98Å; F335-R404 HydrophobicContact CZ-CB 4.4Å; F335-R404 HydrophobicContact CZ-CG 3.86Å; F335-R404 WeakPolarHBondContact CZ-O 3.28Å; T373-R404 PolarHBondContact OG1-NH1 3.29Å; A400-R404 VanDerWaalsContact O-CB 3.27Å; A400-R404 WeakPolarHBondContact O-CB 3.17Å; A400-R404 PolarHBondContact O-N 2.87Å; L401-R404 PolarHBondContact O-N 3.06Å; R404-R408 WeakPolarHBondContact O-CB 3.43Å; R404-R408 VanDerWaalsContact O-CG 3.31Å; R404-R408 WeakPolarHBondContact O-CG 3.49Å; R404-R408 PolarHBondContact O-N 2.95Å; R404-L448 HydrophobicContact CB-CD1 4.08Å; R404-L448 HydrophobicContact CG-CD1 3.93Å
405	H	98.4	Very high	97.6	Very high	35 Å²	35	48.9 Å²	48.9	16%	0.162	25%	0.249	C	C	.	.	H	α-helix	trans	-65.7	-50.2	177.3	-177.7	66.5	0	0	0	111.7	L401 T402 D403 Q407 R408 Q409 D447 L448 I452	L401-H405 WeakPolarHBondContact O-CB 3.41Å; L401-H405 PolarHBondContact O-N 3Å; T402-H405 PolarHBondContact O-N 3.24Å; D403-H405 VanDerWaalsContact C-N 3.32Å; D403-H405 PolarHBondContact O-N 3.28Å; H405-Q407 VanDerWaalsContact C-N 3.32Å; H405-Q407 PolarHBondContact O-N 3.49Å; H405-R408 PolarHBondContact O-N 3.41Å; H405-Q409 PolarHBondContact CE1-NE2 2.84Å; H405-Q409 VanDerWaalsContact CE1-NE2 3.31Å; H405-Q409 WeakPolarHBondContact O-CG 3.46Å; H405-Q409 PolarHBondContact O-N 2.97Å; H405-D447 IonicContact CE1-OD1 3.32Å; H405-D447 PolarHBondContact CE1-OD1 3.43Å; H405-D447 IonicContact ND1-OD1 2.92Å; H405-L448 HydrophobicContact CB-CB 4.2Å; H405-L448 HydrophobicContact CB-CD1 4.37Å; H405-I452 HydrophobicContact CB-CD1 3.61Å
406	Q	98.4	Very high	97.6	Very high	119 Å²	119	48.6 Å²	48.6	56%	0.556	25%	0.248	S	C	*	.	H	α-helix	trans	-60.6	-42.3	179.6	-178.5	55.9	47.5	0	0	111.5	T402 D403 Q409 T410	T402-Q406 PolarHBondContact O-N 3.42Å; D403-Q406 PolarHBondContact O-N 2.84Å; Q406-Q409 PolarHBondContact O-N 3.45Å; Q406-T410 PolarHBondContact NE2-OG1 2.94Å; Q406-T410 WeakPolarHBondContact O-CB 3.48Å; Q406-T410 PolarHBondContact O-N 2.68Å; Q406-T410 PolarHBondContact O-OG1 2.76Å
407	Q	98.5	Very high	97.7	Very high	51 Å²	51	49.7 Å²	49.7	24%	0.238	26%	0.256	C	S	.	.	H	α-helix	trans	-67.9	-41.1	176	-68.1	-162.1	49.9	0	0	112	F335 D403 H405 Q409 T410 W411	F335-Q407 HydrophobicContact CD1-CB 3.66Å; F335-Q407 HydrophobicContact CD2-CB 4.05Å; F335-Q407 HydrophobicContact CD2-CG 4.47Å; F335-Q407 HydrophobicContact CE1-CB 3.43Å; F335-Q407 VanDerWaalsContact CE1-CB 3.43Å; F335-Q407 HydrophobicContact CE2-CB 3.85Å; F335-Q407 HydrophobicContact CG-CB 3.99Å; F335-Q407 HydrophobicContact CZ-CB 3.55Å; D403-Q407 VanDerWaalsContact CG-NE2 3.31Å; D403-Q407 WeakPolarHBondContact O-CB 3.19Å; D403-Q407 WeakPolarHBondContact O-CG 3.47Å; D403-Q407 PolarHBondContact O-N 2.95Å; D403-Q407 PolarHBondContact OD1-NE2 2.76Å; D403-Q407 PolarHBondContact OD2-NE2 3.03Å; D403-Q407 VanDerWaalsContact OD2-NE2 3.16Å; H405-Q407 VanDerWaalsContact C-N 3.32Å; H405-Q407 PolarHBondContact O-N 3.49Å; Q407-Q409 VanDerWaalsContact C-N 3.35Å; Q407-Q409 PolarHBondContact O-N 2.84Å; Q407-T410 PolarHBondContact O-N 3.03Å; Q407-W411 WeakPolarHBondContact O-CB 3.43Å; Q407-W411 VanDerWaalsContact O-CD1 3.23Å; Q407-W411 PolarHBondContact O-N 2.88Å
408	R	98.4	Very high	97.7	Very high	1 Å²	1	54.5 Å²	54.5	0%	0.004	29%	0.29	C	S	.	.	H	α-helix	trans	-55.9	-46.1	173.3	-83.8	179.7	-175.1	173.6	6.5	112.2	E334 F335 E370 R404 H405 R412 F446	E334-R408 VanDerWaalsContact OE1-CG 3.28Å; E334-R408 WeakPolarHBondContact OE1-CG 3.44Å; E334-R408 IonicContact OE1-CZ 3.26Å; E334-R408 IonicContact OE1-NE 3.05Å; E334-R408 PolarHBondContact OE1-NE 3.1Å; E334-R408 IonicContact OE1-NH2 2.71Å; E334-R408 IonicContact OE2-CZ 3.78Å; E334-R408 IonicContact OE2-NE 3.19Å; E334-R408 PolarHBondContact OE2-NE 3.46Å; E334-R408 IonicContact OE2-NH2 2.8Å; E334-R408 PolarHBondContact OE2-NH2 2.74Å; F335-R408 HydrophobicContact CE1-CG 4.1Å; F335-R408 HydrophobicContact CZ-CG 4.05Å; E370-R408 IonicContact OE1-CZ 3.55Å; E370-R408 IonicContact OE1-NH1 2.69Å; E370-R408 IonicContact OE1-NH2 3.19Å; E370-R408 PolarHBondContact OE1-NH2 2.93Å; R404-R408 WeakPolarHBondContact O-CB 3.43Å; R404-R408 VanDerWaalsContact O-CG 3.31Å; R404-R408 WeakPolarHBondContact O-CG 3.49Å; R404-R408 PolarHBondContact O-N 2.95Å; H405-R408 PolarHBondContact O-N 3.41Å; R408-R412 VanDerWaalsContact O-CB 3.27Å; R408-R412 WeakPolarHBondContact O-CB 3.31Å; R408-R412 PolarHBondContact O-N 2.82Å; R408-F446 HydrophobicContact CB-CE1 4.05Å; R408-F446 HydrophobicContact CB-CZ 3.85Å; R408-F446 WeakPolarHBondContact CD-O 3.33Å; R408-F446 HydrophobicContact CG-CE1 4.45Å; R408-F446 HydrophobicContact CG-CE2 4.17Å; R408-F446 HydrophobicContact CG-CZ 3.96Å; R408-F446 PolarHBondContact NH1-O 3.42Å
