A0A087X3G7_POEFO Loading...

Pre-mRNA-processing factor 17

AlphaFold DB , UniProt , Accession A0A087X3G7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 582 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.2	Very low	31.4	Very low	229 Å²	229	131.3 Å²	131.3	100%	1.128	80%	0.799	S	S	*	*				0	101.3	0	-75.2	-163.3	-78.2	0	0	106.7
2	S	28.8	Very low	31.1	Very low	111 Å²	111	126.1 Å²	126.1	78%	0.776	79%	0.792	S	S	*	*				86.2	117.9	80.8	-60.1	0	0	0	0	110.2
3	A	29.9	Very low	30.9	Very low	99 Å²	99	124.5 Å²	124.5	82%	0.818	79%	0.787	S	S	*	*			trans	72.4	148.9	140.1	0	0	0	0	0	118
4	A	29.3	Very low	30.7	Very low	75 Å²	75	126.8 Å²	126.8	62%	0.62	79%	0.791	S	S	*	*			cis	174.7	167.2	-16.9	0	0	0	0	0	104.4
5	I	36.6	Very low	30.5	Very low	158 Å²	158	124.9 Å²	124.9	81%	0.81	78%	0.784	S	S	*	*			trans	77	95.1	145.2	-67.5	154.6	0	0	0	116.4
6	A	33.7	Very low	30.4	Very low	78 Å²	78	126.6 Å²	126.6	65%	0.645	79%	0.786	S	S	*	*				94.9	144.8	97.7	0	0	0	0	0	121.4
7	S	32.6	Very low	30.5	Very low	100 Å²	100	125.4 Å²	125.4	70%	0.699	78%	0.783	S	S	*	*				83.7	115.2	127.9	53.1	0	0	0	0	117.7
8	L	31.6	Very low	30.4	Very low	163 Å²	163	128.3 Å²	128.3	85%	0.853	79%	0.786	S	S	*	*				79.7	116.9	70.5	-112.4	97.1	0	0	0	112.5
9	A	31.6	Very low	30.3	Very low	98 Å²	98	128.1 Å²	128.1	81%	0.81	78%	0.78	S	S	*	*			trans	-161.2	133.8	144.8	0	0	0	0	0	105.3
10	S	28.5	Very low	30.2	Very low	105 Å²	105	129.5 Å²	129.5	73%	0.734	78%	0.777	S	S	*	*			cis	-172.6	125.7	3.9	44.7	0	0	0	0	104.4
11	Y	28.4	Very low	30.2	Very low	228 Å²	228	127.8 Å²	127.8	89%	0.894	77%	0.771	S	S	*	*				47.9	126	89.3	-109.4	-85.1	0	0	0	117.3
12	G	27.8	Very low	29.9	Very low	69 Å²	69	125.5 Å²	125.5	71%	0.711	76%	0.758	S	S	*	*			trans	147.3	88.1	171.3	0	0	0	0	0	108.4
13	S	28.4	Very low	29.9	Very low	105 Å²	105	126.2 Å²	126.2	73%	0.734	76%	0.763	S	S	*	*				56.1	105.2	68.3	-166.4	0	0	0	0	113.5
14	D	27.6	Very low	29.7	Very low	157 Å²	157	128.9 Å²	128.9	84%	0.84	76%	0.764	S	S	*	*			trans	152.5	145.5	148.8	-89.8	-5.8	0	0	0	107.1
15	S	28.9	Very low	29.7	Very low	98 Å²	98	131.8 Å²	131.8	69%	0.685	77%	0.774	S	S	*	*			cis	-178.5	151.2	-10.2	162.3	0	0	0	0	102.8
16	D	27.7	Very low	29.3	Very low	152 Å²	152	129.2 Å²	129.2	81%	0.813	77%	0.77	S	S	*	*			trans	-29.7	142.6	165.5	-65.7	-50.7	0	0	0	116.4
17	S	32.3	Very low	29.1	Very low	106 Å²	106	133.3 Å²	133.3	74%	0.741	78%	0.779	S	S	*	*				-170.1	105.4	128.2	61.7	0	0	0	0	111.8
18	E	29.9	Very low	28.9	Very low	179 Å²	179	137.5 Å²	137.5	84%	0.836	79%	0.788	S	S	*	*				66.4	111.4	116.8	-73.7	-174.2	-177.2	0	0	121.3
19	N	27.5	Very low	29.2	Very low	124 Å²	124	139.3 Å²	139.3	66%	0.663	79%	0.788	S	S	*	*				76.7	117.1	108.9	-114.6	15.4	0	0	0	120.7
20	E	29.4	Very low	29.2	Very low	155 Å²	155	141.5 Å²	141.5	72%	0.724	79%	0.792	S	S	*	*				116.6	136.7	108.1	-109	174.8	-145.9	0	0	119.3
21	S	28.4	Very low	29.4	Very low	95 Å²	95	139.4 Å²	139.4	66%	0.664	79%	0.787	S	S	*	*			trans	74.9	133.7	151.7	71.3	0	0	0	0	116.5
22	E	28.8	Very low	30.2	Very low	181 Å²	181	134.3 Å²	134.3	85%	0.846	78%	0.781	S	S	*	*			cis	-172.6	128.1	25	-129.2	164.9	-147.7	0	0	108.3
23	S	29.2	Very low	31.1	Very low	126 Å²	126	138.4 Å²	138.4	88%	0.881	79%	0.787	S	S	*	*			trans	-155.4	73.8	150.8	70.1	0	0	0	0	109.8
24	N	26.3	Very low	31.7	Very low	155 Å²	155	140.6 Å²	140.6	83%	0.829	79%	0.79	S	S	*	*			trans	-86.5	121.8	159.7	-106.1	-19.1	0	0	0	108.3
25	T	28	Very low	33	Very low	136 Å²	136	138.4 Å²	138.4	83%	0.834	79%	0.785	S	S	*	*			trans	170.8	133.2	140.7	24.5	0	0	0	0	106.8
26	S	28.6	Very low	34.3	Very low	104 Å²	104	140.4 Å²	140.4	73%	0.727	79%	0.788	S	S	*	*			cis	-174.2	138.6	-8.7	32.2	0	0	0	0	104.4	E28	S26-E28 PolarHBondContact O-N 3.34Å
27	I	30.3	Very low	35.6	Very low	164 Å²	164	136.9 Å²	136.9	84%	0.841	78%	0.78	S	S	*	*			trans	-64.5	124.8	172.1	-65.5	162	0	0	0	108.8
28	E	28.5	Very low	36.9	Very low	188 Å²	188	136.1 Å²	136.1	88%	0.879	77%	0.771	S	S	*	*			trans	-130.3	142.1	148.2	-87.1	-161.1	156.3	0	0	110.9	S26	S26-E28 PolarHBondContact O-N 3.34Å
29	K	36.1	Very low	38.3	Very low	200 Å²	200	130.9 Å²	130.9	87%	0.87	76%	0.758	S	S	*	*			trans	-68.2	134.7	-164.7	-65	164.2	172.7	172.3	0	112
30	V	31.9	Very low	39.8	Very low	145 Å²	145	132 Å²	132	88%	0.879	76%	0.759	S	S	*	*			trans	-133.5	139.1	160.6	-178.5	0	0	0	0	109.5
31	G	33.9	Very low	41	Very low	61 Å²	61	130.6 Å²	130.6	63%	0.629	76%	0.756	S	S	*	*			trans	-72.4	-172.1	-175.9	0	0	0	0	0	114.9
32	P	44.1	Very low	42.2	Very low	120 Å²	120	134.8 Å²	134.8	78%	0.779	76%	0.762	S	S	*	*	S	Bend	trans	-80.5	125.9	-164.1	33.3	-30.8	0	0	0	110.2
33	D	48.4	Very low	43.3	Very low	155 Å²	155	131.8 Å²	131.8	83%	0.829	76%	0.758	S	S	*	*			trans	163.7	91.2	139.9	-81.1	-21	0	0	0	108.3
34	D	40.3	Very low	44.3	Very low	151 Å²	151	134.3 Å²	134.3	81%	0.807	76%	0.761	S	S	*	*			trans	-151.6	132.4	154.9	-107.9	-29.8	0	0	0	111.8	D36	D34-D36 VanDerWaalsContact C-N 3.3Å; D34-D36 PolarHBondContact O-N 2.83Å; D34-D36 VanDerWaalsContact O-N 3.14Å
35	P	55.6	Low	45.2	Very low	111 Å²	111	136 Å²	136	72%	0.721	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	21.1	-161	34.9	-37.3	0	0	0	115.6
36	D	54.8	Low	45.8	Very low	141 Å²	141	135.1 Å²	135.1	75%	0.754	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-5.7	-176	-123.6	-4.6	0	0	0	114	D34 T38	D34-D36 VanDerWaalsContact C-N 3.3Å; D34-D36 PolarHBondContact O-N 2.83Å; D34-D36 VanDerWaalsContact O-N 3.14Å; D36-T38 PolarHBondContact O-N 3.01Å
37	A	56	Low	46.6	Very low	77 Å²	77	133.3 Å²	133.3	64%	0.636	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	5.2	177.2	0	0	0	0	0	114.4	H40	A37-H40 PolarHBondContact O-CE1 3.26Å
38	T	58.5	Low	47.3	Very low	91 Å²	91	132 Å²	132	56%	0.558	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.4	5.2	-177.5	58.9	0	0	0	0	114.9	D36 H40 L41	D36-T38 PolarHBondContact O-N 3.01Å; T38-H40 VanDerWaalsContact C-N 3.25Å; T38-H40 PolarHBondContact O-N 3.23Å; T38-L41 PolarHBondContact O-N 2.92Å
39	A	59.1	Low	47.8	Very low	68 Å²	68	129.4 Å²	129.4	56%	0.562	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-67.6	-20.6	179.7	0	0	0	0	0	114.3	L41	A39-L41 PolarHBondContact O-N 3.37Å
40	H	59.8	Low	48	Very low	148 Å²	148	129 Å²	129	69%	0.685	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-80.1	0.9	176.6	63.5	-88.8	0	0	0	114	A37 T38	A37-H40 PolarHBondContact O-CE1 3.26Å; T38-H40 VanDerWaalsContact C-N 3.25Å; T38-H40 PolarHBondContact O-N 3.23Å
41	L	54.3	Low	48.5	Very low	126 Å²	126	127.8 Å²	127.8	66%	0.66	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-103.6	10.2	179.6	-67.8	169.1	0	0	0	113.7	T38 A39	T38-L41 PolarHBondContact O-N 2.92Å; A39-L41 PolarHBondContact O-N 3.37Å
42	K	53.1	Low	48.8	Very low	182 Å²	182	133 Å²	133	79%	0.791	77%	0.774	S	S	*	*	S	Bend	trans	-92.7	119.9	170.2	-74.8	-177.3	-179.1	174.1	0	110.3
43	P	53.1	Low	48.8	Very low	119 Å²	119	132.2 Å²	132.2	77%	0.773	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-67.8	132.5	-177	24.7	-31.2	0	0	0	111.8	Q45	P43-Q45 PolarHBondContact O-N 3.1Å
44	L	48.8	Very low	48.5	Very low	179 Å²	179	130.9 Å²	130.9	94%	0.937	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-57.5	120.5	165.2	-80.1	155.8	0	0	0	108.5
45	Q	45.9	Very low	48.6	Very low	191 Å²	191	131.7 Å²	131.7	89%	0.893	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-63.9	139.7	175.7	-73.5	-173.1	-9.6	0	0	110.6	P43	P43-Q45 PolarHBondContact O-N 3.1Å
46	S	40.9	Very low	47.9	Very low	117 Å²	117	133.1 Å²	133.1	82%	0.818	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-47.7	130.1	-171.1	50.6	0	0	0	0	115
47	G	45.9	Very low	47.6	Very low	66 Å²	66	132.1 Å²	132.1	68%	0.68	78%	0.784	S	S	*	*			trans	-68.4	-161.4	171.3	0	0	0	0	0	114.7
48	P	45.3	Very low	47.2	Very low	135 Å²	135	132 Å²	132	88%	0.877	78%	0.783	S	S	*	*				-129.7	137.4	100.1	30.7	-19	0	0	0	114.2
49	T	38.5	Very low	46.9	Very low	134 Å²	134	133.5 Å²	133.5	82%	0.822	79%	0.794	S	S	*	*			trans	-67.7	154.7	166.4	43.4	0	0	0	0	112.7
50	M	40.3	Very low	46.3	Very low	192 Å²	192	139.4 Å²	139.4	95%	0.946	81%	0.81	S	S	*	*			trans	-41.7	138.5	175.3	-53.1	-173.2	-163	0	0	115.2
51	S	42.1	Very low	46.1	Very low	119 Å²	119	138.6 Å²	138.6	83%	0.832	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-100	138.4	155.5	52.5	0	0	0	0	110.2
52	L	40.4	Very low	45.7	Very low	172 Å²	172	136.6 Å²	136.6	90%	0.901	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-59.9	143.9	-178.3	-97.4	130.2	0	0	0	113.2	V54	L52-V54 PolarHBondContact O-N 3.34Å
53	A	44	Very low	45.2	Very low	103 Å²	103	133.8 Å²	133.8	85%	0.851	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-59.9	118.5	-176.7	0	0	0	0	0	113.7
54	V	41.6	Very low	45.1	Very low	127 Å²	127	137.8 Å²	137.8	77%	0.77	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-100.3	119.9	156.4	176.9	0	0	0	0	107	L52 N56	L52-V54 PolarHBondContact O-N 3.34Å; V54-N56 PolarHBondContact O-N 2.92Å
55	L	41.8	Very low	45.2	Very low	167 Å²	167	137.5 Å²	137.5	87%	0.874	81%	0.814	S	S	*	*			trans	-74.9	95.5	-178.6	-156.7	136	0	0	0	108.9
56	N	42	Very low	45.1	Very low	141 Å²	141	133 Å²	133	75%	0.754	81%	0.809	S	S	*	*			trans	-102	118.9	171.3	-110.5	-11.3	0	0	0	109.5	V54 A58	V54-N56 PolarHBondContact O-N 2.92Å; N56-A58 PolarHBondContact O-N 2.75Å
57	S	48	Very low	45.5	Very low	120 Å²	120	132.6 Å²	132.6	84%	0.839	80%	0.802	S	S	*	*	S	Bend	trans	-82.3	53.9	-176.8	51.7	0	0	0	0	113
58	A	48.8	Very low	45.6	Very low	74 Å²	74	138.3 Å²	138.3	61%	0.612	81%	0.811	S	S	*	*	S	Bend	trans	-155.2	138.2	170.1	0	0	0	0	0	109.5	N56 E60	N56-A58 PolarHBondContact O-N 2.75Å; A58-E60 PolarHBondContact O-N 3.45Å
59	P	51.9	Low	46.1	Very low	124 Å²	124	136 Å²	136	81%	0.805	79%	0.794	S	S	*	*			trans	-66.2	127.6	178.7	27	-32.1	0	0	0	110.2	V61	P59-V61 PolarHBondContact O-N 3.41Å
60	E	45.3	Very low	47.1	Very low	192 Å²	192	132.6 Å²	132.6	90%	0.897	79%	0.786	S	S	*	*			trans	-66.4	113.9	171.2	-151	171.5	-158.7	0	0	108.1	A58 A62	A58-E60 PolarHBondContact O-N 3.45Å; E60-A62 VanDerWaalsContact C-N 3.34Å; E60-A62 PolarHBondContact O-N 3.33Å
61	V	55.6	Low	48.2	Very low	131 Å²	131	129.4 Å²	129.4	79%	0.794	77%	0.771	S	S	*	*			trans	-76.9	91	175.8	179.2	0	0	0	0	107.1	P59 V63	P59-V61 PolarHBondContact O-N 3.41Å; V61-V63 PolarHBondContact O-N 3.22Å
62	A	46.9	Very low	49.4	Very low	83 Å²	83	128.9 Å²	128.9	69%	0.686	76%	0.756	S	S	*	*			trans	-61.3	119.7	172.9	0	0	0	0	0	109.7	E60	E60-A62 VanDerWaalsContact C-N 3.34Å; E60-A62 PolarHBondContact O-N 3.33Å
63	V	42.2	Very low	51.3	Low	124 Å²	124	122.7 Å²	122.7	75%	0.752	72%	0.723	S	S	*	*			trans	-67.4	134.1	172.4	-176.9	0	0	0	0	108.4	V61 E65	V61-V63 PolarHBondContact O-N 3.22Å; V63-E65 PolarHBondContact O-N 2.96Å
64	K	51.5	Low	53.1	Low	202 Å²	202	122.3 Å²	122.3	88%	0.878	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	13.3	-159.1	-74.7	179.1	169.4	-178.2	0	118.6
65	E	50.1	Low	55.1	Low	174 Å²	174	120.2 Å²	120.2	81%	0.813	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	-6.6	-169.1	-70.1	179.4	173.5	0	0	115.5	V63	V63-E65 PolarHBondContact O-N 2.96Å
66	A	43	Very low	57.1	Low	96 Å²	96	116.4 Å²	116.4	79%	0.793	68%	0.683	S	S	*	*	S	Bend	trans	-106	10.2	-178.8	0	0	0	0	0	115
67	V	50	Low	59.2	Low	109 Å²	109	114.3 Å²	114.3	66%	0.661	67%	0.671	S	S	*	*			trans	-125.5	57.5	174.3	-168.3	0	0	0	0	108.6	T69	V67-T69 HydrophobicContact CG1-CG2 3.76Å; V67-T69 PolarHBondContact O-N 3.06Å; V67-T69 VanDerWaalsContact O-N 3.11Å
68	E	48.2	Very low	61	Low	186 Å²	186	115.9 Å²	115.9	87%	0.869	66%	0.663	S	S	*	*			trans	-80.2	67.3	158	-75.8	-172.2	162.7	0	0	108.1	G70	E68-G70 PolarHBondContact O-N 3.35Å
69	T	55.7	Low	62.8	Low	86 Å²	86	120.4 Å²	120.4	53%	0.528	67%	0.671	S	S	.	*			trans	-69	106.8	159.7	50.6	0	0	0	0	105.8	V67 H72	V67-T69 HydrophobicContact CG1-CG2 3.76Å; V67-T69 PolarHBondContact O-N 3.06Å; V67-T69 VanDerWaalsContact O-N 3.11Å; T69-H72 PolarHBondContact O-CD2 2.93Å; T69-H72 PolarHBondContact O-NE2 3.08Å; T69-H72 PolarHBondContact OG1-NE2 3.45Å
70	G	59	Low	64.6	Low	63 Å²	63	117 Å²	117	65%	0.649	65%	0.648	S	S	*	*			trans	50.7	169.5	161.9	0	0	0	0	0	119.7	E68 H72	E68-G70 PolarHBondContact O-N 3.35Å; G70-H72 PolarHBondContact O-N 3.1Å
71	I	63.5	Low	66.6	Low	124 Å²	124	114.8 Å²	114.8	64%	0.636	65%	0.648	S	S	*	*			trans	-82	103.1	163.7	-57.1	170.6	0	0	0	105.9	Y82 T88	I71-Y82 WeakPolarHBondContact CG2-OH 3.31Å; I71-T88 WeakPolarHBondContact O-CB 3.29Å; I71-T88 WeakPolarHBondContact O-CG2 3.34Å
72	H	68	Low	68.1	Low	109 Å²	109	112.8 Å²	112.8	51%	0.505	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-96	143.9	175.3	-67	-75.6	0	0	0	111.4	T69 G70	T69-H72 PolarHBondContact O-CD2 2.93Å; T69-H72 PolarHBondContact O-NE2 3.08Å; T69-H72 PolarHBondContact OG1-NE2 3.45Å; G70-H72 PolarHBondContact O-N 3.1Å
73	L	80	Confident	70.2	Confident	41 Å²	41	116.5 Å²	116.5	22%	0.215	64%	0.635	C	S	.	*	P	Polyproline II helix	trans	-89.8	147.2	173.3	-73.7	170.1	0	0	0	110.9	V80 Y82 P84 M89	L73-V80 HydrophobicContact CD1-CG1 4.13Å; L73-V80 HydrophobicContact CD1-CG2 4.07Å; L73-V80 HydrophobicContact CD2-CG1 3.73Å; L73-V80 HydrophobicContact CD2-CG2 4.35Å; L73-Y82 HydrophobicContact CD2-CE1 3.96Å; L73-Y82 WeakPolarHBondContact CD2-OH 3.48Å; L73-P84 HydrophobicContact CD1-CB 3.62Å; L73-P84 HydrophobicContact CD1-CG 3.78Å; L73-M89 HydrophobicContact CD1-CB 4.42Å; L73-M89 HydrophobicContact CD1-CG 4.37Å
74	D	81.7	Confident	72.3	Confident	95 Å²	95	112.1 Å²	112.1	51%	0.508	61%	0.61	S	S	.	*	P	Polyproline II helix	trans	-71	124	171.9	-176.6	-24.2	0	0	0	109.6	S76 L77	D74-S76 VanDerWaalsContact CG-OG 3.27Å; D74-S76 PolarHBondContact O-N 3.36Å; D74-S76 VanDerWaalsContact O-N 3.15Å; D74-S76 WeakPolarHBondContact OD1-CB 3.42Å; D74-S76 PolarHBondContact OD1-N 3.01Å; D74-S76 PolarHBondContact OD1-OG 3.45Å; D74-S76 PolarHBondContact OD2-OG 2.95Å; D74-L77 HydrophobicContact CB-CB 4.15Å; D74-L77 WeakPolarHBondContact O-CB 3.49Å; D74-L77 PolarHBondContact O-N 3.01Å; D74-L77 VanDerWaalsContact O-N 3.09Å
75	P	83.4	Confident	74	Confident	84 Å²	84	106.6 Å²	106.6	55%	0.545	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.1	-22.2	-179.4	-22.8	32.7	0	0	0	114.7	E93	P75-E93 HydrophobicContact CB-CG 4.33Å; P75-E93 WeakPolarHBondContact CB-OE1 3.23Å; P75-E93 HydrophobicContact CG-CG 4.09Å
76	S	83.1	Confident	75.7	Confident	87 Å²	87	106.8 Å²	106.8	61%	0.608	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-17.2	179.3	70.6	0	0	0	0	113.5	D74	D74-S76 VanDerWaalsContact CG-OG 3.27Å; D74-S76 PolarHBondContact O-N 3.36Å; D74-S76 VanDerWaalsContact O-N 3.15Å; D74-S76 WeakPolarHBondContact OD1-CB 3.42Å; D74-S76 PolarHBondContact OD1-N 3.01Å; D74-S76 PolarHBondContact OD1-OG 3.45Å; D74-S76 PolarHBondContact OD2-OG 2.95Å
77	L	87.1	Confident	77.7	Confident	96 Å²	96	109.9 Å²	109.9	50%	0.503	59%	0.585	S	S	.	*			trans	-75.5	131.6	-178.2	-169.5	72.5	0	0	0	110.7	D74 E79	D74-L77 HydrophobicContact CB-CB 4.15Å; D74-L77 WeakPolarHBondContact O-CB 3.49Å; D74-L77 PolarHBondContact O-N 3.01Å; D74-L77 VanDerWaalsContact O-N 3.09Å; L77-E79 WeakPolarHBondContact CD2-O 3.05Å; L77-E79 WeakPolarHBondContact CG-O 3.3Å
78	K	85.6	Confident	79.4	Confident	154 Å²	154	106 Å²	106	67%	0.67	56%	0.562	S	S	*	*			trans	-101.9	-20.6	-177.1	-65	-59.8	-178.2	-171.5	0	114.9
79	E	87.6	Confident	81.1	Confident	168 Å²	168	101.8 Å²	101.8	79%	0.785	54%	0.543	S	S	*	.			trans	-123.3	127.2	-179.6	-65.7	-179.9	-179.7	0	0	109.2	L77	L77-E79 WeakPolarHBondContact CD2-O 3.05Å; L77-E79 WeakPolarHBondContact CG-O 3.3Å
80	V	88.6	Confident	82.6	Confident	52 Å²	52	103 Å²	103	32%	0.315	54%	0.542	S	S	.	.			trans	-110.6	136.5	179.7	-165.1	0	0	0	0	109.1	L73 Y82 M89	L73-V80 HydrophobicContact CD1-CG1 4.13Å; L73-V80 HydrophobicContact CD1-CG2 4.07Å; L73-V80 HydrophobicContact CD2-CG1 3.73Å; L73-V80 HydrophobicContact CD2-CG2 4.35Å; V80-Y82 HydrophobicContact CG1-CD1 4Å; V80-Y82 HydrophobicContact CG1-CE1 3.97Å; V80-Y82 HydrophobicContact CG1-CG 4.49Å; V80-Y82 VanDerWaalsContact CG1-O 3.25Å; V80-Y82 WeakPolarHBondContact CG1-O 3.26Å; V80-M89 HydrophobicContact CG2-CE 4.23Å
81	T	88.6	Confident	83.8	Confident	146 Å²	146	102.2 Å²	102.2	90%	0.896	53%	0.529	S	S	*	.	S	Bend	trans	-92.1	-9.9	-174.9	52.7	0	0	0	0	114.3
82	Y	87.1	Confident	84.8	Confident	89 Å²	89	101.2 Å²	101.2	35%	0.349	53%	0.531	S	S	.	.	S	Bend	trans	-131.1	165.3	175.2	69.7	-83.8	0	0	0	109.1	I71 L73 V80 P84	I71-Y82 WeakPolarHBondContact CG2-OH 3.31Å; L73-Y82 HydrophobicContact CD2-CE1 3.96Å; L73-Y82 WeakPolarHBondContact CD2-OH 3.48Å; V80-Y82 HydrophobicContact CG1-CD1 4Å; V80-Y82 HydrophobicContact CG1-CE1 3.97Å; V80-Y82 HydrophobicContact CG1-CG 4.49Å; V80-Y82 VanDerWaalsContact CG1-O 3.25Å; V80-Y82 WeakPolarHBondContact CG1-O 3.26Å; Y82-P84 HydrophobicContact CE2-CB 4.09Å; Y82-P84 WeakPolarHBondContact O-CD 3.43Å
83	N	89.4	Confident	85.6	Confident	161 Å²	161	103.5 Å²	103.5	86%	0.861	54%	0.542	S	S	*	.			trans	-85.7	106.2	177.8	-64.4	-13.3	0	0	0	109.3
84	P	87.1	Confident	85.9	Confident	33 Å²	33	111.2 Å²	111.2	21%	0.214	57%	0.574	C	S	.	*			trans	-73.7	159.8	178	33.1	-36.9	0	0	0	111.5	L73 Y82 T88 M89	L73-P84 HydrophobicContact CD1-CB 3.62Å; L73-P84 HydrophobicContact CD1-CG 3.78Å; Y82-P84 HydrophobicContact CE2-CB 4.09Å; Y82-P84 WeakPolarHBondContact O-CD 3.43Å; P84-T88 WeakPolarHBondContact CB-OG1 3.45Å; P84-M89 HydrophobicContact CB-CB 4.22Å; P84-M89 HydrophobicContact CG-CB 3.99Å; P84-M89 HydrophobicContact CG-CE 3.97Å; P84-M89 HydrophobicContact CG-CG 4.14Å; P84-M89 HydrophobicContact CG-SD 3.8Å
85	T	88.2	Confident	86.2	Confident	86 Å²	86	109.7 Å²	109.7	53%	0.528	58%	0.58	S	S	.	*			trans	-79.8	156.7	168.3	64.4	0	0	0	0	110.1	E87 T88 M89	T85-E87 VanDerWaalsContact C-N 3.27Å; T85-E87 PolarHBondContact O-N 3.18Å; T85-T88 PolarHBondContact N-OG1 3.4Å; T85-T88 PolarHBondContact O-N 3.45Å; T85-T88 PolarHBondContact O-OG1 2.73Å; T85-T88 VanDerWaalsContact OG1-CG2 3.25Å; T85-T88 WeakPolarHBondContact OG1-CG2 3.38Å; T85-T88 PolarHBondContact OG1-OG1 3.27Å; T85-T88 VanDerWaalsContact OG1-OG1 3.11Å; T85-M89 PolarHBondContact O-N 3.34Å; T85-M89 VanDerWaalsContact O-N 3.08Å
86	Y	85.7	Confident	86.4	Confident	177 Å²	177	111.9 Å²	111.9	69%	0.694	60%	0.595	S	S	*	*	H	α-helix	trans	-52	-45.8	179.9	176.7	-95.8	0	0	0	112.5	T88 M89 F90	Y86-T88 VanDerWaalsContact C-N 3.31Å; Y86-T88 PolarHBondContact O-N 3.3Å; Y86-M89 PolarHBondContact O-N 3Å; Y86-F90 AromaticContact CD2-CD2 3.42Å; Y86-F90 HydrophobicContact CD2-CD2 3.42Å; Y86-F90 VanDerWaalsContact CD2-CD2 3.42Å; Y86-F90 AromaticContact CD2-CE2 3.96Å; Y86-F90 HydrophobicContact CD2-CE2 3.96Å; Y86-F90 HydrophobicContact CD2-CG 4.31Å; Y86-F90 HydrophobicContact CE2-CB 4.21Å; Y86-F90 AromaticContact CE2-CD2 3.53Å; Y86-F90 HydrophobicContact CE2-CD2 3.53Å; Y86-F90 HydrophobicContact CE2-CE2 4.14Å; Y86-F90 HydrophobicContact CE2-CG 4.04Å; Y86-F90 HydrophobicContact CG-CD2 4.22Å; Y86-F90 PolarHBondContact O-N 2.89Å
87	E	85.1	Confident	86.5	Confident	161 Å²	161	114.1 Å²	114.1	75%	0.752	61%	0.605	S	S	*	*	H	α-helix	trans	-62.8	-36.2	179.3	-170	177.2	-176.2	0	0	112.4	T85 A91	T85-E87 VanDerWaalsContact C-N 3.27Å; T85-E87 PolarHBondContact O-N 3.18Å; E87-A91 WeakPolarHBondContact O-CB 3.37Å
88	T	83.9	Confident	86.4	Confident	29 Å²	29	113.6 Å²	113.6	18%	0.178	60%	0.603	C	S	.	*	H	α-helix	trans	-76.1	-27.5	178.5	59	0	0	0	0	113.8	I71 P84 T85 Y86	I71-T88 WeakPolarHBondContact O-CB 3.29Å; I71-T88 WeakPolarHBondContact O-CG2 3.34Å; P84-T88 WeakPolarHBondContact CB-OG1 3.45Å; T85-T88 PolarHBondContact N-OG1 3.4Å; T85-T88 PolarHBondContact O-N 3.45Å; T85-T88 PolarHBondContact O-OG1 2.73Å; T85-T88 VanDerWaalsContact OG1-CG2 3.25Å; T85-T88 WeakPolarHBondContact OG1-CG2 3.38Å; T85-T88 PolarHBondContact OG1-OG1 3.27Å; T85-T88 VanDerWaalsContact OG1-OG1 3.11Å; Y86-T88 VanDerWaalsContact C-N 3.31Å; Y86-T88 PolarHBondContact O-N 3.3Å
89	M	84.9	Confident	86.6	Confident	96 Å²	96	111.5 Å²	111.5	47%	0.473	60%	0.604	S	S	.	*	H	α-helix	trans	-93.2	-36.4	-175.4	-168.9	177.7	-139.8	0	0	113.6	L73 V80 P84 T85 Y86	L73-M89 HydrophobicContact CD1-CB 4.42Å; L73-M89 HydrophobicContact CD1-CG 4.37Å; V80-M89 HydrophobicContact CG2-CE 4.23Å; P84-M89 HydrophobicContact CB-CB 4.22Å; P84-M89 HydrophobicContact CG-CB 3.99Å; P84-M89 HydrophobicContact CG-CE 3.97Å; P84-M89 HydrophobicContact CG-CG 4.14Å; P84-M89 HydrophobicContact CG-SD 3.8Å; T85-M89 PolarHBondContact O-N 3.34Å; T85-M89 VanDerWaalsContact O-N 3.08Å; Y86-M89 PolarHBondContact O-N 3Å
90	F	85.9	Confident	86.7	Confident	112 Å²	112	113.4 Å²	113.4	49%	0.491	61%	0.606	S	S	.	*	S	Bend	trans	-109.1	16.8	-174.5	-65.4	-75.1	0	0	0	113.4	Y86 T146	Y86-F90 AromaticContact CD2-CD2 3.42Å; Y86-F90 HydrophobicContact CD2-CD2 3.42Å; Y86-F90 VanDerWaalsContact CD2-CD2 3.42Å; Y86-F90 AromaticContact CD2-CE2 3.96Å; Y86-F90 HydrophobicContact CD2-CE2 3.96Å; Y86-F90 HydrophobicContact CD2-CG 4.31Å; Y86-F90 HydrophobicContact CE2-CB 4.21Å; Y86-F90 AromaticContact CE2-CD2 3.53Å; Y86-F90 HydrophobicContact CE2-CD2 3.53Å; Y86-F90 HydrophobicContact CE2-CE2 4.14Å; Y86-F90 HydrophobicContact CE2-CG 4.04Å; Y86-F90 HydrophobicContact CG-CD2 4.22Å; Y86-F90 PolarHBondContact O-N 2.89Å; F90-T146 HydrophobicContact CE1-CG2 4.33Å
91	A	84.6	Confident	86.7	Confident	47 Å²	47	116.4 Å²	116.4	39%	0.388	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-60.2	134.5	171.4	0	0	0	0	0	110.7	E87	E87-A91 WeakPolarHBondContact O-CB 3.37Å
92	P	84.8	Confident	86.7	Confident	103 Å²	103	112.2 Å²	112.2	67%	0.669	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-68.6	145.3	178.8	28.2	-34.1	0	0	0	111.6	F94	P92-F94 PolarHBondContact O-N 3.36Å
93	E	85	Confident	86.8	Confident	157 Å²	157	115.8 Å²	115.8	73%	0.734	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-66.7	128.4	173.3	-65.2	-179.3	-178	0	0	110.6	P75	P75-E93 HydrophobicContact CB-CG 4.33Å; P75-E93 WeakPolarHBondContact CB-OE1 3.23Å; P75-E93 HydrophobicContact CG-CG 4.09Å
94	F	85.4	Confident	86.7	Confident	203 Å²	203	112.9 Å²	112.9	89%	0.89	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-81.2	138.2	178	-69.2	-80.9	0	0	0	112	P92	P92-F94 PolarHBondContact O-N 3.36Å
95	G	88.5	Confident	86.7	Confident	62 Å²	62	116.1 Å²	116.1	64%	0.639	61%	0.606	S	S	*	*	S	Bend	trans	119.4	175.4	172.8	0	0	0	0	0	114
96	P	88.1	Confident	86.7	Confident	131 Å²	131	115 Å²	115	85%	0.851	60%	0.602	S	S	*	*			trans	-73.9	141.7	177.4	29.9	-33.1	0	0	0	111.2
97	T	85.2	Confident	86.8	Confident	134 Å²	134	108.7 Å²	108.7	82%	0.822	59%	0.586	S	S	*	*			trans	-65	137.1	171.4	54.5	0	0	0	0	110	P99	T97-P99 VanDerWaalsContact O-CD 3.27Å; T97-P99 WeakPolarHBondContact O-CD 3.46Å
98	N	85.6	Confident	86.9	Confident	85 Å²	85	106 Å²	106	46%	0.455	58%	0.582	S	S	.	*			trans	-68.4	115	-177.4	-177.8	-12.2	0	0	0	110.5	Y100 K101	N98-Y100 PolarHBondContact O-N 3.37Å; N98-Y100 WeakPolarHBondContact OD1-CB 3.44Å; N98-Y100 VanDerWaalsContact OD1-CD2 3.32Å; N98-Y100 WeakPolarHBondContact OD1-CD2 3.28Å; N98-Y100 PolarHBondContact OD1-N 2.98Å; N98-K101 HydrophobicContact CB-CD 4.37Å; N98-K101 HydrophobicContact CB-CG 4.33Å; N98-K101 PolarHBondContact O-N 3.03Å
99	P	89.3	Confident	87	Confident	109 Å²	109	109.6 Å²	109.6	71%	0.708	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-11	-174.7	32.7	-36.8	0	0	0	113.3	T97 K101	T97-P99 VanDerWaalsContact O-CD 3.27Å; T97-P99 WeakPolarHBondContact O-CD 3.46Å; P99-K101 VanDerWaalsContact C-N 3.33Å
100	Y	90.5	Very high	87.2	Confident	209 Å²	209	110.5 Å²	110.5	82%	0.82	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-3.7	-179.7	-56.7	-64.5	0	0	0	113.5	N98	N98-Y100 PolarHBondContact O-N 3.37Å; N98-Y100 WeakPolarHBondContact OD1-CB 3.44Å; N98-Y100 VanDerWaalsContact OD1-CD2 3.32Å; N98-Y100 WeakPolarHBondContact OD1-CD2 3.28Å; N98-Y100 PolarHBondContact OD1-N 2.98Å
101	K	88.2	Confident	87.3	Confident	114 Å²	114	110.1 Å²	110.1	50%	0.496	60%	0.601	S	S	.	*	S	Bend	trans	-83	128	173.8	-68.3	-176	178.1	-178.1	0	109.5	N98 P99 M105	N98-K101 HydrophobicContact CB-CD 4.37Å; N98-K101 HydrophobicContact CB-CG 4.33Å; N98-K101 PolarHBondContact O-N 3.03Å; P99-K101 VanDerWaalsContact C-N 3.33Å; K101-M105 HydrophobicContact CB-CB 4.04Å; K101-M105 HydrophobicContact CG-CB 4.38Å
102	S	88.1	Confident	87.5	Confident	58 Å²	58	114.1 Å²	114.1	41%	0.406	62%	0.615	S	S	.	*			trans	-67	163.1	167	66.8	0	0	0	0	110.6	Q104 M105 S106	S102-Q104 PolarHBondContact O-N 3.26Å; S102-Q104 VanDerWaalsContact O-N 3.09Å; S102-M105 CarbonylContact O-C 3.4Å; S102-M105 WeakPolarHBondContact O-CA 3.44Å; S102-M105 PolarHBondContact O-N 2.88Å; S102-M105 WeakPolarHBondContact OG-CG 3.35Å; S102-S106 PolarHBondContact O-N 2.9Å; S102-S106 PolarHBondContact O-OG 3.3Å
103	Q	88.9	Confident	87.7	Confident	164 Å²	164	113.8 Å²	113.8	77%	0.766	62%	0.615	S	S	*	*	H	α-helix	trans	-52.9	-34.9	178.8	-171.5	64.7	13	0	0	113.2	S106 A107	Q103-S106 WeakPolarHBondContact CA-OG 3.33Å; Q103-S106 PolarHBondContact O-OG 2.89Å; Q103-A107 PolarHBondContact O-N 3.01Å
104	Q	87.6	Confident	88	Confident	100 Å²	100	107.4 Å²	107.4	47%	0.467	59%	0.592	S	S	.	*	H	α-helix	trans	-72.5	-29.5	176.4	-171.6	-176.7	17.7	0	0	112.9	S102 L112	S102-Q104 PolarHBondContact O-N 3.26Å; S102-Q104 VanDerWaalsContact O-N 3.09Å; Q104-L112 PolarHBondContact NE2-O 3.27Å
105	M	86.9	Confident	88.3	Confident	101 Å²	101	103.1 Å²	103.1	50%	0.498	57%	0.57	S	S	.	*	H	α-helix	trans	-87.4	-23.1	178.4	-69.3	-177	178.8	0	0	113	K101 S102	K101-M105 HydrophobicContact CB-CB 4.04Å; K101-M105 HydrophobicContact CG-CB 4.38Å; S102-M105 CarbonylContact O-C 3.4Å; S102-M105 WeakPolarHBondContact O-CA 3.44Å; S102-M105 PolarHBondContact O-N 2.88Å; S102-M105 WeakPolarHBondContact OG-CG 3.35Å
106	S	88	Confident	88.4	Confident	63 Å²	63	102.7 Å²	102.7	44%	0.441	56%	0.56	S	S	.	*	H	α-helix	trans	-77.6	-32.4	174.5	59.5	0	0	0	0	112	S102 Q103	S102-S106 PolarHBondContact O-N 2.9Å; S102-S106 PolarHBondContact O-OG 3.3Å; Q103-S106 WeakPolarHBondContact CA-OG 3.33Å; Q103-S106 PolarHBondContact O-OG 2.89Å
107	A	88.2	Confident	88.5	Confident	45 Å²	45	102.6 Å²	102.6	37%	0.372	55%	0.549	S	S	.	.	S	Bend	trans	-67.7	140.9	176.7	0	0	0	0	0	112.1	Q103 R109	Q103-A107 PolarHBondContact O-N 3.01Å; A107-R109 PolarHBondContact O-N 3.34Å
108	P	86.9	Confident	88.9	Confident	103 Å²	103	102 Å²	102	67%	0.669	55%	0.547	S	S	*	.			trans	-62.8	126.3	171.6	27.4	-33.1	0	0	0	109.2
109	R	86.8	Confident	89.1	Confident	106 Å²	106	101.6 Å²	101.6	40%	0.4	56%	0.556	S	S	.	*			trans	-138.6	139.8	-175.2	65.6	-178.1	-180	172	-0.1	111.8	A107	A107-R109 PolarHBondContact O-N 3.34Å
110	N	88.5	Confident	89.2	Confident	115 Å²	115	105.3 Å²	105.3	62%	0.615	56%	0.563	S	S	*	*	S	Bend	trans	-102.6	-36	172.1	-170.3	9.4	0	0	0	110.3	G114 Y115 A116	N110-G114 PolarHBondContact N-O 3.09Å; N110-Y115 HydrophobicContact CB-CD2 3.77Å; N110-Y115 HydrophobicContact CB-CE2 3.95Å; N110-Y115 HydrophobicContact CB-CG 4.45Å; N110-A116 PolarHBondContact ND2-O 2.82Å
111	M	89.3	Confident	89.3	Confident	103 Å²	103	99.4 Å²	99.4	51%	0.507	55%	0.549	S	S	.	.	B	Isolated β-bridge	trans	-119.6	166.3	173.3	60.3	-176.9	-68.7	0	0	110.7	S113 G114 A116	M111-S113 PolarHBondContact O-N 2.9Å; M111-S113 VanDerWaalsContact O-N 3.07Å; M111-G114 VanDerWaalsContact CG-O 3.31Å; M111-G114 WeakPolarHBondContact CG-O 3.48Å; M111-G114 PolarHBondContact N-O 3.28Å; M111-G114 PolarHBondContact O-N 3.14Å; M111-A116 HydrophobicContact CG-CB 4.43Å; M111-A116 HydrophobicContact SD-CB 3.75Å
112	L	87.2	Confident	89.6	Confident	131 Å²	131	98.9 Å²	98.9	69%	0.686	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.7	-37.6	-171.1	-178.3	60.7	0	0	0	113.7	Q104	Q104-L112 PolarHBondContact NE2-O 3.27Å
113	S	89.1	Confident	89.9	Confident	96 Å²	96	102.7 Å²	102.7	67%	0.671	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-10.4	-177.6	56.7	0	0	0	0	115.2	M111	M111-S113 PolarHBondContact O-N 2.9Å; M111-S113 VanDerWaalsContact O-N 3.07Å
114	G	91.8	Very high	90.2	Very high	24 Å²	24	99.9 Å²	99.9	25%	0.247	55%	0.553	C	S	.	*	B	Isolated β-bridge	trans	159.3	-163.4	-176.9	0	0	0	0	0	114.9	N110 M111	N110-G114 PolarHBondContact N-O 3.09Å; M111-G114 VanDerWaalsContact CG-O 3.31Å; M111-G114 WeakPolarHBondContact CG-O 3.48Å; M111-G114 PolarHBondContact N-O 3.28Å; M111-G114 PolarHBondContact O-N 3.14Å
115	Y	91.8	Very high	90.4	Very high	113 Å²	113	99.9 Å²	99.9	44%	0.443	55%	0.554	S	S	.	*			trans	-97.9	123.7	176.1	-159.2	-99.2	0	0	0	110	N110 E117	N110-Y115 HydrophobicContact CB-CD2 3.77Å; N110-Y115 HydrophobicContact CB-CE2 3.95Å; N110-Y115 HydrophobicContact CB-CG 4.45Å; Y115-E117 HydrophobicContact CD1-CB 4.3Å; Y115-E117 HydrophobicContact CD1-CG 4.37Å; Y115-E117 HydrophobicContact CE1-CB 3.88Å; Y115-E117 HydrophobicContact CE1-CG 4.21Å; Y115-E117 WeakPolarHBondContact CE1-OE2 3.45Å
116	A	91.4	Very high	90.8	Very high	52 Å²	52	101 Å²	101	43%	0.43	56%	0.556	S	S	.	*			trans	-121.5	118.8	175.9	0	0	0	0	0	108	N110 M111	N110-A116 PolarHBondContact ND2-O 2.82Å; M111-A116 HydrophobicContact CG-CB 4.43Å; M111-A116 HydrophobicContact SD-CB 3.75Å
117	E	90.4	Very high	91	Very high	129 Å²	129	100.1 Å²	100.1	60%	0.603	55%	0.545	S	S	*	.			trans	-126.3	146.3	177	62.5	-177	178.8	0	0	110.5	Y115 A119	Y115-E117 HydrophobicContact CD1-CB 4.3Å; Y115-E117 HydrophobicContact CD1-CG 4.37Å; Y115-E117 HydrophobicContact CE1-CB 3.88Å; Y115-E117 HydrophobicContact CE1-CG 4.21Å; Y115-E117 WeakPolarHBondContact CE1-OE2 3.45Å; E117-A119 PolarHBondContact O-N 3.27Å; E117-A119 VanDerWaalsContact O-N 3.17Å
118	P	92.1	Very high	91.3	Very high	121 Å²	121	99 Å²	99	79%	0.786	53%	0.532	S	S	*	.			trans	-65	112.9	172.2	-19.1	32.5	0	0	0	110.5
119	A	90.4	Very high	91.6	Very high	77 Å²	77	96.1 Å²	96.1	64%	0.636	51%	0.51	S	S	*	.			trans	-98.3	140.7	173.5	0	0	0	0	0	110.9	E117 V121	E117-A119 PolarHBondContact O-N 3.27Å; E117-A119 VanDerWaalsContact O-N 3.17Å; A119-V121 HydrophobicContact CB-CG2 4.34Å
120	H	92.2	Very high	91.9	Very high	187 Å²	187	97.6 Å²	97.6	87%	0.866	52%	0.515	S	S	*	.			trans	-109.1	80	176.6	-68.5	-77.3	0	0	0	110.1
121	V	91.3	Very high	92.2	Very high	85 Å²	85	97.3 Å²	97.3	52%	0.515	51%	0.505	S	S	.	.			trans	-95.6	147	177.1	-174.6	0	0	0	0	109.5	A119 D123 F126	A119-V121 HydrophobicContact CB-CG2 4.34Å; V121-D123 PolarHBondContact O-N 3.24Å; V121-F126 HydrophobicContact CG1-CB 4.04Å
122	N	95.7	Very high	92.3	Very high	103 Å²	103	92.4 Å²	92.4	55%	0.551	48%	0.481	S	S	*	.			trans	-63.5	124.4	171.4	-178.9	-3.8	0	0	0	110.3	F124 M125 F126	N122-F124 PolarHBondContact O-N 3.38Å; N122-F124 VanDerWaalsContact O-N 3.13Å; N122-F124 PolarHBondContact OD1-N 3.25Å; N122-M125 HydrophobicContact CB-CB 4.34Å; N122-M125 HydrophobicContact CB-CG 4.15Å; N122-M125 PolarHBondContact O-N 3.11Å; N122-F126 PolarHBondContact O-N 3.26Å
123	D	93.8	Very high	92.7	Very high	138 Å²	138	91 Å²	91	74%	0.738	47%	0.47	S	S	*	.	H	α-helix	trans	-49	-41.9	-179.2	-66.4	-17.3	0	0	0	112.8	V121 E127	V121-D123 PolarHBondContact O-N 3.24Å; D123-E127 WeakPolarHBondContact O-CB 3.37Å; D123-E127 PolarHBondContact O-N 2.95Å
124	F	95.3	Very high	92.8	Very high	106 Å²	106	90.8 Å²	90.8	47%	0.465	47%	0.468	S	S	.	.	H	α-helix	trans	-64.8	-45.7	-179.7	179.5	-99.2	0	0	0	111.9	N122 E127 Q128 F170	N122-F124 PolarHBondContact O-N 3.38Å; N122-F124 VanDerWaalsContact O-N 3.13Å; N122-F124 PolarHBondContact OD1-N 3.25Å; F124-E127 PolarHBondContact O-N 3.2Å; F124-Q128 VanDerWaalsContact CE1-OE1 3.28Å; F124-Q128 WeakPolarHBondContact O-CB 3.3Å; F124-Q128 PolarHBondContact O-N 2.85Å; F124-F170 HydrophobicContact CE2-CD1 4.47Å; F124-F170 HydrophobicContact CE2-CD2 4.07Å; F124-F170 HydrophobicContact CE2-CE2 4.26Å; F124-F170 HydrophobicContact CE2-CG 4.17Å; F124-F170 HydrophobicContact CZ-CB 4.31Å; F124-F170 HydrophobicContact CZ-CD2 4.12Å; F124-F170 HydrophobicContact CZ-CG 4.21Å
125	M	92.2	Very high	92.7	Very high	100 Å²	100	93.8 Å²	93.8	49%	0.493	48%	0.482	S	S	.	.	H	α-helix	trans	-68.1	-40.7	-178.7	-65.5	-59.8	-127	0	0	111.3	N122 Q128 Q129	N122-M125 HydrophobicContact CB-CB 4.34Å; N122-M125 HydrophobicContact CB-CG 4.15Å; N122-M125 PolarHBondContact O-N 3.11Å; M125-Q128 PolarHBondContact O-N 2.65Å; M125-Q128 PolarHBondContact SD-OE1 3.21Å; M125-Q129 WeakPolarHBondContact O-CG 3.32Å; M125-Q129 PolarHBondContact O-N 2.89Å
126	F	93.9	Very high	92.6	Very high	123 Å²	123	91.5 Å²	91.5	54%	0.539	47%	0.473	S	S	.	.	H	α-helix	trans	-61.8	-49.8	176.2	178.3	-100.4	0	0	0	111.5	V121 N122 Q128 Q129 R130	V121-F126 HydrophobicContact CG1-CB 4.04Å; N122-F126 PolarHBondContact O-N 3.26Å; F126-Q128 VanDerWaalsContact C-N 3.33Å; F126-Q128 PolarHBondContact O-N 2.81Å; F126-Q129 PolarHBondContact O-N 2.92Å; F126-R130 VanDerWaalsContact O-CB 3.29Å; F126-R130 WeakPolarHBondContact O-CB 3.37Å; F126-R130 PolarHBondContact O-N 3.5Å
127	E	94.1	Very high	92.5	Very high	46 Å²	46	90.3 Å²	90.3	22%	0.215	47%	0.466	C	S	.	.	H	α-helix	trans	-69.8	-31.9	-179.6	-172.3	65.5	-176.2	0	0	111.8	D123 F124 R130 R131	D123-E127 WeakPolarHBondContact O-CB 3.37Å; D123-E127 PolarHBondContact O-N 2.95Å; F124-E127 PolarHBondContact O-N 3.2Å; E127-R130 IonicContact OE1-NH1 3.52Å; E127-R130 PolarHBondContact OE1-NH1 3.42Å; E127-R130 IonicContact OE2-NH1 2.75Å; E127-R130 PolarHBondContact OE2-NH1 3.45Å; E127-R131 HydrophobicContact CG-CG 4.32Å; E127-R131 WeakPolarHBondContact O-CB 3.37Å; E127-R131 VanDerWaalsContact O-CG 3.29Å; E127-R131 WeakPolarHBondContact O-CG 3.29Å; E127-R131 PolarHBondContact O-N 3.41Å; E127-R131 IonicContact OE1-CZ 3.45Å; E127-R131 VanDerWaalsContact OE1-CZ 3.27Å; E127-R131 IonicContact OE1-NE 2.92Å; E127-R131 PolarHBondContact OE1-NE 3.32Å; E127-R131 IonicContact OE1-NH2 2.73Å; E127-R131 PolarHBondContact OE1-NH2 3.47Å
128	Q	94.4	Very high	92.7	Very high	22 Å²	22	84.3 Å²	84.3	10%	0.103	44%	0.438	C	S	.	.	H	α-helix	trans	-58.5	-52.8	171.3	177.4	177.8	4.9	0	0	111.1	F124 M125 F126 T132 T168 F170	F124-Q128 VanDerWaalsContact CE1-OE1 3.28Å; F124-Q128 WeakPolarHBondContact O-CB 3.3Å; F124-Q128 PolarHBondContact O-N 2.85Å; M125-Q128 PolarHBondContact O-N 2.65Å; M125-Q128 PolarHBondContact SD-OE1 3.21Å; F126-Q128 VanDerWaalsContact C-N 3.33Å; F126-Q128 PolarHBondContact O-N 2.81Å; Q128-T132 WeakPolarHBondContact O-CB 3.26Å; Q128-T132 PolarHBondContact O-N 2.88Å; Q128-T132 PolarHBondContact O-OG1 2.91Å; Q128-T168 HydrophobicContact CG-CG2 3.89Å; Q128-T168 VanDerWaalsContact NE2-CG2 3.33Å; Q128-T168 PolarHBondContact NE2-OG1 3.05Å; Q128-F170 HydrophobicContact CB-CD2 3.86Å; Q128-F170 HydrophobicContact CB-CE2 4.06Å; Q128-F170 HydrophobicContact CG-CD2 4.02Å
129	Q	92.1	Very high	92.7	Very high	41 Å²	41	78.9 Å²	78.9	19%	0.192	40%	0.403	C	S	.	.	H	α-helix	trans	-67.4	-42.6	179.9	-64.7	-54	-36	0	0	111.9	M125 F126 R131 T132 F133 A139	M125-Q129 WeakPolarHBondContact O-CG 3.32Å; M125-Q129 PolarHBondContact O-N 2.89Å; F126-Q129 PolarHBondContact O-N 2.92Å; Q129-R131 PolarHBondContact O-N 2.88Å; Q129-T132 PolarHBondContact O-N 3.23Å; Q129-F133 PolarHBondContact O-N 3.37Å; Q129-A139 HydrophobicContact CB-CB 4.21Å
130	R	93.8	Very high	92.7	Very high	138 Å²	138	78 Å²	78	52%	0.521	39%	0.387	S	S	.	.	H	α-helix	trans	-59.3	-44.4	177.8	179.9	176.8	171.5	-107.4	-3.3	112.9	F126 E127 S134	F126-R130 VanDerWaalsContact O-CB 3.29Å; F126-R130 WeakPolarHBondContact O-CB 3.37Å; F126-R130 PolarHBondContact O-N 3.5Å; E127-R130 IonicContact OE1-NH1 3.52Å; E127-R130 PolarHBondContact OE1-NH1 3.42Å; E127-R130 IonicContact OE2-NH1 2.75Å; E127-R130 PolarHBondContact OE2-NH1 3.45Å; R130-S134 WeakPolarHBondContact O-CB 3.36Å; R130-S134 PolarHBondContact O-N 2.72Å; R130-S134 PolarHBondContact O-OG 3.36Å
131	R	93.6	Very high	92.5	Very high	108 Å²	108	72 Å²	72	41%	0.408	36%	0.361	S	S	.	.	H	α-helix	trans	-70.2	-36.7	176.7	-72.4	-175.8	-175.5	-178	7.2	112.1	E127 Q129 F133 S134 T135 V169	E127-R131 HydrophobicContact CG-CG 4.32Å; E127-R131 WeakPolarHBondContact O-CB 3.37Å; E127-R131 VanDerWaalsContact O-CG 3.29Å; E127-R131 WeakPolarHBondContact O-CG 3.29Å; E127-R131 PolarHBondContact O-N 3.41Å; E127-R131 IonicContact OE1-CZ 3.45Å; E127-R131 VanDerWaalsContact OE1-CZ 3.27Å; E127-R131 IonicContact OE1-NE 2.92Å; E127-R131 PolarHBondContact OE1-NE 3.32Å; E127-R131 IonicContact OE1-NH2 2.73Å; E127-R131 PolarHBondContact OE1-NH2 3.47Å; Q129-R131 PolarHBondContact O-N 2.88Å; R131-F133 VanDerWaalsContact C-N 3.35Å; R131-S134 PolarHBondContact O-N 3.33Å; R131-T135 VanDerWaalsContact O-CB 3.22Å; R131-T135 WeakPolarHBondContact O-CB 3.39Å; R131-T135 PolarHBondContact O-N 3.3Å; R131-T135 PolarHBondContact O-OG1 2.86Å; R131-V169 HydrophobicContact CB-CB 4.24Å; R131-V169 HydrophobicContact CB-CG2 4.01Å; R131-V169 WeakPolarHBondContact O-CG2 3.42Å
132	T	92.4	Very high	92.3	Very high	0 Å²	0	73.2 Å²	73.2	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-61	-46.1	175.4	-55.9	0	0	0	0	110.2	Q128 Q129 S134 T135 Y136 Y138 T168 V169	Q128-T132 WeakPolarHBondContact O-CB 3.26Å; Q128-T132 PolarHBondContact O-N 2.88Å; Q128-T132 PolarHBondContact O-OG1 2.91Å; Q129-T132 PolarHBondContact O-N 3.23Å; T132-S134 PolarHBondContact O-N 3.48Å; T132-T135 PolarHBondContact O-N 2.9Å; T132-Y136 HydrophobicContact CG2-CD2 3.98Å; T132-Y136 PolarHBondContact O-N 2.82Å; T132-Y138 CarbonylContact C-O 3.54Å; T132-Y138 VanDerWaalsContact C-O 3.24Å; T132-Y138 HydrophobicContact CG2-CD2 4.17Å; T132-Y138 HydrophobicContact CG2-CE2 3.79Å; T132-Y138 WeakPolarHBondContact CG2-O 3.3Å; T132-T168 HydrophobicContact CG2-CG2 4.39Å; T132-T168 WeakPolarHBondContact OG1-CA 3.45Å; T132-T168 WeakPolarHBondContact OG1-CB 3.38Å; T132-V169 PolarHBondContact OG1-N 2.91Å
133	F	94.1	Very high	91.9	Very high	101 Å²	101	70.7 Å²	70.7	44%	0.443	36%	0.362	S	S	.	.	H	α-helix	trans	-62.9	-43.4	174.5	-167.6	-93.5	0	0	0	112.6	Q129 R131 T135 G137 Y138 A139	Q129-F133 PolarHBondContact O-N 3.37Å; R131-F133 VanDerWaalsContact C-N 3.35Å; F133-T135 VanDerWaalsContact C-N 3.29Å; F133-T135 PolarHBondContact O-N 3.22Å; F133-G137 WeakPolarHBondContact O-CA 3.3Å; F133-G137 PolarHBondContact O-N 2.89Å; F133-Y138 VanDerWaalsContact CA-O 3.25Å; F133-Y138 WeakPolarHBondContact CA-O 3.5Å; F133-Y138 PolarHBondContact N-O 2.64Å; F133-Y138 VanDerWaalsContact N-O 3.1Å; F133-A139 HydrophobicContact CB-CB 4.02Å; F133-A139 HydrophobicContact CD2-CB 4.2Å
134	S	92.8	Very high	91.2	Very high	92 Å²	92	70.6 Å²	70.6	64%	0.643	37%	0.366	S	S	*	.	H	α-helix	trans	-68.9	-26.4	-179.8	-56	0	0	0	0	113.5	R130 R131 T132	R130-S134 WeakPolarHBondContact O-CB 3.36Å; R130-S134 PolarHBondContact O-N 2.72Å; R130-S134 PolarHBondContact O-OG 3.36Å; R131-S134 PolarHBondContact O-N 3.33Å; T132-S134 PolarHBondContact O-N 3.48Å
135	T	89.9	Confident	90.2	Very high	87 Å²	87	70 Å²	70	53%	0.534	37%	0.367	S	S	.	.	H	α-helix	trans	-96.9	-42.5	-174.5	-53.2	0	0	0	0	112.5	R131 T132 F133 V169	R131-T135 VanDerWaalsContact O-CB 3.22Å; R131-T135 WeakPolarHBondContact O-CB 3.39Å; R131-T135 PolarHBondContact O-N 3.3Å; R131-T135 PolarHBondContact O-OG1 2.86Å; T132-T135 PolarHBondContact O-N 2.9Å; F133-T135 VanDerWaalsContact C-N 3.29Å; F133-T135 PolarHBondContact O-N 3.22Å; T135-V169 HydrophobicContact CG2-CG2 4.22Å; T135-V169 WeakPolarHBondContact OG1-CG2 3.5Å
