A0A087YHG4_POEFO Loading...

Transmembrane serine protease 3

AlphaFold DB , UniProt , Accession A0A087YHG4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 497 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	E	42	Very low	38.5	Very low	242 Å²	242	146.2 Å²	146.2	100%	1.131	79%	0.787	S	S	*	*				0	118.4	0	-71	167.8	151.4	0	0	107.3
2	V	30.6	Very low	38.1	Very low	150 Å²	150	144.9 Å²	144.9	91%	0.909	79%	0.792	S	S	*	*			trans	-97.4	117.6	-178.6	-177.8	0	0	0	0	106.3
3	V	34.8	Very low	37.6	Very low	128 Å²	128	144.1 Å²	144.1	78%	0.776	79%	0.794	S	S	*	*			trans	-101.3	114	175.4	-179.2	0	0	0	0	107.8
4	S	33.3	Very low	37	Very low	105 Å²	105	146.8 Å²	146.8	73%	0.734	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-82.4	125.2	168.5	50.2	0	0	0	0	109.3
5	V	37.2	Very low	36.8	Very low	107 Å²	107	145.9 Å²	145.9	65%	0.648	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-98.1	121.2	171.5	-176.7	0	0	0	0	107.7
6	T	44.2	Very low	36.4	Very low	101 Å²	101	144.5 Å²	144.5	62%	0.62	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-96.5	157.2	172.8	42.7	0	0	0	0	110.4	E8	T6-E8 PolarHBondContact O-N 2.99Å
7	E	43.4	Very low	35.9	Very low	190 Å²	190	144.8 Å²	144.8	89%	0.888	80%	0.799	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	10	-169.9	-73.8	-169.1	143	0	0	117.5
8	E	42.8	Very low	35.5	Very low	183 Å²	183	144.1 Å²	144.1	86%	0.855	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	2.5	-178	-66.2	-164.7	162.4	0	0	114.8	T6	T6-E8 PolarHBondContact O-N 2.99Å
9	D	38.8	Very low	35	Very low	125 Å²	125	145.2 Å²	145.2	67%	0.668	80%	0.803	S	S	*	*			trans	-100.2	14.2	-174.9	-78.2	-32.6	0	0	0	115.7
10	F	39.1	Very low	34.5	Very low	176 Å²	176	145.1 Å²	145.1	77%	0.772	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-103.2	129.9	176	-67.8	-74.5	0	0	0	112.7
11	P	37.2	Very low	34.3	Very low	101 Å²	101	144.4 Å²	144.4	66%	0.656	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.8	151.7	177.4	29.1	-33.1	0	0	0	111.7	V13	P11-V13 PolarHBondContact O-N 3.36Å
12	P	33.4	Very low	33.5	Very low	131 Å²	131	137.1 Å²	137.1	85%	0.851	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-68.6	122.9	-177.3	28.4	-32.5	0	0	0	110.3
13	V	32.3	Very low	33.4	Very low	134 Å²	134	135 Å²	135	81%	0.812	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-91.7	117.1	172.3	177.8	0	0	0	0	108.4	P11 T15	P11-V13 PolarHBondContact O-N 3.36Å; V13-T15 PolarHBondContact O-N 3.14Å
14	E	29.5	Very low	33.2	Very low	182 Å²	182	137.5 Å²	137.5	85%	0.85	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-61.2	126.6	171.6	-69.1	178.9	154.2	0	0	110.5
15	T	34.2	Very low	32.9	Very low	134 Å²	134	134.7 Å²	134.7	82%	0.822	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-80.4	126.6	171.9	39.9	0	0	0	0	110.4	V13	V13-T15 PolarHBondContact O-N 3.14Å
16	P	29.7	Very low	32.6	Very low	123 Å²	123	135 Å²	135	80%	0.799	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-86.3	119.9	163.4	1.7	17.1	0	0	0	109.6
17	N	27.8	Very low	31.9	Very low	149 Å²	149	139.7 Å²	139.7	80%	0.797	78%	0.779	S	S	*	*			trans	13.9	119.4	153	-62.7	-20.7	0	0	0	118.8	L19	N17-L19 PolarHBondContact O-N 2.97Å
18	T	28.6	Very low	31.2	Very low	132 Å²	132	137.4 Å²	137.4	81%	0.81	77%	0.772	S	S	*	*			trans	-32.1	116	155.1	33.9	0	0	0	0	114.1	I20	T18-I20 PolarHBondContact O-N 2.89Å
19	L	26.4	Very low	30.5	Very low	165 Å²	165	133 Å²	133	86%	0.864	77%	0.767	S	S	*	*			trans	-80.4	104.6	157.8	-84	164.2	0	0	0	108	N17 V21	N17-L19 PolarHBondContact O-N 2.97Å; L19-V21 PolarHBondContact O-N 3.21Å
20	I	25.3	Very low	30	Very low	144 Å²	144	134.1 Å²	134.1	74%	0.738	77%	0.773	S	S	*	*			trans	-70.1	96.6	167.2	-60	174.6	0	0	0	106.8	T18 S22	T18-I20 PolarHBondContact O-N 2.89Å; I20-S22 PolarHBondContact O-N 2.85Å
21	V	29.4	Very low	29.4	Very low	130 Å²	130	135.2 Å²	135.2	79%	0.788	78%	0.777	S	S	*	*			trans	-69.7	111.1	160.7	180	0	0	0	0	105.8	L19	L19-V21 PolarHBondContact O-N 3.21Å
22	S	24.8	Very low	28.9	Very low	89 Å²	89	138.9 Å²	138.9	62%	0.622	79%	0.786	S	S	*	*			trans	-63.4	130.2	175.8	-60.5	0	0	0	0	109.3	I20 L24	I20-S22 PolarHBondContact O-N 2.85Å; S22-L24 PolarHBondContact O-N 2.66Å
23	P	29.2	Very low	28.7	Very low	105 Å²	105	138.1 Å²	138.1	68%	0.682	78%	0.781	S	S	*	*			trans	-65.3	125.9	165.4	27.4	-29.3	0	0	0	106.8	G25	P23-G25 PolarHBondContact O-N 3.35Å
24	L	31.2	Very low	28.4	Very low	182 Å²	182	141.4 Å²	141.4	95%	0.953	79%	0.788	S	S	*	*			trans	-62.9	108.2	171.7	-119.1	97.4	0	0	0	107	S22	S22-L24 PolarHBondContact O-N 2.66Å
25	G	26.2	Very low	28.3	Very low	45 Å²	45	142.3 Å²	142.3	46%	0.464	79%	0.789	S	S	.	*			trans	-53.3	136.4	-172.1	0	0	0	0	0	113.8	P23 F27	P23-G25 PolarHBondContact O-N 3.35Å; G25-F27 WeakPolarHBondContact O-CD2 3.48Å; G25-F27 PolarHBondContact O-N 2.61Å; G25-F27 VanDerWaalsContact O-N 3.09Å
26	S	30.2	Very low	28.2	Very low	114 Å²	114	143.6 Å²	143.6	80%	0.797	79%	0.79	S	S	*	*			trans	-50.7	102.4	152.4	43	0	0	0	0	109.9
27	F	29.9	Very low	28.3	Very low	199 Å²	199	143.4 Å²	143.4	87%	0.873	79%	0.789	S	S	*	*			trans	-99.3	94.4	168.3	-79.6	-76.8	0	0	0	109.7	G25	G25-F27 WeakPolarHBondContact O-CD2 3.48Å; G25-F27 PolarHBondContact O-N 2.61Å; G25-F27 VanDerWaalsContact O-N 3.09Å
28	I	29.8	Very low	28.2	Very low	143 Å²	143	139.8 Å²	139.8	73%	0.733	79%	0.787	S	S	*	*			trans	-71.7	117.4	161.3	-65.3	173.9	0	0	0	107.2	D30	I28-D30 PolarHBondContact O-N 3.21Å
29	A	27.8	Very low	28.2	Very low	91 Å²	91	140.4 Å²	140.4	75%	0.752	79%	0.785	S	S	*	*			trans	-75	98.8	161.1	0	0	0	0	0	107.7	F31	A29-F31 PolarHBondContact O-N 3.43Å
30	D	27.1	Very low	28.5	Very low	148 Å²	148	138.5 Å²	138.5	79%	0.791	78%	0.783	S	S	*	*			trans	-74.3	113.7	171.4	-126.8	-11.2	0	0	0	108.6	I28	I28-D30 PolarHBondContact O-N 3.21Å
31	F	27	Very low	28.6	Very low	199 Å²	199	140.2 Å²	140.2	87%	0.873	79%	0.788	S	S	*	*			trans	-101.8	105.8	170	-122.5	-87.1	0	0	0	106.6	A29	A29-F31 PolarHBondContact O-N 3.43Å
32	Q	27.3	Very low	28.5	Very low	177 Å²	177	141.9 Å²	141.9	83%	0.827	79%	0.787	S	S	*	*			trans	-136.2	147.1	160.5	-80.9	-145.9	-24.2	0	0	112.1
33	P	29.3	Very low	28.5	Very low	116 Å²	116	146.2 Å²	146.2	75%	0.753	80%	0.802	S	S	*	*			trans	-85.6	153.6	-161.4	34.8	-33	0	0	0	113	K35	P33-K35 PolarHBondContact O-N 3.34Å
34	E	25.5	Very low	28.4	Very low	203 Å²	203	148.4 Å²	148.4	95%	0.949	80%	0.803	S	S	*	*			trans	-45.2	130.6	174.4	-84.4	174.1	132.5	0	0	113.3
35	K	26.8	Very low	28.1	Very low	201 Å²	201	145.6 Å²	145.6	87%	0.874	80%	0.798	S	S	*	*			trans	-138.3	117.9	158.9	-145	176.4	-174	-179.3	0	108.6	P33	P33-K35 PolarHBondContact O-N 3.34Å
36	D	32.6	Very low	28.2	Very low	161 Å²	161	151.9 Å²	151.9	86%	0.861	82%	0.816	S	S	*	*			trans	-42.3	147.2	171.7	-109.2	-29.1	0	0	0	113.4
37	P	31.8	Very low	28	Very low	119 Å²	119	151.6 Å²	151.6	77%	0.773	82%	0.82	S	S	*	*			trans	-121.8	112	149.9	32	-17	0	0	0	111.4
38	G	26.8	Very low	28.3	Very low	73 Å²	73	146.7 Å²	146.7	75%	0.753	82%	0.816	S	S	*	*			trans	-73.7	131.7	154.4	0	0	0	0	0	110.7
39	N	27	Very low	28.9	Very low	145 Å²	145	145.1 Å²	145.1	78%	0.775	82%	0.815	S	S	*	*			trans	36	131	146.6	-145.6	37.2	0	0	0	120.3
40	P	32.6	Very low	29	Very low	124 Å²	124	146.1 Å²	146.1	81%	0.805	82%	0.817	S	S	*	*			trans	-114.8	129.4	147.8	17.4	1.7	0	0	0	112.6
41	E	27.6	Very low	29.9	Very low	181 Å²	181	144.2 Å²	144.2	85%	0.846	81%	0.813	S	S	*	*			trans	-64.4	152.7	163	-75.5	175.3	132.5	0	0	112.5
42	E	27.2	Very low	30.1	Very low	165 Å²	165	140.7 Å²	140.7	77%	0.771	81%	0.808	S	S	*	*			trans	-63	152.8	173.2	-76.3	176.4	122.4	0	0	114.4
43	L	26.1	Very low	30.5	Very low	179 Å²	179	140.7 Å²	140.7	94%	0.937	81%	0.81	S	S	*	*			trans	-140	126	147	-164.2	70.8	0	0	0	111.5
44	H	26.9	Very low	31.2	Very low	151 Å²	151	140 Å²	140	70%	0.699	81%	0.805	S	S	*	*			trans	-74.8	158.8	-175.6	-82.6	-55	0	0	0	116
45	S	24.9	Very low	31.5	Very low	123 Å²	123	136.8 Å²	136.8	86%	0.86	80%	0.799	S	S	*	*			trans	-146.2	133	141	176.8	0	0	0	0	111.1
46	Q	27.3	Very low	31.6	Very low	178 Å²	178	132.7 Å²	132.7	83%	0.832	79%	0.791	S	S	*	*			trans	-95.3	158.6	-167.6	-65.5	174.4	-31.5	0	0	114.2
47	A	27.1	Very low	31.2	Very low	107 Å²	107	134 Å²	134	88%	0.884	79%	0.789	S	S	*	*			trans	-158	137.5	136	0	0	0	0	0	112.4
48	A	35.1	Very low	31	Very low	96 Å²	96	134.2 Å²	134.2	79%	0.793	79%	0.788	S	S	*	*			trans	-80.3	-164.2	-163.5	0	0	0	0	0	117
49	P	42.8	Very low	31.4	Very low	110 Å²	110	139.4 Å²	139.4	71%	0.714	79%	0.793	S	S	*	*				-138.8	156.5	-58.2	37.1	-19.6	0	0	0	118.1
50	S	29.9	Very low	31.8	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	79%	0.789	S	S	*	*			trans	63.2	166	133.3	-53.1	0	0	0	0	123.9
51	P	45.3	Very low	31.6	Very low	107 Å²	107	140.1 Å²	140.1	70%	0.695	79%	0.788	S	S	*	*			cis	-140.9	157.3	2.3	43.5	-24.7	0	0	0	119.6
52	T	32	Very low	31.7	Very low	125 Å²	125	137.9 Å²	137.9	77%	0.767	79%	0.786	S	S	*	*			trans	59.7	148	137.3	48.6	0	0	0	0	123.8
53	M	35.3	Very low	31.8	Very low	177 Å²	177	137.9 Å²	137.9	87%	0.872	79%	0.786	S	S	*	*			cis	-165.9	179.5	15.8	-116.7	-144.7	-74.8	0	0	112
54	P	44.2	Very low	32.1	Very low	101 Å²	101	133 Å²	133	66%	0.656	78%	0.778	S	S	*	*			trans	-122.4	174.7	-144.2	45.5	-35.7	0	0	0	117.3
55	V	31.9	Very low	32.4	Very low	137 Å²	137	135.4 Å²	135.4	83%	0.83	79%	0.79	S	S	*	*			trans	-161.5	114	152.4	-174	0	0	0	0	109.2
56	T	28.3	Very low	33.4	Very low	115 Å²	115	134.4 Å²	134.4	71%	0.706	79%	0.789	S	S	*	*				85	103.6	73.3	-44.1	0	0	0	0	117.3
57	K	26.1	Very low	34.2	Very low	187 Å²	187	133.4 Å²	133.4	81%	0.813	79%	0.79	S	S	*	*			trans	66.7	127.8	135.6	-79.5	-174.1	172.7	176.4	0	125
58	V	26.9	Very low	35.1	Very low	124 Å²	124	135 Å²	135	75%	0.752	78%	0.784	S	S	*	*				90.6	122.4	121.5	177.1	0	0	0	0	120.2
59	Q	34.8	Very low	35.8	Very low	182 Å²	182	137.2 Å²	137.2	85%	0.85	78%	0.782	S	S	*	*			trans	-66.6	158.1	165	-67.3	176.5	-47.6	0	0	112.3
60	P	36.2	Very low	36.1	Very low	108 Å²	108	139.6 Å²	139.6	70%	0.701	79%	0.788	S	S	*	*				-153.2	153.1	109.1	26.8	-4.5	0	0	0	117.8
61	F	27.3	Very low	37	Very low	177 Å²	177	139.2 Å²	139.2	78%	0.776	78%	0.78	S	S	*	*			trans	54.3	136.6	143.2	-74.8	-102.1	0	0	0	120.6
62	V	30.1	Very low	37.1	Very low	134 Å²	134	141 Å²	141	81%	0.812	78%	0.777	S	S	*	*				-168.3	117.2	85.8	170.1	0	0	0	0	107.6
63	H	30.2	Very low	37.8	Very low	164 Å²	164	136.5 Å²	136.5	76%	0.759	76%	0.755	S	S	*	*				64.5	124.8	92	-91.1	42.8	0	0	0	119.4
64	G	30.7	Very low	38.4	Very low	76 Å²	76	136.3 Å²	136.3	78%	0.784	75%	0.745	S	S	*	*			trans	94.8	127.5	164.3	0	0	0	0	0	114
65	E	33.3	Very low	38.8	Very low	202 Å²	202	138.4 Å²	138.4	94%	0.944	74%	0.744	S	S	*	*			cis	-147	137.4	21.6	-76.9	166	130	0	0	109.1
66	A	46.4	Very low	40	Very low	102 Å²	102	136.6 Å²	136.6	84%	0.843	73%	0.73	S	S	*	*			trans	-120.5	103	171	0	0	0	0	0	107.7
67	D	44.3	Very low	41.5	Very low	157 Å²	157	139.9 Å²	139.9	84%	0.84	73%	0.729	S	S	*	*	S	Bend	trans	-166.8	36.1	150.4	-140.7	3.4	0	0	0	116.4
68	N	46.5	Very low	43	Very low	142 Å²	142	136.6 Å²	136.6	76%	0.759	72%	0.715	S	S	*	*	S	Bend	trans	-142.5	-4.3	173.9	-123.6	-15.4	0	0	0	117.1
69	D	48.3	Very low	44.7	Very low	142 Å²	142	134.9 Å²	134.9	76%	0.759	70%	0.701	S	S	*	*	S	Bend	trans	-96.4	-15.3	-176.1	-76.6	-36.4	0	0	0	115.1	G73	D69-G73 PolarHBondContact O-N 2.94Å
70	L	49.3	Very low	46	Very low	160 Å²	160	131.9 Å²	131.9	84%	0.838	69%	0.69	S	S	*	*	H	α-helix	trans	-75.1	-33.7	-176.1	-110.9	142.1	0	0	0	113.5	W74	L70-W74 PolarHBondContact O-N 3.38Å
71	V	49.8	Very low	47.6	Very low	104 Å²	104	132.7 Å²	132.7	63%	0.63	68%	0.684	S	S	*	*	H	α-helix	trans	-76.1	-32.5	179.2	-179.8	0	0	0	0	111.8	K75	V71-K75 PolarHBondContact O-N 3.16Å
72	K	46.9	Very low	49.9	Very low	145 Å²	145	132.7 Å²	132.7	63%	0.63	68%	0.679	S	S	*	*	H	α-helix	trans	-72.6	-37.4	-179.9	-151.1	173.6	-173.6	179.3	0	111.6	N76	K72-N76 WeakPolarHBondContact O-CB 3.42Å; K72-N76 PolarHBondContact O-N 2.8Å
73	G	46.8	Very low	52.1	Low	30 Å²	30	132.3 Å²	132.3	31%	0.309	67%	0.666	S	S	.	*	H	α-helix	trans	-67	-37.4	175.7	0	0	0	0	0	114.1	D69 R77	D69-G73 PolarHBondContact O-N 2.94Å; G73-R77 WeakPolarHBondContact O-CG 3.41Å; G73-R77 PolarHBondContact O-N 3.44Å
74	W	48.8	Very low	54.5	Low	174 Å²	174	130 Å²	130	66%	0.659	66%	0.656	S	S	*	*	H	α-helix	trans	-74	-41.4	178.1	-129.9	42.4	0	0	0	112.1	L70 N76 R77 F78	L70-W74 PolarHBondContact O-N 3.38Å; W74-N76 VanDerWaalsContact C-N 3.34Å; W74-N76 PolarHBondContact O-N 3.44Å; W74-R77 PolarHBondContact O-N 2.04Å; W74-F78 HydrophobicContact CD2-CD2 4.48Å; W74-F78 HydrophobicContact CD2-CE2 4.12Å; W74-F78 HydrophobicContact CE3-CE2 4.22Å; W74-F78 HydrophobicContact CZ2-CE2 4.47Å; W74-F78 HydrophobicContact CZ3-CE2 4.45Å; W74-F78 WeakPolarHBondContact O-CB 3.26Å; W74-F78 WeakPolarHBondContact O-CD2 3.04Å; W74-F78 PolarHBondContact O-N 2.68Å
75	K	52.3	Low	57	Low	145 Å²	145	131.3 Å²	131.3	63%	0.63	65%	0.645	S	S	*	*	H	α-helix	trans	-58.7	-44.1	170.7	-86.4	-177.2	173.9	178.3	0	111.8	V71 F78 I79	V71-K75 PolarHBondContact O-N 3.16Å; K75-F78 PolarHBondContact O-N 3.4Å; K75-I79 WeakPolarHBondContact O-CB 3.39Å; K75-I79 WeakPolarHBondContact O-CD1 3.24Å; K75-I79 WeakPolarHBondContact O-CG1 3.35Å; K75-I79 PolarHBondContact O-N 2.87Å
76	N	56.7	Low	59.4	Low	99 Å²	99	126.9 Å²	126.9	53%	0.529	63%	0.627	S	S	.	*	H	α-helix	trans	-67	-37.6	178.1	-82.2	4.4	0	0	0	113.3	K72 W74 I79 L80	K72-N76 WeakPolarHBondContact O-CB 3.42Å; K72-N76 PolarHBondContact O-N 2.8Å; W74-N76 VanDerWaalsContact C-N 3.34Å; W74-N76 PolarHBondContact O-N 3.44Å; N76-I79 PolarHBondContact O-N 3.07Å; N76-L80 WeakPolarHBondContact O-CB 3.39Å; N76-L80 PolarHBondContact O-N 3.46Å
77	R	59.7	Low	61.2	Low	183 Å²	183	126.1 Å²	126.1	69%	0.691	61%	0.608	S	S	*	*	H	α-helix	trans	-67.2	-39	173.8	-74.2	-175.9	-147.7	-177.8	6	112.7	G73 W74 L80 H81	G73-R77 WeakPolarHBondContact O-CG 3.41Å; G73-R77 PolarHBondContact O-N 3.44Å; W74-R77 PolarHBondContact O-N 2.04Å; R77-L80 PolarHBondContact O-N 3.26Å; R77-H81 WeakPolarHBondContact O-CB 3.33Å; R77-H81 PolarHBondContact O-N 3.04Å
78	F	58.1	Low	63.3	Low	119 Å²	119	120.7 Å²	120.7	52%	0.522	59%	0.585	S	S	.	*	H	α-helix	trans	-66.6	-38	174.3	-95.3	-81.7	0	0	0	112.3	W74 K75 R82	W74-F78 HydrophobicContact CD2-CD2 4.48Å; W74-F78 HydrophobicContact CD2-CE2 4.12Å; W74-F78 HydrophobicContact CE3-CE2 4.22Å; W74-F78 HydrophobicContact CZ2-CE2 4.47Å; W74-F78 HydrophobicContact CZ3-CE2 4.45Å; W74-F78 WeakPolarHBondContact O-CB 3.26Å; W74-F78 WeakPolarHBondContact O-CD2 3.04Å; W74-F78 PolarHBondContact O-N 2.68Å; K75-F78 PolarHBondContact O-N 3.4Å; F78-R82 WeakPolarHBondContact O-CB 3.41Å; F78-R82 VanDerWaalsContact O-CG 3.31Å; F78-R82 WeakPolarHBondContact O-CG 3.44Å; F78-R82 PolarHBondContact O-N 3.07Å; F78-R82 VanDerWaalsContact O-N 3.09Å
79	I	61.7	Low	65.2	Low	88 Å²	88	116.9 Å²	116.9	45%	0.451	57%	0.569	S	S	.	*	H	α-helix	trans	-66.9	-44	175.2	-69.6	162.8	0	0	0	110.3	K75 N76 R82 F83	K75-I79 WeakPolarHBondContact O-CB 3.39Å; K75-I79 WeakPolarHBondContact O-CD1 3.24Å; K75-I79 WeakPolarHBondContact O-CG1 3.35Å; K75-I79 PolarHBondContact O-N 2.87Å; N76-I79 PolarHBondContact O-N 3.07Å; I79-R82 PolarHBondContact O-N 3.34Å; I79-F83 HydrophobicContact CG2-CD2 3.92Å; I79-F83 HydrophobicContact CG2-CE2 4.03Å; I79-F83 WeakPolarHBondContact O-CD2 3.29Å; I79-F83 PolarHBondContact O-N 2.84Å
80	L	62.1	Low	67.1	Low	119 Å²	119	113.3 Å²	113.3	62%	0.623	56%	0.555	S	S	*	*	H	α-helix	trans	-63.5	-42.9	178.6	-157	74.4	0	0	0	112	N76 R77 R82 F83 E84	N76-L80 WeakPolarHBondContact O-CB 3.39Å; N76-L80 PolarHBondContact O-N 3.46Å; R77-L80 PolarHBondContact O-N 3.26Å; L80-R82 VanDerWaalsContact C-N 3.34Å; L80-R82 PolarHBondContact O-N 2.84Å; L80-F83 WeakPolarHBondContact O-CB 3.09Å; L80-F83 PolarHBondContact O-N 2.73Å; L80-F83 VanDerWaalsContact O-N 3.16Å; L80-E84 PolarHBondContact O-N 3.12Å
81	H	70.2	Confident	69.1	Low	124 Å²	124	111.2 Å²	111.2	57%	0.574	54%	0.544	S	S	*	.	H	α-helix	trans	-67.5	-33.2	177.3	-161.6	57.8	0	0	0	112.8	R77 L85	R77-H81 WeakPolarHBondContact O-CB 3.33Å; R77-H81 PolarHBondContact O-N 3.04Å; H81-L85 WeakPolarHBondContact O-CG 3.31Å; H81-L85 PolarHBondContact O-N 3.47Å; H81-L85 VanDerWaalsContact O-N 3.1Å
82	R	75.4	Confident	70.9	Confident	178 Å²	178	110.6 Å²	110.6	67%	0.672	54%	0.536	S	S	*	.	H	α-helix	trans	-67.2	-36.1	171.1	-77.1	-177.4	175.9	-150.1	-0.6	112.3	F78 I79 L80 L86	F78-R82 WeakPolarHBondContact O-CB 3.41Å; F78-R82 VanDerWaalsContact O-CG 3.31Å; F78-R82 WeakPolarHBondContact O-CG 3.44Å; F78-R82 PolarHBondContact O-N 3.07Å; F78-R82 VanDerWaalsContact O-N 3.09Å; I79-R82 PolarHBondContact O-N 3.34Å; L80-R82 VanDerWaalsContact C-N 3.34Å; L80-R82 PolarHBondContact O-N 2.84Å; R82-L86 WeakPolarHBondContact O-CB 3.42Å; R82-L86 VanDerWaalsContact O-CG 3.25Å; R82-L86 WeakPolarHBondContact O-CG 3.05Å; R82-L86 PolarHBondContact O-N 3Å
83	F	77.1	Confident	73	Confident	125 Å²	125	109 Å²	109	55%	0.548	54%	0.535	S	S	.	.	H	α-helix	trans	-66.2	-44.1	173.9	-96.1	-80	0	0	0	112.2	I79 L80 L85 L86 I87	I79-F83 HydrophobicContact CG2-CD2 3.92Å; I79-F83 HydrophobicContact CG2-CE2 4.03Å; I79-F83 WeakPolarHBondContact O-CD2 3.29Å; I79-F83 PolarHBondContact O-N 2.84Å; L80-F83 WeakPolarHBondContact O-CB 3.09Å; L80-F83 PolarHBondContact O-N 2.73Å; L80-F83 VanDerWaalsContact O-N 3.16Å; F83-L85 PolarHBondContact O-N 2.84Å; F83-L86 PolarHBondContact O-N 3.33Å; F83-I87 VanDerWaalsContact O-CG1 3.28Å; F83-I87 WeakPolarHBondContact O-CG1 3.3Å; F83-I87 PolarHBondContact O-N 2.86Å
84	E	80.1	Confident	75	Confident	115 Å²	115	112.7 Å²	112.7	54%	0.537	55%	0.545	S	S	.	.	H	α-helix	trans	-59.8	-44.2	175.5	-73.4	-64.7	161	0	0	112.4	L80 L86 I87 A88	L80-E84 PolarHBondContact O-N 3.12Å; E84-L86 VanDerWaalsContact C-N 3.34Å; E84-L86 PolarHBondContact O-N 2.96Å; E84-I87 PolarHBondContact O-N 2.79Å; E84-A88 WeakPolarHBondContact O-CB 3.26Å; E84-A88 PolarHBondContact O-N 2.92Å
85	L	81.9	Confident	76.8	Confident	105 Å²	105	109.2 Å²	109.2	55%	0.55	54%	0.537	S	S	.	.	H	α-helix	trans	-64.3	-37.2	176.1	-74.5	166.5	0	0	0	112.4	H81 F83 S89	H81-L85 WeakPolarHBondContact O-CG 3.31Å; H81-L85 PolarHBondContact O-N 3.47Å; H81-L85 VanDerWaalsContact O-N 3.1Å; F83-L85 PolarHBondContact O-N 2.84Å; L85-S89 VanDerWaalsContact O-CB 3.32Å; L85-S89 WeakPolarHBondContact O-CB 3.46Å; L85-S89 PolarHBondContact O-N 3Å; L85-S89 PolarHBondContact O-OG 2.92Å
86	L	83.8	Confident	78.4	Confident	108 Å²	108	108.6 Å²	108.6	57%	0.565	54%	0.535	S	S	*	.	H	α-helix	trans	-67.4	-43.6	175.7	-76	168.9	0	0	0	111.5	R82 F83 E84 S89 S90	R82-L86 WeakPolarHBondContact O-CB 3.42Å; R82-L86 VanDerWaalsContact O-CG 3.25Å; R82-L86 WeakPolarHBondContact O-CG 3.05Å; R82-L86 PolarHBondContact O-N 3Å; F83-L86 PolarHBondContact O-N 3.33Å; E84-L86 VanDerWaalsContact C-N 3.34Å; E84-L86 PolarHBondContact O-N 2.96Å; L86-S89 PolarHBondContact O-N 3.35Å; L86-S89 PolarHBondContact O-OG 3.11Å; L86-S90 WeakPolarHBondContact O-CB 3.18Å; L86-S90 PolarHBondContact O-N 3.42Å
87	I	85.9	Confident	79.7	Confident	86 Å²	86	108.1 Å²	108.1	44%	0.441	53%	0.532	S	S	.	.	H	α-helix	trans	-61.8	-48.6	176	-67.2	164.9	0	0	0	110.2	F83 E84 S89 S90 L91	F83-I87 VanDerWaalsContact O-CG1 3.28Å; F83-I87 WeakPolarHBondContact O-CG1 3.3Å; F83-I87 PolarHBondContact O-N 2.86Å; E84-I87 PolarHBondContact O-N 2.79Å; I87-S89 VanDerWaalsContact C-N 3.33Å; I87-S89 PolarHBondContact O-N 3.21Å; I87-S90 PolarHBondContact O-N 2.93Å; I87-S90 VanDerWaalsContact O-N 3.16Å; I87-L91 HydrophobicContact CG2-CD1 4Å; I87-L91 HydrophobicContact CG2-CG 4.4Å; I87-L91 WeakPolarHBondContact O-CG 3.24Å; I87-L91 PolarHBondContact O-N 3.33Å
88	A	86.8	Confident	80.6	Confident	44 Å²	44	104 Å²	104	36%	0.364	53%	0.526	S	S	.	.	H	α-helix	trans	-58.9	-44.2	176.4	0	0	0	0	0	111.6	E84 S90 L91 I92	E84-A88 WeakPolarHBondContact O-CB 3.26Å; E84-A88 PolarHBondContact O-N 2.92Å; A88-S90 VanDerWaalsContact C-N 3.33Å; A88-S90 PolarHBondContact O-N 3.39Å; A88-L91 PolarHBondContact O-N 2.97Å; A88-I92 WeakPolarHBondContact O-CB 3.47Å; A88-I92 WeakPolarHBondContact O-CD1 3.29Å; A88-I92 VanDerWaalsContact O-CG1 3.22Å; A88-I92 WeakPolarHBondContact O-CG1 3.41Å; A88-I92 PolarHBondContact O-N 2.77Å
89	S	87.3	Confident	81.4	Confident	61 Å²	61	102.3 Å²	102.3	43%	0.427	52%	0.523	S	S	.	.	H	α-helix	trans	-63.1	-37.9	176.5	78.3	0	0	0	0	112.8	L85 L86 I87 I92 L93	L85-S89 VanDerWaalsContact O-CB 3.32Å; L85-S89 WeakPolarHBondContact O-CB 3.46Å; L85-S89 PolarHBondContact O-N 3Å; L85-S89 PolarHBondContact O-OG 2.92Å; L86-S89 PolarHBondContact O-N 3.35Å; L86-S89 PolarHBondContact O-OG 3.11Å; I87-S89 VanDerWaalsContact C-N 3.33Å; I87-S89 PolarHBondContact O-N 3.21Å; S89-I92 PolarHBondContact O-N 3.35Å; S89-L93 WeakPolarHBondContact O-CB 3.5Å; S89-L93 PolarHBondContact O-N 2.79Å
90	S	88.3	Confident	81.7	Confident	67 Å²	67	100.2 Å²	100.2	47%	0.469	52%	0.522	S	S	.	.	H	α-helix	trans	-70	-38.4	178	-173	0	0	0	0	111.8	L86 I87 A88 L93 M94	L86-S90 WeakPolarHBondContact O-CB 3.18Å; L86-S90 PolarHBondContact O-N 3.42Å; I87-S90 PolarHBondContact O-N 2.93Å; I87-S90 VanDerWaalsContact O-N 3.16Å; A88-S90 VanDerWaalsContact C-N 3.33Å; A88-S90 PolarHBondContact O-N 3.39Å; S90-L93 PolarHBondContact O-N 3.18Å; S90-M94 WeakPolarHBondContact O-CB 3.43Å; S90-M94 VanDerWaalsContact O-CG 3.28Å; S90-M94 WeakPolarHBondContact O-CG 3.49Å; S90-M94 PolarHBondContact O-N 3.41Å
91	L	90.2	Very high	82	Confident	116 Å²	116	99.6 Å²	99.6	61%	0.607	52%	0.519	S	S	*	.	H	α-helix	trans	-67.1	-41.2	174.9	-71.4	174	0	0	0	111.4	I87 A88 M94 M95	I87-L91 HydrophobicContact CG2-CD1 4Å; I87-L91 HydrophobicContact CG2-CG 4.4Å; I87-L91 WeakPolarHBondContact O-CG 3.24Å; I87-L91 PolarHBondContact O-N 3.33Å; A88-L91 PolarHBondContact O-N 2.97Å; L91-M94 PolarHBondContact O-N 3.03Å; L91-M95 WeakPolarHBondContact O-CB 3.05Å; L91-M95 PolarHBondContact O-N 2.85Å
92	I	89.5	Confident	81.4	Confident	91 Å²	91	95.9 Å²	95.9	47%	0.467	51%	0.514	S	S	.	.	H	α-helix	trans	-64.2	-44.6	174.7	-69.4	166.1	0	0	0	110.5	A88 S89 M94 M95 F96	A88-I92 WeakPolarHBondContact O-CB 3.47Å; A88-I92 WeakPolarHBondContact O-CD1 3.29Å; A88-I92 VanDerWaalsContact O-CG1 3.22Å; A88-I92 WeakPolarHBondContact O-CG1 3.41Å; A88-I92 PolarHBondContact O-N 2.77Å; S89-I92 PolarHBondContact O-N 3.35Å; I92-M94 PolarHBondContact O-N 3.3Å; I92-M95 WeakPolarHBondContact O-CB 3.28Å; I92-M95 PolarHBondContact O-N 3.21Å; I92-F96 HydrophobicContact CG2-CD2 3.59Å; I92-F96 HydrophobicContact CG2-CE2 3.35Å; I92-F96 WeakPolarHBondContact O-CD2 3.3Å; I92-F96 PolarHBondContact O-N 3.36Å
93	L	89.8	Confident	80.6	Confident	113 Å²	113	92 Å²	92	59%	0.592	51%	0.506	S	S	*	.	H	α-helix	trans	-62.1	-43.6	176.6	-166.1	82.2	0	0	0	111.4	S89 S90 M95 F96 L97	S89-L93 WeakPolarHBondContact O-CB 3.5Å; S89-L93 PolarHBondContact O-N 2.79Å; S90-L93 PolarHBondContact O-N 3.18Å; L93-M95 VanDerWaalsContact C-N 3.35Å; L93-F96 PolarHBondContact O-N 3.45Å; L93-L97 WeakPolarHBondContact O-CB 3.31Å; L93-L97 PolarHBondContact O-N 2.86Å
94	M	89.3	Confident	79.7	Confident	107 Å²	107	88.4 Å²	88.4	53%	0.527	50%	0.504	S	S	.	.	H	α-helix	trans	-62.7	-40.6	174.5	-78.8	-64.7	-69.5	0	0	111.8	S90 L91 I92 L97 V98	S90-M94 WeakPolarHBondContact O-CB 3.43Å; S90-M94 VanDerWaalsContact O-CG 3.28Å; S90-M94 WeakPolarHBondContact O-CG 3.49Å; S90-M94 PolarHBondContact O-N 3.41Å; L91-M94 PolarHBondContact O-N 3.03Å; I92-M94 PolarHBondContact O-N 3.3Å; M94-L97 PolarHBondContact O-N 2.88Å; M94-V98 WeakPolarHBondContact O-CB 3.25Å; M94-V98 WeakPolarHBondContact O-CG2 3.28Å; M94-V98 PolarHBondContact O-N 3Å
95	M	87.5	Confident	78.5	Confident	101 Å²	101	87.9 Å²	87.9	50%	0.498	51%	0.508	S	S	.	.	H	α-helix	trans	-61.5	-44.3	174.6	-166.5	-157.1	82.3	0	0	111	L91 I92 L93 V98 L99	L91-M95 WeakPolarHBondContact O-CB 3.05Å; L91-M95 PolarHBondContact O-N 2.85Å; I92-M95 WeakPolarHBondContact O-CB 3.28Å; I92-M95 PolarHBondContact O-N 3.21Å; L93-M95 VanDerWaalsContact C-N 3.35Å; M95-V98 PolarHBondContact O-N 2.99Å; M95-L99 HydrophobicContact CE-CD1 3.9Å; M95-L99 HydrophobicContact CG-CD1 3.9Å; M95-L99 WeakPolarHBondContact O-CB 3.26Å; M95-L99 WeakPolarHBondContact O-CD1 3.15Å; M95-L99 PolarHBondContact O-N 2.92Å; M95-L99 HydrophobicContact SD-CD1 4.42Å
96	F	84.5	Confident	77.1	Confident	131 Å²	131	85.9 Å²	85.9	58%	0.575	51%	0.513	S	S	*	.	H	α-helix	trans	-67.2	-34.7	175.5	-78.1	-62.1	0	0	0	113.2	I92 L93 G100	I92-F96 HydrophobicContact CG2-CD2 3.59Å; I92-F96 HydrophobicContact CG2-CE2 3.35Å; I92-F96 WeakPolarHBondContact O-CD2 3.3Å; I92-F96 PolarHBondContact O-N 3.36Å; L93-F96 PolarHBondContact O-N 3.45Å; F96-G100 WeakPolarHBondContact O-CA 3.48Å; F96-G100 PolarHBondContact O-N 3.3Å
97	L	84.2	Confident	75.8	Confident	90 Å²	90	86.1 Å²	86.1	47%	0.471	51%	0.514	S	S	.	.	H	α-helix	trans	-68	-43.7	174.7	-118.7	155.3	0	0	0	111	L93 M94 G100 I101	L93-L97 WeakPolarHBondContact O-CB 3.31Å; L93-L97 PolarHBondContact O-N 2.86Å; M94-L97 PolarHBondContact O-N 2.88Å; L97-G100 PolarHBondContact O-N 2.59Å; L97-I101 HydrophobicContact CD2-CD1 3.72Å; L97-I101 HydrophobicContact CD2-CG1 4.31Å; L97-I101 WeakPolarHBondContact O-CB 3.17Å; L97-I101 WeakPolarHBondContact O-CD1 3.34Å; L97-I101 WeakPolarHBondContact O-CG1 3.38Å; L97-I101 PolarHBondContact O-N 2.78Å
98	V	78.3	Confident	74.7	Confident	95 Å²	95	85.1 Å²	85.1	58%	0.576	52%	0.515	S	S	*	.	H	α-helix	trans	-66	-41.6	175.6	171.9	0	0	0	0	110.9	M94 M95 G102	M94-V98 WeakPolarHBondContact O-CB 3.25Å; M94-V98 WeakPolarHBondContact O-CG2 3.28Å; M94-V98 PolarHBondContact O-N 3Å; M95-V98 PolarHBondContact O-N 2.99Å; V98-G102 WeakPolarHBondContact O-CA 3.28Å; V98-G102 PolarHBondContact O-N 3.29Å
99	L	74.8	Confident	74.1	Confident	85 Å²	85	84.1 Å²	84.1	45%	0.445	51%	0.505	S	S	.	.	H	α-helix	trans	-65.8	-40.2	172.1	-101.9	113.3	0	0	0	111.9	M95 G102 L103	M95-L99 HydrophobicContact CE-CD1 3.9Å; M95-L99 HydrophobicContact CG-CD1 3.9Å; M95-L99 WeakPolarHBondContact O-CB 3.26Å; M95-L99 WeakPolarHBondContact O-CD1 3.15Å; M95-L99 PolarHBondContact O-N 2.92Å; M95-L99 HydrophobicContact SD-CD1 4.42Å; L99-G102 PolarHBondContact O-N 3.42Å; L99-L103 HydrophobicContact CD2-CD1 4.2Å; L99-L103 WeakPolarHBondContact O-CB 3.36Å; L99-L103 WeakPolarHBondContact O-CD1 3.42Å; L99-L103 WeakPolarHBondContact O-CG 3.43Å; L99-L103 PolarHBondContact O-N 2.87Å
100	G	69.8	Low	73.7	Confident	43 Å²	43	86.7 Å²	86.7	44%	0.443	52%	0.518	S	S	.	.	H	α-helix	trans	-66.1	-42.2	178.9	0	0	0	0	0	112.4	F96 L97 G104	F96-G100 WeakPolarHBondContact O-CA 3.48Å; F96-G100 PolarHBondContact O-N 3.3Å; L97-G100 PolarHBondContact O-N 2.59Å; G100-G104 PolarHBondContact O-N 2.88Å
101	I	66.9	Low	73.3	Confident	106 Å²	106	86.7 Å²	86.7	54%	0.544	53%	0.529	S	S	.	.	H	α-helix	trans	-68.9	-44.1	173.4	-65.8	165.2	0	0	0	110.1	L97 G104 V105	L97-I101 HydrophobicContact CD2-CD1 3.72Å; L97-I101 HydrophobicContact CD2-CG1 4.31Å; L97-I101 WeakPolarHBondContact O-CB 3.17Å; L97-I101 WeakPolarHBondContact O-CD1 3.34Å; L97-I101 WeakPolarHBondContact O-CG1 3.38Å; L97-I101 PolarHBondContact O-N 2.78Å; I101-G104 PolarHBondContact O-N 3.09Å; I101-V105 VanDerWaalsContact O-CG2 3.3Å; I101-V105 WeakPolarHBondContact O-CG2 3.44Å; I101-V105 PolarHBondContact O-N 2.82Å
102	G	59.2	Low	73.2	Confident	46 Å²	46	86.9 Å²	86.9	47%	0.474	52%	0.524	S	S	.	.	H	α-helix	trans	-63	-42.6	178.5	0	0	0	0	0	113.3	V98 L99 G106	V98-G102 WeakPolarHBondContact O-CA 3.28Å; V98-G102 PolarHBondContact O-N 3.29Å; L99-G102 PolarHBondContact O-N 3.42Å; G102-G106 PolarHBondContact O-N 3.05Å; G102-G106 VanDerWaalsContact O-N 3.09Å
103	L	58.2	Low	73.1	Confident	98 Å²	98	85 Å²	85	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-68.7	-42.5	173.7	-73.8	164.9	0	0	0	111	L99 V105 G106 L107	L99-L103 HydrophobicContact CD2-CD1 4.2Å; L99-L103 WeakPolarHBondContact O-CB 3.36Å; L99-L103 WeakPolarHBondContact O-CD1 3.42Å; L99-L103 WeakPolarHBondContact O-CG 3.43Å; L99-L103 PolarHBondContact O-N 2.87Å; L103-V105 VanDerWaalsContact C-N 3.3Å; L103-V105 PolarHBondContact O-N 2.86Å; L103-G106 PolarHBondContact O-N 3.13Å; L103-L107 HydrophobicContact CB-CD1 4.13Å; L103-L107 HydrophobicContact CD2-CD1 4.28Å; L103-L107 WeakPolarHBondContact O-CB 3.5Å; L103-L107 VanDerWaalsContact O-CD1 3.27Å; L103-L107 WeakPolarHBondContact O-CD1 3.37Å; L103-L107 PolarHBondContact O-N 2.81Å
104	G	57.2	Low	72.9	Confident	48 Å²	48	87.1 Å²	87.1	50%	0.495	51%	0.513	S	S	.	.	H	α-helix	trans	-61.3	-34.8	178	0	0	0	0	0	113.8	G100 I101	G100-G104 PolarHBondContact O-N 2.88Å; I101-G104 PolarHBondContact O-N 3.09Å
105	V	56.2	Low	72.8	Confident	105 Å²	105	82.1 Å²	82.1	64%	0.636	49%	0.488	S	S	*	.	H	α-helix	trans	-79.3	-32.6	175.5	177	0	0	0	0	111.9	I101 L103	I101-V105 VanDerWaalsContact O-CG2 3.3Å; I101-V105 WeakPolarHBondContact O-CG2 3.44Å; I101-V105 PolarHBondContact O-N 2.82Å; L103-V105 VanDerWaalsContact C-N 3.3Å; L103-V105 PolarHBondContact O-N 2.86Å
106	G	52.5	Low	72.4	Confident	63 Å²	63	80.3 Å²	80.3	65%	0.649	50%	0.496	S	S	*	.	H	α-helix	trans	-76.1	-30.1	178.5	0	0	0	0	0	115	G102 L103	G102-G106 PolarHBondContact O-N 3.05Å; G102-G106 VanDerWaalsContact O-N 3.09Å; L103-G106 PolarHBondContact O-N 3.13Å
107	L	56.4	Low	72.1	Confident	112 Å²	112	77.1 Å²	77.1	59%	0.586	49%	0.49	S	S	*	.	S	Bend	trans	-85.5	-6.3	-178.1	-87.9	128.9	0	0	0	114.7	L103 C109	L103-L107 HydrophobicContact CB-CD1 4.13Å; L103-L107 HydrophobicContact CD2-CD1 4.28Å; L103-L107 WeakPolarHBondContact O-CB 3.5Å; L103-L107 VanDerWaalsContact O-CD1 3.27Å; L103-L107 WeakPolarHBondContact O-CD1 3.37Å; L103-L107 PolarHBondContact O-N 2.81Å; L107-C109 PolarHBondContact O-N 2.68Å
108	S	62.9	Low	71.7	Confident	66 Å²	66	74 Å²	74	46%	0.462	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-22.5	-163.2	83.9	0	0	0	0	115.9	C121	S108-C121 VanDerWaalsContact C-SG 3.6Å; S108-C121 PolarHBondContact O-SG 3.23Å; S108-C121 VanDerWaalsContact O-SG 3.33Å
109	C	73.4	Confident	71.5	Confident	23 Å²	23	74.2 Å²	74.2	16%	0.155	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	15	-179.4	-58.7	0	0	0	0	114.5	L107 G111 K112 R114 C121	L107-C109 PolarHBondContact O-N 2.68Å; C109-G111 PolarHBondContact O-N 3.42Å; C109-G111 VanDerWaalsContact O-N 3.09Å; C109-K112 PolarHBondContact O-N 2.88Å; C109-R114 HydrophobicContact CB-CB 4.31Å; C109-C121 WeakPolarHBondContact CA-SG 3.42Å; C109-C121 HydrophobicContact CB-CB 3.79Å; C109-C121 WeakPolarHBondContact CB-SG 3.43Å; C109-C121 WeakPolarHBondContact SG-CB 3.28Å; C109-C121 CovalentContact SG-SG 2.02Å; C109-C121 PolarHBondContact SG-SG 3.21Å
110	V	79.3	Confident	72.1	Confident	115 Å²	115	75 Å²	75	70%	0.697	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	119.9	-179.8	-180	0	0	0	0	109.7	K112	V110-K112 VanDerWaalsContact C-N 3.34Å
111	G	80.2	Confident	73	Confident	67 Å²	67	74.3 Å²	74.3	69%	0.691	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	10.5	-176.9	0	0	0	0	0	115.5	C109 T124	C109-G111 PolarHBondContact O-N 3.42Å; C109-G111 VanDerWaalsContact O-N 3.09Å; G111-T124 WeakPolarHBondContact O-CG2 3.39Å
112	K	86.9	Confident	74.1	Confident	119 Å²	119	69.9 Å²	69.9	52%	0.517	45%	0.449	S	S	.	.	S	Bend	trans	-121.5	157.9	177.7	-72.4	-175.7	-177.1	179.2	0	110.9	C109 V110 C121 V122	C109-K112 PolarHBondContact O-N 2.88Å; V110-K112 VanDerWaalsContact C-N 3.34Å; K112-C121 HydrophobicContact CB-CB 3.81Å; K112-C121 HydrophobicContact CD-CB 3.89Å; K112-V122 VanDerWaalsContact CB-O 3.25Å; K112-V122 WeakPolarHBondContact CB-O 3.24Å
113	F	86.8	Confident	75.6	Confident	51 Å²	51	70.6 Å²	70.6	22%	0.224	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	132.9	169.7	-176.4	-108.5	0	0	0	109.3	C121 V122 Q127 D139	F113-C121 CarbonylContact O-C 3.56Å; F113-C121 WeakPolarHBondContact O-CA 3.33Å; F113-V122 HydrophobicContact CB-CG2 3.83Å; F113-V122 HydrophobicContact CD1-CG2 3.71Å; F113-V122 HydrophobicContact CG-CG2 4.26Å; F113-V122 PolarHBondContact N-O 3.15Å; F113-V122 PolarHBondContact O-N 3.43Å; F113-Q127 HydrophobicContact CB-CG 3.68Å; F113-Q127 HydrophobicContact CD1-CG 4.05Å; F113-Q127 HydrophobicContact CD2-CG 3.52Å; F113-Q127 HydrophobicContact CE2-CG 4.1Å; F113-Q127 HydrophobicContact CG-CG 3.47Å; F113-Q127 VanDerWaalsContact CG-CG 3.47Å; F113-D139 HydrophobicContact CD1-CB 4.27Å; F113-D139 HydrophobicContact CE1-CB 3.96Å
114	R	87.2	Confident	77	Confident	159 Å²	159	69 Å²	69	60%	0.6	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	122.2	177.8	-178.2	174.7	176.5	175.3	1.7	108.8	C109	C109-R114 HydrophobicContact CB-CB 4.31Å
115	C	86.4	Confident	78.6	Confident	1 Å²	1	72 Å²	72	1%	0.007	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-61.7	144.5	170.8	-52.8	0	0	0	0	109	S118 Q120 C134	C115-S118 CarbonylContact C-O 3.58Å; C115-S118 WeakPolarHBondContact CB-OG 3.35Å; C115-Q120 PolarHBondContact N-O 2.89Å; C115-C134 VanDerWaalsContact CA-SG 3.57Å; C115-C134 HydrophobicContact CB-CB 3.76Å; C115-C134 WeakPolarHBondContact CB-SG 3.36Å; C115-C134 VanDerWaalsContact SG-CA 3.6Å; C115-C134 WeakPolarHBondContact SG-CB 3.28Å; C115-C134 CovalentContact SG-SG 2.04Å; C115-C134 PolarHBondContact SG-SG 3.13Å
116	G	78.9	Confident	80.3	Confident	64 Å²	64	67.4 Å²	67.4	66%	0.66	42%	0.416	S	S	*	.	S	Bend	trans	-80.5	-42.2	-178.1	0	0	0	0	0	112.9	E138	G116-E138 VanDerWaalsContact CA-OE2 3.3Å; G116-E138 WeakPolarHBondContact CA-OE2 3.49Å; G116-E138 PolarHBondContact N-OE2 3.22Å
