A0A096N0H7_PAPAN Loading...

Pre-mRNA-processing factor 17

AlphaFold DB (A0A2K5NA18), UniProt , Accession A0A096N0H7, Species PAPAN (Papio anubis, Olive baboon), Gene CDC40, Length 579 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	32.1	Very low	30	Very low	239 Å²	239	118.5 Å²	118.5	100%	1.177	79%	0.79	S	S	*	*				0	119.9	0	-62.3	-173.1	-74.8	0	0	105.8
2	S	28.3	Very low	29.8	Very low	119 Å²	119	127.7 Å²	127.7	83%	0.832	80%	0.799	S	S	*	*			cis	-145.7	157.3	14.6	-49.4	0	0	0	0	110.2
3	A	31.1	Very low	29.7	Very low	98 Å²	98	122.2 Å²	122.2	81%	0.81	78%	0.783	S	S	*	*			trans	-73.3	171.5	174.3	0	0	0	0	0	111
4	A	32.6	Very low	29.8	Very low	82 Å²	82	123.2 Å²	123.2	68%	0.678	80%	0.795	S	S	*	*			cis	177.6	-177.9	42.8	0	0	0	0	0	112.2
5	I	32.2	Very low	29.7	Very low	160 Å²	160	119.9 Å²	119.9	82%	0.821	79%	0.792	S	S	*	*			trans	98.6	112.4	150	-63.9	153.5	0	0	0	119.8
6	A	29.6	Very low	29.8	Very low	83 Å²	83	119.9 Å²	119.9	69%	0.686	80%	0.796	S	S	*	*			trans	46.1	133.7	138.2	0	0	0	0	0	121.5
7	A	29.4	Very low	29.8	Very low	89 Å²	89	117.4 Å²	117.4	74%	0.736	80%	0.795	S	S	*	*				62.2	134.1	54.6	0	0	0	0	0	111.9
8	L	28.1	Very low	29.8	Very low	168 Å²	168	116.4 Å²	116.4	88%	0.88	79%	0.79	S	S	*	*			cis	-162.2	166.1	12.4	-101.2	150.8	0	0	0	106.4
9	A	28.3	Very low	29.9	Very low	81 Å²	81	119.8 Å²	119.8	67%	0.669	79%	0.793	S	S	*	*			cis	-165.4	-177	-0.9	0	0	0	0	0	110
10	A	29.4	Very low	29.8	Very low	94 Å²	94	118.9 Å²	118.9	78%	0.777	79%	0.788	S	S	*	*			trans	72.1	146.7	151.3	0	0	0	0	0	119.1
11	S	28.5	Very low	29.7	Very low	90 Å²	90	120.4 Å²	120.4	63%	0.629	79%	0.789	S	S	*	*			cis	-172.5	167.9	-12.1	47.2	0	0	0	0	111.4
12	Y	28.2	Very low	29.4	Very low	229 Å²	229	113.3 Å²	113.3	90%	0.898	76%	0.763	S	S	*	*			trans	64.4	140.7	169.9	-66.1	-85.8	0	0	0	118.4
13	G	28.8	Very low	29.4	Very low	57 Å²	57	114.5 Å²	114.5	59%	0.588	76%	0.76	S	S	*	*			cis	137.1	140.9	-7.9	0	0	0	0	0	114
14	S	30.3	Very low	29.2	Very low	136 Å²	136	115.6 Å²	115.6	95%	0.951	76%	0.762	S	S	*	*			trans	60.3	156.5	176.3	65.6	0	0	0	0	115.7
15	G	28.6	Very low	29	Very low	73 Å²	73	119.1 Å²	119.1	75%	0.753	76%	0.764	S	S	*	*			cis	179.5	-173.4	3.1	0	0	0	0	0	106.2
16	S	31	Very low	29	Very low	121 Å²	121	116.9 Å²	116.9	85%	0.846	76%	0.763	S	S	*	*			cis	-177.1	139.4	-1.3	49.2	0	0	0	0	109.1
17	G	29.6	Very low	29	Very low	76 Å²	76	117.6 Å²	117.6	78%	0.784	76%	0.763	S	S	*	*			trans	73.1	167.8	150.8	0	0	0	0	0	119.8
18	S	30.6	Very low	28.8	Very low	100 Å²	100	124.1 Å²	124.1	70%	0.699	77%	0.768	S	S	*	*			cis	-176.8	165.3	-10.4	46.4	0	0	0	0	110.9
19	E	31.4	Very low	28.5	Very low	181 Å²	181	122 Å²	122	85%	0.846	77%	0.766	S	S	*	*			trans	73	145.2	163.2	-51.2	-176.1	175.6	0	0	116.7
20	S	28.2	Very low	29	Very low	101 Å²	101	123.3 Å²	123.3	71%	0.706	77%	0.768	S	S	*	*			cis	-163	148.9	-4	31.9	0	0	0	0	112.9
21	D	26.9	Very low	28.8	Very low	152 Å²	152	126.8 Å²	126.8	81%	0.813	77%	0.772	S	S	*	*			trans	13.4	153.3	131	-60.2	-13.2	0	0	0	121.2
22	S	26.6	Very low	29.3	Very low	89 Å²	89	127.7 Å²	127.7	62%	0.622	78%	0.776	S	S	*	*			cis	-173.1	172.1	-11	59.1	0	0	0	0	112
23	D	28.4	Very low	29.1	Very low	144 Å²	144	121.5 Å²	121.5	77%	0.77	77%	0.772	S	S	*	*			trans	43.7	138.6	149.3	-50	-31.8	0	0	0	122.2
24	S	26.6	Very low	29	Very low	121 Å²	121	122.6 Å²	122.6	85%	0.846	78%	0.776	S	S	*	*				164.9	175.9	77	50.2	0	0	0	0	107.9
25	E	27.8	Very low	28.9	Very low	157 Å²	157	123.5 Å²	123.5	73%	0.734	77%	0.77	S	S	*	*			cis	-151.2	-177.7	3.8	-165.6	-136	-145.2	0	0	107.8	S27	E25-S27 VanDerWaalsContact OE2-CA 3.23Å; E25-S27 WeakPolarHBondContact OE2-CA 3.48Å; E25-S27 PolarHBondContact OE2-N 3.29Å
26	S	32.3	Very low	28.9	Very low	112 Å²	112	124.9 Å²	124.9	78%	0.783	77%	0.768	S	S	*	*			trans	-136.7	139.9	153.9	64	0	0	0	0	109.8
27	S	29.9	Very low	29.5	Very low	98 Å²	98	127.4 Å²	127.4	69%	0.685	77%	0.771	S	S	*	*			trans	-91.3	144.8	-150.4	64.7	0	0	0	0	117.9	E25	E25-S27 VanDerWaalsContact OE2-CA 3.23Å; E25-S27 WeakPolarHBondContact OE2-CA 3.48Å; E25-S27 PolarHBondContact OE2-N 3.29Å
28	R	25.6	Very low	29.5	Very low	227 Å²	227	131.7 Å²	131.7	86%	0.857	77%	0.773	S	S	*	*			trans	86.3	95.5	159.8	-65.7	-177.5	169.2	179.1	-2.7	119.9
29	C	21.5	Very low	29.6	Very low	124 Å²	124	134.3 Å²	134.3	84%	0.838	77%	0.774	S	S	*	*				47.4	158.4	117.1	-60.1	0	0	0	0	122.6
30	P	38	Very low	30.1	Very low	107 Å²	107	133.6 Å²	133.6	70%	0.695	78%	0.775	S	S	*	*			cis	-140.5	151.8	-7.5	30.8	-8.5	0	0	0	118.7
31	L	25.3	Very low	30.3	Very low	167 Å²	167	133.8 Å²	133.8	87%	0.874	77%	0.772	S	S	*	*			trans	63.3	159.4	142.1	-66.6	173.7	0	0	0	121.5
32	P	38.8	Very low	30.8	Very low	110 Å²	110	136 Å²	136	71%	0.714	77%	0.774	S	S	*	*			cis	-135.8	166.4	-17.3	37.4	-19.5	0	0	0	117.2
33	A	24	Very low	31.4	Very low	98 Å²	98	136.7 Å²	136.7	81%	0.81	78%	0.779	S	S	*	*			trans	76	132.9	140.1	0	0	0	0	0	124.6
34	A	28.4	Very low	32	Very low	81 Å²	81	136.1 Å²	136.1	67%	0.669	78%	0.783	S	S	*	*			trans	80.6	123.7	142.5	0	0	0	0	0	121.4
35	D	27.2	Very low	32.5	Very low	154 Å²	154	135.4 Å²	135.4	82%	0.824	78%	0.778	S	S	*	*				47.2	134.2	127.5	-53.8	-17	0	0	0	119.1
36	S	29.6	Very low	33.1	Very low	102 Å²	102	132.5 Å²	132.5	71%	0.713	78%	0.781	S	S	*	*			cis	-178.6	158.6	41.2	25.5	0	0	0	0	112.3
37	L	42.1	Very low	33.2	Very low	175 Å²	175	137 Å²	137	92%	0.916	79%	0.787	S	S	*	*			trans	-56.8	123.4	160.3	-82.9	146.6	0	0	0	112.8
38	M	31.1	Very low	34.5	Very low	165 Å²	165	138.1 Å²	138.1	81%	0.813	79%	0.792	S	S	*	*			trans	-163.2	146.7	149.9	-67.5	-156.4	-145.7	0	0	108
39	H	31.7	Very low	34.7	Very low	155 Å²	155	133.3 Å²	133.3	72%	0.718	79%	0.793	S	S	*	*			cis	-154.9	140.8	2.7	-148.5	-80.9	0	0	0	110.8
40	L	42.5	Very low	35.7	Very low	167 Å²	167	136.1 Å²	136.1	87%	0.874	80%	0.798	S	S	*	*			trans	-86.1	130.9	164.4	-97.3	160.1	0	0	0	110.4
41	T	33	Very low	35.3	Very low	105 Å²	105	135.9 Å²	135.9	64%	0.644	81%	0.805	S	S	*	*			trans	171.9	146.1	157.1	39	0	0	0	0	109.1
42	K	35.8	Very low	36.1	Very low	198 Å²	198	134.7 Å²	134.7	86%	0.861	81%	0.805	S	S	*	*			cis	-160.7	167.6	-5.1	-115.8	173.9	-177.4	176.4	0	109
43	S	39.9	Very low	35.9	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	81%	0.806	S	S	*	*			trans	-79.9	-178.6	-178.3	56.4	0	0	0	0	115
44	P	40.2	Very low	36.9	Very low	133 Å²	133	135.6 Å²	135.6	86%	0.864	81%	0.807	S	S	*	*				-137.3	169.3	110.4	38.9	-28.6	0	0	0	114.9
45	S	37.8	Very low	37.3	Very low	105 Å²	105	138.7 Å²	138.7	73%	0.734	81%	0.812	S	S	*	*			trans	-127	131.3	-167.4	58.8	0	0	0	0	115.5
46	A	41	Very low	38	Very low	96 Å²	96	137 Å²	137	79%	0.793	81%	0.813	S	S	*	*			trans	46.4	142	137.7	0	0	0	0	0	123.4
47	K	33.7	Very low	38.6	Very low	207 Å²	207	135.7 Å²	135.7	90%	0.9	81%	0.808	S	S	*	*			trans	-162	146.6	133.3	-108.3	170.3	-169.5	-180	0	112.1
48	P	58	Low	38.6	Very low	122 Å²	122	132.9 Å²	132.9	79%	0.792	80%	0.8	S	S	*	*			trans	-118.9	157.2	-177.3	40.6	-30.9	0	0	0	115.3
49	S	29.5	Very low	38.9	Very low	126 Å²	126	134.3 Å²	134.3	88%	0.881	81%	0.805	S	S	*	*			trans	-165.3	153.6	152	53	0	0	0	0	112.8
50	L	41.8	Very low	39.8	Very low	182 Å²	182	133 Å²	133	95%	0.953	81%	0.807	S	S	*	*			trans	-79.8	141.9	-173.5	-68.7	139	0	0	0	114
51	A	29.8	Very low	39.9	Very low	102 Å²	102	129.3 Å²	129.3	84%	0.843	80%	0.801	S	S	*	*			trans	-157.1	142.2	148.8	0	0	0	0	0	110.5
52	V	43	Very low	40.3	Very low	143 Å²	143	130.5 Å²	130.5	87%	0.867	81%	0.808	S	S	*	*			trans	-92.1	129.1	170.9	171.7	0	0	0	0	108.9
53	A	34	Very low	41	Very low	88 Å²	88	129.9 Å²	129.9	73%	0.727	81%	0.805	S	S	*	*			trans	-134.6	124.3	161.4	0	0	0	0	0	108.4	D55	A53-D55 PolarHBondContact O-N 2.99Å
54	V	44.8	Very low	41.2	Very low	139 Å²	139	133.4 Å²	133.4	84%	0.842	81%	0.81	S	S	*	*			trans	-86.5	102.1	163.8	174.6	0	0	0	0	105.6
55	D	36.2	Very low	41.4	Very low	146 Å²	146	134.1 Å²	134.1	78%	0.781	81%	0.807	S	S	*	*			trans	-101.4	132.1	173.8	-138.3	-29.4	0	0	0	110	A53 A57	A53-D55 PolarHBondContact O-N 2.99Å; D55-A57 PolarHBondContact O-N 3.2Å
56	S	42	Very low	41.7	Very low	119 Å²	119	136.2 Å²	136.2	83%	0.832	81%	0.809	S	S	*	*			trans	-102.9	49.1	-160.4	48.3	0	0	0	0	113
57	A	41.9	Very low	42.1	Very low	74 Å²	74	141.1 Å²	141.1	61%	0.612	82%	0.815	S	S	*	*	S	Bend	trans	-142.7	142.3	168.5	0	0	0	0	0	109.7	D55 E59	D55-A57 PolarHBondContact O-N 3.2Å; A57-E59 PolarHBondContact O-N 3.44Å
58	P	43	Very low	43.3	Very low	115 Å²	115	136.3 Å²	136.3	75%	0.747	80%	0.804	S	S	*	*			trans	-67.8	131.1	174.7	28.8	-32.9	0	0	0	109.7	V60	P58-V60 PolarHBondContact O-N 2.64Å
59	E	37.5	Very low	43.5	Very low	195 Å²	195	132.8 Å²	132.8	91%	0.911	79%	0.79	S	S	*	*			trans	-60.4	107.1	160.3	-84.5	-172.8	135.3	0	0	108	A57 A61	A57-E59 PolarHBondContact O-N 3.44Å; E59-A61 PolarHBondContact O-N 2.92Å
60	V	51.4	Low	45.4	Very low	127 Å²	127	132 Å²	132	77%	0.77	78%	0.779	S	S	*	*			trans	-72	87.9	164.7	179.4	0	0	0	0	105.9	P58 V62	P58-V60 PolarHBondContact O-N 2.64Å; V60-V62 PolarHBondContact O-N 3.27Å
61	A	43	Very low	46.9	Very low	90 Å²	90	128.1 Å²	128.1	74%	0.744	76%	0.756	S	S	*	*			trans	-54.2	106.1	170.6	0	0	0	0	0	108	E59	E59-A61 PolarHBondContact O-N 2.92Å
62	V	42.6	Very low	49.4	Very low	130 Å²	130	125.4 Å²	125.4	79%	0.788	73%	0.727	S	S	*	*			trans	-57.9	138.3	168.9	177.4	0	0	0	0	106.5	V60 E64	V60-V62 PolarHBondContact O-N 3.27Å; V62-E64 PolarHBondContact O-N 3.29Å
63	K	49.5	Very low	51.4	Low	186 Å²	186	123.6 Å²	123.6	81%	0.809	71%	0.713	S	S	*	*			trans	-54.8	101.5	-178.1	-65.7	179.5	176.2	-174.2	0	110.5
64	E	44.3	Very low	53.8	Low	177 Å²	177	123.1 Å²	123.1	83%	0.827	70%	0.702	S	S	*	*			trans	-71.4	124.2	149.1	-66.6	-173.3	156.7	0	0	105.9	V62 L66	V62-E64 PolarHBondContact O-N 3.29Å; E64-L66 PolarHBondContact O-N 3.45Å
65	D	44.5	Very low	55.7	Low	148 Å²	148	120 Å²	120	79%	0.791	69%	0.691	S	S	*	*			trans	-70.4	87.7	174.9	-69.3	-42.8	0	0	0	108.2	E67	D65-E67 PolarHBondContact O-N 3.27Å
66	L	45	Very low	58.3	Low	149 Å²	149	116.2 Å²	116.2	78%	0.78	67%	0.673	S	S	*	*			trans	-51.7	112.8	159.5	-92.3	144.4	0	0	0	107.2	E64 T68	E64-L66 PolarHBondContact O-N 3.45Å; L66-T68 PolarHBondContact O-N 3.09Å
67	E	49.2	Very low	60.4	Low	198 Å²	198	118.1 Å²	118.1	93%	0.925	67%	0.666	S	S	*	*			trans	-67.1	73.6	171.1	-68.5	-173.4	153.5	0	0	109.5	D65	D65-E67 PolarHBondContact O-N 3.27Å
68	T	58	Low	62.7	Low	107 Å²	107	122 Å²	122	66%	0.656	67%	0.672	S	S	*	*			trans	-63.7	137.7	163.7	55.4	0	0	0	0	108	L66	L66-T68 PolarHBondContact O-N 3.09Å
69	G	62.1	Low	64.9	Low	48 Å²	48	119.2 Å²	119.2	50%	0.495	65%	0.652	S	S	.	*			trans	-61.4	173.7	-176.8	0	0	0	0	0	113.1	H71	G69-H71 PolarHBondContact O-CD2 3.02Å; G69-H71 PolarHBondContact O-N 2.9Å
70	V	69.1	Low	67.4	Low	109 Å²	109	118.2 Å²	118.2	66%	0.661	65%	0.648	S	S	*	*			trans	-66.9	95.9	178.5	-174.4	0	0	0	0	110.2	T87	V70-T87 VanDerWaalsContact O-CB 3.32Å; V70-T87 WeakPolarHBondContact O-CB 3.39Å; V70-T87 WeakPolarHBondContact O-CG2 3.5Å
71	H	73.8	Confident	69.2	Low	100 Å²	100	117.1 Å²	117.1	46%	0.463	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-86.1	150.1	176.4	-72.1	-78.8	0	0	0	112.3	G69	G69-H71 PolarHBondContact O-CD2 3.02Å; G69-H71 PolarHBondContact O-N 2.9Å
72	L	82.6	Confident	71.4	Confident	45 Å²	45	120.6 Å²	120.6	24%	0.236	64%	0.636	C	S	.	*	P	Polyproline II helix	trans	-91.2	154.2	173.5	-72.2	168.8	0	0	0	112.1	V79 Y81 P83 M88	L72-V79 HydrophobicContact CD1-CG1 3.79Å; L72-V79 HydrophobicContact CD2-CG1 3.94Å; L72-Y81 HydrophobicContact CD2-CE1 4.02Å; L72-Y81 WeakPolarHBondContact CD2-OH 3.37Å; L72-P83 HydrophobicContact CD1-CB 3.77Å; L72-P83 HydrophobicContact CD1-CG 3.85Å; L72-M88 HydrophobicContact CD1-CB 4.35Å
73	D	84.5	Confident	73.6	Confident	106 Å²	106	115.9 Å²	115.9	57%	0.567	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-74.2	121.7	171.3	-179.8	-14.2	0	0	0	110.3	A75 V76	D73-A75 PolarHBondContact O-N 2.87Å; D73-A75 VanDerWaalsContact O-N 3.09Å; D73-A75 WeakPolarHBondContact OD1-CB 3.19Å; D73-A75 PolarHBondContact OD1-N 3.34Å; D73-V76 HydrophobicContact CB-CB 4.44Å; D73-V76 VanDerWaalsContact O-CG1 3.28Å; D73-V76 WeakPolarHBondContact O-CG1 3.24Å; D73-V76 PolarHBondContact O-N 3.41Å
74	P	84.8	Confident	75.5	Confident	78 Å²	78	111.1 Å²	111.1	51%	0.506	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58	-23.6	179.5	-24.2	33.7	0	0	0	115	K77 E92	P74-K77 PolarHBondContact O-NZ 2.64Å; P74-E92 HydrophobicContact CB-CG 4.28Å; P74-E92 VanDerWaalsContact CB-OE1 3.28Å; P74-E92 WeakPolarHBondContact CB-OE1 3.15Å; P74-E92 HydrophobicContact CG-CG 4Å
75	A	85.3	Confident	77.5	Confident	73 Å²	73	111.3 Å²	111.3	60%	0.603	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-21.7	178.1	0	0	0	0	0	113.2	D73	D73-A75 PolarHBondContact O-N 2.87Å; D73-A75 VanDerWaalsContact O-N 3.09Å; D73-A75 WeakPolarHBondContact OD1-CB 3.19Å; D73-A75 PolarHBondContact OD1-N 3.34Å
76	V	90.7	Very high	79.4	Confident	67 Å²	67	111.6 Å²	111.6	41%	0.406	59%	0.586	S	S	.	*			trans	-69.1	148.4	-179.1	90.8	0	0	0	0	110.9	D73 V79	D73-V76 HydrophobicContact CB-CB 4.44Å; D73-V76 VanDerWaalsContact O-CG1 3.28Å; D73-V76 WeakPolarHBondContact O-CG1 3.24Å; D73-V76 PolarHBondContact O-N 3.41Å; V76-V79 HydrophobicContact CG1-CG1 4.21Å
77	K	86.3	Confident	81.3	Confident	158 Å²	158	105.7 Å²	105.7	69%	0.687	56%	0.556	S	S	*	*			trans	-122.2	-19.7	-179.7	-59.9	-63.6	158	-132.3	0	114.4	P74	P74-K77 PolarHBondContact O-NZ 2.64Å
78	E	88.9	Confident	83.1	Confident	157 Å²	157	100.4 Å²	100.4	73%	0.734	53%	0.532	S	S	*	.			trans	-123.1	124.6	175.8	-66	179.8	179.6	0	0	108.9
79	V	90.1	Very high	84.5	Confident	55 Å²	55	100.4 Å²	100.4	33%	0.333	52%	0.524	S	S	.	.			trans	-106.9	139.2	178.3	-66.6	0	0	0	0	110.6	L72 V76 M88	L72-V79 HydrophobicContact CD1-CG1 3.79Å; L72-V79 HydrophobicContact CD2-CG1 3.94Å; V76-V79 HydrophobicContact CG1-CG1 4.21Å; V79-M88 HydrophobicContact CG2-CE 4.22Å
80	Q	90.1	Very high	85.6	Confident	175 Å²	175	100.2 Å²	100.2	82%	0.818	52%	0.517	S	S	*	.	S	Bend	trans	-94	-5	-174.5	-58.5	-60.7	-42.7	0	0	113.5
81	Y	88.8	Confident	86.4	Confident	103 Å²	103	99.8 Å²	99.8	40%	0.404	52%	0.517	S	S	.	.	S	Bend	trans	-136.4	162.6	173.9	68.8	-85.1	0	0	0	108.7	L72 P83	L72-Y81 HydrophobicContact CD2-CE1 4.02Å; L72-Y81 WeakPolarHBondContact CD2-OH 3.37Å; Y81-P83 HydrophobicContact CE2-CB 4.07Å; Y81-P83 WeakPolarHBondContact O-CD 3.35Å
82	N	90.4	Very high	87	Confident	163 Å²	163	102.4 Å²	102.4	87%	0.872	53%	0.529	S	S	*	.			trans	-83.9	109.4	176.3	-63.8	-14.5	0	0	0	109.1
83	P	87.9	Confident	87.3	Confident	31 Å²	31	109.8 Å²	109.8	20%	0.201	56%	0.56	C	S	.	*			trans	-77.2	164.7	177.2	34.4	-36.4	0	0	0	111.5	L72 Y81 M88	L72-P83 HydrophobicContact CD1-CB 3.77Å; L72-P83 HydrophobicContact CD1-CG 3.85Å; Y81-P83 HydrophobicContact CE2-CB 4.07Å; Y81-P83 WeakPolarHBondContact O-CD 3.35Å; P83-M88 HydrophobicContact CB-CB 4.19Å; P83-M88 HydrophobicContact CG-CB 3.87Å; P83-M88 HydrophobicContact CG-CE 3.67Å; P83-M88 HydrophobicContact CG-CG 4.28Å; P83-M88 HydrophobicContact CG-SD 3.91Å