136	Y	88.3	Confident	88.6	Confident	66 Å²	66	70.2 Å²	70.2	26%	0.259	38%	0.375	S	S	.	.	H	α-helix	trans	-117	-3.9	-174.2	-55	-63	0	0	0	113.2	T132 Y138 E160 L167 V169	T132-Y136 HydrophobicContact CG2-CD2 3.98Å; T132-Y136 PolarHBondContact O-N 2.82Å; Y136-Y138 VanDerWaalsContact C-N 3.29Å; Y136-Y138 VanDerWaalsContact CB-CE1 3.46Å; Y136-Y138 HydrophobicContact CG-CE1 4.25Å; Y136-Y138 WeakPolarHBondContact O-CD1 3.28Å; Y136-Y138 PolarHBondContact O-N 3.1Å; Y136-E160 VanDerWaalsContact O-OE2 3.06Å; Y136-L167 HydrophobicContact CE2-CD2 4.24Å; Y136-V169 HydrophobicContact CD2-CG2 4.3Å; Y136-V169 HydrophobicContact CE2-CG2 3.89Å
137	G	90.8	Very high	87.1	Confident	27 Å²	27	71.8 Å²	71.8	28%	0.278	38%	0.383	S	S	.	.	S	Bend	trans	78.1	4.7	176.2	0	0	0	0	0	115.7	F133 G156 A157	F133-G137 WeakPolarHBondContact O-CA 3.3Å; F133-G137 PolarHBondContact O-N 2.89Å; G137-G156 WeakPolarHBondContact O-CA 3.43Å; G137-A157 PolarHBondContact O-N 2.92Å
138	Y	92.8	Very high	85.4	Confident	2 Å²	2	78.4 Å²	78.4	1%	0.008	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	156.6	175.9	67.8	-96.6	0	0	0	112.9	T132 F133 Y136 Y154 I155 E160 A161 N164 L167	T132-Y138 CarbonylContact C-O 3.54Å; T132-Y138 VanDerWaalsContact C-O 3.24Å; T132-Y138 HydrophobicContact CG2-CD2 4.17Å; T132-Y138 HydrophobicContact CG2-CE2 3.79Å; T132-Y138 WeakPolarHBondContact CG2-O 3.3Å; F133-Y138 VanDerWaalsContact CA-O 3.25Å; F133-Y138 WeakPolarHBondContact CA-O 3.5Å; F133-Y138 PolarHBondContact N-O 2.64Å; F133-Y138 VanDerWaalsContact N-O 3.1Å; Y136-Y138 VanDerWaalsContact C-N 3.29Å; Y136-Y138 VanDerWaalsContact CB-CE1 3.46Å; Y136-Y138 HydrophobicContact CG-CE1 4.25Å; Y136-Y138 WeakPolarHBondContact O-CD1 3.28Å; Y136-Y138 PolarHBondContact O-N 3.1Å; Y138-Y154 HydrophobicContact CD2-CD1 4.22Å; Y138-I155 VanDerWaalsContact CA-O 3.26Å; Y138-I155 WeakPolarHBondContact CA-O 3.04Å; Y138-E160 HydrophobicContact CD1-CB 4.16Å; Y138-E160 HydrophobicContact CE1-CB 4.42Å; Y138-A161 HydrophobicContact CD1-CB 3.84Å; Y138-A161 HydrophobicContact CD2-CB 3.52Å; Y138-A161 HydrophobicContact CE1-CB 4.24Å; Y138-A161 HydrophobicContact CE2-CB 4Å; Y138-A161 HydrophobicContact CG-CB 3.45Å; Y138-A161 VanDerWaalsContact CG-CB 3.45Å; Y138-N164 HydrophobicContact CE1-CB 4.38Å; Y138-N164 WeakPolarHBondContact OH-CB 3.45Å; Y138-L167 PolarHBondContact OH-N 3.46Å; Y138-L167 PolarHBondContact OH-O 3.43Å
139	A	92.3	Very high	83.5	Confident	7 Å²	7	82.2 Å²	82.2	6%	0.058	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	167.3	172.6	0	0	0	0	0	110.2	Q129 F133 Y154 I155	Q129-A139 HydrophobicContact CB-CB 4.21Å; F133-A139 HydrophobicContact CB-CB 4.02Å; F133-A139 HydrophobicContact CD2-CB 4.2Å; A139-Y154 CarbonylContact O-C 3.58Å; A139-Y154 WeakPolarHBondContact O-CA 3.25Å; A139-I155 PolarHBondContact N-O 3.31Å; A139-I155 VanDerWaalsContact N-O 3.13Å; A139-I155 WeakPolarHBondContact O-CG1 3.48Å; A139-I155 PolarHBondContact O-N 3.04Å
140	L	90.4	Very high	81.7	Confident	59 Å²	59	82.4 Å²	82.4	31%	0.309	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	143.1	166.5	-74.6	110.3	0	0	0	110.4	P142 Y154	L140-P142 WeakPolarHBondContact O-CD 3.22Å; L140-Y154 HydrophobicContact CD1-CE1 3.92Å; L140-Y154 HydrophobicContact CG-CD1 4.09Å; L140-Y154 HydrophobicContact CG-CE1 3.81Å
141	D	88.5	Confident	80	Confident	60 Å²	60	80.8 Å²	80.8	32%	0.321	47%	0.465	S	S	.	.			trans	-65.9	123.5	175.7	-166.9	-0.4	0	0	0	111	S143 S153 I155	D141-S143 PolarHBondContact O-N 2.74Å; D141-S143 WeakPolarHBondContact OD1-CB 3.49Å; D141-S143 PolarHBondContact OD1-N 2.63Å; D141-S143 PolarHBondContact OD1-OG 3.43Å; D141-S143 WeakPolarHBondContact OD2-CB 3.1Å; D141-S143 PolarHBondContact OD2-OG 3.08Å; D141-S153 PolarHBondContact N-O 2.83Å; D141-I155 HydrophobicContact CB-CD1 4.49Å; D141-I155 HydrophobicContact CB-CG1 4.5Å; D141-I155 HydrophobicContact CB-CG2 3.83Å
142	P	88.1	Confident	78.6	Confident	111 Å²	111	80.7 Å²	80.7	72%	0.721	48%	0.48	S	S	*	.			trans	-81.9	6	173.8	34.4	-37.1	0	0	0	113.9	L140	L140-P142 WeakPolarHBondContact O-CD 3.22Å
143	S	86.5	Confident	78.1	Confident	50 Å²	50	83.1 Å²	83.1	35%	0.35	50%	0.497	S	S	.	.			trans	-61.3	141.4	179	65.4	0	0	0	0	112.6	D141	D141-S143 PolarHBondContact O-N 2.74Å; D141-S143 WeakPolarHBondContact OD1-CB 3.49Å; D141-S143 PolarHBondContact OD1-N 2.63Å; D141-S143 PolarHBondContact OD1-OG 3.43Å; D141-S143 WeakPolarHBondContact OD2-CB 3.1Å; D141-S143 PolarHBondContact OD2-OG 3.08Å
144	V	80	Confident	77.9	Confident	136 Å²	136	82.1 Å²	82.1	82%	0.824	49%	0.491	S	S	*	.			trans	-111.7	76.6	175.6	-172.6	0	0	0	0	107.4
145	D	74.1	Confident	77.7	Confident	93 Å²	93	80.7 Å²	80.7	50%	0.497	48%	0.475	S	S	.	.			trans	-78	141.5	177	-71	-13.2	0	0	0	110.7	H147 S150	D145-H147 PolarHBondContact O-N 2.87Å; D145-S150 PolarHBondContact OD2-OG 2.93Å
146	T	58.6	Low	77.6	Confident	105 Å²	105	79 Å²	79	64%	0.644	48%	0.475	S	S	*	.	S	Bend	trans	-73.3	-11	176.6	-29.2	0	0	0	0	112.6	F90	F90-T146 HydrophobicContact CE1-CG2 4.33Å
147	H	61.3	Low	77.7	Confident	156 Å²	156	77.6 Å²	77.6	72%	0.722	48%	0.477	S	S	*	.	S	Bend	trans	-98	116	175.9	-68.7	-71.2	0	0	0	109.9	D145 A149	D145-H147 PolarHBondContact O-N 2.87Å; H147-A149 PolarHBondContact O-N 3.11Å
148	E	57.9	Low	77.7	Confident	186 Å²	186	79.3 Å²	79.3	87%	0.869	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-60.1	-7.9	-169.5	-62.3	179.4	153.8	0	0	115.7	S151	E148-S151 PolarHBondContact O-OG 3.46Å
149	A	54.7	Low	77.5	Confident	102 Å²	102	87.4 Å²	87.4	84%	0.843	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-80	-14.1	-173.8	0	0	0	0	0	115.2	H147	H147-A149 PolarHBondContact O-N 3.11Å
150	S	54.5	Low	77.2	Confident	45 Å²	45	91.7 Å²	91.7	32%	0.315	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-92.5	0.8	-174.2	-53.3	0	0	0	0	114.9	D145 C152	D145-S150 PolarHBondContact OD2-OG 2.93Å; S150-C152 VanDerWaalsContact C-N 3.29Å; S150-C152 PolarHBondContact O-N 3.13Å
151	S	57.5	Low	77	Confident	103 Å²	103	88.9 Å²	88.9	72%	0.72	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-3.5	-154.6	53.5	0	0	0	0	118.1	E148	E148-S151 PolarHBondContact O-OG 3.46Å
152	C	65.4	Low	77	Confident	106 Å²	106	93 Å²	93	72%	0.716	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.9	46.2	179.1	-87.4	0	0	0	0	113	S150	S150-C152 VanDerWaalsContact C-N 3.29Å; S150-C152 PolarHBondContact O-N 3.13Å
153	S	82.3	Confident	77	Confident	51 Å²	51	96.1 Å²	96.1	36%	0.357	54%	0.543	S	S	.	.			trans	-90	141.2	175.1	72.2	0	0	0	0	112.3	D141	D141-S153 PolarHBondContact N-O 2.83Å
154	Y	88.7	Confident	77	Confident	80 Å²	80	96.9 Å²	96.9	31%	0.314	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	139.2	167.4	-69.2	-64.6	0	0	0	109.8	Y138 A139 L140 V158 A161 G166	Y138-Y154 HydrophobicContact CD2-CD1 4.22Å; A139-Y154 CarbonylContact O-C 3.58Å; A139-Y154 WeakPolarHBondContact O-CA 3.25Å; L140-Y154 HydrophobicContact CD1-CE1 3.92Å; L140-Y154 HydrophobicContact CG-CD1 4.09Å; L140-Y154 HydrophobicContact CG-CE1 3.81Å; Y154-V158 WeakPolarHBondContact O-CG2 3.45Å; Y154-A161 HydrophobicContact CD1-CB 4.24Å; Y154-A161 HydrophobicContact CD2-CB 3.88Å; Y154-A161 HydrophobicContact CE2-CB 4.45Å; Y154-A161 HydrophobicContact CG-CB 3.78Å; Y154-G166 WeakPolarHBondContact OH-CA 3.36Å
155	I	88.5	Confident	77.3	Confident	63 Å²	63	99.4 Å²	99.4	32%	0.323	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	151.7	175.5	55.7	165.2	0	0	0	110.9	Y138 A139 D141	Y138-I155 VanDerWaalsContact CA-O 3.26Å; Y138-I155 WeakPolarHBondContact CA-O 3.04Å; A139-I155 PolarHBondContact N-O 3.31Å; A139-I155 VanDerWaalsContact N-O 3.13Å; A139-I155 WeakPolarHBondContact O-CG1 3.48Å; A139-I155 PolarHBondContact O-N 3.04Å; D141-I155 HydrophobicContact CB-CD1 4.49Å; D141-I155 HydrophobicContact CB-CG1 4.5Å; D141-I155 HydrophobicContact CB-CG2 3.83Å
156	G	89.6	Confident	77.8	Confident	51 Å²	51	95.5 Å²	95.5	53%	0.526	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	96.2	-129.2	-175	0	0	0	0	0	112.3	G137 V158	G137-G156 WeakPolarHBondContact O-CA 3.43Å; G156-V158 PolarHBondContact O-N 3.43Å; G156-V158 VanDerWaalsContact O-N 3.11Å
157	A	90.3	Very high	79.2	Confident	37 Å²	37	92.3 Å²	92.3	31%	0.306	50%	0.504	S	S	.	.			trans	-82	78.1	177	0	0	0	0	0	111.6	G137 E159 E160 A161	G137-A157 PolarHBondContact O-N 2.92Å; A157-E159 VanDerWaalsContact C-N 3.27Å; A157-E159 PolarHBondContact O-N 3.09Å; A157-E160 HydrophobicContact CB-CB 4.18Å; A157-E160 HydrophobicContact CB-CG 4.17Å; A157-E160 PolarHBondContact O-N 3.34Å; A157-A161 PolarHBondContact O-N 2.97Å; A157-A161 VanDerWaalsContact O-N 3.14Å
158	V	89.3	Confident	80.6	Confident	63 Å²	63	85.1 Å²	85.1	38%	0.382	47%	0.471	S	S	.	.	H	α-helix	trans	-59.4	-35.9	-176	-175.7	0	0	0	0	112.7	Y154 G156 E160 A161 E162	Y154-V158 WeakPolarHBondContact O-CG2 3.45Å; G156-V158 PolarHBondContact O-N 3.43Å; G156-V158 VanDerWaalsContact O-N 3.11Å; V158-E160 VanDerWaalsContact C-N 3.29Å; V158-E160 PolarHBondContact O-N 3.45Å; V158-A161 VanDerWaalsContact O-CB 3.3Å; V158-A161 WeakPolarHBondContact O-CB 3.32Å; V158-A161 PolarHBondContact O-N 2.84Å; V158-A161 VanDerWaalsContact O-N 3.09Å; V158-E162 PolarHBondContact O-N 2.72Å
159	E	89.1	Confident	82.1	Confident	172 Å²	172	78.8 Å²	78.8	80%	0.804	45%	0.445	S	S	*	.	H	α-helix	trans	-60.4	-37.7	176	-62.5	-175.9	172.8	0	0	112.4	A157 K163	A157-E159 VanDerWaalsContact C-N 3.27Å; A157-E159 PolarHBondContact O-N 3.09Å; E159-K163 VanDerWaalsContact O-CB 3.26Å; E159-K163 WeakPolarHBondContact O-CB 3.43Å; E159-K163 PolarHBondContact O-N 2.95Å; E159-K163 VanDerWaalsContact O-N 3.1Å
160	E	86	Confident	83.7	Confident	97 Å²	97	78.4 Å²	78.4	45%	0.453	42%	0.424	S	S	.	.	H	α-helix	trans	-74.2	-31.3	176.1	-64.2	-168.5	-179.9	0	0	111.8	Y136 Y138 A157 V158 N164	Y136-E160 VanDerWaalsContact O-OE2 3.06Å; Y138-E160 HydrophobicContact CD1-CB 4.16Å; Y138-E160 HydrophobicContact CE1-CB 4.42Å; A157-E160 HydrophobicContact CB-CB 4.18Å; A157-E160 HydrophobicContact CB-CG 4.17Å; A157-E160 PolarHBondContact O-N 3.34Å; V158-E160 VanDerWaalsContact C-N 3.29Å; V158-E160 PolarHBondContact O-N 3.45Å; E160-N164 VanDerWaalsContact O-CB 3.31Å; E160-N164 WeakPolarHBondContact O-CB 3.39Å; E160-N164 PolarHBondContact O-N 3.21Å; E160-N164 PolarHBondContact O-ND2 3.2Å
161	A	86.6	Confident	85.4	Confident	0 Å²	0	81 Å²	81	0%	0	43%	0.432	C	S	.	.	H	α-helix	trans	-63	-48.1	174.6	0	0	0	0	0	111.2	Y138 Y154 A157 V158 N164 K165 G166	Y138-A161 HydrophobicContact CD1-CB 3.84Å; Y138-A161 HydrophobicContact CD2-CB 3.52Å; Y138-A161 HydrophobicContact CE1-CB 4.24Å; Y138-A161 HydrophobicContact CE2-CB 4Å; Y138-A161 HydrophobicContact CG-CB 3.45Å; Y138-A161 VanDerWaalsContact CG-CB 3.45Å; Y154-A161 HydrophobicContact CD1-CB 4.24Å; Y154-A161 HydrophobicContact CD2-CB 3.88Å; Y154-A161 HydrophobicContact CE2-CB 4.45Å; Y154-A161 HydrophobicContact CG-CB 3.78Å; A157-A161 PolarHBondContact O-N 2.97Å; A157-A161 VanDerWaalsContact O-N 3.14Å; V158-A161 VanDerWaalsContact O-CB 3.3Å; V158-A161 WeakPolarHBondContact O-CB 3.32Å; V158-A161 PolarHBondContact O-N 2.84Å; V158-A161 VanDerWaalsContact O-N 3.09Å; A161-N164 CarbonylContact O-C 3.5Å; A161-N164 PolarHBondContact O-N 2.86Å; A161-K165 CarbonylContact O-C 3.55Å; A161-K165 WeakPolarHBondContact O-CA 3.26Å; A161-K165 PolarHBondContact O-N 3.01Å; A161-G166 PolarHBondContact O-N 2.95Å
162	E	87.3	Confident	86.6	Confident	146 Å²	146	82.1 Å²	82.1	68%	0.682	44%	0.439	S	S	*	.	H	α-helix	trans	-66.7	-42.6	177.5	-67.8	-172.9	169	0	0	111.8	V158 N164 K165	V158-E162 PolarHBondContact O-N 2.72Å; E162-N164 VanDerWaalsContact C-N 3.3Å; E162-N164 PolarHBondContact O-N 3.01Å; E162-K165 PolarHBondContact O-N 3.41Å; E162-K165 VanDerWaalsContact O-N 3.08Å
163	K	88.3	Confident	87.1	Confident	176 Å²	176	78.7 Å²	78.7	77%	0.765	42%	0.421	S	S	*	.	H	α-helix	trans	-59.2	-40.6	177.4	-176	178.5	-178.4	177.8	0	112.5	E159	E159-K163 VanDerWaalsContact O-CB 3.26Å; E159-K163 WeakPolarHBondContact O-CB 3.43Å; E159-K163 PolarHBondContact O-N 2.95Å; E159-K163 VanDerWaalsContact O-N 3.1Å
164	N	86.6	Confident	86.5	Confident	66 Å²	66	85.9 Å²	85.9	35%	0.353	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	5.2	178.6	-63.4	-30	0	0	0	113	Y138 E160 A161 E162 G166 L167	Y138-N164 HydrophobicContact CE1-CB 4.38Å; Y138-N164 WeakPolarHBondContact OH-CB 3.45Å; E160-N164 VanDerWaalsContact O-CB 3.31Å; E160-N164 WeakPolarHBondContact O-CB 3.39Å; E160-N164 PolarHBondContact O-N 3.21Å; E160-N164 PolarHBondContact O-ND2 3.2Å; A161-N164 CarbonylContact O-C 3.5Å; A161-N164 PolarHBondContact O-N 2.86Å; E162-N164 VanDerWaalsContact C-N 3.3Å; E162-N164 PolarHBondContact O-N 3.01Å; N164-G166 PolarHBondContact O-N 2.91Å; N164-L167 WeakPolarHBondContact O-CB 3.39Å; N164-L167 PolarHBondContact O-N 3.36Å
165	K	86.5	Confident	85.4	Confident	190 Å²	190	90.6 Å²	90.6	83%	0.826	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	37.6	-177.6	-56.9	-179.3	179.1	-178.8	0	113.7	A161 E162 L167	A161-K165 CarbonylContact O-C 3.55Å; A161-K165 WeakPolarHBondContact O-CA 3.26Å; A161-K165 PolarHBondContact O-N 3.01Å; E162-K165 PolarHBondContact O-N 3.41Å; E162-K165 VanDerWaalsContact O-N 3.08Å; K165-L167 VanDerWaalsContact C-N 3.3Å; K165-L167 PolarHBondContact O-N 3.01Å
166	G	84.3	Confident	84.3	Confident	10 Å²	10	95.8 Å²	95.8	10%	0.103	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	17.1	176.3	0	0	0	0	0	115.4	Y154 A161 N164 T168	Y154-G166 WeakPolarHBondContact OH-CA 3.36Å; A161-G166 PolarHBondContact O-N 2.95Å; N164-G166 PolarHBondContact O-N 2.91Å; G166-T168 PolarHBondContact O-N 3.33Å
167	L	89.2	Confident	83.3	Confident	38 Å²	38	99.7 Å²	99.7	20%	0.199	51%	0.508	C	S	.	.			trans	-59	134.9	-176.5	-171.9	123.7	0	0	0	112.3	Y136 Y138 N164 K165 E171	Y136-L167 HydrophobicContact CE2-CD2 4.24Å; Y138-L167 PolarHBondContact OH-N 3.46Å; Y138-L167 PolarHBondContact OH-O 3.43Å; N164-L167 WeakPolarHBondContact O-CB 3.39Å; N164-L167 PolarHBondContact O-N 3.36Å; K165-L167 VanDerWaalsContact C-N 3.3Å; K165-L167 PolarHBondContact O-N 3.01Å; L167-E171 HydrophobicContact CD1-CB 4.23Å; L167-E171 HydrophobicContact CG-CB 4.12Å
168	T	89.7	Confident	82.7	Confident	6 Å²	6	106.2 Å²	106.2	4%	0.037	53%	0.532	C	S	.	.			trans	-99.5	163.4	177.5	65.7	0	0	0	0	112.3	Q128 T132 G166 F170 E171	Q128-T168 HydrophobicContact CG-CG2 3.89Å; Q128-T168 VanDerWaalsContact NE2-CG2 3.33Å; Q128-T168 PolarHBondContact NE2-OG1 3.05Å; T132-T168 HydrophobicContact CG2-CG2 4.39Å; T132-T168 WeakPolarHBondContact OG1-CA 3.45Å; T132-T168 WeakPolarHBondContact OG1-CB 3.38Å; G166-T168 PolarHBondContact O-N 3.33Å; T168-F170 PolarHBondContact O-N 3.47Å; T168-E171 PolarHBondContact N-OE2 2.98Å; T168-E171 PolarHBondContact O-N 2.68Å; T168-E171 VanDerWaalsContact O-N 3.11Å; T168-E171 VanDerWaalsContact OG1-CD 3.26Å; T168-E171 WeakPolarHBondContact OG1-CG 3.19Å; T168-E171 PolarHBondContact OG1-OE2 3.17Å; T168-E171 VanDerWaalsContact OG1-OE2 3.08Å
169	V	88.9	Confident	82.4	Confident	52 Å²	52	111.5 Å²	111.5	32%	0.315	55%	0.55	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-27.5	-176.8	176.6	0	0	0	0	113.1	R131 T132 T135 Y136 E171	R131-V169 HydrophobicContact CB-CB 4.24Å; R131-V169 HydrophobicContact CB-CG2 4.01Å; R131-V169 WeakPolarHBondContact O-CG2 3.42Å; T132-V169 PolarHBondContact OG1-N 2.91Å; T135-V169 HydrophobicContact CG2-CG2 4.22Å; T135-V169 WeakPolarHBondContact OG1-CG2 3.5Å; Y136-V169 HydrophobicContact CD2-CG2 4.3Å; Y136-V169 HydrophobicContact CE2-CG2 3.89Å; V169-E171 VanDerWaalsContact C-N 3.32Å
170	F	90	Very high	82.3	Confident	95 Å²	95	109.5 Å²	109.5	42%	0.417	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-10.7	179.7	-66.8	-69.9	0	0	0	113.2	F124 Q128 T168	F124-F170 HydrophobicContact CE2-CD1 4.47Å; F124-F170 HydrophobicContact CE2-CD2 4.07Å; F124-F170 HydrophobicContact CE2-CE2 4.26Å; F124-F170 HydrophobicContact CE2-CG 4.17Å; F124-F170 HydrophobicContact CZ-CB 4.31Å; F124-F170 HydrophobicContact CZ-CD2 4.12Å; F124-F170 HydrophobicContact CZ-CG 4.21Å; Q128-F170 HydrophobicContact CB-CD2 3.86Å; Q128-F170 HydrophobicContact CB-CE2 4.06Å; Q128-F170 HydrophobicContact CG-CD2 4.02Å; T168-F170 PolarHBondContact O-N 3.47Å
171	E	89	Confident	82.3	Confident	100 Å²	100	113.1 Å²	113.1	47%	0.467	55%	0.549	S	S	.	.	S	Bend	trans	-91.4	141.2	176.4	-69.8	166.6	157.4	0	0	110.8	L167 T168 V169 G173	L167-E171 HydrophobicContact CD1-CB 4.23Å; L167-E171 HydrophobicContact CG-CB 4.12Å; T168-E171 PolarHBondContact N-OE2 2.98Å; T168-E171 PolarHBondContact O-N 2.68Å; T168-E171 VanDerWaalsContact O-N 3.11Å; T168-E171 VanDerWaalsContact OG1-CD 3.26Å; T168-E171 WeakPolarHBondContact OG1-CG 3.19Å; T168-E171 PolarHBondContact OG1-OE2 3.17Å; T168-E171 VanDerWaalsContact OG1-OE2 3.08Å; V169-E171 VanDerWaalsContact C-N 3.32Å; E171-G173 PolarHBondContact O-N 3.4Å
172	S	82.6	Confident	82.3	Confident	126 Å²	126	118 Å²	118	88%	0.881	57%	0.571	S	S	*	*			trans	-74.7	96.9	176.2	59.1	0	0	0	0	110.3
173	G	75.4	Confident	82.2	Confident	33 Å²	33	114 Å²	114	34%	0.34	56%	0.556	S	S	.	*			trans	-85.2	-178.6	179.5	0	0	0	0	0	115.8	E171 K175	E171-G173 PolarHBondContact O-N 3.4Å; G173-K175 PolarHBondContact O-N 2.88Å
174	Q	70.2	Confident	81.7	Confident	202 Å²	202	115.5 Å²	115.5	94%	0.944	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-65.6	116.2	175.2	-154.8	166	2.9	0	0	109	K176	Q174-K176 PolarHBondContact O-N 3.36Å
175	K	66.8	Low	81.1	Confident	180 Å²	180	113.9 Å²	113.9	78%	0.783	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-60.2	130	-175.6	-72.1	178	179.6	169.3	0	110	G173	G173-K175 PolarHBondContact O-N 2.88Å
176	K	64.9	Low	80.5	Confident	172 Å²	172	106 Å²	106	75%	0.748	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-52.4	135	168.9	-77.1	-171.2	176.9	-177.6	0	109.4	Q174 E178	Q174-K176 PolarHBondContact O-N 3.36Å; K176-E178 VanDerWaalsContact C-N 3.27Å; K176-E178 PolarHBondContact O-N 3.24Å
177	P	68.7	Low	80.2	Confident	132 Å²	132	112.1 Å²	112.1	86%	0.857	56%	0.564	S	S	*	*	S	Bend	trans	-67	-29.6	-173.3	25.3	-33.5	0	0	0	112.4
178	E	78.2	Confident	79.6	Confident	174 Å²	174	114.4 Å²	114.4	81%	0.813	59%	0.588	S	S	*	*			trans	-118.9	115.4	-176.8	-63.6	-170.1	164.9	0	0	111.8	K176	K176-E178 VanDerWaalsContact C-N 3.27Å; K176-E178 PolarHBondContact O-N 3.24Å
179	K	82.8	Confident	79.2	Confident	174 Å²	174	117.5 Å²	117.5	76%	0.757	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-93.1	133.2	169.1	-65.2	-177.7	-179.5	-177.6	0	109	K181	K179-K181 PolarHBondContact O-N 2.98Å
180	R	85.9	Confident	78.6	Confident	131 Å²	131	119.7 Å²	119.7	49%	0.494	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-58.3	133.7	169.7	-68.9	179.8	68.8	-160.8	-5.8	109.8	Y201 D203	R180-Y201 HydrophobicContact CB-CD1 3.52Å; R180-Y201 HydrophobicContact CB-CE1 3.6Å; R180-Y201 HydrophobicContact CB-CG 4.41Å; R180-D203 IonicContact CZ-OD1 3.5Å; R180-D203 IonicContact CZ-OD2 3.1Å; R180-D203 IonicContact NE-OD1 3.45Å; R180-D203 PolarHBondContact NE-OD1 3.25Å; R180-D203 IonicContact NE-OD2 3.77Å; R180-D203 PolarHBondContact NE-OD2 3.05Å; R180-D203 VanDerWaalsContact NH2-CG 3.33Å; R180-D203 IonicContact NH2-OD1 3.52Å; R180-D203 PolarHBondContact NH2-OD1 3.14Å; R180-D203 IonicContact NH2-OD2 3.48Å; R180-D203 PolarHBondContact NH2-OD2 3Å
181	K	86.5	Confident	77.9	Confident	172 Å²	172	122.9 Å²	122.9	75%	0.748	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-81	124.9	-177.8	-66.2	-178.2	-178.7	175.7	0	109.7	K179 V202	K179-K181 PolarHBondContact O-N 2.98Å; K181-V202 HydrophobicContact CB-CG2 4.44Å; K181-V202 PolarHBondContact O-N 3.23Å
182	K	86.3	Confident	77.3	Confident	104 Å²	104	125.3 Å²	125.3	45%	0.452	66%	0.664	S	S	.	*	B	Isolated β-bridge	trans	-88.7	150.4	169.8	-65.5	-173.1	175.7	-165.4	0	110.2	K184 A199 K200 Y201	K182-K184 PolarHBondContact O-N 3.35Å; K182-A199 HydrophobicContact CB-CB 4.26Å; K182-K200 WeakPolarHBondContact CA-O 3.46Å; K182-Y201 HydrophobicContact CD-CE1 4.26Å; K182-Y201 WeakPolarHBondContact CE-OH 3.48Å; K182-Y201 HydrophobicContact CG-CD1 3.65Å; K182-Y201 HydrophobicContact CG-CE1 3.58Å; K182-Y201 HydrophobicContact CG-CG 4.45Å
183	V	85.6	Confident	77.2	Confident	62 Å²	62	124 Å²	124	38%	0.376	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-60.9	127.4	169.5	-179.5	0	0	0	0	108.2	G185 L195 A199 K200 V202	V183-G185 PolarHBondContact O-N 3.48Å; V183-L195 HydrophobicContact CB-CD1 4.15Å; V183-L195 HydrophobicContact CG1-CD1 3.67Å; V183-A199 VanDerWaalsContact O-CB 3.23Å; V183-A199 WeakPolarHBondContact O-CB 3.36Å; V183-K200 PolarHBondContact N-O 3.16Å; V183-V202 HydrophobicContact CG2-CG2 3.9Å
184	K	78.3	Confident	77.6	Confident	206 Å²	206	127 Å²	127	90%	0.896	65%	0.652	S	S	*	*			trans	-76.4	111.8	171.8	-72.7	-174.4	177.4	-177.2	0	107.7	K182	K182-K184 PolarHBondContact O-N 3.35Å
185	G	73	Confident	78.1	Confident	33 Å²	33	120.3 Å²	120.3	34%	0.34	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-72.8	160.6	172.8	0	0	0	0	0	111.9	V183	V183-G185 PolarHBondContact O-N 3.48Å
186	G	74.9	Confident	79	Confident	23 Å²	23	113.3 Å²	113.3	24%	0.237	60%	0.601	C	S	.	*	P	Polyproline II helix	trans	-67.6	171.6	170	0	0	0	0	0	112.1	N193 F194	G186-N193 PolarHBondContact N-O 3.46Å; G186-F194 WeakPolarHBondContact O-CD2 3.29Å
187	D	76.6	Confident	80	Confident	140 Å²	140	110.3 Å²	110.3	75%	0.749	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-68.8	161.4	173.5	-73.9	-32.4	0	0	0	111	G189 E190	D187-G189 PolarHBondContact O-N 3.16Å; D187-E190 PolarHBondContact O-N 3.29Å
188	A	78.2	Confident	80.7	Confident	85 Å²	85	113.5 Å²	113.5	70%	0.702	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-5.3	-176.8	0	0	0	0	0	115	F194	A188-F194 VanDerWaalsContact CA-CD2 3.47Å; A188-F194 HydrophobicContact CB-CD2 4.06Å; A188-F194 HydrophobicContact CB-CE2 3.88Å; A188-F194 HydrophobicContact CB-CZ 4.34Å
189	G	80.1	Confident	81.2	Confident	72 Å²	72	105.9 Å²	105.9	74%	0.742	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-17.2	172.1	0	0	0	0	0	114.7	D187	D187-G189 PolarHBondContact O-N 3.16Å
190	E	76.7	Confident	81.4	Confident	98 Å²	98	102.6 Å²	102.6	46%	0.458	55%	0.546	S	S	.	.			trans	-91.2	104	175.7	-70.1	-173.3	-168.3	0	0	110.5	D187 D192 N193 F194	D187-E190 PolarHBondContact O-N 3.29Å; E190-D192 VanDerWaalsContact C-N 3.31Å; E190-D192 PolarHBondContact O-N 3.29Å; E190-N193 HydrophobicContact CB-CB 4.13Å; E190-N193 PolarHBondContact O-N 3Å; E190-N193 VanDerWaalsContact OE2-CB 3.29Å; E190-N193 WeakPolarHBondContact OE2-CB 3.33Å; E190-N193 PolarHBondContact OE2-ND2 3.46Å; E190-F194 WeakPolarHBondContact O-CB 3.13Å; E190-F194 PolarHBondContact O-N 3.43Å
191	I	74.6	Confident	81.6	Confident	162 Å²	162	99.9 Å²	99.9	83%	0.831	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-39.3	-170.9	-61.8	165.3	0	0	0	112.6
192	D	77.8	Confident	81.5	Confident	150 Å²	150	96.5 Å²	96.5	80%	0.802	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-19.1	-172.9	-62.7	-29.3	0	0	0	113.9	E190	E190-D192 VanDerWaalsContact C-N 3.31Å; E190-D192 PolarHBondContact O-N 3.29Å
193	N	79	Confident	81.5	Confident	99 Å²	99	96.5 Å²	96.5	53%	0.529	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-3.7	-173.6	-67.7	-22.7	0	0	0	113.9	G186 E190 L195	G186-N193 PolarHBondContact N-O 3.46Å; E190-N193 HydrophobicContact CB-CB 4.13Å; E190-N193 PolarHBondContact O-N 3Å; E190-N193 VanDerWaalsContact OE2-CB 3.29Å; E190-N193 WeakPolarHBondContact OE2-CB 3.33Å; E190-N193 PolarHBondContact OE2-ND2 3.46Å; N193-L195 PolarHBondContact O-N 2.95Å
194	F	85.4	Confident	81.5	Confident	97 Å²	97	98.8 Å²	98.8	43%	0.425	54%	0.542	S	S	.	.			trans	-72.6	108.8	178.6	-179.2	-105.1	0	0	0	111	G186 A188 E190	G186-F194 WeakPolarHBondContact O-CD2 3.29Å; A188-F194 VanDerWaalsContact CA-CD2 3.47Å; A188-F194 HydrophobicContact CB-CD2 4.06Å; A188-F194 HydrophobicContact CB-CE2 3.88Å; A188-F194 HydrophobicContact CB-CZ 4.34Å; E190-F194 WeakPolarHBondContact O-CB 3.13Å; E190-F194 PolarHBondContact O-N 3.43Å
195	L	80.6	Confident	81.7	Confident	60 Å²	60	97.9 Å²	97.9	31%	0.314	54%	0.538	S	S	.	.			trans	-103.7	-24.1	179.3	-66.3	168.3	0	0	0	113.2	V183 N193 W198 A199	V183-L195 HydrophobicContact CB-CD1 4.15Å; V183-L195 HydrophobicContact CG1-CD1 3.67Å; N193-L195 PolarHBondContact O-N 2.95Å; L195-W198 CarbonylContact O-C 3.56Å; L195-W198 VanDerWaalsContact O-CA 3.26Å; L195-W198 WeakPolarHBondContact O-CA 3.4Å; L195-W198 VanDerWaalsContact O-CB 3.29Å; L195-W198 WeakPolarHBondContact O-CB 3.4Å; L195-W198 PolarHBondContact O-N 2.84Å; L195-A199 HydrophobicContact CB-CB 4.14Å; L195-A199 PolarHBondContact O-N 3.49Å
196	G	84.9	Confident	82.1	Confident	34 Å²	34	101.9 Å²	101.9	35%	0.351	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	44.7	-131.2	177.7	0	0	0	0	0	113.9	W198 A199	G196-W198 VanDerWaalsContact C-N 3.26Å; G196-W198 PolarHBondContact O-N 3.01Å; G196-A199 WeakPolarHBondContact O-CB 3.44Å; G196-A199 PolarHBondContact O-N 3.13Å
197	P	86	Confident	82.6	Confident	109 Å²	109	105.7 Å²	105.7	71%	0.708	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-67.4	-17.4	172	-21.7	34.4	0	0	0	115.6	A199	P197-A199 PolarHBondContact O-N 3.23Å
198	W	84.1	Confident	83.1	Confident	199 Å²	199	103.7 Å²	103.7	75%	0.754	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-81.8	3.9	177.2	-59.7	-89.2	0	0	0	113.6	L195 G196 K200	L195-W198 CarbonylContact O-C 3.56Å; L195-W198 VanDerWaalsContact O-CA 3.26Å; L195-W198 WeakPolarHBondContact O-CA 3.4Å; L195-W198 VanDerWaalsContact O-CB 3.29Å; L195-W198 WeakPolarHBondContact O-CB 3.4Å; L195-W198 PolarHBondContact O-N 2.84Å; G196-W198 VanDerWaalsContact C-N 3.26Å; G196-W198 PolarHBondContact O-N 3.01Å; W198-K200 PolarHBondContact O-N 3.01Å
199	A	87	Confident	83.6	Confident	13 Å²	13	108.1 Å²	108.1	11%	0.107	58%	0.576	C	S	.	*			trans	-53.9	109.8	172	0	0	0	0	0	111.6	K182 V183 L195 G196 P197	K182-A199 HydrophobicContact CB-CB 4.26Å; V183-A199 VanDerWaalsContact O-CB 3.23Å; V183-A199 WeakPolarHBondContact O-CB 3.36Å; L195-A199 HydrophobicContact CB-CB 4.14Å; L195-A199 PolarHBondContact O-N 3.49Å; G196-A199 WeakPolarHBondContact O-CB 3.44Å; G196-A199 PolarHBondContact O-N 3.13Å; P197-A199 PolarHBondContact O-N 3.23Å
200	K	87.6	Confident	84.1	Confident	105 Å²	105	107.6 Å²	107.6	46%	0.457	56%	0.56	S	S	.	*			trans	-67.2	160	176	-58.3	-175.9	-173.7	-177	0	110.8	K182 V183 W198 D206	K182-K200 WeakPolarHBondContact CA-O 3.46Å; V183-K200 PolarHBondContact N-O 3.16Å; W198-K200 PolarHBondContact O-N 3.01Å; K200-D206 WeakPolarHBondContact CD-OD1 3.2Å; K200-D206 WeakPolarHBondContact CE-OD1 3.4Å; K200-D206 IonicContact NZ-OD1 3.34Å; K200-D206 PolarHBondContact NZ-OD1 3.01Å; K200-D206 IonicContact NZ-OD2 3.98Å; K200-D206 PolarHBondContact NZ-OD2 2.97Å
201	Y	89.6	Confident	84.9	Confident	75 Å²	75	105.4 Å²	105.4	29%	0.294	56%	0.555	S	S	.	*	B	Isolated β-bridge	trans	-76.3	144.5	171.2	-63.2	-78.6	0	0	0	110.7	R180 K182 D203 E204	R180-Y201 HydrophobicContact CB-CD1 3.52Å; R180-Y201 HydrophobicContact CB-CE1 3.6Å; R180-Y201 HydrophobicContact CB-CG 4.41Å; K182-Y201 HydrophobicContact CD-CE1 4.26Å; K182-Y201 WeakPolarHBondContact CE-OH 3.48Å; K182-Y201 HydrophobicContact CG-CD1 3.65Å; K182-Y201 HydrophobicContact CG-CE1 3.58Å; K182-Y201 HydrophobicContact CG-CG 4.45Å; Y201-D203 WeakPolarHBondContact CB-OD1 2.94Å; Y201-D203 PolarHBondContact O-N 3.32Å; Y201-E204 PolarHBondContact O-N 3.28Å
202	V	86.1	Confident	85.7	Confident	101 Å²	101	104.3 Å²	104.3	61%	0.612	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-26.7	-176	178.2	0	0	0	0	112.2	K181 V183	K181-V202 HydrophobicContact CB-CG2 4.44Å; K181-V202 PolarHBondContact O-N 3.23Å; V183-V202 HydrophobicContact CG2-CG2 3.9Å
203	D	85.3	Confident	86.4	Confident	103 Å²	103	104.3 Å²	104.3	55%	0.551	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-7.2	-179.7	56.5	-8.9	0	0	0	113.4	R180 Y201	R180-D203 IonicContact CZ-OD1 3.5Å; R180-D203 IonicContact CZ-OD2 3.1Å; R180-D203 IonicContact NE-OD1 3.45Å; R180-D203 PolarHBondContact NE-OD1 3.25Å; R180-D203 IonicContact NE-OD2 3.77Å; R180-D203 PolarHBondContact NE-OD2 3.05Å; R180-D203 VanDerWaalsContact NH2-CG 3.33Å; R180-D203 IonicContact NH2-OD1 3.52Å; R180-D203 PolarHBondContact NH2-OD1 3.14Å; R180-D203 IonicContact NH2-OD2 3.48Å; R180-D203 PolarHBondContact NH2-OD2 3Å; Y201-D203 WeakPolarHBondContact CB-OD1 2.94Å; Y201-D203 PolarHBondContact O-N 3.32Å
204	E	84.8	Confident	87.1	Confident	111 Å²	111	104.4 Å²	104.4	52%	0.519	54%	0.539	S	S	.	.			trans	-96.8	133.8	-176.7	-167.5	171.6	172.9	0	0	111.4	Y201	Y201-E204 PolarHBondContact O-N 3.28Å
205	K	83.6	Confident	87.5	Confident	186 Å²	186	105.5 Å²	105.5	81%	0.809	54%	0.544	S	S	*	.			trans	-104.7	136.6	176.1	-67.1	-178.9	-179.2	175.9	0	109.8	V207	K205-V207 VanDerWaalsContact C-N 3.33Å; K205-V207 PolarHBondContact O-N 2.64Å
206	D	81	Confident	88.2	Confident	117 Å²	117	108.4 Å²	108.4	63%	0.626	55%	0.554	S	S	*	*	S	Bend	trans	-69.5	-26.9	-177	-76.4	-21.8	0	0	0	114.6	K200	K200-D206 WeakPolarHBondContact CD-OD1 3.2Å; K200-D206 WeakPolarHBondContact CE-OD1 3.4Å; K200-D206 IonicContact NZ-OD1 3.34Å; K200-D206 PolarHBondContact NZ-OD1 3.01Å; K200-D206 IonicContact NZ-OD2 3.98Å; K200-D206 PolarHBondContact NZ-OD2 2.97Å
207	V	86.6	Confident	88.6	Confident	103 Å²	103	112.6 Å²	112.6	62%	0.624	56%	0.564	S	S	*	*			trans	-124.2	111.7	-177.9	-173	0	0	0	0	109	K205 K209	K205-V207 VanDerWaalsContact C-N 3.33Å; K205-V207 PolarHBondContact O-N 2.64Å; V207-K209 HydrophobicContact CG1-CG 3.93Å
208	A	87.1	Confident	89	Confident	99 Å²	99	111.8 Å²	111.8	82%	0.818	55%	0.554	S	S	*	*			trans	-87.5	105.9	166	0	0	0	0	0	108.4
209	K	88.4	Confident	89.5	Confident	178 Å²	178	106.7 Å²	106.7	77%	0.774	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-92	138.4	167.1	-65.4	-175.1	-174.7	177.2	0	108.2	V207	V207-K209 HydrophobicContact CG1-CG 3.93Å
210	P	90.6	Very high	89.8	Confident	60 Å²	60	111 Å²	111	39%	0.39	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-59.3	158.4	172.3	25.2	-32.2	0	0	0	110.3	E214 K215 L218	P210-E214 WeakPolarHBondContact CA-OE2 3.28Å; P210-E214 HydrophobicContact CB-CB 3.77Å; P210-E214 WeakPolarHBondContact CB-OE2 3.37Å; P210-K215 HydrophobicContact CG-CB 4.47Å; P210-L218 HydrophobicContact CB-CD1 4.5Å; P210-L218 HydrophobicContact CG-CD1 4.25Å
211	S	92.5	Very high	90.1	Very high	53 Å²	53	110.5 Å²	110.5	37%	0.371	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-59.2	161.3	174.6	80.4	0	0	0	0	110.7	E213 E214 K215	S211-E213 PolarHBondContact O-N 3.08Å; S211-E214 PolarHBondContact N-OE2 3.46Å; S211-E214 PolarHBondContact O-N 2.9Å; S211-E214 WeakPolarHBondContact OG-CB 3.34Å; S211-E214 VanDerWaalsContact OG-CG 3.3Å; S211-E214 WeakPolarHBondContact OG-CG 3.49Å; S211-E214 PolarHBondContact OG-N 3.32Å; S211-E214 VanDerWaalsContact OG-N 3.1Å; S211-K215 WeakPolarHBondContact O-CB 3.29Å; S211-K215 PolarHBondContact O-N 3.12Å
212	E	92.6	Very high	90.3	Very high	139 Å²	139	110 Å²	110	65%	0.65	57%	0.565	S	S	*	*	H	α-helix	trans	-61.8	-29.6	179.2	-158.5	-168.3	137.5	0	0	112.1	K216	E212-K216 WeakPolarHBondContact O-CG 3.42Å; E212-K216 PolarHBondContact O-N 2.83Å; E212-K216 WeakPolarHBondContact OE1-CE 3.34Å; E212-K216 IonicContact OE1-NZ 2.83Å; E212-K216 PolarHBondContact OE1-NZ 3.25Å
213	E	92.8	Very high	90.5	Very high	150 Å²	150	107.2 Å²	107.2	70%	0.701	55%	0.553	S	S	*	*	H	α-helix	trans	-71.4	-50.9	175.4	-63.5	178.9	171.6	0	0	111.1	S211 K215 K216 E217	S211-E213 PolarHBondContact O-N 3.08Å; E213-K215 PolarHBondContact O-N 2.68Å; E213-K216 WeakPolarHBondContact O-CB 3.27Å; E213-K216 PolarHBondContact O-N 3.3Å; E213-E217 PolarHBondContact O-N 3.2Å
214	E	92.5	Very high	90.8	Very high	100 Å²	100	108.4 Å²	108.4	47%	0.467	55%	0.553	S	S	.	*	H	α-helix	trans	-59.6	-35.5	176.4	-73	170.6	168.3	0	0	111.8	P210 S211 E217 L218	P210-E214 WeakPolarHBondContact CA-OE2 3.28Å; P210-E214 HydrophobicContact CB-CB 3.77Å; P210-E214 WeakPolarHBondContact CB-OE2 3.37Å; S211-E214 PolarHBondContact N-OE2 3.46Å; S211-E214 PolarHBondContact O-N 2.9Å; S211-E214 WeakPolarHBondContact OG-CB 3.34Å; S211-E214 VanDerWaalsContact OG-CG 3.3Å; S211-E214 WeakPolarHBondContact OG-CG 3.49Å; S211-E214 PolarHBondContact OG-N 3.32Å; S211-E214 VanDerWaalsContact OG-N 3.1Å; E214-E217 PolarHBondContact O-N 2.68Å; E214-L218 WeakPolarHBondContact O-CB 3.29Å; E214-L218 VanDerWaalsContact O-CG 3.28Å; E214-L218 WeakPolarHBondContact O-CG 3.38Å; E214-L218 PolarHBondContact O-N 3.09Å
215	K	94.1	Very high	91	Very high	120 Å²	120	112.3 Å²	112.3	52%	0.522	56%	0.563	S	S	.	*	H	α-helix	trans	-64.4	-42.3	175.5	-169.6	-178	176.4	-169.2	0	111.5	P210 S211 E213 E217 L218 D219	P210-K215 HydrophobicContact CG-CB 4.47Å; S211-K215 WeakPolarHBondContact O-CB 3.29Å; S211-K215 PolarHBondContact O-N 3.12Å; E213-K215 PolarHBondContact O-N 2.68Å; K215-E217 VanDerWaalsContact C-N 3.34Å; K215-L218 PolarHBondContact O-N 2.74Å; K215-D219 WeakPolarHBondContact O-CB 2.89Å; K215-D219 PolarHBondContact O-N 3.16Å
216	K	94.6	Very high	91.2	Very high	122 Å²	122	110.1 Å²	110.1	53%	0.53	56%	0.556	S	S	.	*	H	α-helix	trans	-64.5	-39.9	175.6	-73.1	167.9	-172.7	161.6	0	111.2	E212 E213 D219 E220	E212-K216 WeakPolarHBondContact O-CG 3.42Å; E212-K216 PolarHBondContact O-N 2.83Å; E212-K216 WeakPolarHBondContact OE1-CE 3.34Å; E212-K216 IonicContact OE1-NZ 2.83Å; E212-K216 PolarHBondContact OE1-NZ 3.25Å; E213-K216 WeakPolarHBondContact O-CB 3.27Å; E213-K216 PolarHBondContact O-N 3.3Å; K216-D219 PolarHBondContact O-N 2.75Å; K216-E220 PolarHBondContact O-N 2.68Å
217	E	94.5	Very high	91.4	Very high	122 Å²	122	112.5 Å²	112.5	57%	0.57	56%	0.56	S	S	*	*	H	α-helix	trans	-64	-43.1	175.1	-69	-172.6	165	0	0	112.2	E213 E214 K215 E220 I221	E213-E217 PolarHBondContact O-N 3.2Å; E214-E217 PolarHBondContact O-N 2.68Å; K215-E217 VanDerWaalsContact C-N 3.34Å; E217-E220 PolarHBondContact O-N 2.83Å; E217-I221 VanDerWaalsContact O-CG1 3.28Å; E217-I221 WeakPolarHBondContact O-CG1 3.25Å; E217-I221 PolarHBondContact O-N 2.86Å
218	L	93.1	Very high	91.2	Very high	92 Å²	92	116.7 Å²	116.7	48%	0.482	57%	0.57	S	S	.	*	H	α-helix	trans	-63.6	-40.9	175	-73.5	170.3	0	0	0	111.8	P210 E214 K215 E220 I221 T222	P210-L218 HydrophobicContact CB-CD1 4.5Å; P210-L218 HydrophobicContact CG-CD1 4.25Å; E214-L218 WeakPolarHBondContact O-CB 3.29Å; E214-L218 VanDerWaalsContact O-CG 3.28Å; E214-L218 WeakPolarHBondContact O-CG 3.38Å; E214-L218 PolarHBondContact O-N 3.09Å; K215-L218 PolarHBondContact O-N 2.74Å; L218-E220 VanDerWaalsContact C-N 3.31Å; L218-E220 PolarHBondContact O-N 3.04Å; L218-I221 PolarHBondContact O-N 2.86Å; L218-T222 VanDerWaalsContact O-CG2 3.3Å; L218-T222 WeakPolarHBondContact O-CG2 3.19Å; L218-T222 PolarHBondContact O-N 2.8Å; L218-T222 PolarHBondContact O-OG1 3.44Å; L218-T222 VanDerWaalsContact O-OG1 3.09Å
219	D	94.4	Very high	90.5	Very high	92 Å²	92	115.2 Å²	115.2	49%	0.492	56%	0.564	S	S	.	*	H	α-helix	trans	-63.8	-37.6	174.4	-75.6	-14.5	0	0	0	111.1	K215 K216 T222 A223	K215-D219 WeakPolarHBondContact O-CB 2.89Å; K215-D219 PolarHBondContact O-N 3.16Å; K216-D219 PolarHBondContact O-N 2.75Å; D219-T222 WeakPolarHBondContact CA-OG1 2.95Å; D219-T222 PolarHBondContact O-N 3.26Å; D219-T222 PolarHBondContact O-OG1 3.31Å; D219-A223 VanDerWaalsContact O-CB 3.3Å; D219-A223 WeakPolarHBondContact O-CB 3.49Å; D219-A223 PolarHBondContact O-N 3.05Å
220	E	95.2	Very high	89.5	Confident	104 Å²	104	115 Å²	115	49%	0.486	56%	0.558	S	S	.	*	H	α-helix	trans	-67.3	-43.2	174.2	-166.4	-172.4	156.7	0	0	112.2	K216 E217 L218 T222 A223 K224	K216-E220 PolarHBondContact O-N 2.68Å; E217-E220 PolarHBondContact O-N 2.83Å; L218-E220 VanDerWaalsContact C-N 3.31Å; L218-E220 PolarHBondContact O-N 3.04Å; E220-T222 VanDerWaalsContact C-N 3.33Å; E220-T222 PolarHBondContact O-N 3.32Å; E220-A223 PolarHBondContact O-N 3.25Å; E220-K224 WeakPolarHBondContact O-CB 3.35Å; E220-K224 WeakPolarHBondContact O-CG 3.42Å; E220-K224 PolarHBondContact O-N 2.97Å; E220-K224 WeakPolarHBondContact OE1-CE 3.46Å; E220-K224 IonicContact OE1-NZ 3.52Å; E220-K224 PolarHBondContact OE1-NZ 3.4Å
221	I	93.8	Very high	88	Confident	93 Å²	93	119.3 Å²	119.3	48%	0.477	58%	0.579	S	S	.	*	H	α-helix	trans	-61.6	-43.3	176.8	-70.6	165.7	0	0	0	110.5	E217 L218 K224 R225	E217-I221 VanDerWaalsContact O-CG1 3.28Å; E217-I221 WeakPolarHBondContact O-CG1 3.25Å; E217-I221 PolarHBondContact O-N 2.86Å; L218-I221 PolarHBondContact O-N 2.86Å; I221-K224 PolarHBondContact O-N 2.82Å; I221-R225 WeakPolarHBondContact O-CB 3.47Å; I221-R225 PolarHBondContact O-N 2.87Å
222	T	92.9	Very high	86.5	Confident	66 Å²	66	123.3 Å²	123.3	41%	0.405	59%	0.591	S	S	.	*	H	α-helix	trans	-67.8	-40.2	177.7	56.6	0	0	0	0	111.5	L218 D219 E220 R225 Q226	L218-T222 VanDerWaalsContact O-CG2 3.3Å; L218-T222 WeakPolarHBondContact O-CG2 3.19Å; L218-T222 PolarHBondContact O-N 2.8Å; L218-T222 PolarHBondContact O-OG1 3.44Å; L218-T222 VanDerWaalsContact O-OG1 3.09Å; D219-T222 WeakPolarHBondContact CA-OG1 2.95Å; D219-T222 PolarHBondContact O-N 3.26Å; D219-T222 PolarHBondContact O-OG1 3.31Å; E220-T222 VanDerWaalsContact C-N 3.33Å; E220-T222 PolarHBondContact O-N 3.32Å; T222-R225 PolarHBondContact O-N 3.09Å; T222-Q226 WeakPolarHBondContact O-CB 3.49Å; T222-Q226 WeakPolarHBondContact O-CG 3.32Å; T222-Q226 PolarHBondContact O-N 3Å
223	A	91.2	Very high	84.9	Confident	42 Å²	42	123 Å²	123	35%	0.347	59%	0.594	S	S	.	*	H	α-helix	trans	-61.4	-43.6	173.5	0	0	0	0	0	112.3	D219 E220 R225 Q226 K227	D219-A223 VanDerWaalsContact O-CB 3.3Å; D219-A223 WeakPolarHBondContact O-CB 3.49Å; D219-A223 PolarHBondContact O-N 3.05Å; E220-A223 PolarHBondContact O-N 3.25Å; A223-R225 VanDerWaalsContact C-N 3.33Å; A223-R225 PolarHBondContact O-N 2.75Å; A223-Q226 PolarHBondContact O-N 2.68Å; A223-K227 WeakPolarHBondContact O-CG 3.35Å; A223-K227 PolarHBondContact O-N 3.33Å
224	K	91.1	Very high	83.2	Confident	127 Å²	127	124.7 Å²	124.7	55%	0.552	60%	0.602	S	S	*	*	H	α-helix	trans	-60.2	-41.7	173.6	-75.7	173.9	-177.2	164.4	0	111.6	E220 I221 K228	E220-K224 WeakPolarHBondContact O-CB 3.35Å; E220-K224 WeakPolarHBondContact O-CG 3.42Å; E220-K224 PolarHBondContact O-N 2.97Å; E220-K224 WeakPolarHBondContact OE1-CE 3.46Å; E220-K224 IonicContact OE1-NZ 3.52Å; E220-K224 PolarHBondContact OE1-NZ 3.4Å; I221-K224 PolarHBondContact O-N 2.82Å; K224-K228 PolarHBondContact O-N 3.38Å; K224-K228 VanDerWaalsContact O-N 3.16Å
225	R	89.3	Confident	81.6	Confident	193 Å²	193	123.9 Å²	123.9	73%	0.728	61%	0.613	S	S	*	*	H	α-helix	trans	-67	-41.5	177.4	-171.8	179.2	-75.1	-179.9	-3	112	I221 T222 A223 K228 G229	I221-R225 WeakPolarHBondContact O-CB 3.47Å; I221-R225 PolarHBondContact O-N 2.87Å; T222-R225 PolarHBondContact O-N 3.09Å; A223-R225 VanDerWaalsContact C-N 3.33Å; A223-R225 PolarHBondContact O-N 2.75Å; R225-K228 PolarHBondContact O-N 3.47Å; R225-G229 PolarHBondContact O-N 3.32Å
226	Q	87.1	Confident	80	Confident	140 Å²	140	121.6 Å²	121.6	65%	0.654	61%	0.61	S	S	*	*	H	α-helix	trans	-64.9	-43.1	177.1	-74.8	179.1	6.8	0	0	111.8	T222 A223 K228 G229 R230	T222-Q226 WeakPolarHBondContact O-CB 3.49Å; T222-Q226 WeakPolarHBondContact O-CG 3.32Å; T222-Q226 PolarHBondContact O-N 3Å; A223-Q226 PolarHBondContact O-N 2.68Å; Q226-K228 VanDerWaalsContact C-N 3.27Å; Q226-K228 PolarHBondContact O-N 2.97Å; Q226-G229 PolarHBondContact O-N 3.46Å; Q226-G229 VanDerWaalsContact O-N 3.16Å; Q226-R230 WeakPolarHBondContact O-CB 3.48Å; Q226-R230 PolarHBondContact O-N 3.28Å