117	S	79.2	Confident	82.1	Confident	64 Å²	64	66 Å²	66	45%	0.448	39%	0.392	S	S	.	.	S	Bend	trans	-77.2	-31.8	-179.4	-79.2	0	0	0	0	113.3	E138	S117-E138 PolarHBondContact N-OE1 3.45Å; S117-E138 VanDerWaalsContact N-OE1 3.16Å; S117-E138 PolarHBondContact N-OE2 3.36Å; S117-E138 PolarHBondContact OG-OE1 2.63Å; S117-E138 VanDerWaalsContact OG-OE1 3.13Å
118	S	75.1	Confident	83.8	Confident	25 Å²	25	60.7 Å²	60.7	18%	0.175	37%	0.365	C	S	.	.	S	Bend	trans	-116.7	154.1	178.3	70	0	0	0	0	110.5	C115 Q120	C115-S118 CarbonylContact C-O 3.58Å; C115-S118 WeakPolarHBondContact CB-OG 3.35Å; S118-Q120 PolarHBondContact O-N 2.83Å; S118-Q120 VanDerWaalsContact O-N 3.09Å; S118-Q120 VanDerWaalsContact OG-CB 3.29Å; S118-Q120 WeakPolarHBondContact OG-CB 3.48Å
119	S	74.8	Confident	85	Confident	99 Å²	99	59.7 Å²	59.7	69%	0.692	35%	0.354	S	S	*	.	S	Bend	trans	-76.1	16.8	171.3	52.2	0	0	0	0	113.1
120	Q	86.1	Confident	85.6	Confident	101 Å²	101	60.5 Å²	60.5	47%	0.472	37%	0.367	S	S	.	.			trans	-76.3	142.5	179.9	-173.2	176.8	-10.5	0	0	111	C115 S118 V122	C115-Q120 PolarHBondContact N-O 2.89Å; S118-Q120 PolarHBondContact O-N 2.83Å; S118-Q120 VanDerWaalsContact O-N 3.09Å; S118-Q120 VanDerWaalsContact OG-CB 3.29Å; S118-Q120 WeakPolarHBondContact OG-CB 3.48Å; Q120-V122 HydrophobicContact CG-CG1 4.42Å
121	C	88.4	Confident	86	Confident	28 Å²	28	58.4 Å²	58.4	19%	0.189	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	128	172.1	-30.4	0	0	0	0	109.8	S108 C109 K112 F113	S108-C121 VanDerWaalsContact C-SG 3.6Å; S108-C121 PolarHBondContact O-SG 3.23Å; S108-C121 VanDerWaalsContact O-SG 3.33Å; C109-C121 WeakPolarHBondContact CA-SG 3.42Å; C109-C121 HydrophobicContact CB-CB 3.79Å; C109-C121 WeakPolarHBondContact CB-SG 3.43Å; C109-C121 WeakPolarHBondContact SG-CB 3.28Å; C109-C121 CovalentContact SG-SG 2.02Å; C109-C121 PolarHBondContact SG-SG 3.21Å; K112-C121 HydrophobicContact CB-CB 3.81Å; K112-C121 HydrophobicContact CD-CB 3.89Å; F113-C121 CarbonylContact O-C 3.56Å; F113-C121 WeakPolarHBondContact O-CA 3.33Å
122	V	90	Very high	86.4	Confident	13 Å²	13	60.5 Å²	60.5	8%	0.079	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	165.1	176.8	-57.8	0	0	0	0	110.5	K112 F113 Q120 A126 D133	K112-V122 VanDerWaalsContact CB-O 3.25Å; K112-V122 WeakPolarHBondContact CB-O 3.24Å; F113-V122 HydrophobicContact CB-CG2 3.83Å; F113-V122 HydrophobicContact CD1-CG2 3.71Å; F113-V122 HydrophobicContact CG-CG2 4.26Å; F113-V122 PolarHBondContact N-O 3.15Å; F113-V122 PolarHBondContact O-N 3.43Å; Q120-V122 HydrophobicContact CG-CG1 4.42Å; V122-A126 HydrophobicContact CB-CB 4.21Å; V122-A126 HydrophobicContact CG2-CB 4.05Å; V122-D133 HydrophobicContact CB-CB 4.3Å; V122-D133 HydrophobicContact CG1-CB 4Å
123	S	90.9	Very high	86.6	Confident	62 Å²	62	58 Å²	58	43%	0.434	34%	0.34	S	S	.	.			trans	-58.9	147.2	177.8	-176.9	0	0	0	0	110.7	M125 A126	S123-M125 PolarHBondContact O-N 2.99Å; S123-M125 PolarHBondContact OG-N 3.32Å; S123-A126 VanDerWaalsContact O-CB 3.25Å; S123-A126 WeakPolarHBondContact O-CB 3.23Å; S123-A126 PolarHBondContact O-N 3.21Å
124	T	88.8	Confident	86.6	Confident	63 Å²	63	55.6 Å²	55.6	39%	0.387	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-61.7	-25.6	170.3	48.6	0	0	0	0	112.1	G111 A126 Q127 R158 G159	G111-T124 WeakPolarHBondContact O-CG2 3.39Å; T124-A126 PolarHBondContact O-N 2.9Å; T124-Q127 WeakPolarHBondContact O-CB 3.38Å; T124-Q127 PolarHBondContact O-N 3.48Å; T124-R158 CarbonylContact O-C 3.55Å; T124-G159 WeakPolarHBondContact O-CA 3.2Å; T124-G159 PolarHBondContact O-N 2.91Å
125	M	90.2	Very high	86.6	Confident	113 Å²	113	53.3 Å²	53.3	56%	0.557	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-72.1	-16.4	175	-59.7	-176.5	78.9	0	0	113.7	S123 Q127 R158	S123-M125 PolarHBondContact O-N 2.99Å; S123-M125 PolarHBondContact OG-N 3.32Å; M125-Q127 VanDerWaalsContact C-N 3.32Å; M125-R158 HydrophobicContact CB-CB 4.38Å; M125-R158 VanDerWaalsContact O-CA 3.28Å; M125-R158 WeakPolarHBondContact O-CA 3.48Å; M125-R158 WeakPolarHBondContact O-CB 3.22Å; M125-R158 WeakPolarHBondContact O-CG 3.4Å
126	A	91.2	Very high	86.4	Confident	7 Å²	7	56.7 Å²	56.7	6%	0.058	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-76.1	-21.2	173.5	0	0	0	0	0	112.1	V122 S123 T124 C128 D129 D133	V122-A126 HydrophobicContact CB-CB 4.21Å; V122-A126 HydrophobicContact CG2-CB 4.05Å; S123-A126 VanDerWaalsContact O-CB 3.25Å; S123-A126 WeakPolarHBondContact O-CB 3.23Å; S123-A126 PolarHBondContact O-N 3.21Å; T124-A126 PolarHBondContact O-N 2.9Å; A126-C128 PolarHBondContact O-N 3.27Å; A126-D129 PolarHBondContact O-N 3.46Å; A126-D133 HydrophobicContact CB-CB 4.04Å; A126-D133 WeakPolarHBondContact CB-OD2 2.97Å
127	Q	91.8	Very high	86.8	Confident	33 Å²	33	56.9 Å²	56.9	15%	0.154	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	123.8	179.6	-71.2	177.4	67.7	0	0	111.2	F113 T124 M125 D129 R158 G159	F113-Q127 HydrophobicContact CB-CG 3.68Å; F113-Q127 HydrophobicContact CD1-CG 4.05Å; F113-Q127 HydrophobicContact CD2-CG 3.52Å; F113-Q127 HydrophobicContact CE2-CG 4.1Å; F113-Q127 HydrophobicContact CG-CG 3.47Å; F113-Q127 VanDerWaalsContact CG-CG 3.47Å; T124-Q127 WeakPolarHBondContact O-CB 3.38Å; T124-Q127 PolarHBondContact O-N 3.48Å; M125-Q127 VanDerWaalsContact C-N 3.32Å; Q127-D129 PolarHBondContact O-N 3.09Å; Q127-R158 WeakPolarHBondContact O-CA 3.28Å; Q127-R158 PolarHBondContact O-N 2.93Å; Q127-G159 PolarHBondContact O-N 2.83Å
128	C	91.3	Very high	87.1	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.007	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	38.9	176.5	-56.1	0	0	0	0	112.7	A126 D139 E140 C143 Q156 K157 Q219	A126-C128 PolarHBondContact O-N 3.27Å; C128-D139 PolarHBondContact N-O 3.07Å; C128-E140 VanDerWaalsContact C-OE1 3.25Å; C128-E140 WeakPolarHBondContact CA-OE1 3.42Å; C128-E140 PolarHBondContact N-OE1 2.75Å; C128-C143 VanDerWaalsContact CA-SG 3.6Å; C128-C143 HydrophobicContact CB-CB 3.66Å; C128-C143 WeakPolarHBondContact CB-SG 3.48Å; C128-C143 WeakPolarHBondContact SG-CA 3.17Å; C128-C143 WeakPolarHBondContact SG-CB 3.43Å; C128-C143 CovalentContact SG-SG 2.02Å; C128-C143 PolarHBondContact SG-SG 3.16Å; C128-Q156 HydrophobicContact CB-CB 4.23Å; C128-Q156 VanDerWaalsContact CB-O 3.23Å; C128-Q156 WeakPolarHBondContact CB-O 3.43Å; C128-K157 WeakPolarHBondContact O-CA 3.11Å; C128-Q219 HydrophobicContact CB-CB 4.28Å; C128-Q219 HydrophobicContact CB-CG 4.23Å
129	D	88.9	Confident	87.9	Confident	45 Å²	45	53.1 Å²	53.1	24%	0.241	30%	0.3	C	S	.	.	S	Bend	trans	-93.3	-8.1	177.3	84.3	-6	0	0	0	113.4	A126 Q127 T131 E140 R158	A126-D129 PolarHBondContact O-N 3.46Å; Q127-D129 PolarHBondContact O-N 3.09Å; D129-T131 WeakPolarHBondContact OD1-CA 3.35Å; D129-T131 WeakPolarHBondContact OD1-CB 3.12Å; D129-T131 PolarHBondContact OD1-N 3.43Å; D129-T131 PolarHBondContact OD1-OG1 3.27Å; D129-T131 PolarHBondContact OD2-OG1 3.11Å; D129-E140 PolarHBondContact N-OE1 3.27Å; D129-R158 HydrophobicContact CB-CG 3.99Å
130	G	85.9	Confident	88.6	Confident	40 Å²	40	48.6 Å²	48.6	41%	0.412	27%	0.268	S	S	.	.	S	Bend	trans	91.8	3.7	178.7	0	0	0	0	0	113.9	E140	G130-E140 WeakPolarHBondContact CA-OE2 3.42Å; G130-E140 PolarHBondContact N-OE1 3.49Å; G130-E140 PolarHBondContact N-OE2 2.92Å
131	T	87.3	Confident	88.7	Confident	72 Å²	72	44.2 Å²	44.2	44%	0.442	25%	0.248	S	C	.	.	S	Bend	trans	-108.7	163	176	71.2	0	0	0	0	110.8	D129 D133 E140	D129-T131 WeakPolarHBondContact OD1-CA 3.35Å; D129-T131 WeakPolarHBondContact OD1-CB 3.12Å; D129-T131 PolarHBondContact OD1-N 3.43Å; D129-T131 PolarHBondContact OD1-OG1 3.27Å; D129-T131 PolarHBondContact OD2-OG1 3.11Å; T131-D133 PolarHBondContact OG1-OD2 3.05Å; T131-E140 WeakPolarHBondContact O-CG 3.47Å
132	M	88.7	Confident	88.8	Confident	110 Å²	110	43.7 Å²	43.7	54%	0.542	25%	0.246	S	C	.	.			trans	-97.7	99.5	177.8	-178.6	-157.7	-72.8	0	0	108.4	C134 H137	M132-C134 WeakPolarHBondContact CG-O 3.5Å; M132-H137 WeakPolarHBondContact CE-CE1 3.5Å; M132-H137 WeakPolarHBondContact CE-NE2 3.39Å
133	D	90.2	Very high	89	Confident	66 Å²	66	43 Å²	43	35%	0.353	24%	0.243	S	C	.	.			trans	-101	-23.2	172.2	-70	-60.2	0	0	0	112.5	V122 A126 T131 D139	V122-D133 HydrophobicContact CB-CB 4.3Å; V122-D133 HydrophobicContact CG1-CB 4Å; A126-D133 HydrophobicContact CB-CB 4.04Å; A126-D133 WeakPolarHBondContact CB-OD2 2.97Å; T131-D133 PolarHBondContact OG1-OD2 3.05Å; D133-D139 WeakPolarHBondContact CA-OD2 3.28Å; D133-D139 WeakPolarHBondContact CB-OD2 2.73Å; D133-D139 PolarHBondContact N-OD2 3.33Å
134	C	87.7	Confident	89.1	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.014	22%	0.224	C	C	.	.	S	Bend	trans	-107.5	148.9	170.8	-69	0	0	0	0	112.1	C115 M132 H137 E138 D139	C115-C134 VanDerWaalsContact CA-SG 3.57Å; C115-C134 HydrophobicContact CB-CB 3.76Å; C115-C134 WeakPolarHBondContact CB-SG 3.36Å; C115-C134 VanDerWaalsContact SG-CA 3.6Å; C115-C134 WeakPolarHBondContact SG-CB 3.28Å; C115-C134 CovalentContact SG-SG 2.04Å; C115-C134 PolarHBondContact SG-SG 3.13Å; M132-C134 WeakPolarHBondContact CG-O 3.5Å; C134-H137 PolarHBondContact O-N 3.43Å; C134-H137 VanDerWaalsContact O-N 3.13Å; C134-E138 HydrophobicContact CB-CB 3.97Å; C134-D139 HydrophobicContact CB-CB 4.11Å; C134-D139 WeakPolarHBondContact CB-OD1 3.3Å; C134-D139 PolarHBondContact N-OD1 3.46Å; C134-D139 VanDerWaalsContact N-OD1 3.12Å
135	E	87	Confident	89.4	Confident	111 Å²	111	39.9 Å²	39.9	52%	0.519	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-53.2	143.5	170.1	-69.5	-175.5	177.5	0	0	111	H137 E138	E135-H137 PolarHBondContact O-N 2.95Å; E135-E138 VanDerWaalsContact O-CG 3.31Å; E135-E138 WeakPolarHBondContact O-CG 3.49Å; E135-E138 PolarHBondContact O-N 3.29Å
136	N	82.9	Confident	89.6	Confident	72 Å²	72	35.1 Å²	35.1	39%	0.385	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	59.1	19.6	-177.4	-52.7	-62.8	0	0	0	115.1	E138 F488	N136-E138 VanDerWaalsContact C-N 3.27Å; N136-E138 HydrophobicContact CB-CG 4.45Å; N136-E138 PolarHBondContact O-N 3.29Å; N136-F488 HydrophobicContact CB-CZ 4.32Å
137	H	85.6	Confident	89.9	Confident	68 Å²	68	34.9 Å²	34.9	32%	0.315	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	58	35.3	-178.7	-54.5	94.2	0	0	0	113.4	M132 C134 E135 D139 E140 M487	M132-H137 WeakPolarHBondContact CE-CE1 3.5Å; M132-H137 WeakPolarHBondContact CE-NE2 3.39Å; C134-H137 PolarHBondContact O-N 3.43Å; C134-H137 VanDerWaalsContact O-N 3.13Å; E135-H137 PolarHBondContact O-N 2.95Å; H137-D139 VanDerWaalsContact C-N 3.25Å; H137-D139 PolarHBondContact O-N 3Å; H137-E140 HydrophobicContact CB-CB 4.18Å; H137-E140 CarbonylContact O-C 3.55Å; H137-E140 WeakPolarHBondContact O-CA 3.41Å; H137-E140 PolarHBondContact O-N 2.92Å; H137-M487 HydrophobicContact CB-CE 4.4Å; H137-M487 HydrophobicContact CB-SD 4.49Å
138	E	87.1	Confident	89.9	Confident	8 Å²	8	33.5 Å²	33.5	4%	0.037	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-64.3	-29.7	-176.6	-73	-177.5	139.9	0	0	114.2	G116 S117 C134 E135 N136 E140 L141 R484	G116-E138 VanDerWaalsContact CA-OE2 3.3Å; G116-E138 WeakPolarHBondContact CA-OE2 3.49Å; G116-E138 PolarHBondContact N-OE2 3.22Å; S117-E138 PolarHBondContact N-OE1 3.45Å; S117-E138 VanDerWaalsContact N-OE1 3.16Å; S117-E138 PolarHBondContact N-OE2 3.36Å; S117-E138 PolarHBondContact OG-OE1 2.63Å; S117-E138 VanDerWaalsContact OG-OE1 3.13Å; C134-E138 HydrophobicContact CB-CB 3.97Å; E135-E138 VanDerWaalsContact O-CG 3.31Å; E135-E138 WeakPolarHBondContact O-CG 3.49Å; E135-E138 PolarHBondContact O-N 3.29Å; N136-E138 VanDerWaalsContact C-N 3.27Å; N136-E138 HydrophobicContact CB-CG 4.45Å; N136-E138 PolarHBondContact O-N 3.29Å; E138-E140 PolarHBondContact O-N 3.41Å; E138-L141 PolarHBondContact O-N 3.03Å; E138-R484 IonicContact OE1-CZ 2.73Å; E138-R484 IonicContact OE1-NH1 2.59Å; E138-R484 PolarHBondContact OE1-NH1 2.73Å; E138-R484 IonicContact OE1-NH2 3.92Å; E138-R484 PolarHBondContact OE1-NH2 3.01Å
139	D	90.1	Very high	89.9	Confident	2 Å²	2	42 Å²	42	1%	0.011	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-67.8	-17	171.4	55.3	-44.5	0	0	0	113.5	F113 C128 D133 C134 H137	F113-D139 HydrophobicContact CD1-CB 4.27Å; F113-D139 HydrophobicContact CE1-CB 3.96Å; C128-D139 PolarHBondContact N-O 3.07Å; D133-D139 WeakPolarHBondContact CA-OD2 3.28Å; D133-D139 WeakPolarHBondContact CB-OD2 2.73Å; D133-D139 PolarHBondContact N-OD2 3.33Å; C134-D139 HydrophobicContact CB-CB 4.11Å; C134-D139 WeakPolarHBondContact CB-OD1 3.3Å; C134-D139 PolarHBondContact N-OD1 3.46Å; C134-D139 VanDerWaalsContact N-OD1 3.12Å; H137-D139 VanDerWaalsContact C-N 3.25Å; H137-D139 PolarHBondContact O-N 3Å
140	E	89.7	Confident	90	Very high	3 Å²	3	41.7 Å²	41.7	1%	0.014	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-109.6	19.4	-179.2	-65.9	-62.9	135.7	0	0	113.2	C128 D129 G130 T131 H137 E138 C143 K217 Q219	C128-E140 VanDerWaalsContact C-OE1 3.25Å; C128-E140 WeakPolarHBondContact CA-OE1 3.42Å; C128-E140 PolarHBondContact N-OE1 2.75Å; D129-E140 PolarHBondContact N-OE1 3.27Å; G130-E140 WeakPolarHBondContact CA-OE2 3.42Å; G130-E140 PolarHBondContact N-OE1 3.49Å; G130-E140 PolarHBondContact N-OE2 2.92Å; T131-E140 WeakPolarHBondContact O-CG 3.47Å; H137-E140 HydrophobicContact CB-CB 4.18Å; H137-E140 CarbonylContact O-C 3.55Å; H137-E140 WeakPolarHBondContact O-CA 3.41Å; H137-E140 PolarHBondContact O-N 2.92Å; E138-E140 PolarHBondContact O-N 3.41Å; E140-C143 VanDerWaalsContact C-SG 3.56Å; E140-K217 VanDerWaalsContact CB-NZ 3.31Å; E140-K217 PolarHBondContact O-NZ 3.34Å; E140-Q219 PolarHBondContact OE2-NE2 2.88Å
141	L	89.6	Confident	90.4	Very high	10 Å²	10	41.2 Å²	41.2	5%	0.052	21%	0.208	C	C	.	.	S	Bend	trans	-107.8	151.9	172.1	-66.7	174.9	0	0	0	110.1	E138 C143 L480 E483 R484 M487	E138-L141 PolarHBondContact O-N 3.03Å; L141-C143 VanDerWaalsContact C-N 3.27Å; L141-C143 PolarHBondContact O-N 2.9Å; L141-L480 HydrophobicContact CB-CD2 3.65Å; L141-E483 HydrophobicContact CD2-CB 4.49Å; L141-E483 HydrophobicContact CD2-CG 3.89Å; L141-R484 HydrophobicContact CD1-CB 3.88Å; L141-R484 HydrophobicContact CD1-CG 3.99Å; L141-M487 HydrophobicContact CD2-CE 3.38Å; L141-M487 HydrophobicContact CG-CE 4.24Å
142	G	90.6	Very high	90.8	Very high	16 Å²	16	37.8 Å²	37.8	17%	0.165	19%	0.187	C	C	.	.	S	Bend	trans	71.9	21.6	176.9	0	0	0	0	0	113.3	V144 W161 E483	G142-V144 VanDerWaalsContact C-N 3.25Å; G142-V144 PolarHBondContact O-N 2.8Å; G142-W161 WeakPolarHBondContact O-CH2 3.42Å; G142-E483 WeakPolarHBondContact CA-OE2 3.35Å; G142-E483 PolarHBondContact N-OE2 2.87Å
143	C	92.6	Very high	91.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.161	C	C	.	.			trans	-80.4	-2.1	-175	-56.8	0	0	0	0	114.2	C128 E140 L141 V155 Q156 Q219	C128-C143 VanDerWaalsContact CA-SG 3.6Å; C128-C143 HydrophobicContact CB-CB 3.66Å; C128-C143 WeakPolarHBondContact CB-SG 3.48Å; C128-C143 WeakPolarHBondContact SG-CA 3.17Å; C128-C143 WeakPolarHBondContact SG-CB 3.43Å; C128-C143 CovalentContact SG-SG 2.02Å; C128-C143 PolarHBondContact SG-SG 3.16Å; E140-C143 VanDerWaalsContact C-SG 3.56Å; L141-C143 VanDerWaalsContact C-N 3.27Å; L141-C143 PolarHBondContact O-N 2.9Å; C143-V155 CarbonylContact O-C 3.53Å; C143-V155 WeakPolarHBondContact O-CA 2.96Å; C143-Q156 PolarHBondContact O-N 2.89Å; C143-Q219 HydrophobicContact CB-CG 4.45Å
144	V	93.8	Very high	91.4	Very high	7 Å²	7	29.9 Å²	29.9	4%	0.042	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	137	-179.5	-177.5	0	0	0	0	108.8	G142 L153 Q154 V155 A177 Q180 L181 L218	G142-V144 VanDerWaalsContact C-N 3.25Å; G142-V144 PolarHBondContact O-N 2.8Å; V144-L153 HydrophobicContact CG1-CD1 3.54Å; V144-Q154 WeakPolarHBondContact CA-O 2.88Å; V144-V155 HydrophobicContact CG2-CG2 4.42Å; V144-A177 HydrophobicContact CG1-CB 4.38Å; V144-Q180 HydrophobicContact CB-CB 4.21Å; V144-Q180 HydrophobicContact CG2-CB 3.93Å; V144-Q180 HydrophobicContact CG2-CG 4.43Å; V144-L181 HydrophobicContact CB-CD2 4.46Å; V144-L181 HydrophobicContact CB-CG 4.47Å; V144-L181 HydrophobicContact CG1-CD1 4.24Å; V144-L181 HydrophobicContact CG1-CD2 4.18Å; V144-L181 HydrophobicContact CG1-CG 3.99Å; V144-L181 VanDerWaalsContact O-CD2 3.31Å; V144-L181 WeakPolarHBondContact O-CD2 3.29Å; V144-L218 HydrophobicContact CG2-CB 4.26Å; V144-L218 HydrophobicContact CG2-CD2 4.48Å
145	R	95.1	Very high	91.7	Very high	52 Å²	52	29.9 Å²	29.9	20%	0.196	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	158.1	176.1	76.3	-176.4	-174.4	-175.4	1.1	113	S147 Q154 W161 Y363	R145-S147 PolarHBondContact NE-OG 3.19Å; R145-Q154 HydrophobicContact CG-CB 3.97Å; R145-Q154 VanDerWaalsContact CZ-OE1 3.24Å; R145-Q154 PolarHBondContact N-O 3.15Å; R145-Q154 PolarHBondContact O-N 3.03Å; R145-W161 HydrophobicContact CB-CH2 3.89Å; R145-W161 HydrophobicContact CB-CZ3 3.91Å; R145-W161 HydrophobicContact CG-CD2 4.44Å; R145-W161 HydrophobicContact CG-CE3 3.79Å; R145-W161 HydrophobicContact CG-CH2 3.73Å; R145-W161 HydrophobicContact CG-CZ2 4.41Å; R145-W161 HydrophobicContact CG-CZ3 3.4Å; R145-W161 VanDerWaalsContact CG-CZ3 3.4Å; R145-Y363 HydrophobicContact CB-CD2 3.55Å; R145-Y363 HydrophobicContact CB-CE2 3.52Å; R145-Y363 HydrophobicContact CB-CG 4.41Å; R145-Y363 HydrophobicContact CG-CD2 4.01Å; R145-Y363 HydrophobicContact CG-CE2 4.36Å; R145-Y363 HydrophobicContact CG-CG 4.44Å
146	L	95.5	Very high	92	Very high	13 Å²	13	25.5 Å²	25.5	7%	0.068	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	129.3	170.2	-55.2	178.9	0	0	0	108.8	V152 L153 L181 L237 N362 Y363	L146-V152 WeakPolarHBondContact CA-O 3.4Å; L146-L153 HydrophobicContact CD2-CD1 3.98Å; L146-L181 HydrophobicContact CD1-CD1 4.14Å; L146-L181 HydrophobicContact CD2-CD1 3.97Å; L146-L181 HydrophobicContact CG-CD1 3.86Å; L146-L237 WeakPolarHBondContact CD1-O 3.44Å; L146-L237 HydrophobicContact CD2-CB 3.86Å; L146-L237 HydrophobicContact CD2-CD2 4.42Å; L146-N362 WeakPolarHBondContact CB-OD1 3.42Å; L146-Y363 WeakPolarHBondContact O-CD2 3.21Å; L146-Y363 PolarHBondContact O-N 2.96Å
147	S	95.6	Very high	92.2	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.014	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	153.6	-172.6	-48.7	0	0	0	0	112.1	R145 V152 Q154 Y363	R145-S147 PolarHBondContact NE-OG 3.19Å; S147-V152 PolarHBondContact N-O 3.36Å; S147-V152 PolarHBondContact O-N 3.49Å; S147-Q154 PolarHBondContact OG-OE1 2.03Å; S147-Y363 CarbonylContact C-O 3.59Å; S147-Y363 VanDerWaalsContact CA-O 3.28Å; S147-Y363 WeakPolarHBondContact CA-O 3.46Å
148	G	92.9	Very high	92.4	Very high	3 Å²	3	27.7 Å²	27.7	3%	0.031	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	-179.8	179	0	0	0	0	0	113.8	S150 S151 E198 N362 Y363	G148-S150 PolarHBondContact O-N 3.03Å; G148-S151 PolarHBondContact O-N 2.78Å; G148-E198 VanDerWaalsContact CA-OE1 3.24Å; G148-E198 WeakPolarHBondContact CA-OE1 3.48Å; G148-N362 WeakPolarHBondContact O-CB 3.5Å; G148-N362 PolarHBondContact O-ND2 2.94Å; G148-Y363 PolarHBondContact N-O 2.97Å
149	R	90.6	Very high	92.5	Very high	179 Å²	179	28.4 Å²	28.4	68%	0.675	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-27.4	-179.2	-65	177.5	-179	-177.6	0.4	112.6	E198	R149-E198 PolarHBondContact N-OE1 3.11Å
150	S	91.5	Very high	92.5	Very high	40 Å²	40	33.5 Å²	33.5	28%	0.28	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	10.1	-175.2	-70	0	0	0	0	114.5	G148 V152 S236	G148-S150 PolarHBondContact O-N 3.03Å; S150-V152 PolarHBondContact O-N 3.42Å; S150-S236 VanDerWaalsContact O-CB 3.28Å; S150-S236 WeakPolarHBondContact O-CB 3.31Å; S150-S236 PolarHBondContact O-OG 2.97Å
151	S	94.6	Very high	92.7	Very high	30 Å²	30	36 Å²	36	21%	0.21	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	42	-179.7	-56.5	0	0	0	0	112.8	G148 L153 S236 L237 N362	G148-S151 PolarHBondContact O-N 2.78Å; S151-L153 PolarHBondContact O-N 2.84Å; S151-S236 WeakPolarHBondContact O-CA 3.27Å; S151-S236 PolarHBondContact O-OG 3.23Å; S151-L237 PolarHBondContact O-N 2.86Å; S151-L237 VanDerWaalsContact O-N 3.15Å; S151-N362 WeakPolarHBondContact CA-ND2 3.35Å; S151-N362 PolarHBondContact N-ND2 3.15Å; S151-N362 PolarHBondContact OG-ND2 2.87Å
152	V	96.5	Very high	92.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	130.2	-178.8	177.8	0	0	0	0	109.1	L146 S147 S150 T163 I197 L201 V234	L146-V152 WeakPolarHBondContact CA-O 3.4Å; S147-V152 PolarHBondContact N-O 3.36Å; S147-V152 PolarHBondContact O-N 3.49Å; S150-V152 PolarHBondContact O-N 3.42Å; V152-T163 HydrophobicContact CG1-CG2 3.52Å; V152-I197 HydrophobicContact CG2-CB 4.34Å; V152-I197 HydrophobicContact CG2-CD1 4.45Å; V152-I197 HydrophobicContact CG2-CG2 3.76Å; V152-L201 HydrophobicContact CB-CD1 4.28Å; V152-L201 HydrophobicContact CG2-CD1 4.35Å; V152-V234 HydrophobicContact CG1-CB 4.49Å; V152-V234 HydrophobicContact CG1-CG2 4.1Å; V152-V234 HydrophobicContact CG2-CG2 4.44Å
153	L	96.4	Very high	93	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	127.2	-179	-177.7	66.2	0	0	0	110.7	V144 L146 S151 V164 W169 A177 L218 T235 L237	V144-L153 HydrophobicContact CG1-CD1 3.54Å; L146-L153 HydrophobicContact CD2-CD1 3.98Å; S151-L153 PolarHBondContact O-N 2.84Å; L153-V164 HydrophobicContact CB-CB 4.35Å; L153-V164 HydrophobicContact CB-CG2 4.41Å; L153-V164 HydrophobicContact CD2-CB 4.15Å; L153-V164 HydrophobicContact CD2-CG1 4.31Å; L153-V164 HydrophobicContact CD2-CG2 3.95Å; L153-V164 HydrophobicContact CG-CB 4.28Å; L153-V164 HydrophobicContact CG-CG2 3.89Å; L153-V164 PolarHBondContact O-N 3.07Å; L153-W169 HydrophobicContact CD2-CH2 3.15Å; L153-W169 HydrophobicContact CD2-CZ2 3.84Å; L153-W169 HydrophobicContact CD2-CZ3 3.56Å; L153-A177 HydrophobicContact CD1-CB 4.39Å; L153-A177 HydrophobicContact CD2-CB 4.43Å; L153-L218 HydrophobicContact CD2-CD2 4.33Å; L153-T235 HydrophobicContact CB-CG2 4.41Å; L153-T235 HydrophobicContact CD2-CG2 4.3Å; L153-T235 PolarHBondContact N-O 2.91Å; L153-L237 HydrophobicContact CD1-CD2 4.04Å; L153-L237 HydrophobicContact CD2-CD2 4.48Å
154	Q	95.1	Very high	93.1	Very high	9 Å²	9	36.5 Å²	36.5	4%	0.042	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	144.7	169.1	-59.9	-166.9	-51.7	0	0	111.3	V144 R145 S147 W161 R162 T163	V144-Q154 WeakPolarHBondContact CA-O 2.88Å; R145-Q154 HydrophobicContact CG-CB 3.97Å; R145-Q154 VanDerWaalsContact CZ-OE1 3.24Å; R145-Q154 PolarHBondContact N-O 3.15Å; R145-Q154 PolarHBondContact O-N 3.03Å; S147-Q154 PolarHBondContact OG-OE1 2.03Å; Q154-W161 HydrophobicContact CB-CE3 3.89Å; Q154-W161 HydrophobicContact CB-CZ3 4.42Å; Q154-R162 CarbonylContact C-O 3.55Å; Q154-R162 WeakPolarHBondContact CA-O 3.27Å; Q154-R162 WeakPolarHBondContact CB-O 3.39Å; Q154-T163 PolarHBondContact NE2-OG1 2.99Å; Q154-T163 VanDerWaalsContact NE2-OG1 3.12Å
155	V	93.5	Very high	93.1	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.018	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	134.2	175	177.3	0	0	0	0	108.6	C143 V144 R162 V164 I208 L218 Q219	C143-V155 CarbonylContact O-C 3.53Å; C143-V155 WeakPolarHBondContact O-CA 2.96Å; V144-V155 HydrophobicContact CG2-CG2 4.42Å; V155-R162 PolarHBondContact N-O 3.1Å; V155-R162 PolarHBondContact O-N 3.22Å; V155-V164 HydrophobicContact CB-CG2 4.41Å; V155-V164 HydrophobicContact CG2-CG2 3.73Å; V155-I208 HydrophobicContact CG2-CD1 4.1Å; V155-L218 HydrophobicContact CG1-CB 4.31Å; V155-L218 HydrophobicContact CG2-CB 4.11Å; V155-L218 HydrophobicContact CG2-CD2 3.79Å; V155-Q219 HydrophobicContact CG1-CB 4.21Å
156	Q	92.1	Very high	93	Very high	19 Å²	19	34.7 Å²	34.7	9%	0.089	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	136.2	173.4	-158.1	174.6	18	0	0	109.9	C128 C143 G159 E160 W161 Q219	C128-Q156 HydrophobicContact CB-CB 4.23Å; C128-Q156 VanDerWaalsContact CB-O 3.23Å; C128-Q156 WeakPolarHBondContact CB-O 3.43Å; C143-Q156 PolarHBondContact O-N 2.89Å; Q156-G159 PolarHBondContact NE2-O 3.24Å; Q156-E160 CarbonylContact C-O 3.45Å; Q156-E160 VanDerWaalsContact CA-O 3.31Å; Q156-E160 WeakPolarHBondContact CA-O 3.25Å; Q156-W161 HydrophobicContact CB-CD2 3.79Å; Q156-W161 HydrophobicContact CB-CE3 3.73Å; Q156-W161 HydrophobicContact CB-CG 4.49Å; Q156-W161 HydrophobicContact CB-CH2 3.86Å; Q156-W161 HydrophobicContact CB-CZ2 3.88Å; Q156-W161 HydrophobicContact CB-CZ3 3.75Å; Q156-W161 HydrophobicContact CG-CD2 4Å; Q156-W161 HydrophobicContact CG-CE3 4.44Å; Q156-W161 HydrophobicContact CG-CG 4.28Å; Q156-W161 HydrophobicContact CG-CZ2 4.24Å; Q156-Q219 WeakPolarHBondContact O-CB 3.41Å
157	K	88.8	Confident	92.7	Very high	43 Å²	43	35.6 Å²	35.6	19%	0.187	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	123	171.6	178.3	169.5	-169.6	152.6	0	110.8	C128 G159 E160 Q219 A222	C128-K157 WeakPolarHBondContact O-CA 3.11Å; K157-G159 VanDerWaalsContact C-N 3.31Å; K157-E160 PolarHBondContact N-O 3.39Å; K157-E160 PolarHBondContact O-N 2.92Å; K157-Q219 PolarHBondContact NZ-O 3.01Å; K157-A222 HydrophobicContact CD-CB 4.29Å; K157-A222 PolarHBondContact NZ-O 3.32Å
158	R	89.3	Confident	92.2	Very high	143 Å²	143	40.5 Å²	40.5	54%	0.54	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	44.5	-174.1	-58.1	-178.1	171.2	173.3	-3.4	112.4	T124 M125 Q127 D129 E160	T124-R158 CarbonylContact O-C 3.55Å; M125-R158 HydrophobicContact CB-CB 4.38Å; M125-R158 VanDerWaalsContact O-CA 3.28Å; M125-R158 WeakPolarHBondContact O-CA 3.48Å; M125-R158 WeakPolarHBondContact O-CB 3.22Å; M125-R158 WeakPolarHBondContact O-CG 3.4Å; Q127-R158 WeakPolarHBondContact O-CA 3.28Å; Q127-R158 PolarHBondContact O-N 2.93Å; D129-R158 HydrophobicContact CB-CG 3.99Å; R158-E160 PolarHBondContact O-N 2.89Å
159	G	88.6	Confident	92.1	Very high	23 Å²	23	41.3 Å²	41.3	24%	0.237	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.2	-11.3	179.7	0	0	0	0	0	115.9	T124 Q127 Q156 K157	T124-G159 WeakPolarHBondContact O-CA 3.2Å; T124-G159 PolarHBondContact O-N 2.91Å; Q127-G159 PolarHBondContact O-N 2.83Å; Q156-G159 PolarHBondContact NE2-O 3.24Å; K157-G159 VanDerWaalsContact C-N 3.31Å
160	E	91	Very high	91.9	Very high	109 Å²	109	35.8 Å²	35.8	51%	0.509	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	130.9	-179.8	-67.9	-175.5	165	0	0	112.5	Q156 K157 R158 R162	Q156-E160 CarbonylContact C-O 3.45Å; Q156-E160 VanDerWaalsContact CA-O 3.31Å; Q156-E160 WeakPolarHBondContact CA-O 3.25Å; K157-E160 PolarHBondContact N-O 3.39Å; K157-E160 PolarHBondContact O-N 2.92Å; R158-E160 PolarHBondContact O-N 2.89Å; E160-R162 IonicContact OE2-CZ 2.81Å; E160-R162 IonicContact OE2-NE 3.07Å; E160-R162 IonicContact OE2-NH2 2.78Å; E160-R162 PolarHBondContact OE2-NH2 3.44Å
161	W	93	Very high	91.7	Very high	56 Å²	56	38.5 Å²	38.5	21%	0.212	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	134.4	172.7	-73	98.5	0	0	0	111.1	G142 R145 Q154 Q156	G142-W161 WeakPolarHBondContact O-CH2 3.42Å; R145-W161 HydrophobicContact CB-CH2 3.89Å; R145-W161 HydrophobicContact CB-CZ3 3.91Å; R145-W161 HydrophobicContact CG-CD2 4.44Å; R145-W161 HydrophobicContact CG-CE3 3.79Å; R145-W161 HydrophobicContact CG-CH2 3.73Å; R145-W161 HydrophobicContact CG-CZ2 4.41Å; R145-W161 HydrophobicContact CG-CZ3 3.4Å; R145-W161 VanDerWaalsContact CG-CZ3 3.4Å; Q154-W161 HydrophobicContact CB-CE3 3.89Å; Q154-W161 HydrophobicContact CB-CZ3 4.42Å; Q156-W161 HydrophobicContact CB-CD2 3.79Å; Q156-W161 HydrophobicContact CB-CE3 3.73Å; Q156-W161 HydrophobicContact CB-CG 4.49Å; Q156-W161 HydrophobicContact CB-CH2 3.86Å; Q156-W161 HydrophobicContact CB-CZ2 3.88Å; Q156-W161 HydrophobicContact CB-CZ3 3.75Å; Q156-W161 HydrophobicContact CG-CD2 4Å; Q156-W161 HydrophobicContact CG-CE3 4.44Å; Q156-W161 HydrophobicContact CG-CG 4.28Å; Q156-W161 HydrophobicContact CG-CZ2 4.24Å
162	R	93.1	Very high	91.4	Very high	35 Å²	35	42.5 Å²	42.5	13%	0.132	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	137.9	179.4	-60.7	-171.8	-176.6	106.6	8	111.9	Q154 V155 E160 N204 I206	Q154-R162 CarbonylContact C-O 3.55Å; Q154-R162 WeakPolarHBondContact CA-O 3.27Å; Q154-R162 WeakPolarHBondContact CB-O 3.39Å; V155-R162 PolarHBondContact N-O 3.1Å; V155-R162 PolarHBondContact O-N 3.22Å; E160-R162 IonicContact OE2-CZ 2.81Å; E160-R162 IonicContact OE2-NE 3.07Å; E160-R162 IonicContact OE2-NH2 2.78Å; E160-R162 PolarHBondContact OE2-NH2 3.44Å; R162-N204 CarbonylContact C-O 3.56Å; R162-N204 WeakPolarHBondContact CA-O 3.2Å; R162-N204 WeakPolarHBondContact CB-O 3.31Å; R162-N204 HydrophobicContact CG-CB 4.41Å; R162-I206 HydrophobicContact CB-CB 3.96Å; R162-I206 HydrophobicContact CB-CG2 3.64Å
163	T	94.6	Very high	91	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	132.1	176.8	-61.5	0	0	0	0	110.5	V152 Q154 L201 N204 L205 I206 V234	V152-T163 HydrophobicContact CG1-CG2 3.52Å; Q154-T163 PolarHBondContact NE2-OG1 2.99Å; Q154-T163 VanDerWaalsContact NE2-OG1 3.12Å; T163-L201 WeakPolarHBondContact CB-O 3.28Å; T163-L201 PolarHBondContact OG1-O 2.88Å; T163-N204 PolarHBondContact N-O 3.36Å; T163-L205 HydrophobicContact CG2-CD2 4.18Å; T163-L205 WeakPolarHBondContact O-CA 3.21Å; T163-I206 PolarHBondContact O-N 3.5Å; T163-V234 HydrophobicContact CG2-CB 4.01Å; T163-V234 HydrophobicContact CG2-CG1 3.71Å
164	V	93.8	Very high	90.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	122.6	-174	-178.2	0	0	0	0	110.8	L153 V155 W169 I206 I208 V234 T235	L153-V164 HydrophobicContact CB-CB 4.35Å; L153-V164 HydrophobicContact CB-CG2 4.41Å; L153-V164 HydrophobicContact CD2-CB 4.15Å; L153-V164 HydrophobicContact CD2-CG1 4.31Å; L153-V164 HydrophobicContact CD2-CG2 3.95Å; L153-V164 HydrophobicContact CG-CB 4.28Å; L153-V164 HydrophobicContact CG-CG2 3.89Å; L153-V164 PolarHBondContact O-N 3.07Å; V155-V164 HydrophobicContact CB-CG2 4.41Å; V155-V164 HydrophobicContact CG2-CG2 3.73Å; V164-W169 HydrophobicContact CG1-CE3 3.93Å; V164-W169 HydrophobicContact CG1-CZ3 3.98Å; V164-I206 WeakPolarHBondContact CA-O 3.31Å; V164-I206 HydrophobicContact CG2-CG2 4.18Å; V164-I208 HydrophobicContact CG1-CD1 3.93Å; V164-I208 HydrophobicContact CG1-CG1 4.23Å; V164-I208 HydrophobicContact CG2-CD1 4.01Å; V164-V234 WeakPolarHBondContact O-CA 3.18Å; V164-V234 WeakPolarHBondContact O-CB 3.42Å; V164-T235 PolarHBondContact O-N 3.39Å
165	C	93.6	Very high	90.5	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-69.6	152.1	172.4	-66.4	0	0	0	0	111.5	E167 I206 C229 T235	C165-E167 PolarHBondContact O-N 2.95Å; C165-I206 PolarHBondContact N-O 3.32Å; C165-C229 VanDerWaalsContact CA-SG 3.51Å; C165-C229 HydrophobicContact CB-CB 3.77Å; C165-C229 WeakPolarHBondContact CB-SG 3.35Å; C165-C229 VanDerWaalsContact SG-CA 3.52Å; C165-C229 WeakPolarHBondContact SG-CB 3.37Å; C165-C229 CovalentContact SG-SG 2.04Å; C165-C229 PolarHBondContact SG-SG 2.95Å; C165-T235 PolarHBondContact O-OG1 3.46Å
166	S	93.3	Very high	90.2	Very high	21 Å²	21	46.2 Å²	46.2	15%	0.147	22%	0.22	C	C	.	.	S	Bend	trans	-71.2	-17.2	178.2	73.5	0	0	0	0	114.1	W169 S231 M233 T235	S166-W169 VanDerWaalsContact O-CB 3.3Å; S166-W169 WeakPolarHBondContact O-CB 3.39Å; S166-W169 PolarHBondContact O-N 3.42Å; S166-S231 PolarHBondContact OG-OG 3.15Å; S166-M233 PolarHBondContact N-O 3.01Å; S166-M233 PolarHBondContact OG-O 3.41Å; S166-T235 WeakPolarHBondContact CA-OG1 3.41Å
167	E	89.1	Confident	90.2	Very high	32 Å²	32	45.3 Å²	45.3	15%	0.15	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	134.9	-178.9	-73.4	148.8	-125.4	0	0	111.2	C165 W169 K226 C229 S230 S231	C165-E167 PolarHBondContact O-N 2.95Å; E167-W169 PolarHBondContact O-N 3.33Å; E167-K226 IonicContact OE2-NZ 2.68Å; E167-K226 PolarHBondContact OE2-NZ 3.17Å; E167-C229 WeakPolarHBondContact OE1-CA 3.33Å; E167-S230 VanDerWaalsContact CD-CB 3.49Å; E167-S230 VanDerWaalsContact CD-OG 3.25Å; E167-S230 VanDerWaalsContact OE1-CA 3.24Å; E167-S230 WeakPolarHBondContact OE1-CA 3.43Å; E167-S230 WeakPolarHBondContact OE1-CB 3.13Å; E167-S230 PolarHBondContact OE1-N 3.29Å; E167-S230 PolarHBondContact OE1-OG 2.76Å; E167-S230 WeakPolarHBondContact OE2-CB 3.31Å; E167-S230 PolarHBondContact OE2-OG 2.89Å; E167-S231 PolarHBondContact OE1-N 2.83Å
168	E	85.1	Confident	90.4	Very high	105 Å²	105	43.4 Å²	43.4	49%	0.491	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	6.2	178.5	-54.4	175.4	-171.7	0	0	113.9	N170 N209	E168-N170 PolarHBondContact O-ND2 3.25Å; E168-N209 VanDerWaalsContact OE2-CA 3.28Å; E168-N209 WeakPolarHBondContact OE2-CA 3.38Å; E168-N209 WeakPolarHBondContact OE2-CB 3.46Å; E168-N209 PolarHBondContact OE2-ND2 2.97Å
169	W	89.9	Confident	90.3	Very high	20 Å²	20	40.7 Å²	40.7	8%	0.076	20%	0.2	C	C	.	.			trans	-66.3	136.7	173.4	-170.8	-102.5	0	0	0	110.8	L153 V164 S166 E167 L173 A177 S189 Y191 I208 L218 T235 L237	L153-W169 HydrophobicContact CD2-CH2 3.15Å; L153-W169 HydrophobicContact CD2-CZ2 3.84Å; L153-W169 HydrophobicContact CD2-CZ3 3.56Å; V164-W169 HydrophobicContact CG1-CE3 3.93Å; V164-W169 HydrophobicContact CG1-CZ3 3.98Å; S166-W169 VanDerWaalsContact O-CB 3.3Å; S166-W169 WeakPolarHBondContact O-CB 3.39Å; S166-W169 PolarHBondContact O-N 3.42Å; E167-W169 PolarHBondContact O-N 3.33Å; W169-L173 HydrophobicContact CD2-CB 4.26Å; W169-L173 HydrophobicContact CE3-CB 3.89Å; W169-L173 HydrophobicContact CE3-CD1 3.93Å; W169-L173 HydrophobicContact CH2-CB 3.8Å; W169-L173 HydrophobicContact CZ2-CB 4.21Å; W169-L173 HydrophobicContact CZ3-CB 3.64Å; W169-L173 HydrophobicContact CZ3-CD1 4.26Å; W169-A177 HydrophobicContact CH2-CB 4.2Å; W169-S189 PolarHBondContact NE1-OG 2.91Å; W169-Y191 HydrophobicContact CB-CE1 4.28Å; W169-Y191 AromaticContact CD1-CE1 3.84Å; W169-Y191 HydrophobicContact CG-CE1 4.32Å; W169-I208 HydrophobicContact CZ3-CD1 4.28Å; W169-L218 HydrophobicContact CH2-CD2 4.23Å; W169-L218 HydrophobicContact CZ3-CD2 4.3Å; W169-T235 HydrophobicContact CD2-CG2 3.73Å; W169-T235 VanDerWaalsContact CE2-CG2 3.48Å; W169-T235 HydrophobicContact CE3-CG2 4.3Å; W169-T235 HydrophobicContact CG-CG2 4.04Å; W169-T235 HydrophobicContact CH2-CG2 4.44Å; W169-T235 HydrophobicContact CZ2-CG2 3.85Å; W169-L237 HydrophobicContact CZ2-CD1 4.33Å