84	T	89	Confident	87.5	Confident	86 Å²	86	107.8 Å²	107.8	53%	0.528	57%	0.565	S	S	.	*			trans	-79.1	159.9	167	63.5	0	0	0	0	110.5	E86 T87 M88	T84-E86 VanDerWaalsContact C-N 3.28Å; T84-E86 PolarHBondContact O-N 2.71Å; T84-T87 PolarHBondContact N-OG1 2.71Å; T84-T87 PolarHBondContact O-N 3.4Å; T84-T87 VanDerWaalsContact O-N 3.12Å; T84-T87 PolarHBondContact O-OG1 3.35Å; T84-T87 WeakPolarHBondContact OG1-CG2 3.44Å; T84-T87 PolarHBondContact OG1-N 3.08Å; T84-T87 PolarHBondContact OG1-OG1 2.93Å; T84-M88 PolarHBondContact O-N 3.37Å; T84-M88 VanDerWaalsContact O-N 3.13Å
85	Y	85.9	Confident	87.8	Confident	182 Å²	182	110.4 Å²	110.4	71%	0.714	58%	0.582	S	S	*	*	H	α-helix	trans	-53.1	-45.6	177.1	177.9	-94.1	0	0	0	112.5	T87 M88 F89	Y85-T87 PolarHBondContact O-N 3.22Å; Y85-M88 PolarHBondContact O-N 3.45Å; Y85-F89 AromaticContact CD2-CD2 3.51Å; Y85-F89 HydrophobicContact CD2-CD2 3.51Å; Y85-F89 HydrophobicContact CD2-CE2 4.08Å; Y85-F89 HydrophobicContact CD2-CG 4.37Å; Y85-F89 HydrophobicContact CE2-CB 4.23Å; Y85-F89 AromaticContact CE2-CD2 3.64Å; Y85-F89 HydrophobicContact CE2-CD2 3.64Å; Y85-F89 HydrophobicContact CE2-CE2 4.29Å; Y85-F89 HydrophobicContact CE2-CG 4.12Å; Y85-F89 HydrophobicContact CG-CD2 4.24Å; Y85-F89 PolarHBondContact O-N 3.36Å
86	E	85.7	Confident	87.9	Confident	154 Å²	154	115.5 Å²	115.5	72%	0.72	59%	0.593	S	S	*	*	H	α-helix	trans	-66.2	-32.7	179.9	-173	173.1	-166.3	0	0	113.2	T84 A90	T84-E86 VanDerWaalsContact C-N 3.28Å; T84-E86 PolarHBondContact O-N 2.71Å; E86-A90 WeakPolarHBondContact O-CB 3.38Å
87	T	85.1	Confident	87.7	Confident	25 Å²	25	116.1 Å²	116.1	15%	0.153	59%	0.594	C	S	.	*	H	α-helix	trans	-81.4	-20.3	179.3	50.7	0	0	0	0	113.6	V70 T84 Y85	V70-T87 VanDerWaalsContact O-CB 3.32Å; V70-T87 WeakPolarHBondContact O-CB 3.39Å; V70-T87 WeakPolarHBondContact O-CG2 3.5Å; T84-T87 PolarHBondContact N-OG1 2.71Å; T84-T87 PolarHBondContact O-N 3.4Å; T84-T87 VanDerWaalsContact O-N 3.12Å; T84-T87 PolarHBondContact O-OG1 3.35Å; T84-T87 WeakPolarHBondContact OG1-CG2 3.44Å; T84-T87 PolarHBondContact OG1-N 3.08Å; T84-T87 PolarHBondContact OG1-OG1 2.93Å; Y85-T87 PolarHBondContact O-N 3.22Å
88	M	85.8	Confident	87.9	Confident	86 Å²	86	113.7 Å²	113.7	42%	0.424	59%	0.594	S	S	.	*	H	α-helix	trans	-98.3	-37.1	179	-177.8	175.5	-113.6	0	0	114.1	L72 V79 P83 T84 Y85	L72-M88 HydrophobicContact CD1-CB 4.35Å; V79-M88 HydrophobicContact CG2-CE 4.22Å; P83-M88 HydrophobicContact CB-CB 4.19Å; P83-M88 HydrophobicContact CG-CB 3.87Å; P83-M88 HydrophobicContact CG-CE 3.67Å; P83-M88 HydrophobicContact CG-CG 4.28Å; P83-M88 HydrophobicContact CG-SD 3.91Å; T84-M88 PolarHBondContact O-N 3.37Å; T84-M88 VanDerWaalsContact O-N 3.13Å; Y85-M88 PolarHBondContact O-N 3.45Å
89	F	87.4	Confident	88.1	Confident	108 Å²	108	115.2 Å²	115.2	47%	0.474	60%	0.599	S	S	.	*	S	Bend	trans	-110.1	17.8	-173.3	-63.4	-73.9	0	0	0	114	Y85	Y85-F89 AromaticContact CD2-CD2 3.51Å; Y85-F89 HydrophobicContact CD2-CD2 3.51Å; Y85-F89 HydrophobicContact CD2-CE2 4.08Å; Y85-F89 HydrophobicContact CD2-CG 4.37Å; Y85-F89 HydrophobicContact CE2-CB 4.23Å; Y85-F89 AromaticContact CE2-CD2 3.64Å; Y85-F89 HydrophobicContact CE2-CD2 3.64Å; Y85-F89 HydrophobicContact CE2-CE2 4.29Å; Y85-F89 HydrophobicContact CE2-CG 4.12Å; Y85-F89 HydrophobicContact CG-CD2 4.24Å; Y85-F89 PolarHBondContact O-N 3.36Å
90	A	85.8	Confident	88.1	Confident	43 Å²	43	119.2 Å²	119.2	36%	0.355	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-60.2	135.9	169	0	0	0	0	0	110.9	E86	E86-A90 WeakPolarHBondContact O-CB 3.38Å
91	P	86.5	Confident	88.2	Confident	101 Å²	101	114.7 Å²	114.7	66%	0.656	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-69.6	145.8	178.1	28.9	-34.7	0	0	0	111.8	F93	P91-F93 PolarHBondContact O-N 3.5Å
92	E	86.6	Confident	88.3	Confident	155 Å²	155	118 Å²	118	72%	0.724	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-63.8	126.7	172.8	-66.5	-178.9	-165.7	0	0	110.6	P74	P74-E92 HydrophobicContact CB-CG 4.28Å; P74-E92 VanDerWaalsContact CB-OE1 3.28Å; P74-E92 WeakPolarHBondContact CB-OE1 3.15Å; P74-E92 HydrophobicContact CG-CG 4Å
93	F	86.9	Confident	88.2	Confident	199 Å²	199	115.1 Å²	115.1	87%	0.873	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-83.9	129.9	179.2	-73.1	-87.5	0	0	0	112.1	P91	P91-F93 PolarHBondContact O-N 3.5Å
94	G	90.2	Very high	88.3	Confident	65 Å²	65	118.8 Å²	118.8	67%	0.67	61%	0.608	S	S	*	*	S	Bend	trans	131.6	178.2	173.4	0	0	0	0	0	113
95	P	89.7	Confident	88.3	Confident	133 Å²	133	117.4 Å²	117.4	86%	0.864	61%	0.606	S	S	*	*			trans	-73.6	140.4	171.6	30.9	-33.2	0	0	0	110.8
96	E	87.4	Confident	88.5	Confident	179 Å²	179	111.1 Å²	111.1	84%	0.836	59%	0.591	S	S	*	*			trans	-59.9	146.3	169	63.8	175.8	174.4	0	0	111	P98	E96-P98 WeakPolarHBondContact O-CD 3.32Å
97	N	88	Confident	88.6	Confident	80 Å²	80	108.9 Å²	108.9	43%	0.428	59%	0.591	S	S	.	*			trans	-78.4	109.3	-177	-178.5	-17.5	0	0	0	110.8	F99 R100	N97-F99 PolarHBondContact O-N 2.65Å; N97-F99 VanDerWaalsContact O-N 3.13Å; N97-F99 WeakPolarHBondContact OD1-CB 3.39Å; N97-F99 WeakPolarHBondContact OD1-CD2 3.34Å; N97-F99 PolarHBondContact OD1-N 2.9Å; N97-R100 HydrophobicContact CB-CG 4.33Å; N97-R100 PolarHBondContact O-N 2.85Å
98	P	90.8	Very high	88.8	Confident	108 Å²	108	113.6 Å²	113.6	70%	0.701	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-7.9	-172.6	33.4	-37.9	0	0	0	113.5	E96 R100	E96-P98 WeakPolarHBondContact O-CD 3.32Å; P98-R100 VanDerWaalsContact C-N 3.31Å
99	F	92.2	Very high	89	Confident	188 Å²	188	115 Å²	115	83%	0.825	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-2.6	177.3	-56.1	-67.1	0	0	0	113.1	N97	N97-F99 PolarHBondContact O-N 2.65Å; N97-F99 VanDerWaalsContact O-N 3.13Å; N97-F99 WeakPolarHBondContact OD1-CB 3.39Å; N97-F99 WeakPolarHBondContact OD1-CD2 3.34Å; N97-F99 PolarHBondContact OD1-N 2.9Å
100	R	90.4	Very high	89.1	Confident	139 Å²	139	114.7 Å²	114.7	53%	0.525	62%	0.616	S	S	.	*	S	Bend	trans	-84	121.4	172.6	-65.9	-176.4	178.7	176.4	2.2	109.9	N97 P98 M104 A105	N97-R100 HydrophobicContact CB-CG 4.33Å; N97-R100 PolarHBondContact O-N 2.85Å; P98-R100 VanDerWaalsContact C-N 3.31Å; R100-M104 HydrophobicContact CB-CB 4.11Å; R100-M104 HydrophobicContact CG-CB 4.44Å; R100-A105 HydrophobicContact CB-CB 4.17Å
101	T	91.2	Very high	89.3	Confident	80 Å²	80	118.8 Å²	118.8	49%	0.491	63%	0.631	S	S	.	*			trans	-63.6	159.6	163.5	-178.4	0	0	0	0	110.3	Q103 M104 A105	T101-Q103 HydrophobicContact CG2-CB 4.31Å; T101-Q103 PolarHBondContact O-N 2.78Å; T101-Q103 VanDerWaalsContact O-N 3.1Å; T101-M104 HydrophobicContact CG2-CB 3.98Å; T101-M104 HydrophobicContact CG2-CE 4.32Å; T101-M104 HydrophobicContact CG2-CG 3.62Å; T101-M104 HydrophobicContact CG2-SD 3.93Å; T101-M104 CarbonylContact O-C 3.56Å; T101-M104 WeakPolarHBondContact O-CA 3.06Å; T101-M104 WeakPolarHBondContact O-CB 3.37Å; T101-M104 PolarHBondContact O-N 3.38Å; T101-A105 PolarHBondContact O-N 3.23Å
102	Q	91.3	Very high	89.5	Confident	174 Å²	174	118.6 Å²	118.6	81%	0.813	63%	0.632	S	S	*	*	H	α-helix	trans	-53.9	-36.2	-176.4	-167.5	168.7	7.3	0	0	113.2	M104 A105 A106	Q102-M104 VanDerWaalsContact C-N 3.33Å; Q102-M104 PolarHBondContact O-N 3.23Å; Q102-A105 PolarHBondContact O-N 2.65Å; Q102-A106 PolarHBondContact O-N 2.89Å; Q102-A106 VanDerWaalsContact O-N 3.09Å
103	Q	89.4	Confident	89.8	Confident	102 Å²	102	112.2 Å²	112.2	48%	0.477	61%	0.608	S	S	.	*	H	α-helix	trans	-66.3	-28.6	173.3	-173.5	-174.5	10	0	0	113.8	T101 R108 L111	T101-Q103 HydrophobicContact CG2-CB 4.31Å; T101-Q103 PolarHBondContact O-N 2.78Å; T101-Q103 VanDerWaalsContact O-N 3.1Å; Q103-R108 WeakPolarHBondContact O-CD 3.38Å; Q103-L111 PolarHBondContact NE2-O 2.89Å
104	M	88.6	Confident	90.1	Very high	107 Å²	107	108.7 Å²	108.7	53%	0.527	59%	0.59	S	S	.	*	H	α-helix	trans	-91.6	-20.8	177.2	-68	-179.2	-175.6	0	0	113.1	R100 T101 Q102	R100-M104 HydrophobicContact CB-CB 4.11Å; R100-M104 HydrophobicContact CG-CB 4.44Å; T101-M104 HydrophobicContact CG2-CB 3.98Å; T101-M104 HydrophobicContact CG2-CE 4.32Å; T101-M104 HydrophobicContact CG2-CG 3.62Å; T101-M104 HydrophobicContact CG2-SD 3.93Å; T101-M104 CarbonylContact O-C 3.56Å; T101-M104 WeakPolarHBondContact O-CA 3.06Å; T101-M104 WeakPolarHBondContact O-CB 3.37Å; T101-M104 PolarHBondContact O-N 3.38Å; Q102-M104 VanDerWaalsContact C-N 3.33Å; Q102-M104 PolarHBondContact O-N 3.23Å
105	A	89.7	Confident	90.3	Very high	58 Å²	58	107.9 Å²	107.9	48%	0.479	58%	0.577	S	S	.	*	H	α-helix	trans	-78.6	-37.5	174.2	0	0	0	0	0	111.6	R100 T101 Q102	R100-A105 HydrophobicContact CB-CB 4.17Å; T101-A105 PolarHBondContact O-N 3.23Å; Q102-A105 PolarHBondContact O-N 2.65Å
106	A	90	Very high	90.4	Very high	49 Å²	49	107.6 Å²	107.6	41%	0.405	56%	0.564	S	S	.	*	S	Bend	trans	-64.2	140.4	175.7	0	0	0	0	0	112.2	Q102 R108	Q102-A106 PolarHBondContact O-N 2.89Å; Q102-A106 VanDerWaalsContact O-N 3.09Å; A106-R108 PolarHBondContact O-N 3.32Å
107	P	88.3	Confident	90.7	Very high	108 Å²	108	104.8 Å²	104.8	70%	0.701	56%	0.561	S	S	*	*			trans	-62.5	127.5	171.3	27.5	-33.7	0	0	0	109.2
108	R	88.3	Confident	90.9	Very high	123 Å²	123	104.6 Å²	104.6	46%	0.464	57%	0.571	S	S	.	*			trans	-141.2	137.2	-174.5	68.1	-177.5	177.9	85.3	3.4	111.9	Q103 A106	Q103-R108 WeakPolarHBondContact O-CD 3.38Å; A106-R108 PolarHBondContact O-N 3.32Å
109	N	89.9	Confident	91.1	Very high	115 Å²	115	108.3 Å²	108.3	62%	0.615	58%	0.578	S	S	*	*	S	Bend	trans	-99	-40.2	174.9	-167.2	8.1	0	0	0	109.8	G113 Y114 A115	N109-G113 PolarHBondContact N-O 2.92Å; N109-Y114 HydrophobicContact CB-CD2 3.79Å; N109-Y114 HydrophobicContact CB-CE2 3.98Å; N109-Y114 HydrophobicContact CB-CG 4.4Å; N109-A115 PolarHBondContact ND2-O 2.82Å; N109-A115 VanDerWaalsContact ND2-O 3.11Å
110	M	90.8	Very high	91.2	Very high	103 Å²	103	103.5 Å²	103.5	51%	0.507	56%	0.56	S	S	.	*	B	Isolated β-bridge	trans	-113.6	171.4	172.7	59.8	-174.9	-68.7	0	0	111.1	S112 G113 A115	M110-S112 PolarHBondContact O-N 2.87Å; M110-S112 VanDerWaalsContact O-N 3.16Å; M110-G113 WeakPolarHBondContact CG-O 3.49Å; M110-G113 PolarHBondContact N-O 2.77Å; M110-G113 PolarHBondContact O-N 3.3Å; M110-G113 VanDerWaalsContact O-O 3.06Å; M110-A115 HydrophobicContact CG-CB 4.33Å; M110-A115 HydrophobicContact SD-CB 3.72Å
111	L	89	Confident	91.5	Very high	129 Å²	129	101.9 Å²	101.9	68%	0.675	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	-35.2	-172.7	-178.9	60.2	0	0	0	113.7	Q103	Q103-L111 PolarHBondContact NE2-O 2.89Å
112	S	90.9	Very high	91.6	Very high	96 Å²	96	104.6 Å²	104.6	67%	0.671	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-5.6	-176.9	54.6	0	0	0	0	115.3	M110	M110-S112 PolarHBondContact O-N 2.87Å; M110-S112 VanDerWaalsContact O-N 3.16Å
113	G	93.4	Very high	91.9	Very high	22 Å²	22	101.3 Å²	101.3	23%	0.227	56%	0.557	C	S	.	*	B	Isolated β-bridge	trans	156.3	-166.3	-178	0	0	0	0	0	114.5	N109 M110	N109-G113 PolarHBondContact N-O 2.92Å; M110-G113 WeakPolarHBondContact CG-O 3.49Å; M110-G113 PolarHBondContact N-O 2.77Å; M110-G113 PolarHBondContact O-N 3.3Å; M110-G113 VanDerWaalsContact O-O 3.06Å
114	Y	93.5	Very high	92	Very high	125 Å²	125	100.8 Å²	100.8	49%	0.49	56%	0.555	S	S	.	*			trans	-89.5	133.9	172.7	-155.5	-102.4	0	0	0	110.1	N109 E116	N109-Y114 HydrophobicContact CB-CD2 3.79Å; N109-Y114 HydrophobicContact CB-CE2 3.98Å; N109-Y114 HydrophobicContact CB-CG 4.4Å; Y114-E116 HydrophobicContact CD1-CB 4.33Å; Y114-E116 HydrophobicContact CD1-CG 4.37Å; Y114-E116 HydrophobicContact CE1-CB 3.92Å; Y114-E116 HydrophobicContact CE1-CG 4.22Å; Y114-E116 WeakPolarHBondContact CE1-OE2 3.3Å
115	A	92.9	Very high	92.3	Very high	48 Å²	48	101.2 Å²	101.2	40%	0.397	55%	0.554	S	S	.	*			trans	-134.4	122.6	176	0	0	0	0	0	107.6	N109 M110	N109-A115 PolarHBondContact ND2-O 2.82Å; N109-A115 VanDerWaalsContact ND2-O 3.11Å; M110-A115 HydrophobicContact CG-CB 4.33Å; M110-A115 HydrophobicContact SD-CB 3.72Å
116	E	92.3	Very high	92.6	Very high	127 Å²	127	100.5 Å²	100.5	59%	0.593	54%	0.541	S	S	*	.			trans	-134.8	150.3	-179.5	63.8	-173.7	167.2	0	0	110.3	Y114 A118	Y114-E116 HydrophobicContact CD1-CB 4.33Å; Y114-E116 HydrophobicContact CD1-CG 4.37Å; Y114-E116 HydrophobicContact CE1-CB 3.92Å; Y114-E116 HydrophobicContact CE1-CG 4.22Å; Y114-E116 WeakPolarHBondContact CE1-OE2 3.3Å; E116-A118 PolarHBondContact O-N 3.09Å
117	P	93.9	Very high	92.8	Very high	120 Å²	120	99 Å²	99	78%	0.779	53%	0.526	S	S	*	.			trans	-69.6	110.3	175.2	-17.7	32.5	0	0	0	111.3
118	A	92.4	Very high	93.1	Very high	75 Å²	75	95.8 Å²	95.8	62%	0.62	50%	0.501	S	S	*	.			trans	-93.8	139.2	173.4	0	0	0	0	0	111.5	E116 I120	E116-A118 PolarHBondContact O-N 3.09Å; A118-I120 HydrophobicContact CB-CD1 4.45Å; A118-I120 HydrophobicContact CB-CG1 4.3Å
119	H	94.3	Very high	93.4	Very high	187 Å²	187	96.8 Å²	96.8	87%	0.866	51%	0.505	S	S	*	.			trans	-108.1	69.6	178.4	-69.3	-76.6	0	0	0	111.2
120	I	93.9	Very high	93.6	Very high	87 Å²	87	96.3 Å²	96.3	45%	0.446	50%	0.495	S	S	.	.			trans	-85.9	145.2	176.9	-54.2	173.5	0	0	0	109.3	A118 D122 F125	A118-I120 HydrophobicContact CB-CD1 4.45Å; A118-I120 HydrophobicContact CB-CG1 4.3Å; I120-D122 PolarHBondContact O-N 2.97Å; I120-F125 HydrophobicContact CD1-CD2 4.47Å; I120-F125 HydrophobicContact CG2-CB 3.99Å
121	N	96.6	Very high	93.7	Very high	104 Å²	104	91.4 Å²	91.4	56%	0.556	47%	0.471	S	S	*	.			trans	-63.6	122.2	170.8	177.2	-5.7	0	0	0	110.6	F123 M124 F125	N121-F123 PolarHBondContact O-N 3.41Å; N121-F123 VanDerWaalsContact O-N 3.09Å; N121-F123 PolarHBondContact OD1-N 3.36Å; N121-F123 VanDerWaalsContact OD1-N 3.13Å; N121-M124 HydrophobicContact CB-CB 4.39Å; N121-M124 HydrophobicContact CB-CG 4.03Å; N121-M124 PolarHBondContact O-N 3.43Å; N121-F125 PolarHBondContact O-N 2.97Å
122	D	94.9	Very high	94	Very high	138 Å²	138	90 Å²	90	74%	0.738	46%	0.459	S	S	*	.	H	α-helix	trans	-44.8	-43.4	179.8	-64.8	-28.1	0	0	0	113.4	I120 E126	I120-D122 PolarHBondContact O-N 2.97Å; D122-E126 WeakPolarHBondContact O-CB 3.31Å; D122-E126 PolarHBondContact O-N 2.99Å
123	F	96.1	Very high	94.2	Very high	104 Å²	104	89.4 Å²	89.4	46%	0.456	46%	0.461	S	S	.	.	H	α-helix	trans	-64.8	-45.7	-179.4	179.5	-96.8	0	0	0	111.7	N121 E126 Q127 F168	N121-F123 PolarHBondContact O-N 3.41Å; N121-F123 VanDerWaalsContact O-N 3.09Å; N121-F123 PolarHBondContact OD1-N 3.36Å; N121-F123 VanDerWaalsContact OD1-N 3.13Å; F123-E126 PolarHBondContact O-N 3.26Å; F123-Q127 WeakPolarHBondContact O-CB 3.35Å; F123-Q127 PolarHBondContact O-N 2.88Å; F123-F168 HydrophobicContact CE2-CD1 4.49Å; F123-F168 AromaticContact CE2-CD2 3.87Å; F123-F168 HydrophobicContact CE2-CD2 3.87Å; F123-F168 HydrophobicContact CE2-CE2 4.03Å; F123-F168 HydrophobicContact CE2-CG 4.12Å; F123-F168 HydrophobicContact CE2-CZ 4.41Å; F123-F168 HydrophobicContact CZ-CB 4.28Å; F123-F168 AromaticContact CZ-CD2 3.88Å; F123-F168 HydrophobicContact CZ-CD2 3.88Å; F123-F168 HydrophobicContact CZ-CE2 4.44Å; F123-F168 HydrophobicContact CZ-CG 4.13Å