409	Q	98.1	Very high	97.5	Very high	52 Å²	52	59 Å²	59	24%	0.243	31%	0.313	C	S	.	.	H	α-helix	trans	-65.6	-45.3	176.3	-58.8	-62.3	14	0	0	111.7	H405 Q406 Q407 W411 R412 D413	H405-Q409 PolarHBondContact CE1-NE2 2.84Å; H405-Q409 VanDerWaalsContact CE1-NE2 3.31Å; H405-Q409 WeakPolarHBondContact O-CG 3.46Å; H405-Q409 PolarHBondContact O-N 2.97Å; Q406-Q409 PolarHBondContact O-N 3.45Å; Q407-Q409 VanDerWaalsContact C-N 3.35Å; Q407-Q409 PolarHBondContact O-N 2.84Å; Q409-W411 VanDerWaalsContact C-N 3.32Å; Q409-W411 PolarHBondContact O-N 3.03Å; Q409-R412 WeakPolarHBondContact O-CB 3.33Å; Q409-R412 PolarHBondContact O-N 3.49Å; Q409-R412 VanDerWaalsContact O-N 3.1Å; Q409-D413 PolarHBondContact O-N 2.98Å
410	T	98.1	Very high	97.3	Very high	54 Å²	54	55.2 Å²	55.2	33%	0.331	29%	0.288	S	S	.	.	H	α-helix	trans	-57.9	-43.2	178.6	-55.1	0	0	0	0	112	Q406 Q407 R414	Q406-T410 PolarHBondContact NE2-OG1 2.94Å; Q406-T410 WeakPolarHBondContact O-CB 3.48Å; Q406-T410 PolarHBondContact O-N 2.68Å; Q406-T410 PolarHBondContact O-OG1 2.76Å; Q407-T410 PolarHBondContact O-N 3.03Å; T410-R414 WeakPolarHBondContact O-CB 3.4Å; T410-R414 VanDerWaalsContact O-CG 3.29Å; T410-R414 WeakPolarHBondContact O-CG 3.45Å; T410-R414 PolarHBondContact O-N 2.89Å; T410-R414 VanDerWaalsContact O-N 3.1Å
411	W	98.1	Very high	97.1	Very high	16 Å²	16	61.6 Å²	61.6	6%	0.061	32%	0.316	C	S	.	.	H	α-helix	trans	-68.5	-39.6	175.3	-83.6	104.5	0	0	0	112.7	F335 R339 Q340 F343 Q407 Q409 R414 C415	F335-W411 AromaticContact CD1-CD1 3.49Å; F335-W411 VanDerWaalsContact CD1-CD1 3.49Å; F335-W411 AromaticContact CD1-NE1 3.63Å; R339-W411 HydrophobicContact CB-CD2 3.72Å; R339-W411 HydrophobicContact CB-CE3 4.03Å; R339-W411 HydrophobicContact CB-CG 4.06Å; R339-W411 HydrophobicContact CB-CZ2 4.27Å; R339-W411 HydrophobicContact CB-CZ3 4.45Å; R339-W411 HydrophobicContact CG-CG 4.4Å; Q340-W411 HydrophobicContact CB-CH2 4.43Å; Q340-W411 VanDerWaalsContact CD-CH2 3.49Å; Q340-W411 HydrophobicContact CG-CH2 3.85Å; Q340-W411 HydrophobicContact CG-CZ2 3.87Å; F343-W411 HydrophobicContact CB-CE3 4.18Å; F343-W411 HydrophobicContact CB-CH2 4.48Å; F343-W411 HydrophobicContact CB-CZ3 3.54Å; F343-W411 HydrophobicContact CD1-CZ3 4.1Å; F343-W411 HydrophobicContact CD2-CE3 4.25Å; F343-W411 HydrophobicContact CD2-CZ3 4.01Å; F343-W411 HydrophobicContact CG-CE3 4.28Å; F343-W411 AromaticContact CG-CZ3 3.62Å; F343-W411 HydrophobicContact CG-CZ3 3.62Å; Q407-W411 WeakPolarHBondContact O-CB 3.43Å; Q407-W411 VanDerWaalsContact O-CD1 3.23Å; Q407-W411 PolarHBondContact O-N 2.88Å; Q409-W411 VanDerWaalsContact C-N 3.32Å; Q409-W411 PolarHBondContact O-N 3.03Å; W411-R414 PolarHBondContact O-N 2.77Å; W411-C415 PolarHBondContact O-N 2.95Å; W411-C415 PolarHBondContact O-SG 2.92Å; W411-C415 VanDerWaalsContact O-SG 3.34Å
412	R	96.6	Very high	97	Very high	68 Å²	68	66.6 Å²	66.6	26%	0.257	35%	0.346	S	S	.	.	H	α-helix	trans	-61.3	-47.8	175.8	-174.4	175.7	-168.2	81.3	-11.8	111.4	R408 Q409 R414 C415 H416 D431	R408-R412 VanDerWaalsContact O-CB 3.27Å; R408-R412 WeakPolarHBondContact O-CB 3.31Å; R408-R412 PolarHBondContact O-N 2.82Å; Q409-R412 WeakPolarHBondContact O-CB 3.33Å; Q409-R412 PolarHBondContact O-N 3.49Å; Q409-R412 VanDerWaalsContact O-N 3.1Å; R412-R414 VanDerWaalsContact C-N 3.33Å; R412-R414 PolarHBondContact O-N 2.95Å; R412-C415 PolarHBondContact O-N 3.21Å; R412-H416 PolarHBondContact O-N 3.22Å; R412-H416 PolarHBondContact O-ND1 2.79Å; R412-D431 IonicContact CZ-OD2 2.7Å; R412-D431 IonicContact NH1-OD2 2.7Å; R412-D431 PolarHBondContact NH1-OD2 3.14Å
413	D	97.4	Very high	96.9	Very high	112 Å²	112	67 Å²	67	60%	0.599	35%	0.345	S	S	*	.	H	α-helix	trans	-63.4	-39.1	178.2	-71	-20.2	0	0	0	111.6	Q409 H416 S417	Q409-D413 PolarHBondContact O-N 2.98Å; D413-H416 CarbonylContact O-C 3.57Å; D413-H416 PolarHBondContact O-N 3.14Å; D413-S417 PolarHBondContact O-N 2.95Å
414	R	96.9	Very high	96.6	Very high	114 Å²	114	66.8 Å²	66.8	43%	0.43	35%	0.348	S	S	.	.	H	α-helix	trans	-59.6	-49.5	171.9	-77.9	174.5	166.7	-160.7	-8	111.9	F343 T410 W411 R412 H416 S417	F343-R414 HydrophobicContact CE2-CB 3.88Å; F343-R414 HydrophobicContact CZ-CB 4.49Å; T410-R414 WeakPolarHBondContact O-CB 3.4Å; T410-R414 VanDerWaalsContact O-CG 3.29Å; T410-R414 WeakPolarHBondContact O-CG 3.45Å; T410-R414 PolarHBondContact O-N 2.89Å; T410-R414 VanDerWaalsContact O-N 3.1Å; W411-R414 PolarHBondContact O-N 2.77Å; R412-R414 VanDerWaalsContact C-N 3.33Å; R412-R414 PolarHBondContact O-N 2.95Å; R414-H416 VanDerWaalsContact C-N 3.3Å; R414-H416 PolarHBondContact O-N 2.95Å; R414-S417 WeakPolarHBondContact O-CB 3.03Å; R414-S417 PolarHBondContact O-N 3.35Å; R414-S417 PolarHBondContact O-OG 3.16Å