170	N	87.9	Confident	90.3	Very high	63 Å²	63	40 Å²	40	34%	0.337	19%	0.191	S	C	.	.			trans	-146.5	169.2	-179.5	65.6	63.9	0	0	0	111	E168 Q172 L173 G174	E168-N170 PolarHBondContact O-ND2 3.25Å; N170-Q172 VanDerWaalsContact C-N 3.27Å; N170-Q172 PolarHBondContact O-N 3.11Å; N170-Q172 WeakPolarHBondContact OD1-CA 3.25Å; N170-Q172 WeakPolarHBondContact OD1-CB 3.49Å; N170-Q172 PolarHBondContact OD1-N 3.37Å; N170-L173 PolarHBondContact O-N 3.42Å; N170-L173 PolarHBondContact OD1-N 3.09Å; N170-L173 VanDerWaalsContact OD1-N 3.1Å; N170-G174 PolarHBondContact O-N 3.46Å; N170-G174 VanDerWaalsContact O-N 3.16Å
171	I	87.8	Confident	90.3	Very high	97 Å²	97	35 Å²	35	50%	0.497	17%	0.167	S	C	.	.	H	α-helix	trans	-61.2	-32.3	-175.8	-171.1	60	0	0	0	113.4	G174 I175 V187	I171-G174 PolarHBondContact O-N 2.98Å; I171-I175 HydrophobicContact CG1-CD1 4.26Å; I171-I175 WeakPolarHBondContact O-CG1 3.48Å; I171-I175 PolarHBondContact O-N 2.91Å; I171-V187 HydrophobicContact CD1-CB 4.21Å; I171-V187 HydrophobicContact CD1-CG1 3.82Å
172	Q	86.9	Confident	89.9	Confident	115 Å²	115	32.6 Å²	32.6	54%	0.537	16%	0.161	S	C	.	.	H	α-helix	trans	-68.1	-40.6	179.1	-62	-60.3	-34.8	0	0	111.2	N170 G174 I175 S176	N170-Q172 VanDerWaalsContact C-N 3.27Å; N170-Q172 PolarHBondContact O-N 3.11Å; N170-Q172 WeakPolarHBondContact OD1-CA 3.25Å; N170-Q172 WeakPolarHBondContact OD1-CB 3.49Å; N170-Q172 PolarHBondContact OD1-N 3.37Å; Q172-G174 VanDerWaalsContact C-N 3.29Å; Q172-G174 PolarHBondContact O-N 3.06Å; Q172-I175 PolarHBondContact O-N 3.23Å; Q172-S176 PolarHBondContact O-N 3.28Å; Q172-S176 PolarHBondContact O-OG 3.29Å
173	L	88.8	Confident	89.7	Confident	1 Å²	1	32 Å²	32	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-39.1	172.1	-66.6	174.1	0	0	0	111.6	W169 N170 S176 A177 I208 V215	W169-L173 HydrophobicContact CD2-CB 4.26Å; W169-L173 HydrophobicContact CE3-CB 3.89Å; W169-L173 HydrophobicContact CE3-CD1 3.93Å; W169-L173 HydrophobicContact CH2-CB 3.8Å; W169-L173 HydrophobicContact CZ2-CB 4.21Å; W169-L173 HydrophobicContact CZ3-CB 3.64Å; W169-L173 HydrophobicContact CZ3-CD1 4.26Å; N170-L173 PolarHBondContact O-N 3.42Å; N170-L173 PolarHBondContact OD1-N 3.09Å; N170-L173 VanDerWaalsContact OD1-N 3.1Å; L173-S176 PolarHBondContact O-N 2.79Å; L173-A177 VanDerWaalsContact O-CB 3.28Å; L173-A177 WeakPolarHBondContact O-CB 3.25Å; L173-A177 PolarHBondContact O-N 2.89Å; L173-I208 HydrophobicContact CD1-CB 4.3Å; L173-I208 HydrophobicContact CD1-CG2 4.03Å; L173-I208 HydrophobicContact CD2-CG2 3.8Å; L173-V215 HydrophobicContact CD2-CG2 4.46Å
174	G	91.2	Very high	88.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-44.4	173.2	0	0	0	0	0	113.2	N170 I171 Q172 A177 C178	N170-G174 PolarHBondContact O-N 3.46Å; N170-G174 VanDerWaalsContact O-N 3.16Å; I171-G174 PolarHBondContact O-N 2.98Å; Q172-G174 VanDerWaalsContact C-N 3.29Å; Q172-G174 PolarHBondContact O-N 3.06Å; G174-A177 PolarHBondContact O-N 3.36Å; G174-C178 WeakPolarHBondContact O-CB 3.01Å; G174-C178 PolarHBondContact O-N 2.78Å; G174-C178 PolarHBondContact O-SG 2.86Å; G174-C178 VanDerWaalsContact O-SG 3.39Å
175	I	89.3	Confident	87.6	Confident	74 Å²	74	45 Å²	45	38%	0.379	22%	0.222	S	C	.	.	H	α-helix	trans	-61.3	-48.1	175.8	-67.4	163.4	0	0	0	110.7	I171 Q172 A177 C178 K179 V187	I171-I175 HydrophobicContact CG1-CD1 4.26Å; I171-I175 WeakPolarHBondContact O-CG1 3.48Å; I171-I175 PolarHBondContact O-N 2.91Å; Q172-I175 PolarHBondContact O-N 3.23Å; I175-A177 PolarHBondContact O-N 3.47Å; I175-C178 PolarHBondContact O-N 3.35Å; I175-K179 WeakPolarHBondContact O-CB 3.37Å; I175-K179 PolarHBondContact O-N 2.81Å; I175-V187 HydrophobicContact CB-CG2 4.41Å; I175-V187 HydrophobicContact CG1-CG2 3.82Å
176	S	88	Confident	87.2	Confident	15 Å²	15	47.2 Å²	47.2	11%	0.105	23%	0.232	C	C	.	.	H	α-helix	trans	-62.5	-42	178.2	-63	0	0	0	0	111.9	Q172 L173 K179 Q180 V215	Q172-S176 PolarHBondContact O-N 3.28Å; Q172-S176 PolarHBondContact O-OG 3.29Å; L173-S176 PolarHBondContact O-N 2.79Å; S176-K179 PolarHBondContact O-N 3.11Å; S176-Q180 WeakPolarHBondContact O-CG 3.32Å; S176-Q180 PolarHBondContact O-N 3.45Å; S176-V215 PolarHBondContact OG-O 3.18Å
177	A	91.6	Very high	87.1	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.8	-47.1	177.1	0	0	0	0	0	111.9	V144 L153 W169 L173 G174 I175 K179 Q180 L181 L218 L237	V144-A177 HydrophobicContact CG1-CB 4.38Å; L153-A177 HydrophobicContact CD1-CB 4.39Å; L153-A177 HydrophobicContact CD2-CB 4.43Å; W169-A177 HydrophobicContact CH2-CB 4.2Å; L173-A177 VanDerWaalsContact O-CB 3.28Å; L173-A177 WeakPolarHBondContact O-CB 3.25Å; L173-A177 PolarHBondContact O-N 2.89Å; G174-A177 PolarHBondContact O-N 3.36Å; I175-A177 PolarHBondContact O-N 3.47Å; A177-K179 VanDerWaalsContact C-N 3.29Å; A177-K179 PolarHBondContact O-N 3.15Å; A177-Q180 PolarHBondContact O-N 3.28Å; A177-L181 WeakPolarHBondContact O-CG 3.34Å; A177-L181 PolarHBondContact O-N 3.07Å; A177-L218 HydrophobicContact CB-CD1 4.09Å; A177-L218 HydrophobicContact CB-CD2 3.69Å; A177-L237 HydrophobicContact CB-CD2 3.53Å
178	C	92.1	Very high	87.3	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.014	25%	0.25	C	S	.	.	H	α-helix	trans	-64.1	-36.1	177.8	-72	0	0	0	0	112.3	G174 I175 L181 G182 Y183 V187 C239	G174-C178 WeakPolarHBondContact O-CB 3.01Å; G174-C178 PolarHBondContact O-N 2.78Å; G174-C178 PolarHBondContact O-SG 2.86Å; G174-C178 VanDerWaalsContact O-SG 3.39Å; I175-C178 PolarHBondContact O-N 3.35Å; C178-L181 CarbonylContact O-C 3.42Å; C178-L181 WeakPolarHBondContact O-CB 3.28Å; C178-L181 PolarHBondContact O-N 2.02Å; C178-L181 VanDerWaalsContact O-N 3.17Å; C178-G182 PolarHBondContact O-N 2.02Å; C178-G182 VanDerWaalsContact O-N 3.13Å; C178-Y183 CarbonylContact C-O 3.58Å; C178-Y183 VanDerWaalsContact C-O 3.23Å; C178-Y183 PolarHBondContact O-N 2.85Å; C178-Y183 VanDerWaalsContact O-O 3.1Å; C178-V187 HydrophobicContact CB-CG2 4.06Å; C178-C239 WeakPolarHBondContact CA-SG 3.08Å; C178-C239 HydrophobicContact CB-CB 3.62Å; C178-C239 WeakPolarHBondContact CB-SG 3.34Å; C178-C239 WeakPolarHBondContact SG-CA 3.39Å; C178-C239 WeakPolarHBondContact SG-CB 3.4Å; C178-C239 CovalentContact SG-SG 2.04Å; C178-C239 PolarHBondContact SG-SG 2.82Å
179	K	88.5	Confident	87.8	Confident	86 Å²	86	47.9 Å²	47.9	37%	0.374	24%	0.239	S	C	.	.	H	α-helix	trans	-62.9	-43.3	173.8	-169.2	175.7	179.9	-179.1	0	112.4	I175 S176 A177 L181 G182 Y183 L490	I175-K179 WeakPolarHBondContact O-CB 3.37Å; I175-K179 PolarHBondContact O-N 2.81Å; S176-K179 PolarHBondContact O-N 3.11Å; A177-K179 VanDerWaalsContact C-N 3.29Å; A177-K179 PolarHBondContact O-N 3.15Å; K179-L181 VanDerWaalsContact C-N 3.28Å; K179-L181 PolarHBondContact O-N 3.26Å; K179-G182 PolarHBondContact O-N 2.86Å; K179-Y183 VanDerWaalsContact CA-O 3.22Å; K179-Y183 WeakPolarHBondContact CA-O 3.07Å; K179-Y183 PolarHBondContact N-O 3.08Å; K179-L490 VanDerWaalsContact NZ-CD1 3.33Å
180	Q	88.4	Confident	88.1	Confident	10 Å²	10	49.5 Å²	49.5	5%	0.047	25%	0.253	C	S	.	.	H	α-helix	trans	-65.4	-31.9	173.1	-69.3	-173.5	-92.2	0	0	112.2	V144 S176 A177 G182 E483	V144-Q180 HydrophobicContact CB-CB 4.21Å; V144-Q180 HydrophobicContact CG2-CB 3.93Å; V144-Q180 HydrophobicContact CG2-CG 4.43Å; S176-Q180 WeakPolarHBondContact O-CG 3.32Å; S176-Q180 PolarHBondContact O-N 3.45Å; A177-Q180 PolarHBondContact O-N 3.28Å; Q180-G182 PolarHBondContact O-N 3.24Å; Q180-E483 WeakPolarHBondContact O-CB 2.9Å; Q180-E483 WeakPolarHBondContact O-CG 3.46Å
181	L	89.9	Confident	88.5	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.01	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-4.8	172.6	-69.7	167.9	0	0	0	113.9	V144 L146 A177 C178 K179 Y183 L237 R479	V144-L181 HydrophobicContact CB-CD2 4.46Å; V144-L181 HydrophobicContact CB-CG 4.47Å; V144-L181 HydrophobicContact CG1-CD1 4.24Å; V144-L181 HydrophobicContact CG1-CD2 4.18Å; V144-L181 HydrophobicContact CG1-CG 3.99Å; V144-L181 VanDerWaalsContact O-CD2 3.31Å; V144-L181 WeakPolarHBondContact O-CD2 3.29Å; L146-L181 HydrophobicContact CD1-CD1 4.14Å; L146-L181 HydrophobicContact CD2-CD1 3.97Å; L146-L181 HydrophobicContact CG-CD1 3.86Å; A177-L181 WeakPolarHBondContact O-CG 3.34Å; A177-L181 PolarHBondContact O-N 3.07Å; C178-L181 CarbonylContact O-C 3.42Å; C178-L181 WeakPolarHBondContact O-CB 3.28Å; C178-L181 PolarHBondContact O-N 2.02Å; C178-L181 VanDerWaalsContact O-N 3.17Å; K179-L181 VanDerWaalsContact C-N 3.28Å; K179-L181 PolarHBondContact O-N 3.26Å; L181-Y183 HydrophobicContact CB-CD2 3.75Å; L181-Y183 HydrophobicContact CB-CE2 3.98Å; L181-L237 HydrophobicContact CD1-CD2 4.3Å; L181-R479 PolarHBondContact O-NH1 3.34Å
182	G	86.1	Confident	88.8	Confident	7 Å²	7	48.9 Å²	48.9	7%	0.072	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	92	19.6	178.1	0	0	0	0	0	115.5	C178 K179 Q180	C178-G182 PolarHBondContact O-N 2.02Å; C178-G182 VanDerWaalsContact O-N 3.13Å; K179-G182 PolarHBondContact O-N 2.86Å; Q180-G182 PolarHBondContact O-N 3.24Å
183	Y	87.2	Confident	89.2	Confident	21 Å²	21	45.2 Å²	45.2	8%	0.082	23%	0.23	C	C	.	.			trans	-118.3	145.1	-179.4	-55.1	-77.7	0	0	0	111.7	C178 K179 L181 C239 I240 T283 R479	C178-Y183 CarbonylContact C-O 3.58Å; C178-Y183 VanDerWaalsContact C-O 3.23Å; C178-Y183 PolarHBondContact O-N 2.85Å; C178-Y183 VanDerWaalsContact O-O 3.1Å; K179-Y183 VanDerWaalsContact CA-O 3.22Å; K179-Y183 WeakPolarHBondContact CA-O 3.07Å; K179-Y183 PolarHBondContact N-O 3.08Å; L181-Y183 HydrophobicContact CB-CD2 3.75Å; L181-Y183 HydrophobicContact CB-CE2 3.98Å; Y183-C239 WeakPolarHBondContact CB-O 2.97Å; Y183-C239 HydrophobicContact CD2-CB 3.18Å; Y183-C239 HydrophobicContact CE2-CB 3.72Å; Y183-C239 HydrophobicContact CG-CB 3.64Å; Y183-I240 HydrophobicContact CD1-CB 3.87Å; Y183-I240 HydrophobicContact CD1-CD1 4.16Å; Y183-I240 HydrophobicContact CD1-CG2 4.14Å; Y183-I240 HydrophobicContact CE1-CB 3.75Å; Y183-I240 HydrophobicContact CE1-CD1 3.92Å; Y183-I240 HydrophobicContact CE1-CG1 4.45Å; Y183-I240 HydrophobicContact CE1-CG2 3.51Å; Y183-T283 HydrophobicContact CD1-CG2 4.28Å; Y183-T283 HydrophobicContact CE1-CG2 3.83Å; Y183-R479 PolarHBondContact OH-NH1 3.45Å; Y183-R479 PolarHBondContact OH-NH2 3.02Å
184	S	73.9	Confident	89.4	Confident	92 Å²	92	46.1 Å²	46.1	64%	0.643	24%	0.235	S	C	*	.			trans	-125.9	-9.2	-172.5	54.8	0	0	0	0	115.7
185	R	72.4	Confident	89.5	Confident	182 Å²	182	51.7 Å²	51.7	69%	0.687	27%	0.269	S	S	*	.	S	Bend	trans	-117.2	-32.1	-167.4	-70.1	-175.2	175.1	175.3	-0.9	115.8
186	H	83.3	Confident	89.7	Confident	47 Å²	47	51.8 Å²	51.8	22%	0.218	28%	0.276	C	S	.	.			trans	-123.5	134.2	-171.2	-176.3	92.1	0	0	0	110.4	E188 C239 E241	H186-E188 IonicContact NE2-OE2 3.58Å; H186-C239 CarbonylContact O-C 3.36Å; H186-C239 VanDerWaalsContact O-C 3.32Å; H186-C239 VanDerWaalsContact O-CA 3.25Å; H186-C239 WeakPolarHBondContact O-CA 3.22Å; H186-E241 VanDerWaalsContact CE1-CG 3.46Å; H186-E241 WeakPolarHBondContact CE1-CG 3.48Å; H186-E241 IonicContact CE1-OE1 3.37Å
187	V	91.9	Very high	90	Very high	38 Å²	38	51.5 Å²	51.5	23%	0.23	27%	0.274	C	S	.	.			trans	-145	114.9	177	-176.9	0	0	0	0	107.8	I171 I175 C178 L237	I171-V187 HydrophobicContact CD1-CB 4.21Å; I171-V187 HydrophobicContact CD1-CG1 3.82Å; I175-V187 HydrophobicContact CB-CG2 4.41Å; I175-V187 HydrophobicContact CG1-CG2 3.82Å; C178-V187 HydrophobicContact CB-CG2 4.06Å; V187-L237 HydrophobicContact CG1-CD1 4.09Å
188	E	94.3	Very high	90.1	Very high	96 Å²	96	54 Å²	54	45%	0.449	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	123	172.4	-178.2	-177.5	-176.6	0	0	107.5	H186 K238	H186-E188 IonicContact NE2-OE2 3.58Å; E188-K238 HydrophobicContact CB-CB 4.25Å; E188-K238 PolarHBondContact N-O 3.48Å; E188-K238 PolarHBondContact O-N 2.95Å; E188-K238 WeakPolarHBondContact OE2-CD 3.26Å; E188-K238 IonicContact OE2-NZ 3.67Å; E188-K238 PolarHBondContact OE2-NZ 2.88Å
189	S	94.8	Very high	90.2	Very high	37 Å²	37	61.8 Å²	61.8	26%	0.259	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	135.5	176.8	-60.4	0	0	0	0	109.6	W169 S236 L237	W169-S189 PolarHBondContact NE1-OG 2.91Å; S189-S236 WeakPolarHBondContact CA-O 3.37Å; S189-L237 WeakPolarHBondContact OG-CD1 3.39Å
190	S	95.3	Very high	90.3	Very high	54 Å²	54	63 Å²	63	38%	0.378	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	162.7	171.9	67.9	0	0	0	0	110.1	S236	S190-S236 PolarHBondContact N-O 3.28Å; S190-S236 PolarHBondContact O-N 3.38Å; S190-S236 WeakPolarHBondContact OG-CB 3.3Å; S190-S236 PolarHBondContact OG-OG 3.4Å
191	Y	96.3	Very high	90.6	Very high	114 Å²	114	62.6 Å²	62.6	45%	0.447	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.4	-176.7	-51	-62.8	0	0	0	109.8	W169 M233 V234	W169-Y191 HydrophobicContact CB-CE1 4.28Å; W169-Y191 AromaticContact CD1-CE1 3.84Å; W169-Y191 HydrophobicContact CG-CE1 4.32Å; Y191-M233 VanDerWaalsContact C-CE 3.49Å; Y191-M233 VanDerWaalsContact O-CE 3.29Å; Y191-M233 WeakPolarHBondContact O-CE 3.46Å; Y191-V234 WeakPolarHBondContact CA-O 3.2Å
192	I	95.3	Very high	90.7	Very high	33 Å²	33	65.6 Å²	65.6	17%	0.169	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	144	-172.2	-56.7	178.6	0	0	0	108.7	L194 S196 I197 M233 V234 S236	I192-L194 PolarHBondContact O-N 3.23Å; I192-S196 VanDerWaalsContact CG2-OG 3.31Å; I192-S196 WeakPolarHBondContact CG2-OG 3.1Å; I192-I197 HydrophobicContact CG2-CG2 3.79Å; I192-M233 VanDerWaalsContact C-CE 3.45Å; I192-M233 CarbonylContact O-C 3.58Å; I192-M233 VanDerWaalsContact O-CA 3.3Å; I192-M233 WeakPolarHBondContact O-CA 3.36Å; I192-V234 HydrophobicContact CB-CG2 4.45Å; I192-V234 PolarHBondContact N-O 2.93Å; I192-V234 PolarHBondContact O-N 3.27Å; I192-S236 VanDerWaalsContact CD1-CB 3.5Å
193	S	95.9	Very high	90.9	Very high	38 Å²	38	69.2 Å²	69.2	27%	0.266	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	135.8	178.1	-177.1	0	0	0	0	110.6	T195 S196 M233	S193-T195 PolarHBondContact O-N 2.68Å; S193-T195 VanDerWaalsContact O-N 3.14Å; S193-T195 PolarHBondContact OG-N 2.82Å; S193-T195 PolarHBondContact OG-OG1 3.21Å; S193-S196 PolarHBondContact O-N 3Å; S193-S196 VanDerWaalsContact O-N 3.07Å; S193-S196 PolarHBondContact O-OG 3.32Å; S193-M233 VanDerWaalsContact CA-SD 3.5Å
194	L	92.8	Very high	91	Very high	21 Å²	21	72.8 Å²	72.8	11%	0.11	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-57.5	-28.3	174.3	-174.3	68.9	0	0	0	112	I192 I197 Q202 L205 G232 V234	I192-L194 PolarHBondContact O-N 3.23Å; L194-I197 HydrophobicContact CD1-CD1 4.05Å; L194-I197 WeakPolarHBondContact O-CG1 3.5Å; L194-Q202 HydrophobicContact CD1-CB 4.27Å; L194-Q202 HydrophobicContact CG-CB 4.42Å; L194-Q202 VanDerWaalsContact O-CD 3.27Å; L194-Q202 VanDerWaalsContact O-CG 3.26Å; L194-Q202 WeakPolarHBondContact O-CG 3.47Å; L194-Q202 PolarHBondContact O-NE2 3.33Å; L194-L205 HydrophobicContact CD1-CD1 4.3Å; L194-L205 HydrophobicContact CD1-CD2 3.89Å; L194-L205 HydrophobicContact CD2-CD1 3.87Å; L194-G232 WeakPolarHBondContact CB-O 3.16Å; L194-G232 PolarHBondContact N-O 2.84Å; L194-V234 HydrophobicContact CB-CG1 4.48Å; L194-V234 HydrophobicContact CD1-CG1 3.57Å
195	T	92.8	Very high	91.9	Very high	117 Å²	117	68.4 Å²	68.4	72%	0.718	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-81.4	-14.3	-179.2	60.3	0	0	0	0	114	S193	S193-T195 PolarHBondContact O-N 2.68Å; S193-T195 VanDerWaalsContact O-N 3.14Å; S193-T195 PolarHBondContact OG-N 2.82Å; S193-T195 PolarHBondContact OG-OG1 3.21Å
196	S	93.9	Very high	92.7	Very high	75 Å²	75	60 Å²	60	52%	0.524	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-97.9	-4.6	-177.4	61.2	0	0	0	0	114.3	I192 S193	I192-S196 VanDerWaalsContact CG2-OG 3.31Å; I192-S196 WeakPolarHBondContact CG2-OG 3.1Å; S193-S196 PolarHBondContact O-N 3Å; S193-S196 VanDerWaalsContact O-N 3.07Å; S193-S196 PolarHBondContact O-OG 3.32Å
197	I	93.9	Very high	93	Very high	10 Å²	10	58 Å²	58	5%	0.051	32%	0.315	C	S	.	.	S	Bend	trans	-95.3	168.8	177.1	69.4	179.7	0	0	0	111	V152 I192 L194 L201 Q202 V234	V152-I197 HydrophobicContact CG2-CB 4.34Å; V152-I197 HydrophobicContact CG2-CD1 4.45Å; V152-I197 HydrophobicContact CG2-CG2 3.76Å; I192-I197 HydrophobicContact CG2-CG2 3.79Å; L194-I197 HydrophobicContact CD1-CD1 4.05Å; L194-I197 WeakPolarHBondContact O-CG1 3.5Å; I197-L201 HydrophobicContact CD1-CB 3.74Å; I197-L201 HydrophobicContact CG1-CB 4.2Å; I197-Q202 HydrophobicContact CD1-CG 4.36Å; I197-Q202 HydrophobicContact CG1-CG 3.81Å; I197-Q202 PolarHBondContact O-NE2 3.22Å; I197-V234 HydrophobicContact CD1-CG1 4.48Å; I197-V234 HydrophobicContact CD1-CG2 3.98Å; I197-V234 HydrophobicContact CG2-CG2 4.3Å
198	E	94.5	Very high	92.6	Very high	53 Å²	53	56.2 Å²	56.2	25%	0.248	30%	0.304	C	S	.	.			trans	-59.4	143.2	179	-60.7	89.3	155.6	0	0	112.6	G148 R149 D200 L201 Q202	G148-E198 VanDerWaalsContact CA-OE1 3.24Å; G148-E198 WeakPolarHBondContact CA-OE1 3.48Å; R149-E198 PolarHBondContact N-OE1 3.11Å; E198-D200 VanDerWaalsContact C-N 3.28Å; E198-D200 VanDerWaalsContact CB-OD1 3.26Å; E198-D200 WeakPolarHBondContact CB-OD1 3.38Å; E198-D200 PolarHBondContact O-N 3.33Å; E198-L201 HydrophobicContact CB-CD1 4.29Å; E198-L201 HydrophobicContact CB-CG 4.36Å; E198-L201 WeakPolarHBondContact O-CB 3.48Å; E198-L201 PolarHBondContact O-N 2.93Å; E198-Q202 WeakPolarHBondContact O-CG 3.44Å; E198-Q202 PolarHBondContact O-N 3.19Å
199	Q	92.6	Very high	91.7	Very high	165 Å²	165	55 Å²	55	77%	0.771	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-59.7	-34.7	-168.3	-171.8	177	2.5	0	0	113.7	L201 Q202	Q199-L201 VanDerWaalsContact C-N 3.26Å; Q199-L201 PolarHBondContact O-N 3.43Å; Q199-Q202 PolarHBondContact O-N 3.06Å
200	D	91.6	Very high	90.5	Very high	110 Å²	110	56.1 Å²	56.1	59%	0.588	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-67.2	-26.5	176.9	62.7	-51.2	0	0	0	112.7	E198	E198-D200 VanDerWaalsContact C-N 3.28Å; E198-D200 VanDerWaalsContact CB-OD1 3.26Å; E198-D200 WeakPolarHBondContact CB-OD1 3.38Å; E198-D200 PolarHBondContact O-N 3.33Å
201	L	93.5	Very high	88.7	Confident	3 Å²	3	58.9 Å²	58.9	2%	0.016	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-85.8	-13.4	178.3	-55.7	-179.6	0	0	0	113.5	V152 T163 I197 E198 Q199 T203	V152-L201 HydrophobicContact CB-CD1 4.28Å; V152-L201 HydrophobicContact CG2-CD1 4.35Å; T163-L201 WeakPolarHBondContact CB-O 3.28Å; T163-L201 PolarHBondContact OG1-O 2.88Å; I197-L201 HydrophobicContact CD1-CB 3.74Å; I197-L201 HydrophobicContact CG1-CB 4.2Å; E198-L201 HydrophobicContact CB-CD1 4.29Å; E198-L201 HydrophobicContact CB-CG 4.36Å; E198-L201 WeakPolarHBondContact O-CB 3.48Å; E198-L201 PolarHBondContact O-N 2.93Å; Q199-L201 VanDerWaalsContact C-N 3.26Å; Q199-L201 PolarHBondContact O-N 3.43Å; L201-T203 VanDerWaalsContact C-N 3.25Å; L201-T203 PolarHBondContact O-N 2.96Å
202	Q	93.1	Very high	86.9	Confident	65 Å²	65	60.7 Å²	60.7	30%	0.304	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-77.8	-8.6	-176.8	-56.7	-172.5	7.6	0	0	113.9	L194 I197 E198 Q199	L194-Q202 HydrophobicContact CD1-CB 4.27Å; L194-Q202 HydrophobicContact CG-CB 4.42Å; L194-Q202 VanDerWaalsContact O-CD 3.27Å; L194-Q202 VanDerWaalsContact O-CG 3.26Å; L194-Q202 WeakPolarHBondContact O-CG 3.47Å; L194-Q202 PolarHBondContact O-NE2 3.33Å; I197-Q202 HydrophobicContact CD1-CG 4.36Å; I197-Q202 HydrophobicContact CG1-CG 3.81Å; I197-Q202 PolarHBondContact O-NE2 3.22Å; E198-Q202 WeakPolarHBondContact O-CG 3.44Å; E198-Q202 PolarHBondContact O-N 3.19Å; Q199-Q202 PolarHBondContact O-N 3.06Å
203	T	90	Very high	84.8	Confident	82 Å²	82	64 Å²	64	50%	0.503	36%	0.364	S	S	.	.	S	Bend	trans	-111.8	171.2	-177.2	67.2	0	0	0	0	111.3	L201	L201-T203 VanDerWaalsContact C-N 3.25Å; L201-T203 PolarHBondContact O-N 2.96Å
204	N	89.9	Confident	82.9	Confident	96 Å²	96	70 Å²	70	51%	0.513	39%	0.387	S	S	.	.	S	Bend	trans	54.4	65.6	179.2	-63.6	-30.8	0	0	0	113.1	R162 T163	R162-N204 CarbonylContact C-O 3.56Å; R162-N204 WeakPolarHBondContact CA-O 3.2Å; R162-N204 WeakPolarHBondContact CB-O 3.31Å; R162-N204 HydrophobicContact CG-CB 4.41Å; T163-N204 PolarHBondContact N-O 3.36Å
205	L	91.6	Very high	81.2	Confident	1 Å²	1	70.4 Å²	70.4	1%	0.005	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	151.2	-172.6	-52.2	175	0	0	0	112.3	T163 L194 K226	T163-L205 HydrophobicContact CG2-CD2 4.18Å; T163-L205 WeakPolarHBondContact O-CA 3.21Å; L194-L205 HydrophobicContact CD1-CD1 4.3Å; L194-L205 HydrophobicContact CD1-CD2 3.89Å; L194-L205 HydrophobicContact CD2-CD1 3.87Å; L205-K226 PolarHBondContact O-N 2.96Å; L205-K226 VanDerWaalsContact O-N 3.16Å
206	I	90.5	Very high	80.2	Confident	5 Å²	5	71.3 Å²	71.3	3%	0.026	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	139.6	177.3	-168	145.5	0	0	0	111.9	R162 T163 V164 C165 A222	R162-I206 HydrophobicContact CB-CB 3.96Å; R162-I206 HydrophobicContact CB-CG2 3.64Å; T163-I206 PolarHBondContact O-N 3.5Å; V164-I206 WeakPolarHBondContact CA-O 3.31Å; V164-I206 HydrophobicContact CG2-CG2 4.18Å; C165-I206 PolarHBondContact N-O 3.32Å; I206-A222 HydrophobicContact CD1-CB 3.61Å; I206-A222 HydrophobicContact CG1-CB 4.22Å
207	S	87.8	Confident	79.6	Confident	5 Å²	5	69.7 Å²	69.7	4%	0.035	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	140.6	165.4	51.2	0	0	0	0	109.4	K226	S207-K226 WeakPolarHBondContact OG-CE 3.43Å
208	I	84.3	Confident	79.1	Confident	1 Å²	1	69.2 Å²	69.2	1%	0.005	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	100.8	177.2	-58	178.5	0	0	0	107.4	V155 V164 W169 L173 L218 A221 A222	V155-I208 HydrophobicContact CG2-CD1 4.1Å; V164-I208 HydrophobicContact CG1-CD1 3.93Å; V164-I208 HydrophobicContact CG1-CG1 4.23Å; V164-I208 HydrophobicContact CG2-CD1 4.01Å; W169-I208 HydrophobicContact CZ3-CD1 4.28Å; L173-I208 HydrophobicContact CD1-CB 4.3Å; L173-I208 HydrophobicContact CD1-CG2 4.03Å; L173-I208 HydrophobicContact CD2-CG2 3.8Å; I208-L218 HydrophobicContact CD1-CD2 3.92Å; I208-L218 HydrophobicContact CD1-CG 4.19Å; I208-A221 HydrophobicContact CG2-CB 3.88Å; I208-A222 HydrophobicContact CG1-CB 4.4Å
209	N	75.9	Confident	78.6	Confident	69 Å²	69	66.7 Å²	66.7	37%	0.369	36%	0.359	S	S	.	.			trans	-88.7	134.1	171	-169.9	-51.5	0	0	0	108.5	E168	E168-N209 VanDerWaalsContact OE2-CA 3.28Å; E168-N209 WeakPolarHBondContact OE2-CA 3.38Å; E168-N209 WeakPolarHBondContact OE2-CB 3.46Å; E168-N209 PolarHBondContact OE2-ND2 2.97Å
210	Y	69.6	Low	78	Confident	62 Å²	62	62.1 Å²	62.1	24%	0.243	35%	0.345	C	S	.	.			trans	-134.7	120.2	174.2	-167.7	-108.8	0	0	0	112	Q212 E214 V215 A221	Y210-Q212 VanDerWaalsContact CD1-O 3.28Å; Y210-Q212 WeakPolarHBondContact CD1-O 3.43Å; Y210-Q212 HydrophobicContact CE1-CB 4.21Å; Y210-Q212 WeakPolarHBondContact CE1-O 3.11Å; Y210-Q212 HydrophobicContact CE2-CB 4.09Å; Y210-Q212 VanDerWaalsContact OH-CB 3.3Å; Y210-Q212 WeakPolarHBondContact OH-CB 3.39Å; Y210-E214 WeakPolarHBondContact OH-CA 3.2Å; Y210-E214 PolarHBondContact OH-N 3.43Å; Y210-E214 PolarHBondContact OH-O 2.68Å; Y210-V215 HydrophobicContact CD1-CG2 3.21Å; Y210-V215 HydrophobicContact CD2-CG2 3.71Å; Y210-V215 HydrophobicContact CE1-CB 4.15Å; Y210-V215 HydrophobicContact CE1-CG2 2.97Å; Y210-V215 HydrophobicContact CE2-CB 4.31Å; Y210-V215 HydrophobicContact CE2-CG1 4.49Å; Y210-V215 HydrophobicContact CE2-CG2 3.57Å; Y210-V215 HydrophobicContact CG-CG2 3.55Å; Y210-V215 PolarHBondContact OH-N 2.83Å; Y210-V215 VanDerWaalsContact OH-N 3.15Å; Y210-A221 HydrophobicContact CD2-CB 3.8Å; Y210-A221 HydrophobicContact CE2-CB 4.5Å
211	S	57.5	Low	77	Confident	111 Å²	111	57.4 Å²	57.4	78%	0.776	32%	0.321	S	S	*	.			trans	-113.2	-1.5	-175.4	71.9	0	0	0	0	114.5
212	Q	58.3	Low	75.7	Confident	153 Å²	153	57.4 Å²	57.4	72%	0.715	32%	0.322	S	S	*	.	S	Bend	trans	-104.8	177.4	-179.9	-73.3	-178.4	-4.1	0	0	111.2	Y210	Y210-Q212 VanDerWaalsContact CD1-O 3.28Å; Y210-Q212 WeakPolarHBondContact CD1-O 3.43Å; Y210-Q212 HydrophobicContact CE1-CB 4.21Å; Y210-Q212 WeakPolarHBondContact CE1-O 3.11Å; Y210-Q212 HydrophobicContact CE2-CB 4.09Å; Y210-Q212 VanDerWaalsContact OH-CB 3.3Å; Y210-Q212 WeakPolarHBondContact OH-CB 3.39Å
213	A	51.1	Low	74.3	Confident	103 Å²	103	57.3 Å²	57.3	85%	0.851	33%	0.326	S	S	*	.	S	Bend	trans	-97.7	-12.1	-174.8	0	0	0	0	0	114.2
214	E	56.3	Low	72.9	Confident	163 Å²	163	60.7 Å²	60.7	76%	0.762	33%	0.334	S	S	*	.			trans	-129.7	85.5	-172.8	-67.6	-175.3	157.5	0	0	113.2	Y210 I216	Y210-E214 WeakPolarHBondContact OH-CA 3.2Å; Y210-E214 PolarHBondContact OH-N 3.43Å; Y210-E214 PolarHBondContact OH-O 2.68Å; E214-I216 PolarHBondContact O-N 3Å
215	V	57	Low	71.6	Confident	29 Å²	29	60.5 Å²	60.5	18%	0.176	34%	0.34	C	S	.	.			trans	-83.8	116.2	175.8	-166	0	0	0	0	109.6	L173 S176 Y210	L173-V215 HydrophobicContact CD2-CG2 4.46Å; S176-V215 PolarHBondContact OG-O 3.18Å; Y210-V215 HydrophobicContact CD1-CG2 3.21Å; Y210-V215 HydrophobicContact CD2-CG2 3.71Å; Y210-V215 HydrophobicContact CE1-CB 4.15Å; Y210-V215 HydrophobicContact CE1-CG2 2.97Å; Y210-V215 HydrophobicContact CE2-CB 4.31Å; Y210-V215 HydrophobicContact CE2-CG1 4.49Å; Y210-V215 HydrophobicContact CE2-CG2 3.57Å; Y210-V215 HydrophobicContact CG-CG2 3.55Å; Y210-V215 PolarHBondContact OH-N 2.83Å; Y210-V215 VanDerWaalsContact OH-N 3.15Å
216	I	71.5	Confident	70.6	Confident	137 Å²	137	63.1 Å²	63.1	70%	0.703	35%	0.351	S	S	*	.			trans	-99.6	-26.5	173.4	-55.1	179.8	0	0	0	111.9	E214	E214-I216 PolarHBondContact O-N 3Å
217	K	81.2	Confident	69.6	Low	40 Å²	40	73.2 Å²	73.2	17%	0.174	40%	0.395	C	S	.	.			trans	-149.7	141.7	176.7	-60.1	-164.8	-175.6	-175.2	0	114.4	E140 S220	E140-K217 VanDerWaalsContact CB-NZ 3.31Å; E140-K217 PolarHBondContact O-NZ 3.34Å; K217-S220 PolarHBondContact O-N 2.83Å
218	L	83.7	Confident	69.3	Low	0 Å²	0	79.5 Å²	79.5	0%	0	42%	0.424	C	S	.	.	H	α-helix	trans	-68.7	-37.7	-176.5	-94.1	68.6	0	0	0	113.9	V144 L153 V155 W169 A177 I208 S220 A221 A222	V144-L218 HydrophobicContact CG2-CB 4.26Å; V144-L218 HydrophobicContact CG2-CD2 4.48Å; L153-L218 HydrophobicContact CD2-CD2 4.33Å; V155-L218 HydrophobicContact CG1-CB 4.31Å; V155-L218 HydrophobicContact CG2-CB 4.11Å; V155-L218 HydrophobicContact CG2-CD2 3.79Å; W169-L218 HydrophobicContact CH2-CD2 4.23Å; W169-L218 HydrophobicContact CZ3-CD2 4.3Å; A177-L218 HydrophobicContact CB-CD1 4.09Å; A177-L218 HydrophobicContact CB-CD2 3.69Å; I208-L218 HydrophobicContact CD1-CD2 3.92Å; I208-L218 HydrophobicContact CD1-CG 4.19Å; L218-S220 PolarHBondContact O-N 3.3Å; L218-A221 PolarHBondContact O-N 3.03Å; L218-A221 VanDerWaalsContact O-N 3.15Å; L218-A222 PolarHBondContact O-N 2.9Å; L218-A222 VanDerWaalsContact O-N 3.13Å
219	Q	83.6	Confident	69.5	Low	0 Å²	0	79.5 Å²	79.5	0%	0	42%	0.424	C	S	.	.	H	α-helix	trans	-62	-27.2	-178.9	66.9	-89.6	24.7	0	0	112.8	C128 E140 C143 V155 Q156 K157	C128-Q219 HydrophobicContact CB-CB 4.28Å; C128-Q219 HydrophobicContact CB-CG 4.23Å; E140-Q219 PolarHBondContact OE2-NE2 2.88Å; C143-Q219 HydrophobicContact CB-CG 4.45Å; V155-Q219 HydrophobicContact CG1-CB 4.21Å; Q156-Q219 WeakPolarHBondContact O-CB 3.41Å; K157-Q219 PolarHBondContact NZ-O 3.01Å
220	S	79.6	Confident	70.1	Confident	69 Å²	69	80.9 Å²	80.9	48%	0.483	44%	0.439	S	S	.	.	H	α-helix	trans	-75	-36.7	177.5	-49.6	0	0	0	0	112.2	K217 L218	K217-S220 PolarHBondContact O-N 2.83Å; L218-S220 PolarHBondContact O-N 3.3Å
221	A	72	Confident	71.1	Confident	11 Å²	11	80.5 Å²	80.5	9%	0.091	45%	0.446	C	S	.	.	H	α-helix	trans	-80.3	-21	179.5	0	0	0	0	0	113.6	I208 Y210 L218 T223	I208-A221 HydrophobicContact CG2-CB 3.88Å; Y210-A221 HydrophobicContact CD2-CB 3.8Å; Y210-A221 HydrophobicContact CE2-CB 4.5Å; L218-A221 PolarHBondContact O-N 3.03Å; L218-A221 VanDerWaalsContact O-N 3.15Å; A221-T223 PolarHBondContact O-N 3.02Å; A221-T223 PolarHBondContact O-OG1 2.92Å; A221-T223 VanDerWaalsContact O-OG1 3.09Å
222	A	64.6	Low	72.8	Confident	4 Å²	4	76.4 Å²	76.4	3%	0.033	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	110.5	-173	0	0	0	0	0	111.7	K157 I206 I208 L218	K157-A222 HydrophobicContact CD-CB 4.29Å; K157-A222 PolarHBondContact NZ-O 3.32Å; I206-A222 HydrophobicContact CD1-CB 3.61Å; I206-A222 HydrophobicContact CG1-CB 4.22Å; I208-A222 HydrophobicContact CG1-CB 4.4Å; L218-A222 PolarHBondContact O-N 2.9Å; L218-A222 VanDerWaalsContact O-N 3.13Å
223	T	65.1	Low	74.6	Confident	63 Å²	63	72 Å²	72	39%	0.387	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	131.1	-178.8	-41.6	0	0	0	0	109.7	A221	A221-T223 PolarHBondContact O-N 3.02Å; A221-T223 PolarHBondContact O-OG1 2.92Å; A221-T223 VanDerWaalsContact O-OG1 3.09Å
224	F	59	Low	76.7	Confident	152 Å²	152	67.1 Å²	67.1	67%	0.667	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	76.7	121.8	-179.4	-47.6	-76.4	0	0	0	116.8
225	S	64.2	Low	78.6	Confident	92 Å²	92	59.3 Å²	59.3	64%	0.643	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	124.9	161.3	175	0	0	0	0	108.4
226	K	69.6	Low	80.5	Confident	56 Å²	56	58.4 Å²	58.4	24%	0.243	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	146.8	173.8	-68.7	-170.8	-179.3	-173.7	0	109.8	E167 L205 S207 Q228 S230	E167-K226 IonicContact OE2-NZ 2.68Å; E167-K226 PolarHBondContact OE2-NZ 3.17Å; L205-K226 PolarHBondContact O-N 2.96Å; L205-K226 VanDerWaalsContact O-N 3.16Å; S207-K226 WeakPolarHBondContact OG-CE 3.43Å; K226-Q228 VanDerWaalsContact C-N 3.33Å; K226-Q228 WeakPolarHBondContact CB-O 3.07Å; K226-S230 PolarHBondContact NZ-OG 3.46Å
227	K	69.6	Low	81.6	Confident	218 Å²	218	51.9 Å²	51.9	95%	0.948	29%	0.286	S	S	*	.	S	Bend	trans	-75.4	-24.1	168	-69.9	-171.8	177.6	-176.6	0	112.4
228	Q	81.7	Confident	82.3	Confident	137 Å²	137	53.8 Å²	53.8	64%	0.64	29%	0.294	S	S	*	.	S	Bend	trans	-152.8	145.7	-178.1	-166.5	170.3	-4	0	0	110.4	K226	K226-Q228 VanDerWaalsContact C-N 3.33Å; K226-Q228 WeakPolarHBondContact CB-O 3.07Å
229	C	88.3	Confident	82.7	Confident	1 Å²	1	54 Å²	54	1%	0.007	30%	0.296	C	S	.	.			trans	-73.4	122.2	165.6	-54	0	0	0	0	108.5	C165 E167 S231 G232	C165-C229 VanDerWaalsContact CA-SG 3.51Å; C165-C229 HydrophobicContact CB-CB 3.77Å; C165-C229 WeakPolarHBondContact CB-SG 3.35Å; C165-C229 VanDerWaalsContact SG-CA 3.52Å; C165-C229 WeakPolarHBondContact SG-CB 3.37Å; C165-C229 CovalentContact SG-SG 2.04Å; C165-C229 PolarHBondContact SG-SG 2.95Å; E167-C229 WeakPolarHBondContact OE1-CA 3.33Å; C229-S231 PolarHBondContact O-N 2.83Å; C229-G232 PolarHBondContact O-N 2.04Å
230	S	89.4	Confident	83.1	Confident	97 Å²	97	55.1 Å²	55.1	68%	0.678	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-31.9	172.6	-24.9	0	0	0	0	113.1	E167 K226	E167-S230 VanDerWaalsContact CD-CB 3.49Å; E167-S230 VanDerWaalsContact CD-OG 3.25Å; E167-S230 VanDerWaalsContact OE1-CA 3.24Å; E167-S230 WeakPolarHBondContact OE1-CA 3.43Å; E167-S230 WeakPolarHBondContact OE1-CB 3.13Å; E167-S230 PolarHBondContact OE1-N 3.29Å; E167-S230 PolarHBondContact OE1-OG 2.76Å; E167-S230 WeakPolarHBondContact OE2-CB 3.31Å; E167-S230 PolarHBondContact OE2-OG 2.89Å; K226-S230 PolarHBondContact NZ-OG 3.46Å
231	S	90.3	Very high	83.7	Confident	55 Å²	55	57.2 Å²	57.2	39%	0.385	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-17.1	174.3	64.8	0	0	0	0	114.1	S166 E167 C229 M233	S166-S231 PolarHBondContact OG-OG 3.15Å; E167-S231 PolarHBondContact OE1-N 2.83Å; C229-S231 PolarHBondContact O-N 2.83Å; S231-M233 PolarHBondContact O-N 3.13Å; S231-M233 PolarHBondContact OG-N 3.25Å; S231-M233 VanDerWaalsContact OG-N 3.07Å; S231-M233 PolarHBondContact OG-O 3.34Å
232	G	92.9	Very high	84.8	Confident	25 Å²	25	58 Å²	58	26%	0.258	31%	0.308	S	S	.	.	S	Bend	trans	69.1	8.6	-166.8	0	0	0	0	0	114.4	L194 C229	L194-G232 WeakPolarHBondContact CB-O 3.16Å; L194-G232 PolarHBondContact N-O 2.84Å; C229-G232 PolarHBondContact O-N 2.04Å
233	M	95.5	Very high	86.3	Confident	60 Å²	60	57.9 Å²	57.9	30%	0.296	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	147	-173.4	-55.4	-68.2	-75	0	0	111.5	S166 Y191 I192 S193 S231	S166-M233 PolarHBondContact N-O 3.01Å; S166-M233 PolarHBondContact OG-O 3.41Å; Y191-M233 VanDerWaalsContact C-CE 3.49Å; Y191-M233 VanDerWaalsContact O-CE 3.29Å; Y191-M233 WeakPolarHBondContact O-CE 3.46Å; I192-M233 VanDerWaalsContact C-CE 3.45Å; I192-M233 CarbonylContact O-C 3.58Å; I192-M233 VanDerWaalsContact O-CA 3.3Å; I192-M233 WeakPolarHBondContact O-CA 3.36Å; S193-M233 VanDerWaalsContact CA-SD 3.5Å; S231-M233 PolarHBondContact O-N 3.13Å; S231-M233 PolarHBondContact OG-N 3.25Å; S231-M233 VanDerWaalsContact OG-N 3.07Å; S231-M233 PolarHBondContact OG-O 3.34Å
234	V	95.8	Very high	87.7	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	159.6	175.3	-61.5	0	0	0	0	111	V152 T163 V164 Y191 I192 L194 I197	V152-V234 HydrophobicContact CG1-CB 4.49Å; V152-V234 HydrophobicContact CG1-CG2 4.1Å; V152-V234 HydrophobicContact CG2-CG2 4.44Å; T163-V234 HydrophobicContact CG2-CB 4.01Å; T163-V234 HydrophobicContact CG2-CG1 3.71Å; V164-V234 WeakPolarHBondContact O-CA 3.18Å; V164-V234 WeakPolarHBondContact O-CB 3.42Å; Y191-V234 WeakPolarHBondContact CA-O 3.2Å; I192-V234 HydrophobicContact CB-CG2 4.45Å; I192-V234 PolarHBondContact N-O 2.93Å; I192-V234 PolarHBondContact O-N 3.27Å; L194-V234 HydrophobicContact CB-CG1 4.48Å; L194-V234 HydrophobicContact CD1-CG1 3.57Å; I197-V234 HydrophobicContact CD1-CG1 4.48Å; I197-V234 HydrophobicContact CD1-CG2 3.98Å; I197-V234 HydrophobicContact CG2-CG2 4.3Å