124	M	93.4	Very high	94.1	Very high	91 Å²	91	92.4 Å²	92.4	45%	0.448	48%	0.475	S	S	.	.	H	α-helix	trans	-67.6	-40.8	-178.8	-59.1	-58.8	-65.5	0	0	111.1	N121 Q127 Q128	N121-M124 HydrophobicContact CB-CB 4.39Å; N121-M124 HydrophobicContact CB-CG 4.03Å; N121-M124 PolarHBondContact O-N 3.43Å; M124-Q127 PolarHBondContact O-N 3.4Å; M124-Q128 WeakPolarHBondContact O-CG 3.25Å; M124-Q128 PolarHBondContact O-N 3.14Å
125	F	94.9	Very high	93.9	Very high	116 Å²	116	90.2 Å²	90.2	51%	0.509	47%	0.466	S	S	.	.	H	α-helix	trans	-62.1	-50.5	176	178.4	-100.1	0	0	0	111.6	I120 N121 Q127 Q128 R129	I120-F125 HydrophobicContact CD1-CD2 4.47Å; I120-F125 HydrophobicContact CG2-CB 3.99Å; N121-F125 PolarHBondContact O-N 2.97Å; F125-Q127 VanDerWaalsContact C-N 3.34Å; F125-Q127 PolarHBondContact O-N 3.08Å; F125-Q128 PolarHBondContact O-N 3.49Å; F125-R129 VanDerWaalsContact O-CB 3.23Å; F125-R129 WeakPolarHBondContact O-CB 3.46Å; F125-R129 PolarHBondContact O-N 2.8Å
126	E	94.9	Very high	93.8	Very high	43 Å²	43	89.1 Å²	89.1	20%	0.201	46%	0.46	C	S	.	.	H	α-helix	trans	-70.6	-30	-179.3	-174.2	67.3	173.6	0	0	112.1	D122 F123 R129 R130	D122-E126 WeakPolarHBondContact O-CB 3.31Å; D122-E126 PolarHBondContact O-N 2.99Å; F123-E126 PolarHBondContact O-N 3.26Å; E126-R129 IonicContact OE1-NH1 2.67Å; E126-R129 PolarHBondContact OE1-NH1 2.97Å; E126-R129 WeakPolarHBondContact OE2-CD 3.23Å; E126-R129 IonicContact OE2-CZ 3.17Å; E126-R129 IonicContact OE2-NH1 2.76Å; E126-R129 PolarHBondContact OE2-NH1 2.89Å; E126-R130 HydrophobicContact CG-CG 4.31Å; E126-R130 VanDerWaalsContact O-CB 3.28Å; E126-R130 WeakPolarHBondContact O-CB 3.33Å; E126-R130 VanDerWaalsContact O-CG 3.24Å; E126-R130 WeakPolarHBondContact O-CG 3.21Å; E126-R130 PolarHBondContact O-N 3.37Å; E126-R130 IonicContact OE1-CZ 2.9Å; E126-R130 IonicContact OE1-NE 3.62Å; E126-R130 PolarHBondContact OE1-NE 2.99Å; E126-R130 IonicContact OE1-NH2 3.75Å; E126-R130 PolarHBondContact OE1-NH2 2.88Å
127	Q	95.1	Very high	93.9	Very high	19 Å²	19	83.1 Å²	83.1	9%	0.089	43%	0.432	C	S	.	.	H	α-helix	trans	-59.9	-53.6	170.2	177.8	-179.7	21.1	0	0	111.1	F123 M124 F125 T131 T166 F168	F123-Q127 WeakPolarHBondContact O-CB 3.35Å; F123-Q127 PolarHBondContact O-N 2.88Å; M124-Q127 PolarHBondContact O-N 3.4Å; F125-Q127 VanDerWaalsContact C-N 3.34Å; F125-Q127 PolarHBondContact O-N 3.08Å; Q127-T131 WeakPolarHBondContact O-CB 3.42Å; Q127-T131 PolarHBondContact O-N 3.01Å; Q127-T131 PolarHBondContact O-OG1 2.86Å; Q127-T166 HydrophobicContact CG-CG2 3.87Å; Q127-T166 PolarHBondContact NE2-OG1 2.73Å; Q127-F168 HydrophobicContact CB-CD2 3.87Å; Q127-F168 HydrophobicContact CB-CE2 4.03Å; Q127-F168 HydrophobicContact CG-CD2 4.04Å
128	Q	93.1	Very high	93.9	Very high	39 Å²	39	77.8 Å²	77.8	18%	0.182	40%	0.398	C	S	.	.	H	α-helix	trans	-66.2	-43.8	179.3	-66.1	-54.2	-39.8	0	0	111.6	M124 F125 R130 T131 F132 A138	M124-Q128 WeakPolarHBondContact O-CG 3.25Å; M124-Q128 PolarHBondContact O-N 3.14Å; F125-Q128 PolarHBondContact O-N 3.49Å; Q128-R130 PolarHBondContact O-N 2.92Å; Q128-T131 PolarHBondContact O-N 3.31Å; Q128-F132 PolarHBondContact O-N 2.86Å; Q128-A138 HydrophobicContact CB-CB 4.19Å
129	R	94.9	Very high	93.8	Very high	145 Å²	145	77.5 Å²	77.5	55%	0.547	39%	0.385	S	S	.	.	H	α-helix	trans	-58	-44.4	176.7	178.5	174.7	170.7	-101.2	-3.1	112.8	F125 E126 A133	F125-R129 VanDerWaalsContact O-CB 3.23Å; F125-R129 WeakPolarHBondContact O-CB 3.46Å; F125-R129 PolarHBondContact O-N 2.8Å; E126-R129 IonicContact OE1-NH1 2.67Å; E126-R129 PolarHBondContact OE1-NH1 2.97Å; E126-R129 WeakPolarHBondContact OE2-CD 3.23Å; E126-R129 IonicContact OE2-CZ 3.17Å; E126-R129 IonicContact OE2-NH1 2.76Å; E126-R129 PolarHBondContact OE2-NH1 2.89Å; R129-A133 WeakPolarHBondContact O-CB 3.48Å; R129-A133 PolarHBondContact O-N 3.5Å
130	R	94.1	Very high	93.6	Very high	104 Å²	104	71.9 Å²	71.9	39%	0.392	36%	0.362	S	S	.	.	H	α-helix	trans	-70.5	-36	176.4	-73	-179.5	-174.1	-178.4	9.5	112.4	E126 Q128 A133 T134 V167	E126-R130 HydrophobicContact CG-CG 4.31Å; E126-R130 VanDerWaalsContact O-CB 3.28Å; E126-R130 WeakPolarHBondContact O-CB 3.33Å; E126-R130 VanDerWaalsContact O-CG 3.24Å; E126-R130 WeakPolarHBondContact O-CG 3.21Å; E126-R130 PolarHBondContact O-N 3.37Å; E126-R130 IonicContact OE1-CZ 2.9Å; E126-R130 IonicContact OE1-NE 3.62Å; E126-R130 PolarHBondContact OE1-NE 2.99Å; E126-R130 IonicContact OE1-NH2 3.75Å; E126-R130 PolarHBondContact OE1-NH2 2.88Å; Q128-R130 PolarHBondContact O-N 2.92Å; R130-A133 PolarHBondContact O-N 3.39Å; R130-T134 VanDerWaalsContact O-CB 3.23Å; R130-T134 WeakPolarHBondContact O-CB 3.34Å; R130-T134 PolarHBondContact O-N 3.48Å; R130-T134 PolarHBondContact O-OG1 2.86Å; R130-V167 HydrophobicContact CB-CB 4.17Å; R130-V167 HydrophobicContact CB-CG1 4.46Å; R130-V167 HydrophobicContact CB-CG2 4.04Å; R130-V167 WeakPolarHBondContact O-CG2 3.25Å
131	T	93.6	Very high	93.4	Very high	1 Å²	1	72.4 Å²	72.4	1%	0.006	37%	0.37	C	S	.	.	H	α-helix	trans	-62.4	-45.1	175.9	-54.5	0	0	0	0	110.2	Q127 Q128 A133 T134 Y135 Y137 T166 V167	Q127-T131 WeakPolarHBondContact O-CB 3.42Å; Q127-T131 PolarHBondContact O-N 3.01Å; Q127-T131 PolarHBondContact O-OG1 2.86Å; Q128-T131 PolarHBondContact O-N 3.31Å; T131-A133 PolarHBondContact O-N 2.86Å; T131-T134 PolarHBondContact O-N 2.77Å; T131-Y135 HydrophobicContact CG2-CD2 3.97Å; T131-Y135 PolarHBondContact O-N 3.06Å; T131-Y137 CarbonylContact C-O 3.58Å; T131-Y137 HydrophobicContact CG2-CD2 4.16Å; T131-Y137 HydrophobicContact CG2-CE2 3.78Å; T131-Y137 WeakPolarHBondContact CG2-O 3.49Å; T131-T166 HydrophobicContact CG2-CG2 4.49Å; T131-T166 WeakPolarHBondContact OG1-CA 3.46Å; T131-T166 WeakPolarHBondContact OG1-CB 3.44Å; T131-V167 PolarHBondContact OG1-N 3.12Å
132	F	95	Very high	93.1	Very high	99 Å²	99	70.4 Å²	70.4	43%	0.434	37%	0.365	S	S	.	.	H	α-helix	trans	-61.5	-46.5	173.5	-164.6	-89.2	0	0	0	112.4	Q128 T134 G136 Y137 A138	Q128-F132 PolarHBondContact O-N 2.86Å; F132-T134 VanDerWaalsContact C-N 3.27Å; F132-T134 PolarHBondContact O-N 3.13Å; F132-G136 WeakPolarHBondContact O-CA 3.49Å; F132-G136 PolarHBondContact O-N 2.69Å; F132-Y137 WeakPolarHBondContact CA-O 3.48Å; F132-Y137 PolarHBondContact N-O 2.81Å; F132-A138 HydrophobicContact CB-CB 4.07Å; F132-A138 HydrophobicContact CD2-CB 4.16Å
133	A	94.1	Very high	92.5	Very high	84 Å²	84	71.4 Å²	71.4	69%	0.694	37%	0.369	S	S	*	.	H	α-helix	trans	-68.6	-21.3	-179.8	0	0	0	0	0	114.4	R129 R130 T131	R129-A133 WeakPolarHBondContact O-CB 3.48Å; R129-A133 PolarHBondContact O-N 3.5Å; R130-A133 PolarHBondContact O-N 3.39Å; T131-A133 PolarHBondContact O-N 2.86Å
134	T	91.6	Very high	91.8	Very high	85 Å²	85	70.3 Å²	70.3	52%	0.521	37%	0.368	S	S	.	.	H	α-helix	trans	-101.3	-38.8	-176.1	-53	0	0	0	0	112.7	R130 T131 F132 V167	R130-T134 VanDerWaalsContact O-CB 3.23Å; R130-T134 WeakPolarHBondContact O-CB 3.34Å; R130-T134 PolarHBondContact O-N 3.48Å; R130-T134 PolarHBondContact O-OG1 2.86Å; T131-T134 PolarHBondContact O-N 2.77Å; F132-T134 VanDerWaalsContact C-N 3.27Å; F132-T134 PolarHBondContact O-N 3.13Å; T134-V167 HydrophobicContact CG2-CG2 4.09Å; T134-V167 WeakPolarHBondContact OG1-CG2 3.4Å
135	Y	89.3	Confident	90.2	Very high	78 Å²	78	72.4 Å²	72.4	31%	0.306	38%	0.381	S	S	.	.	H	α-helix	trans	-121.1	-5	-172.8	-55.9	-64.9	0	0	0	114.1	T131 Y137 L165 V167	T131-Y135 HydrophobicContact CG2-CD2 3.97Å; T131-Y135 PolarHBondContact O-N 3.06Å; Y135-Y137 HydrophobicContact CG-CE1 4.21Å; Y135-Y137 WeakPolarHBondContact O-CD1 3.47Å; Y135-L165 HydrophobicContact CE2-CD2 4.34Å; Y135-V167 HydrophobicContact CD2-CG2 4.21Å; Y135-V167 HydrophobicContact CE2-CG2 3.76Å
136	G	92	Very high	88.9	Confident	26 Å²	26	74.3 Å²	74.3	27%	0.268	39%	0.392	S	S	.	.	S	Bend	trans	82	5.4	177.4	0	0	0	0	0	115.7	F132 G154 S155	F132-G136 WeakPolarHBondContact O-CA 3.49Å; F132-G136 PolarHBondContact O-N 2.69Å; G136-G154 CarbonylContact O-C 3.52Å; G136-G154 WeakPolarHBondContact O-CA 3.41Å; G136-S155 PolarHBondContact O-N 2.9Å
137	Y	93.8	Very high	87.5	Confident	1 Å²	1	82 Å²	82	0%	0.004	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	157.3	178.5	67.7	-95	0	0	0	113.4	T131 F132 Y135 Y152 I153 E158 A159 N162 L165	T131-Y137 CarbonylContact C-O 3.58Å; T131-Y137 HydrophobicContact CG2-CD2 4.16Å; T131-Y137 HydrophobicContact CG2-CE2 3.78Å; T131-Y137 WeakPolarHBondContact CG2-O 3.49Å; F132-Y137 WeakPolarHBondContact CA-O 3.48Å; F132-Y137 PolarHBondContact N-O 2.81Å; Y135-Y137 HydrophobicContact CG-CE1 4.21Å; Y135-Y137 WeakPolarHBondContact O-CD1 3.47Å; Y137-Y152 HydrophobicContact CD2-CD1 4.22Å; Y137-I153 VanDerWaalsContact CA-O 3.27Å; Y137-I153 WeakPolarHBondContact CA-O 3.24Å; Y137-E158 HydrophobicContact CD1-CB 4.29Å; Y137-E158 WeakPolarHBondContact CE1-O 3.32Å; Y137-A159 HydrophobicContact CD1-CB 3.92Å; Y137-A159 HydrophobicContact CD2-CB 3.56Å; Y137-A159 HydrophobicContact CE1-CB 4.33Å; Y137-A159 HydrophobicContact CE2-CB 4.02Å; Y137-A159 HydrophobicContact CG-CB 3.52Å; Y137-N162 HydrophobicContact CE1-CB 4.38Å; Y137-N162 WeakPolarHBondContact OH-CB 3.28Å; Y137-L165 PolarHBondContact OH-N 3.41Å; Y137-L165 PolarHBondContact OH-O 2.67Å
138	A	93.5	Very high	86.3	Confident	8 Å²	8	85.3 Å²	85.3	7%	0.066	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	169	171.6	0	0	0	0	0	110.1	Q128 F132 Y152 I153	Q128-A138 HydrophobicContact CB-CB 4.19Å; F132-A138 HydrophobicContact CB-CB 4.07Å; F132-A138 HydrophobicContact CD2-CB 4.16Å; A138-Y152 CarbonylContact O-C 3.6Å; A138-Y152 WeakPolarHBondContact O-CA 3.29Å; A138-I153 PolarHBondContact N-O 3.49Å; A138-I153 VanDerWaalsContact N-O 3.11Å; A138-I153 WeakPolarHBondContact O-CG1 3.47Å; A138-I153 PolarHBondContact O-N 3.28Å
139	L	91.4	Very high	85.4	Confident	69 Å²	69	88.1 Å²	88.1	36%	0.361	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	145.1	163.9	-78.1	80.7	0	0	0	109.8	P141 Y152	L139-P141 WeakPolarHBondContact O-CD 3.23Å; L139-Y152 HydrophobicContact CD1-CD1 4.05Å; L139-Y152 HydrophobicContact CD1-CE1 3.52Å; L139-Y152 HydrophobicContact CG-CD1 4.33Å; L139-Y152 HydrophobicContact CG-CE1 4.11Å
140	D	90.1	Very high	84.6	Confident	69 Å²	69	85.9 Å²	85.9	37%	0.369	49%	0.485	S	S	.	.			trans	-66.7	124.5	173.2	-165.1	-5.5	0	0	0	110.9	S142 K151 I153	D140-S142 VanDerWaalsContact C-N 3.26Å; D140-S142 VanDerWaalsContact OD1-CB 3.31Å; D140-S142 WeakPolarHBondContact OD1-CB 3.3Å; D140-S142 PolarHBondContact OD1-N 3.38Å; D140-S142 PolarHBondContact OD1-OG 3.19Å; D140-S142 PolarHBondContact OD2-OG 2.87Å; D140-K151 PolarHBondContact N-O 3.18Å; D140-I153 HydrophobicContact CB-CD1 4.29Å; D140-I153 HydrophobicContact CB-CG1 4.34Å; D140-I153 HydrophobicContact CB-CG2 3.84Å
141	P	89.9	Confident	84.3	Confident	97 Å²	97	87.3 Å²	87.3	63%	0.63	49%	0.494	S	S	*	.			trans	-84.2	6.6	172.8	36.1	-37.7	0	0	0	113.4	L139	L139-P141 WeakPolarHBondContact O-CD 3.23Å
142	S	88.6	Confident	84.1	Confident	63 Å²	63	90.3 Å²	90.3	44%	0.441	51%	0.506	S	S	.	.			trans	-63.3	146.7	178	69.3	0	0	0	0	112.6	D140	D140-S142 VanDerWaalsContact C-N 3.26Å; D140-S142 VanDerWaalsContact OD1-CB 3.31Å; D140-S142 WeakPolarHBondContact OD1-CB 3.3Å; D140-S142 PolarHBondContact OD1-N 3.38Å; D140-S142 PolarHBondContact OD1-OG 3.19Å; D140-S142 PolarHBondContact OD2-OG 2.87Å
143	L	83.9	Confident	83.9	Confident	159 Å²	159	88.5 Å²	88.5	83%	0.832	50%	0.5	S	S	*	.			trans	-115.1	92.9	173.8	-61.2	177.9	0	0	0	107.4
144	D	79.8	Confident	83.7	Confident	80 Å²	80	86.9 Å²	86.9	43%	0.428	49%	0.492	S	S	.	.			trans	-91.4	137.8	175.2	52.6	-2.3	0	0	0	112.2	H146 V148	D144-H146 PolarHBondContact O-N 3.37Å; D144-H146 VanDerWaalsContact O-N 3.12Å; D144-V148 WeakPolarHBondContact OD2-CB 3.43Å; D144-V148 WeakPolarHBondContact OD2-CG2 3.41Å
145	N	61.1	Low	83.7	Confident	136 Å²	136	84.7 Å²	84.7	73%	0.727	48%	0.48	S	S	*	.	S	Bend	trans	-68	-9.2	178.8	-74	3.7	0	0	0	113.3
146	H	66.9	Low	83.8	Confident	156 Å²	156	84.2 Å²	84.2	72%	0.722	49%	0.485	S	S	*	.	S	Bend	trans	-112.7	118.8	174.3	-56.6	90.9	0	0	0	107.1	D144 V148	D144-H146 PolarHBondContact O-N 3.37Å; D144-H146 VanDerWaalsContact O-N 3.12Å; H146-V148 PolarHBondContact O-N 2.76Å
147	Q	66.6	Low	83.8	Confident	203 Å²	203	91 Å²	91	95%	0.949	51%	0.51	S	S	*	.			trans	-63.2	92.1	-173.9	-67.3	179.8	-6.7	0	0	112.3
148	V	68.4	Low	83.5	Confident	89 Å²	89	95 Å²	95	54%	0.539	53%	0.529	S	S	.	.			trans	-84	134.9	166.1	-178.9	0	0	0	0	108.1	D144 H146	D144-V148 WeakPolarHBondContact OD2-CB 3.43Å; D144-V148 WeakPolarHBondContact OD2-CG2 3.41Å; H146-V148 PolarHBondContact O-N 2.76Å
149	S	75.1	Confident	83.2	Confident	99 Å²	99	94.7 Å²	94.7	69%	0.692	53%	0.525	S	S	*	.			trans	-57.4	141.7	177.6	59.4	0	0	0	0	111.4	K151	S149-K151 PolarHBondContact O-N 2.73Å
150	A	77.7	Confident	83.1	Confident	98 Å²	98	97.3 Å²	97.3	81%	0.81	54%	0.536	S	S	*	.			trans	-44.4	122.7	178.2	0	0	0	0	0	112.5
151	K	87.5	Confident	83	Confident	133 Å²	133	101.9 Å²	101.9	58%	0.578	55%	0.553	S	S	*	*			trans	-128.7	141.1	-168.4	-171.6	174.2	-179.5	-179.8	0	111.4	D140 S149	D140-K151 PolarHBondContact N-O 3.18Å; S149-K151 PolarHBondContact O-N 2.73Å
152	Y	90.5	Very high	82.9	Confident	64 Å²	64	100.5 Å²	100.5	25%	0.251	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	139.7	169.9	-63.6	-68.9	0	0	0	111.4	Y137 A138 L139 A159 G164	Y137-Y152 HydrophobicContact CD2-CD1 4.22Å; A138-Y152 CarbonylContact O-C 3.6Å; A138-Y152 WeakPolarHBondContact O-CA 3.29Å; L139-Y152 HydrophobicContact CD1-CD1 4.05Å; L139-Y152 HydrophobicContact CD1-CE1 3.52Å; L139-Y152 HydrophobicContact CG-CD1 4.33Å; L139-Y152 HydrophobicContact CG-CE1 4.11Å; Y152-A159 HydrophobicContact CD1-CB 4.18Å; Y152-A159 HydrophobicContact CD2-CB 3.96Å; Y152-A159 HydrophobicContact CG-CB 3.77Å; Y152-G164 WeakPolarHBondContact OH-CA 3.44Å
153	I	89.9	Confident	82.9	Confident	62 Å²	62	106.1 Å²	106.1	32%	0.318	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.2	153.9	174.5	55.3	164.9	0	0	0	110.7	Y137 A138 D140	Y137-I153 VanDerWaalsContact CA-O 3.27Å; Y137-I153 WeakPolarHBondContact CA-O 3.24Å; A138-I153 PolarHBondContact N-O 3.49Å; A138-I153 VanDerWaalsContact N-O 3.11Å; A138-I153 WeakPolarHBondContact O-CG1 3.47Å; A138-I153 PolarHBondContact O-N 3.28Å; D140-I153 HydrophobicContact CB-CD1 4.29Å; D140-I153 HydrophobicContact CB-CG1 4.34Å; D140-I153 HydrophobicContact CB-CG2 3.84Å
154	G	90.9	Very high	83	Confident	50 Å²	50	99 Å²	99	52%	0.515	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	91.8	-134.1	-168.4	0	0	0	0	0	111.3	G136 V156	G136-G154 CarbonylContact O-C 3.52Å; G136-G154 WeakPolarHBondContact O-CA 3.41Å; G154-V156 PolarHBondContact O-N 2.88Å