415	C	96.6	Very high	96.2	Very high	15 Å²	15	72.6 Å²	72.6	10%	0.101	39%	0.385	C	S	.	.	H	α-helix	trans	-60.5	-36.6	177.4	-73	0	0	0	0	113.1	W411 R412 A420 P429 D431	W411-C415 PolarHBondContact O-N 2.95Å; W411-C415 PolarHBondContact O-SG 2.92Å; W411-C415 VanDerWaalsContact O-SG 3.34Å; R412-C415 PolarHBondContact O-N 3.21Å; C415-A420 WeakPolarHBondContact O-CB 3.44Å; C415-P429 HydrophobicContact CB-CB 4.23Å; C415-D431 HydrophobicContact CB-CB 4.17Å
416	H	95.6	Very high	95.8	Very high	98 Å²	98	75.2 Å²	75.2	45%	0.454	40%	0.398	S	S	.	.	H	α-helix	trans	-95.6	5.3	-177.4	-62.6	87.5	0	0	0	113.8	R412 D413 R414 Q421 D431	R412-H416 PolarHBondContact O-N 3.22Å; R412-H416 PolarHBondContact O-ND1 2.79Å; D413-H416 CarbonylContact O-C 3.57Å; D413-H416 PolarHBondContact O-N 3.14Å; R414-H416 VanDerWaalsContact C-N 3.3Å; R414-H416 PolarHBondContact O-N 2.95Å; H416-Q421 PolarHBondContact O-NE2 3.3Å; H416-D431 IonicContact CE1-OD2 3.24Å
417	S	97	Very high	95.5	Very high	45 Å²	45	73.4 Å²	73.4	32%	0.315	39%	0.39	S	S	.	.	S	Bend	trans	-58.8	150.6	179.2	65.7	0	0	0	0	112.6	D413 R414 L419 A420 Q421	D413-S417 PolarHBondContact O-N 2.95Å; R414-S417 WeakPolarHBondContact O-CB 3.03Å; R414-S417 PolarHBondContact O-N 3.35Å; R414-S417 PolarHBondContact O-OG 3.16Å; S417-L419 PolarHBondContact O-N 3.08Å; S417-A420 WeakPolarHBondContact O-CB 3.36Å; S417-A420 PolarHBondContact O-N 2.89Å; S417-A420 VanDerWaalsContact O-N 3.08Å; S417-A420 VanDerWaalsContact OG-CB 3.25Å; S417-A420 WeakPolarHBondContact OG-CB 3.31Å; S417-A420 PolarHBondContact OG-N 3.11Å; S417-Q421 WeakPolarHBondContact O-CG 2.99Å; S417-Q421 PolarHBondContact O-N 3.24Å; S417-Q421 VanDerWaalsContact O-N 3.09Å
418	S	96.5	Very high	95.3	Very high	101 Å²	101	72.4 Å²	72.4	71%	0.706	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-36.7	-179	54.5	0	0	0	0	112.7
419	L	93.8	Very high	95.3	Very high	124 Å²	124	73.4 Å²	73.4	65%	0.649	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-45.2	175	-177.3	63.1	0	0	0	111.8	S417 Q421 T422	S417-L419 PolarHBondContact O-N 3.08Å; L419-Q421 PolarHBondContact O-N 3.36Å; L419-T422 PolarHBondContact O-N 2.98Å; L419-T422 PolarHBondContact O-OG1 3.18Å
420	A	94.3	Very high	95.1	Very high	8 Å²	8	73.6 Å²	73.6	7%	0.066	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-57.5	-38.6	177.4	0	0	0	0	0	112.2	C415 S417 T422 L423 P429	C415-A420 WeakPolarHBondContact O-CB 3.44Å; S417-A420 WeakPolarHBondContact O-CB 3.36Å; S417-A420 PolarHBondContact O-N 2.89Å; S417-A420 VanDerWaalsContact O-N 3.08Å; S417-A420 VanDerWaalsContact OG-CB 3.25Å; S417-A420 WeakPolarHBondContact OG-CB 3.31Å; S417-A420 PolarHBondContact OG-N 3.11Å; A420-T422 PolarHBondContact O-N 2.9Å; A420-L423 WeakPolarHBondContact O-CB 3.19Å; A420-L423 PolarHBondContact O-N 2.85Å; A420-P429 HydrophobicContact CB-CG 3.85Å
421	Q	93.6	Very high	95	Very high	147 Å²	147	72.2 Å²	72.2	69%	0.687	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-66.6	-15.4	176.4	-64.3	178.1	28.2	0	0	114.3	H416 S417 L419	H416-Q421 PolarHBondContact O-NE2 3.3Å; S417-Q421 WeakPolarHBondContact O-CG 2.99Å; S417-Q421 PolarHBondContact O-N 3.24Å; S417-Q421 VanDerWaalsContact O-N 3.09Å; L419-Q421 PolarHBondContact O-N 3.36Å
422	T	95.5	Very high	94.9	Very high	106 Å²	106	75.3 Å²	75.3	65%	0.65	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-88.7	-8.9	175	66.1	0	0	0	0	114.1	L419 A420	L419-T422 PolarHBondContact O-N 2.98Å; L419-T422 PolarHBondContact O-OG1 3.18Å; A420-T422 PolarHBondContact O-N 2.9Å
423	L	95.3	Very high	94.9	Very high	71 Å²	71	72.4 Å²	72.4	37%	0.372	39%	0.393	S	S	.	.	S	Bend	trans	-73.5	150.7	-176.6	-66.8	172.9	0	0	0	112.2	A420 P429	A420-L423 WeakPolarHBondContact O-CB 3.19Å; A420-L423 PolarHBondContact O-N 2.85Å; L423-P429 HydrophobicContact CD1-CG 4.49Å
424	P	93.7	Very high	94.9	Very high	66 Å²	66	71.5 Å²	71.5	43%	0.429	38%	0.384	S	S	.	.			trans	-58	149	173.3	-22.9	33.5	0	0	0	112	E426 E427 A428	P424-E426 PolarHBondContact O-N 3.07Å; P424-E427 CarbonylContact O-C 3.51Å; P424-E427 WeakPolarHBondContact O-CA 3.46Å; P424-E427 PolarHBondContact O-N 2.94Å; P424-A428 PolarHBondContact O-N 2.97Å
425	P	90.3	Very high	94.8	Very high	121 Å²	121	66.8 Å²	66.8	79%	0.786	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-28	-177.2	-28.7	35.7	0	0	0	115.8	E427	P425-E427 VanDerWaalsContact C-N 3.28Å; P425-E427 PolarHBondContact O-N 3.06Å
426	E	89.6	Confident	94.5	Very high	91 Å²	91	68 Å²	68	43%	0.425	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-23.7	175.7	-62	-78	168.5	0	0	113.1	Q346 R347 R350 P424	Q346-E426 CarbonylContact C-O 3.51Å; Q346-E426 WeakPolarHBondContact CA-O 3.29Å; Q346-E426 PolarHBondContact N-O 3.25Å; R347-E426 PolarHBondContact N-O 2.86Å; R350-E426 WeakPolarHBondContact CD-OE2 3.34Å; P424-E426 PolarHBondContact O-N 3.07Å