235	T	96.1	Very high	89.4	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	127	179.6	-60	0	0	0	0	110.8	L153 V164 C165 S166 W169	L153-T235 HydrophobicContact CB-CG2 4.41Å; L153-T235 HydrophobicContact CD2-CG2 4.3Å; L153-T235 PolarHBondContact N-O 2.91Å; V164-T235 PolarHBondContact O-N 3.39Å; C165-T235 PolarHBondContact O-OG1 3.46Å; S166-T235 WeakPolarHBondContact CA-OG1 3.41Å; W169-T235 HydrophobicContact CD2-CG2 3.73Å; W169-T235 VanDerWaalsContact CE2-CG2 3.48Å; W169-T235 HydrophobicContact CE3-CG2 4.3Å; W169-T235 HydrophobicContact CG-CG2 4.04Å; W169-T235 HydrophobicContact CH2-CG2 4.44Å; W169-T235 HydrophobicContact CZ2-CG2 3.85Å
236	S	96.6	Very high	90.6	Very high	10 Å²	10	50.7 Å²	50.7	7%	0.07	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	141.9	163.5	169.8	0	0	0	0	109.3	S150 S151 S189 S190 I192	S150-S236 VanDerWaalsContact O-CB 3.28Å; S150-S236 WeakPolarHBondContact O-CB 3.31Å; S150-S236 PolarHBondContact O-OG 2.97Å; S151-S236 WeakPolarHBondContact O-CA 3.27Å; S151-S236 PolarHBondContact O-OG 3.23Å; S189-S236 WeakPolarHBondContact CA-O 3.37Å; S190-S236 PolarHBondContact N-O 3.28Å; S190-S236 PolarHBondContact O-N 3.38Å; S190-S236 WeakPolarHBondContact OG-CB 3.3Å; S190-S236 PolarHBondContact OG-OG 3.4Å; I192-S236 VanDerWaalsContact CD1-CB 3.5Å
237	L	95.5	Very high	91.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	135.8	-172.3	-174.5	70.5	0	0	0	110.7	L146 S151 L153 W169 A177 L181 V187 S189	L146-L237 WeakPolarHBondContact CD1-O 3.44Å; L146-L237 HydrophobicContact CD2-CB 3.86Å; L146-L237 HydrophobicContact CD2-CD2 4.42Å; S151-L237 PolarHBondContact O-N 2.86Å; S151-L237 VanDerWaalsContact O-N 3.15Å; L153-L237 HydrophobicContact CD1-CD2 4.04Å; L153-L237 HydrophobicContact CD2-CD2 4.48Å; W169-L237 HydrophobicContact CZ2-CD1 4.33Å; A177-L237 HydrophobicContact CB-CD2 3.53Å; L181-L237 HydrophobicContact CD1-CD2 4.3Å; V187-L237 HydrophobicContact CG1-CD1 4.09Å; S189-L237 WeakPolarHBondContact OG-CD1 3.39Å
238	K	94.3	Very high	92.2	Very high	80 Å²	80	44.7 Å²	44.7	35%	0.348	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	122.2	172.9	178.1	-179.5	162.3	-149.4	0	108.9	E188 I240	E188-K238 HydrophobicContact CB-CB 4.25Å; E188-K238 PolarHBondContact N-O 3.48Å; E188-K238 PolarHBondContact O-N 2.95Å; E188-K238 WeakPolarHBondContact OE2-CD 3.26Å; E188-K238 IonicContact OE2-NZ 3.67Å; E188-K238 PolarHBondContact OE2-NZ 2.88Å; K238-I240 WeakPolarHBondContact CE-O 3.04Å; K238-I240 WeakPolarHBondContact CG-O 3.4Å
239	C	93	Very high	91.9	Very high	5 Å²	5	46.8 Å²	46.8	3%	0.034	25%	0.252	C	S	.	.			trans	-109.3	-4.1	-172	-62.5	0	0	0	0	114.3	C178 Y183 H186	C178-C239 WeakPolarHBondContact CA-SG 3.08Å; C178-C239 HydrophobicContact CB-CB 3.62Å; C178-C239 WeakPolarHBondContact CB-SG 3.34Å; C178-C239 WeakPolarHBondContact SG-CA 3.39Å; C178-C239 WeakPolarHBondContact SG-CB 3.4Å; C178-C239 CovalentContact SG-SG 2.04Å; C178-C239 PolarHBondContact SG-SG 2.82Å; Y183-C239 WeakPolarHBondContact CB-O 2.97Å; Y183-C239 HydrophobicContact CD2-CB 3.18Å; Y183-C239 HydrophobicContact CE2-CB 3.72Å; Y183-C239 HydrophobicContact CG-CB 3.64Å; H186-C239 CarbonylContact O-C 3.36Å; H186-C239 VanDerWaalsContact O-C 3.32Å; H186-C239 VanDerWaalsContact O-CA 3.25Å; H186-C239 WeakPolarHBondContact O-CA 3.22Å
240	I	92.3	Very high	90.8	Very high	22 Å²	22	50.6 Å²	50.6	11%	0.113	28%	0.284	C	S	.	.	S	Bend	trans	-157	144.3	178.1	-170.5	165.6	0	0	0	108.6	Y183 K238 C242 P357	Y183-I240 HydrophobicContact CD1-CB 3.87Å; Y183-I240 HydrophobicContact CD1-CD1 4.16Å; Y183-I240 HydrophobicContact CD1-CG2 4.14Å; Y183-I240 HydrophobicContact CE1-CB 3.75Å; Y183-I240 HydrophobicContact CE1-CD1 3.92Å; Y183-I240 HydrophobicContact CE1-CG1 4.45Å; Y183-I240 HydrophobicContact CE1-CG2 3.51Å; K238-I240 WeakPolarHBondContact CE-O 3.04Å; K238-I240 WeakPolarHBondContact CG-O 3.4Å; I240-C242 HydrophobicContact CG2-CB 4.18Å; I240-P357 HydrophobicContact CD1-CB 4.11Å; I240-P357 HydrophobicContact CD1-CG 3.77Å; I240-P357 HydrophobicContact CG1-CG 4.14Å
241	E	92.8	Very high	89.1	Confident	114 Å²	114	56.6 Å²	56.6	53%	0.533	29%	0.292	S	S	.	.			trans	-83	119.3	163.5	-61.3	-170.7	148.2	0	0	107.8	H186 P357	H186-E241 VanDerWaalsContact CE1-CG 3.46Å; H186-E241 WeakPolarHBondContact CE1-CG 3.48Å; H186-E241 IonicContact CE1-OE1 3.37Å; E241-P357 VanDerWaalsContact O-CG 3.29Å; E241-P357 WeakPolarHBondContact O-CG 3.32Å
242	C	94.8	Very high	87.1	Confident	27 Å²	27	60 Å²	60	18%	0.182	30%	0.304	C	S	.	.			trans	-146.3	167	-173.7	57.6	0	0	0	0	110.7	I240 S244 P357 C359	I240-C242 HydrophobicContact CG2-CB 4.18Å; C242-S244 PolarHBondContact O-N 2.04Å; C242-P357 CarbonylContact C-O 3.51Å; C242-P357 VanDerWaalsContact CA-O 3.3Å; C242-P357 WeakPolarHBondContact CA-O 3.5Å; C242-P357 HydrophobicContact CB-CB 4.36Å; C242-P357 HydrophobicContact CB-CG 4.02Å; C242-P357 WeakPolarHBondContact CB-O 3.08Å; C242-C359 HydrophobicContact CB-CB 4.04Å; C242-C359 WeakPolarHBondContact CB-SG 3.13Å; C242-C359 PolarHBondContact O-SG 3.47Å; C242-C359 WeakPolarHBondContact SG-CA 3.26Å; C242-C359 WeakPolarHBondContact SG-CB 3.07Å; C242-C359 CovalentContact SG-SG 2.04Å; C242-C359 PolarHBondContact SG-SG 2.82Å
243	G	95.5	Very high	84.8	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.01	33%	0.332	C	S	.	.	S	Bend	trans	67.5	20.5	173	0	0	0	0	0	113.6	P357 W447	G243-P357 PolarHBondContact N-O 3.2Å; G243-W447 WeakPolarHBondContact CA-O 3.32Å; G243-W447 WeakPolarHBondContact O-CB 3.09Å; G243-W447 VanDerWaalsContact O-CD1 3.25Å; G243-W447 PolarHBondContact O-N 3.49Å
244	S	94.9	Very high	82.4	Confident	48 Å²	48	66.3 Å²	66.3	34%	0.336	36%	0.356	S	S	.	.			trans	-102.3	159.4	175.4	66.9	0	0	0	0	110.7	C242	C242-S244 PolarHBondContact O-N 2.04Å
245	R	93.4	Very high	80.4	Confident	35 Å²	35	68.6 Å²	68.6	13%	0.132	38%	0.38	C	S	.	.			trans	-132.6	64.1	177.7	-60.7	176.7	173.8	173.7	2.8	110.4	Q247 Y248 Q262 F263 P264 W265 W447	R245-Q247 VanDerWaalsContact C-N 3.33Å; R245-Q247 PolarHBondContact O-N 3.24Å; R245-Y248 PolarHBondContact O-N 3.04Å; R245-Y248 VanDerWaalsContact O-N 3.11Å; R245-Q262 WeakPolarHBondContact CD-O 3.46Å; R245-Q262 VanDerWaalsContact CZ-O 3.23Å; R245-Q262 PolarHBondContact NE-O 3.11Å; R245-F263 VanDerWaalsContact NH2-CE1 3.27Å; R245-P264 HydrophobicContact CG-CG 4.32Å; R245-W265 HydrophobicContact CG-CH2 3.86Å; R245-W265 HydrophobicContact CG-CZ3 3.86Å; R245-W265 VanDerWaalsContact NH2-CZ2 3.31Å; R245-W447 VanDerWaalsContact NH2-CE2 3.26Å; R245-W447 VanDerWaalsContact NH2-CZ2 3.33Å
246	P	90.6	Very high	79.2	Confident	73 Å²	73	73.6 Å²	73.6	47%	0.474	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-31.3	-164.4	27.6	-36.6	0	0	0	113.7	E356	P246-E356 HydrophobicContact CG-CG 4.24Å
247	Q	87.1	Confident	78.6	Confident	100 Å²	100	76.8 Å²	76.8	47%	0.467	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-7.3	178	-62.1	-63.2	-14.4	0	0	113.6	R245 G353 F354	R245-Q247 VanDerWaalsContact C-N 3.33Å; R245-Q247 PolarHBondContact O-N 3.24Å; Q247-G353 VanDerWaalsContact CG-C 3.46Å; Q247-G353 WeakPolarHBondContact CG-O 3.44Å; Q247-F354 HydrophobicContact CB-CD1 4.11Å; Q247-F354 HydrophobicContact CB-CE1 3.78Å; Q247-F354 HydrophobicContact CB-CE2 4.38Å; Q247-F354 HydrophobicContact CB-CZ 3.93Å; Q247-F354 HydrophobicContact CG-CD1 4.37Å; Q247-F354 HydrophobicContact CG-CD2 4.08Å; Q247-F354 HydrophobicContact CG-CE1 4.16Å; Q247-F354 HydrophobicContact CG-CE2 3.85Å; Q247-F354 HydrophobicContact CG-CG 4.33Å; Q247-F354 HydrophobicContact CG-CZ 3.9Å
248	Y	85.3	Confident	78.1	Confident	48 Å²	48	77 Å²	77	19%	0.188	43%	0.428	C	S	.	.			trans	-90.8	118.3	-178.8	-177.2	-110.1	0	0	0	111.8	R245 A250 K259 G261 Q262	R245-Y248 PolarHBondContact O-N 3.04Å; R245-Y248 VanDerWaalsContact O-N 3.11Å; Y248-A250 HydrophobicContact CE1-CB 3.84Å; Y248-K259 HydrophobicContact CD2-CB 4.49Å; Y248-K259 HydrophobicContact CE2-CB 4.18Å; Y248-K259 HydrophobicContact CE2-CD 4.26Å; Y248-G261 WeakPolarHBondContact CB-O 3.3Å; Y248-Q262 HydrophobicContact CD2-CB 3.58Å; Y248-Q262 HydrophobicContact CD2-CG 3.87Å; Y248-Q262 HydrophobicContact CE1-CG 4.26Å; Y248-Q262 HydrophobicContact CE2-CB 3.62Å; Y248-Q262 HydrophobicContact CE2-CG 3.48Å; Y248-Q262 VanDerWaalsContact CE2-CG 3.48Å; Y248-Q262 HydrophobicContact CG-CB 4.27Å; Y248-Q262 HydrophobicContact CG-CG 4.39Å
249	K	76.2	Confident	77.8	Confident	182 Å²	182	77.4 Å²	77.4	79%	0.791	43%	0.429	S	S	*	.			trans	-104.5	105.9	170.7	-64.5	-179.9	-176.7	175.8	0	109.3	R251	K249-R251 PolarHBondContact O-N 3.29Å
250	A	65.3	Low	77.6	Confident	80 Å²	80	80.9 Å²	80.9	66%	0.661	45%	0.451	S	S	*	.			trans	-63.5	106.2	177.2	0	0	0	0	0	110.1	Y248	Y248-A250 HydrophobicContact CE1-CB 3.84Å
251	R	52.2	Low	77.4	Confident	224 Å²	224	80.2 Å²	80.2	85%	0.845	45%	0.45	S	S	*	.			trans	-122.9	-10.5	178.9	-138.5	176.6	-178.7	161.8	0.8	114.8	K249	K249-R251 PolarHBondContact O-N 3.29Å
252	I	49.9	Very low	77.4	Confident	126 Å²	126	75.2 Å²	75.2	65%	0.646	43%	0.427	S	S	*	.			trans	-153.3	130.9	174.7	-53	-77.6	0	0	0	108.2
253	V	44.1	Very low	77.4	Confident	139 Å²	139	74.4 Å²	74.4	84%	0.842	42%	0.42	S	S	*	.	S	Bend	trans	-104.8	128	170.7	-179	0	0	0	0	107.5
254	G	45.5	Very low	77.4	Confident	78 Å²	78	74.4 Å²	74.4	80%	0.804	42%	0.42	S	S	*	.			trans	127.7	21.8	178.5	0	0	0	0	0	116.8
255	G	53.3	Low	77.5	Confident	49 Å²	49	72.1 Å²	72.1	51%	0.505	40%	0.404	S	S	.	.			trans	-104.6	139.8	178.7	0	0	0	0	0	113.4	V257	G255-V257 VanDerWaalsContact C-N 3.33Å
256	N	70.3	Confident	77.7	Confident	104 Å²	104	70.7 Å²	70.7	56%	0.556	40%	0.399	S	S	*	.	S	Bend	trans	-79.3	-12.6	173.5	-116	8.7	0	0	0	113.2	R392	N256-R392 VanDerWaalsContact CB-NH2 3.32Å; N256-R392 VanDerWaalsContact CG-NH2 3.32Å; N256-R392 PolarHBondContact ND2-NH2 2.76Å; N256-R392 WeakPolarHBondContact O-CA 3.47Å; N256-R392 VanDerWaalsContact O-CB 3.25Å; N256-R392 WeakPolarHBondContact O-CB 3.31Å; N256-R392 WeakPolarHBondContact O-CG 3.31Å; N256-R392 PolarHBondContact O-NE 3.45Å
257	V	83.9	Confident	78	Confident	77 Å²	77	67.2 Å²	67.2	47%	0.467	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-114.1	129.5	-178	-179	0	0	0	0	109.2	G255 V390	G255-V257 VanDerWaalsContact C-N 3.33Å; V257-V390 HydrophobicContact CG1-CB 4.29Å; V257-V390 HydrophobicContact CG1-CG2 4.17Å; V257-V390 HydrophobicContact CG2-CG2 4.16Å
258	S	86.1	Confident	78.4	Confident	6 Å²	6	62.5 Å²	62.5	4%	0.042	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-80.1	141.9	-177.6	-62.2	0	0	0	0	111.5	L391 R392 S393	S258-L391 VanDerWaalsContact CB-O 3.32Å; S258-L391 WeakPolarHBondContact CB-O 3.48Å; S258-L391 PolarHBondContact N-O 3.16Å; S258-L391 PolarHBondContact OG-O 3.29Å; S258-R392 VanDerWaalsContact OG-C 3.23Å; S258-R392 PolarHBondContact OG-O 3.32Å; S258-S393 VanDerWaalsContact OG-CB 3.28Å; S258-S393 WeakPolarHBondContact OG-CB 3.19Å; S258-S393 PolarHBondContact OG-N 2.97Å; S258-S393 PolarHBondContact OG-OG 3.11Å
259	K	88.1	Confident	78.8	Confident	88 Å²	88	60.2 Å²	60.2	38%	0.383	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-89.1	155.7	176.3	-62	-179.4	-177.7	174	0	111.2	Y248 G261 Q262	Y248-K259 HydrophobicContact CD2-CB 4.49Å; Y248-K259 HydrophobicContact CE2-CB 4.18Å; Y248-K259 HydrophobicContact CE2-CD 4.26Å; K259-G261 PolarHBondContact O-N 3.32Å; K259-Q262 HydrophobicContact CB-CB 4.47Å; K259-Q262 WeakPolarHBondContact O-CB 3.29Å; K259-Q262 PolarHBondContact O-N 2.9Å
260	P	88	Confident	79.7	Confident	77 Å²	77	51.8 Å²	51.8	50%	0.5	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	133.2	172	-28.8	36.2	0	0	0	111.8	Q262 T310 F354	P260-Q262 PolarHBondContact O-N 2.94Å; P260-T310 HydrophobicContact CB-CG2 4.34Å; P260-T310 HydrophobicContact CG-CG2 4.12Å; P260-F354 HydrophobicContact CB-CD1 4.27Å; P260-F354 HydrophobicContact CB-CE1 4.06Å
261	G	88.4	Confident	81	Confident	8 Å²	8	49.4 Å²	49.4	8%	0.082	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	1.6	-178.7	0	0	0	0	0	115.5	Y248 K259 P264	Y248-G261 WeakPolarHBondContact CB-O 3.3Å; K259-G261 PolarHBondContact O-N 3.32Å; G261-P264 WeakPolarHBondContact O-CD 3.25Å
262	Q	92.2	Very high	82.9	Confident	10 Å²	10	44.6 Å²	44.6	5%	0.047	27%	0.271	C	S	.	.	S	Bend	trans	-68.1	-37.7	177.8	-172.6	175.2	-13.9	0	0	112.4	R245 Y248 K259 P260	R245-Q262 WeakPolarHBondContact CD-O 3.46Å; R245-Q262 VanDerWaalsContact CZ-O 3.23Å; R245-Q262 PolarHBondContact NE-O 3.11Å; Y248-Q262 HydrophobicContact CD2-CB 3.58Å; Y248-Q262 HydrophobicContact CD2-CG 3.87Å; Y248-Q262 HydrophobicContact CE1-CG 4.26Å; Y248-Q262 HydrophobicContact CE2-CB 3.62Å; Y248-Q262 HydrophobicContact CE2-CG 3.48Å; Y248-Q262 VanDerWaalsContact CE2-CG 3.48Å; Y248-Q262 HydrophobicContact CG-CB 4.27Å; Y248-Q262 HydrophobicContact CG-CG 4.39Å; K259-Q262 HydrophobicContact CB-CB 4.47Å; K259-Q262 WeakPolarHBondContact O-CB 3.29Å; K259-Q262 PolarHBondContact O-N 2.9Å; P260-Q262 PolarHBondContact O-N 2.94Å
263	F	95	Very high	84.7	Confident	9 Å²	9	49.5 Å²	49.5	4%	0.039	28%	0.281	C	S	.	.	S	Bend	trans	-129.2	73.6	174.5	-56.4	-78.8	0	0	0	108.9	R245 W265 Q266 W374 S393	R245-F263 VanDerWaalsContact NH2-CE1 3.27Å; F263-W265 HydrophobicContact CD1-CZ2 4.11Å; F263-W265 PolarHBondContact O-N 3.19Å; F263-W265 VanDerWaalsContact O-N 3.11Å; F263-Q266 HydrophobicContact CB-CB 4.07Å; F263-Q266 VanDerWaalsContact O-CB 3.22Å; F263-Q266 WeakPolarHBondContact O-CB 3.43Å; F263-Q266 PolarHBondContact O-N 3.35Å; F263-W374 HydrophobicContact CE1-CB 3.82Å; F263-W374 HydrophobicContact CE1-CD2 4.25Å; F263-W374 HydrophobicContact CE1-CE3 4.17Å; F263-W374 HydrophobicContact CE1-CG 4.17Å; F263-W374 HydrophobicContact CZ-CB 4.32Å; F263-W374 HydrophobicContact CZ-CD2 4.02Å; F263-W374 AromaticContact CZ-CE3 3.52Å; F263-W374 HydrophobicContact CZ-CE3 3.52Å; F263-W374 HydrophobicContact CZ-CG 4.41Å; F263-W374 HydrophobicContact CZ-CZ3 4.09Å; F263-S393 VanDerWaalsContact CE2-OG 3.28Å; F263-S393 WeakPolarHBondContact CE2-OG 3.02Å
264	P	95.8	Very high	86.8	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.013	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-12.6	-169.9	30.1	-36.1	0	0	0	113.6	R245 G261 F354 V355 E356	R245-P264 HydrophobicContact CG-CG 4.32Å; G261-P264 WeakPolarHBondContact O-CD 3.25Å; P264-F354 WeakPolarHBondContact CA-O 3.27Å; P264-F354 WeakPolarHBondContact CB-O 3.48Å; P264-V355 WeakPolarHBondContact O-CA 3Å; P264-E356 CarbonylContact C-O 3.54Å; P264-E356 HydrophobicContact CB-CB 3.82Å; P264-E356 HydrophobicContact CB-CG 4.11Å; P264-E356 HydrophobicContact CG-CB 3.78Å; P264-E356 HydrophobicContact CG-CG 4.21Å; P264-E356 PolarHBondContact O-N 3.09Å; P264-E356 VanDerWaalsContact O-N 3.08Å
265	W	97.8	Very high	89	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-8.7	172.7	49.1	78.8	0	0	0	114.1	R245 F263 S280 I281 E356 I358 A440 W447	R245-W265 HydrophobicContact CG-CH2 3.86Å; R245-W265 HydrophobicContact CG-CZ3 3.86Å; R245-W265 VanDerWaalsContact NH2-CZ2 3.31Å; F263-W265 HydrophobicContact CD1-CZ2 4.11Å; F263-W265 PolarHBondContact O-N 3.19Å; F263-W265 VanDerWaalsContact O-N 3.11Å; W265-S280 CarbonylContact O-C 3.47Å; W265-S280 WeakPolarHBondContact O-CA 3.45Å; W265-I281 HydrophobicContact CB-CB 4.36Å; W265-I281 PolarHBondContact O-N 3.37Å; W265-E356 WeakPolarHBondContact CA-O 3.34Å; W265-E356 VanDerWaalsContact CB-O 3.26Å; W265-E356 WeakPolarHBondContact CB-O 3.22Å; W265-E356 PolarHBondContact N-O 2.84Å; W265-I358 HydrophobicContact CB-CB 3.81Å; W265-I358 HydrophobicContact CB-CG2 4.16Å; W265-I358 HydrophobicContact CD2-CB 3.75Å; W265-I358 HydrophobicContact CD2-CD1 4.09Å; W265-I358 HydrophobicContact CD2-CG1 4.14Å; W265-I358 HydrophobicContact CE3-CB 4.05Å; W265-I358 HydrophobicContact CE3-CG1 4.4Å; W265-I358 HydrophobicContact CG-CB 3.65Å; W265-I358 HydrophobicContact CG-CD1 4.3Å; W265-I358 HydrophobicContact CG-CG1 4.4Å; W265-I358 HydrophobicContact CG-CG2 4.24Å; W265-I358 HydrophobicContact CZ2-CD1 4.07Å; W265-A440 HydrophobicContact CZ2-CB 4.13Å; W265-W447 HydrophobicContact CH2-CB 3.27Å; W265-W447 AromaticContact CH2-CD1 3.95Å; W265-W447 AromaticContact CH2-CD2 3.85Å; W265-W447 HydrophobicContact CH2-CD2 3.85Å; W265-W447 HydrophobicContact CH2-CE3 4.33Å; W265-W447 AromaticContact CH2-CG 3.36Å; W265-W447 HydrophobicContact CH2-CG 3.36Å; W265-W447 HydrophobicContact CZ2-CB 3.92Å; W265-W447 HydrophobicContact CZ2-CD2 4.2Å; W265-W447 HydrophobicContact CZ2-CE3 4.21Å; W265-W447 HydrophobicContact CZ2-CG 4.09Å; W265-W447 HydrophobicContact CZ3-CB 3.88Å; W265-W447 HydrophobicContact CZ3-CG 4.22Å
266	Q	97.1	Very high	90.8	Very high	5 Å²	5	48.2 Å²	48.2	2%	0.023	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	135.2	-179.1	-179.8	68.3	47.9	0	0	110.4	F263 S376 W378 L391 P438	F263-Q266 HydrophobicContact CB-CB 4.07Å; F263-Q266 VanDerWaalsContact O-CB 3.22Å; F263-Q266 WeakPolarHBondContact O-CB 3.43Å; F263-Q266 PolarHBondContact O-N 3.35Å; Q266-S376 PolarHBondContact OE1-O 3.27Å; Q266-S376 PolarHBondContact OE1-OG 3.44Å; Q266-W378 HydrophobicContact CG-CE3 4.44Å; Q266-W378 HydrophobicContact CG-CH2 3.59Å; Q266-W378 HydrophobicContact CG-CZ3 3.45Å; Q266-W378 VanDerWaalsContact CG-CZ3 3.45Å; Q266-L391 HydrophobicContact CG-CD1 3.82Å; Q266-L391 HydrophobicContact CG-CD2 4.26Å; Q266-P438 VanDerWaalsContact OE1-CG 3.31Å
267	V	95.9	Very high	92	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	142.8	177.4	-179.6	0	0	0	0	110.4	L269 G278 G279 I281 I287 V305 V307	V267-L269 HydrophobicContact CG1-CD2 3.65Å; V267-L269 HydrophobicContact CG1-CG 4.28Å; V267-G278 CarbonylContact O-C 3.48Å; V267-G278 VanDerWaalsContact O-CA 3.3Å; V267-G278 WeakPolarHBondContact O-CA 3.11Å; V267-G279 PolarHBondContact N-O 2.02Å; V267-G279 PolarHBondContact O-N 3Å; V267-G279 VanDerWaalsContact O-N 3.11Å; V267-I281 HydrophobicContact CG2-CD1 4.36Å; V267-I281 HydrophobicContact CG2-CG1 3.57Å; V267-I287 HydrophobicContact CB-CG2 4.19Å; V267-I287 HydrophobicContact CG1-CG2 4.16Å; V267-I287 HydrophobicContact CG2-CD1 3.98Å; V267-I287 HydrophobicContact CG2-CG1 4.5Å; V267-I287 HydrophobicContact CG2-CG2 3.9Å; V267-V305 HydrophobicContact CG1-CG1 3.54Å; V267-V307 HydrophobicContact CG2-CG1 4.19Å
268	S	95.3	Very high	92.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	121.4	162.6	179.9	0	0	0	0	109	H270 H275 H306 Q312	S268-H270 PolarHBondContact OG-CD2 2.96Å; S268-H270 PolarHBondContact OG-NE2 3.43Å; S268-H275 PolarHBondContact OG-ND1 2.85Å; S268-H306 PolarHBondContact N-O 3.03Å; S268-H306 PolarHBondContact O-N 3.27Å; S268-Q312 PolarHBondContact OG-NE2 2.84Å; S268-Q312 VanDerWaalsContact OG-NE2 3.08Å
269	L	95.4	Very high	93.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	121.1	176.5	-57.5	179.6	0	0	0	109.3	V267 I276 C277 G278 I287 T289 W303 V305 I343	V267-L269 HydrophobicContact CG1-CD2 3.65Å; V267-L269 HydrophobicContact CG1-CG 4.28Å; L269-I276 PolarHBondContact O-N 3.42Å; L269-C277 WeakPolarHBondContact CA-O 3.42Å; L269-C277 HydrophobicContact CB-CB 4.44Å; L269-C277 WeakPolarHBondContact CB-O 3.18Å; L269-C277 HydrophobicContact CD1-CB 4.28Å; L269-C277 PolarHBondContact N-O 3.35Å; L269-C277 PolarHBondContact O-N 2.74Å; L269-G278 VanDerWaalsContact CD1-O 3.23Å; L269-G278 WeakPolarHBondContact CD1-O 3.12Å; L269-I287 HydrophobicContact CD2-CG2 4.45Å; L269-T289 HydrophobicContact CD1-CG2 3.83Å; L269-T289 WeakPolarHBondContact CD1-OG1 3.38Å; L269-W303 HydrophobicContact CB-CE3 4.18Å; L269-W303 HydrophobicContact CB-CZ3 3.82Å; L269-V305 HydrophobicContact CD2-CG2 3.79Å; L269-I343 HydrophobicContact CD1-CD1 3.66Å; L269-I343 HydrophobicContact CD2-CD1 3.76Å; L269-I343 HydrophobicContact CG-CD1 4.35Å
270	H	93.6	Very high	93.7	Very high	6 Å²	6	35.3 Å²	35.3	3%	0.028	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.7	179	-69.1	-128.8	0	0	0	110.4	S268 R273 E274 H275 W303 T304 H306 Q312	S268-H270 PolarHBondContact OG-CD2 2.96Å; S268-H270 PolarHBondContact OG-NE2 3.43Å; H270-R273 PolarHBondContact ND1-O 3.22Å; H270-E274 CarbonylContact C-O 3.32Å; H270-E274 WeakPolarHBondContact CA-O 3.14Å; H270-E274 WeakPolarHBondContact CB-O 3.46Å; H270-H275 PolarHBondContact ND1-N 2.6Å; H270-W303 VanDerWaalsContact O-CA 3.31Å; H270-W303 WeakPolarHBondContact O-CA 3.21Å; H270-T304 WeakPolarHBondContact CB-OG1 3.42Å; H270-T304 PolarHBondContact N-O 3.06Å; H270-T304 PolarHBondContact O-N 3.25Å; H270-H306 AromaticContact CD2-CD2 3.4Å; H270-H306 PolarHBondContact CD2-CD2 2.76Å; H270-H306 AromaticContact CD2-NE2 3.94Å; H270-H306 AromaticContact CG-CD2 3.83Å; H270-H306 AromaticContact CG-NE2 3.93Å; H270-H306 AromaticContact NE2-CD2 3.79Å; H270-Q312 PolarHBondContact CE1-OE1 2.69Å; H270-Q312 PolarHBondContact NE2-OE1 2.04Å
271	F	93.5	Very high	94.2	Very high	30 Å²	30	31.7 Å²	31.7	13%	0.132	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	126.7	167.4	-178.8	-103.9	0	0	0	107.9	R273 E274 I276 F297 L302 W303	F271-R273 PolarHBondContact O-N 3.12Å; F271-R273 VanDerWaalsContact O-N 3.11Å; F271-E274 PolarHBondContact N-O 3.4Å; F271-E274 PolarHBondContact O-N 2.84Å; F271-I276 HydrophobicContact CB-CG1 3.78Å; F271-F297 HydrophobicContact CD2-CB 4.41Å; F271-F297 AromaticContact CE1-CD1 3.92Å; F271-F297 HydrophobicContact CE1-CD1 3.92Å; F271-F297 HydrophobicContact CE1-CE1 4.31Å; F271-F297 HydrophobicContact CE2-CB 4.05Å; F271-F297 HydrophobicContact CE2-CD1 4.15Å; F271-F297 HydrophobicContact CZ-CB 4.44Å; F271-F297 AromaticContact CZ-CD1 3.67Å; F271-F297 HydrophobicContact CZ-CD1 3.67Å; F271-F297 HydrophobicContact CZ-CE1 4.44Å; F271-F297 HydrophobicContact CZ-CG 4.45Å; F271-L302 HydrophobicContact CD2-CB 3.91Å; F271-L302 HydrophobicContact CE2-CB 3.49Å; F271-L302 VanDerWaalsContact CE2-CB 3.49Å; F271-L302 HydrophobicContact CE2-CD1 3.7Å; F271-L302 HydrophobicContact CE2-CG 4.26Å; F271-L302 HydrophobicContact CZ-CB 4.21Å; F271-L302 HydrophobicContact CZ-CD1 3.73Å; F271-W303 HydrophobicContact CB-CD2 4.38Å; F271-W303 HydrophobicContact CB-CE3 4.33Å; F271-W303 HydrophobicContact CB-CH2 4.19Å; F271-W303 HydrophobicContact CB-CZ2 4.23Å; F271-W303 HydrophobicContact CB-CZ3 4.24Å; F271-W303 AromaticContact CD2-CD1 3.93Å; F271-W303 HydrophobicContact CD2-CD2 4.13Å; F271-W303 AromaticContact CD2-CE2 3.63Å; F271-W303 HydrophobicContact CD2-CG 4.32Å; F271-W303 HydrophobicContact CD2-CZ2 4.01Å; F271-W303 AromaticContact CD2-NE1 3.51Å; F271-W303 AromaticContact CE2-NE1 3.95Å; F271-W303 HydrophobicContact CG-CZ2 4.43Å
272	Q	92.1	Very high	94.6	Very high	123 Å²	123	31.4 Å²	31.4	58%	0.575	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.2	38.1	-177.9	-63.5	-176.4	-24.1	0	0	113.7	E274 L302	Q272-E274 VanDerWaalsContact C-N 3.29Å; Q272-E274 PolarHBondContact O-N 3.17Å; Q272-L302 HydrophobicContact CG-CB 4.43Å; Q272-L302 HydrophobicContact CG-CD2 4.4Å; Q272-L302 PolarHBondContact N-O 3.25Å
273	R	87.6	Confident	94.7	Very high	228 Å²	228	31.2 Å²	31.2	86%	0.86	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.5	-4.1	-179.6	-49	174	-179.4	-175.2	-0.5	115.8	H270 F271	H270-R273 PolarHBondContact ND1-O 3.22Å; F271-R273 PolarHBondContact O-N 3.12Å; F271-R273 VanDerWaalsContact O-N 3.11Å
274	E	88.6	Confident	94.6	Very high	138 Å²	138	31.7 Å²	31.7	65%	0.645	14%	0.143	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	138.9	178.2	-65.7	-177.2	173.5	0	0	111.1	H270 F271 Q272 I276	H270-E274 CarbonylContact C-O 3.32Å; H270-E274 WeakPolarHBondContact CA-O 3.14Å; H270-E274 WeakPolarHBondContact CB-O 3.46Å; F271-E274 PolarHBondContact N-O 3.4Å; F271-E274 PolarHBondContact O-N 2.84Å; Q272-E274 VanDerWaalsContact C-N 3.29Å; Q272-E274 PolarHBondContact O-N 3.17Å; E274-I276 HydrophobicContact CB-CD1 4.49Å; E274-I276 PolarHBondContact O-N 2.78Å
275	H	90.6	Very high	94.6	Very high	29 Å²	29	32.8 Å²	32.8	13%	0.134	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	124.8	173.4	172.1	74.3	0	0	0	109.9	S268 H270 C277 G433	S268-H275 PolarHBondContact OG-ND1 2.85Å; H270-H275 PolarHBondContact ND1-N 2.6Å; H275-C277 VanDerWaalsContact CE1-C 3.47Å; H275-C277 PolarHBondContact CE1-O 3.5Å; H275-G433 PolarHBondContact NE2-O 2.75Å
276	I	91.6	Very high	94.5	Very high	72 Å²	72	32.9 Å²	32.9	37%	0.369	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	-38.4	177.8	-56.4	-60.6	0	0	0	111.7	L269 F271 E274	L269-I276 PolarHBondContact O-N 3.42Å; F271-I276 HydrophobicContact CB-CG1 3.78Å; E274-I276 HydrophobicContact CB-CD1 4.49Å; E274-I276 PolarHBondContact O-N 2.78Å
277	C	95.6	Very high	94.6	Very high	4 Å²	4	32.7 Å²	32.7	3%	0.027	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	162.3	-174.7	-82.5	0	0	0	0	112.5	L269 H275 C293 S435	L269-C277 WeakPolarHBondContact CA-O 3.42Å; L269-C277 HydrophobicContact CB-CB 4.44Å; L269-C277 WeakPolarHBondContact CB-O 3.18Å; L269-C277 HydrophobicContact CD1-CB 4.28Å; L269-C277 PolarHBondContact N-O 3.35Å; L269-C277 PolarHBondContact O-N 2.74Å; H275-C277 VanDerWaalsContact CE1-C 3.47Å; H275-C277 PolarHBondContact CE1-O 3.5Å; C277-C293 HydrophobicContact CB-CB 3.73Å; C277-C293 WeakPolarHBondContact CB-SG 3.31Å; C277-C293 WeakPolarHBondContact SG-CB 3.15Å; C277-C293 CovalentContact SG-SG 2.03Å; C277-C293 PolarHBondContact SG-SG 3.04Å; C277-S435 CarbonylContact C-O 3.6Å; C277-S435 VanDerWaalsContact CB-O 3.28Å; C277-S435 WeakPolarHBondContact CB-O 3.01Å; C277-S435 VanDerWaalsContact SG-CB 3.6Å
278	G	96.4	Very high	94.7	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.01	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	177.4	164.5	0	0	0	0	0	114	V267 L269 T289 S435 G436	V267-G278 CarbonylContact O-C 3.48Å; V267-G278 VanDerWaalsContact O-CA 3.3Å; V267-G278 WeakPolarHBondContact O-CA 3.11Å; L269-G278 VanDerWaalsContact CD1-O 3.23Å; L269-G278 WeakPolarHBondContact CD1-O 3.12Å; G278-T289 PolarHBondContact O-OG1 3.43Å; G278-S435 WeakPolarHBondContact CA-O 3.39Å; G278-S435 PolarHBondContact N-O 3.05Å; G278-G436 CarbonylContact O-C 3.48Å
279	G	98	Very high	94.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.6	174.8	173.5	0	0	0	0	0	111.6	V267 L288 G436	V267-G279 PolarHBondContact N-O 2.02Å; V267-G279 PolarHBondContact O-N 3Å; V267-G279 VanDerWaalsContact O-N 3.11Å; G279-L288 CarbonylContact C-O 3.51Å; G279-L288 VanDerWaalsContact CA-O 3.27Å; G279-L288 WeakPolarHBondContact CA-O 3.07Å; G279-G436 WeakPolarHBondContact CA-O 3.38Å
280	S	98.6	Very high	95	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	130	178.7	-58.1	0	0	0	0	111.7	W265 I282 I287 L288 P438	W265-S280 CarbonylContact O-C 3.47Å; W265-S280 WeakPolarHBondContact O-CA 3.45Å; S280-I282 PolarHBondContact O-N 2.87Å; S280-I287 CarbonylContact O-C 3.54Å; S280-I287 WeakPolarHBondContact O-CA 3.26Å; S280-L288 PolarHBondContact N-O 2.94Å; S280-L288 PolarHBondContact O-N 3.14Å; S280-P438 WeakPolarHBondContact OG-CB 3.07Å
281	I	98.2	Very high	95.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	118.5	170.7	-55.8	170.9	0	0	0	108.6	W265 V267 T283 I287 V307 L349 F351 V355 P357 I358	W265-I281 HydrophobicContact CB-CB 4.36Å; W265-I281 PolarHBondContact O-N 3.37Å; V267-I281 HydrophobicContact CG2-CD1 4.36Å; V267-I281 HydrophobicContact CG2-CG1 3.57Å; I281-T283 VanDerWaalsContact CG2-O 3.3Å; I281-T283 WeakPolarHBondContact CG2-O 3.31Å; I281-I287 HydrophobicContact CB-CD1 4.19Å; I281-I287 HydrophobicContact CG1-CD1 3.72Å; I281-I287 HydrophobicContact CG2-CD1 4.41Å; I281-V307 HydrophobicContact CD1-CB 4.3Å; I281-V307 HydrophobicContact CD1-CG1 3.92Å; I281-V307 HydrophobicContact CG1-CG1 4.4Å; I281-L349 HydrophobicContact CB-CD1 4.45Å; I281-L349 HydrophobicContact CD1-CD1 3.95Å; I281-L349 HydrophobicContact CG1-CD1 4.05Å; I281-L349 HydrophobicContact CG2-CD1 3.56Å; I281-F351 HydrophobicContact CG2-CE1 4.21Å; I281-V355 HydrophobicContact CD1-CG1 3.59Å; I281-P357 HydrophobicContact CG2-CB 4.06Å; I281-P357 CarbonylContact O-C 3.52Å; I281-P357 VanDerWaalsContact O-CA 3.27Å; I281-P357 WeakPolarHBondContact O-CA 3.17Å; I281-I358 WeakPolarHBondContact O-CG2 3.28Å; I281-I358 PolarHBondContact O-N 3.46Å
282	I	97.2	Very high	95.3	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.01	15%	0.154	C	C	.	.			trans	-111.8	-22.1	178.3	59	164	0	0	0	112.8	S280 W286 L288 L342 I358 L360 L449 I478 I482	S280-I282 PolarHBondContact O-N 2.87Å; I282-W286 HydrophobicContact CD1-CB 4.19Å; I282-W286 HydrophobicContact CG1-CB 3.93Å; I282-W286 VanDerWaalsContact CG1-O 3.27Å; I282-W286 WeakPolarHBondContact CG1-O 3.48Å; I282-W286 PolarHBondContact N-O 2.84Å; I282-W286 VanDerWaalsContact N-O 3.1Å; I282-L288 HydrophobicContact CD1-CB 4.3Å; I282-L288 HydrophobicContact CG2-CB 3.9Å; I282-L288 HydrophobicContact CG2-CD2 4.49Å; I282-L342 HydrophobicContact CD1-CD2 3.64Å; I282-I358 HydrophobicContact CG2-CG2 4.4Å; I282-L360 HydrophobicContact CG2-CD2 3.91Å; I282-L360 HydrophobicContact CG2-CG 4.46Å; I282-L449 HydrophobicContact CG2-CD2 4.19Å; I282-I478 HydrophobicContact CD1-CG2 3.98Å; I282-I482 HydrophobicContact CD1-CD1 3.95Å
283	T	94.8	Very high	95.4	Very high	6 Å²	6	27.9 Å²	27.9	4%	0.037	13%	0.129	C	C	.	.	S	Bend	trans	-148.3	179.2	168.7	81.8	0	0	0	0	109.3	Y183 I281 S285 W286 I482	Y183-T283 HydrophobicContact CD1-CG2 4.28Å; Y183-T283 HydrophobicContact CE1-CG2 3.83Å; I281-T283 VanDerWaalsContact CG2-O 3.3Å; I281-T283 WeakPolarHBondContact CG2-O 3.31Å; T283-S285 PolarHBondContact O-N 2.92Å; T283-S285 VanDerWaalsContact O-N 3.13Å; T283-S285 PolarHBondContact OG1-N 3.25Å; T283-S285 VanDerWaalsContact OG1-N 3.16Å; T283-W286 HydrophobicContact CG2-CB 4.45Å; T283-W286 PolarHBondContact N-O 3.26Å; T283-W286 WeakPolarHBondContact OG1-CB 2.95Å; T283-W286 PolarHBondContact OG1-N 3.08Å; T283-I482 HydrophobicContact CG2-CD1 4.49Å
284	S	93.8	Very high	95.8	Very high	19 Å²	19	17 Å²	17	13%	0.133	9%	0.088	C	C	.	.	S	Bend	trans	-61.6	-20.6	175.9	62.1	0	0	0	0	113.6	P348 L349	S284-P348 CarbonylContact O-C 3.56Å; S284-P348 WeakPolarHBondContact O-CA 3.27Å; S284-L349 WeakPolarHBondContact O-CB 3.28Å; S284-L349 WeakPolarHBondContact O-CG 3.29Å; S284-L349 PolarHBondContact O-N 3.17Å
285	S	94.4	Very high	96.1	Very high	26 Å²	26	13.6 Å²	13.6	18%	0.182	7%	0.069	C	C	.	.	S	Bend	trans	-124.2	-1	-171.7	-52	0	0	0	0	113.6	T283 R344 L345	T283-S285 PolarHBondContact O-N 2.92Å; T283-S285 VanDerWaalsContact O-N 3.13Å; T283-S285 PolarHBondContact OG1-N 3.25Å; T283-S285 VanDerWaalsContact OG1-N 3.16Å; S285-R344 WeakPolarHBondContact O-CA 3.29Å; S285-L345 PolarHBondContact O-N 3.29Å
286	W	96.6	Very high	96.2	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.008	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	127.7	-171.5	-69	100.2	0	0	0	111.4	I282 T283 I326 L342 R344 I482 K485	I282-W286 HydrophobicContact CD1-CB 4.19Å; I282-W286 HydrophobicContact CG1-CB 3.93Å; I282-W286 VanDerWaalsContact CG1-O 3.27Å; I282-W286 WeakPolarHBondContact CG1-O 3.48Å; I282-W286 PolarHBondContact N-O 2.84Å; I282-W286 VanDerWaalsContact N-O 3.1Å; T283-W286 HydrophobicContact CG2-CB 4.45Å; T283-W286 PolarHBondContact N-O 3.26Å; T283-W286 WeakPolarHBondContact OG1-CB 2.95Å; T283-W286 PolarHBondContact OG1-N 3.08Å; W286-I326 HydrophobicContact CH2-CD1 3.75Å; W286-I326 HydrophobicContact CZ3-CD1 3.95Å; W286-L342 HydrophobicContact CE3-CB 3.89Å; W286-L342 HydrophobicContact CE3-CD1 4.44Å; W286-L342 HydrophobicContact CE3-CD2 4.2Å; W286-L342 HydrophobicContact CE3-CG 4.42Å; W286-L342 HydrophobicContact CZ3-CB 3.84Å; W286-L342 HydrophobicContact CZ3-CD1 4.41Å; W286-R344 HydrophobicContact CD2-CB 4.33Å; W286-R344 HydrophobicContact CD2-CG 4.4Å; W286-R344 HydrophobicContact CE3-CB 3.87Å; W286-R344 HydrophobicContact CE3-CG 4.42Å; W286-R344 HydrophobicContact CH2-CB 3.94Å; W286-R344 HydrophobicContact CH2-CG 4.27Å; W286-R344 HydrophobicContact CZ2-CB 4.35Å; W286-R344 HydrophobicContact CZ2-CG 4.2Å; W286-R344 HydrophobicContact CZ3-CB 3.67Å; W286-R344 HydrophobicContact CZ3-CG 4.37Å; W286-I482 HydrophobicContact CD2-CG1 4.3Å; W286-I482 HydrophobicContact CG-CG1 4.28Å; W286-K485 HydrophobicContact CZ2-CB 4.27Å
287	I	98.2	Very high	96.2	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135.6	171.4	-50.3	-51.9	0	0	0	108.3	V267 L269 S280 I281 V305 L342 I343 L345 L349	V267-I287 HydrophobicContact CB-CG2 4.19Å; V267-I287 HydrophobicContact CG1-CG2 4.16Å; V267-I287 HydrophobicContact CG2-CD1 3.98Å; V267-I287 HydrophobicContact CG2-CG1 4.5Å; V267-I287 HydrophobicContact CG2-CG2 3.9Å; L269-I287 HydrophobicContact CD2-CG2 4.45Å; S280-I287 CarbonylContact O-C 3.54Å; S280-I287 WeakPolarHBondContact O-CA 3.26Å; I281-I287 HydrophobicContact CB-CD1 4.19Å; I281-I287 HydrophobicContact CG1-CD1 3.72Å; I281-I287 HydrophobicContact CG2-CD1 4.41Å; I287-V305 HydrophobicContact CG1-CG1 4.17Å; I287-L342 WeakPolarHBondContact O-CA 3.1Å; I287-I343 HydrophobicContact CB-CB 4.22Å; I287-I343 PolarHBondContact N-O 3.37Å; I287-I343 PolarHBondContact O-N 3.24Å; I287-L345 HydrophobicContact CD1-CD1 4.25Å; I287-L345 HydrophobicContact CG1-CD1 4.42Å; I287-L345 HydrophobicContact CG1-CD2 4.1Å; I287-L345 HydrophobicContact CG1-CG 4.31Å; I287-L349 HydrophobicContact CD1-CD1 4.28Å