155	S	91.6	Very high	83.5	Confident	39 Å²	39	96.9 Å²	96.9	27%	0.273	51%	0.513	S	S	.	.			trans	-84.1	86.7	-179.9	-168.8	0	0	0	0	111.8	G136 E157 E158 A159	G136-S155 PolarHBondContact O-N 2.9Å; S155-E157 VanDerWaalsContact C-N 3.29Å; S155-E157 PolarHBondContact O-N 2.92Å; S155-E158 WeakPolarHBondContact CB-OE2 3.3Å; S155-E158 PolarHBondContact O-N 3.24Å; S155-E158 VanDerWaalsContact O-N 3.16Å; S155-E158 PolarHBondContact OG-OE2 3.14Å; S155-A159 PolarHBondContact O-N 2.9Å; S155-A159 VanDerWaalsContact O-N 3.1Å
156	V	91.6	Very high	84.9	Confident	67 Å²	67	90.8 Å²	90.8	41%	0.406	48%	0.48	S	S	.	.	H	α-helix	trans	-64.2	-32.3	-176.7	-173.7	0	0	0	0	112.2	G154 E158 A159 E160	G154-V156 PolarHBondContact O-N 2.88Å; V156-E158 PolarHBondContact O-N 3.42Å; V156-A159 WeakPolarHBondContact O-CB 2.96Å; V156-A159 PolarHBondContact O-N 2.56Å; V156-E160 HydrophobicContact CG1-CG 4.48Å; V156-E160 PolarHBondContact O-N 3.06Å
157	E	91	Very high	86	Confident	170 Å²	170	85.8 Å²	85.8	79%	0.794	46%	0.461	S	S	*	.	H	α-helix	trans	-60.5	-36.4	175.4	-62.3	-173.2	-177.3	0	0	112.2	S155 K161	S155-E157 VanDerWaalsContact C-N 3.29Å; S155-E157 PolarHBondContact O-N 2.92Å; E157-K161 WeakPolarHBondContact O-CB 3.14Å; E157-K161 PolarHBondContact O-N 3.18Å; E157-K161 VanDerWaalsContact O-N 3.14Å
158	E	87.4	Confident	87.2	Confident	85 Å²	85	80.6 Å²	80.6	40%	0.397	44%	0.435	S	S	.	.	H	α-helix	trans	-82.5	-24.9	178.7	-72.5	161.1	153.7	0	0	112.1	Y137 S155 V156 N162	Y137-E158 HydrophobicContact CD1-CB 4.29Å; Y137-E158 WeakPolarHBondContact CE1-O 3.32Å; S155-E158 WeakPolarHBondContact CB-OE2 3.3Å; S155-E158 PolarHBondContact O-N 3.24Å; S155-E158 VanDerWaalsContact O-N 3.16Å; S155-E158 PolarHBondContact OG-OE2 3.14Å; V156-E158 PolarHBondContact O-N 3.42Å; E158-N162 VanDerWaalsContact O-CB 3.3Å; E158-N162 WeakPolarHBondContact O-CB 3.31Å; E158-N162 VanDerWaalsContact O-CG 3.31Å; E158-N162 PolarHBondContact O-N 2.66Å; E158-N162 VanDerWaalsContact O-N 3.16Å; E158-N162 PolarHBondContact O-ND2 3.34Å
159	A	88.1	Confident	88.2	Confident	0 Å²	0	80.5 Å²	80.5	0%	0	43%	0.429	C	S	.	.	H	α-helix	trans	-63.8	-53.9	169.1	0	0	0	0	0	111.3	Y137 Y152 S155 V156 N162 Q163 G164	Y137-A159 HydrophobicContact CD1-CB 3.92Å; Y137-A159 HydrophobicContact CD2-CB 3.56Å; Y137-A159 HydrophobicContact CE1-CB 4.33Å; Y137-A159 HydrophobicContact CE2-CB 4.02Å; Y137-A159 HydrophobicContact CG-CB 3.52Å; Y152-A159 HydrophobicContact CD1-CB 4.18Å; Y152-A159 HydrophobicContact CD2-CB 3.96Å; Y152-A159 HydrophobicContact CG-CB 3.77Å; S155-A159 PolarHBondContact O-N 2.9Å; S155-A159 VanDerWaalsContact O-N 3.1Å; V156-A159 WeakPolarHBondContact O-CB 2.96Å; V156-A159 PolarHBondContact O-N 2.56Å; A159-N162 CarbonylContact O-C 3.59Å; A159-N162 PolarHBondContact O-N 2.87Å; A159-Q163 PolarHBondContact O-N 2.78Å; A159-G164 PolarHBondContact O-N 3.05Å
160	E	88.4	Confident	88.7	Confident	125 Å²	125	82.9 Å²	82.9	58%	0.584	44%	0.439	S	S	*	.	H	α-helix	trans	-64	-43.7	179.7	-66.2	-58.6	150.7	0	0	111.9	V156 N162 Q163	V156-E160 HydrophobicContact CG1-CG 4.48Å; V156-E160 PolarHBondContact O-N 3.06Å; E160-N162 VanDerWaalsContact C-N 3.25Å; E160-N162 PolarHBondContact O-N 2.9Å; E160-Q163 PolarHBondContact O-N 2.67Å
161	K	89.1	Confident	88.7	Confident	165 Å²	165	79.5 Å²	79.5	72%	0.717	42%	0.415	S	S	*	.	H	α-helix	trans	-59.8	-33.4	177.3	178.6	-179.4	177.1	-176.3	0	113.4	E157	E157-K161 WeakPolarHBondContact O-CB 3.14Å; E157-K161 PolarHBondContact O-N 3.18Å; E157-K161 VanDerWaalsContact O-N 3.14Å
162	N	87.4	Confident	87.9	Confident	68 Å²	68	82 Å²	82	36%	0.364	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	6.9	177.5	-63.3	-45.1	0	0	0	112.9	Y137 E158 A159 E160 G164 L165	Y137-N162 HydrophobicContact CE1-CB 4.38Å; Y137-N162 WeakPolarHBondContact OH-CB 3.28Å; E158-N162 VanDerWaalsContact O-CB 3.3Å; E158-N162 WeakPolarHBondContact O-CB 3.31Å; E158-N162 VanDerWaalsContact O-CG 3.31Å; E158-N162 PolarHBondContact O-N 2.66Å; E158-N162 VanDerWaalsContact O-N 3.16Å; E158-N162 PolarHBondContact O-ND2 3.34Å; A159-N162 CarbonylContact O-C 3.59Å; A159-N162 PolarHBondContact O-N 2.87Å; E160-N162 VanDerWaalsContact C-N 3.25Å; E160-N162 PolarHBondContact O-N 2.9Å; N162-G164 PolarHBondContact O-N 3.06Å; N162-L165 VanDerWaalsContact O-CB 3.3Å; N162-L165 WeakPolarHBondContact O-CB 3.43Å; N162-L165 PolarHBondContact O-N 3.03Å
163	Q	87.6	Confident	86.5	Confident	180 Å²	180	88.3 Å²	88.3	84%	0.841	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	34.3	179.8	-57.6	177	-16.8	0	0	114	A159 E160 L165	A159-Q163 PolarHBondContact O-N 2.78Å; E160-Q163 PolarHBondContact O-N 2.67Å; Q163-L165 VanDerWaalsContact C-N 3.3Å; Q163-L165 PolarHBondContact O-N 3.02Å
164	G	85.9	Confident	85.1	Confident	10 Å²	10	94.9 Å²	94.9	10%	0.103	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	10	179	0	0	0	0	0	115.9	Y152 A159 N162 T166	Y152-G164 WeakPolarHBondContact OH-CA 3.44Å; A159-G164 PolarHBondContact O-N 3.05Å; N162-G164 PolarHBondContact O-N 3.06Å; G164-T166 PolarHBondContact O-N 3.09Å
165	L	90.6	Very high	84.1	Confident	36 Å²	36	98.4 Å²	98.4	19%	0.188	50%	0.495	C	S	.	.			trans	-55.8	129.1	-172.6	-174.5	122.4	0	0	0	114.2	Y135 Y137 N162 Q163 E169	Y135-L165 HydrophobicContact CE2-CD2 4.34Å; Y137-L165 PolarHBondContact OH-N 3.41Å; Y137-L165 PolarHBondContact OH-O 2.67Å; N162-L165 VanDerWaalsContact O-CB 3.3Å; N162-L165 WeakPolarHBondContact O-CB 3.43Å; N162-L165 PolarHBondContact O-N 3.03Å; Q163-L165 VanDerWaalsContact C-N 3.3Å; Q163-L165 PolarHBondContact O-N 3.02Å; L165-E169 WeakPolarHBondContact CA-OE2 3.24Å; L165-E169 HydrophobicContact CD1-CB 4.03Å; L165-E169 HydrophobicContact CG-CB 4.03Å
166	T	90.9	Very high	83.6	Confident	7 Å²	7	105.4 Å²	105.4	4%	0.043	52%	0.523	C	S	.	.			trans	-93.4	161.3	178.4	76.3	0	0	0	0	113.5	Q127 T131 G164 F168 E169	Q127-T166 HydrophobicContact CG-CG2 3.87Å; Q127-T166 PolarHBondContact NE2-OG1 2.73Å; T131-T166 HydrophobicContact CG2-CG2 4.49Å; T131-T166 WeakPolarHBondContact OG1-CA 3.46Å; T131-T166 WeakPolarHBondContact OG1-CB 3.44Å; G164-T166 PolarHBondContact O-N 3.09Å; T166-F168 PolarHBondContact O-N 2.82Å; T166-F168 VanDerWaalsContact O-N 3.14Å; T166-E169 PolarHBondContact N-OE2 3.48Å; T166-E169 WeakPolarHBondContact O-CB 3.45Å; T166-E169 PolarHBondContact O-N 3.15Å; T166-E169 PolarHBondContact OG1-OE1 3.01Å
167	V	90	Very high	83.3	Confident	52 Å²	52	111.1 Å²	111.1	32%	0.315	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.2	-176.7	176	0	0	0	0	113.7	R130 T131 T134 Y135	R130-V167 HydrophobicContact CB-CB 4.17Å; R130-V167 HydrophobicContact CB-CG1 4.46Å; R130-V167 HydrophobicContact CB-CG2 4.04Å; R130-V167 WeakPolarHBondContact O-CG2 3.25Å; T131-V167 PolarHBondContact OG1-N 3.12Å; T134-V167 HydrophobicContact CG2-CG2 4.09Å; T134-V167 WeakPolarHBondContact OG1-CG2 3.4Å; Y135-V167 HydrophobicContact CD2-CG2 4.21Å; Y135-V167 HydrophobicContact CE2-CG2 3.76Å
168	F	91.4	Very high	83.1	Confident	93 Å²	93	108.8 Å²	108.8	41%	0.408	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-10.1	177.3	-66.1	-66.4	0	0	0	113.2	F123 Q127 T166	F123-F168 HydrophobicContact CE2-CD1 4.49Å; F123-F168 AromaticContact CE2-CD2 3.87Å; F123-F168 HydrophobicContact CE2-CD2 3.87Å; F123-F168 HydrophobicContact CE2-CE2 4.03Å; F123-F168 HydrophobicContact CE2-CG 4.12Å; F123-F168 HydrophobicContact CE2-CZ 4.41Å; F123-F168 HydrophobicContact CZ-CB 4.28Å; F123-F168 AromaticContact CZ-CD2 3.88Å; F123-F168 HydrophobicContact CZ-CD2 3.88Å; F123-F168 HydrophobicContact CZ-CE2 4.44Å; F123-F168 HydrophobicContact CZ-CG 4.13Å; Q127-F168 HydrophobicContact CB-CD2 3.87Å; Q127-F168 HydrophobicContact CB-CE2 4.03Å; Q127-F168 HydrophobicContact CG-CD2 4.04Å; T166-F168 PolarHBondContact O-N 2.82Å; T166-F168 VanDerWaalsContact O-N 3.14Å
169	E	90.1	Very high	83.1	Confident	88 Å²	88	112.8 Å²	112.8	41%	0.411	54%	0.543	S	S	.	.	S	Bend	trans	-91.4	145.6	176.5	-73	146.3	-143.3	0	0	112	L165 T166 G171	L165-E169 WeakPolarHBondContact CA-OE2 3.24Å; L165-E169 HydrophobicContact CD1-CB 4.03Å; L165-E169 HydrophobicContact CG-CB 4.03Å; T166-E169 PolarHBondContact N-OE2 3.48Å; T166-E169 WeakPolarHBondContact O-CB 3.45Å; T166-E169 PolarHBondContact O-N 3.15Å; T166-E169 PolarHBondContact OG1-OE1 3.01Å; E169-G171 PolarHBondContact O-N 3.15Å; E169-G171 VanDerWaalsContact O-N 3.08Å
170	T	85.8	Confident	83.2	Confident	148 Å²	148	117.9 Å²	117.9	91%	0.908	57%	0.565	S	S	*	*			trans	-82.8	87.3	178.5	52	0	0	0	0	111.3
171	G	77.3	Confident	83.1	Confident	28 Å²	28	117 Å²	117	29%	0.289	56%	0.559	S	S	.	*			trans	-80.6	172.1	-179.4	0	0	0	0	0	116.9	E169 K173	E169-G171 PolarHBondContact O-N 3.15Å; E169-G171 VanDerWaalsContact O-N 3.08Å; G171-K173 PolarHBondContact O-N 3.16Å
172	Q	69.4	Low	82.9	Confident	184 Å²	184	117.2 Å²	117.2	86%	0.86	56%	0.56	S	S	*	*			trans	-66.1	82.1	-179.7	-157.3	87.2	-27.8	0	0	111.8	K174	Q172-K174 PolarHBondContact O-N 3.15Å
173	K	62.3	Low	82.8	Confident	198 Å²	198	117.8 Å²	117.8	86%	0.861	56%	0.561	S	S	*	*			trans	-64.7	97.5	-179.1	-80.4	-177.3	177	169.8	0	112.1	G171	G171-K173 PolarHBondContact O-N 3.16Å
174	K	60.8	Low	82.6	Confident	199 Å²	199	113.8 Å²	113.8	87%	0.865	55%	0.545	S	S	*	.			trans	-117.8	28.6	-176.3	-145.8	-178.5	-174.2	-177.1	0	114	Q172	Q172-K174 PolarHBondContact O-N 3.15Å
175	T	69.8	Low	82.6	Confident	124 Å²	124	117.5 Å²	117.5	76%	0.761	56%	0.563	S	S	*	*	S	Bend	trans	-123	147.9	176.3	-167.1	0	0	0	0	111.5
176	E	80.6	Confident	82.3	Confident	186 Å²	186	119.3 Å²	119.3	87%	0.869	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-71.7	135.2	177.5	-63.3	-165.5	157.2	0	0	110.9	R178	E176-R178 PolarHBondContact O-N 2.97Å
177	K	84.6	Confident	82.2	Confident	187 Å²	187	123.6 Å²	123.6	81%	0.813	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-78.5	123.4	177	-64.6	177	-177.1	172.4	0	109.5	K179	K177-K179 PolarHBondContact O-N 3.42Å
178	R	87.2	Confident	81.9	Confident	122 Å²	122	125 Å²	125	46%	0.46	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-51.7	131.7	168.8	-74.6	-179.9	68.7	-157.7	-5.6	110	E176 Y199 D201 E202	E176-R178 PolarHBondContact O-N 2.97Å; R178-Y199 HydrophobicContact CB-CD1 3.55Å; R178-Y199 HydrophobicContact CB-CE1 3.65Å; R178-Y199 HydrophobicContact CB-CG 4.41Å; R178-D201 IonicContact CZ-OD1 3.62Å; R178-D201 IonicContact CZ-OD2 3.43Å; R178-D201 IonicContact NE-OD1 2.82Å; R178-D201 PolarHBondContact NE-OD1 3.41Å; R178-D201 IonicContact NE-OD2 3.35Å; R178-D201 PolarHBondContact NE-OD2 3.37Å; R178-D201 IonicContact NH2-OD1 3.46Å; R178-D201 PolarHBondContact NH2-OD1 3.27Å; R178-D201 IonicContact NH2-OD2 2.71Å; R178-E202 IonicContact CZ-OE2 3.9Å; R178-E202 IonicContact NH1-OE2 3.2Å; R178-E202 IonicContact NH2-OE2 2.68Å; R178-E202 PolarHBondContact NH2-OE2 3.06Å
179	K	88.6	Confident	81.4	Confident	169 Å²	169	128.1 Å²	128.1	74%	0.735	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-77	127	-177.4	-67.7	179.2	-178.4	174	0	109.8	K177 Y199 V200	K177-K179 PolarHBondContact O-N 3.42Å; K179-Y199 WeakPolarHBondContact O-CA 3.36Å; K179-V200 HydrophobicContact CB-CG2 4.44Å; K179-V200 PolarHBondContact O-N 3.21Å
180	K	88.8	Confident	81	Confident	106 Å²	106	131.6 Å²	131.6	46%	0.461	66%	0.659	S	S	.	*	B	Isolated β-bridge	trans	-97.6	156.7	168.9	-65.8	-175.3	171.9	-160.7	0	110.1	K198 Y199	K180-K198 WeakPolarHBondContact CA-O 3.3Å; K180-Y199 HydrophobicContact CD-CD1 4.37Å; K180-Y199 HydrophobicContact CD-CE1 4.03Å; K180-Y199 WeakPolarHBondContact CE-OH 3.48Å; K180-Y199 HydrophobicContact CG-CD1 3.43Å; K180-Y199 VanDerWaalsContact CG-CD1 3.43Å; K180-Y199 HydrophobicContact CG-CE1 3.51Å; K180-Y199 HydrophobicContact CG-CG 4.22Å
181	F	86.7	Confident	80.9	Confident	107 Å²	107	125.6 Å²	125.6	47%	0.469	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-57.4	154.9	155.4	-63.9	-76.3	0	0	0	109.2	L193 A197 K198 V200	F181-L193 HydrophobicContact CB-CD1 3.65Å; F181-L193 HydrophobicContact CG-CD1 4.38Å; F181-A197 HydrophobicContact CB-CB 4.33Å; F181-A197 WeakPolarHBondContact O-CB 3.46Å; F181-K198 HydrophobicContact CD2-CB 4.46Å; F181-K198 WeakPolarHBondContact CD2-O 3.28Å; F181-K198 PolarHBondContact N-O 3.27Å; F181-V200 HydrophobicContact CD1-CG2 4.15Å; F181-V200 HydrophobicContact CD2-CG2 4.15Å; F181-V200 HydrophobicContact CE1-CG1 4.5Å; F181-V200 HydrophobicContact CE1-CG2 4.02Å; F181-V200 HydrophobicContact CE2-CB 4.43Å; F181-V200 HydrophobicContact CE2-CG2 4.02Å; F181-V200 HydrophobicContact CG-CG2 4.21Å; F181-V200 HydrophobicContact CZ-CB 4.3Å; F181-V200 HydrophobicContact CZ-CG1 4.18Å; F181-V200 HydrophobicContact CZ-CG2 3.95Å
182	K	84.4	Confident	81.5	Confident	170 Å²	170	128.3 Å²	128.3	74%	0.739	63%	0.631	S	S	*	*			trans	-145.6	83.1	-179.6	-170.4	-171.7	175.9	-169.7	0	109.5
183	E	85.5	Confident	82.2	Confident	80 Å²	80	122.5 Å²	122.5	37%	0.374	61%	0.605	S	S	.	*			trans	-116.9	106.1	168.2	-167	52.6	-92.8	0	0	108.5	D185 G191 L193 G194	E183-D185 PolarHBondContact OE1-N 2.84Å; E183-G191 WeakPolarHBondContact CB-O 3.24Å; E183-G191 VanDerWaalsContact CG-O 3.24Å; E183-G191 WeakPolarHBondContact CG-O 3.38Å; E183-L193 HydrophobicContact CB-CB 4.5Å; E183-L193 HydrophobicContact CB-CD1 4.47Å; E183-L193 PolarHBondContact O-N 2.91Å; E183-L193 VanDerWaalsContact O-N 3.09Å; E183-G194 PolarHBondContact O-N 2.69Å
184	N	84	Confident	83.4	Confident	96 Å²	96	113.7 Å²	113.7	51%	0.513	57%	0.571	S	S	.	*			trans	-113.5	-6.2	-171	-73.6	10.9	0	0	0	112.1
185	D	86.1	Confident	84.8	Confident	88 Å²	88	109.5 Å²	109.5	47%	0.471	56%	0.564	S	S	.	*			trans	-81.7	116.7	174.7	-173.1	-3.6	0	0	0	109.8	E183 S187	E183-D185 PolarHBondContact OE1-N 2.84Å; D185-S187 PolarHBondContact O-N 2.72Å; D185-S187 WeakPolarHBondContact OD1-CB 3.44Å; D185-S187 PolarHBondContact OD1-N 3.32Å; D185-S187 PolarHBondContact OD1-OG 3.28Å
186	A	83.8	Confident	85.5	Confident	74 Å²	74	113 Å²	113	61%	0.612	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-2.8	178.9	0	0	0	0	0	113.3	N188 F192	A186-N188 VanDerWaalsContact C-N 3.27Å; A186-N188 PolarHBondContact O-N 2.91Å; A186-F192 HydrophobicContact CB-CD2 4.12Å; A186-F192 HydrophobicContact CB-CE2 4.22Å
187	S	88	Confident	85.9	Confident	96 Å²	96	104.5 Å²	104.5	67%	0.671	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-24.1	177	-51	0	0	0	0	113.1	D185	D185-S187 PolarHBondContact O-N 2.72Å; D185-S187 WeakPolarHBondContact OD1-CB 3.44Å; D185-S187 PolarHBondContact OD1-N 3.32Å; D185-S187 PolarHBondContact OD1-OG 3.28Å
188	N	83.7	Confident	86.2	Confident	82 Å²	82	100.6 Å²	100.6	44%	0.439	51%	0.508	S	S	.	.			trans	-94.9	101.1	177.8	-172.6	-5.2	0	0	0	110.8	A186 D190 G191 F192	A186-N188 VanDerWaalsContact C-N 3.27Å; A186-N188 PolarHBondContact O-N 2.91Å; N188-D190 VanDerWaalsContact C-N 3.33Å; N188-D190 PolarHBondContact O-N 2.91Å; N188-G191 PolarHBondContact O-N 3.48Å; N188-G191 PolarHBondContact OD1-N 3.18Å; N188-F192 WeakPolarHBondContact O-CB 3.16Å; N188-F192 PolarHBondContact O-N 3.33Å
189	I	81.6	Confident	86.4	Confident	158 Å²	158	98.4 Å²	98.4	81%	0.81	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-43.4	-172	-62	156.7	0	0	0	112.7