227	K	85.5	Confident	78.4	Confident	167 Å²	167	118.1 Å²	118.1	73%	0.726	61%	0.608	S	S	*	*	H	α-helix	trans	-60.9	-34.7	174.5	-74.5	-177	177.8	-175.3	0	112.9	A223 G229	A223-K227 WeakPolarHBondContact O-CG 3.35Å; A223-K227 PolarHBondContact O-N 3.33Å; K227-G229 VanDerWaalsContact C-N 3.32Å; K227-G229 PolarHBondContact O-N 3Å
228	K	81.8	Confident	77	Confident	192 Å²	192	119 Å²	119	84%	0.835	61%	0.613	S	S	*	*	H	α-helix	trans	-68.8	-29.6	177	-168.1	177.3	-179.8	-179.7	0	113.1	K224 R225 Q226	K224-K228 PolarHBondContact O-N 3.38Å; K224-K228 VanDerWaalsContact O-N 3.16Å; R225-K228 PolarHBondContact O-N 3.47Å; Q226-K228 VanDerWaalsContact C-N 3.27Å; Q226-K228 PolarHBondContact O-N 2.97Å
229	G	73	Confident	76.1	Confident	67 Å²	67	116.9 Å²	116.9	69%	0.691	60%	0.6	S	S	*	*	H	α-helix	trans	-94.4	-19.4	-178.6	0	0	0	0	0	114.7	R225 Q226 K227 N231	R225-G229 PolarHBondContact O-N 3.32Å; Q226-G229 PolarHBondContact O-N 3.46Å; Q226-G229 VanDerWaalsContact O-N 3.16Å; K227-G229 VanDerWaalsContact C-N 3.32Å; K227-G229 PolarHBondContact O-N 3Å; G229-N231 PolarHBondContact O-N 2.76Å
230	R	66.9	Low	75.3	Confident	173 Å²	173	117.8 Å²	117.8	65%	0.653	60%	0.6	S	S	*	*			trans	-89.8	103.3	-179.7	-164.7	177.4	-178.6	179.9	-2.1	109.5	Q226 E232	Q226-R230 WeakPolarHBondContact O-CB 3.48Å; Q226-R230 PolarHBondContact O-N 3.28Å; R230-E232 HydrophobicContact CG-CG 3.93Å; R230-E232 PolarHBondContact O-N 2.65Å
231	N	59.5	Low	74.7	Confident	152 Å²	152	114.7 Å²	114.7	81%	0.813	59%	0.588	S	S	*	*			trans	-69.9	92	156.4	-70	-13.7	0	0	0	106.1	G229 D233	G229-N231 PolarHBondContact O-N 2.76Å; N231-D233 PolarHBondContact O-N 2.97Å
232	E	60.2	Low	74.3	Confident	137 Å²	137	114 Å²	114	64%	0.64	59%	0.585	S	S	*	*			trans	-60.6	110.9	165.4	-69.7	-178.3	168.1	0	0	106.3	R230 E234	R230-E232 HydrophobicContact CG-CG 3.93Å; R230-E232 PolarHBondContact O-N 2.65Å; E232-E234 PolarHBondContact O-N 3.47Å
233	D	59.5	Low	74	Confident	133 Å²	133	113.5 Å²	113.5	71%	0.711	58%	0.579	S	S	*	*			trans	-62.3	93.5	165.7	-80.9	-48.2	0	0	0	105.3	N231 A235 R357	N231-D233 PolarHBondContact O-N 2.97Å; D233-A235 PolarHBondContact O-N 2.78Å; D233-R357 IonicContact OD1-NH2 3.25Å; D233-R357 PolarHBondContact OD1-NH2 3.42Å
234	E	56.6	Low	73.7	Confident	184 Å²	184	116.2 Å²	116.2	86%	0.86	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-47.9	128.8	175.9	-88.2	-177.7	150.8	0	0	108.8	E232	E232-E234 PolarHBondContact O-N 3.47Å
235	A	59.3	Low	73.2	Confident	84 Å²	84	112.1 Å²	112.1	69%	0.694	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-53.5	143.1	174.1	0	0	0	0	0	109.4	D233 G237	D233-A235 PolarHBondContact O-N 2.78Å; A235-G237 PolarHBondContact O-N 2.91Å
236	P	61.3	Low	72.6	Confident	72 Å²	72	112.5 Å²	112.5	47%	0.468	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-57	118.7	-174.6	22.5	-32.4	0	0	0	110
237	G	60.8	Low	72.1	Confident	48 Å²	48	111.7 Å²	111.7	50%	0.495	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-57.6	154.7	-176.7	0	0	0	0	0	113.5	A235 E239	A235-G237 PolarHBondContact O-N 2.91Å; G237-E239 PolarHBondContact O-N 3.21Å
238	E	65.7	Low	71.7	Confident	140 Å²	140	105.8 Å²	105.8	65%	0.654	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-55.4	123.8	179.8	-67.4	-179	160.6	0	0	112.2	K240 V332	E238-K240 PolarHBondContact O-N 3.04Å; E238-K240 WeakPolarHBondContact OE2-CE 3.27Å; E238-K240 IonicContact OE2-NZ 2.7Å; E238-K240 PolarHBondContact OE2-NZ 3.05Å; E238-V332 WeakPolarHBondContact O-CB 3.42Å; E238-V332 WeakPolarHBondContact O-CG1 3.39Å
239	E	73.3	Confident	71.8	Confident	48 Å²	48	102.6 Å²	102.6	22%	0.224	54%	0.536	C	S	.	.	P	Polyproline II helix	trans	-75.9	119.7	179.1	-69.5	161.5	166.5	0	0	111.5	G237 V332 K360 W362 C369 R372	G237-E239 PolarHBondContact O-N 3.21Å; E239-V332 VanDerWaalsContact CA-O 3.32Å; E239-V332 WeakPolarHBondContact CA-O 3.31Å; E239-K360 WeakPolarHBondContact OE1-CE 3.45Å; E239-K360 IonicContact OE1-NZ 3.98Å; E239-K360 PolarHBondContact OE1-NZ 2.63Å; E239-W362 HydrophobicContact CB-CH2 4.31Å; E239-W362 HydrophobicContact CG-CH2 4.12Å; E239-C369 HydrophobicContact CG-CB 4.49Å; E239-C369 PolarHBondContact OE1-SG 2.91Å; E239-C369 WeakPolarHBondContact OE2-CB 3.44Å; E239-R372 IonicContact OE1-CZ 2.78Å; E239-R372 IonicContact OE1-NE 2.7Å; E239-R372 PolarHBondContact OE1-NE 2.87Å; E239-R372 IonicContact OE1-NH2 2.64Å; E239-R372 PolarHBondContact OE1-NH2 3.48Å; E239-R372 IonicContact OE2-CZ 3.16Å; E239-R372 IonicContact OE2-NE 3.38Å; E239-R372 IonicContact OE2-NH2 2.65Å; E239-R372 PolarHBondContact OE2-NH2 2.87Å
240	K	77.7	Confident	72.2	Confident	111 Å²	111	102.5 Å²	102.5	48%	0.483	52%	0.52	S	S	.	.			trans	-121.9	133.6	178.4	-60.4	177.2	-177.6	170.7	0	109.4	E238 I331 V332	E238-K240 PolarHBondContact O-N 3.04Å; E238-K240 WeakPolarHBondContact OE2-CE 3.27Å; E238-K240 IonicContact OE2-NZ 2.7Å; E238-K240 PolarHBondContact OE2-NZ 3.05Å; K240-I331 PolarHBondContact O-N 2.62Å; K240-I331 VanDerWaalsContact O-N 3.16Å; K240-V332 HydrophobicContact CB-CB 4.09Å; K240-V332 HydrophobicContact CB-CG2 3.74Å; K240-V332 HydrophobicContact CD-CG2 4.41Å; K240-V332 HydrophobicContact CG-CB 4.47Å; K240-V332 HydrophobicContact CG-CG2 4.27Å; K240-V332 PolarHBondContact O-N 2.91Å
241	T	83.3	Confident	72.9	Confident	40 Å²	40	104 Å²	104	25%	0.245	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	141.4	170.6	57.5	0	0	0	0	109.6	R328 T329 F330 W362 G367	T241-R328 PolarHBondContact OG1-NH2 2.98Å; T241-T329 WeakPolarHBondContact CA-O 3.33Å; T241-F330 HydrophobicContact CG2-CB 4.35Å; T241-F330 HydrophobicContact CG2-CD1 3.48Å; T241-F330 VanDerWaalsContact CG2-CD1 3.48Å; T241-F330 HydrophobicContact CG2-CE1 4.09Å; T241-F330 HydrophobicContact CG2-CG 4.18Å; T241-W362 HydrophobicContact CG2-CZ3 4.16Å; T241-G367 WeakPolarHBondContact CG2-O 3.01Å
242	I	85.4	Confident	74	Confident	79 Å²	79	101.1 Å²	101.1	41%	0.405	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	114.6	177.8	-57.8	-169.6	0	0	0	106.8	T329 I331	I242-T329 PolarHBondContact N-O 3.38Å; I242-T329 PolarHBondContact O-N 3.02Å; I242-I331 HydrophobicContact CB-CD1 4.23Å; I242-I331 HydrophobicContact CD1-CD1 3.35Å; I242-I331 HydrophobicContact CG1-CD1 3.72Å
243	L	86.3	Confident	75	Confident	55 Å²	55	97 Å²	97	29%	0.288	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	124.3	165	-170.9	72.9	0	0	0	107.5	V245 M248 Y256 L327 R328	L243-V245 WeakPolarHBondContact CD2-O 3.42Å; L243-V245 WeakPolarHBondContact CG-O 3.4Å; L243-M248 HydrophobicContact CD2-CB 3.98Å; L243-Y256 HydrophobicContact CD1-CE1 4.23Å; L243-L327 WeakPolarHBondContact CD1-O 3.43Å; L243-R328 HydrophobicContact CD1-CB 4.27Å; L243-R328 HydrophobicContact CD1-CG 4.32Å
244	H	83.8	Confident	76.2	Confident	99 Å²	99	95.3 Å²	95.3	46%	0.458	49%	0.486	S	S	.	.			trans	-91.1	-21.5	-179.5	-74.2	-69.4	0	0	0	112.5	C326 L327 T329	H244-C326 WeakPolarHBondContact CB-O 3.43Å; H244-L327 PolarHBondContact N-O 3.37Å; H244-T329 PolarHBondContact CD2-OG1 3.45Å; H244-T329 VanDerWaalsContact CD2-OG1 3.25Å; H244-T329 PolarHBondContact NE2-OG1 3.2Å
245	V	81.5	Confident	77.6	Confident	41 Å²	41	87.3 Å²	87.3	25%	0.248	45%	0.451	C	S	.	.	S	Bend	trans	-82.6	143.1	174.1	-172.7	0	0	0	0	109.6	L243 D247 L327	L243-V245 WeakPolarHBondContact CD2-O 3.42Å; L243-V245 WeakPolarHBondContact CG-O 3.4Å; V245-D247 WeakPolarHBondContact CG1-O 3.44Å; V245-L327 HydrophobicContact CG2-CD2 3.66Å
246	K	77.1	Confident	78.7	Confident	201 Å²	201	85.1 Å²	85.1	87%	0.874	43%	0.425	S	S	*	.	S	Bend	trans	-65.5	-40.4	180	-69.9	-179.3	179.3	178.5	0	112.2
247	D	75.9	Confident	79.8	Confident	123 Å²	123	82 Å²	82	66%	0.658	40%	0.404	S	S	*	.			trans	-115.6	126.4	-177.3	-55.5	-46.3	0	0	0	110.2	V245	V245-D247 WeakPolarHBondContact CG1-O 3.44Å
248	M	76.9	Confident	80.9	Confident	42 Å²	42	82.7 Å²	82.7	21%	0.207	40%	0.395	C	S	.	.	S	Bend	trans	-77.8	-26.2	177	176.8	171	168.6	0	0	112.4	L243 Y256 E365	L243-M248 HydrophobicContact CD2-CB 3.98Å; M248-Y256 HydrophobicContact CG-CE1 4.5Å; M248-E365 HydrophobicContact CE-CB 4.01Å; M248-E365 VanDerWaalsContact CE-O 3.25Å; M248-E365 WeakPolarHBondContact CE-O 3.23Å
249	Y	83.7	Confident	81.8	Confident	126 Å²	126	77.2 Å²	77.2	49%	0.494	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-116.1	143.3	-176.3	-61.8	-79.7	0	0	0	110	G253 R254	Y249-G253 WeakPolarHBondContact CD1-O 3.22Å; Y249-R254 WeakPolarHBondContact CA-O 3.46Å
250	D	82.2	Confident	82.2	Confident	64 Å²	64	76.4 Å²	76.4	34%	0.342	37%	0.369	S	S	.	.			trans	-72.2	179.2	170.9	76	2.3	0	0	0	111.7	Q252 G253 R254	D250-Q252 PolarHBondContact O-N 2.83Å; D250-Q252 VanDerWaalsContact O-N 3.08Å; D250-Q252 VanDerWaalsContact OD1-C 3.26Å; D250-Q252 VanDerWaalsContact OD1-CA 3.28Å; D250-Q252 WeakPolarHBondContact OD1-CA 3.17Å; D250-Q252 WeakPolarHBondContact OD1-CB 3.31Å; D250-Q252 PolarHBondContact OD1-N 3.32Å; D250-G253 PolarHBondContact O-N 2.79Å; D250-G253 PolarHBondContact OD1-N 2.86Å; D250-R254 PolarHBondContact N-O 3.4Å; D250-R254 WeakPolarHBondContact OD1-CB 3.32Å; D250-R254 PolarHBondContact OD1-N 3.03Å
251	Y	81.1	Confident	82.3	Confident	206 Å²	206	77.4 Å²	77.4	81%	0.808	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-13.8	177.9	67.3	-83.7	0	0	0	114.2
252	Q	82.6	Confident	82	Confident	91 Å²	91	82.2 Å²	82.2	43%	0.425	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	6.2	175.7	-54.1	-167.3	1.1	0	0	112.5	D250 R254	D250-Q252 PolarHBondContact O-N 2.83Å; D250-Q252 VanDerWaalsContact O-N 3.08Å; D250-Q252 VanDerWaalsContact OD1-C 3.26Å; D250-Q252 VanDerWaalsContact OD1-CA 3.28Å; D250-Q252 WeakPolarHBondContact OD1-CA 3.17Å; D250-Q252 WeakPolarHBondContact OD1-CB 3.31Å; D250-Q252 PolarHBondContact OD1-N 3.32Å; Q252-R254 VanDerWaalsContact C-N 3.28Å; Q252-R254 HydrophobicContact CB-CG 4.15Å; Q252-R254 PolarHBondContact O-N 2.78Å
253	G	81.8	Confident	81.7	Confident	50 Å²	50	79.7 Å²	79.7	52%	0.515	39%	0.388	S	S	.	.	S	Bend	trans	73.5	16.3	-176.8	0	0	0	0	0	114	Y249 D250	Y249-G253 WeakPolarHBondContact CD1-O 3.22Å; D250-G253 PolarHBondContact O-N 2.79Å; D250-G253 PolarHBondContact OD1-N 2.86Å
254	R	84.8	Confident	81.2	Confident	97 Å²	97	81.3 Å²	81.3	37%	0.366	42%	0.418	S	S	.	.			trans	-88.7	142.7	177.9	-56.7	172.2	174.3	168.2	1.9	110.1	Y249 D250 Q252 H258	Y249-R254 WeakPolarHBondContact CA-O 3.46Å; D250-R254 PolarHBondContact N-O 3.4Å; D250-R254 WeakPolarHBondContact OD1-CB 3.32Å; D250-R254 PolarHBondContact OD1-N 3.03Å; Q252-R254 VanDerWaalsContact C-N 3.28Å; Q252-R254 HydrophobicContact CB-CG 4.15Å; Q252-R254 PolarHBondContact O-N 2.78Å; R254-H258 HydrophobicContact CB-CB 4.09Å
255	S	84.8	Confident	80.9	Confident	16 Å²	16	79.3 Å²	79.3	11%	0.112	41%	0.413	C	S	.	.	B	Isolated β-bridge	trans	-72	161.7	173	67.3	0	0	0	0	110.8	L257 H258 E365	S255-L257 PolarHBondContact O-N 3.31Å; S255-H258 WeakPolarHBondContact O-CB 3.32Å; S255-H258 PolarHBondContact O-N 2.95Å; S255-E365 WeakPolarHBondContact CB-OE1 3.3Å; S255-E365 PolarHBondContact OG-OE1 3.11Å
256	Y	83.4	Confident	80.9	Confident	38 Å²	38	82.6 Å²	82.6	15%	0.149	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-5.1	173.7	54.8	-102.6	0	0	0	114.1	L243 M248 H258 H304 L305 L317 L327 S364 E365	L243-Y256 HydrophobicContact CD1-CE1 4.23Å; M248-Y256 HydrophobicContact CG-CE1 4.5Å; Y256-H258 VanDerWaalsContact C-N 3.31Å; Y256-H304 PolarHBondContact O-NE2 3.48Å; Y256-L305 HydrophobicContact CD2-CD1 4.19Å; Y256-L317 HydrophobicContact CD2-CD2 4.43Å; Y256-L317 HydrophobicContact CE2-CD1 4.06Å; Y256-L317 HydrophobicContact CE2-CD2 4.27Å; Y256-L327 HydrophobicContact CD2-CD1 3.93Å; Y256-L327 HydrophobicContact CG-CD1 4.11Å; Y256-S364 PolarHBondContact OH-O 2.98Å; Y256-E365 PolarHBondContact OH-O 2.83Å
257	L	83.7	Confident	81	Confident	8 Å²	8	73.2 Å²	73.2	4%	0.042	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-15.8	171.3	-56.5	-171.3	0	0	0	113.1	S255 V259 Y299 H304 L305 S364 E365	S255-L257 PolarHBondContact O-N 3.31Å; L257-V259 PolarHBondContact O-N 2.76Å; L257-Y299 HydrophobicContact CD2-CE2 4.06Å; L257-H304 PolarHBondContact O-CE1 3.1Å; L257-H304 VanDerWaalsContact O-CE1 3.29Å; L257-H304 PolarHBondContact O-NE2 3.2Å; L257-H304 VanDerWaalsContact O-NE2 3.15Å; L257-L305 HydrophobicContact CD2-CD1 3.48Å; L257-L305 VanDerWaalsContact CD2-CD1 3.48Å; L257-S364 WeakPolarHBondContact CD1-OG 3.43Å; L257-E365 HydrophobicContact CD1-CG 3.2Å; L257-E365 HydrophobicContact CG-CG 3.81Å
258	H	84.2	Confident	81.2	Confident	62 Å²	62	72.9 Å²	72.9	29%	0.287	38%	0.378	S	S	.	.	S	Bend	trans	-69.5	123.5	179.8	177.5	-82.8	0	0	0	109.9	R254 S255 Y256 P260 R268	R254-H258 HydrophobicContact CB-CB 4.09Å; S255-H258 WeakPolarHBondContact O-CB 3.32Å; S255-H258 PolarHBondContact O-N 2.95Å; Y256-H258 VanDerWaalsContact C-N 3.31Å; H258-P260 VanDerWaalsContact O-CD 3.23Å; H258-P260 WeakPolarHBondContact O-CD 3.28Å; H258-P260 VanDerWaalsContact O-N 3.12Å; H258-R268 PolarHBondContact NE2-NH2 3.19Å; H258-R268 VanDerWaalsContact NE2-NH2 3.14Å
259	V	83.9	Confident	81.2	Confident	24 Å²	24	72.4 Å²	72.4	15%	0.145	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-55	116.9	-178.9	-175.1	0	0	0	0	110.9	L257 L267 R268 S302	L257-V259 PolarHBondContact O-N 2.76Å; V259-L267 HydrophobicContact CG1-CB 3.68Å; V259-L267 HydrophobicContact CG1-CD1 4.41Å; V259-R268 HydrophobicContact CG1-CG 4.12Å; V259-S302 WeakPolarHBondContact CG2-OG 3.43Å
260	P	81.3	Confident	80.7	Confident	31 Å²	31	71 Å²	71	20%	0.201	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-63.2	142.1	178.3	-20.1	31.2	0	0	0	111.5	H258 D262 V263 H304	H258-P260 VanDerWaalsContact O-CD 3.23Å; H258-P260 WeakPolarHBondContact O-CD 3.28Å; H258-P260 VanDerWaalsContact O-N 3.12Å; P260-D262 WeakPolarHBondContact CB-OD1 3.41Å; P260-V263 HydrophobicContact CB-CG2 4.21Å; P260-H304 VanDerWaalsContact CD-CD2 3.42Å; P260-H304 WeakPolarHBondContact CD-CD2 3.42Å; P260-H304 HydrophobicContact CG-CB 4.26Å
261	Q	79.9	Confident	80.3	Confident	132 Å²	132	74 Å²	74	62%	0.617	41%	0.409	S	S	*	.	S	Bend	trans	-110.1	-8.3	179.1	-65.5	177.3	10.5	0	0	112.6	V263 R268	Q261-V263 VanDerWaalsContact C-N 3.26Å; Q261-R268 VanDerWaalsContact NE2-NH1 3.18Å
262	D	77.3	Confident	80	Confident	142 Å²	142	66.5 Å²	66.5	76%	0.759	39%	0.39	S	S	*	.	S	Bend	trans	-78.6	-10	177.6	59.7	-23	0	0	0	112.8	P260	P260-D262 WeakPolarHBondContact CB-OD1 3.41Å
263	V	80	Confident	79.9	Confident	25 Å²	25	63.2 Å²	63.2	15%	0.152	38%	0.377	C	S	.	.	S	Bend	trans	-74.9	132	173.4	-176.7	0	0	0	0	109.2	P260 Q261 V265 L267 Y321	P260-V263 HydrophobicContact CB-CG2 4.21Å; Q261-V263 VanDerWaalsContact C-N 3.26Å; V263-V265 HydrophobicContact CG1-CB 4.48Å; V263-V265 PolarHBondContact O-N 3.34Å; V263-L267 HydrophobicContact CB-CD1 4.18Å; V263-L267 HydrophobicContact CG1-CD1 4.4Å; V263-L267 HydrophobicContact CG2-CD1 4.07Å; V263-Y321 HydrophobicContact CG1-CD1 3.74Å; V263-Y321 HydrophobicContact CG1-CE1 3.68Å; V263-Y321 HydrophobicContact CG1-CG 4.3Å; V263-Y321 HydrophobicContact CG2-CD1 3.88Å; V263-Y321 HydrophobicContact CG2-CD2 4.14Å; V263-Y321 HydrophobicContact CG2-CG 3.67Å
264	G	74.3	Confident	79.7	Confident	90 Å²	90	69 Å²	69	93%	0.928	40%	0.396	S	S	*	.	S	Bend	trans	-63.9	2.8	-179.4	0	0	0	0	0	115.8
265	V	79.3	Confident	79.8	Confident	57 Å²	57	70 Å²	70	35%	0.345	40%	0.403	S	S	.	.	S	Bend	trans	-121.9	137.2	175.2	179.5	0	0	0	0	108.2	V263 L267 H564 E565	V263-V265 HydrophobicContact CG1-CB 4.48Å; V263-V265 PolarHBondContact O-N 3.34Å; V265-L267 PolarHBondContact O-N 3.07Å; V265-H564 HydrophobicContact CG1-CB 4.22Å; V265-E565 HydrophobicContact CG2-CG 4.32Å
266	N	80.5	Confident	79.9	Confident	110 Å²	110	69.3 Å²	69.3	59%	0.588	40%	0.398	S	S	*	.			trans	-76.4	94.5	-179.8	-173.4	3	0	0	0	111.5	R268 S269	N266-R268 PolarHBondContact O-N 3.17Å; N266-R268 VanDerWaalsContact O-N 3.11Å; N266-R268 PolarHBondContact OD1-N 3.42Å; N266-S269 WeakPolarHBondContact O-CB 3.15Å; N266-S269 PolarHBondContact O-N 2.77Å
267	L	79.8	Confident	80.2	Confident	3 Å²	3	73.6 Å²	73.6	2%	0.016	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-3.3	-179.9	-57	178	0	0	0	114.5	V259 V263 V265 S302 H304 Y321 H564	V259-L267 HydrophobicContact CG1-CB 3.68Å; V259-L267 HydrophobicContact CG1-CD1 4.41Å; V263-L267 HydrophobicContact CB-CD1 4.18Å; V263-L267 HydrophobicContact CG1-CD1 4.4Å; V263-L267 HydrophobicContact CG2-CD1 4.07Å; V265-L267 PolarHBondContact O-N 3.07Å; L267-S302 WeakPolarHBondContact O-CA 3.25Å; L267-S302 VanDerWaalsContact O-CB 3.31Å; L267-S302 WeakPolarHBondContact O-CB 3.45Å; L267-H304 HydrophobicContact CD1-CB 4.06Å; L267-Y321 HydrophobicContact CD1-CD2 3.99Å; L267-Y321 HydrophobicContact CD1-CE2 3.72Å; L267-Y321 HydrophobicContact CD2-CE2 3.96Å; L267-H564 HydrophobicContact CD2-CB 4.1Å; L267-H564 PolarHBondContact O-NE2 3.06Å
268	R	79.1	Confident	80.4	Confident	116 Å²	116	75 Å²	75	44%	0.438	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-13.6	174.6	-67.5	-172.1	176.7	161.3	-1.5	113.6	H258 V259 Q261 N266	H258-R268 PolarHBondContact NE2-NH2 3.19Å; H258-R268 VanDerWaalsContact NE2-NH2 3.14Å; V259-R268 HydrophobicContact CG1-CG 4.12Å; Q261-R268 VanDerWaalsContact NE2-NH1 3.18Å; N266-R268 PolarHBondContact O-N 3.17Å; N266-R268 VanDerWaalsContact O-N 3.11Å; N266-R268 PolarHBondContact OD1-N 3.42Å
269	S	77.6	Confident	80.6	Confident	33 Å²	33	72 Å²	72	23%	0.231	41%	0.408	C	S	.	.			trans	-61.1	140.9	178	-167.6	0	0	0	0	109.9	N266 D271 H564	N266-S269 WeakPolarHBondContact O-CB 3.15Å; N266-S269 PolarHBondContact O-N 2.77Å; S269-D271 VanDerWaalsContact C-N 3.32Å; S269-D271 PolarHBondContact OG-N 3.06Å; S269-H564 PolarHBondContact O-CE1 2.99Å
270	A	72.1	Confident	80.7	Confident	97 Å²	97	79.1 Å²	79.1	80%	0.802	44%	0.437	S	S	*	.			trans	-88.1	-10.8	168.9	0	0	0	0	0	111.7
271	D	74.8	Confident	81.1	Confident	125 Å²	125	85.4 Å²	85.4	67%	0.668	46%	0.461	S	S	*	.	S	Bend	trans	-77.6	127.5	-175.8	-59.2	-40.9	0	0	0	110.2	S269	S269-D271 VanDerWaalsContact C-N 3.32Å; S269-D271 PolarHBondContact OG-N 3.06Å
272	A	75.1	Confident	81.6	Confident	49 Å²	49	82.7 Å²	82.7	41%	0.405	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-64.1	144.2	170.5	0	0	0	0	0	109.6	P521	A272-P521 HydrophobicContact CB-CB 3.99Å
273	P	81.1	Confident	82.1	Confident	22 Å²	22	79.4 Å²	79.4	14%	0.143	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-57.7	143.1	174.2	22	-33.7	0	0	0	112.1	K275 P521 T566	P273-K275 PolarHBondContact O-N 3.3Å; P273-K275 VanDerWaalsContact O-N 3.11Å; P273-P521 HydrophobicContact CG-CB 3.95Å; P273-P521 HydrophobicContact CG-CG 4.27Å; P273-T566 HydrophobicContact CB-CG2 3.56Å; P273-T566 HydrophobicContact CG-CG2 4.16Å
274	D	77.3	Confident	82.5	Confident	171 Å²	171	80.6 Å²	80.6	91%	0.914	43%	0.434	S	S	*	.	S	Bend	trans	-55.1	-34.2	-176.4	-67.7	-24.4	0	0	0	113.8
275	K	85.4	Confident	83.3	Confident	120 Å²	120	78.9 Å²	78.9	52%	0.522	41%	0.406	S	S	.	.			trans	-154	127.5	-179.2	-170.8	171.6	-177.3	176.7	0	111.8	P273 Y277 T566	P273-K275 PolarHBondContact O-N 3.3Å; P273-K275 VanDerWaalsContact O-N 3.11Å; K275-Y277 HydrophobicContact CD-CE1 4.48Å; K275-T566 WeakPolarHBondContact O-CB 3.21Å; K275-T566 VanDerWaalsContact O-CG2 3.25Å; K275-T566 WeakPolarHBondContact O-CG2 3.36Å
276	C	87.5	Confident	83.9	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	39%	0.39	C	S	.	.			trans	-87.1	151.9	171.9	-65.1	0	0	0	0	111.4	D522 Y525 W561 T566	C276-D522 WeakPolarHBondContact CB-OD1 3.32Å; C276-D522 WeakPolarHBondContact CB-OD2 3.31Å; C276-D522 PolarHBondContact N-OD2 2.96Å; C276-D522 PolarHBondContact SG-OD1 3.27Å; C276-Y525 HydrophobicContact CB-CD2 4.24Å; C276-Y525 HydrophobicContact CB-CE2 4.38Å; C276-Y525 WeakPolarHBondContact O-CE2 3.43Å; C276-W561 HydrophobicContact CB-CZ2 3.96Å; C276-T566 CarbonylContact C-O 3.59Å; C276-T566 WeakPolarHBondContact CA-O 3.39Å; C276-T566 VanDerWaalsContact CB-O 3.29Å; C276-T566 WeakPolarHBondContact CB-O 3.45Å
277	Y	89.3	Confident	84.2	Confident	129 Å²	129	75.5 Å²	75.5	51%	0.506	39%	0.392	S	S	.	.			trans	-123.9	157.1	176.7	-64	-85.7	0	0	0	109.3	K275 W561 T566 S567	K275-Y277 HydrophobicContact CD-CE1 4.48Å; Y277-W561 VanDerWaalsContact O-CH2 3.31Å; Y277-W561 WeakPolarHBondContact O-CH2 3.38Å; Y277-W561 WeakPolarHBondContact O-CZ2 3.31Å; Y277-T566 PolarHBondContact N-O 3.44Å; Y277-S567 WeakPolarHBondContact O-CA 3.03Å; Y277-S567 PolarHBondContact O-OG 3.47Å
278	L	88.1	Confident	84.3	Confident	37 Å²	37	76.7 Å²	76.7	19%	0.194	41%	0.406	C	S	.	.			trans	-84.3	137.3	178.2	-68.3	83.6	0	0	0	110.1	Y525 I537 H547 S567	L278-Y525 HydrophobicContact CD1-CD1 4.25Å; L278-Y525 HydrophobicContact CD1-CD2 4.42Å; L278-Y525 HydrophobicContact CD1-CE1 3.59Å; L278-Y525 HydrophobicContact CD1-CE2 3.77Å; L278-Y525 WeakPolarHBondContact CD1-OH 3.25Å; L278-Y525 HydrophobicContact CG-CE1 4.38Å; L278-Y525 HydrophobicContact CG-CE2 4.49Å; L278-I537 HydrophobicContact CD2-CB 4.14Å; L278-I537 HydrophobicContact CD2-CD1 4.16Å; L278-I537 HydrophobicContact CD2-CG2 3.73Å; L278-I537 HydrophobicContact CG-CD1 4.48Å; L278-I537 HydrophobicContact CG-CG2 4.16Å; L278-H547 HydrophobicContact CD2-CB 3.71Å; L278-S567 PolarHBondContact O-OG 3.44Å
279	P	88.8	Confident	84.7	Confident	0 Å²	0	72 Å²	72	0%	0	39%	0.388	C	S	.	.			trans	-67.9	146.6	173.6	27.7	-34.4	0	0	0	111.7	I537 I549 S567 V569 W581 D582	P279-I537 HydrophobicContact CG-CD1 4.25Å; P279-I549 HydrophobicContact CG-CD1 4.46Å; P279-I549 WeakPolarHBondContact O-CD1 3.31Å; P279-S567 WeakPolarHBondContact CB-O 3.43Å; P279-V569 HydrophobicContact CG-CB 4.14Å; P279-V569 HydrophobicContact CG-CG2 3.83Å; P279-W581 HydrophobicContact CB-CB 3.62Å; P279-W581 HydrophobicContact CG-CB 4.01Å; P279-D582 VanDerWaalsContact CA-C 3.41Å; P279-D582 WeakPolarHBondContact CA-OXT 3.46Å
280	K	87	Confident	85.3	Confident	173 Å²	173	75.7 Å²	75.7	75%	0.752	41%	0.41	S	S	*	.			trans	-124.7	-26.9	179.7	-66.1	-178.2	-176.6	176.1	0	113	D582	K280-D582 PolarHBondContact N-O 3.05Å
281	K	88.5	Confident	86.2	Confident	163 Å²	163	76.9 Å²	76.9	71%	0.709	40%	0.397	S	S	*	.	S	Bend	trans	-122.5	142	-173.6	-66	-178	-179.4	178.5	0	109.9	W581 D582	K281-W581 CarbonylContact O-C 3.57Å; K281-W581 WeakPolarHBondContact O-CA 3.39Å; K281-D582 PolarHBondContact N-O 3.09Å; K281-D582 PolarHBondContact O-N 3.08Å
282	Q	90.2	Very high	86.9	Confident	75 Å²	75	71.2 Å²	71.2	35%	0.35	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	121.3	168	-164.3	-172.9	-25.7	0	0	108.5	K579 W581	Q282-K579 HydrophobicContact CG-CB 4.36Å; Q282-W581 HydrophobicContact CB-CD2 4.36Å; Q282-W581 HydrophobicContact CB-CE3 3.81Å; Q282-W581 HydrophobicContact CB-CH2 3.9Å; Q282-W581 HydrophobicContact CB-CZ2 4.42Å; Q282-W581 HydrophobicContact CB-CZ3 3.58Å; Q282-W581 HydrophobicContact CG-CD2 4.36Å; Q282-W581 HydrophobicContact CG-CE3 4.28Å; Q282-W581 HydrophobicContact CG-CH2 4.05Å; Q282-W581 HydrophobicContact CG-CZ2 4.1Å; Q282-W581 HydrophobicContact CG-CZ3 4.15Å
283	I	88.9	Confident	87.8	Confident	72 Å²	72	68.9 Å²	68.9	37%	0.369	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-43.3	177.8	-46.8	-178.4	0	0	0	111	L580 D582	I283-L580 HydrophobicContact CB-CD2 3.78Å; I283-L580 HydrophobicContact CD1-CD2 3.63Å; I283-L580 HydrophobicContact CG1-CD2 3.83Å; I283-L580 PolarHBondContact N-O 2.76Å; I283-D582 HydrophobicContact CD1-CB 3.22Å; I283-D582 WeakPolarHBondContact CD1-OD2 3.41Å; I283-D582 HydrophobicContact CG1-CB 3.76Å
284	H	87.9	Confident	88.2	Confident	51 Å²	51	68 Å²	68	24%	0.236	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	152.5	-169.8	-161.3	62.7	0	0	0	113.6	W286 K579 L580	H284-W286 AromaticContact CD2-CD1 3.51Å; H284-W286 AromaticContact CD2-CD2 3.71Å; H284-W286 AromaticContact CD2-CE2 3.56Å; H284-W286 AromaticContact CD2-CG 3.75Å; H284-W286 AromaticContact CD2-NE1 3.42Å; H284-W286 PolarHBondContact CD2-NE1 3.43Å; H284-W286 AromaticContact NE2-CD1 3.44Å; H284-W286 AromaticContact NE2-NE1 3.61Å; H284-K579 WeakPolarHBondContact O-CA 3.45Å; H284-L580 HydrophobicContact CB-CB 4.31Å; H284-L580 PolarHBondContact N-O 3.38Å; H284-L580 PolarHBondContact O-N 2.72Å
285	V	92.1	Very high	88.9	Confident	54 Å²	54	60.1 Å²	60.1	33%	0.327	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	113.5	169.9	-179.4	0	0	0	0	107.4	S287 Q577 I578 K579	V285-S287 PolarHBondContact O-N 3.03Å; V285-Q577 HydrophobicContact CG1-CB 4.29Å; V285-Q577 HydrophobicContact CG1-CG 4.26Å; V285-I578 WeakPolarHBondContact CA-O 3.36Å; V285-K579 HydrophobicContact CG2-CG 4.46Å
286	W	91.2	Very high	89.2	Confident	3 Å²	3	54.4 Å²	54.4	1%	0.011	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	108.4	163.3	-60.7	-75.8	0	0	0	108.4	H284 L306 W318 R324 I570 I578 L580	H284-W286 AromaticContact CD2-CD1 3.51Å; H284-W286 AromaticContact CD2-CD2 3.71Å; H284-W286 AromaticContact CD2-CE2 3.56Å; H284-W286 AromaticContact CD2-CG 3.75Å; H284-W286 AromaticContact CD2-NE1 3.42Å; H284-W286 PolarHBondContact CD2-NE1 3.43Å; H284-W286 AromaticContact NE2-CD1 3.44Å; H284-W286 AromaticContact NE2-NE1 3.61Å; W286-L306 HydrophobicContact CH2-CD1 4.44Å; W286-L306 HydrophobicContact CZ3-CD1 4.35Å; W286-W318 HydrophobicContact CB-CD2 4.12Å; W286-W318 HydrophobicContact CB-CE3 3.91Å; W286-W318 HydrophobicContact CB-CH2 4.07Å; W286-W318 HydrophobicContact CB-CZ2 4.28Å; W286-W318 HydrophobicContact CB-CZ3 3.87Å; W286-W318 AromaticContact CD1-CD2 3.91Å; W286-W318 AromaticContact CD1-CE3 3.33Å; W286-W318 AromaticContact CD1-CZ3 3.86Å; W286-W318 HydrophobicContact CG-CD2 4.08Å; W286-W318 AromaticContact CG-CE3 3.83Å; W286-W318 HydrophobicContact CG-CE3 3.83Å; W286-W318 HydrophobicContact CG-CG 4.49Å; W286-W318 HydrophobicContact CG-CZ3 4.22Å; W286-R324 PolarHBondContact NE1-O 2.96Å; W286-R324 VanDerWaalsContact NE1-O 3.15Å; W286-I570 HydrophobicContact CH2-CD1 4.36Å; W286-I570 HydrophobicContact CZ3-CG2 3.91Å; W286-I578 HydrophobicContact CB-CB 4.14Å; W286-I578 HydrophobicContact CD2-CB 4.47Å; W286-I578 HydrophobicContact CD2-CG2 4.49Å; W286-I578 HydrophobicContact CE3-CB 3.69Å; W286-I578 HydrophobicContact CE3-CG2 3.42Å; W286-I578 VanDerWaalsContact CE3-CG2 3.42Å; W286-I578 HydrophobicContact CZ3-CB 4.5Å; W286-I578 HydrophobicContact CZ3-CG2 3.74Å; W286-I578 PolarHBondContact N-O 3.02Å; W286-I578 PolarHBondContact O-N 3.25Å; W286-L580 HydrophobicContact CH2-CB 3.84Å; W286-L580 HydrophobicContact CH2-CD1 3.69Å; W286-L580 HydrophobicContact CH2-CG 4.4Å; W286-L580 HydrophobicContact CZ2-CD1 4.46Å; W286-L580 HydrophobicContact CZ3-CB 3.78Å; W286-L580 HydrophobicContact CZ3-CD1 4.43Å
287	S	86.8	Confident	89.5	Confident	92 Å²	92	56.7 Å²	56.7	64%	0.643	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.6	173.9	-174	0	0	0	0	109.1	V285	V285-S287 PolarHBondContact O-N 3.03Å
288	G	81.9	Confident	89.6	Confident	29 Å²	29	51.6 Å²	51.6	30%	0.299	27%	0.267	S	S	.	.			trans	171.9	-13.2	178.2	0	0	0	0	0	115.1	K316	G288-K316 VanDerWaalsContact C-NZ 3.3Å; G288-K316 PolarHBondContact O-NZ 3.13Å
289	H	88.1	Confident	89.6	Confident	16 Å²	16	50.8 Å²	50.8	7%	0.074	26%	0.261	C	S	.	.			trans	-85.5	140.7	168.3	-73.2	-69.8	0	0	0	110.2	K291 V293 S308 S310 D312	H289-K291 WeakPolarHBondContact CB-O 3.32Å; H289-V293 HydrophobicContact CB-CG2 4.32Å; H289-S308 PolarHBondContact NE2-OG 2.87Å; H289-S310 VanDerWaalsContact CE1-CB 3.49Å; H289-S310 WeakPolarHBondContact CE1-CB 3.46Å; H289-S310 WeakPolarHBondContact ND1-CB 3.41Å; H289-D312 WeakPolarHBondContact CA-OD2 3.32Å; H289-D312 IonicContact CG-OD2 3.9Å; H289-D312 IonicContact ND1-OD1 3.83Å; H289-D312 IonicContact ND1-OD2 3.99Å; H289-D312 PolarHBondContact ND1-OD2 3.01Å; H289-D312 VanDerWaalsContact ND1-OD2 3.1Å
290	T	89.3	Confident	89.5	Confident	111 Å²	111	52 Å²	52	68%	0.681	27%	0.27	S	S	*	.	S	Bend	trans	-87	-20.9	178.4	56.4	0	0	0	0	112.2	D312	T290-D312 PolarHBondContact N-OD2 2.87Å; T290-D312 VanDerWaalsContact OG1-CB 3.32Å; T290-D312 WeakPolarHBondContact OG1-CB 3.2Å
291	K	91.2	Very high	89.2	Confident	122 Å²	122	53 Å²	53	53%	0.53	27%	0.269	S	S	.	.	S	Bend	trans	-124.5	172.4	176.6	-64.1	-177.2	-178.6	173.2	0	110.3	H289 S310 M311 D312 G576	H289-K291 WeakPolarHBondContact CB-O 3.32Å; K291-S310 PolarHBondContact O-OG 3.49Å; K291-M311 HydrophobicContact CB-CB 3.96Å; K291-M311 HydrophobicContact CD-CB 4.21Å; K291-M311 WeakPolarHBondContact CD-O 3.45Å; K291-D312 HydrophobicContact CB-CB 4.09Å; K291-D312 HydrophobicContact CD-CB 4.39Å; K291-D312 HydrophobicContact CG-CB 4.2Å; K291-G576 VanDerWaalsContact O-CA 3.31Å; K291-G576 WeakPolarHBondContact O-CA 3.46Å
292	G	89.7	Confident	88.8	Confident	7 Å²	7	45.4 Å²	45.4	7%	0.072	24%	0.236	C	C	.	.			trans	-53.1	137.8	178.9	0	0	0	0	0	113.8	S310 M311 W574	G292-S310 WeakPolarHBondContact O-CA 3.07Å; G292-S310 PolarHBondContact O-OG 2.78Å; G292-M311 PolarHBondContact O-N 2.82Å; G292-W574 WeakPolarHBondContact CA-O 3.13Å
293	V	92.8	Very high	88.5	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	127.4	174.5	176.5	0	0	0	0	108.1	H289 I296 S309 I557 C572 G573 I578	H289-V293 HydrophobicContact CB-CG2 4.32Å; V293-I296 HydrophobicContact CG1-CD1 4.4Å; V293-I296 HydrophobicContact CG1-CG1 3.97Å; V293-S309 CarbonylContact C-O 3.24Å; V293-S309 WeakPolarHBondContact CA-O 3.5Å; V293-S309 VanDerWaalsContact CG1-O 3.3Å; V293-S309 WeakPolarHBondContact CG1-O 3.29Å; V293-I557 WeakPolarHBondContact O-CD1 3.4Å; V293-C572 HydrophobicContact CB-CB 3.9Å; V293-C572 HydrophobicContact CG1-CB 3.69Å; V293-G573 PolarHBondContact N-O 3.35Å; V293-G573 VanDerWaalsContact N-O 3.15Å; V293-I578 HydrophobicContact CG1-CG1 4.46Å; V293-I578 HydrophobicContact CG2-CD1 4.45Å; V293-I578 HydrophobicContact CG2-CG1 4.04Å
294	S	91.1	Very high	88.4	Confident	4 Å²	4	38.5 Å²	38.5	3%	0.028	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	-36.6	-173.6	55.1	0	0	0	0	113.8	S309 V338 R339	S294-S309 PolarHBondContact N-O 3.07Å; S294-S309 WeakPolarHBondContact OG-CB 3.38Å; S294-S309 PolarHBondContact OG-O 2.81Å; S294-S309 VanDerWaalsContact OG-O 3.09Å; S294-S309 PolarHBondContact OG-OG 3.15Å; S294-V338 VanDerWaalsContact CB-O 3.3Å; S294-V338 WeakPolarHBondContact CB-O 3.4Å; S294-V338 PolarHBondContact OG-O 3.41Å; S294-R339 PolarHBondContact O-NH1 2.86Å
295	A	90.4	Very high	88.6	Confident	4 Å²	4	36.1 Å²	36.1	3%	0.033	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	153.9	178.1	0	0	0	0	0	110.7	S309 I341	A295-S309 WeakPolarHBondContact CB-OG 3.36Å; A295-S309 PolarHBondContact N-OG 3.29Å; A295-S309 VanDerWaalsContact N-OG 3.16Å; A295-S309 PolarHBondContact O-N 2.95Å; A295-S309 PolarHBondContact O-OG 3.3Å; A295-I341 HydrophobicContact CB-CG1 4.19Å
296	I	93.1	Very high	88.5	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	140.6	173.1	-72.9	-172.4	0	0	0	109.1	V293 L306 L307 L560 I570 C572 I578	V293-I296 HydrophobicContact CG1-CD1 4.4Å; V293-I296 HydrophobicContact CG1-CG1 3.97Å; I296-L306 HydrophobicContact CD1-CD1 4.43Å; I296-L306 HydrophobicContact CD1-CD2 4.36Å; I296-L306 HydrophobicContact CG1-CD2 4.48Å; I296-L306 HydrophobicContact CG2-CD1 3.7Å; I296-L306 HydrophobicContact CG2-CD2 4.08Å; I296-L306 HydrophobicContact CG2-CG 3.79Å; I296-L307 WeakPolarHBondContact CA-O 3.46Å; I296-L560 HydrophobicContact CG2-CD1 4.24Å; I296-I570 HydrophobicContact CD1-CG2 4.26Å; I296-C572 HydrophobicContact CD1-CB 3.39Å; I296-C572 HydrophobicContact CG1-CB 3.96Å; I296-I578 HydrophobicContact CD1-CB 4.18Å; I296-I578 HydrophobicContact CD1-CD1 3.87Å; I296-I578 HydrophobicContact CD1-CG1 3.88Å; I296-I578 HydrophobicContact CD1-CG2 3.33Å; I296-I578 HydrophobicContact CG1-CD1 4.48Å
297	R	92.7	Very high	88.6	Confident	48 Å²	48	33.4 Å²	33.4	18%	0.181	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	133.1	169.3	-63.5	-65.6	-179.8	-165.7	-13.2	110.1	L307 D340 I341 F343 K383	R297-L307 PolarHBondContact N-O 3.26Å; R297-L307 PolarHBondContact O-N 3.06Å; R297-D340 IonicContact NE-OD1 3.89Å; R297-D340 IonicContact NH2-OD1 3.8Å; R297-D340 PolarHBondContact NH2-OD1 3.21Å; R297-I341 HydrophobicContact CB-CD1 4.34Å; R297-I341 HydrophobicContact CG-CD1 4.16Å; R297-I341 HydrophobicContact CG-CG1 4Å; R297-I341 VanDerWaalsContact CG-O 3.24Å; R297-I341 WeakPolarHBondContact CG-O 3.16Å; R297-I341 PolarHBondContact NE-O 3.11Å; R297-F343 HydrophobicContact CB-CD2 4.22Å; R297-F343 HydrophobicContact CB-CE2 4.48Å; R297-K383 VanDerWaalsContact NH2-NZ 3.18Å
298	L	91.6	Very high	88.8	Confident	21 Å²	21	29 Å²	29	11%	0.11	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	154.6	166.8	-75.6	-177.2	0	0	0	110.8	L306 V320 L560 I570	L298-L306 HydrophobicContact CD2-CB 4.18Å; L298-L306 HydrophobicContact CD2-CD1 4.24Å; L298-L306 HydrophobicContact CD2-CG 4.44Å; L298-V320 HydrophobicContact CD2-CG2 4.03Å; L298-L560 HydrophobicContact CB-CD1 4.48Å; L298-L560 HydrophobicContact CB-CD2 4.43Å; L298-L560 HydrophobicContact CD1-CD2 3.51Å; L298-L560 HydrophobicContact CG-CD1 4.15Å; L298-L560 HydrophobicContact CG-CD2 3.86Å; L298-I570 HydrophobicContact CD2-CD1 3.79Å
299	Y	89.4	Confident	89.3	Confident	20 Å²	20	27.6 Å²	27.6	8%	0.078	13%	0.13	C	C	.	.	P	Polyproline II helix	trans	-58.9	133.3	172	-166.4	-93.2	0	0	0	110.4	L257 S302 G303 H304 L305 F343 S346 G347	L257-Y299 HydrophobicContact CD2-CE2 4.06Å; Y299-S302 WeakPolarHBondContact CD1-OG 3.26Å; Y299-G303 WeakPolarHBondContact O-CA 3.38Å; Y299-G303 PolarHBondContact O-N 3.35Å; Y299-H304 AromaticContact CD1-CE1 3.38Å; Y299-H304 WeakPolarHBondContact CD1-CE1 3.4Å; Y299-H304 AromaticContact CD1-ND1 3.62Å; Y299-H304 AromaticContact CE1-CE1 3.56Å; Y299-H304 AromaticContact CG-CE1 3.7Å; Y299-H304 AromaticContact CG-ND1 3.94Å; Y299-L305 WeakPolarHBondContact CB-O 3.23Å; Y299-L305 HydrophobicContact CD2-CB 4.22Å; Y299-L305 HydrophobicContact CD2-CD1 3.88Å; Y299-L305 HydrophobicContact CD2-CG 4.43Å; Y299-L305 HydrophobicContact CE2-CD1 4.2Å; Y299-L305 HydrophobicContact CG-CB 4.41Å; Y299-L305 PolarHBondContact N-O 3.06Å; Y299-F343 HydrophobicContact CD2-CE1 4.2Å; Y299-F343 HydrophobicContact CD2-CZ 4.1Å; Y299-S346 PolarHBondContact OH-O 2.94Å; Y299-G347 WeakPolarHBondContact CE2-O 3.38Å; Y299-G347 WeakPolarHBondContact OH-CA 3.28Å
300	P	85.1	Confident	89.4	Confident	26 Å²	26	26.9 Å²	26.9	17%	0.169	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	147.1	-179	28.8	-39.5	0	0	0	111.1	S302 F343 N344 N345	P300-S302 PolarHBondContact O-N 3.4Å; P300-F343 HydrophobicContact CG-CB 4.3Å; P300-N344 WeakPolarHBondContact CG-O 3.41Å; P300-N345 WeakPolarHBondContact CB-O 2.99Å; P300-N345 WeakPolarHBondContact CG-O 3.37Å
301	R	80.4	Confident	89.5	Confident	195 Å²	195	24.7 Å²	24.7	74%	0.736	11%	0.109	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.3	-32.7	176.5	-167.7	175.4	-177.9	169	2.9	117.4	H564	R301-H564 PolarHBondContact O-CE1 3.28Å; R301-H564 PolarHBondContact O-NE2 3.34Å
302	S	80.9	Confident	89.4	Confident	2 Å²	2	19.6 Å²	19.6	1%	0.014	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.4	-19.1	-172	57.4	0	0	0	0	115.5	V259 L267 Y299 P300 H304 H564	V259-S302 WeakPolarHBondContact CG2-OG 3.43Å; L267-S302 WeakPolarHBondContact O-CA 3.25Å; L267-S302 VanDerWaalsContact O-CB 3.31Å; L267-S302 WeakPolarHBondContact O-CB 3.45Å; Y299-S302 WeakPolarHBondContact CD1-OG 3.26Å; P300-S302 PolarHBondContact O-N 3.4Å; S302-H304 PolarHBondContact O-N 3.3Å; S302-H304 PolarHBondContact OG-CE1 3.14Å; S302-H304 PolarHBondContact OG-ND1 2.87Å; S302-H564 PolarHBondContact O-CD2 3.25Å
303	G	83.3	Confident	89.4	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	9%	0.094	C	C	.	.			trans	64.5	6.7	174.6	0	0	0	0	0	116.7	Y299 L305 V320 H562	Y299-G303 WeakPolarHBondContact O-CA 3.38Å; Y299-G303 PolarHBondContact O-N 3.35Å; G303-L305 VanDerWaalsContact C-N 3.34Å; G303-L305 PolarHBondContact O-N 2.97Å; G303-V320 WeakPolarHBondContact O-CG2 3.21Å; G303-H562 PolarHBondContact O-NE2 3.38Å
304	H	88.3	Confident	89.2	Confident	2 Å²	2	23.4 Å²	23.4	1%	0.009	11%	0.106	C	C	.	.			trans	-72.1	-24.3	-175	69.8	-72.9	0	0	0	114.6	Y256 L257 P260 L267 Y299 S302 V320 Y321	Y256-H304 PolarHBondContact O-NE2 3.48Å; L257-H304 PolarHBondContact O-CE1 3.1Å; L257-H304 VanDerWaalsContact O-CE1 3.29Å; L257-H304 PolarHBondContact O-NE2 3.2Å; L257-H304 VanDerWaalsContact O-NE2 3.15Å; P260-H304 VanDerWaalsContact CD-CD2 3.42Å; P260-H304 WeakPolarHBondContact CD-CD2 3.42Å; P260-H304 HydrophobicContact CG-CB 4.26Å; L267-H304 HydrophobicContact CD1-CB 4.06Å; Y299-H304 AromaticContact CD1-CE1 3.38Å; Y299-H304 WeakPolarHBondContact CD1-CE1 3.4Å; Y299-H304 AromaticContact CD1-ND1 3.62Å; Y299-H304 AromaticContact CE1-CE1 3.56Å; Y299-H304 AromaticContact CG-CE1 3.7Å; Y299-H304 AromaticContact CG-ND1 3.94Å; S302-H304 PolarHBondContact O-N 3.3Å; S302-H304 PolarHBondContact OG-CE1 3.14Å; S302-H304 PolarHBondContact OG-ND1 2.87Å; H304-V320 WeakPolarHBondContact O-CB 3.28Å; H304-V320 PolarHBondContact O-N 3.05Å; H304-Y321 HydrophobicContact CB-CD2 4.03Å; H304-Y321 HydrophobicContact CB-CE2 4.35Å
305	L	90.6	Very high	89.3	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	154.3	173.2	-55.1	169.8	0	0	0	110.9	Y256 L257 Y299 G303 L317 W318 L327	Y256-L305 HydrophobicContact CD2-CD1 4.19Å; L257-L305 HydrophobicContact CD2-CD1 3.48Å; L257-L305 VanDerWaalsContact CD2-CD1 3.48Å; Y299-L305 WeakPolarHBondContact CB-O 3.23Å; Y299-L305 HydrophobicContact CD2-CB 4.22Å; Y299-L305 HydrophobicContact CD2-CD1 3.88Å; Y299-L305 HydrophobicContact CD2-CG 4.43Å; Y299-L305 HydrophobicContact CE2-CD1 4.2Å; Y299-L305 HydrophobicContact CG-CB 4.41Å; Y299-L305 PolarHBondContact N-O 3.06Å; G303-L305 VanDerWaalsContact C-N 3.34Å; G303-L305 PolarHBondContact O-N 2.97Å; L305-L317 HydrophobicContact CB-CD2 4.12Å; L305-L317 HydrophobicContact CD1-CD2 4.1Å; L305-L317 HydrophobicContact CD2-CD2 3.88Å; L305-L317 HydrophobicContact CG-CD2 4.24Å; L305-W318 WeakPolarHBondContact CA-O 3.46Å; L305-L327 HydrophobicContact CD2-CD1 3.44Å; L305-L327 VanDerWaalsContact CD2-CD1 3.44Å
306	L	91.6	Very high	89.3	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	126.7	175.4	-178.1	151.4	0	0	0	110	W286 I296 L298 L317 W318 V320 I570 I578	W286-L306 HydrophobicContact CH2-CD1 4.44Å; W286-L306 HydrophobicContact CZ3-CD1 4.35Å; I296-L306 HydrophobicContact CD1-CD1 4.43Å; I296-L306 HydrophobicContact CD1-CD2 4.36Å; I296-L306 HydrophobicContact CG1-CD2 4.48Å; I296-L306 HydrophobicContact CG2-CD1 3.7Å; I296-L306 HydrophobicContact CG2-CD2 4.08Å; I296-L306 HydrophobicContact CG2-CG 3.79Å; L298-L306 HydrophobicContact CD2-CB 4.18Å; L298-L306 HydrophobicContact CD2-CD1 4.24Å; L298-L306 HydrophobicContact CD2-CG 4.44Å; L306-L317 CarbonylContact O-C 3.59Å; L306-L317 WeakPolarHBondContact O-CA 3.44Å; L306-W318 HydrophobicContact CB-CB 4.3Å; L306-W318 HydrophobicContact CD2-CB 4.41Å; L306-W318 HydrophobicContact CD2-CG 4.26Å; L306-W318 PolarHBondContact N-O 2.79Å; L306-W318 PolarHBondContact O-N 2.84Å; L306-V320 HydrophobicContact CB-CG2 3.84Å; L306-I570 HydrophobicContact CD1-CB 4.41Å; L306-I570 HydrophobicContact CD1-CD1 3.74Å; L306-I570 HydrophobicContact CD1-CG2 3.55Å; L306-I578 HydrophobicContact CD1-CG2 4.44Å; L306-I578 HydrophobicContact CD2-CD1 3.99Å
