A0A096MGL9_POEFO Loading...

Tubulin tyrosine ligase like 10

AlphaFold DB , UniProt , Accession A0A096MGL9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 624 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51.5	Low	40.9	Very low	243 Å²	243	161.1 Å²	161.1	100%	1.197	81%	0.807	S	S	*	*				0	78.4	0	-176.8	-172.4	-71.6	0	0	109.2
2	Q	42.1	Very low	40.8	Very low	181 Å²	181	160.9 Å²	160.9	85%	0.846	80%	0.801	S	S	*	*			trans	-160.5	-13.2	171.3	-127.3	173	3.5	0	0	114.8
3	E	37.9	Very low	40.6	Very low	189 Å²	189	159.6 Å²	159.6	88%	0.883	79%	0.794	S	S	*	*	S	Bend	trans	-99.3	-2.4	-179.4	-64.5	-174.8	114.4	0	0	115	I5	E3-I5 VanDerWaalsContact C-N 3.26Å; E3-I5 PolarHBondContact O-N 2.6Å
4	A	39.3	Very low	40.3	Very low	87 Å²	87	163.1 Å²	163.1	72%	0.719	80%	0.796	S	S	*	*	S	Bend	trans	-74.3	-12.2	176	0	0	0	0	0	113.9
5	I	42.8	Very low	40.3	Very low	156 Å²	156	158.4 Å²	158.4	80%	0.8	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	42	-169.7	-39.3	-177.9	0	0	0	111.6	E3	E3-I5 VanDerWaalsContact C-N 3.26Å; E3-I5 PolarHBondContact O-N 2.6Å
6	K	42	Very low	40.1	Very low	183 Å²	183	159.1 Å²	159.1	80%	0.796	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.7	-4.2	173.2	-77.8	-172.1	177.6	175.7	0	115.3
7	S	40.4	Very low	40	Very low	99 Å²	99	155.7 Å²	155.7	69%	0.692	77%	0.769	S	S	*	*	S	Bend	trans	-90.5	-41.4	-175.9	-168.1	0	0	0	0	114	R9	S7-R9 PolarHBondContact O-N 3.37Å
8	E	39.4	Very low	39.7	Very low	166 Å²	166	158.7 Å²	158.7	78%	0.776	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-75.8	-24.1	-172.6	-64.5	178.1	130	0	0	113.8	C10	E8-C10 PolarHBondContact O-N 3.27Å; E8-C10 VanDerWaalsContact O-N 3.08Å
9	R	39.8	Very low	39.5	Very low	223 Å²	223	158.2 Å²	158.2	84%	0.842	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-76.2	4.2	-172.7	-135.1	177.9	-168	-173.7	3.1	115.4	S7	S7-R9 PolarHBondContact O-N 3.37Å
10	C	37.6	Very low	39.3	Very low	86 Å²	86	159.2 Å²	159.2	58%	0.581	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-112.1	-8.7	-179.1	-70.4	0	0	0	0	114.7	E8	E8-C10 PolarHBondContact O-N 3.27Å; E8-C10 VanDerWaalsContact O-N 3.08Å
11	Q	36.8	Very low	39.1	Very low	159 Å²	159	158.3 Å²	158.3	74%	0.743	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-32	-179.5	-74.1	-174.3	-25.4	0	0	113.9	M13 Y14	Q11-M13 VanDerWaalsContact C-N 3.27Å; Q11-M13 PolarHBondContact O-N 3.09Å; Q11-Y14 PolarHBondContact O-N 3.3Å
12	E	39.7	Very low	38.3	Very low	159 Å²	159	154.9 Å²	154.9	74%	0.743	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-67.1	-21.2	-180	-69.3	-161.4	115.8	0	0	114.8	Y14	E12-Y14 VanDerWaalsContact C-N 3.32Å; E12-Y14 PolarHBondContact O-N 3Å
13	M	38.1	Very low	37.9	Very low	144 Å²	144	153.8 Å²	153.8	71%	0.709	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-75.5	-17.2	-179.4	-69.7	-164.6	-67.9	0	0	113.8	Q11	Q11-M13 VanDerWaalsContact C-N 3.27Å; Q11-M13 PolarHBondContact O-N 3.09Å
14	Y	36.9	Very low	37.6	Very low	209 Å²	209	154.2 Å²	154.2	82%	0.82	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-94.8	-2	-175.2	-98.3	-81.5	0	0	0	115.4	Q11 E12	Q11-Y14 PolarHBondContact O-N 3.3Å; E12-Y14 VanDerWaalsContact C-N 3.32Å; E12-Y14 PolarHBondContact O-N 3Å
15	S	40.3	Very low	37.1	Very low	92 Å²	92	159.3 Å²	159.3	64%	0.643	76%	0.755	S	S	*	*	S	Bend	trans	-106.6	-11.7	-179.6	-57.8	0	0	0	0	115.1
16	K	37.1	Very low	36.4	Very low	170 Å²	170	160.1 Å²	160.1	74%	0.739	76%	0.759	S	S	*	*	S	Bend	trans	-85.9	-33.2	178.1	-76.2	179.2	176.7	169.2	0	113.8	R18	K16-R18 PolarHBondContact O-N 3.18Å; K16-R18 VanDerWaalsContact O-N 3.07Å
17	D	38.3	Very low	35.7	Very low	101 Å²	101	158.1 Å²	158.1	54%	0.54	76%	0.756	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.2	7.6	-173.2	-163.7	34.6	0	0	0	114.9	K21	D17-K21 IonicContact OD1-NZ 2.64Å; D17-K21 PolarHBondContact OD1-NZ 2.9Å; D17-K21 IonicContact OD2-NZ 3.31Å; D17-K21 PolarHBondContact OD2-NZ 3.43Å
18	R	34.4	Very low	35.1	Very low	210 Å²	210	164 Å²	164	79%	0.792	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	-9.5	-179	-151.3	175.2	-174.2	179.1	2.7	114.9	K16	K16-R18 PolarHBondContact O-N 3.18Å; K16-R18 VanDerWaalsContact O-N 3.07Å
19	L	35.6	Very low	34.4	Very low	148 Å²	148	160.1 Å²	160.1	78%	0.775	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.6	-16.1	-179.7	-82.8	163.8	0	0	0	114.6
20	E	36.1	Very low	33.7	Very low	178 Å²	178	153.5 Å²	153.5	83%	0.832	77%	0.77	S	S	*	*	S	Bend	trans	-87.5	2.8	178.3	-67.8	-162.7	119.3	0	0	114.5
21	K	35.1	Very low	33.2	Very low	142 Å²	142	159 Å²	159	62%	0.617	78%	0.784	S	S	*	*	S	Bend	trans	-109.2	-5.3	-173.4	-77.1	170.2	179.1	128.7	0	116.3	D17	D17-K21 IonicContact OD1-NZ 2.64Å; D17-K21 PolarHBondContact OD1-NZ 2.9Å; D17-K21 IonicContact OD2-NZ 3.31Å; D17-K21 PolarHBondContact OD2-NZ 3.43Å
22	E	34.9	Very low	32.7	Very low	170 Å²	170	160.9 Å²	160.9	79%	0.794	79%	0.793	S	S	*	*	S	Bend	trans	-105.9	3.5	-175.8	-71.9	-171.1	151.4	0	0	115.9
23	N	33.5	Very low	32.1	Very low	159 Å²	159	161.6 Å²	161.6	85%	0.85	80%	0.797	S	S	*	*	S	Bend	trans	-122.8	30.1	-175.1	-106.3	-52.3	0	0	0	115.6
24	K	31.4	Very low	31.7	Very low	197 Å²	197	160.9 Å²	160.9	86%	0.857	80%	0.803	S	S	*	*	S	Bend	trans	-145.7	65.7	172.1	-76.2	-170.8	177.8	172	0	114.1
25	Q	28.2	Very low	31.1	Very low	195 Å²	195	156 Å²	156	91%	0.911	80%	0.795	S	S	*	*			trans	176	90.1	144.7	-103	171.2	-30.5	0	0	113.4
26	I	28.2	Very low	30.4	Very low	172 Å²	172	157.7 Å²	157.7	88%	0.882	80%	0.801	S	S	*	*			trans	-141.9	135.3	139	-60.1	-172.9	0	0	0	106.6
27	L	28.8	Very low	29.8	Very low	142 Å²	142	158.4 Å²	158.4	74%	0.743	81%	0.807	S	S	*	*			trans	-152.1	138.4	177.7	-133	160.1	0	0	0	109.3
28	Y	27.8	Very low	29.1	Very low	223 Å²	223	160.9 Å²	160.9	88%	0.875	82%	0.815	S	S	*	*			trans	72.1	129.9	-177	-63.3	-79.1	0	0	0	118.3
29	G	24.1	Very low	28.6	Very low	83 Å²	83	156.9 Å²	156.9	86%	0.856	82%	0.82	S	S	*	*			trans	138.9	119.9	150.8	0	0	0	0	0	116.1
30	G	24.9	Very low	28.1	Very low	85 Å²	85	156.8 Å²	156.8	88%	0.876	82%	0.815	S	S	*	*			trans	107.3	143.1	159	0	0	0	0	0	117.1
31	K	27.6	Very low	27.5	Very low	200 Å²	200	154 Å²	154	87%	0.87	82%	0.816	S	S	*	*			trans	-111.3	151.4	164.1	-58.6	172.6	179.5	176.6	0	107.9
32	E	26	Very low	27.2	Very low	200 Å²	200	152.7 Å²	152.7	94%	0.935	82%	0.822	S	S	*	*				-172.3	163.4	122.9	-104.5	163.4	-159.6	0	0	110.5
33	E	27.6	Very low	26.7	Very low	174 Å²	174	151 Å²	151	81%	0.813	82%	0.818	S	S	*	*			trans	-88.1	164.6	-179.5	-62.6	-175.4	153.2	0	0	111.3
34	P	28.8	Very low	26.3	Very low	129 Å²	129	149.6 Å²	149.6	84%	0.838	82%	0.819	S	S	*	*				-134.1	163.2	111.8	37.4	-29.4	0	0	0	115.3
35	T	23.5	Very low	25.9	Very low	107 Å²	107	150.8 Å²	150.8	66%	0.656	82%	0.819	S	S	*	*			trans	-79.3	157	-167.6	49.1	0	0	0	0	116.2
36	T	25.8	Very low	25.7	Very low	126 Å²	126	149 Å²	149	77%	0.773	82%	0.815	S	S	*	*			trans	66.2	149.9	156.6	40.1	0	0	0	0	117.6
37	E	24.3	Very low	25.7	Very low	186 Å²	186	144.9 Å²	144.9	87%	0.869	80%	0.802	S	S	*	*			cis	-139.1	156.2	14.9	-149.4	166.2	-135.3	0	0	112.4
38	Q	24.7	Very low	25.5	Very low	152 Å²	152	147 Å²	147	71%	0.71	81%	0.808	S	S	*	*			trans	-91.6	146.1	-174.7	-74.9	162.4	-70.7	0	0	113.2	E40	Q38-E40 HydrophobicContact CB-CG 4.39Å; Q38-E40 PolarHBondContact NE2-OE1 3.44Å
39	S	23.7	Very low	25.3	Very low	126 Å²	126	142.8 Å²	142.8	88%	0.881	80%	0.796	S	S	*	*			trans	-135.5	106.2	146.6	52.6	0	0	0	0	109.4
40	E	25.2	Very low	25.5	Very low	146 Å²	146	147 Å²	147	68%	0.682	80%	0.795	S	S	*	*			trans	-96.6	150.2	-173.4	-66.4	-172.8	162	0	0	112.5	Q38	Q38-E40 HydrophobicContact CB-CG 4.39Å; Q38-E40 PolarHBondContact NE2-OE1 3.44Å
41	S	23.2	Very low	25.6	Very low	120 Å²	120	147.9 Å²	147.9	84%	0.839	78%	0.784	S	S	*	*			trans	-153.8	97.3	168	-74.9	0	0	0	0	108.7
42	P	29.5	Very low	25.7	Very low	115 Å²	115	144.4 Å²	144.4	75%	0.747	79%	0.785	S	S	*	*			trans	-80.9	130.9	-176.8	31.6	-33.4	0	0	0	111.5
43	D	24.4	Very low	25.7	Very low	133 Å²	133	142.3 Å²	142.3	71%	0.711	78%	0.775	S	S	*	*				171.4	112.1	117.5	-98.5	-30.8	0	0	0	111.3	W45	D43-W45 PolarHBondContact OD1-NE1 2.61Å; D43-W45 VanDerWaalsContact OD1-NE1 3.17Å
44	C	23.9	Very low	25.7	Very low	130 Å²	130	137.2 Å²	137.2	88%	0.878	77%	0.77	S	S	*	*			trans	-147.4	77.8	165.1	-175	0	0	0	0	109.9
45	W	24.3	Very low	25.5	Very low	223 Å²	223	140 Å²	140	85%	0.845	78%	0.777	S	S	*	*			trans	-68.7	132.4	-178.7	-79.3	75.9	0	0	0	112.8	D43 S47	D43-W45 PolarHBondContact OD1-NE1 2.61Å; D43-W45 VanDerWaalsContact OD1-NE1 3.17Å; W45-S47 PolarHBondContact O-N 2.78Å
46	D	24.6	Very low	25.7	Very low	156 Å²	156	144.2 Å²	144.2	83%	0.834	79%	0.789	S	S	*	*			trans	-64.9	127.7	-178.4	-119.6	-38	0	0	0	111.8	Q48	D46-Q48 PolarHBondContact O-N 3.05Å
47	S	26.4	Very low	25.7	Very low	87 Å²	87	144.1 Å²	144.1	61%	0.608	79%	0.792	S	S	*	*			trans	-95.7	89.4	171.8	-63	0	0	0	0	109.1	W45	W45-S47 PolarHBondContact O-N 2.78Å
48	Q	25.5	Very low	25.7	Very low	185 Å²	185	139.5 Å²	139.5	86%	0.864	79%	0.786	S	S	*	*			trans	-52.2	146.5	178.3	-72.2	-178.2	-25.5	0	0	112.4	D46	D46-Q48 PolarHBondContact O-N 3.05Å
49	E	24.3	Very low	25.7	Very low	135 Å²	135	141.5 Å²	141.5	63%	0.631	80%	0.795	S	S	*	*			trans	-72.8	146.4	167.9	-59.3	-172.3	138.2	0	0	110.1	K272	E49-K272 IonicContact OE1-NZ 2.7Å; E49-K272 PolarHBondContact OE1-NZ 3.28Å
50	M	27.6	Very low	25.8	Very low	171 Å²	171	147.1 Å²	147.1	84%	0.842	80%	0.797	S	S	*	*			trans	-141.7	115.9	157.3	-112.9	-59	-164.8	0	0	110.3
51	T	27.5	Very low	25.8	Very low	104 Å²	104	149.9 Å²	149.9	64%	0.638	81%	0.809	S	S	*	*			trans	-71.1	165	167.3	34.6	0	0	0	0	111	E53	T51-E53 PolarHBondContact O-N 3.18Å
52	S	29.2	Very low	25.9	Very low	127 Å²	127	148 Å²	148	89%	0.888	81%	0.809	S	S	*	*			trans	-77.4	84.6	175.5	58.2	0	0	0	0	111.6
53	E	26	Very low	25.7	Very low	156 Å²	156	146.7 Å²	146.7	73%	0.729	81%	0.808	S	S	*	*			trans	-114	150.1	160.9	-65.1	-178.5	172.5	0	0	107.1	T51	T51-E53 PolarHBondContact O-N 3.18Å
54	G	26.6	Very low	25.7	Very low	68 Å²	68	148.4 Å²	148.4	70%	0.701	82%	0.816	S	S	*	*			cis	136.7	97.9	16.2	0	0	0	0	0	105.3	E56	G54-E56 PolarHBondContact O-N 3.29Å
55	L	26.3	Very low	25.8	Very low	188 Å²	188	147.7 Å²	147.7	98%	0.984	81%	0.808	S	S	*	*			trans	-73.3	111.1	-177.2	-85.3	164.8	0	0	0	109.4
56	E	27.2	Very low	25.8	Very low	195 Å²	195	146.9 Å²	146.9	91%	0.911	81%	0.805	S	S	*	*			trans	-138.3	128.3	161.8	-131.6	159.6	-128.7	0	0	110.2	G54	G54-E56 PolarHBondContact O-N 3.29Å
57	C	24.8	Very low	25.9	Very low	124 Å²	124	146.7 Å²	146.7	84%	0.838	80%	0.799	S	S	*	*			trans	-104.4	121.3	178.6	-174.2	0	0	0	0	107.4
58	A	24.7	Very low	25.8	Very low	89 Å²	89	152 Å²	152	74%	0.736	81%	0.814	S	S	*	*			trans	-65.6	136	-176.7	0	0	0	0	0	111.9
59	H	25	Very low	25.8	Very low	194 Å²	194	147.2 Å²	147.2	90%	0.898	81%	0.814	S	S	*	*			trans	-151.4	153.4	140.1	-101.5	-71.4	0	0	0	109.7
60	R	26.6	Very low	25.9	Very low	244 Å²	244	151.2 Å²	151.2	92%	0.921	82%	0.823	S	S	*	*			trans	-76.6	154	-172.1	-72.3	177	171	163.9	-5	112.8
61	E	24.5	Very low	25.8	Very low	203 Å²	203	152.4 Å²	152.4	95%	0.949	82%	0.818	S	S	*	*			trans	-67.5	152.2	165	-60.6	-179.2	126.3	0	0	112.2
62	G	25.5	Very low	25.6	Very low	80 Å²	80	158.2 Å²	158.2	83%	0.825	83%	0.829	S	S	*	*			trans	-162.5	124.7	166.7	0	0	0	0	0	107.3
63	A	24.6	Very low	25.3	Very low	88 Å²	88	157.2 Å²	157.2	73%	0.727	82%	0.821	S	S	*	*			trans	-117.1	140.4	-157.8	0	0	0	0	0	113.9
64	L	24.6	Very low	25.2	Very low	169 Å²	169	155.2 Å²	155.2	89%	0.885	82%	0.823	S	S	*	*			trans	68.3	154.3	163.9	-53.7	164	0	0	0	114.7
65	T	25.2	Very low	25.1	Very low	116 Å²	116	161.4 Å²	161.4	71%	0.712	83%	0.831	S	S	*	*			cis	-143.3	161.5	8.3	45.8	0	0	0	0	112.8
66	R	25	Very low	25	Very low	206 Å²	206	157.4 Å²	157.4	78%	0.777	82%	0.819	S	S	*	*			trans	60.3	140.4	144.4	-76.9	177.3	94.1	140.7	0.3	123.6
67	E	26	Very low	24.9	Very low	151 Å²	151	154.3 Å²	154.3	71%	0.706	81%	0.813	S	S	*	*			trans	82.8	161.8	141.2	-85.7	162	-149.6	0	0	122.9
68	E	25.5	Very low	25	Very low	200 Å²	200	157.2 Å²	157.2	94%	0.935	81%	0.811	S	S	*	*			trans	-98.6	150.8	-155.1	-53.8	-179.8	110.3	0	0	112.9
69	G	25.5	Very low	25.2	Very low	83 Å²	83	160 Å²	160	86%	0.856	81%	0.81	S	S	*	*			trans	-160.7	138.5	177	0	0	0	0	0	113.9
70	R	25.1	Very low	25.3	Very low	219 Å²	219	157.8 Å²	157.8	83%	0.826	80%	0.797	S	S	*	*			trans	-129.1	140.3	-171.4	-141.6	-171.7	-178.7	179	3.3	111.1
71	R	26.3	Very low	25.2	Very low	196 Å²	196	155.9 Å²	155.9	74%	0.74	79%	0.79	S	S	*	*			trans	76.6	118.8	159.1	-61.1	174.5	169.7	172.9	-4.8	120.9
72	R	23.7	Very low	25.3	Very low	227 Å²	227	153.5 Å²	153.5	86%	0.857	78%	0.779	S	S	*	*				67.7	131.1	122.4	-64.4	-175.6	171.9	-175.4	-3.5	123.3
73	S	23.6	Very low	25.3	Very low	105 Å²	105	155.9 Å²	155.9	73%	0.734	78%	0.781	S	S	*	*			trans	68.8	118	133.3	62.2	0	0	0	0	123.6
74	C	23.8	Very low	25.4	Very low	114 Å²	114	155 Å²	155	77%	0.77	78%	0.781	S	S	*	*				-177.6	141.6	114.7	-93.5	0	0	0	0	109.1
75	F	23.2	Very low	25.5	Very low	198 Å²	198	155.6 Å²	155.6	87%	0.868	78%	0.78	S	S	*	*				57.3	131.8	73.6	-81.9	-73	0	0	0	114.9
76	S	24.4	Very low	25.7	Very low	105 Å²	105	157.2 Å²	157.2	73%	0.734	79%	0.789	S	S	*	*			cis	-121.7	-120.9	-3.5	-159.8	0	0	0	0	112.2
77	V	26	Very low	25.7	Very low	129 Å²	129	151.2 Å²	151.2	78%	0.782	79%	0.792	S	S	*	*			cis	-149.4	174.3	-1.6	-155.7	0	0	0	0	108.4
78	K	26.9	Very low	25.7	Very low	185 Å²	185	147.6 Å²	147.6	80%	0.804	80%	0.795	S	S	*	*			trans	-151	170.2	172.6	-77.9	-172.7	175.6	177.6	0	112.9
79	Q	28.1	Very low	25.7	Very low	149 Å²	149	143.9 Å²	143.9	70%	0.696	79%	0.791	S	S	*	*			trans	87.1	151.5	159.4	-49.2	-166.4	36.5	0	0	116.2
80	K	26.7	Very low	25.8	Very low	147 Å²	147	149.6 Å²	149.6	64%	0.639	79%	0.792	S	S	*	*			cis	-168.8	166.5	-3.9	-124.7	175.9	-170.9	154	0	113.3
81	R	26.1	Very low	25.8	Very low	203 Å²	203	145.3 Å²	145.3	77%	0.766	79%	0.79	S	S	*	*			trans	68.2	162.6	149.7	-72.9	165.3	163.6	-171	-1.3	117.5
82	Q	26.6	Very low	25.8	Very low	154 Å²	154	145.2 Å²	145.2	72%	0.72	80%	0.798	S	S	*	*			cis	-150	136	-10.2	-120.6	159.3	-76.2	0	0	108
83	C	25.1	Very low	25.8	Very low	129 Å²	129	138.1 Å²	138.1	87%	0.872	80%	0.795	S	S	*	*				64	126.6	91.5	-156.1	0	0	0	0	117.8
84	G	25.5	Very low	25.9	Very low	71 Å²	71	138.9 Å²	138.9	73%	0.732	80%	0.801	S	S	*	*			trans	-179.6	153.2	171.8	0	0	0	0	0	112.4
85	Q	27.9	Very low	26	Very low	181 Å²	181	142.5 Å²	142.5	85%	0.846	80%	0.804	S	S	*	*			trans	-140.3	177.5	-171.5	-86.8	-169.3	-27.9	0	0	113.8
86	T	28.1	Very low	26.2	Very low	149 Å²	149	142.5 Å²	142.5	91%	0.914	81%	0.806	S	S	*	*			trans	76.8	149.8	176.3	76.4	0	0	0	0	115
87	G	26	Very low	26.3	Very low	81 Å²	81	148.9 Å²	148.9	84%	0.835	81%	0.814	S	S	*	*			cis	-167.5	179.3	-4.4	0	0	0	0	0	108.6
88	G	25.8	Very low	26.4	Very low	74 Å²	74	148.1 Å²	148.1	76%	0.763	81%	0.814	S	S	*	*			cis	-156.1	-124.5	3.6	0	0	0	0	0	111
89	S	26.3	Very low	26.3	Very low	122 Å²	122	148.6 Å²	148.6	85%	0.853	82%	0.817	S	S	*	*			trans	-158.1	145.7	174.2	-64.9	0	0	0	0	114.8
90	K	26	Very low	26.4	Very low	204 Å²	204	146.9 Å²	146.9	89%	0.887	82%	0.821	S	S	*	*			trans	-178.8	131.5	149.8	-99.5	165.9	-177.7	-173.3	0	107.2
91	V	26.9	Very low	26.5	Very low	128 Å²	128	151.9 Å²	151.9	78%	0.776	84%	0.836	S	S	*	*			cis	92.3	135.7	33.3	-175.8	0	0	0	0	112.5
92	E	25	Very low	26.5	Very low	194 Å²	194	145.5 Å²	145.5	91%	0.907	83%	0.833	S	S	*	*			trans	71.6	146.2	-175.3	-41.1	-160.7	143.3	0	0	116.9
93	G	24.1	Very low	27	Very low	78 Å²	78	144.8 Å²	144.8	80%	0.804	84%	0.842	S	S	*	*			cis	151.4	115.8	-12.3	0	0	0	0	0	114
94	S	25.2	Very low	27.1	Very low	122 Å²	122	141.3 Å²	141.3	85%	0.853	83%	0.827	S	S	*	*			trans	-164.9	137.3	164.2	-172.1	0	0	0	0	113.2
95	F	26.4	Very low	27.4	Very low	189 Å²	189	144.6 Å²	144.6	83%	0.829	84%	0.836	S	S	*	*			trans	-97	146.8	161.4	-91	-106.1	0	0	0	108.9
96	H	27.4	Very low	27.3	Very low	198 Å²	198	141.3 Å²	141.3	92%	0.917	83%	0.832	S	S	*	*			trans	-161.5	164.4	135.5	-109.2	51.2	0	0	0	111.5
97	R	26.8	Very low	28	Very low	240 Å²	240	139.5 Å²	139.5	91%	0.906	83%	0.825	S	S	*	*			trans	-143.5	114.9	-157.2	174.9	-166.2	-177.5	-161.6	4.1	112.6
98	S	26.7	Very low	28.1	Very low	112 Å²	112	142.8 Å²	142.8	78%	0.783	82%	0.824	S	S	*	*			trans	-155.8	114.9	173.6	41.5	0	0	0	0	116.6
99	K	26.8	Very low	28.8	Very low	196 Å²	196	148.7 Å²	148.7	85%	0.852	83%	0.828	S	S	*	*			trans	47.9	91.9	138.4	-60.5	-176.9	179.2	179.4	0	120.7
100	S	30.2	Very low	28.8	Very low	112 Å²	112	146.2 Å²	146.2	78%	0.783	82%	0.822	S	S	*	*				20.9	118.7	121.4	60.2	0	0	0	0	120.5
101	R	27.7	Very low	29	Very low	253 Å²	253	144.6 Å²	144.6	96%	0.955	82%	0.817	S	S	*	*			trans	-152.4	141	140	-97.1	178.3	-175.6	-178.9	0.1	108.9
102	G	26.4	Very low	29.2	Very low	69 Å²	69	146.4 Å²	146.4	71%	0.711	82%	0.823	S	S	*	*			trans	-103.6	-168.2	160	0	0	0	0	0	110.2
103	P	37	Very low	29.8	Very low	139 Å²	139	145 Å²	145	90%	0.903	81%	0.814	S	S	*	*			cis	-120	179.6	1.6	41.2	-28.8	0	0	0	113.5
104	G	26.7	Very low	30.5	Very low	55 Å²	55	148.5 Å²	148.5	57%	0.567	81%	0.814	S	S	*	*			trans	168.7	121.5	167.2	0	0	0	0	0	114.4	C106	G104-C106 PolarHBondContact O-N 3.39Å; G104-C106 VanDerWaalsContact O-N 3.08Å
105	P	32.8	Very low	31.4	Very low	141 Å²	141	149.7 Å²	149.7	92%	0.916	81%	0.809	S	S	*	*			trans	-82.8	76.6	176.6	33.7	-33.9	0	0	0	111.1	S107	P105-S107 PolarHBondContact O-N 2.88Å; P105-S107 VanDerWaalsContact O-N 3.16Å
106	C	26	Very low	32.6	Very low	112 Å²	112	149.6 Å²	149.6	76%	0.757	81%	0.809	S	S	*	*			trans	-71.5	109.6	177.9	-69.9	0	0	0	0	111.7	G104 N108	G104-C106 PolarHBondContact O-N 3.39Å; G104-C106 VanDerWaalsContact O-N 3.08Å; C106-N108 PolarHBondContact O-N 3.11Å
107	S	42.3	Very low	34.5	Very low	110 Å²	110	144.1 Å²	144.1	77%	0.769	79%	0.789	S	S	*	*			trans	-56	103.9	167.6	173.2	0	0	0	0	111	P105	P105-S107 PolarHBondContact O-N 2.88Å; P105-S107 VanDerWaalsContact O-N 3.16Å
108	N	27.9	Very low	36.9	Very low	151 Å²	151	139.9 Å²	139.9	81%	0.807	78%	0.78	S	S	*	*			trans	-100.2	114.6	165.4	-96.7	-27.7	0	0	0	108.6	C106 G110	C106-N108 PolarHBondContact O-N 3.11Å; N108-G110 VanDerWaalsContact C-N 3.33Å; N108-G110 PolarHBondContact O-N 2.82Å
109	K	39.4	Very low	39.7	Very low	198 Å²	198	136.8 Å²	136.8	86%	0.861	75%	0.753	S	S	*	*			trans	-64.2	96	165.6	-70.8	-177	177.2	-178.8	0	108.1	Q111	K109-Q111 PolarHBondContact O-N 2.89Å; K109-Q111 VanDerWaalsContact O-N 3.15Å
110	G	27.6	Very low	42.6	Very low	70 Å²	70	129.1 Å²	129.1	72%	0.722	72%	0.723	S	S	*	*			trans	-56.9	118.2	175.5	0	0	0	0	0	109.5	N108 D112	N108-G110 VanDerWaalsContact C-N 3.33Å; N108-G110 PolarHBondContact O-N 2.82Å; G110-D112 PolarHBondContact O-N 3.29Å
111	Q	30	Very low	45.2	Very low	169 Å²	169	132.6 Å²	132.6	79%	0.79	72%	0.719	S	S	*	*			trans	-59.3	124.1	171.7	-68.6	171.6	-29.1	0	0	108.2	K109 K113	K109-Q111 PolarHBondContact O-N 2.89Å; K109-Q111 VanDerWaalsContact O-N 3.15Å; Q111-K113 PolarHBondContact O-N 3.37Å
112	D	31.6	Very low	47.8	Very low	166 Å²	166	123.6 Å²	123.6	89%	0.888	71%	0.705	S	S	*	*			trans	-68.1	98.2	179	-158.2	-1.9	0	0	0	108.8	G110 D114	G110-D112 PolarHBondContact O-N 3.29Å; D112-D114 PolarHBondContact O-N 2.82Å
113	K	36.2	Very low	50.6	Low	164 Å²	164	127.7 Å²	127.7	71%	0.713	71%	0.71	S	S	*	*			trans	-81.3	103.4	-179.2	-77.2	-176.7	178.2	177.8	0	107.3	Q111 I115	Q111-K113 PolarHBondContact O-N 3.37Å; K113-I115 VanDerWaalsContact C-N 3.32Å; K113-I115 WeakPolarHBondContact O-CG1 3.45Å; K113-I115 PolarHBondContact O-N 3.23Å
114	D	39	Very low	52.9	Low	152 Å²	152	123 Å²	123	81%	0.813	69%	0.687	S	S	*	*			trans	-43.4	94.2	165.7	-93.1	-43.8	0	0	0	110.7	D112 K116	D112-D114 PolarHBondContact O-N 2.82Å; D114-K116 PolarHBondContact O-N 2.67Å
115	I	45.2	Very low	56.1	Low	148 Å²	148	123 Å²	123	76%	0.759	68%	0.677	S	S	*	*			trans	-72.4	91.4	170.3	-58.8	-177.3	0	0	0	105.4	K113 T117	K113-I115 VanDerWaalsContact C-N 3.32Å; K113-I115 WeakPolarHBondContact O-CG1 3.45Å; K113-I115 PolarHBondContact O-N 3.23Å; I115-T117 PolarHBondContact O-N 3.04Å; I115-T117 PolarHBondContact O-OG1 2.89Å
116	K	51.6	Low	59.2	Low	187 Å²	187	116.6 Å²	116.6	81%	0.813	64%	0.635	S	S	*	*			trans	-57.2	90.2	168.5	-73.7	179.5	178.8	172.1	0	108.2	D114 E118	D114-K116 PolarHBondContact O-N 2.67Å; K116-E118 PolarHBondContact O-N 3.46Å
117	T	66.2	Low	62.6	Low	83 Å²	83	111.3 Å²	111.3	51%	0.509	60%	0.599	S	S	.	*			trans	-56.9	113.8	-179	-59.3	0	0	0	0	107.6	I115 E119 Y151	I115-T117 PolarHBondContact O-N 3.04Å; I115-T117 PolarHBondContact O-OG1 2.89Å; T117-E119 PolarHBondContact O-N 2.84Å; T117-E119 VanDerWaalsContact O-N 3.17Å; T117-Y151 HydrophobicContact CG2-CD2 4.25Å; T117-Y151 HydrophobicContact CG2-CE2 3.67Å
118	E	77.1	Confident	65.2	Low	151 Å²	151	106.6 Å²	106.6	71%	0.706	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-63.1	121.1	-174.6	-78.1	-139.5	100.9	0	0	110.4	K116 P120 R121	K116-E118 PolarHBondContact O-N 3.46Å; E118-P120 WeakPolarHBondContact O-CD 3.44Å; E118-R121 IonicContact OE1-NH2 2.89Å; E118-R121 PolarHBondContact OE1-NH2 3.37Å
119	E	85.7	Confident	68.5	Low	46 Å²	46	99.7 Å²	99.7	22%	0.215	53%	0.527	C	S	.	.	P	Polyproline II helix	trans	-58.1	117.8	175.2	-90.5	-73.5	148.3	0	0	109.9	T117 R121 Y151 N152 R155	T117-E119 PolarHBondContact O-N 2.84Å; T117-E119 VanDerWaalsContact O-N 3.17Å; E119-R121 WeakPolarHBondContact O-CG 3.16Å; E119-R121 PolarHBondContact O-N 2.73Å; E119-Y151 WeakPolarHBondContact OE1-CA 3.45Å; E119-Y151 PolarHBondContact OE1-N 3.13Å; E119-N152 HydrophobicContact CG-CB 4.38Å; E119-N152 WeakPolarHBondContact OE1-CB 3.2Å; E119-N152 PolarHBondContact OE1-N 3.09Å; E119-R155 WeakPolarHBondContact OE2-CD 3.45Å; E119-R155 IonicContact OE2-CZ 3.69Å; E119-R155 IonicContact OE2-NE 3.45Å; E119-R155 IonicContact OE2-NH1 3.22Å; E119-R155 PolarHBondContact OE2-NH1 3.14Å
120	P	87.6	Confident	71.2	Confident	35 Å²	35	90.5 Å²	90.5	23%	0.227	49%	0.488	C	S	.	.	P	Polyproline II helix	trans	-70.1	134	-170.6	25.6	-33	0	0	0	111	E118 F126 K148 R149 I150 R155	E118-P120 WeakPolarHBondContact O-CD 3.44Å; P120-F126 HydrophobicContact CB-CE1 4.22Å; P120-F126 HydrophobicContact CG-CD1 4.4Å; P120-F126 HydrophobicContact CG-CE1 4.16Å; P120-F126 WeakPolarHBondContact O-CE1 2.97Å; P120-K148 HydrophobicContact CB-CB 4.22Å; P120-K148 HydrophobicContact CB-CD 4.31Å; P120-K148 HydrophobicContact CG-CB 4.03Å; P120-R149 WeakPolarHBondContact CD-O 3.12Å; P120-R149 WeakPolarHBondContact CG-O 3.4Å; P120-I150 HydrophobicContact CG-CG2 4.36Å; P120-R155 PolarHBondContact O-NH1 3.32Å; P120-R155 PolarHBondContact O-NH2 2.95Å
121	R	84.3	Confident	74.4	Confident	185 Å²	185	88.9 Å²	88.9	70%	0.698	47%	0.472	S	S	*	.			trans	-109.9	-178.2	-172.7	-43.4	-173.5	-157.6	-135.2	6.4	111.3	E118 E119 K148	E118-R121 IonicContact OE1-NH2 2.89Å; E118-R121 PolarHBondContact OE1-NH2 3.37Å; E119-R121 WeakPolarHBondContact O-CG 3.16Å; E119-R121 PolarHBondContact O-N 2.73Å; R121-K148 PolarHBondContact O-NZ 2.73Å
122	G	83.8	Confident	77.6	Confident	65 Å²	65	86 Å²	86	67%	0.67	47%	0.467	S	S	*	.	S	Bend	trans	76	-155.6	-179.4	0	0	0	0	0	113	F126	G122-F126 WeakPolarHBondContact O-CE2 3.38Å; G122-F126 WeakPolarHBondContact O-CZ 2.94Å
123	L	84.4	Confident	80.6	Confident	155 Å²	155	78.4 Å²	78.4	81%	0.812	43%	0.426	S	S	*	.	S	Bend	trans	-68.2	138.6	-179.8	-62	176.3	0	0	0	111.5	K148	L123-K148 PolarHBondContact O-NZ 3.11Å
124	G	85.3	Confident	83.5	Confident	40 Å²	40	71 Å²	71	41%	0.412	40%	0.396	S	S	.	.			trans	-81.3	-156.4	171.9	0	0	0	0	0	112.5
125	P	94.3	Very high	86.2	Confident	54 Å²	54	65 Å²	65	35%	0.351	37%	0.368	S	S	.	.			cis	-71.1	149.5	9.9	28.3	-36.7	0	0	0	114.5	W147 K148 R159	P125-W147 HydrophobicContact CB-CD2 4.11Å; P125-W147 HydrophobicContact CB-CG 4.18Å; P125-W147 HydrophobicContact CG-CB 4.37Å; P125-W147 HydrophobicContact CG-CD2 3.97Å; P125-W147 HydrophobicContact CG-CG 3.65Å; P125-W147 WeakPolarHBondContact O-CA 3.3Å; P125-K148 PolarHBondContact O-N 2.94Å; P125-R159 HydrophobicContact CB-CB 4.08Å
126	F	97.1	Very high	88.7	Confident	8 Å²	8	64.2 Å²	64.2	4%	0.035	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	152	177.2	-66.2	-72.9	0	0	0	111.2	P120 G122 K148 I150 R155 D157 F158 R159	P120-F126 HydrophobicContact CB-CE1 4.22Å; P120-F126 HydrophobicContact CG-CD1 4.4Å; P120-F126 HydrophobicContact CG-CE1 4.16Å; P120-F126 WeakPolarHBondContact O-CE1 2.97Å; G122-F126 WeakPolarHBondContact O-CE2 3.38Å; G122-F126 WeakPolarHBondContact O-CZ 2.94Å; F126-K148 CarbonylContact C-O 3.56Å; F126-K148 VanDerWaalsContact CA-O 3.28Å; F126-K148 WeakPolarHBondContact CA-O 3.48Å; F126-K148 HydrophobicContact CD1-CB 3.57Å; F126-K148 HydrophobicContact CD1-CD 4.31Å; F126-K148 HydrophobicContact CE1-CB 3.73Å; F126-K148 HydrophobicContact CE1-CD 3.65Å; F126-K148 HydrophobicContact CE1-CG 4.35Å; F126-K148 HydrophobicContact CZ-CD 4.25Å; F126-I150 HydrophobicContact CB-CG2 3.84Å; F126-I150 HydrophobicContact CD1-CG2 3.63Å; F126-I150 HydrophobicContact CG-CG2 4.03Å; F126-R155 VanDerWaalsContact CZ-NH2 3.34Å; F126-D157 WeakPolarHBondContact CD2-OD2 3.24Å; F126-F158 CarbonylContact O-C 3.6Å; F126-R159 PolarHBondContact O-N 2.68Å
127	Y	97.8	Very high	90.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	151.2	169.7	77.2	-76.3	0	0	0	112.1	F129 C139 C142 E143 W147 K148 R149 I150 L160	Y127-F129 HydrophobicContact CE2-CB 4.26Å; Y127-C139 HydrophobicContact CE2-CB 4.35Å; Y127-C139 WeakPolarHBondContact OH-CA 3.48Å; Y127-C139 WeakPolarHBondContact OH-CB 3.26Å; Y127-C142 HydrophobicContact CD1-CB 3.54Å; Y127-C142 HydrophobicContact CD2-CB 4.01Å; Y127-C142 HydrophobicContact CE1-CB 3.46Å; Y127-C142 VanDerWaalsContact CE1-CB 3.46Å; Y127-C142 HydrophobicContact CE2-CB 3.95Å; Y127-C142 HydrophobicContact CG-CB 3.81Å; Y127-E143 HydrophobicContact CE1-CG 4.48Å; Y127-E143 PolarHBondContact OH-OE1 3.07Å; Y127-W147 HydrophobicContact CD1-CB 3.88Å; Y127-W147 HydrophobicContact CE1-CB 4.38Å; Y127-K148 WeakPolarHBondContact CD1-O 3.27Å; Y127-K148 PolarHBondContact N-O 3.1Å; Y127-R149 HydrophobicContact CE1-CB 3.72Å; Y127-R149 HydrophobicContact CE1-CG 4.3Å; Y127-R149 HydrophobicContact CE2-CB 4.38Å; Y127-R149 HydrophobicContact CE2-CG 4.07Å; Y127-R149 CarbonylContact O-C 3.6Å; Y127-R149 WeakPolarHBondContact O-CA 3.23Å; Y127-I150 PolarHBondContact O-N 3.2Å; Y127-L160 VanDerWaalsContact CA-O 3.3Å; Y127-L160 WeakPolarHBondContact CA-O 3.16Å
128	F	97.4	Very high	92.4	Very high	11 Å²	11	52.2 Å²	52.2	5%	0.048	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	135.7	171.6	171.1	-85.8	0	0	0	109.5	I150 Y151 K153 L160 K161 W162	F128-I150 HydrophobicContact CB-CD1 4.18Å; F128-I150 HydrophobicContact CB-CG1 3.75Å; F128-I150 HydrophobicContact CD2-CG1 4.34Å; F128-I150 WeakPolarHBondContact CD2-O 3.48Å; F128-Y151 WeakPolarHBondContact CE2-O 3.42Å; F128-K153 HydrophobicContact CD2-CB 4.28Å; F128-K153 HydrophobicContact CE1-CB 4.39Å; F128-K153 HydrophobicContact CE2-CB 3.62Å; F128-K153 HydrophobicContact CZ-CB 3.69Å; F128-L160 PolarHBondContact N-O 3.34Å; F128-K161 HydrophobicContact CB-CG 3.75Å; F128-K161 HydrophobicContact CD1-CG 3.95Å; F128-K161 HydrophobicContact CG-CG 4.2Å; F128-W162 PolarHBondContact O-N 2.77Å
129	F	97.6	Very high	93.4	Very high	6 Å²	6	45.3 Å²	45.3	3%	0.026	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	123.9	170.9	-172.2	-78.8	0	0	0	109.9	Y127 G131 A135 V138 R149 W162	Y127-F129 HydrophobicContact CE2-CB 4.26Å; F129-G131 WeakPolarHBondContact CE1-O 3.39Å; F129-A135 HydrophobicContact CD1-CB 4.04Å; F129-A135 HydrophobicContact CE1-CB 3.48Å; F129-A135 VanDerWaalsContact CE1-CB 3.48Å; F129-A135 HydrophobicContact CZ-CB 3.84Å; F129-V138 HydrophobicContact CD2-CB 3.79Å; F129-V138 HydrophobicContact CD2-CG1 3.78Å; F129-V138 HydrophobicContact CE2-CB 3.69Å; F129-V138 HydrophobicContact CE2-CG1 4.07Å; F129-V138 HydrophobicContact CE2-CG2 3.98Å; F129-R149 PolarHBondContact O-NH2 2.97Å; F129-W162 WeakPolarHBondContact CA-O 3.48Å; F129-W162 HydrophobicContact CD2-CB 3.94Å; F129-W162 AromaticContact CD2-CD1 3.71Å; F129-W162 AromaticContact CD2-CG 4Å; F129-W162 HydrophobicContact CD2-CG 4Å; F129-W162 HydrophobicContact CE2-CB 4.3Å; F129-W162 AromaticContact CE2-CD1 3.18Å; F129-W162 AromaticContact CE2-CG 3.85Å; F129-W162 HydrophobicContact CE2-CG 3.85Å; F129-W162 AromaticContact CE2-NE1 3.72Å; F129-W162 AromaticContact CZ-CD1 3.91Å
130	G	96.2	Very high	94	Very high	5 Å²	5	43.6 Å²	43.6	5%	0.052	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	123.9	-178.7	0	0	0	0	0	113.5	W162 C163 E164 Q168	G130-W162 PolarHBondContact N-O 3.01Å; G130-C163 WeakPolarHBondContact O-CA 3.35Å; G130-E164 PolarHBondContact O-N 3Å; G130-Q168 VanDerWaalsContact CA-OE1 3.26Å
131	G	94.9	Very high	94.5	Very high	37 Å²	37	42.7 Å²	42.7	38%	0.381	26%	0.258	S	S	.	.	S	Bend	trans	115.5	-164.4	-168.9	0	0	0	0	0	111.7	F129 E164	F129-G131 WeakPolarHBondContact CE1-O 3.39Å; G131-E164 WeakPolarHBondContact CA-OE2 3.5Å
132	T	95.7	Very high	95.1	Very high	109 Å²	109	33.9 Å²	33.9	67%	0.669	22%	0.224	S	C	*	.	S	Bend	trans	-127.2	-23.5	175.5	60.9	0	0	0	0	113.1	G134 A135 E164	T132-G134 PolarHBondContact O-N 3.43Å; T132-A135 WeakPolarHBondContact O-CB 3.4Å; T132-A135 PolarHBondContact O-N 2.77Å; T132-A135 VanDerWaalsContact O-N 3.09Å; T132-E164 PolarHBondContact N-OE2 2.74Å
133	N	95.8	Very high	95.8	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.027	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	104.1	-177.2	-174.4	44.2	0	0	0	113	E164 N466 P467 L469	N133-E164 VanDerWaalsContact CB-OE1 3.31Å; N133-E164 WeakPolarHBondContact CB-OE1 3.31Å; N133-E164 WeakPolarHBondContact CB-OE2 3.44Å; N133-E164 PolarHBondContact N-OE2 3.4Å; N133-N466 PolarHBondContact ND2-OD1 3.46Å; N133-P467 PolarHBondContact ND2-O 3.08Å; N133-L469 PolarHBondContact OD1-N 2.97Å
134	G	95.8	Very high	96.4	Very high	9 Å²	9	37.1 Å²	37.1	9%	0.093	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	15.8	-179.2	0	0	0	0	0	115.4	T132 E136 I137 V138	T132-G134 PolarHBondContact O-N 3.43Å; G134-E136 PolarHBondContact O-N 2.9Å; G134-I137 PolarHBondContact O-N 3.36Å; G134-V138 PolarHBondContact O-N 3.44Å; G134-V138 VanDerWaalsContact O-N 3.08Å
135	A	96.8	Very high	96.9	Very high	27 Å²	27	41.1 Å²	41.1	22%	0.223	21%	0.212	C	C	.	.	H	α-helix	trans	-51.5	-50.6	-174.1	0	0	0	0	0	114.1	F129 T132 I137 V138 C139	F129-A135 HydrophobicContact CD1-CB 4.04Å; F129-A135 HydrophobicContact CE1-CB 3.48Å; F129-A135 VanDerWaalsContact CE1-CB 3.48Å; F129-A135 HydrophobicContact CZ-CB 3.84Å; T132-A135 WeakPolarHBondContact O-CB 3.4Å; T132-A135 PolarHBondContact O-N 2.77Å; T132-A135 VanDerWaalsContact O-N 3.09Å; A135-I137 VanDerWaalsContact C-N 3.31Å; A135-I137 PolarHBondContact O-N 2.87Å; A135-V138 PolarHBondContact O-N 3.42Å; A135-C139 WeakPolarHBondContact O-CB 3.49Å; A135-C139 PolarHBondContact O-N 2.76Å; A135-C139 PolarHBondContact O-SG 2.83Å
136	E	97	Very high	97	Very high	131 Å²	131	41.2 Å²	41.2	61%	0.612	22%	0.223	S	C	*	.	H	α-helix	trans	-55.1	-43.6	176.8	-175.8	-161.4	158.4	0	0	112.5	G134 G140 R471	G134-E136 PolarHBondContact O-N 2.9Å; E136-G140 PolarHBondContact O-N 3.39Å; E136-R471 IonicContact OE1-CZ 2.93Å; E136-R471 IonicContact OE1-NH2 3.55Å; E136-R471 PolarHBondContact OE1-NH2 2.88Å; E136-R471 IonicContact OE2-CZ 2.75Å; E136-R471 IonicContact OE2-NE 3.69Å; E136-R471 IonicContact OE2-NH2 2.65Å; E136-R471 PolarHBondContact OE2-NH2 3.35Å
137	I	97.8	Very high	97	Very high	18 Å²	18	42.4 Å²	42.4	9%	0.092	23%	0.227	C	C	.	.	H	α-helix	trans	-68.8	-49.3	-175.8	-51.4	176.5	0	0	0	110	G134 A135 Y141 I480 P481 V484	G134-I137 PolarHBondContact O-N 3.36Å; A135-I137 VanDerWaalsContact C-N 3.31Å; A135-I137 PolarHBondContact O-N 2.87Å; I137-Y141 WeakPolarHBondContact O-CB 3.34Å; I137-Y141 PolarHBondContact O-N 3.08Å; I137-I480 HydrophobicContact CD1-CG2 3.74Å; I137-P481 HydrophobicContact CD1-CG 4.28Å; I137-P481 HydrophobicContact CG2-CB 4.47Å; I137-V484 HydrophobicContact CG2-CB 3.95Å; I137-V484 HydrophobicContact CG2-CG1 3.78Å
138	V	98	Very high	96.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-76.4	-39.2	-175.3	-178.1	0	0	0	0	111.8	F129 G134 A135 C142 W162 V484 L488	F129-V138 HydrophobicContact CD2-CB 3.79Å; F129-V138 HydrophobicContact CD2-CG1 3.78Å; F129-V138 HydrophobicContact CE2-CB 3.69Å; F129-V138 HydrophobicContact CE2-CG1 4.07Å; F129-V138 HydrophobicContact CE2-CG2 3.98Å; G134-V138 PolarHBondContact O-N 3.44Å; G134-V138 VanDerWaalsContact O-N 3.08Å; A135-V138 PolarHBondContact O-N 3.42Å; V138-C142 PolarHBondContact O-N 2.95Å; V138-C142 VanDerWaalsContact O-N 3.13Å; V138-C142 PolarHBondContact O-SG 3.21Å; V138-W162 HydrophobicContact CG1-CB 4Å; V138-W162 HydrophobicContact CG1-CD2 3.96Å; V138-W162 HydrophobicContact CG1-CE3 4.1Å; V138-W162 HydrophobicContact CG1-CG 3.92Å; V138-W162 HydrophobicContact CG2-CD2 3.94Å; V138-W162 HydrophobicContact CG2-CE3 4.27Å; V138-W162 HydrophobicContact CG2-CG 4.38Å; V138-W162 HydrophobicContact CG2-CH2 4.39Å; V138-W162 HydrophobicContact CG2-CZ2 4.07Å; V138-W162 HydrophobicContact CG2-CZ3 4.48Å; V138-V484 HydrophobicContact CG2-CG1 3.86Å; V138-L488 HydrophobicContact CG1-CD1 4.29Å; V138-L488 HydrophobicContact CG2-CD1 4.4Å
139	C	98	Very high	96.8	Very high	6 Å²	6	49.1 Å²	49.1	4%	0.041	26%	0.255	C	S	.	.	H	α-helix	trans	-64.9	-53.6	174.7	-64.7	0	0	0	0	110.3	Y127 A135 Y141 C142 E143	Y127-C139 HydrophobicContact CE2-CB 4.35Å; Y127-C139 WeakPolarHBondContact OH-CA 3.48Å; Y127-C139 WeakPolarHBondContact OH-CB 3.26Å; A135-C139 WeakPolarHBondContact O-CB 3.49Å; A135-C139 PolarHBondContact O-N 2.76Å; A135-C139 PolarHBondContact O-SG 2.83Å; C139-Y141 PolarHBondContact O-N 3.08Å; C139-C142 WeakPolarHBondContact O-CA 3.48Å; C139-C142 WeakPolarHBondContact O-CB 3.27Å; C139-C142 PolarHBondContact O-N 3.14Å; C139-E143 WeakPolarHBondContact O-CB 3.48Å; C139-E143 VanDerWaalsContact O-CG 3.29Å; C139-E143 WeakPolarHBondContact O-CG 3.44Å; C139-E143 PolarHBondContact O-N 2.79Å
140	G	98.1	Very high	96.7	Very high	10 Å²	10	48.9 Å²	48.9	10%	0.103	25%	0.253	C	S	.	.	H	α-helix	trans	-60.2	-32.9	178.8	0	0	0	0	0	113.4	E136 E143 R144	E136-G140 PolarHBondContact O-N 3.39Å; G140-E143 WeakPolarHBondContact CA-OE2 3.27Å; G140-E143 PolarHBondContact N-OE2 2.96Å; G140-R144 VanDerWaalsContact C-NH1 3.32Å; G140-R144 VanDerWaalsContact O-CB 3.3Å; G140-R144 WeakPolarHBondContact O-CB 3.24Å; G140-R144 VanDerWaalsContact O-CG 3.24Å; G140-R144 WeakPolarHBondContact O-CG 3.39Å; G140-R144 PolarHBondContact O-N 2.97Å; G140-R144 PolarHBondContact O-NE 3.37Å; G140-R144 PolarHBondContact O-NH1 2.92Å
141	Y	98.3	Very high	96.6	Very high	16 Å²	16	54.2 Å²	54.2	6%	0.063	27%	0.273	C	S	.	.	H	α-helix	trans	-63.6	-43.4	171.7	174	-84.1	0	0	0	112.5	I137 C139 R145 L488 D489 L492	I137-Y141 WeakPolarHBondContact O-CB 3.34Å; I137-Y141 PolarHBondContact O-N 3.08Å; C139-Y141 PolarHBondContact O-N 3.08Å; Y141-R145 WeakPolarHBondContact O-CG 3.24Å; Y141-R145 PolarHBondContact O-N 3.33Å; Y141-R145 PolarHBondContact OH-NE 3.06Å; Y141-R145 PolarHBondContact OH-NH2 2.81Å; Y141-L488 HydrophobicContact CD1-CB 4.18Å; Y141-L488 HydrophobicContact CD1-CD1 3.67Å; Y141-L488 HydrophobicContact CD1-CG 4.46Å; Y141-L488 HydrophobicContact CD2-CD1 4.43Å; Y141-L488 HydrophobicContact CE1-CB 3.59Å; Y141-L488 HydrophobicContact CE1-CD1 3.96Å; Y141-L488 HydrophobicContact CE1-CG 4.26Å; Y141-L488 HydrophobicContact CE2-CB 4.01Å; Y141-L488 HydrophobicContact CG-CD1 3.94Å; Y141-L488 VanDerWaalsContact CZ-CB 3.48Å; Y141-D489 WeakPolarHBondContact CE2-OD1 3.38Å; Y141-D489 WeakPolarHBondContact OH-CA 3.5Å; Y141-D489 PolarHBondContact OH-N 3.17Å; Y141-D489 PolarHBondContact OH-OD1 3.42Å; Y141-L492 HydrophobicContact CE1-CD1 3.93Å; Y141-L492 WeakPolarHBondContact OH-CD1 3.27Å
142	C	98.1	Very high	96.5	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-70.7	-44.1	177.7	-64.9	0	0	0	0	111.6	Y127 V138 C139 R145 G146 W147	Y127-C142 HydrophobicContact CD1-CB 3.54Å; Y127-C142 HydrophobicContact CD2-CB 4.01Å; Y127-C142 HydrophobicContact CE1-CB 3.46Å; Y127-C142 VanDerWaalsContact CE1-CB 3.46Å; Y127-C142 HydrophobicContact CE2-CB 3.95Å; Y127-C142 HydrophobicContact CG-CB 3.81Å; V138-C142 PolarHBondContact O-N 2.95Å; V138-C142 VanDerWaalsContact O-N 3.13Å; V138-C142 PolarHBondContact O-SG 3.21Å; C139-C142 WeakPolarHBondContact O-CA 3.48Å; C139-C142 WeakPolarHBondContact O-CB 3.27Å; C139-C142 PolarHBondContact O-N 3.14Å; C142-R145 CarbonylContact O-C 3.6Å; C142-R145 WeakPolarHBondContact O-CA 3.46Å; C142-R145 WeakPolarHBondContact O-CB 3.13Å; C142-R145 PolarHBondContact O-N 3.12Å; C142-G146 PolarHBondContact O-N 2.71Å; C142-W147 HydrophobicContact CB-CB 4.05Å; C142-W147 HydrophobicContact CB-CE3 4.32Å; C142-W147 VanDerWaalsContact O-CB 3.28Å; C142-W147 WeakPolarHBondContact O-CB 3.43Å; C142-W147 PolarHBondContact O-N 2.93Å
143	E	96.9	Very high	96.3	Very high	99 Å²	99	55.6 Å²	55.6	46%	0.463	26%	0.263	S	S	.	.	H	α-helix	trans	-63	-43.2	-179.9	-70.2	153.7	-176.3	0	0	111.4	Y127 C139 G140 R145 G146	Y127-E143 HydrophobicContact CE1-CG 4.48Å; Y127-E143 PolarHBondContact OH-OE1 3.07Å; C139-E143 WeakPolarHBondContact O-CB 3.48Å; C139-E143 VanDerWaalsContact O-CG 3.29Å; C139-E143 WeakPolarHBondContact O-CG 3.44Å; C139-E143 PolarHBondContact O-N 2.79Å; G140-E143 WeakPolarHBondContact CA-OE2 3.27Å; G140-E143 PolarHBondContact N-OE2 2.96Å; E143-R145 PolarHBondContact O-N 3.43Å; E143-R145 VanDerWaalsContact O-N 3.17Å; E143-G146 WeakPolarHBondContact O-CA 3.24Å; E143-G146 PolarHBondContact O-N 3.36Å
144	R	97.4	Very high	96.1	Very high	189 Å²	189	61.3 Å²	61.3	71%	0.713	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-18.3	172.2	-74.6	-172.9	-57.4	-87.2	2.5	114.1	G140	G140-R144 VanDerWaalsContact C-NH1 3.32Å; G140-R144 VanDerWaalsContact O-CB 3.3Å; G140-R144 WeakPolarHBondContact O-CB 3.24Å; G140-R144 VanDerWaalsContact O-CG 3.24Å; G140-R144 WeakPolarHBondContact O-CG 3.39Å; G140-R144 PolarHBondContact O-N 2.97Å; G140-R144 PolarHBondContact O-NE 3.37Å; G140-R144 PolarHBondContact O-NH1 2.92Å
145	R	95.9	Very high	95.9	Very high	123 Å²	123	62.7 Å²	62.7	46%	0.464	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	4.8	172.2	-70.2	176.2	161.3	-77.1	5.2	112.8	Y141 C142 E143 W147 D489	Y141-R145 WeakPolarHBondContact O-CG 3.24Å; Y141-R145 PolarHBondContact O-N 3.33Å; Y141-R145 PolarHBondContact OH-NE 3.06Å; Y141-R145 PolarHBondContact OH-NH2 2.81Å; C142-R145 CarbonylContact O-C 3.6Å; C142-R145 WeakPolarHBondContact O-CA 3.46Å; C142-R145 WeakPolarHBondContact O-CB 3.13Å; C142-R145 PolarHBondContact O-N 3.12Å; E143-R145 PolarHBondContact O-N 3.43Å; E143-R145 VanDerWaalsContact O-N 3.17Å; R145-W147 HydrophobicContact CB-CG 4.34Å; R145-D489 IonicContact CZ-OD1 3.68Å; R145-D489 IonicContact NE-OD1 2.69Å; R145-D489 IonicContact NH2-OD1 3.6Å; R145-D489 PolarHBondContact NH2-OD1 2.99Å
146	G	95.9	Very high	95.7	Very high	56 Å²	56	64 Å²	64	58%	0.577	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	16.9	-177.7	0	0	0	0	0	114.5	C142 E143	C142-G146 PolarHBondContact O-N 2.71Å; E143-G146 WeakPolarHBondContact O-CA 3.24Å; E143-G146 PolarHBondContact O-N 3.36Å
147	W	97	Very high	95.5	Very high	33 Å²	33	61.8 Å²	61.8	13%	0.125	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-85.5	138.6	-176.5	-62.8	19.4	0	0	0	110.8	P125 Y127 C142 R145 R159 L160 L492	P125-W147 HydrophobicContact CB-CD2 4.11Å; P125-W147 HydrophobicContact CB-CG 4.18Å; P125-W147 HydrophobicContact CG-CB 4.37Å; P125-W147 HydrophobicContact CG-CD2 3.97Å; P125-W147 HydrophobicContact CG-CG 3.65Å; P125-W147 WeakPolarHBondContact O-CA 3.3Å; Y127-W147 HydrophobicContact CD1-CB 3.88Å; Y127-W147 HydrophobicContact CE1-CB 4.38Å; C142-W147 HydrophobicContact CB-CB 4.05Å; C142-W147 HydrophobicContact CB-CE3 4.32Å; C142-W147 VanDerWaalsContact O-CB 3.28Å; C142-W147 WeakPolarHBondContact O-CB 3.43Å; C142-W147 PolarHBondContact O-N 2.93Å; R145-W147 HydrophobicContact CB-CG 4.34Å; W147-R159 HydrophobicContact CH2-CB 4.01Å; W147-R159 HydrophobicContact CH2-CG 3.46Å; W147-R159 VanDerWaalsContact CH2-CG 3.46Å; W147-R159 HydrophobicContact CZ2-CG 4.08Å; W147-R159 HydrophobicContact CZ3-CB 3.98Å; W147-R159 HydrophobicContact CZ3-CG 3.93Å; W147-L160 HydrophobicContact CZ3-CB 3.8Å; W147-L160 HydrophobicContact CZ3-CD2 4.49Å; W147-L492 HydrophobicContact CH2-CD1 4.13Å; W147-L492 HydrophobicContact CH2-CD2 3.58Å; W147-L492 HydrophobicContact CZ2-CD1 4.35Å; W147-L492 HydrophobicContact CZ2-CD2 4.12Å
148	K	96.3	Very high	95.4	Very high	83 Å²	83	61.6 Å²	61.6	36%	0.361	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	127.1	-176.2	-66.8	167.1	178.7	175.5	0	111.1	P120 R121 L123 P125 F126 Y127	P120-K148 HydrophobicContact CB-CB 4.22Å; P120-K148 HydrophobicContact CB-CD 4.31Å; P120-K148 HydrophobicContact CG-CB 4.03Å; R121-K148 PolarHBondContact O-NZ 2.73Å; L123-K148 PolarHBondContact O-NZ 3.11Å; P125-K148 PolarHBondContact O-N 2.94Å; F126-K148 CarbonylContact C-O 3.56Å; F126-K148 VanDerWaalsContact CA-O 3.28Å; F126-K148 WeakPolarHBondContact CA-O 3.48Å; F126-K148 HydrophobicContact CD1-CB 3.57Å; F126-K148 HydrophobicContact CD1-CD 4.31Å; F126-K148 HydrophobicContact CE1-CB 3.73Å; F126-K148 HydrophobicContact CE1-CD 3.65Å; F126-K148 HydrophobicContact CE1-CG 4.35Å; F126-K148 HydrophobicContact CZ-CD 4.25Å; Y127-K148 WeakPolarHBondContact CD1-O 3.27Å; Y127-K148 PolarHBondContact N-O 3.1Å
149	R	96.1	Very high	95.3	Very high	70 Å²	70	63 Å²	63	26%	0.264	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	137.3	177.3	-168.5	173.8	177.6	172.8	1	111.6	P120 Y127 F129 Y151	P120-R149 WeakPolarHBondContact CD-O 3.12Å; P120-R149 WeakPolarHBondContact CG-O 3.4Å; Y127-R149 HydrophobicContact CE1-CB 3.72Å; Y127-R149 HydrophobicContact CE1-CG 4.3Å; Y127-R149 HydrophobicContact CE2-CB 4.38Å; Y127-R149 HydrophobicContact CE2-CG 4.07Å; Y127-R149 CarbonylContact O-C 3.6Å; Y127-R149 WeakPolarHBondContact O-CA 3.23Å; F129-R149 PolarHBondContact O-NH2 2.97Å; R149-Y151 HydrophobicContact CG-CE2 4.31Å
150	I	95.8	Very high	95.3	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	146.7	173	79.9	-168.2	0	0	0	109.2	P120 F126 Y127 F128 R155 F158	P120-I150 HydrophobicContact CG-CG2 4.36Å; F126-I150 HydrophobicContact CB-CG2 3.84Å; F126-I150 HydrophobicContact CD1-CG2 3.63Å; F126-I150 HydrophobicContact CG-CG2 4.03Å; Y127-I150 PolarHBondContact O-N 3.2Å; F128-I150 HydrophobicContact CB-CD1 4.18Å; F128-I150 HydrophobicContact CB-CG1 3.75Å; F128-I150 HydrophobicContact CD2-CG1 4.34Å; F128-I150 WeakPolarHBondContact CD2-O 3.48Å; I150-R155 HydrophobicContact CD1-CB 3.73Å; I150-F158 HydrophobicContact CD1-CB 3.96Å