288	L	98.6	Very high	95.9	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	137.8	171.9	-161.9	70.5	0	0	0	109.8	G279 S280 I282 I340 L342 L449 V452 I471 I478	G279-L288 CarbonylContact C-O 3.51Å; G279-L288 VanDerWaalsContact CA-O 3.27Å; G279-L288 WeakPolarHBondContact CA-O 3.07Å; S280-L288 PolarHBondContact N-O 2.94Å; S280-L288 PolarHBondContact O-N 3.14Å; I282-L288 HydrophobicContact CD1-CB 4.3Å; I282-L288 HydrophobicContact CG2-CB 3.9Å; I282-L288 HydrophobicContact CG2-CD2 4.49Å; L288-I340 HydrophobicContact CD1-CD1 3.86Å; L288-I340 HydrophobicContact CD1-CG1 3.88Å; L288-I340 HydrophobicContact CD2-CD1 4.24Å; L288-I340 HydrophobicContact CG-CD1 4.31Å; L288-I340 HydrophobicContact CG-CG1 4.31Å; L288-L342 HydrophobicContact CD1-CD2 3.47Å; L288-L342 VanDerWaalsContact CD1-CD2 3.47Å; L288-L342 HydrophobicContact CD1-CG 3.95Å; L288-L449 HydrophobicContact CB-CD2 4.49Å; L288-L449 HydrophobicContact CD2-CD2 3.59Å; L288-V452 HydrophobicContact CD2-CG2 3.9Å; L288-V452 HydrophobicContact CG-CG2 4.22Å; L288-I471 HydrophobicContact CD2-CD1 3.61Å; L288-I478 HydrophobicContact CD1-CD1 4.01Å; L288-I478 HydrophobicContact CD1-CG1 4.01Å; L288-I478 HydrophobicContact CD2-CD1 3.87Å
289	T	98.5	Very high	95.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	-177.4	178	-170.6	0	0	0	0	110.1	L269 G278 A341 I343 G436	L269-T289 HydrophobicContact CD1-CG2 3.83Å; L269-T289 WeakPolarHBondContact CD1-OG1 3.38Å; G278-T289 PolarHBondContact O-OG1 3.43Å; T289-A341 HydrophobicContact CG2-CB 4.11Å; T289-A341 PolarHBondContact N-O 2.81Å; T289-A341 PolarHBondContact O-N 3Å; T289-A341 VanDerWaalsContact O-O 3.11Å; T289-I343 HydrophobicContact CG2-CD1 3.88Å; T289-I343 HydrophobicContact CG2-CG1 4.12Å; T289-G436 WeakPolarHBondContact OG1-CA 3.36Å
290	A	97.8	Very high	95.7	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.144	C	C	.	.			trans	-80.5	150.1	176.9	0	0	0	0	0	111.4	H292 V452	A290-H292 WeakPolarHBondContact CB-ND1 3.28Å; A290-V452 HydrophobicContact CB-CG1 4.12Å
291	A	97.6	Very high	95.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.176	C	C	.	.	S	Bend	trans	-68.6	-36.2	176.7	0	0	0	0	0	112.1	C293 V294 Y295 R327 Y331 D339	A291-C293 PolarHBondContact O-N 3.42Å; A291-V294 WeakPolarHBondContact O-CG2 3.36Å; A291-V294 PolarHBondContact O-N 3.14Å; A291-V294 VanDerWaalsContact O-N 3.15Å; A291-Y295 PolarHBondContact O-N 3.29Å; A291-R327 HydrophobicContact CB-CG 3.46Å; A291-R327 VanDerWaalsContact CB-CG 3.46Å; A291-Y331 HydrophobicContact CB-CD1 3.56Å; A291-Y331 HydrophobicContact CB-CD2 3.62Å; A291-Y331 HydrophobicContact CB-CE1 3.97Å; A291-Y331 HydrophobicContact CB-CE2 4.04Å; A291-Y331 HydrophobicContact CB-CG 3.35Å; A291-D339 WeakPolarHBondContact CA-OD1 3.36Å; A291-D339 VanDerWaalsContact CB-OD1 3.31Å; A291-D339 WeakPolarHBondContact CB-OD1 3.19Å; A291-D339 PolarHBondContact N-OD1 3.16Å
292	H	95.6	Very high	95.4	Very high	54 Å²	54	33.4 Å²	33.4	25%	0.25	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-30	-178.9	76.8	-105.8	0	0	0	112.6	A290 V294 Y331 D339 S435 S454	A290-H292 WeakPolarHBondContact CB-ND1 3.28Å; H292-V294 PolarHBondContact O-N 3.46Å; H292-Y331 WeakPolarHBondContact CA-OH 3.17Å; H292-Y331 HydrophobicContact CB-CE1 4.48Å; H292-Y331 HydrophobicContact CB-CE2 4.42Å; H292-Y331 WeakPolarHBondContact CB-OH 3.5Å; H292-D339 IonicContact CE1-OD2 2.78Å; H292-D339 IonicContact CG-OD1 3.92Å; H292-D339 IonicContact CG-OD2 3.17Å; H292-D339 PolarHBondContact N-OD1 3.1Å; H292-D339 IonicContact ND1-OD1 2.72Å; H292-D339 PolarHBondContact ND1-OD1 2.56Å; H292-D339 IonicContact ND1-OD2 3.86Å; H292-D339 PolarHBondContact ND1-OD2 3.09Å; H292-S435 PolarHBondContact CE1-OG 3.46Å; H292-S435 VanDerWaalsContact CE1-OG 3.31Å; H292-S435 WeakPolarHBondContact NE2-CB 3.44Å; H292-S435 PolarHBondContact NE2-OG 3.41Å; H292-S454 PolarHBondContact CE1-O 3.47Å
293	C	95.8	Very high	95.3	Very high	5 Å²	5	33.6 Å²	33.6	3%	0.034	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-32.8	175.8	-67.2	0	0	0	0	112.9	C277 A291 W303	C277-C293 HydrophobicContact CB-CB 3.73Å; C277-C293 WeakPolarHBondContact CB-SG 3.31Å; C277-C293 WeakPolarHBondContact SG-CB 3.15Å; C277-C293 CovalentContact SG-SG 2.03Å; C277-C293 PolarHBondContact SG-SG 3.04Å; A291-C293 PolarHBondContact O-N 3.42Å; C293-W303 VanDerWaalsContact O-CH2 3.27Å; C293-W303 WeakPolarHBondContact O-CH2 3.27Å; C293-W303 WeakPolarHBondContact O-CZ2 3.23Å
294	V	95.8	Very high	95.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-4.8	-172	-60.6	0	0	0	0	113.6	A291 H292 G296 F297 W303 I325 R327 A341 I343	A291-V294 WeakPolarHBondContact O-CG2 3.36Å; A291-V294 PolarHBondContact O-N 3.14Å; A291-V294 VanDerWaalsContact O-N 3.15Å; H292-V294 PolarHBondContact O-N 3.46Å; V294-G296 PolarHBondContact O-N 3.03Å; V294-F297 CarbonylContact O-C 3.23Å; V294-F297 PolarHBondContact O-N 2.92Å; V294-W303 HydrophobicContact CB-CZ2 4.42Å; V294-W303 HydrophobicContact CG1-CH2 4.11Å; V294-W303 HydrophobicContact CG1-CZ2 3.9Å; V294-I325 HydrophobicContact CB-CG2 3.78Å; V294-I325 HydrophobicContact CG1-CD1 4.31Å; V294-I325 HydrophobicContact CG1-CG2 3.87Å; V294-I325 HydrophobicContact CG2-CG2 3.75Å; V294-R327 HydrophobicContact CG2-CB 4.4Å; V294-A341 HydrophobicContact CG2-CB 3.74Å; V294-I343 HydrophobicContact CG1-CD1 4.41Å
295	Y	94.7	Very high	95.4	Very high	65 Å²	65	34.4 Å²	34.4	26%	0.255	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	118.9	-176.9	-177.6	-87.1	0	0	0	111	A291 F297 Y331 W332 P333	A291-Y295 PolarHBondContact O-N 3.29Å; Y295-F297 VanDerWaalsContact O-CD2 3.29Å; Y295-F297 WeakPolarHBondContact O-CD2 3.4Å; Y295-F297 PolarHBondContact O-N 3.34Å; Y295-Y331 AromaticContact CD2-CD1 3.78Å; Y295-Y331 HydrophobicContact CD2-CD1 3.78Å; Y295-Y331 AromaticContact CD2-CE1 3.66Å; Y295-Y331 HydrophobicContact CD2-CE1 3.66Å; Y295-Y331 HydrophobicContact CE2-CD1 4.46Å; Y295-Y331 HydrophobicContact CE2-CE1 4.48Å; Y295-Y331 HydrophobicContact CG-CD1 4.47Å; Y295-Y331 AromaticContact CG-CE1 3.93Å; Y295-Y331 HydrophobicContact CG-CE1 3.93Å; Y295-W332 HydrophobicContact CE2-CE3 4.46Å; Y295-W332 WeakPolarHBondContact OH-CZ3 3.48Å; Y295-P333 HydrophobicContact CD1-CG 3.67Å; Y295-P333 HydrophobicContact CD2-CG 4.26Å; Y295-P333 HydrophobicContact CE1-CG 3.5Å; Y295-P333 HydrophobicContact CE2-CG 4.11Å; Y295-P333 HydrophobicContact CG-CG 4.07Å
296	G	92.3	Very high	95.4	Very high	53 Å²	53	33.7 Å²	33.7	55%	0.546	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	-1.6	-174.7	0	0	0	0	0	114.4	V294 E298	V294-G296 PolarHBondContact O-N 3.03Å; G296-E298 VanDerWaalsContact C-OE2 3.26Å; G296-E298 VanDerWaalsContact CA-OE2 3.27Å; G296-E298 WeakPolarHBondContact CA-OE2 3.45Å; G296-E298 VanDerWaalsContact N-CD 3.32Å; G296-E298 PolarHBondContact N-OE1 3.41Å; G296-E298 PolarHBondContact N-OE2 3.01Å
297	F	92.7	Very high	95.3	Very high	104 Å²	104	34.1 Å²	34.1	46%	0.456	19%	0.193	S	C	.	.			trans	-123.5	32	180	-56.5	-75.5	0	0	0	111.3	F271 V294 Y295 N299 W303	F271-F297 HydrophobicContact CD2-CB 4.41Å; F271-F297 AromaticContact CE1-CD1 3.92Å; F271-F297 HydrophobicContact CE1-CD1 3.92Å; F271-F297 HydrophobicContact CE1-CE1 4.31Å; F271-F297 HydrophobicContact CE2-CB 4.05Å; F271-F297 HydrophobicContact CE2-CD1 4.15Å; F271-F297 HydrophobicContact CZ-CB 4.44Å; F271-F297 AromaticContact CZ-CD1 3.67Å; F271-F297 HydrophobicContact CZ-CD1 3.67Å; F271-F297 HydrophobicContact CZ-CE1 4.44Å; F271-F297 HydrophobicContact CZ-CG 4.45Å; V294-F297 CarbonylContact O-C 3.23Å; V294-F297 PolarHBondContact O-N 2.92Å; Y295-F297 VanDerWaalsContact O-CD2 3.29Å; Y295-F297 WeakPolarHBondContact O-CD2 3.4Å; Y295-F297 PolarHBondContact O-N 3.34Å; F297-N299 PolarHBondContact O-N 2.99Å; F297-W303 HydrophobicContact CB-CZ2 4.01Å; F297-W303 PolarHBondContact O-NE1 2.93Å
298	E	88.8	Confident	94.9	Very high	86 Å²	86	36 Å²	36	40%	0.402	21%	0.212	S	C	.	.			trans	-72.6	-2.8	-168.9	-62.4	86	170.7	0	0	115	G296 S300 R327	G296-E298 VanDerWaalsContact C-OE2 3.26Å; G296-E298 VanDerWaalsContact CA-OE2 3.27Å; G296-E298 WeakPolarHBondContact CA-OE2 3.45Å; G296-E298 VanDerWaalsContact N-CD 3.32Å; G296-E298 PolarHBondContact N-OE1 3.41Å; G296-E298 PolarHBondContact N-OE2 3.01Å; E298-S300 PolarHBondContact O-N 3.27Å; E298-R327 IonicContact OE1-NE 3.76Å
299	N	94.4	Very high	94.3	Very high	91 Å²	91	37.5 Å²	37.5	49%	0.487	22%	0.22	S	C	.	.			trans	-69.9	100.4	178.5	-175.6	2.8	0	0	0	111.3	F297 S301 L302	F297-N299 PolarHBondContact O-N 2.99Å; N299-S301 PolarHBondContact O-N 3.04Å; N299-S301 VanDerWaalsContact O-N 3.12Å; N299-S301 PolarHBondContact OD1-N 3.39Å; N299-S301 PolarHBondContact OD1-OG 2.87Å; N299-L302 HydrophobicContact CB-CD1 4.23Å; N299-L302 HydrophobicContact CB-CG 4.46Å; N299-L302 PolarHBondContact O-N 3.05Å; N299-L302 VanDerWaalsContact O-N 3.15Å
300	S	94.6	Very high	93.7	Very high	32 Å²	32	39.1 Å²	39.1	22%	0.224	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-60	-24.7	-174.3	58.2	0	0	0	0	115	E298 L302 W303 V322	E298-S300 PolarHBondContact O-N 3.27Å; S300-L302 PolarHBondContact O-N 2.98Å; S300-W303 PolarHBondContact O-N 3.01Å; S300-V322 WeakPolarHBondContact CB-O 3.44Å
301	S	95.2	Very high	93.1	Very high	95 Å²	95	44.1 Å²	44.1	66%	0.664	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-69.8	-16.4	179.9	66.1	0	0	0	0	113.8	N299	N299-S301 PolarHBondContact O-N 3.04Å; N299-S301 VanDerWaalsContact O-N 3.12Å; N299-S301 PolarHBondContact OD1-N 3.39Å; N299-S301 PolarHBondContact OD1-OG 2.87Å
302	L	95.6	Very high	92.2	Very high	62 Å²	62	45.6 Å²	45.6	33%	0.325	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-90.9	-6.3	177.6	-60.3	178.8	0	0	0	113	F271 Q272 N299 S300	F271-L302 HydrophobicContact CD2-CB 3.91Å; F271-L302 HydrophobicContact CE2-CB 3.49Å; F271-L302 VanDerWaalsContact CE2-CB 3.49Å; F271-L302 HydrophobicContact CE2-CD1 3.7Å; F271-L302 HydrophobicContact CE2-CG 4.26Å; F271-L302 HydrophobicContact CZ-CB 4.21Å; F271-L302 HydrophobicContact CZ-CD1 3.73Å; Q272-L302 HydrophobicContact CG-CB 4.43Å; Q272-L302 HydrophobicContact CG-CD2 4.4Å; Q272-L302 PolarHBondContact N-O 3.25Å; N299-L302 HydrophobicContact CB-CD1 4.23Å; N299-L302 HydrophobicContact CB-CG 4.46Å; N299-L302 PolarHBondContact O-N 3.05Å; N299-L302 VanDerWaalsContact O-N 3.15Å; S300-L302 PolarHBondContact O-N 2.98Å
303	W	96.3	Very high	90.7	Very high	5 Å²	5	49.1 Å²	49.1	2%	0.019	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	138.7	-177.3	-72.5	85.2	0	0	0	112.2	L269 H270 F271 C293 V294 F297 S300 V322 I325	L269-W303 HydrophobicContact CB-CE3 4.18Å; L269-W303 HydrophobicContact CB-CZ3 3.82Å; H270-W303 VanDerWaalsContact O-CA 3.31Å; H270-W303 WeakPolarHBondContact O-CA 3.21Å; F271-W303 HydrophobicContact CB-CD2 4.38Å; F271-W303 HydrophobicContact CB-CE3 4.33Å; F271-W303 HydrophobicContact CB-CH2 4.19Å; F271-W303 HydrophobicContact CB-CZ2 4.23Å; F271-W303 HydrophobicContact CB-CZ3 4.24Å; F271-W303 AromaticContact CD2-CD1 3.93Å; F271-W303 HydrophobicContact CD2-CD2 4.13Å; F271-W303 AromaticContact CD2-CE2 3.63Å; F271-W303 HydrophobicContact CD2-CG 4.32Å; F271-W303 HydrophobicContact CD2-CZ2 4.01Å; F271-W303 AromaticContact CD2-NE1 3.51Å; F271-W303 AromaticContact CE2-NE1 3.95Å; F271-W303 HydrophobicContact CG-CZ2 4.43Å; C293-W303 VanDerWaalsContact O-CH2 3.27Å; C293-W303 WeakPolarHBondContact O-CH2 3.27Å; C293-W303 WeakPolarHBondContact O-CZ2 3.23Å; V294-W303 HydrophobicContact CB-CZ2 4.42Å; V294-W303 HydrophobicContact CG1-CH2 4.11Å; V294-W303 HydrophobicContact CG1-CZ2 3.9Å; F297-W303 HydrophobicContact CB-CZ2 4.01Å; F297-W303 PolarHBondContact O-NE1 2.93Å; S300-W303 PolarHBondContact O-N 3.01Å; W303-V322 HydrophobicContact CB-CB 4.11Å; W303-V322 HydrophobicContact CB-CG2 3.7Å; W303-I325 VanDerWaalsContact CD1-CD1 3.43Å; W303-I325 HydrophobicContact CD2-CD1 4.26Å; W303-I325 HydrophobicContact CG-CD1 3.87Å
304	T	95.1	Very high	89.1	Confident	42 Å²	42	52.3 Å²	52.3	26%	0.258	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	142.3	168.1	54.6	0	0	0	0	110.6	H270 H306	H270-T304 WeakPolarHBondContact CB-OG1 3.42Å; H270-T304 PolarHBondContact N-O 3.06Å; H270-T304 PolarHBondContact O-N 3.25Å; T304-H306 PolarHBondContact OG1-NE2 3.23Å
305	V	95.7	Very high	86.9	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.006	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	127.7	179.7	170.3	0	0	0	0	109	V267 L269 I287 V307 L320 V322 I343 L345	V267-V305 HydrophobicContact CG1-CG1 3.54Å; L269-V305 HydrophobicContact CD2-CG2 3.79Å; I287-V305 HydrophobicContact CG1-CG1 4.17Å; V305-V307 HydrophobicContact CG1-CG1 4.09Å; V305-L320 HydrophobicContact CB-CB 4.22Å; V305-L320 HydrophobicContact CG1-CD1 4.49Å; V305-L320 PolarHBondContact N-O 3.49Å; V305-L320 PolarHBondContact O-N 2.9Å; V305-V322 HydrophobicContact CG2-CG2 3.72Å; V305-I343 HydrophobicContact CG2-CG2 4.07Å; V305-L345 HydrophobicContact CB-CD2 3.79Å; V305-L345 HydrophobicContact CG1-CD2 3.88Å; V305-L345 HydrophobicContact CG2-CD2 3.73Å
306	H	94	Very high	84.8	Confident	10 Å²	10	61.7 Å²	61.7	5%	0.046	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	133.4	177.6	-64.7	-111.6	0	0	0	110.5	S268 H270 T304 L309	S268-H306 PolarHBondContact N-O 3.03Å; S268-H306 PolarHBondContact O-N 3.27Å; H270-H306 AromaticContact CD2-CD2 3.4Å; H270-H306 PolarHBondContact CD2-CD2 2.76Å; H270-H306 AromaticContact CD2-NE2 3.94Å; H270-H306 AromaticContact CG-CD2 3.83Å; H270-H306 AromaticContact CG-NE2 3.93Å; H270-H306 AromaticContact NE2-CD2 3.79Å; T304-H306 PolarHBondContact OG1-NE2 3.23Å; H306-L309 HydrophobicContact CB-CD1 3.59Å; H306-L309 HydrophobicContact CB-CG 4.43Å
307	V	93.4	Very high	83.1	Confident	12 Å²	12	60.1 Å²	60.1	7%	0.073	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	160	-174.6	-60.6	0	0	0	0	111	V267 I281 V305 L309 L320 L349 V355	V267-V307 HydrophobicContact CG2-CG1 4.19Å; I281-V307 HydrophobicContact CD1-CB 4.3Å; I281-V307 HydrophobicContact CD1-CG1 3.92Å; I281-V307 HydrophobicContact CG1-CG1 4.4Å; V305-V307 HydrophobicContact CG1-CG1 4.09Å; V307-L309 PolarHBondContact O-N 3.31Å; V307-L320 HydrophobicContact CG1-CD1 4.29Å; V307-L320 HydrophobicContact CG2-CD1 4Å; V307-L349 HydrophobicContact CG1-CD2 4.13Å; V307-L349 HydrophobicContact CG2-CD2 3.9Å; V307-V355 HydrophobicContact CB-CG1 4.29Å; V307-V355 HydrophobicContact CB-CG2 4.12Å; V307-V355 HydrophobicContact CG2-CG1 4.17Å; V307-V355 HydrophobicContact CG2-CG2 3.8Å
308	G	89.4	Confident	81.8	Confident	39 Å²	39	62.5 Å²	62.5	40%	0.402	36%	0.355	S	S	.	.	S	Bend	trans	67.3	14.5	177.8	0	0	0	0	0	114.2
309	L	86.4	Confident	81.6	Confident	32 Å²	32	61.9 Å²	61.9	17%	0.168	36%	0.36	C	S	.	.			trans	-92.8	145	-179	-63.3	-175.4	0	0	0	111.8	H306 V307 I314 A317 W378	H306-L309 HydrophobicContact CB-CD1 3.59Å; H306-L309 HydrophobicContact CB-CG 4.43Å; V307-L309 PolarHBondContact O-N 3.31Å; L309-I314 HydrophobicContact CD1-CG1 4.48Å; L309-A317 HydrophobicContact CD1-CB 4.07Å; L309-A317 HydrophobicContact CD2-CB 3.69Å; L309-A317 HydrophobicContact CG-CB 4.41Å; L309-W378 HydrophobicContact CB-CZ2 4.14Å; L309-W378 WeakPolarHBondContact O-CZ2 3.29Å
310	T	86.4	Confident	81.5	Confident	33 Å²	33	59 Å²	59	20%	0.202	35%	0.345	C	S	.	.	S	Bend	trans	-118.5	-7	162.5	51.1	0	0	0	0	112.8	P260 V390 L391	P260-T310 HydrophobicContact CB-CG2 4.34Å; P260-T310 HydrophobicContact CG-CG2 4.12Å; T310-V390 CarbonylContact O-C 3.45Å; T310-V390 WeakPolarHBondContact O-CA 3.38Å; T310-L391 HydrophobicContact CG2-CD2 4.48Å; T310-L391 PolarHBondContact O-N 3.28Å
311	E	85.4	Confident	81.5	Confident	105 Å²	105	60.3 Å²	60.3	49%	0.491	36%	0.358	S	S	.	.	B	Isolated β-bridge	trans	-139.2	142.9	178	-58.3	-172.2	-171	0	0	110.1	V389 V390	E311-V389 CarbonylContact C-O 3.53Å; E311-V389 VanDerWaalsContact CA-O 3.25Å; E311-V389 WeakPolarHBondContact CA-O 3.35Å; E311-V390 HydrophobicContact CG-CG1 4.17Å
312	Q	78.4	Confident	81.6	Confident	31 Å²	31	56.3 Å²	56.3	15%	0.145	33%	0.329	C	S	.	.	S	Bend	trans	-80.4	-13.2	-178.9	-70.7	-71.3	-14.4	0	0	113.4	S268 H270 I314 W378 V389	S268-Q312 PolarHBondContact OG-NE2 2.84Å; S268-Q312 VanDerWaalsContact OG-NE2 3.08Å; H270-Q312 PolarHBondContact CE1-OE1 2.69Å; H270-Q312 PolarHBondContact NE2-OE1 2.04Å; Q312-I314 VanDerWaalsContact C-N 3.31Å; Q312-I314 VanDerWaalsContact O-CG1 3.29Å; Q312-I314 WeakPolarHBondContact O-CG1 3.42Å; Q312-I314 PolarHBondContact O-N 2.75Å; Q312-W378 HydrophobicContact CG-CB 4.47Å; Q312-W378 HydrophobicContact CG-CG 4Å; Q312-W378 VanDerWaalsContact NE2-CD2 3.26Å; Q312-W378 VanDerWaalsContact NE2-CG 3.26Å; Q312-V389 HydrophobicContact CB-CG1 4.45Å; Q312-V389 PolarHBondContact N-O 3.35Å
313	L	64.8	Low	81.6	Confident	128 Å²	128	59.5 Å²	59.5	67%	0.67	34%	0.337	S	S	*	.			trans	-72.2	87.7	177	-76.5	156.8	0	0	0	109.5	H315 V389	L313-H315 PolarHBondContact O-N 3.28Å; L313-V389 HydrophobicContact CD1-CG1 3.68Å; L313-V389 HydrophobicContact CG-CG1 3.89Å
314	I	61.3	Low	81.6	Confident	72 Å²	72	65 Å²	65	37%	0.369	36%	0.357	S	S	.	.			trans	-77.5	80.6	-174.1	-65.7	150.9	0	0	0	110.5	L309 Q312 A317	L309-I314 HydrophobicContact CD1-CG1 4.48Å; Q312-I314 VanDerWaalsContact C-N 3.31Å; Q312-I314 VanDerWaalsContact O-CG1 3.29Å; Q312-I314 WeakPolarHBondContact O-CG1 3.42Å; Q312-I314 PolarHBondContact O-N 2.75Å; I314-A317 HydrophobicContact CB-CB 4.11Å; I314-A317 HydrophobicContact CG1-CB 3.8Å; I314-A317 HydrophobicContact CG2-CB 3.47Å; I314-A317 VanDerWaalsContact CG2-CB 3.47Å
315	H	49.1	Very low	81.6	Confident	190 Å²	190	63.9 Å²	63.9	88%	0.88	35%	0.35	S	S	*	.	S	Bend	trans	-93.1	100.4	148.8	-71.4	-52.2	0	0	0	108.2	L313	L313-H315 PolarHBondContact O-N 3.28Å
316	G	51.1	Low	81.7	Confident	72 Å²	72	64.6 Å²	64.6	74%	0.742	35%	0.353	S	S	*	.	S	Bend	trans	86.6	17.1	171.4	0	0	0	0	0	117.2
317	A	56.4	Low	81.8	Confident	21 Å²	21	67.1 Å²	67.1	17%	0.174	36%	0.362	C	S	.	.			trans	-63.5	137.9	175	0	0	0	0	0	112.3	L309 I314 S319	L309-A317 HydrophobicContact CD1-CB 4.07Å; L309-A317 HydrophobicContact CD2-CB 3.69Å; L309-A317 HydrophobicContact CG-CB 4.41Å; I314-A317 HydrophobicContact CB-CB 4.11Å; I314-A317 HydrophobicContact CG1-CB 3.8Å; I314-A317 HydrophobicContact CG2-CB 3.47Å; I314-A317 VanDerWaalsContact CG2-CB 3.47Å; A317-S319 PolarHBondContact O-N 3.43Å
318	H	66.4	Low	81.9	Confident	154 Å²	154	67.2 Å²	67.2	71%	0.713	36%	0.362	S	S	*	.			trans	-69.1	98.8	170.5	-77	-148.6	0	0	0	109.4
319	S	83.6	Confident	82	Confident	72 Å²	72	69.8 Å²	69.8	50%	0.503	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	135.7	170.4	61.9	0	0	0	0	110	A317	A317-S319 PolarHBondContact O-N 3.43Å
320	L	92.6	Very high	82.3	Confident	31 Å²	31	74.1 Å²	74.1	16%	0.162	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	131.9	-178.8	-65.7	151.6	0	0	0	109.1	V305 V307 L345 L349	V305-L320 HydrophobicContact CB-CB 4.22Å; V305-L320 HydrophobicContact CG1-CD1 4.49Å; V305-L320 PolarHBondContact N-O 3.49Å; V305-L320 PolarHBondContact O-N 2.9Å; V307-L320 HydrophobicContact CG1-CD1 4.29Å; V307-L320 HydrophobicContact CG2-CD1 4Å; L320-L345 HydrophobicContact CB-CD2 4.18Å; L320-L345 HydrophobicContact CD1-CD1 4.26Å; L320-L349 HydrophobicContact CD1-CD2 3.24Å; L320-L349 HydrophobicContact CD1-CG 4.38Å
321	A	95.1	Very high	82.7	Confident	60 Å²	60	73.3 Å²	73.3	50%	0.496	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	144.3	175.9	0	0	0	0	0	111.1	Q346	A321-Q346 HydrophobicContact CB-CB 3.97Å; A321-Q346 WeakPolarHBondContact O-CB 3.4Å; A321-Q346 PolarHBondContact O-N 2.78Å
322	V	96.8	Very high	83	Confident	10 Å²	10	75.3 Å²	75.3	6%	0.061	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	125.6	176.4	178.3	0	0	0	0	110.2	S300 W303 V305 I325 I343	S300-V322 WeakPolarHBondContact CB-O 3.44Å; W303-V322 HydrophobicContact CB-CB 4.11Å; W303-V322 HydrophobicContact CB-CG2 3.7Å; V305-V322 HydrophobicContact CG2-CG2 3.72Å; V322-I325 HydrophobicContact CG1-CG1 3.9Å; V322-I343 HydrophobicContact CB-CG2 4.29Å; V322-I343 HydrophobicContact CG1-CG2 3.59Å; V322-I343 HydrophobicContact CG2-CG2 3.69Å
323	R	95.9	Very high	83.4	Confident	130 Å²	130	76.1 Å²	76.1	49%	0.491	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-40.5	175	-175.5	165.5	-179.3	132.1	-0.3	112.4	R344 Q346	R323-R344 HydrophobicContact CB-CG 4.48Å; R323-R344 WeakPolarHBondContact CB-O 3.49Å; R323-R344 PolarHBondContact N-O 3.4Å; R323-Q346 HydrophobicContact CB-CB 4.46Å
324	R	95.5	Very high	84.4	Confident	119 Å²	119	78.9 Å²	78.9	45%	0.449	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	148	-174.2	-174.8	171.1	177.1	154.4	-0.1	111.5	I326 R344	R324-I326 HydrophobicContact CG-CG1 4.07Å; R324-R344 HydrophobicContact CB-CB 4.41Å; R324-R344 PolarHBondContact N-O 2.82Å; R324-R344 PolarHBondContact O-N 3.01Å
325	I	96.8	Very high	85.3	Confident	19 Å²	19	77.8 Å²	77.8	10%	0.097	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	136.4	170.5	-56.7	177.3	0	0	0	108.5	V294 W303 V322 I343	V294-I325 HydrophobicContact CB-CG2 3.78Å; V294-I325 HydrophobicContact CG1-CD1 4.31Å; V294-I325 HydrophobicContact CG1-CG2 3.87Å; V294-I325 HydrophobicContact CG2-CG2 3.75Å; W303-I325 VanDerWaalsContact CD1-CD1 3.43Å; W303-I325 HydrophobicContact CD2-CD1 4.26Å; W303-I325 HydrophobicContact CG-CD1 3.87Å; V322-I325 HydrophobicContact CG1-CG1 3.9Å; I325-I343 HydrophobicContact CG1-CG1 4.35Å
326	I	96.3	Very high	86.9	Confident	16 Å²	16	71.7 Å²	71.7	8%	0.082	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	106.5	179	-52	178.5	0	0	0	108.2	W286 R324 A341 L342 W477 Q481	W286-I326 HydrophobicContact CH2-CD1 3.75Å; W286-I326 HydrophobicContact CZ3-CD1 3.95Å; R324-I326 HydrophobicContact CG-CG1 4.07Å; I326-A341 CarbonylContact O-C 3.57Å; I326-A341 VanDerWaalsContact O-CA 3.27Å; I326-A341 WeakPolarHBondContact O-CA 3.25Å; I326-L342 HydrophobicContact CB-CB 4.41Å; I326-L342 PolarHBondContact N-O 3.41Å; I326-L342 PolarHBondContact O-N 2.75Å; I326-W477 HydrophobicContact CG2-CZ2 4.24Å; I326-Q481 HydrophobicContact CG2-CG 4.22Å
327	R	95.6	Very high	88.9	Confident	64 Å²	64	69.9 Å²	69.9	24%	0.242	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	150.1	175.7	-171.4	175.1	57.8	74.4	-11.7	110.7	A291 V294 E298 A329 Y331 A341	A291-R327 HydrophobicContact CB-CG 3.46Å; A291-R327 VanDerWaalsContact CB-CG 3.46Å; V294-R327 HydrophobicContact CG2-CB 4.4Å; E298-R327 IonicContact OE1-NE 3.76Å; R327-A329 PolarHBondContact O-N 2.99Å; R327-Y331 HydrophobicContact CG-CD1 4.42Å; R327-Y331 PolarHBondContact NH1-O 3.39Å; R327-A341 HydrophobicContact CB-CB 4.47Å
328	H	95.7	Very high	90.8	Very high	13 Å²	13	71.4 Å²	71.4	6%	0.06	37%	0.365	C	S	.	.			trans	-59.9	127	169.8	-162.4	-79.7	0	0	0	110.7	Q330 Y331 Y338 I340 W477	H328-Q330 VanDerWaalsContact C-N 3.26Å; H328-Q330 PolarHBondContact CE1-OE1 3.31Å; H328-Q330 PolarHBondContact ND1-N 2.79Å; H328-Q330 PolarHBondContact O-N 3.36Å; H328-Y331 WeakPolarHBondContact O-CB 3.42Å; H328-Y331 PolarHBondContact O-N 3.07Å; H328-Y331 VanDerWaalsContact O-N 3.07Å; H328-Y338 WeakPolarHBondContact CB-O 3.4Å; H328-Y338 AromaticContact CE1-CD1 3.26Å; H328-Y338 WeakPolarHBondContact CE1-CD1 3.32Å; H328-Y338 AromaticContact CE1-CE1 3.87Å; H328-Y338 AromaticContact CE1-CG 3.79Å; H328-Y338 WeakPolarHBondContact ND1-CB 3.44Å; H328-Y338 AromaticContact ND1-CD1 3.65Å; H328-Y338 AromaticContact ND1-CG 3.71Å; H328-Y338 AromaticContact NE2-CD1 3.72Å; H328-I340 HydrophobicContact CB-CG2 3.84Å; H328-I340 PolarHBondContact N-O 2.78Å; H328-W477 HydrophobicContact CB-CZ2 4.2Å; H328-W477 AromaticContact CD2-CD1 3.26Å; H328-W477 AromaticContact CD2-CD2 3.64Å; H328-W477 AromaticContact CD2-CE2 3.65Å; H328-W477 AromaticContact CD2-CG 3.42Å; H328-W477 VanDerWaalsContact CD2-CG 3.42Å; H328-W477 AromaticContact CD2-NE1 3.4Å; H328-W477 PolarHBondContact CD2-NE1 2.79Å; H328-W477 AromaticContact CG-NE1 4Å; H328-W477 AromaticContact NE2-CD1 3.52Å; H328-W477 AromaticContact NE2-CG 3.85Å
329	A	92.6	Very high	92.3	Very high	94 Å²	94	64.2 Å²	64.2	78%	0.777	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-28.8	-171.9	0	0	0	0	0	113.5	R327 Y331	R327-A329 PolarHBondContact O-N 2.99Å; A329-Y331 VanDerWaalsContact C-N 3.33Å
330	Q	92.9	Very high	93	Very high	123 Å²	123	60.8 Å²	60.8	58%	0.575	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-7.4	177.8	-59.7	-177	-89.2	0	0	113.7	H328 W332 Y338	H328-Q330 VanDerWaalsContact C-N 3.26Å; H328-Q330 PolarHBondContact CE1-OE1 3.31Å; H328-Q330 PolarHBondContact ND1-N 2.79Å; H328-Q330 PolarHBondContact O-N 3.36Å; Q330-W332 PolarHBondContact O-N 3.09Å; Q330-Y338 HydrophobicContact CB-CD1 4.41Å; Q330-Y338 HydrophobicContact CB-CD2 3.73Å; Q330-Y338 HydrophobicContact CB-CE2 4Å; Q330-Y338 HydrophobicContact CB-CG 3.96Å
331	Y	94.8	Very high	93.3	Very high	15 Å²	15	59.3 Å²	59.3	6%	0.059	30%	0.3	C	S	.	.			trans	-66.3	132.2	177.1	173.1	-95.3	0	0	0	110.5	A291 H292 Y295 R327 H328 A329 P333 D337 Y338 D339	A291-Y331 HydrophobicContact CB-CD1 3.56Å; A291-Y331 HydrophobicContact CB-CD2 3.62Å; A291-Y331 HydrophobicContact CB-CE1 3.97Å; A291-Y331 HydrophobicContact CB-CE2 4.04Å; A291-Y331 HydrophobicContact CB-CG 3.35Å; H292-Y331 WeakPolarHBondContact CA-OH 3.17Å; H292-Y331 HydrophobicContact CB-CE1 4.48Å; H292-Y331 HydrophobicContact CB-CE2 4.42Å; H292-Y331 WeakPolarHBondContact CB-OH 3.5Å; Y295-Y331 AromaticContact CD2-CD1 3.78Å; Y295-Y331 HydrophobicContact CD2-CD1 3.78Å; Y295-Y331 AromaticContact CD2-CE1 3.66Å; Y295-Y331 HydrophobicContact CD2-CE1 3.66Å; Y295-Y331 HydrophobicContact CE2-CD1 4.46Å; Y295-Y331 HydrophobicContact CE2-CE1 4.48Å; Y295-Y331 HydrophobicContact CG-CD1 4.47Å; Y295-Y331 AromaticContact CG-CE1 3.93Å; Y295-Y331 HydrophobicContact CG-CE1 3.93Å; R327-Y331 HydrophobicContact CG-CD1 4.42Å; R327-Y331 PolarHBondContact NH1-O 3.39Å; H328-Y331 WeakPolarHBondContact O-CB 3.42Å; H328-Y331 PolarHBondContact O-N 3.07Å; H328-Y331 VanDerWaalsContact O-N 3.07Å; A329-Y331 VanDerWaalsContact C-N 3.33Å; Y331-P333 HydrophobicContact CE1-CG 4.22Å; Y331-D337 WeakPolarHBondContact CD2-O 3.19Å; Y331-Y338 WeakPolarHBondContact CB-O 3.42Å; Y331-D339 HydrophobicContact CD2-CB 3.93Å; Y331-D339 HydrophobicContact CE2-CB 3.79Å; Y331-D339 WeakPolarHBondContact CE2-OD1 3.36Å
332	W	90.9	Very high	93.4	Very high	147 Å²	147	56.5 Å²	56.5	56%	0.557	28%	0.276	S	S	*	.			trans	-142.6	133.6	172.8	178.9	-102	0	0	0	109.4	Y295 Q330 K334 G335	Y295-W332 HydrophobicContact CE2-CE3 4.46Å; Y295-W332 WeakPolarHBondContact OH-CZ3 3.48Å; Q330-W332 PolarHBondContact O-N 3.09Å; W332-K334 VanDerWaalsContact C-N 3.27Å; W332-K334 PolarHBondContact O-N 3.27Å; W332-G335 PolarHBondContact O-N 3.25Å
333	P	86.3	Confident	93.5	Very high	48 Å²	48	56 Å²	56	31%	0.312	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-35.7	-169.7	-29.6	34.9	0	0	0	115.7	Y295 Y331 G335	Y295-P333 HydrophobicContact CD1-CG 3.67Å; Y295-P333 HydrophobicContact CD2-CG 4.26Å; Y295-P333 HydrophobicContact CE1-CG 3.5Å; Y295-P333 HydrophobicContact CE2-CG 4.11Å; Y295-P333 HydrophobicContact CG-CG 4.07Å; Y331-P333 HydrophobicContact CE1-CG 4.22Å; P333-G335 VanDerWaalsContact C-N 3.34Å
334	K	85.7	Confident	93.5	Very high	187 Å²	187	51.4 Å²	51.4	81%	0.813	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-20	179.4	-61.8	-172.5	177.5	-175.7	0	113.9	W332	W332-K334 VanDerWaalsContact C-N 3.27Å; W332-K334 PolarHBondContact O-N 3.27Å
335	G	80.6	Confident	93.5	Very high	48 Å²	48	45.9 Å²	45.9	50%	0.495	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-21.4	-175.5	0	0	0	0	0	113.4	W332 P333 D337	W332-G335 PolarHBondContact O-N 3.25Å; P333-G335 VanDerWaalsContact C-N 3.34Å; G335-D337 PolarHBondContact O-N 2.82Å
336	L	83.4	Confident	93.4	Very high	63 Å²	63	49.6 Å²	49.6	33%	0.33	25%	0.252	S	S	.	.			trans	58.7	-12.6	-177	-54.1	175	0	0	0	115.4	M418 W455	L336-M418 VanDerWaalsContact C-CE 3.47Å; L336-M418 HydrophobicContact CB-CE 3.85Å; L336-M418 VanDerWaalsContact O-CE 3.27Å; L336-M418 WeakPolarHBondContact O-CE 3.32Å; L336-W455 HydrophobicContact CD1-CD2 4.12Å; L336-W455 HydrophobicContact CD1-CE3 4.45Å; L336-W455 HydrophobicContact CD1-CH2 4.45Å; L336-W455 HydrophobicContact CD1-CZ2 4.1Å; L336-W455 HydrophobicContact CD2-CG 4.44Å
337	D	93.7	Very high	93.3	Very high	34 Å²	34	55.4 Å²	55.4	18%	0.182	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	158.5	179.9	-149	-28.1	0	0	0	112.1	Y331 G335 D339 S415 W417 M418	Y331-D337 WeakPolarHBondContact CD2-O 3.19Å; G335-D337 PolarHBondContact O-N 2.82Å; D337-D339 PolarHBondContact O-N 2.68Å; D337-S415 VanDerWaalsContact OD2-CB 3.29Å; D337-S415 WeakPolarHBondContact OD2-CB 3.47Å; D337-S415 PolarHBondContact OD2-OG 3.13Å; D337-W417 WeakPolarHBondContact OD1-CB 3.26Å; D337-M418 HydrophobicContact CB-CE 4.28Å
338	Y	96.4	Very high	93.1	Very high	53 Å²	53	55.3 Å²	55.3	21%	0.208	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	30.1	-177.8	-52.1	-84.3	0	0	0	113.7	H328 Q330 Y331 I340 W417	H328-Y338 WeakPolarHBondContact CB-O 3.4Å; H328-Y338 AromaticContact CE1-CD1 3.26Å; H328-Y338 WeakPolarHBondContact CE1-CD1 3.32Å; H328-Y338 AromaticContact CE1-CE1 3.87Å; H328-Y338 AromaticContact CE1-CG 3.79Å; H328-Y338 WeakPolarHBondContact ND1-CB 3.44Å; H328-Y338 AromaticContact ND1-CD1 3.65Å; H328-Y338 AromaticContact ND1-CG 3.71Å; H328-Y338 AromaticContact NE2-CD1 3.72Å; Q330-Y338 HydrophobicContact CB-CD1 4.41Å; Q330-Y338 HydrophobicContact CB-CD2 3.73Å; Q330-Y338 HydrophobicContact CB-CE2 4Å; Q330-Y338 HydrophobicContact CB-CG 3.96Å; Y331-Y338 WeakPolarHBondContact CB-O 3.42Å; Y338-I340 PolarHBondContact O-N 2.73Å; Y338-W417 AromaticContact CD1-CD2 3.83Å; Y338-W417 HydrophobicContact CD1-CD2 3.83Å; Y338-W417 AromaticContact CD1-CE2 3.68Å; Y338-W417 AromaticContact CD1-CE3 3.98Å; Y338-W417 HydrophobicContact CD1-CE3 3.98Å; Y338-W417 HydrophobicContact CD1-CG 4.47Å; Y338-W417 AromaticContact CD1-CH2 3.9Å; Y338-W417 HydrophobicContact CD1-CH2 3.9Å; Y338-W417 AromaticContact CD1-CZ2 3.75Å; Y338-W417 HydrophobicContact CD1-CZ2 3.75Å; Y338-W417 AromaticContact CD1-CZ3 3.99Å; Y338-W417 HydrophobicContact CD1-CZ3 3.99Å; Y338-W417 AromaticContact CE1-CD2 3.87Å; Y338-W417 HydrophobicContact CE1-CD2 3.87Å; Y338-W417 AromaticContact CE1-CE2 3.31Å; Y338-W417 HydrophobicContact CE1-CE3 4.45Å; Y338-W417 HydrophobicContact CE1-CG 4.33Å; Y338-W417 HydrophobicContact CE1-CH2 4.1Å; Y338-W417 AromaticContact CE1-CZ2 3.48Å; Y338-W417 HydrophobicContact CE1-CZ2 3.48Å; Y338-W417 VanDerWaalsContact CE1-CZ2 3.48Å; Y338-W417 AromaticContact CE1-NE1 3.44Å; Y338-W417 AromaticContact CZ-NE1 3.95Å
339	D	97.6	Very high	93	Very high	3 Å²	3	55 Å²	55	2%	0.016	29%	0.286	C	S	.	.			trans	-74.2	72.2	-176.5	-172	22.4	0	0	0	112.5	A291 H292 Y331 D337 S454 T469	A291-D339 WeakPolarHBondContact CA-OD1 3.36Å; A291-D339 VanDerWaalsContact CB-OD1 3.31Å; A291-D339 WeakPolarHBondContact CB-OD1 3.19Å; A291-D339 PolarHBondContact N-OD1 3.16Å; H292-D339 IonicContact CE1-OD2 2.78Å; H292-D339 IonicContact CG-OD1 3.92Å; H292-D339 IonicContact CG-OD2 3.17Å; H292-D339 PolarHBondContact N-OD1 3.1Å; H292-D339 IonicContact ND1-OD1 2.72Å; H292-D339 PolarHBondContact ND1-OD1 2.56Å; H292-D339 IonicContact ND1-OD2 3.86Å; H292-D339 PolarHBondContact ND1-OD2 3.09Å; Y331-D339 HydrophobicContact CD2-CB 3.93Å; Y331-D339 HydrophobicContact CE2-CB 3.79Å; Y331-D339 WeakPolarHBondContact CE2-OD1 3.36Å; D337-D339 PolarHBondContact O-N 2.68Å; D339-S454 WeakPolarHBondContact CB-OG 3.46Å; D339-S454 WeakPolarHBondContact OD2-CA 3.19Å; D339-S454 WeakPolarHBondContact OD2-CB 3.48Å; D339-S454 PolarHBondContact OD2-OG 2.88Å; D339-T469 PolarHBondContact O-OG1 3.48Å
340	I	98.4	Very high	93	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.283	C	S	.	.			trans	-146.7	140.3	-177.6	-161.8	171.2	0	0	0	112.3	L288 H328 Y338 T469 I471 A474 W477 I478	L288-I340 HydrophobicContact CD1-CD1 3.86Å; L288-I340 HydrophobicContact CD1-CG1 3.88Å; L288-I340 HydrophobicContact CD2-CD1 4.24Å; L288-I340 HydrophobicContact CG-CD1 4.31Å; L288-I340 HydrophobicContact CG-CG1 4.31Å; H328-I340 HydrophobicContact CB-CG2 3.84Å; H328-I340 PolarHBondContact N-O 2.78Å; Y338-I340 PolarHBondContact O-N 2.73Å; I340-T469 HydrophobicContact CB-CG2 4.19Å; I340-T469 HydrophobicContact CD1-CG2 4.5Å; I340-I471 HydrophobicContact CD1-CD1 4.02Å; I340-A474 HydrophobicContact CD1-CB 3.44Å; I340-A474 VanDerWaalsContact CD1-CB 3.44Å; I340-W477 HydrophobicContact CB-CZ3 4.41Å; I340-W477 HydrophobicContact CD1-CE3 4.3Å; I340-W477 HydrophobicContact CD1-CZ3 4.16Å; I340-W477 HydrophobicContact CG1-CZ3 3.96Å; I340-W477 HydrophobicContact CG2-CD2 4.45Å; I340-W477 HydrophobicContact CG2-CE3 3.88Å; I340-W477 HydrophobicContact CG2-CH2 4.29Å; I340-W477 HydrophobicContact CG2-CZ3 3.8Å; I340-I478 HydrophobicContact CD1-CD1 3.88Å; I340-I478 HydrophobicContact CD1-CG1 4Å
341	A	98	Very high	93.1	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	155.7	174.9	0	0	0	0	0	111.8	T289 V294 I326 R327	T289-A341 HydrophobicContact CG2-CB 4.11Å; T289-A341 PolarHBondContact N-O 2.81Å; T289-A341 PolarHBondContact O-N 3Å; T289-A341 VanDerWaalsContact O-O 3.11Å; V294-A341 HydrophobicContact CG2-CB 3.74Å; I326-A341 CarbonylContact O-C 3.57Å; I326-A341 VanDerWaalsContact O-CA 3.27Å; I326-A341 WeakPolarHBondContact O-CA 3.25Å; R327-A341 HydrophobicContact CB-CB 4.47Å