307	L	91.8	Very high	89.2	Confident	0 Å²	0	24 Å²	24	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	135.4	165.6	-82.5	178.6	0	0	0	110.4	I296 R297 I315 K316 L317 I341 F343 F350	I296-L307 WeakPolarHBondContact CA-O 3.46Å; R297-L307 PolarHBondContact N-O 3.26Å; R297-L307 PolarHBondContact O-N 3.06Å; L307-I315 HydrophobicContact CD2-CG2 4.02Å; L307-K316 WeakPolarHBondContact CA-O 3.33Å; L307-L317 HydrophobicContact CD2-CB 3.82Å; L307-L317 HydrophobicContact CD2-CD1 4.04Å; L307-L317 HydrophobicContact CD2-CG 3.87Å; L307-I341 HydrophobicContact CB-CD1 3.65Å; L307-I341 WeakPolarHBondContact O-CD1 3.19Å; L307-F343 HydrophobicContact CB-CE2 3.92Å; L307-F343 HydrophobicContact CB-CZ 4.11Å; L307-F343 HydrophobicContact CD1-CD1 3.98Å; L307-F343 HydrophobicContact CD1-CD2 3.99Å; L307-F343 HydrophobicContact CD1-CE1 3.39Å; L307-F343 HydrophobicContact CD1-CE2 3.39Å; L307-F343 HydrophobicContact CD1-CG 4.28Å; L307-F343 HydrophobicContact CD1-CZ 3.1Å; L307-F343 HydrophobicContact CD2-CZ 4.45Å; L307-F343 HydrophobicContact CG-CE1 4.02Å; L307-F343 HydrophobicContact CG-CE2 3.6Å; L307-F343 HydrophobicContact CG-CZ 3.27Å; L307-F350 HydrophobicContact CD1-CB 3.84Å; L307-F350 HydrophobicContact CD1-CD1 4.11Å; L307-F350 HydrophobicContact CD1-CD2 3.99Å; L307-F350 HydrophobicContact CD1-CG 3.71Å
308	S	92.1	Very high	89.2	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	134.3	171.3	65.2	0	0	0	0	111	H289 I315 K316 W318	H289-S308 PolarHBondContact NE2-OG 2.87Å; S308-I315 CarbonylContact O-C 3.52Å; S308-I315 WeakPolarHBondContact O-CA 3.43Å; S308-I315 WeakPolarHBondContact O-CG2 3.44Å; S308-K316 PolarHBondContact N-O 3.35Å; S308-K316 PolarHBondContact O-N 3.37Å; S308-K316 PolarHBondContact OG-O 3.39Å; S308-W318 PolarHBondContact OG-NE1 2.86Å
309	S	91.4	Very high	89.1	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	143.6	169.5	60	0	0	0	0	109.9	V293 S294 A295	V293-S309 CarbonylContact C-O 3.24Å; V293-S309 WeakPolarHBondContact CA-O 3.5Å; V293-S309 VanDerWaalsContact CG1-O 3.3Å; V293-S309 WeakPolarHBondContact CG1-O 3.29Å; S294-S309 PolarHBondContact N-O 3.07Å; S294-S309 WeakPolarHBondContact OG-CB 3.38Å; S294-S309 PolarHBondContact OG-O 2.81Å; S294-S309 VanDerWaalsContact OG-O 3.09Å; S294-S309 PolarHBondContact OG-OG 3.15Å; A295-S309 WeakPolarHBondContact CB-OG 3.36Å; A295-S309 PolarHBondContact N-OG 3.29Å; A295-S309 VanDerWaalsContact N-OG 3.16Å; A295-S309 PolarHBondContact O-N 2.95Å; A295-S309 PolarHBondContact O-OG 3.3Å
310	S	91.3	Very high	88.9	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	161.4	179.3	174.1	0	0	0	0	112.7	H289 K291 G292 D312 C313 K314 V338	H289-S310 VanDerWaalsContact CE1-CB 3.49Å; H289-S310 WeakPolarHBondContact CE1-CB 3.46Å; H289-S310 WeakPolarHBondContact ND1-CB 3.41Å; K291-S310 PolarHBondContact O-OG 3.49Å; G292-S310 WeakPolarHBondContact O-CA 3.07Å; G292-S310 PolarHBondContact O-OG 2.78Å; S310-D312 WeakPolarHBondContact CB-OD1 3.24Å; S310-D312 PolarHBondContact O-N 2.93Å; S310-D312 VanDerWaalsContact OG-CG 3.3Å; S310-D312 PolarHBondContact OG-N 2.91Å; S310-D312 PolarHBondContact OG-OD1 3.41Å; S310-C313 PolarHBondContact O-N 3.46Å; S310-K314 PolarHBondContact N-O 3.13Å; S310-K314 VanDerWaalsContact N-O 3.13Å; S310-V338 PolarHBondContact O-N 2.97Å
311	M	90.4	Very high	88.8	Confident	65 Å²	65	22.4 Å²	22.4	32%	0.32	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-6.8	173.1	-60.6	-177.9	-175.6	0	0	113.2	K291 G292 C313 A337 W574	K291-M311 HydrophobicContact CB-CB 3.96Å; K291-M311 HydrophobicContact CD-CB 4.21Å; K291-M311 WeakPolarHBondContact CD-O 3.45Å; G292-M311 PolarHBondContact O-N 2.82Å; M311-C313 PolarHBondContact O-N 2.72Å; M311-A337 HydrophobicContact CB-CB 4.07Å; M311-A337 HydrophobicContact CG-CB 4.35Å; M311-W574 HydrophobicContact CE-CD2 4.36Å; M311-W574 HydrophobicContact CE-CZ2 3.94Å
312	D	89.1	Confident	88.7	Confident	16 Å²	16	16.3 Å²	16.3	9%	0.086	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	10	172.7	66.9	4.9	0	0	0	113.7	H289 T290 K291 S310 K314	H289-D312 WeakPolarHBondContact CA-OD2 3.32Å; H289-D312 IonicContact CG-OD2 3.9Å; H289-D312 IonicContact ND1-OD1 3.83Å; H289-D312 IonicContact ND1-OD2 3.99Å; H289-D312 PolarHBondContact ND1-OD2 3.01Å; H289-D312 VanDerWaalsContact ND1-OD2 3.1Å; T290-D312 PolarHBondContact N-OD2 2.87Å; T290-D312 VanDerWaalsContact OG1-CB 3.32Å; T290-D312 WeakPolarHBondContact OG1-CB 3.2Å; K291-D312 HydrophobicContact CB-CB 4.09Å; K291-D312 HydrophobicContact CD-CB 4.39Å; K291-D312 HydrophobicContact CG-CB 4.2Å; S310-D312 WeakPolarHBondContact CB-OD1 3.24Å; S310-D312 PolarHBondContact O-N 2.93Å; S310-D312 VanDerWaalsContact OG-CG 3.3Å; S310-D312 PolarHBondContact OG-N 2.91Å; S310-D312 PolarHBondContact OG-OD1 3.41Å; D312-K314 PolarHBondContact O-N 3.42Å; D312-K314 VanDerWaalsContact OD1-CB 3.25Å; D312-K314 WeakPolarHBondContact OD1-CB 3.43Å; D312-K314 PolarHBondContact OD1-N 2.98Å
313	C	89.3	Confident	88.5	Confident	29 Å²	29	22.3 Å²	22.3	20%	0.196	12%	0.124	C	C	.	.	S	Bend	trans	67.7	9.4	-176.6	-48.4	0	0	0	0	114.1	S310 M311 H334 K336	S310-C313 PolarHBondContact O-N 3.46Å; M311-C313 PolarHBondContact O-N 2.72Å; C313-H334 WeakPolarHBondContact CB-O 3.1Å; C313-K336 PolarHBondContact SG-O 3.11Å
314	K	90	Very high	88.4	Confident	57 Å²	57	24.8 Å²	24.8	25%	0.248	13%	0.134	C	C	.	.			trans	-105.1	148	-179.7	-52.1	177	-176.3	174.8	0	111.2	S310 D312 T329 F330 I331	S310-K314 PolarHBondContact N-O 3.13Å; S310-K314 VanDerWaalsContact N-O 3.13Å; D312-K314 PolarHBondContact O-N 3.42Å; D312-K314 VanDerWaalsContact OD1-CB 3.25Å; D312-K314 WeakPolarHBondContact OD1-CB 3.43Å; D312-K314 PolarHBondContact OD1-N 2.98Å; K314-T329 HydrophobicContact CB-CG2 4.15Å; K314-T329 HydrophobicContact CD-CG2 4.19Å; K314-F330 VanDerWaalsContact CA-O 3.28Å; K314-F330 WeakPolarHBondContact CA-O 3.5Å; K314-I331 HydrophobicContact CD-CG1 4.21Å; K314-I331 HydrophobicContact CD-CG2 4.46Å; K314-I331 HydrophobicContact CG-CG1 4.42Å; K314-I331 HydrophobicContact CG-CG2 4.46Å
315	I	91.7	Very high	88.3	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.01	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	137.1	166.9	-54	169	0	0	0	106.6	L307 S308 F330 V338 I341 F350	L307-I315 HydrophobicContact CD2-CG2 4.02Å; S308-I315 CarbonylContact O-C 3.52Å; S308-I315 WeakPolarHBondContact O-CA 3.43Å; S308-I315 WeakPolarHBondContact O-CG2 3.44Å; I315-F330 HydrophobicContact CB-CB 4.05Å; I315-F330 HydrophobicContact CB-CD2 4.13Å; I315-F330 HydrophobicContact CB-CG 4.39Å; I315-F330 HydrophobicContact CG2-CD2 4.23Å; I315-F330 PolarHBondContact N-O 3.44Å; I315-F330 WeakPolarHBondContact O-CD2 3.39Å; I315-F330 PolarHBondContact O-N 2.84Å; I315-V338 HydrophobicContact CD1-CG1 4.18Å; I315-V338 HydrophobicContact CD1-CG2 4.35Å; I315-V338 HydrophobicContact CG1-CG1 4.23Å; I315-V338 HydrophobicContact CG1-CG2 4.09Å; I315-I341 HydrophobicContact CD1-CG2 4.27Å; I315-F350 HydrophobicContact CD1-CE2 4.01Å; I315-F350 HydrophobicContact CG2-CE2 4.17Å
316	K	91.6	Very high	88	Confident	21 Å²	21	31.7 Å²	31.7	9%	0.091	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	142	178.4	-73.5	-174	171.6	-157.6	0	110.6	G288 L307 S308 W318 R328 T329	G288-K316 VanDerWaalsContact C-NZ 3.3Å; G288-K316 PolarHBondContact O-NZ 3.13Å; L307-K316 WeakPolarHBondContact CA-O 3.33Å; S308-K316 PolarHBondContact N-O 3.35Å; S308-K316 PolarHBondContact O-N 3.37Å; S308-K316 PolarHBondContact OG-O 3.39Å; K316-W318 HydrophobicContact CB-CZ2 3.92Å; K316-W318 HydrophobicContact CD-CH2 4.04Å; K316-W318 HydrophobicContact CD-CZ2 3.43Å; K316-W318 VanDerWaalsContact CD-CZ2 3.43Å; K316-W318 HydrophobicContact CG-CZ2 4.29Å; K316-R328 WeakPolarHBondContact CA-O 3.49Å; K316-T329 HydrophobicContact CD-CG2 4.32Å; K316-T329 WeakPolarHBondContact CE-OG1 3.13Å; K316-T329 HydrophobicContact CG-CG2 3.72Å
317	L	91.7	Very high	87.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	125.3	173.7	-160.1	160.5	0	0	0	107.9	Y256 L305 L306 L307 L327 R328 F330	Y256-L317 HydrophobicContact CD2-CD2 4.43Å; Y256-L317 HydrophobicContact CE2-CD1 4.06Å; Y256-L317 HydrophobicContact CE2-CD2 4.27Å; L305-L317 HydrophobicContact CB-CD2 4.12Å; L305-L317 HydrophobicContact CD1-CD2 4.1Å; L305-L317 HydrophobicContact CD2-CD2 3.88Å; L305-L317 HydrophobicContact CG-CD2 4.24Å; L306-L317 CarbonylContact O-C 3.59Å; L306-L317 WeakPolarHBondContact O-CA 3.44Å; L307-L317 HydrophobicContact CD2-CB 3.82Å; L307-L317 HydrophobicContact CD2-CD1 4.04Å; L307-L317 HydrophobicContact CD2-CG 3.87Å; L317-L327 HydrophobicContact CD2-CB 3.94Å; L317-L327 HydrophobicContact CD2-CD1 3.42Å; L317-L327 VanDerWaalsContact CD2-CD1 3.42Å; L317-L327 HydrophobicContact CD2-CG 4.23Å; L317-L327 PolarHBondContact O-N 2.83Å; L317-R328 HydrophobicContact CB-CB 4.41Å; L317-R328 PolarHBondContact N-O 3.3Å; L317-R328 PolarHBondContact O-N 2.99Å; L317-F330 HydrophobicContact CB-CE2 4.4Å
318	W	91.1	Very high	87.4	Confident	10 Å²	10	33.2 Å²	33.2	4%	0.038	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	147.8	-176.6	-51.4	88.5	0	0	0	110.1	W286 L305 L306 S308 K316 C326	W286-W318 HydrophobicContact CB-CD2 4.12Å; W286-W318 HydrophobicContact CB-CE3 3.91Å; W286-W318 HydrophobicContact CB-CH2 4.07Å; W286-W318 HydrophobicContact CB-CZ2 4.28Å; W286-W318 HydrophobicContact CB-CZ3 3.87Å; W286-W318 AromaticContact CD1-CD2 3.91Å; W286-W318 AromaticContact CD1-CE3 3.33Å; W286-W318 AromaticContact CD1-CZ3 3.86Å; W286-W318 HydrophobicContact CG-CD2 4.08Å; W286-W318 AromaticContact CG-CE3 3.83Å; W286-W318 HydrophobicContact CG-CE3 3.83Å; W286-W318 HydrophobicContact CG-CG 4.49Å; W286-W318 HydrophobicContact CG-CZ3 4.22Å; L305-W318 WeakPolarHBondContact CA-O 3.46Å; L306-W318 HydrophobicContact CB-CB 4.3Å; L306-W318 HydrophobicContact CD2-CB 4.41Å; L306-W318 HydrophobicContact CD2-CG 4.26Å; L306-W318 PolarHBondContact N-O 2.79Å; L306-W318 PolarHBondContact O-N 2.84Å; S308-W318 PolarHBondContact OG-NE1 2.86Å; K316-W318 HydrophobicContact CB-CZ2 3.92Å; K316-W318 HydrophobicContact CD-CH2 4.04Å; K316-W318 HydrophobicContact CD-CZ2 3.43Å; K316-W318 VanDerWaalsContact CD-CZ2 3.43Å; K316-W318 HydrophobicContact CG-CZ2 4.29Å; W318-C326 HydrophobicContact CD2-CB 4.43Å; W318-C326 HydrophobicContact CE3-CB 3.64Å; W318-C326 HydrophobicContact CH2-CB 4.05Å; W318-C326 HydrophobicContact CZ3-CB 3.43Å; W318-C326 VanDerWaalsContact CZ3-CB 3.43Å
319	E	89.3	Confident	87.1	Confident	52 Å²	52	33.3 Å²	33.3	24%	0.243	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	134.5	168.1	-157.6	-174.2	166.9	0	0	109.8	Y321 R324 R325 L327	E319-Y321 VanDerWaalsContact CG-O 3.24Å; E319-Y321 WeakPolarHBondContact CG-O 3.44Å; E319-R324 WeakPolarHBondContact O-CA 3.42Å; E319-R325 PolarHBondContact N-O 3.45Å; E319-R325 VanDerWaalsContact N-O 3.13Å; E319-L327 HydrophobicContact CB-CD1 4.14Å; E319-L327 HydrophobicContact CB-CG 4.35Å
320	V	86.3	Confident	86.6	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.006	17%	0.17	C	C	.	.	S	Bend	trans	-86.1	-35.4	177.3	178.7	0	0	0	0	111.2	L298 G303 H304 L306 R324 I570 L580	L298-V320 HydrophobicContact CD2-CG2 4.03Å; G303-V320 WeakPolarHBondContact O-CG2 3.21Å; H304-V320 WeakPolarHBondContact O-CB 3.28Å; H304-V320 PolarHBondContact O-N 3.05Å; L306-V320 HydrophobicContact CB-CG2 3.84Å; V320-R324 WeakPolarHBondContact O-CG 3.28Å; V320-R324 PolarHBondContact O-NE 3.48Å; V320-I570 HydrophobicContact CG1-CD1 4.46Å; V320-I570 HydrophobicContact CG2-CD1 4.45Å; V320-L580 HydrophobicContact CG1-CD1 4.16Å
321	Y	82.1	Confident	85.2	Confident	17 Å²	17	35.7 Å²	35.7	7%	0.067	18%	0.182	C	C	.	.	S	Bend	trans	-100.8	174.4	178.8	-61.5	-74.8	0	0	0	111.2	V263 L267 H304 E319 R324 H562 E565	V263-Y321 HydrophobicContact CG1-CD1 3.74Å; V263-Y321 HydrophobicContact CG1-CE1 3.68Å; V263-Y321 HydrophobicContact CG1-CG 4.3Å; V263-Y321 HydrophobicContact CG2-CD1 3.88Å; V263-Y321 HydrophobicContact CG2-CD2 4.14Å; V263-Y321 HydrophobicContact CG2-CG 3.67Å; L267-Y321 HydrophobicContact CD1-CD2 3.99Å; L267-Y321 HydrophobicContact CD1-CE2 3.72Å; L267-Y321 HydrophobicContact CD2-CE2 3.96Å; H304-Y321 HydrophobicContact CB-CD2 4.03Å; H304-Y321 HydrophobicContact CB-CE2 4.35Å; E319-Y321 VanDerWaalsContact CG-O 3.24Å; E319-Y321 WeakPolarHBondContact CG-O 3.44Å; Y321-R324 PolarHBondContact O-N 2.88Å; Y321-H562 AromaticContact CE2-NE2 3.9Å; Y321-H562 AromaticContact CZ-NE2 3.93Å; Y321-H562 PolarHBondContact OH-CE1 3.33Å; Y321-H562 PolarHBondContact OH-ND1 3.13Å; Y321-H562 PolarHBondContact OH-NE2 3.06Å; Y321-H562 VanDerWaalsContact OH-NE2 3.14Å; Y321-E565 WeakPolarHBondContact CE1-OE1 3.24Å; Y321-E565 PolarHBondContact OH-OE1 2.99Å; Y321-E565 PolarHBondContact OH-OE2 3.4Å
322	G	79.9	Confident	83.7	Confident	67 Å²	67	35.3 Å²	35.3	69%	0.691	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.5	-135	-179.8	0	0	0	0	0	114.6	R324	G322-R324 PolarHBondContact O-N 3.5Å
323	E	75.2	Confident	82.6	Confident	129 Å²	129	35 Å²	35	60%	0.603	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-0.6	179.7	-83	177.7	108.3	0	0	113.9	R325	E323-R325 HydrophobicContact CB-CG 3.8Å; E323-R325 VanDerWaalsContact CD-NE 3.34Å; E323-R325 PolarHBondContact O-N 3.38Å; E323-R325 IonicContact OE1-CZ 3Å; E323-R325 IonicContact OE1-NE 3.64Å; E323-R325 PolarHBondContact OE1-NE 3.4Å; E323-R325 IonicContact OE1-NH2 3.27Å; E323-R325 PolarHBondContact OE1-NH2 3.42Å; E323-R325 IonicContact OE2-CZ 2.72Å; E323-R325 IonicContact OE2-NE 3.55Å; E323-R325 PolarHBondContact OE2-NE 3.22Å; E323-R325 VanDerWaalsContact OE2-NE 3.11Å; E323-R325 IonicContact OE2-NH1 2.92Å; E323-R325 PolarHBondContact OE2-NH1 3.15Å; E323-R325 IonicContact OE2-NH2 3.46Å; E323-R325 PolarHBondContact OE2-NH2 2.82Å
324	R	82.5	Confident	82.1	Confident	52 Å²	52	34.2 Å²	34.2	20%	0.196	18%	0.177	C	C	.	.			trans	55.5	37.5	174.7	-60.7	178.9	-179.5	148.2	1.3	113.4	W286 E319 V320 Y321 G322	W286-R324 PolarHBondContact NE1-O 2.96Å; W286-R324 VanDerWaalsContact NE1-O 3.15Å; E319-R324 WeakPolarHBondContact O-CA 3.42Å; V320-R324 WeakPolarHBondContact O-CG 3.28Å; V320-R324 PolarHBondContact O-NE 3.48Å; Y321-R324 PolarHBondContact O-N 2.88Å; G322-R324 PolarHBondContact O-N 3.5Å
325	R	85.5	Confident	81.9	Confident	125 Å²	125	36.1 Å²	36.1	47%	0.472	20%	0.198	S	C	.	.			trans	-76.3	157.4	-174.7	-66.5	171.6	172.6	-178.4	-3.6	111	E319 E323 L327	E319-R325 PolarHBondContact N-O 3.45Å; E319-R325 VanDerWaalsContact N-O 3.13Å; E323-R325 HydrophobicContact CB-CG 3.8Å; E323-R325 VanDerWaalsContact CD-NE 3.34Å; E323-R325 PolarHBondContact O-N 3.38Å; E323-R325 IonicContact OE1-CZ 3Å; E323-R325 IonicContact OE1-NE 3.64Å; E323-R325 PolarHBondContact OE1-NE 3.4Å; E323-R325 IonicContact OE1-NH2 3.27Å; E323-R325 PolarHBondContact OE1-NH2 3.42Å; E323-R325 IonicContact OE2-CZ 2.72Å; E323-R325 IonicContact OE2-NE 3.55Å; E323-R325 PolarHBondContact OE2-NE 3.22Å; E323-R325 VanDerWaalsContact OE2-NE 3.11Å; E323-R325 IonicContact OE2-NH1 2.92Å; E323-R325 PolarHBondContact OE2-NH1 3.15Å; E323-R325 IonicContact OE2-NH2 3.46Å; E323-R325 PolarHBondContact OE2-NH2 2.82Å; R325-L327 PolarHBondContact O-N 3.02Å
326	C	84.9	Confident	81.7	Confident	22 Å²	22	41.4 Å²	41.4	15%	0.149	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	114.1	162.2	-168.9	0	0	0	0	107.2	H244 W318	H244-C326 WeakPolarHBondContact CB-O 3.43Å; W318-C326 HydrophobicContact CD2-CB 4.43Å; W318-C326 HydrophobicContact CE3-CB 3.64Å; W318-C326 HydrophobicContact CH2-CB 4.05Å; W318-C326 HydrophobicContact CZ3-CB 3.43Å; W318-C326 VanDerWaalsContact CZ3-CB 3.43Å
327	L	84.8	Confident	81.7	Confident	11 Å²	11	41.4 Å²	41.4	6%	0.058	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	-54.4	-179.8	-68.5	170.9	0	0	0	109.5	L243 H244 V245 Y256 L305 L317 E319 R325	L243-L327 WeakPolarHBondContact CD1-O 3.43Å; H244-L327 PolarHBondContact N-O 3.37Å; V245-L327 HydrophobicContact CG2-CD2 3.66Å; Y256-L327 HydrophobicContact CD2-CD1 3.93Å; Y256-L327 HydrophobicContact CG-CD1 4.11Å; L305-L327 HydrophobicContact CD2-CD1 3.44Å; L305-L327 VanDerWaalsContact CD2-CD1 3.44Å; L317-L327 HydrophobicContact CD2-CB 3.94Å; L317-L327 HydrophobicContact CD2-CD1 3.42Å; L317-L327 VanDerWaalsContact CD2-CD1 3.42Å; L317-L327 HydrophobicContact CD2-CG 4.23Å; L317-L327 PolarHBondContact O-N 2.83Å; E319-L327 HydrophobicContact CB-CD1 4.14Å; E319-L327 HydrophobicContact CB-CG 4.35Å; R325-L327 PolarHBondContact O-N 3.02Å
328	R	86.3	Confident	81.7	Confident	21 Å²	21	41.4 Å²	41.4	8%	0.079	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	139.7	-173.5	-162.1	166.9	-166.9	141	5.4	112.2	T241 L243 K316 L317 F330 E365 T366	T241-R328 PolarHBondContact OG1-NH2 2.98Å; L243-R328 HydrophobicContact CD1-CB 4.27Å; L243-R328 HydrophobicContact CD1-CG 4.32Å; K316-R328 WeakPolarHBondContact CA-O 3.49Å; L317-R328 HydrophobicContact CB-CB 4.41Å; L317-R328 PolarHBondContact N-O 3.3Å; L317-R328 PolarHBondContact O-N 2.99Å; R328-F330 HydrophobicContact CB-CE2 4.36Å; R328-F330 HydrophobicContact CG-CE2 4.29Å; R328-F330 HydrophobicContact CG-CZ 4.35Å; R328-E365 PolarHBondContact NH1-O 3.29Å; R328-T366 VanDerWaalsContact CZ-C 3.44Å; R328-T366 PolarHBondContact NH1-O 3.38Å; R328-T366 VanDerWaalsContact NH1-O 3.12Å; R328-T366 PolarHBondContact NH2-O 3.41Å
329	T	85.1	Confident	81.7	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	126	169.1	-53.7	0	0	0	0	110.1	T241 I242 H244 K314 K316 I331	T241-T329 WeakPolarHBondContact CA-O 3.33Å; I242-T329 PolarHBondContact N-O 3.38Å; I242-T329 PolarHBondContact O-N 3.02Å; H244-T329 PolarHBondContact CD2-OG1 3.45Å; H244-T329 VanDerWaalsContact CD2-OG1 3.25Å; H244-T329 PolarHBondContact NE2-OG1 3.2Å; K314-T329 HydrophobicContact CB-CG2 4.15Å; K314-T329 HydrophobicContact CD-CG2 4.19Å; K316-T329 HydrophobicContact CD-CG2 4.32Å; K316-T329 WeakPolarHBondContact CE-OG1 3.13Å; K316-T329 HydrophobicContact CG-CG2 3.72Å; T329-I331 HydrophobicContact CG2-CD1 3.82Å; T329-I331 HydrophobicContact CG2-CG1 3.25Å
330	F	80.3	Confident	81.8	Confident	3 Å²	3	41.7 Å²	41.7	1%	0.013	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	104.1	170.6	-55.1	-99.6	0	0	0	107.7	T241 K314 I315 L317 R328 F350 W362	T241-F330 HydrophobicContact CG2-CB 4.35Å; T241-F330 HydrophobicContact CG2-CD1 3.48Å; T241-F330 VanDerWaalsContact CG2-CD1 3.48Å; T241-F330 HydrophobicContact CG2-CE1 4.09Å; T241-F330 HydrophobicContact CG2-CG 4.18Å; K314-F330 VanDerWaalsContact CA-O 3.28Å; K314-F330 WeakPolarHBondContact CA-O 3.5Å; I315-F330 HydrophobicContact CB-CB 4.05Å; I315-F330 HydrophobicContact CB-CD2 4.13Å; I315-F330 HydrophobicContact CB-CG 4.39Å; I315-F330 HydrophobicContact CG2-CD2 4.23Å; I315-F330 PolarHBondContact N-O 3.44Å; I315-F330 WeakPolarHBondContact O-CD2 3.39Å; I315-F330 PolarHBondContact O-N 2.84Å; L317-F330 HydrophobicContact CB-CE2 4.4Å; R328-F330 HydrophobicContact CB-CE2 4.36Å; R328-F330 HydrophobicContact CG-CE2 4.29Å; R328-F330 HydrophobicContact CG-CZ 4.35Å; F330-F350 AromaticContact CD1-CZ 3.86Å; F330-F350 HydrophobicContact CD1-CZ 3.86Å; F330-F350 HydrophobicContact CD2-CZ 4.01Å; F330-F350 AromaticContact CE1-CE1 3.69Å; F330-F350 HydrophobicContact CE1-CE1 3.69Å; F330-F350 AromaticContact CE1-CZ 3.49Å; F330-F350 HydrophobicContact CE1-CZ 3.49Å; F330-F350 VanDerWaalsContact CE1-CZ 3.49Å; F330-F350 AromaticContact CE2-CE1 3.96Å; F330-F350 HydrophobicContact CE2-CE1 3.96Å; F330-F350 AromaticContact CE2-CZ 3.7Å; F330-F350 HydrophobicContact CE2-CZ 3.7Å; F330-F350 HydrophobicContact CG-CZ 4.12Å; F330-F350 AromaticContact CZ-CE1 3.41Å; F330-F350 HydrophobicContact CZ-CE1 3.41Å; F330-F350 VanDerWaalsContact CZ-CE1 3.41Å; F330-F350 AromaticContact CZ-CZ 3.44Å; F330-F350 HydrophobicContact CZ-CZ 3.44Å; F330-F350 VanDerWaalsContact CZ-CZ 3.44Å; F330-W362 HydrophobicContact CD1-CD2 4.07Å; F330-W362 AromaticContact CD1-CE3 3.64Å; F330-W362 HydrophobicContact CD1-CE3 3.64Å; F330-W362 HydrophobicContact CD1-CZ3 4.04Å; F330-W362 HydrophobicContact CE1-CB 4.46Å; F330-W362 HydrophobicContact CE1-CD2 4.47Å; F330-W362 HydrophobicContact CE1-CE3 4.08Å
331	I	61.4	Low	82.1	Confident	47 Å²	47	41.7 Å²	41.7	24%	0.241	22%	0.224	C	C	.	.			trans	-103.1	-38.6	-164.7	-63.5	-178.8	0	0	0	113	K240 I242 K314 T329	K240-I331 PolarHBondContact O-N 2.62Å; K240-I331 VanDerWaalsContact O-N 3.16Å; I242-I331 HydrophobicContact CB-CD1 4.23Å; I242-I331 HydrophobicContact CD1-CD1 3.35Å; I242-I331 HydrophobicContact CG1-CD1 3.72Å; K314-I331 HydrophobicContact CD-CG1 4.21Å; K314-I331 HydrophobicContact CD-CG2 4.46Å; K314-I331 HydrophobicContact CG-CG1 4.42Å; K314-I331 HydrophobicContact CG-CG2 4.46Å; T329-I331 HydrophobicContact CG2-CD1 3.82Å; T329-I331 HydrophobicContact CG2-CG1 3.25Å
332	V	60.7	Low	82.5	Confident	57 Å²	57	41.5 Å²	41.5	35%	0.345	23%	0.225	S	C	.	.	S	Bend	trans	-117.8	34.7	-168	-159.8	0	0	0	0	111.3	E238 E239 K240	E238-V332 WeakPolarHBondContact O-CB 3.42Å; E238-V332 WeakPolarHBondContact O-CG1 3.39Å; E239-V332 VanDerWaalsContact CA-O 3.32Å; E239-V332 WeakPolarHBondContact CA-O 3.31Å; K240-V332 HydrophobicContact CB-CB 4.09Å; K240-V332 HydrophobicContact CB-CG2 3.74Å; K240-V332 HydrophobicContact CD-CG2 4.41Å; K240-V332 HydrophobicContact CG-CB 4.47Å; K240-V332 HydrophobicContact CG-CG2 4.27Å; K240-V332 PolarHBondContact O-N 2.91Å
333	G	64.4	Low	83.1	Confident	9 Å²	9	39.2 Å²	39.2	9%	0.093	20%	0.196	C	C	.	.	S	Bend	trans	-79	-59.1	173.1	0	0	0	0	0	112.1	K360	G333-K360 VanDerWaalsContact O-CE 3.23Å; G333-K360 WeakPolarHBondContact O-CE 3.48Å; G333-K360 PolarHBondContact O-NZ 2.9Å
334	H	79.9	Confident	83.8	Confident	14 Å²	14	33.3 Å²	33.3	7%	0.065	17%	0.169	C	C	.	.			trans	-109.2	138.8	-166.4	-71	-73.7	0	0	0	112	C313 K336 V338 S352 A354 D356	C313-H334 WeakPolarHBondContact CB-O 3.1Å; H334-K336 VanDerWaalsContact C-N 3.31Å; H334-K336 WeakPolarHBondContact CB-O 3.4Å; H334-V338 HydrophobicContact CB-CG2 4.08Å; H334-S352 PolarHBondContact NE2-OG 2.84Å; H334-A354 HydrophobicContact CB-CB 3.84Å; H334-A354 VanDerWaalsContact CG-CB 3.46Å; H334-A354 WeakPolarHBondContact ND1-CB 3.18Å; H334-D356 WeakPolarHBondContact CA-OD2 3.46Å; H334-D356 VanDerWaalsContact CB-OD2 3.31Å; H334-D356 WeakPolarHBondContact CB-OD2 3.5Å; H334-D356 IonicContact CG-OD2 2.95Å; H334-D356 IonicContact ND1-OD1 2.68Å; H334-D356 PolarHBondContact ND1-OD1 3.15Å; H334-D356 IonicContact ND1-OD2 3.93Å; H334-D356 PolarHBondContact ND1-OD2 2.79Å
335	S	84.6	Confident	83.9	Confident	97 Å²	97	33.9 Å²	33.9	68%	0.678	18%	0.176	S	C	*	.	S	Bend	trans	-73.3	-29.2	176.5	172.3	0	0	0	0	111.4	D356	S335-D356 PolarHBondContact N-OD2 2.81Å
336	K	89.3	Confident	83.8	Confident	112 Å²	112	31.5 Å²	31.5	49%	0.487	18%	0.179	S	C	.	.	S	Bend	trans	-125.5	171.9	-178.6	-61.6	-178.1	-179	175.5	0	111.1	C313 H334 V338 Y355 D356	C313-K336 PolarHBondContact SG-O 3.11Å; H334-K336 VanDerWaalsContact C-N 3.31Å; H334-K336 WeakPolarHBondContact CB-O 3.4Å; K336-V338 PolarHBondContact O-N 2.96Å; K336-Y355 WeakPolarHBondContact CD-O 3.36Å; K336-D356 HydrophobicContact CB-CB 4.09Å; K336-D356 HydrophobicContact CG-CB 4.23Å
337	A	90.8	Very high	83.7	Confident	21 Å²	21	30.5 Å²	30.5	17%	0.174	17%	0.171	C	C	.	.			trans	-51.2	137.6	-179	0	0	0	0	0	112.6	M311 A354 Y355	M311-A337 HydrophobicContact CB-CB 4.07Å; M311-A337 HydrophobicContact CG-CB 4.35Å; A337-A354 WeakPolarHBondContact O-CA 3.42Å; A337-A354 WeakPolarHBondContact O-CB 3.33Å; A337-Y355 HydrophobicContact CB-CD2 3.91Å; A337-Y355 HydrophobicContact CB-CE2 4.5Å; A337-Y355 VanDerWaalsContact O-CD2 3.28Å; A337-Y355 WeakPolarHBondContact O-CD2 3.25Å; A337-Y355 PolarHBondContact O-N 3.41Å
338	V	91.3	Very high	83.9	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.006	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	130	175.8	-175.1	0	0	0	0	108.3	S294 S310 I315 H334 K336 I341 A353 A354	S294-V338 VanDerWaalsContact CB-O 3.3Å; S294-V338 WeakPolarHBondContact CB-O 3.4Å; S294-V338 PolarHBondContact OG-O 3.41Å; S310-V338 PolarHBondContact O-N 2.97Å; I315-V338 HydrophobicContact CD1-CG1 4.18Å; I315-V338 HydrophobicContact CD1-CG2 4.35Å; I315-V338 HydrophobicContact CG1-CG1 4.23Å; I315-V338 HydrophobicContact CG1-CG2 4.09Å; H334-V338 HydrophobicContact CB-CG2 4.08Å; K336-V338 PolarHBondContact O-N 2.96Å; V338-I341 HydrophobicContact CG1-CG2 4.25Å; V338-A353 WeakPolarHBondContact CG1-O 3.49Å; V338-A354 HydrophobicContact CB-CB 4.48Å; V338-A354 HydrophobicContact CG2-CB 4.2Å
339	R	90.9	Very high	84.1	Confident	56 Å²	56	34.4 Å²	34.4	21%	0.211	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-45.1	-172.6	-179.5	59.5	-170.5	104.6	-4	113.8	S294 A353 Y355 Y380	S294-R339 PolarHBondContact O-NH1 2.86Å; R339-A353 PolarHBondContact N-O 2.91Å; R339-Y355 HydrophobicContact CB-CE2 4.09Å; R339-Y355 WeakPolarHBondContact CD-OH 3.36Å; R339-Y355 HydrophobicContact CG-CE2 4.45Å; R339-Y380 WeakPolarHBondContact CG-O 3.43Å
340	D	91.1	Very high	84.4	Confident	12 Å²	12	34.3 Å²	34.3	6%	0.064	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	157.6	-177	-167.7	25.1	0	0	0	110.1	R297 A353 C381 V382	R297-D340 IonicContact NE-OD1 3.89Å; R297-D340 IonicContact NH2-OD1 3.8Å; R297-D340 PolarHBondContact NH2-OD1 3.21Å; D340-A353 PolarHBondContact N-O 2.92Å; D340-A353 PolarHBondContact O-N 3.3Å; D340-C381 WeakPolarHBondContact OD2-CA 3.38Å; D340-C381 PolarHBondContact OD2-SG 3.15Å; D340-V382 PolarHBondContact OD2-N 3.27Å
341	I	92.6	Very high	84.9	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	147	-177.2	41.7	162.1	0	0	0	109.5	A295 R297 L307 I315 V338 L351	A295-I341 HydrophobicContact CB-CG1 4.19Å; R297-I341 HydrophobicContact CB-CD1 4.34Å; R297-I341 HydrophobicContact CG-CD1 4.16Å; R297-I341 HydrophobicContact CG-CG1 4Å; R297-I341 VanDerWaalsContact CG-O 3.24Å; R297-I341 WeakPolarHBondContact CG-O 3.16Å; R297-I341 PolarHBondContact NE-O 3.11Å; L307-I341 HydrophobicContact CB-CD1 3.65Å; L307-I341 WeakPolarHBondContact O-CD1 3.19Å; I315-I341 HydrophobicContact CD1-CG2 4.27Å; V338-I341 HydrophobicContact CG1-CG2 4.25Å; I341-L351 WeakPolarHBondContact CA-O 3.48Å
342	C	92.2	Very high	86.4	Confident	14 Å²	14	32 Å²	32	10%	0.095	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	134.4	177.1	-164.6	0	0	0	0	111.5	F350 L351 V382 F384	C342-F350 CarbonylContact O-C 3.55Å; C342-F350 VanDerWaalsContact O-CA 3.29Å; C342-F350 WeakPolarHBondContact O-CA 3.22Å; C342-F350 WeakPolarHBondContact O-CB 3.33Å; C342-L351 PolarHBondContact N-O 3.19Å; C342-L351 PolarHBondContact O-N 2.72Å; C342-V382 VanDerWaalsContact CB-O 3.31Å; C342-V382 WeakPolarHBondContact CB-O 3.38Å; C342-F384 HydrophobicContact CB-CD2 4.36Å
343	F	91	Very high	87.9	Confident	18 Å²	18	29.2 Å²	29.2	8%	0.079	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	153.5	171.6	-81.3	-72.7	0	0	0	111.3	R297 Y299 P300 L307 F350 F384	R297-F343 HydrophobicContact CB-CD2 4.22Å; R297-F343 HydrophobicContact CB-CE2 4.48Å; Y299-F343 HydrophobicContact CD2-CE1 4.2Å; Y299-F343 HydrophobicContact CD2-CZ 4.1Å; P300-F343 HydrophobicContact CG-CB 4.3Å; L307-F343 HydrophobicContact CB-CE2 3.92Å; L307-F343 HydrophobicContact CB-CZ 4.11Å; L307-F343 HydrophobicContact CD1-CD1 3.98Å; L307-F343 HydrophobicContact CD1-CD2 3.99Å; L307-F343 HydrophobicContact CD1-CE1 3.39Å; L307-F343 HydrophobicContact CD1-CE2 3.39Å; L307-F343 HydrophobicContact CD1-CG 4.28Å; L307-F343 HydrophobicContact CD1-CZ 3.1Å; L307-F343 HydrophobicContact CD2-CZ 4.45Å; L307-F343 HydrophobicContact CG-CE1 4.02Å; L307-F343 HydrophobicContact CG-CE2 3.6Å; L307-F343 HydrophobicContact CG-CZ 3.27Å; F343-F350 HydrophobicContact CD1-CB 3.87Å; F343-F350 HydrophobicContact CE1-CB 4.28Å; F343-F350 HydrophobicContact CG-CB 4.47Å; F343-F384 VanDerWaalsContact C-CD2 3.48Å; F343-F384 VanDerWaalsContact O-CD2 3.28Å; F343-F384 WeakPolarHBondContact O-CD2 3.44Å
344	N	89.4	Confident	89.2	Confident	6 Å²	6	28.8 Å²	28.8	3%	0.032	16%	0.161	C	C	.	.			trans	-70.4	165.6	160.5	69.1	-16.9	0	0	0	110.6	P300 S346 G347 T348 Q349 F384 Q391	P300-N344 WeakPolarHBondContact CG-O 3.41Å; N344-S346 VanDerWaalsContact C-N 3.27Å; N344-S346 PolarHBondContact O-N 3.33Å; N344-G347 PolarHBondContact O-N 3.09Å; N344-G347 WeakPolarHBondContact OD1-CA 3.42Å; N344-G347 PolarHBondContact OD1-N 3.09Å; N344-T348 PolarHBondContact ND2-OG1 3.43Å; N344-T348 PolarHBondContact OD1-N 2.9Å; N344-Q349 HydrophobicContact CB-CB 4.45Å; N344-Q349 VanDerWaalsContact CG-O 3.27Å; N344-Q349 PolarHBondContact N-O 3.23Å; N344-Q349 PolarHBondContact ND2-N 3.08Å; N344-Q349 PolarHBondContact OD1-N 2.87Å; N344-Q349 PolarHBondContact OD1-O 3.02Å; N344-F384 HydrophobicContact CB-CD2 4.41Å; N344-F384 HydrophobicContact CB-CE1 4.4Å; N344-F384 HydrophobicContact CB-CE2 4.29Å; N344-F384 HydrophobicContact CB-CZ 4.27Å; N344-Q391 HydrophobicContact CB-CG 4.35Å
345	N	85.7	Confident	89.7	Confident	63 Å²	63	32.2 Å²	32.2	34%	0.337	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-33.8	-178.2	-169.1	32.7	0	0	0	112.8	P300	P300-N345 WeakPolarHBondContact CB-O 2.99Å; P300-N345 WeakPolarHBondContact CG-O 3.37Å
346	S	83.9	Confident	89.9	Confident	76 Å²	76	28.2 Å²	28.2	53%	0.531	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-18.4	178.7	-47.4	0	0	0	0	114.3	Y299 N344 T348	Y299-S346 PolarHBondContact OH-O 2.94Å; N344-S346 VanDerWaalsContact C-N 3.27Å; N344-S346 PolarHBondContact O-N 3.33Å; S346-T348 VanDerWaalsContact C-N 3.33Å
347	G	82.5	Confident	89.9	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.139	C	C	.	.	S	Bend	trans	77.8	0.8	-175.3	0	0	0	0	0	116.9	Y299 N344 S364	Y299-G347 WeakPolarHBondContact CE2-O 3.38Å; Y299-G347 WeakPolarHBondContact OH-CA 3.28Å; N344-G347 PolarHBondContact O-N 3.09Å; N344-G347 WeakPolarHBondContact OD1-CA 3.42Å; N344-G347 PolarHBondContact OD1-N 3.09Å; G347-S364 PolarHBondContact O-OG 3.48Å
348	T	87.9	Confident	89.8	Confident	57 Å²	57	29.8 Å²	29.8	35%	0.35	14%	0.144	S	C	.	.	S	Bend	trans	-74	-21.7	178.6	57.4	0	0	0	0	114.2	N344 S346 S364	N344-T348 PolarHBondContact ND2-OG1 3.43Å; N344-T348 PolarHBondContact OD1-N 2.9Å; S346-T348 VanDerWaalsContact C-N 3.33Å; T348-S364 WeakPolarHBondContact CA-OG 3.49Å; T348-S364 PolarHBondContact O-N 2.96Å; T348-S364 VanDerWaalsContact O-N 3.07Å; T348-S364 PolarHBondContact O-OG 3.22Å
349	Q	90.6	Very high	89.8	Confident	58 Å²	58	29.8 Å²	29.8	27%	0.271	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	150	-178.9	-64.5	177.9	-7.6	0	0	110.1	N344 L361 W362 I370	N344-Q349 HydrophobicContact CB-CB 4.45Å; N344-Q349 VanDerWaalsContact CG-O 3.27Å; N344-Q349 PolarHBondContact N-O 3.23Å; N344-Q349 PolarHBondContact ND2-N 3.08Å; N344-Q349 PolarHBondContact OD1-N 2.87Å; N344-Q349 PolarHBondContact OD1-O 3.02Å; Q349-L361 HydrophobicContact CB-CD1 4.08Å; Q349-W362 CarbonylContact C-O 3.48Å; Q349-W362 VanDerWaalsContact CA-O 3.28Å; Q349-W362 WeakPolarHBondContact CA-O 3.2Å; Q349-I370 HydrophobicContact CG-CD1 3.98Å
350	F	91.5	Very high	89.8	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	148.7	172.2	70.6	-87.9	0	0	0	111.6	L307 I315 F330 C342 F343 W362	L307-F350 HydrophobicContact CD1-CB 3.84Å; L307-F350 HydrophobicContact CD1-CD1 4.11Å; L307-F350 HydrophobicContact CD1-CD2 3.99Å; L307-F350 HydrophobicContact CD1-CG 3.71Å; I315-F350 HydrophobicContact CD1-CE2 4.01Å; I315-F350 HydrophobicContact CG2-CE2 4.17Å; F330-F350 AromaticContact CD1-CZ 3.86Å; F330-F350 HydrophobicContact CD1-CZ 3.86Å; F330-F350 HydrophobicContact CD2-CZ 4.01Å; F330-F350 AromaticContact CE1-CE1 3.69Å; F330-F350 HydrophobicContact CE1-CE1 3.69Å; F330-F350 AromaticContact CE1-CZ 3.49Å; F330-F350 HydrophobicContact CE1-CZ 3.49Å; F330-F350 VanDerWaalsContact CE1-CZ 3.49Å; F330-F350 AromaticContact CE2-CE1 3.96Å; F330-F350 HydrophobicContact CE2-CE1 3.96Å; F330-F350 AromaticContact CE2-CZ 3.7Å; F330-F350 HydrophobicContact CE2-CZ 3.7Å; F330-F350 HydrophobicContact CG-CZ 4.12Å; F330-F350 AromaticContact CZ-CE1 3.41Å; F330-F350 HydrophobicContact CZ-CE1 3.41Å; F330-F350 VanDerWaalsContact CZ-CE1 3.41Å; F330-F350 AromaticContact CZ-CZ 3.44Å; F330-F350 HydrophobicContact CZ-CZ 3.44Å; F330-F350 VanDerWaalsContact CZ-CZ 3.44Å; C342-F350 CarbonylContact O-C 3.55Å; C342-F350 VanDerWaalsContact O-CA 3.29Å; C342-F350 WeakPolarHBondContact O-CA 3.22Å; C342-F350 WeakPolarHBondContact O-CB 3.33Å; F343-F350 HydrophobicContact CD1-CB 3.87Å; F343-F350 HydrophobicContact CE1-CB 4.28Å; F343-F350 HydrophobicContact CG-CB 4.47Å; F350-W362 HydrophobicContact CD1-CB 3.75Å; F350-W362 HydrophobicContact CD2-CB 4.01Å; F350-W362 AromaticContact CD2-CD1 3.91Å; F350-W362 HydrophobicContact CD2-CG 4.24Å; F350-W362 HydrophobicContact CE1-CB 3.27Å; F350-W362 HydrophobicContact CE1-CG 4.07Å; F350-W362 HydrophobicContact CE2-CB 3.56Å; F350-W362 AromaticContact CE2-CD1 3.33Å; F350-W362 HydrophobicContact CE2-CD2 4.47Å; F350-W362 AromaticContact CE2-CG 3.51Å; F350-W362 HydrophobicContact CE2-CG 3.51Å; F350-W362 HydrophobicContact CG-CB 4.11Å; F350-W362 HydrophobicContact CZ-CB 3.18Å; F350-W362 AromaticContact CZ-CD1 3.77Å; F350-W362 HydrophobicContact CZ-CD2 4.22Å; F350-W362 AromaticContact CZ-CG 3.43Å; F350-W362 HydrophobicContact CZ-CG 3.43Å; F350-W362 VanDerWaalsContact CZ-CG 3.43Å; F350-W362 PolarHBondContact N-O 3.23Å; F350-W362 PolarHBondContact O-N 3Å
351	L	92	Very high	89.9	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	142.1	173.8	-78.2	165.8	0	0	0	109.9	I341 C342 K360 L361 F373 V382 F384 F394	I341-L351 WeakPolarHBondContact CA-O 3.48Å; C342-L351 PolarHBondContact N-O 3.19Å; C342-L351 PolarHBondContact O-N 2.72Å; L351-K360 WeakPolarHBondContact CA-O 3.38Å; L351-L361 HydrophobicContact CD2-CB 3.84Å; L351-L361 HydrophobicContact CD2-CD1 3.78Å; L351-L361 HydrophobicContact CD2-CG 4.44Å; L351-L361 HydrophobicContact CG-CD1 3.89Å; L351-F373 HydrophobicContact CD2-CE2 4.16Å; L351-V382 HydrophobicContact CB-CG1 3.76Å; L351-V382 HydrophobicContact CD1-CG1 3.64Å; L351-V382 HydrophobicContact CG-CG1 4.3Å; L351-F384 HydrophobicContact CB-CE2 3.83Å; L351-F384 HydrophobicContact CB-CZ 4.33Å; L351-F384 HydrophobicContact CD1-CD1 4.13Å; L351-F384 HydrophobicContact CD1-CD2 3.82Å; L351-F384 HydrophobicContact CD1-CE1 3.73Å; L351-F384 HydrophobicContact CD1-CE2 3.37Å; L351-F384 HydrophobicContact CD1-CG 4.19Å; L351-F384 HydrophobicContact CD1-CZ 3.33Å; L351-F384 HydrophobicContact CD2-CZ 4.5Å; L351-F384 HydrophobicContact CG-CD2 4.29Å; L351-F384 HydrophobicContact CG-CE1 4.27Å; L351-F384 HydrophobicContact CG-CE2 3.41Å; L351-F384 VanDerWaalsContact CG-CE2 3.41Å; L351-F384 HydrophobicContact CG-CZ 3.41Å; L351-F384 VanDerWaalsContact CG-CZ 3.41Å; L351-F394 HydrophobicContact CD1-CB 3.54Å; L351-F394 HydrophobicContact CD1-CD1 3.69Å; L351-F394 HydrophobicContact CD1-CD2 3.65Å; L351-F394 HydrophobicContact CD1-CE1 4.27Å; L351-F394 HydrophobicContact CD1-CE2 4.24Å; L351-F394 HydrophobicContact CD1-CG 3.33Å; L351-F394 HydrophobicContact CD2-CE1 4.37Å; L351-F394 HydrophobicContact CD2-CZ 4.4Å
352	S	91.6	Very high	89.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133.3	171	59.1	0	0	0	0	111.2	H334 L359 K360 W362	H334-S352 PolarHBondContact NE2-OG 2.84Å; S352-L359 WeakPolarHBondContact O-CA 3.45Å; S352-K360 PolarHBondContact N-O 2.84Å; S352-K360 PolarHBondContact O-N 3.24Å; S352-K360 PolarHBondContact OG-O 2.85Å; S352-W362 PolarHBondContact OG-NE1 3.45Å
353	A	92	Very high	89.7	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.4	170.2	0	0	0	0	0	110.3	V338 R339 D340 L359 P379 V382	V338-A353 WeakPolarHBondContact CG1-O 3.49Å; R339-A353 PolarHBondContact N-O 2.91Å; D340-A353 PolarHBondContact N-O 2.92Å; D340-A353 PolarHBondContact O-N 3.3Å; A353-L359 HydrophobicContact CB-CD2 3.81Å; A353-P379 HydrophobicContact CB-CB 3.89Å; A353-P379 HydrophobicContact CB-CG 3.77Å; A353-V382 HydrophobicContact CB-CG2 3.43Å; A353-V382 VanDerWaalsContact CB-CG2 3.43Å
354	A	92	Very high	89.4	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	163.6	178.3	0	0	0	0	0	113	H334 A337 V338 D356 R357 Y358 P379	H334-A354 HydrophobicContact CB-CB 3.84Å; H334-A354 VanDerWaalsContact CG-CB 3.46Å; H334-A354 WeakPolarHBondContact ND1-CB 3.18Å; A337-A354 WeakPolarHBondContact O-CA 3.42Å; A337-A354 WeakPolarHBondContact O-CB 3.33Å; V338-A354 HydrophobicContact CB-CB 4.48Å; V338-A354 HydrophobicContact CG2-CB 4.2Å; A354-D356 WeakPolarHBondContact CB-OD1 3.45Å; A354-D356 PolarHBondContact O-N 3.3Å; A354-D356 VanDerWaalsContact O-N 3.13Å; A354-R357 PolarHBondContact O-N 2.89Å; A354-Y358 PolarHBondContact N-O 3.02Å; A354-P379 WeakPolarHBondContact O-CD 3.24Å
355	Y	91.3	Very high	89.1	Confident	86 Å²	86	29.2 Å²	29.2	34%	0.337	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-5	177.4	-73.8	-70.9	0	0	0	114.1	K336 A337 R339 R357 V378 Y380	K336-Y355 WeakPolarHBondContact CD-O 3.36Å; A337-Y355 HydrophobicContact CB-CD2 3.91Å; A337-Y355 HydrophobicContact CB-CE2 4.5Å; A337-Y355 VanDerWaalsContact O-CD2 3.28Å; A337-Y355 WeakPolarHBondContact O-CD2 3.25Å; A337-Y355 PolarHBondContact O-N 3.41Å; R339-Y355 HydrophobicContact CB-CE2 4.09Å; R339-Y355 WeakPolarHBondContact CD-OH 3.36Å; R339-Y355 HydrophobicContact CG-CE2 4.45Å; Y355-R357 PolarHBondContact O-N 2.71Å; Y355-V378 HydrophobicContact CD1-CG1 3.62Å; Y355-V378 HydrophobicContact CE1-CG1 4.13Å; Y355-V378 HydrophobicContact CG-CG1 4.48Å; Y355-Y380 AromaticContact CE1-CE1 4Å; Y355-Y380 HydrophobicContact CE1-CE1 4Å
356	D	88.1	Confident	89	Confident	12 Å²	12	28.4 Å²	28.4	6%	0.064	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	1.7	176.1	64.1	3.4	0	0	0	113.4	H334 S335 K336 A354 Y358	H334-D356 WeakPolarHBondContact CA-OD2 3.46Å; H334-D356 VanDerWaalsContact CB-OD2 3.31Å; H334-D356 WeakPolarHBondContact CB-OD2 3.5Å; H334-D356 IonicContact CG-OD2 2.95Å; H334-D356 IonicContact ND1-OD1 2.68Å; H334-D356 PolarHBondContact ND1-OD1 3.15Å; H334-D356 IonicContact ND1-OD2 3.93Å; H334-D356 PolarHBondContact ND1-OD2 2.79Å; S335-D356 PolarHBondContact N-OD2 2.81Å; K336-D356 HydrophobicContact CB-CB 4.09Å; K336-D356 HydrophobicContact CG-CB 4.23Å; A354-D356 WeakPolarHBondContact CB-OD1 3.45Å; A354-D356 PolarHBondContact O-N 3.3Å; A354-D356 VanDerWaalsContact O-N 3.13Å; D356-Y358 HydrophobicContact CB-CD2 4.33Å; D356-Y358 VanDerWaalsContact O-CD2 3.32Å; D356-Y358 WeakPolarHBondContact O-CD2 3.41Å; D356-Y358 WeakPolarHBondContact OD1-CB 3.48Å; D356-Y358 PolarHBondContact OD1-N 2.94Å
357	R	89.4	Confident	88.9	Confident	96 Å²	96	24.9 Å²	24.9	36%	0.362	12%	0.115	S	C	.	.	S	Bend	trans	74.5	11.1	-178.5	-47.3	168.7	-75.2	-172.8	-0.6	113.5	D233 A354 Y355 T374 R376 K377 V378	D233-R357 IonicContact OD1-NH2 3.25Å; D233-R357 PolarHBondContact OD1-NH2 3.42Å; A354-R357 PolarHBondContact O-N 2.89Å; Y355-R357 PolarHBondContact O-N 2.71Å; R357-T374 PolarHBondContact O-OG1 3.1Å; R357-R376 WeakPolarHBondContact CD-O 3.38Å; R357-K377 WeakPolarHBondContact CB-O 3.34Å; R357-V378 HydrophobicContact CG-CG2 3.99Å