151	Y	93.9	Very high	95.3	Very high	117 Å²	117	62.9 Å²	62.9	46%	0.459	29%	0.285	S	S	.	.			trans	-112.4	-26.5	-174.8	-57.5	-96.5	0	0	0	111	T117 E119 F128 R149 K153	T117-Y151 HydrophobicContact CG2-CD2 4.25Å; T117-Y151 HydrophobicContact CG2-CE2 3.67Å; E119-Y151 WeakPolarHBondContact OE1-CA 3.45Å; E119-Y151 PolarHBondContact OE1-N 3.13Å; F128-Y151 WeakPolarHBondContact CE2-O 3.42Å; R149-Y151 HydrophobicContact CG-CE2 4.31Å; Y151-K153 PolarHBondContact O-N 3.07Å
152	N	92.1	Very high	95.2	Very high	70 Å²	70	62.2 Å²	62.2	37%	0.374	28%	0.283	S	S	.	.			trans	-68.4	96.4	170.1	-176.5	-28.7	0	0	0	110.9	E119 Q154 R155	E119-N152 HydrophobicContact CG-CB 4.38Å; E119-N152 WeakPolarHBondContact OE1-CB 3.2Å; E119-N152 PolarHBondContact OE1-N 3.09Å; N152-Q154 PolarHBondContact O-N 3.04Å; N152-Q154 VanDerWaalsContact O-N 3.07Å; N152-Q154 WeakPolarHBondContact OD1-CA 3.47Å; N152-Q154 WeakPolarHBondContact OD1-CB 3.24Å; N152-Q154 PolarHBondContact OD1-N 3.35Å; N152-Q154 PolarHBondContact OD1-OE1 3.4Å; N152-R155 HydrophobicContact CB-CG 4.16Å; N152-R155 WeakPolarHBondContact O-CB 3.38Å; N152-R155 PolarHBondContact O-N 2.86Å; N152-R155 VanDerWaalsContact O-N 3.07Å; N152-R155 PolarHBondContact OD1-N 2.77Å
153	K	90.8	Very high	95.2	Very high	106 Å²	106	62.2 Å²	62.2	46%	0.461	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-17.9	178.5	66	-177.3	175.8	-172.4	0	114.1	F128 Y151 K161	F128-K153 HydrophobicContact CD2-CB 4.28Å; F128-K153 HydrophobicContact CE1-CB 4.39Å; F128-K153 HydrophobicContact CE2-CB 3.62Å; F128-K153 HydrophobicContact CZ-CB 3.69Å; Y151-K153 PolarHBondContact O-N 3.07Å; K153-K161 PolarHBondContact O-NZ 3.37Å
154	Q	91.4	Very high	95	Very high	124 Å²	124	59.9 Å²	59.9	58%	0.579	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-12.1	177.9	-63.1	85	-21.3	0	0	113.7	N152	N152-Q154 PolarHBondContact O-N 3.04Å; N152-Q154 VanDerWaalsContact O-N 3.07Å; N152-Q154 WeakPolarHBondContact OD1-CA 3.47Å; N152-Q154 WeakPolarHBondContact OD1-CB 3.24Å; N152-Q154 PolarHBondContact OD1-N 3.35Å; N152-Q154 PolarHBondContact OD1-OE1 3.4Å
155	R	91.7	Very high	94.8	Very high	38 Å²	38	54.2 Å²	54.2	14%	0.143	26%	0.258	C	S	.	.			trans	-57.4	144.6	172.3	-87.1	178.9	74.3	165.6	4.2	112.1	E119 P120 F126 I150 N152 D157 F158 K161	E119-R155 WeakPolarHBondContact OE2-CD 3.45Å; E119-R155 IonicContact OE2-CZ 3.69Å; E119-R155 IonicContact OE2-NE 3.45Å; E119-R155 IonicContact OE2-NH1 3.22Å; E119-R155 PolarHBondContact OE2-NH1 3.14Å; P120-R155 PolarHBondContact O-NH1 3.32Å; P120-R155 PolarHBondContact O-NH2 2.95Å; F126-R155 VanDerWaalsContact CZ-NH2 3.34Å; I150-R155 HydrophobicContact CD1-CB 3.73Å; N152-R155 HydrophobicContact CB-CG 4.16Å; N152-R155 WeakPolarHBondContact O-CB 3.38Å; N152-R155 PolarHBondContact O-N 2.86Å; N152-R155 VanDerWaalsContact O-N 3.07Å; N152-R155 PolarHBondContact OD1-N 2.77Å; R155-D157 WeakPolarHBondContact CB-OD1 3.41Å; R155-D157 IonicContact CZ-OD1 2.97Å; R155-D157 IonicContact CZ-OD2 3.56Å; R155-D157 IonicContact NE-OD1 3.38Å; R155-D157 PolarHBondContact NE-OD1 3.19Å; R155-D157 IonicContact NE-OD2 2.88Å; R155-D157 PolarHBondContact NE-OD2 3.24Å; R155-D157 IonicContact NH2-OD1 3.58Å; R155-D157 IonicContact NH2-OD2 2.91Å; R155-D157 PolarHBondContact NH2-OD2 3.13Å; R155-F158 VanDerWaalsContact O-CD1 3.3Å; R155-F158 WeakPolarHBondContact O-CD1 3.27Å; R155-K161 PolarHBondContact O-NZ 3.41Å
156	E	92.3	Very high	94.6	Very high	56 Å²	56	50.2 Å²	50.2	26%	0.262	24%	0.244	S	C	.	.	S	Bend	trans	-117.5	1.3	-175.9	-67.3	-173.2	179.8	0	0	114.2	R173 K175 H179	E156-R173 IonicContact OE1-CZ 3.63Å; E156-R173 IonicContact OE1-NE 3.75Å; E156-R173 PolarHBondContact OE1-NE 3.36Å; E156-R173 IonicContact OE1-NH2 2.7Å; E156-R173 PolarHBondContact OE1-NH2 3.01Å; E156-K175 WeakPolarHBondContact OE2-CE 3.49Å; E156-K175 IonicContact OE2-NZ 3.56Å; E156-K175 PolarHBondContact OE2-NZ 3.45Å; E156-H179 PolarHBondContact O-NE2 3.38Å
157	D	93.6	Very high	94.4	Very high	83 Å²	83	52.5 Å²	52.5	44%	0.444	25%	0.251	S	S	.	.			trans	-98.4	11.1	-177.4	61.2	-39.7	0	0	0	113.2	F126 R155	F126-D157 WeakPolarHBondContact CD2-OD2 3.24Å; R155-D157 WeakPolarHBondContact CB-OD1 3.41Å; R155-D157 IonicContact CZ-OD1 2.97Å; R155-D157 IonicContact CZ-OD2 3.56Å; R155-D157 IonicContact NE-OD1 3.38Å; R155-D157 PolarHBondContact NE-OD1 3.19Å; R155-D157 IonicContact NE-OD2 2.88Å; R155-D157 PolarHBondContact NE-OD2 3.24Å; R155-D157 IonicContact NH2-OD1 3.58Å; R155-D157 IonicContact NH2-OD2 2.91Å; R155-D157 PolarHBondContact NH2-OD2 3.13Å
158	F	95.1	Very high	94.2	Very high	14 Å²	14	53.1 Å²	53.1	6%	0.061	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	146	173.7	66.7	-83.7	0	0	0	112.6	F126 I150 R155 K161 H179 V181	F126-F158 CarbonylContact O-C 3.6Å; I150-F158 HydrophobicContact CD1-CB 3.96Å; R155-F158 VanDerWaalsContact O-CD1 3.3Å; R155-F158 WeakPolarHBondContact O-CD1 3.27Å; F158-K161 HydrophobicContact CD1-CD 4.04Å; F158-K161 VanDerWaalsContact CD1-CE 3.4Å; F158-K161 HydrophobicContact CD1-CG 4.46Å; F158-K161 HydrophobicContact CD2-CB 4.06Å; F158-K161 HydrophobicContact CD2-CD 4.03Å; F158-K161 HydrophobicContact CD2-CG 3.72Å; F158-K161 HydrophobicContact CE1-CD 3.75Å; F158-K161 VanDerWaalsContact CE1-CE 3.46Å; F158-K161 HydrophobicContact CE1-CG 4.49Å; F158-K161 VanDerWaalsContact CE1-NZ 3.33Å; F158-K161 HydrophobicContact CE2-CB 3.84Å; F158-K161 HydrophobicContact CE2-CD 3.72Å; F158-K161 HydrophobicContact CE2-CG 3.74Å; F158-K161 HydrophobicContact CG-CD 4.18Å; F158-K161 HydrophobicContact CG-CG 4.09Å; F158-K161 HydrophobicContact CZ-CD 3.58Å; F158-K161 HydrophobicContact CZ-CG 4.14Å; F158-H179 AromaticContact CD1-NE2 3.99Å; F158-H179 HydrophobicContact CD2-CB 4.5Å; F158-H179 AromaticContact CE1-CD2 3.92Å; F158-H179 AromaticContact CE1-CE1 3.46Å; F158-H179 VanDerWaalsContact CE1-CE1 3.46Å; F158-H179 WeakPolarHBondContact CE1-CE1 3.32Å; F158-H179 AromaticContact CE1-ND1 3.8Å; F158-H179 AromaticContact CE1-NE2 3.55Å; F158-H179 HydrophobicContact CE2-CB 3.68Å; F158-H179 AromaticContact CE2-CD2 3.8Å; F158-H179 AromaticContact CE2-CG 3.56Å; F158-H179 AromaticContact CE2-ND1 3.94Å; F158-H179 HydrophobicContact CZ-CB 3.95Å; F158-H179 AromaticContact CZ-CD2 3.67Å; F158-H179 AromaticContact CZ-CE1 3.46Å; F158-H179 VanDerWaalsContact CZ-CE1 3.46Å; F158-H179 WeakPolarHBondContact CZ-CE1 3.48Å; F158-H179 AromaticContact CZ-CG 3.39Å; F158-H179 AromaticContact CZ-ND1 3.27Å; F158-H179 VanDerWaalsContact CZ-ND1 3.27Å; F158-H179 WeakPolarHBondContact CZ-ND1 3.26Å; F158-H179 AromaticContact CZ-NE2 3.7Å; F158-H179 PolarHBondContact O-CD2 2.97Å; F158-H179 VanDerWaalsContact O-CD2 3.24Å; F158-V181 HydrophobicContact CE2-CG2 4.33Å
159	R	96.3	Very high	94	Very high	30 Å²	30	49.8 Å²	49.8	11%	0.113	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-36.4	164.9	-172.7	56.9	169.4	169	1.8	111.4	P125 F126 W147 G177 R178 L180 F495 N496	P125-R159 HydrophobicContact CB-CB 4.08Å; F126-R159 PolarHBondContact O-N 2.68Å; W147-R159 HydrophobicContact CH2-CB 4.01Å; W147-R159 HydrophobicContact CH2-CG 3.46Å; W147-R159 VanDerWaalsContact CH2-CG 3.46Å; W147-R159 HydrophobicContact CZ2-CG 4.08Å; W147-R159 HydrophobicContact CZ3-CB 3.98Å; W147-R159 HydrophobicContact CZ3-CG 3.93Å; R159-G177 PolarHBondContact NH1-O 2.89Å; R159-R178 WeakPolarHBondContact CD-O 3.39Å; R159-R178 PolarHBondContact NH1-O 2.7Å; R159-L180 WeakPolarHBondContact O-CB 3.22Å; R159-L180 PolarHBondContact O-N 3.44Å; R159-F495 VanDerWaalsContact CZ-CD1 3.5Å; R159-F495 VanDerWaalsContact NH2-CD1 3.33Å; R159-N496 PolarHBondContact NH2-OD1 3.21Å
160	L	97.9	Very high	93.9	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	137.1	178.8	173.8	64	0	0	0	112.1	Y127 F128 W147 L180 F443 L488	Y127-L160 VanDerWaalsContact CA-O 3.3Å; Y127-L160 WeakPolarHBondContact CA-O 3.16Å; F128-L160 PolarHBondContact N-O 3.34Å; W147-L160 HydrophobicContact CZ3-CB 3.8Å; W147-L160 HydrophobicContact CZ3-CD2 4.49Å; L160-L180 CarbonylContact C-O 3.54Å; L160-L180 WeakPolarHBondContact CA-O 3.48Å; L160-L180 HydrophobicContact CB-CB 4.47Å; L160-L180 HydrophobicContact CD1-CB 3.79Å; L160-F443 HydrophobicContact CD1-CE1 3.71Å; L160-F443 HydrophobicContact CD1-CZ 3.89Å; L160-L488 HydrophobicContact CD2-CD2 4.01Å
161	K	97.6	Very high	93.8	Very high	12 Å²	12	52.5 Å²	52.5	5%	0.052	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	112.2	160.1	-96.8	174	-168.5	174.6	0	109.3	F128 K153 R155 F158 L180 V181 F182	F128-K161 HydrophobicContact CB-CG 3.75Å; F128-K161 HydrophobicContact CD1-CG 3.95Å; F128-K161 HydrophobicContact CG-CG 4.2Å; K153-K161 PolarHBondContact O-NZ 3.37Å; R155-K161 PolarHBondContact O-NZ 3.41Å; F158-K161 HydrophobicContact CD1-CD 4.04Å; F158-K161 VanDerWaalsContact CD1-CE 3.4Å; F158-K161 HydrophobicContact CD1-CG 4.46Å; F158-K161 HydrophobicContact CD2-CB 4.06Å; F158-K161 HydrophobicContact CD2-CD 4.03Å; F158-K161 HydrophobicContact CD2-CG 3.72Å; F158-K161 HydrophobicContact CE1-CD 3.75Å; F158-K161 VanDerWaalsContact CE1-CE 3.46Å; F158-K161 HydrophobicContact CE1-CG 4.49Å; F158-K161 VanDerWaalsContact CE1-NZ 3.33Å; F158-K161 HydrophobicContact CE2-CB 3.84Å; F158-K161 HydrophobicContact CE2-CD 3.72Å; F158-K161 HydrophobicContact CE2-CG 3.74Å; F158-K161 HydrophobicContact CG-CD 4.18Å; F158-K161 HydrophobicContact CG-CG 4.09Å; F158-K161 HydrophobicContact CZ-CD 3.58Å; F158-K161 HydrophobicContact CZ-CG 4.14Å; K161-L180 PolarHBondContact N-O 3.29Å; K161-V181 HydrophobicContact CB-CG2 4.38Å; K161-F182 PolarHBondContact O-N 2.65Å
162	W	97.9	Very high	93.8	Very high	2 Å²	2	52 Å²	52	1%	0.008	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	114.6	169.5	-170.5	-70.3	0	0	0	108.9	F128 F129 G130 V138 F182 F443 L469 V484 L488	F128-W162 PolarHBondContact O-N 2.77Å; F129-W162 WeakPolarHBondContact CA-O 3.48Å; F129-W162 HydrophobicContact CD2-CB 3.94Å; F129-W162 AromaticContact CD2-CD1 3.71Å; F129-W162 AromaticContact CD2-CG 4Å; F129-W162 HydrophobicContact CD2-CG 4Å; F129-W162 HydrophobicContact CE2-CB 4.3Å; F129-W162 AromaticContact CE2-CD1 3.18Å; F129-W162 AromaticContact CE2-CG 3.85Å; F129-W162 HydrophobicContact CE2-CG 3.85Å; F129-W162 AromaticContact CE2-NE1 3.72Å; F129-W162 AromaticContact CZ-CD1 3.91Å; G130-W162 PolarHBondContact N-O 3.01Å; V138-W162 HydrophobicContact CG1-CB 4Å; V138-W162 HydrophobicContact CG1-CD2 3.96Å; V138-W162 HydrophobicContact CG1-CE3 4.1Å; V138-W162 HydrophobicContact CG1-CG 3.92Å; V138-W162 HydrophobicContact CG2-CD2 3.94Å; V138-W162 HydrophobicContact CG2-CE3 4.27Å; V138-W162 HydrophobicContact CG2-CG 4.38Å; V138-W162 HydrophobicContact CG2-CH2 4.39Å; V138-W162 HydrophobicContact CG2-CZ2 4.07Å; V138-W162 HydrophobicContact CG2-CZ3 4.48Å; W162-F182 HydrophobicContact CB-CB 4.42Å; W162-F182 AromaticContact CD1-CD1 3.89Å; W162-F182 HydrophobicContact CD2-CB 3.98Å; W162-F182 AromaticContact CD2-CD1 3.71Å; W162-F182 HydrophobicContact CD2-CD1 3.71Å; W162-F182 HydrophobicContact CD2-CD2 4.31Å; W162-F182 HydrophobicContact CD2-CE1 4.28Å; W162-F182 AromaticContact CD2-CG 3.74Å; W162-F182 HydrophobicContact CD2-CG 3.74Å; W162-F182 AromaticContact CE2-CD1 3.49Å; W162-F182 VanDerWaalsContact CE2-CD1 3.49Å; W162-F182 AromaticContact CE2-CE1 3.58Å; W162-F182 AromaticContact CE2-CG 3.89Å; W162-F182 HydrophobicContact CE3-CB 3.99Å; W162-F182 HydrophobicContact CE3-CD1 4.32Å; W162-F182 HydrophobicContact CE3-CD2 4.11Å; W162-F182 AromaticContact CE3-CG 3.88Å; W162-F182 HydrophobicContact CE3-CG 3.88Å; W162-F182 HydrophobicContact CG-CB 4.18Å; W162-F182 AromaticContact CG-CD1 3.98Å; W162-F182 HydrophobicContact CG-CD1 3.98Å; W162-F182 HydrophobicContact CG-CG 4.24Å; W162-F182 AromaticContact CH2-CD2 3.96Å; W162-F182 HydrophobicContact CH2-CD2 3.96Å; W162-F182 HydrophobicContact CH2-CE1 4.4Å; W162-F182 AromaticContact CH2-CE2 3.8Å; W162-F182 HydrophobicContact CH2-CE2 3.8Å; W162-F182 HydrophobicContact CH2-CG 4.33Å; W162-F182 HydrophobicContact CH2-CZ 4.04Å; W162-F182 AromaticContact CZ2-CD1 3.95Å; W162-F182 HydrophobicContact CZ2-CD1 3.95Å; W162-F182 HydrophobicContact CZ2-CD2 4.15Å; W162-F182 AromaticContact CZ2-CE1 3.66Å; W162-F182 HydrophobicContact CZ2-CE1 3.66Å; W162-F182 AromaticContact CZ2-CE2 3.87Å; W162-F182 HydrophobicContact CZ2-CE2 3.87Å; W162-F182 HydrophobicContact CZ2-CG 4.2Å; W162-F182 AromaticContact CZ2-CZ 3.62Å; W162-F182 HydrophobicContact CZ2-CZ 3.62Å; W162-F182 AromaticContact CZ3-CD2 3.93Å; W162-F182 HydrophobicContact CZ3-CD2 3.93Å; W162-F182 HydrophobicContact CZ3-CE2 4.24Å; W162-F182 HydrophobicContact CZ3-CG 4.18Å; W162-F182 AromaticContact NE1-CD1 3.6Å; W162-F182 AromaticContact NE1-CE1 3.68Å; W162-F443 HydrophobicContact CE3-CE2 4.25Å; W162-F443 AromaticContact CE3-CZ 3.92Å; W162-F443 HydrophobicContact CE3-CZ 3.92Å; W162-F443 AromaticContact CZ3-CE2 3.8Å; W162-F443 HydrophobicContact CZ3-CE2 3.8Å; W162-F443 AromaticContact CZ3-CZ 3.94Å; W162-F443 HydrophobicContact CZ3-CZ 3.94Å; W162-L469 HydrophobicContact CZ2-CD1 4.31Å; W162-V484 HydrophobicContact CH2-CG1 4.32Å; W162-L488 HydrophobicContact CE3-CD2 3.88Å; W162-L488 HydrophobicContact CZ3-CD1 4.24Å; W162-L488 HydrophobicContact CZ3-CD2 3.65Å; W162-L488 HydrophobicContact CZ3-CG 3.94Å
163	C	96.3	Very high	93.8	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	135.5	-178.8	-57.5	0	0	0	0	110.6	G130 Q168 I169 F182 Q183	G130-C163 WeakPolarHBondContact O-CA 3.35Å; C163-Q168 HydrophobicContact CB-CB 4.12Å; C163-I169 HydrophobicContact CB-CD1 3.78Å; C163-I169 HydrophobicContact CB-CG1 3.77Å; C163-I169 WeakPolarHBondContact SG-CG1 3.3Å; C163-F182 WeakPolarHBondContact O-CD1 3.45Å; C163-Q183 PolarHBondContact O-NE2 3.45Å
164	E	94.3	Very high	94	Very high	50 Å²	50	51.2 Å²	51.2	23%	0.234	26%	0.262	C	S	.	.	S	Bend	trans	-65.4	-39.3	169.5	167.5	140.6	-140.5	0	0	111.5	G130 G131 T132 N133 Q183 N466	G130-E164 PolarHBondContact O-N 3Å; G131-E164 WeakPolarHBondContact CA-OE2 3.5Å; T132-E164 PolarHBondContact N-OE2 2.74Å; N133-E164 VanDerWaalsContact CB-OE1 3.31Å; N133-E164 WeakPolarHBondContact CB-OE1 3.31Å; N133-E164 WeakPolarHBondContact CB-OE2 3.44Å; N133-E164 PolarHBondContact N-OE2 3.4Å; E164-Q183 PolarHBondContact O-NE2 3.16Å; E164-N466 WeakPolarHBondContact CG-ND2 3.49Å; E164-N466 PolarHBondContact OE1-ND2 3.23Å
165	T	92.4	Very high	94.2	Very high	69 Å²	69	49 Å²	49	42%	0.423	25%	0.25	S	S	.	.	S	Bend	trans	-115.1	128.4	179.5	-19	0	0	0	0	111.4	S167 Q168	T165-S167 WeakPolarHBondContact CG2-OG 3.5Å; T165-S167 PolarHBondContact O-N 3.2Å; T165-S167 VanDerWaalsContact O-N 3.15Å; T165-Q168 WeakPolarHBondContact O-CB 3.49Å; T165-Q168 PolarHBondContact O-N 3.1Å; T165-Q168 PolarHBondContact OG1-NE2 3.4Å; T165-Q168 VanDerWaalsContact OG1-NE2 3.09Å
166	K	92.8	Very high	94.2	Very high	40 Å²	40	52.5 Å²	52.5	17%	0.174	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-60.7	-24.6	179.1	-64.1	-171.4	-66.5	179.6	0	114.3	Q168 I169 Y171 Q183 P185 N187 M188	K166-Q168 PolarHBondContact O-N 2.95Å; K166-I169 PolarHBondContact O-N 3.47Å; K166-Y171 HydrophobicContact CB-CE2 4.2Å; K166-Y171 WeakPolarHBondContact CG-OH 3.45Å; K166-Q183 HydrophobicContact CD-CB 4.03Å; K166-Q183 HydrophobicContact CG-CB 3.93Å; K166-Q183 HydrophobicContact CG-CG 4.48Å; K166-Q183 VanDerWaalsContact CG-OE1 3.24Å; K166-P185 PolarHBondContact NZ-O 2.91Å; K166-N187 PolarHBondContact NZ-OD1 3.13Å; K166-M188 PolarHBondContact NZ-SD 3.15Å
167	S	91.4	Very high	94.1	Very high	104 Å²	104	50.9 Å²	50.9	73%	0.727	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-62.9	-18.6	173.5	52.5	0	0	0	0	113.9	T165 I169	T165-S167 WeakPolarHBondContact CG2-OG 3.5Å; T165-S167 PolarHBondContact O-N 3.2Å; T165-S167 VanDerWaalsContact O-N 3.15Å; S167-I169 VanDerWaalsContact C-N 3.28Å
168	Q	91.6	Very high	94.1	Very high	45 Å²	45	55.3 Å²	55.3	21%	0.21	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-80.3	-10.6	174.3	-54.2	-175.2	49.3	0	0	112.5	G130 C163 T165 K166	G130-Q168 VanDerWaalsContact CA-OE1 3.26Å; C163-Q168 HydrophobicContact CB-CB 4.12Å; T165-Q168 WeakPolarHBondContact O-CB 3.49Å; T165-Q168 PolarHBondContact O-N 3.1Å; T165-Q168 PolarHBondContact OG1-NE2 3.4Å; T165-Q168 VanDerWaalsContact OG1-NE2 3.09Å; K166-Q168 PolarHBondContact O-N 2.95Å
169	I	92.4	Very high	94.1	Very high	13 Å²	13	54.8 Å²	54.8	7%	0.067	28%	0.275	C	S	.	.			trans	-104.7	120.2	-177.8	-59.8	160.8	0	0	0	109.8	C163 K166 S167 Y171 V181 F182	C163-I169 HydrophobicContact CB-CD1 3.78Å; C163-I169 HydrophobicContact CB-CG1 3.77Å; C163-I169 WeakPolarHBondContact SG-CG1 3.3Å; K166-I169 PolarHBondContact O-N 3.47Å; S167-I169 VanDerWaalsContact C-N 3.28Å; I169-Y171 HydrophobicContact CB-CD2 4.14Å; I169-Y171 HydrophobicContact CB-CE1 4.35Å; I169-Y171 HydrophobicContact CB-CE2 3.67Å; I169-Y171 HydrophobicContact CD1-CE1 4.49Å; I169-Y171 HydrophobicContact CD1-CE2 4.48Å; I169-Y171 WeakPolarHBondContact CD1-OH 3.39Å; I169-Y171 HydrophobicContact CG2-CD1 3.78Å; I169-Y171 HydrophobicContact CG2-CD2 3.86Å; I169-Y171 HydrophobicContact CG2-CE1 3.65Å; I169-Y171 HydrophobicContact CG2-CE2 3.72Å; I169-Y171 HydrophobicContact CG2-CG 3.9Å; I169-Y171 VanDerWaalsContact O-CD2 3.31Å; I169-Y171 WeakPolarHBondContact O-CD2 3.42Å; I169-Y171 PolarHBondContact O-N 3.27Å; I169-V181 HydrophobicContact CD1-CG1 3.74Å; I169-V181 HydrophobicContact CG1-CG1 4.37Å; I169-V181 HydrophobicContact CG2-CG1 3.77Å; I169-V181 HydrophobicContact CG2-CG2 4.38Å; I169-F182 VanDerWaalsContact CD1-O 3.26Å; I169-F182 WeakPolarHBondContact CD1-O 3.47Å
170	N	93.4	Very high	94.2	Very high	87 Å²	87	53.5 Å²	53.5	47%	0.465	27%	0.27	S	S	.	.			trans	-87.5	84.8	172.4	-167.4	-26.5	0	0	0	111.1	S172 R173	N170-S172 PolarHBondContact O-N 3.21Å; N170-S172 PolarHBondContact OD1-N 3.42Å; N170-S172 PolarHBondContact OD1-OG 2.74Å; N170-R173 WeakPolarHBondContact ND2-CD 3.26Å; N170-R173 PolarHBondContact O-N 2.98Å; N170-R173 VanDerWaalsContact O-N 3.1Å
171	Y	94.6	Very high	94.2	Very high	40 Å²	40	53.5 Å²	53.5	16%	0.157	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-63.9	-18.1	-177.4	-63.4	-85.7	0	0	0	115	K166 I169 R173 F174 V181 Q183 P185 F442	K166-Y171 HydrophobicContact CB-CE2 4.2Å; K166-Y171 WeakPolarHBondContact CG-OH 3.45Å; I169-Y171 HydrophobicContact CB-CD2 4.14Å; I169-Y171 HydrophobicContact CB-CE1 4.35Å; I169-Y171 HydrophobicContact CB-CE2 3.67Å; I169-Y171 HydrophobicContact CD1-CE1 4.49Å; I169-Y171 HydrophobicContact CD1-CE2 4.48Å; I169-Y171 WeakPolarHBondContact CD1-OH 3.39Å; I169-Y171 HydrophobicContact CG2-CD1 3.78Å; I169-Y171 HydrophobicContact CG2-CD2 3.86Å; I169-Y171 HydrophobicContact CG2-CE1 3.65Å; I169-Y171 HydrophobicContact CG2-CE2 3.72Å; I169-Y171 HydrophobicContact CG2-CG 3.9Å; I169-Y171 VanDerWaalsContact O-CD2 3.31Å; I169-Y171 WeakPolarHBondContact O-CD2 3.42Å; I169-Y171 PolarHBondContact O-N 3.27Å; Y171-R173 VanDerWaalsContact C-N 3.33Å; Y171-F174 WeakPolarHBondContact O-CB 3.39Å; Y171-V181 HydrophobicContact CD1-CG1 4.46Å; Y171-V181 HydrophobicContact CE1-CG1 3.76Å; Y171-Q183 PolarHBondContact OH-O 3.1Å; Y171-P185 HydrophobicContact CD1-CB 3.79Å; Y171-P185 HydrophobicContact CD1-CG 3.56Å; Y171-P185 HydrophobicContact CD2-CB 4.13Å; Y171-P185 HydrophobicContact CE1-CB 3.71Å; Y171-P185 HydrophobicContact CE1-CG 3.63Å; Y171-P185 HydrophobicContact CE2-CB 4.07Å; Y171-P185 HydrophobicContact CG-CB 3.98Å; Y171-P185 HydrophobicContact CG-CG 4.15Å; Y171-F442 AromaticContact CD1-CE1 3.95Å; Y171-F442 HydrophobicContact CD1-CE1 3.95Å; Y171-F442 AromaticContact CD1-CZ 3.86Å; Y171-F442 HydrophobicContact CD1-CZ 3.86Å; Y171-F442 HydrophobicContact CE1-CE1 4.35Å; Y171-F442 HydrophobicContact CE1-CZ 4.47Å
172	S	93.3	Very high	94.2	Very high	108 Å²	108	53 Å²	53	76%	0.755	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-77.9	-20.1	174.6	69.7	0	0	0	0	112.7	N170	N170-S172 PolarHBondContact O-N 3.21Å; N170-S172 PolarHBondContact OD1-N 3.42Å; N170-S172 PolarHBondContact OD1-OG 2.74Å
173	R	93.1	Very high	94.2	Very high	139 Å²	139	53.1 Å²	53.1	53%	0.525	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-98.1	9.6	176	-57.4	179.4	73.4	147.7	1.5	113	E156 N170 Y171	E156-R173 IonicContact OE1-CZ 3.63Å; E156-R173 IonicContact OE1-NE 3.75Å; E156-R173 PolarHBondContact OE1-NE 3.36Å; E156-R173 IonicContact OE1-NH2 2.7Å; E156-R173 PolarHBondContact OE1-NH2 3.01Å; N170-R173 WeakPolarHBondContact ND2-CD 3.26Å; N170-R173 PolarHBondContact O-N 2.98Å; N170-R173 VanDerWaalsContact O-N 3.1Å; Y171-R173 VanDerWaalsContact C-N 3.33Å
174	F	95.4	Very high	94.2	Very high	20 Å²	20	53.1 Å²	53.1	9%	0.088	27%	0.269	C	S	.	.			trans	-73	130.3	179.1	174	-104.3	0	0	0	112.6	Y171 Q176 H179 V181 R439 P440 F442	Y171-F174 WeakPolarHBondContact O-CB 3.39Å; F174-Q176 HydrophobicContact CD1-CG 4.22Å; F174-Q176 HydrophobicContact CE1-CB 4.5Å; F174-Q176 HydrophobicContact CE1-CG 3.78Å; F174-H179 HydrophobicContact CD2-CB 3.64Å; F174-H179 AromaticContact CD2-ND1 3.98Å; F174-H179 HydrophobicContact CE2-CB 3.49Å; F174-H179 VanDerWaalsContact CE2-CB 3.49Å; F174-H179 WeakPolarHBondContact CE2-O 3.31Å; F174-H179 HydrophobicContact CZ-CB 4.47Å; F174-V181 HydrophobicContact CD2-CB 4.44Å; F174-V181 HydrophobicContact CD2-CG2 3.56Å; F174-V181 HydrophobicContact CE2-CB 4.18Å; F174-V181 HydrophobicContact CE2-CG2 3.65Å; F174-R439 HydrophobicContact CE1-CB 4.12Å; F174-P440 WeakPolarHBondContact CZ-O 3.45Å; F174-F442 HydrophobicContact CD1-CD1 4.35Å; F174-F442 AromaticContact CD1-CE1 3.51Å; F174-F442 HydrophobicContact CD1-CE1 3.51Å; F174-F442 AromaticContact CD1-CZ 3.88Å; F174-F442 HydrophobicContact CD1-CZ 3.88Å; F174-F442 HydrophobicContact CD2-CD1 4.39Å; F174-F442 AromaticContact CD2-CE1 3.8Å; F174-F442 HydrophobicContact CD2-CE1 3.8Å; F174-F442 AromaticContact CE1-CD1 3.82Å; F174-F442 HydrophobicContact CE1-CD1 3.82Å; F174-F442 AromaticContact CE1-CE1 3.42Å; F174-F442 HydrophobicContact CE1-CE1 3.42Å; F174-F442 VanDerWaalsContact CE1-CE1 3.42Å; F174-F442 AromaticContact CE1-CZ 3.99Å; F174-F442 HydrophobicContact CE1-CZ 3.99Å; F174-F442 AromaticContact CE2-CD1 3.86Å; F174-F442 HydrophobicContact CE2-CD1 3.86Å; F174-F442 AromaticContact CE2-CE1 3.71Å; F174-F442 HydrophobicContact CE2-CE1 3.71Å; F174-F442 AromaticContact CG-CE1 3.68Å; F174-F442 HydrophobicContact CG-CE1 3.68Å; F174-F442 HydrophobicContact CG-CZ 4.3Å; F174-F442 AromaticContact CZ-CD1 3.55Å; F174-F442 HydrophobicContact CZ-CD1 3.55Å; F174-F442 AromaticContact CZ-CE1 3.53Å; F174-F442 HydrophobicContact CZ-CE1 3.53Å
175	K	95.2	Very high	94.3	Very high	78 Å²	78	52.2 Å²	52.2	34%	0.339	27%	0.267	S	S	.	.			trans	-111.5	100.7	-176.8	-60.6	178.1	-173.4	175.2	0	110.2	E156 R178 H179	E156-K175 WeakPolarHBondContact OE2-CE 3.49Å; E156-K175 IonicContact OE2-NZ 3.56Å; E156-K175 PolarHBondContact OE2-NZ 3.45Å; K175-R178 HydrophobicContact CB-CB 4.2Å; K175-R178 PolarHBondContact O-N 3.01Å; K175-R178 VanDerWaalsContact O-N 3.14Å; K175-H179 PolarHBondContact N-ND1 3.24Å; K175-H179 PolarHBondContact O-N 3.44Å
176	Q	92.3	Very high	94.5	Very high	110 Å²	110	51 Å²	51	51%	0.514	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	142.1	177.7	-63.1	178.9	35	0	0	111.6	F174 R178 R439	F174-Q176 HydrophobicContact CD1-CG 4.22Å; F174-Q176 HydrophobicContact CE1-CB 4.5Å; F174-Q176 HydrophobicContact CE1-CG 3.78Å; Q176-R178 PolarHBondContact O-N 2.85Å; Q176-R439 HydrophobicContact CG-CB 4.4Å
177	G	88.8	Confident	94.7	Very high	23 Å²	23	49.1 Å²	49.1	24%	0.237	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	-17.3	-178.1	0	0	0	0	0	115.9	R159 P440 F495 R499	R159-G177 PolarHBondContact NH1-O 2.89Å; G177-P440 PolarHBondContact N-O 3.31Å; G177-F495 VanDerWaalsContact C-CZ 3.42Å; G177-F495 WeakPolarHBondContact O-CZ 3.48Å; G177-R499 WeakPolarHBondContact O-CD 3.06Å
178	R	93.4	Very high	94.9	Very high	176 Å²	176	48.3 Å²	48.3	66%	0.664	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-49.9	173.6	-68.7	-179.7	172.5	153.7	-2.6	111.7	R159 K175 Q176	R159-R178 WeakPolarHBondContact CD-O 3.39Å; R159-R178 PolarHBondContact NH1-O 2.7Å; K175-R178 HydrophobicContact CB-CB 4.2Å; K175-R178 PolarHBondContact O-N 3.01Å; K175-R178 VanDerWaalsContact O-N 3.14Å; Q176-R178 PolarHBondContact O-N 2.85Å
179	H	96.7	Very high	95.1	Very high	3 Å²	3	47.9 Å²	47.9	1%	0.014	24%	0.236	C	C	.	.			trans	-94.8	137.8	-174.3	-62.7	167	0	0	0	113.2	E156 F158 F174 K175 G441 F495	E156-H179 PolarHBondContact O-NE2 3.38Å; F158-H179 AromaticContact CD1-NE2 3.99Å; F158-H179 HydrophobicContact CD2-CB 4.5Å; F158-H179 AromaticContact CE1-CD2 3.92Å; F158-H179 AromaticContact CE1-CE1 3.46Å; F158-H179 VanDerWaalsContact CE1-CE1 3.46Å; F158-H179 WeakPolarHBondContact CE1-CE1 3.32Å; F158-H179 AromaticContact CE1-ND1 3.8Å; F158-H179 AromaticContact CE1-NE2 3.55Å; F158-H179 HydrophobicContact CE2-CB 3.68Å; F158-H179 AromaticContact CE2-CD2 3.8Å; F158-H179 AromaticContact CE2-CG 3.56Å; F158-H179 AromaticContact CE2-ND1 3.94Å; F158-H179 HydrophobicContact CZ-CB 3.95Å; F158-H179 AromaticContact CZ-CD2 3.67Å; F158-H179 AromaticContact CZ-CE1 3.46Å; F158-H179 VanDerWaalsContact CZ-CE1 3.46Å; F158-H179 WeakPolarHBondContact CZ-CE1 3.48Å; F158-H179 AromaticContact CZ-CG 3.39Å; F158-H179 AromaticContact CZ-ND1 3.27Å; F158-H179 VanDerWaalsContact CZ-ND1 3.27Å; F158-H179 WeakPolarHBondContact CZ-ND1 3.26Å; F158-H179 AromaticContact CZ-NE2 3.7Å; F158-H179 PolarHBondContact O-CD2 2.97Å; F158-H179 VanDerWaalsContact O-CD2 3.24Å; F174-H179 HydrophobicContact CD2-CB 3.64Å; F174-H179 AromaticContact CD2-ND1 3.98Å; F174-H179 HydrophobicContact CE2-CB 3.49Å; F174-H179 VanDerWaalsContact CE2-CB 3.49Å; F174-H179 WeakPolarHBondContact CE2-O 3.31Å; F174-H179 HydrophobicContact CZ-CB 4.47Å; K175-H179 PolarHBondContact N-ND1 3.24Å; K175-H179 PolarHBondContact O-N 3.44Å; H179-G441 WeakPolarHBondContact O-CA 3.44Å; H179-F495 WeakPolarHBondContact O-CZ 3.28Å
180	L	97.8	Very high	95.3	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.016	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	141.3	154.7	-82.2	162.1	0	0	0	110.4	R159 L160 K161 G441 F443 T491 L492 F495	R159-L180 WeakPolarHBondContact O-CB 3.22Å; R159-L180 PolarHBondContact O-N 3.44Å; L160-L180 CarbonylContact C-O 3.54Å; L160-L180 WeakPolarHBondContact CA-O 3.48Å; L160-L180 HydrophobicContact CB-CB 4.47Å; L160-L180 HydrophobicContact CD1-CB 3.79Å; K161-L180 PolarHBondContact N-O 3.29Å; L180-G441 CarbonylContact C-O 3.58Å; L180-G441 WeakPolarHBondContact CA-O 3.47Å; L180-F443 HydrophobicContact CB-CE1 4.27Å; L180-F443 HydrophobicContact CD2-CD1 3.92Å; L180-F443 HydrophobicContact CD2-CE1 4.3Å; L180-T491 HydrophobicContact CD1-CG2 4.19Å; L180-T491 HydrophobicContact CD2-CG2 3.55Å; L180-T491 HydrophobicContact CG-CG2 4.5Å; L180-L492 HydrophobicContact CD1-CD2 3.38Å; L180-L492 HydrophobicContact CD1-CG 4.18Å; L180-F495 HydrophobicContact CD1-CB 4.21Å; L180-F495 HydrophobicContact CD1-CD1 3.56Å; L180-F495 HydrophobicContact CD1-CE1 4.14Å; L180-F495 HydrophobicContact CD1-CG 4.14Å; L180-F495 HydrophobicContact CD2-CB 4.09Å; L180-F495 HydrophobicContact CD2-CD1 3.96Å; L180-F495 HydrophobicContact CD2-CD2 4.31Å; L180-F495 HydrophobicContact CD2-CE1 4.36Å; L180-F495 HydrophobicContact CD2-CG 3.9Å; L180-F495 HydrophobicContact CG-CB 4.36Å; L180-F495 HydrophobicContact CG-CD1 3.42Å; L180-F495 VanDerWaalsContact CG-CD1 3.42Å; L180-F495 HydrophobicContact CG-CE1 3.63Å; L180-F495 HydrophobicContact CG-CG 3.91Å; L180-F495 HydrophobicContact CG-CZ 4.32Å
181	V	97.6	Very high	95.4	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	123.5	178.2	168.9	0	0	0	0	109.3	F158 K161 I169 Y171 F174 G441 F442 F443	F158-V181 HydrophobicContact CE2-CG2 4.33Å; K161-V181 HydrophobicContact CB-CG2 4.38Å; I169-V181 HydrophobicContact CD1-CG1 3.74Å; I169-V181 HydrophobicContact CG1-CG1 4.37Å; I169-V181 HydrophobicContact CG2-CG1 3.77Å; I169-V181 HydrophobicContact CG2-CG2 4.38Å; Y171-V181 HydrophobicContact CD1-CG1 4.46Å; Y171-V181 HydrophobicContact CE1-CG1 3.76Å; F174-V181 HydrophobicContact CD2-CB 4.44Å; F174-V181 HydrophobicContact CD2-CG2 3.56Å; F174-V181 HydrophobicContact CE2-CB 4.18Å; F174-V181 HydrophobicContact CE2-CG2 3.65Å; V181-G441 PolarHBondContact N-O 2.88Å; V181-F442 HydrophobicContact CB-CD1 4.16Å; V181-F442 HydrophobicContact CB-CE1 4.47Å; V181-F443 VanDerWaalsContact C-CE1 3.43Å; V181-F443 WeakPolarHBondContact O-CD1 3.46Å; V181-F443 WeakPolarHBondContact O-CE1 3.19Å; V181-F443 PolarHBondContact O-N 3.11Å
182	F	97.9	Very high	95.4	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.009	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	140.2	170.5	-178.4	-124	0	0	0	110.6	K161 W162 C163 I169 F443 L445	K161-F182 PolarHBondContact O-N 2.65Å; W162-F182 HydrophobicContact CB-CB 4.42Å; W162-F182 AromaticContact CD1-CD1 3.89Å; W162-F182 HydrophobicContact CD2-CB 3.98Å; W162-F182 AromaticContact CD2-CD1 3.71Å; W162-F182 HydrophobicContact CD2-CD1 3.71Å; W162-F182 HydrophobicContact CD2-CD2 4.31Å; W162-F182 HydrophobicContact CD2-CE1 4.28Å; W162-F182 AromaticContact CD2-CG 3.74Å; W162-F182 HydrophobicContact CD2-CG 3.74Å; W162-F182 AromaticContact CE2-CD1 3.49Å; W162-F182 VanDerWaalsContact CE2-CD1 3.49Å; W162-F182 AromaticContact CE2-CE1 3.58Å; W162-F182 AromaticContact CE2-CG 3.89Å; W162-F182 HydrophobicContact CE3-CB 3.99Å; W162-F182 HydrophobicContact CE3-CD1 4.32Å; W162-F182 HydrophobicContact CE3-CD2 4.11Å; W162-F182 AromaticContact CE3-CG 3.88Å; W162-F182 HydrophobicContact CE3-CG 3.88Å; W162-F182 HydrophobicContact CG-CB 4.18Å; W162-F182 AromaticContact CG-CD1 3.98Å; W162-F182 HydrophobicContact CG-CD1 3.98Å; W162-F182 HydrophobicContact CG-CG 4.24Å; W162-F182 AromaticContact CH2-CD2 3.96Å; W162-F182 HydrophobicContact CH2-CD2 3.96Å; W162-F182 HydrophobicContact CH2-CE1 4.4Å; W162-F182 AromaticContact CH2-CE2 3.8Å; W162-F182 HydrophobicContact CH2-CE2 3.8Å; W162-F182 HydrophobicContact CH2-CG 4.33Å; W162-F182 HydrophobicContact CH2-CZ 4.04Å; W162-F182 AromaticContact CZ2-CD1 3.95Å; W162-F182 HydrophobicContact CZ2-CD1 3.95Å; W162-F182 HydrophobicContact CZ2-CD2 4.15Å; W162-F182 AromaticContact CZ2-CE1 3.66Å; W162-F182 HydrophobicContact CZ2-CE1 3.66Å; W162-F182 AromaticContact CZ2-CE2 3.87Å; W162-F182 HydrophobicContact CZ2-CE2 3.87Å; W162-F182 HydrophobicContact CZ2-CG 4.2Å; W162-F182 AromaticContact CZ2-CZ 3.62Å; W162-F182 HydrophobicContact CZ2-CZ 3.62Å; W162-F182 AromaticContact CZ3-CD2 3.93Å; W162-F182 HydrophobicContact CZ3-CD2 3.93Å; W162-F182 HydrophobicContact CZ3-CE2 4.24Å; W162-F182 HydrophobicContact CZ3-CG 4.18Å; W162-F182 AromaticContact NE1-CD1 3.6Å; W162-F182 AromaticContact NE1-CE1 3.68Å; C163-F182 WeakPolarHBondContact O-CD1 3.45Å; I169-F182 VanDerWaalsContact CD1-O 3.26Å; I169-F182 WeakPolarHBondContact CD1-O 3.47Å; F182-F443 HydrophobicContact CB-CE1 4.05Å; F182-F443 HydrophobicContact CB-CE2 4.31Å; F182-F443 HydrophobicContact CB-CZ 3.75Å; F182-F443 HydrophobicContact CD2-CD2 4.16Å; F182-F443 AromaticContact CD2-CE2 3.64Å; F182-F443 HydrophobicContact CD2-CE2 3.64Å; F182-F443 AromaticContact CD2-CZ 3.98Å; F182-F443 HydrophobicContact CD2-CZ 3.98Å; F182-F443 HydrophobicContact CE2-CE2 4.49Å; F182-F443 HydrophobicContact CG-CE2 4.41Å; F182-F443 HydrophobicContact CG-CZ 4.31Å; F182-L445 HydrophobicContact CE2-CB 3.77Å; F182-L445 HydrophobicContact CZ-CB 4.28Å
183	Q	96.8	Very high	95.4	Very high	5 Å²	5	39.9 Å²	39.9	2%	0.023	19%	0.188	C	C	.	.	S	Bend	trans	72.9	126.9	-169.9	-49.3	-170.7	44	0	0	113.9	C163 E164 K166 Y171 F443 D444	C163-Q183 PolarHBondContact O-NE2 3.45Å; E164-Q183 PolarHBondContact O-NE2 3.16Å; K166-Q183 HydrophobicContact CD-CB 4.03Å; K166-Q183 HydrophobicContact CG-CB 3.93Å; K166-Q183 HydrophobicContact CG-CG 4.48Å; K166-Q183 VanDerWaalsContact CG-OE1 3.24Å; Y171-Q183 PolarHBondContact OH-O 3.1Å; Q183-F443 PolarHBondContact N-O 3.11Å; Q183-D444 WeakPolarHBondContact CA-OD2 3.15Å
184	I	97.5	Very high	95.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.17	C	C	.	.			trans	-77.6	131.6	172.5	-63.7	158.8	0	0	0	107.9	N186 N187 I335 T338 L436 D437 F442 D444	I184-N186 VanDerWaalsContact C-N 3.29Å; I184-N186 PolarHBondContact O-N 3Å; I184-N186 VanDerWaalsContact O-N 3.12Å; I184-N187 HydrophobicContact CB-CB 4.19Å; I184-N187 VanDerWaalsContact O-CB 3.3Å; I184-N187 WeakPolarHBondContact O-CB 3.13Å; I184-N187 VanDerWaalsContact O-CG 3.23Å; I184-N187 PolarHBondContact O-N 2.99Å; I184-N187 PolarHBondContact O-OD1 3.24Å; I184-I335 HydrophobicContact CD1-CB 4.25Å; I184-I335 HydrophobicContact CD1-CD1 4.01Å; I184-I335 HydrophobicContact CD1-CG2 3.96Å; I184-T338 HydrophobicContact CD1-CG2 3.45Å; I184-T338 VanDerWaalsContact CD1-CG2 3.45Å; I184-T338 HydrophobicContact CG1-CG2 3.8Å; I184-L436 HydrophobicContact CG2-CD2 4.16Å; I184-D437 HydrophobicContact CG2-CB 4.05Å; I184-F442 HydrophobicContact CG1-CB 4.22Å; I184-D444 HydrophobicContact CD1-CB 3.89Å; I184-D444 HydrophobicContact CG1-CB 4.06Å; I184-D444 PolarHBondContact N-OD2 2.97Å
185	P	96.6	Very high	95.4	Very high	31 Å²	31	34.2 Å²	34.2	20%	0.201	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-42.5	-168.4	1.4	-12.2	0	0	0	113.9	K166 Y171 D437 F442	K166-P185 PolarHBondContact NZ-O 2.91Å; Y171-P185 HydrophobicContact CD1-CB 3.79Å; Y171-P185 HydrophobicContact CD1-CG 3.56Å; Y171-P185 HydrophobicContact CD2-CB 4.13Å; Y171-P185 HydrophobicContact CE1-CB 3.71Å; Y171-P185 HydrophobicContact CE1-CG 3.63Å; Y171-P185 HydrophobicContact CE2-CB 4.07Å; Y171-P185 HydrophobicContact CG-CB 3.98Å; Y171-P185 HydrophobicContact CG-CG 4.15Å; P185-D437 HydrophobicContact CG-CB 3.94Å; P185-D437 WeakPolarHBondContact CG-OD2 3.38Å; P185-F442 HydrophobicContact CG-CD2 4.13Å; P185-F442 HydrophobicContact CG-CE2 3.47Å; P185-F442 VanDerWaalsContact CG-CE2 3.47Å; P185-F442 HydrophobicContact CG-CZ 3.79Å
186	N	96.7	Very high	95.5	Very high	43 Å²	43	31.1 Å²	31.1	23%	0.23	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	17.9	179.5	73.5	-3.2	0	0	0	115.6	I184 M188 V189 K435 L436 D437	I184-N186 VanDerWaalsContact C-N 3.29Å; I184-N186 PolarHBondContact O-N 3Å; I184-N186 VanDerWaalsContact O-N 3.12Å; N186-M188 PolarHBondContact O-N 3.2Å; N186-V189 PolarHBondContact O-N 2.86Å; N186-K435 PolarHBondContact ND2-O 3.36Å; N186-L436 WeakPolarHBondContact OD1-CA 3.3Å; N186-D437 WeakPolarHBondContact CB-OD2 3.49Å; N186-D437 PolarHBondContact N-OD2 3.25Å; N186-D437 PolarHBondContact ND2-N 3.16Å; N186-D437 PolarHBondContact ND2-OD2 3.31Å; N186-D437 PolarHBondContact OD1-N 3.34Å
187	N	95.9	Very high	95.7	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-16.5	-177.7	67.6	-1	0	0	0	116.1	K166 I184 V189 L190 T191 D444	K166-N187 PolarHBondContact NZ-OD1 3.13Å; I184-N187 HydrophobicContact CB-CB 4.19Å; I184-N187 VanDerWaalsContact O-CB 3.3Å; I184-N187 WeakPolarHBondContact O-CB 3.13Å; I184-N187 VanDerWaalsContact O-CG 3.23Å; I184-N187 PolarHBondContact O-N 2.99Å; I184-N187 PolarHBondContact O-OD1 3.24Å; N187-V189 PolarHBondContact O-N 2.91Å; N187-L190 WeakPolarHBondContact O-CA 3.37Å; N187-L190 WeakPolarHBondContact O-CB 3.23Å; N187-L190 PolarHBondContact O-N 3.38Å; N187-T191 HydrophobicContact CB-CG2 4.46Å; N187-T191 PolarHBondContact O-N 2.81Å; N187-T191 PolarHBondContact O-OG1 2.89Å; N187-D444 WeakPolarHBondContact CB-OD2 3.47Å; N187-D444 PolarHBondContact ND2-OD2 2.98Å
188	M	95.2	Very high	96	Very high	86 Å²	86	27.9 Å²	27.9	42%	0.424	14%	0.14	S	C	.	.	H	α-helix	trans	-54.2	-22.9	175.4	-47.6	-51.6	-87.6	0	0	113.8	K166 N186 L190 T192	K166-M188 PolarHBondContact NZ-SD 3.15Å; N186-M188 PolarHBondContact O-N 3.2Å; M188-L190 PolarHBondContact O-N 2.78Å; M188-T192 HydrophobicContact CB-CG2 3.83Å; M188-T192 HydrophobicContact CE-CG2 3.52Å; M188-T192 HydrophobicContact CG-CG2 4.45Å; M188-T192 PolarHBondContact O-N 2.99Å; M188-T192 PolarHBondContact O-OG1 2.99Å; M188-T192 HydrophobicContact SD-CG2 4.22Å
189	V	96.4	Very high	96.2	Very high	37 Å²	37	19.8 Å²	19.8	22%	0.224	11%	0.11	C	C	.	.	H	α-helix	trans	-63	-17.5	171.7	-60	0	0	0	0	113.7	N186 N187 G195 L196 S199 V432 L436	N186-V189 PolarHBondContact O-N 2.86Å; N187-V189 PolarHBondContact O-N 2.91Å; V189-G195 CarbonylContact O-C 3.56Å; V189-L196 PolarHBondContact O-N 2.68Å; V189-S199 PolarHBondContact O-OG 2.81Å; V189-V432 HydrophobicContact CB-CG1 4.34Å; V189-V432 HydrophobicContact CG2-CB 4Å; V189-V432 HydrophobicContact CG2-CG1 3.96Å; V189-V432 WeakPolarHBondContact O-CG1 3.3Å; V189-L436 HydrophobicContact CG2-CD2 3.67Å; V189-L436 HydrophobicContact CG2-CG 4.22Å
190	L	95.8	Very high	96.2	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-116.6	-36.9	176.6	-171.5	64.7	0	0	0	111.1	N187 M188 L196 L333 C428 V432 I446 M463	N187-L190 WeakPolarHBondContact O-CA 3.37Å; N187-L190 WeakPolarHBondContact O-CB 3.23Å; N187-L190 PolarHBondContact O-N 3.38Å; M188-L190 PolarHBondContact O-N 2.78Å; L190-L196 HydrophobicContact CD1-CD1 4.03Å; L190-L333 HydrophobicContact CD2-CD2 4.21Å; L190-C428 HydrophobicContact CD1-CB 4.05Å; L190-V432 HydrophobicContact CB-CG1 4.13Å; L190-V432 HydrophobicContact CB-CG2 4.2Å; L190-V432 HydrophobicContact CD1-CG1 4.03Å; L190-V432 HydrophobicContact CD1-CG2 3.92Å; L190-V432 HydrophobicContact CD2-CG2 4.09Å; L190-V432 HydrophobicContact CG-CG2 4.31Å; L190-I446 HydrophobicContact CD2-CD1 3.71Å; L190-M463 HydrophobicContact CD1-CE 3.83Å; L190-M463 HydrophobicContact CD1-SD 3.58Å; L190-M463 VanDerWaalsContact CD1-SD 3.58Å; L190-M463 HydrophobicContact CD2-CE 3.93Å; L190-M463 HydrophobicContact CG-CE 3.87Å; L190-M463 HydrophobicContact CG-SD 3.94Å
191	T	95.8	Very high	96.1	Very high	8 Å²	8	22.8 Å²	22.8	5%	0.049	12%	0.122	C	C	.	.	H	α-helix	trans	-102.7	24.1	-168.7	66.8	0	0	0	0	115	N187 I446 M463 C465	N187-T191 HydrophobicContact CB-CG2 4.46Å; N187-T191 PolarHBondContact O-N 2.81Å; N187-T191 PolarHBondContact O-OG1 2.89Å; T191-I446 HydrophobicContact CG2-CD1 3.71Å; T191-I446 HydrophobicContact CG2-CG1 3.99Å; T191-I446 HydrophobicContact CG2-CG2 3.86Å; T191-M463 CarbonylContact C-O 3.56Å; T191-M463 VanDerWaalsContact CA-O 3.28Å; T191-M463 WeakPolarHBondContact CA-O 3.36Å; T191-C465 HydrophobicContact CG2-CB 3.84Å
192	T	94.8	Very high	95.9	Very high	39 Å²	39	26.4 Å²	26.4	24%	0.239	14%	0.138	C	C	.	.	S	Bend	trans	-131.6	153.5	168.2	64.5	0	0	0	0	111	M188 I194 G195 L196	M188-T192 HydrophobicContact CB-CG2 3.83Å; M188-T192 HydrophobicContact CE-CG2 3.52Å; M188-T192 HydrophobicContact CG-CG2 4.45Å; M188-T192 PolarHBondContact O-N 2.99Å; M188-T192 PolarHBondContact O-OG1 2.99Å; M188-T192 HydrophobicContact SD-CG2 4.22Å; T192-I194 PolarHBondContact O-N 3.47Å; T192-G195 PolarHBondContact O-N 3.37Å; T192-G195 WeakPolarHBondContact OG1-CA 3.32Å; T192-G195 PolarHBondContact OG1-N 3.49Å; T192-L196 VanDerWaalsContact O-CB 3.31Å; T192-L196 WeakPolarHBondContact O-CB 3.41Å; T192-L196 PolarHBondContact O-N 2.7Å
193	K	93.6	Very high	95.7	Very high	31 Å²	31	27.8 Å²	27.8	14%	0.135	14%	0.144	C	C	.	.	H	α-helix	trans	-56.8	-45	-178.4	-67.7	173.4	174.1	67.8	0	112.3	L197 K264 T266 I311 E462	K193-L197 VanDerWaalsContact O-CB 3.29Å; K193-L197 WeakPolarHBondContact O-CB 3.37Å; K193-L197 PolarHBondContact O-N 3.46Å; K193-K264 HydrophobicContact CD-CB 3.97Å; K193-T266 HydrophobicContact CB-CG2 4.29Å; K193-I311 HydrophobicContact CB-CD1 3.9Å; K193-I311 HydrophobicContact CB-CG1 4.36Å; K193-I311 HydrophobicContact CD-CD1 4.31Å; K193-I311 HydrophobicContact CD-CG1 4.49Å; K193-I311 HydrophobicContact CG-CD1 4.3Å; K193-E462 WeakPolarHBondContact CE-OE2 3.47Å; K193-E462 IonicContact NZ-OE2 2.7Å; K193-E462 PolarHBondContact NZ-OE2 3.29Å
194	I	93.8	Very high	95.5	Very high	28 Å²	28	30.2 Å²	30.2	14%	0.144	16%	0.156	C	C	.	.	H	α-helix	trans	-74.7	-42.4	174.6	-71.3	175.2	0	0	0	111.8	T192 L196 L197 N198 R230 T266 P309 I311	T192-I194 PolarHBondContact O-N 3.47Å; I194-L196 PolarHBondContact O-N 3.02Å; I194-L197 PolarHBondContact O-N 3.19Å; I194-N198 VanDerWaalsContact CG2-ND2 3.31Å; I194-N198 WeakPolarHBondContact CG2-ND2 3.25Å; I194-N198 VanDerWaalsContact O-CB 3.3Å; I194-N198 WeakPolarHBondContact O-CB 3.34Å; I194-N198 PolarHBondContact O-N 2.95Å; I194-R230 HydrophobicContact CG1-CG 4.46Å; I194-T266 HydrophobicContact CD1-CG2 3.74Å; I194-T266 HydrophobicContact CG1-CG2 3.73Å; I194-P309 HydrophobicContact CD1-CB 3.69Å; I194-P309 HydrophobicContact CD1-CG 4.33Å; I194-I311 HydrophobicContact CG1-CG2 4.27Å
195	G	95.5	Very high	95.2	Very high	13 Å²	13	37 Å²	37	13%	0.134	18%	0.181	C	C	.	.	H	α-helix	trans	-60.8	-47.7	-177.2	0	0	0	0	0	112.6	V189 T192 S199	V189-G195 CarbonylContact O-C 3.56Å; T192-G195 PolarHBondContact O-N 3.37Å; T192-G195 WeakPolarHBondContact OG1-CA 3.32Å; T192-G195 PolarHBondContact OG1-N 3.49Å; G195-S199 VanDerWaalsContact O-CB 3.24Å; G195-S199 WeakPolarHBondContact O-CB 3.45Å; G195-S199 PolarHBondContact O-N 3.39Å; G195-S199 PolarHBondContact O-OG 3.13Å
196	L	96.5	Very high	94.8	Very high	12 Å²	12	38.9 Å²	38.9	6%	0.063	19%	0.189	C	C	.	.	H	α-helix	trans	-60.1	-50.6	175.7	-178.7	61.5	0	0	0	111.3	V189 L190 T192 I194 S199 L200 C428 L460 M463	V189-L196 PolarHBondContact O-N 2.68Å; L190-L196 HydrophobicContact CD1-CD1 4.03Å; T192-L196 VanDerWaalsContact O-CB 3.31Å; T192-L196 WeakPolarHBondContact O-CB 3.41Å; T192-L196 PolarHBondContact O-N 2.7Å; I194-L196 PolarHBondContact O-N 3.02Å; L196-S199 PolarHBondContact O-N 2.86Å; L196-L200 HydrophobicContact CD1-CD1 3.92Å; L196-L200 HydrophobicContact CD1-CG 4.19Å; L196-L200 HydrophobicContact CG-CD1 4.02Å; L196-L200 WeakPolarHBondContact O-CB 3.47Å; L196-L200 WeakPolarHBondContact O-CG 3.27Å; L196-L200 PolarHBondContact O-N 3.28Å; L196-C428 HydrophobicContact CD1-CB 4.38Å; L196-L460 HydrophobicContact CD2-CD2 4.27Å; L196-M463 HydrophobicContact CD1-SD 3.81Å; L196-M463 HydrophobicContact CD2-CG 4.17Å; L196-M463 HydrophobicContact CD2-SD 4.35Å
197	L	96.3	Very high	94.2	Very high	8 Å²	8	37.7 Å²	37.7	4%	0.042	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-49.9	-179.3	-179.3	65.5	0	0	0	112.1	K193 I194 S199 L200 R201 M221 T228 R230 I311	K193-L197 VanDerWaalsContact O-CB 3.29Å; K193-L197 WeakPolarHBondContact O-CB 3.37Å; K193-L197 PolarHBondContact O-N 3.46Å; I194-L197 PolarHBondContact O-N 3.19Å; L197-S199 VanDerWaalsContact C-N 3.34Å; L197-S199 PolarHBondContact O-N 3.46Å; L197-L200 PolarHBondContact O-N 2.92Å; L197-R201 HydrophobicContact CD1-CG 4.48Å; L197-R201 WeakPolarHBondContact O-CB 3.31Å; L197-R201 VanDerWaalsContact O-CG 3.28Å; L197-R201 WeakPolarHBondContact O-CG 3.47Å; L197-R201 PolarHBondContact O-N 2.8Å; L197-M221 HydrophobicContact CD1-CE 4.44Å; L197-M221 HydrophobicContact CD1-SD 4.09Å; L197-T228 HydrophobicContact CD1-CG2 4.29Å; L197-T228 HydrophobicContact CD2-CG2 3.73Å; L197-R230 HydrophobicContact CD2-CG 3.93Å; L197-I311 HydrophobicContact CD2-CG2 4.37Å