342	L	98.1	Very high	92.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.9	173.1	-78.7	168	0	0	0	109.7	I282 W286 I287 L288 I326 W477 Q481 I482	I282-L342 HydrophobicContact CD1-CD2 3.64Å; W286-L342 HydrophobicContact CE3-CB 3.89Å; W286-L342 HydrophobicContact CE3-CD1 4.44Å; W286-L342 HydrophobicContact CE3-CD2 4.2Å; W286-L342 HydrophobicContact CE3-CG 4.42Å; W286-L342 HydrophobicContact CZ3-CB 3.84Å; W286-L342 HydrophobicContact CZ3-CD1 4.41Å; I287-L342 WeakPolarHBondContact O-CA 3.1Å; L288-L342 HydrophobicContact CD1-CD2 3.47Å; L288-L342 VanDerWaalsContact CD1-CD2 3.47Å; L288-L342 HydrophobicContact CD1-CG 3.95Å; I326-L342 HydrophobicContact CB-CB 4.41Å; I326-L342 PolarHBondContact N-O 3.41Å; I326-L342 PolarHBondContact O-N 2.75Å; L342-W477 HydrophobicContact CB-CH2 4.35Å; L342-W477 HydrophobicContact CD1-CH2 4.03Å; L342-W477 HydrophobicContact CD1-CZ3 3.92Å; L342-W477 HydrophobicContact CG-CH2 3.97Å; L342-W477 HydrophobicContact CG-CZ3 3.89Å; L342-Q481 HydrophobicContact CD1-CB 3.47Å; L342-Q481 VanDerWaalsContact CD1-CB 3.47Å; L342-Q481 HydrophobicContact CD1-CG 4.05Å; L342-I482 HydrophobicContact CD1-CG1 4.47Å
343	I	97.8	Very high	93	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	121.2	172.9	-63.8	-179.8	0	0	0	107.5	L269 I287 T289 V294 V305 V322 I325	L269-I343 HydrophobicContact CD1-CD1 3.66Å; L269-I343 HydrophobicContact CD2-CD1 3.76Å; L269-I343 HydrophobicContact CG-CD1 4.35Å; I287-I343 HydrophobicContact CB-CB 4.22Å; I287-I343 PolarHBondContact N-O 3.37Å; I287-I343 PolarHBondContact O-N 3.24Å; T289-I343 HydrophobicContact CG2-CD1 3.88Å; T289-I343 HydrophobicContact CG2-CG1 4.12Å; V294-I343 HydrophobicContact CG1-CD1 4.41Å; V305-I343 HydrophobicContact CG2-CG2 4.07Å; V322-I343 HydrophobicContact CB-CG2 4.29Å; V322-I343 HydrophobicContact CG1-CG2 3.59Å; V322-I343 HydrophobicContact CG2-CG2 3.69Å; I325-I343 HydrophobicContact CG1-CG1 4.35Å
344	R	96.5	Very high	93.3	Very high	34 Å²	34	51.6 Å²	51.6	13%	0.128	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	127.3	174.5	-172.6	178	173.5	160.8	2.5	109.7	S285 W286 R323 R324	S285-R344 WeakPolarHBondContact O-CA 3.29Å; W286-R344 HydrophobicContact CD2-CB 4.33Å; W286-R344 HydrophobicContact CD2-CG 4.4Å; W286-R344 HydrophobicContact CE3-CB 3.87Å; W286-R344 HydrophobicContact CE3-CG 4.42Å; W286-R344 HydrophobicContact CH2-CB 3.94Å; W286-R344 HydrophobicContact CH2-CG 4.27Å; W286-R344 HydrophobicContact CZ2-CB 4.35Å; W286-R344 HydrophobicContact CZ2-CG 4.2Å; W286-R344 HydrophobicContact CZ3-CB 3.67Å; W286-R344 HydrophobicContact CZ3-CG 4.37Å; R323-R344 HydrophobicContact CB-CG 4.48Å; R323-R344 WeakPolarHBondContact CB-O 3.49Å; R323-R344 PolarHBondContact N-O 3.4Å; R324-R344 HydrophobicContact CB-CB 4.41Å; R324-R344 PolarHBondContact N-O 2.82Å; R324-R344 PolarHBondContact O-N 3.01Å
345	L	96	Very high	93.7	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.016	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	149.5	175.1	-56.5	176.9	0	0	0	111.3	S285 I287 V305 L320 E347 L349	S285-L345 PolarHBondContact O-N 3.29Å; I287-L345 HydrophobicContact CD1-CD1 4.25Å; I287-L345 HydrophobicContact CG1-CD1 4.42Å; I287-L345 HydrophobicContact CG1-CD2 4.1Å; I287-L345 HydrophobicContact CG1-CG 4.31Å; V305-L345 HydrophobicContact CB-CD2 3.79Å; V305-L345 HydrophobicContact CG1-CD2 3.88Å; V305-L345 HydrophobicContact CG2-CD2 3.73Å; L320-L345 HydrophobicContact CB-CD2 4.18Å; L320-L345 HydrophobicContact CD1-CD1 4.26Å; L345-E347 VanDerWaalsContact CB-O 3.26Å; L345-E347 WeakPolarHBondContact CB-O 3.16Å; L345-L349 HydrophobicContact CD1-CD1 3.8Å; L345-L349 HydrophobicContact CD1-CD2 4.03Å; L345-L349 HydrophobicContact CD1-CG 3.57Å
346	Q	94.5	Very high	94.5	Very high	96 Å²	96	42 Å²	42	45%	0.449	21%	0.211	S	C	.	.	S	Bend	trans	-67.1	-40.3	173.3	-175	64.1	21	0	0	111.5	A321 R323	A321-Q346 HydrophobicContact CB-CB 3.97Å; A321-Q346 WeakPolarHBondContact O-CB 3.4Å; A321-Q346 PolarHBondContact O-N 2.78Å; R323-Q346 HydrophobicContact CB-CB 4.46Å
347	E	93.1	Very high	95.1	Very high	138 Å²	138	39 Å²	39	65%	0.645	20%	0.195	S	C	*	.	S	Bend	trans	-123.4	146.4	177.8	-65.2	-174.6	175	0	0	110.3	L345	L345-E347 VanDerWaalsContact CB-O 3.26Å; L345-E347 WeakPolarHBondContact CB-O 3.16Å
348	P	92.9	Very high	95.3	Very high	62 Å²	62	37.5 Å²	37.5	40%	0.403	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-70.8	141	177.9	29.9	-34	0	0	0	111.3	S284	S284-P348 CarbonylContact O-C 3.56Å; S284-P348 WeakPolarHBondContact O-CA 3.27Å
349	L	93.3	Very high	95.4	Very high	8 Å²	8	35.6 Å²	35.6	4%	0.042	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-59.5	146.2	169.8	-66.1	164.9	0	0	0	111.6	I281 S284 I287 V307 L320 L345 F351 V355	I281-L349 HydrophobicContact CB-CD1 4.45Å; I281-L349 HydrophobicContact CD1-CD1 3.95Å; I281-L349 HydrophobicContact CG1-CD1 4.05Å; I281-L349 HydrophobicContact CG2-CD1 3.56Å; S284-L349 WeakPolarHBondContact O-CB 3.28Å; S284-L349 WeakPolarHBondContact O-CG 3.29Å; S284-L349 PolarHBondContact O-N 3.17Å; I287-L349 HydrophobicContact CD1-CD1 4.28Å; V307-L349 HydrophobicContact CG1-CD2 4.13Å; V307-L349 HydrophobicContact CG2-CD2 3.9Å; L320-L349 HydrophobicContact CD1-CD2 3.24Å; L320-L349 HydrophobicContact CD1-CG 4.38Å; L345-L349 HydrophobicContact CD1-CD1 3.8Å; L345-L349 HydrophobicContact CD1-CD2 4.03Å; L345-L349 HydrophobicContact CD1-CG 3.57Å; L349-F351 HydrophobicContact CB-CD1 4.28Å; L349-F351 HydrophobicContact CB-CE1 3.9Å; L349-F351 HydrophobicContact CD1-CE1 4.32Å; L349-V355 HydrophobicContact CB-CG1 4.48Å; L349-V355 HydrophobicContact CD1-CG1 4.39Å; L349-V355 HydrophobicContact CD2-CG1 4.11Å
350	V	92.6	Very high	95.3	Very high	117 Å²	117	36 Å²	36	71%	0.709	18%	0.183	S	C	*	.	P	Polyproline II helix	trans	-99.7	125.4	164.4	-178.9	0	0	0	0	106.9
351	F	93.5	Very high	95.2	Very high	68 Å²	68	36 Å²	36	30%	0.298	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-87.2	124.6	176.4	-56	-34.3	0	0	0	109.5	I281 L349 V355 P357	I281-F351 HydrophobicContact CG2-CE1 4.21Å; L349-F351 HydrophobicContact CB-CD1 4.28Å; L349-F351 HydrophobicContact CB-CE1 3.9Å; L349-F351 HydrophobicContact CD1-CE1 4.32Å; F351-V355 VanDerWaalsContact CA-O 3.26Å; F351-V355 WeakPolarHBondContact CA-O 3.27Å; F351-V355 WeakPolarHBondContact CB-O 3.45Å; F351-V355 HydrophobicContact CD1-CG1 4.28Å; F351-P357 HydrophobicContact CD2-CG 4.47Å; F351-P357 HydrophobicContact CE1-CG 4.39Å; F351-P357 HydrophobicContact CE2-CG 3.82Å; F351-P357 HydrophobicContact CZ-CB 4.18Å; F351-P357 HydrophobicContact CZ-CG 3.77Å
352	D	92.3	Very high	95.1	Very high	86 Å²	86	36.6 Å²	36.6	46%	0.46	19%	0.186	S	C	.	.			trans	-130.6	7.2	-173.6	66.6	1.6	0	0	0	112.6	F354 V355	D352-F354 VanDerWaalsContact C-N 3.3Å; D352-F354 PolarHBondContact O-N 2.72Å; D352-F354 WeakPolarHBondContact OD1-CA 3.37Å; D352-F354 WeakPolarHBondContact OD1-CB 3.49Å; D352-F354 PolarHBondContact OD1-N 3.17Å; D352-V355 PolarHBondContact N-O 3.17Å; D352-V355 PolarHBondContact OD1-N 3.13Å
353	G	91.7	Very high	94.9	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.01	19%	0.194	C	C	.	.	S	Bend	trans	85	-13.7	-176.9	0	0	0	0	0	116.2	Q247 E356	Q247-G353 VanDerWaalsContact CG-C 3.46Å; Q247-G353 WeakPolarHBondContact CG-O 3.44Å; G353-E356 VanDerWaalsContact CA-OE1 3.25Å; G353-E356 WeakPolarHBondContact CA-OE1 3.28Å; G353-E356 PolarHBondContact N-OE1 2.99Å
354	F	92.9	Very high	94.5	Very high	83 Å²	83	41.6 Å²	41.6	36%	0.364	23%	0.226	S	C	.	.	S	Bend	trans	-94.2	-25.5	162.9	-62.6	-76.7	0	0	0	111.3	Q247 P260 P264 D352	Q247-F354 HydrophobicContact CB-CD1 4.11Å; Q247-F354 HydrophobicContact CB-CE1 3.78Å; Q247-F354 HydrophobicContact CB-CE2 4.38Å; Q247-F354 HydrophobicContact CB-CZ 3.93Å; Q247-F354 HydrophobicContact CG-CD1 4.37Å; Q247-F354 HydrophobicContact CG-CD2 4.08Å; Q247-F354 HydrophobicContact CG-CE1 4.16Å; Q247-F354 HydrophobicContact CG-CE2 3.85Å; Q247-F354 HydrophobicContact CG-CG 4.33Å; Q247-F354 HydrophobicContact CG-CZ 3.9Å; P260-F354 HydrophobicContact CB-CD1 4.27Å; P260-F354 HydrophobicContact CB-CE1 4.06Å; P264-F354 WeakPolarHBondContact CA-O 3.27Å; P264-F354 WeakPolarHBondContact CB-O 3.48Å; D352-F354 VanDerWaalsContact C-N 3.3Å; D352-F354 PolarHBondContact O-N 2.72Å; D352-F354 WeakPolarHBondContact OD1-CA 3.37Å; D352-F354 WeakPolarHBondContact OD1-CB 3.49Å; D352-F354 PolarHBondContact OD1-N 3.17Å
355	V	95.1	Very high	94.3	Very high	10 Å²	10	40.5 Å²	40.5	6%	0.061	22%	0.223	C	C	.	.	S	Bend	trans	-114.6	113.5	170.6	-176.6	0	0	0	0	107.9	P264 I281 V307 L349 F351 D352	P264-V355 WeakPolarHBondContact O-CA 3Å; I281-V355 HydrophobicContact CD1-CG1 3.59Å; V307-V355 HydrophobicContact CB-CG1 4.29Å; V307-V355 HydrophobicContact CB-CG2 4.12Å; V307-V355 HydrophobicContact CG2-CG1 4.17Å; V307-V355 HydrophobicContact CG2-CG2 3.8Å; L349-V355 HydrophobicContact CB-CG1 4.48Å; L349-V355 HydrophobicContact CD1-CG1 4.39Å; L349-V355 HydrophobicContact CD2-CG1 4.11Å; F351-V355 VanDerWaalsContact CA-O 3.26Å; F351-V355 WeakPolarHBondContact CA-O 3.27Å; F351-V355 WeakPolarHBondContact CB-O 3.45Å; F351-V355 HydrophobicContact CD1-CG1 4.28Å; D352-V355 PolarHBondContact N-O 3.17Å; D352-V355 PolarHBondContact OD1-N 3.13Å
356	E	96.1	Very high	94	Very high	24 Å²	24	48.1 Å²	48.1	11%	0.112	26%	0.259	C	S	.	.			trans	-146	150.1	179.3	-67.8	-65.6	168.2	0	0	110.1	P246 P264 W265 G353	P246-E356 HydrophobicContact CG-CG 4.24Å; P264-E356 CarbonylContact C-O 3.54Å; P264-E356 HydrophobicContact CB-CB 3.82Å; P264-E356 HydrophobicContact CB-CG 4.11Å; P264-E356 HydrophobicContact CG-CB 3.78Å; P264-E356 HydrophobicContact CG-CG 4.21Å; P264-E356 PolarHBondContact O-N 3.09Å; P264-E356 VanDerWaalsContact O-N 3.08Å; W265-E356 WeakPolarHBondContact CA-O 3.34Å; W265-E356 VanDerWaalsContact CB-O 3.26Å; W265-E356 WeakPolarHBondContact CB-O 3.22Å; W265-E356 PolarHBondContact N-O 2.84Å; G353-E356 VanDerWaalsContact CA-OE1 3.25Å; G353-E356 WeakPolarHBondContact CA-OE1 3.28Å; G353-E356 PolarHBondContact N-OE1 2.99Å
357	P	97.3	Very high	93.9	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-79.2	145.5	176.2	32.2	-31.9	0	0	0	111.6	I240 E241 C242 G243 I281 F351	I240-P357 HydrophobicContact CD1-CB 4.11Å; I240-P357 HydrophobicContact CD1-CG 3.77Å; I240-P357 HydrophobicContact CG1-CG 4.14Å; E241-P357 VanDerWaalsContact O-CG 3.29Å; E241-P357 WeakPolarHBondContact O-CG 3.32Å; C242-P357 CarbonylContact C-O 3.51Å; C242-P357 VanDerWaalsContact CA-O 3.3Å; C242-P357 WeakPolarHBondContact CA-O 3.5Å; C242-P357 HydrophobicContact CB-CB 4.36Å; C242-P357 HydrophobicContact CB-CG 4.02Å; C242-P357 WeakPolarHBondContact CB-O 3.08Å; G243-P357 PolarHBondContact N-O 3.2Å; I281-P357 HydrophobicContact CG2-CB 4.06Å; I281-P357 CarbonylContact O-C 3.52Å; I281-P357 VanDerWaalsContact O-CA 3.27Å; I281-P357 WeakPolarHBondContact O-CA 3.17Å; F351-P357 HydrophobicContact CD2-CG 4.47Å; F351-P357 HydrophobicContact CE1-CG 4.39Å; F351-P357 HydrophobicContact CE2-CG 3.82Å; F351-P357 HydrophobicContact CZ-CB 4.18Å; F351-P357 HydrophobicContact CZ-CG 3.77Å
358	I	98.1	Very high	93.8	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-84	145.7	165.8	-167.8	166.4	0	0	0	110.1	W265 I281 I282 A440 W447 L449	W265-I358 HydrophobicContact CB-CB 3.81Å; W265-I358 HydrophobicContact CB-CG2 4.16Å; W265-I358 HydrophobicContact CD2-CB 3.75Å; W265-I358 HydrophobicContact CD2-CD1 4.09Å; W265-I358 HydrophobicContact CD2-CG1 4.14Å; W265-I358 HydrophobicContact CE3-CB 4.05Å; W265-I358 HydrophobicContact CE3-CG1 4.4Å; W265-I358 HydrophobicContact CG-CB 3.65Å; W265-I358 HydrophobicContact CG-CD1 4.3Å; W265-I358 HydrophobicContact CG-CG1 4.4Å; W265-I358 HydrophobicContact CG-CG2 4.24Å; W265-I358 HydrophobicContact CZ2-CD1 4.07Å; I281-I358 WeakPolarHBondContact O-CG2 3.28Å; I281-I358 PolarHBondContact O-N 3.46Å; I282-I358 HydrophobicContact CG2-CG2 4.4Å; I358-A440 HydrophobicContact CD1-CB 3.57Å; I358-W447 HydrophobicContact CG1-CB 4.48Å; I358-W447 WeakPolarHBondContact CG1-O 2.96Å; I358-L449 HydrophobicContact CD1-CB 3.89Å; I358-L449 HydrophobicContact CD1-CD1 4.26Å; I358-L449 HydrophobicContact CG1-CB 4.14Å; I358-L449 HydrophobicContact CG2-CB 3.77Å; I358-L449 HydrophobicContact CG2-CD1 4.48Å; I358-L449 HydrophobicContact CG2-CD2 4.13Å; I358-L449 HydrophobicContact CG2-CG 4.36Å
359	C	96.9	Very high	93.9	Very high	13 Å²	13	45.2 Å²	45.2	9%	0.088	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-72	142.2	176	-65.3	0	0	0	0	111.2	C242 V446 W447 K448 L449	C242-C359 HydrophobicContact CB-CB 4.04Å; C242-C359 WeakPolarHBondContact CB-SG 3.13Å; C242-C359 PolarHBondContact O-SG 3.47Å; C242-C359 WeakPolarHBondContact SG-CA 3.26Å; C242-C359 WeakPolarHBondContact SG-CB 3.07Å; C242-C359 CovalentContact SG-SG 2.04Å; C242-C359 PolarHBondContact SG-SG 2.82Å; C359-V446 HydrophobicContact CB-CG1 4.17Å; C359-V446 WeakPolarHBondContact SG-CG1 3.27Å; C359-W447 WeakPolarHBondContact CB-O 3.21Å; C359-W447 PolarHBondContact N-O 3.09Å; C359-W447 VanDerWaalsContact N-O 3.15Å; C359-K448 HydrophobicContact CB-CG 4.05Å; C359-K448 CarbonylContact O-C 3.56Å; C359-K448 VanDerWaalsContact O-CA 3.26Å; C359-K448 WeakPolarHBondContact O-CA 3.28Å; C359-L449 PolarHBondContact O-N 2.87Å
360	L	96.6	Very high	94	Very high	12 Å²	12	47 Å²	47	6%	0.063	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-81.2	145.3	162.8	-64.1	176.9	0	0	0	109.2	I282 L449 I471 L475 I478	I282-L360 HydrophobicContact CG2-CD2 3.91Å; I282-L360 HydrophobicContact CG2-CG 4.46Å; L360-L449 HydrophobicContact CD2-CD2 4.4Å; L360-I471 HydrophobicContact CD2-CG2 3.93Å; L360-L475 HydrophobicContact CB-CD1 4.03Å; L360-L475 HydrophobicContact CD1-CD1 4.13Å; L360-I478 HydrophobicContact CD1-CG2 3.89Å
361	P	95.9	Very high	94.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-55.7	153.2	168.1	-24.1	33.6	0	0	0	112.1	F367 L449 I471 T472 L475	P361-F367 HydrophobicContact CB-CE2 3.89Å; P361-F367 HydrophobicContact CB-CZ 4.18Å; P361-F367 HydrophobicContact CG-CE2 3.8Å; P361-F367 HydrophobicContact CG-CZ 4.05Å; P361-L449 WeakPolarHBondContact CD-O 3.36Å; P361-L449 WeakPolarHBondContact CG-O 3.43Å; P361-I471 HydrophobicContact CG-CG2 4.21Å; P361-T472 HydrophobicContact CB-CG2 3.92Å; P361-T472 HydrophobicContact CG-CG2 4.2Å; P361-L475 WeakPolarHBondContact O-CD2 3.43Å
362	N	94.9	Very high	94.2	Very high	12 Å²	12	45.8 Å²	45.8	6%	0.064	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-81.6	162.3	170.3	-70.6	-34.7	0	0	0	111.1	L146 G148 S151 G364 E365	L146-N362 WeakPolarHBondContact CB-OD1 3.42Å; G148-N362 WeakPolarHBondContact O-CB 3.5Å; G148-N362 PolarHBondContact O-ND2 2.94Å; S151-N362 WeakPolarHBondContact CA-ND2 3.35Å; S151-N362 PolarHBondContact N-ND2 3.15Å; S151-N362 PolarHBondContact OG-ND2 2.87Å; N362-G364 PolarHBondContact O-N 3.41Å; N362-E365 HydrophobicContact CB-CB 4.44Å; N362-E365 PolarHBondContact N-OE2 2.84Å; N362-E365 VanDerWaalsContact O-CB 3.26Å; N362-E365 WeakPolarHBondContact O-CB 3.25Å; N362-E365 PolarHBondContact O-N 3.23Å
363	Y	94.3	Very high	94.4	Very high	38 Å²	38	41.7 Å²	41.7	15%	0.149	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-63.8	134.2	173.2	-76.9	-89	0	0	0	111.1	R145 L146 S147 G148 E365 L475 S476	R145-Y363 HydrophobicContact CB-CD2 3.55Å; R145-Y363 HydrophobicContact CB-CE2 3.52Å; R145-Y363 HydrophobicContact CB-CG 4.41Å; R145-Y363 HydrophobicContact CG-CD2 4.01Å; R145-Y363 HydrophobicContact CG-CE2 4.36Å; R145-Y363 HydrophobicContact CG-CG 4.44Å; L146-Y363 WeakPolarHBondContact O-CD2 3.21Å; L146-Y363 PolarHBondContact O-N 2.96Å; S147-Y363 CarbonylContact C-O 3.59Å; S147-Y363 VanDerWaalsContact CA-O 3.28Å; S147-Y363 WeakPolarHBondContact CA-O 3.46Å; G148-Y363 PolarHBondContact N-O 2.97Å; Y363-E365 PolarHBondContact O-N 2.87Å; Y363-L475 HydrophobicContact CD1-CD2 4.04Å; Y363-L475 HydrophobicContact CD2-CD2 3.46Å; Y363-L475 VanDerWaalsContact CD2-CD2 3.46Å; Y363-L475 HydrophobicContact CD2-CG 4.26Å; Y363-L475 HydrophobicContact CE1-CB 4.32Å; Y363-L475 HydrophobicContact CE1-CD2 4.07Å; Y363-L475 HydrophobicContact CE1-CG 4.28Å; Y363-L475 HydrophobicContact CE2-CD2 3.53Å; Y363-L475 HydrophobicContact CE2-CG 3.8Å; Y363-L475 HydrophobicContact CG-CD2 3.77Å; Y363-S476 VanDerWaalsContact CE1-OG 3.29Å; Y363-S476 WeakPolarHBondContact CE1-OG 3.25Å; Y363-S476 WeakPolarHBondContact OH-CA 3.27Å; Y363-S476 PolarHBondContact OH-N 3.11Å; Y363-S476 PolarHBondContact OH-OG 3.02Å; Y363-S476 VanDerWaalsContact OH-OG 3.07Å
364	G	91	Very high	94.6	Very high	67 Å²	67	44.2 Å²	44.2	69%	0.691	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.5	1.5	-177.1	0	0	0	0	0	114.2	N362	N362-G364 PolarHBondContact O-N 3.41Å
365	E	91.9	Very high	94.7	Very high	11 Å²	11	40.7 Å²	40.7	5%	0.051	22%	0.224	C	C	.	.			trans	-74.1	132	172.5	-169	174.4	178	0	0	110.8	N362 Y363 F367 K448 T472	N362-E365 HydrophobicContact CB-CB 4.44Å; N362-E365 PolarHBondContact N-OE2 2.84Å; N362-E365 VanDerWaalsContact O-CB 3.26Å; N362-E365 WeakPolarHBondContact O-CB 3.25Å; N362-E365 PolarHBondContact O-N 3.23Å; Y363-E365 PolarHBondContact O-N 2.87Å; E365-F367 HydrophobicContact CG-CE2 4.21Å; E365-F367 HydrophobicContact CG-CZ 4.14Å; E365-K448 WeakPolarHBondContact OE1-CD 3.45Å; E365-K448 IonicContact OE1-NZ 3.88Å; E365-K448 PolarHBondContact OE1-NZ 3.23Å; E365-K448 IonicContact OE2-NZ 3.8Å; E365-K448 PolarHBondContact OE2-NZ 2.84Å; E365-T472 WeakPolarHBondContact O-CG2 3.36Å
366	E	88.7	Confident	94.6	Very high	164 Å²	164	40.4 Å²	40.4	77%	0.766	22%	0.223	S	C	*	.			trans	-118.6	139.8	-178.9	-63.9	-170.7	165.4	0	0	111.5
367	F	92.1	Very high	94.5	Very high	32 Å²	32	39.4 Å²	39.4	14%	0.14	22%	0.218	C	C	.	.			trans	-112.5	119.3	175.5	-60.3	-88.3	0	0	0	108.8	P361 E365 L398 C441 K448 V450 T472	P361-F367 HydrophobicContact CB-CE2 3.89Å; P361-F367 HydrophobicContact CB-CZ 4.18Å; P361-F367 HydrophobicContact CG-CE2 3.8Å; P361-F367 HydrophobicContact CG-CZ 4.05Å; E365-F367 HydrophobicContact CG-CE2 4.21Å; E365-F367 HydrophobicContact CG-CZ 4.14Å; F367-L398 HydrophobicContact CB-CD1 3.56Å; F367-C441 HydrophobicContact CD1-CB 4.37Å; F367-C441 HydrophobicContact CE1-CB 4.49Å; F367-K448 HydrophobicContact CE1-CD 4.44Å; F367-K448 HydrophobicContact CZ-CB 4.23Å; F367-K448 HydrophobicContact CZ-CD 4.05Å; F367-V450 HydrophobicContact CB-CG1 4.25Å; F367-V450 HydrophobicContact CD1-CG2 3.66Å; F367-V450 HydrophobicContact CD2-CB 4.39Å; F367-V450 HydrophobicContact CD2-CG1 3.76Å; F367-V450 HydrophobicContact CD2-CG2 3.75Å; F367-V450 HydrophobicContact CE1-CG2 3.53Å; F367-V450 HydrophobicContact CE2-CG1 4.31Å; F367-V450 HydrophobicContact CE2-CG2 3.62Å; F367-V450 HydrophobicContact CG-CG1 3.95Å; F367-V450 HydrophobicContact CG-CG2 3.78Å; F367-V450 HydrophobicContact CZ-CG2 3.52Å; F367-T472 HydrophobicContact CD2-CG2 4.36Å; F367-T472 HydrophobicContact CE2-CG2 4.13Å
368	T	91.6	Very high	94.2	Very high	91 Å²	91	39.5 Å²	39.5	56%	0.558	22%	0.219	S	C	*	.			trans	-77.9	151.2	-172.5	56.4	0	0	0	0	112.2	R371	T368-R371 VanDerWaalsContact O-CB 3.25Å; T368-R371 WeakPolarHBondContact O-CB 3.47Å; T368-R371 PolarHBondContact O-N 2.85Å
369	E	95.1	Very high	93.5	Very high	111 Å²	111	39.6 Å²	39.6	52%	0.519	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	144.9	168.2	-179.7	170.1	-135.9	0	0	111.3	R371 S400 T403	E369-R371 PolarHBondContact O-N 3.36Å; E369-S400 VanDerWaalsContact CD-CB 3.48Å; E369-S400 VanDerWaalsContact OE1-CB 3.29Å; E369-S400 WeakPolarHBondContact OE1-CB 3.45Å; E369-S400 PolarHBondContact OE1-N 3.48Å; E369-S400 VanDerWaalsContact OE1-N 3.11Å; E369-S400 PolarHBondContact OE1-OG 3.36Å; E369-S400 PolarHBondContact OE2-OG 3.19Å; E369-T403 PolarHBondContact OE1-OG1 3.07Å
370	G	95.8	Very high	92.4	Very high	47 Å²	47	39.3 Å²	39.3	49%	0.485	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	-5.1	-177.1	0	0	0	0	0	114.7	M372 L398	G370-M372 PolarHBondContact O-N 2.92Å; G370-L398 PolarHBondContact N-O 3.46Å
371	R	95.4	Very high	91.1	Very high	69 Å²	69	43.1 Å²	43.1	26%	0.26	24%	0.242	S	C	.	.			trans	-63.9	127.2	174.2	-172.7	174.7	-158.3	98	-7	109.9	T368 E369 P397 L398 E442 D443	T368-R371 VanDerWaalsContact O-CB 3.25Å; T368-R371 WeakPolarHBondContact O-CB 3.47Å; T368-R371 PolarHBondContact O-N 2.85Å; E369-R371 PolarHBondContact O-N 3.36Å; R371-P397 CarbonylContact O-C 3.46Å; R371-P397 WeakPolarHBondContact O-CA 3.42Å; R371-L398 HydrophobicContact CB-CD1 4.08Å; R371-L398 HydrophobicContact CB-CG 4.34Å; R371-L398 PolarHBondContact O-N 2.86Å; R371-E442 PolarHBondContact NE-O 2.92Å; R371-E442 PolarHBondContact NH2-O 3.47Å; R371-D443 IonicContact CZ-OD1 3.54Å; R371-D443 VanDerWaalsContact NH2-CA 3.33Å; R371-D443 IonicContact NH2-OD1 2.73Å; R371-D443 PolarHBondContact NH2-OD1 3.2Å
372	M	95.4	Very high	89.4	Confident	90 Å²	90	49.5 Å²	49.5	44%	0.443	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	127	175.7	-61.2	-55.9	-66.3	0	0	110.6	G370 T395 P397 Y423	G370-M372 PolarHBondContact O-N 2.92Å; M372-T395 HydrophobicContact CB-CG2 3.93Å; M372-T395 HydrophobicContact CE-CG2 3.48Å; M372-T395 VanDerWaalsContact CE-CG2 3.48Å; M372-P397 HydrophobicContact SD-CB 3.8Å; M372-P397 HydrophobicContact SD-CG 4.48Å; M372-Y423 WeakPolarHBondContact CE-OH 3.28Å
373	C	96.1	Very high	88.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	164.4	177.6	-56.2	0	0	0	0	109.5	T395 I396 L439 A440 C441	C373-T395 CarbonylContact O-C 3.53Å; C373-T395 VanDerWaalsContact O-CA 3.3Å; C373-T395 WeakPolarHBondContact O-CA 3.31Å; C373-T395 VanDerWaalsContact O-CG2 3.31Å; C373-T395 WeakPolarHBondContact O-CG2 3.36Å; C373-I396 PolarHBondContact N-O 3.34Å; C373-I396 PolarHBondContact O-N 2.73Å; C373-L439 HydrophobicContact CB-CD1 3.76Å; C373-L439 HydrophobicContact CB-CG 4.27Å; C373-A440 CarbonylContact C-O 3.45Å; C373-A440 WeakPolarHBondContact CA-O 3.14Å; C373-C441 HydrophobicContact CB-CB 4.05Å; C373-C441 WeakPolarHBondContact CB-SG 3.38Å; C373-C441 WeakPolarHBondContact SG-CB 3.37Å; C373-C441 CovalentContact SG-SG 2.03Å; C373-C441 PolarHBondContact SG-SG 3.08Å
374	W	95.4	Very high	87.1	Confident	54 Å²	54	57.5 Å²	57.5	21%	0.205	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.8	-179	-75.3	75.3	0	0	0	110.5	F263 A394 T395 A440 W447	F263-W374 HydrophobicContact CE1-CB 3.82Å; F263-W374 HydrophobicContact CE1-CD2 4.25Å; F263-W374 HydrophobicContact CE1-CE3 4.17Å; F263-W374 HydrophobicContact CE1-CG 4.17Å; F263-W374 HydrophobicContact CZ-CB 4.32Å; F263-W374 HydrophobicContact CZ-CD2 4.02Å; F263-W374 AromaticContact CZ-CE3 3.52Å; F263-W374 HydrophobicContact CZ-CE3 3.52Å; F263-W374 HydrophobicContact CZ-CG 4.41Å; F263-W374 HydrophobicContact CZ-CZ3 4.09Å; W374-A394 WeakPolarHBondContact CA-O 3.48Å; W374-T395 VanDerWaalsContact CE2-OG1 3.26Å; W374-T395 WeakPolarHBondContact CH2-OG1 3.37Å; W374-T395 WeakPolarHBondContact CZ2-OG1 3.34Å; W374-A440 PolarHBondContact N-O 3.38Å; W374-A440 PolarHBondContact O-N 3.26Å; W374-W447 HydrophobicContact CB-CZ3 4.08Å; W374-W447 AromaticContact CD1-CH2 3.26Å; W374-W447 AromaticContact CD1-CZ3 3.39Å; W374-W447 AromaticContact CG-CH2 3.98Å; W374-W447 HydrophobicContact CG-CH2 3.98Å; W374-W447 AromaticContact CG-CZ3 3.9Å; W374-W447 HydrophobicContact CG-CZ3 3.9Å; W374-W447 AromaticContact NE1-CH2 3.58Å
375	I	94.9	Very high	86.1	Confident	8 Å²	8	55.4 Å²	55.4	4%	0.041	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	147.3	164.9	54.9	166.9	0	0	0	108.8	S393 A394 I396 S430 L439 Y468	I375-S393 WeakPolarHBondContact O-CA 3.06Å; I375-S393 VanDerWaalsContact O-CB 3.28Å; I375-S393 WeakPolarHBondContact O-CB 3.2Å; I375-A394 HydrophobicContact CD1-CB 4.19Å; I375-A394 HydrophobicContact CG1-CB 3.99Å; I375-A394 PolarHBondContact N-O 3.13Å; I375-A394 PolarHBondContact O-N 3.08Å; I375-I396 HydrophobicContact CD1-CD1 4.21Å; I375-I396 HydrophobicContact CD1-CG2 4.5Å; I375-I396 HydrophobicContact CG1-CD1 4.32Å; I375-I396 HydrophobicContact CG2-CD1 3.54Å; I375-I396 HydrophobicContact CG2-CG1 4.16Å; I375-S430 VanDerWaalsContact CD1-OG 3.25Å; I375-S430 WeakPolarHBondContact CD1-OG 3.37Å; I375-L439 HydrophobicContact CG2-CD1 3.75Å; I375-Y468 HydrophobicContact CG2-CE1 4.01Å
376	S	94.2	Very high	85.2	Confident	5 Å²	5	63.5 Å²	63.5	4%	0.035	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	145.8	175.3	54.3	0	0	0	0	110.9	Q266 R392 P438	Q266-S376 PolarHBondContact OE1-O 3.27Å; Q266-S376 PolarHBondContact OE1-OG 3.44Å; S376-R392 VanDerWaalsContact CA-O 3.26Å; S376-R392 WeakPolarHBondContact CA-O 3.32Å; S376-R392 WeakPolarHBondContact CB-O 3.44Å; S376-P438 WeakPolarHBondContact OG-CG 3.08Å
377	G	93.3	Very high	84.8	Confident	2 Å²	2	58.7 Å²	58.7	2%	0.021	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.4	-178.3	179.6	0	0	0	0	0	113.5	R392 D434	G377-R392 PolarHBondContact N-O 2.81Å; G377-R392 VanDerWaalsContact N-O 3.16Å; G377-R392 PolarHBondContact O-N 2.94Å; G377-D434 VanDerWaalsContact C-OD1 3.22Å; G377-D434 WeakPolarHBondContact CA-OD1 3.45Å
378	W	90.9	Very high	84.4	Confident	2 Å²	2	58 Å²	58	1%	0.008	32%	0.315	C	S	.	.			trans	-112.3	18.3	-179.5	-68	-89.2	0	0	0	111.4	Q266 L309 Q312 S387 S388 V390 L391 D434	Q266-W378 HydrophobicContact CG-CE3 4.44Å; Q266-W378 HydrophobicContact CG-CH2 3.59Å; Q266-W378 HydrophobicContact CG-CZ3 3.45Å; Q266-W378 VanDerWaalsContact CG-CZ3 3.45Å; L309-W378 HydrophobicContact CB-CZ2 4.14Å; L309-W378 WeakPolarHBondContact O-CZ2 3.29Å; Q312-W378 HydrophobicContact CG-CB 4.47Å; Q312-W378 HydrophobicContact CG-CG 4Å; Q312-W378 VanDerWaalsContact NE2-CD2 3.26Å; Q312-W378 VanDerWaalsContact NE2-CG 3.26Å; W378-S387 CarbonylContact O-C 3.52Å; W378-S387 WeakPolarHBondContact O-CA 3.46Å; W378-S387 WeakPolarHBondContact O-CB 3.3Å; W378-S388 WeakPolarHBondContact CB-O 3.47Å; W378-S388 PolarHBondContact O-N 3.16Å; W378-V390 VanDerWaalsContact CD1-C 3.43Å; W378-L391 HydrophobicContact CD2-CB 4.49Å; W378-L391 HydrophobicContact CD2-CD1 3.88Å; W378-L391 HydrophobicContact CE3-CD1 3.97Å; W378-L391 HydrophobicContact CH2-CD1 3.88Å; W378-L391 HydrophobicContact CH2-CD2 4.5Å; W378-L391 HydrophobicContact CZ2-CB 3.8Å; W378-L391 HydrophobicContact CZ2-CD1 3.79Å; W378-L391 HydrophobicContact CZ2-CD2 4.29Å; W378-L391 HydrophobicContact CZ2-CG 4.15Å; W378-L391 HydrophobicContact CZ3-CD1 3.98Å; W378-L391 VanDerWaalsContact NE1-N 3.19Å; W378-D434 PolarHBondContact N-OD1 2.8Å
379	G	82.7	Confident	84	Confident	3 Å²	3	57.1 Å²	57.1	3%	0.031	31%	0.309	C	S	.	.			trans	-62.1	169.5	177.7	0	0	0	0	0	113.3	S388 Q432 D434	G379-S388 PolarHBondContact O-N 3.25Å; G379-Q432 CarbonylContact C-O 3.57Å; G379-Q432 WeakPolarHBondContact CA-O 3.22Å; G379-D434 WeakPolarHBondContact CA-OD1 3.36Å; G379-D434 PolarHBondContact N-OD1 2.88Å
380	A	73.5	Confident	83.7	Confident	7 Å²	7	53.6 Å²	53.6	6%	0.058	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-56.9	143.6	176.5	0	0	0	0	0	110.8	E382 G385 E386 C431 Q432	A380-E382 VanDerWaalsContact C-N 3.32Å; A380-E382 VanDerWaalsContact CB-O 3.32Å; A380-E382 WeakPolarHBondContact CB-O 3.3Å; A380-G385 VanDerWaalsContact CB-O 3.28Å; A380-G385 WeakPolarHBondContact CB-O 3.47Å; A380-E386 WeakPolarHBondContact CA-O 3.4Å; A380-C431 WeakPolarHBondContact O-CB 3.35Å; A380-Q432 PolarHBondContact N-O 3.22Å
381	T	70.1	Confident	83.5	Confident	92 Å²	92	51.6 Å²	51.6	56%	0.564	27%	0.273	S	S	*	.	S	Bend	trans	-86.3	-9.4	177.8	51.7	0	0	0	0	113.5
382	E	59.3	Low	83.3	Confident	134 Å²	134	51.4 Å²	51.4	63%	0.626	27%	0.273	S	S	*	.	S	Bend	trans	-146.3	155.7	177.1	59.7	-169.7	170.8	0	0	108.4	A380 D384 G385	A380-E382 VanDerWaalsContact C-N 3.32Å; A380-E382 VanDerWaalsContact CB-O 3.32Å; A380-E382 WeakPolarHBondContact CB-O 3.3Å; E382-D384 PolarHBondContact O-N 2.66Å; E382-G385 PolarHBondContact O-N 2.96Å
383	E	69.5	Low	83.1	Confident	88 Å²	88	47.4 Å²	47.4	41%	0.411	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	136.5	177.8	-176.3	172.8	-174.7	0	0	110.7	G385 C459	E383-G385 PolarHBondContact O-N 2.96Å; E383-C459 HydrophobicContact CB-CB 4.41Å
384	D	72.7	Confident	82.9	Confident	130 Å²	130	48.3 Å²	48.3	70%	0.695	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	13.1	-173.1	-61.1	-38.5	0	0	0	115	E382	E382-D384 PolarHBondContact O-N 2.66Å
385	G	68.6	Low	82.7	Confident	24 Å²	24	47.7 Å²	47.7	25%	0.247	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-78	169.9	175.2	0	0	0	0	0	113.7	A380 E382 E383	A380-G385 VanDerWaalsContact CB-O 3.28Å; A380-G385 WeakPolarHBondContact CB-O 3.47Å; E382-G385 PolarHBondContact O-N 2.96Å; E383-G385 PolarHBondContact O-N 2.96Å
386	E	74.9	Confident	82.7	Confident	180 Å²	180	47.3 Å²	47.3	84%	0.841	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-76.5	145.8	173.9	-66.8	-170.4	164.8	0	0	112	A380	A380-E386 WeakPolarHBondContact CA-O 3.4Å
387	S	79.9	Confident	82.8	Confident	63 Å²	63	48.1 Å²	48.1	44%	0.441	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-54.7	139.6	173	-61	0	0	0	0	111.6	W378	W378-S387 CarbonylContact O-C 3.52Å; W378-S387 WeakPolarHBondContact O-CA 3.46Å; W378-S387 WeakPolarHBondContact O-CB 3.3Å
388	S	82.6	Confident	83.1	Confident	19 Å²	19	48.2 Å²	48.2	13%	0.133	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-70.7	134.7	179.3	-156.9	0	0	0	0	111.8	W378 G379 V390	W378-S388 WeakPolarHBondContact CB-O 3.47Å; W378-S388 PolarHBondContact O-N 3.16Å; G379-S388 PolarHBondContact O-N 3.25Å; S388-V390 VanDerWaalsContact C-N 3.27Å; S388-V390 WeakPolarHBondContact CB-O 3.35Å; S388-V390 PolarHBondContact O-N 2.9Å; S388-V390 PolarHBondContact OG-O 3.1Å
389	V	84.4	Confident	83.4	Confident	71 Å²	71	48.9 Å²	48.9	43%	0.43	27%	0.27	S	S	.	.	S	Bend	trans	-68.6	-30.4	172.1	178.9	0	0	0	0	111.3	E311 Q312 L313	E311-V389 CarbonylContact C-O 3.53Å; E311-V389 VanDerWaalsContact CA-O 3.25Å; E311-V389 WeakPolarHBondContact CA-O 3.35Å; Q312-V389 HydrophobicContact CB-CG1 4.45Å; Q312-V389 PolarHBondContact N-O 3.35Å; L313-V389 HydrophobicContact CD1-CG1 3.68Å; L313-V389 HydrophobicContact CG-CG1 3.89Å
390	V	88.8	Confident	84	Confident	38 Å²	38	50.2 Å²	50.2	23%	0.23	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-103.2	145.1	-177.6	-58.4	0	0	0	0	110.6	V257 T310 E311 W378 S388 R392	V257-V390 HydrophobicContact CG1-CB 4.29Å; V257-V390 HydrophobicContact CG1-CG2 4.17Å; V257-V390 HydrophobicContact CG2-CG2 4.16Å; T310-V390 CarbonylContact O-C 3.45Å; T310-V390 WeakPolarHBondContact O-CA 3.38Å; E311-V390 HydrophobicContact CG-CG1 4.17Å; W378-V390 VanDerWaalsContact CD1-C 3.43Å; S388-V390 VanDerWaalsContact C-N 3.27Å; S388-V390 WeakPolarHBondContact CB-O 3.35Å; S388-V390 PolarHBondContact O-N 2.9Å; S388-V390 PolarHBondContact OG-O 3.1Å; V390-R392 HydrophobicContact CG2-CG 4.43Å; V390-R392 PolarHBondContact O-N 3.45Å
391	L	90.8	Very high	85.1	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.021	29%	0.294	C	S	.	.			trans	-66.3	126.6	175.9	179.4	63	0	0	0	108.6	S258 Q266 T310 W378	S258-L391 VanDerWaalsContact CB-O 3.32Å; S258-L391 WeakPolarHBondContact CB-O 3.48Å; S258-L391 PolarHBondContact N-O 3.16Å; S258-L391 PolarHBondContact OG-O 3.29Å; Q266-L391 HydrophobicContact CG-CD1 3.82Å; Q266-L391 HydrophobicContact CG-CD2 4.26Å; T310-L391 HydrophobicContact CG2-CD2 4.48Å; T310-L391 PolarHBondContact O-N 3.28Å; W378-L391 HydrophobicContact CD2-CB 4.49Å; W378-L391 HydrophobicContact CD2-CD1 3.88Å; W378-L391 HydrophobicContact CE3-CD1 3.97Å; W378-L391 HydrophobicContact CH2-CD1 3.88Å; W378-L391 HydrophobicContact CH2-CD2 4.5Å; W378-L391 HydrophobicContact CZ2-CB 3.8Å; W378-L391 HydrophobicContact CZ2-CD1 3.79Å; W378-L391 HydrophobicContact CZ2-CD2 4.29Å; W378-L391 HydrophobicContact CZ2-CG 4.15Å; W378-L391 HydrophobicContact CZ3-CD1 3.98Å; W378-L391 VanDerWaalsContact NE1-N 3.19Å
392	R	90.9	Very high	86.4	Confident	65 Å²	65	56.8 Å²	56.8	25%	0.245	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	162.8	176.6	-56.6	-170.8	78.9	88.3	-15.9	110.5	N256 S258 S376 G377 V390	N256-R392 VanDerWaalsContact CB-NH2 3.32Å; N256-R392 VanDerWaalsContact CG-NH2 3.32Å; N256-R392 PolarHBondContact ND2-NH2 2.76Å; N256-R392 WeakPolarHBondContact O-CA 3.47Å; N256-R392 VanDerWaalsContact O-CB 3.25Å; N256-R392 WeakPolarHBondContact O-CB 3.31Å; N256-R392 WeakPolarHBondContact O-CG 3.31Å; N256-R392 PolarHBondContact O-NE 3.45Å; S258-R392 VanDerWaalsContact OG-C 3.23Å; S258-R392 PolarHBondContact OG-O 3.32Å; S376-R392 VanDerWaalsContact CA-O 3.26Å; S376-R392 WeakPolarHBondContact CA-O 3.32Å; S376-R392 WeakPolarHBondContact CB-O 3.44Å; G377-R392 PolarHBondContact N-O 2.81Å; G377-R392 VanDerWaalsContact N-O 3.16Å; G377-R392 PolarHBondContact O-N 2.94Å; V390-R392 HydrophobicContact CG2-CG 4.43Å; V390-R392 PolarHBondContact O-N 3.45Å
393	S	91.9	Very high	88.2	Confident	7 Å²	7	51.7 Å²	51.7	5%	0.049	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	151.9	172.4	56.2	0	0	0	0	111.4	S258 F263 I375	S258-S393 VanDerWaalsContact OG-CB 3.28Å; S258-S393 WeakPolarHBondContact OG-CB 3.19Å; S258-S393 PolarHBondContact OG-N 2.97Å; S258-S393 PolarHBondContact OG-OG 3.11Å; F263-S393 VanDerWaalsContact CE2-OG 3.28Å; F263-S393 WeakPolarHBondContact CE2-OG 3.02Å; I375-S393 WeakPolarHBondContact O-CA 3.06Å; I375-S393 VanDerWaalsContact O-CB 3.28Å; I375-S393 WeakPolarHBondContact O-CB 3.2Å
394	A	91	Very high	89.5	Confident	19 Å²	19	47.5 Å²	47.5	16%	0.157	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	158	177.2	0	0	0	0	0	110.8	W374 I375 I428	W374-A394 WeakPolarHBondContact CA-O 3.48Å; I375-A394 HydrophobicContact CD1-CB 4.19Å; I375-A394 HydrophobicContact CG1-CB 3.99Å; I375-A394 PolarHBondContact N-O 3.13Å; I375-A394 PolarHBondContact O-N 3.08Å; A394-I428 HydrophobicContact CB-CG2 3.54Å