190	D	83.1	Confident	86.4	Confident	161 Å²	161	94.3 Å²	94.3	86%	0.861	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-12.2	-177.3	-60.2	-38.9	0	0	0	113.1	N188	N188-D190 VanDerWaalsContact C-N 3.33Å; N188-D190 PolarHBondContact O-N 2.91Å
191	G	82.1	Confident	86.3	Confident	22 Å²	22	94 Å²	94	23%	0.227	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-16.8	-174.8	0	0	0	0	0	115.5	E183 N188 L193	E183-G191 WeakPolarHBondContact CB-O 3.24Å; E183-G191 VanDerWaalsContact CG-O 3.24Å; E183-G191 WeakPolarHBondContact CG-O 3.38Å; N188-G191 PolarHBondContact O-N 3.48Å; N188-G191 PolarHBondContact OD1-N 3.18Å; G191-L193 PolarHBondContact O-N 3.41Å
192	F	89.5	Confident	86.3	Confident	85 Å²	85	94.2 Å²	94.2	37%	0.373	50%	0.495	S	S	.	.			trans	-65	120.7	-178.5	175.8	-104.2	0	0	0	111.9	A186 N188 W196	A186-F192 HydrophobicContact CB-CD2 4.12Å; A186-F192 HydrophobicContact CB-CE2 4.22Å; N188-F192 WeakPolarHBondContact O-CB 3.16Å; N188-F192 PolarHBondContact O-N 3.33Å; F192-W196 HydrophobicContact CE1-CZ3 4.4Å
193	L	85.3	Confident	86.3	Confident	62 Å²	62	95 Å²	95	33%	0.325	50%	0.499	S	S	.	.			trans	-112.2	-37.2	-179.5	-69.6	170.5	0	0	0	112.6	F181 E183 G191 W196 A197	F181-L193 HydrophobicContact CB-CD1 3.65Å; F181-L193 HydrophobicContact CG-CD1 4.38Å; E183-L193 HydrophobicContact CB-CB 4.5Å; E183-L193 HydrophobicContact CB-CD1 4.47Å; E183-L193 PolarHBondContact O-N 2.91Å; E183-L193 VanDerWaalsContact O-N 3.09Å; G191-L193 PolarHBondContact O-N 3.41Å; L193-W196 CarbonylContact O-C 3.6Å; L193-W196 WeakPolarHBondContact O-CA 3.39Å; L193-W196 WeakPolarHBondContact O-CB 3.45Å; L193-W196 PolarHBondContact O-N 2.89Å; L193-A197 HydrophobicContact CB-CB 3.86Å; L193-A197 HydrophobicContact CD1-CB 4.5Å; L193-A197 PolarHBondContact O-N 2.93Å
194	G	87.9	Confident	86.2	Confident	14 Å²	14	97 Å²	97	14%	0.144	51%	0.512	C	S	.	.	G	3₁₀ helix	trans	47.4	-129.5	178	0	0	0	0	0	113.2	E183 W196 A197	E183-G194 PolarHBondContact O-N 2.69Å; G194-W196 VanDerWaalsContact C-N 3.26Å; G194-W196 PolarHBondContact O-N 3.17Å; G194-A197 WeakPolarHBondContact O-CB 3.4Å; G194-A197 PolarHBondContact O-N 3.37Å
195	P	89.1	Confident	86.4	Confident	110 Å²	110	97.8 Å²	97.8	71%	0.714	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-63.8	-22.6	174.8	-23.5	35.1	0	0	0	115.5	A197	P195-A197 PolarHBondContact O-N 3.38Å
196	W	85.8	Confident	86.5	Confident	198 Å²	198	98.5 Å²	98.5	75%	0.75	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-81.3	2.5	179.7	-61	-89.9	0	0	0	113.6	F192 L193 G194 K198	F192-W196 HydrophobicContact CE1-CZ3 4.4Å; L193-W196 CarbonylContact O-C 3.6Å; L193-W196 WeakPolarHBondContact O-CA 3.39Å; L193-W196 WeakPolarHBondContact O-CB 3.45Å; L193-W196 PolarHBondContact O-N 2.89Å; G194-W196 VanDerWaalsContact C-N 3.26Å; G194-W196 PolarHBondContact O-N 3.17Å; W196-K198 PolarHBondContact O-N 3.08Å; W196-K198 VanDerWaalsContact O-N 3.08Å
197	A	88.9	Confident	86.8	Confident	8 Å²	8	103.1 Å²	103.1	7%	0.066	54%	0.544	C	S	.	.			trans	-59.7	113.9	177.4	0	0	0	0	0	112.2	F181 L193 G194 P195	F181-A197 HydrophobicContact CB-CB 4.33Å; F181-A197 WeakPolarHBondContact O-CB 3.46Å; L193-A197 HydrophobicContact CB-CB 3.86Å; L193-A197 HydrophobicContact CD1-CB 4.5Å; L193-A197 PolarHBondContact O-N 2.93Å; G194-A197 WeakPolarHBondContact O-CB 3.4Å; G194-A197 PolarHBondContact O-N 3.37Å; P195-A197 PolarHBondContact O-N 3.38Å
198	K	89.3	Confident	87	Confident	105 Å²	105	101.1 Å²	101.1	46%	0.457	53%	0.529	S	S	.	.			trans	-67.3	162.8	177.7	-56.3	-175.4	-173.9	-176	0	111.2	K180 F181 W196 D204	K180-K198 WeakPolarHBondContact CA-O 3.3Å; F181-K198 HydrophobicContact CD2-CB 4.46Å; F181-K198 WeakPolarHBondContact CD2-O 3.28Å; F181-K198 PolarHBondContact N-O 3.27Å; W196-K198 PolarHBondContact O-N 3.08Å; W196-K198 VanDerWaalsContact O-N 3.08Å; K198-D204 VanDerWaalsContact CD-OD1 3.32Å; K198-D204 WeakPolarHBondContact CD-OD1 3.21Å; K198-D204 WeakPolarHBondContact CE-OD1 3.41Å; K198-D204 IonicContact NZ-OD1 2.64Å; K198-D204 PolarHBondContact NZ-OD1 3.15Å; K198-D204 IonicContact NZ-OD2 2.71Å; K198-D204 PolarHBondContact NZ-OD2 3.22Å
199	Y	92	Very high	87.5	Confident	76 Å²	76	99.8 Å²	99.8	30%	0.298	53%	0.526	S	S	.	.	B	Isolated β-bridge	trans	-76	147.6	169.8	-60.4	-78.1	0	0	0	110.9	R178 K179 K180 D201 E202	R178-Y199 HydrophobicContact CB-CD1 3.55Å; R178-Y199 HydrophobicContact CB-CE1 3.65Å; R178-Y199 HydrophobicContact CB-CG 4.41Å; K179-Y199 WeakPolarHBondContact O-CA 3.36Å; K180-Y199 HydrophobicContact CD-CD1 4.37Å; K180-Y199 HydrophobicContact CD-CE1 4.03Å; K180-Y199 WeakPolarHBondContact CE-OH 3.48Å; K180-Y199 HydrophobicContact CG-CD1 3.43Å; K180-Y199 VanDerWaalsContact CG-CD1 3.43Å; K180-Y199 HydrophobicContact CG-CE1 3.51Å; K180-Y199 HydrophobicContact CG-CG 4.22Å; Y199-D201 VanDerWaalsContact C-N 3.31Å; Y199-D201 WeakPolarHBondContact CB-OD1 3.45Å; Y199-E202 PolarHBondContact O-N 2.9Å
200	V	88.5	Confident	88.1	Confident	83 Å²	83	98.7 Å²	98.7	50%	0.503	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-21.9	-175.8	-176.7	0	0	0	0	112.2	K179 F181	K179-V200 HydrophobicContact CB-CG2 4.44Å; K179-V200 PolarHBondContact O-N 3.21Å; F181-V200 HydrophobicContact CD1-CG2 4.15Å; F181-V200 HydrophobicContact CD2-CG2 4.15Å; F181-V200 HydrophobicContact CE1-CG1 4.5Å; F181-V200 HydrophobicContact CE1-CG2 4.02Å; F181-V200 HydrophobicContact CE2-CB 4.43Å; F181-V200 HydrophobicContact CE2-CG2 4.02Å; F181-V200 HydrophobicContact CG-CG2 4.21Å; F181-V200 HydrophobicContact CZ-CB 4.3Å; F181-V200 HydrophobicContact CZ-CG1 4.18Å; F181-V200 HydrophobicContact CZ-CG2 3.95Å
201	D	86.9	Confident	88.6	Confident	98 Å²	98	98.4 Å²	98.4	52%	0.524	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-7.8	177.3	55.7	1.6	0	0	0	113.4	R178 Y199	R178-D201 IonicContact CZ-OD1 3.62Å; R178-D201 IonicContact CZ-OD2 3.43Å; R178-D201 IonicContact NE-OD1 2.82Å; R178-D201 PolarHBondContact NE-OD1 3.41Å; R178-D201 IonicContact NE-OD2 3.35Å; R178-D201 PolarHBondContact NE-OD2 3.37Å; R178-D201 IonicContact NH2-OD1 3.46Å; R178-D201 PolarHBondContact NH2-OD1 3.27Å; R178-D201 IonicContact NH2-OD2 2.71Å; Y199-D201 VanDerWaalsContact C-N 3.31Å; Y199-D201 WeakPolarHBondContact CB-OD1 3.45Å
202	E	86.1	Confident	89.1	Confident	113 Å²	113	102 Å²	102	53%	0.528	52%	0.522	S	S	.	.			trans	-102.3	139.4	-173.3	-160.1	165.1	146.9	0	0	111.6	R178 Y199	R178-E202 IonicContact CZ-OE2 3.9Å; R178-E202 IonicContact NH1-OE2 3.2Å; R178-E202 IonicContact NH2-OE2 2.68Å; R178-E202 PolarHBondContact NH2-OE2 3.06Å; Y199-E202 PolarHBondContact O-N 2.9Å
203	K	85	Confident	89.3	Confident	187 Å²	187	102.3 Å²	102.3	81%	0.813	52%	0.524	S	S	*	.			trans	-112.8	132.2	-179.7	-67.2	179.4	-178.7	174.6	0	110.3	V205	K203-V205 PolarHBondContact O-N 2.92Å
204	D	83	Confident	89.8	Confident	122 Å²	122	105.3 Å²	105.3	65%	0.652	54%	0.535	S	S	*	.	S	Bend	trans	-64.7	-22.5	-177.4	-78.5	-19.8	0	0	0	115	K198	K198-D204 VanDerWaalsContact CD-OD1 3.32Å; K198-D204 WeakPolarHBondContact CD-OD1 3.21Å; K198-D204 WeakPolarHBondContact CE-OD1 3.41Å; K198-D204 IonicContact NZ-OD1 2.64Å; K198-D204 PolarHBondContact NZ-OD1 3.15Å; K198-D204 IonicContact NZ-OD2 2.71Å; K198-D204 PolarHBondContact NZ-OD2 3.22Å
205	V	88.6	Confident	90.2	Very high	111 Å²	111	110.8 Å²	110.8	67%	0.673	56%	0.557	S	S	*	*			trans	-125.6	110.9	-179.2	-70.5	0	0	0	0	111.1	K203	K203-V205 PolarHBondContact O-N 2.92Å
206	A	88.9	Confident	90.4	Very high	104 Å²	104	110 Å²	110	86%	0.86	55%	0.546	S	S	*	.			trans	-89.3	100.4	165.8	0	0	0	0	0	108.7
207	K	90.5	Very high	90.8	Very high	171 Å²	171	105.9 Å²	105.9	74%	0.743	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-87.4	135.7	165.1	-67.7	-174.3	178.6	-177.2	0	108.3
208	P	92.3	Very high	91.2	Very high	54 Å²	54	110.5 Å²	110.5	35%	0.351	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-60.6	161	170.1	22.5	-28	0	0	0	110.6	E212 Q213 L216	P208-E212 HydrophobicContact CB-CB 3.81Å; P208-Q213 HydrophobicContact CB-CG 4.45Å; P208-Q213 HydrophobicContact CG-CG 3.85Å; P208-Q213 PolarHBondContact O-NE2 3.14Å; P208-L216 HydrophobicContact CG-CD1 4.15Å
209	S	93.8	Very high	91.4	Very high	54 Å²	54	109.3 Å²	109.3	38%	0.378	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-58.6	161.8	175.9	64.9	0	0	0	0	112	E211 E212 Q213	S209-E211 PolarHBondContact O-N 3.16Å; S209-E212 VanDerWaalsContact CB-OE2 3.25Å; S209-E212 WeakPolarHBondContact CB-OE2 3.37Å; S209-E212 PolarHBondContact N-OE2 3.01Å; S209-E212 PolarHBondContact O-N 2.95Å; S209-E212 WeakPolarHBondContact OG-CB 3.42Å; S209-E212 VanDerWaalsContact OG-CD 3.28Å; S209-E212 VanDerWaalsContact OG-CG 3.23Å; S209-E212 WeakPolarHBondContact OG-CG 3.43Å; S209-E212 PolarHBondContact OG-N 2.62Å; S209-E212 PolarHBondContact OG-OE2 2.56Å; S209-Q213 WeakPolarHBondContact O-CB 3.08Å; S209-Q213 VanDerWaalsContact O-CG 3.3Å; S209-Q213 WeakPolarHBondContact O-CG 3.31Å; S209-Q213 PolarHBondContact O-N 3.48Å
210	E	93.8	Very high	91.5	Very high	135 Å²	135	108.5 Å²	108.5	63%	0.631	56%	0.56	S	S	*	*	H	α-helix	trans	-64.1	-25	179.8	-156.2	-168.4	128.9	0	0	112.5	K214	E210-K214 WeakPolarHBondContact O-CD 3.43Å; E210-K214 VanDerWaalsContact O-CG 3.31Å; E210-K214 WeakPolarHBondContact O-CG 3.35Å; E210-K214 PolarHBondContact O-N 3.18Å; E210-K214 WeakPolarHBondContact OE1-CE 3.43Å; E210-K214 IonicContact OE1-NZ 3.54Å; E210-K214 PolarHBondContact OE1-NZ 3.1Å
211	E	93.8	Very high	91.6	Very high	154 Å²	154	106.4 Å²	106.4	72%	0.72	55%	0.551	S	S	*	*	H	α-helix	trans	-74	-52.4	174.6	-62.3	-178.4	166.2	0	0	110.6	S209 Q213 K214 E215	S209-E211 PolarHBondContact O-N 3.16Å; E211-Q213 PolarHBondContact O-N 3.33Å; E211-K214 WeakPolarHBondContact O-CB 3.37Å; E211-K214 PolarHBondContact O-N 3.27Å; E211-E215 PolarHBondContact O-N 3.29Å
212	E	93.1	Very high	91.8	Very high	98 Å²	98	107.2 Å²	107.2	46%	0.458	55%	0.55	S	S	.	.	H	α-helix	trans	-58.8	-34.4	174.8	-71.1	165.1	128.1	0	0	112.4	P208 S209 K214 E215 L216	P208-E212 HydrophobicContact CB-CB 3.81Å; S209-E212 VanDerWaalsContact CB-OE2 3.25Å; S209-E212 WeakPolarHBondContact CB-OE2 3.37Å; S209-E212 PolarHBondContact N-OE2 3.01Å; S209-E212 PolarHBondContact O-N 2.95Å; S209-E212 WeakPolarHBondContact OG-CB 3.42Å; S209-E212 VanDerWaalsContact OG-CD 3.28Å; S209-E212 VanDerWaalsContact OG-CG 3.23Å; S209-E212 WeakPolarHBondContact OG-CG 3.43Å; S209-E212 PolarHBondContact OG-N 2.62Å; S209-E212 PolarHBondContact OG-OE2 2.56Å; E212-K214 VanDerWaalsContact C-N 3.34Å; E212-E215 PolarHBondContact O-N 3.16Å; E212-L216 WeakPolarHBondContact O-CB 3.47Å; E212-L216 WeakPolarHBondContact O-CG 3.37Å; E212-L216 PolarHBondContact O-N 3.03Å
213	Q	93.6	Very high	92	Very high	91 Å²	91	110.7 Å²	110.7	43%	0.425	56%	0.558	S	S	.	*	H	α-helix	trans	-62.5	-40.2	173.6	-75.5	177.1	42.9	0	0	112	P208 S209 E211 D217	P208-Q213 HydrophobicContact CB-CG 4.45Å; P208-Q213 HydrophobicContact CG-CG 3.85Å; P208-Q213 PolarHBondContact O-NE2 3.14Å; S209-Q213 WeakPolarHBondContact O-CB 3.08Å; S209-Q213 VanDerWaalsContact O-CG 3.3Å; S209-Q213 WeakPolarHBondContact O-CG 3.31Å; S209-Q213 PolarHBondContact O-N 3.48Å; E211-Q213 PolarHBondContact O-N 3.33Å; Q213-D217 WeakPolarHBondContact O-CB 3.42Å; Q213-D217 PolarHBondContact O-N 3.29Å
214	K	95.5	Very high	92.1	Very high	126 Å²	126	108.4 Å²	108.4	55%	0.548	55%	0.55	S	S	.	*	H	α-helix	trans	-71.1	-39.2	177.2	-69.5	163.5	-169.7	162.4	0	111.5	E210 E211 E212 D217 E218	E210-K214 WeakPolarHBondContact O-CD 3.43Å; E210-K214 VanDerWaalsContact O-CG 3.31Å; E210-K214 WeakPolarHBondContact O-CG 3.35Å; E210-K214 PolarHBondContact O-N 3.18Å; E210-K214 WeakPolarHBondContact OE1-CE 3.43Å; E210-K214 IonicContact OE1-NZ 3.54Å; E210-K214 PolarHBondContact OE1-NZ 3.1Å; E211-K214 WeakPolarHBondContact O-CB 3.37Å; E211-K214 PolarHBondContact O-N 3.27Å; E212-K214 VanDerWaalsContact C-N 3.34Å; K214-D217 PolarHBondContact O-N 3.11Å; K214-E218 WeakPolarHBondContact O-CB 2.96Å; K214-E218 PolarHBondContact O-N 2.7Å
215	E	94.9	Very high	92.2	Very high	128 Å²	128	110.8 Å²	110.8	60%	0.598	56%	0.555	S	S	*	*	H	α-helix	trans	-63.5	-43.8	173.3	-67.9	-165.5	157	0	0	112	E211 E212 E218 I219	E211-E215 PolarHBondContact O-N 3.29Å; E212-E215 PolarHBondContact O-N 3.16Å; E215-E218 PolarHBondContact O-N 2.85Å; E215-I219 WeakPolarHBondContact O-CB 3.3Å; E215-I219 VanDerWaalsContact O-CG1 3.24Å; E215-I219 WeakPolarHBondContact O-CG1 3.09Å; E215-I219 PolarHBondContact O-N 2.65Å
216	L	93.6	Very high	91.9	Very high	95 Å²	95	114.9 Å²	114.9	50%	0.497	56%	0.564	S	S	.	*	H	α-helix	trans	-62.1	-43.4	175.3	-74.5	170	0	0	0	111.6	P208 E212 I219 T220	P208-L216 HydrophobicContact CG-CD1 4.15Å; E212-L216 WeakPolarHBondContact O-CB 3.47Å; E212-L216 WeakPolarHBondContact O-CG 3.37Å; E212-L216 PolarHBondContact O-N 3.03Å; L216-I219 PolarHBondContact O-N 3.35Å; L216-T220 WeakPolarHBondContact O-CG2 3.26Å; L216-T220 PolarHBondContact O-N 3.18Å
217	D	95.6	Very high	91.2	Very high	111 Å²	111	112.9 Å²	112.9	59%	0.594	55%	0.554	S	S	*	*	H	α-helix	trans	-61.1	-45.8	174.8	-169.6	42.9	0	0	0	111.1	Q213 K214 I219 T220 A221	Q213-D217 WeakPolarHBondContact O-CB 3.42Å; Q213-D217 PolarHBondContact O-N 3.29Å; K214-D217 PolarHBondContact O-N 3.11Å; D217-I219 VanDerWaalsContact C-N 3.34Å; D217-I219 PolarHBondContact O-N 2.74Å; D217-T220 PolarHBondContact O-N 3.05Å; D217-T220 VanDerWaalsContact O-N 3.09Å; D217-T220 PolarHBondContact O-OG1 2.91Å; D217-A221 WeakPolarHBondContact O-CB 3.38Å; D217-A221 PolarHBondContact O-N 2.67Å
218	E	95.4	Very high	90.4	Very high	104 Å²	104	112.5 Å²	112.5	49%	0.486	55%	0.552	S	S	.	*	H	α-helix	trans	-60.1	-41.2	175.9	-156.7	-153.5	170.7	0	0	112.4	K214 E215 A221 K222	K214-E218 WeakPolarHBondContact O-CB 2.96Å; K214-E218 PolarHBondContact O-N 2.7Å; E215-E218 PolarHBondContact O-N 2.85Å; E218-A221 PolarHBondContact O-N 2.97Å; E218-K222 VanDerWaalsContact CD-CE 3.43Å; E218-K222 WeakPolarHBondContact O-CB 3.09Å; E218-K222 VanDerWaalsContact O-CG 3.29Å; E218-K222 WeakPolarHBondContact O-CG 3.1Å; E218-K222 PolarHBondContact O-N 2.89Å; E218-K222 WeakPolarHBondContact OE1-CE 3.43Å; E218-K222 IonicContact OE1-NZ 3.79Å; E218-K222 PolarHBondContact OE1-NZ 3.05Å; E218-K222 IonicContact OE2-NZ 2.65Å; E218-K222 PolarHBondContact OE2-NZ 2.73Å
219	I	94.7	Very high	89	Confident	81 Å²	81	118.7 Å²	118.7	42%	0.415	58%	0.576	S	S	.	*	H	α-helix	trans	-62.4	-42.3	174.5	-71.5	164.7	0	0	0	110.8	E215 L216 D217 K222 R223	E215-I219 WeakPolarHBondContact O-CB 3.3Å; E215-I219 VanDerWaalsContact O-CG1 3.24Å; E215-I219 WeakPolarHBondContact O-CG1 3.09Å; E215-I219 PolarHBondContact O-N 2.65Å; L216-I219 PolarHBondContact O-N 3.35Å; D217-I219 VanDerWaalsContact C-N 3.34Å; D217-I219 PolarHBondContact O-N 2.74Å; I219-K222 PolarHBondContact O-N 2.81Å; I219-R223 WeakPolarHBondContact O-CB 3.47Å; I219-R223 PolarHBondContact O-N 3.35Å