198	N	96	Very high	93.4	Very high	57 Å²	57	42.1 Å²	42.1	31%	0.305	21%	0.214	S	C	.	.	H	α-helix	trans	-63.2	-41	177.5	-73.1	-5.7	0	0	0	111	I194 E202 R230	I194-N198 VanDerWaalsContact CG2-ND2 3.31Å; I194-N198 WeakPolarHBondContact CG2-ND2 3.25Å; I194-N198 VanDerWaalsContact O-CB 3.3Å; I194-N198 WeakPolarHBondContact O-CB 3.34Å; I194-N198 PolarHBondContact O-N 2.95Å; N198-E202 VanDerWaalsContact O-CB 3.25Å; N198-E202 WeakPolarHBondContact O-CB 3.48Å; N198-E202 PolarHBondContact O-N 2.89Å; N198-R230 PolarHBondContact ND2-NH1 3.14Å; N198-R230 PolarHBondContact OD1-NH1 3.18Å
199	S	97.2	Very high	92.7	Very high	6 Å²	6	46 Å²	46	4%	0.042	23%	0.228	C	C	.	.	H	α-helix	trans	-66.9	-42.2	179.8	-70.3	0	0	0	0	113.1	V189 G195 L196 L197 F203 K435	V189-S199 PolarHBondContact O-OG 2.81Å; G195-S199 VanDerWaalsContact O-CB 3.24Å; G195-S199 WeakPolarHBondContact O-CB 3.45Å; G195-S199 PolarHBondContact O-N 3.39Å; G195-S199 PolarHBondContact O-OG 3.13Å; L196-S199 PolarHBondContact O-N 2.86Å; L197-S199 VanDerWaalsContact C-N 3.34Å; L197-S199 PolarHBondContact O-N 3.46Å; S199-F203 VanDerWaalsContact O-CB 3.3Å; S199-F203 WeakPolarHBondContact O-CB 3.29Å; S199-F203 PolarHBondContact O-N 2.84Å; S199-K435 PolarHBondContact OG-NZ 2.85Å
200	L	96.4	Very high	91.7	Very high	5 Å²	5	47.8 Å²	47.8	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-64.5	-49.3	175.9	-72.5	174.4	0	0	0	111.6	L196 L197 E202 F203 E204 M221 F224 I225 A431	L196-L200 HydrophobicContact CD1-CD1 3.92Å; L196-L200 HydrophobicContact CD1-CG 4.19Å; L196-L200 HydrophobicContact CG-CD1 4.02Å; L196-L200 WeakPolarHBondContact O-CB 3.47Å; L196-L200 WeakPolarHBondContact O-CG 3.27Å; L196-L200 PolarHBondContact O-N 3.28Å; L197-L200 PolarHBondContact O-N 2.92Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-E202 PolarHBondContact O-N 2.92Å; L200-F203 PolarHBondContact O-N 3.11Å; L200-E204 WeakPolarHBondContact O-CB 3.29Å; L200-E204 PolarHBondContact O-N 3.24Å; L200-M221 HydrophobicContact CB-CG 4.21Å; L200-M221 HydrophobicContact CB-SD 3.73Å; L200-M221 HydrophobicContact CD1-CG 4.35Å; L200-M221 HydrophobicContact CD1-SD 4.48Å; L200-F224 HydrophobicContact CD1-CE2 3.95Å; L200-F224 HydrophobicContact CD1-CZ 4.27Å; L200-F224 HydrophobicContact CD2-CE2 4.29Å; L200-F224 HydrophobicContact CD2-CZ 3.96Å; L200-I225 HydrophobicContact CD1-CD1 3.96Å; L200-I225 HydrophobicContact CD1-CG1 3.72Å; L200-A431 HydrophobicContact CD2-CB 3.91Å
201	R	95.4	Very high	89.9	Confident	65 Å²	65	59.3 Å²	59.3	25%	0.245	28%	0.28	C	S	.	.	H	α-helix	trans	-58	-43.3	176	-72.9	171.9	173.4	-178.7	-4.3	112.4	L197 E204 R205 M221 T228 E236	L197-R201 HydrophobicContact CD1-CG 4.48Å; L197-R201 WeakPolarHBondContact O-CB 3.31Å; L197-R201 VanDerWaalsContact O-CG 3.28Å; L197-R201 WeakPolarHBondContact O-CG 3.47Å; L197-R201 PolarHBondContact O-N 2.8Å; R201-E204 PolarHBondContact O-N 2.96Å; R201-R205 VanDerWaalsContact O-CB 3.29Å; R201-R205 WeakPolarHBondContact O-CB 3.22Å; R201-R205 PolarHBondContact O-N 3.49Å; R201-M221 HydrophobicContact CG-CE 3.58Å; R201-M221 HydrophobicContact CG-SD 3.86Å; R201-T228 PolarHBondContact NH2-O 3.14Å; R201-E236 IonicContact CZ-OE1 3.15Å; R201-E236 IonicContact CZ-OE2 2.77Å; R201-E236 VanDerWaalsContact CZ-OE2 3.3Å; R201-E236 IonicContact NH1-OE1 3.91Å; R201-E236 PolarHBondContact NH1-OE1 3.42Å; R201-E236 IonicContact NH1-OE2 3.01Å; R201-E236 PolarHBondContact NH1-OE2 2.67Å; R201-E236 IonicContact NH2-OE1 3.41Å; R201-E236 IonicContact NH2-OE2 3.26Å; R201-E236 PolarHBondContact NH2-OE2 2.8Å
202	E	94.7	Very high	88.2	Confident	77 Å²	77	64.6 Å²	64.6	36%	0.36	30%	0.299	S	S	.	.	H	α-helix	trans	-65.5	-42.3	177.8	-166.9	-162.9	151	0	0	111.6	N198 L200 R205 I206 K435	N198-E202 VanDerWaalsContact O-CB 3.25Å; N198-E202 WeakPolarHBondContact O-CB 3.48Å; N198-E202 PolarHBondContact O-N 2.89Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-E202 PolarHBondContact O-N 2.92Å; E202-R205 PolarHBondContact O-N 3.21Å; E202-I206 HydrophobicContact CG-CD1 3.99Å; E202-I206 WeakPolarHBondContact O-CB 3.28Å; E202-I206 VanDerWaalsContact O-CG1 3.27Å; E202-I206 WeakPolarHBondContact O-CG1 3.49Å; E202-I206 PolarHBondContact O-N 3.4Å; E202-K435 WeakPolarHBondContact OE2-CE 3.44Å; E202-K435 IonicContact OE2-NZ 2.71Å; E202-K435 PolarHBondContact OE2-NZ 2.94Å
203	F	93.4	Very high	86.2	Confident	31 Å²	31	72.7 Å²	72.7	14%	0.136	33%	0.331	C	S	.	.	H	α-helix	trans	-64.5	-41.4	177.3	-175.1	-110.5	0	0	0	112	S199 L200 I206 T207 F430 A431	S199-F203 VanDerWaalsContact O-CB 3.3Å; S199-F203 WeakPolarHBondContact O-CB 3.29Å; S199-F203 PolarHBondContact O-N 2.84Å; L200-F203 PolarHBondContact O-N 3.11Å; F203-I206 PolarHBondContact O-N 3.43Å; F203-T207 HydrophobicContact CD1-CG2 4.32Å; F203-T207 HydrophobicContact CD2-CG2 3.93Å; F203-T207 HydrophobicContact CE1-CG2 4.1Å; F203-T207 HydrophobicContact CE2-CG2 3.68Å; F203-T207 HydrophobicContact CG-CG2 4.25Å; F203-T207 HydrophobicContact CZ-CG2 3.78Å; F203-T207 WeakPolarHBondContact O-CB 3.48Å; F203-T207 VanDerWaalsContact O-CG2 3.25Å; F203-T207 WeakPolarHBondContact O-CG2 3.49Å; F203-T207 PolarHBondContact O-N 3.45Å; F203-T207 PolarHBondContact O-OG1 3.29Å; F203-F430 HydrophobicContact CE1-CB 4.23Å; F203-F430 HydrophobicContact CE2-CB 4.05Å; F203-F430 HydrophobicContact CZ-CB 3.61Å; F203-A431 HydrophobicContact CB-CB 3.62Å; F203-A431 HydrophobicContact CD1-CB 4.09Å; F203-A431 HydrophobicContact CD2-CB 4.38Å; F203-A431 HydrophobicContact CG-CB 3.8Å
204	E	91.9	Very high	84.1	Confident	55 Å²	55	75.3 Å²	75.3	26%	0.257	35%	0.347	S	S	.	.	H	α-helix	trans	-63.5	-45.1	174.9	-171.9	159.6	-122.1	0	0	111.8	L200 R201 I206 T207 S208 K220 M221	L200-E204 WeakPolarHBondContact O-CB 3.29Å; L200-E204 PolarHBondContact O-N 3.24Å; R201-E204 PolarHBondContact O-N 2.96Å; E204-I206 VanDerWaalsContact C-N 3.31Å; E204-I206 PolarHBondContact O-N 2.72Å; E204-T207 PolarHBondContact O-N 2.89Å; E204-S208 VanDerWaalsContact O-CB 3.27Å; E204-S208 WeakPolarHBondContact O-CB 3.38Å; E204-S208 PolarHBondContact O-N 3.23Å; E204-S208 PolarHBondContact O-OG 2.84Å; E204-K220 WeakPolarHBondContact OE1-CA 3.43Å; E204-K220 VanDerWaalsContact OE1-CB 3.24Å; E204-K220 WeakPolarHBondContact OE1-CB 3.41Å; E204-M221 PolarHBondContact OE1-N 3.32Å; E204-M221 VanDerWaalsContact OE2-CB 3.31Å; E204-M221 WeakPolarHBondContact OE2-CB 3.24Å
205	R	91	Very high	82	Confident	143 Å²	143	78.1 Å²	78.1	54%	0.54	38%	0.382	S	S	.	.	H	α-helix	trans	-63.2	-30.4	174.3	-174.6	-160.9	65.8	98	5	113.9	R201 E202 S208	R201-R205 VanDerWaalsContact O-CB 3.29Å; R201-R205 WeakPolarHBondContact O-CB 3.22Å; R201-R205 PolarHBondContact O-N 3.49Å; E202-R205 PolarHBondContact O-N 3.21Å; R205-S208 PolarHBondContact O-OG 2.83Å
206	I	87.9	Confident	80.2	Confident	70 Å²	70	85.7 Å²	85.7	36%	0.359	41%	0.414	S	S	.	.	H	α-helix	trans	-79.7	-48.4	175.2	-71.5	166.8	0	0	0	110.4	E202 F203 E204 K209 I210	E202-I206 HydrophobicContact CG-CD1 3.99Å; E202-I206 WeakPolarHBondContact O-CB 3.28Å; E202-I206 VanDerWaalsContact O-CG1 3.27Å; E202-I206 WeakPolarHBondContact O-CG1 3.49Å; E202-I206 PolarHBondContact O-N 3.4Å; F203-I206 PolarHBondContact O-N 3.43Å; E204-I206 VanDerWaalsContact C-N 3.31Å; E204-I206 PolarHBondContact O-N 2.72Å; I206-K209 WeakPolarHBondContact O-CB 3.34Å; I206-K209 PolarHBondContact O-N 3.33Å; I206-I210 HydrophobicContact CG2-CD1 4.37Å
207	T	84.2	Confident	78.9	Confident	19 Å²	19	94.2 Å²	94.2	12%	0.117	45%	0.445	C	S	.	.	H	α-helix	trans	-78.3	-25.9	-169.8	56.2	0	0	0	0	113.8	F203 E204 K209 I210	F203-T207 HydrophobicContact CD1-CG2 4.32Å; F203-T207 HydrophobicContact CD2-CG2 3.93Å; F203-T207 HydrophobicContact CE1-CG2 4.1Å; F203-T207 HydrophobicContact CE2-CG2 3.68Å; F203-T207 HydrophobicContact CG-CG2 4.25Å; F203-T207 HydrophobicContact CZ-CG2 3.78Å; F203-T207 WeakPolarHBondContact O-CB 3.48Å; F203-T207 VanDerWaalsContact O-CG2 3.25Å; F203-T207 WeakPolarHBondContact O-CG2 3.49Å; F203-T207 PolarHBondContact O-N 3.45Å; F203-T207 PolarHBondContact O-OG1 3.29Å; E204-T207 PolarHBondContact O-N 2.89Å; T207-K209 PolarHBondContact O-N 2.95Å; T207-I210 PolarHBondContact O-N 3.41Å
208	S	80.3	Confident	78	Confident	93 Å²	93	98.1 Å²	98.1	65%	0.65	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-21.5	167.8	48.3	0	0	0	0	113.9	E204 R205	E204-S208 VanDerWaalsContact O-CB 3.27Å; E204-S208 WeakPolarHBondContact O-CB 3.38Å; E204-S208 PolarHBondContact O-N 3.23Å; E204-S208 PolarHBondContact O-OG 2.84Å; R205-S208 PolarHBondContact O-OG 2.83Å
209	K	78.9	Confident	77.7	Confident	167 Å²	167	96.4 Å²	96.4	73%	0.726	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-8.2	175	-56.5	-169.6	178	-161.8	0	113.8	I206 T207	I206-K209 WeakPolarHBondContact O-CB 3.34Å; I206-K209 PolarHBondContact O-N 3.33Å; T207-K209 PolarHBondContact O-N 2.95Å
210	I	75.7	Confident	77.4	Confident	75 Å²	75	100.9 Å²	100.9	39%	0.385	47%	0.469	S	S	.	.			trans	-107.7	106.3	-172.9	-54.4	172.8	0	0	0	109.4	I206 T207 Y212	I206-I210 HydrophobicContact CG2-CD1 4.37Å; T207-I210 PolarHBondContact O-N 3.41Å; I210-Y212 HydrophobicContact CB-CD2 4.31Å; I210-Y212 HydrophobicContact CB-CE2 3.72Å; I210-Y212 HydrophobicContact CG2-CD1 4.2Å; I210-Y212 HydrophobicContact CG2-CD2 4.03Å; I210-Y212 HydrophobicContact CG2-CE1 3.77Å; I210-Y212 HydrophobicContact CG2-CE2 3.6Å; I210-Y212 HydrophobicContact CG2-CG 4.31Å; I210-Y212 VanDerWaalsContact CG2-CZ 3.45Å; I210-Y212 VanDerWaalsContact O-CD2 3.3Å; I210-Y212 WeakPolarHBondContact O-CD2 3.15Å; I210-Y212 PolarHBondContact O-N 2.98Å
211	R	59.8	Low	77.2	Confident	244 Å²	244	102.3 Å²	102.3	92%	0.921	48%	0.476	S	S	*	.			trans	-73.5	89	171.6	-67.6	-171.9	-177.9	-169.1	1.9	110.3
212	Y	59.8	Low	77.2	Confident	118 Å²	118	104.7 Å²	104.7	46%	0.463	49%	0.49	S	S	.	.			trans	-66.9	132.4	170.6	-67	-77.1	0	0	0	110.6	I210 R218	I210-Y212 HydrophobicContact CB-CD2 4.31Å; I210-Y212 HydrophobicContact CB-CE2 3.72Å; I210-Y212 HydrophobicContact CG2-CD1 4.2Å; I210-Y212 HydrophobicContact CG2-CD2 4.03Å; I210-Y212 HydrophobicContact CG2-CE1 3.77Å; I210-Y212 HydrophobicContact CG2-CE2 3.6Å; I210-Y212 HydrophobicContact CG2-CG 4.31Å; I210-Y212 VanDerWaalsContact CG2-CZ 3.45Å; I210-Y212 VanDerWaalsContact O-CD2 3.3Å; I210-Y212 WeakPolarHBondContact O-CD2 3.15Å; I210-Y212 PolarHBondContact O-N 2.98Å; Y212-R218 VanDerWaalsContact CE2-CZ 3.44Å; Y212-R218 VanDerWaalsContact CE2-NH1 3.27Å; Y212-R218 VanDerWaalsContact CZ-CZ 3.43Å; Y212-R218 VanDerWaalsContact CZ-NH1 3.3Å; Y212-R218 PolarHBondContact OH-NH1 3.37Å; Y212-R218 PolarHBondContact OH-NH2 3.09Å
213	K	53	Low	77.2	Confident	210 Å²	210	102.3 Å²	102.3	91%	0.913	48%	0.479	S	S	*	.	S	Bend	trans	-78.8	-18.4	177.6	-69	-174.1	176.2	-177.6	0	113.7
214	N	48.1	Very low	77.4	Confident	86 Å²	86	100.9 Å²	100.9	46%	0.46	47%	0.472	S	S	.	.	S	Bend	trans	-98.4	127.5	-174.1	-57.9	-1.4	0	0	0	109.5	H216 D525	N214-H216 PolarHBondContact O-N 3.5Å; N214-D525 PolarHBondContact ND2-OD2 2.99Å
215	G	50.3	Low	77.7	Confident	86 Å²	86	99 Å²	99	89%	0.887	46%	0.464	S	S	*	.			trans	-68.4	18.6	-162.3	0	0	0	0	0	118.7	R217	G215-R217 PolarHBondContact O-N 3.47Å; G215-R217 VanDerWaalsContact O-N 3.13Å
216	H	56.8	Low	77.9	Confident	173 Å²	173	92.2 Å²	92.2	80%	0.801	44%	0.439	S	S	*	.			trans	-78.4	95.4	175.2	-68.6	-56.5	0	0	0	111.1	N214 R218	N214-H216 PolarHBondContact O-N 3.5Å; H216-R218 PolarHBondContact O-N 2.96Å; H216-R218 VanDerWaalsContact O-N 3.09Å
217	R	69.8	Low	78.3	Confident	190 Å²	190	92 Å²	92	72%	0.717	44%	0.441	S	S	*	.			trans	-52.3	115.4	168.2	173.2	177.4	168.9	167.2	-2.2	109.7	G215 E223	G215-R217 PolarHBondContact O-N 3.47Å; G215-R217 VanDerWaalsContact O-N 3.13Å; R217-E223 IonicContact CZ-OE1 3.8Å; R217-E223 IonicContact NE-OE1 3.47Å; R217-E223 PolarHBondContact NE-OE1 3.21Å; R217-E223 IonicContact NH2-OE1 2.67Å; R217-E223 PolarHBondContact NH2-OE1 2.84Å
218	R	77.4	Confident	78.9	Confident	91 Å²	91	91.8 Å²	91.8	34%	0.343	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-72.7	147.2	170.2	-68.8	-173.1	176.1	172	3.6	110.1	Y212 H216 K220	Y212-R218 VanDerWaalsContact CE2-CZ 3.44Å; Y212-R218 VanDerWaalsContact CE2-NH1 3.27Å; Y212-R218 VanDerWaalsContact CZ-CZ 3.43Å; Y212-R218 VanDerWaalsContact CZ-NH1 3.3Å; Y212-R218 PolarHBondContact OH-NH1 3.37Å; Y212-R218 PolarHBondContact OH-NH2 3.09Å; H216-R218 PolarHBondContact O-N 2.96Å; H216-R218 VanDerWaalsContact O-N 3.09Å; R218-K220 PolarHBondContact O-N 3.08Å
219	L	88.9	Confident	79.6	Confident	21 Å²	21	87.8 Å²	87.8	11%	0.11	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-73.8	120.6	178	-53.3	-168.6	0	0	0	109.8	F224 Q423 I424 Q427	L219-F224 HydrophobicContact CB-CD1 3.98Å; L219-F224 HydrophobicContact CB-CE1 3.88Å; L219-F224 HydrophobicContact CD1-CD1 4.39Å; L219-Q423 HydrophobicContact CD1-CB 3.86Å; L219-I424 HydrophobicContact CD1-CG1 3.98Å; L219-Q427 HydrophobicContact CB-CG 4.45Å; L219-Q427 PolarHBondContact O-NE2 3.45Å
220	K	91.2	Very high	80.3	Confident	100 Å²	100	81.9 Å²	81.9	44%	0.435	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-65.3	154.2	166.2	-65.6	-177.1	178.4	-171.9	0	110.7	E204 R218 E222 E223 F224	E204-K220 WeakPolarHBondContact OE1-CA 3.43Å; E204-K220 VanDerWaalsContact OE1-CB 3.24Å; E204-K220 WeakPolarHBondContact OE1-CB 3.41Å; R218-K220 PolarHBondContact O-N 3.08Å; K220-E222 VanDerWaalsContact C-N 3.29Å; K220-E222 HydrophobicContact CB-CG 3.87Å; K220-E222 HydrophobicContact CD-CG 3.96Å; K220-E222 WeakPolarHBondContact CD-OE1 3.21Å; K220-E222 WeakPolarHBondContact CE-OE1 3.26Å; K220-E222 IonicContact NZ-OE1 3.08Å; K220-E222 PolarHBondContact NZ-OE1 3.3Å; K220-E222 IonicContact NZ-OE2 2.73Å; K220-E222 PolarHBondContact O-N 3.12Å; K220-E223 HydrophobicContact CB-CG 4.16Å; K220-E223 PolarHBondContact N-OE1 3.26Å; K220-E223 WeakPolarHBondContact O-CB 3.18Å; K220-E223 PolarHBondContact O-N 3.38Å; K220-E223 VanDerWaalsContact O-N 3.07Å; K220-F224 VanDerWaalsContact O-CD1 3.22Å; K220-F224 WeakPolarHBondContact O-CD1 3.3Å; K220-F224 VanDerWaalsContact O-CE1 3.24Å; K220-F224 WeakPolarHBondContact O-CE1 3.47Å
221	M	93.8	Very high	81.1	Confident	34 Å²	34	78.9 Å²	78.9	17%	0.167	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-60	-38.5	179.9	-172.5	178.9	62.1	0	0	112.2	L197 L200 R201 E204 E223 F224 I225	L197-M221 HydrophobicContact CD1-CE 4.44Å; L197-M221 HydrophobicContact CD1-SD 4.09Å; L200-M221 HydrophobicContact CB-CG 4.21Å; L200-M221 HydrophobicContact CB-SD 3.73Å; L200-M221 HydrophobicContact CD1-CG 4.35Å; L200-M221 HydrophobicContact CD1-SD 4.48Å; R201-M221 HydrophobicContact CG-CE 3.58Å; R201-M221 HydrophobicContact CG-SD 3.86Å; E204-M221 PolarHBondContact OE1-N 3.32Å; E204-M221 VanDerWaalsContact OE2-CB 3.31Å; E204-M221 WeakPolarHBondContact OE2-CB 3.24Å; M221-E223 PolarHBondContact O-N 3.26Å; M221-E223 VanDerWaalsContact O-N 3.14Å; M221-F224 PolarHBondContact O-N 3.14Å; M221-F224 VanDerWaalsContact O-N 3.13Å; M221-I225 HydrophobicContact CG-CB 3.83Å; M221-I225 HydrophobicContact CG-CG1 3.76Å; M221-I225 HydrophobicContact CG-CG2 4.48Å; M221-I225 PolarHBondContact O-N 3.15Å
222	E	93.6	Very high	82.5	Confident	115 Å²	115	70.5 Å²	70.5	54%	0.537	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-61	-17.3	176.2	67.8	-167.4	-162.3	0	0	114.7	K220 F224 K457	K220-E222 VanDerWaalsContact C-N 3.29Å; K220-E222 HydrophobicContact CB-CG 3.87Å; K220-E222 HydrophobicContact CD-CG 3.96Å; K220-E222 WeakPolarHBondContact CD-OE1 3.21Å; K220-E222 WeakPolarHBondContact CE-OE1 3.26Å; K220-E222 IonicContact NZ-OE1 3.08Å; K220-E222 PolarHBondContact NZ-OE1 3.3Å; K220-E222 IonicContact NZ-OE2 2.73Å; K220-E222 PolarHBondContact O-N 3.12Å; E222-F224 VanDerWaalsContact C-N 3.35Å; E222-K457 PolarHBondContact O-NZ 3.48Å; E222-K457 VanDerWaalsContact O-NZ 3.1Å
223	E	95.7	Very high	84	Confident	28 Å²	28	66.3 Å²	66.3	13%	0.131	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-82.8	-9.1	177.5	-58.7	179.8	-151.1	0	0	113.8	R217 K220 M221 R420 K457	R217-E223 IonicContact CZ-OE1 3.8Å; R217-E223 IonicContact NE-OE1 3.47Å; R217-E223 PolarHBondContact NE-OE1 3.21Å; R217-E223 IonicContact NH2-OE1 2.67Å; R217-E223 PolarHBondContact NH2-OE1 2.84Å; K220-E223 HydrophobicContact CB-CG 4.16Å; K220-E223 PolarHBondContact N-OE1 3.26Å; K220-E223 WeakPolarHBondContact O-CB 3.18Å; K220-E223 PolarHBondContact O-N 3.38Å; K220-E223 VanDerWaalsContact O-N 3.07Å; M221-E223 PolarHBondContact O-N 3.26Å; M221-E223 VanDerWaalsContact O-N 3.14Å; E223-R420 VanDerWaalsContact CB-NH2 3.32Å; E223-R420 PolarHBondContact O-NH2 3.49Å; E223-R420 IonicContact OE2-NH1 3.37Å; E223-R420 IonicContact OE2-NH2 2.71Å; E223-R420 PolarHBondContact OE2-NH2 3.4Å; E223-K457 VanDerWaalsContact O-CE 3.24Å; E223-K457 WeakPolarHBondContact O-CE 3.2Å
224	F	97.3	Very high	85.7	Confident	1 Å²	1	61.5 Å²	61.5	0%	0.004	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-152.5	-10.1	-176.5	66.9	-89.2	0	0	0	116.5	L200 L219 K220 M221 E222 I424 Q427 W459 L460	L200-F224 HydrophobicContact CD1-CE2 3.95Å; L200-F224 HydrophobicContact CD1-CZ 4.27Å; L200-F224 HydrophobicContact CD2-CE2 4.29Å; L200-F224 HydrophobicContact CD2-CZ 3.96Å; L219-F224 HydrophobicContact CB-CD1 3.98Å; L219-F224 HydrophobicContact CB-CE1 3.88Å; L219-F224 HydrophobicContact CD1-CD1 4.39Å; K220-F224 VanDerWaalsContact O-CD1 3.22Å; K220-F224 WeakPolarHBondContact O-CD1 3.3Å; K220-F224 VanDerWaalsContact O-CE1 3.24Å; K220-F224 WeakPolarHBondContact O-CE1 3.47Å; M221-F224 PolarHBondContact O-N 3.14Å; M221-F224 VanDerWaalsContact O-N 3.13Å; E222-F224 VanDerWaalsContact C-N 3.35Å; F224-I424 HydrophobicContact CB-CD1 3.62Å; F224-I424 HydrophobicContact CB-CG1 3.69Å; F224-I424 HydrophobicContact CB-CG2 4.39Å; F224-I424 HydrophobicContact CD1-CG1 4.46Å; F224-I424 HydrophobicContact CD2-CB 4.39Å; F224-I424 HydrophobicContact CD2-CG1 4.19Å; F224-I424 HydrophobicContact CD2-CG2 3.46Å; F224-I424 VanDerWaalsContact CD2-CG2 3.46Å; F224-I424 HydrophobicContact CE2-CG2 3.9Å; F224-I424 HydrophobicContact CG-CD1 4.34Å; F224-I424 HydrophobicContact CG-CG1 3.89Å; F224-I424 HydrophobicContact CG-CG2 4.06Å; F224-Q427 HydrophobicContact CE1-CG 4.09Å; F224-Q427 HydrophobicContact CZ-CB 4.49Å; F224-Q427 HydrophobicContact CZ-CG 3.94Å; F224-W459 CarbonylContact O-C 3.09Å; F224-W459 WeakPolarHBondContact O-CA 3.39Å; F224-L460 HydrophobicContact CD2-CB 4.45Å; F224-L460 PolarHBondContact O-N 3.47Å
225	I	97.4	Very high	87.9	Confident	15 Å²	15	63.6 Å²	63.6	8%	0.077	31%	0.314	C	S	.	.	S	Bend	trans	-109.8	125.7	170	-59.8	-63.4	0	0	0	108.5	L200 M221 W459 L460	L200-I225 HydrophobicContact CD1-CD1 3.96Å; L200-I225 HydrophobicContact CD1-CG1 3.72Å; M221-I225 HydrophobicContact CG-CB 3.83Å; M221-I225 HydrophobicContact CG-CG1 3.76Å; M221-I225 HydrophobicContact CG-CG2 4.48Å; M221-I225 PolarHBondContact O-N 3.15Å; I225-W459 WeakPolarHBondContact O-CZ3 3.26Å; I225-L460 HydrophobicContact CD1-CB 3.99Å; I225-L460 HydrophobicContact CD1-CD2 4.13Å; I225-L460 HydrophobicContact CD1-CG 4.23Å
226	P	96.8	Very high	89.9	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.006	28%	0.278	C	S	.	.			trans	-61.6	143.3	172.8	-19.5	31.6	0	0	0	110.5	T228 Q313 R314 I316 W459	P226-T228 PolarHBondContact O-N 3.15Å; P226-T228 VanDerWaalsContact O-N 3.14Å; P226-T228 PolarHBondContact O-OG1 2.92Å; P226-Q313 HydrophobicContact CB-CG 3.88Å; P226-Q313 HydrophobicContact CG-CG 4.47Å; P226-R314 WeakPolarHBondContact CB-O 3.49Å; P226-I316 HydrophobicContact CG-CD1 4.17Å; P226-I316 HydrophobicContact CG-CG1 4.39Å; P226-W459 HydrophobicContact CB-CE3 4.29Å; P226-W459 HydrophobicContact CB-CZ3 4.5Å; P226-W459 HydrophobicContact CG-CB 4.18Å; P226-W459 HydrophobicContact CG-CD2 4.06Å; P226-W459 HydrophobicContact CG-CE3 3.75Å; P226-W459 HydrophobicContact CG-CG 4.29Å; P226-W459 HydrophobicContact CG-CZ3 4.43Å
227	T	95.3	Very high	91.7	Very high	66 Å²	66	54.1 Å²	54.1	41%	0.405	25%	0.245	S	C	.	.			trans	-45.3	120.5	-176.7	-41.2	0	0	0	0	111	F229 W261 Q313 R314	T227-F229 HydrophobicContact CG2-CE2 3.82Å; T227-F229 HydrophobicContact CG2-CZ 4.02Å; T227-W261 HydrophobicContact CG2-CH2 4.48Å; T227-Q313 CarbonylContact O-C 3.51Å; T227-Q313 WeakPolarHBondContact O-CA 3.22Å; T227-R314 PolarHBondContact O-N 3.13Å
228	T	96.1	Very high	92.7	Very high	13 Å²	13	49.4 Å²	49.4	8%	0.08	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	133.1	-170.8	-57.2	0	0	0	0	110.8	L197 R201 P226 I311 V312 Q313	L197-T228 HydrophobicContact CD1-CG2 4.29Å; L197-T228 HydrophobicContact CD2-CG2 3.73Å; R201-T228 PolarHBondContact NH2-O 3.14Å; P226-T228 PolarHBondContact O-N 3.15Å; P226-T228 VanDerWaalsContact O-N 3.14Å; P226-T228 PolarHBondContact O-OG1 2.92Å; T228-I311 HydrophobicContact CG2-CB 3.83Å; T228-I311 HydrophobicContact CG2-CD1 3.75Å; T228-I311 HydrophobicContact CG2-CG1 4.34Å; T228-I311 HydrophobicContact CG2-CG2 4.19Å; T228-V312 WeakPolarHBondContact CA-O 3.34Å; T228-Q313 HydrophobicContact CG2-CB 4.24Å; T228-Q313 WeakPolarHBondContact OG1-CG 3.43Å; T228-Q313 PolarHBondContact OG1-NE2 3.46Å
229	F	95.3	Very high	93.4	Very high	10 Å²	10	48 Å²	48	4%	0.044	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	144	177.8	-59.8	-86.9	0	0	0	110.7	T227 M231 E236 D239 F240 W261 I311 V312	T227-F229 HydrophobicContact CG2-CE2 3.82Å; T227-F229 HydrophobicContact CG2-CZ 4.02Å; F229-M231 HydrophobicContact CB-CE 3.54Å; F229-E236 WeakPolarHBondContact CA-OE2 3.48Å; F229-D239 WeakPolarHBondContact CE1-OD2 3.33Å; F229-F240 HydrophobicContact CB-CB 4.07Å; F229-F240 HydrophobicContact CB-CD2 4.49Å; F229-F240 HydrophobicContact CD1-CB 4.06Å; F229-F240 HydrophobicContact CD2-CB 4.08Å; F229-F240 AromaticContact CD2-CD2 3.65Å; F229-F240 HydrophobicContact CD2-CD2 3.65Å; F229-F240 HydrophobicContact CD2-CG 4.31Å; F229-F240 HydrophobicContact CE2-CD2 4.11Å; F229-F240 HydrophobicContact CG-CB 3.81Å; F229-F240 HydrophobicContact CG-CD2 4.19Å; F229-F240 HydrophobicContact CG-CG 4.41Å; F229-W261 HydrophobicContact CD2-CH2 4.43Å; F229-W261 AromaticContact CD2-CZ3 3.94Å; F229-W261 HydrophobicContact CD2-CZ3 3.94Å; F229-W261 AromaticContact CE2-CH2 3.76Å; F229-W261 HydrophobicContact CE2-CH2 3.76Å; F229-W261 AromaticContact CE2-CZ3 3.69Å; F229-W261 HydrophobicContact CE2-CZ3 3.69Å; F229-I311 CarbonylContact O-C 3.58Å; F229-I311 VanDerWaalsContact O-CA 3.27Å; F229-I311 WeakPolarHBondContact O-CA 3.27Å; F229-V312 PolarHBondContact N-O 3.07Å; F229-V312 PolarHBondContact O-N 3.46Å
230	R	94.6	Very high	93.6	Very high	43 Å²	43	47 Å²	47	16%	0.162	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	120.5	172.3	-79	178.3	63.7	-159.4	-7.9	110.8	I194 L197 N198 D232 V233 E236 I311	I194-R230 HydrophobicContact CG1-CG 4.46Å; L197-R230 HydrophobicContact CD2-CG 3.93Å; N198-R230 PolarHBondContact ND2-NH1 3.14Å; N198-R230 PolarHBondContact OD1-NH1 3.18Å; R230-D232 WeakPolarHBondContact CB-OD1 3.34Å; R230-D232 IonicContact CZ-OD1 2.99Å; R230-D232 IonicContact CZ-OD2 3.3Å; R230-D232 IonicContact NE-OD1 2.65Å; R230-D232 PolarHBondContact NE-OD1 3.35Å; R230-D232 IonicContact NE-OD2 3.45Å; R230-D232 IonicContact NH2-OD1 3.52Å; R230-D232 IonicContact NH2-OD2 3.72Å; R230-D232 PolarHBondContact NH2-OD2 2.83Å; R230-D232 PolarHBondContact O-N 2.93Å; R230-V233 HydrophobicContact CB-CB 4.14Å; R230-V233 HydrophobicContact CB-CG2 3.87Å; R230-V233 PolarHBondContact O-N 2.78Å; R230-E236 PolarHBondContact N-OE2 2.87Å; R230-E236 WeakPolarHBondContact O-CB 3.38Å; R230-I311 HydrophobicContact CG-CG2 4.12Å
231	M	92.4	Very high	93.6	Very high	11 Å²	11	43.3 Å²	43.3	5%	0.054	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-8.4	177.1	-56.9	-65.7	96.9	0	0	112.7	F229 V233 R237 F240 F286 L290 H310 V312	F229-M231 HydrophobicContact CB-CE 3.54Å; M231-V233 VanDerWaalsContact C-N 3.34Å; M231-R237 HydrophobicContact CE-CB 4.49Å; M231-R237 HydrophobicContact SD-CG 4.43Å; M231-F240 HydrophobicContact CE-CB 3.93Å; M231-F240 HydrophobicContact CE-CD1 4Å; M231-F240 HydrophobicContact CE-CG 3.92Å; M231-F240 HydrophobicContact SD-CD1 4.02Å; M231-F240 HydrophobicContact SD-CE1 4.39Å; M231-F286 HydrophobicContact CG-CE1 3.98Å; M231-F286 HydrophobicContact CG-CZ 3.94Å; M231-F286 HydrophobicContact SD-CE1 3.83Å; M231-F286 HydrophobicContact SD-CZ 4.38Å; M231-L290 HydrophobicContact CB-CD1 4.14Å; M231-L290 HydrophobicContact CG-CD1 4.38Å; M231-L290 HydrophobicContact SD-CD1 4.17Å; M231-H310 HydrophobicContact CB-CB 4.26Å; M231-H310 WeakPolarHBondContact CB-O 3.47Å; M231-H310 HydrophobicContact CG-CB 4.34Å; M231-H310 PolarHBondContact N-O 3.14Å; M231-V312 HydrophobicContact CE-CB 4.3Å; M231-V312 HydrophobicContact CE-CG2 4.29Å; M231-V312 HydrophobicContact CG-CB 4.5Å; M231-V312 HydrophobicContact CG-CG2 3.65Å; M231-V312 HydrophobicContact SD-CB 4.37Å; M231-V312 HydrophobicContact SD-CG2 3.73Å
232	D	88.6	Confident	93.4	Very high	69 Å²	69	45.4 Å²	45.4	37%	0.369	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	6.6	171.7	71.6	-54.4	0	0	0	113.6	R230 P309	R230-D232 WeakPolarHBondContact CB-OD1 3.34Å; R230-D232 IonicContact CZ-OD1 2.99Å; R230-D232 IonicContact CZ-OD2 3.3Å; R230-D232 IonicContact NE-OD1 2.65Å; R230-D232 PolarHBondContact NE-OD1 3.35Å; R230-D232 IonicContact NE-OD2 3.45Å; R230-D232 IonicContact NH2-OD1 3.52Å; R230-D232 IonicContact NH2-OD2 3.72Å; R230-D232 PolarHBondContact NH2-OD2 2.83Å; R230-D232 PolarHBondContact O-N 2.93Å; D232-P309 HydrophobicContact CB-CB 3.93Å
233	V	91.2	Very high	93	Very high	29 Å²	29	47.4 Å²	47.4	18%	0.176	23%	0.23	C	C	.	.	S	Bend	trans	-121.4	120.7	174.4	177.2	0	0	0	0	107.2	R230 M231 E235 E236 R237	R230-V233 HydrophobicContact CB-CB 4.14Å; R230-V233 HydrophobicContact CB-CG2 3.87Å; R230-V233 PolarHBondContact O-N 2.78Å; M231-V233 VanDerWaalsContact C-N 3.34Å; V233-E235 VanDerWaalsContact C-N 3.3Å; V233-E235 WeakPolarHBondContact CG1-OE2 3.45Å; V233-E235 PolarHBondContact O-N 3.13Å; V233-E236 HydrophobicContact CB-CB 4.11Å; V233-E236 HydrophobicContact CB-CG 4.14Å; V233-E236 HydrophobicContact CG1-CB 4.2Å; V233-E236 HydrophobicContact CG1-CG 3.9Å; V233-E236 PolarHBondContact O-N 2.94Å; V233-R237 WeakPolarHBondContact O-CB 3.43Å; V233-R237 PolarHBondContact O-N 2.92Å
234	K	89.9	Confident	92.5	Very high	110 Å²	110	47.4 Å²	47.4	48%	0.478	23%	0.231	S	C	.	.	H	α-helix	trans	-59.5	-44.5	-171.6	179.4	179.7	172.3	-177.8	0	111.3	R237 E238	K234-R237 WeakPolarHBondContact O-CB 3.48Å; K234-R237 PolarHBondContact O-N 2.69Å; K234-E238 VanDerWaalsContact CE-CD 3.42Å; K234-E238 WeakPolarHBondContact CE-OE1 3.37Å; K234-E238 WeakPolarHBondContact CE-OE2 3.42Å; K234-E238 HydrophobicContact CG-CG 4.49Å; K234-E238 IonicContact NZ-OE1 2.72Å; K234-E238 WeakPolarHBondContact O-CB 3.19Å; K234-E238 WeakPolarHBondContact O-CG 3.34Å; K234-E238 PolarHBondContact O-N 3.28Å
235	E	93	Very high	91.4	Very high	129 Å²	129	49.4 Å²	49.4	60%	0.603	25%	0.247	S	C	*	.	H	α-helix	trans	-68.2	-38.7	-175.3	-55.8	73	-161.5	0	0	111.4	V233 D239	V233-E235 VanDerWaalsContact C-N 3.3Å; V233-E235 WeakPolarHBondContact CG1-OE2 3.45Å; V233-E235 PolarHBondContact O-N 3.13Å; E235-D239 VanDerWaalsContact O-CB 3.29Å; E235-D239 WeakPolarHBondContact O-CB 3.42Å; E235-D239 PolarHBondContact O-N 3.23Å
236	E	94	Very high	90	Very high	30 Å²	30	53.7 Å²	53.7	14%	0.14	28%	0.277	C	S	.	.	H	α-helix	trans	-73.1	-33.1	174.7	-68.2	-171.2	-129.7	0	0	112.6	R201 F229 R230 V233 F240	R201-E236 IonicContact CZ-OE1 3.15Å; R201-E236 IonicContact CZ-OE2 2.77Å; R201-E236 VanDerWaalsContact CZ-OE2 3.3Å; R201-E236 IonicContact NH1-OE1 3.91Å; R201-E236 PolarHBondContact NH1-OE1 3.42Å; R201-E236 IonicContact NH1-OE2 3.01Å; R201-E236 PolarHBondContact NH1-OE2 2.67Å; R201-E236 IonicContact NH2-OE1 3.41Å; R201-E236 IonicContact NH2-OE2 3.26Å; R201-E236 PolarHBondContact NH2-OE2 2.8Å; F229-E236 WeakPolarHBondContact CA-OE2 3.48Å; R230-E236 PolarHBondContact N-OE2 2.87Å; R230-E236 WeakPolarHBondContact O-CB 3.38Å; V233-E236 HydrophobicContact CB-CB 4.11Å; V233-E236 HydrophobicContact CB-CG 4.14Å; V233-E236 HydrophobicContact CG1-CB 4.2Å; V233-E236 HydrophobicContact CG1-CG 3.9Å; V233-E236 PolarHBondContact O-N 2.94Å; E236-F240 VanDerWaalsContact O-CB 3.23Å; E236-F240 WeakPolarHBondContact O-CB 3.38Å; E236-F240 PolarHBondContact O-N 2.83Å
237	R	92.7	Very high	88.2	Confident	30 Å²	30	60 Å²	60	11%	0.113	31%	0.306	C	S	.	.	H	α-helix	trans	-66.4	-42.2	173.8	176.8	177.9	68.7	170.4	0.9	111.1	M231 V233 K234 F241 L290 E294	M231-R237 HydrophobicContact CE-CB 4.49Å; M231-R237 HydrophobicContact SD-CG 4.43Å; V233-R237 WeakPolarHBondContact O-CB 3.43Å; V233-R237 PolarHBondContact O-N 2.92Å; K234-R237 WeakPolarHBondContact O-CB 3.48Å; K234-R237 PolarHBondContact O-N 2.69Å; R237-F241 HydrophobicContact CG-CD2 3.85Å; R237-F241 HydrophobicContact CG-CE2 3.63Å; R237-F241 WeakPolarHBondContact O-CB 3.31Å; R237-F241 WeakPolarHBondContact O-CD2 3.44Å; R237-F241 WeakPolarHBondContact O-CG 3.33Å; R237-F241 PolarHBondContact O-N 2.86Å; R237-F241 VanDerWaalsContact O-N 3.08Å; R237-L290 HydrophobicContact CG-CD1 4.38Å; R237-E294 IonicContact CZ-OE1 3.57Å; R237-E294 IonicContact CZ-OE2 2.94Å; R237-E294 VanDerWaalsContact CZ-OE2 3.22Å; R237-E294 IonicContact NH1-OE1 2.69Å; R237-E294 IonicContact NH1-OE2 3.87Å; R237-E294 PolarHBondContact NH1-OE2 2.94Å; R237-E294 VanDerWaalsContact NH2-CD 3.32Å; R237-E294 IonicContact NH2-OE1 2.66Å; R237-E294 PolarHBondContact NH2-OE1 2.77Å; R237-E294 IonicContact NH2-OE2 2.83Å; R237-E294 PolarHBondContact NH2-OE2 2.79Å
238	E	92	Very high	85.9	Confident	92 Å²	92	66.4 Å²	66.4	43%	0.43	33%	0.331	S	S	.	.	H	α-helix	trans	-69.2	-47.3	176.7	-73.4	170.4	168.5	0	0	111.1	K234 F240 F241 S242	K234-E238 VanDerWaalsContact CE-CD 3.42Å; K234-E238 WeakPolarHBondContact CE-OE1 3.37Å; K234-E238 WeakPolarHBondContact CE-OE2 3.42Å; K234-E238 HydrophobicContact CG-CG 4.49Å; K234-E238 IonicContact NZ-OE1 2.72Å; K234-E238 WeakPolarHBondContact O-CB 3.19Å; K234-E238 WeakPolarHBondContact O-CG 3.34Å; K234-E238 PolarHBondContact O-N 3.28Å; E238-F240 VanDerWaalsContact C-N 3.35Å; E238-F240 PolarHBondContact O-N 2.98Å; E238-F241 PolarHBondContact O-N 2.81Å; E238-F241 VanDerWaalsContact O-N 3.09Å; E238-S242 PolarHBondContact O-N 2.81Å; E238-S242 PolarHBondContact O-OG 2.89Å
239	D	91.9	Very high	83.9	Confident	61 Å²	61	69.1 Å²	69.1	33%	0.326	36%	0.362	S	S	.	.	H	α-helix	trans	-57.4	-43.9	174.7	-175.3	30	0	0	0	112.4	F229 E235 F241 S242 R243	F229-D239 WeakPolarHBondContact CE1-OD2 3.33Å; E235-D239 VanDerWaalsContact O-CB 3.29Å; E235-D239 WeakPolarHBondContact O-CB 3.42Å; E235-D239 PolarHBondContact O-N 3.23Å; D239-F241 PolarHBondContact O-N 2.83Å; D239-S242 PolarHBondContact O-N 2.81Å; D239-R243 VanDerWaalsContact CG-NH2 3.31Å; D239-R243 WeakPolarHBondContact O-CD 3.3Å; D239-R243 VanDerWaalsContact O-CG 3.23Å; D239-R243 WeakPolarHBondContact O-CG 3.29Å; D239-R243 PolarHBondContact O-N 3.35Å; D239-R243 VanDerWaalsContact O-N 3.1Å; D239-R243 IonicContact OD1-CZ 3.36Å; D239-R243 VanDerWaalsContact OD1-CZ 3.26Å; D239-R243 IonicContact OD1-NE 3.67Å; D239-R243 PolarHBondContact OD1-NE 2.94Å; D239-R243 IonicContact OD1-NH2 3.04Å; D239-R243 PolarHBondContact OD1-NH2 2.89Å; D239-R243 IonicContact OD2-CZ 3.81Å; D239-R243 IonicContact OD2-NE 3.52Å; D239-R243 PolarHBondContact OD2-NE 3.32Å; D239-R243 IonicContact OD2-NH2 2.97Å; D239-R243 PolarHBondContact OD2-NH2 2.82Å
240	F	93.1	Very high	81.7	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-56.8	-49.3	172	169.5	-102.6	0	0	0	112.3	F229 M231 E236 E238 R243 I244 W261 L277 V312	F229-F240 HydrophobicContact CB-CB 4.07Å; F229-F240 HydrophobicContact CB-CD2 4.49Å; F229-F240 HydrophobicContact CD1-CB 4.06Å; F229-F240 HydrophobicContact CD2-CB 4.08Å; F229-F240 AromaticContact CD2-CD2 3.65Å; F229-F240 HydrophobicContact CD2-CD2 3.65Å; F229-F240 HydrophobicContact CD2-CG 4.31Å; F229-F240 HydrophobicContact CE2-CD2 4.11Å; F229-F240 HydrophobicContact CG-CB 3.81Å; F229-F240 HydrophobicContact CG-CD2 4.19Å; F229-F240 HydrophobicContact CG-CG 4.41Å; M231-F240 HydrophobicContact CE-CB 3.93Å; M231-F240 HydrophobicContact CE-CD1 4Å; M231-F240 HydrophobicContact CE-CG 3.92Å; M231-F240 HydrophobicContact SD-CD1 4.02Å; M231-F240 HydrophobicContact SD-CE1 4.39Å; E236-F240 VanDerWaalsContact O-CB 3.23Å; E236-F240 WeakPolarHBondContact O-CB 3.38Å; E236-F240 PolarHBondContact O-N 2.83Å; E238-F240 VanDerWaalsContact C-N 3.35Å; E238-F240 PolarHBondContact O-N 2.98Å; F240-R243 PolarHBondContact O-N 3.11Å; F240-I244 HydrophobicContact CD1-CD1 4.48Å; F240-I244 HydrophobicContact CD2-CD1 3.6Å; F240-I244 HydrophobicContact CE1-CD1 4.1Å; F240-I244 HydrophobicContact CE2-CD1 3.13Å; F240-I244 HydrophobicContact CG-CD1 4.25Å; F240-I244 HydrophobicContact CZ-CD1 3.4Å; F240-I244 VanDerWaalsContact CZ-CD1 3.4Å; F240-I244 WeakPolarHBondContact O-CD1 3.35Å; F240-I244 PolarHBondContact O-N 2.78Å; F240-W261 HydrophobicContact CD2-CE3 4.45Å; F240-W261 AromaticContact CE2-CD2 3.74Å; F240-W261 HydrophobicContact CE2-CD2 3.74Å; F240-W261 AromaticContact CE2-CE3 3.92Å; F240-W261 HydrophobicContact CE2-CE3 3.92Å; F240-W261 HydrophobicContact CE2-CG 4.02Å; F240-W261 HydrophobicContact CE2-CZ3 4.46Å; F240-W261 HydrophobicContact CZ-CG 4.48Å; F240-L277 HydrophobicContact CZ-CD1 3.98Å; F240-V312 HydrophobicContact CD2-CB 4.47Å; F240-V312 HydrophobicContact CD2-CG1 4.24Å; F240-V312 HydrophobicContact CE1-CG1 4.49Å; F240-V312 HydrophobicContact CE2-CB 4.03Å; F240-V312 HydrophobicContact CE2-CG1 3.38Å; F240-V312 HydrophobicContact CZ-CB 4.19Å; F240-V312 HydrophobicContact CZ-CG1 3.56Å; F240-V312 HydrophobicContact CZ-CG2 4.41Å
241	F	91.3	Very high	79.4	Confident	22 Å²	22	77.5 Å²	77.5	10%	0.096	41%	0.413	C	S	.	.	H	α-helix	trans	-72.5	-28.3	-177.4	-78.2	-44.2	0	0	0	114	R237 E238 D239 A245 V283 F286 R287 L290	R237-F241 HydrophobicContact CG-CD2 3.85Å; R237-F241 HydrophobicContact CG-CE2 3.63Å; R237-F241 WeakPolarHBondContact O-CB 3.31Å; R237-F241 WeakPolarHBondContact O-CD2 3.44Å; R237-F241 WeakPolarHBondContact O-CG 3.33Å; R237-F241 PolarHBondContact O-N 2.86Å; R237-F241 VanDerWaalsContact O-N 3.08Å; E238-F241 PolarHBondContact O-N 2.81Å; E238-F241 VanDerWaalsContact O-N 3.09Å; D239-F241 PolarHBondContact O-N 2.83Å; F241-A245 PolarHBondContact O-N 2.9Å; F241-A245 VanDerWaalsContact O-N 3.13Å; F241-V283 HydrophobicContact CD1-CG1 4.04Å; F241-V283 HydrophobicContact CE1-CG1 3.96Å; F241-F286 HydrophobicContact CZ-CD1 4.39Å; F241-R287 HydrophobicContact CD2-CG 4.25Å; F241-R287 HydrophobicContact CE1-CB 3.76Å; F241-R287 HydrophobicContact CE1-CG 4.14Å; F241-R287 HydrophobicContact CE2-CB 4.15Å; F241-R287 HydrophobicContact CE2-CG 3.81Å; F241-R287 HydrophobicContact CZ-CB 3.55Å; F241-R287 HydrophobicContact CZ-CG 3.76Å; F241-R287 PolarHBondContact O-NH2 3.47Å; F241-L290 HydrophobicContact CE2-CD1 4.27Å; F241-L290 HydrophobicContact CZ-CD1 4.19Å
242	S	89.5	Confident	77.2	Confident	78 Å²	78	81.1 Å²	81.1	55%	0.545	43%	0.432	S	S	.	.	H	α-helix	trans	-71.4	-37.6	172.7	-67.2	0	0	0	0	112.3	E238 D239 I244 A245	E238-S242 PolarHBondContact O-N 2.81Å; E238-S242 PolarHBondContact O-OG 2.89Å; D239-S242 PolarHBondContact O-N 2.81Å; S242-I244 PolarHBondContact O-N 2.84Å; S242-A245 PolarHBondContact O-N 2.75Å
243	R	86	Confident	75.2	Confident	157 Å²	157	85.4 Å²	85.4	59%	0.592	45%	0.454	S	S	*	.	H	α-helix	trans	-68.7	-16.4	176.7	-70.4	169.3	-165.7	-102.2	4.9	114.4	D239 F240	D239-R243 VanDerWaalsContact CG-NH2 3.31Å; D239-R243 WeakPolarHBondContact O-CD 3.3Å; D239-R243 VanDerWaalsContact O-CG 3.23Å; D239-R243 WeakPolarHBondContact O-CG 3.29Å; D239-R243 PolarHBondContact O-N 3.35Å; D239-R243 VanDerWaalsContact O-N 3.1Å; D239-R243 IonicContact OD1-CZ 3.36Å; D239-R243 VanDerWaalsContact OD1-CZ 3.26Å; D239-R243 IonicContact OD1-NE 3.67Å; D239-R243 PolarHBondContact OD1-NE 2.94Å; D239-R243 IonicContact OD1-NH2 3.04Å; D239-R243 PolarHBondContact OD1-NH2 2.89Å; D239-R243 IonicContact OD2-CZ 3.81Å; D239-R243 IonicContact OD2-NE 3.52Å; D239-R243 PolarHBondContact OD2-NE 3.32Å; D239-R243 IonicContact OD2-NH2 2.97Å; D239-R243 PolarHBondContact OD2-NH2 2.82Å; F240-R243 PolarHBondContact O-N 3.11Å
244	I	83.6	Confident	72.9	Confident	28 Å²	28	92.7 Å²	92.7	14%	0.144	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118	8.2	-177.8	-54.4	161.4	0	0	0	110.1	F240 S242 W261 Q280 V283	F240-I244 HydrophobicContact CD1-CD1 4.48Å; F240-I244 HydrophobicContact CD2-CD1 3.6Å; F240-I244 HydrophobicContact CE1-CD1 4.1Å; F240-I244 HydrophobicContact CE2-CD1 3.13Å; F240-I244 HydrophobicContact CG-CD1 4.25Å; F240-I244 HydrophobicContact CZ-CD1 3.4Å; F240-I244 VanDerWaalsContact CZ-CD1 3.4Å; F240-I244 WeakPolarHBondContact O-CD1 3.35Å; F240-I244 PolarHBondContact O-N 2.78Å; S242-I244 PolarHBondContact O-N 2.84Å; I244-W261 HydrophobicContact CD1-CD2 4.34Å; I244-W261 HydrophobicContact CD1-CZ2 3.99Å; I244-W261 VanDerWaalsContact CD1-NE1 3.3Å; I244-W261 HydrophobicContact CG1-CZ2 4.41Å; I244-Q280 PolarHBondContact O-NE2 2.88Å; I244-Q280 PolarHBondContact O-OE1 3.27Å; I244-V283 HydrophobicContact CG2-CG1 4.12Å; I244-V283 HydrophobicContact CG2-CG2 4.14Å
245	A	75.9	Confident	70.7	Confident	43 Å²	43	93.6 Å²	93.6	36%	0.355	49%	0.487	S	S	.	.	S	Bend	trans	-67.5	138.7	163.3	0	0	0	0	0	108.9	F241 S242 Q247	F241-A245 PolarHBondContact O-N 2.9Å; F241-A245 VanDerWaalsContact O-N 3.13Å; S242-A245 PolarHBondContact O-N 2.75Å; A245-Q247 PolarHBondContact O-N 3.21Å
246	P	67.4	Low	68.4	Low	106 Å²	106	92.2 Å²	92.2	69%	0.688	49%	0.488	S	S	*	.			trans	-57.6	123.7	170.9	-22	34.3	0	0	0	109.4	E248	P246-E248 PolarHBondContact O-N 3.41Å
247	Q	59.1	Low	66.2	Low	132 Å²	132	96.3 Å²	96.3	62%	0.617	51%	0.507	S	S	*	.			trans	-78.2	113	173.8	-62.7	-92.3	-41.7	0	0	107.5	A245 G249 E250	A245-Q247 PolarHBondContact O-N 3.21Å; Q247-G249 PolarHBondContact O-N 2.9Å; Q247-E250 HydrophobicContact CB-CG 4.11Å
248	E	46.6	Very low	64.5	Low	202 Å²	202	98.2 Å²	98.2	94%	0.944	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	118.4	175.7	-66	-173	159.8	0	0	109.9	P246	P246-E248 PolarHBondContact O-N 3.41Å
249	G	53.6	Low	63.8	Low	70 Å²	70	96.9 Å²	96.9	72%	0.722	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	103	-7.3	173.1	0	0	0	0	0	117.4	Q247 T251	Q247-G249 PolarHBondContact O-N 2.9Å; G249-T251 PolarHBondContact O-N 2.87Å
250	E	48.7	Very low	63.7	Low	93 Å²	93	94.5 Å²	94.5	44%	0.435	51%	0.513	S	S	.	.			trans	-77	94.2	174.3	-68.9	-143.9	104.9	0	0	111.7	Q247 D252 K255	Q247-E250 HydrophobicContact CB-CG 4.11Å; E250-D252 VanDerWaalsContact C-N 3.27Å; E250-D252 PolarHBondContact O-N 3.35Å; E250-K255 IonicContact OE1-NZ 2.6Å; E250-K255 PolarHBondContact OE1-NZ 3.03Å; E250-K255 WeakPolarHBondContact OE2-CD 3.41Å; E250-K255 IonicContact OE2-NZ 2.61Å; E250-K255 PolarHBondContact OE2-NZ 2.86Å
251	T	46.2	Very low	63.8	Low	136 Å²	136	95.5 Å²	95.5	83%	0.834	52%	0.516	S	S	*	.			trans	-80.1	0.5	176	51.1	0	0	0	0	114.4	G249 L253	G249-T251 PolarHBondContact O-N 2.87Å; T251-L253 PolarHBondContact O-N 2.93Å
252	D	47.1	Very low	64	Low	87 Å²	87	95 Å²	95	47%	0.465	52%	0.515	S	S	.	.			trans	-80.3	101.3	-175.8	-168.2	-6.1	0	0	0	112.3	E250 K254 K255	E250-D252 VanDerWaalsContact C-N 3.27Å; E250-D252 PolarHBondContact O-N 3.35Å; D252-K254 PolarHBondContact O-N 3.41Å; D252-K254 WeakPolarHBondContact OD1-CB 3.45Å; D252-K254 PolarHBondContact OD1-N 3.08Å; D252-K254 VanDerWaalsContact OD1-N 3.09Å; D252-K255 PolarHBondContact O-N 2.89Å
253	L	45.7	Very low	64.2	Low	158 Å²	158	91.3 Å²	91.3	83%	0.827	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-9.6	176.5	-72.2	161.8	0	0	0	114.9	T251 T256	T251-L253 PolarHBondContact O-N 2.93Å; L253-T256 WeakPolarHBondContact CA-OG1 3.28Å; L253-T256 PolarHBondContact O-OG1 3.32Å
254	K	44	Very low	64.6	Low	183 Å²	183	84.6 Å²	84.6	80%	0.796	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-15.4	175.7	-67.2	175.9	178.6	172.7	0	114.5	D252	D252-K254 PolarHBondContact O-N 3.41Å; D252-K254 WeakPolarHBondContact OD1-CB 3.45Å; D252-K254 PolarHBondContact OD1-N 3.08Å; D252-K254 VanDerWaalsContact OD1-N 3.09Å
255	K	44.2	Very low	64.8	Low	129 Å²	129	83.4 Å²	83.4	56%	0.561	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-22	173.1	-91.1	-177.2	169.2	-176.4	0	113.3	E250 D252 E257	E250-K255 IonicContact OE1-NZ 2.6Å; E250-K255 PolarHBondContact OE1-NZ 3.03Å; E250-K255 WeakPolarHBondContact OE2-CD 3.41Å; E250-K255 IonicContact OE2-NZ 2.61Å; E250-K255 PolarHBondContact OE2-NZ 2.86Å; D252-K255 PolarHBondContact O-N 2.89Å; K255-E257 PolarHBondContact O-N 3.47Å
256	T	43.2	Very low	64.9	Low	99 Å²	99	82.6 Å²	82.6	61%	0.607	45%	0.449	S	S	*	.			trans	-79.6	32.5	-178.8	30.4	0	0	0	0	114.3	L253 S258	L253-T256 WeakPolarHBondContact CA-OG1 3.28Å; L253-T256 PolarHBondContact O-OG1 3.32Å; T256-S258 PolarHBondContact O-N 3.36Å
257	E	48.6	Very low	65.1	Low	116 Å²	116	80.5 Å²	80.5	54%	0.542	45%	0.447	S	S	.	.			trans	-64.9	93.9	151.6	-76.9	-154.4	161.7	0	0	107.9	K255 S259 K318	K255-E257 PolarHBondContact O-N 3.47Å; E257-S259 VanDerWaalsContact C-N 3.29Å; E257-S259 WeakPolarHBondContact O-CA 3.49Å; E257-S259 PolarHBondContact O-N 2.91Å; E257-S259 PolarHBondContact O-OG 3.35Å; E257-S259 VanDerWaalsContact O-OG 3.11Å; E257-K318 VanDerWaalsContact OE1-CE 3.24Å; E257-K318 WeakPolarHBondContact OE1-CE 3.27Å; E257-K318 IonicContact OE1-NZ 3.89Å; E257-K318 PolarHBondContact OE1-NZ 3.48Å; E257-K318 IonicContact OE2-NZ 2.78Å
258	S	57.6	Low	66	Low	70 Å²	70	76.8 Å²	76.8	49%	0.49	43%	0.431	S	S	.	.			trans	-50	95	173.8	-177.1	0	0	0	0	109.1	T256 M260 K278 Q317	T256-S258 PolarHBondContact O-N 3.36Å; S258-M260 PolarHBondContact O-N 2.89Å; S258-K278 PolarHBondContact OG-O 2.95Å; S258-Q317 PolarHBondContact O-OE1 3.13Å
259	S	75.9	Confident	67.3	Low	65 Å²	65	71.8 Å²	71.8	46%	0.455	41%	0.411	S	S	.	.			trans	-72.8	101.5	-165.3	-76.7	0	0	0	0	107.9	E257 W261	E257-S259 VanDerWaalsContact C-N 3.29Å; E257-S259 WeakPolarHBondContact O-CA 3.49Å; E257-S259 PolarHBondContact O-N 2.91Å; E257-S259 PolarHBondContact O-OG 3.35Å; E257-S259 VanDerWaalsContact O-OG 3.11Å; S259-W261 PolarHBondContact O-NE1 3.47Å