395	T	92.8	Very high	90.6	Very high	40 Å²	40	43.4 Å²	43.4	25%	0.245	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	125.8	176.1	-39.7	0	0	0	0	110.1	M372 C373 W374 Y423	M372-T395 HydrophobicContact CB-CG2 3.93Å; M372-T395 HydrophobicContact CE-CG2 3.48Å; M372-T395 VanDerWaalsContact CE-CG2 3.48Å; C373-T395 CarbonylContact O-C 3.53Å; C373-T395 VanDerWaalsContact O-CA 3.3Å; C373-T395 WeakPolarHBondContact O-CA 3.31Å; C373-T395 VanDerWaalsContact O-CG2 3.31Å; C373-T395 WeakPolarHBondContact O-CG2 3.36Å; W374-T395 VanDerWaalsContact CE2-OG1 3.26Å; W374-T395 WeakPolarHBondContact CH2-OG1 3.37Å; W374-T395 WeakPolarHBondContact CZ2-OG1 3.34Å; T395-Y423 PolarHBondContact O-OH 2.03Å
396	I	94.4	Very high	92	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	144.8	-177.2	58.8	174.4	0	0	0	110.8	C373 I375 A421 Y423 I428 L439 Y468	C373-I396 PolarHBondContact N-O 3.34Å; C373-I396 PolarHBondContact O-N 2.73Å; I375-I396 HydrophobicContact CD1-CD1 4.21Å; I375-I396 HydrophobicContact CD1-CG2 4.5Å; I375-I396 HydrophobicContact CG1-CD1 4.32Å; I375-I396 HydrophobicContact CG2-CD1 3.54Å; I375-I396 HydrophobicContact CG2-CG1 4.16Å; I396-A421 HydrophobicContact CD1-CB 3.57Å; I396-A421 HydrophobicContact CG1-CB 4.04Å; I396-Y423 HydrophobicContact CG2-CD2 4.48Å; I396-Y423 HydrophobicContact CG2-CE2 4.07Å; I396-I428 HydrophobicContact CG2-CG2 3.78Å; I396-L439 HydrophobicContact CD1-CD1 3.97Å; I396-L439 HydrophobicContact CG1-CD1 4.17Å; I396-Y468 HydrophobicContact CD1-CE2 4.33Å; I396-Y468 WeakPolarHBondContact CD1-OH 3.36Å
397	P	96.9	Very high	93.1	Very high	22 Å²	22	41.2 Å²	41.2	14%	0.143	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	150.1	176.1	31.8	-32.6	0	0	0	111.7	R371 M372 A421 G422 Y423	R371-P397 CarbonylContact O-C 3.46Å; R371-P397 WeakPolarHBondContact O-CA 3.42Å; M372-P397 HydrophobicContact SD-CB 3.8Å; M372-P397 HydrophobicContact SD-CG 4.48Å; P397-A421 CarbonylContact O-C 3.42Å; P397-A421 WeakPolarHBondContact O-CA 3.27Å; P397-A421 WeakPolarHBondContact O-CB 3.44Å; P397-G422 WeakPolarHBondContact CD-O 3.38Å; P397-G422 VanDerWaalsContact CG-O 3.28Å; P397-G422 WeakPolarHBondContact CG-O 3.45Å; P397-G422 PolarHBondContact O-N 3.31Å; P397-Y423 HydrophobicContact CG-CD1 4.21Å; P397-Y423 HydrophobicContact CG-CE1 3.99Å
398	L	97.9	Very high	93.8	Very high	5 Å²	5	42.2 Å²	42.2	3%	0.026	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	139.9	166.8	-62.8	-177	0	0	0	111.1	F367 G370 R371 I419 A421 L439	F367-L398 HydrophobicContact CB-CD1 3.56Å; G370-L398 PolarHBondContact N-O 3.46Å; R371-L398 HydrophobicContact CB-CD1 4.08Å; R371-L398 HydrophobicContact CB-CG 4.34Å; R371-L398 PolarHBondContact O-N 2.86Å; L398-I419 HydrophobicContact CD1-CD1 4.2Å; L398-I419 HydrophobicContact CD2-CD1 3.96Å; L398-I419 HydrophobicContact CD2-CG1 4.47Å; L398-A421 HydrophobicContact CD2-CB 4.05Å; L398-L439 HydrophobicContact CD2-CD2 3.87Å
399	I	97.6	Very high	94.5	Very high	15 Å²	15	41.4 Å²	41.4	8%	0.077	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	135.4	176.6	-58.3	173.9	0	0	0	108.6	T403 C404 C420 G422 L424 P465	I399-T403 HydrophobicContact CG2-CG2 3.7Å; I399-C404 HydrophobicContact CG2-CB 4.36Å; I399-C420 HydrophobicContact CB-CB 3.91Å; I399-C420 HydrophobicContact CG2-CB 4.45Å; I399-C420 PolarHBondContact N-O 3.4Å; I399-G422 WeakPolarHBondContact CD1-O 3.42Å; I399-L424 HydrophobicContact CD1-CD2 4.12Å; I399-L424 HydrophobicContact CD1-CG 4.43Å; I399-P465 HydrophobicContact CD1-CB 3.46Å; I399-P465 VanDerWaalsContact CD1-CB 3.46Å; I399-P465 HydrophobicContact CD1-CG 3.68Å
400	S	96.7	Very high	95	Very high	31 Å²	31	38.3 Å²	38.3	22%	0.217	21%	0.211	C	C	.	.			trans	-64.9	146.6	177.2	64.3	0	0	0	0	112.1	E369 K402 T403 C404	E369-S400 VanDerWaalsContact CD-CB 3.48Å; E369-S400 VanDerWaalsContact OE1-CB 3.29Å; E369-S400 WeakPolarHBondContact OE1-CB 3.45Å; E369-S400 PolarHBondContact OE1-N 3.48Å; E369-S400 VanDerWaalsContact OE1-N 3.11Å; E369-S400 PolarHBondContact OE1-OG 3.36Å; E369-S400 PolarHBondContact OE2-OG 3.19Å; S400-K402 PolarHBondContact O-N 3.44Å; S400-K402 VanDerWaalsContact O-N 3.13Å; S400-T403 PolarHBondContact O-N 3.43Å; S400-T403 PolarHBondContact OG-N 3.16Å; S400-T403 PolarHBondContact OG-OG1 2.77Å; S400-C404 PolarHBondContact O-N 3.47Å
401	T	95.6	Very high	95.3	Very high	60 Å²	60	44.4 Å²	44.4	37%	0.368	24%	0.235	S	C	.	.	H	α-helix	trans	-54.2	-34.1	174.3	-52.4	0	0	0	0	112	C404 N405 I414	T401-C404 PolarHBondContact O-N 2.88Å; T401-N405 WeakPolarHBondContact CG2-ND2 3.43Å; T401-N405 VanDerWaalsContact O-CB 3.28Å; T401-N405 WeakPolarHBondContact O-CB 3.26Å; T401-N405 PolarHBondContact O-N 2.88Å; T401-N405 PolarHBondContact O-ND2 3.46Å; T401-I414 HydrophobicContact CG2-CB 4.42Å; T401-I414 HydrophobicContact CG2-CG2 4.04Å
402	K	96.7	Very high	95.5	Very high	177 Å²	177	46.7 Å²	46.7	77%	0.77	26%	0.259	S	S	*	.	H	α-helix	trans	-62.7	-48.7	176.5	-178	-176.1	175.5	-173.6	0	111.6	S400 C404 N405	S400-K402 PolarHBondContact O-N 3.44Å; S400-K402 VanDerWaalsContact O-N 3.13Å; K402-C404 VanDerWaalsContact C-N 3.35Å; K402-N405 PolarHBondContact O-N 2.91Å
403	T	97.2	Very high	95.7	Very high	27 Å²	27	48.9 Å²	48.9	17%	0.166	28%	0.275	C	S	.	.	H	α-helix	trans	-63.9	-44.1	176.6	-61	0	0	0	0	110.5	E369 I399 S400 N405 Q406 L424	E369-T403 PolarHBondContact OE1-OG1 3.07Å; I399-T403 HydrophobicContact CG2-CG2 3.7Å; S400-T403 PolarHBondContact O-N 3.43Å; S400-T403 PolarHBondContact OG-N 3.16Å; S400-T403 PolarHBondContact OG-OG1 2.77Å; T403-N405 VanDerWaalsContact C-N 3.25Å; T403-N405 PolarHBondContact O-N 2.89Å; T403-Q406 WeakPolarHBondContact O-CB 3.35Å; T403-Q406 VanDerWaalsContact O-CG 3.24Å; T403-Q406 WeakPolarHBondContact O-CG 3.48Å; T403-Q406 PolarHBondContact O-N 2.94Å; T403-Q406 VanDerWaalsContact O-N 3.11Å; T403-L424 HydrophobicContact CG2-CD1 3.87Å
404	C	96.6	Very high	95.9	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.6	-28.6	-178.3	-135.4	0	0	0	0	113.5	I399 S400 T401 K402 Q406 V409 Y410 I414 C420	I399-C404 HydrophobicContact CG2-CB 4.36Å; S400-C404 PolarHBondContact O-N 3.47Å; T401-C404 PolarHBondContact O-N 2.88Å; K402-C404 VanDerWaalsContact C-N 3.35Å; C404-Q406 VanDerWaalsContact C-N 3.34Å; C404-V409 WeakPolarHBondContact O-CB 3.34Å; C404-V409 VanDerWaalsContact O-CG1 3.27Å; C404-V409 WeakPolarHBondContact O-CG1 3.32Å; C404-Y410 WeakPolarHBondContact O-CB 3.49Å; C404-Y410 PolarHBondContact O-N 2.9Å; C404-I414 HydrophobicContact CB-CG1 3.98Å; C404-C420 HydrophobicContact CB-CB 3.8Å; C404-C420 WeakPolarHBondContact CB-SG 3.25Å; C404-C420 WeakPolarHBondContact SG-CB 3.22Å; C404-C420 CovalentContact SG-SG 2.02Å; C404-C420 PolarHBondContact SG-SG 3.26Å
405	N	97.4	Very high	96.1	Very high	45 Å²	45	49.3 Å²	49.3	24%	0.241	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	9.2	176.3	-80.9	-31.9	0	0	0	114.8	T401 K402 T403 G412 L413 I414	T401-N405 WeakPolarHBondContact CG2-ND2 3.43Å; T401-N405 VanDerWaalsContact O-CB 3.28Å; T401-N405 WeakPolarHBondContact O-CB 3.26Å; T401-N405 PolarHBondContact O-N 2.88Å; T401-N405 PolarHBondContact O-ND2 3.46Å; K402-N405 PolarHBondContact O-N 2.91Å; T403-N405 VanDerWaalsContact C-N 3.25Å; T403-N405 PolarHBondContact O-N 2.89Å; N405-G412 PolarHBondContact O-N 3.4Å; N405-G412 WeakPolarHBondContact OD1-CA 3.34Å; N405-G412 PolarHBondContact OD1-N 3.48Å; N405-L413 PolarHBondContact OD1-N 3.21Å; N405-I414 PolarHBondContact ND2-O 3.33Å; N405-I414 WeakPolarHBondContact OD1-CA 3.4Å; N405-I414 VanDerWaalsContact OD1-CB 3.25Å; N405-I414 WeakPolarHBondContact OD1-CB 3.19Å; N405-I414 WeakPolarHBondContact OD1-CG1 3.46Å; N405-I414 PolarHBondContact OD1-N 3.09Å
406	Q	98	Very high	96.2	Very high	84 Å²	84	51.3 Å²	51.3	39%	0.393	29%	0.292	S	S	.	.	S	Bend	trans	-60.7	156.1	171.1	-70	176.9	7.7	0	0	111.6	T403 C404 D408 V409 Y410 K411	T403-Q406 WeakPolarHBondContact O-CB 3.35Å; T403-Q406 VanDerWaalsContact O-CG 3.24Å; T403-Q406 WeakPolarHBondContact O-CG 3.48Å; T403-Q406 PolarHBondContact O-N 2.94Å; T403-Q406 VanDerWaalsContact O-N 3.11Å; C404-Q406 VanDerWaalsContact C-N 3.34Å; Q406-D408 WeakPolarHBondContact CB-OD1 3.34Å; Q406-D408 PolarHBondContact O-N 3.41Å; Q406-V409 HydrophobicContact CB-CG2 4.13Å; Q406-V409 PolarHBondContact O-N 3.34Å; Q406-V409 VanDerWaalsContact O-N 3.11Å; Q406-Y410 PolarHBondContact O-N 2.84Å; Q406-K411 PolarHBondContact O-N 3.28Å
407	A	96.4	Very high	96.2	Very high	74 Å²	74	53.3 Å²	53.3	61%	0.612	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-24	-172.4	0	0	0	0	0	113.6	K411	A407-K411 WeakPolarHBondContact O-CE 3.34Å; A407-K411 WeakPolarHBondContact O-CG 3.37Å
408	D	95.3	Very high	96.2	Very high	84 Å²	84	52.7 Å²	52.7	45%	0.449	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-10.7	177.5	60.4	-38.7	0	0	0	113.3	Q406 N463	Q406-D408 WeakPolarHBondContact CB-OD1 3.34Å; Q406-D408 PolarHBondContact O-N 3.41Å; D408-N463 WeakPolarHBondContact O-CB 3.35Å; D408-N463 PolarHBondContact OD2-ND2 3.16Å
409	V	96.3	Very high	96.2	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.006	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-94.6	179.9	-172.3	0	0	0	0	110.1	C404 Q406 L424 N463 K464 P465	C404-V409 WeakPolarHBondContact O-CB 3.34Å; C404-V409 VanDerWaalsContact O-CG1 3.27Å; C404-V409 WeakPolarHBondContact O-CG1 3.32Å; Q406-V409 HydrophobicContact CB-CG2 4.13Å; Q406-V409 PolarHBondContact O-N 3.34Å; Q406-V409 VanDerWaalsContact O-N 3.11Å; V409-L424 HydrophobicContact CG1-CD2 4.44Å; V409-L424 HydrophobicContact CG2-CD2 4.19Å; V409-N463 WeakPolarHBondContact CA-O 3.47Å; V409-N463 VanDerWaalsContact CG1-O 3.31Å; V409-N463 WeakPolarHBondContact CG1-O 3.22Å; V409-N463 HydrophobicContact CG2-CB 4.29Å; V409-K464 PolarHBondContact O-NZ 3.21Å; V409-P465 HydrophobicContact CG1-CG 4.2Å
410	Y	95.8	Very high	96.2	Very high	6 Å²	6	53 Å²	53	2%	0.024	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	8.6	179.9	-69.4	-61.3	0	0	0	115.1	C404 Q406 G412 L413 I414 W455 V457 K464 P465 V467	C404-Y410 WeakPolarHBondContact O-CB 3.49Å; C404-Y410 PolarHBondContact O-N 2.9Å; Q406-Y410 PolarHBondContact O-N 2.84Å; Y410-G412 VanDerWaalsContact C-N 3.26Å; Y410-G412 PolarHBondContact O-N 3.48Å; Y410-G412 VanDerWaalsContact O-N 3.09Å; Y410-L413 VanDerWaalsContact O-CB 3.31Å; Y410-L413 WeakPolarHBondContact O-CB 3.44Å; Y410-L413 WeakPolarHBondContact O-CD1 3.3Å; Y410-L413 WeakPolarHBondContact O-CG 3.39Å; Y410-L413 PolarHBondContact O-N 2.84Å; Y410-I414 HydrophobicContact CD2-CD1 3.64Å; Y410-I414 HydrophobicContact CD2-CG1 3.95Å; Y410-I414 HydrophobicContact CE2-CD1 4.29Å; Y410-I414 HydrophobicContact CG-CD1 3.95Å; Y410-I414 HydrophobicContact CG-CG1 4.28Å; Y410-W455 AromaticContact CD1-CH2 3.88Å; Y410-W455 HydrophobicContact CD1-CH2 3.88Å; Y410-W455 AromaticContact CD1-CZ3 3.87Å; Y410-W455 HydrophobicContact CD1-CZ3 3.87Å; Y410-W455 AromaticContact CE1-CH2 3.99Å; Y410-W455 HydrophobicContact CE1-CH2 3.99Å; Y410-W455 AromaticContact CE1-CZ3 3.57Å; Y410-W455 HydrophobicContact CE1-CZ3 3.57Å; Y410-W455 HydrophobicContact CG-CH2 4.26Å; Y410-V457 HydrophobicContact CE1-CB 4.44Å; Y410-V457 HydrophobicContact CE1-CG2 3.93Å; Y410-K464 HydrophobicContact CE1-CD 4.12Å; Y410-P465 HydrophobicContact CE2-CG 4Å; Y410-P465 VanDerWaalsContact CE2-O 3.27Å; Y410-P465 WeakPolarHBondContact CE2-O 3.43Å; Y410-P465 PolarHBondContact OH-O 3.27Å; Y410-V467 HydrophobicContact CD2-CG2 4.25Å; Y410-V467 HydrophobicContact CE2-CG2 3.57Å
411	K	95.9	Very high	96.2	Very high	167 Å²	167	51.5 Å²	51.5	73%	0.726	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	38.6	168.5	-63.8	176.6	178.6	178.6	0	114.6	Q406 A407	Q406-K411 PolarHBondContact O-N 3.28Å; A407-K411 WeakPolarHBondContact O-CE 3.34Å; A407-K411 WeakPolarHBondContact O-CG 3.37Å
412	G	94.9	Very high	96.2	Very high	51 Å²	51	48.8 Å²	48.8	53%	0.526	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	5.3	178.1	0	0	0	0	0	115.8	N405 Y410 I414	N405-G412 PolarHBondContact O-N 3.4Å; N405-G412 WeakPolarHBondContact OD1-CA 3.34Å; N405-G412 PolarHBondContact OD1-N 3.48Å; Y410-G412 VanDerWaalsContact C-N 3.26Å; Y410-G412 PolarHBondContact O-N 3.48Å; Y410-G412 VanDerWaalsContact O-N 3.09Å; G412-I414 VanDerWaalsContact C-N 3.31Å; G412-I414 PolarHBondContact O-N 2.84Å
413	L	94.2	Very high	96.1	Very high	111 Å²	111	43.8 Å²	43.8	58%	0.581	25%	0.247	S	C	*	.			trans	-73.5	-17.4	-180	-66.3	171.1	0	0	0	114.2	N405 Y410 S415 W455	N405-L413 PolarHBondContact OD1-N 3.21Å; Y410-L413 VanDerWaalsContact O-CB 3.31Å; Y410-L413 WeakPolarHBondContact O-CB 3.44Å; Y410-L413 WeakPolarHBondContact O-CD1 3.3Å; Y410-L413 WeakPolarHBondContact O-CG 3.39Å; Y410-L413 PolarHBondContact O-N 2.84Å; L413-S415 PolarHBondContact O-N 2.89Å; L413-W455 HydrophobicContact CB-CH2 4.47Å
414	I	96.2	Very high	95.9	Very high	6 Å²	6	44.7 Å²	44.7	3%	0.031	25%	0.25	C	S	.	.			trans	-80.8	110.2	-176.5	-51.7	-54.8	0	0	0	109.7	T401 C404 N405 Y410 G412 M418 W455 V467	T401-I414 HydrophobicContact CG2-CB 4.42Å; T401-I414 HydrophobicContact CG2-CG2 4.04Å; C404-I414 HydrophobicContact CB-CG1 3.98Å; N405-I414 PolarHBondContact ND2-O 3.33Å; N405-I414 WeakPolarHBondContact OD1-CA 3.4Å; N405-I414 VanDerWaalsContact OD1-CB 3.25Å; N405-I414 WeakPolarHBondContact OD1-CB 3.19Å; N405-I414 WeakPolarHBondContact OD1-CG1 3.46Å; N405-I414 PolarHBondContact OD1-N 3.09Å; Y410-I414 HydrophobicContact CD2-CD1 3.64Å; Y410-I414 HydrophobicContact CD2-CG1 3.95Å; Y410-I414 HydrophobicContact CE2-CD1 4.29Å; Y410-I414 HydrophobicContact CG-CD1 3.95Å; Y410-I414 HydrophobicContact CG-CG1 4.28Å; G412-I414 VanDerWaalsContact C-N 3.31Å; G412-I414 PolarHBondContact O-N 2.84Å; I414-M418 HydrophobicContact CD1-SD 4.43Å; I414-M418 HydrophobicContact CG2-CB 3.77Å; I414-W455 HydrophobicContact CD1-CH2 3.88Å; I414-W455 HydrophobicContact CD1-CZ2 3.74Å; I414-V467 HydrophobicContact CD1-CG1 3.99Å; I414-V467 HydrophobicContact CD1-CG2 3.72Å
415	S	95.4	Very high	95.8	Very high	30 Å²	30	51.8 Å²	51.8	21%	0.21	28%	0.283	C	S	.	.			trans	-80.7	174.9	179.2	93.9	0	0	0	0	112.2	D337 L413 W417 M418	D337-S415 VanDerWaalsContact OD2-CB 3.29Å; D337-S415 WeakPolarHBondContact OD2-CB 3.47Å; D337-S415 PolarHBondContact OD2-OG 3.13Å; L413-S415 PolarHBondContact O-N 2.89Å; S415-W417 PolarHBondContact O-N 3.07Å; S415-W417 PolarHBondContact OG-N 3.05Å; S415-M418 PolarHBondContact O-N 2.92Å
416	S	94.3	Very high	95.4	Very high	82 Å²	82	50.2 Å²	50.2	57%	0.573	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-19.3	176.6	62.8	0	0	0	0	114	M418 K473	S416-M418 VanDerWaalsContact C-N 3.3Å; S416-K473 WeakPolarHBondContact O-CE 3.41Å; S416-K473 VanDerWaalsContact O-CG 3.28Å; S416-K473 WeakPolarHBondContact O-CG 3.4Å
417	W	95.8	Very high	94.8	Very high	41 Å²	41	49.3 Å²	49.3	16%	0.155	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-1.2	178.5	-87.8	85.3	0	0	0	112.8	D337 Y338 S415 S470 K473 A474	D337-W417 WeakPolarHBondContact OD1-CB 3.26Å; Y338-W417 AromaticContact CD1-CD2 3.83Å; Y338-W417 HydrophobicContact CD1-CD2 3.83Å; Y338-W417 AromaticContact CD1-CE2 3.68Å; Y338-W417 AromaticContact CD1-CE3 3.98Å; Y338-W417 HydrophobicContact CD1-CE3 3.98Å; Y338-W417 HydrophobicContact CD1-CG 4.47Å; Y338-W417 AromaticContact CD1-CH2 3.9Å; Y338-W417 HydrophobicContact CD1-CH2 3.9Å; Y338-W417 AromaticContact CD1-CZ2 3.75Å; Y338-W417 HydrophobicContact CD1-CZ2 3.75Å; Y338-W417 AromaticContact CD1-CZ3 3.99Å; Y338-W417 HydrophobicContact CD1-CZ3 3.99Å; Y338-W417 AromaticContact CE1-CD2 3.87Å; Y338-W417 HydrophobicContact CE1-CD2 3.87Å; Y338-W417 AromaticContact CE1-CE2 3.31Å; Y338-W417 HydrophobicContact CE1-CE3 4.45Å; Y338-W417 HydrophobicContact CE1-CG 4.33Å; Y338-W417 HydrophobicContact CE1-CH2 4.1Å; Y338-W417 AromaticContact CE1-CZ2 3.48Å; Y338-W417 HydrophobicContact CE1-CZ2 3.48Å; Y338-W417 VanDerWaalsContact CE1-CZ2 3.48Å; Y338-W417 AromaticContact CE1-NE1 3.44Å; Y338-W417 AromaticContact CZ-NE1 3.95Å; S415-W417 PolarHBondContact O-N 3.07Å; S415-W417 PolarHBondContact OG-N 3.05Å; W417-S470 WeakPolarHBondContact O-CB 3.25Å; W417-S470 PolarHBondContact O-N 3.4Å; W417-K473 HydrophobicContact CD2-CB 4.03Å; W417-K473 HydrophobicContact CE3-CB 4.19Å; W417-K473 HydrophobicContact CG-CB 4.34Å; W417-A474 HydrophobicContact CE3-CB 4.32Å; W417-A474 HydrophobicContact CH2-CB 4.41Å; W417-A474 VanDerWaalsContact CZ3-CA 3.47Å; W417-A474 HydrophobicContact CZ3-CB 3.62Å
418	M	97.1	Very high	94.1	Very high	10 Å²	10	49.4 Å²	49.4	5%	0.049	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	151.2	-179.4	-62.3	172.5	-173.8	0	0	110.7	L336 D337 I414 S415 S416 W455 V467 Y468	L336-M418 VanDerWaalsContact C-CE 3.47Å; L336-M418 HydrophobicContact CB-CE 3.85Å; L336-M418 VanDerWaalsContact O-CE 3.27Å; L336-M418 WeakPolarHBondContact O-CE 3.32Å; D337-M418 HydrophobicContact CB-CE 4.28Å; I414-M418 HydrophobicContact CD1-SD 4.43Å; I414-M418 HydrophobicContact CG2-CB 3.77Å; S415-M418 PolarHBondContact O-N 2.92Å; S416-M418 VanDerWaalsContact C-N 3.3Å; M418-W455 HydrophobicContact SD-CZ2 4.03Å; M418-V467 HydrophobicContact CB-CG1 3.9Å; M418-V467 HydrophobicContact CG-CG1 4.1Å; M418-V467 HydrophobicContact SD-CG1 4.02Å; M418-Y468 CarbonylContact C-O 3.54Å; M418-Y468 WeakPolarHBondContact CA-O 3.5Å
419	I	97.1	Very high	93.4	Very high	25 Å²	25	46.6 Å²	46.6	13%	0.128	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141	169.9	-170.1	170.2	0	0	0	108.9	L398 L439 V450 Y468	L398-I419 HydrophobicContact CD1-CD1 4.2Å; L398-I419 HydrophobicContact CD2-CD1 3.96Å; L398-I419 HydrophobicContact CD2-CG1 4.47Å; I419-L439 HydrophobicContact CG2-CD2 4.31Å; I419-V450 HydrophobicContact CD1-CG1 3.99Å; I419-Y468 PolarHBondContact N-O 3.15Å; I419-Y468 PolarHBondContact O-N 3.31Å
420	C	97.3	Very high	92.6	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.007	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	145.9	177.4	-67.9	0	0	0	0	111.1	I399 C404 G466	I399-C420 HydrophobicContact CB-CB 3.91Å; I399-C420 HydrophobicContact CG2-CB 4.45Å; I399-C420 PolarHBondContact N-O 3.4Å; C404-C420 HydrophobicContact CB-CB 3.8Å; C404-C420 WeakPolarHBondContact CB-SG 3.25Å; C404-C420 WeakPolarHBondContact SG-CB 3.22Å; C404-C420 CovalentContact SG-SG 2.02Å; C404-C420 PolarHBondContact SG-SG 3.26Å; C420-G466 WeakPolarHBondContact CA-O 3.35Å
421	A	97.2	Very high	92	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	147.6	171	0	0	0	0	0	110	I396 P397 L398 L439 G466 Y468	I396-A421 HydrophobicContact CD1-CB 3.57Å; I396-A421 HydrophobicContact CG1-CB 4.04Å; P397-A421 CarbonylContact O-C 3.42Å; P397-A421 WeakPolarHBondContact O-CA 3.27Å; P397-A421 WeakPolarHBondContact O-CB 3.44Å; L398-A421 HydrophobicContact CD2-CB 4.05Å; A421-L439 HydrophobicContact CB-CD1 4.04Å; A421-L439 HydrophobicContact CB-CD2 4.06Å; A421-G466 PolarHBondContact N-O 2.04Å; A421-G466 VanDerWaalsContact N-O 3.11Å; A421-G466 PolarHBondContact O-N 2.87Å; A421-Y468 HydrophobicContact CB-CD2 4.2Å; A421-Y468 HydrophobicContact CB-CE2 3.8Å
422	G	95.1	Very high	91.1	Very high	2 Å²	2	43.7 Å²	43.7	2%	0.021	26%	0.257	C	S	.	.	S	Bend	trans	139.6	-172.6	-177.3	0	0	0	0	0	112.8	P397 I399	P397-G422 WeakPolarHBondContact CD-O 3.38Å; P397-G422 VanDerWaalsContact CG-O 3.28Å; P397-G422 WeakPolarHBondContact CG-O 3.45Å; P397-G422 PolarHBondContact O-N 3.31Å; I399-G422 WeakPolarHBondContact CD1-O 3.42Å
423	Y	93.8	Very high	90.2	Very high	73 Å²	73	41.8 Å²	41.8	29%	0.286	24%	0.238	S	C	.	.			trans	-107.9	133	174.4	-58.9	-86.2	0	0	0	108.9	M372 T395 I396 P397 E425 G426 I428	M372-Y423 WeakPolarHBondContact CE-OH 3.28Å; T395-Y423 PolarHBondContact O-OH 2.03Å; I396-Y423 HydrophobicContact CG2-CD2 4.48Å; I396-Y423 HydrophobicContact CG2-CE2 4.07Å; P397-Y423 HydrophobicContact CG-CD1 4.21Å; P397-Y423 HydrophobicContact CG-CE1 3.99Å; Y423-E425 PolarHBondContact O-N 2.77Å; Y423-G426 PolarHBondContact O-N 2.81Å; Y423-I428 HydrophobicContact CD2-CB 4Å; Y423-I428 HydrophobicContact CE2-CB 4.03Å; Y423-I428 HydrophobicContact CE2-CD1 4.03Å; Y423-I428 HydrophobicContact CE2-CG2 4.42Å
424	L	93.8	Very high	89.8	Confident	45 Å²	45	37.4 Å²	37.4	24%	0.236	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-22.1	177.6	-67.1	177.7	0	0	0	111.6	I399 T403 V409 G426 R462 N463 P465	I399-L424 HydrophobicContact CD1-CD2 4.12Å; I399-L424 HydrophobicContact CD1-CG 4.43Å; T403-L424 HydrophobicContact CG2-CD1 3.87Å; V409-L424 HydrophobicContact CG1-CD2 4.44Å; V409-L424 HydrophobicContact CG2-CD2 4.19Å; L424-G426 PolarHBondContact O-N 2.8Å; L424-R462 WeakPolarHBondContact O-CG 3.41Å; L424-N463 PolarHBondContact O-N 2.81Å; L424-N463 PolarHBondContact O-OD1 2.89Å; L424-P465 HydrophobicContact CD2-CG 4.17Å
425	E	93.7	Very high	89.7	Confident	149 Å²	149	38.2 Å²	38.2	70%	0.696	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-15.7	171.1	-60.7	76.6	-167.7	0	0	112.7	Y423	Y423-E425 PolarHBondContact O-N 2.77Å
426	G	89.2	Confident	89.8	Confident	13 Å²	13	36.8 Å²	36.8	13%	0.134	21%	0.211	C	C	.	.			trans	82.5	-157.8	-172.8	0	0	0	0	0	112.9	Y423 L424 I428 A460	Y423-G426 PolarHBondContact O-N 2.81Å; L424-G426 PolarHBondContact O-N 2.8Å; G426-I428 PolarHBondContact O-N 3.3Å; G426-A460 CarbonylContact C-O 3.45Å; G426-A460 VanDerWaalsContact CA-O 3.23Å; G426-A460 WeakPolarHBondContact CA-O 3.26Å
427	G	85.6	Confident	89.9	Confident	64 Å²	64	32.9 Å²	32.9	66%	0.66	18%	0.184	S	C	*	.	S	Bend	trans	88.7	-40.9	173.5	0	0	0	0	0	116.2	A460	G427-A460 PolarHBondContact N-O 3.21Å
428	I	82.9	Confident	90	Very high	76 Å²	76	31 Å²	31	39%	0.39	18%	0.176	S	C	.	.			trans	-124.8	119.7	177.8	-57.8	175.8	0	0	0	109.4	A394 I396 Y423 G426	A394-I428 HydrophobicContact CB-CG2 3.54Å; I396-I428 HydrophobicContact CG2-CG2 3.78Å; Y423-I428 HydrophobicContact CD2-CB 4Å; Y423-I428 HydrophobicContact CE2-CB 4.03Å; Y423-I428 HydrophobicContact CE2-CD1 4.03Å; Y423-I428 HydrophobicContact CE2-CG2 4.42Å; G426-I428 PolarHBondContact O-N 3.3Å
429	D	80.1	Confident	90.1	Very high	26 Å²	26	30.5 Å²	30.5	14%	0.139	17%	0.174	C	C	.	.			trans	-156.8	170.2	-177.8	-157.3	4.6	0	0	0	111.9	A460 G466	D429-A460 HydrophobicContact CB-CB 3.79Å; D429-A460 VanDerWaalsContact CB-N 3.34Å; D429-A460 PolarHBondContact OD2-N 2.99Å; D429-A460 VanDerWaalsContact OD2-N 3.17Å; D429-G466 WeakPolarHBondContact OD1-CA 3.41Å; D429-G466 PolarHBondContact OD1-N 3Å
430	S	78.8	Confident	90.1	Very high	11 Å²	11	29.3 Å²	29.3	8%	0.077	17%	0.168	C	C	.	.			trans	-79.6	153	162.1	-61.8	0	0	0	0	110.3	I375 Y468	I375-S430 VanDerWaalsContact CD1-OG 3.25Å; I375-S430 WeakPolarHBondContact CD1-OG 3.37Å; S430-Y468 PolarHBondContact OG-OH 3.01Å
431	C	82.8	Confident	90.1	Very high	13 Å²	13	29.2 Å²	29.2	9%	0.088	17%	0.168	C	C	.	.			trans	-137.8	-175	-178.8	-155.9	0	0	0	0	112.5	A380 G433 D434 C459	A380-C431 WeakPolarHBondContact O-CB 3.35Å; C431-G433 PolarHBondContact O-N 3.29Å; C431-D434 PolarHBondContact N-OD2 2.85Å; C431-D434 WeakPolarHBondContact O-CB 3.37Å; C431-D434 PolarHBondContact O-N 2.82Å; C431-C459 WeakPolarHBondContact CA-SG 3.43Å; C431-C459 HydrophobicContact CB-CB 3.86Å; C431-C459 WeakPolarHBondContact CB-SG 3.47Å; C431-C459 WeakPolarHBondContact SG-CB 3.35Å; C431-C459 CovalentContact SG-SG 2.04Å; C431-C459 PolarHBondContact SG-SG 3.45Å
432	Q	77.1	Confident	89.9	Confident	89 Å²	89	33.4 Å²	33.4	42%	0.416	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	129.7	-177.9	-69.3	79	11.8	0	0	110.7	G379 A380 C459	G379-Q432 CarbonylContact C-O 3.57Å; G379-Q432 WeakPolarHBondContact CA-O 3.22Å; A380-Q432 PolarHBondContact N-O 3.22Å; Q432-C459 PolarHBondContact OE1-SG 2.99Å
433	G	76.4	Confident	89.5	Confident	11 Å²	11	35 Å²	35	11%	0.113	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.1	-17.4	-174.4	0	0	0	0	0	114.7	H275 C431 S435	H275-G433 PolarHBondContact NE2-O 2.75Å; C431-G433 PolarHBondContact O-N 3.29Å; G433-S435 VanDerWaalsContact C-N 3.29Å
434	D	87.1	Confident	89	Confident	19 Å²	19	36.4 Å²	36.4	10%	0.102	22%	0.216	C	C	.	.			trans	-82.1	-10.4	170.2	-65.6	-38.4	0	0	0	113	G377 W378 G379 C431 G436 G437 T453	G377-D434 VanDerWaalsContact C-OD1 3.22Å; G377-D434 WeakPolarHBondContact CA-OD1 3.45Å; W378-D434 PolarHBondContact N-OD1 2.8Å; G379-D434 WeakPolarHBondContact CA-OD1 3.36Å; G379-D434 PolarHBondContact N-OD1 2.88Å; C431-D434 PolarHBondContact N-OD2 2.85Å; C431-D434 WeakPolarHBondContact O-CB 3.37Å; C431-D434 PolarHBondContact O-N 2.82Å; D434-G436 PolarHBondContact O-N 3.01Å; D434-G437 WeakPolarHBondContact O-CA 3.36Å; D434-G437 PolarHBondContact O-N 3.16Å; D434-T453 HydrophobicContact CB-CG2 4.37Å; D434-T453 VanDerWaalsContact O-CB 3.31Å; D434-T453 WeakPolarHBondContact O-CB 3.32Å; D434-T453 PolarHBondContact O-OG1 3.1Å
435	S	93.2	Very high	88.7	Confident	23 Å²	23	39.1 Å²	39.1	16%	0.161	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.6	134.9	177	-78.9	0	0	0	0	112.8	C277 G278 H292 G433 G437	C277-S435 CarbonylContact C-O 3.6Å; C277-S435 VanDerWaalsContact CB-O 3.28Å; C277-S435 WeakPolarHBondContact CB-O 3.01Å; C277-S435 VanDerWaalsContact SG-CB 3.6Å; G278-S435 WeakPolarHBondContact CA-O 3.39Å; G278-S435 PolarHBondContact N-O 3.05Å; H292-S435 PolarHBondContact CE1-OG 3.46Å; H292-S435 VanDerWaalsContact CE1-OG 3.31Å; H292-S435 WeakPolarHBondContact NE2-CB 3.44Å; H292-S435 PolarHBondContact NE2-OG 3.41Å; G433-S435 VanDerWaalsContact C-N 3.29Å; S435-G437 PolarHBondContact O-N 3.32Å
436	G	97	Very high	88.7	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.3	-10.7	-174.9	0	0	0	0	0	115.2	G278 G279 T289 D434 T453	G278-G436 CarbonylContact O-C 3.48Å; G279-G436 WeakPolarHBondContact CA-O 3.38Å; T289-G436 WeakPolarHBondContact OG1-CA 3.36Å; D434-G436 PolarHBondContact O-N 3.01Å; G436-T453 PolarHBondContact N-O 3.28Å
437	G	97.3	Very high	89.1	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	22%	0.217	C	C	.	.			trans	-67	167.3	177	0	0	0	0	0	114.2	D434 S435 V452 T453	D434-G437 WeakPolarHBondContact O-CA 3.36Å; D434-G437 PolarHBondContact O-N 3.16Å; S435-G437 PolarHBondContact O-N 3.32Å; G437-V452 WeakPolarHBondContact O-CA 3.3Å; G437-T453 PolarHBondContact O-N 3.45Å; G437-T453 PolarHBondContact O-OG1 2.98Å
438	P	98	Very high	89.6	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	136	-175.6	28.7	-32.4	0	0	0	113.5	Q266 S280 S376 A440 L449	Q266-P438 VanDerWaalsContact OE1-CG 3.31Å; S280-P438 WeakPolarHBondContact OG-CB 3.07Å; S376-P438 WeakPolarHBondContact OG-CG 3.08Å; P438-A440 HydrophobicContact CB-CB 4.45Å; P438-L449 HydrophobicContact CB-CD1 3.56Å
439	L	97.9	Very high	90.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	96.1	150.6	179.7	68.2	0	0	0	108.1	C373 I375 I396 L398 I419 A421 V450 G451 Y468	C373-L439 HydrophobicContact CB-CD1 3.76Å; C373-L439 HydrophobicContact CB-CG 4.27Å; I375-L439 HydrophobicContact CG2-CD1 3.75Å; I396-L439 HydrophobicContact CD1-CD1 3.97Å; I396-L439 HydrophobicContact CG1-CD1 4.17Å; L398-L439 HydrophobicContact CD2-CD2 3.87Å; I419-L439 HydrophobicContact CG2-CD2 4.31Å; A421-L439 HydrophobicContact CB-CD1 4.04Å; A421-L439 HydrophobicContact CB-CD2 4.06Å; L439-V450 PolarHBondContact O-N 3.21Å; L439-G451 PolarHBondContact N-O 2.77Å; L439-G451 PolarHBondContact O-N 3.27Å; L439-Y468 HydrophobicContact CB-CD1 3.73Å; L439-Y468 HydrophobicContact CB-CE1 4.05Å; L439-Y468 HydrophobicContact CB-CG 4.26Å; L439-Y468 HydrophobicContact CD1-CE1 4.42Å; L439-Y468 HydrophobicContact CD2-CD1 4.16Å; L439-Y468 HydrophobicContact CD2-CD2 3.96Å; L439-Y468 HydrophobicContact CD2-CE2 4.43Å; L439-Y468 HydrophobicContact CD2-CG 3.85Å; L439-Y468 HydrophobicContact CG-CD1 4.41Å
440	A	97.8	Very high	91.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	119.1	-172.1	0	0	0	0	0	111.4	W265 I358 C373 W374 P438 W447 K448	W265-A440 HydrophobicContact CZ2-CB 4.13Å; I358-A440 HydrophobicContact CD1-CB 3.57Å; C373-A440 CarbonylContact C-O 3.45Å; C373-A440 WeakPolarHBondContact CA-O 3.14Å; W374-A440 PolarHBondContact N-O 3.38Å; W374-A440 PolarHBondContact O-N 3.26Å; P438-A440 HydrophobicContact CB-CB 4.45Å; A440-W447 HydrophobicContact CB-CE3 4.02Å; A440-W447 HydrophobicContact CB-CZ3 4.47Å; A440-K448 CarbonylContact C-O 3.52Å; A440-K448 WeakPolarHBondContact CA-O 2.99Å
441	C	96.7	Very high	92.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	134.4	176.3	-48.9	0	0	0	0	109.4	F367 C373 K448 V450	F367-C441 HydrophobicContact CD1-CB 4.37Å; F367-C441 HydrophobicContact CE1-CB 4.49Å; C373-C441 HydrophobicContact CB-CB 4.05Å; C373-C441 WeakPolarHBondContact CB-SG 3.38Å; C373-C441 WeakPolarHBondContact SG-CB 3.37Å; C373-C441 CovalentContact SG-SG 2.03Å; C373-C441 PolarHBondContact SG-SG 3.08Å; C441-K448 PolarHBondContact N-O 3.34Å; C441-K448 PolarHBondContact O-N 2.82Å; C441-V450 HydrophobicContact CB-CG2 3.66Å; C441-V450 WeakPolarHBondContact SG-CG2 3.5Å
442	E	92.7	Very high	92.9	Very high	88 Å²	88	26.5 Å²	26.5	41%	0.411	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	133.5	173.7	-171.9	168.8	-135.2	0	0	109.6	R371 W447	R371-E442 PolarHBondContact NE-O 2.92Å; R371-E442 PolarHBondContact NH2-O 3.47Å; E442-W447 HydrophobicContact CB-CD2 3.89Å; E442-W447 HydrophobicContact CB-CE3 4.03Å; E442-W447 HydrophobicContact CB-CH2 3.91Å; E442-W447 HydrophobicContact CB-CZ2 3.75Å; E442-W447 HydrophobicContact CB-CZ3 4.05Å; E442-W447 HydrophobicContact CG-CD2 4.3Å; E442-W447 HydrophobicContact CG-CZ2 4.1Å; E442-W447 PolarHBondContact OE1-NE1 3.11Å
443	D	86.9	Confident	93.8	Very high	34 Å²	34	22.8 Å²	22.8	18%	0.182	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	122.4	170.1	-171.8	48.9	0	0	0	110.8	R371 S445 V446	R371-D443 IonicContact CZ-OD1 3.54Å; R371-D443 VanDerWaalsContact NH2-CA 3.33Å; R371-D443 IonicContact NH2-OD1 2.73Å; R371-D443 PolarHBondContact NH2-OD1 3.2Å; D443-S445 VanDerWaalsContact C-N 3.25Å; D443-S445 PolarHBondContact O-N 2.91Å; D443-V446 PolarHBondContact N-O 2.99Å; D443-V446 WeakPolarHBondContact O-CB 3Å; D443-V446 PolarHBondContact O-N 2.94Å; D443-V446 VanDerWaalsContact O-O 3.13Å
444	S	84.6	Confident	94.7	Very high	104 Å²	104	22.6 Å²	22.6	73%	0.727	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.9	44	-178.3	-54.5	0	0	0	0	113.8	V446	S444-V446 PolarHBondContact O-N 3.31Å
445	S	86.9	Confident	95	Very high	101 Å²	101	23.8 Å²	23.8	71%	0.706	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.2	13.3	-176.8	-47.8	0	0	0	0	115.6	D443	D443-S445 VanDerWaalsContact C-N 3.25Å; D443-S445 PolarHBondContact O-N 2.91Å
446	V	93.4	Very high	94.7	Very high	53 Å²	53	24.3 Å²	24.3	32%	0.321	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.4	173.9	-179.9	0	0	0	0	109.3	C359 D443 S444	C359-V446 HydrophobicContact CB-CG1 4.17Å; C359-V446 WeakPolarHBondContact SG-CG1 3.27Å; D443-V446 PolarHBondContact N-O 2.99Å; D443-V446 WeakPolarHBondContact O-CB 3Å; D443-V446 PolarHBondContact O-N 2.94Å; D443-V446 VanDerWaalsContact O-O 3.13Å; S444-V446 PolarHBondContact O-N 3.31Å
447	W	96.8	Very high	94.1	Very high	16 Å²	16	27.5 Å²	27.5	6%	0.061	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	127.1	177.5	-68.9	80.2	0	0	0	111.6	G243 R245 W265 I358 C359 W374 A440 E442	G243-W447 WeakPolarHBondContact CA-O 3.32Å; G243-W447 WeakPolarHBondContact O-CB 3.09Å; G243-W447 VanDerWaalsContact O-CD1 3.25Å; G243-W447 PolarHBondContact O-N 3.49Å; R245-W447 VanDerWaalsContact NH2-CE2 3.26Å; R245-W447 VanDerWaalsContact NH2-CZ2 3.33Å; W265-W447 HydrophobicContact CH2-CB 3.27Å; W265-W447 AromaticContact CH2-CD1 3.95Å; W265-W447 AromaticContact CH2-CD2 3.85Å; W265-W447 HydrophobicContact CH2-CD2 3.85Å; W265-W447 HydrophobicContact CH2-CE3 4.33Å; W265-W447 AromaticContact CH2-CG 3.36Å; W265-W447 HydrophobicContact CH2-CG 3.36Å; W265-W447 HydrophobicContact CZ2-CB 3.92Å; W265-W447 HydrophobicContact CZ2-CD2 4.2Å; W265-W447 HydrophobicContact CZ2-CE3 4.21Å; W265-W447 HydrophobicContact CZ2-CG 4.09Å; W265-W447 HydrophobicContact CZ3-CB 3.88Å; W265-W447 HydrophobicContact CZ3-CG 4.22Å; I358-W447 HydrophobicContact CG1-CB 4.48Å; I358-W447 WeakPolarHBondContact CG1-O 2.96Å; C359-W447 WeakPolarHBondContact CB-O 3.21Å; C359-W447 PolarHBondContact N-O 3.09Å; C359-W447 VanDerWaalsContact N-O 3.15Å; W374-W447 HydrophobicContact CB-CZ3 4.08Å; W374-W447 AromaticContact CD1-CH2 3.26Å; W374-W447 AromaticContact CD1-CZ3 3.39Å; W374-W447 AromaticContact CG-CH2 3.98Å; W374-W447 HydrophobicContact CG-CH2 3.98Å; W374-W447 AromaticContact CG-CZ3 3.9Å; W374-W447 HydrophobicContact CG-CZ3 3.9Å; W374-W447 AromaticContact NE1-CH2 3.58Å; A440-W447 HydrophobicContact CB-CE3 4.02Å; A440-W447 HydrophobicContact CB-CZ3 4.47Å; E442-W447 HydrophobicContact CB-CD2 3.89Å; E442-W447 HydrophobicContact CB-CE3 4.03Å; E442-W447 HydrophobicContact CB-CH2 3.91Å; E442-W447 HydrophobicContact CB-CZ2 3.75Å; E442-W447 HydrophobicContact CB-CZ3 4.05Å; E442-W447 HydrophobicContact CG-CD2 4.3Å; E442-W447 HydrophobicContact CG-CZ2 4.1Å; E442-W447 PolarHBondContact OE1-NE1 3.11Å
448	K	97.4	Very high	93.5	Very high	17 Å²	17	28.3 Å²	28.3	7%	0.074	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	140.3	-178.6	-63.9	-177	-179.9	-177.7	0	111.4	C359 E365 F367 A440 C441 V450	C359-K448 HydrophobicContact CB-CG 4.05Å; C359-K448 CarbonylContact O-C 3.56Å; C359-K448 VanDerWaalsContact O-CA 3.26Å; C359-K448 WeakPolarHBondContact O-CA 3.28Å; E365-K448 WeakPolarHBondContact OE1-CD 3.45Å; E365-K448 IonicContact OE1-NZ 3.88Å; E365-K448 PolarHBondContact OE1-NZ 3.23Å; E365-K448 IonicContact OE2-NZ 3.8Å; E365-K448 PolarHBondContact OE2-NZ 2.84Å; F367-K448 HydrophobicContact CE1-CD 4.44Å; F367-K448 HydrophobicContact CZ-CB 4.23Å; F367-K448 HydrophobicContact CZ-CD 4.05Å; A440-K448 CarbonylContact C-O 3.52Å; A440-K448 WeakPolarHBondContact CA-O 2.99Å; C441-K448 PolarHBondContact N-O 3.34Å; C441-K448 PolarHBondContact O-N 2.82Å; K448-V450 PolarHBondContact O-N 3.36Å