427	E	92.7	Very high	94	Very high	81 Å²	81	69.7 Å²	69.7	38%	0.379	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-7.9	-171.7	-68.3	168.8	-156.5	0	0	112.4	R347 R350 P424 P425	R347-E427 HydrophobicContact CB-CG 4.22Å; R350-E427 IonicContact NH1-OE1 2.65Å; P424-E427 CarbonylContact O-C 3.51Å; P424-E427 WeakPolarHBondContact O-CA 3.46Å; P424-E427 PolarHBondContact O-N 2.94Å; P425-E427 VanDerWaalsContact C-N 3.28Å; P425-E427 PolarHBondContact O-N 3.06Å
428	A	94.2	Very high	93.3	Very high	30 Å²	30	74.9 Å²	74.9	25%	0.248	42%	0.423	C	S	.	.	S	Bend	trans	-61.1	132.1	176.6	0	0	0	0	0	111	G345 P424	G345-A428 VanDerWaalsContact CA-O 3.24Å; G345-A428 WeakPolarHBondContact CA-O 3.3Å; P424-A428 PolarHBondContact O-N 2.97Å
429	P	96.6	Very high	93.1	Very high	22 Å²	22	73.3 Å²	73.3	14%	0.143	41%	0.406	C	S	.	.			trans	-57.8	139.3	176.4	-29.2	36.7	0	0	0	113.4	F343 C415 A420 L423	F343-P429 HydrophobicContact CD2-CB 3.62Å; F343-P429 HydrophobicContact CD2-CG 3.9Å; F343-P429 HydrophobicContact CE2-CB 3.92Å; F343-P429 HydrophobicContact CE2-CG 3.73Å; F343-P429 HydrophobicContact CG-CB 4.31Å; F343-P429 HydrophobicContact CZ-CG 4.28Å; F343-P429 VanDerWaalsContact O-CA 3.3Å; F343-P429 WeakPolarHBondContact O-CA 3.32Å; F343-P429 WeakPolarHBondContact O-CB 3.27Å; F343-P429 WeakPolarHBondContact O-CG 3.26Å; C415-P429 HydrophobicContact CB-CB 4.23Å; A420-P429 HydrophobicContact CB-CG 3.85Å; L423-P429 HydrophobicContact CD1-CG 4.49Å
430	V	95.6	Very high	92.8	Very high	55 Å²	55	73.7 Å²	73.7	33%	0.333	42%	0.416	S	S	.	.			trans	-109	115	174	-174.7	0	0	0	0	108.3	W342 R432	W342-V430 CarbonylContact C-O 3.59Å; W342-V430 HydrophobicContact CB-CB 4.3Å; W342-V430 WeakPolarHBondContact CB-O 3.47Å; W342-V430 PolarHBondContact O-N 2.96Å; V430-R432 VanDerWaalsContact C-N 3.33Å; V430-R432 HydrophobicContact CG1-CB 3.93Å; V430-R432 PolarHBondContact O-N 2.85Å
431	D	95.7	Very high	92.7	Very high	25 Å²	25	75.1 Å²	75.1	13%	0.134	43%	0.431	C	S	.	.			trans	-69.5	91.1	170	-173.3	5.1	0	0	0	109	R339 R412 C415 H416 F434	R339-D431 IonicContact NH1-OD1 3.52Å; R339-D431 PolarHBondContact NH1-OD1 3.44Å; R412-D431 IonicContact CZ-OD2 2.7Å; R412-D431 IonicContact NH1-OD2 2.7Å; R412-D431 PolarHBondContact NH1-OD2 3.14Å; C415-D431 HydrophobicContact CB-CB 4.17Å; H416-D431 IonicContact CE1-OD2 3.24Å; D431-F434 VanDerWaalsContact O-CB 3.23Å; D431-F434 WeakPolarHBondContact O-CB 3.45Å
432	R	96.1	Very high	92.8	Very high	81 Å²	81	69.2 Å²	69.2	31%	0.306	40%	0.404	S	S	.	.			trans	-144.5	134	-178.5	-179.9	174.7	173.5	172.5	2.2	110.1	W342 E363 V430	W342-R432 HydrophobicContact CB-CB 3.95Å; W342-R432 HydrophobicContact CD2-CB 4.35Å; W342-R432 HydrophobicContact CD2-CG 4.25Å; W342-R432 VanDerWaalsContact CE2-CD 3.5Å; W342-R432 HydrophobicContact CG-CB 3.76Å; W342-R432 HydrophobicContact CG-CG 3.99Å; W342-R432 VanDerWaalsContact CZ2-CZ 3.43Å; E363-R432 IonicContact OE1-CZ 3.86Å; E363-R432 IonicContact OE1-NE 3.39Å; E363-R432 PolarHBondContact OE1-NE 2.84Å; E363-R432 IonicContact OE1-NH2 3.81Å; E363-R432 PolarHBondContact OE1-NH2 3.29Å; E363-R432 IonicContact OE2-CZ 3.24Å; E363-R432 IonicContact OE2-NE 3.91Å; E363-R432 PolarHBondContact OE2-NE 2.89Å; E363-R432 IonicContact OE2-NH2 3.76Å; E363-R432 PolarHBondContact OE2-NH2 3.08Å; V430-R432 VanDerWaalsContact C-N 3.33Å; V430-R432 HydrophobicContact CG1-CB 3.93Å; V430-R432 PolarHBondContact O-N 2.85Å
433	P	96.5	Very high	92.8	Very high	7 Å²	7	66.4 Å²	66.4	5%	0.045	39%	0.388	C	S	.	.	S	Bend	cis	-71.8	137.9	-1.4	29.3	-34.1	0	0	0	113.2	L338 R339 W366 W435	L338-P433 HydrophobicContact CD1-CG 4.5Å; R339-P433 PolarHBondContact NH1-O 2.7Å; R339-P433 PolarHBondContact NH2-O 2.97Å; W366-P433 HydrophobicContact CD2-CG 3.99Å; W366-P433 HydrophobicContact CE3-CB 4.15Å; W366-P433 HydrophobicContact CE3-CG 4.06Å; W366-P433 HydrophobicContact CH2-CB 3.38Å; W366-P433 HydrophobicContact CH2-CG 3.56Å; W366-P433 HydrophobicContact CZ2-CB 3.82Å; W366-P433 HydrophobicContact CZ2-CG 3.42Å; W366-P433 VanDerWaalsContact CZ2-CG 3.42Å; W366-P433 HydrophobicContact CZ3-CB 3.55Å; W366-P433 HydrophobicContact CZ3-CG 3.86Å; P433-W435 HydrophobicContact CB-CZ3 4.38Å
434	F	96.3	Very high	92.8	Very high	94 Å²	94	63.8 Å²	63.8	41%	0.412	37%	0.374	S	S	.	.			trans	-145.3	145.2	174.2	174.8	-106.5	0	0	0	109.7	D431 F446	D431-F434 VanDerWaalsContact O-CB 3.23Å; D431-F434 WeakPolarHBondContact O-CB 3.45Å; F434-F446 HydrophobicContact CB-CE2 4.37Å; F434-F446 HydrophobicContact CD2-CD1 4.1Å; F434-F446 AromaticContact CD2-CD2 3.62Å; F434-F446 HydrophobicContact CD2-CD2 3.62Å; F434-F446 HydrophobicContact CD2-CE1 4.18Å; F434-F446 AromaticContact CD2-CE2 3.66Å; F434-F446 HydrophobicContact CD2-CE2 3.66Å; F434-F446 AromaticContact CD2-CG 3.83Å; F434-F446 HydrophobicContact CD2-CG 3.83Å; F434-F446 AromaticContact CD2-CZ 3.96Å; F434-F446 HydrophobicContact CD2-CZ 3.96Å; F434-F446 HydrophobicContact CE2-CB 4.46Å; F434-F446 HydrophobicContact CE2-CD1 4.05Å; F434-F446 HydrophobicContact CE2-CD2 4.28Å; F434-F446 HydrophobicContact CE2-CE1 4.36Å; F434-F446 HydrophobicContact CE2-CG 4.01Å