260	M	91.1	Very high	68.4	Low	10 Å²	10	73.8 Å²	73.8	5%	0.049	40%	0.396	C	S	.	.			trans	-64.1	140.1	179.8	-171.4	177.4	-54.2	0	0	110.1	S258 L276 L277 K278 Y315 P359	S258-M260 PolarHBondContact O-N 2.89Å; M260-L276 HydrophobicContact SD-CD1 3.95Å; M260-L277 WeakPolarHBondContact CA-O 3.23Å; M260-L277 WeakPolarHBondContact CG-O 3.42Å; M260-K278 HydrophobicContact CE-CB 4.28Å; M260-K278 HydrophobicContact CE-CD 3.79Å; M260-K278 HydrophobicContact CE-CG 3.79Å; M260-K278 HydrophobicContact CG-CG 4.22Å; M260-K278 HydrophobicContact SD-CD 4.34Å; M260-K278 HydrophobicContact SD-CG 4.02Å; M260-Y315 HydrophobicContact CB-CD1 4.14Å; M260-Y315 HydrophobicContact CB-CG 4.43Å; M260-Y315 HydrophobicContact CG-CD1 3.95Å; M260-Y315 HydrophobicContact CG-CG 4.11Å; M260-Y315 WeakPolarHBondContact O-CB 3.4Å; M260-Y315 PolarHBondContact O-N 3.49Å; M260-Y315 HydrophobicContact SD-CD1 3.45Å; M260-Y315 WeakPolarHBondContact SD-CD1 3.49Å; M260-Y315 HydrophobicContact SD-CE1 3.67Å; M260-Y315 HydrophobicContact SD-CG 4.05Å; M260-P359 WeakPolarHBondContact CE-O 3.37Å
261	W	94.8	Very high	69.6	Low	21 Å²	21	69.7 Å²	69.7	8%	0.08	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	156.5	173.7	-55.1	81	0	0	0	110.8	T227 F229 F240 I244 S259 L276 L277 V312 Q313 R314	T227-W261 HydrophobicContact CG2-CH2 4.48Å; F229-W261 HydrophobicContact CD2-CH2 4.43Å; F229-W261 AromaticContact CD2-CZ3 3.94Å; F229-W261 HydrophobicContact CD2-CZ3 3.94Å; F229-W261 AromaticContact CE2-CH2 3.76Å; F229-W261 HydrophobicContact CE2-CH2 3.76Å; F229-W261 AromaticContact CE2-CZ3 3.69Å; F229-W261 HydrophobicContact CE2-CZ3 3.69Å; F240-W261 HydrophobicContact CD2-CE3 4.45Å; F240-W261 AromaticContact CE2-CD2 3.74Å; F240-W261 HydrophobicContact CE2-CD2 3.74Å; F240-W261 AromaticContact CE2-CE3 3.92Å; F240-W261 HydrophobicContact CE2-CE3 3.92Å; F240-W261 HydrophobicContact CE2-CG 4.02Å; F240-W261 HydrophobicContact CE2-CZ3 4.46Å; F240-W261 HydrophobicContact CZ-CG 4.48Å; I244-W261 HydrophobicContact CD1-CD2 4.34Å; I244-W261 HydrophobicContact CD1-CZ2 3.99Å; I244-W261 VanDerWaalsContact CD1-NE1 3.3Å; I244-W261 HydrophobicContact CG1-CZ2 4.41Å; S259-W261 PolarHBondContact O-NE1 3.47Å; W261-L276 CarbonylContact O-C 3.5Å; W261-L276 WeakPolarHBondContact O-CA 3.25Å; W261-L277 HydrophobicContact CB-CB 4.25Å; W261-L277 HydrophobicContact CB-CD1 4.32Å; W261-L277 PolarHBondContact N-O 3.19Å; W261-L277 PolarHBondContact O-N 3.49Å; W261-V312 HydrophobicContact CB-CG1 3.52Å; W261-V312 HydrophobicContact CD2-CG1 4.2Å; W261-V312 HydrophobicContact CE3-CG1 3.99Å; W261-V312 HydrophobicContact CG-CG1 4Å; W261-Q313 CarbonylContact C-O 3.49Å; W261-Q313 WeakPolarHBondContact CA-O 3.49Å; W261-Q313 VanDerWaalsContact CE3-C 3.44Å; W261-R314 VanDerWaalsContact CE3-CA 3.44Å; W261-R314 HydrophobicContact CE3-CB 3.98Å; W261-R314 HydrophobicContact CH2-CB 4.11Å; W261-R314 HydrophobicContact CZ3-CB 3.69Å
262	I	95.2	Very high	71.3	Confident	12 Å²	12	66.2 Å²	66.2	6%	0.062	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	115	174.9	-178.5	166.9	0	0	0	108.7	K264 I274 L276 Q313 Y315 L368	I262-K264 HydrophobicContact CG1-CG 4.04Å; I262-I274 HydrophobicContact CD1-CG2 3.72Å; I262-I274 HydrophobicContact CG1-CG2 3.67Å; I262-L276 HydrophobicContact CB-CD2 3.79Å; I262-L276 HydrophobicContact CD1-CD2 4.15Å; I262-L276 HydrophobicContact CG1-CD2 3.91Å; I262-Q313 HydrophobicContact CG2-CB 4.14Å; I262-Q313 VanDerWaalsContact CG2-O 3.31Å; I262-Q313 WeakPolarHBondContact CG2-O 3.43Å; I262-Q313 PolarHBondContact N-O 3.22Å; I262-Q313 PolarHBondContact O-N 3.43Å; I262-Y315 HydrophobicContact CB-CD2 3.97Å; I262-Y315 HydrophobicContact CD1-CD2 4.3Å; I262-Y315 HydrophobicContact CD1-CE2 4.41Å; I262-Y315 HydrophobicContact CG2-CD2 4.14Å; I262-L368 HydrophobicContact CD1-CD2 3.98Å
263	C	94.8	Very high	73.1	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	126.5	175.7	-165.4	0	0	0	0	108.9	I274 F275 H310 V312	C263-I274 WeakPolarHBondContact O-CA 3.33Å; C263-F275 HydrophobicContact CB-CD1 4.06Å; C263-F275 HydrophobicContact CB-CD2 4.02Å; C263-F275 HydrophobicContact CB-CE1 3.71Å; C263-F275 HydrophobicContact CB-CE2 3.68Å; C263-F275 HydrophobicContact CB-CG 4.21Å; C263-F275 HydrophobicContact CB-CZ 3.51Å; C263-F275 PolarHBondContact N-O 2.92Å; C263-F275 PolarHBondContact O-N 2.82Å; C263-F275 WeakPolarHBondContact SG-CZ 3.12Å; C263-H310 VanDerWaalsContact SG-CD2 3.58Å; C263-V312 HydrophobicContact CB-CG2 4.21Å
264	K	93.3	Very high	75.2	Confident	16 Å²	16	57.9 Å²	57.9	7%	0.07	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	110.4	-175.2	-58.4	176.9	175.9	176.8	0	110	K193 I262 I274 I311	K193-K264 HydrophobicContact CD-CB 3.97Å; I262-K264 HydrophobicContact CG1-CG 4.04Å; K264-I274 HydrophobicContact CG-CD1 4.3Å; K264-I274 HydrophobicContact CG-CG1 4.41Å; K264-I311 HydrophobicContact CB-CD1 4.43Å; K264-I311 HydrophobicContact CB-CG1 3.91Å; K264-I311 HydrophobicContact CD-CD1 4.38Å; K264-I311 PolarHBondContact N-O 3.27Å; K264-I311 PolarHBondContact O-N 3.49Å
265	P	88.6	Confident	77.5	Confident	3 Å²	3	52 Å²	52	2%	0.019	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	139.9	169.4	21.1	-30.1	0	0	0	110.8	L268 G273 Q308	P265-L268 HydrophobicContact CB-CB 4.48Å; P265-L268 HydrophobicContact CB-CD1 4.2Å; P265-L268 HydrophobicContact CB-CG 4.23Å; P265-L268 HydrophobicContact CG-CB 4.14Å; P265-L268 HydrophobicContact CG-CD1 3.82Å; P265-L268 HydrophobicContact CG-CG 4.16Å; P265-G273 WeakPolarHBondContact CD-O 3.44Å; P265-G273 WeakPolarHBondContact CG-O 3.47Å; P265-Q308 HydrophobicContact CB-CG 4.17Å
266	T	78	Confident	79.9	Confident	26 Å²	26	46.8 Å²	46.8	16%	0.16	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-13.2	-165.6	66.1	0	0	0	0	114.1	K193 I194 P309 I311	K193-T266 HydrophobicContact CB-CG2 4.29Å; I194-T266 HydrophobicContact CD1-CG2 3.74Å; I194-T266 HydrophobicContact CG1-CG2 3.73Å; T266-P309 HydrophobicContact CG2-CB 4.21Å; T266-P309 WeakPolarHBondContact CG2-O 3.28Å; T266-P309 PolarHBondContact N-O 2.91Å; T266-P309 WeakPolarHBondContact OG1-CB 3.47Å; T266-P309 PolarHBondContact OG1-O 3.34Å; T266-I311 HydrophobicContact CG2-CG2 4.08Å
267	G	71	Confident	82.3	Confident	63 Å²	63	42.3 Å²	42.3	65%	0.649	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-2.4	176.1	0	0	0	0	0	115
268	L	77.2	Confident	84.3	Confident	54 Å²	54	39 Å²	39	28%	0.283	23%	0.228	S	C	.	.			trans	-107	155.3	-178.8	-56.9	-175.3	0	0	0	112.4	P265 K272	P265-L268 HydrophobicContact CB-CB 4.48Å; P265-L268 HydrophobicContact CB-CD1 4.2Å; P265-L268 HydrophobicContact CB-CG 4.23Å; P265-L268 HydrophobicContact CG-CB 4.14Å; P265-L268 HydrophobicContact CG-CD1 3.82Å; P265-L268 HydrophobicContact CG-CG 4.16Å; L268-K272 HydrophobicContact CB-CB 4.32Å; L268-K272 HydrophobicContact CD1-CB 4.09Å; L268-K272 WeakPolarHBondContact CD1-O 3.47Å
269	N	74.5	Confident	85.7	Confident	97 Å²	97	38.6 Å²	38.6	52%	0.519	22%	0.221	S	C	.	.			trans	-128.6	-173.8	178.3	66.3	17.8	0	0	0	110.6	G271 K272	N269-G271 PolarHBondContact O-N 3.02Å; N269-K272 PolarHBondContact O-N 2.97Å
270	R	76.9	Confident	86.2	Confident	112 Å²	112	38.7 Å²	38.7	42%	0.423	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	8.6	175	-63.7	175.5	-178.9	-175.4	2	115.8	Y372	R270-Y372 HydrophobicContact CB-CD1 3.76Å; R270-Y372 HydrophobicContact CB-CE1 4.49Å; R270-Y372 HydrophobicContact CB-CG 3.78Å; R270-Y372 HydrophobicContact CG-CG 4.29Å; R270-Y372 WeakPolarHBondContact O-CD1 3.31Å
271	G	74.3	Confident	86.1	Confident	6 Å²	6	44 Å²	44	6%	0.062	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	91	-1.9	-174.1	0	0	0	0	0	114.9	N269 G273 I274	N269-G271 PolarHBondContact O-N 3.02Å; G271-G273 PolarHBondContact O-N 3.48Å; G271-I274 PolarHBondContact O-N 2.7Å
272	K	80.8	Confident	85.9	Confident	63 Å²	63	45.4 Å²	45.4	27%	0.274	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	133.8	179.3	-71.5	-164.9	177	-165	0	111.3	E49 L268 N269 I274	E49-K272 IonicContact OE1-NZ 2.7Å; E49-K272 PolarHBondContact OE1-NZ 3.28Å; L268-K272 HydrophobicContact CB-CB 4.32Å; L268-K272 HydrophobicContact CD1-CB 4.09Å; L268-K272 WeakPolarHBondContact CD1-O 3.47Å; N269-K272 PolarHBondContact O-N 2.97Å; K272-I274 PolarHBondContact O-N 2.81Å
273	G	85.3	Confident	85.7	Confident	47 Å²	47	45 Å²	45	49%	0.485	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	7.7	176.4	0	0	0	0	0	115.7	P265 G271	P265-G273 WeakPolarHBondContact CD-O 3.44Å; P265-G273 WeakPolarHBondContact CG-O 3.47Å; G271-G273 PolarHBondContact O-N 3.48Å
274	I	90.6	Very high	85.5	Confident	24 Å²	24	47.6 Å²	47.6	12%	0.123	27%	0.267	C	S	.	.			trans	-77.2	136.6	172.2	-63.4	-174.5	0	0	0	109.6	I262 C263 K264 G271 K272 L368	I262-I274 HydrophobicContact CD1-CG2 3.72Å; I262-I274 HydrophobicContact CG1-CG2 3.67Å; C263-I274 WeakPolarHBondContact O-CA 3.33Å; K264-I274 HydrophobicContact CG-CD1 4.3Å; K264-I274 HydrophobicContact CG-CG1 4.41Å; G271-I274 PolarHBondContact O-N 2.7Å; K272-I274 PolarHBondContact O-N 2.81Å; I274-L368 HydrophobicContact CB-CD1 4.14Å; I274-L368 HydrophobicContact CG2-CD1 4.03Å; I274-L368 HydrophobicContact CG2-CD2 4.12Å
275	F	92.8	Very high	85.4	Confident	58 Å²	58	52.8 Å²	52.8	25%	0.254	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	165.4	170.9	58.6	-80.1	0	0	0	110.6	C263 L277 F286	C263-F275 HydrophobicContact CB-CD1 4.06Å; C263-F275 HydrophobicContact CB-CD2 4.02Å; C263-F275 HydrophobicContact CB-CE1 3.71Å; C263-F275 HydrophobicContact CB-CE2 3.68Å; C263-F275 HydrophobicContact CB-CG 4.21Å; C263-F275 HydrophobicContact CB-CZ 3.51Å; C263-F275 PolarHBondContact N-O 2.92Å; C263-F275 PolarHBondContact O-N 2.82Å; C263-F275 WeakPolarHBondContact SG-CZ 3.12Å; F275-L277 HydrophobicContact CD2-CD2 4.16Å; F275-L277 HydrophobicContact CE2-CD2 3.88Å; F275-F286 AromaticContact CE2-CD2 3.89Å; F275-F286 HydrophobicContact CE2-CD2 3.89Å; F275-F286 HydrophobicContact CE2-CE2 4.33Å; F275-F286 HydrophobicContact CE2-CG 4.32Å; F275-F286 AromaticContact CZ-CD2 3.62Å; F275-F286 HydrophobicContact CZ-CD2 3.62Å; F275-F286 AromaticContact CZ-CE2 3.68Å; F275-F286 HydrophobicContact CZ-CE2 3.68Å; F275-F286 HydrophobicContact CZ-CG 4.45Å
276	L	93.9	Very high	85.6	Confident	21 Å²	21	52.9 Å²	52.9	11%	0.11	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	153.2	177.8	-59.4	175.6	0	0	0	109.7	M260 W261 I262 K278 Y315 L364 H367	M260-L276 HydrophobicContact SD-CD1 3.95Å; W261-L276 CarbonylContact O-C 3.5Å; W261-L276 WeakPolarHBondContact O-CA 3.25Å; I262-L276 HydrophobicContact CB-CD2 3.79Å; I262-L276 HydrophobicContact CD1-CD2 4.15Å; I262-L276 HydrophobicContact CG1-CD2 3.91Å; L276-K278 HydrophobicContact CB-CG 4.17Å; L276-Y315 HydrophobicContact CD2-CD2 3.75Å; L276-Y315 HydrophobicContact CD2-CE2 3.72Å; L276-Y315 HydrophobicContact CD2-CG 4.42Å; L276-L364 HydrophobicContact CD1-CD1 4.5Å; L276-L364 HydrophobicContact CG-CD1 4.4Å; L276-H367 HydrophobicContact CD1-CB 4.23Å; L276-H367 WeakPolarHBondContact CD1-CD2 3.21Å
277	L	93.3	Very high	86.2	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.021	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	106.2	164.9	-53.1	173.4	0	0	0	105.5	F240 M260 W261 F275 D282 V283 F286 V312	F240-L277 HydrophobicContact CZ-CD1 3.98Å; M260-L277 WeakPolarHBondContact CA-O 3.23Å; M260-L277 WeakPolarHBondContact CG-O 3.42Å; W261-L277 HydrophobicContact CB-CB 4.25Å; W261-L277 HydrophobicContact CB-CD1 4.32Å; W261-L277 PolarHBondContact N-O 3.19Å; W261-L277 PolarHBondContact O-N 3.49Å; F275-L277 HydrophobicContact CD2-CD2 4.16Å; F275-L277 HydrophobicContact CE2-CD2 3.88Å; L277-D282 HydrophobicContact CB-CB 4.23Å; L277-D282 HydrophobicContact CD2-CB 3.9Å; L277-V283 HydrophobicContact CB-CG2 4.03Å; L277-V283 HydrophobicContact CD1-CG2 4.28Å; L277-F286 HydrophobicContact CD1-CD1 4.01Å; L277-F286 HydrophobicContact CD2-CB 3.9Å; L277-F286 HydrophobicContact CD2-CG 4.29Å; L277-V312 HydrophobicContact CD1-CG1 4.14Å
278	K	89.6	Confident	87.1	Confident	46 Å²	46	58.1 Å²	58.1	20%	0.2	30%	0.297	C	S	.	.			trans	-99.7	-30.3	-172.8	-60.8	-157.5	175.9	-159.7	0	113.4	S258 M260 L276 D282 P359 T360 S361 H367	S258-K278 PolarHBondContact OG-O 2.95Å; M260-K278 HydrophobicContact CE-CB 4.28Å; M260-K278 HydrophobicContact CE-CD 3.79Å; M260-K278 HydrophobicContact CE-CG 3.79Å; M260-K278 HydrophobicContact CG-CG 4.22Å; M260-K278 HydrophobicContact SD-CD 4.34Å; M260-K278 HydrophobicContact SD-CG 4.02Å; L276-K278 HydrophobicContact CB-CG 4.17Å; K278-D282 PolarHBondContact N-OD2 2.88Å; K278-P359 PolarHBondContact NZ-O 3.5Å; K278-T360 PolarHBondContact NZ-O 2.94Å; K278-S361 PolarHBondContact NZ-O 2.68Å; K278-H367 PolarHBondContact NZ-NE2 3.15Å; K278-H367 VanDerWaalsContact NZ-NE2 3.11Å
279	N	87.2	Confident	87.7	Confident	63 Å²	63	60.3 Å²	60.3	34%	0.337	30%	0.304	S	S	.	.	S	Bend	trans	-139.1	-177	-174	63.4	2.8	0	0	0	110.8	E281 D282 V283	N279-E281 VanDerWaalsContact C-N 3.33Å; N279-E281 VanDerWaalsContact CB-OE2 3.23Å; N279-E281 WeakPolarHBondContact CB-OE2 3.36Å; N279-E281 PolarHBondContact ND2-OE2 2.71Å; N279-E281 PolarHBondContact OD1-N 2.99Å; N279-D282 WeakPolarHBondContact OD1-CB 2.77Å; N279-D282 PolarHBondContact OD1-N 3.34Å; N279-D282 PolarHBondContact OD1-OD1 3.36Å; N279-D282 PolarHBondContact OD1-OD2 2.86Å; N279-V283 WeakPolarHBondContact O-CG2 3.5Å; N279-V283 PolarHBondContact O-N 3.43Å
280	Q	86.9	Confident	88.3	Confident	66 Å²	66	56.2 Å²	56.2	31%	0.308	28%	0.282	S	S	.	.	H	α-helix	trans	-74.8	-26.9	-177.3	-163.5	64.4	1.4	0	0	112.5	I244 V283 A284	I244-Q280 PolarHBondContact O-NE2 2.88Å; I244-Q280 PolarHBondContact O-OE1 3.27Å; Q280-V283 PolarHBondContact O-N 3.35Å; Q280-A284 WeakPolarHBondContact O-CB 3.46Å; Q280-A284 PolarHBondContact O-N 3.24Å
281	E	89.4	Confident	88.8	Confident	121 Å²	121	55.2 Å²	55.2	57%	0.565	28%	0.282	S	S	*	.	H	α-helix	trans	-65.3	-47.7	177.5	-62.1	68.2	-151.2	0	0	110.9	N279 V283 A284 E285	N279-E281 VanDerWaalsContact C-N 3.33Å; N279-E281 VanDerWaalsContact CB-OE2 3.23Å; N279-E281 WeakPolarHBondContact CB-OE2 3.36Å; N279-E281 PolarHBondContact ND2-OE2 2.71Å; N279-E281 PolarHBondContact OD1-N 2.99Å; E281-V283 VanDerWaalsContact C-N 3.28Å; E281-V283 PolarHBondContact O-N 3.25Å; E281-A284 PolarHBondContact O-N 2.97Å; E281-E285 PolarHBondContact O-N 3.07Å
282	D	91.2	Very high	89.3	Confident	51 Å²	51	61.2 Å²	61.2	27%	0.273	31%	0.306	S	S	.	.	H	α-helix	trans	-57.6	-42.1	174	-67.4	-23.2	0	0	0	111	L277 K278 N279 F286	L277-D282 HydrophobicContact CB-CB 4.23Å; L277-D282 HydrophobicContact CD2-CB 3.9Å; K278-D282 PolarHBondContact N-OD2 2.88Å; N279-D282 WeakPolarHBondContact OD1-CB 2.77Å; N279-D282 PolarHBondContact OD1-N 3.34Å; N279-D282 PolarHBondContact OD1-OD1 3.36Å; N279-D282 PolarHBondContact OD1-OD2 2.86Å; D282-F286 VanDerWaalsContact O-CB 3.29Å; D282-F286 WeakPolarHBondContact O-CB 3.42Å; D282-F286 PolarHBondContact O-N 3.34Å
283	V	90.1	Very high	89.3	Confident	4 Å²	4	61 Å²	61	2%	0.024	31%	0.307	C	S	.	.	H	α-helix	trans	-67.7	-37.6	179.5	174.9	0	0	0	0	111.3	F241 I244 L277 N279 Q280 E281 R287	F241-V283 HydrophobicContact CD1-CG1 4.04Å; F241-V283 HydrophobicContact CE1-CG1 3.96Å; I244-V283 HydrophobicContact CG2-CG1 4.12Å; I244-V283 HydrophobicContact CG2-CG2 4.14Å; L277-V283 HydrophobicContact CB-CG2 4.03Å; L277-V283 HydrophobicContact CD1-CG2 4.28Å; N279-V283 WeakPolarHBondContact O-CG2 3.5Å; N279-V283 PolarHBondContact O-N 3.43Å; Q280-V283 PolarHBondContact O-N 3.35Å; E281-V283 VanDerWaalsContact C-N 3.28Å; E281-V283 PolarHBondContact O-N 3.25Å; V283-R287 WeakPolarHBondContact O-CB 3.46Å; V283-R287 PolarHBondContact O-N 3.18Å
284	A	90.4	Very high	89	Confident	54 Å²	54	63 Å²	63	45%	0.446	30%	0.304	S	S	.	.	H	α-helix	trans	-70.3	-44.7	176.5	0	0	0	0	0	112.1	Q280 E281 F286 R287 L288	Q280-A284 WeakPolarHBondContact O-CB 3.46Å; Q280-A284 PolarHBondContact O-N 3.24Å; E281-A284 PolarHBondContact O-N 2.97Å; A284-F286 VanDerWaalsContact C-N 3.31Å; A284-F286 PolarHBondContact O-N 3.48Å; A284-R287 PolarHBondContact O-N 3.34Å; A284-L288 PolarHBondContact O-N 3.42Å
285	E	91.9	Very high	88.5	Confident	125 Å²	125	67.6 Å²	67.6	58%	0.584	33%	0.325	S	S	*	.	H	α-helix	trans	-59.3	-45.1	173.5	-165.3	-154.1	127.4	0	0	110.3	E281 R287 L288 K289	E281-E285 PolarHBondContact O-N 3.07Å; E285-R287 VanDerWaalsContact C-N 3.35Å; E285-R287 PolarHBondContact O-N 3.13Å; E285-L288 PolarHBondContact O-N 3.12Å; E285-K289 VanDerWaalsContact O-CB 3.26Å; E285-K289 WeakPolarHBondContact O-CB 3.33Å; E285-K289 PolarHBondContact O-N 3.07Å
286	F	91.8	Very high	87.6	Confident	6 Å²	6	68.9 Å²	68.9	3%	0.026	33%	0.334	C	S	.	.	H	α-helix	trans	-64.2	-37.2	178.2	-176.9	-121.4	0	0	0	112.8	M231 F241 F275 L277 D282 A284 K289 L290 V312	M231-F286 HydrophobicContact CG-CE1 3.98Å; M231-F286 HydrophobicContact CG-CZ 3.94Å; M231-F286 HydrophobicContact SD-CE1 3.83Å; M231-F286 HydrophobicContact SD-CZ 4.38Å; F241-F286 HydrophobicContact CZ-CD1 4.39Å; F275-F286 AromaticContact CE2-CD2 3.89Å; F275-F286 HydrophobicContact CE2-CD2 3.89Å; F275-F286 HydrophobicContact CE2-CE2 4.33Å; F275-F286 HydrophobicContact CE2-CG 4.32Å; F275-F286 AromaticContact CZ-CD2 3.62Å; F275-F286 HydrophobicContact CZ-CD2 3.62Å; F275-F286 AromaticContact CZ-CE2 3.68Å; F275-F286 HydrophobicContact CZ-CE2 3.68Å; F275-F286 HydrophobicContact CZ-CG 4.45Å; L277-F286 HydrophobicContact CD1-CD1 4.01Å; L277-F286 HydrophobicContact CD2-CB 3.9Å; L277-F286 HydrophobicContact CD2-CG 4.29Å; D282-F286 VanDerWaalsContact O-CB 3.29Å; D282-F286 WeakPolarHBondContact O-CB 3.42Å; D282-F286 PolarHBondContact O-N 3.34Å; A284-F286 VanDerWaalsContact C-N 3.31Å; A284-F286 PolarHBondContact O-N 3.48Å; F286-K289 PolarHBondContact O-N 2.77Å; F286-L290 HydrophobicContact CD1-CD1 4.32Å; F286-L290 HydrophobicContact CD2-CG 4.46Å; F286-L290 HydrophobicContact CE1-CD1 3.73Å; F286-L290 HydrophobicContact CE1-CG 4.33Å; F286-L290 HydrophobicContact CE2-CD1 4.28Å; F286-L290 HydrophobicContact CE2-CD2 4.08Å; F286-L290 HydrophobicContact CE2-CG 4.01Å; F286-L290 HydrophobicContact CZ-CD1 3.72Å; F286-L290 HydrophobicContact CZ-CD2 4.05Å; F286-L290 HydrophobicContact CZ-CG 3.95Å; F286-L290 WeakPolarHBondContact O-CG 3.39Å; F286-L290 PolarHBondContact O-N 2.65Å; F286-V312 HydrophobicContact CE1-CG2 3.66Å; F286-V312 HydrophobicContact CZ-CG2 4.14Å
287	R	91.1	Very high	86.4	Confident	85 Å²	85	71.8 Å²	71.8	32%	0.321	35%	0.347	S	S	.	.	H	α-helix	trans	-61.4	-50.8	173.3	-171.5	-179.5	-64.1	175	2.3	111.6	F241 V283 A284 E285 K289 L290 Q291	F241-R287 HydrophobicContact CD2-CG 4.25Å; F241-R287 HydrophobicContact CE1-CB 3.76Å; F241-R287 HydrophobicContact CE1-CG 4.14Å; F241-R287 HydrophobicContact CE2-CB 4.15Å; F241-R287 HydrophobicContact CE2-CG 3.81Å; F241-R287 HydrophobicContact CZ-CB 3.55Å; F241-R287 HydrophobicContact CZ-CG 3.76Å; F241-R287 PolarHBondContact O-NH2 3.47Å; V283-R287 WeakPolarHBondContact O-CB 3.46Å; V283-R287 PolarHBondContact O-N 3.18Å; A284-R287 PolarHBondContact O-N 3.34Å; E285-R287 VanDerWaalsContact C-N 3.35Å; E285-R287 PolarHBondContact O-N 3.13Å; R287-K289 VanDerWaalsContact C-N 3.3Å; R287-K289 PolarHBondContact O-N 2.97Å; R287-L290 PolarHBondContact O-N 3.21Å; R287-Q291 WeakPolarHBondContact O-CG 3.49Å; R287-Q291 PolarHBondContact O-N 3.26Å; R287-Q291 PolarHBondContact O-OE1 2.87Å
288	L	90.8	Very high	85.2	Confident	113 Å²	113	75.7 Å²	75.7	59%	0.592	38%	0.38	S	S	*	.	H	α-helix	trans	-60.6	-40.1	178.1	-177.6	64.1	0	0	0	111.8	A284 E285 Q291 K292	A284-L288 PolarHBondContact O-N 3.42Å; E285-L288 PolarHBondContact O-N 3.12Å; L288-Q291 PolarHBondContact O-N 2.97Å; L288-K292 WeakPolarHBondContact O-CB 3.43Å; L288-K292 PolarHBondContact O-N 2.94Å
289	K	89.1	Confident	84	Confident	100 Å²	100	80.2 Å²	80.2	44%	0.435	41%	0.406	S	S	.	.	H	α-helix	trans	-62.2	-42.1	175.7	-174.6	174.7	-174.6	169.9	0	112.3	E285 F286 R287 M293	E285-K289 VanDerWaalsContact O-CB 3.26Å; E285-K289 WeakPolarHBondContact O-CB 3.33Å; E285-K289 PolarHBondContact O-N 3.07Å; F286-K289 PolarHBondContact O-N 2.77Å; R287-K289 VanDerWaalsContact C-N 3.3Å; R287-K289 PolarHBondContact O-N 2.97Å; K289-M293 HydrophobicContact CG-SD 4.1Å; K289-M293 WeakPolarHBondContact O-CB 3.43Å; K289-M293 WeakPolarHBondContact O-CG 3.09Å; K289-M293 PolarHBondContact O-N 2.8Å; K289-M293 VanDerWaalsContact O-N 3.13Å
290	L	87.3	Confident	82.7	Confident	12 Å²	12	83.6 Å²	83.6	6%	0.063	41%	0.414	C	S	.	.	H	α-helix	trans	-66	-43.2	174.7	-71.9	179.7	0	0	0	112.1	M231 R237 F241 F286 R287 M293 E294	M231-L290 HydrophobicContact CB-CD1 4.14Å; M231-L290 HydrophobicContact CG-CD1 4.38Å; M231-L290 HydrophobicContact SD-CD1 4.17Å; R237-L290 HydrophobicContact CG-CD1 4.38Å; F241-L290 HydrophobicContact CE2-CD1 4.27Å; F241-L290 HydrophobicContact CZ-CD1 4.19Å; F286-L290 HydrophobicContact CD1-CD1 4.32Å; F286-L290 HydrophobicContact CD2-CG 4.46Å; F286-L290 HydrophobicContact CE1-CD1 3.73Å; F286-L290 HydrophobicContact CE1-CG 4.33Å; F286-L290 HydrophobicContact CE2-CD1 4.28Å; F286-L290 HydrophobicContact CE2-CD2 4.08Å; F286-L290 HydrophobicContact CE2-CG 4.01Å; F286-L290 HydrophobicContact CZ-CD1 3.72Å; F286-L290 HydrophobicContact CZ-CD2 4.05Å; F286-L290 HydrophobicContact CZ-CG 3.95Å; F286-L290 WeakPolarHBondContact O-CG 3.39Å; F286-L290 PolarHBondContact O-N 2.65Å; R287-L290 PolarHBondContact O-N 3.21Å; L290-M293 PolarHBondContact O-N 2.69Å; L290-E294 PolarHBondContact O-N 2.84Å
291	Q	86.3	Confident	81.3	Confident	90 Å²	90	90.6 Å²	90.6	42%	0.421	44%	0.444	S	S	.	.	H	α-helix	trans	-59.6	-52.5	177.5	-71.2	169	-52.9	0	0	111.3	R287 L288 M293 E294 E295	R287-Q291 WeakPolarHBondContact O-CG 3.49Å; R287-Q291 PolarHBondContact O-N 3.26Å; R287-Q291 PolarHBondContact O-OE1 2.87Å; L288-Q291 PolarHBondContact O-N 2.97Å; Q291-M293 PolarHBondContact O-N 2.88Å; Q291-E294 WeakPolarHBondContact O-CB 3.31Å; Q291-E294 PolarHBondContact O-N 2.98Å; Q291-E295 WeakPolarHBondContact O-CG 3.38Å; Q291-E295 PolarHBondContact O-N 2.83Å
292	K	85.6	Confident	79.4	Confident	132 Å²	132	89.2 Å²	89.2	57%	0.574	44%	0.444	S	S	*	.	H	α-helix	trans	-58.4	-32.8	177	-175.2	169.4	-175.2	168.3	0	113.2	L288 L296	L288-K292 WeakPolarHBondContact O-CB 3.43Å; L288-K292 PolarHBondContact O-N 2.94Å; K292-L296 HydrophobicContact CG-CD1 4.29Å; K292-L296 WeakPolarHBondContact O-CB 3.24Å; K292-L296 WeakPolarHBondContact O-CD1 3.17Å; K292-L296 WeakPolarHBondContact O-CG 3.35Å; K292-L296 PolarHBondContact O-N 2.75Å; K292-L296 VanDerWaalsContact O-N 3.17Å
293	M	80.8	Confident	77.5	Confident	58 Å²	58	91.4 Å²	91.4	29%	0.286	46%	0.461	S	S	.	.	H	α-helix	trans	-73.5	-35	176	-73.3	172.2	60.1	0	0	112.4	K289 L290 Q291 Q297 I307	K289-M293 HydrophobicContact CG-SD 4.1Å; K289-M293 WeakPolarHBondContact O-CB 3.43Å; K289-M293 WeakPolarHBondContact O-CG 3.09Å; K289-M293 PolarHBondContact O-N 2.8Å; K289-M293 VanDerWaalsContact O-N 3.13Å; L290-M293 PolarHBondContact O-N 2.69Å; Q291-M293 PolarHBondContact O-N 2.88Å; M293-Q297 WeakPolarHBondContact O-CG 3.45Å; M293-Q297 PolarHBondContact O-N 2.91Å; M293-I307 HydrophobicContact CB-CD1 3.75Å; M293-I307 HydrophobicContact CB-CG1 4.25Å; M293-I307 HydrophobicContact CE-CB 4.29Å; M293-I307 HydrophobicContact CE-CD1 4.38Å; M293-I307 HydrophobicContact CE-CG1 3.93Å; M293-I307 HydrophobicContact CE-CG2 3.57Å
294	E	78.9	Confident	75.4	Confident	89 Å²	89	99.2 Å²	99.2	42%	0.416	50%	0.497	S	S	.	.	H	α-helix	trans	-69.6	-43	175.9	-168.4	166.9	-153.3	0	0	111.6	R237 L290 Q291 L296 Q297 A298	R237-E294 IonicContact CZ-OE1 3.57Å; R237-E294 IonicContact CZ-OE2 2.94Å; R237-E294 VanDerWaalsContact CZ-OE2 3.22Å; R237-E294 IonicContact NH1-OE1 2.69Å; R237-E294 IonicContact NH1-OE2 3.87Å; R237-E294 PolarHBondContact NH1-OE2 2.94Å; R237-E294 VanDerWaalsContact NH2-CD 3.32Å; R237-E294 IonicContact NH2-OE1 2.66Å; R237-E294 PolarHBondContact NH2-OE1 2.77Å; R237-E294 IonicContact NH2-OE2 2.83Å; R237-E294 PolarHBondContact NH2-OE2 2.79Å; L290-E294 PolarHBondContact O-N 2.84Å; Q291-E294 WeakPolarHBondContact O-CB 3.31Å; Q291-E294 PolarHBondContact O-N 2.98Å; E294-L296 PolarHBondContact O-N 2.86Å; E294-Q297 WeakPolarHBondContact O-CB 3.29Å; E294-Q297 PolarHBondContact O-N 2.89Å; E294-A298 PolarHBondContact O-N 2.56Å
295	E	80.2	Confident	73.5	Confident	121 Å²	121	105.7 Å²	105.7	57%	0.565	51%	0.51	S	S	*	.	H	α-helix	trans	-54.9	-49.4	169.7	-69.2	161.9	-171.9	0	0	111.5	Q291 Q297 A298 D299	Q291-E295 WeakPolarHBondContact O-CG 3.38Å; Q291-E295 PolarHBondContact O-N 2.83Å; E295-Q297 PolarHBondContact O-N 2.87Å; E295-A298 WeakPolarHBondContact O-CB 3.32Å; E295-A298 PolarHBondContact O-N 2.7Å; E295-D299 PolarHBondContact O-N 2.79Å
296	L	74.1	Confident	71.9	Confident	85 Å²	85	110 Å²	110	45%	0.445	52%	0.521	S	S	.	.	H	α-helix	trans	-64.6	-9.9	177.1	-75.2	170	0	0	0	114.5	K292 E294 R300	K292-L296 HydrophobicContact CG-CD1 4.29Å; K292-L296 WeakPolarHBondContact O-CB 3.24Å; K292-L296 WeakPolarHBondContact O-CD1 3.17Å; K292-L296 WeakPolarHBondContact O-CG 3.35Å; K292-L296 PolarHBondContact O-N 2.75Å; K292-L296 VanDerWaalsContact O-N 3.17Å; E294-L296 PolarHBondContact O-N 2.86Å; L296-R300 VanDerWaalsContact O-CD 3.23Å; L296-R300 WeakPolarHBondContact O-CD 3.45Å; L296-R300 WeakPolarHBondContact O-CG 3.32Å; L296-R300 PolarHBondContact O-NE 3.05Å
297	Q	69.8	Low	70.5	Confident	82 Å²	82	112.2 Å²	112.2	38%	0.383	53%	0.532	S	S	.	.	H	α-helix	trans	-90.8	-31.9	168.2	-67.7	-161.9	-55.6	0	0	112.9	M293 E294 E295 R300 R305 I307	M293-Q297 WeakPolarHBondContact O-CG 3.45Å; M293-Q297 PolarHBondContact O-N 2.91Å; E294-Q297 WeakPolarHBondContact O-CB 3.29Å; E294-Q297 PolarHBondContact O-N 2.89Å; E295-Q297 PolarHBondContact O-N 2.87Å; Q297-R300 PolarHBondContact O-N 2.72Å; Q297-R305 PolarHBondContact NE2-O 2.78Å; Q297-I307 HydrophobicContact CG-CD1 3.96Å; Q297-I307 HydrophobicContact CG-CG1 4.1Å
298	A	67	Low	69.6	Low	87 Å²	87	111.7 Å²	111.7	72%	0.719	53%	0.533	S	S	*	.	H	α-helix	trans	-64.1	-41.3	179.9	0	0	0	0	0	112.4	E294 E295 R300	E294-A298 PolarHBondContact O-N 2.56Å; E295-A298 WeakPolarHBondContact O-CB 3.32Å; E295-A298 PolarHBondContact O-N 2.7Å; A298-R300 VanDerWaalsContact C-N 3.28Å; A298-R300 PolarHBondContact O-N 2.81Å
299	D	65.2	Low	69.3	Low	140 Å²	140	108.3 Å²	108.3	75%	0.749	52%	0.518	S	S	*	.	S	Bend	trans	-68.8	-21.6	178	-80.8	-22.6	0	0	0	114.1	E295 K301	E295-D299 PolarHBondContact O-N 2.79Å; D299-K301 PolarHBondContact O-N 2.85Å
300	R	60	Low	69.3	Low	135 Å²	135	105 Å²	105	51%	0.509	50%	0.504	S	S	.	.			trans	-91.9	98.6	-168.4	-72.2	-176.6	-178.2	-112.8	-7	112.1	L296 Q297 A298 T302	L296-R300 VanDerWaalsContact O-CD 3.23Å; L296-R300 WeakPolarHBondContact O-CD 3.45Å; L296-R300 WeakPolarHBondContact O-CG 3.32Å; L296-R300 PolarHBondContact O-NE 3.05Å; Q297-R300 PolarHBondContact O-N 2.72Å; A298-R300 VanDerWaalsContact C-N 3.28Å; A298-R300 PolarHBondContact O-N 2.81Å; R300-T302 PolarHBondContact O-N 2.7Å
301	K	57	Low	69.7	Low	212 Å²	212	104.7 Å²	104.7	92%	0.922	50%	0.502	S	S	*	.			trans	-58.8	0.9	169.1	-64.5	-177.8	179.7	176.2	0	115.4	D299	D299-K301 PolarHBondContact O-N 2.85Å
302	T	49.6	Very low	70.1	Confident	93 Å²	93	100.4 Å²	100.4	57%	0.571	48%	0.482	S	S	*	.			trans	-109.3	111.6	179.6	46.6	0	0	0	0	111.8	R300 H304	R300-T302 PolarHBondContact O-N 2.7Å; T302-H304 PolarHBondContact O-N 2.56Å
303	P	51.2	Low	70.6	Confident	97 Å²	97	94.5 Å²	94.5	63%	0.63	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	14.8	-165.4	32.1	-37.6	0	0	0	115.4
304	H	45.8	Very low	71.4	Confident	168 Å²	168	95.2 Å²	95.2	78%	0.778	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-19.9	-165.1	-62.5	-40.4	0	0	0	115.1	T302 R306	T302-H304 PolarHBondContact O-N 2.56Å; H304-R306 PolarHBondContact O-N 3.09Å
305	R	50.3	Low	72.2	Confident	189 Å²	189	91.4 Å²	91.4	71%	0.713	44%	0.438	S	S	*	.			trans	-95.8	67.9	175.7	-134.5	178.1	-157.2	-164	7.2	111.9	Q297	Q297-R305 PolarHBondContact NE2-O 2.78Å
306	R	58.8	Low	73	Confident	216 Å²	216	86.1 Å²	86.1	82%	0.815	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-65.5	132.8	170.4	-68.3	-171.2	179.2	-155	-2.4	109.9	H304 Q308	H304-R306 PolarHBondContact O-N 3.09Å; R306-Q308 PolarHBondContact O-N 3.07Å
307	I	62.9	Low	73.9	Confident	52 Å²	52	85.2 Å²	85.2	27%	0.267	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-49.4	135.1	169.5	-71.1	165.1	0	0	0	109.5	M293 Q297 P309	M293-I307 HydrophobicContact CB-CD1 3.75Å; M293-I307 HydrophobicContact CB-CG1 4.25Å; M293-I307 HydrophobicContact CE-CB 4.29Å; M293-I307 HydrophobicContact CE-CD1 4.38Å; M293-I307 HydrophobicContact CE-CG1 3.93Å; M293-I307 HydrophobicContact CE-CG2 3.57Å; Q297-I307 HydrophobicContact CG-CD1 3.96Å; Q297-I307 HydrophobicContact CG-CG1 4.1Å; I307-P309 VanDerWaalsContact O-CD 3.3Å; I307-P309 WeakPolarHBondContact O-CD 3.28Å
308	Q	72.2	Confident	75.2	Confident	75 Å²	75	85.5 Å²	85.5	35%	0.35	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-62.6	119.8	169.7	179.4	166.6	83.5	0	0	108.6	P265 R306 H310	P265-Q308 HydrophobicContact CB-CG 4.17Å; R306-Q308 PolarHBondContact O-N 3.07Å; Q308-H310 PolarHBondContact O-CE1 3.37Å; Q308-H310 PolarHBondContact O-ND1 2.8Å
309	P	83.3	Confident	76.7	Confident	41 Å²	41	81.7 Å²	81.7	27%	0.266	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-64.1	147.1	-179	-18.6	31	0	0	0	110.7	I194 D232 T266 I307	I194-P309 HydrophobicContact CD1-CB 3.69Å; I194-P309 HydrophobicContact CD1-CG 4.33Å; D232-P309 HydrophobicContact CB-CB 3.93Å; T266-P309 HydrophobicContact CG2-CB 4.21Å; T266-P309 WeakPolarHBondContact CG2-O 3.28Å; T266-P309 PolarHBondContact N-O 2.91Å; T266-P309 WeakPolarHBondContact OG1-CB 3.47Å; T266-P309 PolarHBondContact OG1-O 3.34Å; I307-P309 VanDerWaalsContact O-CD 3.3Å; I307-P309 WeakPolarHBondContact O-CD 3.28Å
310	H	90.1	Very high	78.3	Confident	30 Å²	30	75.6 Å²	75.6	14%	0.139	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	141	175.4	-69.7	69.7	0	0	0	108.8	M231 C263 Q308	M231-H310 HydrophobicContact CB-CB 4.26Å; M231-H310 WeakPolarHBondContact CB-O 3.47Å; M231-H310 HydrophobicContact CG-CB 4.34Å; M231-H310 PolarHBondContact N-O 3.14Å; C263-H310 VanDerWaalsContact SG-CD2 3.58Å; Q308-H310 PolarHBondContact O-CE1 3.37Å; Q308-H310 PolarHBondContact O-ND1 2.8Å
311	I	94.6	Very high	80.1	Confident	6 Å²	6	71.5 Å²	71.5	3%	0.031	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	144.6	157.5	60.1	162.8	0	0	0	108.9	K193 I194 L197 T228 F229 R230 K264 T266	K193-I311 HydrophobicContact CB-CD1 3.9Å; K193-I311 HydrophobicContact CB-CG1 4.36Å; K193-I311 HydrophobicContact CD-CD1 4.31Å; K193-I311 HydrophobicContact CD-CG1 4.49Å; K193-I311 HydrophobicContact CG-CD1 4.3Å; I194-I311 HydrophobicContact CG1-CG2 4.27Å; L197-I311 HydrophobicContact CD2-CG2 4.37Å; T228-I311 HydrophobicContact CG2-CB 3.83Å; T228-I311 HydrophobicContact CG2-CD1 3.75Å; T228-I311 HydrophobicContact CG2-CG1 4.34Å; T228-I311 HydrophobicContact CG2-CG2 4.19Å; F229-I311 CarbonylContact O-C 3.58Å; F229-I311 VanDerWaalsContact O-CA 3.27Å; F229-I311 WeakPolarHBondContact O-CA 3.27Å; R230-I311 HydrophobicContact CG-CG2 4.12Å; K264-I311 HydrophobicContact CB-CD1 4.43Å; K264-I311 HydrophobicContact CB-CG1 3.91Å; K264-I311 HydrophobicContact CD-CD1 4.38Å; K264-I311 PolarHBondContact N-O 3.27Å; K264-I311 PolarHBondContact O-N 3.49Å; T266-I311 HydrophobicContact CG2-CG2 4.08Å
312	V	95.7	Very high	82	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	125.9	163.5	-178.8	0	0	0	0	107.6	T228 F229 M231 F240 W261 C263 L277 F286	T228-V312 WeakPolarHBondContact CA-O 3.34Å; F229-V312 PolarHBondContact N-O 3.07Å; F229-V312 PolarHBondContact O-N 3.46Å; M231-V312 HydrophobicContact CE-CB 4.3Å; M231-V312 HydrophobicContact CE-CG2 4.29Å; M231-V312 HydrophobicContact CG-CB 4.5Å; M231-V312 HydrophobicContact CG-CG2 3.65Å; M231-V312 HydrophobicContact SD-CB 4.37Å; M231-V312 HydrophobicContact SD-CG2 3.73Å; F240-V312 HydrophobicContact CD2-CB 4.47Å; F240-V312 HydrophobicContact CD2-CG1 4.24Å; F240-V312 HydrophobicContact CE1-CG1 4.49Å; F240-V312 HydrophobicContact CE2-CB 4.03Å; F240-V312 HydrophobicContact CE2-CG1 3.38Å; F240-V312 HydrophobicContact CZ-CB 4.19Å; F240-V312 HydrophobicContact CZ-CG1 3.56Å; F240-V312 HydrophobicContact CZ-CG2 4.41Å; W261-V312 HydrophobicContact CB-CG1 3.52Å; W261-V312 HydrophobicContact CD2-CG1 4.2Å; W261-V312 HydrophobicContact CE3-CG1 3.99Å; W261-V312 HydrophobicContact CG-CG1 4Å; C263-V312 HydrophobicContact CB-CG2 4.21Å; L277-V312 HydrophobicContact CD1-CG1 4.14Å; F286-V312 HydrophobicContact CE1-CG2 3.66Å; F286-V312 HydrophobicContact CZ-CG2 4.14Å
313	Q	96.3	Very high	84.2	Confident	9 Å²	9	60.9 Å²	60.9	4%	0.042	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	141.1	-174	175.5	171	79.9	0	0	109.6	P226 T227 T228 W261 I262 Y315	P226-Q313 HydrophobicContact CB-CG 3.88Å; P226-Q313 HydrophobicContact CG-CG 4.47Å; T227-Q313 CarbonylContact O-C 3.51Å; T227-Q313 WeakPolarHBondContact O-CA 3.22Å; T228-Q313 HydrophobicContact CG2-CB 4.24Å; T228-Q313 WeakPolarHBondContact OG1-CG 3.43Å; T228-Q313 PolarHBondContact OG1-NE2 3.46Å; W261-Q313 CarbonylContact C-O 3.49Å; W261-Q313 WeakPolarHBondContact CA-O 3.49Å; W261-Q313 VanDerWaalsContact CE3-C 3.44Å; I262-Q313 HydrophobicContact CG2-CB 4.14Å; I262-Q313 VanDerWaalsContact CG2-O 3.31Å; I262-Q313 WeakPolarHBondContact CG2-O 3.43Å; I262-Q313 PolarHBondContact N-O 3.22Å; I262-Q313 PolarHBondContact O-N 3.43Å; Q313-Y315 PolarHBondContact O-N 3.42Å
314	R	95.5	Very high	86.3	Confident	73 Å²	73	61.2 Å²	61.2	28%	0.275	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	126.7	177.3	-174.3	175.6	60.5	77.5	2.3	108.9	P226 T227 W261	P226-R314 WeakPolarHBondContact CB-O 3.49Å; T227-R314 PolarHBondContact O-N 3.13Å; W261-R314 VanDerWaalsContact CE3-CA 3.44Å; W261-R314 HydrophobicContact CE3-CB 3.98Å; W261-R314 HydrophobicContact CH2-CB 4.11Å; W261-R314 HydrophobicContact CZ3-CB 3.69Å
315	Y	96.4	Very high	88.8	Confident	8 Å²	8	54.8 Å²	54.8	3%	0.031	25%	0.246	C	C	.	.			trans	-74.4	143.5	179.4	-171.7	-110.1	0	0	0	110.2	M260 I262 L276 Q313 Q317 K326 Y357 H367	M260-Y315 HydrophobicContact CB-CD1 4.14Å; M260-Y315 HydrophobicContact CB-CG 4.43Å; M260-Y315 HydrophobicContact CG-CD1 3.95Å; M260-Y315 HydrophobicContact CG-CG 4.11Å; M260-Y315 WeakPolarHBondContact O-CB 3.4Å; M260-Y315 PolarHBondContact O-N 3.49Å; M260-Y315 HydrophobicContact SD-CD1 3.45Å; M260-Y315 WeakPolarHBondContact SD-CD1 3.49Å; M260-Y315 HydrophobicContact SD-CE1 3.67Å; M260-Y315 HydrophobicContact SD-CG 4.05Å; I262-Y315 HydrophobicContact CB-CD2 3.97Å; I262-Y315 HydrophobicContact CD1-CD2 4.3Å; I262-Y315 HydrophobicContact CD1-CE2 4.41Å; I262-Y315 HydrophobicContact CG2-CD2 4.14Å; L276-Y315 HydrophobicContact CD2-CD2 3.75Å; L276-Y315 HydrophobicContact CD2-CE2 3.72Å; L276-Y315 HydrophobicContact CD2-CG 4.42Å; Q313-Y315 PolarHBondContact O-N 3.42Å; Y315-Q317 HydrophobicContact CD1-CB 4.04Å; Y315-Q317 PolarHBondContact O-N 2.85Å; Y315-K326 PolarHBondContact OH-NZ 3.17Å; Y315-Y357 WeakPolarHBondContact CE1-OH 3.47Å; Y315-H367 WeakPolarHBondContact OH-CB 3.31Å; Y315-H367 PolarHBondContact OH-ND1 2.75Å
316	I	96.3	Very high	91.1	Very high	11 Å²	11	46.1 Å²	46.1	6%	0.056	21%	0.213	C	C	.	.			trans	-86.2	88.9	171.1	-59.6	168.5	0	0	0	105.9	P226 P319 M451 D453 W459 L461	P226-I316 HydrophobicContact CG-CD1 4.17Å; P226-I316 HydrophobicContact CG-CG1 4.39Å; I316-P319 HydrophobicContact CG2-CB 4.2Å; I316-M451 HydrophobicContact CB-SD 4.03Å; I316-M451 HydrophobicContact CD1-CB 3.94Å; I316-M451 HydrophobicContact CD1-CG 3.95Å; I316-M451 HydrophobicContact CD1-SD 3.85Å; I316-M451 HydrophobicContact CG2-SD 4.25Å; I316-D453 HydrophobicContact CG2-CB 4.03Å; I316-W459 HydrophobicContact CD1-CB 3.72Å; I316-W459 HydrophobicContact CD1-CD2 4.47Å; I316-W459 HydrophobicContact CD1-CG 3.66Å; I316-L461 HydrophobicContact CD1-CD2 4.07Å
317	Q	94.9	Very high	92.9	Very high	65 Å²	65	35.9 Å²	35.9	30%	0.304	18%	0.175	S	C	.	.	S	Bend	trans	-76.5	-24.9	-173.9	-175	167.1	-19.7	0	0	113.2	S258 Y315 P319 Y357 P359	S258-Q317 PolarHBondContact O-OE1 3.13Å; Y315-Q317 HydrophobicContact CD1-CB 4.04Å; Y315-Q317 PolarHBondContact O-N 2.85Å; Q317-P319 VanDerWaalsContact O-CD 3.26Å; Q317-P319 WeakPolarHBondContact O-CD 3.47Å; Q317-Y357 WeakPolarHBondContact O-CE1 3.28Å; Q317-Y357 PolarHBondContact O-OH 3.45Å; Q317-P359 HydrophobicContact CG-CB 4.11Å
318	K	96.7	Very high	94.6	Very high	88 Å²	88	33.4 Å²	33.4	38%	0.383	16%	0.162	S	C	.	.	S	Bend	trans	-117.2	67.1	174.7	-52.4	-179.1	-165.8	169.6	0	109.9	E257 D453 E454	E257-K318 VanDerWaalsContact OE1-CE 3.24Å; E257-K318 WeakPolarHBondContact OE1-CE 3.27Å; E257-K318 IonicContact OE1-NZ 3.89Å; E257-K318 PolarHBondContact OE1-NZ 3.48Å; E257-K318 IonicContact OE2-NZ 2.78Å; K318-D453 WeakPolarHBondContact O-CA 3.17Å; K318-D453 WeakPolarHBondContact O-CB 3.29Å; K318-E454 HydrophobicContact CB-CG 4.01Å; K318-E454 WeakPolarHBondContact CD-OE1 3.42Å; K318-E454 IonicContact NZ-OE1 2.69Å; K318-E454 PolarHBondContact O-N 3.47Å
319	P	97.6	Very high	95.9	Very high	8 Å²	8	29.9 Å²	29.9	5%	0.052	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-68	157.2	175.7	32.8	-35.3	0	0	0	110	I316 Q317 L321 K326 Y357 M451	I316-P319 HydrophobicContact CG2-CB 4.2Å; Q317-P319 VanDerWaalsContact O-CD 3.26Å; Q317-P319 WeakPolarHBondContact O-CD 3.47Å; P319-L321 HydrophobicContact CG-CD2 3.9Å; P319-K326 HydrophobicContact CB-CG 4.35Å; P319-K326 HydrophobicContact CG-CD 4.24Å; P319-K326 HydrophobicContact CG-CG 4.07Å; P319-Y357 HydrophobicContact CG-CD1 4.1Å; P319-Y357 HydrophobicContact CG-CE1 3.81Å; P319-Y357 HydrophobicContact CG-CE2 4.37Å; P319-Y357 HydrophobicContact CG-CG 4.48Å; P319-M451 HydrophobicContact CB-SD 4.37Å
320	L	98.2	Very high	96.6	Very high	11 Å²	11	28.3 Å²	28.3	6%	0.058	13%	0.134	C	C	.	.			trans	-63.3	139.7	160.8	-173.2	60.7	0	0	0	108.5	F327 L402 I452 F456	L320-F327 HydrophobicContact CB-CE1 3.96Å; L320-F327 HydrophobicContact CB-CZ 4.3Å; L320-F327 HydrophobicContact CD2-CE1 4.33Å; L320-F327 HydrophobicContact CD2-CZ 4.12Å; L320-F327 HydrophobicContact CG-CE1 4Å; L320-F327 HydrophobicContact CG-CZ 4.29Å; L320-F327 VanDerWaalsContact O-CD1 3.3Å; L320-F327 WeakPolarHBondContact O-CD1 3.29Å; L320-F327 WeakPolarHBondContact O-CE1 3.37Å; L320-L402 HydrophobicContact CD1-CD1 4.13Å; L320-I452 HydrophobicContact CB-CB 4.07Å; L320-I452 HydrophobicContact CB-CG2 4.12Å; L320-I452 HydrophobicContact CD2-CB 4.23Å; L320-I452 HydrophobicContact CD2-CG2 3.91Å; L320-I452 PolarHBondContact N-O 3.07Å; L320-F456 HydrophobicContact CD1-CE1 4.28Å; L320-F456 HydrophobicContact CD1-CE2 4.19Å; L320-F456 HydrophobicContact CD1-CZ 3.76Å; L320-F456 HydrophobicContact CD2-CD1 4.14Å; L320-F456 HydrophobicContact CD2-CE1 3.61Å; L320-F456 HydrophobicContact CD2-CZ 3.97Å
321	L	98	Very high	97	Very high	49 Å²	49	26.9 Å²	26.9	26%	0.257	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	152.4	-178.7	-58.7	178.9	0	0	0	111.1	P319 R325 K326 Y357	P319-L321 HydrophobicContact CG-CD2 3.9Å; L321-R325 WeakPolarHBondContact CA-O 3.44Å; L321-K326 HydrophobicContact CD2-CB 4.31Å; L321-Y357 HydrophobicContact CD1-CD1 4.23Å; L321-Y357 HydrophobicContact CD2-CD1 3.83Å; L321-Y357 HydrophobicContact CD2-CG 3.88Å
322	L	97.4	Very high	97.2	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	109.9	172.8	-64.2	173.3	0	0	0	107.9	D324 R325 F327 V350 L352 W389 F394 Y397	L322-D324 VanDerWaalsContact C-N 3.28Å; L322-D324 PolarHBondContact O-N 2.99Å; L322-R325 PolarHBondContact N-O 2.89Å; L322-R325 PolarHBondContact O-N 2.88Å; L322-R325 VanDerWaalsContact O-N 3.15Å; L322-F327 HydrophobicContact CB-CD1 4.3Å; L322-F327 HydrophobicContact CD1-CB 4.25Å; L322-F327 HydrophobicContact CD1-CD1 3.6Å; L322-F327 HydrophobicContact CD1-CD2 4Å; L322-F327 HydrophobicContact CD1-CE1 3.79Å; L322-F327 HydrophobicContact CD1-CE2 4.13Å; L322-F327 HydrophobicContact CD1-CG 3.69Å; L322-F327 HydrophobicContact CD1-CZ 4.03Å; L322-F327 HydrophobicContact CD2-CE1 4.25Å; L322-F327 HydrophobicContact CG-CD1 3.54Å; L322-F327 HydrophobicContact CG-CE1 3.55Å; L322-F327 HydrophobicContact CG-CG 4.16Å; L322-F327 HydrophobicContact CG-CZ 4.17Å; L322-V350 HydrophobicContact CD1-CG1 3.99Å; L322-L352 HydrophobicContact CB-CD2 3.83Å; L322-L352 HydrophobicContact CD1-CD2 4.28Å; L322-W389 HydrophobicContact CB-CH2 4.09Å; L322-W389 HydrophobicContact CB-CZ3 4.14Å; L322-W389 HydrophobicContact CD1-CE3 4.02Å; L322-W389 HydrophobicContact CD1-CZ3 3.94Å; L322-W389 HydrophobicContact CD2-CZ3 4.07Å; L322-W389 HydrophobicContact CG-CZ3 4.26Å; L322-F394 HydrophobicContact CD1-CD2 3.96Å; L322-F394 HydrophobicContact CD1-CE2 4.22Å; L322-F394 HydrophobicContact CD2-CD2 3.97Å; L322-F394 HydrophobicContact CD2-CE2 3.98Å; L322-Y397 HydrophobicContact CD2-CD1 3.36Å; L322-Y397 HydrophobicContact CD2-CE1 3.46Å; L322-Y397 VanDerWaalsContact CD2-CE1 3.46Å; L322-Y397 HydrophobicContact CD2-CG 4.22Å
323	N	95.7	Very high	97.4	Very high	82 Å²	82	26.7 Å²	26.7	44%	0.439	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	50.8	-167.4	-60.7	-19.1	0	0	0	111.4	R325 Y397	N323-R325 WeakPolarHBondContact O-CG 3.42Å; N323-R325 PolarHBondContact O-N 2.81Å; N323-Y397 PolarHBondContact N-OH 3.27Å; N323-Y397 WeakPolarHBondContact OD1-CE2 3.26Å; N323-Y397 PolarHBondContact OD1-OH 2.75Å
324	D	96.6	Very high	97.5	Very high	105 Å²	105	26.2 Å²	26.2	56%	0.561	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	5.1	-178.5	-48.9	-49.5	0	0	0	116	L322 V356 Y357	L322-D324 VanDerWaalsContact C-N 3.28Å; L322-D324 PolarHBondContact O-N 2.99Å; D324-V356 HydrophobicContact CB-CG1 3.96Å; D324-Y357 WeakPolarHBondContact O-CB 3.17Å; D324-Y357 PolarHBondContact O-N 3.39Å
325	R	96.9	Very high	97.7	Very high	32 Å²	32	22.8 Å²	22.8	12%	0.121	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	143	176	-59.9	-175.8	-55.8	-173.9	6.2	110.8	L321 L322 N323 T353 C354 D355 D386	L321-R325 WeakPolarHBondContact CA-O 3.44Å; L322-R325 PolarHBondContact N-O 2.89Å; L322-R325 PolarHBondContact O-N 2.88Å; L322-R325 VanDerWaalsContact O-N 3.15Å; N323-R325 WeakPolarHBondContact O-CG 3.42Å; N323-R325 PolarHBondContact O-N 2.81Å; R325-T353 WeakPolarHBondContact CD-O 3.38Å; R325-C354 VanDerWaalsContact CD-O 3.28Å; R325-C354 WeakPolarHBondContact CD-O 3.3Å; R325-D355 WeakPolarHBondContact CG-O 3.24Å; R325-D386 PolarHBondContact NH2-O 3.06Å; R325-D386 VanDerWaalsContact NH2-O 3.12Å
326	K	98.1	Very high	97.7	Very high	7 Å²	7	22.5 Å²	22.5	3%	0.03	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	143.7	179	-176.3	176.3	-175.9	-173.7	0	109.8	Y315 P319 L321 L352 T353 Y357 H367 T369 M451	Y315-K326 PolarHBondContact OH-NZ 3.17Å; P319-K326 HydrophobicContact CB-CG 4.35Å; P319-K326 HydrophobicContact CG-CD 4.24Å; P319-K326 HydrophobicContact CG-CG 4.07Å; L321-K326 HydrophobicContact CD2-CB 4.31Å; K326-L352 CarbonylContact O-C 3.52Å; K326-L352 WeakPolarHBondContact O-CA 3.31Å; K326-T353 HydrophobicContact CB-CG2 4.12Å; K326-T353 PolarHBondContact N-OG1 3.4Å; K326-T353 PolarHBondContact O-N 2.93Å; K326-T353 PolarHBondContact O-OG1 3.12Å; K326-Y357 HydrophobicContact CB-CD2 3.83Å; K326-Y357 HydrophobicContact CB-CG 4.12Å; K326-Y357 HydrophobicContact CD-CD2 3.75Å; K326-Y357 HydrophobicContact CD-CE2 3.77Å; K326-Y357 HydrophobicContact CG-CD2 4.29Å; K326-H367 PolarHBondContact NZ-O 2.94Å; K326-T369 HydrophobicContact CG-CG2 4.35Å; K326-M451 VanDerWaalsContact CE-CE 3.44Å; K326-M451 HydrophobicContact CG-CE 4.37Å