220	T	93.3	Very high	87.4	Confident	59 Å²	59	124.6 Å²	124.6	36%	0.362	60%	0.598	S	S	.	*	H	α-helix	trans	-68.7	-39.8	176.9	71	0	0	0	0	111.6	L216 D217 K222 R223 Q224	L216-T220 WeakPolarHBondContact O-CG2 3.26Å; L216-T220 PolarHBondContact O-N 3.18Å; D217-T220 PolarHBondContact O-N 3.05Å; D217-T220 VanDerWaalsContact O-N 3.09Å; D217-T220 PolarHBondContact O-OG1 2.91Å; T220-K222 PolarHBondContact O-N 3.11Å; T220-R223 CarbonylContact O-C 3.59Å; T220-R223 WeakPolarHBondContact O-CB 3.46Å; T220-R223 PolarHBondContact O-N 2.83Å; T220-R223 VanDerWaalsContact O-N 3.14Å; T220-Q224 WeakPolarHBondContact O-CG 3.44Å; T220-Q224 PolarHBondContact O-N 3.05Å
221	A	91.2	Very high	85.9	Confident	38 Å²	38	126.5 Å²	126.5	31%	0.314	61%	0.606	S	S	.	*	H	α-helix	trans	-62.3	-42.3	175.2	0	0	0	0	0	111.9	D217 E218 Q224 K225	D217-A221 WeakPolarHBondContact O-CB 3.38Å; D217-A221 PolarHBondContact O-N 2.67Å; E218-A221 PolarHBondContact O-N 2.97Å; A221-Q224 PolarHBondContact O-N 2.99Å; A221-K225 WeakPolarHBondContact O-CG 3.41Å; A221-K225 PolarHBondContact O-N 3.09Å
222	K	91.8	Very high	84.3	Confident	115 Å²	115	123.6 Å²	123.6	50%	0.5	59%	0.593	S	S	.	*	H	α-helix	trans	-59.1	-44.1	171.2	-75.1	166.1	-179.1	161.1	0	111.3	E218 I219 T220 K226	E218-K222 VanDerWaalsContact CD-CE 3.43Å; E218-K222 WeakPolarHBondContact O-CB 3.09Å; E218-K222 VanDerWaalsContact O-CG 3.29Å; E218-K222 WeakPolarHBondContact O-CG 3.1Å; E218-K222 PolarHBondContact O-N 2.89Å; E218-K222 WeakPolarHBondContact OE1-CE 3.43Å; E218-K222 IonicContact OE1-NZ 3.79Å; E218-K222 PolarHBondContact OE1-NZ 3.05Å; E218-K222 IonicContact OE2-NZ 2.65Å; E218-K222 PolarHBondContact OE2-NZ 2.73Å; I219-K222 PolarHBondContact O-N 2.81Å; T220-K222 PolarHBondContact O-N 3.11Å; K222-K226 PolarHBondContact O-N 3.02Å; K222-K226 VanDerWaalsContact O-N 3.15Å
223	R	89.1	Confident	83	Confident	186 Å²	186	127.8 Å²	127.8	70%	0.702	61%	0.61	S	S	*	*	H	α-helix	trans	-65.8	-43.1	177.7	-171.1	-179.2	-67.6	-177.5	-0.4	112.3	I219 T220 K226 G227	I219-R223 WeakPolarHBondContact O-CB 3.47Å; I219-R223 PolarHBondContact O-N 3.35Å; T220-R223 CarbonylContact O-C 3.59Å; T220-R223 WeakPolarHBondContact O-CB 3.46Å; T220-R223 PolarHBondContact O-N 2.83Å; T220-R223 VanDerWaalsContact O-N 3.14Å; R223-K226 PolarHBondContact O-N 3.49Å; R223-G227 PolarHBondContact O-N 3.43Å; R223-G227 VanDerWaalsContact O-N 3.15Å
224	Q	87.1	Confident	81.6	Confident	139 Å²	139	126.6 Å²	126.6	65%	0.65	61%	0.61	S	S	*	*	H	α-helix	trans	-63.5	-44.2	176.8	-72.7	179.5	20.4	0	0	111.6	T220 A221 K226 G227 K228	T220-Q224 WeakPolarHBondContact O-CG 3.44Å; T220-Q224 PolarHBondContact O-N 3.05Å; A221-Q224 PolarHBondContact O-N 2.99Å; Q224-K226 VanDerWaalsContact C-N 3.29Å; Q224-K226 PolarHBondContact O-N 2.84Å; Q224-G227 PolarHBondContact O-N 3.47Å; Q224-G227 VanDerWaalsContact O-N 3.16Å; Q224-K228 WeakPolarHBondContact O-CB 3.34Å; Q224-K228 PolarHBondContact O-N 2.84Å
225	K	85.3	Confident	80.2	Confident	172 Å²	172	121.8 Å²	121.8	75%	0.748	60%	0.596	S	S	*	*	H	α-helix	trans	-58.1	-39.7	173.9	-76.2	179.2	178.9	178.4	0	112.3	A221 G227	A221-K225 WeakPolarHBondContact O-CG 3.41Å; A221-K225 PolarHBondContact O-N 3.09Å; K225-G227 VanDerWaalsContact C-N 3.34Å; K225-G227 PolarHBondContact O-N 2.96Å
226	K	82.9	Confident	79.6	Confident	197 Å²	197	122.6 Å²	122.6	86%	0.857	60%	0.6	S	S	*	*	H	α-helix	trans	-67.4	-30.7	177	-170.4	176.7	-179.4	179.8	0	113.6	K222 R223 Q224	K222-K226 PolarHBondContact O-N 3.02Å; K222-K226 VanDerWaalsContact O-N 3.15Å; R223-K226 PolarHBondContact O-N 3.49Å; Q224-K226 VanDerWaalsContact C-N 3.29Å; Q224-K226 PolarHBondContact O-N 2.84Å
227	G	74.9	Confident	79.3	Confident	63 Å²	63	120.9 Å²	120.9	65%	0.649	59%	0.589	S	S	*	*	H	α-helix	trans	-89	-17.6	-180	0	0	0	0	0	114.9	R223 Q224 K225 Q229	R223-G227 PolarHBondContact O-N 3.43Å; R223-G227 VanDerWaalsContact O-N 3.15Å; Q224-G227 PolarHBondContact O-N 3.47Å; Q224-G227 VanDerWaalsContact O-N 3.16Å; K225-G227 VanDerWaalsContact C-N 3.34Å; K225-G227 PolarHBondContact O-N 2.96Å; G227-Q229 PolarHBondContact O-N 2.97Å
228	K	73.7	Confident	79	Confident	163 Å²	163	121.2 Å²	121.2	71%	0.709	59%	0.586	S	S	*	*			trans	-77.7	108.7	-177.3	-164.6	168.8	-172.6	172.5	0	110.2	Q224 E230	Q224-K228 WeakPolarHBondContact O-CB 3.34Å; Q224-K228 PolarHBondContact O-N 2.84Å; K228-E230 PolarHBondContact O-N 2.96Å; K228-E230 VanDerWaalsContact O-N 3.15Å
229	Q	61.2	Low	78.8	Confident	184 Å²	184	119 Å²	119	86%	0.86	58%	0.579	S	S	*	*			trans	-63.7	112.9	161.9	-64.4	179.8	12.3	0	0	107.1	G227 E231	G227-Q229 PolarHBondContact O-N 2.97Å; Q229-E231 PolarHBondContact O-N 3Å
230	E	60.7	Low	78.7	Confident	178 Å²	178	119 Å²	119	83%	0.832	58%	0.579	S	S	*	*			trans	-64.9	115.5	172.6	-64.4	-171.4	152.6	0	0	108	K228 E232	K228-E230 PolarHBondContact O-N 2.96Å; K228-E230 VanDerWaalsContact O-N 3.15Å; E230-E232 PolarHBondContact O-N 2.96Å; E230-E232 VanDerWaalsContact O-N 3.15Å
231	E	62.3	Low	78.7	Confident	174 Å²	174	119 Å²	119	81%	0.813	58%	0.577	S	S	*	*			trans	-63	119.1	166.2	-76.3	-141	131.5	0	0	107.9	Q229 K233	Q229-E231 PolarHBondContact O-N 3Å; E231-K233 PolarHBondContact O-N 2.85Å
232	E	60.3	Low	78.6	Confident	94 Å²	94	121.7 Å²	121.7	44%	0.439	58%	0.582	S	S	.	*			trans	-61.4	96.6	-179.8	-72.4	177.7	-162.1	0	0	109.6	E230 K333	E230-E232 PolarHBondContact O-N 2.96Å; E230-E232 VanDerWaalsContact O-N 3.15Å; E232-K333 WeakPolarHBondContact OE1-CE 3.47Å; E232-K333 IonicContact OE1-NZ 3.16Å; E232-K333 PolarHBondContact OE1-NZ 2.91Å; E232-K333 WeakPolarHBondContact OE2-CE 3.41Å; E232-K333 IonicContact OE2-NZ 3.13Å; E232-K333 PolarHBondContact OE2-NZ 2.94Å
233	K	65.8	Low	78.3	Confident	186 Å²	186	117.4 Å²	117.4	81%	0.809	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-52.5	140.5	169.9	-72.4	-176.7	177.6	179.8	0	108.7	E231 G235	E231-K233 PolarHBondContact O-N 2.85Å; K233-G235 PolarHBondContact O-N 3.03Å; K233-G235 VanDerWaalsContact O-N 3.12Å
234	P	64.8	Low	78	Confident	66 Å²	66	118.5 Å²	118.5	43%	0.429	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-56.9	122.9	178.9	23.1	-33.1	0	0	0	109.6
235	G	66.6	Low	77.6	Confident	25 Å²	25	119.4 Å²	119.4	26%	0.258	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-56.3	144.8	-177.7	0	0	0	0	0	112.4	K233 E237 R369	K233-G235 PolarHBondContact O-N 3.03Å; K233-G235 VanDerWaalsContact O-N 3.12Å; G235-E237 PolarHBondContact O-N 3.47Å; G235-R369 PolarHBondContact O-NH2 2.87Å; G235-R369 VanDerWaalsContact O-NH2 3.09Å
236	E	80.9	Confident	77.4	Confident	145 Å²	145	112.7 Å²	112.7	68%	0.678	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-55.8	128.9	174.4	-67.5	-177.9	176.7	0	0	110.3	K238 G330	E236-K238 WeakPolarHBondContact OE2-CE 3.33Å; E236-K238 IonicContact OE2-NZ 2.81Å; E236-K238 PolarHBondContact OE2-NZ 3.5Å; E236-G330 WeakPolarHBondContact O-CA 3.31Å
237	E	87.5	Confident	77.6	Confident	59 Å²	59	109.9 Å²	109.9	28%	0.276	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-90.3	128.4	178.4	-75.4	156.7	166.4	0	0	110.6	G235 I329 K357 W359 C366 R369	G235-E237 PolarHBondContact O-N 3.47Å; E237-I329 WeakPolarHBondContact CA-O 3.41Å; E237-K357 WeakPolarHBondContact OE1-CD 3.39Å; E237-K357 WeakPolarHBondContact OE1-CE 3.45Å; E237-K357 IonicContact OE1-NZ 3.67Å; E237-K357 PolarHBondContact OE1-NZ 3.02Å; E237-W359 HydrophobicContact CB-CH2 4.39Å; E237-W359 HydrophobicContact CG-CH2 3.89Å; E237-W359 HydrophobicContact CG-CZ3 4.37Å; E237-C366 HydrophobicContact CG-CB 4.21Å; E237-C366 VanDerWaalsContact OE1-CB 3.3Å; E237-C366 WeakPolarHBondContact OE1-CB 3.31Å; E237-C366 PolarHBondContact OE1-SG 3.31Å; E237-C366 WeakPolarHBondContact OE2-CB 3.08Å; E237-R369 IonicContact OE1-CZ 3.73Å; E237-R369 IonicContact OE1-NE 3.9Å; E237-R369 IonicContact OE1-NH1 2.85Å; E237-R369 PolarHBondContact OE1-NH1 2.82Å; E237-R369 IonicContact OE1-NH2 3.24Å; E237-R369 PolarHBondContact OE1-NH2 3.39Å; E237-R369 IonicContact OE2-CZ 2.92Å; E237-R369 IonicContact OE2-NH1 3.59Å; E237-R369 PolarHBondContact OE2-NH1 2.85Å; E237-R369 IonicContact OE2-NH2 3.49Å; E237-R369 PolarHBondContact OE2-NH2 3.32Å
238	K	89.3	Confident	78.1	Confident	118 Å²	118	109.7 Å²	109.7	51%	0.513	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	133.3	-178.8	-63.6	-179.2	-175.6	168.6	0	108.3	E236 I329	E236-K238 WeakPolarHBondContact OE2-CE 3.33Å; E236-K238 IonicContact OE2-NZ 2.81Å; E236-K238 PolarHBondContact OE2-NZ 3.5Å; K238-I329 PolarHBondContact N-O 2.84Å; K238-I329 WeakPolarHBondContact O-CA 3.36Å; K238-I329 VanDerWaalsContact O-CB 3.26Å; K238-I329 WeakPolarHBondContact O-CB 3.4Å; K238-I329 PolarHBondContact O-N 3.37Å; K238-I329 VanDerWaalsContact O-O 3.11Å
239	T	91.4	Very high	78.6	Confident	57 Å²	57	111.7 Å²	111.7	35%	0.35	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135.3	174.4	50.2	0	0	0	0	110.9	T327 F328 W359 G364	T239-T327 WeakPolarHBondContact CA-O 3.05Å; T239-F328 HydrophobicContact CG2-CB 4.38Å; T239-F328 HydrophobicContact CG2-CD1 3.89Å; T239-F328 HydrophobicContact CG2-CG 4.37Å; T239-W359 HydrophobicContact CG2-CZ3 4.29Å; T239-G364 WeakPolarHBondContact CG2-O 3.5Å
240	I	92.5	Very high	79.8	Confident	81 Å²	81	107.4 Å²	107.4	42%	0.415	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	104.6	-179.5	-54.5	176.1	0	0	0	106.7	H242 R326 T327 I329	I240-H242 PolarHBondContact O-CD2 3.27Å; I240-R326 CarbonylContact O-C 3.46Å; I240-R326 WeakPolarHBondContact O-CA 3.45Å; I240-T327 PolarHBondContact N-O 2.82Å; I240-T327 PolarHBondContact O-N 3.4Å; I240-I329 HydrophobicContact CD1-CD1 3.85Å; I240-I329 HydrophobicContact CG1-CD1 4.42Å
241	L	92.8	Very high	81.1	Confident	59 Å²	59	101.5 Å²	101.5	31%	0.309	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	127.4	164.4	-171.6	73.4	0	0	0	107.4	V243 M246 Y254 L325 R326	L241-V243 HydrophobicContact CD1-CG2 3.67Å; L241-V243 HydrophobicContact CD2-CG2 4.24Å; L241-V243 WeakPolarHBondContact CD2-O 3.17Å; L241-V243 HydrophobicContact CG-CG2 3.82Å; L241-V243 WeakPolarHBondContact CG-O 3.12Å; L241-M246 HydrophobicContact CD1-SD 4.16Å; L241-M246 HydrophobicContact CD2-CB 4.06Å; L241-M246 HydrophobicContact CD2-SD 4.29Å; L241-Y254 HydrophobicContact CD1-CE1 4.16Å; L241-L325 WeakPolarHBondContact CD1-O 3.39Å; L241-R326 HydrophobicContact CD1-CB 4.32Å
242	H	89.3	Confident	82.3	Confident	94 Å²	94	97.6 Å²	97.6	44%	0.435	47%	0.47	S	S	.	.			trans	-97.3	-23.2	179.9	-62.9	-89.2	0	0	0	112.5	I240 C324 L325 T327	I240-H242 PolarHBondContact O-CD2 3.27Å; H242-C324 WeakPolarHBondContact CB-O 3.29Å; H242-L325 PolarHBondContact N-O 3.04Å; H242-T327 PolarHBondContact NE2-OG1 3.07Å
243	V	86.7	Confident	83.6	Confident	26 Å²	26	93.9 Å²	93.9	16%	0.158	45%	0.454	C	S	.	.	S	Bend	trans	-77.3	141.2	170.2	-70	0	0	0	0	110.6	L241 E245 L325	L241-V243 HydrophobicContact CD1-CG2 3.67Å; L241-V243 HydrophobicContact CD2-CG2 4.24Å; L241-V243 WeakPolarHBondContact CD2-O 3.17Å; L241-V243 HydrophobicContact CG-CG2 3.82Å; L241-V243 WeakPolarHBondContact CG-O 3.12Å; V243-E245 VanDerWaalsContact C-N 3.32Å; V243-E245 WeakPolarHBondContact CG2-O 3.27Å; V243-L325 HydrophobicContact CG1-CD2 3.85Å; V243-L325 HydrophobicContact CG2-CD2 4.12Å
244	K	81.8	Confident	84.7	Confident	209 Å²	209	86.6 Å²	86.6	91%	0.909	42%	0.422	S	S	*	.	S	Bend	trans	-70.2	-31.2	-179.3	-67.1	179	173.4	178.6	0	112.7
245	E	79.3	Confident	85.8	Confident	157 Å²	157	84.2 Å²	84.2	73%	0.734	41%	0.405	S	S	*	.			trans	-117	125.4	-176.9	-71.3	164.2	-157.4	0	0	108.1	V243	V243-E245 VanDerWaalsContact C-N 3.32Å; V243-E245 WeakPolarHBondContact CG2-O 3.27Å
246	M	81.4	Confident	86.8	Confident	32 Å²	32	85.9 Å²	85.9	16%	0.158	41%	0.407	C	S	.	.	S	Bend	trans	-83.7	-30.2	179.3	174	63.6	-147	0	0	112	L241 Y254 R326 E362	L241-M246 HydrophobicContact CD1-SD 4.16Å; L241-M246 HydrophobicContact CD2-CB 4.06Å; L241-M246 HydrophobicContact CD2-SD 4.29Å; M246-Y254 HydrophobicContact CE-CD1 3.84Å; M246-Y254 HydrophobicContact CE-CE1 3.44Å; M246-Y254 VanDerWaalsContact CE-CE1 3.44Å; M246-Y254 HydrophobicContact SD-CD1 4.06Å; M246-Y254 HydrophobicContact SD-CE1 3.49Å; M246-Y254 WeakPolarHBondContact SD-CE1 3.23Å; M246-R326 PolarHBondContact SD-NH2 2.93Å; M246-R326 VanDerWaalsContact SD-NH2 3.38Å; M246-E362 HydrophobicContact CE-CB 4.31Å; M246-E362 WeakPolarHBondContact CE-O 3.36Å
247	Y	87.4	Confident	87.2	Confident	137 Å²	137	80.2 Å²	80.2	54%	0.537	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-115.7	146.7	-176.1	-61.4	-80.4	0	0	0	109.9	G251 R252	Y247-G251 WeakPolarHBondContact CD1-O 3.4Å; Y247-R252 CarbonylContact C-O 3.18Å; Y247-R252 VanDerWaalsContact CA-O 3.24Å; Y247-R252 WeakPolarHBondContact CA-O 3.47Å
248	D	84.7	Confident	87.2	Confident	60 Å²	60	78.9 Å²	78.9	32%	0.321	38%	0.377	S	S	.	.			trans	-73.5	178	171	74.9	3.7	0	0	0	112.2	Q250 G251 R252	D248-Q250 PolarHBondContact O-N 2.89Å; D248-Q250 VanDerWaalsContact OD1-CA 3.24Å; D248-Q250 WeakPolarHBondContact OD1-CA 3.34Å; D248-Q250 WeakPolarHBondContact OD1-CB 3.33Å; D248-Q250 PolarHBondContact OD1-N 3.05Å; D248-G251 PolarHBondContact O-N 3.03Å; D248-G251 PolarHBondContact OD1-N 2.66Å; D248-R252 PolarHBondContact N-O 3.47Å; D248-R252 WeakPolarHBondContact OD1-CB 3.32Å; D248-R252 PolarHBondContact OD1-N 2.99Å
249	Y	84.8	Confident	87	Confident	204 Å²	204	79.4 Å²	79.4	80%	0.8	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-9.6	175.9	70	-78.9	0	0	0	114.5
250	Q	86.4	Confident	86.6	Confident	94 Å²	94	83.7 Å²	83.7	44%	0.439	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	7.7	175.3	-77.3	168.4	-10.9	0	0	112.4	D248 R252	D248-Q250 PolarHBondContact O-N 2.89Å; D248-Q250 VanDerWaalsContact OD1-CA 3.24Å; D248-Q250 WeakPolarHBondContact OD1-CA 3.34Å; D248-Q250 WeakPolarHBondContact OD1-CB 3.33Å; D248-Q250 PolarHBondContact OD1-N 3.05Å; Q250-R252 VanDerWaalsContact C-N 3.3Å; Q250-R252 HydrophobicContact CB-CG 4.18Å; Q250-R252 PolarHBondContact O-N 3.37Å
251	G	86.9	Confident	86.3	Confident	54 Å²	54	80.9 Å²	80.9	56%	0.557	39%	0.389	S	S	*	.	S	Bend	trans	73.8	16.7	-179.6	0	0	0	0	0	114.1	Y247 D248	Y247-G251 WeakPolarHBondContact CD1-O 3.4Å; D248-G251 PolarHBondContact O-N 3.03Å; D248-G251 PolarHBondContact OD1-N 2.66Å
252	R	88.2	Confident	85.8	Confident	93 Å²	93	82.2 Å²	82.2	35%	0.351	42%	0.417	S	S	.	.			trans	-93.1	145.3	-178.8	-53.4	177.5	-178.8	147.8	9.6	110.6	Y247 D248 Q250 H256	Y247-R252 CarbonylContact C-O 3.18Å; Y247-R252 VanDerWaalsContact CA-O 3.24Å; Y247-R252 WeakPolarHBondContact CA-O 3.47Å; D248-R252 PolarHBondContact N-O 3.47Å; D248-R252 WeakPolarHBondContact OD1-CB 3.32Å; D248-R252 PolarHBondContact OD1-N 2.99Å; Q250-R252 VanDerWaalsContact C-N 3.3Å; Q250-R252 HydrophobicContact CB-CG 4.18Å; Q250-R252 PolarHBondContact O-N 3.37Å; R252-H256 HydrophobicContact CB-CB 4.06Å