435	W	96.3	Very high	92.9	Very high	15 Å²	15	62.9 Å²	62.9	6%	0.057	37%	0.368	C	S	.	.			trans	-151	159.1	178.5	61.7	104.8	0	0	0	111.1	W366 E370 P433 D439 M442 L444 F446	W366-W435 HydrophobicContact CH2-CE3 4.1Å; W366-W435 AromaticContact CH2-CH2 3.73Å; W366-W435 HydrophobicContact CH2-CH2 3.73Å; W366-W435 AromaticContact CH2-CZ3 3.34Å; W366-W435 HydrophobicContact CH2-CZ3 3.34Å; W366-W435 AromaticContact CZ2-CH2 3.67Å; W366-W435 HydrophobicContact CZ2-CH2 3.67Å; W366-W435 AromaticContact CZ2-CZ3 3.56Å; W366-W435 HydrophobicContact CZ2-CZ3 3.56Å; E370-W435 VanDerWaalsContact OE2-CZ2 3.31Å; E370-W435 WeakPolarHBondContact OE2-CZ2 3.35Å; P433-W435 HydrophobicContact CB-CZ3 4.38Å; W435-D439 HydrophobicContact CB-CB 4.01Å; W435-D439 HydrophobicContact CG-CB 4.43Å; W435-M442 HydrophobicContact CB-CG 4.13Å; W435-M442 HydrophobicContact CD2-CB 4.32Å; W435-M442 HydrophobicContact CD2-CE 4.05Å; W435-M442 HydrophobicContact CD2-CG 3.84Å; W435-M442 HydrophobicContact CE3-CE 4.09Å; W435-M442 HydrophobicContact CG-CB 4.1Å; W435-M442 HydrophobicContact CG-CG 3.63Å; W435-M442 HydrophobicContact CH2-CE 3.82Å; W435-M442 HydrophobicContact CZ2-CE 3.73Å; W435-M442 HydrophobicContact CZ3-CE 4.03Å; W435-L444 PolarHBondContact NE1-O 2.85Å; W435-F446 HydrophobicContact CD2-CB 4Å; W435-F446 HydrophobicContact CD2-CD2 4.44Å; W435-F446 HydrophobicContact CE3-CB 4.33Å; W435-F446 AromaticContact CE3-CD2 3.92Å; W435-F446 HydrophobicContact CE3-CD2 3.92Å; W435-F446 HydrophobicContact CG-CB 4.49Å; W435-F446 HydrophobicContact CH2-CB 4.4Å; W435-F446 HydrophobicContact CH2-CD2 4.17Å; W435-F446 HydrophobicContact CZ2-CB 4.1Å; W435-F446 HydrophobicContact CZ3-CB 4.48Å; W435-F446 AromaticContact CZ3-CD2 3.73Å; W435-F446 HydrophobicContact CZ3-CD2 3.73Å
436	G	90.3	Very high	93.2	Very high	41 Å²	41	57.8 Å²	57.8	42%	0.423	33%	0.334	S	S	.	.			trans	-81.2	166.2	175.9	0	0	0	0	0	112.8	D438 D439	G436-D438 PolarHBondContact O-N 3.46Å; G436-D439 PolarHBondContact O-N 3Å
437	V	84.6	Confident	93.6	Very high	132 Å²	132	57.2 Å²	57.2	80%	0.8	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-33.1	-179.8	-176.7	0	0	0	0	112.5
438	D	82.8	Confident	93.8	Very high	154 Å²	154	53.4 Å²	53.4	82%	0.824	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	19.4	-175.8	-56.4	-57.8	0	0	0	114.2	G436 P440	G436-D438 PolarHBondContact O-N 3.46Å; D438-P440 WeakPolarHBondContact O-CD 3.17Å
439	D	91.1	Very high	94	Very high	68 Å²	68	53.7 Å²	53.7	36%	0.364	32%	0.318	S	S	.	.			trans	-73.1	107.9	178.4	-169.6	-26.2	0	0	0	111.2	W435 G436 G441 M442	W435-D439 HydrophobicContact CB-CB 4.01Å; W435-D439 HydrophobicContact CG-CB 4.43Å; G436-D439 PolarHBondContact O-N 3Å; D439-G441 PolarHBondContact O-N 2.98Å; D439-G441 VanDerWaalsContact O-N 3.13Å; D439-G441 WeakPolarHBondContact OD1-CA 3.23Å; D439-G441 PolarHBondContact OD1-N 3.07Å; D439-M442 PolarHBondContact O-N 3.25Å
440	P	88.4	Confident	93.9	Very high	133 Å²	133	59.4 Å²	59.4	86%	0.864	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-9.1	-177.8	34.6	-38	0	0	0	112.7	D438 M442	D438-P440 WeakPolarHBondContact O-CD 3.17Å; P440-M442 VanDerWaalsContact C-N 3.34Å
441	G	91	Very high	94	Very high	37 Å²	37	57.2 Å²	57.2	38%	0.381	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-9.2	175.2	0	0	0	0	0	113.6	K367 D439	K367-G441 WeakPolarHBondContact CE-O 3.35Å; K367-G441 PolarHBondContact NZ-O 2.86Å; D439-G441 PolarHBondContact O-N 2.98Å; D439-G441 VanDerWaalsContact O-N 3.13Å; D439-G441 WeakPolarHBondContact OD1-CA 3.23Å; D439-G441 PolarHBondContact OD1-N 3.07Å
442	M	96	Very high	94.1	Very high	24 Å²	24	56.8 Å²	56.8	12%	0.118	33%	0.331	C	S	.	.			trans	-117.5	135.5	-176.6	-65.9	-58.4	-63.4	0	0	111.5	W366 K367 E370 W435 D439 P440	W366-M442 HydrophobicContact CH2-CE 3.43Å; W366-M442 VanDerWaalsContact CH2-CE 3.43Å; W366-M442 HydrophobicContact CZ2-CE 4.34Å; W366-M442 HydrophobicContact CZ3-CE 3.87Å; K367-M442 HydrophobicContact CD-SD 3.93Å; K367-M442 VanDerWaalsContact CE-SD 3.58Å; K367-M442 HydrophobicContact CG-SD 4.21Å; K367-M442 PolarHBondContact NZ-SD 2.77Å; E370-M442 HydrophobicContact CB-CE 4.35Å; E370-M442 HydrophobicContact CG-CE 3.99Å; W435-M442 HydrophobicContact CB-CG 4.13Å; W435-M442 HydrophobicContact CD2-CB 4.32Å; W435-M442 HydrophobicContact CD2-CE 4.05Å; W435-M442 HydrophobicContact CD2-CG 3.84Å; W435-M442 HydrophobicContact CE3-CE 4.09Å; W435-M442 HydrophobicContact CG-CB 4.1Å; W435-M442 HydrophobicContact CG-CG 3.63Å; W435-M442 HydrophobicContact CH2-CE 3.82Å; W435-M442 HydrophobicContact CZ2-CE 3.73Å; W435-M442 HydrophobicContact CZ3-CE 4.03Å; D439-M442 PolarHBondContact O-N 3.25Å; P440-M442 VanDerWaalsContact C-N 3.34Å