327	F	98.4	Very high	97.8	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.009	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	164.7	179.5	77.2	-85.3	0	0	0	114.4	L320 L322 V329 V350 R351 L352 F394 M451 I452	L320-F327 HydrophobicContact CB-CE1 3.96Å; L320-F327 HydrophobicContact CB-CZ 4.3Å; L320-F327 HydrophobicContact CD2-CE1 4.33Å; L320-F327 HydrophobicContact CD2-CZ 4.12Å; L320-F327 HydrophobicContact CG-CE1 4Å; L320-F327 HydrophobicContact CG-CZ 4.29Å; L320-F327 VanDerWaalsContact O-CD1 3.3Å; L320-F327 WeakPolarHBondContact O-CD1 3.29Å; L320-F327 WeakPolarHBondContact O-CE1 3.37Å; L322-F327 HydrophobicContact CB-CD1 4.3Å; L322-F327 HydrophobicContact CD1-CB 4.25Å; L322-F327 HydrophobicContact CD1-CD1 3.6Å; L322-F327 HydrophobicContact CD1-CD2 4Å; L322-F327 HydrophobicContact CD1-CE1 3.79Å; L322-F327 HydrophobicContact CD1-CE2 4.13Å; L322-F327 HydrophobicContact CD1-CG 3.69Å; L322-F327 HydrophobicContact CD1-CZ 4.03Å; L322-F327 HydrophobicContact CD2-CE1 4.25Å; L322-F327 HydrophobicContact CG-CD1 3.54Å; L322-F327 HydrophobicContact CG-CE1 3.55Å; L322-F327 HydrophobicContact CG-CG 4.16Å; L322-F327 HydrophobicContact CG-CZ 4.17Å; F327-V329 HydrophobicContact CD2-CG2 4.22Å; F327-V329 HydrophobicContact CE2-CG2 3.94Å; F327-V350 HydrophobicContact CB-CG1 3.82Å; F327-V350 HydrophobicContact CD2-CG1 3.56Å; F327-V350 HydrophobicContact CE2-CG1 4.39Å; F327-V350 HydrophobicContact CG-CG1 3.98Å; F327-R351 CarbonylContact C-O 3.51Å; F327-R351 WeakPolarHBondContact CA-O 3.44Å; F327-R351 WeakPolarHBondContact CB-O 3.42Å; F327-L352 HydrophobicContact CB-CG 4.07Å; F327-F394 HydrophobicContact CE2-CE1 4.14Å; F327-F394 HydrophobicContact CE2-CE2 4.08Å; F327-F394 AromaticContact CE2-CZ 3.71Å; F327-F394 HydrophobicContact CE2-CZ 3.71Å; F327-F394 AromaticContact CZ-CE2 3.8Å; F327-F394 HydrophobicContact CZ-CE2 3.8Å; F327-F394 AromaticContact CZ-CZ 3.67Å; F327-F394 HydrophobicContact CZ-CZ 3.67Å; F327-M451 WeakPolarHBondContact O-CE 3.26Å; F327-I452 HydrophobicContact CE2-CD1 3.61Å; F327-I452 HydrophobicContact CZ-CD1 3.86Å
328	D	98.5	Very high	97.9	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	163	164	85.4	-108	0	0	0	110.2	V350 R351 T369 F450 M451 L461	D328-V350 CarbonylContact O-C 3.5Å; D328-V350 WeakPolarHBondContact O-CA 3.35Å; D328-R351 PolarHBondContact N-O 3.43Å; D328-R351 PolarHBondContact O-N 3.45Å; D328-R351 IonicContact OD1-CZ 2.68Å; D328-R351 IonicContact OD1-NE 3.73Å; D328-R351 PolarHBondContact OD1-NE 3.25Å; D328-R351 IonicContact OD1-NH2 3.2Å; D328-R351 PolarHBondContact OD1-NH2 3.33Å; D328-R351 IonicContact OD2-CZ 3.68Å; D328-R351 VanDerWaalsContact OD2-CZ 3.22Å; D328-R351 IonicContact OD2-NE 2.7Å; D328-R351 PolarHBondContact OD2-NE 3.45Å; D328-R351 IonicContact OD2-NH2 2.74Å; D328-R351 PolarHBondContact OD2-NH2 3Å; D328-T369 WeakPolarHBondContact OD1-CB 3.33Å; D328-T369 PolarHBondContact OD1-OG1 2.96Å; D328-F450 CarbonylContact C-O 3.51Å; D328-F450 WeakPolarHBondContact CA-O 3.49Å; D328-F450 VanDerWaalsContact CB-O 3.26Å; D328-F450 WeakPolarHBondContact CB-O 3.39Å; D328-M451 HydrophobicContact CB-CE 4.2Å; D328-L461 HydrophobicContact CB-CD1 4.34Å
329	V	98.7	Very high	97.8	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	120.2	177.4	-176.2	0	0	0	0	109.9	F327 V350 M391 F394 F417 M421 F450 I452	F327-V329 HydrophobicContact CD2-CG2 4.22Å; F327-V329 HydrophobicContact CE2-CG2 3.94Å; V329-V350 HydrophobicContact CG2-CG2 4.34Å; V329-M391 HydrophobicContact CG1-CE 4.33Å; V329-M391 HydrophobicContact CG1-SD 3.73Å; V329-F394 HydrophobicContact CG2-CE1 4.04Å; V329-F417 HydrophobicContact CB-CE1 4.34Å; V329-F417 HydrophobicContact CB-CZ 4.02Å; V329-F417 HydrophobicContact CG1-CE1 4.15Å; V329-F417 HydrophobicContact CG1-CZ 4.26Å; V329-F417 HydrophobicContact CG2-CE1 3.97Å; V329-F417 HydrophobicContact CG2-CZ 3.75Å; V329-M421 HydrophobicContact CG1-SD 4.31Å; V329-F450 HydrophobicContact CB-CB 4.4Å; V329-F450 PolarHBondContact N-O 3.43Å; V329-F450 PolarHBondContact O-N 3.35Å; V329-I452 HydrophobicContact CG2-CD1 4Å
330	R	98.5	Very high	97.7	Very high	9 Å²	9	17.9 Å²	17.9	3%	0.034	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	120.5	165.8	168.9	55.2	56.6	73.2	-6.7	108.9	Y332 G348 Y349 R351 D449	R330-Y332 HydrophobicContact CG-CE2 4.1Å; R330-G348 CarbonylContact O-C 3.59Å; R330-G348 WeakPolarHBondContact O-CA 3.37Å; R330-G348 PolarHBondContact O-N 3.49Å; R330-Y349 HydrophobicContact CB-CD1 4.29Å; R330-Y349 HydrophobicContact CB-CD2 4.27Å; R330-Y349 HydrophobicContact CB-CE1 4.03Å; R330-Y349 HydrophobicContact CB-CE2 4.05Å; R330-Y349 HydrophobicContact CB-CG 4.4Å; R330-Y349 HydrophobicContact CG-CD1 4.12Å; R330-Y349 HydrophobicContact CG-CE1 3.56Å; R330-Y349 HydrophobicContact CG-CE2 4.38Å; R330-Y349 PolarHBondContact N-O 2.92Å; R330-Y349 PolarHBondContact NH1-OH 3.01Å; R330-Y349 PolarHBondContact O-N 2.99Å; R330-R351 VanDerWaalsContact NH2-NH1 3.11Å; R330-D449 IonicContact CZ-OD1 2.7Å; R330-D449 IonicContact CZ-OD2 3.05Å; R330-D449 IonicContact NE-OD1 2.85Å; R330-D449 PolarHBondContact NE-OD1 2.76Å; R330-D449 VanDerWaalsContact NH2-CG 3.27Å; R330-D449 IonicContact NH2-OD1 3.89Å; R330-D449 PolarHBondContact NH2-OD1 3.26Å; R330-D449 IonicContact NH2-OD2 3.57Å; R330-D449 PolarHBondContact NH2-OD2 3.5Å
331	S	98.6	Very high	97.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	167.3	164.8	-134.2	0	0	0	0	110.9	F345 R346 C448	S331-F345 VanDerWaalsContact OG-CE2 3.24Å; S331-F345 WeakPolarHBondContact OG-CE2 3.32Å; S331-F345 WeakPolarHBondContact OG-CZ 3.38Å; S331-R346 PolarHBondContact OG-O 3.31Å; S331-C448 PolarHBondContact N-O 2.88Å; S331-C448 PolarHBondContact O-N 2.99Å
332	Y	98.8	Very high	97.7	Very high	1 Å²	1	15.8 Å²	15.8	0%	0.004	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130.3	-176.5	-68.2	-84.1	0	0	0	112.3	R330 F345 R346 Y349 M425 L445 P467 I480 T483	R330-Y332 HydrophobicContact CG-CE2 4.1Å; Y332-F345 CarbonylContact O-C 3.45Å; Y332-F345 WeakPolarHBondContact O-CA 3.3Å; Y332-R346 PolarHBondContact N-O 2.86Å; Y332-R346 PolarHBondContact O-N 2.91Å; Y332-Y349 HydrophobicContact CE2-CE1 4.48Å; Y332-M425 VanDerWaalsContact C-CE 3.46Å; Y332-M425 VanDerWaalsContact O-CE 3.28Å; Y332-M425 WeakPolarHBondContact O-CE 3.43Å; Y332-L445 HydrophobicContact CD1-CD1 4Å; Y332-L445 HydrophobicContact CD1-CD2 4.42Å; Y332-L445 HydrophobicContact CD1-CG 4.14Å; Y332-L445 HydrophobicContact CG-CD1 4.45Å; Y332-P467 HydrophobicContact CD1-CG 4.28Å; Y332-P467 HydrophobicContact CE1-CB 4.1Å; Y332-P467 HydrophobicContact CE1-CG 3.85Å; Y332-I480 WeakPolarHBondContact OH-CD1 3.49Å; Y332-T483 HydrophobicContact CD1-CG2 4.07Å; Y332-T483 HydrophobicContact CD2-CG2 3.79Å; Y332-T483 HydrophobicContact CE1-CG2 4.29Å; Y332-T483 HydrophobicContact CE2-CG2 4.04Å; Y332-T483 HydrophobicContact CG-CG2 3.81Å
333	L	98.9	Very high	97.8	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	115.9	165.5	-176.1	67.9	0	0	0	108.4	L190 V343 F344 M425 I446 M463 L516	L190-L333 HydrophobicContact CD2-CD2 4.21Å; L333-V343 HydrophobicContact CD1-CG1 3.45Å; L333-V343 VanDerWaalsContact CD1-CG1 3.45Å; L333-V343 HydrophobicContact CG-CG1 4.22Å; L333-F344 WeakPolarHBondContact CA-O 3.35Å; L333-M425 HydrophobicContact CB-CE 3.74Å; L333-M425 HydrophobicContact CD1-CB 4.31Å; L333-M425 HydrophobicContact CD1-CE 4.3Å; L333-I446 HydrophobicContact CB-CB 4.35Å; L333-I446 PolarHBondContact N-O 3.14Å; L333-I446 PolarHBondContact O-N 2.86Å; L333-M463 HydrophobicContact CD2-CE 3.6Å; L333-L516 HydrophobicContact CD1-CD1 3.78Å
334	L	98.9	Very high	97.9	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	116.8	173.3	170.3	64	0	0	0	109.1	A336 V343 F344 D444 L445 A487 L490 F513	L334-A336 HydrophobicContact CD1-CB 4.2Å; L334-A336 HydrophobicContact CD2-CB 4.01Å; L334-A336 HydrophobicContact CG-CB 3.87Å; L334-A336 PolarHBondContact O-N 3.05Å; L334-V343 CarbonylContact O-C 3.4Å; L334-V343 WeakPolarHBondContact O-CA 3.13Å; L334-F344 HydrophobicContact CB-CB 4.4Å; L334-F344 HydrophobicContact CD2-CD2 4.37Å; L334-F344 PolarHBondContact N-O 3.47Å; L334-F344 PolarHBondContact O-N 3.01Å; L334-D444 WeakPolarHBondContact CA-O 3.31Å; L334-L445 HydrophobicContact CB-CD1 4.11Å; L334-L445 HydrophobicContact CD1-CD1 4.42Å; L334-A487 HydrophobicContact CD1-CB 3.96Å; L334-A487 HydrophobicContact CD2-CB 3.81Å; L334-A487 HydrophobicContact CG-CB 4.47Å; L334-L490 HydrophobicContact CD2-CB 4.4Å; L334-L490 HydrophobicContact CD2-CD1 3.94Å; L334-F513 HydrophobicContact CB-CD1 3.89Å; L334-F513 HydrophobicContact CB-CE1 3.32Å; L334-F513 HydrophobicContact CB-CZ 3.78Å; L334-F513 HydrophobicContact CD2-CD1 4.05Å; L334-F513 HydrophobicContact CD2-CD2 4.04Å; L334-F513 HydrophobicContact CD2-CE1 3.91Å; L334-F513 HydrophobicContact CD2-CE2 3.9Å; L334-F513 HydrophobicContact CD2-CG 4.15Å; L334-F513 HydrophobicContact CD2-CZ 3.84Å; L334-F513 HydrophobicContact CG-CE1 4.26Å; L334-F513 HydrophobicContact CG-CZ 4.41Å
335	I	98.7	Very high	98	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.039	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	84.2	164.1	-55.8	175.9	0	0	0	105.7	I184 S337 T338 Y341 M342 V343 F429 L436 F443 D444 I446	I184-I335 HydrophobicContact CD1-CB 4.25Å; I184-I335 HydrophobicContact CD1-CD1 4.01Å; I184-I335 HydrophobicContact CD1-CG2 3.96Å; I335-S337 WeakPolarHBondContact CG2-O 3.5Å; I335-S337 PolarHBondContact O-N 3.21Å; I335-T338 HydrophobicContact CG2-CG2 4.07Å; I335-Y341 HydrophobicContact CG2-CD1 4.24Å; I335-Y341 HydrophobicContact CG2-CE1 4.43Å; I335-M342 CarbonylContact C-O 3.46Å; I335-V343 HydrophobicContact CG1-CG1 4.33Å; I335-V343 HydrophobicContact CG1-CG2 4.34Å; I335-V343 HydrophobicContact CG2-CG2 4.42Å; I335-F429 HydrophobicContact CD1-CD2 4.39Å; I335-L436 HydrophobicContact CD1-CD1 3.96Å; I335-F443 CarbonylContact O-C 3.53Å; I335-F443 WeakPolarHBondContact O-CA 3.29Å; I335-F443 VanDerWaalsContact O-CB 3.29Å; I335-F443 WeakPolarHBondContact O-CB 3.35Å; I335-D444 HydrophobicContact CB-CB 4.47Å; I335-D444 PolarHBondContact N-O 3.29Å; I335-D444 PolarHBondContact O-N 2.89Å; I335-I446 HydrophobicContact CD1-CD1 4.43Å
336	A	98.3	Very high	98.1	Very high	3 Å²	3	6.2 Å²	6.2	3%	0.025	4%	0.036	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	-19.4	-173.7	0	0	0	0	0	113.2	L334 M342 F344 L494	L334-A336 HydrophobicContact CD1-CB 4.2Å; L334-A336 HydrophobicContact CD2-CB 4.01Å; L334-A336 HydrophobicContact CG-CB 3.87Å; L334-A336 PolarHBondContact O-N 3.05Å; A336-M342 PolarHBondContact N-O 3.03Å; A336-F344 HydrophobicContact CB-CD2 4.18Å; A336-F344 HydrophobicContact CB-CE2 3.89Å; A336-L494 HydrophobicContact CB-CD1 3.51Å
337	S	97.6	Very high	98.1	Very high	11 Å²	11	7.8 Å²	7.8	8%	0.077	4%	0.044	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	146.7	169.5	168.8	0	0	0	0	109.2	I335 A339 P340 Y341 M342	I335-S337 WeakPolarHBondContact CG2-O 3.5Å; I335-S337 PolarHBondContact O-N 3.21Å; S337-A339 PolarHBondContact OG-N 3.37Å; S337-P340 CarbonylContact C-O 3.53Å; S337-P340 VanDerWaalsContact CB-O 3.27Å; S337-P340 WeakPolarHBondContact CB-O 3.4Å; S337-P340 PolarHBondContact OG-O 3.41Å; S337-Y341 CarbonylContact O-C 3.5Å; S337-Y341 VanDerWaalsContact O-CA 3.31Å; S337-Y341 WeakPolarHBondContact O-CA 3.36Å; S337-M342 PolarHBondContact O-N 2.82Å
338	T	97.1	Very high	98.1	Very high	1 Å²	1	7.9 Å²	7.9	1%	0.006	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-25.2	169.4	59.2	0	0	0	0	113.5	I184 I335 P340 Y341 C438 R439 F442	I184-T338 HydrophobicContact CD1-CG2 3.45Å; I184-T338 VanDerWaalsContact CD1-CG2 3.45Å; I184-T338 HydrophobicContact CG1-CG2 3.8Å; I335-T338 HydrophobicContact CG2-CG2 4.07Å; T338-P340 VanDerWaalsContact C-C 3.41Å; T338-P340 CarbonylContact C-O 3.5Å; T338-P340 CarbonylContact O-C 3.57Å; T338-Y341 HydrophobicContact CG2-CE1 3.94Å; T338-Y341 VanDerWaalsContact O-CD2 3.28Å; T338-Y341 WeakPolarHBondContact O-CD2 3.45Å; T338-Y341 VanDerWaalsContact O-CG 3.29Å; T338-Y341 PolarHBondContact O-N 3.08Å; T338-Y341 VanDerWaalsContact O-N 3.14Å; T338-C438 PolarHBondContact O-SG 2.85Å; T338-R439 PolarHBondContact OG1-N 2.97Å; T338-R439 PolarHBondContact OG1-O 3.36Å; T338-F442 HydrophobicContact CG2-CB 4.23Å; T338-F442 PolarHBondContact N-O 3Å
339	A	94.9	Very high	98.1	Very high	24 Å²	24	8.2 Å²	8.2	20%	0.198	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	-138.9	94.8	-174.4	0	0	0	0	0	111.4	S337 P440	S337-A339 PolarHBondContact OG-N 3.37Å; A339-P440 HydrophobicContact CB-CG 3.77Å
340	P	95.6	Very high	98.1	Very high	39 Å²	39	8.2 Å²	8.2	25%	0.253	5%	0.047	S	C	.	.	T	Hydrogen-bonded Turn	cis	-67.7	157	-6.7	31.4	-35.7	0	0	0	111.6	S337 T338 M342 I504 V520	S337-P340 CarbonylContact C-O 3.53Å; S337-P340 VanDerWaalsContact CB-O 3.27Å; S337-P340 WeakPolarHBondContact CB-O 3.4Å; S337-P340 PolarHBondContact OG-O 3.41Å; T338-P340 VanDerWaalsContact C-C 3.41Å; T338-P340 CarbonylContact C-O 3.5Å; T338-P340 CarbonylContact O-C 3.57Å; P340-M342 PolarHBondContact O-N 2.92Å; P340-I504 HydrophobicContact CG-CD1 3.77Å; P340-V520 HydrophobicContact CB-CG2 3.83Å; P340-V520 HydrophobicContact CG-CG2 3.51Å
341	Y	97.7	Very high	98	Very high	15 Å²	15	8.6 Å²	8.6	6%	0.059	5%	0.048	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	124.5	174.9	-86.5	-69.6	0	0	0	110.6	I335 S337 T338 F429 K433 L436 S518 G519	I335-Y341 HydrophobicContact CG2-CD1 4.24Å; I335-Y341 HydrophobicContact CG2-CE1 4.43Å; S337-Y341 CarbonylContact O-C 3.5Å; S337-Y341 VanDerWaalsContact O-CA 3.31Å; S337-Y341 WeakPolarHBondContact O-CA 3.36Å; T338-Y341 HydrophobicContact CG2-CE1 3.94Å; T338-Y341 VanDerWaalsContact O-CD2 3.28Å; T338-Y341 WeakPolarHBondContact O-CD2 3.45Å; T338-Y341 VanDerWaalsContact O-CG 3.29Å; T338-Y341 PolarHBondContact O-N 3.08Å; T338-Y341 VanDerWaalsContact O-N 3.14Å; Y341-F429 AromaticContact CD1-CE2 3.66Å; Y341-F429 HydrophobicContact CD1-CE2 3.66Å; Y341-F429 AromaticContact CD1-CZ 3.61Å; Y341-F429 HydrophobicContact CD1-CZ 3.61Å; Y341-F429 HydrophobicContact CD2-CZ 4.38Å; Y341-F429 AromaticContact CE1-CE2 3.8Å; Y341-F429 HydrophobicContact CE1-CE2 3.8Å; Y341-F429 HydrophobicContact CE1-CZ 4.1Å; Y341-F429 HydrophobicContact CG-CE2 4.31Å; Y341-F429 AromaticContact CG-CZ 3.79Å; Y341-F429 HydrophobicContact CG-CZ 3.79Å; Y341-K433 HydrophobicContact CD2-CG 4.09Å; Y341-K433 HydrophobicContact CE2-CG 3.93Å; Y341-K433 WeakPolarHBondContact CE2-O 3.4Å; Y341-K433 PolarHBondContact OH-O 3.13Å; Y341-L436 VanDerWaalsContact OH-CB 3.31Å; Y341-L436 WeakPolarHBondContact OH-CB 3.37Å; Y341-L436 PolarHBondContact OH-O 3.5Å; Y341-S518 CarbonylContact O-C 3.57Å; Y341-G519 PolarHBondContact O-N 3.14Å
342	M	98.1	Very high	97.9	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	113.7	172.1	-66.2	-63.3	-65.7	0	0	107.9	I335 A336 S337 P340 F344 L494 I504 L505 L507 L515 S518 V520	I335-M342 CarbonylContact C-O 3.46Å; A336-M342 PolarHBondContact N-O 3.03Å; S337-M342 PolarHBondContact O-N 2.82Å; P340-M342 PolarHBondContact O-N 2.92Å; M342-F344 HydrophobicContact CB-CE2 3.93Å; M342-F344 HydrophobicContact CB-CZ 4.48Å; M342-F344 HydrophobicContact CE-CZ 4.15Å; M342-L494 HydrophobicContact CB-CD1 3.75Å; M342-L494 HydrophobicContact CB-CD2 4.45Å; M342-L494 HydrophobicContact CE-CD2 4.27Å; M342-L494 HydrophobicContact CG-CD1 4.07Å; M342-L494 HydrophobicContact CG-CD2 3.86Å; M342-I504 HydrophobicContact CE-CG2 3.87Å; M342-I504 HydrophobicContact SD-CG2 4.08Å; M342-L505 HydrophobicContact CE-CD2 4.06Å; M342-L507 HydrophobicContact CE-CD1 4.23Å; M342-L515 HydrophobicContact CE-CD1 3.81Å; M342-S518 PolarHBondContact SD-OG 3.28Å; M342-V520 HydrophobicContact SD-CG2 4.37Å
343	V	98.8	Very high	97.8	Very high	1 Å²	1	8.7 Å²	8.7	1%	0.006	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	129.5	-167.3	-173.1	0	0	0	0	110.3	L333 L334 I335 F429 L516 Y517	L333-V343 HydrophobicContact CD1-CG1 3.45Å; L333-V343 VanDerWaalsContact CD1-CG1 3.45Å; L333-V343 HydrophobicContact CG-CG1 4.22Å; L334-V343 CarbonylContact O-C 3.4Å; L334-V343 WeakPolarHBondContact O-CA 3.13Å; I335-V343 HydrophobicContact CG1-CG1 4.33Å; I335-V343 HydrophobicContact CG1-CG2 4.34Å; I335-V343 HydrophobicContact CG2-CG2 4.42Å; V343-F429 HydrophobicContact CG1-CG 4.39Å; V343-F429 HydrophobicContact CG2-CD1 4.24Å; V343-F429 HydrophobicContact CG2-CD2 4.03Å; V343-F429 HydrophobicContact CG2-CE1 3.9Å; V343-F429 HydrophobicContact CG2-CE2 3.69Å; V343-F429 HydrophobicContact CG2-CG 4.29Å; V343-F429 HydrophobicContact CG2-CZ 3.62Å; V343-L516 PolarHBondContact O-N 3.03Å; V343-Y517 PolarHBondContact N-O 2.99Å; V343-Y517 PolarHBondContact O-N 3.28Å; V343-Y517 VanDerWaalsContact O-N 3.13Å
344	F	98.8	Very high	97.6	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	147	-173.2	-54.1	-103.7	0	0	0	112.2	L333 L334 A336 M342 L490 L494 L507 Q510 F513 V514 L515	L333-F344 WeakPolarHBondContact CA-O 3.35Å; L334-F344 HydrophobicContact CB-CB 4.4Å; L334-F344 HydrophobicContact CD2-CD2 4.37Å; L334-F344 PolarHBondContact N-O 3.47Å; L334-F344 PolarHBondContact O-N 3.01Å; A336-F344 HydrophobicContact CB-CD2 4.18Å; A336-F344 HydrophobicContact CB-CE2 3.89Å; M342-F344 HydrophobicContact CB-CE2 3.93Å; M342-F344 HydrophobicContact CB-CZ 4.48Å; M342-F344 HydrophobicContact CE-CZ 4.15Å; F344-L490 HydrophobicContact CE1-CD2 4.41Å; F344-L490 HydrophobicContact CZ-CD2 4.31Å; F344-L494 HydrophobicContact CE2-CD1 4.2Å; F344-L494 HydrophobicContact CZ-CD1 4.49Å; F344-L507 HydrophobicContact CE1-CD1 4.04Å; F344-L507 HydrophobicContact CZ-CD1 3.59Å; F344-Q510 HydrophobicContact CE1-CG 4.49Å; F344-F513 HydrophobicContact CB-CB 3.85Å; F344-F513 HydrophobicContact CB-CD1 3.52Å; F344-F513 HydrophobicContact CB-CE1 4.48Å; F344-F513 HydrophobicContact CB-CG 4.03Å; F344-F513 HydrophobicContact CD1-CB 4.1Å; F344-F513 HydrophobicContact CG-CB 4.21Å; F344-V514 CarbonylContact C-O 3.55Å; F344-V514 VanDerWaalsContact CA-O 3.22Å; F344-V514 WeakPolarHBondContact CA-O 3.33Å; F344-L515 HydrophobicContact CD1-CB 4.01Å; F344-L515 HydrophobicContact CD1-CD1 4.04Å; F344-L515 HydrophobicContact CE1-CB 3.99Å; F344-L515 HydrophobicContact CE1-CD1 3.63Å; F344-L515 HydrophobicContact CE1-CG 4.4Å; F344-L515 HydrophobicContact CE2-CD1 4.31Å; F344-L515 HydrophobicContact CZ-CD1 3.78Å
345	F	98.8	Very high	97.4	Very high	1 Å²	1	11.4 Å²	11.4	0%	0.004	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	138.9	167.7	166.7	-88.1	0	0	0	109.4	S331 Y332 H347 T418 M421 Q422 M425 F513 V514 L516	S331-F345 VanDerWaalsContact OG-CE2 3.24Å; S331-F345 WeakPolarHBondContact OG-CE2 3.32Å; S331-F345 WeakPolarHBondContact OG-CZ 3.38Å; Y332-F345 CarbonylContact O-C 3.45Å; Y332-F345 WeakPolarHBondContact O-CA 3.3Å; F345-H347 AromaticContact CE1-CD2 3.82Å; F345-H347 AromaticContact CE1-CE1 3.96Å; F345-H347 AromaticContact CE1-NE2 3.67Å; F345-H347 AromaticContact CZ-CE1 3.77Å; F345-H347 AromaticContact CZ-ND1 3.96Å; F345-H347 AromaticContact CZ-NE2 3.97Å; F345-T418 HydrophobicContact CE1-CG2 4.01Å; F345-T418 HydrophobicContact CZ-CG2 4.11Å; F345-M421 HydrophobicContact CE2-CB 3.9Å; F345-M421 HydrophobicContact CE2-CE 4.24Å; F345-M421 HydrophobicContact CZ-CE 4.01Å; F345-Q422 HydrophobicContact CB-CG 4.07Å; F345-Q422 HydrophobicContact CD1-CG 3.86Å; F345-Q422 HydrophobicContact CD2-CG 3.69Å; F345-Q422 HydrophobicContact CE1-CG 4.2Å; F345-Q422 HydrophobicContact CE2-CG 4.04Å; F345-Q422 HydrophobicContact CG-CG 3.6Å; F345-Q422 HydrophobicContact CZ-CG 4.29Å; F345-M425 HydrophobicContact CD2-CE 3.69Å; F345-M425 HydrophobicContact CD2-SD 3.64Å; F345-M425 HydrophobicContact CE2-CE 4.35Å; F345-M425 HydrophobicContact CE2-SD 3.97Å; F345-F513 CarbonylContact O-C 3.47Å; F345-F513 WeakPolarHBondContact O-CA 3.47Å; F345-V514 HydrophobicContact CD1-CB 4.39Å; F345-V514 HydrophobicContact CD1-CG2 4.49Å; F345-V514 PolarHBondContact N-O 2.88Å; F345-V514 PolarHBondContact O-N 3.45Å; F345-L516 HydrophobicContact CB-CD1 3.96Å; F345-L516 HydrophobicContact CB-CD2 3.83Å; F345-L516 HydrophobicContact CB-CG 3.82Å
346	R	98.6	Very high	97.2	Very high	16 Å²	16	15.9 Å²	15.9	6%	0.06	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	146.3	159.7	-167.1	-170.1	-178.7	-70.7	-4.7	109.7	S331 Y332 T483 E486 D512 F513	S331-R346 PolarHBondContact OG-O 3.31Å; Y332-R346 PolarHBondContact N-O 2.86Å; Y332-R346 PolarHBondContact O-N 2.91Å; R346-T483 PolarHBondContact NH1-OG1 3.38Å; R346-E486 IonicContact NE-OE2 3.12Å; R346-D512 HydrophobicContact CG-CB 3.89Å; R346-D512 IonicContact CZ-OD2 3.2Å; R346-D512 VanDerWaalsContact NE-CB 3.35Å; R346-D512 IonicContact NE-OD2 3.38Å; R346-D512 IonicContact NH2-OD2 2.65Å; R346-D512 PolarHBondContact NH2-OD2 2.76Å; R346-F513 HydrophobicContact CB-CD1 3.48Å; R346-F513 VanDerWaalsContact CB-CD1 3.48Å; R346-F513 HydrophobicContact CB-CD2 4.34Å; R346-F513 HydrophobicContact CB-CE1 3.41Å; R346-F513 VanDerWaalsContact CB-CE1 3.41Å; R346-F513 HydrophobicContact CB-CE2 4.29Å; R346-F513 HydrophobicContact CB-CG 3.95Å; R346-F513 HydrophobicContact CB-CZ 3.84Å; R346-F513 HydrophobicContact CG-CD1 4.47Å; R346-F513 HydrophobicContact CG-CE1 4.49Å; R346-F513 HydrophobicContact CG-CG 4.49Å
347	H	98.4	Very high	97.2	Very high	40 Å²	40	16.9 Å²	16.9	19%	0.185	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	149.6	163.9	-78.7	-65.8	0	0	0	112.6	F345 M391 T418	F345-H347 AromaticContact CE1-CD2 3.82Å; F345-H347 AromaticContact CE1-CE1 3.96Å; F345-H347 AromaticContact CE1-NE2 3.67Å; F345-H347 AromaticContact CZ-CE1 3.77Å; F345-H347 AromaticContact CZ-ND1 3.96Å; F345-H347 AromaticContact CZ-NE2 3.97Å; H347-M391 HydrophobicContact CB-CG 3.89Å; H347-T418 PolarHBondContact CE1-OG1 2.92Å; H347-T418 WeakPolarHBondContact NE2-CG2 3.4Å; H347-T418 PolarHBondContact NE2-OG1 3.42Å
348	G	97.4	Very high	97	Very high	4 Å²	4	19.2 Å²	19.2	4%	0.041	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	-106.1	166.1	0	0	0	0	0	110.4	R330	R330-G348 CarbonylContact O-C 3.59Å; R330-G348 WeakPolarHBondContact O-CA 3.37Å; R330-G348 PolarHBondContact O-N 3.49Å
349	Y	98.3	Very high	96.8	Very high	7 Å²	7	21.1 Å²	21.1	3%	0.027	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	160.8	-169.3	54.7	-88.1	0	0	0	111.4	R330 Y332 R351 V388 W389 L476 V479 I480	R330-Y349 HydrophobicContact CB-CD1 4.29Å; R330-Y349 HydrophobicContact CB-CD2 4.27Å; R330-Y349 HydrophobicContact CB-CE1 4.03Å; R330-Y349 HydrophobicContact CB-CE2 4.05Å; R330-Y349 HydrophobicContact CB-CG 4.4Å; R330-Y349 HydrophobicContact CG-CD1 4.12Å; R330-Y349 HydrophobicContact CG-CE1 3.56Å; R330-Y349 HydrophobicContact CG-CE2 4.38Å; R330-Y349 PolarHBondContact N-O 2.92Å; R330-Y349 PolarHBondContact NH1-OH 3.01Å; R330-Y349 PolarHBondContact O-N 2.99Å; Y332-Y349 HydrophobicContact CE2-CE1 4.48Å; Y349-R351 HydrophobicContact CD2-CG 3.87Å; Y349-R351 HydrophobicContact CE2-CG 3.56Å; Y349-V388 HydrophobicContact CD2-CG1 3.74Å; Y349-V388 HydrophobicContact CG-CG1 4.15Å; Y349-W389 WeakPolarHBondContact CB-O 3.16Å; Y349-L476 HydrophobicContact CD1-CD2 3.59Å; Y349-L476 HydrophobicContact CD2-CD2 3.86Å; Y349-L476 HydrophobicContact CE1-CD2 3.49Å; Y349-L476 VanDerWaalsContact CE1-CD2 3.49Å; Y349-L476 HydrophobicContact CE2-CD2 3.72Å; Y349-L476 HydrophobicContact CG-CD2 3.79Å; Y349-V479 HydrophobicContact CD1-CG1 4.24Å; Y349-I480 HydrophobicContact CE1-CD1 3.94Å
350	V	98.4	Very high	96.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	144.2	172.2	-175.5	0	0	0	0	110.1	L322 F327 D328 V329 L352 V388 W389 F394	L322-V350 HydrophobicContact CD1-CG1 3.99Å; F327-V350 HydrophobicContact CB-CG1 3.82Å; F327-V350 HydrophobicContact CD2-CG1 3.56Å; F327-V350 HydrophobicContact CE2-CG1 4.39Å; F327-V350 HydrophobicContact CG-CG1 3.98Å; D328-V350 CarbonylContact O-C 3.5Å; D328-V350 WeakPolarHBondContact O-CA 3.35Å; V329-V350 HydrophobicContact CG2-CG2 4.34Å; V350-L352 HydrophobicContact CB-CD1 4.31Å; V350-L352 HydrophobicContact CG1-CD1 3.72Å; V350-L352 HydrophobicContact CG1-CG 4.17Å; V350-V388 WeakPolarHBondContact O-CA 3.43Å; V350-W389 HydrophobicContact CB-CB 4.1Å; V350-W389 HydrophobicContact CG2-CB 4.4Å; V350-W389 PolarHBondContact N-O 2.83Å; V350-W389 PolarHBondContact O-N 2.93Å; V350-F394 HydrophobicContact CG2-CB 3.72Å; V350-F394 HydrophobicContact CG2-CD1 3.72Å; V350-F394 HydrophobicContact CG2-CG 3.83Å
351	R	97.6	Very high	96.3	Very high	18 Å²	18	24.7 Å²	24.7	7%	0.068	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	115.5	170	-60.5	-175.7	-60.2	-162.9	2.6	109.1	F327 D328 R330 Y349 D449	F327-R351 CarbonylContact C-O 3.51Å; F327-R351 WeakPolarHBondContact CA-O 3.44Å; F327-R351 WeakPolarHBondContact CB-O 3.42Å; D328-R351 PolarHBondContact N-O 3.43Å; D328-R351 PolarHBondContact O-N 3.45Å; D328-R351 IonicContact OD1-CZ 2.68Å; D328-R351 IonicContact OD1-NE 3.73Å; D328-R351 PolarHBondContact OD1-NE 3.25Å; D328-R351 IonicContact OD1-NH2 3.2Å; D328-R351 PolarHBondContact OD1-NH2 3.33Å; D328-R351 IonicContact OD2-CZ 3.68Å; D328-R351 VanDerWaalsContact OD2-CZ 3.22Å; D328-R351 IonicContact OD2-NE 2.7Å; D328-R351 PolarHBondContact OD2-NE 3.45Å; D328-R351 IonicContact OD2-NH2 2.74Å; D328-R351 PolarHBondContact OD2-NH2 3Å; R330-R351 VanDerWaalsContact NH2-NH1 3.11Å; Y349-R351 HydrophobicContact CD2-CG 3.87Å; Y349-R351 HydrophobicContact CE2-CG 3.56Å; R351-D449 IonicContact CZ-OD2 3.22Å; R351-D449 IonicContact NH1-OD2 3.2Å; R351-D449 PolarHBondContact NH1-OD2 2.88Å; R351-D449 VanDerWaalsContact NH2-CG 3.34Å; R351-D449 IonicContact NH2-OD2 3.86Å; R351-D449 PolarHBondContact NH2-OD2 2.65Å
352	L	97	Very high	95.8	Very high	2 Å²	2	34 Å²	34	1%	0.01	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	156.1	177.9	-58.4	86.7	0	0	0	110.4	L322 K326 F327 V350 T387 W389	L322-L352 HydrophobicContact CB-CD2 3.83Å; L322-L352 HydrophobicContact CD1-CD2 4.28Å; K326-L352 CarbonylContact O-C 3.52Å; K326-L352 WeakPolarHBondContact O-CA 3.31Å; F327-L352 HydrophobicContact CB-CG 4.07Å; V350-L352 HydrophobicContact CB-CD1 4.31Å; V350-L352 HydrophobicContact CG1-CD1 3.72Å; V350-L352 HydrophobicContact CG1-CG 4.17Å; L352-T387 PolarHBondContact N-O 3.43Å; L352-W389 HydrophobicContact CD1-CB 4.44Å; L352-W389 HydrophobicContact CD1-CD2 4.2Å; L352-W389 HydrophobicContact CD1-CG 3.9Å; L352-W389 HydrophobicContact CD2-CD2 4.46Å; L352-W389 HydrophobicContact CD2-CZ2 4.19Å
353	T	96.6	Very high	95.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	154.4	161.6	52.5	0	0	0	0	110.5	R325 K326 D355 S365 T369	R325-T353 WeakPolarHBondContact CD-O 3.38Å; K326-T353 HydrophobicContact CB-CG2 4.12Å; K326-T353 PolarHBondContact N-OG1 3.4Å; K326-T353 PolarHBondContact O-N 2.93Å; K326-T353 PolarHBondContact O-OG1 3.12Å; T353-D355 WeakPolarHBondContact CB-O 3.42Å; T353-D355 PolarHBondContact OG1-O 3.3Å; T353-S365 VanDerWaalsContact CG2-O 3.31Å; T353-S365 WeakPolarHBondContact CG2-O 3.16Å; T353-T369 HydrophobicContact CG2-CG2 4.01Å
354	C	94.6	Very high	94.8	Very high	17 Å²	17	39.9 Å²	39.9	12%	0.115	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	-45.3	166.4	-56.6	0	0	0	0	109.6	R325 Q374 N377 V383	R325-C354 VanDerWaalsContact CD-O 3.28Å; R325-C354 WeakPolarHBondContact CD-O 3.3Å; C354-Q374 PolarHBondContact SG-OE1 3.08Å; C354-N377 HydrophobicContact CB-CB 4.23Å; C354-V383 HydrophobicContact CB-CG2 4.08Å
355	D	93.6	Very high	94.3	Very high	41 Å²	41	40.5 Å²	40.5	22%	0.219	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	150.3	-177.1	-48.8	-69	0	0	0	112.2	R325 T353 S365 A366 N377	R325-D355 WeakPolarHBondContact CG-O 3.24Å; T353-D355 WeakPolarHBondContact CB-O 3.42Å; T353-D355 PolarHBondContact OG1-O 3.3Å; D355-S365 WeakPolarHBondContact OD2-CB 3.46Å; D355-S365 PolarHBondContact OD2-OG 3.27Å; D355-A366 HydrophobicContact CB-CB 4.12Å; D355-N377 PolarHBondContact OD1-ND2 2.7Å; D355-N377 PolarHBondContact OD2-ND2 2.97Å
356	V	95.6	Very high	93.9	Very high	94 Å²	94	40.6 Å²	40.6	57%	0.57	22%	0.216	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-61.6	145.2	166.6	173.5	0	0	0	0	109.9	D324	D324-V356 HydrophobicContact CB-CG1 3.96Å
357	Y	97	Very high	93.7	Very high	23 Å²	23	40.1 Å²	40.1	9%	0.09	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-81.8	117.9	179.6	-179.3	-107.8	0	0	0	111.9	Y315 Q317 P319 L321 D324 K326 P359 H367	Y315-Y357 WeakPolarHBondContact CE1-OH 3.47Å; Q317-Y357 WeakPolarHBondContact O-CE1 3.28Å; Q317-Y357 PolarHBondContact O-OH 3.45Å; P319-Y357 HydrophobicContact CG-CD1 4.1Å; P319-Y357 HydrophobicContact CG-CE1 3.81Å; P319-Y357 HydrophobicContact CG-CE2 4.37Å; P319-Y357 HydrophobicContact CG-CG 4.48Å; L321-Y357 HydrophobicContact CD1-CD1 4.23Å; L321-Y357 HydrophobicContact CD2-CD1 3.83Å; L321-Y357 HydrophobicContact CD2-CG 3.88Å; D324-Y357 WeakPolarHBondContact O-CB 3.17Å; D324-Y357 PolarHBondContact O-N 3.39Å; K326-Y357 HydrophobicContact CB-CD2 3.83Å; K326-Y357 HydrophobicContact CB-CG 4.12Å; K326-Y357 HydrophobicContact CD-CD2 3.75Å; K326-Y357 HydrophobicContact CD-CE2 3.77Å; K326-Y357 HydrophobicContact CG-CD2 4.29Å; Y357-P359 HydrophobicContact CE1-CB 4.35Å; Y357-H367 AromaticContact CE2-ND1 3.72Å
358	D	94.6	Very high	93.5	Very high	60 Å²	60	38.6 Å²	38.6	32%	0.321	21%	0.208	S	C	.	.			trans	-124.2	123	165.9	160.4	30	0	0	0	108.3	T360 S361 H367	D358-T360 VanDerWaalsContact C-N 3.25Å; D358-T360 VanDerWaalsContact CG-OG1 3.25Å; D358-T360 PolarHBondContact O-N 3.4Å; D358-T360 WeakPolarHBondContact OD1-CA 3.28Å; D358-T360 WeakPolarHBondContact OD1-CB 3.25Å; D358-T360 PolarHBondContact OD1-N 3.02Å; D358-T360 PolarHBondContact OD1-OG1 3.19Å; D358-T360 PolarHBondContact OD2-OG1 2.91Å; D358-S361 VanDerWaalsContact OD2-CA 3.3Å; D358-S361 WeakPolarHBondContact OD2-CA 3.49Å; D358-S361 WeakPolarHBondContact OD2-CB 3.42Å; D358-S361 PolarHBondContact OD2-N 2.89Å; D358-H367 PolarHBondContact O-CE1 2.87Å
359	P	91.7	Very high	93.3	Very high	42 Å²	42	38.9 Å²	38.9	27%	0.273	21%	0.209	S	C	.	.	S	Bend	trans	-65.8	-26.2	177.8	27.4	-34.4	0	0	0	112.8	M260 K278 Q317 Y357	M260-P359 WeakPolarHBondContact CE-O 3.37Å; K278-P359 PolarHBondContact NZ-O 3.5Å; Q317-P359 HydrophobicContact CG-CB 4.11Å; Y357-P359 HydrophobicContact CE1-CB 4.35Å
360	T	90.4	Very high	92.9	Very high	107 Å²	107	39.8 Å²	39.8	66%	0.656	21%	0.214	S	C	*	.	S	Bend	trans	-78.2	-40.4	-177.2	76	0	0	0	0	112	K278 D358 K362	K278-T360 PolarHBondContact NZ-O 2.94Å; D358-T360 VanDerWaalsContact C-N 3.25Å; D358-T360 VanDerWaalsContact CG-OG1 3.25Å; D358-T360 PolarHBondContact O-N 3.4Å; D358-T360 WeakPolarHBondContact OD1-CA 3.28Å; D358-T360 WeakPolarHBondContact OD1-CB 3.25Å; D358-T360 PolarHBondContact OD1-N 3.02Å; D358-T360 PolarHBondContact OD1-OG1 3.19Å; D358-T360 PolarHBondContact OD2-OG1 2.91Å; T360-K362 PolarHBondContact O-N 2.93Å
361	S	90	Very high	92.2	Very high	31 Å²	31	41.2 Å²	41.2	22%	0.217	22%	0.221	C	C	.	.			trans	-35.8	130	-179.4	-177.1	0	0	0	0	114.4	K278 D358 N363 H367	K278-S361 PolarHBondContact NZ-O 2.68Å; D358-S361 VanDerWaalsContact OD2-CA 3.3Å; D358-S361 WeakPolarHBondContact OD2-CA 3.49Å; D358-S361 WeakPolarHBondContact OD2-CB 3.42Å; D358-S361 PolarHBondContact OD2-N 2.89Å; S361-N363 PolarHBondContact O-N 2.69Å; S361-N363 PolarHBondContact OG-N 2.81Å; S361-N363 VanDerWaalsContact OG-N 3.13Å; S361-H367 PolarHBondContact O-NE2 2.71Å
362	K	86.8	Confident	91.8	Very high	211 Å²	211	44 Å²	44	92%	0.917	23%	0.232	S	C	*	.	S	Bend	trans	-77.6	-7.7	173.1	-63.6	-175.6	179.6	-177.5	0	112.5	T360 L364	T360-K362 PolarHBondContact O-N 2.93Å; K362-L364 PolarHBondContact O-N 3.09Å
363	N	87.9	Confident	91.3	Very high	78 Å²	78	45.1 Å²	45.1	42%	0.417	24%	0.237	S	C	.	.			trans	-80.8	115.3	-178.9	-176.8	7.6	0	0	0	111.8	S361 S365 A366 H367	S361-N363 PolarHBondContact O-N 2.69Å; S361-N363 PolarHBondContact OG-N 2.81Å; S361-N363 VanDerWaalsContact OG-N 3.13Å; N363-S365 VanDerWaalsContact C-N 3.26Å; N363-S365 VanDerWaalsContact CG-OG 3.27Å; N363-S365 PolarHBondContact ND2-OG 3.32Å; N363-S365 PolarHBondContact O-N 2.92Å; N363-S365 PolarHBondContact OD1-N 3.47Å; N363-S365 VanDerWaalsContact OD1-N 3.07Å; N363-S365 PolarHBondContact OD1-OG 3.05Å; N363-S365 VanDerWaalsContact OD1-OG 3.07Å; N363-A366 PolarHBondContact O-N 3.37Å; N363-H367 PolarHBondContact O-CD2 3.13Å
364	L	88.8	Confident	91.1	Very high	46 Å²	46	45.2 Å²	45.2	24%	0.241	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-68.1	-18.5	-178.2	-164.6	63.9	0	0	0	113.9	L276 K362 H367 L368 M373	L276-L364 HydrophobicContact CD1-CD1 4.5Å; L276-L364 HydrophobicContact CG-CD1 4.4Å; K362-L364 PolarHBondContact O-N 3.09Å; L364-H367 HydrophobicContact CD1-CB 4.31Å; L364-H367 PolarHBondContact O-N 3.07Å; L364-H367 VanDerWaalsContact O-N 3.14Å; L364-L368 HydrophobicContact CD1-CD1 3.94Å; L364-L368 HydrophobicContact CD1-CG 3.93Å; L364-L368 HydrophobicContact CD2-CD1 3.76Å; L364-L368 HydrophobicContact CG-CD1 3.62Å; L364-L368 HydrophobicContact CG-CG 3.89Å; L364-L368 PolarHBondContact O-N 2.93Å; L364-L368 VanDerWaalsContact O-N 3.07Å; L364-M373 HydrophobicContact CD2-CE 4.17Å; L364-M373 HydrophobicContact CG-CE 4.49Å
365	S	88.2	Confident	90.9	Very high	13 Å²	13	49.3 Å²	49.3	9%	0.091	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-69.3	-30.9	176.5	65.2	0	0	0	0	113.3	T353 D355 N363 H367 Q374	T353-S365 VanDerWaalsContact CG2-O 3.31Å; T353-S365 WeakPolarHBondContact CG2-O 3.16Å; D355-S365 WeakPolarHBondContact OD2-CB 3.46Å; D355-S365 PolarHBondContact OD2-OG 3.27Å; N363-S365 VanDerWaalsContact C-N 3.26Å; N363-S365 VanDerWaalsContact CG-OG 3.27Å; N363-S365 PolarHBondContact ND2-OG 3.32Å; N363-S365 PolarHBondContact O-N 2.92Å; N363-S365 PolarHBondContact OD1-N 3.47Å; N363-S365 VanDerWaalsContact OD1-N 3.07Å; N363-S365 PolarHBondContact OD1-OG 3.05Å; N363-S365 VanDerWaalsContact OD1-OG 3.07Å; S365-H367 PolarHBondContact O-N 3Å; S365-Q374 PolarHBondContact O-NE2 3.2Å
366	A	90.5	Very high	90.7	Very high	3 Å²	3	54.7 Å²	54.7	3%	0.025	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-69.3	-18.3	171.3	0	0	0	0	0	112.7	D355 N363	D355-A366 HydrophobicContact CB-CB 4.12Å; N363-A366 PolarHBondContact O-N 3.37Å
367	H	93.8	Very high	90.4	Very high	5 Å²	5	51 Å²	51	2%	0.023	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-25.2	-175.3	-65.1	-47.7	0	0	0	114.7	L276 K278 Y315 K326 Y357 D358 S361 N363 L364 S365	L276-H367 HydrophobicContact CD1-CB 4.23Å; L276-H367 WeakPolarHBondContact CD1-CD2 3.21Å; K278-H367 PolarHBondContact NZ-NE2 3.15Å; K278-H367 VanDerWaalsContact NZ-NE2 3.11Å; Y315-H367 WeakPolarHBondContact OH-CB 3.31Å; Y315-H367 PolarHBondContact OH-ND1 2.75Å; K326-H367 PolarHBondContact NZ-O 2.94Å; Y357-H367 AromaticContact CE2-ND1 3.72Å; D358-H367 PolarHBondContact O-CE1 2.87Å; S361-H367 PolarHBondContact O-NE2 2.71Å; N363-H367 PolarHBondContact O-CD2 3.13Å; L364-H367 HydrophobicContact CD1-CB 4.31Å; L364-H367 PolarHBondContact O-N 3.07Å; L364-H367 VanDerWaalsContact O-N 3.14Å; S365-H367 PolarHBondContact O-N 3Å
368	L	94.3	Very high	90.1	Very high	9 Å²	9	55.6 Å²	55.6	5%	0.047	28%	0.28	C	S	.	.			trans	-120	105	-172.8	-61.3	-172.1	0	0	0	113.3	I262 I274 L364 N370 M373 Q374	I262-L368 HydrophobicContact CD1-CD2 3.98Å; I274-L368 HydrophobicContact CB-CD1 4.14Å; I274-L368 HydrophobicContact CG2-CD1 4.03Å; I274-L368 HydrophobicContact CG2-CD2 4.12Å; L364-L368 HydrophobicContact CD1-CD1 3.94Å; L364-L368 HydrophobicContact CD1-CG 3.93Å; L364-L368 HydrophobicContact CD2-CD1 3.76Å; L364-L368 HydrophobicContact CG-CD1 3.62Å; L364-L368 HydrophobicContact CG-CG 3.89Å; L364-L368 PolarHBondContact O-N 2.93Å; L364-L368 VanDerWaalsContact O-N 3.07Å; L368-N370 PolarHBondContact O-N 2.84Å; L368-N370 VanDerWaalsContact O-N 3.09Å; L368-M373 HydrophobicContact CB-CG 4.3Å; L368-M373 HydrophobicContact CD1-CG 4.33Å; L368-Q374 PolarHBondContact O-NE2 3.23Å
369	T	93.3	Very high	89.9	Confident	9 Å²	9	57.1 Å²	57.1	6%	0.055	29%	0.288	C	S	.	.			trans	-68.6	-0.9	-179.9	51	0	0	0	0	115.5	K326 D328 T353 Q371	K326-T369 HydrophobicContact CG-CG2 4.35Å; D328-T369 WeakPolarHBondContact OD1-CB 3.33Å; D328-T369 PolarHBondContact OD1-OG1 2.96Å; T353-T369 HydrophobicContact CG2-CG2 4.01Å; T369-Q371 PolarHBondContact O-N 3.35Å
370	N	89.9	Confident	89.9	Confident	26 Å²	26	55.9 Å²	55.9	14%	0.139	28%	0.278	C	S	.	.			trans	-63.7	123.8	-179.8	-59	103.6	0	0	0	110.9	L368 Y372 M373 Q374	L368-N370 PolarHBondContact O-N 2.84Å; L368-N370 VanDerWaalsContact O-N 3.09Å; N370-Y372 PolarHBondContact O-N 2.9Å; N370-M373 HydrophobicContact CB-CG 4.31Å; N370-M373 WeakPolarHBondContact O-CA 3.47Å; N370-M373 WeakPolarHBondContact O-CB 3.4Å; N370-M373 PolarHBondContact O-N 2.94Å; N370-Q374 PolarHBondContact O-N 3.34Å
371	Q	85.1	Confident	89.9	Confident	30 Å²	30	55.4 Å²	55.4	14%	0.14	28%	0.279	C	S	.	.	H	α-helix	trans	-52.9	-28.4	179.3	-83.3	-165.4	-12	0	0	114.7	T369 M373 Q374 K375 N472	T369-Q371 PolarHBondContact O-N 3.35Å; Q371-M373 VanDerWaalsContact C-N 3.33Å; Q371-Q374 PolarHBondContact O-N 2.73Å; Q371-K375 VanDerWaalsContact O-CB 3.29Å; Q371-K375 WeakPolarHBondContact O-CB 3.47Å; Q371-K375 VanDerWaalsContact O-CG 3.28Å; Q371-K375 WeakPolarHBondContact O-CG 3.27Å; Q371-K375 PolarHBondContact O-N 3.33Å; Q371-N472 PolarHBondContact OE1-ND2 2.97Å; Q371-N472 VanDerWaalsContact OE1-ND2 3.17Å
372	Y	87.4	Confident	89.9	Confident	77 Å²	77	61.1 Å²	61.1	30%	0.302	30%	0.302	S	S	.	.	H	α-helix	trans	-68	-31.2	174.9	179.4	-95.6	0	0	0	113.2	R270 N370 R376	R270-Y372 HydrophobicContact CB-CD1 3.76Å; R270-Y372 HydrophobicContact CB-CE1 4.49Å; R270-Y372 HydrophobicContact CB-CG 3.78Å; R270-Y372 HydrophobicContact CG-CG 4.29Å; R270-Y372 WeakPolarHBondContact O-CD1 3.31Å; N370-Y372 PolarHBondContact O-N 2.9Å; Y372-R376 PolarHBondContact OH-NH2 2.71Å
373	M	87.8	Confident	90.1	Very high	26 Å²	26	52.6 Å²	52.6	13%	0.128	27%	0.268	C	S	.	.	H	α-helix	trans	-76.5	-44.8	170.9	-63.3	-59.4	-65.1	0	0	110.4	L364 L368 N370 Q371 K375 R376	L364-M373 HydrophobicContact CD2-CE 4.17Å; L364-M373 HydrophobicContact CG-CE 4.49Å; L368-M373 HydrophobicContact CB-CG 4.3Å; L368-M373 HydrophobicContact CD1-CG 4.33Å; N370-M373 HydrophobicContact CB-CG 4.31Å; N370-M373 WeakPolarHBondContact O-CA 3.47Å; N370-M373 WeakPolarHBondContact O-CB 3.4Å; N370-M373 PolarHBondContact O-N 2.94Å; Q371-M373 VanDerWaalsContact C-N 3.33Å; M373-K375 VanDerWaalsContact C-N 3.34Å; M373-K375 PolarHBondContact O-N 3.23Å; M373-R376 WeakPolarHBondContact O-CB 3.29Å; M373-R376 PolarHBondContact O-N 3.07Å
374	Q	92	Very high	90.3	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-63.4	-36.3	-179.5	-60.4	-54.4	-44	0	0	112.8	C354 S365 L368 N370 Q371 R376 N377 Y380	C354-Q374 PolarHBondContact SG-OE1 3.08Å; S365-Q374 PolarHBondContact O-NE2 3.2Å; L368-Q374 PolarHBondContact O-NE2 3.23Å; N370-Q374 PolarHBondContact O-N 3.34Å; Q371-Q374 PolarHBondContact O-N 2.73Å; Q374-R376 PolarHBondContact O-N 2.89Å; Q374-N377 VanDerWaalsContact O-CB 3.3Å; Q374-N377 WeakPolarHBondContact O-CB 3.14Å; Q374-N377 PolarHBondContact O-N 2.99Å; Q374-Y380 HydrophobicContact CB-CD2 4.03Å; Q374-Y380 HydrophobicContact CB-CE2 4.19Å; Q374-Y380 WeakPolarHBondContact O-CB 3.14Å; Q374-Y380 WeakPolarHBondContact O-CD2 3.19Å
375	K	90.1	Very high	90.5	Very high	103 Å²	103	53.1 Å²	53.1	45%	0.448	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-9.6	172.3	-81.7	-174.1	176.2	-157.5	0	115	Q371 M373 Y380 N472	Q371-K375 VanDerWaalsContact O-CB 3.29Å; Q371-K375 WeakPolarHBondContact O-CB 3.47Å; Q371-K375 VanDerWaalsContact O-CG 3.28Å; Q371-K375 WeakPolarHBondContact O-CG 3.27Å; Q371-K375 PolarHBondContact O-N 3.33Å; M373-K375 VanDerWaalsContact C-N 3.34Å; M373-K375 PolarHBondContact O-N 3.23Å; K375-Y380 HydrophobicContact CD-CE1 4.44Å; K375-Y380 HydrophobicContact CG-CD1 3.91Å; K375-Y380 HydrophobicContact CG-CD2 4.43Å; K375-Y380 HydrophobicContact CG-CE1 3.56Å; K375-Y380 HydrophobicContact CG-CE2 4.09Å; K375-Y380 HydrophobicContact CG-CG 4.35Å; K375-N472 PolarHBondContact NZ-ND2 3.32Å; K375-N472 PolarHBondContact NZ-OD1 2.88Å
376	R	89.1	Confident	90.6	Very high	155 Å²	155	56.4 Å²	56.4	59%	0.585	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-9.8	173.6	-59	174.3	171.5	-150.7	-6.3	113.1	Y372 M373 Q374	Y372-R376 PolarHBondContact OH-NH2 2.71Å; M373-R376 WeakPolarHBondContact O-CB 3.29Å; M373-R376 PolarHBondContact O-N 3.07Å; Q374-R376 PolarHBondContact O-N 2.89Å
377	N	89.3	Confident	90.8	Very high	17 Å²	17	56.3 Å²	56.3	9%	0.091	28%	0.281	C	S	.	.	S	Bend	trans	-72.5	128.2	173.8	-174.2	-55.6	0	0	0	108.8	C354 D355 Q374 L379 Y380	C354-N377 HydrophobicContact CB-CB 4.23Å; D355-N377 PolarHBondContact OD1-ND2 2.7Å; D355-N377 PolarHBondContact OD2-ND2 2.97Å; Q374-N377 VanDerWaalsContact O-CB 3.3Å; Q374-N377 WeakPolarHBondContact O-CB 3.14Å; Q374-N377 PolarHBondContact O-N 2.99Å; N377-L379 PolarHBondContact O-N 2.98Å; N377-L379 VanDerWaalsContact O-N 3.12Å; N377-L379 WeakPolarHBondContact OD1-CB 3.28Å; N377-L379 PolarHBondContact OD1-N 2.58Å; N377-Y380 VanDerWaalsContact O-CB 3.23Å; N377-Y380 WeakPolarHBondContact O-CB 3.47Å; N377-Y380 PolarHBondContact O-N 3.42Å
378	P	91.1	Very high	90.9	Very high	118 Å²	118	56.2 Å²	56.2	77%	0.766	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.8	-178.7	-27.8	35.8	0	0	0	114.6	Y380	P378-Y380 VanDerWaalsContact C-N 3.33Å
379	L	89.6	Confident	91.1	Very high	92 Å²	92	57.6 Å²	57.6	48%	0.482	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-9.3	-179.9	-57.3	178.7	0	0	0	113.3	N377 S381 Q382 V383	N377-L379 PolarHBondContact O-N 2.98Å; N377-L379 VanDerWaalsContact O-N 3.12Å; N377-L379 WeakPolarHBondContact OD1-CB 3.28Å; N377-L379 PolarHBondContact OD1-N 2.58Å; L379-S381 VanDerWaalsContact C-N 3.28Å; L379-S381 PolarHBondContact O-N 3.44Å; L379-S381 VanDerWaalsContact O-N 3.15Å; L379-Q382 WeakPolarHBondContact O-CB 3.49Å; L379-Q382 PolarHBondContact O-N 2.88Å; L379-V383 PolarHBondContact O-N 3.16Å; L379-V383 VanDerWaalsContact O-N 3.09Å