449	L	98.3	Very high	92.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	101.1	175.9	-172	64.2	0	0	0	109.5	I282 L288 I358 C359 L360 P361 P438 G451 V452 I471	I282-L449 HydrophobicContact CG2-CD2 4.19Å; L288-L449 HydrophobicContact CB-CD2 4.49Å; L288-L449 HydrophobicContact CD2-CD2 3.59Å; I358-L449 HydrophobicContact CD1-CB 3.89Å; I358-L449 HydrophobicContact CD1-CD1 4.26Å; I358-L449 HydrophobicContact CG1-CB 4.14Å; I358-L449 HydrophobicContact CG2-CB 3.77Å; I358-L449 HydrophobicContact CG2-CD1 4.48Å; I358-L449 HydrophobicContact CG2-CD2 4.13Å; I358-L449 HydrophobicContact CG2-CG 4.36Å; C359-L449 PolarHBondContact O-N 2.87Å; L360-L449 HydrophobicContact CD2-CD2 4.4Å; P361-L449 WeakPolarHBondContact CD-O 3.36Å; P361-L449 WeakPolarHBondContact CG-O 3.43Å; P438-L449 HydrophobicContact CB-CD1 3.56Å; L449-G451 VanDerWaalsContact CD1-O 3.29Å; L449-G451 WeakPolarHBondContact CD1-O 3.23Å; L449-V452 HydrophobicContact CD2-CG2 4.43Å; L449-I471 HydrophobicContact CD2-CG1 4.44Å; L449-I471 HydrophobicContact CG-CG1 4.11Å; L449-I471 VanDerWaalsContact O-CB 3.31Å; L449-I471 WeakPolarHBondContact O-CB 3.46Å; L449-I471 WeakPolarHBondContact O-CG1 3.28Å; L449-I471 WeakPolarHBondContact O-CG2 3.16Å
450	V	97.9	Very high	91.9	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.012	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-31.9	-175.8	177.6	0	0	0	0	111.5	F367 I419 L439 C441 K448 I471	F367-V450 HydrophobicContact CB-CG1 4.25Å; F367-V450 HydrophobicContact CD1-CG2 3.66Å; F367-V450 HydrophobicContact CD2-CB 4.39Å; F367-V450 HydrophobicContact CD2-CG1 3.76Å; F367-V450 HydrophobicContact CD2-CG2 3.75Å; F367-V450 HydrophobicContact CE1-CG2 3.53Å; F367-V450 HydrophobicContact CE2-CG1 4.31Å; F367-V450 HydrophobicContact CE2-CG2 3.62Å; F367-V450 HydrophobicContact CG-CG1 3.95Å; F367-V450 HydrophobicContact CG-CG2 3.78Å; F367-V450 HydrophobicContact CZ-CG2 3.52Å; I419-V450 HydrophobicContact CD1-CG1 3.99Å; L439-V450 PolarHBondContact O-N 3.21Å; C441-V450 HydrophobicContact CB-CG2 3.66Å; C441-V450 WeakPolarHBondContact SG-CG2 3.5Å; K448-V450 PolarHBondContact O-N 3.36Å; V450-I471 PolarHBondContact O-N 3.39Å
451	G	98.1	Very high	91.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	164.2	177.7	0	0	0	0	0	113.6	L439 L449 T469	L439-G451 PolarHBondContact N-O 2.77Å; L439-G451 PolarHBondContact O-N 3.27Å; L449-G451 VanDerWaalsContact CD1-O 3.29Å; L449-G451 WeakPolarHBondContact CD1-O 3.23Å; G451-T469 WeakPolarHBondContact CA-O 3.28Å
452	V	98.4	Very high	91.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127.1	170.4	166.9	0	0	0	0	108	L288 A290 G437 L449 S454 Y468 T469 I471	L288-V452 HydrophobicContact CD2-CG2 3.9Å; L288-V452 HydrophobicContact CG-CG2 4.22Å; A290-V452 HydrophobicContact CB-CG1 4.12Å; G437-V452 WeakPolarHBondContact O-CA 3.3Å; L449-V452 HydrophobicContact CD2-CG2 4.43Å; V452-S454 PolarHBondContact O-N 3.09Å; V452-Y468 CarbonylContact O-C 3.59Å; V452-Y468 WeakPolarHBondContact O-CA 3.4Å; V452-Y468 WeakPolarHBondContact O-CB 3.42Å; V452-T469 PolarHBondContact N-O 3.19Å; V452-T469 VanDerWaalsContact N-O 3.14Å; V452-T469 PolarHBondContact O-N 3.47Å; V452-I471 HydrophobicContact CG2-CD1 3.73Å; V452-I471 HydrophobicContact CG2-CG1 4.47Å
453	T	97.4	Very high	91.4	Very high	11 Å²	11	41.1 Å²	41.1	7%	0.067	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56	123.2	-178.1	-51	0	0	0	0	110.3	D434 G436 G437 Y468	D434-T453 HydrophobicContact CB-CG2 4.37Å; D434-T453 VanDerWaalsContact O-CB 3.31Å; D434-T453 WeakPolarHBondContact O-CB 3.32Å; D434-T453 PolarHBondContact O-OG1 3.1Å; G436-T453 PolarHBondContact N-O 3.28Å; G437-T453 PolarHBondContact O-N 3.45Å; G437-T453 PolarHBondContact O-OG1 2.98Å; T453-Y468 VanDerWaalsContact CA-CD1 3.43Å; T453-Y468 HydrophobicContact CG2-CE1 4.17Å; T453-Y468 WeakPolarHBondContact OG1-CE1 3.31Å
454	S	95.3	Very high	91.8	Very high	7 Å²	7	41.7 Å²	41.7	5%	0.049	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	-65.3	-170.8	-178.3	0	0	0	0	111.9	H292 D339 V452 V467	H292-S454 PolarHBondContact CE1-O 3.47Å; D339-S454 WeakPolarHBondContact CB-OG 3.46Å; D339-S454 WeakPolarHBondContact OD2-CA 3.19Å; D339-S454 WeakPolarHBondContact OD2-CB 3.48Å; D339-S454 PolarHBondContact OD2-OG 2.88Å; V452-S454 PolarHBondContact O-N 3.09Å; S454-V467 WeakPolarHBondContact CB-O 3.33Å; S454-V467 PolarHBondContact N-O 3.3Å; S454-V467 VanDerWaalsContact N-O 3.08Å
455	W	92.7	Very high	92.3	Very high	44 Å²	44	36.9 Å²	36.9	17%	0.167	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	169.6	-178	63.2	-87.3	0	0	0	112.3	L336 Y410 L413 I414 M418 V467	L336-W455 HydrophobicContact CD1-CD2 4.12Å; L336-W455 HydrophobicContact CD1-CE3 4.45Å; L336-W455 HydrophobicContact CD1-CH2 4.45Å; L336-W455 HydrophobicContact CD1-CZ2 4.1Å; L336-W455 HydrophobicContact CD2-CG 4.44Å; Y410-W455 AromaticContact CD1-CH2 3.88Å; Y410-W455 HydrophobicContact CD1-CH2 3.88Å; Y410-W455 AromaticContact CD1-CZ3 3.87Å; Y410-W455 HydrophobicContact CD1-CZ3 3.87Å; Y410-W455 AromaticContact CE1-CH2 3.99Å; Y410-W455 HydrophobicContact CE1-CH2 3.99Å; Y410-W455 AromaticContact CE1-CZ3 3.57Å; Y410-W455 HydrophobicContact CE1-CZ3 3.57Å; Y410-W455 HydrophobicContact CG-CH2 4.26Å; L413-W455 HydrophobicContact CB-CH2 4.47Å; I414-W455 HydrophobicContact CD1-CH2 3.88Å; I414-W455 HydrophobicContact CD1-CZ2 3.74Å; M418-W455 HydrophobicContact SD-CZ2 4.03Å; W455-V467 HydrophobicContact CD2-CB 3.94Å; W455-V467 HydrophobicContact CD2-CG1 4.38Å; W455-V467 HydrophobicContact CD2-CG2 4.09Å; W455-V467 HydrophobicContact CE3-CG2 4.2Å; W455-V467 HydrophobicContact CG-CB 4.23Å; W455-V467 HydrophobicContact CH2-CG2 3.93Å; W455-V467 HydrophobicContact CZ2-CB 4.09Å; W455-V467 HydrophobicContact CZ2-CG1 3.88Å; W455-V467 HydrophobicContact CZ2-CG2 3.82Å; W455-V467 HydrophobicContact CZ3-CG2 4.12Å; W455-V467 PolarHBondContact N-O 3.35Å; W455-V467 VanDerWaalsContact N-O 3.1Å; W455-V467 WeakPolarHBondContact O-CA 3.39Å; W455-V467 VanDerWaalsContact O-CB 3.31Å; W455-V467 WeakPolarHBondContact O-CB 3.49Å; W455-V467 PolarHBondContact O-N 3.45Å
456	G	87.2	Confident	92.7	Very high	34 Å²	34	32.2 Å²	32.2	35%	0.351	17%	0.171	S	C	.	.			trans	-161.5	169.2	173.6	0	0	0	0	0	109.4
457	V	84.4	Confident	92.9	Very high	67 Å²	67	29.8 Å²	29.8	41%	0.406	16%	0.156	S	C	.	.	S	Bend	trans	-104.8	115.6	168.1	173.8	0	0	0	0	107.1	Y410 K464	Y410-V457 HydrophobicContact CE1-CB 4.44Å; Y410-V457 HydrophobicContact CE1-CG2 3.93Å; V457-K464 HydrophobicContact CB-CB 4.35Å; V457-K464 HydrophobicContact CB-CD 3.89Å; V457-K464 HydrophobicContact CB-CG 4.07Å; V457-K464 HydrophobicContact CG1-CD 4.2Å; V457-K464 HydrophobicContact CG1-CG 4.28Å; V457-K464 VanDerWaalsContact O-CB 3.28Å; V457-K464 WeakPolarHBondContact O-CB 3.43Å
458	G	83.8	Confident	93	Very high	16 Å²	16	29 Å²	29	17%	0.165	15%	0.154	C	C	.	.	S	Bend	trans	61.8	-164.4	-167.2	0	0	0	0	0	111.8
459	C	81.6	Confident	93	Very high	22 Å²	22	28.4 Å²	28.4	15%	0.149	15%	0.151	C	C	.	.	S	Bend	trans	-126.7	127.8	170.3	-61.9	0	0	0	0	109.7	E383 C431 Q432 E461	E383-C459 HydrophobicContact CB-CB 4.41Å; C431-C459 WeakPolarHBondContact CA-SG 3.43Å; C431-C459 HydrophobicContact CB-CB 3.86Å; C431-C459 WeakPolarHBondContact CB-SG 3.47Å; C431-C459 WeakPolarHBondContact SG-CB 3.35Å; C431-C459 CovalentContact SG-SG 2.04Å; C431-C459 PolarHBondContact SG-SG 3.45Å; Q432-C459 PolarHBondContact OE1-SG 2.99Å; C459-E461 PolarHBondContact O-N 3.06Å; C459-E461 VanDerWaalsContact O-N 3.17Å
460	A	82.8	Confident	92.9	Very high	30 Å²	30	28.8 Å²	28.8	25%	0.248	15%	0.154	C	C	.	.	S	Bend	trans	59.6	26.1	175.9	0	0	0	0	0	114.2	G426 G427 D429	G426-A460 CarbonylContact C-O 3.45Å; G426-A460 VanDerWaalsContact CA-O 3.23Å; G426-A460 WeakPolarHBondContact CA-O 3.26Å; G427-A460 PolarHBondContact N-O 3.21Å; D429-A460 HydrophobicContact CB-CB 3.79Å; D429-A460 VanDerWaalsContact CB-N 3.34Å; D429-A460 PolarHBondContact OD2-N 2.99Å; D429-A460 VanDerWaalsContact OD2-N 3.17Å
461	E	88.2	Confident	92.9	Very high	81 Å²	81	28.7 Å²	28.7	38%	0.379	15%	0.154	S	C	.	.			trans	-76	152.9	174.1	-69.7	-167.4	173.2	0	0	112.5	C459 N463 K464	C459-E461 PolarHBondContact O-N 3.06Å; C459-E461 VanDerWaalsContact O-N 3.17Å; E461-N463 PolarHBondContact O-N 2.9Å; E461-K464 HydrophobicContact CB-CB 3.94Å; E461-K464 HydrophobicContact CB-CG 3.92Å; E461-K464 PolarHBondContact O-N 2.94Å
462	R	92.9	Very high	92.8	Very high	193 Å²	193	31 Å²	31	73%	0.728	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	133.7	174.5	-168.5	-178.2	-170.4	-151.4	1.5	110.4	L424 K464	L424-R462 WeakPolarHBondContact O-CG 3.41Å; R462-K464 PolarHBondContact O-N 3.31Å
463	N	94.6	Very high	92.6	Very high	31 Å²	31	36.3 Å²	36.3	17%	0.166	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	18.4	-177.3	-69.2	-12.7	0	0	0	114.3	D408 V409 L424 E461 P465	D408-N463 WeakPolarHBondContact O-CB 3.35Å; D408-N463 PolarHBondContact OD2-ND2 3.16Å; V409-N463 WeakPolarHBondContact CA-O 3.47Å; V409-N463 VanDerWaalsContact CG1-O 3.31Å; V409-N463 WeakPolarHBondContact CG1-O 3.22Å; V409-N463 HydrophobicContact CG2-CB 4.29Å; L424-N463 PolarHBondContact O-N 2.81Å; L424-N463 PolarHBondContact O-OD1 2.89Å; E461-N463 PolarHBondContact O-N 2.9Å; N463-P465 VanDerWaalsContact C-CD 3.44Å; N463-P465 WeakPolarHBondContact O-CD 3.48Å
464	K	94.8	Very high	92.6	Very high	47 Å²	47	35.8 Å²	35.8	20%	0.204	19%	0.187	C	C	.	.			trans	-123.6	67.5	174.5	-54.7	-57.8	177.6	-156.1	0	110.8	V409 Y410 V457 E461 R462	V409-K464 PolarHBondContact O-NZ 3.21Å; Y410-K464 HydrophobicContact CE1-CD 4.12Å; V457-K464 HydrophobicContact CB-CB 4.35Å; V457-K464 HydrophobicContact CB-CD 3.89Å; V457-K464 HydrophobicContact CB-CG 4.07Å; V457-K464 HydrophobicContact CG1-CD 4.2Å; V457-K464 HydrophobicContact CG1-CG 4.28Å; V457-K464 VanDerWaalsContact O-CB 3.28Å; V457-K464 WeakPolarHBondContact O-CB 3.43Å; E461-K464 HydrophobicContact CB-CB 3.94Å; E461-K464 HydrophobicContact CB-CG 3.92Å; E461-K464 PolarHBondContact O-N 2.94Å; R462-K464 PolarHBondContact O-N 3.31Å
465	P	95.7	Very high	92.5	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.013	19%	0.186	C	C	.	.			trans	-67.9	153	176.9	31.2	-35.4	0	0	0	111	I399 V409 Y410 L424 N463	I399-P465 HydrophobicContact CD1-CB 3.46Å; I399-P465 VanDerWaalsContact CD1-CB 3.46Å; I399-P465 HydrophobicContact CD1-CG 3.68Å; V409-P465 HydrophobicContact CG1-CG 4.2Å; Y410-P465 HydrophobicContact CE2-CG 4Å; Y410-P465 VanDerWaalsContact CE2-O 3.27Å; Y410-P465 WeakPolarHBondContact CE2-O 3.43Å; Y410-P465 PolarHBondContact OH-O 3.27Å; L424-P465 HydrophobicContact CD2-CG 4.17Å; N463-P465 VanDerWaalsContact C-CD 3.44Å; N463-P465 WeakPolarHBondContact O-CD 3.48Å
466	G	95.5	Very high	92.5	Very high	4 Å²	4	36.2 Å²	36.2	4%	0.041	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	143	174.3	0	0	0	0	0	113.7	C420 A421 D429 Y468	C420-G466 WeakPolarHBondContact CA-O 3.35Å; A421-G466 PolarHBondContact N-O 2.04Å; A421-G466 VanDerWaalsContact N-O 3.11Å; A421-G466 PolarHBondContact O-N 2.87Å; D429-G466 WeakPolarHBondContact OD1-CA 3.41Å; D429-G466 PolarHBondContact OD1-N 3Å; G466-Y468 WeakPolarHBondContact O-CE2 3.47Å
467	V	97.2	Very high	92.8	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.006	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	131.4	177.4	-172.1	0	0	0	0	109.8	Y410 I414 M418 S454 W455	Y410-V467 HydrophobicContact CD2-CG2 4.25Å; Y410-V467 HydrophobicContact CE2-CG2 3.57Å; I414-V467 HydrophobicContact CD1-CG1 3.99Å; I414-V467 HydrophobicContact CD1-CG2 3.72Å; M418-V467 HydrophobicContact CB-CG1 3.9Å; M418-V467 HydrophobicContact CG-CG1 4.1Å; M418-V467 HydrophobicContact SD-CG1 4.02Å; S454-V467 WeakPolarHBondContact CB-O 3.33Å; S454-V467 PolarHBondContact N-O 3.3Å; S454-V467 VanDerWaalsContact N-O 3.08Å; W455-V467 HydrophobicContact CD2-CB 3.94Å; W455-V467 HydrophobicContact CD2-CG1 4.38Å; W455-V467 HydrophobicContact CD2-CG2 4.09Å; W455-V467 HydrophobicContact CE3-CG2 4.2Å; W455-V467 HydrophobicContact CG-CB 4.23Å; W455-V467 HydrophobicContact CH2-CG2 3.93Å; W455-V467 HydrophobicContact CZ2-CB 4.09Å; W455-V467 HydrophobicContact CZ2-CG1 3.88Å; W455-V467 HydrophobicContact CZ2-CG2 3.82Å; W455-V467 HydrophobicContact CZ3-CG2 4.12Å; W455-V467 PolarHBondContact N-O 3.35Å; W455-V467 VanDerWaalsContact N-O 3.1Å; W455-V467 WeakPolarHBondContact O-CA 3.39Å; W455-V467 VanDerWaalsContact O-CB 3.31Å; W455-V467 WeakPolarHBondContact O-CB 3.49Å; W455-V467 PolarHBondContact O-N 3.45Å
468	Y	98.1	Very high	93.3	Very high	1 Å²	1	32.7 Å²	32.7	0%	0.004	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	147.6	-174.1	-56	-100.5	0	0	0	110	I375 I396 M418 I419 A421 S430 L439 V452 T453 G466 S470	I375-Y468 HydrophobicContact CG2-CE1 4.01Å; I396-Y468 HydrophobicContact CD1-CE2 4.33Å; I396-Y468 WeakPolarHBondContact CD1-OH 3.36Å; M418-Y468 CarbonylContact C-O 3.54Å; M418-Y468 WeakPolarHBondContact CA-O 3.5Å; I419-Y468 PolarHBondContact N-O 3.15Å; I419-Y468 PolarHBondContact O-N 3.31Å; A421-Y468 HydrophobicContact CB-CD2 4.2Å; A421-Y468 HydrophobicContact CB-CE2 3.8Å; S430-Y468 PolarHBondContact OG-OH 3.01Å; L439-Y468 HydrophobicContact CB-CD1 3.73Å; L439-Y468 HydrophobicContact CB-CE1 4.05Å; L439-Y468 HydrophobicContact CB-CG 4.26Å; L439-Y468 HydrophobicContact CD1-CE1 4.42Å; L439-Y468 HydrophobicContact CD2-CD1 4.16Å; L439-Y468 HydrophobicContact CD2-CD2 3.96Å; L439-Y468 HydrophobicContact CD2-CE2 4.43Å; L439-Y468 HydrophobicContact CD2-CG 3.85Å; L439-Y468 HydrophobicContact CG-CD1 4.41Å; V452-Y468 CarbonylContact O-C 3.59Å; V452-Y468 WeakPolarHBondContact O-CA 3.4Å; V452-Y468 WeakPolarHBondContact O-CB 3.42Å; T453-Y468 VanDerWaalsContact CA-CD1 3.43Å; T453-Y468 HydrophobicContact CG2-CE1 4.17Å; T453-Y468 WeakPolarHBondContact OG1-CE1 3.31Å; G466-Y468 WeakPolarHBondContact O-CE2 3.47Å; Y468-S470 PolarHBondContact O-N 3.06Å
469	T	98	Very high	93.7	Very high	3 Å²	3	32.8 Å²	32.8	2%	0.018	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	125.9	169.8	-62	0	0	0	0	109.8	D339 I340 G451 V452 I471	D339-T469 PolarHBondContact O-OG1 3.48Å; I340-T469 HydrophobicContact CB-CG2 4.19Å; I340-T469 HydrophobicContact CD1-CG2 4.5Å; G451-T469 WeakPolarHBondContact CA-O 3.28Å; V452-T469 PolarHBondContact N-O 3.19Å; V452-T469 VanDerWaalsContact N-O 3.14Å; V452-T469 PolarHBondContact O-N 3.47Å; T469-I471 PolarHBondContact O-N 2.84Å
470	S	97.5	Very high	94.1	Very high	9 Å²	9	34.3 Å²	34.3	6%	0.063	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	113.4	-179.1	-179.5	0	0	0	0	111.8	W417 Y468 T472 K473 A474	W417-S470 WeakPolarHBondContact O-CB 3.25Å; W417-S470 PolarHBondContact O-N 3.4Å; Y468-S470 PolarHBondContact O-N 3.06Å; S470-T472 VanDerWaalsContact C-N 3.34Å; S470-T472 PolarHBondContact O-N 3.46Å; S470-T472 PolarHBondContact OG-OG1 3.03Å; S470-T472 VanDerWaalsContact OG-OG1 3.11Å; S470-K473 PolarHBondContact O-N 3.08Å; S470-A474 PolarHBondContact O-N 3.24Å; S470-A474 VanDerWaalsContact O-N 3.08Å
471	I	97.6	Very high	94.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-69.2	-31.7	-178.4	-63.7	-49.1	0	0	0	112.6	L288 I340 L360 P361 L449 V450 V452 T469 K473 A474 L475 I478	L288-I471 HydrophobicContact CD2-CD1 3.61Å; I340-I471 HydrophobicContact CD1-CD1 4.02Å; L360-I471 HydrophobicContact CD2-CG2 3.93Å; P361-I471 HydrophobicContact CG-CG2 4.21Å; L449-I471 HydrophobicContact CD2-CG1 4.44Å; L449-I471 HydrophobicContact CG-CG1 4.11Å; L449-I471 VanDerWaalsContact O-CB 3.31Å; L449-I471 WeakPolarHBondContact O-CB 3.46Å; L449-I471 WeakPolarHBondContact O-CG1 3.28Å; L449-I471 WeakPolarHBondContact O-CG2 3.16Å; V450-I471 PolarHBondContact O-N 3.39Å; V452-I471 HydrophobicContact CG2-CD1 3.73Å; V452-I471 HydrophobicContact CG2-CG1 4.47Å; T469-I471 PolarHBondContact O-N 2.84Å; I471-K473 PolarHBondContact O-N 2.78Å; I471-A474 CarbonylContact O-C 3.46Å; I471-A474 PolarHBondContact O-N 3.16Å; I471-A474 VanDerWaalsContact O-N 3.15Å; I471-L475 WeakPolarHBondContact O-CB 2.98Å; I471-L475 PolarHBondContact O-N 2.92Å; I471-I478 HydrophobicContact CD1-CD1 4.32Å; I471-I478 HydrophobicContact CG2-CD1 4.18Å
472	T	95.2	Very high	94.6	Very high	47 Å²	47	30.7 Å²	30.7	29%	0.288	15%	0.145	S	C	.	.	H	α-helix	trans	-61.8	-31.8	176.3	55.5	0	0	0	0	111.8	P361 E365 F367 S470	P361-T472 HydrophobicContact CB-CG2 3.92Å; P361-T472 HydrophobicContact CG-CG2 4.2Å; E365-T472 WeakPolarHBondContact O-CG2 3.36Å; F367-T472 HydrophobicContact CD2-CG2 4.36Å; F367-T472 HydrophobicContact CE2-CG2 4.13Å; S470-T472 VanDerWaalsContact C-N 3.34Å; S470-T472 PolarHBondContact O-N 3.46Å; S470-T472 PolarHBondContact OG-OG1 3.03Å; S470-T472 VanDerWaalsContact OG-OG1 3.11Å
473	K	95.2	Very high	94.3	Very high	113 Å²	113	22 Å²	22	49%	0.491	11%	0.113	S	C	.	.	H	α-helix	trans	-79.5	-36.8	172.7	-60.8	-60.4	-175.8	-176.3	0	113.1	S416 W417 S470 I471 L475	S416-K473 WeakPolarHBondContact O-CE 3.41Å; S416-K473 VanDerWaalsContact O-CG 3.28Å; S416-K473 WeakPolarHBondContact O-CG 3.4Å; W417-K473 HydrophobicContact CD2-CB 4.03Å; W417-K473 HydrophobicContact CE3-CB 4.19Å; W417-K473 HydrophobicContact CG-CB 4.34Å; S470-K473 PolarHBondContact O-N 3.08Å; I471-K473 PolarHBondContact O-N 2.78Å; K473-L475 VanDerWaalsContact C-N 3.29Å; K473-L475 PolarHBondContact O-N 2.82Å
474	A	96.1	Very high	93.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-77.7	-11.5	179.8	0	0	0	0	0	114.4	I340 W417 S470 I471 S476 W477 I478	I340-A474 HydrophobicContact CD1-CB 3.44Å; I340-A474 VanDerWaalsContact CD1-CB 3.44Å; W417-A474 HydrophobicContact CE3-CB 4.32Å; W417-A474 HydrophobicContact CH2-CB 4.41Å; W417-A474 VanDerWaalsContact CZ3-CA 3.47Å; W417-A474 HydrophobicContact CZ3-CB 3.62Å; S470-A474 PolarHBondContact O-N 3.24Å; S470-A474 VanDerWaalsContact O-N 3.08Å; I471-A474 CarbonylContact O-C 3.46Å; I471-A474 PolarHBondContact O-N 3.16Å; I471-A474 VanDerWaalsContact O-N 3.15Å; A474-S476 VanDerWaalsContact C-N 3.33Å; A474-S476 PolarHBondContact O-N 2.8Å; A474-W477 WeakPolarHBondContact O-CB 3.39Å; A474-W477 PolarHBondContact O-N 3.4Å; A474-I478 HydrophobicContact CB-CD1 4.11Å; A474-I478 HydrophobicContact CB-CG1 4.4Å; A474-I478 WeakPolarHBondContact O-CG1 3.14Å; A474-I478 PolarHBondContact O-N 2.93Å
475	L	94.3	Very high	92.3	Very high	2 Å²	2	23 Å²	23	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-55.1	-42.8	-169.9	-168.9	61.7	0	0	0	113.5	L360 P361 Y363 I471 K473 W477 I478 R479	L360-L475 HydrophobicContact CB-CD1 4.03Å; L360-L475 HydrophobicContact CD1-CD1 4.13Å; P361-L475 WeakPolarHBondContact O-CD2 3.43Å; Y363-L475 HydrophobicContact CD1-CD2 4.04Å; Y363-L475 HydrophobicContact CD2-CD2 3.46Å; Y363-L475 VanDerWaalsContact CD2-CD2 3.46Å; Y363-L475 HydrophobicContact CD2-CG 4.26Å; Y363-L475 HydrophobicContact CE1-CB 4.32Å; Y363-L475 HydrophobicContact CE1-CD2 4.07Å; Y363-L475 HydrophobicContact CE1-CG 4.28Å; Y363-L475 HydrophobicContact CE2-CD2 3.53Å; Y363-L475 HydrophobicContact CE2-CG 3.8Å; Y363-L475 HydrophobicContact CG-CD2 3.77Å; I471-L475 WeakPolarHBondContact O-CB 2.98Å; I471-L475 PolarHBondContact O-N 2.92Å; K473-L475 VanDerWaalsContact C-N 3.29Å; K473-L475 PolarHBondContact O-N 2.82Å; L475-W477 PolarHBondContact O-N 2.93Å; L475-I478 PolarHBondContact O-N 2.9Å; L475-R479 HydrophobicContact CD1-CG 4.39Å; L475-R479 HydrophobicContact CG-CG 4.43Å; L475-R479 WeakPolarHBondContact O-CB 3.34Å; L475-R479 WeakPolarHBondContact O-CG 3.29Å; L475-R479 PolarHBondContact O-N 2.81Å
476	S	91.8	Very high	90.5	Very high	57 Å²	57	25 Å²	25	40%	0.399	12%	0.123	S	C	.	.	H	α-helix	trans	-60.9	-45.4	175.9	-62.2	0	0	0	0	112.5	Y363 A474 L480	Y363-S476 VanDerWaalsContact CE1-OG 3.29Å; Y363-S476 WeakPolarHBondContact CE1-OG 3.25Å; Y363-S476 WeakPolarHBondContact OH-CA 3.27Å; Y363-S476 PolarHBondContact OH-N 3.11Å; Y363-S476 PolarHBondContact OH-OG 3.02Å; Y363-S476 VanDerWaalsContact OH-OG 3.07Å; A474-S476 VanDerWaalsContact C-N 3.33Å; A474-S476 PolarHBondContact O-N 2.8Å; S476-L480 WeakPolarHBondContact O-CB 3.49Å; S476-L480 WeakPolarHBondContact O-CD1 3.27Å; S476-L480 WeakPolarHBondContact O-CG 3.4Å; S476-L480 PolarHBondContact O-N 2.81Å
477	W	93.9	Very high	88.5	Confident	28 Å²	28	26.4 Å²	26.4	11%	0.106	13%	0.13	C	C	.	.	H	α-helix	trans	-62.9	-47.2	177.2	177	86.8	0	0	0	111.2	I326 H328 I340 L342 A474 L475 R479 L480 Q481	I326-W477 HydrophobicContact CG2-CZ2 4.24Å; H328-W477 HydrophobicContact CB-CZ2 4.2Å; H328-W477 AromaticContact CD2-CD1 3.26Å; H328-W477 AromaticContact CD2-CD2 3.64Å; H328-W477 AromaticContact CD2-CE2 3.65Å; H328-W477 AromaticContact CD2-CG 3.42Å; H328-W477 VanDerWaalsContact CD2-CG 3.42Å; H328-W477 AromaticContact CD2-NE1 3.4Å; H328-W477 PolarHBondContact CD2-NE1 2.79Å; H328-W477 AromaticContact CG-NE1 4Å; H328-W477 AromaticContact NE2-CD1 3.52Å; H328-W477 AromaticContact NE2-CG 3.85Å; I340-W477 HydrophobicContact CB-CZ3 4.41Å; I340-W477 HydrophobicContact CD1-CE3 4.3Å; I340-W477 HydrophobicContact CD1-CZ3 4.16Å; I340-W477 HydrophobicContact CG1-CZ3 3.96Å; I340-W477 HydrophobicContact CG2-CD2 4.45Å; I340-W477 HydrophobicContact CG2-CE3 3.88Å; I340-W477 HydrophobicContact CG2-CH2 4.29Å; I340-W477 HydrophobicContact CG2-CZ3 3.8Å; L342-W477 HydrophobicContact CB-CH2 4.35Å; L342-W477 HydrophobicContact CD1-CH2 4.03Å; L342-W477 HydrophobicContact CD1-CZ3 3.92Å; L342-W477 HydrophobicContact CG-CH2 3.97Å; L342-W477 HydrophobicContact CG-CZ3 3.89Å; A474-W477 WeakPolarHBondContact O-CB 3.39Å; A474-W477 PolarHBondContact O-N 3.4Å; L475-W477 PolarHBondContact O-N 2.93Å; W477-R479 PolarHBondContact O-N 3.39Å; W477-L480 PolarHBondContact O-N 3.45Å; W477-Q481 HydrophobicContact CD2-CG 4.08Å; W477-Q481 HydrophobicContact CH2-CG 4.35Å; W477-Q481 HydrophobicContact CZ2-CG 3.82Å; W477-Q481 WeakPolarHBondContact O-CG 3.41Å; W477-Q481 PolarHBondContact O-N 3.22Å
478	I	95.3	Very high	86.3	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-56.4	-51.6	179.4	-63.6	167.7	0	0	0	110.3	I282 L288 I340 L360 I471 A474 L475 L480 Q481 I482	I282-I478 HydrophobicContact CD1-CG2 3.98Å; L288-I478 HydrophobicContact CD1-CD1 4.01Å; L288-I478 HydrophobicContact CD1-CG1 4.01Å; L288-I478 HydrophobicContact CD2-CD1 3.87Å; I340-I478 HydrophobicContact CD1-CD1 3.88Å; I340-I478 HydrophobicContact CD1-CG1 4Å; L360-I478 HydrophobicContact CD1-CG2 3.89Å; I471-I478 HydrophobicContact CD1-CD1 4.32Å; I471-I478 HydrophobicContact CG2-CD1 4.18Å; A474-I478 HydrophobicContact CB-CD1 4.11Å; A474-I478 HydrophobicContact CB-CG1 4.4Å; A474-I478 WeakPolarHBondContact O-CG1 3.14Å; A474-I478 PolarHBondContact O-N 2.93Å; L475-I478 PolarHBondContact O-N 2.9Å; I478-L480 PolarHBondContact O-N 3Å; I478-Q481 PolarHBondContact O-N 2.91Å; I478-I482 HydrophobicContact CG2-CD1 3.79Å; I478-I482 VanDerWaalsContact O-CG1 3.32Å; I478-I482 WeakPolarHBondContact O-CG1 3.34Å; I478-I482 PolarHBondContact O-N 3.42Å; I478-I482 VanDerWaalsContact O-N 3.14Å
479	R	91.9	Very high	84.1	Confident	17 Å²	17	33.9 Å²	33.9	6%	0.064	16%	0.163	C	C	.	.	H	α-helix	trans	-60.4	-46.3	-178.5	-69.2	-70.6	-179.3	-169.3	-3.2	112.1	L181 Y183 L475 W477 Q481 I482 E483	L181-R479 PolarHBondContact O-NH1 3.34Å; Y183-R479 PolarHBondContact OH-NH1 3.45Å; Y183-R479 PolarHBondContact OH-NH2 3.02Å; L475-R479 HydrophobicContact CD1-CG 4.39Å; L475-R479 HydrophobicContact CG-CG 4.43Å; L475-R479 WeakPolarHBondContact O-CB 3.34Å; L475-R479 WeakPolarHBondContact O-CG 3.29Å; L475-R479 PolarHBondContact O-N 2.81Å; W477-R479 PolarHBondContact O-N 3.39Å; R479-Q481 VanDerWaalsContact C-N 3.33Å; R479-Q481 PolarHBondContact O-N 2.9Å; R479-I482 PolarHBondContact O-N 2.96Å; R479-E483 WeakPolarHBondContact O-CB 3.39Å; R479-E483 PolarHBondContact O-N 3.02Å
480	L	89.8	Confident	81.8	Confident	55 Å²	55	37.5 Å²	37.5	29%	0.288	18%	0.182	S	C	.	.	H	α-helix	trans	-60	-41.6	178.4	-75	169.3	0	0	0	112.3	L141 S476 W477 I478 R484	L141-L480 HydrophobicContact CB-CD2 3.65Å; S476-L480 WeakPolarHBondContact O-CB 3.49Å; S476-L480 WeakPolarHBondContact O-CD1 3.27Å; S476-L480 WeakPolarHBondContact O-CG 3.4Å; S476-L480 PolarHBondContact O-N 2.81Å; W477-L480 PolarHBondContact O-N 3.45Å; I478-L480 PolarHBondContact O-N 3Å; L480-R484 WeakPolarHBondContact O-CB 3.47Å; L480-R484 PolarHBondContact O-N 3.45Å
481	Q	91.4	Very high	79.3	Confident	34 Å²	34	41.3 Å²	41.3	16%	0.159	20%	0.201	C	C	.	.	H	α-helix	trans	-67.4	-38.4	179	-65.7	-45.5	-46.9	0	0	112.5	I326 L342 W477 I478 R479	I326-Q481 HydrophobicContact CG2-CG 4.22Å; L342-Q481 HydrophobicContact CD1-CB 3.47Å; L342-Q481 VanDerWaalsContact CD1-CB 3.47Å; L342-Q481 HydrophobicContact CD1-CG 4.05Å; W477-Q481 HydrophobicContact CD2-CG 4.08Å; W477-Q481 HydrophobicContact CH2-CG 4.35Å; W477-Q481 HydrophobicContact CZ2-CG 3.82Å; W477-Q481 WeakPolarHBondContact O-CG 3.41Å; W477-Q481 PolarHBondContact O-N 3.22Å; I478-Q481 PolarHBondContact O-N 2.91Å; R479-Q481 VanDerWaalsContact C-N 3.33Å; R479-Q481 PolarHBondContact O-N 2.9Å
482	I	89.9	Confident	76.6	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-68	-50.3	177.7	-61.5	169.6	0	0	0	109.9	I282 T283 W286 L342 I478 R479 K485	I282-I482 HydrophobicContact CD1-CD1 3.95Å; T283-I482 HydrophobicContact CG2-CD1 4.49Å; W286-I482 HydrophobicContact CD2-CG1 4.3Å; W286-I482 HydrophobicContact CG-CG1 4.28Å; L342-I482 HydrophobicContact CD1-CG1 4.47Å; I478-I482 HydrophobicContact CG2-CD1 3.79Å; I478-I482 VanDerWaalsContact O-CG1 3.32Å; I478-I482 WeakPolarHBondContact O-CG1 3.34Å; I478-I482 PolarHBondContact O-N 3.42Å; I478-I482 VanDerWaalsContact O-N 3.14Å; R479-I482 PolarHBondContact O-N 2.96Å; I482-K485 PolarHBondContact O-N 2.98Å
483	E	86.8	Confident	74.1	Confident	11 Å²	11	46.3 Å²	46.3	5%	0.051	23%	0.23	C	C	.	.	H	α-helix	trans	-63.4	-46.6	-177.5	-175.2	-179.4	-175.3	0	0	112.6	L141 G142 Q180 R479 K485 E486 M487	L141-E483 HydrophobicContact CD2-CB 4.49Å; L141-E483 HydrophobicContact CD2-CG 3.89Å; G142-E483 WeakPolarHBondContact CA-OE2 3.35Å; G142-E483 PolarHBondContact N-OE2 2.87Å; Q180-E483 WeakPolarHBondContact O-CB 2.9Å; Q180-E483 WeakPolarHBondContact O-CG 3.46Å; R479-E483 WeakPolarHBondContact O-CB 3.39Å; R479-E483 PolarHBondContact O-N 3.02Å; E483-K485 PolarHBondContact O-N 2.89Å; E483-E486 PolarHBondContact O-N 2.94Å; E483-E486 VanDerWaalsContact O-N 3.07Å; E483-M487 PolarHBondContact O-N 3.27Å
484	R	80.2	Confident	71.5	Confident	57 Å²	57	44.3 Å²	44.3	22%	0.215	23%	0.231	C	C	.	.	H	α-helix	trans	-47.9	-35.2	-179.2	-176	-177.8	-69.8	-132	1.6	111.4	E138 L141 L480 F488	E138-R484 IonicContact OE1-CZ 2.73Å; E138-R484 IonicContact OE1-NH1 2.59Å; E138-R484 PolarHBondContact OE1-NH1 2.73Å; E138-R484 IonicContact OE1-NH2 3.92Å; E138-R484 PolarHBondContact OE1-NH2 3.01Å; L141-R484 HydrophobicContact CD1-CB 3.88Å; L141-R484 HydrophobicContact CD1-CG 3.99Å; L480-R484 WeakPolarHBondContact O-CB 3.47Å; L480-R484 PolarHBondContact O-N 3.45Å; R484-F488 HydrophobicContact CG-CD2 4.16Å; R484-F488 HydrophobicContact CG-CE2 3.8Å; R484-F488 WeakPolarHBondContact O-CD2 3.49Å; R484-F488 PolarHBondContact O-N 3.05Å
485	K	66.3	Low	68.8	Low	41 Å²	41	48.8 Å²	48.8	18%	0.178	26%	0.262	C	S	.	.	H	α-helix	trans	-90.4	-24.1	-174.6	-72.5	-68.1	170.1	-160.1	0	115.6	W286 I482 E483 M487 F488 H489	W286-K485 HydrophobicContact CZ2-CB 4.27Å; I482-K485 PolarHBondContact O-N 2.98Å; E483-K485 PolarHBondContact O-N 2.89Å; K485-M487 PolarHBondContact O-N 3.15Å; K485-F488 HydrophobicContact CD-CD2 4.22Å; K485-F488 PolarHBondContact O-N 3.02Å; K485-H489 PolarHBondContact O-N 3.11Å
486	E	59	Low	66.2	Low	43 Å²	43	54 Å²	54	20%	0.201	29%	0.294	C	S	.	.	H	α-helix	trans	-62.4	-37	167.2	-69.3	-57.3	129.4	0	0	110.2	E483 H489 L490	E483-E486 PolarHBondContact O-N 2.94Å; E483-E486 VanDerWaalsContact O-N 3.07Å; E486-H489 PolarHBondContact O-N 3.33Å; E486-L490 WeakPolarHBondContact O-CD1 3.06Å; E486-L490 WeakPolarHBondContact O-CG 3.42Å; E486-L490 PolarHBondContact O-N 3.21Å
487	M	53.4	Low	63.4	Low	35 Å²	35	59.3 Å²	59.3	17%	0.172	32%	0.324	C	S	.	.	H	α-helix	trans	-65	-46.5	175.8	-166.9	-162.5	-64.1	0	0	113.1	H137 L141 E483 K485 H489 L490 L491	H137-M487 HydrophobicContact CB-CE 4.4Å; H137-M487 HydrophobicContact CB-SD 4.49Å; L141-M487 HydrophobicContact CD2-CE 3.38Å; L141-M487 HydrophobicContact CG-CE 4.24Å; E483-M487 PolarHBondContact O-N 3.27Å; K485-M487 PolarHBondContact O-N 3.15Å; M487-H489 VanDerWaalsContact C-N 3.31Å; M487-H489 PolarHBondContact O-N 3.12Å; M487-L490 PolarHBondContact O-N 3.49Å; M487-L491 HydrophobicContact CG-CD1 4.18Å; M487-L491 WeakPolarHBondContact O-CG 3.31Å; M487-L491 PolarHBondContact O-N 3.47Å; M487-L491 VanDerWaalsContact O-N 3.08Å
488	F	51.9	Low	61.9	Low	75 Å²	75	60.9 Å²	60.9	33%	0.329	34%	0.335	S	S	.	.	H	α-helix	trans	-65.1	-31.2	178.6	-80.1	-69.1	0	0	0	113.3	N136 R484 K485 S492	N136-F488 HydrophobicContact CB-CZ 4.32Å; R484-F488 HydrophobicContact CG-CD2 4.16Å; R484-F488 HydrophobicContact CG-CE2 3.8Å; R484-F488 WeakPolarHBondContact O-CD2 3.49Å; R484-F488 PolarHBondContact O-N 3.05Å; K485-F488 HydrophobicContact CD-CD2 4.22Å; K485-F488 PolarHBondContact O-N 3.02Å; F488-S492 PolarHBondContact O-N 2.87Å; F488-S492 PolarHBondContact O-OG 2.99Å
489	H	50.3	Low	60.1	Low	84 Å²	84	64.1 Å²	64.1	39%	0.389	35%	0.352	S	S	.	.	H	α-helix	trans	-69.4	-37.5	176.3	-165.1	-19	0	0	0	111.8	K485 E486 M487 S492 L493	K485-H489 PolarHBondContact O-N 3.11Å; E486-H489 PolarHBondContact O-N 3.33Å; M487-H489 VanDerWaalsContact C-N 3.31Å; M487-H489 PolarHBondContact O-N 3.12Å; H489-S492 PolarHBondContact O-OG 2.99Å; H489-L493 WeakPolarHBondContact ND1-CD1 3.29Å; H489-L493 WeakPolarHBondContact O-CD1 3.44Å; H489-L493 WeakPolarHBondContact O-CG 3.4Å; H489-L493 PolarHBondContact O-N 3.35Å
490	L	49.5	Very low	58.3	Low	78 Å²	78	66.7 Å²	66.7	41%	0.408	37%	0.368	S	S	.	.	H	α-helix	trans	-69.1	-41.2	177	-66.9	160.4	0	0	0	111.5	K179 E486 M487 L493 S494	K179-L490 VanDerWaalsContact NZ-CD1 3.33Å; E486-L490 WeakPolarHBondContact O-CD1 3.06Å; E486-L490 WeakPolarHBondContact O-CG 3.42Å; E486-L490 PolarHBondContact O-N 3.21Å; M487-L490 PolarHBondContact O-N 3.49Å; L490-L493 PolarHBondContact O-N 3.24Å; L490-S494 PolarHBondContact O-N 3.34Å; L490-S494 VanDerWaalsContact O-N 3.09Å
491	L	45.4	Very low	56.5	Low	90 Å²	90	67.4 Å²	67.4	47%	0.471	37%	0.373	S	S	.	.	H	α-helix	trans	-66.6	-35.9	176.6	-69.8	169.1	0	0	0	112.5	M487 L493 S494 S495	M487-L491 HydrophobicContact CG-CD1 4.18Å; M487-L491 WeakPolarHBondContact O-CG 3.31Å; M487-L491 PolarHBondContact O-N 3.47Å; M487-L491 VanDerWaalsContact O-N 3.08Å; L491-L493 VanDerWaalsContact C-N 3.34Å; L491-S494 PolarHBondContact O-OG 3.41Å; L491-S495 PolarHBondContact O-N 3.29Å; L491-S495 PolarHBondContact O-OG 2.95Å
492	S	40.7	Very low	54.3	Low	59 Å²	59	69.4 Å²	69.4	41%	0.413	39%	0.387	S	S	.	.	H	α-helix	trans	-68.3	-34.6	175.2	66.1	0	0	0	0	112.5	F488 H489 S495 T496	F488-S492 PolarHBondContact O-N 2.87Å; F488-S492 PolarHBondContact O-OG 2.99Å; H489-S492 PolarHBondContact O-OG 2.99Å; S492-S495 PolarHBondContact O-OG 3.46Å; S492-T496 PolarHBondContact O-OG1 3.31Å; S492-T496 VanDerWaalsContact O-OG1 3.11Å
493	L	42.8	Very low	51.9	Low	93 Å²	93	74 Å²	74	49%	0.487	41%	0.412	S	S	.	.	H	α-helix	trans	-70.1	-38.2	177.5	-76	163	0	0	0	111.8	H489 L490 L491 S495 T496	H489-L493 WeakPolarHBondContact ND1-CD1 3.29Å; H489-L493 WeakPolarHBondContact O-CD1 3.44Å; H489-L493 WeakPolarHBondContact O-CG 3.4Å; H489-L493 PolarHBondContact O-N 3.35Å; L490-L493 PolarHBondContact O-N 3.24Å; L491-L493 VanDerWaalsContact C-N 3.34Å; L493-S495 VanDerWaalsContact C-N 3.32Å; L493-S495 PolarHBondContact O-N 3.35Å; L493-T496 PolarHBondContact O-N 3.05Å; L493-T496 PolarHBondContact O-OG1 3Å
494	S	40.5	Very low	49.4	Very low	71 Å²	71	78.5 Å²	78.5	50%	0.497	44%	0.438	S	S	.	.	H	α-helix	trans	-72.8	-21.7	176.8	65.1	0	0	0	0	113.9	L490 L491 T496 T497	L490-S494 PolarHBondContact O-N 3.34Å; L490-S494 VanDerWaalsContact O-N 3.09Å; L491-S494 PolarHBondContact O-OG 3.41Å; S494-T496 VanDerWaalsContact C-N 3.34Å; S494-T497 PolarHBondContact O-OG1 2.83Å
495	S	39.2	Very low	47.1	Very low	93 Å²	93	80.2 Å²	80.2	65%	0.65	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-10.2	174.6	60.7	0	0	0	0	114.2	L491 S492 L493	L491-S495 PolarHBondContact O-N 3.29Å; L491-S495 PolarHBondContact O-OG 2.95Å; S492-S495 PolarHBondContact O-OG 3.46Å; L493-S495 VanDerWaalsContact C-N 3.32Å; L493-S495 PolarHBondContact O-N 3.35Å
496	T	39.6	Very low	45.5	Very low	112 Å²	112	83.4 Å²	83.4	69%	0.687	48%	0.478	S	S	*	.			trans	-103	1.9	179.4	41.9	0	0	0	0	114	S492 L493 S494	S492-T496 PolarHBondContact O-OG1 3.31Å; S492-T496 VanDerWaalsContact O-OG1 3.11Å; L493-T496 PolarHBondContact O-N 3.05Å; L493-T496 PolarHBondContact O-OG1 3Å; S494-T496 VanDerWaalsContact C-N 3.34Å
497	T	33.3	Very low	44.2	Very low	168 Å²	168	87.1 Å²	87.1	100%	1.031	50%	0.503	S	S	*	.			trans	-112.4	0	170.4	50.2	0	0	0	0	109	S494	S494-T497 PolarHBondContact O-OG1 2.83Å

Retrieved 497 of 497 residues in 322.3 ms (Link to these results)

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