443	P	94.9	Very high	94.1	Very high	47 Å²	47	56 Å²	56	31%	0.305	34%	0.338	S	S	.	.	S	Bend	trans	-81	-17.7	-174.1	33.6	-36.7	0	0	0	113.6	E370 M374	E370-P443 HydrophobicContact CB-CG 3.87Å; M374-P443 HydrophobicContact CB-CB 4.13Å; M374-P443 HydrophobicContact CG-CB 4.26Å
444	L	95.7	Very high	94.1	Very high	15 Å²	15	61.1 Å²	61.1	8%	0.079	36%	0.357	C	S	.	.	S	Bend	trans	-131.8	155	179.8	-64.4	178	0	0	0	109.6	T373 M374 L377 W435 I451	T373-L444 HydrophobicContact CG2-CD1 3.69Å; M374-L444 HydrophobicContact CB-CD1 4.38Å; M374-L444 HydrophobicContact CB-CD2 3.82Å; M374-L444 HydrophobicContact CB-CG 3.97Å; M374-L444 HydrophobicContact CG-CD2 4.05Å; L377-L444 HydrophobicContact CD2-CD2 4.29Å; W435-L444 PolarHBondContact NE1-O 2.85Å; L444-I451 HydrophobicContact CD2-CD1 3.94Å
445	P	96.5	Very high	94	Very high	47 Å²	47	56.6 Å²	56.6	31%	0.305	34%	0.337	S	S	.	.			trans	-66.6	152.9	167.6	30.1	-36.1	0	0	0	111.4	D447 L448 I451	P445-D447 VanDerWaalsContact C-N 3.35Å; P445-D447 WeakPolarHBondContact CB-O 3.48Å; P445-D447 WeakPolarHBondContact CG-O 3.27Å; P445-L448 WeakPolarHBondContact O-CD2 3.45Å; P445-I451 HydrophobicContact CG-CD1 3.8Å
446	F	97.1	Very high	94	Very high	14 Å²	14	59.7 Å²	59.7	6%	0.061	35%	0.352	C	S	.	.	S	Bend	trans	-62.4	-45.1	171.9	176.6	-86.9	0	0	0	111.4	R339 R408 F434 W435	R339-F446 VanDerWaalsContact NH2-CE2 3.32Å; R408-F446 HydrophobicContact CB-CE1 4.05Å; R408-F446 HydrophobicContact CB-CZ 3.85Å; R408-F446 WeakPolarHBondContact CD-O 3.33Å; R408-F446 HydrophobicContact CG-CE1 4.45Å; R408-F446 HydrophobicContact CG-CE2 4.17Å; R408-F446 HydrophobicContact CG-CZ 3.96Å; R408-F446 PolarHBondContact NH1-O 3.42Å; F434-F446 HydrophobicContact CB-CE2 4.37Å; F434-F446 HydrophobicContact CD2-CD1 4.1Å; F434-F446 AromaticContact CD2-CD2 3.62Å; F434-F446 HydrophobicContact CD2-CD2 3.62Å; F434-F446 HydrophobicContact CD2-CE1 4.18Å; F434-F446 AromaticContact CD2-CE2 3.66Å; F434-F446 HydrophobicContact CD2-CE2 3.66Å; F434-F446 AromaticContact CD2-CG 3.83Å; F434-F446 HydrophobicContact CD2-CG 3.83Å; F434-F446 AromaticContact CD2-CZ 3.96Å; F434-F446 HydrophobicContact CD2-CZ 3.96Å; F434-F446 HydrophobicContact CE2-CB 4.46Å; F434-F446 HydrophobicContact CE2-CD1 4.05Å; F434-F446 HydrophobicContact CE2-CD2 4.28Å; F434-F446 HydrophobicContact CE2-CE1 4.36Å; F434-F446 HydrophobicContact CE2-CG 4.01Å; W435-F446 HydrophobicContact CD2-CB 4Å; W435-F446 HydrophobicContact CD2-CD2 4.44Å; W435-F446 HydrophobicContact CE3-CB 4.33Å; W435-F446 AromaticContact CE3-CD2 3.92Å; W435-F446 HydrophobicContact CE3-CD2 3.92Å; W435-F446 HydrophobicContact CG-CB 4.49Å; W435-F446 HydrophobicContact CH2-CB 4.4Å; W435-F446 HydrophobicContact CH2-CD2 4.17Å; W435-F446 HydrophobicContact CZ2-CB 4.1Å; W435-F446 HydrophobicContact CZ3-CB 4.48Å; W435-F446 AromaticContact CZ3-CD2 3.73Å; W435-F446 HydrophobicContact CZ3-CD2 3.73Å
447	D	96.8	Very high	94.1	Very high	79 Å²	79	59.5 Å²	59.5	42%	0.422	34%	0.344	S	S	.	.			trans	-79.8	123.8	173.3	-168.6	-22.6	0	0	0	109.7	H405 P445 A449	H405-D447 IonicContact CE1-OD1 3.32Å; H405-D447 PolarHBondContact CE1-OD1 3.43Å; H405-D447 IonicContact ND1-OD1 2.92Å; P445-D447 VanDerWaalsContact C-N 3.35Å; P445-D447 WeakPolarHBondContact CB-O 3.48Å; P445-D447 WeakPolarHBondContact CG-O 3.27Å; D447-A449 WeakPolarHBondContact OD1-CB 3.32Å; D447-A449 PolarHBondContact OD1-N 2.91Å
448	L	97.5	Very high	94.3	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.005	32%	0.316	C	S	.	.			trans	-103.3	-0.4	-172.8	-56.3	171.8	0	0	0	112.3	L401 R404 H405 P445 D450 I451 I452	L401-L448 HydrophobicContact CD2-CD1 4.09Å; R404-L448 HydrophobicContact CB-CD1 4.08Å; R404-L448 HydrophobicContact CG-CD1 3.93Å; H405-L448 HydrophobicContact CB-CB 4.2Å; H405-L448 HydrophobicContact CB-CD1 4.37Å; P445-L448 WeakPolarHBondContact O-CD2 3.45Å; L448-D450 VanDerWaalsContact C-N 3.34Å; L448-D450 PolarHBondContact O-N 3.25Å; L448-I451 HydrophobicContact CD2-CD1 4.36Å; L448-I451 WeakPolarHBondContact O-CA 3.34Å; L448-I451 WeakPolarHBondContact O-CB 3.41Å; L448-I451 PolarHBondContact O-N 2.84Å; L448-I452 HydrophobicContact CB-CD1 4.03Å; L448-I452 HydrophobicContact CB-CG1 4.38Å; L448-I452 WeakPolarHBondContact O-CG1 3.39Å; L448-I452 PolarHBondContact O-N 3.26Å