380	Y	91.6	Very high	91.4	Very high	17 Å²	17	58 Å²	58	7%	0.067	29%	0.289	C	S	.	.	H	α-helix	trans	-53.4	-41.8	-171.9	178.6	-89.5	0	0	0	113	Q374 K375 N377 P378 Q382 V383 K384 T387	Q374-Y380 HydrophobicContact CB-CD2 4.03Å; Q374-Y380 HydrophobicContact CB-CE2 4.19Å; Q374-Y380 WeakPolarHBondContact O-CB 3.14Å; Q374-Y380 WeakPolarHBondContact O-CD2 3.19Å; K375-Y380 HydrophobicContact CD-CE1 4.44Å; K375-Y380 HydrophobicContact CG-CD1 3.91Å; K375-Y380 HydrophobicContact CG-CD2 4.43Å; K375-Y380 HydrophobicContact CG-CE1 3.56Å; K375-Y380 HydrophobicContact CG-CE2 4.09Å; K375-Y380 HydrophobicContact CG-CG 4.35Å; N377-Y380 VanDerWaalsContact O-CB 3.23Å; N377-Y380 WeakPolarHBondContact O-CB 3.47Å; N377-Y380 PolarHBondContact O-N 3.42Å; P378-Y380 VanDerWaalsContact C-N 3.33Å; Y380-Q382 PolarHBondContact O-N 3.29Å; Y380-Q382 VanDerWaalsContact O-N 3.17Å; Y380-V383 PolarHBondContact O-N 3.44Å; Y380-K384 HydrophobicContact CD1-CB 4.32Å; Y380-K384 HydrophobicContact CE1-CB 3.82Å; Y380-K384 HydrophobicContact CE2-CB 4.39Å; Y380-K384 WeakPolarHBondContact O-CA 3.31Å; Y380-K384 VanDerWaalsContact O-CB 3.23Å; Y380-K384 WeakPolarHBondContact O-CB 3.37Å; Y380-K384 PolarHBondContact O-N 2.72Å; Y380-T387 HydrophobicContact CD2-CG2 4.4Å; Y380-T387 HydrophobicContact CE2-CG2 4.34Å
381	S	90.3	Very high	91.8	Very high	96 Å²	96	56.8 Å²	56.8	67%	0.671	28%	0.282	S	S	*	.	H	α-helix	trans	-60.4	-27	180	-60.9	0	0	0	0	113.5	L379	L379-S381 VanDerWaalsContact C-N 3.28Å; L379-S381 PolarHBondContact O-N 3.44Å; L379-S381 VanDerWaalsContact O-N 3.15Å
382	Q	90.9	Very high	92.4	Very high	152 Å²	152	60.7 Å²	60.7	71%	0.71	30%	0.301	S	S	*	.	H	α-helix	trans	-85.9	-47.9	177.8	-54.8	174.7	12.3	0	0	110.8	L379 Y380	L379-Q382 WeakPolarHBondContact O-CB 3.49Å; L379-Q382 PolarHBondContact O-N 2.88Å; Y380-Q382 PolarHBondContact O-N 3.29Å; Y380-Q382 VanDerWaalsContact O-N 3.17Å
383	V	91.1	Very high	92.9	Very high	32 Å²	32	60 Å²	60	19%	0.194	31%	0.307	C	S	.	.	H	α-helix	trans	-92.2	5.8	-173.6	-53.6	0	0	0	0	114.8	C354 L379 Y380 E385 D386 T387	C354-V383 HydrophobicContact CB-CG2 4.08Å; L379-V383 PolarHBondContact O-N 3.16Å; L379-V383 VanDerWaalsContact O-N 3.09Å; Y380-V383 PolarHBondContact O-N 3.44Å; V383-E385 VanDerWaalsContact C-N 3.27Å; V383-E385 PolarHBondContact O-N 3.28Å; V383-E385 VanDerWaalsContact O-N 3.13Å; V383-D386 WeakPolarHBondContact O-CA 3.41Å; V383-D386 WeakPolarHBondContact O-CB 3.41Å; V383-D386 PolarHBondContact O-N 2.98Å; V383-T387 HydrophobicContact CG2-CG2 4.16Å; V383-T387 PolarHBondContact O-N 3.42Å
384	K	91.3	Very high	93.4	Very high	70 Å²	70	58.8 Å²	58.8	30%	0.304	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-36.7	-171.2	58.2	-175.6	-176.9	77.7	0	114.6	Y380 T387	Y380-K384 HydrophobicContact CD1-CB 4.32Å; Y380-K384 HydrophobicContact CE1-CB 3.82Å; Y380-K384 HydrophobicContact CE2-CB 4.39Å; Y380-K384 WeakPolarHBondContact O-CA 3.31Å; Y380-K384 VanDerWaalsContact O-CB 3.23Å; Y380-K384 WeakPolarHBondContact O-CB 3.37Å; Y380-K384 PolarHBondContact O-N 2.72Å; K384-T387 PolarHBondContact O-N 3.41Å; K384-T387 PolarHBondContact O-OG1 3.2Å
385	E	93.1	Very high	93.7	Very high	64 Å²	64	59.2 Å²	59.2	30%	0.299	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-40.3	177	-54.2	-53.6	127.3	0	0	110.8	V383 T387 V388 C473 E474	V383-E385 VanDerWaalsContact C-N 3.27Å; V383-E385 PolarHBondContact O-N 3.28Å; V383-E385 VanDerWaalsContact O-N 3.13Å; E385-T387 PolarHBondContact O-N 2.95Å; E385-V388 PolarHBondContact O-N 2.86Å; E385-C473 VanDerWaalsContact CD-CB 3.46Å; E385-C473 WeakPolarHBondContact OE1-CA 3.37Å; E385-C473 VanDerWaalsContact OE1-CB 3.31Å; E385-C473 WeakPolarHBondContact OE1-CB 3.41Å; E385-C473 VanDerWaalsContact OE2-CA 3.31Å; E385-C473 WeakPolarHBondContact OE2-CA 3.42Å; E385-C473 WeakPolarHBondContact OE2-CB 3.16Å; E385-E474 PolarHBondContact OE2-N 2.83Å
386	D	91.7	Very high	94.1	Very high	82 Å²	82	56.7 Å²	56.7	44%	0.439	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-16.5	177.2	-53.5	-50.2	0	0	0	113.9	R325 V383 V388 W389	R325-D386 PolarHBondContact NH2-O 3.06Å; R325-D386 VanDerWaalsContact NH2-O 3.12Å; V383-D386 WeakPolarHBondContact O-CA 3.41Å; V383-D386 WeakPolarHBondContact O-CB 3.41Å; V383-D386 PolarHBondContact O-N 2.98Å; D386-V388 VanDerWaalsContact C-N 3.28Å; D386-W389 PolarHBondContact O-NE1 2.76Å
387	T	94.2	Very high	94.6	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.012	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-8.7	176.1	69.3	0	0	0	0	113.9	L352 Y380 V383 K384 E385	L352-T387 PolarHBondContact N-O 3.43Å; Y380-T387 HydrophobicContact CD2-CG2 4.4Å; Y380-T387 HydrophobicContact CE2-CG2 4.34Å; V383-T387 HydrophobicContact CG2-CG2 4.16Å; V383-T387 PolarHBondContact O-N 3.42Å; K384-T387 PolarHBondContact O-N 3.41Å; K384-T387 PolarHBondContact O-OG1 3.2Å; E385-T387 PolarHBondContact O-N 2.95Å
388	V	96.7	Very high	95	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	114.2	-179.2	-178.3	0	0	0	0	111.2	Y349 V350 E385 D386 V475 L476	Y349-V388 HydrophobicContact CD2-CG1 3.74Å; Y349-V388 HydrophobicContact CG-CG1 4.15Å; V350-V388 WeakPolarHBondContact O-CA 3.43Å; E385-V388 PolarHBondContact O-N 2.86Å; D386-V388 VanDerWaalsContact C-N 3.28Å; V388-V475 HydrophobicContact CG1-CB 3.97Å; V388-V475 HydrophobicContact CG1-CG1 3.91Å; V388-L476 HydrophobicContact CG1-CD2 4.15Å; V388-L476 HydrophobicContact CG1-CG 4.15Å; V388-L476 HydrophobicContact CG2-CD1 4.43Å
389	W	97.9	Very high	95.3	Very high	38 Å²	38	46.5 Å²	46.5	14%	0.144	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	149.9	173.7	-63.1	-0.5	0	0	0	111.5	L322 Y349 V350 L352 D386 Y397	L322-W389 HydrophobicContact CB-CH2 4.09Å; L322-W389 HydrophobicContact CB-CZ3 4.14Å; L322-W389 HydrophobicContact CD1-CE3 4.02Å; L322-W389 HydrophobicContact CD1-CZ3 3.94Å; L322-W389 HydrophobicContact CD2-CZ3 4.07Å; L322-W389 HydrophobicContact CG-CZ3 4.26Å; Y349-W389 WeakPolarHBondContact CB-O 3.16Å; V350-W389 HydrophobicContact CB-CB 4.1Å; V350-W389 HydrophobicContact CG2-CB 4.4Å; V350-W389 PolarHBondContact N-O 2.83Å; V350-W389 PolarHBondContact O-N 2.93Å; L352-W389 HydrophobicContact CD1-CB 4.44Å; L352-W389 HydrophobicContact CD1-CD2 4.2Å; L352-W389 HydrophobicContact CD1-CG 3.9Å; L352-W389 HydrophobicContact CD2-CD2 4.46Å; L352-W389 HydrophobicContact CD2-CZ2 4.19Å; D386-W389 PolarHBondContact O-NE1 2.76Å; W389-Y397 AromaticContact CH2-CD2 3.68Å; W389-Y397 HydrophobicContact CH2-CD2 3.68Å; W389-Y397 AromaticContact CH2-CE2 3.98Å; W389-Y397 HydrophobicContact CH2-CE2 3.98Å; W389-Y397 HydrophobicContact CH2-CG 4.04Å; W389-Y397 HydrophobicContact CZ3-CD1 4.31Å; W389-Y397 AromaticContact CZ3-CD2 3.84Å; W389-Y397 HydrophobicContact CZ3-CD2 3.84Å; W389-Y397 HydrophobicContact CZ3-CE2 4.48Å; W389-Y397 AromaticContact CZ3-CG 3.72Å; W389-Y397 HydrophobicContact CZ3-CG 3.72Å
390	S	98.2	Very high	95.7	Very high	18 Å²	18	48.3 Å²	48.3	13%	0.126	26%	0.256	C	S	.	.			trans	-70.2	166.1	165.5	72.4	0	0	0	0	110.8	E392 S393 F394	S390-E392 VanDerWaalsContact CB-OE2 3.22Å; S390-E392 WeakPolarHBondContact CB-OE2 3.34Å; S390-E392 PolarHBondContact O-N 2.91Å; S390-E392 PolarHBondContact OG-OE2 3.29Å; S390-S393 PolarHBondContact O-N 2.99Å; S390-S393 PolarHBondContact OG-N 3.2Å; S390-S393 VanDerWaalsContact OG-N 3.15Å; S390-S393 PolarHBondContact OG-OG 2.68Å; S390-F394 PolarHBondContact O-N 3.24Å; S390-F394 VanDerWaalsContact O-N 3.14Å
391	M	98.4	Very high	96	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-67.3	-29	176.7	-68.7	-58.8	-46	0	0	111.7	V329 H347 F394 N395 V413 L414 F417	V329-M391 HydrophobicContact CG1-CE 4.33Å; V329-M391 HydrophobicContact CG1-SD 3.73Å; H347-M391 HydrophobicContact CB-CG 3.89Å; M391-F394 HydrophobicContact CE-CD1 3.99Å; M391-N395 VanDerWaalsContact O-CB 3.24Å; M391-N395 WeakPolarHBondContact O-CB 3.31Å; M391-N395 PolarHBondContact O-N 3.32Å; M391-V413 HydrophobicContact CE-CG1 3.39Å; M391-L414 HydrophobicContact CB-CD2 4.18Å; M391-F417 HydrophobicContact CE-CD1 4.43Å; M391-F417 HydrophobicContact CE-CE1 4.15Å
392	E	98.3	Very high	96.3	Very high	112 Å²	112	51.7 Å²	51.7	52%	0.523	26%	0.255	S	S	.	.	H	α-helix	trans	-69.8	-45.5	178.8	-61.1	65	-141.7	0	0	110.3	S390 N395 A396	S390-E392 VanDerWaalsContact CB-OE2 3.22Å; S390-E392 WeakPolarHBondContact CB-OE2 3.34Å; S390-E392 PolarHBondContact O-N 2.91Å; S390-E392 PolarHBondContact OG-OE2 3.29Å; E392-N395 PolarHBondContact O-N 2.96Å; E392-A396 WeakPolarHBondContact O-CB 3.15Å; E392-A396 PolarHBondContact O-N 2.85Å
393	S	98.4	Very high	96.5	Very high	62 Å²	62	46.9 Å²	46.9	43%	0.434	23%	0.233	S	C	.	.	H	α-helix	trans	-65.4	-39.4	174.8	-62.9	0	0	0	0	112.1	S390 A396 Y397	S390-S393 PolarHBondContact O-N 2.99Å; S390-S393 PolarHBondContact OG-N 3.2Å; S390-S393 VanDerWaalsContact OG-N 3.15Å; S390-S393 PolarHBondContact OG-OG 2.68Å; S393-A396 PolarHBondContact O-N 3.48Å; S393-Y397 WeakPolarHBondContact O-CB 3.25Å; S393-Y397 PolarHBondContact O-N 3.25Å
394	F	98.6	Very high	96.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.6	-41.8	173.3	176.5	-146.9	0	0	0	112	L322 F327 V329 V350 S390 M391 Y397 V398 V413 F417 I452	L322-F394 HydrophobicContact CD1-CD2 3.96Å; L322-F394 HydrophobicContact CD1-CE2 4.22Å; L322-F394 HydrophobicContact CD2-CD2 3.97Å; L322-F394 HydrophobicContact CD2-CE2 3.98Å; F327-F394 HydrophobicContact CE2-CE1 4.14Å; F327-F394 HydrophobicContact CE2-CE2 4.08Å; F327-F394 AromaticContact CE2-CZ 3.71Å; F327-F394 HydrophobicContact CE2-CZ 3.71Å; F327-F394 AromaticContact CZ-CE2 3.8Å; F327-F394 HydrophobicContact CZ-CE2 3.8Å; F327-F394 AromaticContact CZ-CZ 3.67Å; F327-F394 HydrophobicContact CZ-CZ 3.67Å; V329-F394 HydrophobicContact CG2-CE1 4.04Å; V350-F394 HydrophobicContact CG2-CB 3.72Å; V350-F394 HydrophobicContact CG2-CD1 3.72Å; V350-F394 HydrophobicContact CG2-CG 3.83Å; S390-F394 PolarHBondContact O-N 3.24Å; S390-F394 VanDerWaalsContact O-N 3.14Å; M391-F394 HydrophobicContact CE-CD1 3.99Å; F394-Y397 PolarHBondContact O-N 3.43Å; F394-V398 HydrophobicContact CD2-CG2 3.83Å; F394-V398 HydrophobicContact CE2-CG2 3.49Å; F394-V398 VanDerWaalsContact CE2-CG2 3.49Å; F394-V398 HydrophobicContact CZ-CG2 4.28Å; F394-V398 WeakPolarHBondContact O-CG2 3.32Å; F394-V398 PolarHBondContact O-N 3.14Å; F394-V413 HydrophobicContact CD1-CB 4.36Å; F394-V413 HydrophobicContact CD1-CG1 3.44Å; F394-V413 VanDerWaalsContact CD1-CG1 3.44Å; F394-V413 HydrophobicContact CD1-CG2 3.93Å; F394-V413 HydrophobicContact CD2-CG2 4.2Å; F394-V413 HydrophobicContact CE1-CB 4.41Å; F394-V413 HydrophobicContact CE1-CG1 3.72Å; F394-V413 HydrophobicContact CE1-CG2 3.78Å; F394-V413 HydrophobicContact CE2-CG2 4.05Å; F394-V413 HydrophobicContact CG-CG1 4.12Å; F394-V413 HydrophobicContact CG-CG2 4.12Å; F394-V413 HydrophobicContact CZ-CG2 3.84Å; F394-F417 HydrophobicContact CE1-CD1 4.31Å; F394-F417 HydrophobicContact CE1-CE1 4.04Å; F394-I452 HydrophobicContact CZ-CD1 4.42Å
395	N	98.6	Very high	96.9	Very high	11 Å²	11	52.6 Å²	52.6	6%	0.059	28%	0.282	C	S	.	.	H	α-helix	trans	-64.4	-42.5	175.6	-174.1	84.4	0	0	0	112.3	M391 E392 V398 N399 D411 V413 L414	M391-N395 VanDerWaalsContact O-CB 3.24Å; M391-N395 WeakPolarHBondContact O-CB 3.31Å; M391-N395 PolarHBondContact O-N 3.32Å; E392-N395 PolarHBondContact O-N 2.96Å; N395-V398 PolarHBondContact O-N 2.92Å; N395-N399 PolarHBondContact ND2-ND2 2.83Å; N395-N399 WeakPolarHBondContact O-CB 3.23Å; N395-N399 VanDerWaalsContact O-CG 3.27Å; N395-N399 PolarHBondContact O-N 3.25Å; N395-D411 PolarHBondContact ND2-OD1 3.02Å; N395-D411 VanDerWaalsContact OD1-CA 3.26Å; N395-D411 WeakPolarHBondContact OD1-CA 3.29Å; N395-V413 HydrophobicContact CB-CB 3.82Å; N395-V413 HydrophobicContact CB-CG1 4.13Å; N395-V413 HydrophobicContact CB-CG2 4.42Å; N395-V413 WeakPolarHBondContact OD1-CB 3.41Å; N395-L414 HydrophobicContact CB-CD1 4.08Å; N395-L414 HydrophobicContact CB-CG 3.92Å; N395-L414 PolarHBondContact OD1-N 2.92Å
396	A	98.6	Very high	97	Very high	50 Å²	50	54.3 Å²	54.3	41%	0.413	29%	0.289	S	S	.	.	H	α-helix	trans	-60.4	-46.7	174.1	0	0	0	0	0	111.6	E392 S393 V398 N399 E400	E392-A396 WeakPolarHBondContact O-CB 3.15Å; E392-A396 PolarHBondContact O-N 2.85Å; S393-A396 PolarHBondContact O-N 3.48Å; A396-V398 PolarHBondContact O-N 2.65Å; A396-N399 WeakPolarHBondContact O-CB 3.23Å; A396-N399 PolarHBondContact O-N 3.37Å; A396-E400 WeakPolarHBondContact O-CB 3.38Å; A396-E400 PolarHBondContact O-N 3.31Å
397	Y	98.3	Very high	97.3	Very high	41 Å²	41	53.7 Å²	53.7	16%	0.161	30%	0.302	C	S	.	.	H	α-helix	trans	-60.2	-44.7	176.9	-173.3	-89.1	0	0	0	112.7	L322 N323 W389 S393 F394 E400 R401 L402	L322-Y397 HydrophobicContact CD2-CD1 3.36Å; L322-Y397 HydrophobicContact CD2-CE1 3.46Å; L322-Y397 VanDerWaalsContact CD2-CE1 3.46Å; L322-Y397 HydrophobicContact CD2-CG 4.22Å; N323-Y397 PolarHBondContact N-OH 3.27Å; N323-Y397 WeakPolarHBondContact OD1-CE2 3.26Å; N323-Y397 PolarHBondContact OD1-OH 2.75Å; W389-Y397 AromaticContact CH2-CD2 3.68Å; W389-Y397 HydrophobicContact CH2-CD2 3.68Å; W389-Y397 AromaticContact CH2-CE2 3.98Å; W389-Y397 HydrophobicContact CH2-CE2 3.98Å; W389-Y397 HydrophobicContact CH2-CG 4.04Å; W389-Y397 HydrophobicContact CZ3-CD1 4.31Å; W389-Y397 AromaticContact CZ3-CD2 3.84Å; W389-Y397 HydrophobicContact CZ3-CD2 3.84Å; W389-Y397 HydrophobicContact CZ3-CE2 4.48Å; W389-Y397 AromaticContact CZ3-CG 3.72Å; W389-Y397 HydrophobicContact CZ3-CG 3.72Å; S393-Y397 WeakPolarHBondContact O-CB 3.25Å; S393-Y397 PolarHBondContact O-N 3.25Å; F394-Y397 PolarHBondContact O-N 3.43Å; Y397-E400 PolarHBondContact O-N 2.9Å; Y397-R401 HydrophobicContact CD1-CB 4.42Å; Y397-R401 HydrophobicContact CD2-CG 4.15Å; Y397-R401 HydrophobicContact CE1-CB 4.16Å; Y397-R401 HydrophobicContact CE1-CG 4.35Å; Y397-R401 HydrophobicContact CE2-CG 3.92Å; Y397-R401 HydrophobicContact CG-CG 4.49Å; Y397-R401 WeakPolarHBondContact O-CB 3.38Å; Y397-R401 PolarHBondContact O-N 3.02Å; Y397-L402 HydrophobicContact CD1-CD1 4.48Å; Y397-L402 HydrophobicContact CE1-CD1 4.34Å
398	V	98.2	Very high	97.4	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.006	31%	0.306	C	S	.	.	I	π-helix	trans	-64	-42.5	177.2	170.7	0	0	0	0	111	F394 N395 A396 L402 Q403 L408 W412 V413	F394-V398 HydrophobicContact CD2-CG2 3.83Å; F394-V398 HydrophobicContact CE2-CG2 3.49Å; F394-V398 VanDerWaalsContact CE2-CG2 3.49Å; F394-V398 HydrophobicContact CZ-CG2 4.28Å; F394-V398 WeakPolarHBondContact O-CG2 3.32Å; F394-V398 PolarHBondContact O-N 3.14Å; N395-V398 PolarHBondContact O-N 2.92Å; A396-V398 PolarHBondContact O-N 2.65Å; V398-L402 HydrophobicContact CG1-CB 4.43Å; V398-L402 HydrophobicContact CG2-CD1 4.17Å; V398-L402 CarbonylContact O-C 3.57Å; V398-L402 PolarHBondContact O-N 2.84Å; V398-L402 VanDerWaalsContact O-N 3.08Å; V398-Q403 PolarHBondContact O-N 3.03Å; V398-L408 HydrophobicContact CG1-CD1 3.69Å; V398-W412 HydrophobicContact CG1-CB 4.37Å; V398-W412 HydrophobicContact CG1-CE3 4.41Å; V398-V413 HydrophobicContact CB-CG2 3.87Å; V398-V413 HydrophobicContact CG1-CG2 4.23Å; V398-V413 HydrophobicContact CG2-CG2 3.6Å
399	N	98.3	Very high	97.4	Very high	34 Å²	34	58.3 Å²	58.3	18%	0.182	33%	0.33	C	S	.	.	I	π-helix	trans	-59.7	-45.9	174.4	-74.8	-15.1	0	0	0	112.3	N395 A396 Q403 D411	N395-N399 PolarHBondContact ND2-ND2 2.83Å; N395-N399 WeakPolarHBondContact O-CB 3.23Å; N395-N399 VanDerWaalsContact O-CG 3.27Å; N395-N399 PolarHBondContact O-N 3.25Å; A396-N399 WeakPolarHBondContact O-CB 3.23Å; A396-N399 PolarHBondContact O-N 3.37Å; N399-Q403 WeakPolarHBondContact O-CB 3.4Å; N399-D411 PolarHBondContact ND2-OD1 3.02Å; N399-D411 WeakPolarHBondContact OD1-CA 3.47Å; N399-D411 PolarHBondContact OD1-N 3.13Å
400	E	98	Very high	97.3	Very high	130 Å²	130	65.1 Å²	65.1	61%	0.607	36%	0.356	S	S	*	.	I	π-helix	trans	-73.9	-46.7	-175.6	-173.2	-169.9	133.6	0	0	113.1	A396 Y397	A396-E400 WeakPolarHBondContact O-CB 3.38Å; A396-E400 PolarHBondContact O-N 3.31Å; Y397-E400 PolarHBondContact O-N 2.9Å
401	R	96.9	Very high	97.3	Very high	153 Å²	153	66.8 Å²	66.8	58%	0.577	36%	0.363	S	S	*	.	I	π-helix	trans	-103.2	-26.1	-166.4	-61.2	-67.7	168.3	139.7	-5.3	114.5	Y397	Y397-R401 HydrophobicContact CD1-CB 4.42Å; Y397-R401 HydrophobicContact CD2-CG 4.15Å; Y397-R401 HydrophobicContact CE1-CB 4.16Å; Y397-R401 HydrophobicContact CE1-CG 4.35Å; Y397-R401 HydrophobicContact CE2-CG 3.92Å; Y397-R401 HydrophobicContact CG-CG 4.49Å; Y397-R401 WeakPolarHBondContact O-CB 3.38Å; Y397-R401 PolarHBondContact O-N 3.02Å
402	L	96.5	Very high	97.3	Very high	30 Å²	30	67.7 Å²	67.7	16%	0.157	37%	0.367	C	S	.	.	I	π-helix	trans	-121.3	-25.7	-167.4	-62.4	172.5	0	0	0	113.5	L320 Y397 V398 V404 A405 K406 L408 F456	L320-L402 HydrophobicContact CD1-CD1 4.13Å; Y397-L402 HydrophobicContact CD1-CD1 4.48Å; Y397-L402 HydrophobicContact CE1-CD1 4.34Å; V398-L402 HydrophobicContact CG1-CB 4.43Å; V398-L402 HydrophobicContact CG2-CD1 4.17Å; V398-L402 CarbonylContact O-C 3.57Å; V398-L402 PolarHBondContact O-N 2.84Å; V398-L402 VanDerWaalsContact O-N 3.08Å; L402-V404 PolarHBondContact O-N 2.89Å; L402-A405 PolarHBondContact O-N 3.23Å; L402-K406 WeakPolarHBondContact O-CB 3.19Å; L402-K406 PolarHBondContact O-N 2.73Å; L402-L408 HydrophobicContact CB-CD1 4.3Å; L402-F456 HydrophobicContact CB-CZ 4.46Å; L402-F456 HydrophobicContact CD1-CZ 4.3Å
403	Q	95.4	Very high	97.3	Very high	52 Å²	52	62.3 Å²	62.3	24%	0.243	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-51.9	-171.1	-170.3	-164.4	-39.1	0	0	112.8	V398 N399 G407 L408	V398-Q403 PolarHBondContact O-N 3.03Å; N399-Q403 WeakPolarHBondContact O-CB 3.4Å; Q403-G407 CarbonylContact O-C 3.58Å; Q403-G407 PolarHBondContact O-N 3.39Å; Q403-G407 VanDerWaalsContact O-N 3.11Å; Q403-L408 HydrophobicContact CG-CB 4.26Å; Q403-L408 WeakPolarHBondContact CG-O 3.41Å; Q403-L408 PolarHBondContact O-N 3.37Å
404	V	95.9	Very high	97.3	Very high	137 Å²	137	62.6 Å²	62.6	83%	0.83	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-48.6	179.4	-177.7	0	0	0	0	110.6	L402 K406 G407	L402-V404 PolarHBondContact O-N 2.89Å; V404-K406 VanDerWaalsContact C-N 3.28Å; V404-K406 PolarHBondContact O-N 2.8Å; V404-G407 PolarHBondContact O-N 3.36Å
405	A	95.7	Very high	97.3	Very high	84 Å²	84	63.8 Å²	63.8	69%	0.694	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-24.8	-174.6	0	0	0	0	0	114.6	L402	L402-A405 PolarHBondContact O-N 3.23Å
406	K	95.4	Very high	97.3	Very high	100 Å²	100	65.3 Å²	65.3	44%	0.435	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	11.2	178.9	-68	-80	-165.9	158.1	0	113.1	L402 V404 L408 E454 F456	L402-K406 WeakPolarHBondContact O-CB 3.19Å; L402-K406 PolarHBondContact O-N 2.73Å; V404-K406 VanDerWaalsContact C-N 3.28Å; V404-K406 PolarHBondContact O-N 2.8Å; K406-L408 VanDerWaalsContact C-N 3.28Å; K406-L408 HydrophobicContact CB-CD1 4.3Å; K406-L408 HydrophobicContact CB-CD2 4.18Å; K406-L408 HydrophobicContact CB-CG 3.95Å; K406-L408 PolarHBondContact O-N 3.32Å; K406-E454 PolarHBondContact NZ-O 3.14Å; K406-F456 HydrophobicContact CB-CE2 3.85Å; K406-F456 HydrophobicContact CB-CZ 4.14Å; K406-F456 HydrophobicContact CD-CE2 3.71Å; K406-F456 HydrophobicContact CG-CE2 3.61Å; K406-F456 HydrophobicContact CG-CZ 3.98Å
407	G	96.1	Very high	97.3	Very high	69 Å²	69	63 Å²	63	71%	0.711	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	29.1	175.5	0	0	0	0	0	114.9	Q403 V404	Q403-G407 CarbonylContact O-C 3.58Å; Q403-G407 PolarHBondContact O-N 3.39Å; Q403-G407 VanDerWaalsContact O-N 3.11Å; V404-G407 PolarHBondContact O-N 3.36Å
408	L	96.9	Very high	97.3	Very high	22 Å²	22	61.4 Å²	61.4	12%	0.115	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-80.1	149.9	-173	-50.5	173	0	0	0	111.6	V398 L402 Q403 K406 W412 F456	V398-L408 HydrophobicContact CG1-CD1 3.69Å; L402-L408 HydrophobicContact CB-CD1 4.3Å; Q403-L408 HydrophobicContact CG-CB 4.26Å; Q403-L408 WeakPolarHBondContact CG-O 3.41Å; Q403-L408 PolarHBondContact O-N 3.37Å; K406-L408 VanDerWaalsContact C-N 3.28Å; K406-L408 HydrophobicContact CB-CD1 4.3Å; K406-L408 HydrophobicContact CB-CD2 4.18Å; K406-L408 HydrophobicContact CB-CG 3.95Å; K406-L408 PolarHBondContact O-N 3.32Å; L408-W412 HydrophobicContact CB-CB 4.27Å; L408-W412 HydrophobicContact CB-CG 4.47Å; L408-W412 HydrophobicContact CD1-CG 4.49Å; L408-F456 HydrophobicContact CD1-CD1 4.05Å; L408-F456 HydrophobicContact CD1-CE1 3.48Å; L408-F456 VanDerWaalsContact CD1-CE1 3.48Å; L408-F456 HydrophobicContact CD1-CZ 3.83Å; L408-F456 HydrophobicContact CD2-CD1 3.96Å; L408-F456 HydrophobicContact CD2-CD2 4.31Å; L408-F456 HydrophobicContact CD2-CE1 4.15Å; L408-F456 HydrophobicContact CD2-CE2 4.5Å; L408-F456 HydrophobicContact CD2-CG 4.06Å; L408-F456 HydrophobicContact CD2-CZ 4.42Å; L408-F456 HydrophobicContact CG-CE1 4.44Å
409	P	96.8	Very high	97.3	Very high	79 Å²	79	67.7 Å²	67.7	51%	0.513	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-61.2	147	162.4	28.9	-35.6	0	0	0	110.3	W412	P409-W412 HydrophobicContact CG-CB 4.33Å; P409-W412 WeakPolarHBondContact O-CB 3.28Å; P409-W412 PolarHBondContact O-N 2.83Å
410	R	96.6	Very high	97.3	Very high	182 Å²	182	68.5 Å²	68.5	69%	0.687	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	141.5	169.6	-169.4	-166.7	159.9	144.8	7.8	110.1	W412	R410-W412 VanDerWaalsContact C-N 3.27Å; R410-W412 PolarHBondContact O-N 3.27Å
411	D	97.7	Very high	97.3	Very high	52 Å²	52	62.3 Å²	62.3	28%	0.278	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	34.9	-179.9	-55.9	-55.9	0	0	0	112.6	N395 N399 V413 L414 G415	N395-D411 PolarHBondContact ND2-OD1 3.02Å; N395-D411 VanDerWaalsContact OD1-CA 3.26Å; N395-D411 WeakPolarHBondContact OD1-CA 3.29Å; N399-D411 PolarHBondContact ND2-OD1 3.02Å; N399-D411 WeakPolarHBondContact OD1-CA 3.47Å; N399-D411 PolarHBondContact OD1-N 3.13Å; D411-V413 PolarHBondContact O-N 2.95Å; D411-V413 VanDerWaalsContact O-N 3.14Å; D411-L414 PolarHBondContact O-N 3.19Å; D411-G415 WeakPolarHBondContact O-CA 3.48Å; D411-G415 PolarHBondContact O-N 3.36Å
412	W	98.4	Very high	97.4	Very high	20 Å²	20	57 Å²	57	8%	0.076	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-37.1	-179.6	177.7	91	0	0	0	113.4	V398 L408 P409 R410 A416 F417 I452 F456	V398-W412 HydrophobicContact CG1-CB 4.37Å; V398-W412 HydrophobicContact CG1-CE3 4.41Å; L408-W412 HydrophobicContact CB-CB 4.27Å; L408-W412 HydrophobicContact CB-CG 4.47Å; L408-W412 HydrophobicContact CD1-CG 4.49Å; P409-W412 HydrophobicContact CG-CB 4.33Å; P409-W412 WeakPolarHBondContact O-CB 3.28Å; P409-W412 PolarHBondContact O-N 2.83Å; R410-W412 VanDerWaalsContact C-N 3.27Å; R410-W412 PolarHBondContact O-N 3.27Å; W412-A416 HydrophobicContact CG-CB 4.34Å; W412-A416 PolarHBondContact O-N 3.17Å; W412-F417 HydrophobicContact CD2-CB 4.19Å; W412-F417 HydrophobicContact CE3-CB 3.86Å; W412-F417 HydrophobicContact CH2-CB 3.65Å; W412-F417 AromaticContact CH2-CD2 3.78Å; W412-F417 HydrophobicContact CH2-CD2 3.78Å; W412-F417 AromaticContact CH2-CG 3.93Å; W412-F417 HydrophobicContact CH2-CG 3.93Å; W412-F417 HydrophobicContact CZ2-CB 3.98Å; W412-F417 HydrophobicContact CZ3-CB 3.59Å; W412-F417 HydrophobicContact CZ3-CD2 4.14Å; W412-F417 AromaticContact CZ3-CG 3.88Å; W412-F417 HydrophobicContact CZ3-CG 3.88Å; W412-F417 WeakPolarHBondContact O-CB 3.49Å; W412-F417 PolarHBondContact O-N 2.95Å; W412-I452 HydrophobicContact CH2-CG1 4.2Å; W412-I452 HydrophobicContact CH2-CG2 3.95Å; W412-F456 HydrophobicContact CD2-CD1 4.22Å; W412-F456 AromaticContact CE2-CD1 3.97Å; W412-F456 HydrophobicContact CE3-CD1 4.17Å; W412-F456 HydrophobicContact CH2-CB 4.29Å; W412-F456 AromaticContact CH2-CD1 3.73Å; W412-F456 HydrophobicContact CH2-CD1 3.73Å; W412-F456 HydrophobicContact CZ2-CB 3.79Å; W412-F456 AromaticContact CZ2-CD1 3.76Å; W412-F456 HydrophobicContact CZ2-CD1 3.76Å; W412-F456 HydrophobicContact CZ2-CG 4.27Å; W412-F456 AromaticContact CZ3-CD1 3.92Å; W412-F456 HydrophobicContact CZ3-CD1 3.92Å; W412-F456 HydrophobicContact CZ3-CE1 4.46Å
413	V	98.6	Very high	97.5	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.334	C	S	.	.	I	π-helix	trans	-65.1	-55	179.6	173.9	0	0	0	0	110.5	M391 F394 N395 V398 D411 G415 F417 T418	M391-V413 HydrophobicContact CE-CG1 3.39Å; F394-V413 HydrophobicContact CD1-CB 4.36Å; F394-V413 HydrophobicContact CD1-CG1 3.44Å; F394-V413 VanDerWaalsContact CD1-CG1 3.44Å; F394-V413 HydrophobicContact CD1-CG2 3.93Å; F394-V413 HydrophobicContact CD2-CG2 4.2Å; F394-V413 HydrophobicContact CE1-CB 4.41Å; F394-V413 HydrophobicContact CE1-CG1 3.72Å; F394-V413 HydrophobicContact CE1-CG2 3.78Å; F394-V413 HydrophobicContact CE2-CG2 4.05Å; F394-V413 HydrophobicContact CG-CG1 4.12Å; F394-V413 HydrophobicContact CG-CG2 4.12Å; F394-V413 HydrophobicContact CZ-CG2 3.84Å; N395-V413 HydrophobicContact CB-CB 3.82Å; N395-V413 HydrophobicContact CB-CG1 4.13Å; N395-V413 HydrophobicContact CB-CG2 4.42Å; N395-V413 WeakPolarHBondContact OD1-CB 3.41Å; V398-V413 HydrophobicContact CB-CG2 3.87Å; V398-V413 HydrophobicContact CG1-CG2 4.23Å; V398-V413 HydrophobicContact CG2-CG2 3.6Å; D411-V413 PolarHBondContact O-N 2.95Å; D411-V413 VanDerWaalsContact O-N 3.14Å; V413-G415 VanDerWaalsContact C-N 3.28Å; V413-G415 PolarHBondContact O-N 2.64Å; V413-F417 HydrophobicContact CG1-CD1 4.1Å; V413-F417 WeakPolarHBondContact O-CB 3.31Å; V413-T418 PolarHBondContact O-N 3Å; V413-T418 VanDerWaalsContact O-N 3.16Å; V413-T418 PolarHBondContact O-OG1 3.01Å
414	L	98.3	Very high	97.6	Very high	68 Å²	68	57.7 Å²	57.7	36%	0.356	32%	0.322	S	S	.	.	I	π-helix	trans	-75.4	-17.9	179.8	-61.7	176.1	0	0	0	113	M391 N395 D411 T418	M391-L414 HydrophobicContact CB-CD2 4.18Å; N395-L414 HydrophobicContact CB-CD1 4.08Å; N395-L414 HydrophobicContact CB-CG 3.92Å; N395-L414 PolarHBondContact OD1-N 2.92Å; D411-L414 PolarHBondContact O-N 3.19Å; L414-T418 WeakPolarHBondContact CA-OG1 3.35Å; L414-T418 VanDerWaalsContact O-CB 3.27Å; L414-T418 WeakPolarHBondContact O-CB 3.28Å; L414-T418 PolarHBondContact O-OG1 3.31Å
415	G	98.1	Very high	97.8	Very high	24 Å²	24	51.2 Å²	51.2	25%	0.247	28%	0.283	C	S	.	.	I	π-helix	trans	-96.2	-89.2	178.3	0	0	0	0	0	114.2	D411 V413 K419	D411-G415 WeakPolarHBondContact O-CA 3.48Å; D411-G415 PolarHBondContact O-N 3.36Å; V413-G415 VanDerWaalsContact C-N 3.28Å; V413-G415 PolarHBondContact O-N 2.64Å; G415-K419 VanDerWaalsContact O-CG 3.27Å; G415-K419 WeakPolarHBondContact O-CG 3.33Å; G415-K419 PolarHBondContact O-N 2.92Å
416	A	98.1	Very high	97.8	Very high	43 Å²	43	48.5 Å²	48.5	36%	0.355	26%	0.258	S	S	.	.	I	π-helix	trans	-70.2	-46	-168.7	0	0	0	0	0	113	W412 K419 R420	W412-A416 HydrophobicContact CG-CB 4.34Å; W412-A416 PolarHBondContact O-N 3.17Å; A416-K419 PolarHBondContact O-N 3.03Å; A416-R420 PolarHBondContact O-N 3.3Å
417	F	98.6	Very high	97.9	Very high	1 Å²	1	44.7 Å²	44.7	0%	0.004	24%	0.242	C	C	.	.	I	π-helix	trans	-60.9	-45.3	176.6	173.7	-117.3	0	0	0	111.7	V329 M391 F394 W412 V413 R420 M421 I452 V458	V329-F417 HydrophobicContact CB-CE1 4.34Å; V329-F417 HydrophobicContact CB-CZ 4.02Å; V329-F417 HydrophobicContact CG1-CE1 4.15Å; V329-F417 HydrophobicContact CG1-CZ 4.26Å; V329-F417 HydrophobicContact CG2-CE1 3.97Å; V329-F417 HydrophobicContact CG2-CZ 3.75Å; M391-F417 HydrophobicContact CE-CD1 4.43Å; M391-F417 HydrophobicContact CE-CE1 4.15Å; F394-F417 HydrophobicContact CE1-CD1 4.31Å; F394-F417 HydrophobicContact CE1-CE1 4.04Å; W412-F417 HydrophobicContact CD2-CB 4.19Å; W412-F417 HydrophobicContact CE3-CB 3.86Å; W412-F417 HydrophobicContact CH2-CB 3.65Å; W412-F417 AromaticContact CH2-CD2 3.78Å; W412-F417 HydrophobicContact CH2-CD2 3.78Å; W412-F417 AromaticContact CH2-CG 3.93Å; W412-F417 HydrophobicContact CH2-CG 3.93Å; W412-F417 HydrophobicContact CZ2-CB 3.98Å; W412-F417 HydrophobicContact CZ3-CB 3.59Å; W412-F417 HydrophobicContact CZ3-CD2 4.14Å; W412-F417 AromaticContact CZ3-CG 3.88Å; W412-F417 HydrophobicContact CZ3-CG 3.88Å; W412-F417 WeakPolarHBondContact O-CB 3.49Å; W412-F417 PolarHBondContact O-N 2.95Å; V413-F417 HydrophobicContact CG1-CD1 4.1Å; V413-F417 WeakPolarHBondContact O-CB 3.31Å; F417-R420 WeakPolarHBondContact O-CB 3.42Å; F417-R420 PolarHBondContact O-N 3.34Å; F417-R420 VanDerWaalsContact O-N 3.13Å; F417-M421 HydrophobicContact CD1-CE 3.64Å; F417-M421 HydrophobicContact CD1-SD 4.42Å; F417-M421 HydrophobicContact CE1-CE 3.31Å; F417-M421 HydrophobicContact CE1-CG 4.44Å; F417-M421 HydrophobicContact CE1-SD 3.66Å; F417-M421 HydrophobicContact CE2-CG 4.07Å; F417-M421 HydrophobicContact CE2-SD 4.18Å; F417-M421 HydrophobicContact CG-CE 4.38Å; F417-M421 HydrophobicContact CZ-CE 3.82Å; F417-M421 HydrophobicContact CZ-CG 4.01Å; F417-M421 HydrophobicContact CZ-SD 3.49Å; F417-M421 WeakPolarHBondContact CZ-SD 3.5Å; F417-M421 PolarHBondContact O-N 2.98Å; F417-I452 HydrophobicContact CD2-CD1 4.36Å; F417-I452 HydrophobicContact CD2-CG1 3.98Å; F417-I452 HydrophobicContact CE2-CD1 3.54Å; F417-I452 HydrophobicContact CE2-CG1 3.54Å; F417-I452 HydrophobicContact CZ-CD1 3.65Å; F417-I452 HydrophobicContact CZ-CG1 4.17Å; F417-V458 HydrophobicContact CD2-CG1 4.31Å; F417-V458 HydrophobicContact CD2-CG2 3.53Å; F417-V458 HydrophobicContact CE2-CG1 3.87Å; F417-V458 HydrophobicContact CE2-CG2 3.87Å
418	T	98.7	Very high	98	Very high	8 Å²	8	41.4 Å²	41.4	5%	0.049	21%	0.208	C	C	.	.	H	α-helix	trans	-57.2	-50.7	174.8	-66	0	0	0	0	112.2	F345 H347 V413 L414 R420 M421 Q422	F345-T418 HydrophobicContact CE1-CG2 4.01Å; F345-T418 HydrophobicContact CZ-CG2 4.11Å; H347-T418 PolarHBondContact CE1-OG1 2.92Å; H347-T418 WeakPolarHBondContact NE2-CG2 3.4Å; H347-T418 PolarHBondContact NE2-OG1 3.42Å; V413-T418 PolarHBondContact O-N 3Å; V413-T418 VanDerWaalsContact O-N 3.16Å; V413-T418 PolarHBondContact O-OG1 3.01Å; L414-T418 WeakPolarHBondContact CA-OG1 3.35Å; L414-T418 VanDerWaalsContact O-CB 3.27Å; L414-T418 WeakPolarHBondContact O-CB 3.28Å; L414-T418 PolarHBondContact O-OG1 3.31Å; T418-R420 VanDerWaalsContact C-N 3.26Å; T418-R420 PolarHBondContact O-N 3.12Å; T418-M421 PolarHBondContact O-N 2.68Å; T418-Q422 VanDerWaalsContact O-CG 3.31Å; T418-Q422 WeakPolarHBondContact O-CG 3.35Å; T418-Q422 PolarHBondContact O-N 2.57Å
419	K	98.2	Very high	98	Very high	133 Å²	133	40.4 Å²	40.4	58%	0.578	20%	0.202	S	C	*	.	H	α-helix	trans	-58.2	-38.1	175.2	-72.8	168.5	-176.5	176.9	0	111.9	G415 A416 Q422 Q423	G415-K419 VanDerWaalsContact O-CG 3.27Å; G415-K419 WeakPolarHBondContact O-CG 3.33Å; G415-K419 PolarHBondContact O-N 2.92Å; A416-K419 PolarHBondContact O-N 3.03Å; K419-Q422 PolarHBondContact O-N 2.94Å; K419-Q423 VanDerWaalsContact O-CG 3.27Å; K419-Q423 WeakPolarHBondContact O-CG 3.01Å; K419-Q423 PolarHBondContact O-N 3.45Å
420	R	98.3	Very high	98	Very high	52 Å²	52	39.7 Å²	39.7	20%	0.196	19%	0.192	C	C	.	.	H	α-helix	trans	-68.1	-43.1	177.2	-174.2	55.4	173.2	-164.1	0.4	112.5	E223 A416 F417 T418 Q422 Q423 I424 V458	E223-R420 VanDerWaalsContact CB-NH2 3.32Å; E223-R420 PolarHBondContact O-NH2 3.49Å; E223-R420 IonicContact OE2-NH1 3.37Å; E223-R420 IonicContact OE2-NH2 2.71Å; E223-R420 PolarHBondContact OE2-NH2 3.4Å; A416-R420 PolarHBondContact O-N 3.3Å; F417-R420 WeakPolarHBondContact O-CB 3.42Å; F417-R420 PolarHBondContact O-N 3.34Å; F417-R420 VanDerWaalsContact O-N 3.13Å; T418-R420 VanDerWaalsContact C-N 3.26Å; T418-R420 PolarHBondContact O-N 3.12Å; R420-Q422 PolarHBondContact O-N 3.01Å; R420-Q423 PolarHBondContact O-N 2.84Å; R420-I424 HydrophobicContact CG-CD1 3.91Å; R420-I424 WeakPolarHBondContact O-CD1 3.34Å; R420-I424 VanDerWaalsContact O-CG1 3.26Å; R420-I424 WeakPolarHBondContact O-CG1 3.43Å; R420-I424 PolarHBondContact O-N 3.17Å; R420-V458 HydrophobicContact CB-CB 4.49Å; R420-V458 HydrophobicContact CB-CG2 4.1Å; R420-V458 HydrophobicContact CG-CB 3.65Å; R420-V458 HydrophobicContact CG-CG1 4.2Å; R420-V458 HydrophobicContact CG-CG2 3.69Å
421	M	98.7	Very high	98	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.3	-45.5	172.9	-70.8	-171.3	-70.8	0	0	111.6	V329 F345 F417 T418 Q423 I424 M425 F450 V458	V329-M421 HydrophobicContact CG1-SD 4.31Å; F345-M421 HydrophobicContact CE2-CB 3.9Å; F345-M421 HydrophobicContact CE2-CE 4.24Å; F345-M421 HydrophobicContact CZ-CE 4.01Å; F417-M421 HydrophobicContact CD1-CE 3.64Å; F417-M421 HydrophobicContact CD1-SD 4.42Å; F417-M421 HydrophobicContact CE1-CE 3.31Å; F417-M421 HydrophobicContact CE1-CG 4.44Å; F417-M421 HydrophobicContact CE1-SD 3.66Å; F417-M421 HydrophobicContact CE2-CG 4.07Å; F417-M421 HydrophobicContact CE2-SD 4.18Å; F417-M421 HydrophobicContact CG-CE 4.38Å; F417-M421 HydrophobicContact CZ-CE 3.82Å; F417-M421 HydrophobicContact CZ-CG 4.01Å; F417-M421 HydrophobicContact CZ-SD 3.49Å; F417-M421 WeakPolarHBondContact CZ-SD 3.5Å; F417-M421 PolarHBondContact O-N 2.98Å; T418-M421 PolarHBondContact O-N 2.68Å; M421-Q423 PolarHBondContact O-N 3.27Å; M421-I424 PolarHBondContact O-N 2.87Å; M421-M425 HydrophobicContact CB-SD 4.39Å; M421-M425 WeakPolarHBondContact O-CB 3.29Å; M421-M425 WeakPolarHBondContact O-CG 3.12Å; M421-M425 PolarHBondContact O-N 3.39Å; M421-F450 HydrophobicContact CB-CE1 4.36Å; M421-F450 HydrophobicContact CB-CE2 4.12Å; M421-F450 HydrophobicContact CB-CZ 3.96Å; M421-F450 HydrophobicContact CG-CD1 4.08Å; M421-F450 HydrophobicContact CG-CD2 3.94Å; M421-F450 HydrophobicContact CG-CE1 4.05Å; M421-F450 HydrophobicContact CG-CE2 3.91Å; M421-F450 HydrophobicContact CG-CG 4.01Å; M421-F450 HydrophobicContact CG-CZ 3.95Å; M421-F450 HydrophobicContact SD-CD2 3.7Å; M421-F450 HydrophobicContact SD-CE2 4Å; M421-F450 HydrophobicContact SD-CG 4.1Å; M421-V458 HydrophobicContact CG-CG1 4.49Å
422	Q	98.6	Very high	98	Very high	41 Å²	41	28.7 Å²	28.7	19%	0.192	15%	0.146	C	C	.	.	H	α-helix	trans	-59.2	-45.1	177.3	-70.8	172.3	-3.5	0	0	112.2	F345 T418 K419 R420 T426 L516	F345-Q422 HydrophobicContact CB-CG 4.07Å; F345-Q422 HydrophobicContact CD1-CG 3.86Å; F345-Q422 HydrophobicContact CD2-CG 3.69Å; F345-Q422 HydrophobicContact CE1-CG 4.2Å; F345-Q422 HydrophobicContact CE2-CG 4.04Å; F345-Q422 HydrophobicContact CG-CG 3.6Å; F345-Q422 HydrophobicContact CZ-CG 4.29Å; T418-Q422 VanDerWaalsContact O-CG 3.31Å; T418-Q422 WeakPolarHBondContact O-CG 3.35Å; T418-Q422 PolarHBondContact O-N 2.57Å; K419-Q422 PolarHBondContact O-N 2.94Å; R420-Q422 PolarHBondContact O-N 3.01Å; Q422-T426 VanDerWaalsContact O-CB 3.31Å; Q422-T426 WeakPolarHBondContact O-CB 3.21Å; Q422-T426 PolarHBondContact O-N 3.04Å; Q422-T426 PolarHBondContact O-OG1 3.2Å; Q422-L516 HydrophobicContact CB-CD2 3.76Å; Q422-L516 HydrophobicContact CG-CD2 3.95Å
423	Q	97.9	Very high	97.9	Very high	97 Å²	97	30.6 Å²	30.6	45%	0.453	16%	0.155	S	C	.	.	H	α-helix	trans	-59.6	-46.6	174.3	-72.1	169	-3.4	0	0	112.1	L219 K419 R420 M421 T426 Q427	L219-Q423 HydrophobicContact CD1-CB 3.86Å; K419-Q423 VanDerWaalsContact O-CG 3.27Å; K419-Q423 WeakPolarHBondContact O-CG 3.01Å; K419-Q423 PolarHBondContact O-N 3.45Å; R420-Q423 PolarHBondContact O-N 2.84Å; M421-Q423 PolarHBondContact O-N 3.27Å; Q423-T426 PolarHBondContact O-N 2.86Å; Q423-Q427 WeakPolarHBondContact O-CB 3.21Å; Q423-Q427 PolarHBondContact O-N 3.31Å
424	I	98.5	Very high	97.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.4	-48.7	-179.6	-68.3	162.9	0	0	0	110.8	L219 F224 R420 M421 T426 Q427 C428 F450 V458 L460	L219-I424 HydrophobicContact CD1-CG1 3.98Å; F224-I424 HydrophobicContact CB-CD1 3.62Å; F224-I424 HydrophobicContact CB-CG1 3.69Å; F224-I424 HydrophobicContact CB-CG2 4.39Å; F224-I424 HydrophobicContact CD1-CG1 4.46Å; F224-I424 HydrophobicContact CD2-CB 4.39Å; F224-I424 HydrophobicContact CD2-CG1 4.19Å; F224-I424 HydrophobicContact CD2-CG2 3.46Å; F224-I424 VanDerWaalsContact CD2-CG2 3.46Å; F224-I424 HydrophobicContact CE2-CG2 3.9Å; F224-I424 HydrophobicContact CG-CD1 4.34Å; F224-I424 HydrophobicContact CG-CG1 3.89Å; F224-I424 HydrophobicContact CG-CG2 4.06Å; R420-I424 HydrophobicContact CG-CD1 3.91Å; R420-I424 WeakPolarHBondContact O-CD1 3.34Å; R420-I424 VanDerWaalsContact O-CG1 3.26Å; R420-I424 WeakPolarHBondContact O-CG1 3.43Å; R420-I424 PolarHBondContact O-N 3.17Å; M421-I424 PolarHBondContact O-N 2.87Å; I424-T426 VanDerWaalsContact C-N 3.28Å; I424-T426 PolarHBondContact O-N 3.12Å; I424-Q427 WeakPolarHBondContact O-CB 3.35Å; I424-Q427 PolarHBondContact O-N 2.8Å; I424-Q427 VanDerWaalsContact O-N 3.14Å; I424-C428 PolarHBondContact O-N 2.93Å; I424-C428 PolarHBondContact O-SG 3.49Å; I424-F450 HydrophobicContact CB-CE1 4.12Å; I424-F450 HydrophobicContact CB-CZ 4.5Å; I424-F450 HydrophobicContact CD1-CE1 3.98Å; I424-F450 HydrophobicContact CG2-CE1 3.86Å; I424-F450 HydrophobicContact CG2-CZ 4.29Å; I424-V458 HydrophobicContact CD1-CB 4.28Å; I424-V458 HydrophobicContact CD1-CG1 3.86Å; I424-L460 HydrophobicContact CG2-CB 4.02Å; I424-L460 HydrophobicContact CG2-CD2 3.92Å
425	M	98.6	Very high	97.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.4	-35.1	179.3	-73	155.4	77.8	0	0	112.1	Y332 L333 F345 M421 F429 C448 F450 L516	Y332-M425 VanDerWaalsContact C-CE 3.46Å; Y332-M425 VanDerWaalsContact O-CE 3.28Å; Y332-M425 WeakPolarHBondContact O-CE 3.43Å; L333-M425 HydrophobicContact CB-CE 3.74Å; L333-M425 HydrophobicContact CD1-CB 4.31Å; L333-M425 HydrophobicContact CD1-CE 4.3Å; F345-M425 HydrophobicContact CD2-CE 3.69Å; F345-M425 HydrophobicContact CD2-SD 3.64Å; F345-M425 HydrophobicContact CE2-CE 4.35Å; F345-M425 HydrophobicContact CE2-SD 3.97Å; M421-M425 HydrophobicContact CB-SD 4.39Å; M421-M425 WeakPolarHBondContact O-CB 3.29Å; M421-M425 WeakPolarHBondContact O-CG 3.12Å; M421-M425 PolarHBondContact O-N 3.39Å; M425-F429 WeakPolarHBondContact O-CB 3.2Å; M425-F429 PolarHBondContact O-N 3.03Å; M425-C448 HydrophobicContact CE-CB 4.26Å; M425-C448 HydrophobicContact CG-CB 4.42Å; M425-C448 HydrophobicContact SD-CB 4.29Å; M425-F450 HydrophobicContact CG-CE2 4.26Å; M425-F450 HydrophobicContact CG-CZ 3.83Å; M425-F450 HydrophobicContact SD-CE2 3.68Å; M425-F450 HydrophobicContact SD-CZ 3.75Å; M425-L516 HydrophobicContact CB-CD1 4.09Å
426	T	97.6	Very high	97.5	Very high	28 Å²	28	35.5 Å²	35.5	17%	0.172	18%	0.178	C	C	.	.	H	α-helix	trans	-65.8	-43.5	172.9	-57.3	0	0	0	0	111.8	Q422 Q423 I424 F429 F430	Q422-T426 VanDerWaalsContact O-CB 3.31Å; Q422-T426 WeakPolarHBondContact O-CB 3.21Å; Q422-T426 PolarHBondContact O-N 3.04Å; Q422-T426 PolarHBondContact O-OG1 3.2Å; Q423-T426 PolarHBondContact O-N 2.86Å; I424-T426 VanDerWaalsContact C-N 3.28Å; I424-T426 PolarHBondContact O-N 3.12Å; T426-F429 PolarHBondContact O-N 2.87Å; T426-F430 HydrophobicContact CG2-CD2 3.91Å; T426-F430 HydrophobicContact CG2-CE2 3.45Å; T426-F430 VanDerWaalsContact CG2-CE2 3.45Å; T426-F430 HydrophobicContact CG2-CZ 4.04Å; T426-F430 WeakPolarHBondContact O-CD2 3.36Å; T426-F430 PolarHBondContact O-N 2.96Å
427	Q	96.5	Very high	97.4	Very high	19 Å²	19	36.2 Å²	36.2	9%	0.089	18%	0.176	C	C	.	.	H	α-helix	trans	-64	-43.3	176.3	-174	71.4	-17.7	0	0	111.7	L219 F224 Q423 I424 F430 A431	L219-Q427 HydrophobicContact CB-CG 4.45Å; L219-Q427 PolarHBondContact O-NE2 3.45Å; F224-Q427 HydrophobicContact CE1-CG 4.09Å; F224-Q427 HydrophobicContact CZ-CB 4.49Å; F224-Q427 HydrophobicContact CZ-CG 3.94Å; Q423-Q427 WeakPolarHBondContact O-CB 3.21Å; Q423-Q427 PolarHBondContact O-N 3.31Å; I424-Q427 WeakPolarHBondContact O-CB 3.35Å; I424-Q427 PolarHBondContact O-N 2.8Å; I424-Q427 VanDerWaalsContact O-N 3.14Å; Q427-F430 PolarHBondContact O-N 3.33Å; Q427-A431 PolarHBondContact O-N 3.38Å; Q427-A431 VanDerWaalsContact O-N 3.08Å
428	C	98.1	Very high	97.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.3	-41	173.9	-66.9	0	0	0	0	112.3	L190 L196 I424 A431 L460 M463	L190-C428 HydrophobicContact CD1-CB 4.05Å; L196-C428 HydrophobicContact CD1-CB 4.38Å; I424-C428 PolarHBondContact O-N 2.93Å; I424-C428 PolarHBondContact O-SG 3.49Å; C428-A431 PolarHBondContact O-N 3.31Å; C428-L460 VanDerWaalsContact SG-CD2 3.54Å; C428-M463 HydrophobicContact CB-CE 4.18Å; C428-M463 HydrophobicContact CB-SD 3.73Å
429	F	97.9	Very high	97	Very high	1 Å²	1	43.9 Å²	43.9	0%	0.004	22%	0.215	C	C	.	.	H	α-helix	trans	-62.8	-46.8	173.7	169.9	-110.1	0	0	0	112.1	I335 Y341 V343 M425 T426 A431 V432 K433 Y517	I335-F429 HydrophobicContact CD1-CD2 4.39Å; Y341-F429 AromaticContact CD1-CE2 3.66Å; Y341-F429 HydrophobicContact CD1-CE2 3.66Å; Y341-F429 AromaticContact CD1-CZ 3.61Å; Y341-F429 HydrophobicContact CD1-CZ 3.61Å; Y341-F429 HydrophobicContact CD2-CZ 4.38Å; Y341-F429 AromaticContact CE1-CE2 3.8Å; Y341-F429 HydrophobicContact CE1-CE2 3.8Å; Y341-F429 HydrophobicContact CE1-CZ 4.1Å; Y341-F429 HydrophobicContact CG-CE2 4.31Å; Y341-F429 AromaticContact CG-CZ 3.79Å; Y341-F429 HydrophobicContact CG-CZ 3.79Å; V343-F429 HydrophobicContact CG1-CG 4.39Å; V343-F429 HydrophobicContact CG2-CD1 4.24Å; V343-F429 HydrophobicContact CG2-CD2 4.03Å; V343-F429 HydrophobicContact CG2-CE1 3.9Å; V343-F429 HydrophobicContact CG2-CE2 3.69Å; V343-F429 HydrophobicContact CG2-CG 4.29Å; V343-F429 HydrophobicContact CG2-CZ 3.62Å; M425-F429 WeakPolarHBondContact O-CB 3.2Å; M425-F429 PolarHBondContact O-N 3.03Å; T426-F429 PolarHBondContact O-N 2.87Å; F429-A431 VanDerWaalsContact C-N 3.25Å; F429-A431 PolarHBondContact O-N 2.93Å; F429-V432 CarbonylContact O-C 3.56Å; F429-V432 WeakPolarHBondContact O-CG2 3.34Å; F429-V432 PolarHBondContact O-N 3.2Å; F429-K433 HydrophobicContact CE1-CB 4.25Å; F429-K433 HydrophobicContact CE1-CD 3.77Å; F429-K433 HydrophobicContact CE1-CG 4.08Å; F429-K433 HydrophobicContact CE2-CB 4.22Å; F429-K433 HydrophobicContact CE2-CG 4.31Å; F429-K433 HydrophobicContact CZ-CB 3.97Å; F429-K433 HydrophobicContact CZ-CD 3.86Å; F429-K433 HydrophobicContact CZ-CG 3.68Å; F429-K433 WeakPolarHBondContact O-CB 3.44Å; F429-K433 PolarHBondContact O-N 3.26Å; F429-Y517 HydrophobicContact CD1-CG 4.48Å; F429-Y517 AromaticContact CE1-CD1 3.55Å; F429-Y517 HydrophobicContact CE1-CD1 3.55Å; F429-Y517 HydrophobicContact CE1-CE1 4.15Å; F429-Y517 AromaticContact CE1-CG 3.81Å; F429-Y517 HydrophobicContact CE1-CG 3.81Å; F429-Y517 HydrophobicContact CZ-CD1 4.05Å; F429-Y517 HydrophobicContact CZ-CE1 4.47Å
430	F	96.2	Very high	96.8	Very high	65 Å²	65	39.6 Å²	39.6	29%	0.285	20%	0.201	S	C	.	.	H	α-helix	trans	-61.1	-33.4	178.2	-72.8	-42.8	0	0	0	113.1	F203 T426 Q427 V432 K433 Y517	F203-F430 HydrophobicContact CE1-CB 4.23Å; F203-F430 HydrophobicContact CE2-CB 4.05Å; F203-F430 HydrophobicContact CZ-CB 3.61Å; T426-F430 HydrophobicContact CG2-CD2 3.91Å; T426-F430 HydrophobicContact CG2-CE2 3.45Å; T426-F430 VanDerWaalsContact CG2-CE2 3.45Å; T426-F430 HydrophobicContact CG2-CZ 4.04Å; T426-F430 WeakPolarHBondContact O-CD2 3.36Å; T426-F430 PolarHBondContact O-N 2.96Å; Q427-F430 PolarHBondContact O-N 3.33Å; F430-V432 PolarHBondContact O-N 3.47Å; F430-K433 HydrophobicContact CD1-CD 4.14Å; F430-K433 HydrophobicContact CE1-CD 4.47Å; F430-Y517 AromaticContact CE1-CD2 3.8Å; F430-Y517 HydrophobicContact CE1-CD2 3.8Å; F430-Y517 AromaticContact CE1-CE2 3.97Å; F430-Y517 HydrophobicContact CE1-CE2 3.97Å; F430-Y517 HydrophobicContact CE1-CG 4.5Å; F430-Y517 HydrophobicContact CZ-CD2 4.03Å; F430-Y517 HydrophobicContact CZ-CE2 4.43Å