358	Y	89.9	Confident	89	Confident	70 Å²	70	31.2 Å²	31.2	28%	0.275	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	140.7	175.7	-69	-85.4	0	0	0	111.2	A354 D356 T374	A354-Y358 PolarHBondContact N-O 3.02Å; D356-Y358 HydrophobicContact CB-CD2 4.33Å; D356-Y358 VanDerWaalsContact O-CD2 3.32Å; D356-Y358 WeakPolarHBondContact O-CD2 3.41Å; D356-Y358 WeakPolarHBondContact OD1-CB 3.48Å; D356-Y358 PolarHBondContact OD1-N 2.94Å; Y358-T374 HydrophobicContact CE1-CG2 4.39Å
359	L	90.8	Very high	89	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.01	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	129.1	163.5	-67.6	153.6	0	0	0	106.3	S352 A353 R372 F373 P379 V382 F394 A396	S352-L359 WeakPolarHBondContact O-CA 3.45Å; A353-L359 HydrophobicContact CB-CD2 3.81Å; L359-R372 CarbonylContact O-C 3.59Å; L359-R372 WeakPolarHBondContact O-CA 3.34Å; L359-F373 HydrophobicContact CB-CB 4.05Å; L359-F373 HydrophobicContact CB-CD2 4.13Å; L359-F373 HydrophobicContact CD1-CB 4.42Å; L359-F373 PolarHBondContact N-O 3.23Å; L359-F373 PolarHBondContact O-N 3.36Å; L359-P379 HydrophobicContact CD1-CB 4.36Å; L359-P379 HydrophobicContact CD2-CB 3.7Å; L359-P379 HydrophobicContact CD2-CG 3.83Å; L359-P379 HydrophobicContact CG-CB 4.06Å; L359-P379 HydrophobicContact CG-CG 3.92Å; L359-V382 HydrophobicContact CD2-CG2 3.19Å; L359-F394 HydrophobicContact CD1-CE2 4.21Å; L359-A396 HydrophobicContact CD1-CB 3.83Å; L359-A396 HydrophobicContact CD2-CB 4.27Å
360	K	91.1	Very high	88.9	Confident	3 Å²	3	31 Å²	31	1%	0.013	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	132.5	179.5	-66.5	-170.8	176.9	-154.8	0	110.1	E239 G333 L351 S352 W362 R372	E239-K360 WeakPolarHBondContact OE1-CE 3.45Å; E239-K360 IonicContact OE1-NZ 3.98Å; E239-K360 PolarHBondContact OE1-NZ 2.63Å; G333-K360 VanDerWaalsContact O-CE 3.23Å; G333-K360 WeakPolarHBondContact O-CE 3.48Å; G333-K360 PolarHBondContact O-NZ 2.9Å; L351-K360 WeakPolarHBondContact CA-O 3.38Å; S352-K360 PolarHBondContact N-O 2.84Å; S352-K360 PolarHBondContact O-N 3.24Å; S352-K360 PolarHBondContact OG-O 2.85Å; K360-W362 HydrophobicContact CB-CZ2 4.19Å; K360-W362 HydrophobicContact CD-CZ2 3.82Å; K360-R372 HydrophobicContact CG-CG 4.29Å
361	L	91.8	Very high	88.7	Confident	0 Å²	0	32 Å²	32	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	123.3	171.3	-179	68.9	0	0	0	108.4	Q349 L351 C369 I370 S371 F373 F384 I408	Q349-L361 HydrophobicContact CB-CD1 4.08Å; L351-L361 HydrophobicContact CD2-CB 3.84Å; L351-L361 HydrophobicContact CD2-CD1 3.78Å; L351-L361 HydrophobicContact CD2-CG 4.44Å; L351-L361 HydrophobicContact CG-CD1 3.89Å; L361-C369 CarbonylContact O-C 3.29Å; L361-C369 WeakPolarHBondContact O-CA 3.45Å; L361-I370 HydrophobicContact CB-CB 4.49Å; L361-I370 HydrophobicContact CD2-CB 4.02Å; L361-I370 HydrophobicContact CD2-CD1 4.19Å; L361-I370 HydrophobicContact CD2-CG2 4.06Å; L361-I370 HydrophobicContact CG-CB 4.18Å; L361-I370 HydrophobicContact CG-CD1 4.2Å; L361-I370 PolarHBondContact O-N 2.76Å; L361-S371 PolarHBondContact N-O 3.06Å; L361-F373 HydrophobicContact CB-CE2 4.08Å; L361-F384 HydrophobicContact CD1-CZ 3.7Å; L361-I408 HydrophobicContact CD2-CD1 4.36Å; L361-I408 HydrophobicContact CD2-CG1 4.36Å; L361-I408 HydrophobicContact CD2-CG2 3.4Å
362	W	90.6	Very high	88.5	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.008	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	143.4	-179.1	-60.8	90	0	0	0	110.3	E239 T241 F330 Q349 F350 S352 K360 Q368 C369	E239-W362 HydrophobicContact CB-CH2 4.31Å; E239-W362 HydrophobicContact CG-CH2 4.12Å; T241-W362 HydrophobicContact CG2-CZ3 4.16Å; F330-W362 HydrophobicContact CD1-CD2 4.07Å; F330-W362 AromaticContact CD1-CE3 3.64Å; F330-W362 HydrophobicContact CD1-CE3 3.64Å; F330-W362 HydrophobicContact CD1-CZ3 4.04Å; F330-W362 HydrophobicContact CE1-CB 4.46Å; F330-W362 HydrophobicContact CE1-CD2 4.47Å; F330-W362 HydrophobicContact CE1-CE3 4.08Å; Q349-W362 CarbonylContact C-O 3.48Å; Q349-W362 VanDerWaalsContact CA-O 3.28Å; Q349-W362 WeakPolarHBondContact CA-O 3.2Å; F350-W362 HydrophobicContact CD1-CB 3.75Å; F350-W362 HydrophobicContact CD2-CB 4.01Å; F350-W362 AromaticContact CD2-CD1 3.91Å; F350-W362 HydrophobicContact CD2-CG 4.24Å; F350-W362 HydrophobicContact CE1-CB 3.27Å; F350-W362 HydrophobicContact CE1-CG 4.07Å; F350-W362 HydrophobicContact CE2-CB 3.56Å; F350-W362 AromaticContact CE2-CD1 3.33Å; F350-W362 HydrophobicContact CE2-CD2 4.47Å; F350-W362 AromaticContact CE2-CG 3.51Å; F350-W362 HydrophobicContact CE2-CG 3.51Å; F350-W362 HydrophobicContact CG-CB 4.11Å; F350-W362 HydrophobicContact CZ-CB 3.18Å; F350-W362 AromaticContact CZ-CD1 3.77Å; F350-W362 HydrophobicContact CZ-CD2 4.22Å; F350-W362 AromaticContact CZ-CG 3.43Å; F350-W362 HydrophobicContact CZ-CG 3.43Å; F350-W362 VanDerWaalsContact CZ-CG 3.43Å; F350-W362 PolarHBondContact N-O 3.23Å; F350-W362 PolarHBondContact O-N 3Å; S352-W362 PolarHBondContact OG-NE1 3.45Å; K360-W362 HydrophobicContact CB-CZ2 4.19Å; K360-W362 HydrophobicContact CD-CZ2 3.82Å; W362-Q368 WeakPolarHBondContact CA-O 3.4Å; W362-C369 HydrophobicContact CD2-CB 4.4Å; W362-C369 HydrophobicContact CE3-CB 3.95Å; W362-C369 HydrophobicContact CH2-CB 4.12Å; W362-C369 HydrophobicContact CZ3-CB 3.8Å
363	D	89.8	Confident	88.4	Confident	32 Å²	32	37.9 Å²	37.9	17%	0.171	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	126.4	162.2	-174.2	-9.5	0	0	0	109.1	E365 T366 G367 Q368 I370	D363-E365 VanDerWaalsContact C-N 3.33Å; D363-E365 PolarHBondContact OD1-N 2.76Å; D363-T366 VanDerWaalsContact CB-OG1 3.29Å; D363-T366 WeakPolarHBondContact CB-OG1 3.3Å; D363-T366 WeakPolarHBondContact OD2-CB 3.43Å; D363-T366 VanDerWaalsContact OD2-CG2 3.27Å; D363-T366 WeakPolarHBondContact OD2-CG2 3.39Å; D363-T366 PolarHBondContact OD2-OG1 3.31Å; D363-G367 WeakPolarHBondContact O-CA 3.38Å; D363-G367 PolarHBondContact O-N 2.76Å; D363-G367 VanDerWaalsContact O-N 3.09Å; D363-Q368 PolarHBondContact N-O 2.62Å; D363-I370 HydrophobicContact CB-CD1 4.03Å; D363-I370 HydrophobicContact CB-CG1 4.27Å
364	S	84.9	Confident	88.1	Confident	0 Å²	0	41 Å²	41	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-22.9	180	55.7	0	0	0	0	112.9	Y256 L257 G347 T348	Y256-S364 PolarHBondContact OH-O 2.98Å; L257-S364 WeakPolarHBondContact CD1-OG 3.43Å; G347-S364 PolarHBondContact O-OG 3.48Å; T348-S364 WeakPolarHBondContact CA-OG 3.49Å; T348-S364 PolarHBondContact O-N 2.96Å; T348-S364 VanDerWaalsContact O-N 3.07Å; T348-S364 PolarHBondContact O-OG 3.22Å
365	E	84.8	Confident	87.5	Confident	57 Å²	57	43.4 Å²	43.4	27%	0.266	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-61.7	178.1	-60.6	-164.6	151.9	0	0	111.5	M248 S255 Y256 L257 R328 D363 G367	M248-E365 HydrophobicContact CE-CB 4.01Å; M248-E365 VanDerWaalsContact CE-O 3.25Å; M248-E365 WeakPolarHBondContact CE-O 3.23Å; S255-E365 WeakPolarHBondContact CB-OE1 3.3Å; S255-E365 PolarHBondContact OG-OE1 3.11Å; Y256-E365 PolarHBondContact OH-O 2.83Å; L257-E365 HydrophobicContact CD1-CG 3.2Å; L257-E365 HydrophobicContact CG-CG 3.81Å; R328-E365 PolarHBondContact NH1-O 3.29Å; D363-E365 VanDerWaalsContact C-N 3.33Å; D363-E365 PolarHBondContact OD1-N 2.76Å; E365-G367 VanDerWaalsContact C-N 3.29Å; E365-G367 PolarHBondContact O-N 2.99Å
366	T	82.6	Confident	87.2	Confident	46 Å²	46	49.2 Å²	49.2	28%	0.282	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-16.8	-173.9	66	0	0	0	0	112.7	R328 D363 Q368	R328-T366 VanDerWaalsContact CZ-C 3.44Å; R328-T366 PolarHBondContact NH1-O 3.38Å; R328-T366 VanDerWaalsContact NH1-O 3.12Å; R328-T366 PolarHBondContact NH2-O 3.41Å; D363-T366 VanDerWaalsContact CB-OG1 3.29Å; D363-T366 WeakPolarHBondContact CB-OG1 3.3Å; D363-T366 WeakPolarHBondContact OD2-CB 3.43Å; D363-T366 VanDerWaalsContact OD2-CG2 3.27Å; D363-T366 WeakPolarHBondContact OD2-CG2 3.39Å; D363-T366 PolarHBondContact OD2-OG1 3.31Å; T366-Q368 PolarHBondContact O-N 2.96Å; T366-Q368 PolarHBondContact OG1-N 3.16Å
367	G	81.5	Confident	87.2	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.01	24%	0.241	C	C	.	.			trans	67.5	12	-175.3	0	0	0	0	0	114.3	T241 D363 E365	T241-G367 WeakPolarHBondContact CG2-O 3.01Å; D363-G367 WeakPolarHBondContact O-CA 3.38Å; D363-G367 PolarHBondContact O-N 2.76Å; D363-G367 VanDerWaalsContact O-N 3.09Å; E365-G367 VanDerWaalsContact C-N 3.29Å; E365-G367 PolarHBondContact O-N 2.99Å
368	Q	85.1	Confident	87.3	Confident	134 Å²	134	49.3 Å²	49.3	63%	0.626	23%	0.232	S	C	*	.			trans	-79.1	145.4	178.9	-65.8	-179.3	-0.9	0	0	110.2	W362 D363 T366 I370	W362-Q368 WeakPolarHBondContact CA-O 3.4Å; D363-Q368 PolarHBondContact N-O 2.62Å; T366-Q368 PolarHBondContact O-N 2.96Å; T366-Q368 PolarHBondContact OG1-N 3.16Å; Q368-I370 PolarHBondContact O-N 3.09Å
369	C	87.6	Confident	87.5	Confident	24 Å²	24	46 Å²	46	16%	0.162	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	114.4	168.2	-171.7	0	0	0	0	107.9	E239 L361 W362	E239-C369 HydrophobicContact CG-CB 4.49Å; E239-C369 PolarHBondContact OE1-SG 2.91Å; E239-C369 WeakPolarHBondContact OE2-CB 3.44Å; L361-C369 CarbonylContact O-C 3.29Å; L361-C369 WeakPolarHBondContact O-CA 3.45Å; W362-C369 HydrophobicContact CD2-CB 4.4Å; W362-C369 HydrophobicContact CE3-CB 3.95Å; W362-C369 HydrophobicContact CH2-CB 4.12Å; W362-C369 HydrophobicContact CZ3-CB 3.8Å
370	I	87.9	Confident	87.5	Confident	86 Å²	86	49.2 Å²	49.2	44%	0.441	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-48.2	-177.5	-60.4	169	0	0	0	110	Q349 L361 D363 Q368	Q349-I370 HydrophobicContact CG-CD1 3.98Å; L361-I370 HydrophobicContact CB-CB 4.49Å; L361-I370 HydrophobicContact CD2-CB 4.02Å; L361-I370 HydrophobicContact CD2-CD1 4.19Å; L361-I370 HydrophobicContact CD2-CG2 4.06Å; L361-I370 HydrophobicContact CG-CB 4.18Å; L361-I370 HydrophobicContact CG-CD1 4.2Å; L361-I370 PolarHBondContact O-N 2.76Å; D363-I370 HydrophobicContact CB-CD1 4.03Å; D363-I370 HydrophobicContact CB-CG1 4.27Å; Q368-I370 PolarHBondContact O-N 3.09Å
371	S	87.5	Confident	87.5	Confident	22 Å²	22	49.2 Å²	49.2	15%	0.154	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	155.3	-177.7	-171.3	0	0	0	0	111.8	L361 S411	L361-S371 PolarHBondContact N-O 3.06Å; S371-S411 PolarHBondContact OG-OG 3.14Å; S371-S411 VanDerWaalsContact OG-OG 3.05Å
372	R	88.6	Confident	87.5	Confident	120 Å²	120	49.2 Å²	49.2	45%	0.453	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	123.5	177.7	-54	-178	-169.3	105.6	2.8	108.3	E239 L359 K360	E239-R372 IonicContact OE1-CZ 2.78Å; E239-R372 IonicContact OE1-NE 2.7Å; E239-R372 PolarHBondContact OE1-NE 2.87Å; E239-R372 IonicContact OE1-NH2 2.64Å; E239-R372 PolarHBondContact OE1-NH2 3.48Å; E239-R372 IonicContact OE2-CZ 3.16Å; E239-R372 IonicContact OE2-NE 3.38Å; E239-R372 IonicContact OE2-NH2 2.65Å; E239-R372 PolarHBondContact OE2-NH2 2.87Å; L359-R372 CarbonylContact O-C 3.59Å; L359-R372 WeakPolarHBondContact O-CA 3.34Å; K360-R372 HydrophobicContact CG-CG 4.29Å
373	F	88.6	Confident	87.6	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.009	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	136.2	174.9	-40.7	-91.6	0	0	0	109.1	L351 L359 L361 F394 W406 I408 S411	L351-F373 HydrophobicContact CD2-CE2 4.16Å; L359-F373 HydrophobicContact CB-CB 4.05Å; L359-F373 HydrophobicContact CB-CD2 4.13Å; L359-F373 HydrophobicContact CD1-CB 4.42Å; L359-F373 PolarHBondContact N-O 3.23Å; L359-F373 PolarHBondContact O-N 3.36Å; L361-F373 HydrophobicContact CB-CE2 4.08Å; F373-F394 HydrophobicContact CB-CZ 4.4Å; F373-F394 HydrophobicContact CD1-CE1 4.33Å; F373-F394 HydrophobicContact CD1-CZ 4.13Å; F373-F394 AromaticContact CD2-CE1 3.91Å; F373-F394 HydrophobicContact CD2-CE1 3.91Å; F373-F394 AromaticContact CD2-CZ 3.46Å; F373-F394 HydrophobicContact CD2-CZ 3.46Å; F373-F394 VanDerWaalsContact CD2-CZ 3.46Å; F373-F394 HydrophobicContact CE1-CE1 4Å; F373-F394 HydrophobicContact CE1-CZ 4.25Å; F373-F394 AromaticContact CE2-CE1 3.55Å; F373-F394 HydrophobicContact CE2-CE1 3.55Å; F373-F394 AromaticContact CE2-CZ 3.63Å; F373-F394 HydrophobicContact CE2-CZ 3.63Å; F373-F394 HydrophobicContact CG-CE1 4.29Å; F373-F394 AromaticContact CG-CZ 3.73Å; F373-F394 HydrophobicContact CG-CZ 3.73Å; F373-F394 AromaticContact CZ-CE1 3.61Å; F373-F394 HydrophobicContact CZ-CE1 3.61Å; F373-F394 HydrophobicContact CZ-CZ 4.04Å; F373-W406 HydrophobicContact CB-CD2 4.11Å; F373-W406 HydrophobicContact CB-CE3 4.15Å; F373-W406 HydrophobicContact CB-CH2 4.32Å; F373-W406 HydrophobicContact CB-CZ2 4.29Å; F373-W406 HydrophobicContact CB-CZ3 4.26Å; F373-W406 HydrophobicContact CD1-CD2 4.13Å; F373-W406 AromaticContact CD1-CE3 3.69Å; F373-W406 HydrophobicContact CD1-CE3 3.69Å; F373-W406 HydrophobicContact CD1-CZ3 4.22Å; F373-W406 HydrophobicContact CG-CD2 4.38Å; F373-W406 HydrophobicContact CG-CE3 4.3Å; F373-I408 HydrophobicContact CZ-CB 4.47Å; F373-I408 HydrophobicContact CZ-CG1 4.21Å; F373-S411 WeakPolarHBondContact CE1-OG 3.38Å
374	T	85.4	Confident	87.6	Confident	67 Å²	67	49.6 Å²	49.6	41%	0.411	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	139.9	178.7	-170	0	0	0	0	110.3	R357 Y358 W406	R357-T374 PolarHBondContact O-OG1 3.1Å; Y358-T374 HydrophobicContact CE1-CG2 4.39Å; T374-W406 WeakPolarHBondContact O-CH2 3.45Å
375	N	79.8	Confident	87.8	Confident	49 Å²	49	49.6 Å²	49.6	26%	0.262	23%	0.232	S	C	.	.			trans	-130.2	24.8	173.1	-159.3	-14.7	0	0	0	111.7	K377 M398 W406	N375-K377 WeakPolarHBondContact O-CG 3.32Å; N375-K377 PolarHBondContact O-N 3.24Å; N375-M398 HydrophobicContact CB-CE 3.95Å; N375-W406 HydrophobicContact CB-CZ2 4.22Å
376	R	84.8	Confident	87.6	Confident	209 Å²	209	48.9 Å²	48.9	79%	0.789	23%	0.232	S	C	*	.	S	Bend	trans	53.7	1	-175.3	-59.1	-177.5	176.9	-175.2	-0.6	115.9	R357	R357-R376 WeakPolarHBondContact CD-O 3.38Å
377	K	89.6	Confident	87.7	Confident	81 Å²	81	48.9 Å²	48.9	35%	0.352	23%	0.23	S	C	.	.	S	Bend	trans	-124.6	158	-175.6	-59.3	-71.1	177.4	149.8	0	109	R357 N375 P379 M398 D400	R357-K377 WeakPolarHBondContact CB-O 3.34Å; N375-K377 WeakPolarHBondContact O-CG 3.32Å; N375-K377 PolarHBondContact O-N 3.24Å; K377-P379 WeakPolarHBondContact O-CD 3.43Å; K377-M398 HydrophobicContact CB-CE 3.89Å; K377-M398 WeakPolarHBondContact O-CE 3.48Å; K377-D400 HydrophobicContact CB-CB 4.37Å; K377-D400 HydrophobicContact CD-CB 4.02Å; K377-D400 WeakPolarHBondContact CE-OD2 3.5Å; K377-D400 HydrophobicContact CG-CB 3.91Å; K377-D400 IonicContact NZ-OD1 2.68Å; K377-D400 IonicContact NZ-OD2 2.64Å; K377-D400 PolarHBondContact NZ-OD2 2.7Å; K377-D400 VanDerWaalsContact NZ-OD2 3.16Å
378	V	91.3	Very high	87.6	Confident	29 Å²	29	55.8 Å²	55.8	18%	0.176	26%	0.262	C	S	.	.			trans	-82.3	126.9	-175.3	173.5	0	0	0	0	109.9	Y355 R357 S399	Y355-V378 HydrophobicContact CD1-CG1 3.62Å; Y355-V378 HydrophobicContact CE1-CG1 4.13Å; Y355-V378 HydrophobicContact CG-CG1 4.48Å; R357-V378 HydrophobicContact CG-CG2 3.99Å; V378-S399 PolarHBondContact N-OG 3.41Å; V378-S399 WeakPolarHBondContact O-CB 3.44Å; V378-S399 PolarHBondContact O-N 2.95Å
379	P	93.3	Very high	87.4	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	133.2	167.2	33	-34.9	0	0	0	110.9	A353 A354 L359 K377 M398	A353-P379 HydrophobicContact CB-CB 3.89Å; A353-P379 HydrophobicContact CB-CG 3.77Å; A354-P379 WeakPolarHBondContact O-CD 3.24Å; L359-P379 HydrophobicContact CD1-CB 4.36Å; L359-P379 HydrophobicContact CD2-CB 3.7Å; L359-P379 HydrophobicContact CD2-CG 3.83Å; L359-P379 HydrophobicContact CG-CB 4.06Å; L359-P379 HydrophobicContact CG-CG 3.92Å; K377-P379 WeakPolarHBondContact O-CD 3.43Å; P379-M398 HydrophobicContact CB-CE 4.25Å; P379-M398 HydrophobicContact CB-SD 3.88Å
380	Y	91.6	Very high	87.2	Confident	70 Å²	70	58.1 Å²	58.1	28%	0.275	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-39.8	176.8	-81.4	-65.9	0	0	0	113.2	R339 Y355 G397 A423 V424	R339-Y380 WeakPolarHBondContact CG-O 3.43Å; Y355-Y380 AromaticContact CE1-CE1 4Å; Y355-Y380 HydrophobicContact CE1-CE1 4Å; Y380-G397 PolarHBondContact N-O 2.84Å; Y380-A423 HydrophobicContact CD2-CB 4.08Å; Y380-A423 HydrophobicContact CE2-CB 3.66Å; Y380-V424 VanDerWaalsContact CB-O 3.27Å; Y380-V424 WeakPolarHBondContact CB-O 3.39Å
381	C	89.7	Confident	86.9	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.02	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	146.8	-178.9	179.2	0	0	0	0	110.2	D340 A396 G397 N425	D340-C381 WeakPolarHBondContact OD2-CA 3.38Å; D340-C381 PolarHBondContact OD2-SG 3.15Å; C381-A396 CarbonylContact O-C 3.6Å; C381-A396 WeakPolarHBondContact O-CA 3.03Å; C381-G397 PolarHBondContact O-N 2.84Å; C381-N425 VanDerWaalsContact CB-O 3.28Å; C381-N425 WeakPolarHBondContact CB-O 3.35Å
382	V	92.6	Very high	86.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	135.1	177.2	-179.2	0	0	0	0	109.5	D340 C342 L351 A353 L359 F394 V395 A396	D340-V382 PolarHBondContact OD2-N 3.27Å; C342-V382 VanDerWaalsContact CB-O 3.31Å; C342-V382 WeakPolarHBondContact CB-O 3.38Å; L351-V382 HydrophobicContact CB-CG1 3.76Å; L351-V382 HydrophobicContact CD1-CG1 3.64Å; L351-V382 HydrophobicContact CG-CG1 4.3Å; A353-V382 HydrophobicContact CB-CG2 3.43Å; A353-V382 VanDerWaalsContact CB-CG2 3.43Å; L359-V382 HydrophobicContact CD2-CG2 3.19Å; V382-F394 HydrophobicContact CG1-CD2 4.09Å; V382-V395 WeakPolarHBondContact CA-O 3.44Å; V382-A396 HydrophobicContact CG2-CB 4.31Å
383	K	92.3	Very high	87	Confident	33 Å²	33	51.7 Å²	51.7	14%	0.143	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	130.8	171.7	-65.4	-66.9	178.1	-179.3	0	110.9	R297 V395 I427 F429	R297-K383 VanDerWaalsContact NH2-NZ 3.18Å; K383-V395 PolarHBondContact N-O 3.46Å; K383-V395 PolarHBondContact O-N 3.08Å; K383-I427 WeakPolarHBondContact CE-O 3.32Å; K383-I427 HydrophobicContact CG-CB 4.18Å; K383-I427 HydrophobicContact CG-CG2 4.39Å; K383-I427 VanDerWaalsContact CG-O 3.26Å; K383-I427 WeakPolarHBondContact CG-O 3.25Å; K383-F429 HydrophobicContact CB-CD2 4.2Å; K383-F429 HydrophobicContact CB-CE2 3.67Å
384	F	91.1	Very high	87.1	Confident	9 Å²	9	51.6 Å²	51.6	4%	0.039	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	148.5	164.5	-85.4	-78.6	0	0	0	110.4	C342 F343 N344 L351 L361 P386 F394 I408 F429	C342-F384 HydrophobicContact CB-CD2 4.36Å; F343-F384 VanDerWaalsContact C-CD2 3.48Å; F343-F384 VanDerWaalsContact O-CD2 3.28Å; F343-F384 WeakPolarHBondContact O-CD2 3.44Å; N344-F384 HydrophobicContact CB-CD2 4.41Å; N344-F384 HydrophobicContact CB-CE1 4.4Å; N344-F384 HydrophobicContact CB-CE2 4.29Å; N344-F384 HydrophobicContact CB-CZ 4.27Å; L351-F384 HydrophobicContact CB-CE2 3.83Å; L351-F384 HydrophobicContact CB-CZ 4.33Å; L351-F384 HydrophobicContact CD1-CD1 4.13Å; L351-F384 HydrophobicContact CD1-CD2 3.82Å; L351-F384 HydrophobicContact CD1-CE1 3.73Å; L351-F384 HydrophobicContact CD1-CE2 3.37Å; L351-F384 HydrophobicContact CD1-CG 4.19Å; L351-F384 HydrophobicContact CD1-CZ 3.33Å; L351-F384 HydrophobicContact CD2-CZ 4.5Å; L351-F384 HydrophobicContact CG-CD2 4.29Å; L351-F384 HydrophobicContact CG-CE1 4.27Å; L351-F384 HydrophobicContact CG-CE2 3.41Å; L351-F384 VanDerWaalsContact CG-CE2 3.41Å; L351-F384 HydrophobicContact CG-CZ 3.41Å; L351-F384 VanDerWaalsContact CG-CZ 3.41Å; L361-F384 HydrophobicContact CD1-CZ 3.7Å; F384-P386 WeakPolarHBondContact O-CD 3.22Å; F384-F394 HydrophobicContact CD1-CB 4.04Å; F384-F394 HydrophobicContact CE1-CB 4.46Å; F384-F394 HydrophobicContact CG-CB 4.45Å; F384-I408 HydrophobicContact CD1-CD1 4.38Å; F384-I408 HydrophobicContact CE1-CD1 3.49Å; F384-I408 VanDerWaalsContact CE1-CD1 3.49Å; F384-I408 HydrophobicContact CZ-CD1 4.28Å; F384-F429 WeakPolarHBondContact O-CE2 3.31Å
385	N	87.6	Confident	87.5	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.227	C	C	.	.			trans	-62.1	126	163.4	-164.2	-13.4	0	0	0	108.5	D387 K390 Q391 L393 F429 W450	N385-D387 PolarHBondContact OD1-N 2.71Å; N385-K390 HydrophobicContact CB-CB 4.46Å; N385-K390 VanDerWaalsContact ND2-CB 3.31Å; N385-K390 WeakPolarHBondContact ND2-CB 3.47Å; N385-Q391 PolarHBondContact O-NE2 3.33Å; N385-L393 WeakPolarHBondContact CB-O 3.24Å; N385-L393 PolarHBondContact N-O 3.37Å; N385-L393 VanDerWaalsContact N-O 3.08Å; N385-F429 HydrophobicContact CB-CZ 4.42Å; N385-W450 HydrophobicContact CB-CH2 3.9Å; N385-W450 HydrophobicContact CB-CZ2 4.16Å; N385-W450 HydrophobicContact CB-CZ3 4.47Å; N385-W450 VanDerWaalsContact ND2-CE2 3.29Å; N385-W450 WeakPolarHBondContact ND2-CZ2 3.46Å
386	P	81.9	Confident	88.2	Confident	41 Å²	41	46 Å²	46	27%	0.266	21%	0.214	S	C	.	.			trans	-81.7	-5.9	-179.6	-1.6	20	0	0	0	112.8	F384 F429 N433	F384-P386 WeakPolarHBondContact O-CD 3.22Å; P386-F429 HydrophobicContact CG-CB 3.82Å; P386-F429 HydrophobicContact CG-CD1 4.31Å; P386-F429 HydrophobicContact CG-CD2 3.73Å; P386-F429 HydrophobicContact CG-CE2 4.36Å; P386-F429 HydrophobicContact CG-CG 3.69Å; P386-N433 WeakPolarHBondContact CB-ND2 3.1Å; P386-N433 HydrophobicContact CG-CB 4.35Å; P386-N433 VanDerWaalsContact CG-OD1 3.29Å; P386-N433 WeakPolarHBondContact CG-OD1 3.42Å
387	D	84.5	Confident	88.6	Confident	47 Å²	47	36.1 Å²	36.1	25%	0.251	18%	0.177	S	C	.	.	S	Bend	trans	-74	131.5	175.3	-166.6	11.4	0	0	0	111.3	N385 D389 K390 Q391 N433	N385-D387 PolarHBondContact OD1-N 2.71Å; D387-D389 VanDerWaalsContact C-N 3.27Å; D387-D389 PolarHBondContact O-N 3.35Å; D387-K390 PolarHBondContact O-N 2.72Å; D387-K390 WeakPolarHBondContact OD2-CE 3.4Å; D387-K390 IonicContact OD2-NZ 2.68Å; D387-K390 PolarHBondContact OD2-NZ 3.32Å; D387-Q391 PolarHBondContact O-N 3.22Å; D387-N433 HydrophobicContact CB-CB 4.36Å; D387-N433 PolarHBondContact N-ND2 3.44Å
388	E	79.5	Confident	88.8	Confident	146 Å²	146	32.4 Å²	32.4	68%	0.682	16%	0.161	S	C	*	.	G	3₁₀ helix	trans	-63.3	-35.8	-173.6	-68.1	-172.4	172.7	0	0	111.7	K390	E388-K390 VanDerWaalsContact C-N 3.28Å; E388-K390 PolarHBondContact O-N 3.09Å
389	D	81	Confident	88.8	Confident	139 Å²	139	32.9 Å²	32.9	74%	0.743	17%	0.166	S	C	*	.	G	3₁₀ helix	trans	-68	-27	-179.3	-68.7	-22.1	0	0	0	113.2	D387	D387-D389 VanDerWaalsContact C-N 3.27Å; D387-D389 PolarHBondContact O-N 3.35Å
390	K	82.4	Confident	88.6	Confident	67 Å²	67	36.3 Å²	36.3	29%	0.291	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-119.3	25.7	-169.5	-71	-180	-72.8	-72.8	0	112.7	N385 D387 E388 N392 L393	N385-K390 HydrophobicContact CB-CB 4.46Å; N385-K390 VanDerWaalsContact ND2-CB 3.31Å; N385-K390 WeakPolarHBondContact ND2-CB 3.47Å; D387-K390 PolarHBondContact O-N 2.72Å; D387-K390 WeakPolarHBondContact OD2-CE 3.4Å; D387-K390 IonicContact OD2-NZ 2.68Å; D387-K390 PolarHBondContact OD2-NZ 3.32Å; E388-K390 VanDerWaalsContact C-N 3.28Å; E388-K390 PolarHBondContact O-N 3.09Å; K390-N392 PolarHBondContact O-N 3.35Å; K390-N392 VanDerWaalsContact O-N 3.09Å; K390-L393 HydrophobicContact CB-CD1 4.32Å; K390-L393 HydrophobicContact CD-CD1 4.49Å; K390-L393 HydrophobicContact CG-CD1 4.42Å; K390-L393 PolarHBondContact O-N 3.19Å
391	Q	82.6	Confident	88.7	Confident	35 Å²	35	37.8 Å²	37.8	16%	0.164	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-19.4	-176.3	-166.3	61.2	71.4	0	0	114	N344 N385 D387 L393	N344-Q391 HydrophobicContact CB-CG 4.35Å; N385-Q391 PolarHBondContact O-NE2 3.33Å; D387-Q391 PolarHBondContact O-N 3.22Å; Q391-L393 VanDerWaalsContact C-N 3.25Å; Q391-L393 PolarHBondContact O-N 2.88Å
392	N	85.6	Confident	88.8	Confident	38 Å²	38	40.9 Å²	40.9	20%	0.203	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-13.1	174.5	62.8	-52.2	0	0	0	113.6	K390 D407 I408 R409	K390-N392 PolarHBondContact O-N 3.35Å; K390-N392 VanDerWaalsContact O-N 3.09Å; N392-D407 PolarHBondContact ND2-OD1 2.9Å; N392-I408 WeakPolarHBondContact O-CB 3.37Å; N392-I408 WeakPolarHBondContact O-CD1 3.1Å; N392-I408 WeakPolarHBondContact O-CG1 3.28Å; N392-I408 PolarHBondContact O-N 2.98Å; N392-R409 HydrophobicContact CB-CG 4.4Å
393	L	91.4	Very high	88.9	Confident	20 Å²	20	40.9 Å²	40.9	11%	0.105	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	134.5	178.5	-61.7	170.8	0	0	0	110.3	N385 K390 Q391 W406 D407 V414 W450	N385-L393 WeakPolarHBondContact CB-O 3.24Å; N385-L393 PolarHBondContact N-O 3.37Å; N385-L393 VanDerWaalsContact N-O 3.08Å; K390-L393 HydrophobicContact CB-CD1 4.32Å; K390-L393 HydrophobicContact CD-CD1 4.49Å; K390-L393 HydrophobicContact CG-CD1 4.42Å; K390-L393 PolarHBondContact O-N 3.19Å; Q391-L393 VanDerWaalsContact C-N 3.25Å; Q391-L393 PolarHBondContact O-N 2.88Å; L393-W406 WeakPolarHBondContact CA-O 3.26Å; L393-D407 HydrophobicContact CD2-CB 3.78Å; L393-V414 HydrophobicContact CD2-CG2 4.02Å; L393-W450 HydrophobicContact CB-CH2 4.17Å; L393-W450 HydrophobicContact CB-CZ2 3.72Å; L393-W450 HydrophobicContact CD1-CZ2 3.85Å; L393-W450 HydrophobicContact CG-CZ2 4.42Å
394	F	92.4	Very high	89	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	158	170.2	71.8	-91.1	0	0	0	111	L351 L359 F373 V382 F384 Q405 W406 I408	L351-F394 HydrophobicContact CD1-CB 3.54Å; L351-F394 HydrophobicContact CD1-CD1 3.69Å; L351-F394 HydrophobicContact CD1-CD2 3.65Å; L351-F394 HydrophobicContact CD1-CE1 4.27Å; L351-F394 HydrophobicContact CD1-CE2 4.24Å; L351-F394 HydrophobicContact CD1-CG 3.33Å; L351-F394 HydrophobicContact CD2-CE1 4.37Å; L351-F394 HydrophobicContact CD2-CZ 4.4Å; L359-F394 HydrophobicContact CD1-CE2 4.21Å; F373-F394 HydrophobicContact CB-CZ 4.4Å; F373-F394 HydrophobicContact CD1-CE1 4.33Å; F373-F394 HydrophobicContact CD1-CZ 4.13Å; F373-F394 AromaticContact CD2-CE1 3.91Å; F373-F394 HydrophobicContact CD2-CE1 3.91Å; F373-F394 AromaticContact CD2-CZ 3.46Å; F373-F394 HydrophobicContact CD2-CZ 3.46Å; F373-F394 VanDerWaalsContact CD2-CZ 3.46Å; F373-F394 HydrophobicContact CE1-CE1 4Å; F373-F394 HydrophobicContact CE1-CZ 4.25Å; F373-F394 AromaticContact CE2-CE1 3.55Å; F373-F394 HydrophobicContact CE2-CE1 3.55Å; F373-F394 AromaticContact CE2-CZ 3.63Å; F373-F394 HydrophobicContact CE2-CZ 3.63Å; F373-F394 HydrophobicContact CG-CE1 4.29Å; F373-F394 AromaticContact CG-CZ 3.73Å; F373-F394 HydrophobicContact CG-CZ 3.73Å; F373-F394 AromaticContact CZ-CE1 3.61Å; F373-F394 HydrophobicContact CZ-CE1 3.61Å; F373-F394 HydrophobicContact CZ-CZ 4.04Å; V382-F394 HydrophobicContact CG1-CD2 4.09Å; F384-F394 HydrophobicContact CD1-CB 4.04Å; F384-F394 HydrophobicContact CE1-CB 4.46Å; F384-F394 HydrophobicContact CG-CB 4.45Å; F394-Q405 WeakPolarHBondContact O-CA 3.46Å; F394-W406 HydrophobicContact CD1-CB 3.96Å; F394-W406 HydrophobicContact CD2-CB 4.27Å; F394-W406 HydrophobicContact CE1-CB 3.38Å; F394-W406 HydrophobicContact CE1-CG 4.17Å; F394-W406 HydrophobicContact CE2-CB 3.72Å; F394-W406 AromaticContact CE2-CD1 3.57Å; F394-W406 AromaticContact CE2-CG 3.81Å; F394-W406 HydrophobicContact CE2-CG 3.81Å; F394-W406 HydrophobicContact CG-CB 4.38Å; F394-W406 HydrophobicContact CZ-CB 3.24Å; F394-W406 AromaticContact CZ-CD1 3.77Å; F394-W406 HydrophobicContact CZ-CD2 4.41Å; F394-W406 AromaticContact CZ-CG 3.52Å; F394-W406 HydrophobicContact CZ-CG 3.52Å; F394-W406 PolarHBondContact N-O 3.02Å; F394-W406 VanDerWaalsContact N-O 3.08Å; F394-W406 PolarHBondContact O-N 3.39Å; F394-I408 HydrophobicContact CD1-CD1 4.1Å; F394-I408 HydrophobicContact CD1-CG1 3.64Å; F394-I408 HydrophobicContact CE1-CG1 3.82Å
395	V	93.3	Very high	89.1	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.4	-179	177.5	0	0	0	0	109.5	V382 K383 I403 Q405 I427 W450	V382-V395 WeakPolarHBondContact CA-O 3.44Å; K383-V395 PolarHBondContact N-O 3.46Å; K383-V395 PolarHBondContact O-N 3.08Å; V395-I403 HydrophobicContact CG1-CG2 3.04Å; V395-Q405 HydrophobicContact CG2-CB 4.3Å; V395-Q405 HydrophobicContact CG2-CG 4.35Å; V395-I427 HydrophobicContact CG1-CD1 3.56Å; V395-W450 HydrophobicContact CG2-CH2 3.59Å; V395-W450 HydrophobicContact CG2-CZ3 3.38Å
396	A	93.3	Very high	89.4	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	128.2	175.7	0	0	0	0	0	110.7	L359 C381 V382 M398 I403 V404	L359-A396 HydrophobicContact CD1-CB 3.83Å; L359-A396 HydrophobicContact CD2-CB 4.27Å; C381-A396 CarbonylContact O-C 3.6Å; C381-A396 WeakPolarHBondContact O-CA 3.03Å; V382-A396 HydrophobicContact CG2-CB 4.31Å; A396-M398 HydrophobicContact CB-SD 4.06Å; A396-I403 WeakPolarHBondContact O-CA 3.39Å; A396-V404 PolarHBondContact N-O 2.79Å; A396-V404 PolarHBondContact O-N 3.02Å
397	G	93.4	Very high	89.8	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	116.9	170.3	0	0	0	0	0	109.7	Y380 C381	Y380-G397 PolarHBondContact N-O 2.84Å; C381-G397 PolarHBondContact O-N 2.84Å
398	M	93.3	Very high	90.1	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.015	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	160.8	-175.2	-53.7	-59.6	-63.1	0	0	111.8	N375 K377 P379 A396 D400 K402 V404 V424	N375-M398 HydrophobicContact CB-CE 3.95Å; K377-M398 HydrophobicContact CB-CE 3.89Å; K377-M398 WeakPolarHBondContact O-CE 3.48Å; P379-M398 HydrophobicContact CB-CE 4.25Å; P379-M398 HydrophobicContact CB-SD 3.88Å; A396-M398 HydrophobicContact CB-SD 4.06Å; M398-D400 PolarHBondContact O-N 2.88Å; M398-K402 VanDerWaalsContact CB-O 3.28Å; M398-K402 WeakPolarHBondContact CB-O 3.48Å; M398-K402 PolarHBondContact N-O 3.11Å; M398-V404 HydrophobicContact CG-CB 4.35Å; M398-V404 HydrophobicContact CG-CG2 3.71Å; M398-V424 PolarHBondContact O-N 2.89Å
399	S	92.1	Very high	90.5	Very high	40 Å²	40	40.5 Å²	40.5	28%	0.28	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-23.5	170.7	68.3	0	0	0	0	112.9	V378 K401	V378-S399 PolarHBondContact N-OG 3.41Å; V378-S399 WeakPolarHBondContact O-CB 3.44Å; V378-S399 PolarHBondContact O-N 2.95Å; S399-K401 PolarHBondContact O-N 3.18Å
400	D	90	Very high	90.7	Very high	71 Å²	71	37.5 Å²	37.5	38%	0.38	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	27.6	-176.7	-146.5	14.9	0	0	0	112.8	K377 M398 K402	K377-D400 HydrophobicContact CB-CB 4.37Å; K377-D400 HydrophobicContact CD-CB 4.02Å; K377-D400 WeakPolarHBondContact CE-OD2 3.5Å; K377-D400 HydrophobicContact CG-CB 3.91Å; K377-D400 IonicContact NZ-OD1 2.68Å; K377-D400 IonicContact NZ-OD2 2.64Å; K377-D400 PolarHBondContact NZ-OD2 2.7Å; K377-D400 VanDerWaalsContact NZ-OD2 3.16Å; M398-D400 PolarHBondContact O-N 2.88Å; D400-K402 PolarHBondContact O-N 2.83Å
401	K	91.9	Very high	90.8	Very high	102 Å²	102	36.5 Å²	36.5	44%	0.443	18%	0.179	S	C	.	.	S	Bend	trans	66.1	-22.9	-176.9	-42.6	165.3	-177.9	-163.3	0	114.2	S399 H420 L421 G422 V424	S399-K401 PolarHBondContact O-N 3.18Å; K401-H420 HydrophobicContact CB-CB 4.29Å; K401-H420 VanDerWaalsContact CB-O 3.32Å; K401-H420 WeakPolarHBondContact CB-O 3.46Å; K401-H420 WeakPolarHBondContact O-CB 3.31Å; K401-L421 WeakPolarHBondContact CD-O 3.49Å; K401-L421 WeakPolarHBondContact CE-O 3.49Å; K401-L421 PolarHBondContact NZ-O 3.25Å; K401-L421 VanDerWaalsContact NZ-O 3.13Å; K401-G422 VanDerWaalsContact CA-O 3.27Å; K401-G422 WeakPolarHBondContact CA-O 3.43Å; K401-G422 WeakPolarHBondContact CB-O 3.43Å; K401-V424 VanDerWaalsContact O-CG2 3.28Å; K401-V424 WeakPolarHBondContact O-CG2 3.38Å
402	K	93.1	Very high	91.1	Very high	67 Å²	67	41.1 Å²	41.1	29%	0.291	20%	0.2	S	C	.	.			trans	-72.3	145.4	179.6	-63.4	-179.2	176.7	-167.9	0	112	M398 D400 V404 E416 Y417 D418	M398-K402 VanDerWaalsContact CB-O 3.28Å; M398-K402 WeakPolarHBondContact CB-O 3.48Å; M398-K402 PolarHBondContact N-O 3.11Å; D400-K402 PolarHBondContact O-N 2.83Å; K402-V404 HydrophobicContact CB-CG2 4.23Å; K402-E416 IonicContact NZ-OE2 3.96Å; K402-E416 PolarHBondContact NZ-OE2 3.27Å; K402-Y417 VanDerWaalsContact CA-O 3.29Å; K402-Y417 WeakPolarHBondContact CA-O 3.18Å; K402-D418 HydrophobicContact CG-CB 4.49Å
403	I	94.5	Very high	91.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	132.8	159.2	-56.5	174.3	0	0	0	106.4	V395 A396 E416 Y417 V424 I427 F436 W448	V395-I403 HydrophobicContact CG1-CG2 3.04Å; A396-I403 WeakPolarHBondContact O-CA 3.39Å; I403-E416 WeakPolarHBondContact O-CA 3.27Å; I403-Y417 HydrophobicContact CB-CD2 3.96Å; I403-Y417 HydrophobicContact CB-CG 4.3Å; I403-Y417 HydrophobicContact CG2-CD2 3.98Å; I403-Y417 PolarHBondContact N-O 3.38Å; I403-Y417 WeakPolarHBondContact O-CD2 3.31Å; I403-Y417 PolarHBondContact O-N 3.22Å; I403-V424 HydrophobicContact CD1-CG1 4.14Å; I403-V424 HydrophobicContact CD1-CG2 4.4Å; I403-V424 HydrophobicContact CG1-CB 4.35Å; I403-V424 HydrophobicContact CG1-CG1 3.98Å; I403-V424 HydrophobicContact CG1-CG2 3.73Å; I403-I427 HydrophobicContact CD1-CD1 4.28Å; I403-I427 HydrophobicContact CG1-CD1 4.31Å; I403-I427 HydrophobicContact CG2-CD1 3.66Å; I403-F436 HydrophobicContact CD1-CE2 3.98Å; I403-F436 HydrophobicContact CG2-CE2 4.44Å; I403-W448 HydrophobicContact CD1-CZ2 4.42Å
404	V	94	Very high	91.3	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	125	-174.1	-175.1	0	0	0	0	108.8	A396 M398 K402 W406 V413	A396-V404 PolarHBondContact N-O 2.79Å; A396-V404 PolarHBondContact O-N 3.02Å; M398-V404 HydrophobicContact CG-CB 4.35Å; M398-V404 HydrophobicContact CG-CG2 3.71Å; K402-V404 HydrophobicContact CB-CG2 4.23Å; V404-W406 HydrophobicContact CG1-CZ2 4.4Å; V404-V413 HydrophobicContact CG1-CB 4.21Å; V404-V413 HydrophobicContact CG1-CG1 3.51Å; V404-V413 HydrophobicContact CG1-CG2 3.7Å
405	Q	93.8	Very high	91.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	128.4	173.8	-178.6	178	-36.7	0	0	109	F394 V395 V414 Q415 Y417 W450 D451	F394-Q405 WeakPolarHBondContact O-CA 3.46Å; V395-Q405 HydrophobicContact CG2-CB 4.3Å; V395-Q405 HydrophobicContact CG2-CG 4.35Å; Q405-V414 HydrophobicContact CG-CB 4.3Å; Q405-V414 PolarHBondContact O-N 3.17Å; Q405-Q415 HydrophobicContact CB-CB 4.05Å; Q405-Q415 PolarHBondContact N-O 2.83Å; Q405-Q415 PolarHBondContact O-N 2.7Å; Q405-Y417 HydrophobicContact CB-CE2 4.37Å; Q405-Y417 PolarHBondContact OE1-OH 3.07Å; Q405-W450 HydrophobicContact CG-CH2 4.38Å; Q405-W450 HydrophobicContact CG-CZ2 4.42Å; Q405-D451 PolarHBondContact NE2-OD1 3.48Å; Q405-D451 VanDerWaalsContact NE2-OD1 3.16Å
406	W	92.9	Very high	91.2	Very high	16 Å²	16	49.9 Å²	49.9	6%	0.061	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	145.4	-179.8	-71.6	89.3	0	0	0	110.1	F373 T374 N375 L393 F394 V404 S411 E412 V413	F373-W406 HydrophobicContact CB-CD2 4.11Å; F373-W406 HydrophobicContact CB-CE3 4.15Å; F373-W406 HydrophobicContact CB-CH2 4.32Å; F373-W406 HydrophobicContact CB-CZ2 4.29Å; F373-W406 HydrophobicContact CB-CZ3 4.26Å; F373-W406 HydrophobicContact CD1-CD2 4.13Å; F373-W406 AromaticContact CD1-CE3 3.69Å; F373-W406 HydrophobicContact CD1-CE3 3.69Å; F373-W406 HydrophobicContact CD1-CZ3 4.22Å; F373-W406 HydrophobicContact CG-CD2 4.38Å; F373-W406 HydrophobicContact CG-CE3 4.3Å; T374-W406 WeakPolarHBondContact O-CH2 3.45Å; N375-W406 HydrophobicContact CB-CZ2 4.22Å; L393-W406 WeakPolarHBondContact CA-O 3.26Å; F394-W406 HydrophobicContact CD1-CB 3.96Å; F394-W406 HydrophobicContact CD2-CB 4.27Å; F394-W406 HydrophobicContact CE1-CB 3.38Å; F394-W406 HydrophobicContact CE1-CG 4.17Å; F394-W406 HydrophobicContact CE2-CB 3.72Å; F394-W406 AromaticContact CE2-CD1 3.57Å; F394-W406 AromaticContact CE2-CG 3.81Å; F394-W406 HydrophobicContact CE2-CG 3.81Å; F394-W406 HydrophobicContact CG-CB 4.38Å; F394-W406 HydrophobicContact CZ-CB 3.24Å; F394-W406 AromaticContact CZ-CD1 3.77Å; F394-W406 HydrophobicContact CZ-CD2 4.41Å; F394-W406 AromaticContact CZ-CG 3.52Å; F394-W406 HydrophobicContact CZ-CG 3.52Å; F394-W406 PolarHBondContact N-O 3.02Å; F394-W406 VanDerWaalsContact N-O 3.08Å; F394-W406 PolarHBondContact O-N 3.39Å; V404-W406 HydrophobicContact CG1-CZ2 4.4Å; W406-S411 VanDerWaalsContact CZ3-O 3.26Å; W406-S411 WeakPolarHBondContact CZ3-O 3.45Å; W406-E412 VanDerWaalsContact CE3-C 3.44Å; W406-V413 HydrophobicContact CD2-CG2 4.02Å; W406-V413 HydrophobicContact CE3-CG2 3.97Å; W406-V413 HydrophobicContact CH2-CG2 3.43Å; W406-V413 VanDerWaalsContact CH2-CG2 3.43Å; W406-V413 HydrophobicContact CZ2-CG2 3.47Å; W406-V413 VanDerWaalsContact CZ2-CG2 3.47Å; W406-V413 HydrophobicContact CZ3-CG2 3.68Å
407	D	91.9	Very high	91.2	Very high	26 Å²	26	49.9 Å²	49.9	14%	0.139	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	127.4	163	-175.8	4.3	0	0	0	109.6	N392 L393 R409 S411 E412 V414	N392-D407 PolarHBondContact ND2-OD1 2.9Å; L393-D407 HydrophobicContact CD2-CB 3.78Å; D407-R409 VanDerWaalsContact C-N 3.26Å; D407-R409 PolarHBondContact O-N 2.8Å; D407-R409 PolarHBondContact OD1-N 2.87Å; D407-R409 VanDerWaalsContact OD1-N 3.09Å; D407-S411 WeakPolarHBondContact O-CA 3.28Å; D407-S411 PolarHBondContact O-N 3.46Å; D407-E412 PolarHBondContact N-O 3.38Å; D407-V414 HydrophobicContact CB-CG2 3.68Å
408	I	89.2	Confident	91.2	Very high	23 Å²	23	53.6 Å²	53.6	12%	0.118	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-33.4	-179.5	-68.3	165.5	0	0	0	111.5	L361 F373 F384 N392 F394 S411	L361-I408 HydrophobicContact CD2-CD1 4.36Å; L361-I408 HydrophobicContact CD2-CG1 4.36Å; L361-I408 HydrophobicContact CD2-CG2 3.4Å; F373-I408 HydrophobicContact CZ-CB 4.47Å; F373-I408 HydrophobicContact CZ-CG1 4.21Å; F384-I408 HydrophobicContact CD1-CD1 4.38Å; F384-I408 HydrophobicContact CE1-CD1 3.49Å; F384-I408 VanDerWaalsContact CE1-CD1 3.49Å; F384-I408 HydrophobicContact CZ-CD1 4.28Å; N392-I408 WeakPolarHBondContact O-CB 3.37Å; N392-I408 WeakPolarHBondContact O-CD1 3.1Å; N392-I408 WeakPolarHBondContact O-CG1 3.28Å; N392-I408 PolarHBondContact O-N 2.98Å; F394-I408 HydrophobicContact CD1-CD1 4.1Å; F394-I408 HydrophobicContact CD1-CG1 3.64Å; F394-I408 HydrophobicContact CE1-CG1 3.82Å; I408-S411 PolarHBondContact O-OG 3.16Å
409	R	88.6	Confident	91.1	Very high	204 Å²	204	59.5 Å²	59.5	77%	0.77	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-48.2	-174	-63.6	-178.9	-178.9	177.9	3.4	111.8	N392 D407	N392-R409 HydrophobicContact CB-CG 4.4Å; D407-R409 VanDerWaalsContact C-N 3.26Å; D407-R409 PolarHBondContact O-N 2.8Å; D407-R409 PolarHBondContact OD1-N 2.87Å; D407-R409 VanDerWaalsContact OD1-N 3.09Å
410	T	85.8	Confident	91.2	Very high	76 Å²	76	57.9 Å²	57.9	47%	0.466	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-23.1	179.3	60.6	0	0	0	0	111.9	E412	T410-E412 PolarHBondContact O-N 2.93Å; T410-E412 PolarHBondContact OG1-N 2.88Å
411	S	83.7	Confident	91.3	Very high	45 Å²	45	59.8 Å²	59.8	32%	0.315	29%	0.287	S	S	.	.			trans	55.9	29.8	-170	-57.5	0	0	0	0	113.6	S371 F373 W406 D407 I408	S371-S411 PolarHBondContact OG-OG 3.14Å; S371-S411 VanDerWaalsContact OG-OG 3.05Å; F373-S411 WeakPolarHBondContact CE1-OG 3.38Å; W406-S411 VanDerWaalsContact CZ3-O 3.26Å; W406-S411 WeakPolarHBondContact CZ3-O 3.45Å; D407-S411 WeakPolarHBondContact O-CA 3.28Å; D407-S411 PolarHBondContact O-N 3.46Å; I408-S411 PolarHBondContact O-OG 3.16Å
412	E	88.3	Confident	91.3	Very high	133 Å²	133	55.6 Å²	55.6	62%	0.621	27%	0.273	S	S	*	.	S	Bend	trans	-109.9	158.5	175.2	-67.3	-177.3	163.7	0	0	111.2	W406 D407 T410 V414	W406-E412 VanDerWaalsContact CE3-C 3.44Å; D407-E412 PolarHBondContact N-O 3.38Å; T410-E412 PolarHBondContact O-N 2.93Å; T410-E412 PolarHBondContact OG1-N 2.88Å; E412-V414 PolarHBondContact O-N 3.29Å