253	S	88	Confident	85.6	Confident	15 Å²	15	80.2 Å²	80.2	11%	0.105	41%	0.411	C	S	.	.	B	Isolated β-bridge	trans	-70.5	162.1	171.6	70.9	0	0	0	0	111.1	L255 H256 E362	S253-L255 PolarHBondContact O-N 3.48Å; S253-L255 PolarHBondContact OG-N 3.3Å; S253-H256 WeakPolarHBondContact O-CB 3.43Å; S253-H256 PolarHBondContact O-N 2.7Å; S253-H256 VanDerWaalsContact O-N 3.07Å; S253-E362 WeakPolarHBondContact CB-OE1 3.33Å; S253-E362 PolarHBondContact OG-OE1 3.42Å
254	Y	88	Confident	85.6	Confident	34 Å²	34	84.1 Å²	84.1	13%	0.133	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-1.5	172.7	57.8	-109.1	0	0	0	114.5	L241 M246 H256 H302 L303 L315 L325 R326 T361	L241-Y254 HydrophobicContact CD1-CE1 4.16Å; M246-Y254 HydrophobicContact CE-CD1 3.84Å; M246-Y254 HydrophobicContact CE-CE1 3.44Å; M246-Y254 VanDerWaalsContact CE-CE1 3.44Å; M246-Y254 HydrophobicContact SD-CD1 4.06Å; M246-Y254 HydrophobicContact SD-CE1 3.49Å; M246-Y254 WeakPolarHBondContact SD-CE1 3.23Å; Y254-H256 VanDerWaalsContact C-N 3.32Å; Y254-H302 PolarHBondContact O-NE2 3.04Å; Y254-L303 HydrophobicContact CD2-CD1 4.02Å; Y254-L303 HydrophobicContact CD2-CD2 4.42Å; Y254-L303 HydrophobicContact CE2-CD1 4.49Å; Y254-L315 HydrophobicContact CD2-CD2 4.3Å; Y254-L315 HydrophobicContact CE2-CD1 3.95Å; Y254-L315 HydrophobicContact CE2-CD2 3.91Å; Y254-L325 HydrophobicContact CD1-CD2 4.37Å; Y254-L325 HydrophobicContact CD2-CD1 3.91Å; Y254-L325 HydrophobicContact CE2-CD1 4.41Å; Y254-L325 HydrophobicContact CG-CD1 4.06Å; Y254-L325 HydrophobicContact CG-CD2 4.37Å; Y254-R326 PolarHBondContact OH-NH1 2.9Å; Y254-T361 PolarHBondContact OH-O 3.04Å
255	L	87.9	Confident	85.8	Confident	15 Å²	15	74.3 Å²	74.3	8%	0.079	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-15.8	169.6	-51.6	-169.2	0	0	0	113.1	S253 I257 F297 H302 L303 T345 T361 E362	S253-L255 PolarHBondContact O-N 3.48Å; S253-L255 PolarHBondContact OG-N 3.3Å; L255-I257 PolarHBondContact O-N 3.03Å; L255-F297 HydrophobicContact CB-CZ 4.25Å; L255-F297 HydrophobicContact CD2-CE2 3.99Å; L255-H302 PolarHBondContact O-CE1 3.36Å; L255-H302 PolarHBondContact O-NE2 2.89Å; L255-L303 HydrophobicContact CD2-CD1 3.58Å; L255-T345 HydrophobicContact CD1-CG2 4.47Å; L255-T361 WeakPolarHBondContact CD1-OG1 3.48Å; L255-E362 HydrophobicContact CD1-CG 3.37Å; L255-E362 WeakPolarHBondContact CD1-OE1 3.42Å; L255-E362 HydrophobicContact CG-CG 3.83Å
256	H	88.4	Confident	86.2	Confident	61 Å²	61	72.4 Å²	72.4	28%	0.282	37%	0.374	S	S	.	.	S	Bend	trans	-68.9	120.3	-179.4	173.4	-83.1	0	0	0	109.9	R252 S253 Y254 P258 R266	R252-H256 HydrophobicContact CB-CB 4.06Å; S253-H256 WeakPolarHBondContact O-CB 3.43Å; S253-H256 PolarHBondContact O-N 2.7Å; S253-H256 VanDerWaalsContact O-N 3.07Å; Y254-H256 VanDerWaalsContact C-N 3.32Å; H256-P258 WeakPolarHBondContact O-CD 3.36Å; H256-P258 VanDerWaalsContact O-N 3.14Å; H256-R266 PolarHBondContact NE2-NH2 3.04Å
257	I	88.4	Confident	86.5	Confident	25 Å²	25	72.7 Å²	72.7	13%	0.128	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-53.2	117.1	-176.8	-54.8	172.9	0	0	0	110.7	L255 L265 R266 L299	L255-I257 PolarHBondContact O-N 3.03Å; I257-L265 HydrophobicContact CG2-CB 3.73Å; I257-R266 HydrophobicContact CD1-CG 3.97Å; I257-R266 HydrophobicContact CG2-CG 4.09Å; I257-L299 HydrophobicContact CD1-CD2 4.32Å
258	P	86.8	Confident	86.2	Confident	32 Å²	32	72 Å²	72	21%	0.208	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-65.5	145.9	-179.8	22.2	-29	0	0	0	111.7	H256 D260 V261 L265 H302	H256-P258 WeakPolarHBondContact O-CD 3.36Å; H256-P258 VanDerWaalsContact O-N 3.14Å; P258-D260 WeakPolarHBondContact CB-OD1 3.19Å; P258-V261 HydrophobicContact CB-CG2 4.17Å; P258-V261 HydrophobicContact CG-CG2 4.11Å; P258-L265 HydrophobicContact CG-CD1 3.99Å; P258-H302 VanDerWaalsContact CD-CD2 3.41Å; P258-H302 WeakPolarHBondContact CD-CD2 3.39Å; P258-H302 VanDerWaalsContact CD-CG 3.5Å; P258-H302 HydrophobicContact CG-CB 3.8Å
259	Q	85.2	Confident	86.3	Confident	129 Å²	129	76 Å²	76	60%	0.603	41%	0.408	S	S	*	.	S	Bend	trans	-118	-8.4	-176.1	-64.4	173.9	28.3	0	0	112.6	V261 R266	Q259-V261 VanDerWaalsContact C-N 3.33Å; Q259-R266 VanDerWaalsContact NE2-NH1 3.12Å; Q259-R266 VanDerWaalsContact NE2-NH2 3.2Å
260	D	83.7	Confident	86.3	Confident	146 Å²	146	69.2 Å²	69.2	78%	0.781	39%	0.389	S	S	*	.	S	Bend	trans	-80.3	-13.2	173.6	59	-40.3	0	0	0	112.8	P258	P258-D260 WeakPolarHBondContact CB-OD1 3.19Å
261	V	86.3	Confident	86.4	Confident	22 Å²	22	66 Å²	66	13%	0.133	38%	0.376	C	S	.	.	S	Bend	trans	-69.9	129.1	170.4	-179.3	0	0	0	0	109.5	P258 Q259 V263 L265 Y319	P258-V261 HydrophobicContact CB-CG2 4.17Å; P258-V261 HydrophobicContact CG-CG2 4.11Å; Q259-V261 VanDerWaalsContact C-N 3.33Å; V261-V263 HydrophobicContact CG1-CB 4.47Å; V261-V263 PolarHBondContact O-N 2.76Å; V261-L265 HydrophobicContact CB-CD1 4.27Å; V261-L265 HydrophobicContact CG1-CD1 4.35Å; V261-L265 HydrophobicContact CG1-CD2 4.44Å; V261-L265 HydrophobicContact CG1-CG 4.4Å; V261-L265 HydrophobicContact CG2-CD1 4.16Å; V261-Y319 HydrophobicContact CB-CD1 4.41Å; V261-Y319 HydrophobicContact CG1-CD1 3.68Å; V261-Y319 HydrophobicContact CG1-CE1 3.54Å; V261-Y319 HydrophobicContact CG1-CG 4.33Å; V261-Y319 HydrophobicContact CG2-CD1 3.75Å; V261-Y319 HydrophobicContact CG2-CD2 4.18Å; V261-Y319 HydrophobicContact CG2-CE1 4.38Å; V261-Y319 HydrophobicContact CG2-CG 3.64Å
262	G	82.1	Confident	86.3	Confident	87 Å²	87	73 Å²	73	90%	0.897	40%	0.395	S	S	*	.	S	Bend	trans	-66.2	8.6	-178.9	0	0	0	0	0	116.4
263	V	84.8	Confident	86.3	Confident	53 Å²	53	74.1 Å²	74.1	32%	0.321	40%	0.402	S	S	.	.	S	Bend	trans	-128.1	134.2	174.8	175.1	0	0	0	0	107.7	V261 L265 H561 E562	V261-V263 HydrophobicContact CG1-CB 4.47Å; V261-V263 PolarHBondContact O-N 2.76Å; V263-L265 PolarHBondContact O-N 2.93Å; V263-H561 HydrophobicContact CG1-CB 3.99Å; V263-E562 HydrophobicContact CG1-CG 4.44Å; V263-E562 HydrophobicContact CG2-CG 4.38Å
264	N	87.3	Confident	86.6	Confident	108 Å²	108	73.4 Å²	73.4	58%	0.578	40%	0.397	S	S	*	.			trans	-73.4	96.3	-178.4	-178.5	5.3	0	0	0	111.8	R266 S267	N264-R266 PolarHBondContact O-N 2.7Å; N264-R266 VanDerWaalsContact O-N 3.12Å; N264-R266 WeakPolarHBondContact OD1-CB 3.36Å; N264-R266 PolarHBondContact OD1-N 2.85Å; N264-S267 WeakPolarHBondContact O-CB 3.24Å; N264-S267 PolarHBondContact O-N 2.9Å
265	L	86	Confident	86.9	Confident	2 Å²	2	77.9 Å²	77.9	1%	0.01	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	0.5	179.2	-53.5	-177	0	0	0	114.8	I257 P258 V261 V263 S300 H302 Y319 H561	I257-L265 HydrophobicContact CG2-CB 3.73Å; P258-L265 HydrophobicContact CG-CD1 3.99Å; V261-L265 HydrophobicContact CB-CD1 4.27Å; V261-L265 HydrophobicContact CG1-CD1 4.35Å; V261-L265 HydrophobicContact CG1-CD2 4.44Å; V261-L265 HydrophobicContact CG1-CG 4.4Å; V261-L265 HydrophobicContact CG2-CD1 4.16Å; V263-L265 PolarHBondContact O-N 2.93Å; L265-S300 WeakPolarHBondContact O-CA 3.38Å; L265-S300 WeakPolarHBondContact O-CB 3.18Å; L265-H302 HydrophobicContact CD1-CB 3.9Å; L265-Y319 HydrophobicContact CD1-CD2 4.09Å; L265-Y319 HydrophobicContact CD1-CE2 3.76Å; L265-Y319 HydrophobicContact CD2-CE2 4.19Å; L265-H561 HydrophobicContact CD2-CB 4.08Å; L265-H561 PolarHBondContact O-NE2 2.79Å
266	R	87.1	Confident	87	Confident	117 Å²	117	79.1 Å²	79.1	44%	0.442	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-2.9	169.3	-65.3	-174.7	176.1	139.8	-0.9	113.2	H256 I257 Q259 N264 T268	H256-R266 PolarHBondContact NE2-NH2 3.04Å; I257-R266 HydrophobicContact CD1-CG 3.97Å; I257-R266 HydrophobicContact CG2-CG 4.09Å; Q259-R266 VanDerWaalsContact NE2-NH1 3.12Å; Q259-R266 VanDerWaalsContact NE2-NH2 3.2Å; N264-R266 PolarHBondContact O-N 2.7Å; N264-R266 VanDerWaalsContact O-N 3.12Å; N264-R266 WeakPolarHBondContact OD1-CB 3.36Å; N264-R266 PolarHBondContact OD1-N 2.85Å; R266-T268 PolarHBondContact O-N 2.59Å
267	S	87.1	Confident	87.3	Confident	38 Å²	38	76.3 Å²	76.3	27%	0.266	41%	0.409	S	S	.	.			trans	-61.2	129.1	175.2	-176.3	0	0	0	0	110.2	N264 M269 H561	N264-S267 WeakPolarHBondContact O-CB 3.24Å; N264-S267 PolarHBondContact O-N 2.9Å; S267-M269 PolarHBondContact OG-N 3.36Å; S267-M269 VanDerWaalsContact OG-N 3.16Å; S267-M269 PolarHBondContact OG-O 2.53Å; S267-H561 PolarHBondContact O-CE1 2.83Å; S267-H561 PolarHBondContact O-ND1 2.9Å
268	T	83	Confident	87.4	Confident	123 Å²	123	84.4 Å²	84.4	76%	0.755	44%	0.443	S	S	*	.			trans	-87.9	-12.4	165.9	52.7	0	0	0	0	112.1	R266 L299	R266-T268 PolarHBondContact O-N 2.59Å; T268-L299 HydrophobicContact CG2-CD1 4.17Å
269	M	85.1	Confident	87.6	Confident	144 Å²	144	88.5 Å²	88.5	71%	0.709	46%	0.457	S	S	*	.	S	Bend	trans	-81.1	129.3	175.2	-69.1	-179.8	62.3	0	0	110.2	S267	S267-M269 PolarHBondContact OG-N 3.36Å; S267-M269 VanDerWaalsContact OG-N 3.16Å; S267-M269 PolarHBondContact OG-O 2.53Å
270	P	85.1	Confident	88	Confident	62 Å²	62	86 Å²	86	40%	0.403	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-56.1	149.6	167.8	-25.7	35.5	0	0	0	112	P518	P270-P518 HydrophobicContact CB-CB 3.86Å
271	P	88.1	Confident	88.4	Confident	25 Å²	25	81.9 Å²	81.9	16%	0.162	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-59.9	146.5	170.7	26.7	-36.9	0	0	0	111.8	K273 P518 T563	P271-K273 PolarHBondContact O-N 3.07Å; P271-K273 VanDerWaalsContact O-N 3.1Å; P271-P518 HydrophobicContact CG-CB 4.12Å; P271-P518 HydrophobicContact CG-CG 4.4Å; P271-T563 HydrophobicContact CB-CG2 3.71Å; P271-T563 HydrophobicContact CG-CG2 4.24Å
272	E	84.8	Confident	88.7	Confident	202 Å²	202	83.2 Å²	83.2	94%	0.944	43%	0.428	S	S	*	.	S	Bend	trans	-55.6	-34	-171.8	-60.3	-176.2	165.8	0	0	114.6
273	K	90.2	Very high	89.4	Confident	116 Å²	116	81.9 Å²	81.9	50%	0.504	40%	0.402	S	S	.	.			trans	-157.1	125.1	-177.4	-175.3	171.7	-177.4	174.7	0	111.7	P271 Y275 T563	P271-K273 PolarHBondContact O-N 3.07Å; P271-K273 VanDerWaalsContact O-N 3.1Å; K273-Y275 HydrophobicContact CG-CE2 4.47Å; K273-T563 WeakPolarHBondContact O-CB 3.48Å; K273-T563 WeakPolarHBondContact O-CG2 3.39Å
274	C	92.9	Very high	89.9	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	39%	0.387	C	S	.	.			trans	-83.5	157.4	173.1	-66.4	0	0	0	0	112.1	D519 Y522 W558 T563	C274-D519 WeakPolarHBondContact CB-OD1 3.33Å; C274-D519 PolarHBondContact N-OD2 2.99Å; C274-D519 VanDerWaalsContact SG-CG 3.52Å; C274-D519 PolarHBondContact SG-OD1 2.95Å; C274-D519 VanDerWaalsContact SG-OD1 3.35Å; C274-Y522 HydrophobicContact CB-CD2 4.16Å; C274-Y522 HydrophobicContact CB-CE2 4.16Å; C274-W558 HydrophobicContact CB-CZ2 3.91Å; C274-T563 CarbonylContact C-O 3.56Å; C274-T563 WeakPolarHBondContact CA-O 3.22Å; C274-T563 VanDerWaalsContact CB-O 3.24Å; C274-T563 WeakPolarHBondContact CB-O 3.15Å
275	Y	93.7	Very high	90.1	Very high	128 Å²	128	78.5 Å²	78.5	50%	0.502	39%	0.388	S	S	.	.			trans	-128.4	159.5	177.2	-65.1	-87.1	0	0	0	109.3	K273 W558 T563	K273-Y275 HydrophobicContact CG-CE2 4.47Å; Y275-W558 WeakPolarHBondContact O-CH2 3.23Å; Y275-W558 WeakPolarHBondContact O-CZ2 3.41Å; Y275-T563 PolarHBondContact N-O 3.11Å
276	L	91.9	Very high	90.2	Very high	41 Å²	41	79.9 Å²	79.9	22%	0.215	40%	0.404	C	S	.	.			trans	-87.7	132.9	178.2	-67.2	83.6	0	0	0	109.9	Y522 I534	L276-Y522 HydrophobicContact CD1-CD1 4.26Å; L276-Y522 HydrophobicContact CD1-CD2 4.46Å; L276-Y522 HydrophobicContact CD1-CE1 3.62Å; L276-Y522 HydrophobicContact CD1-CE2 3.83Å; L276-Y522 WeakPolarHBondContact CD1-OH 3.43Å; L276-Y522 HydrophobicContact CG-CE1 4.45Å; L276-Y522 HydrophobicContact CG-CE2 4.49Å; L276-I534 HydrophobicContact CB-CD1 4.49Å; L276-I534 HydrophobicContact CD2-CB 4.04Å; L276-I534 HydrophobicContact CD2-CD1 4.22Å; L276-I534 HydrophobicContact CD2-CG2 3.7Å; L276-I534 HydrophobicContact CG-CD1 4.47Å; L276-I534 HydrophobicContact CG-CG2 4.09Å
277	P	93.1	Very high	90.5	Very high	3 Å²	3	75.1 Å²	75.1	2%	0.019	39%	0.386	C	S	.	.			trans	-66.3	149.4	175.8	27.2	-34.9	0	0	0	112	I534 S564 V566 W578 D579	P277-I534 HydrophobicContact CG-CD1 4.27Å; P277-S564 WeakPolarHBondContact CA-OG 3.31Å; P277-S564 WeakPolarHBondContact CB-O 3.4Å; P277-S564 WeakPolarHBondContact CD-O 3.16Å; P277-V566 HydrophobicContact CG-CB 4.16Å; P277-V566 HydrophobicContact CG-CG2 3.92Å; P277-W578 HydrophobicContact CB-CB 3.67Å; P277-W578 HydrophobicContact CG-CB 4.05Å; P277-D579 VanDerWaalsContact CA-C 3.45Å; P277-D579 WeakPolarHBondContact CA-OXT 3.38Å
278	K	90.3	Very high	90.9	Very high	194 Å²	194	78.7 Å²	78.7	84%	0.843	41%	0.407	S	S	*	.			trans	-128.6	-30.1	-176.6	-65.2	-179.6	-177.2	174.9	0	113.7	D579	K278-D579 PolarHBondContact N-O 3.43Å
279	K	92.6	Very high	91.5	Very high	118 Å²	118	78.4 Å²	78.4	51%	0.513	40%	0.395	S	S	.	.	S	Bend	trans	-117.1	145.7	-176.7	49.6	170.1	-178.6	173	0	109.9	W578 D579	K279-W578 VanDerWaalsContact O-CA 3.31Å; K279-W578 WeakPolarHBondContact O-CA 3.23Å; K279-D579 WeakPolarHBondContact CE-OD2 3.18Å; K279-D579 WeakPolarHBondContact CG-O 3.19Å; K279-D579 PolarHBondContact N-O 3.36Å; K279-D579 IonicContact NZ-OD2 3.46Å; K279-D579 PolarHBondContact NZ-OD2 3.48Å; K279-D579 PolarHBondContact O-N 2.91Å
280	Q	93.6	Very high	91.9	Very high	77 Å²	77	71.8 Å²	71.8	36%	0.36	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	119.2	166.9	-153.4	-166.4	-71.9	0	0	107.4	K576 L577 W578	Q280-K576 HydrophobicContact CG-CB 4.28Å; Q280-K576 HydrophobicContact CG-CD 4.42Å; Q280-L577 CarbonylContact C-O 3.47Å; Q280-L577 WeakPolarHBondContact CA-O 3.21Å; Q280-W578 HydrophobicContact CB-CD2 4.39Å; Q280-W578 HydrophobicContact CB-CE3 3.76Å; Q280-W578 HydrophobicContact CB-CH2 3.98Å; Q280-W578 HydrophobicContact CB-CZ3 3.54Å; Q280-W578 HydrophobicContact CG-CD2 4.1Å; Q280-W578 HydrophobicContact CG-CE3 3.93Å; Q280-W578 HydrophobicContact CG-CH2 3.73Å; Q280-W578 HydrophobicContact CG-CZ2 3.89Å; Q280-W578 HydrophobicContact CG-CZ3 3.76Å
281	I	91.9	Very high	92.4	Very high	60 Å²	60	68.8 Å²	68.8	31%	0.308	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-38.7	177.6	-40.6	165.7	0	0	0	111.3	K565 L577 D579	I281-K565 HydrophobicContact CD1-CD 4.09Å; I281-L577 HydrophobicContact CB-CD2 4.38Å; I281-L577 HydrophobicContact CD1-CD2 3.85Å; I281-L577 HydrophobicContact CD1-CG 4.09Å; I281-L577 PolarHBondContact N-O 3.05Å; I281-D579 HydrophobicContact CD1-CB 3.25Å; I281-D579 HydrophobicContact CG1-CB 3.66Å
282	H	93.1	Very high	92.7	Very high	50 Å²	50	67.9 Å²	67.9	23%	0.231	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	156.3	-168.3	-164.9	68.4	0	0	0	113.3	W284 K576 L577	H282-W284 AromaticContact CD2-CD1 3.64Å; H282-W284 AromaticContact CD2-CD2 3.68Å; H282-W284 AromaticContact CD2-CE2 3.6Å; H282-W284 AromaticContact CD2-CG 3.76Å; H282-W284 AromaticContact CD2-NE1 3.59Å; H282-W284 AromaticContact NE2-CD1 3.48Å; H282-W284 AromaticContact NE2-CG 3.94Å; H282-W284 AromaticContact NE2-NE1 3.68Å; H282-K576 WeakPolarHBondContact O-CA 3.43Å; H282-L577 HydrophobicContact CB-CB 4.1Å; H282-L577 PolarHBondContact O-N 2.83Å