431	A	96.3	Very high	96.7	Very high	2 Å²	2	37.3 Å²	37.3	2%	0.017	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-16.6	175.4	0	0	0	0	0	114.8	L200 F203 Q427 C428 F429 K435	L200-A431 HydrophobicContact CD2-CB 3.91Å; F203-A431 HydrophobicContact CB-CB 3.62Å; F203-A431 HydrophobicContact CD1-CB 4.09Å; F203-A431 HydrophobicContact CD2-CB 4.38Å; F203-A431 HydrophobicContact CG-CB 3.8Å; Q427-A431 PolarHBondContact O-N 3.38Å; Q427-A431 VanDerWaalsContact O-N 3.08Å; C428-A431 PolarHBondContact O-N 3.31Å; F429-A431 VanDerWaalsContact C-N 3.25Å; F429-A431 PolarHBondContact O-N 2.93Å; A431-K435 VanDerWaalsContact O-CE 3.29Å; A431-K435 WeakPolarHBondContact O-CE 3.47Å; A431-K435 PolarHBondContact O-NZ 2.98Å
432	V	97.1	Very high	96.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-9.7	179.9	-57.8	0	0	0	0	114.8	V189 L190 F429 F430 T434 K435 L436	V189-V432 HydrophobicContact CB-CG1 4.34Å; V189-V432 HydrophobicContact CG2-CB 4Å; V189-V432 HydrophobicContact CG2-CG1 3.96Å; V189-V432 WeakPolarHBondContact O-CG1 3.3Å; L190-V432 HydrophobicContact CB-CG1 4.13Å; L190-V432 HydrophobicContact CB-CG2 4.2Å; L190-V432 HydrophobicContact CD1-CG1 4.03Å; L190-V432 HydrophobicContact CD1-CG2 3.92Å; L190-V432 HydrophobicContact CD2-CG2 4.09Å; L190-V432 HydrophobicContact CG-CG2 4.31Å; F429-V432 CarbonylContact O-C 3.56Å; F429-V432 WeakPolarHBondContact O-CG2 3.34Å; F429-V432 PolarHBondContact O-N 3.2Å; F430-V432 PolarHBondContact O-N 3.47Å; V432-T434 PolarHBondContact O-N 2.66Å; V432-T434 VanDerWaalsContact O-N 3.08Å; V432-K435 WeakPolarHBondContact O-CA 3.49Å; V432-K435 PolarHBondContact O-N 2.93Å; V432-L436 HydrophobicContact CB-CD1 4.35Å; V432-L436 HydrophobicContact CB-CG 4.12Å; V432-L436 HydrophobicContact CG2-CD1 3.61Å; V432-L436 HydrophobicContact CG2-CG 3.92Å; V432-L436 PolarHBondContact O-N 3.05Å
433	K	96.2	Very high	96.7	Very high	61 Å²	61	35.5 Å²	35.5	27%	0.265	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-34	-174.6	-179.4	179.7	-174.4	-68.5	0	114.6	Y341 F429 F430 Y517	Y341-K433 HydrophobicContact CD2-CG 4.09Å; Y341-K433 HydrophobicContact CE2-CG 3.93Å; Y341-K433 WeakPolarHBondContact CE2-O 3.4Å; Y341-K433 PolarHBondContact OH-O 3.13Å; F429-K433 HydrophobicContact CE1-CB 4.25Å; F429-K433 HydrophobicContact CE1-CD 3.77Å; F429-K433 HydrophobicContact CE1-CG 4.08Å; F429-K433 HydrophobicContact CE2-CB 4.22Å; F429-K433 HydrophobicContact CE2-CG 4.31Å; F429-K433 HydrophobicContact CZ-CB 3.97Å; F429-K433 HydrophobicContact CZ-CD 3.86Å; F429-K433 HydrophobicContact CZ-CG 3.68Å; F429-K433 WeakPolarHBondContact O-CB 3.44Å; F429-K433 PolarHBondContact O-N 3.26Å; F430-K433 HydrophobicContact CD1-CD 4.14Å; F430-K433 HydrophobicContact CE1-CD 4.47Å; K433-Y517 HydrophobicContact CD-CE1 4.43Å; K433-Y517 WeakPolarHBondContact CE-OH 3.4Å
434	T	94.9	Very high	96.7	Very high	132 Å²	132	30.9 Å²	30.9	81%	0.81	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-9	177.9	50.3	0	0	0	0	113.9	V432	V432-T434 PolarHBondContact O-N 2.66Å; V432-T434 VanDerWaalsContact O-N 3.08Å
435	K	96.2	Very high	96.7	Very high	54 Å²	54	31 Å²	31	24%	0.235	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-33.6	-177	-49.2	-177.4	-164.4	177.6	0	112.4	N186 S199 E202 A431 V432	N186-K435 PolarHBondContact ND2-O 3.36Å; S199-K435 PolarHBondContact OG-NZ 2.85Å; E202-K435 WeakPolarHBondContact OE2-CE 3.44Å; E202-K435 IonicContact OE2-NZ 2.71Å; E202-K435 PolarHBondContact OE2-NZ 2.94Å; A431-K435 VanDerWaalsContact O-CE 3.29Å; A431-K435 WeakPolarHBondContact O-CE 3.47Å; A431-K435 PolarHBondContact O-NZ 2.98Å; V432-K435 WeakPolarHBondContact O-CA 3.49Å; V432-K435 PolarHBondContact O-N 2.93Å
436	L	97	Very high	96.7	Very high	8 Å²	8	31.1 Å²	31.1	4%	0.042	16%	0.164	C	C	.	.	S	Bend	trans	-62.8	140.2	179.5	-75.6	174.8	0	0	0	111.9	I184 N186 V189 I335 Y341 V432 C438	I184-L436 HydrophobicContact CG2-CD2 4.16Å; N186-L436 WeakPolarHBondContact OD1-CA 3.3Å; V189-L436 HydrophobicContact CG2-CD2 3.67Å; V189-L436 HydrophobicContact CG2-CG 4.22Å; I335-L436 HydrophobicContact CD1-CD1 3.96Å; Y341-L436 VanDerWaalsContact OH-CB 3.31Å; Y341-L436 WeakPolarHBondContact OH-CB 3.37Å; Y341-L436 PolarHBondContact OH-O 3.5Å; V432-L436 HydrophobicContact CB-CD1 4.35Å; V432-L436 HydrophobicContact CB-CG 4.12Å; V432-L436 HydrophobicContact CG2-CD1 3.61Å; V432-L436 HydrophobicContact CG2-CG 3.92Å; V432-L436 PolarHBondContact O-N 3.05Å; L436-C438 PolarHBondContact O-N 2.88Å
437	D	96.1	Very high	96.8	Very high	58 Å²	58	29.8 Å²	29.8	31%	0.31	16%	0.156	S	C	.	.			trans	-63.9	104.2	178.9	-81.4	-47.5	0	0	0	111.2	I184 P185 N186 R439 F442	I184-D437 HydrophobicContact CG2-CB 4.05Å; P185-D437 HydrophobicContact CG-CB 3.94Å; P185-D437 WeakPolarHBondContact CG-OD2 3.38Å; N186-D437 WeakPolarHBondContact CB-OD2 3.49Å; N186-D437 PolarHBondContact N-OD2 3.25Å; N186-D437 PolarHBondContact ND2-N 3.16Å; N186-D437 PolarHBondContact ND2-OD2 3.31Å; N186-D437 PolarHBondContact OD1-N 3.34Å; D437-R439 PolarHBondContact O-N 3.2Å; D437-F442 HydrophobicContact CB-CD2 4.36Å; D437-F442 HydrophobicContact CB-CE2 4.17Å; D437-F442 WeakPolarHBondContact O-CD2 3.39Å
438	C	95.2	Very high	96.9	Very high	75 Å²	75	28.9 Å²	28.9	51%	0.507	15%	0.152	S	C	.	.			trans	-88.4	105.3	-176.3	-175.1	0	0	0	0	111.3	T338 L436	T338-C438 PolarHBondContact O-SG 2.85Å; L436-C438 PolarHBondContact O-N 2.88Å
439	R	93.9	Very high	96.9	Very high	96 Å²	96	29 Å²	29	36%	0.362	15%	0.152	S	C	.	.			trans	-149.1	136.3	176.2	-62.9	-170.4	-178.5	-178.3	1.1	112.8	F174 Q176 T338 D437 G441 F442	F174-R439 HydrophobicContact CE1-CB 4.12Å; Q176-R439 HydrophobicContact CG-CB 4.4Å; T338-R439 PolarHBondContact OG1-N 2.97Å; T338-R439 PolarHBondContact OG1-O 3.36Å; D437-R439 PolarHBondContact O-N 3.2Å; R439-G441 PolarHBondContact O-N 2.75Å; R439-G441 VanDerWaalsContact O-N 3.11Å; R439-F442 HydrophobicContact CB-CD2 3.81Å; R439-F442 HydrophobicContact CB-CE2 3.84Å; R439-F442 HydrophobicContact CB-CG 4.27Å; R439-F442 HydrophobicContact CB-CZ 4.32Å; R439-F442 HydrophobicContact CG-CD2 4.28Å; R439-F442 HydrophobicContact CG-CE2 3.9Å; R439-F442 HydrophobicContact CG-CZ 4.45Å; R439-F442 PolarHBondContact O-N 2.91Å; R439-F442 VanDerWaalsContact O-N 3.11Å
440	P	93.7	Very high	96.9	Very high	43 Å²	43	28.9 Å²	28.9	28%	0.279	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	115.4	177.2	-23	32.8	0	0	0	111.9	F174 G177 A339	F174-P440 WeakPolarHBondContact CZ-O 3.45Å; G177-P440 PolarHBondContact N-O 3.31Å; A339-P440 HydrophobicContact CB-CG 3.77Å
441	G	96.1	Very high	97	Very high	3 Å²	3	26.1 Å²	26.1	3%	0.031	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	109.3	-2.1	-177.6	0	0	0	0	0	115.4	H179 L180 V181 R439	H179-G441 WeakPolarHBondContact O-CA 3.44Å; L180-G441 CarbonylContact C-O 3.58Å; L180-G441 WeakPolarHBondContact CA-O 3.47Å; V181-G441 PolarHBondContact N-O 2.88Å; R439-G441 PolarHBondContact O-N 2.75Å; R439-G441 VanDerWaalsContact O-N 3.11Å
442	F	97.9	Very high	97.1	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.009	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	132.4	164.5	-66.7	-14	0	0	0	110.8	Y171 F174 V181 I184 P185 T338 D437 R439	Y171-F442 AromaticContact CD1-CE1 3.95Å; Y171-F442 HydrophobicContact CD1-CE1 3.95Å; Y171-F442 AromaticContact CD1-CZ 3.86Å; Y171-F442 HydrophobicContact CD1-CZ 3.86Å; Y171-F442 HydrophobicContact CE1-CE1 4.35Å; Y171-F442 HydrophobicContact CE1-CZ 4.47Å; F174-F442 HydrophobicContact CD1-CD1 4.35Å; F174-F442 AromaticContact CD1-CE1 3.51Å; F174-F442 HydrophobicContact CD1-CE1 3.51Å; F174-F442 AromaticContact CD1-CZ 3.88Å; F174-F442 HydrophobicContact CD1-CZ 3.88Å; F174-F442 HydrophobicContact CD2-CD1 4.39Å; F174-F442 AromaticContact CD2-CE1 3.8Å; F174-F442 HydrophobicContact CD2-CE1 3.8Å; F174-F442 AromaticContact CE1-CD1 3.82Å; F174-F442 HydrophobicContact CE1-CD1 3.82Å; F174-F442 AromaticContact CE1-CE1 3.42Å; F174-F442 HydrophobicContact CE1-CE1 3.42Å; F174-F442 VanDerWaalsContact CE1-CE1 3.42Å; F174-F442 AromaticContact CE1-CZ 3.99Å; F174-F442 HydrophobicContact CE1-CZ 3.99Å; F174-F442 AromaticContact CE2-CD1 3.86Å; F174-F442 HydrophobicContact CE2-CD1 3.86Å; F174-F442 AromaticContact CE2-CE1 3.71Å; F174-F442 HydrophobicContact CE2-CE1 3.71Å; F174-F442 AromaticContact CG-CE1 3.68Å; F174-F442 HydrophobicContact CG-CE1 3.68Å; F174-F442 HydrophobicContact CG-CZ 4.3Å; F174-F442 AromaticContact CZ-CD1 3.55Å; F174-F442 HydrophobicContact CZ-CD1 3.55Å; F174-F442 AromaticContact CZ-CE1 3.53Å; F174-F442 HydrophobicContact CZ-CE1 3.53Å; V181-F442 HydrophobicContact CB-CD1 4.16Å; V181-F442 HydrophobicContact CB-CE1 4.47Å; I184-F442 HydrophobicContact CG1-CB 4.22Å; P185-F442 HydrophobicContact CG-CD2 4.13Å; P185-F442 HydrophobicContact CG-CE2 3.47Å; P185-F442 VanDerWaalsContact CG-CE2 3.47Å; P185-F442 HydrophobicContact CG-CZ 3.79Å; T338-F442 HydrophobicContact CG2-CB 4.23Å; T338-F442 PolarHBondContact N-O 3Å; D437-F442 HydrophobicContact CB-CD2 4.36Å; D437-F442 HydrophobicContact CB-CE2 4.17Å; D437-F442 WeakPolarHBondContact O-CD2 3.39Å; R439-F442 HydrophobicContact CB-CD2 3.81Å; R439-F442 HydrophobicContact CB-CE2 3.84Å; R439-F442 HydrophobicContact CB-CG 4.27Å; R439-F442 HydrophobicContact CB-CZ 4.32Å; R439-F442 HydrophobicContact CG-CD2 4.28Å; R439-F442 HydrophobicContact CG-CE2 3.9Å; R439-F442 HydrophobicContact CG-CZ 4.45Å; R439-F442 PolarHBondContact O-N 2.91Å; R439-F442 VanDerWaalsContact O-N 3.11Å
443	F	98.4	Very high	97.2	Very high	2 Å²	2	27 Å²	27	1%	0.009	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	157.9	174.3	77.1	-78.4	0	0	0	111.2	L160 W162 L180 V181 F182 Q183 I335 L488 T491	L160-F443 HydrophobicContact CD1-CE1 3.71Å; L160-F443 HydrophobicContact CD1-CZ 3.89Å; W162-F443 HydrophobicContact CE3-CE2 4.25Å; W162-F443 AromaticContact CE3-CZ 3.92Å; W162-F443 HydrophobicContact CE3-CZ 3.92Å; W162-F443 AromaticContact CZ3-CE2 3.8Å; W162-F443 HydrophobicContact CZ3-CE2 3.8Å; W162-F443 AromaticContact CZ3-CZ 3.94Å; W162-F443 HydrophobicContact CZ3-CZ 3.94Å; L180-F443 HydrophobicContact CB-CE1 4.27Å; L180-F443 HydrophobicContact CD2-CD1 3.92Å; L180-F443 HydrophobicContact CD2-CE1 4.3Å; V181-F443 VanDerWaalsContact C-CE1 3.43Å; V181-F443 WeakPolarHBondContact O-CD1 3.46Å; V181-F443 WeakPolarHBondContact O-CE1 3.19Å; V181-F443 PolarHBondContact O-N 3.11Å; F182-F443 HydrophobicContact CB-CE1 4.05Å; F182-F443 HydrophobicContact CB-CE2 4.31Å; F182-F443 HydrophobicContact CB-CZ 3.75Å; F182-F443 HydrophobicContact CD2-CD2 4.16Å; F182-F443 AromaticContact CD2-CE2 3.64Å; F182-F443 HydrophobicContact CD2-CE2 3.64Å; F182-F443 AromaticContact CD2-CZ 3.98Å; F182-F443 HydrophobicContact CD2-CZ 3.98Å; F182-F443 HydrophobicContact CE2-CE2 4.49Å; F182-F443 HydrophobicContact CG-CE2 4.41Å; F182-F443 HydrophobicContact CG-CZ 4.31Å; Q183-F443 PolarHBondContact N-O 3.11Å; I335-F443 CarbonylContact O-C 3.53Å; I335-F443 WeakPolarHBondContact O-CA 3.29Å; I335-F443 VanDerWaalsContact O-CB 3.29Å; I335-F443 WeakPolarHBondContact O-CB 3.35Å; F443-L488 HydrophobicContact CZ-CD2 4.28Å; F443-T491 HydrophobicContact CB-CG2 3.9Å; F443-T491 HydrophobicContact CD1-CG2 3.65Å; F443-T491 HydrophobicContact CD2-CG2 3.8Å; F443-T491 HydrophobicContact CE1-CG2 4.05Å; F443-T491 HydrophobicContact CE2-CG2 4.18Å; F443-T491 HydrophobicContact CG-CG2 3.51Å; F443-T491 HydrophobicContact CZ-CG2 4.3Å
444	D	98.5	Very high	97.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	145.7	-177	-141.9	-36	0	0	0	112.2	Q183 I184 N187 L334 I335 I446	Q183-D444 WeakPolarHBondContact CA-OD2 3.15Å; I184-D444 HydrophobicContact CD1-CB 3.89Å; I184-D444 HydrophobicContact CG1-CB 4.06Å; I184-D444 PolarHBondContact N-OD2 2.97Å; N187-D444 WeakPolarHBondContact CB-OD2 3.47Å; N187-D444 PolarHBondContact ND2-OD2 2.98Å; L334-D444 WeakPolarHBondContact CA-O 3.31Å; I335-D444 HydrophobicContact CB-CB 4.47Å; I335-D444 PolarHBondContact N-O 3.29Å; I335-D444 PolarHBondContact O-N 2.89Å; D444-I446 HydrophobicContact CB-CD1 4.37Å; D444-I446 HydrophobicContact CB-CG1 4.34Å
445	L	98.7	Very high	97.3	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.01	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	114.6	174.3	-177.6	67.2	0	0	0	107.8	F182 Y332 L334 P467 T483 F513	F182-L445 HydrophobicContact CE2-CB 3.77Å; F182-L445 HydrophobicContact CZ-CB 4.28Å; Y332-L445 HydrophobicContact CD1-CD1 4Å; Y332-L445 HydrophobicContact CD1-CD2 4.42Å; Y332-L445 HydrophobicContact CD1-CG 4.14Å; Y332-L445 HydrophobicContact CG-CD1 4.45Å; L334-L445 HydrophobicContact CB-CD1 4.11Å; L334-L445 HydrophobicContact CD1-CD1 4.42Å; L445-P467 HydrophobicContact CG-CG 4.42Å; L445-P467 WeakPolarHBondContact O-CD 3.23Å; L445-T483 HydrophobicContact CD2-CG2 4.46Å; L445-F513 HydrophobicContact CD1-CZ 4.07Å
446	I	98.7	Very high	97.3	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.01	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	121	-167.9	-60.6	173.4	0	0	0	108.6	L190 T191 L333 I335 D444 M463 N464	L190-I446 HydrophobicContact CD2-CD1 3.71Å; T191-I446 HydrophobicContact CG2-CD1 3.71Å; T191-I446 HydrophobicContact CG2-CG1 3.99Å; T191-I446 HydrophobicContact CG2-CG2 3.86Å; L333-I446 HydrophobicContact CB-CB 4.35Å; L333-I446 PolarHBondContact N-O 3.14Å; L333-I446 PolarHBondContact O-N 2.86Å; I335-I446 HydrophobicContact CD1-CD1 4.43Å; D444-I446 HydrophobicContact CB-CD1 4.37Å; D444-I446 HydrophobicContact CB-CG1 4.34Å; I446-M463 HydrophobicContact CG2-CB 3.97Å; I446-M463 HydrophobicContact CG2-CE 4.36Å; I446-N464 WeakPolarHBondContact CA-O 3.5Å
447	G	98.4	Very high	97.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	126.5	172.6	0	0	0	0	0	109.9	M463 N464	G447-M463 CarbonylContact O-C 3.6Å; G447-M463 WeakPolarHBondContact O-CA 3.5Å; G447-N464 PolarHBondContact N-O 3.12Å; G447-N464 PolarHBondContact O-N 3.49Å
448	C	98.6	Very high	97.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	126.5	178.9	-56.1	0	0	0	0	108.3	S331 M425 F450 L460 M463	S331-C448 PolarHBondContact N-O 2.88Å; S331-C448 PolarHBondContact O-N 2.99Å; M425-C448 HydrophobicContact CE-CB 4.26Å; M425-C448 HydrophobicContact CG-CB 4.42Å; M425-C448 HydrophobicContact SD-CB 4.29Å; C448-F450 HydrophobicContact CB-CD2 4.39Å; C448-F450 HydrophobicContact CB-CE2 3.71Å; C448-F450 HydrophobicContact CB-CZ 4.4Å; C448-L460 HydrophobicContact CB-CD1 4.32Å; C448-M463 HydrophobicContact CB-CG 4.48Å; C448-M463 VanDerWaalsContact SG-CE 3.53Å
449	D	98.4	Very high	97.6	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.011	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	112.3	-167.3	-64.8	19.7	0	0	0	108.4	R330 R351 L461 E462 N464	R330-D449 IonicContact CZ-OD1 2.7Å; R330-D449 IonicContact CZ-OD2 3.05Å; R330-D449 IonicContact NE-OD1 2.85Å; R330-D449 PolarHBondContact NE-OD1 2.76Å; R330-D449 VanDerWaalsContact NH2-CG 3.27Å; R330-D449 IonicContact NH2-OD1 3.89Å; R330-D449 PolarHBondContact NH2-OD1 3.26Å; R330-D449 IonicContact NH2-OD2 3.57Å; R330-D449 PolarHBondContact NH2-OD2 3.5Å; R351-D449 IonicContact CZ-OD2 3.22Å; R351-D449 IonicContact NH1-OD2 3.2Å; R351-D449 PolarHBondContact NH1-OD2 2.88Å; R351-D449 VanDerWaalsContact NH2-CG 3.34Å; R351-D449 IonicContact NH2-OD2 3.86Å; R351-D449 PolarHBondContact NH2-OD2 2.65Å; D449-L461 WeakPolarHBondContact O-CB 3.31Å; D449-L461 PolarHBondContact O-N 2.79Å; D449-E462 HydrophobicContact CB-CG 4.22Å; D449-E462 PolarHBondContact N-O 2.7Å; D449-N464 PolarHBondContact OD2-ND2 3.46Å
450	F	98.8	Very high	97.9	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	150.5	-172.4	-70.5	-86.5	0	0	0	112.9	D328 V329 M421 I424 M425 C448 V458 W459 L460	D328-F450 CarbonylContact C-O 3.51Å; D328-F450 WeakPolarHBondContact CA-O 3.49Å; D328-F450 VanDerWaalsContact CB-O 3.26Å; D328-F450 WeakPolarHBondContact CB-O 3.39Å; V329-F450 HydrophobicContact CB-CB 4.4Å; V329-F450 PolarHBondContact N-O 3.43Å; V329-F450 PolarHBondContact O-N 3.35Å; M421-F450 HydrophobicContact CB-CE1 4.36Å; M421-F450 HydrophobicContact CB-CE2 4.12Å; M421-F450 HydrophobicContact CB-CZ 3.96Å; M421-F450 HydrophobicContact CG-CD1 4.08Å; M421-F450 HydrophobicContact CG-CD2 3.94Å; M421-F450 HydrophobicContact CG-CE1 4.05Å; M421-F450 HydrophobicContact CG-CE2 3.91Å; M421-F450 HydrophobicContact CG-CG 4.01Å; M421-F450 HydrophobicContact CG-CZ 3.95Å; M421-F450 HydrophobicContact SD-CD2 3.7Å; M421-F450 HydrophobicContact SD-CE2 4Å; M421-F450 HydrophobicContact SD-CG 4.1Å; I424-F450 HydrophobicContact CB-CE1 4.12Å; I424-F450 HydrophobicContact CB-CZ 4.5Å; I424-F450 HydrophobicContact CD1-CE1 3.98Å; I424-F450 HydrophobicContact CG2-CE1 3.86Å; I424-F450 HydrophobicContact CG2-CZ 4.29Å; M425-F450 HydrophobicContact CG-CE2 4.26Å; M425-F450 HydrophobicContact CG-CZ 3.83Å; M425-F450 HydrophobicContact SD-CE2 3.68Å; M425-F450 HydrophobicContact SD-CZ 3.75Å; C448-F450 HydrophobicContact CB-CD2 4.39Å; C448-F450 HydrophobicContact CB-CE2 3.71Å; C448-F450 HydrophobicContact CB-CZ 4.4Å; F450-V458 HydrophobicContact CD1-CG1 3.79Å; F450-V458 HydrophobicContact CE1-CG1 4.38Å; F450-W459 CarbonylContact C-O 3.45Å; F450-W459 VanDerWaalsContact CA-O 3.27Å; F450-W459 WeakPolarHBondContact CA-O 3.47Å; F450-L460 HydrophobicContact CD1-CB 4.14Å; F450-L460 HydrophobicContact CD1-CD1 4.27Å; F450-L460 HydrophobicContact CE1-CB 3.93Å; F450-L460 HydrophobicContact CE1-CD1 3.96Å; F450-L460 HydrophobicContact CE1-CG 4.49Å; F450-L460 HydrophobicContact CE2-CD1 4.32Å; F450-L460 HydrophobicContact CZ-CD1 4Å
451	M	98.6	Very high	98	Very high	7 Å²	7	18.9 Å²	18.9	3%	0.034	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	150.9	171.7	-169.1	159.1	-80.9	0	0	110	I316 P319 K326 F327 D328 W459 L461	I316-M451 HydrophobicContact CB-SD 4.03Å; I316-M451 HydrophobicContact CD1-CB 3.94Å; I316-M451 HydrophobicContact CD1-CG 3.95Å; I316-M451 HydrophobicContact CD1-SD 3.85Å; I316-M451 HydrophobicContact CG2-SD 4.25Å; P319-M451 HydrophobicContact CB-SD 4.37Å; K326-M451 VanDerWaalsContact CE-CE 3.44Å; K326-M451 HydrophobicContact CG-CE 4.37Å; F327-M451 WeakPolarHBondContact O-CE 3.26Å; D328-M451 HydrophobicContact CB-CE 4.2Å; M451-W459 PolarHBondContact N-O 2.69Å; M451-W459 PolarHBondContact O-N 2.66Å; M451-L461 HydrophobicContact CB-CD1 4.1Å; M451-L461 HydrophobicContact CB-CD2 3.93Å; M451-L461 HydrophobicContact CB-CG 4.11Å; M451-L461 HydrophobicContact CE-CD1 3.98Å; M451-L461 HydrophobicContact SD-CD2 4.5Å
452	I	98.6	Very high	98	Very high	1 Å²	1	20 Å²	20	1%	0.005	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	140.4	173.4	-53.2	79.7	0	0	0	106.8	L320 F327 V329 F394 W412 F417 F456 K457	L320-I452 HydrophobicContact CB-CB 4.07Å; L320-I452 HydrophobicContact CB-CG2 4.12Å; L320-I452 HydrophobicContact CD2-CB 4.23Å; L320-I452 HydrophobicContact CD2-CG2 3.91Å; L320-I452 PolarHBondContact N-O 3.07Å; F327-I452 HydrophobicContact CE2-CD1 3.61Å; F327-I452 HydrophobicContact CZ-CD1 3.86Å; V329-I452 HydrophobicContact CG2-CD1 4Å; F394-I452 HydrophobicContact CZ-CD1 4.42Å; W412-I452 HydrophobicContact CH2-CG1 4.2Å; W412-I452 HydrophobicContact CH2-CG2 3.95Å; F417-I452 HydrophobicContact CD2-CD1 4.36Å; F417-I452 HydrophobicContact CD2-CG1 3.98Å; F417-I452 HydrophobicContact CE2-CD1 3.54Å; F417-I452 HydrophobicContact CE2-CG1 3.54Å; F417-I452 HydrophobicContact CZ-CD1 3.65Å; F417-I452 HydrophobicContact CZ-CG1 4.17Å; I452-F456 HydrophobicContact CG2-CB 4.45Å; I452-F456 HydrophobicContact CG2-CD1 4.46Å; I452-K457 WeakPolarHBondContact CA-O 3.46Å
453	D	97.9	Very high	98	Very high	20 Å²	20	20.1 Å²	20.1	11%	0.107	10%	0.098	C	C	.	.	B	Isolated β-bridge	trans	-97	175.2	170.6	58.5	22.6	0	0	0	112.6	I316 K318 D455 F456 K457 W459	I316-D453 HydrophobicContact CG2-CB 4.03Å; K318-D453 WeakPolarHBondContact O-CA 3.17Å; K318-D453 WeakPolarHBondContact O-CB 3.29Å; D453-D455 PolarHBondContact O-N 3.17Å; D453-D455 VanDerWaalsContact O-N 3.12Å; D453-D455 PolarHBondContact OD1-N 3.46Å; D453-F456 PolarHBondContact O-N 3.24Å; D453-F456 PolarHBondContact OD1-N 3.35Å; D453-K457 PolarHBondContact N-O 3.05Å; D453-K457 WeakPolarHBondContact OD1-CA 3.35Å; D453-K457 WeakPolarHBondContact OD1-CB 3.46Å; D453-K457 PolarHBondContact OD1-N 3.31Å; D453-W459 PolarHBondContact OD2-NE1 3.32Å
454	E	96.4	Very high	97.8	Very high	75 Å²	75	21.7 Å²	21.7	35%	0.35	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-20.2	-178.1	66.3	178.7	177.4	0	0	114.7	K318 K406 F456	K318-E454 HydrophobicContact CB-CG 4.01Å; K318-E454 WeakPolarHBondContact CD-OE1 3.42Å; K318-E454 IonicContact NZ-OE1 2.69Å; K318-E454 PolarHBondContact O-N 3.47Å; K406-E454 PolarHBondContact NZ-O 3.14Å; E454-F456 VanDerWaalsContact C-N 3.35Å
455	D	96.2	Very high	97.6	Very high	128 Å²	128	23.4 Å²	23.4	68%	0.684	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	6.8	175.8	-66.8	-37.2	0	0	0	112.9	D453 K457	D453-D455 PolarHBondContact O-N 3.17Å; D453-D455 VanDerWaalsContact O-N 3.12Å; D453-D455 PolarHBondContact OD1-N 3.46Å; D455-K457 PolarHBondContact O-N 2.97Å
456	F	97.5	Very high	97.4	Very high	25 Å²	25	24.5 Å²	24.5	11%	0.11	12%	0.124	C	C	.	.			trans	63.3	18.5	-179.6	-67.2	-102.4	0	0	0	114.5	L320 L402 K406 L408 W412 I452 D453 E454	L320-F456 HydrophobicContact CD1-CE1 4.28Å; L320-F456 HydrophobicContact CD1-CE2 4.19Å; L320-F456 HydrophobicContact CD1-CZ 3.76Å; L320-F456 HydrophobicContact CD2-CD1 4.14Å; L320-F456 HydrophobicContact CD2-CE1 3.61Å; L320-F456 HydrophobicContact CD2-CZ 3.97Å; L402-F456 HydrophobicContact CB-CZ 4.46Å; L402-F456 HydrophobicContact CD1-CZ 4.3Å; K406-F456 HydrophobicContact CB-CE2 3.85Å; K406-F456 HydrophobicContact CB-CZ 4.14Å; K406-F456 HydrophobicContact CD-CE2 3.71Å; K406-F456 HydrophobicContact CG-CE2 3.61Å; K406-F456 HydrophobicContact CG-CZ 3.98Å; L408-F456 HydrophobicContact CD1-CD1 4.05Å; L408-F456 HydrophobicContact CD1-CE1 3.48Å; L408-F456 VanDerWaalsContact CD1-CE1 3.48Å; L408-F456 HydrophobicContact CD1-CZ 3.83Å; L408-F456 HydrophobicContact CD2-CD1 3.96Å; L408-F456 HydrophobicContact CD2-CD2 4.31Å; L408-F456 HydrophobicContact CD2-CE1 4.15Å; L408-F456 HydrophobicContact CD2-CE2 4.5Å; L408-F456 HydrophobicContact CD2-CG 4.06Å; L408-F456 HydrophobicContact CD2-CZ 4.42Å; L408-F456 HydrophobicContact CG-CE1 4.44Å; W412-F456 HydrophobicContact CD2-CD1 4.22Å; W412-F456 AromaticContact CE2-CD1 3.97Å; W412-F456 HydrophobicContact CE3-CD1 4.17Å; W412-F456 HydrophobicContact CH2-CB 4.29Å; W412-F456 AromaticContact CH2-CD1 3.73Å; W412-F456 HydrophobicContact CH2-CD1 3.73Å; W412-F456 HydrophobicContact CZ2-CB 3.79Å; W412-F456 AromaticContact CZ2-CD1 3.76Å; W412-F456 HydrophobicContact CZ2-CD1 3.76Å; W412-F456 HydrophobicContact CZ2-CG 4.27Å; W412-F456 AromaticContact CZ3-CD1 3.92Å; W412-F456 HydrophobicContact CZ3-CD1 3.92Å; W412-F456 HydrophobicContact CZ3-CE1 4.46Å; I452-F456 HydrophobicContact CG2-CB 4.45Å; I452-F456 HydrophobicContact CG2-CD1 4.46Å; D453-F456 PolarHBondContact O-N 3.24Å; D453-F456 PolarHBondContact OD1-N 3.35Å; E454-F456 VanDerWaalsContact C-N 3.35Å
457	K	97.8	Very high	97.2	Very high	75 Å²	75	24.6 Å²	24.6	33%	0.326	13%	0.125	S	C	.	.			trans	-76.8	137.7	171.3	177.6	175.6	174.3	179.3	0	110.3	E222 E223 I452 D453 D455 W459	E222-K457 PolarHBondContact O-NZ 3.48Å; E222-K457 VanDerWaalsContact O-NZ 3.1Å; E223-K457 VanDerWaalsContact O-CE 3.24Å; E223-K457 WeakPolarHBondContact O-CE 3.2Å; I452-K457 WeakPolarHBondContact CA-O 3.46Å; D453-K457 PolarHBondContact N-O 3.05Å; D453-K457 WeakPolarHBondContact OD1-CA 3.35Å; D453-K457 WeakPolarHBondContact OD1-CB 3.46Å; D453-K457 PolarHBondContact OD1-N 3.31Å; D455-K457 PolarHBondContact O-N 2.97Å; K457-W459 HydrophobicContact CD-CH2 4.08Å; K457-W459 HydrophobicContact CD-CZ2 3.56Å; K457-W459 HydrophobicContact CG-CZ2 4.27Å
458	V	98.6	Very high	96.9	Very high	5 Å²	5	26.8 Å²	26.8	3%	0.03	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	124.6	-175.4	-176.6	0	0	0	0	110.9	F417 R420 M421 I424 F450	F417-V458 HydrophobicContact CD2-CG1 4.31Å; F417-V458 HydrophobicContact CD2-CG2 3.53Å; F417-V458 HydrophobicContact CE2-CG1 3.87Å; F417-V458 HydrophobicContact CE2-CG2 3.87Å; R420-V458 HydrophobicContact CB-CB 4.49Å; R420-V458 HydrophobicContact CB-CG2 4.1Å; R420-V458 HydrophobicContact CG-CB 3.65Å; R420-V458 HydrophobicContact CG-CG1 4.2Å; R420-V458 HydrophobicContact CG-CG2 3.69Å; M421-V458 HydrophobicContact CG-CG1 4.49Å; I424-V458 HydrophobicContact CD1-CB 4.28Å; I424-V458 HydrophobicContact CD1-CG1 3.86Å; F450-V458 HydrophobicContact CD1-CG1 3.79Å; F450-V458 HydrophobicContact CE1-CG1 4.38Å
459	W	98.8	Very high	96.7	Very high	13 Å²	13	27.2 Å²	27.2	5%	0.049	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	133.7	177.8	-57	94.8	0	0	0	111	F224 I225 P226 I316 F450 M451 D453 K457	F224-W459 CarbonylContact O-C 3.09Å; F224-W459 WeakPolarHBondContact O-CA 3.39Å; I225-W459 WeakPolarHBondContact O-CZ3 3.26Å; P226-W459 HydrophobicContact CB-CE3 4.29Å; P226-W459 HydrophobicContact CB-CZ3 4.5Å; P226-W459 HydrophobicContact CG-CB 4.18Å; P226-W459 HydrophobicContact CG-CD2 4.06Å; P226-W459 HydrophobicContact CG-CE3 3.75Å; P226-W459 HydrophobicContact CG-CG 4.29Å; P226-W459 HydrophobicContact CG-CZ3 4.43Å; I316-W459 HydrophobicContact CD1-CB 3.72Å; I316-W459 HydrophobicContact CD1-CD2 4.47Å; I316-W459 HydrophobicContact CD1-CG 3.66Å; F450-W459 CarbonylContact C-O 3.45Å; F450-W459 VanDerWaalsContact CA-O 3.27Å; F450-W459 WeakPolarHBondContact CA-O 3.47Å; M451-W459 PolarHBondContact N-O 2.69Å; M451-W459 PolarHBondContact O-N 2.66Å; D453-W459 PolarHBondContact OD2-NE1 3.32Å; K457-W459 HydrophobicContact CD-CH2 4.08Å; K457-W459 HydrophobicContact CD-CZ2 3.56Å; K457-W459 HydrophobicContact CG-CZ2 4.27Å
460	L	98.7	Very high	96.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	123.7	167.6	174.6	65.5	0	0	0	108.8	L196 F224 I225 I424 C428 C448 F450 M463	L196-L460 HydrophobicContact CD2-CD2 4.27Å; F224-L460 HydrophobicContact CD2-CB 4.45Å; F224-L460 PolarHBondContact O-N 3.47Å; I225-L460 HydrophobicContact CD1-CB 3.99Å; I225-L460 HydrophobicContact CD1-CD2 4.13Å; I225-L460 HydrophobicContact CD1-CG 4.23Å; I424-L460 HydrophobicContact CG2-CB 4.02Å; I424-L460 HydrophobicContact CG2-CD2 3.92Å; C428-L460 VanDerWaalsContact SG-CD2 3.54Å; C448-L460 HydrophobicContact CB-CD1 4.32Å; F450-L460 HydrophobicContact CD1-CB 4.14Å; F450-L460 HydrophobicContact CD1-CD1 4.27Å; F450-L460 HydrophobicContact CE1-CB 3.93Å; F450-L460 HydrophobicContact CE1-CD1 3.96Å; F450-L460 HydrophobicContact CE1-CG 4.49Å; F450-L460 HydrophobicContact CE2-CD1 4.32Å; F450-L460 HydrophobicContact CZ-CD1 4Å; L460-M463 HydrophobicContact CD1-CG 4.1Å; L460-M463 HydrophobicContact CD2-CG 4.03Å; L460-M463 HydrophobicContact CD2-SD 4.08Å
461	L	97.1	Very high	96.1	Very high	34 Å²	34	35.5 Å²	35.5	18%	0.178	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-46.3	-178.6	-56.8	-177.2	0	0	0	112.3	I316 D328 D449 M451	I316-L461 HydrophobicContact CD1-CD2 4.07Å; D328-L461 HydrophobicContact CB-CD1 4.34Å; D449-L461 WeakPolarHBondContact O-CB 3.31Å; D449-L461 PolarHBondContact O-N 2.79Å; M451-L461 HydrophobicContact CB-CD1 4.1Å; M451-L461 HydrophobicContact CB-CD2 3.93Å; M451-L461 HydrophobicContact CB-CG 4.11Å; M451-L461 HydrophobicContact CE-CD1 3.98Å; M451-L461 HydrophobicContact SD-CD2 4.5Å
462	E	95.4	Very high	95.7	Very high	27 Å²	27	37.3 Å²	37.3	13%	0.126	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	162.5	176.4	51.2	179.2	-144.8	0	0	111.8	K193 D449 N464	K193-E462 WeakPolarHBondContact CE-OE2 3.47Å; K193-E462 IonicContact NZ-OE2 2.7Å; K193-E462 PolarHBondContact NZ-OE2 3.29Å; D449-E462 HydrophobicContact CB-CG 4.22Å; D449-E462 PolarHBondContact N-O 2.7Å; E462-N464 PolarHBondContact OE1-ND2 3Å; E462-N464 PolarHBondContact OE1-OD1 2.99Å
463	M	97.5	Very high	95.5	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.02	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	131	168.7	-62	176	81	0	0	108.2	L190 T191 L196 L333 C428 I446 G447 C448 L460	L190-M463 HydrophobicContact CD1-CE 3.83Å; L190-M463 HydrophobicContact CD1-SD 3.58Å; L190-M463 VanDerWaalsContact CD1-SD 3.58Å; L190-M463 HydrophobicContact CD2-CE 3.93Å; L190-M463 HydrophobicContact CG-CE 3.87Å; L190-M463 HydrophobicContact CG-SD 3.94Å; T191-M463 CarbonylContact C-O 3.56Å; T191-M463 VanDerWaalsContact CA-O 3.28Å; T191-M463 WeakPolarHBondContact CA-O 3.36Å; L196-M463 HydrophobicContact CD1-SD 3.81Å; L196-M463 HydrophobicContact CD2-CG 4.17Å; L196-M463 HydrophobicContact CD2-SD 4.35Å; L333-M463 HydrophobicContact CD2-CE 3.6Å; C428-M463 HydrophobicContact CB-CE 4.18Å; C428-M463 HydrophobicContact CB-SD 3.73Å; I446-M463 HydrophobicContact CG2-CB 3.97Å; I446-M463 HydrophobicContact CG2-CE 4.36Å; G447-M463 CarbonylContact O-C 3.6Å; G447-M463 WeakPolarHBondContact O-CA 3.5Å; C448-M463 HydrophobicContact CB-CG 4.48Å; C448-M463 VanDerWaalsContact SG-CE 3.53Å; L460-M463 HydrophobicContact CD1-CG 4.1Å; L460-M463 HydrophobicContact CD2-CG 4.03Å; L460-M463 HydrophobicContact CD2-SD 4.08Å
464	N	95.2	Very high	95.4	Very high	36 Å²	36	41.4 Å²	41.4	19%	0.193	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	116.8	-167.1	-80.6	-56.1	0	0	0	110.9	I446 G447 D449 E462	I446-N464 WeakPolarHBondContact CA-O 3.5Å; G447-N464 PolarHBondContact N-O 3.12Å; G447-N464 PolarHBondContact O-N 3.49Å; D449-N464 PolarHBondContact OD2-ND2 3.46Å; E462-N464 PolarHBondContact OE1-ND2 3Å; E462-N464 PolarHBondContact OE1-OD1 2.99Å
465	C	94.3	Very high	95.4	Very high	36 Å²	36	39.3 Å²	39.3	24%	0.243	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	147.9	167.9	52.3	0	0	0	0	110.6	T191	T191-C465 HydrophobicContact CG2-CB 3.84Å
466	N	93.3	Very high	95.4	Very high	25 Å²	25	33.3 Å²	33.3	13%	0.134	17%	0.168	C	C	.	.	S	Bend	trans	48.2	61.8	-176.4	-176.6	53.1	0	0	0	111.8	N133 E164	N133-N466 PolarHBondContact ND2-OD1 3.46Å; E164-N466 WeakPolarHBondContact CG-ND2 3.49Å; E164-N466 PolarHBondContact OE1-ND2 3.23Å
467	P	94.9	Very high	95.4	Very high	4 Å²	4	36.5 Å²	36.5	3%	0.026	18%	0.182	C	C	.	.			trans	-57.7	146.2	178.4	25.9	-34.8	0	0	0	110.6	N133 Y332 L445 L469	N133-P467 PolarHBondContact ND2-O 3.08Å; Y332-P467 HydrophobicContact CD1-CG 4.28Å; Y332-P467 HydrophobicContact CE1-CB 4.1Å; Y332-P467 HydrophobicContact CE1-CG 3.85Å; L445-P467 HydrophobicContact CG-CG 4.42Å; L445-P467 WeakPolarHBondContact O-CD 3.23Å; P467-L469 WeakPolarHBondContact O-CD2 3.3Å; P467-L469 WeakPolarHBondContact O-CG 3.35Å; P467-L469 PolarHBondContact O-N 3.23Å
468	A	92.7	Very high	95.4	Very high	46 Å²	46	37.5 Å²	37.5	38%	0.38	19%	0.188	S	C	.	.			trans	-60.5	131.1	179.7	0	0	0	0	0	111.7
469	L	94.7	Very high	95.3	Very high	8 Å²	8	38 Å²	38	4%	0.042	19%	0.191	C	C	.	.			trans	-113.2	25.3	-176.1	-53.3	178.1	0	0	0	111.9	N133 W162 P467 I480 V484	N133-L469 PolarHBondContact OD1-N 2.97Å; W162-L469 HydrophobicContact CZ2-CD1 4.31Å; P467-L469 WeakPolarHBondContact O-CD2 3.3Å; P467-L469 WeakPolarHBondContact O-CG 3.35Å; P467-L469 PolarHBondContact O-N 3.23Å; L469-I480 HydrophobicContact CB-CG2 3.76Å; L469-I480 HydrophobicContact CD2-CG2 3.93Å; L469-I480 HydrophobicContact CG-CG2 4.41Å; L469-V484 HydrophobicContact CD1-CG2 3.93Å; L469-V484 HydrophobicContact CD2-CG2 3.82Å; L469-V484 HydrophobicContact CG-CG2 4.43Å
470	H	91	Very high	95.3	Very high	88 Å²	88	37.4 Å²	37.4	41%	0.407	19%	0.189	S	C	.	.			trans	-74	143.7	177.6	-53.6	-62.8	0	0	0	111.5
471	R	93.3	Very high	95.3	Very high	88 Å²	88	39.3 Å²	39.3	33%	0.332	20%	0.201	S	C	.	.			trans	-111.9	52.8	-174.3	-56.8	-175.6	-62.4	141.9	2	111.8	E136 C473 K477 I480	E136-R471 IonicContact OE1-CZ 2.93Å; E136-R471 IonicContact OE1-NH2 3.55Å; E136-R471 PolarHBondContact OE1-NH2 2.88Å; E136-R471 IonicContact OE2-CZ 2.75Å; E136-R471 IonicContact OE2-NE 3.69Å; E136-R471 IonicContact OE2-NH2 2.65Å; E136-R471 PolarHBondContact OE2-NH2 3.35Å; R471-C473 VanDerWaalsContact C-N 3.3Å; R471-C473 PolarHBondContact O-N 2.88Å; R471-K477 HydrophobicContact CB-CG 3.85Å; R471-I480 HydrophobicContact CG-CB 4.46Å
472	N	90.2	Very high	95.3	Very high	45 Å²	45	44 Å²	44	24%	0.241	22%	0.217	C	C	.	.			trans	-72.7	-15.9	-166.4	-58	-49.5	0	0	0	115.2	Q371 K375	Q371-N472 PolarHBondContact OE1-ND2 2.97Å; Q371-N472 VanDerWaalsContact OE1-ND2 3.17Å; K375-N472 PolarHBondContact NZ-ND2 3.32Å; K375-N472 PolarHBondContact NZ-OD1 2.88Å
473	C	93.5	Very high	95.5	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.007	21%	0.211	C	C	.	.	S	Bend	trans	-148.6	164.2	-175.1	51.3	0	0	0	0	109.3	E385 R471 V475 L476 K477	E385-C473 VanDerWaalsContact CD-CB 3.46Å; E385-C473 WeakPolarHBondContact OE1-CA 3.37Å; E385-C473 VanDerWaalsContact OE1-CB 3.31Å; E385-C473 WeakPolarHBondContact OE1-CB 3.41Å; E385-C473 VanDerWaalsContact OE2-CA 3.31Å; E385-C473 WeakPolarHBondContact OE2-CA 3.42Å; E385-C473 WeakPolarHBondContact OE2-CB 3.16Å; R471-C473 VanDerWaalsContact C-N 3.3Å; R471-C473 PolarHBondContact O-N 2.88Å; C473-V475 PolarHBondContact O-N 2.81Å; C473-L476 PolarHBondContact O-N 3.48Å; C473-L476 VanDerWaalsContact SG-CD1 3.6Å; C473-L476 VanDerWaalsContact SG-CG 3.56Å; C473-K477 PolarHBondContact O-N 3.29Å
474	E	95.8	Very high	95.5	Very high	107 Å²	107	42.7 Å²	42.7	50%	0.5	21%	0.21	S	C	.	.	H	α-helix	trans	-61.2	-42.5	-169.6	-59.3	-44.7	124.1	0	0	113.1	E385 L476 K477 E478	E385-E474 PolarHBondContact OE2-N 2.83Å; E474-L476 PolarHBondContact O-N 2.97Å; E474-K477 WeakPolarHBondContact O-CA 3.24Å; E474-K477 WeakPolarHBondContact O-CB 3.44Å; E474-K477 PolarHBondContact O-N 2.8Å; E474-K477 IonicContact OE1-NZ 3.47Å; E474-K477 PolarHBondContact OE1-NZ 2.96Å; E474-K477 WeakPolarHBondContact OE2-CD 3.45Å; E474-K477 IonicContact OE2-NZ 2.69Å; E474-K477 PolarHBondContact OE2-NZ 2.88Å; E474-E478 PolarHBondContact O-N 2.91Å
475	V	97.1	Very high	95.7	Very high	31 Å²	31	41.6 Å²	41.6	19%	0.188	21%	0.208	C	C	.	.	H	α-helix	trans	-56.8	-37.2	175.7	179.2	0	0	0	0	111.7	V388 C473 E478 V479	V388-V475 HydrophobicContact CG1-CB 3.97Å; V388-V475 HydrophobicContact CG1-CG1 3.91Å; C473-V475 PolarHBondContact O-N 2.81Å; V475-E478 PolarHBondContact O-N 2.58Å; V475-V479 HydrophobicContact CG1-CG2 4.14Å; V475-V479 WeakPolarHBondContact O-CB 3.42Å; V475-V479 VanDerWaalsContact O-CG2 3.29Å; V475-V479 WeakPolarHBondContact O-CG2 3.29Å; V475-V479 PolarHBondContact O-N 2.94Å
476	L	96.9	Very high	95.9	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-79.3	-26.6	177.2	-62.8	-179.5	0	0	0	113.2	Y349 V388 C473 E474 E478 I480	Y349-L476 HydrophobicContact CD1-CD2 3.59Å; Y349-L476 HydrophobicContact CD2-CD2 3.86Å; Y349-L476 HydrophobicContact CE1-CD2 3.49Å; Y349-L476 VanDerWaalsContact CE1-CD2 3.49Å; Y349-L476 HydrophobicContact CE2-CD2 3.72Å; Y349-L476 HydrophobicContact CG-CD2 3.79Å; V388-L476 HydrophobicContact CG1-CD2 4.15Å; V388-L476 HydrophobicContact CG1-CG 4.15Å; V388-L476 HydrophobicContact CG2-CD1 4.43Å; C473-L476 PolarHBondContact O-N 3.48Å; C473-L476 VanDerWaalsContact SG-CD1 3.6Å; C473-L476 VanDerWaalsContact SG-CG 3.56Å; E474-L476 PolarHBondContact O-N 2.97Å; L476-E478 VanDerWaalsContact C-N 3.26Å; L476-I480 HydrophobicContact CB-CG1 4.16Å; L476-I480 HydrophobicContact CD2-CD1 4.18Å; L476-I480 HydrophobicContact CD2-CG1 4.13Å; L476-I480 WeakPolarHBondContact O-CB 3.43Å; L476-I480 VanDerWaalsContact O-CG1 3.26Å; L476-I480 WeakPolarHBondContact O-CG1 3.28Å; L476-I480 PolarHBondContact O-N 3.33Å
477	K	97.1	Very high	96.1	Very high	93 Å²	93	39 Å²	39	40%	0.404	19%	0.192	S	C	.	.	H	α-helix	trans	-65.8	-31	170.4	-70.9	167.4	175	176.1	0	111.7	R471 C473 E474 P481	R471-K477 HydrophobicContact CB-CG 3.85Å; C473-K477 PolarHBondContact O-N 3.29Å; E474-K477 WeakPolarHBondContact O-CA 3.24Å; E474-K477 WeakPolarHBondContact O-CB 3.44Å; E474-K477 PolarHBondContact O-N 2.8Å; E474-K477 IonicContact OE1-NZ 3.47Å; E474-K477 PolarHBondContact OE1-NZ 2.96Å; E474-K477 WeakPolarHBondContact OE2-CD 3.45Å; E474-K477 IonicContact OE2-NZ 2.69Å; E474-K477 PolarHBondContact OE2-NZ 2.88Å; K477-P481 WeakPolarHBondContact O-CD 3.17Å; K477-P481 VanDerWaalsContact O-CG 3.25Å; K477-P481 WeakPolarHBondContact O-CG 3.49Å
478	E	96.6	Very high	96.3	Very high	96 Å²	96	39 Å²	39	45%	0.449	19%	0.191	S	C	.	.	H	α-helix	trans	-83.8	-55	175.1	-175.3	172.7	-157.1	0	0	113.2	E474 V475 L476 R482	E474-E478 PolarHBondContact O-N 2.91Å; V475-E478 PolarHBondContact O-N 2.58Å; L476-E478 VanDerWaalsContact C-N 3.26Å; E478-R482 IonicContact OE1-CZ 2.58Å; E478-R482 IonicContact OE1-NH1 2.61Å; E478-R482 PolarHBondContact OE1-NH1 3.36Å; E478-R482 IonicContact OE1-NH2 2.72Å; E478-R482 PolarHBondContact OE1-NH2 2.89Å
479	V	97.7	Very high	96.6	Very high	14 Å²	14	38.6 Å²	38.6	9%	0.085	18%	0.183	C	C	.	.	H	α-helix	trans	-70.3	-40.5	-169.1	172.4	0	0	0	0	112.7	Y349 V475 T483	Y349-V479 HydrophobicContact CD1-CG1 4.24Å; V475-V479 HydrophobicContact CG1-CG2 4.14Å; V475-V479 WeakPolarHBondContact O-CB 3.42Å; V475-V479 VanDerWaalsContact O-CG2 3.29Å; V475-V479 WeakPolarHBondContact O-CG2 3.29Å; V475-V479 PolarHBondContact O-N 2.94Å; V479-T483 WeakPolarHBondContact O-CB 3.46Å; V479-T483 PolarHBondContact O-N 3.02Å; V479-T483 VanDerWaalsContact O-N 3.08Å; V479-T483 PolarHBondContact O-OG1 3Å
480	I	98.3	Very high	96.8	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-68.4	-49.6	-173.3	-55.9	-62.9	0	0	0	112.1	I137 Y332 Y349 L469 R471 L476 R482 T483 V484	I137-I480 HydrophobicContact CD1-CG2 3.74Å; Y332-I480 WeakPolarHBondContact OH-CD1 3.49Å; Y349-I480 HydrophobicContact CE1-CD1 3.94Å; L469-I480 HydrophobicContact CB-CG2 3.76Å; L469-I480 HydrophobicContact CD2-CG2 3.93Å; L469-I480 HydrophobicContact CG-CG2 4.41Å; R471-I480 HydrophobicContact CG-CB 4.46Å; L476-I480 HydrophobicContact CB-CG1 4.16Å; L476-I480 HydrophobicContact CD2-CD1 4.18Å; L476-I480 HydrophobicContact CD2-CG1 4.13Å; L476-I480 WeakPolarHBondContact O-CB 3.43Å; L476-I480 VanDerWaalsContact O-CG1 3.26Å; L476-I480 WeakPolarHBondContact O-CG1 3.28Å; L476-I480 PolarHBondContact O-N 3.33Å; I480-R482 PolarHBondContact O-N 2.89Å; I480-T483 PolarHBondContact O-N 3.17Å; I480-V484 HydrophobicContact CG2-CG2 4.25Å; I480-V484 WeakPolarHBondContact O-CG2 3.44Å; I480-V484 PolarHBondContact O-N 3.47Å
481	P	98.1	Very high	97.1	Very high	40 Å²	40	34 Å²	34	26%	0.26	16%	0.162	S	C	.	.	H	α-helix	trans	-64	-37.7	-179.3	-25.1	38	0	0	0	113.6	I137 K477 G485	I137-P481 HydrophobicContact CD1-CG 4.28Å; I137-P481 HydrophobicContact CG2-CB 4.47Å; K477-P481 WeakPolarHBondContact O-CD 3.17Å; K477-P481 VanDerWaalsContact O-CG 3.25Å; K477-P481 WeakPolarHBondContact O-CG 3.49Å; P481-G485 PolarHBondContact O-N 2.99Å
482	R	97.9	Very high	97.3	Very high	134 Å²	134	30.3 Å²	30.3	51%	0.506	15%	0.148	S	C	.	.	H	α-helix	trans	-62.5	-50.3	174.5	-68.7	-171.2	-171.7	143.3	14	111.2	E478 I480 V484 G485 E486	E478-R482 IonicContact OE1-CZ 2.58Å; E478-R482 IonicContact OE1-NH1 2.61Å; E478-R482 PolarHBondContact OE1-NH1 3.36Å; E478-R482 IonicContact OE1-NH2 2.72Å; E478-R482 PolarHBondContact OE1-NH2 2.89Å; I480-R482 PolarHBondContact O-N 2.89Å; R482-V484 VanDerWaalsContact C-N 3.34Å; R482-V484 PolarHBondContact O-N 3.31Å; R482-G485 PolarHBondContact O-N 3.18Å; R482-E486 WeakPolarHBondContact O-CB 3.44Å; R482-E486 PolarHBondContact O-N 3.38Å
483	T	98.5	Very high	97.7	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.006	14%	0.144	C	C	.	.	H	α-helix	trans	-56.8	-44.7	178.9	-57.4	0	0	0	0	112.3	Y332 R346 L445 V479 I480 A487 F513	Y332-T483 HydrophobicContact CD1-CG2 4.07Å; Y332-T483 HydrophobicContact CD2-CG2 3.79Å; Y332-T483 HydrophobicContact CE1-CG2 4.29Å; Y332-T483 HydrophobicContact CE2-CG2 4.04Å; Y332-T483 HydrophobicContact CG-CG2 3.81Å; R346-T483 PolarHBondContact NH1-OG1 3.38Å; L445-T483 HydrophobicContact CD2-CG2 4.46Å; V479-T483 WeakPolarHBondContact O-CB 3.46Å; V479-T483 PolarHBondContact O-N 3.02Å; V479-T483 VanDerWaalsContact O-N 3.08Å; V479-T483 PolarHBondContact O-OG1 3Å; I480-T483 PolarHBondContact O-N 3.17Å; T483-A487 WeakPolarHBondContact O-CB 3.47Å; T483-A487 PolarHBondContact O-N 3.49Å; T483-A487 VanDerWaalsContact O-N 3.16Å; T483-F513 HydrophobicContact CG2-CZ 4.14Å
484	V	98.5	Very high	97.8	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.006	14%	0.144	C	C	.	.	H	α-helix	trans	-74.7	-39.4	-178.3	174.9	0	0	0	0	111.9	I137 V138 W162 L469 I480 R482 L488	I137-V484 HydrophobicContact CG2-CB 3.95Å; I137-V484 HydrophobicContact CG2-CG1 3.78Å; V138-V484 HydrophobicContact CG2-CG1 3.86Å; W162-V484 HydrophobicContact CH2-CG1 4.32Å; L469-V484 HydrophobicContact CD1-CG2 3.93Å; L469-V484 HydrophobicContact CD2-CG2 3.82Å; L469-V484 HydrophobicContact CG-CG2 4.43Å; I480-V484 HydrophobicContact CG2-CG2 4.25Å; I480-V484 WeakPolarHBondContact O-CG2 3.44Å; I480-V484 PolarHBondContact O-N 3.47Å; R482-V484 VanDerWaalsContact C-N 3.34Å; R482-V484 PolarHBondContact O-N 3.31Å; V484-L488 HydrophobicContact CG1-CD1 4.07Å; V484-L488 WeakPolarHBondContact O-CG 3.44Å; V484-L488 PolarHBondContact O-N 3.47Å; V484-L488 VanDerWaalsContact O-N 3.12Å
485	G	98.4	Very high	97.9	Very high	14 Å²	14	25.1 Å²	25.1	14%	0.144	12%	0.122	C	C	.	.	H	α-helix	trans	-61.9	-56.6	176.4	0	0	0	0	0	111.7	P481 R482 A487 L488 D489	P481-G485 PolarHBondContact O-N 2.99Å; R482-G485 PolarHBondContact O-N 3.18Å; G485-A487 VanDerWaalsContact C-N 3.29Å; G485-A487 PolarHBondContact O-N 2.98Å; G485-L488 WeakPolarHBondContact O-CB 3.3Å; G485-L488 PolarHBondContact O-N 3.38Å; G485-D489 PolarHBondContact O-N 3.16Å; G485-D489 VanDerWaalsContact O-OD2 3.11Å
486	E	98.6	Very high	97.8	Very high	6 Å²	6	26.2 Å²	26.2	3%	0.028	13%	0.127	C	C	.	.	H	α-helix	trans	-59.8	-39.2	-179.8	-163.7	-165.4	159.2	0	0	111.8	R346 R482 L488 D489 L490 Q511 D512 F513	R346-E486 IonicContact NE-OE2 3.12Å; R482-E486 WeakPolarHBondContact O-CB 3.44Å; R482-E486 PolarHBondContact O-N 3.38Å; E486-L488 VanDerWaalsContact C-N 3.33Å; E486-L488 PolarHBondContact O-N 2.82Å; E486-D489 PolarHBondContact O-N 2.96Å; E486-L490 HydrophobicContact CG-CD1 4.13Å; E486-L490 WeakPolarHBondContact O-CB 3.47Å; E486-L490 WeakPolarHBondContact O-CG 3.38Å; E486-L490 PolarHBondContact O-N 3.13Å; E486-Q511 HydrophobicContact CG-CB 4.3Å; E486-Q511 WeakPolarHBondContact OE1-CA 3.42Å; E486-Q511 PolarHBondContact OE1-N 3.38Å; E486-D512 VanDerWaalsContact CD-N 3.34Å; E486-D512 PolarHBondContact OE1-N 2.7Å; E486-D512 WeakPolarHBondContact OE2-CB 3.45Å; E486-D512 PolarHBondContact OE2-N 2.88Å; E486-D512 VanDerWaalsContact OE2-N 3.13Å; E486-F513 HydrophobicContact CB-CD2 4.15Å; E486-F513 HydrophobicContact CB-CE2 4.32Å; E486-F513 VanDerWaalsContact CD-CD2 3.47Å; E486-F513 HydrophobicContact CG-CD2 3.95Å; E486-F513 WeakPolarHBondContact OE1-CB 3.44Å; E486-F513 PolarHBondContact OE1-N 3.21Å