413	V	90.6	Very high	91.2	Very high	53 Å²	53	53.5 Å²	53.5	32%	0.321	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	118.4	173.3	176.2	0	0	0	0	108.3	V404 W406 E416	V404-V413 HydrophobicContact CG1-CB 4.21Å; V404-V413 HydrophobicContact CG1-CG1 3.51Å; V404-V413 HydrophobicContact CG1-CG2 3.7Å; W406-V413 HydrophobicContact CD2-CG2 4.02Å; W406-V413 HydrophobicContact CE3-CG2 3.97Å; W406-V413 HydrophobicContact CH2-CG2 3.43Å; W406-V413 VanDerWaalsContact CH2-CG2 3.43Å; W406-V413 HydrophobicContact CZ2-CG2 3.47Å; W406-V413 VanDerWaalsContact CZ2-CG2 3.47Å; W406-V413 HydrophobicContact CZ3-CG2 3.68Å; V413-E416 HydrophobicContact CG1-CG 3.84Å
414	V	90.9	Very high	91.2	Very high	66 Å²	66	53.5 Å²	53.5	40%	0.4	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-48.6	176.5	178	0	0	0	0	110	L393 Q405 D407 E412	L393-V414 HydrophobicContact CD2-CG2 4.02Å; Q405-V414 HydrophobicContact CG-CB 4.3Å; Q405-V414 PolarHBondContact O-N 3.17Å; D407-V414 HydrophobicContact CB-CG2 3.68Å; E412-V414 PolarHBondContact O-N 3.29Å
415	Q	90.3	Very high	91.1	Very high	55 Å²	55	55 Å²	55	26%	0.257	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	145.6	-172.6	-166.4	57	40.4	0	0	111.7	Q405 Y417	Q405-Q415 HydrophobicContact CB-CB 4.05Å; Q405-Q415 PolarHBondContact N-O 2.83Å; Q405-Q415 PolarHBondContact O-N 2.7Å; Q415-Y417 HydrophobicContact CG-CE2 4.35Å
416	E	92.9	Very high	91.1	Very high	67 Å²	67	56 Å²	56	31%	0.313	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	135.5	170.8	-60.1	-169	158.6	0	0	110.2	K402 I403 V413 P453	K402-E416 IonicContact NZ-OE2 3.96Å; K402-E416 PolarHBondContact NZ-OE2 3.27Å; I403-E416 WeakPolarHBondContact O-CA 3.27Å; V413-E416 HydrophobicContact CG1-CG 3.84Å; E416-P453 WeakPolarHBondContact O-CB 3.16Å
417	Y	93.8	Very high	91.1	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	115.7	172.1	-50.8	-103.9	0	0	0	108.8	K402 I403 Q405 Q415 F436 W448 D451 I452 P453	K402-Y417 VanDerWaalsContact CA-O 3.29Å; K402-Y417 WeakPolarHBondContact CA-O 3.18Å; I403-Y417 HydrophobicContact CB-CD2 3.96Å; I403-Y417 HydrophobicContact CB-CG 4.3Å; I403-Y417 HydrophobicContact CG2-CD2 3.98Å; I403-Y417 PolarHBondContact N-O 3.38Å; I403-Y417 WeakPolarHBondContact O-CD2 3.31Å; I403-Y417 PolarHBondContact O-N 3.22Å; Q405-Y417 HydrophobicContact CB-CE2 4.37Å; Q405-Y417 PolarHBondContact OE1-OH 3.07Å; Q415-Y417 HydrophobicContact CG-CE2 4.35Å; Y417-F436 HydrophobicContact CD1-CZ 4.09Å; Y417-F436 HydrophobicContact CD2-CZ 4.24Å; Y417-F436 HydrophobicContact CE1-CE1 4.02Å; Y417-F436 AromaticContact CE1-CZ 3.72Å; Y417-F436 HydrophobicContact CE1-CZ 3.72Å; Y417-F436 HydrophobicContact CE2-CE1 4.35Å; Y417-F436 AromaticContact CE2-CZ 3.89Å; Y417-F436 HydrophobicContact CE2-CZ 3.89Å; Y417-F436 HydrophobicContact CG-CZ 4.35Å; Y417-F436 AromaticContact CZ-CE1 3.79Å; Y417-F436 AromaticContact CZ-CZ 3.64Å; Y417-W448 AromaticContact CD1-CD2 3.91Å; Y417-W448 HydrophobicContact CD1-CD2 3.91Å; Y417-W448 AromaticContact CD1-CE3 3.49Å; Y417-W448 HydrophobicContact CD1-CE3 3.49Å; Y417-W448 VanDerWaalsContact CD1-CE3 3.49Å; Y417-W448 HydrophobicContact CD1-CG 4.38Å; Y417-W448 AromaticContact CD1-CZ3 3.89Å; Y417-W448 HydrophobicContact CD1-CZ3 3.89Å; Y417-W448 HydrophobicContact CE1-CB 4.36Å; Y417-W448 HydrophobicContact CE1-CE3 4.28Å; Y417-W448 HydrophobicContact CG-CE3 4.31Å; Y417-W448 HydrophobicContact CG-CZ3 4.41Å; Y417-D451 PolarHBondContact OH-N 3.46Å; Y417-I452 WeakPolarHBondContact CE1-O 2.99Å; Y417-P453 HydrophobicContact CD1-CB 4.49Å
418	D	93.5	Very high	91.1	Very high	78 Å²	78	54.6 Å²	54.6	42%	0.417	28%	0.276	S	S	.	.			trans	-115.1	5.1	-163.8	73.3	-16.6	0	0	0	115	K402 H420	K402-D418 HydrophobicContact CG-CB 4.49Å; D418-H420 VanDerWaalsContact C-N 3.29Å; D418-H420 PolarHBondContact O-N 2.78Å
419	R	92.1	Very high	91.2	Very high	127 Å²	127	54.3 Å²	54.3	48%	0.479	27%	0.274	S	S	.	.			trans	-76.3	-12.8	-173.3	-52.6	-74.8	106.3	173.5	6.3	114.5	R446 W448	R419-R446 PolarHBondContact O-NE 2.7Å; R419-R446 PolarHBondContact O-NH2 2.71Å; R419-W448 HydrophobicContact CB-CH2 3.56Å; R419-W448 HydrophobicContact CB-CZ2 4.45Å; R419-W448 HydrophobicContact CB-CZ3 4.2Å; R419-W448 HydrophobicContact CG-CH2 3.71Å; R419-W448 HydrophobicContact CG-CZ3 3.83Å
420	H	93	Very high	91.2	Very high	6 Å²	6	44.6 Å²	44.6	3%	0.028	24%	0.237	C	C	.	.			trans	-71.9	145.6	179.5	-79.9	-59	0	0	0	112.6	K401 D418 V424 S438 S440 R446 W448	K401-H420 HydrophobicContact CB-CB 4.29Å; K401-H420 VanDerWaalsContact CB-O 3.32Å; K401-H420 WeakPolarHBondContact CB-O 3.46Å; K401-H420 WeakPolarHBondContact O-CB 3.31Å; D418-H420 VanDerWaalsContact C-N 3.29Å; D418-H420 PolarHBondContact O-N 2.78Å; H420-V424 HydrophobicContact CB-CG2 4.39Å; H420-S438 PolarHBondContact CE1-OG 2.64Å; H420-S438 PolarHBondContact NE2-OG 3.16Å; H420-S440 PolarHBondContact CE1-OG 3.48Å; H420-S440 VanDerWaalsContact CE1-OG 3.27Å; H420-S440 WeakPolarHBondContact ND1-CB 3.34Å; H420-S440 PolarHBondContact ND1-OG 3.36Å; H420-R446 PolarHBondContact ND1-NH1 2.9Å; H420-W448 AromaticContact CD2-CZ2 3.75Å; H420-W448 AromaticContact NE2-CZ2 3.68Å; H420-W448 AromaticContact NE2-NE1 3.88Å
421	L	92.1	Very high	91	Very high	112 Å²	112	43.3 Å²	43.3	59%	0.586	23%	0.228	S	C	*	.	S	Bend	trans	-101.2	-16.9	-179.8	-72.8	87	0	0	0	113.3	K401 D442	K401-L421 WeakPolarHBondContact CD-O 3.49Å; K401-L421 WeakPolarHBondContact CE-O 3.49Å; K401-L421 PolarHBondContact NZ-O 3.25Å; K401-L421 VanDerWaalsContact NZ-O 3.13Å; L421-D442 HydrophobicContact CB-CB 4.01Å; L421-D442 PolarHBondContact N-OD2 3.19Å
422	G	91.7	Very high	90.8	Very high	14 Å²	14	50.2 Å²	50.2	14%	0.144	26%	0.255	C	S	.	.	S	Bend	trans	-128.8	175.8	179.6	0	0	0	0	0	112.3	K401 V424	K401-G422 VanDerWaalsContact CA-O 3.27Å; K401-G422 WeakPolarHBondContact CA-O 3.43Å; K401-G422 WeakPolarHBondContact CB-O 3.43Å; G422-V424 PolarHBondContact O-N 3.44Å
423	A	92.3	Very high	90.5	Very high	22 Å²	22	46.1 Å²	46.1	18%	0.182	24%	0.237	C	C	.	.			trans	-57.4	138.9	176	0	0	0	0	0	111	Y380 S440 D441	Y380-A423 HydrophobicContact CD2-CB 4.08Å; Y380-A423 HydrophobicContact CE2-CB 3.66Å; A423-S440 CarbonylContact O-C 3.59Å; A423-S440 WeakPolarHBondContact O-CA 3.43Å; A423-S440 WeakPolarHBondContact O-CB 3.28Å; A423-D441 PolarHBondContact O-N 2.76Å
424	V	94	Very high	90.3	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	118.7	179.6	-176.6	0	0	0	0	108.6	Y380 M398 K401 I403 H420 G422 I427 T439	Y380-V424 VanDerWaalsContact CB-O 3.27Å; Y380-V424 WeakPolarHBondContact CB-O 3.39Å; M398-V424 PolarHBondContact O-N 2.89Å; K401-V424 VanDerWaalsContact O-CG2 3.28Å; K401-V424 WeakPolarHBondContact O-CG2 3.38Å; I403-V424 HydrophobicContact CD1-CG1 4.14Å; I403-V424 HydrophobicContact CD1-CG2 4.4Å; I403-V424 HydrophobicContact CG1-CB 4.35Å; I403-V424 HydrophobicContact CG1-CG1 3.98Å; I403-V424 HydrophobicContact CG1-CG2 3.73Å; H420-V424 HydrophobicContact CB-CG2 4.39Å; G422-V424 PolarHBondContact O-N 3.44Å; V424-I427 HydrophobicContact CG1-CD1 4.39Å; V424-I427 HydrophobicContact CG1-CG1 4.13Å; V424-T439 CarbonylContact C-O 3.5Å; V424-T439 WeakPolarHBondContact CA-O 3.5Å; V424-T439 WeakPolarHBondContact CG1-O 3.35Å
425	N	92.5	Very high	90.3	Very high	33 Å²	33	48.4 Å²	48.4	18%	0.176	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-53.7	-175.8	-71.6	-32.4	0	0	0	111.7	C381 T439 S466	C381-N425 VanDerWaalsContact CB-O 3.28Å; C381-N425 WeakPolarHBondContact CB-O 3.35Å; N425-T439 PolarHBondContact N-O 3.44Å; N425-S466 PolarHBondContact ND2-OG 2.87Å
426	T	92.2	Very high	90.4	Very high	21 Å²	21	45.8 Å²	45.8	13%	0.129	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	156.4	-177.7	60.4	0	0	0	0	113.3	S438 T439 P468	T426-S438 WeakPolarHBondContact O-CA 3.25Å; T426-T439 PolarHBondContact N-OG1 2.86Å; T426-T439 PolarHBondContact O-N 2.82Å; T426-T439 PolarHBondContact OG1-OG1 2.92Å; T426-P468 WeakPolarHBondContact CG2-O 3.39Å
427	I	93.9	Very high	90.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	135.3	176.6	-58	179.3	0	0	0	107.7	K383 V395 I403 V424 F436 V437	K383-I427 WeakPolarHBondContact CE-O 3.32Å; K383-I427 HydrophobicContact CG-CB 4.18Å; K383-I427 HydrophobicContact CG-CG2 4.39Å; K383-I427 VanDerWaalsContact CG-O 3.26Å; K383-I427 WeakPolarHBondContact CG-O 3.25Å; V395-I427 HydrophobicContact CG1-CD1 3.56Å; I403-I427 HydrophobicContact CD1-CD1 4.28Å; I403-I427 HydrophobicContact CG1-CD1 4.31Å; I403-I427 HydrophobicContact CG2-CD1 3.66Å; V424-I427 HydrophobicContact CG1-CD1 4.39Å; V424-I427 HydrophobicContact CG1-CG1 4.13Å; I427-F436 HydrophobicContact CG2-CB 4.3Å; I427-F436 HydrophobicContact CG2-CD2 3.8Å; I427-F436 HydrophobicContact CG2-CG 4.31Å; I427-V437 WeakPolarHBondContact CA-O 3.08Å
428	T	91.2	Very high	90.4	Very high	12 Å²	12	42.7 Å²	42.7	7%	0.074	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	130.2	177.2	48.9	0	0	0	0	110	F436 V437 V470	T428-F436 CarbonylContact O-C 3.54Å; T428-F436 VanDerWaalsContact O-CA 3.25Å; T428-F436 WeakPolarHBondContact O-CA 3.11Å; T428-F436 WeakPolarHBondContact O-CB 3.27Å; T428-V437 PolarHBondContact N-O 3.46Å; T428-V437 PolarHBondContact O-N 3.35Å; T428-V437 PolarHBondContact OG1-O 2.9Å; T428-V470 HydrophobicContact CG2-CB 4.01Å; T428-V470 HydrophobicContact CG2-CG1 3.94Å; T428-V470 WeakPolarHBondContact CG2-O 3.27Å
429	F	91.3	Very high	90.3	Very high	16 Å²	16	39 Å²	39	7%	0.07	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	144.5	174.3	-74.7	-87.1	0	0	0	110.6	K383 F384 N385 P386 F436 W450	K383-F429 HydrophobicContact CB-CD2 4.2Å; K383-F429 HydrophobicContact CB-CE2 3.67Å; F384-F429 WeakPolarHBondContact O-CE2 3.31Å; N385-F429 HydrophobicContact CB-CZ 4.42Å; P386-F429 HydrophobicContact CG-CB 3.82Å; P386-F429 HydrophobicContact CG-CD1 4.31Å; P386-F429 HydrophobicContact CG-CD2 3.73Å; P386-F429 HydrophobicContact CG-CE2 4.36Å; P386-F429 HydrophobicContact CG-CG 3.69Å; F429-F436 HydrophobicContact CD1-CB 3.99Å; F429-F436 HydrophobicContact CE1-CB 4.24Å; F429-F436 HydrophobicContact CG-CB 4.37Å; F429-W450 AromaticContact CE1-CE3 3.61Å; F429-W450 HydrophobicContact CE1-CE3 3.61Å; F429-W450 HydrophobicContact CE1-CH2 4.49Å; F429-W450 AromaticContact CE1-CZ3 3.48Å; F429-W450 HydrophobicContact CE1-CZ3 3.48Å; F429-W450 VanDerWaalsContact CE1-CZ3 3.48Å; F429-W450 HydrophobicContact CZ-CE3 4.15Å; F429-W450 HydrophobicContact CZ-CH2 4.31Å; F429-W450 AromaticContact CZ-CZ3 3.52Å; F429-W450 HydrophobicContact CZ-CZ3 3.52Å
430	V	88.2	Confident	90.3	Very high	1 Å²	1	33 Å²	33	1%	0.006	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	158.9	-175.5	-174.6	0	0	0	0	109.1	N433 R435 V437 L472 L479 A493 F497	V430-N433 PolarHBondContact O-N 2.9Å; V430-R435 PolarHBondContact N-O 3.49Å; V430-R435 CarbonylContact O-C 3.57Å; V430-R435 PolarHBondContact O-N 2.84Å; V430-R435 VanDerWaalsContact O-N 3.16Å; V430-V437 HydrophobicContact CB-CG2 4.44Å; V430-V437 HydrophobicContact CG2-CB 4.37Å; V430-V437 HydrophobicContact CG2-CG2 3.67Å; V430-L472 HydrophobicContact CG1-CD1 4.47Å; V430-L472 HydrophobicContact CG2-CD1 4.25Å; V430-L479 HydrophobicContact CG2-CD1 4.18Å; V430-L479 HydrophobicContact CG2-CD2 3.81Å; V430-L479 HydrophobicContact CG2-CG 4.44Å; V430-A493 HydrophobicContact CG1-CB 3.67Å; V430-A493 VanDerWaalsContact CG1-O 3.23Å; V430-A493 WeakPolarHBondContact CG1-O 3.26Å; V430-F497 HydrophobicContact CG1-CE1 3.98Å; V430-F497 HydrophobicContact CG1-CZ 4.12Å
431	D	82.9	Confident	90.3	Very high	49 Å²	49	37.2 Å²	37.2	26%	0.262	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	57.5	170.7	-157.3	25.5	0	0	0	111.4	N433 R434 R435	D431-N433 PolarHBondContact O-N 2.93Å; D431-N433 VanDerWaalsContact O-N 3.16Å; D431-R434 WeakPolarHBondContact O-CB 3.4Å; D431-R434 PolarHBondContact O-N 2.75Å; D431-R435 HydrophobicContact CB-CB 4.28Å; D431-R435 IonicContact OD2-CZ 3.8Å; D431-R435 IonicContact OD2-NE 3.52Å; D431-R435 IonicContact OD2-NH1 3.58Å; D431-R435 PolarHBondContact OD2-NH1 2.85Å
432	E	79.8	Confident	90.2	Very high	190 Å²	190	33.8 Å²	33.8	89%	0.888	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	41.2	-179.6	-61.8	174.6	-179.2	0	0	112.3	R434	E432-R434 PolarHBondContact O-N 3.1Å; E432-R434 VanDerWaalsContact O-N 3.1Å
433	N	82.1	Confident	90.2	Very high	47 Å²	47	37.9 Å²	37.9	25%	0.251	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.8	0.6	178.5	-48.7	-31.9	0	0	0	115.8	P386 D387 V430 D431 R435	P386-N433 WeakPolarHBondContact CB-ND2 3.1Å; P386-N433 HydrophobicContact CG-CB 4.35Å; P386-N433 VanDerWaalsContact CG-OD1 3.29Å; P386-N433 WeakPolarHBondContact CG-OD1 3.42Å; D387-N433 HydrophobicContact CB-CB 4.36Å; D387-N433 PolarHBondContact N-ND2 3.44Å; V430-N433 PolarHBondContact O-N 2.9Å; D431-N433 PolarHBondContact O-N 2.93Å; D431-N433 VanDerWaalsContact O-N 3.16Å; N433-R435 VanDerWaalsContact C-N 3.27Å; N433-R435 PolarHBondContact O-N 2.87Å
434	R	86	Confident	90.1	Very high	142 Å²	142	36.8 Å²	36.8	54%	0.536	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-29.9	176.3	-176.3	178.2	166.2	-178.7	-1	112.4	D431 E432 E449 W450	D431-R434 WeakPolarHBondContact O-CB 3.4Å; D431-R434 PolarHBondContact O-N 2.75Å; E432-R434 PolarHBondContact O-N 3.1Å; E432-R434 VanDerWaalsContact O-N 3.1Å; R434-E449 IonicContact CZ-OE1 2.73Å; R434-E449 VanDerWaalsContact CZ-OE1 3.23Å; R434-E449 IonicContact NE-OE1 2.85Å; R434-E449 PolarHBondContact NE-OE1 2.81Å; R434-E449 IonicContact NH2-OE1 2.88Å; R434-E449 PolarHBondContact NH2-OE1 2.82Å; R434-W450 WeakPolarHBondContact O-CB 3.32Å; R434-W450 PolarHBondContact O-N 3.23Å
435	R	90	Very high	90	Very high	25 Å²	25	36.9 Å²	36.9	9%	0.094	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	158.7	-177.6	-67.5	175.4	175	150.5	-8.4	110.6	V430 D431 N433 V447 W448	V430-R435 PolarHBondContact N-O 3.49Å; V430-R435 CarbonylContact O-C 3.57Å; V430-R435 PolarHBondContact O-N 2.84Å; V430-R435 VanDerWaalsContact O-N 3.16Å; D431-R435 HydrophobicContact CB-CB 4.28Å; D431-R435 IonicContact OD2-CZ 3.8Å; D431-R435 IonicContact OD2-NE 3.52Å; D431-R435 IonicContact OD2-NH1 3.58Å; D431-R435 PolarHBondContact OD2-NH1 2.85Å; N433-R435 VanDerWaalsContact C-N 3.27Å; N433-R435 PolarHBondContact O-N 2.87Å; R435-V447 HydrophobicContact CB-CG1 4.34Å; R435-W448 CarbonylContact C-O 3.53Å; R435-W448 WeakPolarHBondContact CA-O 3.29Å; R435-W448 VanDerWaalsContact CB-O 3.27Å; R435-W448 WeakPolarHBondContact CB-O 3.49Å
436	F	92.6	Very high	90.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	145.1	166.6	65.5	-90.5	0	0	0	110.9	I403 Y417 I427 T428 F429 V447 W448 W450	I403-F436 HydrophobicContact CD1-CE2 3.98Å; I403-F436 HydrophobicContact CG2-CE2 4.44Å; Y417-F436 HydrophobicContact CD1-CZ 4.09Å; Y417-F436 HydrophobicContact CD2-CZ 4.24Å; Y417-F436 HydrophobicContact CE1-CE1 4.02Å; Y417-F436 AromaticContact CE1-CZ 3.72Å; Y417-F436 HydrophobicContact CE1-CZ 3.72Å; Y417-F436 HydrophobicContact CE2-CE1 4.35Å; Y417-F436 AromaticContact CE2-CZ 3.89Å; Y417-F436 HydrophobicContact CE2-CZ 3.89Å; Y417-F436 HydrophobicContact CG-CZ 4.35Å; Y417-F436 AromaticContact CZ-CE1 3.79Å; Y417-F436 AromaticContact CZ-CZ 3.64Å; I427-F436 HydrophobicContact CG2-CB 4.3Å; I427-F436 HydrophobicContact CG2-CD2 3.8Å; I427-F436 HydrophobicContact CG2-CG 4.31Å; T428-F436 CarbonylContact O-C 3.54Å; T428-F436 VanDerWaalsContact O-CA 3.25Å; T428-F436 WeakPolarHBondContact O-CA 3.11Å; T428-F436 WeakPolarHBondContact O-CB 3.27Å; F429-F436 HydrophobicContact CD1-CB 3.99Å; F429-F436 HydrophobicContact CE1-CB 4.24Å; F429-F436 HydrophobicContact CG-CB 4.37Å; F436-V447 WeakPolarHBondContact O-CA 3.34Å; F436-W448 HydrophobicContact CD1-CB 4.06Å; F436-W448 HydrophobicContact CD2-CB 4.14Å; F436-W448 AromaticContact CD2-CD1 3.61Å; F436-W448 HydrophobicContact CD2-CG 4.16Å; F436-W448 HydrophobicContact CE1-CB 3.62Å; F436-W448 HydrophobicContact CE1-CG 4.3Å; F436-W448 HydrophobicContact CE2-CB 3.72Å; F436-W448 AromaticContact CE2-CD1 3.19Å; F436-W448 HydrophobicContact CE2-CD2 4.45Å; F436-W448 AromaticContact CE2-CG 3.53Å; F436-W448 HydrophobicContact CE2-CG 3.53Å; F436-W448 AromaticContact CE2-NE1 3.92Å; F436-W448 HydrophobicContact CG-CB 4.31Å; F436-W448 HydrophobicContact CZ-CB 3.43Å; F436-W448 VanDerWaalsContact CZ-CB 3.43Å; F436-W448 AromaticContact CZ-CD1 3.8Å; F436-W448 HydrophobicContact CZ-CD2 4.45Å; F436-W448 AromaticContact CZ-CG 3.62Å; F436-W448 HydrophobicContact CZ-CG 3.62Å; F436-W448 PolarHBondContact N-O 3.31Å; F436-W448 PolarHBondContact O-N 3Å; F436-W450 HydrophobicContact CD1-CE3 4.1Å; F436-W450 HydrophobicContact CE1-CE3 4.24Å
437	V	93	Very high	90.1	Very high	2 Å²	2	35 Å²	35	1%	0.012	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	128	173.3	-177.7	0	0	0	0	107.8	I427 T428 V430 L445 R446 V447 L479 F497	I427-V437 WeakPolarHBondContact CA-O 3.08Å; T428-V437 PolarHBondContact N-O 3.46Å; T428-V437 PolarHBondContact O-N 3.35Å; T428-V437 PolarHBondContact OG1-O 2.9Å; V430-V437 HydrophobicContact CB-CG2 4.44Å; V430-V437 HydrophobicContact CG2-CB 4.37Å; V430-V437 HydrophobicContact CG2-CG2 3.67Å; V437-L445 HydrophobicContact CG1-CB 4.36Å; V437-L445 HydrophobicContact CG1-CD2 4.35Å; V437-R446 WeakPolarHBondContact CA-O 3Å; V437-V447 HydrophobicContact CG2-CB 4.48Å; V437-V447 HydrophobicContact CG2-CG1 4.19Å; V437-V447 HydrophobicContact CG2-CG2 3.98Å; V437-L479 HydrophobicContact CB-CD1 4.41Å; V437-L479 HydrophobicContact CG2-CD1 3.82Å; V437-F497 HydrophobicContact CG2-CD1 4.33Å; V437-F497 HydrophobicContact CG2-CE1 3.83Å
438	S	93.6	Very high	90	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	146	173.9	65.4	0	0	0	0	110.5	H420 T426 R446 W448	H420-S438 PolarHBondContact CE1-OG 2.64Å; H420-S438 PolarHBondContact NE2-OG 3.16Å; T426-S438 WeakPolarHBondContact O-CA 3.25Å; S438-R446 PolarHBondContact N-O 3.23Å; S438-R446 PolarHBondContact O-N 2.9Å; S438-R446 PolarHBondContact OG-O 3.5Å; S438-W448 PolarHBondContact OG-NE1 3.44Å
439	T	92.4	Very high	90.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	145.3	175.7	72.2	0	0	0	0	110	V424 N425 T426 L445 M467 V470	V424-T439 CarbonylContact C-O 3.5Å; V424-T439 WeakPolarHBondContact CA-O 3.5Å; V424-T439 WeakPolarHBondContact CG1-O 3.35Å; N425-T439 PolarHBondContact N-O 3.44Å; T426-T439 PolarHBondContact N-OG1 2.86Å; T426-T439 PolarHBondContact O-N 2.82Å; T426-T439 PolarHBondContact OG1-OG1 2.92Å; T439-L445 HydrophobicContact CG2-CD2 3.11Å; T439-M467 VanDerWaalsContact CB-O 3.28Å; T439-M467 WeakPolarHBondContact CB-O 3.21Å; T439-M467 HydrophobicContact CG2-CB 4.36Å; T439-M467 PolarHBondContact OG1-O 3.24Å; T439-V470 HydrophobicContact CG2-CB 4.25Å; T439-V470 HydrophobicContact CG2-CG2 3.18Å
440	S	92.5	Very high	90	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	163.7	-176.8	40.4	0	0	0	0	111.3	H420 A423 D442 K443 S444	H420-S440 PolarHBondContact CE1-OG 3.48Å; H420-S440 VanDerWaalsContact CE1-OG 3.27Å; H420-S440 WeakPolarHBondContact ND1-CB 3.34Å; H420-S440 PolarHBondContact ND1-OG 3.36Å; A423-S440 CarbonylContact O-C 3.59Å; A423-S440 WeakPolarHBondContact O-CA 3.43Å; A423-S440 WeakPolarHBondContact O-CB 3.28Å; S440-D442 WeakPolarHBondContact CB-OD1 3.45Å; S440-D442 PolarHBondContact O-N 3.2Å; S440-D442 VanDerWaalsContact OG-CG 3.28Å; S440-D442 PolarHBondContact OG-OD1 2.98Å; S440-K443 PolarHBondContact O-N 3.34Å; S440-S444 PolarHBondContact N-O 3.06Å; S440-S444 PolarHBondContact OG-OG 3.47Å
441	D	91.3	Very high	90	Very high	95 Å²	95	41 Å²	41	51%	0.508	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-11.8	-179.6	-155.2	40.3	0	0	0	113.6	A423 K443 S466	A423-D441 PolarHBondContact O-N 2.76Å; D441-K443 PolarHBondContact O-N 3.15Å; D441-K443 VanDerWaalsContact O-N 3.09Å; D441-S466 WeakPolarHBondContact OD1-CB 3.16Å; D441-S466 PolarHBondContact OD1-OG 2.85Å
442	D	90.1	Very high	90.4	Very high	41 Å²	41	42.3 Å²	42.3	22%	0.219	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	9.2	169.8	70.4	4.7	0	0	0	113.6	L421 S440 S444 R446	L421-D442 HydrophobicContact CB-CB 4.01Å; L421-D442 PolarHBondContact N-OD2 3.19Å; S440-D442 WeakPolarHBondContact CB-OD1 3.45Å; S440-D442 PolarHBondContact O-N 3.2Å; S440-D442 VanDerWaalsContact OG-CG 3.28Å; S440-D442 PolarHBondContact OG-OD1 2.98Å; D442-S444 VanDerWaalsContact CG-OG 3.29Å; D442-S444 PolarHBondContact O-N 3.3Å; D442-S444 WeakPolarHBondContact OD1-CB 3.29Å; D442-S444 PolarHBondContact OD1-N 3.2Å; D442-S444 VanDerWaalsContact OD1-N 3.1Å; D442-S444 PolarHBondContact OD1-OG 2.98Å; D442-S444 PolarHBondContact OD2-OG 2.86Å; D442-R446 IonicContact OD1-NH1 2.91Å; D442-R446 IonicContact OD2-CZ 3.49Å; D442-R446 IonicContact OD2-NH1 3.37Å; D442-R446 PolarHBondContact OD2-NH1 3.13Å; D442-R446 IonicContact OD2-NH2 3.11Å
443	K	91.5	Very high	90.9	Very high	99 Å²	99	35.4 Å²	35.4	43%	0.43	17%	0.17	S	C	.	.	S	Bend	trans	67.3	15.7	177	-44.7	171.7	-176.7	-178.9	0	114	S440 D441 M464	S440-K443 PolarHBondContact O-N 3.34Å; D441-K443 PolarHBondContact O-N 3.15Å; D441-K443 VanDerWaalsContact O-N 3.09Å; K443-M464 WeakPolarHBondContact CD-O 3.45Å
444	S	91.5	Very high	91.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.184	C	C	.	.			trans	-103.5	152.2	179.8	74.9	0	0	0	0	113	S440 D442 R446 I459	S440-S444 PolarHBondContact N-O 3.06Å; S440-S444 PolarHBondContact OG-OG 3.47Å; D442-S444 VanDerWaalsContact CG-OG 3.29Å; D442-S444 PolarHBondContact O-N 3.3Å; D442-S444 WeakPolarHBondContact OD1-CB 3.29Å; D442-S444 PolarHBondContact OD1-N 3.2Å; D442-S444 VanDerWaalsContact OD1-N 3.1Å; D442-S444 PolarHBondContact OD1-OG 2.98Å; D442-S444 PolarHBondContact OD2-OG 2.86Å; S444-R446 PolarHBondContact OG-NH1 3.4Å; S444-I459 WeakPolarHBondContact CA-O 3.07Å
445	L	92.1	Very high	91.5	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.9	160.6	-58.9	174.8	0	0	0	107.9	V437 T439 I459 M467 F491	V437-L445 HydrophobicContact CG1-CB 4.36Å; V437-L445 HydrophobicContact CG1-CD2 4.35Å; T439-L445 HydrophobicContact CG2-CD2 3.11Å; L445-I459 HydrophobicContact CB-CB 4.26Å; L445-I459 HydrophobicContact CB-CD1 4.48Å; L445-I459 PolarHBondContact N-O 2.83Å; L445-I459 PolarHBondContact O-N 2.76Å; L445-M467 HydrophobicContact CD1-CE 4.08Å; L445-M467 HydrophobicContact CD1-SD 3.98Å; L445-M467 HydrophobicContact CD2-CE 3.55Å; L445-M467 HydrophobicContact CD2-SD 3.85Å; L445-M467 HydrophobicContact CG-CE 3.51Å; L445-M467 HydrophobicContact CG-SD 4.01Å; L445-F491 HydrophobicContact CD1-CD1 4.21Å; L445-F491 HydrophobicContact CD1-CD2 3.71Å; L445-F491 HydrophobicContact CD1-CE1 3.99Å; L445-F491 HydrophobicContact CD1-CE2 3.46Å; L445-F491 VanDerWaalsContact CD1-CE2 3.46Å; L445-F491 HydrophobicContact CD1-CG 4.08Å; L445-F491 HydrophobicContact CD1-CZ 3.61Å
446	R	92.9	Very high	91.4	Very high	12 Å²	12	36.7 Å²	36.7	5%	0.045	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	129.3	170	-69.1	-173	173.3	83.9	-1.2	109.5	R419 H420 V437 S438 D442 S444 W448 D455 K457 Y458	R419-R446 PolarHBondContact O-NE 2.7Å; R419-R446 PolarHBondContact O-NH2 2.71Å; H420-R446 PolarHBondContact ND1-NH1 2.9Å; V437-R446 WeakPolarHBondContact CA-O 3Å; S438-R446 PolarHBondContact N-O 3.23Å; S438-R446 PolarHBondContact O-N 2.9Å; S438-R446 PolarHBondContact OG-O 3.5Å; D442-R446 IonicContact OD1-NH1 2.91Å; D442-R446 IonicContact OD2-CZ 3.49Å; D442-R446 IonicContact OD2-NH1 3.37Å; D442-R446 PolarHBondContact OD2-NH1 3.13Å; D442-R446 IonicContact OD2-NH2 3.11Å; S444-R446 PolarHBondContact OG-NH1 3.4Å; R446-W448 HydrophobicContact CB-CZ2 3.83Å; R446-W448 HydrophobicContact CG-CZ2 4.39Å; R446-W448 PolarHBondContact O-NE1 2.92Å; R446-D455 HydrophobicContact CB-CB 4.29Å; R446-D455 HydrophobicContact CG-CB 4.49Å; R446-D455 IonicContact NE-OD2 3.82Å; R446-K457 WeakPolarHBondContact CA-O 3.11Å; R446-Y458 HydrophobicContact CG-CD2 4.02Å
447	V	93.1	Very high	91.3	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.5	172.7	-169.4	0	0	0	0	108	R435 F436 V437 F456 K457 F497	R435-V447 HydrophobicContact CB-CG1 4.34Å; F436-V447 WeakPolarHBondContact O-CA 3.34Å; V437-V447 HydrophobicContact CG2-CB 4.48Å; V437-V447 HydrophobicContact CG2-CG1 4.19Å; V437-V447 HydrophobicContact CG2-CG2 3.98Å; V447-F456 PolarHBondContact O-N 2.7Å; V447-K457 HydrophobicContact CB-CB 3.95Å; V447-K457 HydrophobicContact CG2-CB 3.91Å; V447-K457 HydrophobicContact CG2-CG 4.46Å; V447-K457 PolarHBondContact N-O 2.85Å; V447-K457 PolarHBondContact O-N 3.34Å; V447-F497 HydrophobicContact CB-CE2 4.48Å; V447-F497 HydrophobicContact CG1-CD2 4.39Å; V447-F497 HydrophobicContact CG1-CE1 4.22Å; V447-F497 HydrophobicContact CG1-CE2 3.78Å; V447-F497 HydrophobicContact CG1-CZ 3.68Å; V447-F497 HydrophobicContact CG2-CB 4.41Å; V447-F497 HydrophobicContact CG2-CD1 3.95Å; V447-F497 HydrophobicContact CG2-CD2 3.97Å; V447-F497 HydrophobicContact CG2-CE1 4.13Å; V447-F497 HydrophobicContact CG2-CE2 4.18Å; V447-F497 HydrophobicContact CG2-CG 3.85Å; V447-F497 HydrophobicContact CG2-CZ 4.26Å
448	W	92.8	Very high	91.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	147.3	-178	-50.5	87.7	0	0	0	109.2	I403 Y417 R419 H420 R435 F436 S438 R446 P453 D455	I403-W448 HydrophobicContact CD1-CZ2 4.42Å; Y417-W448 AromaticContact CD1-CD2 3.91Å; Y417-W448 HydrophobicContact CD1-CD2 3.91Å; Y417-W448 AromaticContact CD1-CE3 3.49Å; Y417-W448 HydrophobicContact CD1-CE3 3.49Å; Y417-W448 VanDerWaalsContact CD1-CE3 3.49Å; Y417-W448 HydrophobicContact CD1-CG 4.38Å; Y417-W448 AromaticContact CD1-CZ3 3.89Å; Y417-W448 HydrophobicContact CD1-CZ3 3.89Å; Y417-W448 HydrophobicContact CE1-CB 4.36Å; Y417-W448 HydrophobicContact CE1-CE3 4.28Å; Y417-W448 HydrophobicContact CG-CE3 4.31Å; Y417-W448 HydrophobicContact CG-CZ3 4.41Å; R419-W448 HydrophobicContact CB-CH2 3.56Å; R419-W448 HydrophobicContact CB-CZ2 4.45Å; R419-W448 HydrophobicContact CB-CZ3 4.2Å; R419-W448 HydrophobicContact CG-CH2 3.71Å; R419-W448 HydrophobicContact CG-CZ3 3.83Å; H420-W448 AromaticContact CD2-CZ2 3.75Å; H420-W448 AromaticContact NE2-CZ2 3.68Å; H420-W448 AromaticContact NE2-NE1 3.88Å; R435-W448 CarbonylContact C-O 3.53Å; R435-W448 WeakPolarHBondContact CA-O 3.29Å; R435-W448 VanDerWaalsContact CB-O 3.27Å; R435-W448 WeakPolarHBondContact CB-O 3.49Å; F436-W448 HydrophobicContact CD1-CB 4.06Å; F436-W448 HydrophobicContact CD2-CB 4.14Å; F436-W448 AromaticContact CD2-CD1 3.61Å; F436-W448 HydrophobicContact CD2-CG 4.16Å; F436-W448 HydrophobicContact CE1-CB 3.62Å; F436-W448 HydrophobicContact CE1-CG 4.3Å; F436-W448 HydrophobicContact CE2-CB 3.72Å; F436-W448 AromaticContact CE2-CD1 3.19Å; F436-W448 HydrophobicContact CE2-CD2 4.45Å; F436-W448 AromaticContact CE2-CG 3.53Å; F436-W448 HydrophobicContact CE2-CG 3.53Å; F436-W448 AromaticContact CE2-NE1 3.92Å; F436-W448 HydrophobicContact CG-CB 4.31Å; F436-W448 HydrophobicContact CZ-CB 3.43Å; F436-W448 VanDerWaalsContact CZ-CB 3.43Å; F436-W448 AromaticContact CZ-CD1 3.8Å; F436-W448 HydrophobicContact CZ-CD2 4.45Å; F436-W448 AromaticContact CZ-CG 3.62Å; F436-W448 HydrophobicContact CZ-CG 3.62Å; F436-W448 PolarHBondContact N-O 3.31Å; F436-W448 PolarHBondContact O-N 3Å; S438-W448 PolarHBondContact OG-NE1 3.44Å; R446-W448 HydrophobicContact CB-CZ2 3.83Å; R446-W448 HydrophobicContact CG-CZ2 4.39Å; R446-W448 PolarHBondContact O-NE1 2.92Å; W448-P453 WeakPolarHBondContact CZ3-O 3.28Å; W448-D455 HydrophobicContact CD2-CB 4.12Å; W448-D455 HydrophobicContact CE3-CB 3.77Å; W448-D455 HydrophobicContact CH2-CB 4.16Å; W448-D455 HydrophobicContact CZ2-CB 4.4Å; W448-D455 HydrophobicContact CZ3-CB 3.78Å
449	E	91.9	Very high	91.1	Very high	43 Å²	43	47.5 Å²	47.5	20%	0.201	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	142.7	161.5	-168.8	155.2	-165.4	0	0	108.3	R434 D451 I452	R434-E449 IonicContact CZ-OE1 2.73Å; R434-E449 VanDerWaalsContact CZ-OE1 3.23Å; R434-E449 IonicContact NE-OE1 2.85Å; R434-E449 PolarHBondContact NE-OE1 2.81Å; R434-E449 IonicContact NH2-OE1 2.88Å; R434-E449 PolarHBondContact NH2-OE1 2.82Å; E449-D451 PolarHBondContact O-N 2.64Å; E449-I452 HydrophobicContact CB-CB 4.36Å; E449-I452 HydrophobicContact CB-CD1 4.14Å; E449-I452 HydrophobicContact CG-CD1 3.96Å; E449-I452 PolarHBondContact O-N 2.95Å
450	W	90.2	Very high	91	Very high	28 Å²	28	49.4 Å²	49.4	11%	0.106	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	140.1	179.2	-176.6	-98.3	0	0	0	110.5	N385 L393 V395 Q405 F429 R434 F436 I452	N385-W450 HydrophobicContact CB-CH2 3.9Å; N385-W450 HydrophobicContact CB-CZ2 4.16Å; N385-W450 HydrophobicContact CB-CZ3 4.47Å; N385-W450 VanDerWaalsContact ND2-CE2 3.29Å; N385-W450 WeakPolarHBondContact ND2-CZ2 3.46Å; L393-W450 HydrophobicContact CB-CH2 4.17Å; L393-W450 HydrophobicContact CB-CZ2 3.72Å; L393-W450 HydrophobicContact CD1-CZ2 3.85Å; L393-W450 HydrophobicContact CG-CZ2 4.42Å; V395-W450 HydrophobicContact CG2-CH2 3.59Å; V395-W450 HydrophobicContact CG2-CZ3 3.38Å; Q405-W450 HydrophobicContact CG-CH2 4.38Å; Q405-W450 HydrophobicContact CG-CZ2 4.42Å; F429-W450 AromaticContact CE1-CE3 3.61Å; F429-W450 HydrophobicContact CE1-CE3 3.61Å; F429-W450 HydrophobicContact CE1-CH2 4.49Å; F429-W450 AromaticContact CE1-CZ3 3.48Å; F429-W450 HydrophobicContact CE1-CZ3 3.48Å; F429-W450 VanDerWaalsContact CE1-CZ3 3.48Å; F429-W450 HydrophobicContact CZ-CE3 4.15Å; F429-W450 HydrophobicContact CZ-CH2 4.31Å; F429-W450 AromaticContact CZ-CZ3 3.52Å; F429-W450 HydrophobicContact CZ-CZ3 3.52Å; R434-W450 WeakPolarHBondContact O-CB 3.32Å; R434-W450 PolarHBondContact O-N 3.23Å; F436-W450 HydrophobicContact CD1-CE3 4.1Å; F436-W450 HydrophobicContact CE1-CE3 4.24Å; W450-I452 PolarHBondContact O-N 3.35Å
451	D	87.9	Confident	90.7	Very high	84 Å²	84	55.4 Å²	55.4	45%	0.449	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	67	-9.4	179.9	-137.4	38.4	0	0	0	116.5	Q405 Y417 E449	Q405-D451 PolarHBondContact NE2-OD1 3.48Å; Q405-D451 VanDerWaalsContact NE2-OD1 3.16Å; Y417-D451 PolarHBondContact OH-N 3.46Å; E449-D451 PolarHBondContact O-N 2.64Å
452	I	90.6	Very high	90.6	Very high	78 Å²	78	57.2 Å²	57.2	40%	0.4	29%	0.293	S	S	.	.			trans	-103.5	115.6	-177.5	-58.1	176.5	0	0	0	110	Y417 E449 W450 V454	Y417-I452 WeakPolarHBondContact CE1-O 2.99Å; E449-I452 HydrophobicContact CB-CB 4.36Å; E449-I452 HydrophobicContact CB-CD1 4.14Å; E449-I452 HydrophobicContact CG-CD1 3.96Å; E449-I452 PolarHBondContact O-N 2.95Å; W450-I452 PolarHBondContact O-N 3.35Å; I452-V454 HydrophobicContact CG2-CB 4.32Å; I452-V454 PolarHBondContact O-N 2.74Å
453	P	90.1	Very high	90.4	Very high	45 Å²	45	59.8 Å²	59.8	29%	0.292	31%	0.314	S	S	.	.			trans	-73	5.4	-174	30.1	-37	0	0	0	115.4	E416 Y417 W448	E416-P453 WeakPolarHBondContact O-CB 3.16Å; Y417-P453 HydrophobicContact CD1-CB 4.49Å; W448-P453 WeakPolarHBondContact CZ3-O 3.28Å
454	V	90.9	Very high	90.2	Very high	90 Å²	90	55.7 Å²	55.7	55%	0.545	30%	0.297	S	S	.	.	S	Bend	trans	-104.4	131.2	179.9	-178.5	0	0	0	0	108.6	I452 F456	I452-V454 HydrophobicContact CG2-CB 4.32Å; I452-V454 PolarHBondContact O-N 2.74Å; V454-F456 PolarHBondContact O-N 3.12Å
455	D	90.4	Very high	90.1	Very high	38 Å²	38	59.5 Å²	59.5	20%	0.203	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	126.1	176.7	55	-32.5	0	0	0	110.5	R446 W448	R446-D455 HydrophobicContact CB-CB 4.29Å; R446-D455 HydrophobicContact CG-CB 4.49Å; R446-D455 IonicContact NE-OD2 3.82Å; W448-D455 HydrophobicContact CD2-CB 4.12Å; W448-D455 HydrophobicContact CE3-CB 3.77Å; W448-D455 HydrophobicContact CH2-CB 4.16Å; W448-D455 HydrophobicContact CZ2-CB 4.4Å; W448-D455 HydrophobicContact CZ3-CB 3.78Å
456	F	87.3	Confident	90	Very high	112 Å²	112	60 Å²	60	49%	0.491	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	-37.4	175.8	171.9	-102.8	0	0	0	111.1	V447 V454	V447-F456 PolarHBondContact O-N 2.7Å; V454-F456 PolarHBondContact O-N 3.12Å
457	K	90.4	Very high	89.9	Confident	88 Å²	88	59.4 Å²	59.4	38%	0.383	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	123.3	-176.8	-171	66.3	177.8	171	0	111.8	R446 V447 I459	R446-K457 WeakPolarHBondContact CA-O 3.11Å; V447-K457 HydrophobicContact CB-CB 3.95Å; V447-K457 HydrophobicContact CG2-CB 3.91Å; V447-K457 HydrophobicContact CG2-CG 4.46Å; V447-K457 PolarHBondContact N-O 2.85Å; V447-K457 PolarHBondContact O-N 3.34Å; K457-I459 HydrophobicContact CG-CD1 4.37Å; K457-I459 HydrophobicContact CG-CG1 4.12Å
458	Y	91.6	Very high	89.7	Confident	118 Å²	118	59.8 Å²	59.8	46%	0.463	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.3	170	178.1	-109.2	0	0	0	110.4	R446 A460	R446-Y458 HydrophobicContact CG-CD2 4.02Å; Y458-A460 HydrophobicContact CE1-CB 3.64Å; Y458-A460 HydrophobicContact CE2-CB 4.08Å; Y458-A460 WeakPolarHBondContact OH-CB 3.4Å
459	I	91.3	Very high	89.6	Confident	23 Å²	23	60.1 Å²	60.1	12%	0.118	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	109.5	174.9	-56.8	161.2	0	0	0	107.8	S444 L445 K457 M464 F491 F497	S444-I459 WeakPolarHBondContact CA-O 3.07Å; L445-I459 HydrophobicContact CB-CB 4.26Å; L445-I459 HydrophobicContact CB-CD1 4.48Å; L445-I459 PolarHBondContact N-O 2.83Å; L445-I459 PolarHBondContact O-N 2.76Å; K457-I459 HydrophobicContact CG-CD1 4.37Å; K457-I459 HydrophobicContact CG-CG1 4.12Å; I459-M464 HydrophobicContact CG2-CE 4.24Å; I459-M464 HydrophobicContact CG2-SD 4.16Å; I459-F491 HydrophobicContact CD1-CD1 4.47Å; I459-F491 HydrophobicContact CG2-CE1 4.08Å; I459-F497 HydrophobicContact CD1-CB 3.63Å; I459-F497 WeakPolarHBondContact CD1-O 3.35Å
460	A	90.6	Very high	89.6	Confident	40 Å²	40	58.6 Å²	58.6	33%	0.331	31%	0.314	S	S	.	.			trans	-143.6	124.1	168.8	0	0	0	0	0	108.4	Y458	Y458-A460 HydrophobicContact CE1-CB 3.64Å; Y458-A460 HydrophobicContact CE2-CB 4.08Å; Y458-A460 WeakPolarHBondContact OH-CB 3.4Å
461	E	86.1	Confident	89.7	Confident	126 Å²	126	58.2 Å²	58.2	59%	0.589	32%	0.315	S	S	*	.			trans	-113.6	142.4	171	-69	-79	173.7	0	0	107.5	S463 M464	E461-S463 PolarHBondContact O-N 2.84Å; E461-S463 VanDerWaalsContact O-N 3.08Å; E461-M464 HydrophobicContact CB-CB 4.4Å; E461-M464 HydrophobicContact CB-CG 3.87Å; E461-M464 HydrophobicContact CB-SD 3.77Å; E461-M464 HydrophobicContact CG-SD 3.94Å; E461-M464 WeakPolarHBondContact O-CB 3.42Å; E461-M464 PolarHBondContact O-N 2.88Å
462	P	89	Confident	89.9	Confident	133 Å²	133	56.8 Å²	56.8	86%	0.864	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-26.5	177.1	-26.2	35	0	0	0	113.9	M464	P462-M464 VanDerWaalsContact C-N 3.34Å
463	S	86.3	Confident	89.9	Confident	96 Å²	96	53.2 Å²	53.2	67%	0.671	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-18.4	175.7	176.1	0	0	0	0	113.7	E461 H465	E461-S463 PolarHBondContact O-N 2.84Å; E461-S463 VanDerWaalsContact O-N 3.08Å; S463-H465 PolarHBondContact O-ND1 3.24Å
464	M	86.9	Confident	89.8	Confident	13 Å²	13	54.8 Å²	54.8	6%	0.064	30%	0.299	C	S	.	.			trans	-75.8	147.7	-177.8	-76.8	169.1	60.6	0	0	110.8	K443 I459 E461 P462 M467 F491	K443-M464 WeakPolarHBondContact CD-O 3.45Å; I459-M464 HydrophobicContact CG2-CE 4.24Å; I459-M464 HydrophobicContact CG2-SD 4.16Å; E461-M464 HydrophobicContact CB-CB 4.4Å; E461-M464 HydrophobicContact CB-CG 3.87Å; E461-M464 HydrophobicContact CB-SD 3.77Å; E461-M464 HydrophobicContact CG-SD 3.94Å; E461-M464 WeakPolarHBondContact O-CB 3.42Å; E461-M464 PolarHBondContact O-N 2.88Å; P462-M464 VanDerWaalsContact C-N 3.34Å; M464-M467 HydrophobicContact CE-CE 3.32Å; M464-M467 HydrophobicContact CE-SD 4.1Å; M464-F491 HydrophobicContact CE-CZ 3.91Å; M464-F491 HydrophobicContact SD-CZ 4.42Å
465	H	90.1	Very high	89.6	Confident	80 Å²	80	53.9 Å²	53.9	37%	0.37	29%	0.291	S	S	.	.			trans	-111	171.8	174.4	-68.7	71.7	0	0	0	110.2	S463 M467 M484 D485	S463-H465 PolarHBondContact O-ND1 3.24Å; H465-M467 PolarHBondContact O-N 3.16Å; H465-M484 HydrophobicContact CB-CB 4.23Å; H465-D485 HydrophobicContact CB-CB 4.41Å
466	S	88.9	Confident	89.4	Confident	12 Å²	12	53 Å²	53	8%	0.084	29%	0.292	C	S	.	.			trans	-57.1	134.6	176.4	-171.5	0	0	0	0	109.4	N425 D441 P468 M484	N425-S466 PolarHBondContact ND2-OG 2.87Å; D441-S466 WeakPolarHBondContact OD1-CB 3.16Å; D441-S466 PolarHBondContact OD1-OG 2.85Å; S466-P468 VanDerWaalsContact O-CD 3.27Å; S466-P468 WeakPolarHBondContact O-CD 3.49Å; S466-M484 VanDerWaalsContact O-CG 3.27Å; S466-M484 WeakPolarHBondContact O-CG 3.34Å; S466-M484 PolarHBondContact O-N 3Å; S466-M484 VanDerWaalsContact O-N 3.07Å
467	M	90.8	Very high	89.5	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.29	C	S	.	.			trans	-109.7	94.6	179.7	-74.4	162.2	-73.9	0	0	109.2	T439 L445 M464 H465 A469 C481 Q482 F491	T439-M467 VanDerWaalsContact CB-O 3.28Å; T439-M467 WeakPolarHBondContact CB-O 3.21Å; T439-M467 HydrophobicContact CG2-CB 4.36Å; T439-M467 PolarHBondContact OG1-O 3.24Å; L445-M467 HydrophobicContact CD1-CE 4.08Å; L445-M467 HydrophobicContact CD1-SD 3.98Å; L445-M467 HydrophobicContact CD2-CE 3.55Å; L445-M467 HydrophobicContact CD2-SD 3.85Å; L445-M467 HydrophobicContact CG-CE 3.51Å; L445-M467 HydrophobicContact CG-SD 4.01Å; M464-M467 HydrophobicContact CE-CE 3.32Å; M464-M467 HydrophobicContact CE-SD 4.1Å; H465-M467 PolarHBondContact O-N 3.16Å; M467-A469 VanDerWaalsContact C-N 3.35Å; M467-C481 HydrophobicContact CB-CB 4.43Å; M467-C481 HydrophobicContact CG-CB 4.03Å; M467-C481 HydrophobicContact SD-CB 3.58Å; M467-C481 VanDerWaalsContact SD-CB 3.58Å; M467-Q482 WeakPolarHBondContact CA-O 3.4Å; M467-Q482 WeakPolarHBondContact CB-O 3.22Å; M467-Q482 WeakPolarHBondContact CG-O 3.37Å; M467-F491 HydrophobicContact SD-CE2 4.11Å
468	P	89.4	Confident	89.6	Confident	9 Å²	9	51.7 Å²	51.7	6%	0.058	28%	0.284	C	S	.	.			trans	-80.7	-13.4	-173.2	34.4	-42.5	0	0	0	114.1	T426 S466 Q482 M484 A514	T426-P468 WeakPolarHBondContact CG2-O 3.39Å; S466-P468 VanDerWaalsContact O-CD 3.27Å; S466-P468 WeakPolarHBondContact O-CD 3.49Å; P468-Q482 VanDerWaalsContact CD-O 3.31Å; P468-Q482 WeakPolarHBondContact CD-O 3.5Å; P468-M484 HydrophobicContact CB-CE 3.82Å; P468-M484 HydrophobicContact CG-CE 3.54Å; P468-M484 HydrophobicContact CG-CG 4.37Å; P468-M484 HydrophobicContact CG-SD 4.08Å; P468-A514 HydrophobicContact CB-CB 3.69Å; P468-A514 HydrophobicContact CG-CB 4.35Å
469	A	90	Very high	89.6	Confident	6 Å²	6	46.1 Å²	46.1	5%	0.05	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	127.6	178.5	0	0	0	0	0	110.8	M467 Q482 C515	M467-A469 VanDerWaalsContact C-N 3.35Å; A469-Q482 HydrophobicContact CB-CB 4.27Å; A469-Q482 PolarHBondContact O-N 3.43Å; A469-C515 WeakPolarHBondContact CB-O 3.22Å
470	V	92.3	Very high	89.7	Confident	12 Å²	12	45 Å²	45	7%	0.073	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	138.4	173.3	-178.9	0	0	0	0	109.6	T428 T439 L479 A480 C481	T428-V470 HydrophobicContact CG2-CB 4.01Å; T428-V470 HydrophobicContact CG2-CG1 3.94Å; T428-V470 WeakPolarHBondContact CG2-O 3.27Å; T439-V470 HydrophobicContact CG2-CB 4.25Å; T439-V470 HydrophobicContact CG2-CG2 3.18Å; V470-L479 HydrophobicContact CG1-CB 4.44Å; V470-L479 HydrophobicContact CG1-CD2 4.05Å; V470-A480 WeakPolarHBondContact CA-O 3.48Å; V470-C481 HydrophobicContact CG2-CB 3.99Å; V470-C481 VanDerWaalsContact CG2-SG 3.54Å
471	T	92	Very high	89.7	Confident	19 Å²	19	43.1 Å²	43.1	12%	0.117	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	139.1	176.6	-54.5	0	0	0	0	109.7	A480 V517	T471-A480 PolarHBondContact N-O 2.99Å; T471-A480 PolarHBondContact O-N 2.75Å; T471-V517 WeakPolarHBondContact CB-O 3.19Å; T471-V517 WeakPolarHBondContact CG2-O 3.02Å; T471-V517 PolarHBondContact OG1-O 2.86Å