449	A	97.3	Very high	94.6	Very high	37 Å²	37	49.3 Å²	49.3	31%	0.306	29%	0.285	S	S	.	.	H	α-helix	trans	-56.4	-42.6	-172.4	0	0	0	0	0	113.4	D447 I451 S453	D447-A449 WeakPolarHBondContact OD1-CB 3.32Å; D447-A449 PolarHBondContact OD1-N 2.91Å; A449-I451 VanDerWaalsContact C-N 3.34Å; A449-I451 PolarHBondContact O-N 2.74Å; A449-S453 WeakPolarHBondContact O-CB 3.3Å; A449-S453 PolarHBondContact O-N 2.76Å; A449-S453 PolarHBondContact O-OG 2.82Å
450	D	96.1	Very high	94.4	Very high	141 Å²	141	56.4 Å²	56.4	75%	0.754	31%	0.307	S	S	*	.	H	α-helix	trans	-67.2	-34.1	176.4	-78.1	-16.4	0	0	0	112.5	L448 R454	L448-D450 VanDerWaalsContact C-N 3.34Å; L448-D450 PolarHBondContact O-N 3.25Å; D450-R454 WeakPolarHBondContact O-CB 3.42Å; D450-R454 PolarHBondContact O-N 2.85Å; D450-R454 VanDerWaalsContact O-N 3.07Å
451	I	96.8	Very high	94	Very high	9 Å²	9	59.4 Å²	59.4	5%	0.046	30%	0.301	C	S	.	.	H	α-helix	trans	-73.5	-45.2	178.3	-65	176.4	0	0	0	110.2	L377 L401 L444 P445 L448 A449 S453 R454 V455	L377-I451 HydrophobicContact CD1-CG2 3.9Å; L377-I451 HydrophobicContact CD2-CD1 4.22Å; L377-I451 HydrophobicContact CD2-CG1 4.43Å; L377-I451 HydrophobicContact CD2-CG2 3.59Å; L377-I451 HydrophobicContact CG-CG2 4.41Å; L401-I451 HydrophobicContact CD1-CG2 3.74Å; L444-I451 HydrophobicContact CD2-CD1 3.94Å; P445-I451 HydrophobicContact CG-CD1 3.8Å; L448-I451 HydrophobicContact CD2-CD1 4.36Å; L448-I451 WeakPolarHBondContact O-CA 3.34Å; L448-I451 WeakPolarHBondContact O-CB 3.41Å; L448-I451 PolarHBondContact O-N 2.84Å; A449-I451 VanDerWaalsContact C-N 3.34Å; A449-I451 PolarHBondContact O-N 2.74Å; I451-S453 PolarHBondContact O-N 2.98Å; I451-R454 WeakPolarHBondContact O-CA 3.19Å; I451-R454 WeakPolarHBondContact O-CB 3.32Å; I451-R454 PolarHBondContact O-N 2.8Å; I451-R454 VanDerWaalsContact O-N 3.08Å; I451-V455 HydrophobicContact CG2-CG2 4.44Å; I451-V455 WeakPolarHBondContact O-CG2 3.42Å; I451-V455 PolarHBondContact O-N 3.23Å
452	I	97.9	Very high	93.4	Very high	16 Å²	16	60 Å²	60	8%	0.082	30%	0.295	C	S	.	.	H	α-helix	trans	-54.8	-53.7	174	-71.5	165.6	0	0	0	109.4	L398 L401 H405 L448 R454 V455 E456	L398-I452 HydrophobicContact CD1-CB 4.5Å; L398-I452 HydrophobicContact CD1-CG2 3.78Å; L401-I452 HydrophobicContact CB-CD1 4.43Å; L401-I452 HydrophobicContact CB-CG1 3.9Å; H405-I452 HydrophobicContact CB-CD1 3.61Å; L448-I452 HydrophobicContact CB-CD1 4.03Å; L448-I452 HydrophobicContact CB-CG1 4.38Å; L448-I452 WeakPolarHBondContact O-CG1 3.39Å; L448-I452 PolarHBondContact O-N 3.26Å; I452-R454 PolarHBondContact O-N 3.2Å; I452-R454 VanDerWaalsContact O-N 3.17Å; I452-V455 PolarHBondContact O-N 2.89Å; I452-V455 VanDerWaalsContact O-N 3.1Å; I452-E456 WeakPolarHBondContact O-CG 3.32Å; I452-E456 PolarHBondContact O-N 2.94Å
453	S	97.1	Very high	93.3	Very high	65 Å²	65	61.9 Å²	61.9	46%	0.455	30%	0.303	S	S	.	.	H	α-helix	trans	-55.3	-35.2	176.2	-55.7	0	0	0	0	112.9	A449 I451 S457	A449-S453 WeakPolarHBondContact O-CB 3.3Å; A449-S453 PolarHBondContact O-N 2.76Å; A449-S453 PolarHBondContact O-OG 2.82Å; I451-S453 PolarHBondContact O-N 2.98Å; S453-S457 WeakPolarHBondContact O-CB 3.36Å; S453-S457 PolarHBondContact O-N 2.98Å
454	R	94.9	Very high	93.2	Very high	114 Å²	114	62.6 Å²	62.6	43%	0.43	30%	0.303	S	S	.	.	H	α-helix	trans	-71.5	-44.9	177.4	-167	167.6	80	-156.3	19.1	112	E381 D450 I451 I452 S457 L458	E381-R454 VanDerWaalsContact CD-NH2 3.35Å; E381-R454 IonicContact OE1-CZ 3.87Å; E381-R454 IonicContact OE1-NE 2.68Å; E381-R454 PolarHBondContact OE1-NE 2.8Å; E381-R454 IonicContact OE1-NH2 3.24Å; E381-R454 PolarHBondContact OE1-NH2 3.11Å; E381-R454 IonicContact OE2-CZ 3.94Å; E381-R454 IonicContact OE2-NE 2.99Å; E381-R454 IonicContact OE2-NH2 3.57Å; E381-R454 PolarHBondContact OE2-NH2 3.24Å; D450-R454 WeakPolarHBondContact O-CB 3.42Å; D450-R454 PolarHBondContact O-N 2.85Å; D450-R454 VanDerWaalsContact O-N 3.07Å; I451-R454 WeakPolarHBondContact O-CA 3.19Å; I451-R454 WeakPolarHBondContact O-CB 3.32Å; I451-R454 PolarHBondContact O-N 2.8Å; I451-R454 VanDerWaalsContact O-N 3.08Å; I452-R454 PolarHBondContact O-N 3.2Å; I452-R454 VanDerWaalsContact O-N 3.17Å; R454-S457 PolarHBondContact O-N 3.15Å; R454-L458 PolarHBondContact O-N 3.4Å; R454-L458 VanDerWaalsContact O-N 3.15Å
455	V	95.3	Very high	93	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-65.8	-42.9	176.8	177.7	0	0	0	0	111	L377 A394 L397 L398 L401 I451 I452 S457 L458 L459	L377-V455 HydrophobicContact CD1-CG2 3.56Å; A394-V455 HydrophobicContact CB-CG1 4.09Å; A394-V455 WeakPolarHBondContact O-CG1 3.47Å; L397-V455 HydrophobicContact CD2-CG2 4.2Å; L398-V455 HydrophobicContact CB-CG1 3.96Å; L401-V455 HydrophobicContact CD1-CG2 4.43Å; I451-V455 HydrophobicContact CG2-CG2 4.44Å; I451-V455 WeakPolarHBondContact O-CG2 3.42Å; I451-V455 PolarHBondContact O-N 3.23Å; I452-V455 PolarHBondContact O-N 2.89Å; I452-V455 VanDerWaalsContact O-N 3.1Å; V455-S457 VanDerWaalsContact C-N 3.34Å; V455-S457 PolarHBondContact O-N 3.47Å; V455-L458 WeakPolarHBondContact O-CB 3.15Å; V455-L458 PolarHBondContact O-N 2.93Å; V455-L459 PolarHBondContact O-N 2.9Å; V455-L459 VanDerWaalsContact O-N 3.14Å