487	A	98.8	Very high	97.8	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.008	13%	0.133	C	C	.	.	H	α-helix	trans	-62.1	-38.1	175.3	0	0	0	0	0	113	L334 T483 G485 T491 F513	L334-A487 HydrophobicContact CD1-CB 3.96Å; L334-A487 HydrophobicContact CD2-CB 3.81Å; L334-A487 HydrophobicContact CG-CB 4.47Å; T483-A487 WeakPolarHBondContact O-CB 3.47Å; T483-A487 PolarHBondContact O-N 3.49Å; T483-A487 VanDerWaalsContact O-N 3.16Å; G485-A487 VanDerWaalsContact C-N 3.29Å; G485-A487 PolarHBondContact O-N 2.98Å; A487-T491 WeakPolarHBondContact O-CB 3.46Å; A487-T491 PolarHBondContact O-N 2.84Å; A487-T491 VanDerWaalsContact O-N 3.13Å; A487-T491 PolarHBondContact O-OG1 3.45Å; A487-F513 HydrophobicContact CB-CE2 3.87Å; A487-F513 HydrophobicContact CB-CZ 4.14Å
488	L	98.6	Very high	97.6	Very high	2 Å²	2	25 Å²	25	1%	0.01	13%	0.126	C	C	.	.	H	α-helix	trans	-73	-39	174.9	-77.4	166	0	0	0	112	V138 Y141 L160 W162 F443 V484 G485 E486 T491 L492	V138-L488 HydrophobicContact CG1-CD1 4.29Å; V138-L488 HydrophobicContact CG2-CD1 4.4Å; Y141-L488 HydrophobicContact CD1-CB 4.18Å; Y141-L488 HydrophobicContact CD1-CD1 3.67Å; Y141-L488 HydrophobicContact CD1-CG 4.46Å; Y141-L488 HydrophobicContact CD2-CD1 4.43Å; Y141-L488 HydrophobicContact CE1-CB 3.59Å; Y141-L488 HydrophobicContact CE1-CD1 3.96Å; Y141-L488 HydrophobicContact CE1-CG 4.26Å; Y141-L488 HydrophobicContact CE2-CB 4.01Å; Y141-L488 HydrophobicContact CG-CD1 3.94Å; Y141-L488 VanDerWaalsContact CZ-CB 3.48Å; L160-L488 HydrophobicContact CD2-CD2 4.01Å; W162-L488 HydrophobicContact CE3-CD2 3.88Å; W162-L488 HydrophobicContact CZ3-CD1 4.24Å; W162-L488 HydrophobicContact CZ3-CD2 3.65Å; W162-L488 HydrophobicContact CZ3-CG 3.94Å; F443-L488 HydrophobicContact CZ-CD2 4.28Å; V484-L488 HydrophobicContact CG1-CD1 4.07Å; V484-L488 WeakPolarHBondContact O-CG 3.44Å; V484-L488 PolarHBondContact O-N 3.47Å; V484-L488 VanDerWaalsContact O-N 3.12Å; G485-L488 WeakPolarHBondContact O-CB 3.3Å; G485-L488 PolarHBondContact O-N 3.38Å; E486-L488 VanDerWaalsContact C-N 3.33Å; E486-L488 PolarHBondContact O-N 2.82Å; L488-T491 PolarHBondContact O-N 3.06Å; L488-L492 VanDerWaalsContact O-CB 3.31Å; L488-L492 WeakPolarHBondContact O-CB 3.42Å; L488-L492 VanDerWaalsContact O-CG 3.28Å; L488-L492 WeakPolarHBondContact O-CG 3.33Å; L488-L492 PolarHBondContact O-N 3.32Å
489	D	98.6	Very high	97.3	Very high	38 Å²	38	26.8 Å²	26.8	20%	0.203	13%	0.129	C	C	.	.	H	α-helix	trans	-62.2	-51.3	176.2	-68.5	-45.3	0	0	0	111.1	Y141 R145 G485 E486 T491 L492 E493	Y141-D489 WeakPolarHBondContact CE2-OD1 3.38Å; Y141-D489 WeakPolarHBondContact OH-CA 3.5Å; Y141-D489 PolarHBondContact OH-N 3.17Å; Y141-D489 PolarHBondContact OH-OD1 3.42Å; R145-D489 IonicContact CZ-OD1 3.68Å; R145-D489 IonicContact NE-OD1 2.69Å; R145-D489 IonicContact NH2-OD1 3.6Å; R145-D489 PolarHBondContact NH2-OD1 2.99Å; G485-D489 PolarHBondContact O-N 3.16Å; G485-D489 VanDerWaalsContact O-OD2 3.11Å; E486-D489 PolarHBondContact O-N 2.96Å; D489-T491 PolarHBondContact O-N 2.87Å; D489-L492 PolarHBondContact O-N 3.09Å; D489-E493 WeakPolarHBondContact O-CB 3.31Å; D489-E493 PolarHBondContact O-N 2.97Å
490	L	98.6	Very high	97.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-56.5	-48.4	175.2	-78.4	166.1	0	0	0	112.3	L334 F344 E486 L492 E493 L494 L507 S509 Q510 F513	L334-L490 HydrophobicContact CD2-CB 4.4Å; L334-L490 HydrophobicContact CD2-CD1 3.94Å; F344-L490 HydrophobicContact CE1-CD2 4.41Å; F344-L490 HydrophobicContact CZ-CD2 4.31Å; E486-L490 HydrophobicContact CG-CD1 4.13Å; E486-L490 WeakPolarHBondContact O-CB 3.47Å; E486-L490 WeakPolarHBondContact O-CG 3.38Å; E486-L490 PolarHBondContact O-N 3.13Å; L490-L492 VanDerWaalsContact C-N 3.3Å; L490-L492 PolarHBondContact O-N 3.01Å; L490-E493 PolarHBondContact O-N 2.98Å; L490-L494 VanDerWaalsContact O-CB 3.28Å; L490-L494 WeakPolarHBondContact O-CB 3.49Å; L490-L494 VanDerWaalsContact O-CG 3.25Å; L490-L494 WeakPolarHBondContact O-CG 3.49Å; L490-L494 PolarHBondContact O-N 2.87Å; L490-L507 HydrophobicContact CD2-CB 4.3Å; L490-L507 HydrophobicContact CD2-CD1 4.01Å; L490-S509 WeakPolarHBondContact CA-OG 3.09Å; L490-S509 PolarHBondContact N-OG 2.75Å; L490-Q510 HydrophobicContact CD2-CB 3.85Å; L490-Q510 HydrophobicContact CD2-CG 4.24Å; L490-F513 HydrophobicContact CD1-CB 3.67Å; L490-F513 HydrophobicContact CD1-CD2 3.68Å; L490-F513 HydrophobicContact CD1-CG 3.87Å
491	T	98.3	Very high	96.9	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-60.6	-40.6	178.9	-63.8	0	0	0	0	111.3	L180 F443 A487 L488 D489 F495	L180-T491 HydrophobicContact CD1-CG2 4.19Å; L180-T491 HydrophobicContact CD2-CG2 3.55Å; L180-T491 HydrophobicContact CG-CG2 4.5Å; F443-T491 HydrophobicContact CB-CG2 3.9Å; F443-T491 HydrophobicContact CD1-CG2 3.65Å; F443-T491 HydrophobicContact CD2-CG2 3.8Å; F443-T491 HydrophobicContact CE1-CG2 4.05Å; F443-T491 HydrophobicContact CE2-CG2 4.18Å; F443-T491 HydrophobicContact CG-CG2 3.51Å; F443-T491 HydrophobicContact CZ-CG2 4.3Å; A487-T491 WeakPolarHBondContact O-CB 3.46Å; A487-T491 PolarHBondContact O-N 2.84Å; A487-T491 VanDerWaalsContact O-N 3.13Å; A487-T491 PolarHBondContact O-OG1 3.45Å; L488-T491 PolarHBondContact O-N 3.06Å; D489-T491 PolarHBondContact O-N 2.87Å; T491-F495 WeakPolarHBondContact O-CB 3.46Å; T491-F495 PolarHBondContact O-N 2.89Å
492	L	97.7	Very high	96.7	Very high	9 Å²	9	45.2 Å²	45.2	5%	0.047	20%	0.203	C	C	.	.	H	α-helix	trans	-74.7	-39.3	179.4	-75.9	167.5	0	0	0	113	Y141 W147 L180 L488 D489 L490 N496	Y141-L492 HydrophobicContact CE1-CD1 3.93Å; Y141-L492 WeakPolarHBondContact OH-CD1 3.27Å; W147-L492 HydrophobicContact CH2-CD1 4.13Å; W147-L492 HydrophobicContact CH2-CD2 3.58Å; W147-L492 HydrophobicContact CZ2-CD1 4.35Å; W147-L492 HydrophobicContact CZ2-CD2 4.12Å; L180-L492 HydrophobicContact CD1-CD2 3.38Å; L180-L492 HydrophobicContact CD1-CG 4.18Å; L488-L492 VanDerWaalsContact O-CB 3.31Å; L488-L492 WeakPolarHBondContact O-CB 3.42Å; L488-L492 VanDerWaalsContact O-CG 3.28Å; L488-L492 WeakPolarHBondContact O-CG 3.33Å; L488-L492 PolarHBondContact O-N 3.32Å; D489-L492 PolarHBondContact O-N 3.09Å; L490-L492 VanDerWaalsContact C-N 3.3Å; L490-L492 PolarHBondContact O-N 3.01Å; L492-N496 VanDerWaalsContact O-CB 3.29Å; L492-N496 WeakPolarHBondContact O-CB 3.33Å; L492-N496 PolarHBondContact O-N 3.01Å; L492-N496 PolarHBondContact O-ND2 2.97Å
493	E	97.9	Very high	96.5	Very high	32 Å²	32	46.6 Å²	46.6	15%	0.15	22%	0.215	C	C	.	.	H	α-helix	trans	-61.1	-51.3	174.5	-165.7	-168.9	153.6	0	0	110.2	D489 L490 F495 N496 K497 L507 V508 S509	D489-E493 WeakPolarHBondContact O-CB 3.31Å; D489-E493 PolarHBondContact O-N 2.97Å; L490-E493 PolarHBondContact O-N 2.98Å; E493-F495 PolarHBondContact O-N 3.09Å; E493-N496 PolarHBondContact O-N 3.15Å; E493-K497 HydrophobicContact CG-CD 4.14Å; E493-K497 WeakPolarHBondContact O-CB 3.15Å; E493-K497 PolarHBondContact O-N 3.03Å; E493-K497 WeakPolarHBondContact OE1-CE 3.38Å; E493-K497 IonicContact OE1-NZ 2.81Å; E493-K497 PolarHBondContact OE1-NZ 3.1Å; E493-L507 HydrophobicContact CG-CD2 4.32Å; E493-L507 WeakPolarHBondContact OE1-CA 3.43Å; E493-V508 PolarHBondContact OE1-N 2.69Å; E493-V508 PolarHBondContact OE2-N 2.91Å; E493-S509 WeakPolarHBondContact OE2-CB 3.4Å; E493-S509 PolarHBondContact OE2-N 3.22Å; E493-S509 PolarHBondContact OE2-OG 3.24Å
494	L	97.1	Very high	96.2	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-56.8	-50.6	176.2	-75.8	170.1	0	0	0	112	A336 M342 F344 L490 N496 K497 C498 I504 L507	A336-L494 HydrophobicContact CB-CD1 3.51Å; M342-L494 HydrophobicContact CB-CD1 3.75Å; M342-L494 HydrophobicContact CB-CD2 4.45Å; M342-L494 HydrophobicContact CE-CD2 4.27Å; M342-L494 HydrophobicContact CG-CD1 4.07Å; M342-L494 HydrophobicContact CG-CD2 3.86Å; F344-L494 HydrophobicContact CE2-CD1 4.2Å; F344-L494 HydrophobicContact CZ-CD1 4.49Å; L490-L494 VanDerWaalsContact O-CB 3.28Å; L490-L494 WeakPolarHBondContact O-CB 3.49Å; L490-L494 VanDerWaalsContact O-CG 3.25Å; L490-L494 WeakPolarHBondContact O-CG 3.49Å; L490-L494 PolarHBondContact O-N 2.87Å; L494-N496 VanDerWaalsContact C-N 3.27Å; L494-N496 PolarHBondContact O-N 3.14Å; L494-K497 PolarHBondContact O-N 3.23Å; L494-C498 WeakPolarHBondContact O-CB 3.37Å; L494-C498 PolarHBondContact O-N 3.35Å; L494-C498 PolarHBondContact O-SG 2.99Å; L494-I504 HydrophobicContact CD2-CD1 4.34Å; L494-I504 HydrophobicContact CD2-CG2 3.62Å; L494-L507 HydrophobicContact CD2-CD1 4.23Å; L494-L507 HydrophobicContact CD2-CD2 3.72Å; L494-L507 HydrophobicContact CG-CD1 4.5Å; L494-L507 HydrophobicContact CG-CD2 3.96Å
495	F	96.3	Very high	96	Very high	11 Å²	11	49.9 Å²	49.9	5%	0.048	23%	0.232	C	C	.	.	H	α-helix	trans	-66	-30.3	-178.4	-171.2	-129.1	0	0	0	113.1	R159 G177 H179 L180 T491 E493 R499	R159-F495 VanDerWaalsContact CZ-CD1 3.5Å; R159-F495 VanDerWaalsContact NH2-CD1 3.33Å; G177-F495 VanDerWaalsContact C-CZ 3.42Å; G177-F495 WeakPolarHBondContact O-CZ 3.48Å; H179-F495 WeakPolarHBondContact O-CZ 3.28Å; L180-F495 HydrophobicContact CD1-CB 4.21Å; L180-F495 HydrophobicContact CD1-CD1 3.56Å; L180-F495 HydrophobicContact CD1-CE1 4.14Å; L180-F495 HydrophobicContact CD1-CG 4.14Å; L180-F495 HydrophobicContact CD2-CB 4.09Å; L180-F495 HydrophobicContact CD2-CD1 3.96Å; L180-F495 HydrophobicContact CD2-CD2 4.31Å; L180-F495 HydrophobicContact CD2-CE1 4.36Å; L180-F495 HydrophobicContact CD2-CG 3.9Å; L180-F495 HydrophobicContact CG-CB 4.36Å; L180-F495 HydrophobicContact CG-CD1 3.42Å; L180-F495 VanDerWaalsContact CG-CD1 3.42Å; L180-F495 HydrophobicContact CG-CE1 3.63Å; L180-F495 HydrophobicContact CG-CG 3.91Å; L180-F495 HydrophobicContact CG-CZ 4.32Å; T491-F495 WeakPolarHBondContact O-CB 3.46Å; T491-F495 PolarHBondContact O-N 2.89Å; E493-F495 PolarHBondContact O-N 3.09Å; F495-R499 WeakPolarHBondContact O-CB 3.43Å; F495-R499 PolarHBondContact O-N 2.87Å
496	N	95.9	Very high	95.9	Very high	55 Å²	55	54.5 Å²	54.5	29%	0.294	26%	0.26	S	S	.	.	H	α-helix	trans	-72.9	-48.7	172.8	-73.7	-33.1	0	0	0	111.6	R159 L492 E493 L494 R499 L500	R159-N496 PolarHBondContact NH2-OD1 3.21Å; L492-N496 VanDerWaalsContact O-CB 3.29Å; L492-N496 WeakPolarHBondContact O-CB 3.33Å; L492-N496 PolarHBondContact O-N 3.01Å; L492-N496 PolarHBondContact O-ND2 2.97Å; E493-N496 PolarHBondContact O-N 3.15Å; L494-N496 VanDerWaalsContact C-N 3.27Å; L494-N496 PolarHBondContact O-N 3.14Å; N496-R499 PolarHBondContact O-N 2.76Å; N496-R499 PolarHBondContact OD1-NH2 2.98Å; N496-L500 WeakPolarHBondContact O-CB 3.3Å; N496-L500 WeakPolarHBondContact O-CG 3.43Å; N496-L500 PolarHBondContact O-N 2.93Å
497	K	95.8	Very high	95.7	Very high	28 Å²	28	54.9 Å²	54.9	12%	0.122	26%	0.262	C	S	.	.	H	α-helix	trans	-57.8	-49.9	177	-80.2	172.1	155.4	173.7	0	112.2	E493 L494 R499 L500 R501 Q502 E503 I504 P506 L507	E493-K497 HydrophobicContact CG-CD 4.14Å; E493-K497 WeakPolarHBondContact O-CB 3.15Å; E493-K497 PolarHBondContact O-N 3.03Å; E493-K497 WeakPolarHBondContact OE1-CE 3.38Å; E493-K497 IonicContact OE1-NZ 2.81Å; E493-K497 PolarHBondContact OE1-NZ 3.1Å; L494-K497 PolarHBondContact O-N 3.23Å; K497-R499 VanDerWaalsContact C-N 3.32Å; K497-R499 PolarHBondContact O-N 3.17Å; K497-L500 CarbonylContact O-C 3.55Å; K497-L500 PolarHBondContact O-N 2.94Å; K497-L500 VanDerWaalsContact O-N 3.16Å; K497-R501 PolarHBondContact O-N 2.75Å; K497-Q502 HydrophobicContact CB-CB 4.21Å; K497-Q502 HydrophobicContact CG-CB 4.1Å; K497-Q502 PolarHBondContact O-N 2.79Å; K497-E503 VanDerWaalsContact CD-O 3.28Å; K497-E503 WeakPolarHBondContact CD-O 3.36Å; K497-E503 WeakPolarHBondContact CE-O 3.37Å; K497-I504 PolarHBondContact NZ-O 3.22Å; K497-P506 PolarHBondContact NZ-O 2.7Å; K497-L507 HydrophobicContact CD-CD2 4.48Å
498	C	92.8	Very high	95.6	Very high	40 Å²	40	61 Å²	61	27%	0.27	30%	0.299	S	S	.	.	H	α-helix	trans	-54.8	-45.6	174.7	-69.9	0	0	0	0	112.3	L494 L500 R501 I504	L494-C498 WeakPolarHBondContact O-CB 3.37Å; L494-C498 PolarHBondContact O-N 3.35Å; L494-C498 PolarHBondContact O-SG 2.99Å; C498-L500 VanDerWaalsContact C-N 3.34Å; C498-L500 PolarHBondContact O-N 3.39Å; C498-R501 PolarHBondContact O-N 2.81Å; C498-I504 WeakPolarHBondContact SG-CD1 3.16Å
499	R	91.8	Very high	95.5	Very high	133 Å²	133	61.9 Å²	61.9	50%	0.502	31%	0.305	S	S	.	.	H	α-helix	trans	-67.5	-33.5	-179.8	-179.7	-178.9	64.3	139.9	-0.8	112.6	G177 F495 N496 K497	G177-R499 WeakPolarHBondContact O-CD 3.06Å; F495-R499 WeakPolarHBondContact O-CB 3.43Å; F495-R499 PolarHBondContact O-N 2.87Å; N496-R499 PolarHBondContact O-N 2.76Å; N496-R499 PolarHBondContact OD1-NH2 2.98Å; K497-R499 VanDerWaalsContact C-N 3.32Å; K497-R499 PolarHBondContact O-N 3.17Å
500	L	94.2	Very high	95.5	Very high	99 Å²	99	63.3 Å²	63.3	52%	0.518	31%	0.311	S	S	.	.	H	α-helix	trans	-90.2	0.1	179.3	-64.8	174.7	0	0	0	113.4	N496 K497 C498 Q502	N496-L500 WeakPolarHBondContact O-CB 3.3Å; N496-L500 WeakPolarHBondContact O-CG 3.43Å; N496-L500 PolarHBondContact O-N 2.93Å; K497-L500 CarbonylContact O-C 3.55Å; K497-L500 PolarHBondContact O-N 2.94Å; K497-L500 VanDerWaalsContact O-N 3.16Å; C498-L500 VanDerWaalsContact C-N 3.34Å; C498-L500 PolarHBondContact O-N 3.39Å; L500-Q502 HydrophobicContact CB-CG 3.85Å; L500-Q502 PolarHBondContact O-N 2.75Å
501	R	92	Very high	95.4	Very high	238 Å²	238	69.9 Å²	69.9	90%	0.898	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	31.8	-173	-55.6	-176.4	178.7	-171.7	-0.4	113.7	K497 C498	K497-R501 PolarHBondContact O-N 2.75Å; C498-R501 PolarHBondContact O-N 2.81Å
502	Q	94.3	Very high	95.3	Very high	105 Å²	105	73.6 Å²	73.6	49%	0.491	36%	0.361	S	S	.	.			trans	-81.9	159.2	175.1	-68	171.7	-40.4	0	0	111	K497 L500 I504	K497-Q502 HydrophobicContact CB-CB 4.21Å; K497-Q502 HydrophobicContact CG-CB 4.1Å; K497-Q502 PolarHBondContact O-N 2.79Å; L500-Q502 HydrophobicContact CB-CG 3.85Å; L500-Q502 PolarHBondContact O-N 2.75Å; Q502-I504 PolarHBondContact O-N 2.61Å
503	E	93.4	Very high	95.3	Very high	164 Å²	164	73.2 Å²	73.2	77%	0.766	36%	0.359	S	S	*	.			trans	-58.3	133.4	171.7	-62.2	-170.2	145.2	0	0	110.9	K497	K497-E503 VanDerWaalsContact CD-O 3.28Å; K497-E503 WeakPolarHBondContact CD-O 3.36Å; K497-E503 WeakPolarHBondContact CE-O 3.37Å
504	I	93.7	Very high	95.4	Very high	15 Å²	15	75 Å²	75	8%	0.077	37%	0.372	C	S	.	.			trans	-73.4	-45.5	-173.7	-66.2	-119.6	0	0	0	110.8	P340 M342 L494 K497 C498 Q502 L507 V520	P340-I504 HydrophobicContact CG-CD1 3.77Å; M342-I504 HydrophobicContact CE-CG2 3.87Å; M342-I504 HydrophobicContact SD-CG2 4.08Å; L494-I504 HydrophobicContact CD2-CD1 4.34Å; L494-I504 HydrophobicContact CD2-CG2 3.62Å; K497-I504 PolarHBondContact NZ-O 3.22Å; C498-I504 WeakPolarHBondContact SG-CD1 3.16Å; Q502-I504 PolarHBondContact O-N 2.61Å; I504-L507 VanDerWaalsContact O-CD2 3.29Å; I504-L507 WeakPolarHBondContact O-CD2 3.49Å; I504-V520 HydrophobicContact CB-CG1 4.46Å; I504-V520 HydrophobicContact CB-CG2 4.07Å; I504-V520 HydrophobicContact CD1-CG2 3.75Å; I504-V520 HydrophobicContact CG1-CG1 4.38Å; I504-V520 HydrophobicContact CG1-CG2 3.75Å; I504-V520 HydrophobicContact CG2-CG2 4.16Å
505	L	94.2	Very high	95.4	Very high	55 Å²	55	77.5 Å²	77.5	29%	0.288	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-103.6	151.9	-179.8	-58.9	178.3	0	0	0	109.8	M342 L507 L521	M342-L505 HydrophobicContact CE-CD2 4.06Å; L505-L507 HydrophobicContact CD2-CD1 4.13Å; L505-L507 HydrophobicContact CD2-CG 4.13Å; L505-L521 HydrophobicContact CD1-CD1 3.93Å; L505-L521 HydrophobicContact CD1-CG 4.23Å
506	P	94.6	Very high	95.5	Very high	111 Å²	111	78.6 Å²	78.6	72%	0.721	39%	0.391	S	S	*	.	S	Bend	cis	-70.5	152.6	-8.3	31.7	-35.8	0	0	0	111.6	K497	K497-P506 PolarHBondContact NZ-O 2.7Å
507	L	96.1	Very high	95.6	Very high	15 Å²	15	78.6 Å²	78.6	8%	0.079	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-91.5	125.4	174.6	-70.3	165.2	0	0	0	109.8	M342 F344 L490 E493 L494 K497 I504 L505 Q510	M342-L507 HydrophobicContact CE-CD1 4.23Å; F344-L507 HydrophobicContact CE1-CD1 4.04Å; F344-L507 HydrophobicContact CZ-CD1 3.59Å; L490-L507 HydrophobicContact CD2-CB 4.3Å; L490-L507 HydrophobicContact CD2-CD1 4.01Å; E493-L507 HydrophobicContact CG-CD2 4.32Å; E493-L507 WeakPolarHBondContact OE1-CA 3.43Å; L494-L507 HydrophobicContact CD2-CD1 4.23Å; L494-L507 HydrophobicContact CD2-CD2 3.72Å; L494-L507 HydrophobicContact CG-CD1 4.5Å; L494-L507 HydrophobicContact CG-CD2 3.96Å; K497-L507 HydrophobicContact CD-CD2 4.48Å; I504-L507 VanDerWaalsContact O-CD2 3.29Å; I504-L507 WeakPolarHBondContact O-CD2 3.49Å; L505-L507 HydrophobicContact CD2-CD1 4.13Å; L505-L507 HydrophobicContact CD2-CG 4.13Å; L507-Q510 HydrophobicContact CB-CB 4.02Å
508	V	96.4	Very high	95.6	Very high	130 Å²	130	77.7 Å²	77.7	79%	0.788	39%	0.385	S	S	*	.	S	Bend	trans	-81.7	-27.4	-175.2	-176.9	0	0	0	0	111.6	E493	E493-V508 PolarHBondContact OE1-N 2.69Å; E493-V508 PolarHBondContact OE2-N 2.91Å
509	S	96.1	Very high	95.6	Very high	20 Å²	20	77.4 Å²	77.4	14%	0.14	39%	0.389	C	S	.	.	S	Bend	trans	-83	-9.9	178.4	53.7	0	0	0	0	115	L490 E493 Q511	L490-S509 WeakPolarHBondContact CA-OG 3.09Å; L490-S509 PolarHBondContact N-OG 2.75Å; E493-S509 WeakPolarHBondContact OE2-CB 3.4Å; E493-S509 PolarHBondContact OE2-N 3.22Å; E493-S509 PolarHBondContact OE2-OG 3.24Å; S509-Q511 PolarHBondContact O-N 3.28Å; S509-Q511 PolarHBondContact O-NE2 2.69Å
510	Q	97.6	Very high	95.2	Very high	67 Å²	67	74.6 Å²	74.6	31%	0.313	39%	0.386	S	S	.	.			trans	-71.6	125.5	-176.9	-165.4	-180	-21.9	0	0	111.3	F344 L490 L507 F513	F344-Q510 HydrophobicContact CE1-CG 4.49Å; L490-Q510 HydrophobicContact CD2-CB 3.85Å; L490-Q510 HydrophobicContact CD2-CG 4.24Å; L507-Q510 HydrophobicContact CB-CB 4.02Å; Q510-F513 VanDerWaalsContact CG-O 3.24Å; Q510-F513 WeakPolarHBondContact CG-O 3.45Å; Q510-F513 PolarHBondContact NE2-O 2.79Å
511	Q	96.3	Very high	94	Very high	139 Å²	139	75 Å²	75	65%	0.65	39%	0.389	S	S	*	.	S	Bend	trans	-128.7	-86.7	-178.6	-68.7	159.5	79.3	0	0	109.9	E486 S509	E486-Q511 HydrophobicContact CG-CB 4.3Å; E486-Q511 WeakPolarHBondContact OE1-CA 3.42Å; E486-Q511 PolarHBondContact OE1-N 3.38Å; S509-Q511 PolarHBondContact O-N 3.28Å; S509-Q511 PolarHBondContact O-NE2 2.69Å
512	D	97.4	Very high	91.8	Very high	79 Å²	79	66.3 Å²	66.3	42%	0.422	37%	0.372	S	S	.	.	S	Bend	trans	-91.2	-16.8	-177	-57.9	-43.1	0	0	0	112.7	R346 E486 V514	R346-D512 HydrophobicContact CG-CB 3.89Å; R346-D512 IonicContact CZ-OD2 3.2Å; R346-D512 VanDerWaalsContact NE-CB 3.35Å; R346-D512 IonicContact NE-OD2 3.38Å; R346-D512 IonicContact NH2-OD2 2.65Å; R346-D512 PolarHBondContact NH2-OD2 2.76Å; E486-D512 VanDerWaalsContact CD-N 3.34Å; E486-D512 PolarHBondContact OE1-N 2.7Å; E486-D512 WeakPolarHBondContact OE2-CB 3.45Å; E486-D512 PolarHBondContact OE2-N 2.88Å; E486-D512 VanDerWaalsContact OE2-N 3.13Å; D512-V514 PolarHBondContact O-N 2.78Å
513	F	98.6	Very high	89	Confident	1 Å²	1	68.4 Å²	68.4	0%	0.004	38%	0.382	C	S	.	.			trans	-72.9	114.7	174.2	-87.4	-73.6	0	0	0	111.1	L334 F344 F345 R346 L445 T483 E486 A487 L490 Q510	L334-F513 HydrophobicContact CB-CD1 3.89Å; L334-F513 HydrophobicContact CB-CE1 3.32Å; L334-F513 HydrophobicContact CB-CZ 3.78Å; L334-F513 HydrophobicContact CD2-CD1 4.05Å; L334-F513 HydrophobicContact CD2-CD2 4.04Å; L334-F513 HydrophobicContact CD2-CE1 3.91Å; L334-F513 HydrophobicContact CD2-CE2 3.9Å; L334-F513 HydrophobicContact CD2-CG 4.15Å; L334-F513 HydrophobicContact CD2-CZ 3.84Å; L334-F513 HydrophobicContact CG-CE1 4.26Å; L334-F513 HydrophobicContact CG-CZ 4.41Å; F344-F513 HydrophobicContact CB-CB 3.85Å; F344-F513 HydrophobicContact CB-CD1 3.52Å; F344-F513 HydrophobicContact CB-CE1 4.48Å; F344-F513 HydrophobicContact CB-CG 4.03Å; F344-F513 HydrophobicContact CD1-CB 4.1Å; F344-F513 HydrophobicContact CG-CB 4.21Å; F345-F513 CarbonylContact O-C 3.47Å; F345-F513 WeakPolarHBondContact O-CA 3.47Å; R346-F513 HydrophobicContact CB-CD1 3.48Å; R346-F513 VanDerWaalsContact CB-CD1 3.48Å; R346-F513 HydrophobicContact CB-CD2 4.34Å; R346-F513 HydrophobicContact CB-CE1 3.41Å; R346-F513 VanDerWaalsContact CB-CE1 3.41Å; R346-F513 HydrophobicContact CB-CE2 4.29Å; R346-F513 HydrophobicContact CB-CG 3.95Å; R346-F513 HydrophobicContact CB-CZ 3.84Å; R346-F513 HydrophobicContact CG-CD1 4.47Å; R346-F513 HydrophobicContact CG-CE1 4.49Å; R346-F513 HydrophobicContact CG-CG 4.49Å; L445-F513 HydrophobicContact CD1-CZ 4.07Å; T483-F513 HydrophobicContact CG2-CZ 4.14Å; E486-F513 HydrophobicContact CB-CD2 4.15Å; E486-F513 HydrophobicContact CB-CE2 4.32Å; E486-F513 VanDerWaalsContact CD-CD2 3.47Å; E486-F513 HydrophobicContact CG-CD2 3.95Å; E486-F513 WeakPolarHBondContact OE1-CB 3.44Å; E486-F513 PolarHBondContact OE1-N 3.21Å; A487-F513 HydrophobicContact CB-CE2 3.87Å; A487-F513 HydrophobicContact CB-CZ 4.14Å; L490-F513 HydrophobicContact CD1-CB 3.67Å; L490-F513 HydrophobicContact CD1-CD2 3.68Å; L490-F513 HydrophobicContact CD1-CG 3.87Å; Q510-F513 VanDerWaalsContact CG-O 3.24Å; Q510-F513 WeakPolarHBondContact CG-O 3.45Å; Q510-F513 PolarHBondContact NE2-O 2.79Å
514	V	98.3	Very high	86	Confident	68 Å²	68	67 Å²	67	41%	0.412	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	124.6	174.6	-178.1	0	0	0	0	109.9	F344 F345 D512 L516	F344-V514 CarbonylContact C-O 3.55Å; F344-V514 VanDerWaalsContact CA-O 3.22Å; F344-V514 WeakPolarHBondContact CA-O 3.33Å; F345-V514 HydrophobicContact CD1-CB 4.39Å; F345-V514 HydrophobicContact CD1-CG2 4.49Å; F345-V514 PolarHBondContact N-O 2.88Å; F345-V514 PolarHBondContact O-N 3.45Å; D512-V514 PolarHBondContact O-N 2.78Å; V514-L516 PolarHBondContact O-N 3.22Å
515	L	98.2	Very high	83	Confident	55 Å²	55	70.7 Å²	70.7	29%	0.288	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	118.8	178.2	-178.2	68.9	0	0	0	111.1	M342 F344 Y517	M342-L515 HydrophobicContact CE-CD1 3.81Å; F344-L515 HydrophobicContact CD1-CB 4.01Å; F344-L515 HydrophobicContact CD1-CD1 4.04Å; F344-L515 HydrophobicContact CE1-CB 3.99Å; F344-L515 HydrophobicContact CE1-CD1 3.63Å; F344-L515 HydrophobicContact CE1-CG 4.4Å; F344-L515 HydrophobicContact CE2-CD1 4.31Å; F344-L515 HydrophobicContact CZ-CD1 3.78Å; L515-Y517 WeakPolarHBondContact CD1-O 3.4Å
516	L	97.5	Very high	80.1	Confident	34 Å²	34	75.4 Å²	75.4	18%	0.178	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-39	172.8	-65.8	-177.2	0	0	0	112.3	L333 V343 F345 Q422 M425 V514	L333-L516 HydrophobicContact CD1-CD1 3.78Å; V343-L516 PolarHBondContact O-N 3.03Å; F345-L516 HydrophobicContact CB-CD1 3.96Å; F345-L516 HydrophobicContact CB-CD2 3.83Å; F345-L516 HydrophobicContact CB-CG 3.82Å; Q422-L516 HydrophobicContact CB-CD2 3.76Å; Q422-L516 HydrophobicContact CG-CD2 3.95Å; M425-L516 HydrophobicContact CB-CD1 4.09Å; V514-L516 PolarHBondContact O-N 3.22Å
517	Y	97.4	Very high	77.1	Confident	54 Å²	54	79.6 Å²	79.6	21%	0.212	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	134.7	-176.5	179.9	-95.2	0	0	0	112.2	V343 F429 F430 K433 L515	V343-Y517 PolarHBondContact N-O 2.99Å; V343-Y517 PolarHBondContact O-N 3.28Å; V343-Y517 VanDerWaalsContact O-N 3.13Å; F429-Y517 HydrophobicContact CD1-CG 4.48Å; F429-Y517 AromaticContact CE1-CD1 3.55Å; F429-Y517 HydrophobicContact CE1-CD1 3.55Å; F429-Y517 HydrophobicContact CE1-CE1 4.15Å; F429-Y517 AromaticContact CE1-CG 3.81Å; F429-Y517 HydrophobicContact CE1-CG 3.81Å; F429-Y517 HydrophobicContact CZ-CD1 4.05Å; F429-Y517 HydrophobicContact CZ-CE1 4.47Å; F430-Y517 AromaticContact CE1-CD2 3.8Å; F430-Y517 HydrophobicContact CE1-CD2 3.8Å; F430-Y517 AromaticContact CE1-CE2 3.97Å; F430-Y517 HydrophobicContact CE1-CE2 3.97Å; F430-Y517 HydrophobicContact CE1-CG 4.5Å; F430-Y517 HydrophobicContact CZ-CD2 4.03Å; F430-Y517 HydrophobicContact CZ-CE2 4.43Å; K433-Y517 HydrophobicContact CD-CE1 4.43Å; K433-Y517 WeakPolarHBondContact CE-OH 3.4Å; L515-Y517 WeakPolarHBondContact CD1-O 3.4Å
518	S	96.4	Very high	74.2	Confident	9 Å²	9	90.4 Å²	90.4	6%	0.063	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.8	166.8	179.4	0	0	0	0	110.2	Y341 M342 V520 L521	Y341-S518 CarbonylContact O-C 3.57Å; M342-S518 PolarHBondContact SD-OG 3.28Å; S518-V520 VanDerWaalsContact C-N 3.32Å; S518-V520 PolarHBondContact OG-N 3.07Å; S518-V520 VanDerWaalsContact OG-N 3.12Å; S518-L521 PolarHBondContact OG-N 3.07Å
519	G	92.5	Very high	71	Confident	34 Å²	34	90.3 Å²	90.3	35%	0.351	48%	0.476	S	S	.	.	S	Bend	trans	-88.4	5.7	169.2	0	0	0	0	0	114.1	Y341	Y341-G519 PolarHBondContact O-N 3.14Å
520	V	84.2	Confident	68.1	Low	74 Å²	74	96.8 Å²	96.8	45%	0.448	51%	0.509	S	S	.	.	S	Bend	trans	-95.3	-39.3	174.1	-176	0	0	0	0	110.3	P340 M342 I504 S518 G522	P340-V520 HydrophobicContact CB-CG2 3.83Å; P340-V520 HydrophobicContact CG-CG2 3.51Å; M342-V520 HydrophobicContact SD-CG2 4.37Å; I504-V520 HydrophobicContact CB-CG1 4.46Å; I504-V520 HydrophobicContact CB-CG2 4.07Å; I504-V520 HydrophobicContact CD1-CG2 3.75Å; I504-V520 HydrophobicContact CG1-CG1 4.38Å; I504-V520 HydrophobicContact CG1-CG2 3.75Å; I504-V520 HydrophobicContact CG2-CG2 4.16Å; S518-V520 VanDerWaalsContact C-N 3.32Å; S518-V520 PolarHBondContact OG-N 3.07Å; S518-V520 VanDerWaalsContact OG-N 3.12Å; V520-G522 PolarHBondContact O-N 3.05Å
521	L	69.1	Low	64.8	Low	109 Å²	109	98.8 Å²	98.8	57%	0.571	53%	0.531	S	S	*	.	S	Bend	trans	-70.2	82.9	165.4	-65.9	171.8	0	0	0	108.6	L505 S518	L505-L521 HydrophobicContact CD1-CD1 3.93Å; L505-L521 HydrophobicContact CD1-CG 4.23Å; S518-L521 PolarHBondContact OG-N 3.07Å
522	G	46.2	Very low	61.7	Low	54 Å²	54	97.1 Å²	97.1	56%	0.557	53%	0.534	S	S	*	.			trans	-52.4	146.5	163	0	0	0	0	0	109.8	V520 V524	V520-G522 PolarHBondContact O-N 3.05Å; G522-V524 PolarHBondContact O-N 3.38Å; G522-V524 VanDerWaalsContact O-N 3.11Å
523	H	35.3	Very low	58.7	Low	150 Å²	150	100.7 Å²	100.7	69%	0.694	55%	0.553	S	S	*	*			trans	-57	119.9	-175.3	-151.3	-70	0	0	0	109.6	D525	H523-D525 IonicContact CE1-OD1 2.71Å; H523-D525 PolarHBondContact CE1-OD1 3.17Å; H523-D525 IonicContact CE1-OD2 3.99Å; H523-D525 IonicContact ND1-OD1 3.74Å; H523-D525 PolarHBondContact ND1-OD1 3.41Å; H523-D525 IonicContact ND1-OD2 2.68Å; H523-D525 PolarHBondContact O-N 2.72Å
524	V	29.8	Very low	55.4	Low	134 Å²	134	110.8 Å²	110.8	81%	0.812	60%	0.598	S	S	*	*			trans	-79.9	53	175.4	-167.3	0	0	0	0	109.4	G522	G522-V524 PolarHBondContact O-N 3.38Å; G522-V524 VanDerWaalsContact O-N 3.11Å
525	D	30.9	Very low	52.1	Low	92 Å²	92	113.6 Å²	113.6	49%	0.492	62%	0.619	S	S	.	*			trans	-92.6	113.9	163	-89.1	19	0	0	0	107.3	N214 H523 K527	N214-D525 PolarHBondContact ND2-OD2 2.99Å; H523-D525 IonicContact CE1-OD1 2.71Å; H523-D525 PolarHBondContact CE1-OD1 3.17Å; H523-D525 IonicContact CE1-OD2 3.99Å; H523-D525 IonicContact ND1-OD1 3.74Å; H523-D525 PolarHBondContact ND1-OD1 3.41Å; H523-D525 IonicContact ND1-OD2 2.68Å; H523-D525 PolarHBondContact O-N 2.72Å; D525-K527 PolarHBondContact O-N 2.86Å
526	N	32.5	Very low	48.9	Very low	155 Å²	155	120.3 Å²	120.3	83%	0.829	65%	0.649	S	S	*	*			trans	-66.4	96.6	176	-93.9	-33.9	0	0	0	111.1
527	K	33.1	Very low	45.6	Very low	199 Å²	199	129.1 Å²	129.1	87%	0.865	69%	0.685	S	S	*	*			trans	180	153.8	130.7	-96.3	151	-171.1	-179.8	0	113.1	D525	D525-K527 PolarHBondContact O-N 2.86Å
528	R	35.4	Very low	42.3	Very low	242 Å²	242	131.1 Å²	131.1	91%	0.913	71%	0.714	S	S	*	*			trans	-67.6	132.5	170.5	-63.1	176	-179.8	164.1	-2.1	110.4
529	T	28.3	Very low	39.2	Very low	128 Å²	128	140.1 Å²	140.1	79%	0.785	75%	0.752	S	S	*	*			trans	-144.5	119.8	152.3	50.5	0	0	0	0	107.3
530	D	34.4	Very low	36.1	Very low	155 Å²	155	146.3 Å²	146.3	83%	0.829	78%	0.776	S	S	*	*			trans	-66.7	140.1	177.8	-71.6	-67.3	0	0	0	111.6
531	S	29.2	Very low	33.4	Very low	110 Å²	110	150.3 Å²	150.3	77%	0.769	80%	0.795	S	S	*	*			trans	-146.1	41.7	172.3	79	0	0	0	0	111.9	D533	S531-D533 VanDerWaalsContact C-N 3.27Å; S531-D533 PolarHBondContact O-N 2.74Å
532	S	32.1	Very low	31.5	Very low	103 Å²	103	156.8 Å²	156.8	72%	0.72	81%	0.812	S	S	*	*			trans	-76.2	77.6	166.4	56.1	0	0	0	0	110.3
533	D	33.1	Very low	30.6	Very low	155 Å²	155	163.5 Å²	163.5	83%	0.829	83%	0.826	S	S	*	*			trans	178.5	91.9	147.3	-99.7	-18.3	0	0	0	112.7	S531	S531-D533 VanDerWaalsContact C-N 3.27Å; S531-D533 PolarHBondContact O-N 2.74Å
534	F	29.9	Very low	30.2	Very low	213 Å²	213	162 Å²	162	93%	0.934	83%	0.83	S	S	*	*			trans	-156.1	50.8	156.8	-139.5	-90	0	0	0	114.8
535	C	28.6	Very low	30.1	Very low	127 Å²	127	167.2 Å²	167.2	86%	0.858	84%	0.835	S	S	*	*			trans	-146.2	44.8	173.2	-152.8	0	0	0	0	115.6
536	Q	31.8	Very low	30	Very low	195 Å²	195	172 Å²	172	91%	0.911	85%	0.854	S	S	*	*			trans	-152.8	81.3	171	-117.5	-179.2	80.4	0	0	113.9
537	K	28.1	Very low	29.7	Very low	219 Å²	219	173.3 Å²	173.3	95%	0.952	86%	0.855	S	S	*	*			trans	-171.8	79.9	160.4	-110.8	160.2	-172.7	170.6	0	113.2
538	A	27.8	Very low	29.4	Very low	97 Å²	97	173.8 Å²	173.8	80%	0.802	86%	0.857	S	S	*	*			trans	-165.3	51.2	167.5	0	0	0	0	0	114.3
539	K	30.7	Very low	29	Very low	198 Å²	198	168.8 Å²	168.8	86%	0.861	85%	0.853	S	S	*	*			trans	-170.6	108.3	164.7	-107.8	152.5	-171.3	176.9	0	111.9
540	N	28.8	Very low	28.8	Very low	163 Å²	163	173.3 Å²	173.3	87%	0.872	86%	0.856	S	S	*	*			trans	160.6	105.5	138.1	-85.2	-9.5	0	0	0	109.1
541	N	25.9	Very low	28.4	Very low	158 Å²	158	170.7 Å²	170.7	85%	0.845	85%	0.846	S	S	*	*			trans	-142.2	75.4	168.7	-136.3	-5	0	0	0	109.4
542	R	29.4	Very low	28.3	Very low	245 Å²	245	171.8 Å²	171.8	93%	0.925	84%	0.839	S	S	*	*			trans	-137.5	110.2	165.3	-81.8	-170.7	172	-173.1	-3.2	107.3
543	K	26.9	Very low	28.1	Very low	196 Å²	196	173.3 Å²	173.3	85%	0.852	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-88	130.7	171.5	-68.8	-175.1	177.3	-176.3	0	109.9
544	P	26.9	Very low	27.9	Very low	119 Å²	119	172.8 Å²	172.8	77%	0.773	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-74.2	163.5	141.3	-13.6	30.9	0	0	0	110.3
545	R	29.5	Very low	27.8	Very low	242 Å²	242	172.4 Å²	172.4	91%	0.913	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-89.2	149.4	164	-69.8	171.9	168.8	167.6	-6.2	108.6
546	E	27.2	Very low	27.6	Very low	192 Å²	192	170 Å²	170	90%	0.897	83%	0.834	S	S	*	*			trans	-148.6	165.6	154.1	-128.2	151.7	-126.6	0	0	110.7
547	H	27.5	Very low	27.4	Very low	184 Å²	184	167.2 Å²	167.2	85%	0.852	83%	0.831	S	S	*	*			trans	-83.9	153.1	-160.6	-79.3	-86.6	0	0	0	114.5
548	K	26.6	Very low	27.4	Very low	209 Å²	209	163.3 Å²	163.3	91%	0.909	83%	0.825	S	S	*	*			trans	-75.1	136.5	162.2	-74.2	-174.9	174.7	-175.3	0	110
549	T	26.5	Very low	27.4	Very low	136 Å²	136	162.7 Å²	162.7	83%	0.834	82%	0.82	S	S	*	*			trans	-133.1	142.8	154	-44.3	0	0	0	0	110
550	R	24.6	Very low	27.3	Very low	224 Å²	224	157.7 Å²	157.7	85%	0.845	81%	0.81	S	S	*	*			trans	-62	153.1	173	-89.8	172.6	90.7	167.8	4.4	112.7
551	T	26.1	Very low	27.2	Very low	99 Å²	99	156.8 Å²	156.8	61%	0.607	80%	0.8	S	S	*	*			cis	-138.4	-100.5	-18.7	-34.7	0	0	0	0	110.9
552	E	26.7	Very low	27.3	Very low	134 Å²	134	156.4 Å²	156.4	63%	0.626	79%	0.794	S	S	*	*			cis	-152.8	166.6	-11.4	-154.7	49.9	-83.9	0	0	113.1
553	I	28.6	Very low	27.3	Very low	134 Å²	134	151.9 Å²	151.9	69%	0.687	79%	0.788	S	S	*	*			trans	-80	138.5	-165	-64	154	0	0	0	114.8
554	T	27.5	Very low	28.3	Very low	145 Å²	145	147.6 Å²	147.6	89%	0.89	78%	0.78	S	S	*	*				-161.5	159.3	128.9	0.4	0	0	0	0	113.9
555	K	27.2	Very low	28.4	Very low	205 Å²	205	149.4 Å²	149.4	89%	0.891	78%	0.782	S	S	*	*			trans	-107.5	157.5	175.5	-58.3	173.5	-179	175.8	0	109.9
556	G	25.8	Very low	28.3	Very low	75 Å²	75	145 Å²	145	77%	0.773	78%	0.783	S	S	*	*			trans	-172.1	133.5	166.7	0	0	0	0	0	111.6
557	T	26.3	Very low	28.4	Very low	137 Å²	137	144.3 Å²	144.3	84%	0.84	78%	0.78	S	S	*	*			trans	-142.8	165.1	-173.9	-46.6	0	0	0	0	109.6
558	V	29.3	Very low	28.5	Very low	138 Å²	138	140.8 Å²	140.8	84%	0.836	77%	0.771	S	S	*	*			trans	115.4	150	160.5	-176.9	0	0	0	0	115
559	A	27.8	Very low	28.6	Very low	84 Å²	84	137.3 Å²	137.3	69%	0.694	77%	0.767	S	S	*	*			trans	-73.3	-175.7	-173.2	0	0	0	0	0	113.2
560	S	27.2	Very low	28.7	Very low	93 Å²	93	139.2 Å²	139.2	65%	0.65	77%	0.767	S	S	*	*			cis	-157.1	-159.6	28.3	-50.2	0	0	0	0	111.7
561	Q	27.8	Very low	28.8	Very low	143 Å²	143	135.6 Å²	135.6	67%	0.668	77%	0.77	S	S	*	*			cis	-160.7	176.3	2.7	-139.6	147.6	-72.7	0	0	112.4
562	E	28.1	Very low	29	Very low	150 Å²	150	139.3 Å²	139.3	70%	0.701	78%	0.78	S	S	*	*			trans	32.6	116.8	150.4	-77.6	148.8	-139.2	0	0	123.2
563	D	28.7	Very low	28.9	Very low	151 Å²	151	139.6 Å²	139.6	81%	0.807	79%	0.791	S	S	*	*				44.2	163.9	98.7	-81.8	6.1	0	0	0	122.7
564	P	47.5	Very low	28.9	Very low	106 Å²	106	138.6 Å²	138.6	69%	0.688	80%	0.796	S	S	*	*			cis	-136.7	172.1	-7.7	29.5	-6.4	0	0	0	117.8
565	L	29.1	Very low	29.7	Very low	156 Å²	156	136.7 Å²	136.7	82%	0.817	79%	0.786	S	S	*	*			trans	8.4	139.7	144.6	-60.7	162.3	0	0	0	122.6
566	T	28.1	Very low	29.7	Very low	150 Å²	150	133.4 Å²	133.4	92%	0.92	78%	0.777	S	S	*	*				-165.1	171.7	110.5	12.5	0	0	0	0	112.5
567	E	28.8	Very low	30	Very low	178 Å²	178	138.8 Å²	138.8	83%	0.832	78%	0.782	S	S	*	*			trans	-146.9	-179.6	-156.8	-166	-172.3	-147.4	0	0	112.7
568	V	31	Very low	30.1	Very low	110 Å²	110	139.7 Å²	139.7	67%	0.667	78%	0.777	S	S	*	*			trans	104	137	148.2	-157.6	0	0	0	0	119.4
569	T	27.3	Very low	30	Very low	135 Å²	135	139 Å²	139	83%	0.828	78%	0.778	S	S	*	*			trans	97.5	142.3	153.6	7.4	0	0	0	0	121.8
570	Q	29.3	Very low	30.1	Very low	177 Å²	177	139.8 Å²	139.8	83%	0.827	78%	0.784	S	S	*	*			trans	-125.7	160.5	179.3	-55.7	165.5	-22	0	0	108.8
571	T	26.6	Very low	30.2	Very low	148 Å²	148	140.1 Å²	140.1	91%	0.908	79%	0.793	S	S	*	*			trans	-168	177.6	139	7.4	0	0	0	0	112.3
572	E	30.2	Very low	30.1	Very low	176 Å²	176	139.1 Å²	139.1	82%	0.822	80%	0.802	S	S	*	*			trans	-100.4	164.4	-159.1	-48.1	171.1	123.8	0	0	114.4
573	T	25.6	Very low	30.2	Very low	141 Å²	141	138.9 Å²	138.9	87%	0.865	81%	0.81	S	S	*	*				175.4	171.9	121.4	31.1	0	0	0	0	112.9
574	S	27.2	Very low	30.1	Very low	112 Å²	112	135.1 Å²	135.1	78%	0.783	81%	0.807	S	S	*	*			trans	-130.3	-176	174.8	-69	0	0	0	0	107.5
575	P	45.5	Very low	29.1	Very low	106 Å²	106	138.8 Å²	138.8	69%	0.688	82%	0.815	S	S	*	*			cis	-149.3	-168.8	14.7	44.5	-22.7	0	0	0	118
576	L	27.3	Very low	29	Very low	135 Å²	135	137.3 Å²	137.3	71%	0.707	82%	0.817	S	S	*	*			trans	63.7	121.3	147.3	-81.5	163.4	0	0	0	122.7	Q578	L576-Q578 HydrophobicContact CD2-CG 4.39Å
577	H	30.6	Very low	29.1	Very low	189 Å²	189	136.1 Å²	136.1	88%	0.875	81%	0.811	S	S	*	*				-154	-176.7	113.1	-121.6	-48.1	0	0	0	111.7
578	Q	28.3	Very low	29.1	Very low	155 Å²	155	136.8 Å²	136.8	72%	0.724	82%	0.816	S	S	*	*			trans	-138.7	171.2	-160.1	-74.1	-174.4	-20.5	0	0	114.9	L576	L576-Q578 HydrophobicContact CD2-CG 4.39Å
579	S	28.9	Very low	28.9	Very low	124 Å²	124	136.1 Å²	136.1	87%	0.867	82%	0.823	S	S	*	*			trans	79.7	153.9	165.3	84.5	0	0	0	0	116.5
580	A	28.5	Very low	29	Very low	100 Å²	100	135.6 Å²	135.6	83%	0.826	82%	0.819	S	S	*	*			cis	-137.2	168.5	0.6	0	0	0	0	0	111.5
581	A	29	Very low	28.9	Very low	101 Å²	101	138.8 Å²	138.8	84%	0.835	82%	0.823	S	S	*	*			trans	-104.5	155.3	178.7	0	0	0	0	0	112.5
582	S	27.5	Very low	28.9	Very low	121 Å²	121	142.5 Å²	142.5	85%	0.846	82%	0.821	S	S	*	*			trans	-144.7	145.5	159.9	60.8	0	0	0	0	110.4
583	V	29.4	Very low	28.9	Very low	145 Å²	145	143.6 Å²	143.6	88%	0.879	82%	0.823	S	S	*	*			trans	-98.7	142.9	-174.7	177.8	0	0	0	0	110.5
584	G	27	Very low	29.1	Very low	72 Å²	72	143.5 Å²	143.5	74%	0.742	82%	0.822	S	S	*	*			trans	-146.6	128.1	172	0	0	0	0	0	110.5
585	E	26.3	Very low	29.1	Very low	184 Å²	184	149.8 Å²	149.8	86%	0.86	83%	0.829	S	S	*	*			trans	-88	155.2	-162.9	-60.8	175.5	112.5	0	0	114.4	P587	E585-P587 WeakPolarHBondContact O-CD 3.22Å
586	C	26.1	Very low	28.3	Very low	125 Å²	125	148.9 Å²	148.9	85%	0.845	83%	0.83	S	S	*	*			trans	-89.8	121.8	171.3	-63.2	0	0	0	0	111.8	M588	C586-M588 PolarHBondContact O-N 3.25Å
587	P	31.4	Very low	28.4	Very low	124 Å²	124	148.1 Å²	148.1	81%	0.805	83%	0.833	S	S	*	*			trans	-80.1	113.1	167.9	30.4	-31.6	0	0	0	111.3	E585	E585-P587 WeakPolarHBondContact O-CD 3.22Å
588	M	28	Very low	28.2	Very low	192 Å²	192	148.4 Å²	148.4	95%	0.946	84%	0.835	S	S	*	*			trans	-70.3	127.2	166.4	-81.7	-156	-68.2	0	0	111.2	C586	C586-M588 PolarHBondContact O-N 3.25Å
589	A	27.6	Very low	28.1	Very low	96 Å²	96	146.8 Å²	146.8	79%	0.793	84%	0.836	S	S	*	*			trans	-117.8	85.1	-178.4	0	0	0	0	0	114
590	V	28.2	Very low	28	Very low	124 Å²	124	152.3 Å²	152.3	75%	0.752	84%	0.837	S	S	*	*			trans	41.2	99.1	147.9	-169.1	0	0	0	0	118.6	R592	V590-R592 HydrophobicContact CG1-CG 4.26Å; V590-R592 PolarHBondContact O-N 3.38Å
591	R	28.4	Very low	28	Very low	245 Å²	245	155.1 Å²	155.1	93%	0.925	84%	0.838	S	S	*	*			trans	-65.9	82.6	165.8	-171.4	-178.6	-171.2	176.5	4.2	112.1	K593	R591-K593 PolarHBondContact O-N 2.9Å; R591-K593 VanDerWaalsContact O-N 3.15Å
592	R	26.9	Very low	27.9	Very low	226 Å²	226	159.9 Å²	159.9	85%	0.853	84%	0.84	S	S	*	*			trans	-62.7	111.1	177.5	-83.9	-173.4	168.5	178.4	-2.5	112.1	V590 T594	V590-R592 HydrophobicContact CG1-CG 4.26Å; V590-R592 PolarHBondContact O-N 3.38Å; R592-T594 PolarHBondContact O-N 2.9Å
593	K	30.2	Very low	27.9	Very low	199 Å²	199	162.8 Å²	162.8	87%	0.865	84%	0.844	S	S	*	*			trans	-75.1	107.7	165.5	-69.5	-179.8	178.7	177.6	0	109.7	R591	R591-K593 PolarHBondContact O-N 2.9Å; R591-K593 VanDerWaalsContact O-N 3.15Å
594	T	28.7	Very low	27.8	Very low	139 Å²	139	161.3 Å²	161.3	85%	0.853	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-76.3	122	164.9	35.2	0	0	0	0	109.8	R592	R592-T594 PolarHBondContact O-N 2.9Å
595	R	26.6	Very low	27.9	Very low	244 Å²	244	167.4 Å²	167.4	92%	0.921	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-78.3	137	171.4	-73.8	177.5	169.3	170.2	-4.5	109.4
596	A	29.9	Very low	27.9	Very low	87 Å²	87	164.8 Å²	164.8	72%	0.719	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-69.5	141.8	166.1	0	0	0	0	0	110.3
597	P	29	Very low	28.1	Very low	118 Å²	118	165.7 Å²	165.7	77%	0.766	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-75.4	125.3	176.1	30	-33	0	0	0	111.1	V599	P597-V599 PolarHBondContact O-N 3.15Å
598	Q	26.1	Very low	27.9	Very low	195 Å²	195	165.1 Å²	165.1	91%	0.911	84%	0.843	S	S	*	*			trans	-75.5	108.9	168.9	-75.9	-176	-27.4	0	0	110.2	R600	Q598-R600 PolarHBondContact O-N 3.25Å
599	V	27.5	Very low	28	Very low	122 Å²	122	162.8 Å²	162.8	74%	0.739	84%	0.839	S	S	*	*			trans	-82.2	102.7	168.1	-179.1	0	0	0	0	108.9	P597 L601	P597-V599 PolarHBondContact O-N 3.15Å; V599-L601 HydrophobicContact CG1-CG 4.39Å; V599-L601 PolarHBondContact O-N 3.16Å; V599-L601 VanDerWaalsContact O-N 3.12Å
600	R	26.7	Very low	28.2	Very low	240 Å²	240	166.7 Å²	166.7	91%	0.906	84%	0.841	S	S	*	*			trans	-82.3	80.8	-178.7	-170.4	-177.6	-173.4	-177	3.5	111	Q598	Q598-R600 PolarHBondContact O-N 3.25Å
601	L	28	Very low	28.2	Very low	159 Å²	159	164.5 Å²	164.5	83%	0.832	84%	0.843	S	S	*	*			trans	-64.9	135.9	172.3	-79.3	168.7	0	0	0	111	V599	V599-L601 HydrophobicContact CG1-CG 4.39Å; V599-L601 PolarHBondContact O-N 3.16Å; V599-L601 VanDerWaalsContact O-N 3.12Å
602	K	26.6	Very low	28.3	Very low	201 Å²	201	163.8 Å²	163.8	87%	0.874	84%	0.84	S	S	*	*			trans	-84.7	130.2	177.6	-65.8	178.4	179.4	177.6	0	109.5	S604	K602-S604 PolarHBondContact O-N 3.08Å
603	L	27	Very low	28.4	Very low	181 Å²	181	160.8 Å²	160.8	95%	0.948	84%	0.84	S	S	*	*			trans	-73.3	113.8	166.2	-75.7	164.8	0	0	0	109.5
604	S	28.7	Very low	28.4	Very low	115 Å²	115	159.2 Å²	159.2	80%	0.804	83%	0.834	S	S	*	*			trans	-85.2	125.2	166.2	49.9	0	0	0	0	109.6	K602	K602-S604 PolarHBondContact O-N 3.08Å
605	K	28.1	Very low	28.5	Very low	200 Å²	200	157.3 Å²	157.3	87%	0.87	83%	0.832	S	S	*	*			trans	-65.4	142.7	174.9	-63.9	-179.5	177.6	-177	0	110.8
606	C	26.6	Very low	28.7	Very low	128 Å²	128	153.4 Å²	153.4	87%	0.865	82%	0.824	S	S	*	*			trans	-142	155.3	145.5	-148.3	0	0	0	0	108.3
607	N	29.2	Very low	28.9	Very low	145 Å²	145	157 Å²	157	78%	0.775	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-91.1	134.6	-154.3	-60.2	-26.4	0	0	0	113.8
608	S	28.4	Very low	29.1	Very low	111 Å²	111	158.9 Å²	158.9	78%	0.776	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-84.5	129.9	158.5	52.4	0	0	0	0	110
609	V	30.4	Very low	29.3	Very low	143 Å²	143	152.2 Å²	152.2	87%	0.867	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-88.8	126.4	169	178	0	0	0	0	108.4
610	E	30.9	Very low	29.6	Very low	179 Å²	179	156.1 Å²	156.1	84%	0.836	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-80.1	142.6	173.7	-68.9	-169.6	117.9	0	0	111.7
611	G	27.4	Very low	30	Very low	78 Å²	78	152.9 Å²	152.9	80%	0.804	82%	0.821	S	S	*	*			trans	-142.8	104.4	167.8	0	0	0	0	0	109.5
612	R	31	Very low	30.4	Very low	229 Å²	229	151.1 Å²	151.1	86%	0.864	82%	0.817	S	S	*	*			trans	-74.3	150.3	179.7	-73.7	177.1	171.1	174.1	-3.9	111.8
613	L	30	Very low	31.2	Very low	163 Å²	163	151 Å²	151	85%	0.853	82%	0.816	S	S	*	*				-179.9	98.2	123.6	-92.4	161.2	0	0	0	105.9
614	K	30.3	Very low	31.9	Very low	166 Å²	166	151 Å²	151	72%	0.722	84%	0.842	S	S	*	*				55.1	109.5	84.1	-140.8	-162.9	-176.4	-152.5	0	112.1	E616	K614-E616 WeakPolarHBondContact CE-OE1 3.46Å; K614-E616 IonicContact NZ-OE1 2.68Å; K614-E616 PolarHBondContact NZ-OE1 3.02Å
615	A	30.7	Very low	32	Very low	100 Å²	100	152.8 Å²	152.8	83%	0.826	84%	0.844	S	S	*	*			trans	-101.3	146	166.2	0	0	0	0	0	109.2
616	E	30.7	Very low	32.2	Very low	161 Å²	161	150.3 Å²	150.3	75%	0.752	84%	0.843	S	S	*	*			trans	-130.4	143.8	166.8	-83.6	167.1	-173	0	0	107.7	K614	K614-E616 WeakPolarHBondContact CE-OE1 3.46Å; K614-E616 IonicContact NZ-OE1 2.68Å; K614-E616 PolarHBondContact NZ-OE1 3.02Å
617	D	34.1	Very low	32.5	Very low	162 Å²	162	151.6 Å²	151.6	87%	0.866	84%	0.842	S	S	*	*			trans	-122.2	124	-175.3	175	32.5	0	0	0	107.4
618	D	32.2	Very low	32.7	Very low	158 Å²	158	151.9 Å²	151.9	85%	0.845	85%	0.846	S	S	*	*			trans	-159.7	136.8	166.9	-142.8	-18.2	0	0	0	109.5
619	G	32.1	Very low	33	Very low	55 Å²	55	154.5 Å²	154.5	57%	0.567	85%	0.85	S	S	*	*			trans	-131.7	143.3	-171.2	0	0	0	0	0	113
620	K	33.7	Very low	33.2	Very low	205 Å²	205	155.3 Å²	155.3	89%	0.891	85%	0.849	S	S	*	*			trans	-158.4	155.2	159.2	-112.5	143.2	-168.3	162.4	0	114.4
621	Q	34.9	Very low	33.4	Very low	172 Å²	172	153.6 Å²	153.6	80%	0.804	85%	0.85	S	S	*	*			trans	-77.3	151	179.8	-54.2	146.4	-45.6	0	0	110.6
622	T	36.5	Very low	33.8	Very low	121 Å²	121	159.4 Å²	159.4	74%	0.742	85%	0.853	S	S	*	*				175.2	145.9	99.2	30.3	0	0	0	0	113.8
623	K	41.8	Very low	34.1	Very low	199 Å²	199	153.6 Å²	153.6	87%	0.865	85%	0.853	S	S	*	*			trans	35	111.3	146.4	-59.9	179.2	178.3	-178.7	0	119.6
624	A	41.7	Very low	34.4	Very low	181 Å²	181	152.7 Å²	152.7	100%	1.496	85%	0.852	S	S	*	*				-144.8	0	104.8	0	0	0	0	0	108.8

Retrieved 624 of 624 residues in 236 ms (Link to these results)

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