472	L	92.5	Very high	90	Very high	55 Å²	55	37.1 Å²	37.1	29%	0.288	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	141.5	174	-174.7	71.5	0	0	0	109.9	V430 L479 A493	V430-L472 HydrophobicContact CG1-CD1 4.47Å; V430-L472 HydrophobicContact CG2-CD1 4.25Å; L472-L479 HydrophobicContact CB-CD2 4.25Å; L472-L479 HydrophobicContact CD1-CD2 3.65Å; L472-L479 HydrophobicContact CD1-CG 4.24Å; L472-A493 HydrophobicContact CD1-CB 4.03Å
473	S	91.1	Very high	90.1	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.014	17%	0.172	C	C	.	.			trans	-68.8	151	172.5	60.4	0	0	0	0	111.9	N475 G476 K477 W478	S473-N475 WeakPolarHBondContact CB-OD1 3.48Å; S473-N475 PolarHBondContact O-N 3.39Å; S473-N475 VanDerWaalsContact O-N 3.07Å; S473-N475 PolarHBondContact OG-OD1 2.81Å; S473-G476 PolarHBondContact O-N 3.23Å; S473-K477 PolarHBondContact OG-N 3.06Å; S473-W478 WeakPolarHBondContact CB-O 3.4Å; S473-W478 PolarHBondContact N-O 3.45Å; S473-W478 PolarHBondContact OG-N 3.16Å; S473-W478 PolarHBondContact OG-O 2.94Å
474	P	87.6	Confident	90.3	Very high	78 Å²	78	28.5 Å²	28.5	51%	0.506	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-29.8	179.8	-28.5	34.2	0	0	0	114.2	G476 F519	P474-G476 VanDerWaalsContact C-N 3.33Å; P474-F519 HydrophobicContact CG-CB 4.24Å
475	N	86.1	Confident	90.4	Very high	71 Å²	71	29.9 Å²	29.9	38%	0.38	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	1.7	176.6	63	10.4	0	0	0	114.7	S473 K477 M523	S473-N475 WeakPolarHBondContact CB-OD1 3.48Å; S473-N475 PolarHBondContact O-N 3.39Å; S473-N475 VanDerWaalsContact O-N 3.07Å; S473-N475 PolarHBondContact OG-OD1 2.81Å; N475-K477 PolarHBondContact O-N 3.01Å; N475-K477 PolarHBondContact OD1-N 3.1Å; N475-K477 VanDerWaalsContact OD1-N 3.13Å; N475-M523 PolarHBondContact ND2-SD 3.3Å
476	G	86.4	Confident	90.5	Very high	21 Å²	21	28.7 Å²	28.7	22%	0.216	16%	0.155	C	C	.	.	S	Bend	trans	65.2	8.7	-180	0	0	0	0	0	115.6	S473 P474 A493	S473-G476 PolarHBondContact O-N 3.23Å; P474-G476 VanDerWaalsContact C-N 3.33Å; G476-A493 VanDerWaalsContact O-CB 3.31Å; G476-A493 WeakPolarHBondContact O-CB 3.43Å
477	K	89.8	Confident	90.6	Very high	105 Å²	105	29.8 Å²	29.8	46%	0.457	16%	0.159	S	C	.	.	S	Bend	trans	-90.3	-25.3	-175.3	-75.3	177.6	-179.6	176.3	0	114.1	S473 N475 A493	S473-K477 PolarHBondContact OG-N 3.06Å; N475-K477 PolarHBondContact O-N 3.01Å; N475-K477 PolarHBondContact OD1-N 3.1Å; N475-K477 VanDerWaalsContact OD1-N 3.13Å; K477-A493 VanDerWaalsContact C-CB 3.49Å; K477-A493 WeakPolarHBondContact O-CB 3.38Å; K477-A493 PolarHBondContact O-N 3.43Å
478	W	91.9	Very high	90.7	Very high	67 Å²	67	29.8 Å²	29.8	25%	0.254	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	146.2	-169.4	-54.7	94.8	0	0	0	111.3	S473 I490 F491 N500 M523 W540	S473-W478 WeakPolarHBondContact CB-O 3.4Å; S473-W478 PolarHBondContact N-O 3.45Å; S473-W478 PolarHBondContact OG-N 3.16Å; S473-W478 PolarHBondContact OG-O 2.94Å; W478-I490 HydrophobicContact CB-CG2 4.16Å; W478-I490 HydrophobicContact CD2-CG2 4.11Å; W478-I490 HydrophobicContact CE3-CG2 3.52Å; W478-I490 HydrophobicContact CG-CG2 4.41Å; W478-I490 HydrophobicContact CZ3-CG2 4.28Å; W478-F491 CarbonylContact C-O 3.59Å; W478-F491 WeakPolarHBondContact CA-O 3.4Å; W478-N500 WeakPolarHBondContact CH2-ND2 3.35Å; W478-N500 HydrophobicContact CZ3-CB 4Å; W478-N500 WeakPolarHBondContact CZ3-ND2 3.21Å; W478-M523 HydrophobicContact CB-CE 4.06Å; W478-M523 HydrophobicContact CG-CE 3.73Å; W478-W540 HydrophobicContact CB-CH2 4.15Å; W478-W540 AromaticContact CD1-CZ2 3.97Å; W478-W540 HydrophobicContact CD2-CH2 4.24Å; W478-W540 HydrophobicContact CD2-CZ2 4.06Å; W478-W540 AromaticContact CG-CH2 3.96Å; W478-W540 HydrophobicContact CG-CH2 3.96Å; W478-W540 AromaticContact CG-CZ2 3.93Å; W478-W540 HydrophobicContact CG-CZ2 3.93Å; W478-W540 AromaticContact NE1-CZ2 3.95Å
479	L	92.7	Very high	90.9	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	122.3	171.7	-69.5	163.1	0	0	0	107.8	V430 V437 V470 L472 I490 F491 A493 F497	V430-L479 HydrophobicContact CG2-CD1 4.18Å; V430-L479 HydrophobicContact CG2-CD2 3.81Å; V430-L479 HydrophobicContact CG2-CG 4.44Å; V437-L479 HydrophobicContact CB-CD1 4.41Å; V437-L479 HydrophobicContact CG2-CD1 3.82Å; V470-L479 HydrophobicContact CG1-CB 4.44Å; V470-L479 HydrophobicContact CG1-CD2 4.05Å; L472-L479 HydrophobicContact CB-CD2 4.25Å; L472-L479 HydrophobicContact CD1-CD2 3.65Å; L472-L479 HydrophobicContact CD1-CG 4.24Å; L479-I490 CarbonylContact O-C 3.56Å; L479-I490 VanDerWaalsContact O-CA 3.31Å; L479-I490 WeakPolarHBondContact O-CA 3.28Å; L479-F491 HydrophobicContact CB-CB 4.2Å; L479-F491 PolarHBondContact N-O 3.16Å; L479-F491 PolarHBondContact O-N 3.02Å; L479-A493 HydrophobicContact CD1-CB 4.38Å; L479-A493 HydrophobicContact CG-CB 4.1Å; L479-F497 HydrophobicContact CD1-CD1 4.15Å; L479-F497 HydrophobicContact CD1-CE1 4.13Å
480	A	92.9	Very high	91.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	111.7	166.2	0	0	0	0	0	108.8	V470 T471 I488 I490 V517 F519	V470-A480 WeakPolarHBondContact CA-O 3.48Å; T471-A480 PolarHBondContact N-O 2.99Å; T471-A480 PolarHBondContact O-N 2.75Å; A480-I488 HydrophobicContact CB-CG2 4Å; A480-I490 HydrophobicContact CB-CD1 3.86Å; A480-V517 HydrophobicContact CB-CB 4.42Å; A480-V517 HydrophobicContact CB-CG1 3.85Å; A480-F519 HydrophobicContact CB-CE2 3.48Å; A480-F519 VanDerWaalsContact CB-CE2 3.48Å; A480-F519 HydrophobicContact CB-CZ 3.46Å; A480-F519 VanDerWaalsContact CB-CZ 3.46Å
481	C	91.8	Very high	91	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	115.8	172.4	-57.6	0	0	0	0	108.2	M467 V470 S483 I488 L489 F491	M467-C481 HydrophobicContact CB-CB 4.43Å; M467-C481 HydrophobicContact CG-CB 4.03Å; M467-C481 HydrophobicContact SD-CB 3.58Å; M467-C481 VanDerWaalsContact SD-CB 3.58Å; V470-C481 HydrophobicContact CG2-CB 3.99Å; V470-C481 VanDerWaalsContact CG2-SG 3.54Å; C481-S483 PolarHBondContact O-N 3.3Å; C481-I488 WeakPolarHBondContact O-CA 3.49Å; C481-L489 PolarHBondContact N-O 3.22Å; C481-L489 PolarHBondContact O-N 2.71Å; C481-F491 HydrophobicContact CB-CD2 4.18Å; C481-F491 HydrophobicContact CB-CE2 4.1Å; C481-F491 VanDerWaalsContact SG-CD2 3.55Å
482	Q	91.4	Very high	91	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	125	168	-173.5	177.1	73.3	0	0	108.6	M467 P468 A469 V510 C515 V517	M467-Q482 WeakPolarHBondContact CA-O 3.4Å; M467-Q482 WeakPolarHBondContact CB-O 3.22Å; M467-Q482 WeakPolarHBondContact CG-O 3.37Å; P468-Q482 VanDerWaalsContact CD-O 3.31Å; P468-Q482 WeakPolarHBondContact CD-O 3.5Å; A469-Q482 HydrophobicContact CB-CB 4.27Å; A469-Q482 PolarHBondContact O-N 3.43Å; Q482-V510 HydrophobicContact CG-CG1 3.74Å; Q482-V510 VanDerWaalsContact NE2-CG2 3.33Å; Q482-V510 VanDerWaalsContact OE1-CG1 3.24Å; Q482-C515 VanDerWaalsContact NE2-CB 3.27Å; Q482-C515 PolarHBondContact NE2-O 2.81Å; Q482-C515 VanDerWaalsContact NE2-O 3.12Å; Q482-C515 VanDerWaalsContact OE1-CA 3.27Å; Q482-C515 PolarHBondContact OE1-O 3.31Å; Q482-V517 HydrophobicContact CB-CG2 3.81Å; Q482-V517 HydrophobicContact CG-CG2 4.41Å
483	S	91.6	Very high	90.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	142.7	176.8	170.8	0	0	0	0	109.6	C481 D485 N486 Q487	C481-S483 PolarHBondContact O-N 3.3Å; S483-D485 WeakPolarHBondContact CB-OD1 3.07Å; S483-D485 PolarHBondContact O-N 2.98Å; S483-D485 VanDerWaalsContact OG-CG 3.26Å; S483-D485 PolarHBondContact OG-OD1 2.84Å; S483-N486 PolarHBondContact O-N 2.82Å; S483-Q487 WeakPolarHBondContact CB-O 3.42Å; S483-Q487 PolarHBondContact N-O 2.72Å
484	M	90.5	Very high	89.9	Confident	47 Å²	47	31 Å²	31	23%	0.232	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-10.5	179.5	-74.3	-66.4	-167.1	0	0	113.9	H465 S466 P468 N486 G512	H465-M484 HydrophobicContact CB-CB 4.23Å; S466-M484 VanDerWaalsContact O-CG 3.27Å; S466-M484 WeakPolarHBondContact O-CG 3.34Å; S466-M484 PolarHBondContact O-N 3Å; S466-M484 VanDerWaalsContact O-N 3.07Å; P468-M484 HydrophobicContact CB-CE 3.82Å; P468-M484 HydrophobicContact CG-CE 3.54Å; P468-M484 HydrophobicContact CG-CG 4.37Å; P468-M484 HydrophobicContact CG-SD 4.08Å; M484-N486 PolarHBondContact O-N 2.76Å; M484-G512 PolarHBondContact SD-N 2.86Å
485	D	89.6	Confident	89.2	Confident	42 Å²	42	32.9 Å²	32.9	23%	0.225	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	20.9	174.6	74.5	-25.8	0	0	0	113.9	H465 S483 Q487	H465-D485 HydrophobicContact CB-CB 4.41Å; S483-D485 WeakPolarHBondContact CB-OD1 3.07Å; S483-D485 PolarHBondContact O-N 2.98Å; S483-D485 VanDerWaalsContact OG-CG 3.26Å; S483-D485 PolarHBondContact OG-OD1 2.84Å; D485-Q487 VanDerWaalsContact C-N 3.29Å; D485-Q487 PolarHBondContact O-N 3.44Å; D485-Q487 WeakPolarHBondContact OD1-CB 3.48Å; D485-Q487 PolarHBondContact OD1-N 3.07Å; D485-Q487 VanDerWaalsContact OD2-CD 3.31Å; D485-Q487 PolarHBondContact OD2-NE2 3.34Å
486	N	90.9	Very high	88.8	Confident	55 Å²	55	38.2 Å²	38.2	29%	0.294	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	64	30.4	-179.6	-62.2	-32.6	0	0	0	113.6	S483 M484 H508 V510 A511	S483-N486 PolarHBondContact O-N 2.82Å; M484-N486 PolarHBondContact O-N 2.76Å; N486-H508 VanDerWaalsContact C-NE2 3.3Å; N486-H508 VanDerWaalsContact CB-O 3.31Å; N486-H508 WeakPolarHBondContact CB-O 3.36Å; N486-H508 PolarHBondContact O-NE2 2.77Å; N486-V510 PolarHBondContact OD1-N 2.61Å; N486-A511 PolarHBondContact OD1-N 3.3Å; N486-A511 VanDerWaalsContact OD1-N 3.08Å
487	Q	91.1	Very high	88.7	Confident	36 Å²	36	37.4 Å²	37.4	17%	0.168	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	149.3	178	-48.6	-178.8	31.1	0	0	110.8	S483 D485 I504 F505 K506 H508	S483-Q487 WeakPolarHBondContact CB-O 3.42Å; S483-Q487 PolarHBondContact N-O 2.72Å; D485-Q487 VanDerWaalsContact C-N 3.29Å; D485-Q487 PolarHBondContact O-N 3.44Å; D485-Q487 WeakPolarHBondContact OD1-CB 3.48Å; D485-Q487 PolarHBondContact OD1-N 3.07Å; D485-Q487 VanDerWaalsContact OD2-CD 3.31Å; D485-Q487 PolarHBondContact OD2-NE2 3.34Å; Q487-I504 HydrophobicContact CB-CG2 4.32Å; Q487-I504 VanDerWaalsContact OE1-CG2 3.3Å; Q487-F505 WeakPolarHBondContact CA-O 3.39Å; Q487-K506 VanDerWaalsContact CD-CE 3.45Å; Q487-K506 HydrophobicContact CG-CD 4.32Å; Q487-K506 HydrophobicContact CG-CG 4.07Å; Q487-H508 PolarHBondContact N-NE2 2.51Å
488	I	93.1	Very high	88.5	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	118.9	164.1	-64.1	150.6	0	0	0	107.4	A480 C481 I490 F505 H508 V517 V526 W538	A480-I488 HydrophobicContact CB-CG2 4Å; C481-I488 WeakPolarHBondContact O-CA 3.49Å; I488-I490 HydrophobicContact CG2-CD1 4.06Å; I488-F505 HydrophobicContact CB-CB 4.13Å; I488-F505 HydrophobicContact CB-CD2 4.17Å; I488-F505 HydrophobicContact CD1-CB 4.38Å; I488-F505 HydrophobicContact CG2-CD2 4.15Å; I488-F505 PolarHBondContact N-O 3.17Å; I488-F505 PolarHBondContact O-N 2.97Å; I488-H508 VanDerWaalsContact CG1-CE1 3.45Å; I488-H508 WeakPolarHBondContact CG1-CE1 3.44Å; I488-H508 PolarHBondContact N-CE1 2.86Å; I488-V517 HydrophobicContact CD1-CG1 4.16Å; I488-V517 HydrophobicContact CD1-CG2 3.96Å; I488-V517 HydrophobicContact CG1-CG2 3.93Å; I488-V517 HydrophobicContact CG2-CG1 4.42Å; I488-V526 HydrophobicContact CD1-CG1 4.39Å; I488-W538 HydrophobicContact CD1-CE3 4.12Å; I488-W538 HydrophobicContact CD1-CH2 3.86Å; I488-W538 HydrophobicContact CD1-CZ3 3.56Å
489	L	92.8	Very high	88.3	Confident	11 Å²	11	40.5 Å²	40.5	6%	0.058	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	131.2	178.7	-63.3	-179.5	0	0	0	109.5	C481 F491 L499	C481-L489 PolarHBondContact N-O 3.22Å; C481-L489 PolarHBondContact O-N 2.71Å; L489-F491 HydrophobicContact CB-CE2 3.91Å; L489-L499 HydrophobicContact CB-CD1 3.73Å; L489-L499 HydrophobicContact CD2-CD1 4.07Å; L489-L499 HydrophobicContact CG-CD1 4.33Å
490	I	94.1	Very high	88	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	118.8	179.4	-61.7	-51.2	0	0	0	110.7	W478 L479 A480 I488 N500 K503 F505 F519 W540	W478-I490 HydrophobicContact CB-CG2 4.16Å; W478-I490 HydrophobicContact CD2-CG2 4.11Å; W478-I490 HydrophobicContact CE3-CG2 3.52Å; W478-I490 HydrophobicContact CG-CG2 4.41Å; W478-I490 HydrophobicContact CZ3-CG2 4.28Å; L479-I490 CarbonylContact O-C 3.56Å; L479-I490 VanDerWaalsContact O-CA 3.31Å; L479-I490 WeakPolarHBondContact O-CA 3.28Å; A480-I490 HydrophobicContact CB-CD1 3.86Å; I488-I490 HydrophobicContact CG2-CD1 4.06Å; I490-N500 HydrophobicContact CG2-CB 4.42Å; I490-N500 PolarHBondContact O-N 2.82Å; I490-K503 HydrophobicContact CB-CB 3.98Å; I490-K503 HydrophobicContact CG1-CB 3.88Å; I490-K503 WeakPolarHBondContact CG1-O 3.18Å; I490-K503 HydrophobicContact CG2-CB 4.35Å; I490-F505 HydrophobicContact CD1-CD2 4.37Å; I490-F505 HydrophobicContact CD1-CE2 3.92Å; I490-F505 HydrophobicContact CG1-CD2 4.26Å; I490-F505 HydrophobicContact CG1-CE2 3.72Å; I490-F519 HydrophobicContact CD1-CZ 4.27Å; I490-W540 HydrophobicContact CB-CH2 4.44Å; I490-W540 HydrophobicContact CD1-CH2 4.17Å; I490-W540 HydrophobicContact CD1-CZ3 3.77Å; I490-W540 HydrophobicContact CG1-CH2 3.97Å; I490-W540 HydrophobicContact CG1-CZ3 3.8Å; I490-W540 HydrophobicContact CG2-CH2 3.66Å; I490-W540 HydrophobicContact CG2-CZ3 4.36Å
491	F	91.8	Very high	87.7	Confident	3 Å²	3	50.8 Å²	50.8	1%	0.013	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	143.3	172	-65.9	-91.8	0	0	0	110.9	L445 I459 M464 M467 W478 L479 C481 L489 L499	L445-F491 HydrophobicContact CD1-CD1 4.21Å; L445-F491 HydrophobicContact CD1-CD2 3.71Å; L445-F491 HydrophobicContact CD1-CE1 3.99Å; L445-F491 HydrophobicContact CD1-CE2 3.46Å; L445-F491 VanDerWaalsContact CD1-CE2 3.46Å; L445-F491 HydrophobicContact CD1-CG 4.08Å; L445-F491 HydrophobicContact CD1-CZ 3.61Å; I459-F491 HydrophobicContact CD1-CD1 4.47Å; I459-F491 HydrophobicContact CG2-CE1 4.08Å; M464-F491 HydrophobicContact CE-CZ 3.91Å; M464-F491 HydrophobicContact SD-CZ 4.42Å; M467-F491 HydrophobicContact SD-CE2 4.11Å; W478-F491 CarbonylContact C-O 3.59Å; W478-F491 WeakPolarHBondContact CA-O 3.4Å; L479-F491 HydrophobicContact CB-CB 4.2Å; L479-F491 PolarHBondContact N-O 3.16Å; L479-F491 PolarHBondContact O-N 3.02Å; C481-F491 HydrophobicContact CB-CD2 4.18Å; C481-F491 HydrophobicContact CB-CE2 4.1Å; C481-F491 VanDerWaalsContact SG-CD2 3.55Å; L489-F491 HydrophobicContact CB-CE2 3.91Å; F491-L499 HydrophobicContact CD1-CB 4.14Å; F491-L499 HydrophobicContact CD1-CD1 4.47Å; F491-L499 HydrophobicContact CD2-CD1 4.42Å; F491-L499 HydrophobicContact CE1-CB 3.82Å; F491-L499 HydrophobicContact CE1-CD1 4.11Å; F491-L499 HydrophobicContact CE2-CD1 4.07Å; F491-L499 HydrophobicContact CZ-CB 4.39Å; F491-L499 HydrophobicContact CZ-CD1 3.91Å
492	G	90.5	Very high	87.5	Confident	17 Å²	17	59.2 Å²	59.2	18%	0.175	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	127.2	171.7	0	0	0	0	0	111.3	F497 R498	G492-F497 WeakPolarHBondContact O-CA 3.47Å; G492-F497 PolarHBondContact O-N 2.83Å; G492-R498 PolarHBondContact N-O 2.89Å; G492-R498 VanDerWaalsContact N-O 3.13Å
493	A	83.3	Confident	87.4	Confident	0 Å²	0	61 Å²	61	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-26.9	-167.9	0	0	0	0	0	114.6	V430 L472 G476 K477 L479 F497	V430-A493 HydrophobicContact CG1-CB 3.67Å; V430-A493 VanDerWaalsContact CG1-O 3.23Å; V430-A493 WeakPolarHBondContact CG1-O 3.26Å; L472-A493 HydrophobicContact CD1-CB 4.03Å; G476-A493 VanDerWaalsContact O-CB 3.31Å; G476-A493 WeakPolarHBondContact O-CB 3.43Å; K477-A493 VanDerWaalsContact C-CB 3.49Å; K477-A493 WeakPolarHBondContact O-CB 3.38Å; K477-A493 PolarHBondContact O-N 3.43Å; L479-A493 HydrophobicContact CD1-CB 4.38Å; L479-A493 HydrophobicContact CG-CB 4.1Å; A493-F497 WeakPolarHBondContact O-CE1 3.36Å; A493-F497 WeakPolarHBondContact O-CZ 3.07Å
494	Q	78.3	Confident	87.4	Confident	97 Å²	97	63.4 Å²	63.4	45%	0.453	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-16.3	-163.4	-71.7	-179.4	-25.6	0	0	116.1
495	N	72	Confident	87.4	Confident	118 Å²	118	61.1 Å²	61.1	63%	0.631	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-163.8	-64.9	-177.8	-91.5	-47.1	0	0	0	114.7	F497	N495-F497 VanDerWaalsContact O-CD2 3.27Å; N495-F497 WeakPolarHBondContact O-CD2 3.34Å
496	R	79.1	Confident	87.4	Confident	182 Å²	182	64.8 Å²	64.8	69%	0.687	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-11	-169.1	-75.4	-171	-81.2	-161.5	-5.2	114	R498	R496-R498 HydrophobicContact CB-CG 4.1Å; R496-R498 PolarHBondContact O-N 3.27Å
497	F	83	Confident	87.1	Confident	5 Å²	5	64 Å²	64	2%	0.022	30%	0.299	C	S	.	.			trans	43.2	40.9	-176.9	-61.7	-84.9	0	0	0	112.9	V430 V437 V447 I459 L479 G492 A493 N495	V430-F497 HydrophobicContact CG1-CE1 3.98Å; V430-F497 HydrophobicContact CG1-CZ 4.12Å; V437-F497 HydrophobicContact CG2-CD1 4.33Å; V437-F497 HydrophobicContact CG2-CE1 3.83Å; V447-F497 HydrophobicContact CB-CE2 4.48Å; V447-F497 HydrophobicContact CG1-CD2 4.39Å; V447-F497 HydrophobicContact CG1-CE1 4.22Å; V447-F497 HydrophobicContact CG1-CE2 3.78Å; V447-F497 HydrophobicContact CG1-CZ 3.68Å; V447-F497 HydrophobicContact CG2-CB 4.41Å; V447-F497 HydrophobicContact CG2-CD1 3.95Å; V447-F497 HydrophobicContact CG2-CD2 3.97Å; V447-F497 HydrophobicContact CG2-CE1 4.13Å; V447-F497 HydrophobicContact CG2-CE2 4.18Å; V447-F497 HydrophobicContact CG2-CG 3.85Å; V447-F497 HydrophobicContact CG2-CZ 4.26Å; I459-F497 HydrophobicContact CD1-CB 3.63Å; I459-F497 WeakPolarHBondContact CD1-O 3.35Å; L479-F497 HydrophobicContact CD1-CD1 4.15Å; L479-F497 HydrophobicContact CD1-CE1 4.13Å; G492-F497 WeakPolarHBondContact O-CA 3.47Å; G492-F497 PolarHBondContact O-N 2.83Å; A493-F497 WeakPolarHBondContact O-CE1 3.36Å; A493-F497 WeakPolarHBondContact O-CZ 3.07Å; N495-F497 VanDerWaalsContact O-CD2 3.27Å; N495-F497 WeakPolarHBondContact O-CD2 3.34Å
498	R	86	Confident	87	Confident	175 Å²	175	62.7 Å²	62.7	66%	0.66	29%	0.293	S	S	*	.			trans	-90.7	140.2	179.5	-75.5	-178.2	178.7	-170.3	-2.3	109.9	G492 R496 N500	G492-R498 PolarHBondContact N-O 2.89Å; G492-R498 VanDerWaalsContact N-O 3.13Å; R496-R498 HydrophobicContact CB-CG 4.1Å; R496-R498 PolarHBondContact O-N 3.27Å; R498-N500 PolarHBondContact O-N 3.02Å
499	L	88.6	Confident	86.8	Confident	62 Å²	62	66.6 Å²	66.6	33%	0.325	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	128.8	171.9	-178.7	70.8	0	0	0	109.9	L489 F491 K501	L489-L499 HydrophobicContact CB-CD1 3.73Å; L489-L499 HydrophobicContact CD2-CD1 4.07Å; L489-L499 HydrophobicContact CG-CD1 4.33Å; F491-L499 HydrophobicContact CD1-CB 4.14Å; F491-L499 HydrophobicContact CD1-CD1 4.47Å; F491-L499 HydrophobicContact CD2-CD1 4.42Å; F491-L499 HydrophobicContact CE1-CB 3.82Å; F491-L499 HydrophobicContact CE1-CD1 4.11Å; F491-L499 HydrophobicContact CE2-CD1 4.07Å; F491-L499 HydrophobicContact CZ-CB 4.39Å; F491-L499 HydrophobicContact CZ-CD1 3.91Å; L499-K501 PolarHBondContact O-N 2.93Å
500	N	86.2	Confident	86.5	Confident	40 Å²	40	66.1 Å²	66.1	21%	0.214	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	98	173.3	-169	-4.6	0	0	0	110.2	W478 I490 R498 K502 K503	W478-N500 WeakPolarHBondContact CH2-ND2 3.35Å; W478-N500 HydrophobicContact CZ3-CB 4Å; W478-N500 WeakPolarHBondContact CZ3-ND2 3.21Å; I490-N500 HydrophobicContact CG2-CB 4.42Å; I490-N500 PolarHBondContact O-N 2.82Å; R498-N500 PolarHBondContact O-N 3.02Å; N500-K502 PolarHBondContact O-N 3.4Å; N500-K502 PolarHBondContact OD1-N 2.85Å; N500-K503 HydrophobicContact CB-CB 4.45Å; N500-K503 PolarHBondContact O-N 3.22Å
501	K	85.9	Confident	85.9	Confident	176 Å²	176	68.8 Å²	68.8	77%	0.765	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.3	-19.3	-179.4	-62.9	-174.2	179.5	-175.4	0	114.2	L499 K503	L499-K501 PolarHBondContact O-N 2.93Å; K501-K503 VanDerWaalsContact C-N 3.33Å
502	K	87.9	Confident	85.5	Confident	177 Å²	177	71.7 Å²	71.7	77%	0.77	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	-18.3	177.2	-62	-176.6	179.7	-178.2	0	113	N500	N500-K502 PolarHBondContact O-N 3.4Å; N500-K502 PolarHBondContact OD1-N 2.85Å
503	K	89.5	Confident	85.4	Confident	37 Å²	37	74.4 Å²	74.4	16%	0.161	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	83.2	-174.1	-61.4	-60.2	-176.2	-176	0	109.1	I490 N500 K501 W540 K541 T543	I490-K503 HydrophobicContact CB-CB 3.98Å; I490-K503 HydrophobicContact CG1-CB 3.88Å; I490-K503 WeakPolarHBondContact CG1-O 3.18Å; I490-K503 HydrophobicContact CG2-CB 4.35Å; N500-K503 HydrophobicContact CB-CB 4.45Å; N500-K503 PolarHBondContact O-N 3.22Å; K501-K503 VanDerWaalsContact C-N 3.33Å; K503-W540 WeakPolarHBondContact CE-O 3.42Å; K503-W540 HydrophobicContact CG-CZ2 4.5Å; K503-W540 PolarHBondContact NZ-O 3.03Å; K503-K541 PolarHBondContact NZ-O 2.88Å; K503-T543 HydrophobicContact CD-CG2 3.46Å; K503-T543 VanDerWaalsContact CD-CG2 3.46Å
504	I	91.1	Very high	85.5	Confident	51 Å²	51	75.5 Å²	75.5	26%	0.262	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	120.1	175.5	-57.6	174.1	0	0	0	106.8	Q487 K506	Q487-I504 HydrophobicContact CB-CG2 4.32Å; Q487-I504 VanDerWaalsContact OE1-CG2 3.3Å; I504-K506 HydrophobicContact CG2-CD 4.46Å; I504-K506 HydrophobicContact CG2-CG 3.96Å
505	F	91.3	Very high	86.1	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	118.2	178.5	-54.1	-84.7	0	0	0	109.3	Q487 I488 I490 H508 V526 W538 W540 T543	Q487-F505 WeakPolarHBondContact CA-O 3.39Å; I488-F505 HydrophobicContact CB-CB 4.13Å; I488-F505 HydrophobicContact CB-CD2 4.17Å; I488-F505 HydrophobicContact CD1-CB 4.38Å; I488-F505 HydrophobicContact CG2-CD2 4.15Å; I488-F505 PolarHBondContact N-O 3.17Å; I488-F505 PolarHBondContact O-N 2.97Å; I490-F505 HydrophobicContact CD1-CD2 4.37Å; I490-F505 HydrophobicContact CD1-CE2 3.92Å; I490-F505 HydrophobicContact CG1-CD2 4.26Å; I490-F505 HydrophobicContact CG1-CE2 3.72Å; F505-H508 PolarHBondContact O-CE1 3.46Å; F505-V526 HydrophobicContact CE1-CG2 4.23Å; F505-V526 HydrophobicContact CE2-CG2 3.98Å; F505-V526 HydrophobicContact CZ-CG2 3.75Å; F505-W538 HydrophobicContact CB-CD2 3.95Å; F505-W538 HydrophobicContact CB-CG 3.99Å; F505-W538 HydrophobicContact CD1-CB 3.36Å; F505-W538 AromaticContact CD1-CD1 3.79Å; F505-W538 HydrophobicContact CD1-CD2 4.24Å; F505-W538 AromaticContact CD1-CG 3.51Å; F505-W538 HydrophobicContact CD1-CG 3.51Å; F505-W538 HydrophobicContact CE1-CB 3.71Å; F505-W538 HydrophobicContact CE1-CG 4.36Å; F505-W538 HydrophobicContact CG-CB 4.29Å; F505-W538 HydrophobicContact CG-CD2 4.38Å; F505-W538 HydrophobicContact CG-CG 4.1Å; F505-W540 AromaticContact CE2-CE3 3.94Å; F505-W540 HydrophobicContact CE2-CE3 3.94Å; F505-W540 AromaticContact CE2-CZ3 3.8Å; F505-W540 HydrophobicContact CE2-CZ3 3.8Å; F505-W540 HydrophobicContact CZ-CD2 4.44Å; F505-W540 AromaticContact CZ-CE3 3.5Å; F505-W540 HydrophobicContact CZ-CE3 3.5Å; F505-W540 AromaticContact CZ-CZ3 3.85Å; F505-W540 HydrophobicContact CZ-CZ3 3.85Å; F505-T543 HydrophobicContact CD1-CG2 4.49Å; F505-T543 HydrophobicContact CE1-CG2 3.95Å; F505-T543 HydrophobicContact CZ-CG2 4.21Å
506	K	89.8	Confident	87	Confident	119 Å²	119	66.3 Å²	66.3	52%	0.517	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	164.1	178.4	-53.6	-165.2	-178.8	-162	0	110.1	Q487 I504 W538	Q487-K506 VanDerWaalsContact CD-CE 3.45Å; Q487-K506 HydrophobicContact CG-CD 4.32Å; Q487-K506 HydrophobicContact CG-CG 4.07Å; I504-K506 HydrophobicContact CG2-CD 4.46Å; I504-K506 HydrophobicContact CG2-CG 3.96Å; K506-W538 PolarHBondContact O-NE1 2.89Å
507	G	85	Confident	87.7	Confident	38 Å²	38	57.7 Å²	57.7	39%	0.392	30%	0.298	S	S	.	.	S	Bend	trans	104.3	11.8	175.4	0	0	0	0	0	114.6	R548	G507-R548 PolarHBondContact O-NH2 2.8Å
508	H	87.6	Confident	88.2	Confident	9 Å²	9	58.5 Å²	58.5	4%	0.042	30%	0.302	C	S	.	.			trans	-105.4	158.8	163.5	53.6	-94.1	0	0	0	110.6	N486 Q487 I488 F505 V510 D530 N536 W538	N486-H508 VanDerWaalsContact C-NE2 3.3Å; N486-H508 VanDerWaalsContact CB-O 3.31Å; N486-H508 WeakPolarHBondContact CB-O 3.36Å; N486-H508 PolarHBondContact O-NE2 2.77Å; Q487-H508 PolarHBondContact N-NE2 2.51Å; I488-H508 VanDerWaalsContact CG1-CE1 3.45Å; I488-H508 WeakPolarHBondContact CG1-CE1 3.44Å; I488-H508 PolarHBondContact N-CE1 2.86Å; F505-H508 PolarHBondContact O-CE1 3.46Å; H508-V510 HydrophobicContact CB-CG2 4.47Å; H508-V510 WeakPolarHBondContact CD2-CG2 3.25Å; H508-D530 WeakPolarHBondContact CA-OD2 3.27Å; H508-D530 WeakPolarHBondContact CB-OD1 3.45Å; H508-N536 WeakPolarHBondContact CA-ND2 3.5Å; H508-N536 WeakPolarHBondContact CB-ND2 3.42Å; H508-W538 HydrophobicContact CB-CH2 3.81Å; H508-W538 HydrophobicContact CB-CZ2 3.86Å; H508-W538 AromaticContact CG-CH2 3.74Å; H508-W538 AromaticContact CG-CZ2 3.83Å; H508-W538 AromaticContact ND1-CH2 3.12Å; H508-W538 WeakPolarHBondContact ND1-CH2 3.5Å; H508-W538 AromaticContact ND1-CZ2 3.07Å; H508-W538 WeakPolarHBondContact ND1-CZ2 3.16Å
509	M	89.5	Confident	88.5	Confident	82 Å²	82	50.3 Å²	50.3	40%	0.404	27%	0.272	S	S	.	.			trans	-115.3	118.7	170.3	-175.3	170.9	68.5	0	0	109.5	D530 A531 D532	M509-D530 PolarHBondContact N-OD2 2.81Å; M509-D530 WeakPolarHBondContact O-CA 3.34Å; M509-A531 HydrophobicContact CE-CB 4.17Å; M509-A531 HydrophobicContact CG-CB 4.46Å; M509-A531 WeakPolarHBondContact O-CB 3.4Å; M509-A531 PolarHBondContact O-N 3.08Å; M509-D532 WeakPolarHBondContact CE-OD1 3.45Å
510	V	85.4	Confident	88.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.256	C	S	.	.			trans	-133.8	-6.8	-170.2	160.8	0	0	0	0	112.4	Q482 N486 H508 G512 Y513 C515	Q482-V510 HydrophobicContact CG-CG1 3.74Å; Q482-V510 VanDerWaalsContact NE2-CG2 3.33Å; Q482-V510 VanDerWaalsContact OE1-CG1 3.24Å; N486-V510 PolarHBondContact OD1-N 2.61Å; H508-V510 HydrophobicContact CB-CG2 4.47Å; H508-V510 WeakPolarHBondContact CD2-CG2 3.25Å; V510-G512 PolarHBondContact O-N 3.1Å; V510-Y513 WeakPolarHBondContact CG1-O 3.48Å; V510-Y513 PolarHBondContact O-N 3.02Å; V510-C515 HydrophobicContact CG2-CB 4.26Å
511	A	81.6	Confident	88.8	Confident	57 Å²	57	46.2 Å²	46.2	47%	0.471	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-41	115.1	-179.3	0	0	0	0	0	113.5	N486 Y513	N486-A511 PolarHBondContact OD1-N 3.3Å; N486-A511 VanDerWaalsContact OD1-N 3.08Å; A511-Y513 WeakPolarHBondContact O-CD2 3.33Å
512	G	83.7	Confident	88.9	Confident	64 Å²	64	39.7 Å²	39.7	66%	0.66	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.5	-1.4	178.2	0	0	0	0	0	116.1	M484 V510	M484-G512 PolarHBondContact SD-N 2.86Å; V510-G512 PolarHBondContact O-N 3.1Å
513	Y	88.2	Confident	88.9	Confident	73 Å²	73	32.1 Å²	32.1	29%	0.286	19%	0.192	S	C	.	.			trans	-116.3	145.1	-178.5	-60.8	-75.4	0	0	0	112.4	V510 A511 C515 A531 V555 W574	V510-Y513 WeakPolarHBondContact CG1-O 3.48Å; V510-Y513 PolarHBondContact O-N 3.02Å; A511-Y513 WeakPolarHBondContact O-CD2 3.33Å; Y513-C515 PolarHBondContact O-N 3.38Å; Y513-A531 HydrophobicContact CD2-CB 3.69Å; Y513-A531 HydrophobicContact CE2-CB 3.68Å; Y513-V555 HydrophobicContact CD1-CG1 3.82Å; Y513-V555 HydrophobicContact CD1-CG2 4.14Å; Y513-V555 HydrophobicContact CD2-CG1 4.37Å; Y513-V555 HydrophobicContact CD2-CG2 4.49Å; Y513-V555 HydrophobicContact CE1-CB 4.42Å; Y513-V555 HydrophobicContact CE1-CG1 4.2Å; Y513-V555 HydrophobicContact CE1-CG2 3.64Å; Y513-V555 HydrophobicContact CE2-CG2 4.03Å; Y513-V555 HydrophobicContact CG-CG1 3.91Å; Y513-W574 AromaticContact CD1-CH2 3.96Å; Y513-W574 HydrophobicContact CD1-CH2 3.96Å; Y513-W574 AromaticContact CD1-CZ2 4Å; Y513-W574 HydrophobicContact CD1-CZ2 4Å; Y513-W574 HydrophobicContact CE1-CE3 4.41Å; Y513-W574 AromaticContact CE1-CH2 3.53Å; Y513-W574 HydrophobicContact CE1-CH2 3.53Å; Y513-W574 HydrophobicContact CE1-CZ2 4.01Å; Y513-W574 AromaticContact CE1-CZ3 3.75Å; Y513-W574 HydrophobicContact CE1-CZ3 3.75Å
514	A	86.6	Confident	89	Confident	24 Å²	24	32.3 Å²	32.3	20%	0.198	20%	0.198	C	C	.	.			trans	-93.9	74	176.4	0	0	0	0	0	110	P468 I557	P468-A514 HydrophobicContact CB-CB 3.69Å; P468-A514 HydrophobicContact CG-CB 4.35Å; A514-I557 WeakPolarHBondContact O-CG2 3.4Å
515	C	90.4	Very high	89.1	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-85.8	119.9	-176.2	-66.7	0	0	0	0	110.9	A469 Q482 V510 Y513 V517 G529 C556 I557	A469-C515 WeakPolarHBondContact CB-O 3.22Å; Q482-C515 VanDerWaalsContact NE2-CB 3.27Å; Q482-C515 PolarHBondContact NE2-O 2.81Å; Q482-C515 VanDerWaalsContact NE2-O 3.12Å; Q482-C515 VanDerWaalsContact OE1-CA 3.27Å; Q482-C515 PolarHBondContact OE1-O 3.31Å; V510-C515 HydrophobicContact CG2-CB 4.26Å; Y513-C515 PolarHBondContact O-N 3.38Å; C515-V517 PolarHBondContact O-N 2.93Å; C515-G529 WeakPolarHBondContact CB-O 3.47Å; C515-C556 PolarHBondContact SG-O 2.81Å; C515-I557 CarbonylContact C-O 3.57Å; C515-I557 VanDerWaalsContact C-O 3.29Å; C515-I557 WeakPolarHBondContact CA-O 3.33Å; C515-I557 WeakPolarHBondContact CB-O 3.31Å
516	Q	90.9	Very high	89.2	Confident	22 Å²	22	31.5 Å²	31.5	10%	0.103	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-69	134.9	179.4	-163.4	177.8	-17.7	0	0	110.5	I557 S558	Q516-I557 PolarHBondContact N-O 3.42Å; Q516-S558 PolarHBondContact OE1-OG 2.84Å
517	V	92.7	Very high	89.4	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	146.5	174.7	-178.8	0	0	0	0	108	T471 A480 Q482 I488 C515 V526 V527	T471-V517 WeakPolarHBondContact CB-O 3.19Å; T471-V517 WeakPolarHBondContact CG2-O 3.02Å; T471-V517 PolarHBondContact OG1-O 2.86Å; A480-V517 HydrophobicContact CB-CB 4.42Å; A480-V517 HydrophobicContact CB-CG1 3.85Å; Q482-V517 HydrophobicContact CB-CG2 3.81Å; Q482-V517 HydrophobicContact CG-CG2 4.41Å; I488-V517 HydrophobicContact CD1-CG1 4.16Å; I488-V517 HydrophobicContact CD1-CG2 3.96Å; I488-V517 HydrophobicContact CG1-CG2 3.93Å; I488-V517 HydrophobicContact CG2-CG1 4.42Å; C515-V517 PolarHBondContact O-N 2.93Å; V517-V526 HydrophobicContact CG1-CG1 3.61Å; V517-V527 WeakPolarHBondContact CA-O 3.32Å; V517-V527 WeakPolarHBondContact CG1-O 3.44Å
518	D	93.6	Very high	89.8	Confident	23 Å²	23	24 Å²	24	12%	0.123	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	162	171.8	-157.3	12.5	0	0	0	111.9	V527 A559 L560 W561	D518-V527 PolarHBondContact N-O 2.97Å; D518-V527 PolarHBondContact O-N 2.6Å; D518-A559 WeakPolarHBondContact CB-O 3.38Å; D518-L560 WeakPolarHBondContact OD2-CA 3.47Å; D518-L560 WeakPolarHBondContact OD2-CD2 3.47Å; D518-W561 PolarHBondContact OD2-N 2.96Å
519	F	92.9	Very high	90	Very high	3 Å²	3	23.6 Å²	23.6	1%	0.013	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	149.4	177.8	-69.4	-84.2	0	0	0	110.4	P474 A480 I490 M523 V526 W540 W561	P474-F519 HydrophobicContact CG-CB 4.24Å; A480-F519 HydrophobicContact CB-CE2 3.48Å; A480-F519 VanDerWaalsContact CB-CE2 3.48Å; A480-F519 HydrophobicContact CB-CZ 3.46Å; A480-F519 VanDerWaalsContact CB-CZ 3.46Å; I490-F519 HydrophobicContact CD1-CZ 4.27Å; F519-M523 HydrophobicContact CD1-CG 4.42Å; F519-M523 HydrophobicContact CE1-CE 4.23Å; F519-V526 HydrophobicContact CD1-CG2 3.76Å; F519-V526 HydrophobicContact CE1-CG2 3.64Å; F519-W540 HydrophobicContact CD1-CE3 4.45Å; F519-W540 AromaticContact CE1-CE3 3.76Å; F519-W540 HydrophobicContact CE1-CE3 3.76Å; F519-W540 HydrophobicContact CE1-CH2 4.22Å; F519-W540 AromaticContact CE1-CZ3 3.49Å; F519-W540 HydrophobicContact CE1-CZ3 3.49Å; F519-W540 VanDerWaalsContact CE1-CZ3 3.49Å; F519-W540 HydrophobicContact CZ-CZ3 4.12Å; F519-W561 WeakPolarHBondContact O-CB 3.44Å
520	S	92.1	Very high	90	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	13%	0.128	C	C	.	.			trans	-65.7	148.2	162	66	0	0	0	0	110	D522 M523 S524 Y525	S520-D522 WeakPolarHBondContact CB-OD1 3.19Å; S520-D522 PolarHBondContact O-N 2.89Å; S520-D522 PolarHBondContact OG-OD1 3.25Å; S520-M523 WeakPolarHBondContact O-CA 3.09Å; S520-M523 PolarHBondContact O-N 3.41Å; S520-S524 PolarHBondContact OG-N 3.27Å; S520-Y525 PolarHBondContact N-O 3.44Å; S520-Y525 PolarHBondContact OG-N 2.83Å; S520-Y525 PolarHBondContact OG-O 3.09Å
521	P	88.7	Confident	90.2	Very high	16 Å²	16	20.7 Å²	20.7	10%	0.104	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-38.9	-179.7	-31.3	34.6	0	0	0	114.4	A272 P273 M523 H562 P563	A272-P521 HydrophobicContact CB-CB 3.99Å; P273-P521 HydrophobicContact CG-CB 3.95Å; P273-P521 HydrophobicContact CG-CG 4.27Å; P521-M523 PolarHBondContact O-N 3.01Å; P521-H562 WeakPolarHBondContact CG-O 3.32Å; P521-P563 WeakPolarHBondContact CB-O 3.18Å; P521-P563 WeakPolarHBondContact CG-O 3.25Å
522	D	87.9	Confident	90.6	Very high	38 Å²	38	21.4 Å²	21.4	20%	0.203	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-2.8	177.3	71.4	-14.6	0	0	0	113.6	C276 S520 S524	C276-D522 WeakPolarHBondContact CB-OD1 3.32Å; C276-D522 WeakPolarHBondContact CB-OD2 3.31Å; C276-D522 PolarHBondContact N-OD2 2.96Å; C276-D522 PolarHBondContact SG-OD1 3.27Å; S520-D522 WeakPolarHBondContact CB-OD1 3.19Å; S520-D522 PolarHBondContact O-N 2.89Å; S520-D522 PolarHBondContact OG-OD1 3.25Å; D522-S524 PolarHBondContact O-N 3.21Å; D522-S524 VanDerWaalsContact OD1-CB 3.24Å; D522-S524 WeakPolarHBondContact OD1-CB 3.38Å; D522-S524 PolarHBondContact OD1-N 3.07Å; D522-S524 PolarHBondContact OD1-OG 2.88Å; D522-S524 VanDerWaalsContact OD2-CB 3.25Å; D522-S524 WeakPolarHBondContact OD2-CB 3.35Å; D522-S524 PolarHBondContact OD2-OG 2.92Å
523	M	89.1	Confident	90.8	Very high	19 Å²	19	18.3 Å²	18.3	9%	0.094	10%	0.099	C	C	.	.	S	Bend	trans	62.4	19.2	-174.6	-150.4	-166.7	-175.7	0	0	114.8	N475 W478 F519 S520 P521 W540	N475-M523 PolarHBondContact ND2-SD 3.3Å; W478-M523 HydrophobicContact CB-CE 4.06Å; W478-M523 HydrophobicContact CG-CE 3.73Å; F519-M523 HydrophobicContact CD1-CG 4.42Å; F519-M523 HydrophobicContact CE1-CE 4.23Å; S520-M523 WeakPolarHBondContact O-CA 3.09Å; S520-M523 PolarHBondContact O-N 3.41Å; P521-M523 PolarHBondContact O-N 3.01Å; M523-W540 HydrophobicContact CE-CD2 3.79Å; M523-W540 HydrophobicContact CE-CE3 4.17Å; M523-W540 HydrophobicContact CE-CG 4.5Å; M523-W540 HydrophobicContact CE-CH2 3.51Å; M523-W540 HydrophobicContact CE-CZ2 3.1Å; M523-W540 HydrophobicContact CE-CZ3 4.05Å; M523-W540 HydrophobicContact CG-CD2 4.43Å; M523-W540 HydrophobicContact CG-CG 4.36Å; M523-W540 WeakPolarHBondContact O-CB 3.28Å; M523-W540 VanDerWaalsContact O-CD1 3.3Å; M523-W540 VanDerWaalsContact O-CG 3.23Å; M523-W540 HydrophobicContact SD-CZ2 4.3Å
524	S	90.9	Very high	91	Very high	40 Å²	40	17.6 Å²	17.6	28%	0.28	10%	0.097	S	C	.	.	S	Bend	trans	-71	-34.1	174.7	-69.4	0	0	0	0	112.7	S520 D522 W540	S520-S524 PolarHBondContact OG-N 3.27Å; D522-S524 PolarHBondContact O-N 3.21Å; D522-S524 VanDerWaalsContact OD1-CB 3.24Å; D522-S524 WeakPolarHBondContact OD1-CB 3.38Å; D522-S524 PolarHBondContact OD1-N 3.07Å; D522-S524 PolarHBondContact OD1-OG 2.88Å; D522-S524 VanDerWaalsContact OD2-CB 3.25Å; D522-S524 WeakPolarHBondContact OD2-CB 3.35Å; D522-S524 PolarHBondContact OD2-OG 2.92Å; S524-W540 WeakPolarHBondContact O-CB 3.42Å; S524-W540 PolarHBondContact O-N 2.92Å
525	Y	93.1	Very high	91.4	Very high	34 Å²	34	16.4 Å²	16.4	13%	0.133	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	152.2	-172.5	-54.9	-66.2	0	0	0	112.8	C276 L278 S520 I537 W538 D539 W561	C276-Y525 HydrophobicContact CB-CD2 4.24Å; C276-Y525 HydrophobicContact CB-CE2 4.38Å; C276-Y525 WeakPolarHBondContact O-CE2 3.43Å; L278-Y525 HydrophobicContact CD1-CD1 4.25Å; L278-Y525 HydrophobicContact CD1-CD2 4.42Å; L278-Y525 HydrophobicContact CD1-CE1 3.59Å; L278-Y525 HydrophobicContact CD1-CE2 3.77Å; L278-Y525 WeakPolarHBondContact CD1-OH 3.25Å; L278-Y525 HydrophobicContact CG-CE1 4.38Å; L278-Y525 HydrophobicContact CG-CE2 4.49Å; S520-Y525 PolarHBondContact N-O 3.44Å; S520-Y525 PolarHBondContact OG-N 2.83Å; S520-Y525 PolarHBondContact OG-O 3.09Å; Y525-I537 HydrophobicContact CD1-CG2 4.23Å; Y525-I537 HydrophobicContact CG-CG2 4.26Å; Y525-W538 CarbonylContact C-O 3.57Å; Y525-W538 WeakPolarHBondContact CA-O 3.19Å; Y525-D539 HydrophobicContact CD1-CB 4.46Å; Y525-D539 HydrophobicContact CE1-CB 4.47Å; Y525-W561 HydrophobicContact CD2-CH2 4.01Å
526	V	94.3	Very high	91.5	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	135.9	168.9	-177.6	0	0	0	0	107.6	I488 F505 V517 F519 I537 W538 W540	I488-V526 HydrophobicContact CD1-CG1 4.39Å; F505-V526 HydrophobicContact CE1-CG2 4.23Å; F505-V526 HydrophobicContact CE2-CG2 3.98Å; F505-V526 HydrophobicContact CZ-CG2 3.75Å; V517-V526 HydrophobicContact CG1-CG1 3.61Å; F519-V526 HydrophobicContact CD1-CG2 3.76Å; F519-V526 HydrophobicContact CE1-CG2 3.64Å; V526-I537 CarbonylContact O-C 3.46Å; V526-I537 WeakPolarHBondContact O-CA 3.19Å; V526-W538 HydrophobicContact CB-CB 4.47Å; V526-W538 HydrophobicContact CB-CE3 4.36Å; V526-W538 HydrophobicContact CG1-CE3 4.29Å; V526-W538 PolarHBondContact N-O 3.36Å; V526-W538 PolarHBondContact O-N 2.68Å; V526-W540 HydrophobicContact CG2-CE3 3.62Å; V526-W540 HydrophobicContact CG2-CZ3 4.21Å
527	V	93.8	Very high	91.7	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.006	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	138	-178.3	-175.6	0	0	0	0	110.2	V517 D518 L535 N536 I537 A559 W561 V569	V517-V527 WeakPolarHBondContact CA-O 3.32Å; V517-V527 WeakPolarHBondContact CG1-O 3.44Å; D518-V527 PolarHBondContact N-O 2.97Å; D518-V527 PolarHBondContact O-N 2.6Å; V527-L535 HydrophobicContact CG1-CD1 3.21Å; V527-L535 HydrophobicContact CG1-CD2 4.27Å; V527-L535 HydrophobicContact CG1-CG 3.82Å; V527-N536 WeakPolarHBondContact CA-O 3.29Å; V527-I537 HydrophobicContact CG1-CG1 4.39Å; V527-I537 HydrophobicContact CG2-CG1 4.08Å; V527-I537 HydrophobicContact CG2-CG2 4.23Å; V527-A559 HydrophobicContact CG1-CB 3.66Å; V527-W561 HydrophobicContact CG2-CE3 3.38Å; V527-W561 HydrophobicContact CG2-CZ3 3.39Å; V527-V569 HydrophobicContact CG1-CG1 4.29Å
528	S	93.3	Very high	91.8	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	155.5	167.5	83.1	0	0	0	0	112.2	N536 W538	S528-N536 PolarHBondContact N-O 3.08Å; S528-N536 PolarHBondContact O-N 2.87Å; S528-W538 WeakPolarHBondContact OG-CH2 3.29Å; S528-W538 WeakPolarHBondContact OG-CZ3 3.35Å
529	G	91.2	Very high	91.8	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	154.8	167	0	0	0	0	0	112.8	C515 K534 C556	C515-G529 WeakPolarHBondContact CB-O 3.47Å; G529-K534 CarbonylContact C-O 3.53Å; G529-C556 CarbonylContact C-O 3.59Å; G529-C556 WeakPolarHBondContact CA-O 3.02Å
530	D	90.3	Very high	91.7	Very high	4 Å²	4	16.5 Å²	16.5	2%	0.021	9%	0.087	C	C	.	.			trans	-114.5	161.7	177.5	-76	23.7	0	0	0	112.5	H508 M509 D532 G533 K534 N536 C556	H508-D530 WeakPolarHBondContact CA-OD2 3.27Å; H508-D530 WeakPolarHBondContact CB-OD1 3.45Å; M509-D530 PolarHBondContact N-OD2 2.81Å; M509-D530 WeakPolarHBondContact O-CA 3.34Å; D530-D532 PolarHBondContact O-N 2.67Å; D530-G533 PolarHBondContact O-N 3.23Å; D530-K534 HydrophobicContact CB-CB 4.24Å; D530-K534 WeakPolarHBondContact CB-O 3.35Å; D530-K534 PolarHBondContact N-O 2.88Å; D530-N536 PolarHBondContact OD1-ND2 3.05Å; D530-N536 PolarHBondContact OD2-ND2 2.56Å; D530-C556 PolarHBondContact O-N 2.86Å
531	A	89.8	Confident	91.6	Very high	17 Å²	17	24.7 Å²	24.7	14%	0.14	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-34.7	167.5	0	0	0	0	0	112.9	M509 Y513 G533 V555	M509-A531 HydrophobicContact CE-CB 4.17Å; M509-A531 HydrophobicContact CG-CB 4.46Å; M509-A531 WeakPolarHBondContact O-CB 3.4Å; M509-A531 PolarHBondContact O-N 3.08Å; Y513-A531 HydrophobicContact CD2-CB 3.69Å; Y513-A531 HydrophobicContact CE2-CB 3.68Å; A531-G533 PolarHBondContact O-N 2.74Å; A531-V555 WeakPolarHBondContact O-CA 3.23Å; A531-V555 VanDerWaalsContact O-CG2 3.25Å; A531-V555 WeakPolarHBondContact O-CG2 3.14Å