456	E	95.3	Very high	92.8	Very high	80 Å²	80	66.4 Å²	66.4	37%	0.374	32%	0.316	S	S	.	.	H	α-helix	trans	-55.6	-47.8	170.9	-72.6	-179.3	164.8	0	0	111.4	L398 I452 L458 L459 W460	L398-E456 HydrophobicContact CD1-CG 3.75Å; L398-E456 HydrophobicContact CD2-CG 3.78Å; L398-E456 HydrophobicContact CG-CG 4.45Å; I452-E456 WeakPolarHBondContact O-CG 3.32Å; I452-E456 PolarHBondContact O-N 2.94Å; E456-L458 PolarHBondContact O-N 2.81Å; E456-L459 WeakPolarHBondContact O-CB 3.24Å; E456-L459 PolarHBondContact O-N 2.72Å; E456-L459 VanDerWaalsContact O-N 3.09Å; E456-W460 PolarHBondContact O-N 2.91Å
457	S	92.8	Very high	92.6	Very high	36 Å²	36	69.6 Å²	69.6	25%	0.252	33%	0.332	S	S	.	.	H	α-helix	trans	-63.6	-20.8	177.5	-178.8	0	0	0	0	113.7	S453 R454 V455 R461	S453-S457 WeakPolarHBondContact O-CB 3.36Å; S453-S457 PolarHBondContact O-N 2.98Å; R454-S457 PolarHBondContact O-N 3.15Å; V455-S457 VanDerWaalsContact C-N 3.34Å; V455-S457 PolarHBondContact O-N 3.47Å; S457-R461 VanDerWaalsContact O-CD 3.32Å; S457-R461 WeakPolarHBondContact O-CD 3.4Å; S457-R461 WeakPolarHBondContact O-CG 3.47Å; S457-R461 PolarHBondContact O-NE 3.44Å; S457-R461 PolarHBondContact OG-NE 2.99Å; S457-R461 PolarHBondContact OG-NH2 2.72Å
458	L	89.6	Confident	92.3	Very high	41 Å²	41	69 Å²	69	22%	0.215	33%	0.326	C	S	.	.	H	α-helix	trans	-75.7	-44.7	171.3	-66.7	171.4	0	0	0	110.5	V380 E381 R454 V455 E456 W460 R461 M462	V380-L458 HydrophobicContact CG1-CD1 3.89Å; E381-L458 HydrophobicContact CG-CD1 3.83Å; R454-L458 PolarHBondContact O-N 3.4Å; R454-L458 VanDerWaalsContact O-N 3.15Å; V455-L458 WeakPolarHBondContact O-CB 3.15Å; V455-L458 PolarHBondContact O-N 2.93Å; E456-L458 PolarHBondContact O-N 2.81Å; L458-W460 VanDerWaalsContact C-N 3.28Å; L458-W460 PolarHBondContact O-N 3.25Å; L458-R461 PolarHBondContact O-N 3.19Å; L458-M462 HydrophobicContact CB-CE 4.48Å; L458-M462 PolarHBondContact O-N 2.85Å
459	L	89.6	Confident	91.9	Very high	32 Å²	32	73.9 Å²	73.9	17%	0.168	35%	0.349	C	S	.	.	H	α-helix	trans	-58.5	-38	176	-69.1	173	0	0	0	112.5	R391 A394 E395 L398 V455 E456 R461 M462	R391-L459 HydrophobicContact CB-CD2 4.46Å; R391-L459 HydrophobicContact CG-CD2 3.7Å; A394-L459 HydrophobicContact CB-CD2 3.55Å; A394-L459 HydrophobicContact CB-CG 3.92Å; E395-L459 HydrophobicContact CG-CD1 4.2Å; E395-L459 HydrophobicContact CG-CD2 3.8Å; L398-L459 HydrophobicContact CD2-CD1 3.59Å; V455-L459 PolarHBondContact O-N 2.9Å; V455-L459 VanDerWaalsContact O-N 3.14Å; E456-L459 WeakPolarHBondContact O-CB 3.24Å; E456-L459 PolarHBondContact O-N 2.72Å; E456-L459 VanDerWaalsContact O-N 3.09Å; L459-R461 VanDerWaalsContact C-N 3.26Å; L459-R461 PolarHBondContact O-N 2.86Å; L459-M462 HydrophobicContact CD2-CE 4.05Å
460	W	86.1	Confident	91.5	Very high	217 Å²	217	76.7 Å²	76.7	82%	0.822	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-12.2	175.9	-69.2	117	0	0	0	115.1	E456 L458	E456-W460 PolarHBondContact O-N 2.91Å; L458-W460 VanDerWaalsContact C-N 3.28Å; L458-W460 PolarHBondContact O-N 3.25Å
461	R	80.7	Confident	91.1	Very high	195 Å²	195	71.3 Å²	71.3	74%	0.736	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-8.2	-177.8	-71.2	176.1	-163.4	-173.9	13.2	113.8	S457 L458 L459	S457-R461 VanDerWaalsContact O-CD 3.32Å; S457-R461 WeakPolarHBondContact O-CD 3.4Å; S457-R461 WeakPolarHBondContact O-CG 3.47Å; S457-R461 PolarHBondContact O-NE 3.44Å; S457-R461 PolarHBondContact OG-NE 2.99Å; S457-R461 PolarHBondContact OG-NH2 2.72Å; L458-R461 PolarHBondContact O-N 3.19Å; L459-R461 VanDerWaalsContact C-N 3.26Å; L459-R461 PolarHBondContact O-N 2.86Å
462	M	77.6	Confident	90.6	Very high	51 Å²	51	77 Å²	77	25%	0.251	34%	0.344	S	S	.	.			trans	-103.6	0	173.4	-64.5	-177.4	-71.6	0	0	109.3	E387 R390 R391 A394 L458 L459	E387-M462 HydrophobicContact CG-CB 3.92Å; E387-M462 HydrophobicContact CG-CG 4.12Å; E387-M462 HydrophobicContact CG-SD 4.43Å; R390-M462 HydrophobicContact CB-SD 3.78Å; R390-M462 VanDerWaalsContact CD-SD 3.59Å; R390-M462 HydrophobicContact CG-CE 4.26Å; R390-M462 HydrophobicContact CG-SD 3.79Å; R391-M462 HydrophobicContact CB-CE 4.06Å; R391-M462 HydrophobicContact CB-SD 4.43Å; R391-M462 PolarHBondContact NH2-O 3.44Å; R391-M462 PolarHBondContact NH2-OXT 2.65Å; A394-M462 HydrophobicContact CB-CE 4.4Å; L458-M462 HydrophobicContact CB-CE 4.48Å; L458-M462 PolarHBondContact O-N 2.85Å; L459-M462 HydrophobicContact CD2-CE 4.05Å

Retrieved 462 of 462 residues in 384.4 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).