532	D	89.3	Confident	91.7	Very high	71 Å²	71	26.7 Å²	26.7	38%	0.38	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	2.3	177.4	-74	-9.3	0	0	0	113.7	M509 D530 K534	M509-D532 WeakPolarHBondContact CE-OD1 3.45Å; D530-D532 PolarHBondContact O-N 2.67Å; D532-K534 HydrophobicContact CB-CD 4.09Å; D532-K534 HydrophobicContact CB-CG 3.97Å; D532-K534 PolarHBondContact O-N 2.73Å; D532-K534 IonicContact OD2-NZ 3.45Å; D532-K534 PolarHBondContact OD2-NZ 2.85Å
533	G	88.3	Confident	91.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	75.3	12.9	-174.6	0	0	0	0	0	114.1	D530 A531 A551 H552 K554	D530-G533 PolarHBondContact O-N 3.23Å; A531-G533 PolarHBondContact O-N 2.74Å; G533-A551 PolarHBondContact O-N 3.32Å; G533-H552 PolarHBondContact O-N 3.02Å; G533-K554 WeakPolarHBondContact CA-O 3.28Å
534	K	92.9	Very high	91.8	Very high	57 Å²	57	33 Å²	33	25%	0.248	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	141.1	178.3	-56.7	178.2	-168.6	138.4	0	110	G529 D530 D532 R548 I549	G529-K534 CarbonylContact C-O 3.53Å; D530-K534 HydrophobicContact CB-CB 4.24Å; D530-K534 WeakPolarHBondContact CB-O 3.35Å; D530-K534 PolarHBondContact N-O 2.88Å; D532-K534 HydrophobicContact CB-CD 4.09Å; D532-K534 HydrophobicContact CB-CG 3.97Å; D532-K534 PolarHBondContact O-N 2.73Å; D532-K534 IonicContact OD2-NZ 3.45Å; D532-K534 PolarHBondContact OD2-NZ 2.85Å; K534-R548 HydrophobicContact CB-CG 4.14Å; K534-R548 HydrophobicContact CD-CG 3.94Å; K534-R548 HydrophobicContact CG-CG 4.5Å; K534-I549 CarbonylContact C-O 3.48Å; K534-I549 VanDerWaalsContact CA-O 3.26Å; K534-I549 WeakPolarHBondContact CA-O 3.23Å
535	L	93.2	Very high	91.9	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	116.8	167.5	-174.8	69	0	0	0	107.9	V527 I537 R548 I549 A551 A559 V569 T571	V527-L535 HydrophobicContact CG1-CD1 3.21Å; V527-L535 HydrophobicContact CG1-CD2 4.27Å; V527-L535 HydrophobicContact CG1-CG 3.82Å; L535-I537 HydrophobicContact CD2-CD1 4.4Å; L535-I537 HydrophobicContact CG-CG1 4.43Å; L535-R548 WeakPolarHBondContact O-CA 3.46Å; L535-I549 HydrophobicContact CB-CB 4.32Å; L535-I549 HydrophobicContact CD2-CD1 4.48Å; L535-I549 PolarHBondContact N-O 2.62Å; L535-I549 PolarHBondContact O-N 3.3Å; L535-A551 HydrophobicContact CB-CB 4.19Å; L535-A559 HydrophobicContact CD1-CB 3.47Å; L535-A559 VanDerWaalsContact CD1-CB 3.47Å; L535-V569 HydrophobicContact CD2-CG1 4.05Å; L535-T571 HydrophobicContact CD1-CG2 3.63Å; L535-T571 HydrophobicContact CD2-CG2 3.91Å; L535-T571 HydrophobicContact CG-CG2 4.26Å
536	N	93.8	Very high	91.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	132.7	176.2	-76.6	-40.4	0	0	0	110.2	H508 V527 S528 D530 W538 L545 R548	H508-N536 WeakPolarHBondContact CA-ND2 3.5Å; H508-N536 WeakPolarHBondContact CB-ND2 3.42Å; V527-N536 WeakPolarHBondContact CA-O 3.29Å; S528-N536 PolarHBondContact N-O 3.08Å; S528-N536 PolarHBondContact O-N 2.87Å; D530-N536 PolarHBondContact OD1-ND2 3.05Å; D530-N536 PolarHBondContact OD2-ND2 2.56Å; N536-W538 HydrophobicContact CB-CE3 4.47Å; N536-W538 HydrophobicContact CB-CH2 3.28Å; N536-W538 HydrophobicContact CB-CZ2 3.59Å; N536-W538 HydrophobicContact CB-CZ3 3.79Å; N536-W538 WeakPolarHBondContact O-CZ3 3.31Å; N536-L545 HydrophobicContact CB-CD1 3.7Å; N536-R548 VanDerWaalsContact OD1-CG 3.28Å; N536-R548 WeakPolarHBondContact OD1-CG 3.07Å; N536-R548 PolarHBondContact OD1-NE 3.13Å; N536-R548 VanDerWaalsContact OD1-NE 3.08Å
537	I	94.3	Very high	91.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	119.1	-180	-53	179.2	0	0	0	108.2	L278 P279 Y525 V526 V527 L535 Y546 H547 I549	L278-I537 HydrophobicContact CD2-CB 4.14Å; L278-I537 HydrophobicContact CD2-CD1 4.16Å; L278-I537 HydrophobicContact CD2-CG2 3.73Å; L278-I537 HydrophobicContact CG-CD1 4.48Å; L278-I537 HydrophobicContact CG-CG2 4.16Å; P279-I537 HydrophobicContact CG-CD1 4.25Å; Y525-I537 HydrophobicContact CD1-CG2 4.23Å; Y525-I537 HydrophobicContact CG-CG2 4.26Å; V526-I537 CarbonylContact O-C 3.46Å; V526-I537 WeakPolarHBondContact O-CA 3.19Å; V527-I537 HydrophobicContact CG1-CG1 4.39Å; V527-I537 HydrophobicContact CG2-CG1 4.08Å; V527-I537 HydrophobicContact CG2-CG2 4.23Å; L535-I537 HydrophobicContact CD2-CD1 4.4Å; L535-I537 HydrophobicContact CG-CG1 4.43Å; I537-Y546 PolarHBondContact O-N 2.91Å; I537-H547 HydrophobicContact CB-CB 4.48Å; I537-H547 PolarHBondContact N-O 3.06Å; I537-H547 PolarHBondContact O-N 2.94Å; I537-I549 HydrophobicContact CD1-CD1 4.38Å
538	W	94.8	Very high	91.2	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	150.2	173.8	-59.6	-94.2	0	0	0	110.7	I488 F505 K506 H508 Y525 V526 S528 N536 K544 L545	I488-W538 HydrophobicContact CD1-CE3 4.12Å; I488-W538 HydrophobicContact CD1-CH2 3.86Å; I488-W538 HydrophobicContact CD1-CZ3 3.56Å; F505-W538 HydrophobicContact CB-CD2 3.95Å; F505-W538 HydrophobicContact CB-CG 3.99Å; F505-W538 HydrophobicContact CD1-CB 3.36Å; F505-W538 AromaticContact CD1-CD1 3.79Å; F505-W538 HydrophobicContact CD1-CD2 4.24Å; F505-W538 AromaticContact CD1-CG 3.51Å; F505-W538 HydrophobicContact CD1-CG 3.51Å; F505-W538 HydrophobicContact CE1-CB 3.71Å; F505-W538 HydrophobicContact CE1-CG 4.36Å; F505-W538 HydrophobicContact CG-CB 4.29Å; F505-W538 HydrophobicContact CG-CD2 4.38Å; F505-W538 HydrophobicContact CG-CG 4.1Å; K506-W538 PolarHBondContact O-NE1 2.89Å; H508-W538 HydrophobicContact CB-CH2 3.81Å; H508-W538 HydrophobicContact CB-CZ2 3.86Å; H508-W538 AromaticContact CG-CH2 3.74Å; H508-W538 AromaticContact CG-CZ2 3.83Å; H508-W538 AromaticContact ND1-CH2 3.12Å; H508-W538 WeakPolarHBondContact ND1-CH2 3.5Å; H508-W538 AromaticContact ND1-CZ2 3.07Å; H508-W538 WeakPolarHBondContact ND1-CZ2 3.16Å; Y525-W538 CarbonylContact C-O 3.57Å; Y525-W538 WeakPolarHBondContact CA-O 3.19Å; V526-W538 HydrophobicContact CB-CB 4.47Å; V526-W538 HydrophobicContact CB-CE3 4.36Å; V526-W538 HydrophobicContact CG1-CE3 4.29Å; V526-W538 PolarHBondContact N-O 3.36Å; V526-W538 PolarHBondContact O-N 2.68Å; S528-W538 WeakPolarHBondContact OG-CH2 3.29Å; S528-W538 WeakPolarHBondContact OG-CZ3 3.35Å; N536-W538 HydrophobicContact CB-CE3 4.47Å; N536-W538 HydrophobicContact CB-CH2 3.28Å; N536-W538 HydrophobicContact CB-CZ2 3.59Å; N536-W538 HydrophobicContact CB-CZ3 3.79Å; N536-W538 WeakPolarHBondContact O-CZ3 3.31Å; W538-K544 WeakPolarHBondContact CA-O 3.44Å; W538-L545 VanDerWaalsContact CD1-CA 3.48Å; W538-L545 HydrophobicContact CD2-CD1 4.1Å; W538-L545 HydrophobicContact CG-CD1 4.24Å; W538-L545 HydrophobicContact CZ2-CD1 4.01Å
539	D	93.8	Very high	91.1	Very high	17 Å²	17	48.9 Å²	48.9	9%	0.091	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	126	165.7	166.3	13.5	0	0	0	109.6	Y525 K541 T542 T543 K544 Y546	Y525-D539 HydrophobicContact CD1-CB 4.46Å; Y525-D539 HydrophobicContact CE1-CB 4.47Å; D539-K541 VanDerWaalsContact C-N 3.28Å; D539-K541 PolarHBondContact O-N 2.86Å; D539-K541 WeakPolarHBondContact OD1-CB 3Å; D539-K541 PolarHBondContact OD1-N 2.93Å; D539-T542 VanDerWaalsContact CG-OG1 3.32Å; D539-T542 WeakPolarHBondContact OD2-CB 3.38Å; D539-T542 VanDerWaalsContact OD2-CG2 3.23Å; D539-T542 WeakPolarHBondContact OD2-CG2 3.27Å; D539-T542 PolarHBondContact OD2-N 3.11Å; D539-T542 PolarHBondContact OD2-OG1 3.4Å; D539-T543 VanDerWaalsContact O-CA 3.25Å; D539-T543 WeakPolarHBondContact O-CA 3.31Å; D539-T543 PolarHBondContact O-N 2.92Å; D539-K544 PolarHBondContact N-O 3.03Å; D539-Y546 HydrophobicContact CB-CD2 3.2Å; D539-Y546 HydrophobicContact CB-CE2 2.94Å; D539-Y546 HydrophobicContact CB-CG 4.21Å; D539-Y546 WeakPolarHBondContact OD2-CE2 3.27Å; D539-Y546 PolarHBondContact OD2-OH 3.29Å
540	W	91.1	Very high	91.1	Very high	32 Å²	32	55.5 Å²	55.5	12%	0.121	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-38.7	-179.7	176.6	-111.5	0	0	0	112.1	W478 I490 K503 F505 F519 M523 S524 V526	W478-W540 HydrophobicContact CB-CH2 4.15Å; W478-W540 AromaticContact CD1-CZ2 3.97Å; W478-W540 HydrophobicContact CD2-CH2 4.24Å; W478-W540 HydrophobicContact CD2-CZ2 4.06Å; W478-W540 AromaticContact CG-CH2 3.96Å; W478-W540 HydrophobicContact CG-CH2 3.96Å; W478-W540 AromaticContact CG-CZ2 3.93Å; W478-W540 HydrophobicContact CG-CZ2 3.93Å; W478-W540 AromaticContact NE1-CZ2 3.95Å; I490-W540 HydrophobicContact CB-CH2 4.44Å; I490-W540 HydrophobicContact CD1-CH2 4.17Å; I490-W540 HydrophobicContact CD1-CZ3 3.77Å; I490-W540 HydrophobicContact CG1-CH2 3.97Å; I490-W540 HydrophobicContact CG1-CZ3 3.8Å; I490-W540 HydrophobicContact CG2-CH2 3.66Å; I490-W540 HydrophobicContact CG2-CZ3 4.36Å; K503-W540 WeakPolarHBondContact CE-O 3.42Å; K503-W540 HydrophobicContact CG-CZ2 4.5Å; K503-W540 PolarHBondContact NZ-O 3.03Å; F505-W540 AromaticContact CE2-CE3 3.94Å; F505-W540 HydrophobicContact CE2-CE3 3.94Å; F505-W540 AromaticContact CE2-CZ3 3.8Å; F505-W540 HydrophobicContact CE2-CZ3 3.8Å; F505-W540 HydrophobicContact CZ-CD2 4.44Å; F505-W540 AromaticContact CZ-CE3 3.5Å; F505-W540 HydrophobicContact CZ-CE3 3.5Å; F505-W540 AromaticContact CZ-CZ3 3.85Å; F505-W540 HydrophobicContact CZ-CZ3 3.85Å; F519-W540 HydrophobicContact CD1-CE3 4.45Å; F519-W540 AromaticContact CE1-CE3 3.76Å; F519-W540 HydrophobicContact CE1-CE3 3.76Å; F519-W540 HydrophobicContact CE1-CH2 4.22Å; F519-W540 AromaticContact CE1-CZ3 3.49Å; F519-W540 HydrophobicContact CE1-CZ3 3.49Å; F519-W540 VanDerWaalsContact CE1-CZ3 3.49Å; F519-W540 HydrophobicContact CZ-CZ3 4.12Å; M523-W540 HydrophobicContact CE-CD2 3.79Å; M523-W540 HydrophobicContact CE-CE3 4.17Å; M523-W540 HydrophobicContact CE-CG 4.5Å; M523-W540 HydrophobicContact CE-CH2 3.51Å; M523-W540 HydrophobicContact CE-CZ2 3.1Å; M523-W540 HydrophobicContact CE-CZ3 4.05Å; M523-W540 HydrophobicContact CG-CD2 4.43Å; M523-W540 HydrophobicContact CG-CG 4.36Å; M523-W540 WeakPolarHBondContact O-CB 3.28Å; M523-W540 VanDerWaalsContact O-CD1 3.3Å; M523-W540 VanDerWaalsContact O-CG 3.23Å; M523-W540 HydrophobicContact SD-CZ2 4.3Å; S524-W540 WeakPolarHBondContact O-CB 3.42Å; S524-W540 PolarHBondContact O-N 2.92Å; V526-W540 HydrophobicContact CG2-CE3 3.62Å; V526-W540 HydrophobicContact CG2-CZ3 4.21Å
541	K	90.9	Very high	91	Very high	173 Å²	173	55.4 Å²	55.4	75%	0.752	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-48.2	-174.9	-170.9	175.2	-177.9	177.6	0	111.5	K503 D539	K503-K541 PolarHBondContact NZ-O 2.88Å; D539-K541 VanDerWaalsContact C-N 3.28Å; D539-K541 PolarHBondContact O-N 2.86Å; D539-K541 WeakPolarHBondContact OD1-CB 3Å; D539-K541 PolarHBondContact OD1-N 2.93Å
542	T	89.4	Confident	91	Very high	58 Å²	58	54.6 Å²	54.6	36%	0.356	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-12.6	-175	63.5	0	0	0	0	114.2	D539 K544	D539-T542 VanDerWaalsContact CG-OG1 3.32Å; D539-T542 WeakPolarHBondContact OD2-CB 3.38Å; D539-T542 VanDerWaalsContact OD2-CG2 3.23Å; D539-T542 WeakPolarHBondContact OD2-CG2 3.27Å; D539-T542 PolarHBondContact OD2-N 3.11Å; D539-T542 PolarHBondContact OD2-OG1 3.4Å; T542-K544 PolarHBondContact O-N 2.81Å; T542-K544 VanDerWaalsContact O-N 3.09Å
543	T	88.8	Confident	91	Very high	42 Å²	42	57.3 Å²	57.3	26%	0.258	26%	0.262	S	S	.	.			trans	60	9.5	-174.7	62.5	0	0	0	0	115.1	K503 F505 D539	K503-T543 HydrophobicContact CD-CG2 3.46Å; K503-T543 VanDerWaalsContact CD-CG2 3.46Å; F505-T543 HydrophobicContact CD1-CG2 4.49Å; F505-T543 HydrophobicContact CE1-CG2 3.95Å; F505-T543 HydrophobicContact CZ-CG2 4.21Å; D539-T543 VanDerWaalsContact O-CA 3.25Å; D539-T543 WeakPolarHBondContact O-CA 3.31Å; D539-T543 PolarHBondContact O-N 2.92Å
544	K	90.6	Very high	91.1	Very high	147 Å²	147	63.2 Å²	63.2	64%	0.639	29%	0.288	S	S	*	.			trans	-81	144.4	177.2	-66.8	-175.4	178.7	-177.8	0	109.7	W538 D539 T542 Y546	W538-K544 WeakPolarHBondContact CA-O 3.44Å; D539-K544 PolarHBondContact N-O 3.03Å; T542-K544 PolarHBondContact O-N 2.81Å; T542-K544 VanDerWaalsContact O-N 3.09Å; K544-Y546 HydrophobicContact CB-CE2 4.49Å; K544-Y546 PolarHBondContact O-N 3.29Å
545	L	92.8	Very high	91	Very high	60 Å²	60	61 Å²	61	31%	0.314	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	115.5	167.6	-178.4	70.4	0	0	0	107.7	N536 W538 R548	N536-L545 HydrophobicContact CB-CD1 3.7Å; W538-L545 VanDerWaalsContact CD1-CA 3.48Å; W538-L545 HydrophobicContact CD2-CD1 4.1Å; W538-L545 HydrophobicContact CG-CD1 4.24Å; W538-L545 HydrophobicContact CZ2-CD1 4.01Å; L545-R548 VanDerWaalsContact CD2-NH2 3.26Å
546	Y	88.7	Confident	91	Very high	129 Å²	129	61 Å²	61	51%	0.506	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	-47.6	-179.1	-97.6	-107.7	0	0	0	111.6	I537 D539 K544	I537-Y546 PolarHBondContact O-N 2.91Å; D539-Y546 HydrophobicContact CB-CD2 3.2Å; D539-Y546 HydrophobicContact CB-CE2 2.94Å; D539-Y546 HydrophobicContact CB-CG 4.21Å; D539-Y546 WeakPolarHBondContact OD2-CE2 3.27Å; D539-Y546 PolarHBondContact OD2-OH 3.29Å; K544-Y546 HydrophobicContact CB-CE2 4.49Å; K544-Y546 PolarHBondContact O-N 3.29Å
547	H	87	Confident	90.9	Very high	80 Å²	80	61.6 Å²	61.6	37%	0.37	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	147.1	-174	-153.9	38.9	0	0	0	111.9	L278 I537 I549	L278-H547 HydrophobicContact CD2-CB 3.71Å; I537-H547 HydrophobicContact CB-CB 4.48Å; I537-H547 PolarHBondContact N-O 3.06Å; I537-H547 PolarHBondContact O-N 2.94Å; H547-I549 WeakPolarHBondContact CD2-CG1 3.19Å
548	R	91.4	Very high	90.6	Very high	122 Å²	122	61.7 Å²	61.7	46%	0.46	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	108.8	178.3	-179.6	177.5	-69.3	168.1	-1.4	107.5	G507 K534 L535 N536 L545	G507-R548 PolarHBondContact O-NH2 2.8Å; K534-R548 HydrophobicContact CB-CG 4.14Å; K534-R548 HydrophobicContact CD-CG 3.94Å; K534-R548 HydrophobicContact CG-CG 4.5Å; L535-R548 WeakPolarHBondContact O-CA 3.46Å; N536-R548 VanDerWaalsContact OD1-CG 3.28Å; N536-R548 WeakPolarHBondContact OD1-CG 3.07Å; N536-R548 PolarHBondContact OD1-NE 3.13Å; N536-R548 VanDerWaalsContact OD1-NE 3.08Å; L545-R548 VanDerWaalsContact CD2-NH2 3.26Å
549	I	90.7	Very high	90.5	Very high	17 Å²	17	61.7 Å²	61.7	9%	0.087	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.7	-177.6	-54.7	175.1	0	0	0	107.6	P279 K534 L535 I537 H547 A551 W581	P279-I549 HydrophobicContact CG-CD1 4.46Å; P279-I549 WeakPolarHBondContact O-CD1 3.31Å; K534-I549 CarbonylContact C-O 3.48Å; K534-I549 VanDerWaalsContact CA-O 3.26Å; K534-I549 WeakPolarHBondContact CA-O 3.23Å; L535-I549 HydrophobicContact CB-CB 4.32Å; L535-I549 HydrophobicContact CD2-CD1 4.48Å; L535-I549 PolarHBondContact N-O 2.62Å; L535-I549 PolarHBondContact O-N 3.3Å; I537-I549 HydrophobicContact CD1-CD1 4.38Å; H547-I549 WeakPolarHBondContact CD2-CG1 3.19Å; I549-A551 PolarHBondContact O-N 2.87Å; I549-A551 VanDerWaalsContact O-N 3.16Å; I549-W581 HydrophobicContact CG2-CE3 4.04Å; I549-W581 HydrophobicContact CG2-CH2 3.95Å; I549-W581 HydrophobicContact CG2-CZ3 3.62Å
550	K	91.2	Very high	90.4	Very high	140 Å²	140	61.7 Å²	61.7	61%	0.609	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	103.3	169.6	-174.7	174.1	178.4	179.3	0	108.2	D553	K550-D553 IonicContact NZ-OD1 3.23Å
551	A	88.4	Confident	90.5	Very high	2 Å²	2	60.4 Å²	60.4	2%	0.017	28%	0.278	C	S	.	.			trans	-91.6	-48.3	-174	0	0	0	0	0	111.9	G533 L535 I549 K579 W581	G533-A551 PolarHBondContact O-N 3.32Å; L535-A551 HydrophobicContact CB-CB 4.19Å; I549-A551 PolarHBondContact O-N 2.87Å; I549-A551 VanDerWaalsContact O-N 3.16Å; A551-K579 WeakPolarHBondContact O-CD 3.38Å; A551-K579 VanDerWaalsContact O-CE 3.32Å; A551-K579 WeakPolarHBondContact O-CE 3.23Å; A551-K579 PolarHBondContact O-NZ 3.35Å; A551-W581 HydrophobicContact CB-CH2 4.38Å; A551-W581 HydrophobicContact CB-CZ2 3.55Å
552	H	90.4	Very high	90.4	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.242	C	C	.	.			trans	-125.1	158.1	-174.9	-67.6	-86.3	0	0	0	111.1	G533 K554 T571 D575 Q577	G533-H552 PolarHBondContact O-N 3.02Å; H552-K554 VanDerWaalsContact CB-O 3.27Å; H552-K554 WeakPolarHBondContact CB-O 3.33Å; H552-T571 PolarHBondContact NE2-O 2.84Å; H552-T571 PolarHBondContact NE2-OG1 2.71Å; H552-D575 WeakPolarHBondContact CB-OD2 3.08Å; H552-D575 IonicContact CE1-OD1 2.78Å; H552-D575 IonicContact CE1-OD2 3.32Å; H552-D575 IonicContact CG-OD1 3.1Å; H552-D575 IonicContact CG-OD2 2.75Å; H552-D575 VanDerWaalsContact ND1-CG 3.29Å; H552-D575 IonicContact ND1-OD1 2.75Å; H552-D575 PolarHBondContact ND1-OD1 2.57Å; H552-D575 VanDerWaalsContact ND1-OD1 3.1Å; H552-D575 IonicContact ND1-OD2 3.35Å; H552-D575 PolarHBondContact ND1-OD2 3.47Å; H552-Q577 PolarHBondContact CE1-O 3.2Å; H552-Q577 VanDerWaalsContact CE1-O 3.23Å
553	D	88.8	Confident	90.3	Very high	128 Å²	128	51.7 Å²	51.7	68%	0.684	24%	0.24	S	C	*	.	S	Bend	trans	-82.1	-21.9	175.3	-69.6	-33	0	0	0	112.3	K550	K550-D553 IonicContact NZ-OD1 3.23Å
554	K	90.6	Very high	90.1	Very high	123 Å²	123	50.6 Å²	50.6	54%	0.535	23%	0.232	S	C	.	.	S	Bend	trans	-112.5	177.8	171	-62.4	-174.7	-175.2	174.2	0	110	G533 H552 C556 W574 D575	G533-K554 WeakPolarHBondContact CA-O 3.28Å; H552-K554 VanDerWaalsContact CB-O 3.27Å; H552-K554 WeakPolarHBondContact CB-O 3.33Å; K554-C556 PolarHBondContact O-N 2.85Å; K554-W574 HydrophobicContact CB-CB 4.04Å; K554-W574 HydrophobicContact CD-CB 4.23Å; K554-D575 HydrophobicContact CB-CB 4.36Å; K554-D575 HydrophobicContact CD-CB 4.45Å; K554-D575 HydrophobicContact CG-CB 4.38Å
555	V	91.3	Very high	89.8	Confident	11 Å²	11	44.6 Å²	44.6	7%	0.067	21%	0.206	C	C	.	.			trans	-43.7	128.6	175.3	-178.6	0	0	0	0	111.6	Y513 A531 G573 W574	Y513-V555 HydrophobicContact CD1-CG1 3.82Å; Y513-V555 HydrophobicContact CD1-CG2 4.14Å; Y513-V555 HydrophobicContact CD2-CG1 4.37Å; Y513-V555 HydrophobicContact CD2-CG2 4.49Å; Y513-V555 HydrophobicContact CE1-CB 4.42Å; Y513-V555 HydrophobicContact CE1-CG1 4.2Å; Y513-V555 HydrophobicContact CE1-CG2 3.64Å; Y513-V555 HydrophobicContact CE2-CG2 4.03Å; Y513-V555 HydrophobicContact CG-CG1 3.91Å; A531-V555 WeakPolarHBondContact O-CA 3.23Å; A531-V555 VanDerWaalsContact O-CG2 3.25Å; A531-V555 WeakPolarHBondContact O-CG2 3.14Å; V555-G573 CarbonylContact O-C 3.48Å; V555-G573 WeakPolarHBondContact O-CA 3.27Å; V555-W574 HydrophobicContact CB-CD2 4.44Å; V555-W574 HydrophobicContact CB-CG 4.4Å; V555-W574 PolarHBondContact O-N 3.47Å
556	C	92.8	Very high	89.5	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	108.2	173	-178	0	0	0	0	108	C515 G529 D530 K554 C572	C515-C556 PolarHBondContact SG-O 2.81Å; G529-C556 CarbonylContact C-O 3.59Å; G529-C556 WeakPolarHBondContact CA-O 3.02Å; D530-C556 PolarHBondContact O-N 2.86Å; K554-C556 PolarHBondContact O-N 2.85Å; C556-C572 CarbonylContact C-O 3.54Å; C556-C572 WeakPolarHBondContact CA-O 3.37Å
557	I	90.4	Very high	89.5	Confident	12 Å²	12	38.5 Å²	38.5	6%	0.062	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-62.3	-178.1	-48.5	-177.3	0	0	0	110.4	V293 A514 C515 Q516 C572	V293-I557 WeakPolarHBondContact O-CD1 3.4Å; A514-I557 WeakPolarHBondContact O-CG2 3.4Å; C515-I557 CarbonylContact C-O 3.57Å; C515-I557 VanDerWaalsContact C-O 3.29Å; C515-I557 WeakPolarHBondContact CA-O 3.33Å; C515-I557 WeakPolarHBondContact CB-O 3.31Å; Q516-I557 PolarHBondContact N-O 3.42Å; I557-C572 PolarHBondContact N-O 3.08Å
558	S	89.3	Confident	89.7	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.014	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135.2	-170.7	-169.4	0	0	0	0	109.7	Q516 T571 C572	Q516-S558 PolarHBondContact OE1-OG 2.84Å; S558-T571 CarbonylContact O-C 3.56Å; S558-T571 VanDerWaalsContact O-CA 3.28Å; S558-T571 WeakPolarHBondContact O-CA 3.35Å; S558-C572 WeakPolarHBondContact CB-SG 3.31Å; S558-C572 PolarHBondContact N-O 2.89Å; S558-C572 PolarHBondContact N-SG 2.84Å; S558-C572 PolarHBondContact O-N 2.89Å
559	A	92.1	Very high	89.7	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	126.1	165.5	0	0	0	0	0	107.2	D518 V527 L535 I570 T571	D518-A559 WeakPolarHBondContact CB-O 3.38Å; V527-A559 HydrophobicContact CG1-CB 3.66Å; L535-A559 HydrophobicContact CD1-CB 3.47Å; L535-A559 VanDerWaalsContact CD1-CB 3.47Å; A559-I570 WeakPolarHBondContact CA-O 3.12Å; A559-T571 HydrophobicContact CB-CG2 4.32Å
560	L	92.5	Very high	89.9	Confident	18 Å²	18	29.2 Å²	29.2	9%	0.094	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	126.9	-175.2	-151.2	169	0	0	0	108.4	I296 L298 D518 I570	I296-L560 HydrophobicContact CG2-CD1 4.24Å; L298-L560 HydrophobicContact CB-CD1 4.48Å; L298-L560 HydrophobicContact CB-CD2 4.43Å; L298-L560 HydrophobicContact CD1-CD2 3.51Å; L298-L560 HydrophobicContact CG-CD1 4.15Å; L298-L560 HydrophobicContact CG-CD2 3.86Å; D518-L560 WeakPolarHBondContact OD2-CA 3.47Å; D518-L560 WeakPolarHBondContact OD2-CD2 3.47Å; L560-I570 PolarHBondContact N-O 3.02Å; L560-I570 PolarHBondContact O-N 2.84Å
561	W	92.1	Very high	90	Very high	4 Å²	4	22.5 Å²	22.5	2%	0.015	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	137.1	176.8	-156.8	-67.9	0	0	0	109.8	C276 Y277 D518 F519 Y525 V527 E565 T566 V569	C276-W561 HydrophobicContact CB-CZ2 3.96Å; Y277-W561 VanDerWaalsContact O-CH2 3.31Å; Y277-W561 WeakPolarHBondContact O-CH2 3.38Å; Y277-W561 WeakPolarHBondContact O-CZ2 3.31Å; D518-W561 PolarHBondContact OD2-N 2.96Å; F519-W561 WeakPolarHBondContact O-CB 3.44Å; Y525-W561 HydrophobicContact CD2-CH2 4.01Å; V527-W561 HydrophobicContact CG2-CE3 3.38Å; V527-W561 HydrophobicContact CG2-CZ3 3.39Å; W561-E565 PolarHBondContact NE1-O 3.32Å; W561-T566 VanDerWaalsContact CZ2-O 3.29Å; W561-T566 WeakPolarHBondContact CZ2-O 3.45Å; W561-V569 HydrophobicContact CD2-CG2 3.67Å; W561-V569 HydrophobicContact CE3-CG2 3.46Å; W561-V569 VanDerWaalsContact CE3-CG2 3.46Å; W561-V569 HydrophobicContact CG-CG2 4.28Å; W561-V569 HydrophobicContact CH2-CG2 4.15Å; W561-V569 HydrophobicContact CZ2-CG2 4.34Å; W561-V569 HydrophobicContact CZ3-CG2 3.72Å
562	H	90	Very high	90.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.117	C	C	.	.			trans	-68.1	125.6	178	-167.8	-86.5	0	0	0	111.1	G303 Y321 P521 H564 E565 K568	G303-H562 PolarHBondContact O-NE2 3.38Å; Y321-H562 AromaticContact CE2-NE2 3.9Å; Y321-H562 AromaticContact CZ-NE2 3.93Å; Y321-H562 PolarHBondContact OH-CE1 3.33Å; Y321-H562 PolarHBondContact OH-ND1 3.13Å; Y321-H562 PolarHBondContact OH-NE2 3.06Å; Y321-H562 VanDerWaalsContact OH-NE2 3.14Å; P521-H562 WeakPolarHBondContact CG-O 3.32Å; H562-H564 VanDerWaalsContact C-N 3.26Å; H562-H564 PolarHBondContact ND1-N 3.45Å; H562-H564 PolarHBondContact O-N 2.55Å; H562-H564 VanDerWaalsContact O-N 3.15Å; H562-E565 HydrophobicContact CB-CB 4.13Å; H562-E565 IonicContact CG-OE2 2.74Å; H562-E565 PolarHBondContact ND1-N 2.86Å; H562-E565 IonicContact ND1-OE2 2.83Å; H562-E565 PolarHBondContact O-N 2.84Å; H562-K568 HydrophobicContact CB-CB 4Å; H562-K568 WeakPolarHBondContact CB-O 3.36Å; H562-K568 PolarHBondContact N-O 3.44Å
563	P	86.1	Confident	90.3	Very high	49 Å²	49	22.4 Å²	22.4	32%	0.318	12%	0.117	S	C	.	.	S	Bend	trans	-62.1	-30.7	-170.5	22.3	-33.5	0	0	0	114.1	P521	P521-P563 WeakPolarHBondContact CB-O 3.18Å; P521-P563 WeakPolarHBondContact CG-O 3.25Å
564	H	84.9	Confident	90.4	Very high	19 Å²	19	20.7 Å²	20.7	9%	0.088	10%	0.101	C	C	.	.	S	Bend	trans	-102	-20.1	-176.5	-63.2	-52.2	0	0	0	114.7	V265 L267 S269 R301 S302 H562	V265-H564 HydrophobicContact CG1-CB 4.22Å; L267-H564 HydrophobicContact CD2-CB 4.1Å; L267-H564 PolarHBondContact O-NE2 3.06Å; S269-H564 PolarHBondContact O-CE1 2.99Å; R301-H564 PolarHBondContact O-CE1 3.28Å; R301-H564 PolarHBondContact O-NE2 3.34Å; S302-H564 PolarHBondContact O-CD2 3.25Å; H562-H564 VanDerWaalsContact C-N 3.26Å; H562-H564 PolarHBondContact ND1-N 3.45Å; H562-H564 PolarHBondContact O-N 2.55Å; H562-H564 VanDerWaalsContact O-N 3.15Å
565	E	84.8	Confident	90.4	Very high	20 Å²	20	16.6 Å²	16.6	9%	0.093	9%	0.085	C	C	.	.			trans	-105.9	141.6	-171.9	-74.1	-175.6	137.3	0	0	110.9	V265 Y321 W561 H562 S567 K568	V265-E565 HydrophobicContact CG2-CG 4.32Å; Y321-E565 WeakPolarHBondContact CE1-OE1 3.24Å; Y321-E565 PolarHBondContact OH-OE1 2.99Å; Y321-E565 PolarHBondContact OH-OE2 3.4Å; W561-E565 PolarHBondContact NE1-O 3.32Å; H562-E565 HydrophobicContact CB-CB 4.13Å; H562-E565 IonicContact CG-OE2 2.74Å; H562-E565 PolarHBondContact ND1-N 2.86Å; H562-E565 IonicContact ND1-OE2 2.83Å; H562-E565 PolarHBondContact O-N 2.84Å; E565-S567 PolarHBondContact O-N 3.22Å; E565-K568 HydrophobicContact CB-CB 4.27Å; E565-K568 HydrophobicContact CB-CG 4.25Å; E565-K568 WeakPolarHBondContact OE1-CE 3.02Å; E565-K568 IonicContact OE1-NZ 2.74Å; E565-K568 PolarHBondContact OE1-NZ 2.71Å; E565-K568 WeakPolarHBondContact OE2-CD 3.49Å; E565-K568 WeakPolarHBondContact OE2-CE 3.4Å; E565-K568 WeakPolarHBondContact OE2-CG 3.48Å; E565-K568 IonicContact OE2-NZ 3.41Å; E565-K568 PolarHBondContact OE2-NZ 3.09Å
566	T	86.1	Confident	90.2	Very high	53 Å²	53	16.2 Å²	16.2	33%	0.325	8%	0.083	S	C	.	.	S	Bend	trans	-75.3	-27.3	-166.2	59.4	0	0	0	0	113.6	P273 K275 C276 Y277 W561	P273-T566 HydrophobicContact CB-CG2 3.56Å; P273-T566 HydrophobicContact CG-CG2 4.16Å; K275-T566 WeakPolarHBondContact O-CB 3.21Å; K275-T566 VanDerWaalsContact O-CG2 3.25Å; K275-T566 WeakPolarHBondContact O-CG2 3.36Å; C276-T566 CarbonylContact C-O 3.59Å; C276-T566 WeakPolarHBondContact CA-O 3.39Å; C276-T566 VanDerWaalsContact CB-O 3.29Å; C276-T566 WeakPolarHBondContact CB-O 3.45Å; Y277-T566 PolarHBondContact N-O 3.44Å; W561-T566 VanDerWaalsContact CZ2-O 3.29Å; W561-T566 WeakPolarHBondContact CZ2-O 3.45Å
567	S	88.8	Confident	90.2	Very high	9 Å²	9	19 Å²	19	6%	0.063	10%	0.097	C	C	.	.	S	Bend	trans	-126.7	-11.5	-171.6	-164.6	0	0	0	0	113.7	Y277 L278 P279 E565 V569 D582	Y277-S567 WeakPolarHBondContact O-CA 3.03Å; Y277-S567 PolarHBondContact O-OG 3.47Å; L278-S567 PolarHBondContact O-OG 3.44Å; P279-S567 WeakPolarHBondContact CB-O 3.43Å; E565-S567 PolarHBondContact O-N 3.22Å; S567-V569 PolarHBondContact O-N 2.82Å; S567-D582 VanDerWaalsContact CB-OD1 3.28Å; S567-D582 WeakPolarHBondContact CB-OD1 3.25Å; S567-D582 WeakPolarHBondContact CB-OXT 3.48Å; S567-D582 PolarHBondContact OG-OXT 3.19Å
568	K	90.5	Very high	90.4	Very high	22 Å²	22	18.5 Å²	18.5	10%	0.096	9%	0.094	C	C	.	.			trans	-77.2	121.7	-173.9	-62	-153.8	-163	137.9	0	113	H562 E565 L580 W581 D582	H562-K568 HydrophobicContact CB-CB 4Å; H562-K568 WeakPolarHBondContact CB-O 3.36Å; H562-K568 PolarHBondContact N-O 3.44Å; E565-K568 HydrophobicContact CB-CB 4.27Å; E565-K568 HydrophobicContact CB-CG 4.25Å; E565-K568 WeakPolarHBondContact OE1-CE 3.02Å; E565-K568 IonicContact OE1-NZ 2.74Å; E565-K568 PolarHBondContact OE1-NZ 2.71Å; E565-K568 WeakPolarHBondContact OE2-CD 3.49Å; E565-K568 WeakPolarHBondContact OE2-CE 3.4Å; E565-K568 WeakPolarHBondContact OE2-CG 3.48Å; E565-K568 IonicContact OE2-NZ 3.41Å; E565-K568 PolarHBondContact OE2-NZ 3.09Å; K568-L580 HydrophobicContact CD-CD1 4.29Å; K568-L580 HydrophobicContact CD-CD2 4.06Å; K568-W581 CarbonylContact C-O 3.56Å; K568-W581 VanDerWaalsContact CA-O 3.22Å; K568-W581 WeakPolarHBondContact CA-O 3.21Å; K568-D582 HydrophobicContact CG-CB 4.17Å; K568-D582 WeakPolarHBondContact CG-OD1 3.34Å
569	V	93	Very high	90.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	135.9	174.6	-179.4	0	0	0	0	109.4	P279 V527 L535 W561 S567 T571 W581	P279-V569 HydrophobicContact CG-CB 4.14Å; P279-V569 HydrophobicContact CG-CG2 3.83Å; V527-V569 HydrophobicContact CG1-CG1 4.29Å; L535-V569 HydrophobicContact CD2-CG1 4.05Å; W561-V569 HydrophobicContact CD2-CG2 3.67Å; W561-V569 HydrophobicContact CE3-CG2 3.46Å; W561-V569 VanDerWaalsContact CE3-CG2 3.46Å; W561-V569 HydrophobicContact CG-CG2 4.28Å; W561-V569 HydrophobicContact CH2-CG2 4.15Å; W561-V569 HydrophobicContact CZ2-CG2 4.34Å; W561-V569 HydrophobicContact CZ3-CG2 3.72Å; S567-V569 PolarHBondContact O-N 2.82Å; V569-T571 HydrophobicContact CG1-CG2 4.22Å; V569-W581 HydrophobicContact CB-CB 4.49Å; V569-W581 PolarHBondContact N-O 2.99Å; V569-W581 PolarHBondContact O-N 3.44Å
570	I	93.9	Very high	90.7	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.005	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	127.6	178.6	-58.5	168.2	0	0	0	108.8	W286 I296 L298 L306 V320 A559 L560 I578 K579 L580	W286-I570 HydrophobicContact CH2-CD1 4.36Å; W286-I570 HydrophobicContact CZ3-CG2 3.91Å; I296-I570 HydrophobicContact CD1-CG2 4.26Å; L298-I570 HydrophobicContact CD2-CD1 3.79Å; L306-I570 HydrophobicContact CD1-CB 4.41Å; L306-I570 HydrophobicContact CD1-CD1 3.74Å; L306-I570 HydrophobicContact CD1-CG2 3.55Å; V320-I570 HydrophobicContact CG1-CD1 4.46Å; V320-I570 HydrophobicContact CG2-CD1 4.45Å; A559-I570 WeakPolarHBondContact CA-O 3.12Å; L560-I570 PolarHBondContact N-O 3.02Å; L560-I570 PolarHBondContact O-N 2.84Å; I570-I578 HydrophobicContact CG2-CG2 3.57Å; I570-K579 WeakPolarHBondContact CA-O 3.07Å; I570-L580 HydrophobicContact CD1-CD1 4.35Å; I570-L580 HydrophobicContact CG1-CD1 4.08Å; I570-L580 HydrophobicContact CG1-CG 4.29Å
571	T	94.1	Very high	90.6	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	146.9	-179.6	64.7	0	0	0	0	111.4	L535 H552 S558 A559 V569 I578 K579 W581	L535-T571 HydrophobicContact CD1-CG2 3.63Å; L535-T571 HydrophobicContact CD2-CG2 3.91Å; L535-T571 HydrophobicContact CG-CG2 4.26Å; H552-T571 PolarHBondContact NE2-O 2.84Å; H552-T571 PolarHBondContact NE2-OG1 2.71Å; S558-T571 CarbonylContact O-C 3.56Å; S558-T571 VanDerWaalsContact O-CA 3.28Å; S558-T571 WeakPolarHBondContact O-CA 3.35Å; A559-T571 HydrophobicContact CB-CG2 4.32Å; V569-T571 HydrophobicContact CG1-CG2 4.22Å; T571-I578 CarbonylContact O-C 3.48Å; T571-I578 WeakPolarHBondContact O-CA 3.46Å; T571-I578 WeakPolarHBondContact O-CG2 3.47Å; T571-K579 PolarHBondContact N-O 3.13Å; T571-K579 PolarHBondContact O-N 3.44Å; T571-W581 PolarHBondContact OG1-NE1 3.29Å
572	C	92.9	Very high	90.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	148	167	67.3	0	0	0	0	113.7	V293 I296 C556 I557 S558 I578	V293-C572 HydrophobicContact CB-CB 3.9Å; V293-C572 HydrophobicContact CG1-CB 3.69Å; I296-C572 HydrophobicContact CD1-CB 3.39Å; I296-C572 HydrophobicContact CG1-CB 3.96Å; C556-C572 CarbonylContact C-O 3.54Å; C556-C572 WeakPolarHBondContact CA-O 3.37Å; I557-C572 PolarHBondContact N-O 3.08Å; S558-C572 WeakPolarHBondContact CB-SG 3.31Å; S558-C572 PolarHBondContact N-O 2.89Å; S558-C572 PolarHBondContact N-SG 2.84Å; S558-C572 PolarHBondContact O-N 2.89Å; C572-I578 HydrophobicContact CB-CG1 4.37Å
573	G	91.8	Very high	90.4	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	171.9	177.6	0	0	0	0	0	114.8	V293 V555 D575 G576 Q577	V293-G573 PolarHBondContact N-O 3.35Å; V293-G573 VanDerWaalsContact N-O 3.15Å; V555-G573 CarbonylContact O-C 3.48Å; V555-G573 WeakPolarHBondContact O-CA 3.27Å; G573-D575 WeakPolarHBondContact CA-OD1 3.19Å; G573-D575 PolarHBondContact O-N 2.64Å; G573-G576 PolarHBondContact O-N 2.92Å; G573-Q577 PolarHBondContact N-O 3.18Å
574	W	90.7	Very high	90.7	Very high	91 Å²	91	22.4 Å²	22.4	35%	0.345	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-5	170.4	-77	15	0	0	0	113.4	G292 M311 Y513 K554 V555 G576	G292-W574 WeakPolarHBondContact CA-O 3.13Å; M311-W574 HydrophobicContact CE-CD2 4.36Å; M311-W574 HydrophobicContact CE-CZ2 3.94Å; Y513-W574 AromaticContact CD1-CH2 3.96Å; Y513-W574 HydrophobicContact CD1-CH2 3.96Å; Y513-W574 AromaticContact CD1-CZ2 4Å; Y513-W574 HydrophobicContact CD1-CZ2 4Å; Y513-W574 HydrophobicContact CE1-CE3 4.41Å; Y513-W574 AromaticContact CE1-CH2 3.53Å; Y513-W574 HydrophobicContact CE1-CH2 3.53Å; Y513-W574 HydrophobicContact CE1-CZ2 4.01Å; Y513-W574 AromaticContact CE1-CZ3 3.75Å; Y513-W574 HydrophobicContact CE1-CZ3 3.75Å; K554-W574 HydrophobicContact CB-CB 4.04Å; K554-W574 HydrophobicContact CD-CB 4.23Å; V555-W574 HydrophobicContact CB-CD2 4.44Å; V555-W574 HydrophobicContact CB-CG 4.4Å; V555-W574 PolarHBondContact O-N 3.47Å; W574-G576 PolarHBondContact O-N 2.84Å
575	D	90	Very high	91	Very high	37 Å²	37	22.6 Å²	22.6	20%	0.198	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-9.7	169.3	60.6	-3.2	0	0	0	112.7	H552 K554 G573 Q577	H552-D575 WeakPolarHBondContact CB-OD2 3.08Å; H552-D575 IonicContact CE1-OD1 2.78Å; H552-D575 IonicContact CE1-OD2 3.32Å; H552-D575 IonicContact CG-OD1 3.1Å; H552-D575 IonicContact CG-OD2 2.75Å; H552-D575 VanDerWaalsContact ND1-CG 3.29Å; H552-D575 IonicContact ND1-OD1 2.75Å; H552-D575 PolarHBondContact ND1-OD1 2.57Å; H552-D575 VanDerWaalsContact ND1-OD1 3.1Å; H552-D575 IonicContact ND1-OD2 3.35Å; H552-D575 PolarHBondContact ND1-OD2 3.47Å; K554-D575 HydrophobicContact CB-CB 4.36Å; K554-D575 HydrophobicContact CD-CB 4.45Å; K554-D575 HydrophobicContact CG-CB 4.38Å; G573-D575 WeakPolarHBondContact CA-OD1 3.19Å; G573-D575 PolarHBondContact O-N 2.64Å; D575-Q577 VanDerWaalsContact C-N 3.26Å; D575-Q577 PolarHBondContact OD1-N 3.06Å; D575-Q577 VanDerWaalsContact OD1-N 3.1Å
576	G	88.6	Confident	91.3	Very high	3 Å²	3	22.8 Å²	22.8	3%	0.031	11%	0.111	C	C	.	.	S	Bend	trans	81.7	7.5	179.9	0	0	0	0	0	113.1	K291 G573 W574	K291-G576 VanDerWaalsContact O-CA 3.31Å; K291-G576 WeakPolarHBondContact O-CA 3.46Å; G573-G576 PolarHBondContact O-N 2.92Å; W574-G576 PolarHBondContact O-N 2.84Å
577	Q	92.4	Very high	91.7	Very high	60 Å²	60	20.9 Å²	20.9	28%	0.28	10%	0.098	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	147.6	178.6	-61.6	-175.7	-1.9	0	0	110.4	V285 H552 G573 D575	V285-Q577 HydrophobicContact CG1-CB 4.29Å; V285-Q577 HydrophobicContact CG1-CG 4.26Å; H552-Q577 PolarHBondContact CE1-O 3.2Å; H552-Q577 VanDerWaalsContact CE1-O 3.23Å; G573-Q577 PolarHBondContact N-O 3.18Å; D575-Q577 VanDerWaalsContact C-N 3.26Å; D575-Q577 PolarHBondContact OD1-N 3.06Å; D575-Q577 VanDerWaalsContact OD1-N 3.1Å
578	I	93.8	Very high	91.9	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129	166.7	-47.6	171.5	0	0	0	106.5	V285 W286 V293 I296 L306 I570 T571 C572	V285-I578 WeakPolarHBondContact CA-O 3.36Å; W286-I578 HydrophobicContact CB-CB 4.14Å; W286-I578 HydrophobicContact CD2-CB 4.47Å; W286-I578 HydrophobicContact CD2-CG2 4.49Å; W286-I578 HydrophobicContact CE3-CB 3.69Å; W286-I578 HydrophobicContact CE3-CG2 3.42Å; W286-I578 VanDerWaalsContact CE3-CG2 3.42Å; W286-I578 HydrophobicContact CZ3-CB 4.5Å; W286-I578 HydrophobicContact CZ3-CG2 3.74Å; W286-I578 PolarHBondContact N-O 3.02Å; W286-I578 PolarHBondContact O-N 3.25Å; V293-I578 HydrophobicContact CG1-CG1 4.46Å; V293-I578 HydrophobicContact CG2-CD1 4.45Å; V293-I578 HydrophobicContact CG2-CG1 4.04Å; I296-I578 HydrophobicContact CD1-CB 4.18Å; I296-I578 HydrophobicContact CD1-CD1 3.87Å; I296-I578 HydrophobicContact CD1-CG1 3.88Å; I296-I578 HydrophobicContact CD1-CG2 3.33Å; I296-I578 HydrophobicContact CG1-CD1 4.48Å; L306-I578 HydrophobicContact CD1-CG2 4.44Å; L306-I578 HydrophobicContact CD2-CD1 3.99Å; I570-I578 HydrophobicContact CG2-CG2 3.57Å; T571-I578 CarbonylContact O-C 3.48Å; T571-I578 WeakPolarHBondContact O-CA 3.46Å; T571-I578 WeakPolarHBondContact O-CG2 3.47Å; C572-I578 HydrophobicContact CB-CG1 4.37Å
579	K	93.7	Very high	92	Very high	21 Å²	21	21.6 Å²	21.6	9%	0.091	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	136	-176	-63.6	-179.4	178.1	-169.6	0	109.6	Q282 H284 V285 A551 I570 T571 W581	Q282-K579 HydrophobicContact CG-CB 4.36Å; H284-K579 WeakPolarHBondContact O-CA 3.45Å; V285-K579 HydrophobicContact CG2-CG 4.46Å; A551-K579 WeakPolarHBondContact O-CD 3.38Å; A551-K579 VanDerWaalsContact O-CE 3.32Å; A551-K579 WeakPolarHBondContact O-CE 3.23Å; A551-K579 PolarHBondContact O-NZ 3.35Å; I570-K579 WeakPolarHBondContact CA-O 3.07Å; T571-K579 PolarHBondContact N-O 3.13Å; T571-K579 PolarHBondContact O-N 3.44Å; K579-W581 HydrophobicContact CB-CZ2 4.17Å; K579-W581 HydrophobicContact CD-CZ2 3.94Å
580	L	93.3	Very high	91.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	129.9	172.8	-176.3	146.7	0	0	0	109.2	I283 H284 W286 V320 K568 I570	I283-L580 HydrophobicContact CB-CD2 3.78Å; I283-L580 HydrophobicContact CD1-CD2 3.63Å; I283-L580 HydrophobicContact CG1-CD2 3.83Å; I283-L580 PolarHBondContact N-O 2.76Å; H284-L580 HydrophobicContact CB-CB 4.31Å; H284-L580 PolarHBondContact N-O 3.38Å; H284-L580 PolarHBondContact O-N 2.72Å; W286-L580 HydrophobicContact CH2-CB 3.84Å; W286-L580 HydrophobicContact CH2-CD1 3.69Å; W286-L580 HydrophobicContact CH2-CG 4.4Å; W286-L580 HydrophobicContact CZ2-CD1 4.46Å; W286-L580 HydrophobicContact CZ3-CB 3.78Å; W286-L580 HydrophobicContact CZ3-CD1 4.43Å; V320-L580 HydrophobicContact CG1-CD1 4.16Å; K568-L580 HydrophobicContact CD-CD1 4.29Å; K568-L580 HydrophobicContact CD-CD2 4.06Å; I570-L580 HydrophobicContact CD1-CD1 4.35Å; I570-L580 HydrophobicContact CG1-CD1 4.08Å; I570-L580 HydrophobicContact CG1-CG 4.29Å
581	W	91.4	Very high	91.7	Very high	15 Å²	15	25.2 Å²	25.2	6%	0.057	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	144.2	-178.4	-54.9	88	0	0	0	109.9	P279 K281 Q282 I549 A551 K568 V569 T571 K579	P279-W581 HydrophobicContact CB-CB 3.62Å; P279-W581 HydrophobicContact CG-CB 4.01Å; K281-W581 CarbonylContact O-C 3.57Å; K281-W581 WeakPolarHBondContact O-CA 3.39Å; Q282-W581 HydrophobicContact CB-CD2 4.36Å; Q282-W581 HydrophobicContact CB-CE3 3.81Å; Q282-W581 HydrophobicContact CB-CH2 3.9Å; Q282-W581 HydrophobicContact CB-CZ2 4.42Å; Q282-W581 HydrophobicContact CB-CZ3 3.58Å; Q282-W581 HydrophobicContact CG-CD2 4.36Å; Q282-W581 HydrophobicContact CG-CE3 4.28Å; Q282-W581 HydrophobicContact CG-CH2 4.05Å; Q282-W581 HydrophobicContact CG-CZ2 4.1Å; Q282-W581 HydrophobicContact CG-CZ3 4.15Å; I549-W581 HydrophobicContact CG2-CE3 4.04Å; I549-W581 HydrophobicContact CG2-CH2 3.95Å; I549-W581 HydrophobicContact CG2-CZ3 3.62Å; A551-W581 HydrophobicContact CB-CH2 4.38Å; A551-W581 HydrophobicContact CB-CZ2 3.55Å; K568-W581 CarbonylContact C-O 3.56Å; K568-W581 VanDerWaalsContact CA-O 3.22Å; K568-W581 WeakPolarHBondContact CA-O 3.21Å; V569-W581 HydrophobicContact CB-CB 4.49Å; V569-W581 PolarHBondContact N-O 2.99Å; V569-W581 PolarHBondContact O-N 3.44Å; T571-W581 PolarHBondContact OG1-NE1 3.29Å; K579-W581 HydrophobicContact CB-CZ2 4.17Å; K579-W581 HydrophobicContact CD-CZ2 3.94Å
582	D	87.7	Confident	91.5	Very high	75 Å²	75	27.5 Å²	27.5	40%	0.401	13%	0.128	S	C	.	.			trans	-148.3	0	177	-165.5	29.9	0	0	0	112.4	P279 K280 K281 I283 S567 K568	P279-D582 VanDerWaalsContact CA-C 3.41Å; P279-D582 WeakPolarHBondContact CA-OXT 3.46Å; K280-D582 PolarHBondContact N-O 3.05Å; K281-D582 PolarHBondContact N-O 3.09Å; K281-D582 PolarHBondContact O-N 3.08Å; I283-D582 HydrophobicContact CD1-CB 3.22Å; I283-D582 WeakPolarHBondContact CD1-OD2 3.41Å; I283-D582 HydrophobicContact CG1-CB 3.76Å; S567-D582 VanDerWaalsContact CB-OD1 3.28Å; S567-D582 WeakPolarHBondContact CB-OD1 3.25Å; S567-D582 WeakPolarHBondContact CB-OXT 3.48Å; S567-D582 PolarHBondContact OG-OXT 3.19Å; K568-D582 HydrophobicContact CG-CB 4.17Å; K568-D582 WeakPolarHBondContact CG-OD1 3.34Å

Retrieved 582 of 582 residues in 311.5 ms (Link to these results)

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