283	V	94.9	Very high	93.2	Very high	58 Å²	58	58.5 Å²	58.5	35%	0.352	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	110.7	170	-178.2	0	0	0	0	107.8	S285 L574 I575 K576	V283-S285 PolarHBondContact O-N 2.83Å; V283-L574 HydrophobicContact CG1-CB 4.32Å; V283-L574 HydrophobicContact CG1-CD1 4.22Å; V283-L574 HydrophobicContact CG1-CD2 3.85Å; V283-L574 HydrophobicContact CG1-CG 4.35Å; V283-I575 WeakPolarHBondContact CA-O 3.47Å; V283-K576 HydrophobicContact CG2-CG 4.48Å
284	W	95.3	Very high	93.5	Very high	3 Å²	3	53 Å²	53	1%	0.011	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	108.6	162.5	-61.7	-76.5	0	0	0	107.8	H282 L304 W316 E317 R322 I567 I575 L577	H282-W284 AromaticContact CD2-CD1 3.64Å; H282-W284 AromaticContact CD2-CD2 3.68Å; H282-W284 AromaticContact CD2-CE2 3.6Å; H282-W284 AromaticContact CD2-CG 3.76Å; H282-W284 AromaticContact CD2-NE1 3.59Å; H282-W284 AromaticContact NE2-CD1 3.48Å; H282-W284 AromaticContact NE2-CG 3.94Å; H282-W284 AromaticContact NE2-NE1 3.68Å; W284-L304 HydrophobicContact CH2-CD1 4.45Å; W284-L304 HydrophobicContact CZ3-CD1 4.35Å; W284-W316 HydrophobicContact CB-CD2 4.11Å; W284-W316 HydrophobicContact CB-CE3 3.86Å; W284-W316 HydrophobicContact CB-CH2 4.03Å; W284-W316 HydrophobicContact CB-CZ2 4.28Å; W284-W316 HydrophobicContact CB-CZ3 3.82Å; W284-W316 AromaticContact CD1-CD2 3.87Å; W284-W316 AromaticContact CD1-CE3 3.34Å; W284-W316 AromaticContact CD1-CZ3 3.93Å; W284-W316 HydrophobicContact CG-CD2 4.09Å; W284-W316 AromaticContact CG-CE3 3.85Å; W284-W316 HydrophobicContact CG-CE3 3.85Å; W284-W316 HydrophobicContact CG-CG 4.49Å; W284-W316 HydrophobicContact CG-CZ3 4.26Å; W284-E317 PolarHBondContact NE1-O 3.29Å; W284-R322 VanDerWaalsContact CD1-O 3.26Å; W284-R322 HydrophobicContact CZ2-CB 4.49Å; W284-R322 PolarHBondContact NE1-O 3.29Å; W284-R322 VanDerWaalsContact NE1-O 3.12Å; W284-I567 HydrophobicContact CH2-CD1 4.2Å; W284-I567 HydrophobicContact CH2-CG1 4.47Å; W284-I567 HydrophobicContact CZ3-CG1 4.46Å; W284-I567 HydrophobicContact CZ3-CG2 3.94Å; W284-I575 HydrophobicContact CB-CB 4.16Å; W284-I575 HydrophobicContact CE3-CB 3.8Å; W284-I575 HydrophobicContact CE3-CG2 3.62Å; W284-I575 HydrophobicContact CZ3-CG2 4.01Å; W284-I575 PolarHBondContact N-O 2.78Å; W284-I575 PolarHBondContact O-N 2.91Å; W284-L577 HydrophobicContact CH2-CB 3.84Å; W284-L577 HydrophobicContact CH2-CD1 4.32Å; W284-L577 HydrophobicContact CH2-CD2 4.35Å; W284-L577 HydrophobicContact CH2-CG 4.4Å; W284-L577 HydrophobicContact CZ3-CB 3.82Å
285	S	92.3	Very high	93.6	Very high	87 Å²	87	55.1 Å²	55.1	61%	0.608	28%	0.28	S	S	*	.			trans	-107.7	137.1	173.6	-175.6	0	0	0	0	109.4	V283	V283-S285 PolarHBondContact O-N 2.83Å
286	G	88.3	Confident	93.7	Very high	32 Å²	32	50.2 Å²	50.2	33%	0.33	26%	0.262	S	S	.	.			trans	153.5	-1.3	177	0	0	0	0	0	116.4	K314	G286-K314 WeakPolarHBondContact O-CE 3.11Å; G286-K314 PolarHBondContact O-NZ 2.85Å
287	H	94.3	Very high	93.8	Very high	16 Å²	16	48.9 Å²	48.9	7%	0.074	25%	0.254	C	S	.	.			trans	-87.9	143.8	159.3	-78.1	-67.8	0	0	0	109.5	S306 S308 D310	H287-S306 PolarHBondContact NE2-OG 2.89Å; H287-S308 VanDerWaalsContact CE1-CB 3.47Å; H287-S308 WeakPolarHBondContact CE1-CB 3.34Å; H287-S308 WeakPolarHBondContact ND1-CB 3.36Å; H287-D310 WeakPolarHBondContact CA-OD2 3.48Å; H287-D310 IonicContact CE1-OD1 3.02Å; H287-D310 IonicContact CG-OD2 3.78Å; H287-D310 IonicContact ND1-OD1 2.67Å; H287-D310 PolarHBondContact ND1-OD1 2.9Å; H287-D310 IonicContact ND1-OD2 3.58Å; H287-D310 PolarHBondContact ND1-OD2 2.9Å
288	T	94.1	Very high	93.6	Very high	113 Å²	113	50.1 Å²	50.1	69%	0.693	26%	0.263	S	S	*	.	S	Bend	trans	-90.6	-13.3	179.2	59.5	0	0	0	0	113.1	D310	T288-D310 PolarHBondContact N-OD2 2.8Å; T288-D310 VanDerWaalsContact N-OD2 3.1Å; T288-D310 WeakPolarHBondContact OG1-CB 3.21Å
289	K	95.5	Very high	93.4	Very high	117 Å²	117	45.8 Å²	45.8	51%	0.509	25%	0.248	S	C	.	.	S	Bend	trans	-132.7	170.6	176	-64.2	178.5	-179.8	173.9	0	110.4	S308 M309 D310 G573	K289-S308 PolarHBondContact O-OG 3.01Å; K289-M309 HydrophobicContact CB-CB 3.92Å; K289-M309 HydrophobicContact CD-CB 4.1Å; K289-M309 VanDerWaalsContact CD-O 3.27Å; K289-M309 WeakPolarHBondContact CD-O 3.49Å; K289-D310 HydrophobicContact CB-CB 4.17Å; K289-D310 HydrophobicContact CD-CB 4.38Å; K289-D310 HydrophobicContact CG-CB 4.28Å; K289-G573 WeakPolarHBondContact O-CA 3.42Å
290	G	94	Very high	93.1	Very high	5 Å²	5	40.1 Å²	40.1	5%	0.052	22%	0.223	C	C	.	.			trans	-49.7	137.5	179.9	0	0	0	0	0	114.6	S308 M309 W571	G290-S308 WeakPolarHBondContact O-CA 3.44Å; G290-S308 PolarHBondContact O-OG 3.07Å; G290-M309 PolarHBondContact O-N 2.78Å; G290-W571 WeakPolarHBondContact CA-O 3.48Å
291	V	96.6	Very high	92.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	128.9	173.8	-174.4	0	0	0	0	108.2	C307 C569 G570 I575	V291-C307 CarbonylContact C-O 3.58Å; V291-C307 WeakPolarHBondContact CA-O 3.41Å; V291-C307 VanDerWaalsContact CG1-O 3.28Å; V291-C307 WeakPolarHBondContact CG1-O 3.41Å; V291-C569 HydrophobicContact CB-CB 3.88Å; V291-C569 HydrophobicContact CG1-CB 3.7Å; V291-G570 PolarHBondContact N-O 2.85Å; V291-I575 HydrophobicContact CG1-CD1 4.47Å; V291-I575 HydrophobicContact CG1-CG1 4.44Å; V291-I575 HydrophobicContact CG2-CD1 4.45Å; V291-I575 HydrophobicContact CG2-CG1 3.97Å
292	S	94.3	Very high	92.9	Very high	5 Å²	5	33.9 Å²	33.9	4%	0.035	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-31.9	-172.3	47.9	0	0	0	0	113.5	C307 V335 R336 I554	S292-C307 PolarHBondContact N-O 2.86Å; S292-C307 PolarHBondContact OG-O 2.91Å; S292-C307 PolarHBondContact OG-SG 2.77Å; S292-V335 WeakPolarHBondContact CB-O 3.43Å; S292-V335 PolarHBondContact OG-O 3.11Å; S292-R336 PolarHBondContact O-NH1 3.34Å; S292-I554 WeakPolarHBondContact O-CG2 3.48Å
293	A	94.2	Very high	93	Very high	5 Å²	5	31.6 Å²	31.6	4%	0.041	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	159	169.3	0	0	0	0	0	111	C307 I338	A293-C307 PolarHBondContact N-SG 2.92Å; A293-C307 VanDerWaalsContact N-SG 3.42Å; A293-C307 PolarHBondContact O-N 2.91Å; A293-C307 VanDerWaalsContact O-N 3.14Å; A293-I338 HydrophobicContact CB-CG1 4.44Å
294	V	95.8	Very high	93	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	138.6	175.6	65.2	0	0	0	0	109.2	L304 L305 V557 C569	V294-L304 HydrophobicContact CG2-CD1 3.59Å; V294-L304 HydrophobicContact CG2-CD2 3.76Å; V294-L304 HydrophobicContact CG2-CG 3.61Å; V294-L305 WeakPolarHBondContact CA-O 3.39Å; V294-V557 HydrophobicContact CG1-CG2 3.85Å; V294-C569 HydrophobicContact CB-CB 4.36Å; V294-C569 HydrophobicContact CG1-CB 4.35Å
295	R	95.7	Very high	93	Very high	45 Å²	45	28.7 Å²	28.7	17%	0.17	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	130.6	178.4	-60.3	-67.8	175.8	-134.7	-2.3	109.2	L304 L305 D337 I338 F340 Q513	R295-L304 WeakPolarHBondContact O-CA 3.41Å; R295-L305 PolarHBondContact N-O 3.3Å; R295-L305 PolarHBondContact O-N 2.82Å; R295-D337 IonicContact CZ-OD1 2.66Å; R295-D337 IonicContact NE-OD1 2.69Å; R295-D337 IonicContact NH2-OD1 3.98Å; R295-D337 PolarHBondContact NH2-OD1 2.82Å; R295-D337 IonicContact NH2-OD2 3.98Å; R295-I338 HydrophobicContact CB-CD1 4.18Å; R295-I338 HydrophobicContact CG-CD1 3.84Å; R295-I338 HydrophobicContact CG-CG1 3.76Å; R295-I338 WeakPolarHBondContact CG-O 3.27Å; R295-I338 PolarHBondContact NE-O 2.67Å; R295-I338 VanDerWaalsContact NE-O 3.09Å; R295-F340 HydrophobicContact CB-CD2 4.32Å; R295-F340 HydrophobicContact CB-CE2 4.34Å; R295-Q513 VanDerWaalsContact NH1-CD 3.35Å
296	L	95.1	Very high	93.2	Very high	25 Å²	25	24.6 Å²	24.6	13%	0.131	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	154.5	166.6	-77.6	180	0	0	0	110.5	L304 V318 F340 V557 H559 I567	L296-L304 HydrophobicContact CD2-CB 4.29Å; L296-L304 HydrophobicContact CD2-CD1 4.49Å; L296-V318 HydrophobicContact CD2-CG2 3.92Å; L296-F340 WeakPolarHBondContact O-CD2 3.39Å; L296-F340 WeakPolarHBondContact O-CE2 3.45Å; L296-V557 HydrophobicContact CD1-CG1 3.7Å; L296-V557 HydrophobicContact CG-CG1 3.94Å; L296-H559 HydrophobicContact CD1-CB 4.49Å; L296-I567 HydrophobicContact CD2-CD1 3.74Å; L296-I567 HydrophobicContact CG-CD1 4.47Å
297	F	93.9	Very high	93.6	Very high	13 Å²	13	23 Å²	23	6%	0.057	12%	0.12	C	C	.	.	P	Polyproline II helix	trans	-59.3	135.2	172.4	-163.8	-97.1	0	0	0	110.5	L255 S300 G301 H302 L303 F340 G344	L255-F297 HydrophobicContact CB-CZ 4.25Å; L255-F297 HydrophobicContact CD2-CE2 3.99Å; F297-S300 WeakPolarHBondContact CD1-OG 3.24Å; F297-G301 WeakPolarHBondContact O-CA 3.24Å; F297-G301 PolarHBondContact O-N 2.82Å; F297-H302 AromaticContact CD1-CE1 3.47Å; F297-H302 VanDerWaalsContact CD1-CE1 3.47Å; F297-H302 WeakPolarHBondContact CD1-CE1 3.39Å; F297-H302 AromaticContact CD1-ND1 3.67Å; F297-H302 AromaticContact CE1-CE1 3.62Å; F297-H302 AromaticContact CG-CE1 3.91Å; F297-L303 HydrophobicContact CB-CB 3.97Å; F297-L303 WeakPolarHBondContact CB-O 3.38Å; F297-L303 HydrophobicContact CD2-CB 4.11Å; F297-L303 HydrophobicContact CD2-CD1 3.77Å; F297-L303 HydrophobicContact CD2-CG 4.33Å; F297-L303 HydrophobicContact CE2-CD1 4.01Å; F297-L303 HydrophobicContact CG-CB 4.3Å; F297-L303 HydrophobicContact CG-CD1 4.42Å; F297-L303 PolarHBondContact N-O 3.46Å; F297-F340 HydrophobicContact CD2-CD1 4.41Å; F297-F340 AromaticContact CD2-CE1 3.75Å; F297-F340 HydrophobicContact CD2-CE1 3.75Å; F297-F340 AromaticContact CD2-CZ 3.8Å; F297-F340 HydrophobicContact CD2-CZ 3.8Å; F297-F340 HydrophobicContact CE2-CE1 4.13Å; F297-G344 VanDerWaalsContact CE2-O 3.31Å; F297-G344 WeakPolarHBondContact CE2-O 3.37Å
298	P	89.9	Confident	93.6	Very high	29 Å²	29	22.3 Å²	22.3	19%	0.188	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	154.5	179.6	28.8	-38.2	0	0	0	111.3	S300 F340 N341 T342 G344	P298-S300 PolarHBondContact O-N 3.38Å; P298-F340 HydrophobicContact CG-CB 4.13Å; P298-F340 HydrophobicContact CG-CG 4.48Å; P298-N341 WeakPolarHBondContact CG-O 3.41Å; P298-T342 WeakPolarHBondContact CB-O 3.36Å; P298-T342 WeakPolarHBondContact CG-O 3.31Å; P298-G344 VanDerWaalsContact CG-CA 3.44Å
299	L	85.9	Confident	93.7	Very high	102 Å²	102	20 Å²	20	53%	0.534	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	61	-50.4	-174.2	-174.3	64.8	0	0	0	115.7	I257 T268 H561	I257-L299 HydrophobicContact CD1-CD2 4.32Å; T268-L299 HydrophobicContact CG2-CD1 4.17Å; L299-H561 PolarHBondContact O-CE1 2.83Å; L299-H561 VanDerWaalsContact O-CE1 3.28Å; L299-H561 PolarHBondContact O-NE2 2.91Å
300	S	86.4	Confident	93.6	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.1	-18.4	-161.7	57.3	0	0	0	0	116.5	L265 F297 P298 H302 H561	L265-S300 WeakPolarHBondContact O-CA 3.38Å; L265-S300 WeakPolarHBondContact O-CB 3.18Å; F297-S300 WeakPolarHBondContact CD1-OG 3.24Å; P298-S300 PolarHBondContact O-N 3.38Å; S300-H302 PolarHBondContact O-N 2.84Å; S300-H302 PolarHBondContact OG-ND1 3.19Å; S300-H561 WeakPolarHBondContact CA-NE2 3.46Å; S300-H561 PolarHBondContact O-CD2 2.71Å
301	G	89.3	Confident	93.6	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.085	C	C	.	.			trans	64.2	6.9	176.6	0	0	0	0	0	117	F297 L303 V318 H559	F297-G301 WeakPolarHBondContact O-CA 3.24Å; F297-G301 PolarHBondContact O-N 2.82Å; G301-L303 VanDerWaalsContact C-N 3.33Å; G301-L303 PolarHBondContact O-N 2.92Å; G301-V318 WeakPolarHBondContact O-CG2 3.49Å; G301-H559 PolarHBondContact O-NE2 3.13Å
302	H	92.6	Very high	93.5	Very high	6 Å²	6	19.6 Å²	19.6	3%	0.028	10%	0.1	C	C	.	.			trans	-71.2	-24.6	-175.5	72.3	-75.2	0	0	0	114.5	Y254 L255 P258 L265 F297 S300 V318 Y319	Y254-H302 PolarHBondContact O-NE2 3.04Å; L255-H302 PolarHBondContact O-CE1 3.36Å; L255-H302 PolarHBondContact O-NE2 2.89Å; P258-H302 VanDerWaalsContact CD-CD2 3.41Å; P258-H302 WeakPolarHBondContact CD-CD2 3.39Å; P258-H302 VanDerWaalsContact CD-CG 3.5Å; P258-H302 HydrophobicContact CG-CB 3.8Å; L265-H302 HydrophobicContact CD1-CB 3.9Å; F297-H302 AromaticContact CD1-CE1 3.47Å; F297-H302 VanDerWaalsContact CD1-CE1 3.47Å; F297-H302 WeakPolarHBondContact CD1-CE1 3.39Å; F297-H302 AromaticContact CD1-ND1 3.67Å; F297-H302 AromaticContact CE1-CE1 3.62Å; F297-H302 AromaticContact CG-CE1 3.91Å; S300-H302 PolarHBondContact O-N 2.84Å; S300-H302 PolarHBondContact OG-ND1 3.19Å; H302-V318 WeakPolarHBondContact O-CB 3.47Å; H302-V318 PolarHBondContact O-N 3.38Å; H302-Y319 HydrophobicContact CB-CD2 4.16Å; H302-Y319 HydrophobicContact CB-CE2 4.43Å
303	L	94.1	Very high	93.7	Very high	2 Å²	2	19.4 Å²	19.4	1%	0.01	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	159	172	-51.3	169.2	0	0	0	110.9	Y254 L255 F297 G301 L315 W316 L325	Y254-L303 HydrophobicContact CD2-CD1 4.02Å; Y254-L303 HydrophobicContact CD2-CD2 4.42Å; Y254-L303 HydrophobicContact CE2-CD1 4.49Å; L255-L303 HydrophobicContact CD2-CD1 3.58Å; F297-L303 HydrophobicContact CB-CB 3.97Å; F297-L303 WeakPolarHBondContact CB-O 3.38Å; F297-L303 HydrophobicContact CD2-CB 4.11Å; F297-L303 HydrophobicContact CD2-CD1 3.77Å; F297-L303 HydrophobicContact CD2-CG 4.33Å; F297-L303 HydrophobicContact CE2-CD1 4.01Å; F297-L303 HydrophobicContact CG-CB 4.3Å; F297-L303 HydrophobicContact CG-CD1 4.42Å; F297-L303 PolarHBondContact N-O 3.46Å; G301-L303 VanDerWaalsContact C-N 3.33Å; G301-L303 PolarHBondContact O-N 2.92Å; L303-L315 HydrophobicContact CB-CD2 4.13Å; L303-L315 HydrophobicContact CD1-CD2 4.1Å; L303-L315 HydrophobicContact CD2-CD2 3.99Å; L303-L315 HydrophobicContact CG-CD2 4.28Å; L303-W316 WeakPolarHBondContact CA-O 3.5Å; L303-L325 HydrophobicContact CD2-CD1 3.56Å
304	L	95.1	Very high	93.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	126.1	176.8	176.5	154.9	0	0	0	109.6	W284 V294 R295 L296 L315 W316 V318 I567 I575	W284-L304 HydrophobicContact CH2-CD1 4.45Å; W284-L304 HydrophobicContact CZ3-CD1 4.35Å; V294-L304 HydrophobicContact CG2-CD1 3.59Å; V294-L304 HydrophobicContact CG2-CD2 3.76Å; V294-L304 HydrophobicContact CG2-CG 3.61Å; R295-L304 WeakPolarHBondContact O-CA 3.41Å; L296-L304 HydrophobicContact CD2-CB 4.29Å; L296-L304 HydrophobicContact CD2-CD1 4.49Å; L304-L315 CarbonylContact O-C 3.4Å; L304-L315 WeakPolarHBondContact O-CA 3.43Å; L304-W316 HydrophobicContact CB-CB 4.41Å; L304-W316 HydrophobicContact CD2-CB 4.26Å; L304-W316 VanDerWaalsContact CD2-CD1 3.42Å; L304-W316 HydrophobicContact CD2-CG 4.09Å; L304-W316 PolarHBondContact N-O 3.03Å; L304-W316 PolarHBondContact O-N 3.13Å; L304-V318 HydrophobicContact CB-CG2 3.8Å; L304-I567 HydrophobicContact CD1-CD1 3.72Å; L304-I567 HydrophobicContact CD1-CG2 3.65Å; L304-I575 HydrophobicContact CD1-CG2 4.34Å; L304-I575 HydrophobicContact CD2-CD1 3.96Å
305	L	95.9	Very high	93.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	136.4	164.1	-82.4	176.9	0	0	0	110.3	V294 R295 I313 K314 L315 F328 I338 F340 F347	V294-L305 WeakPolarHBondContact CA-O 3.39Å; R295-L305 PolarHBondContact N-O 3.3Å; R295-L305 PolarHBondContact O-N 2.82Å; L305-I313 HydrophobicContact CD2-CG2 4.01Å; L305-K314 WeakPolarHBondContact CA-O 3.26Å; L305-L315 HydrophobicContact CD2-CB 3.75Å; L305-L315 HydrophobicContact CD2-CD1 4.1Å; L305-L315 HydrophobicContact CD2-CG 3.96Å; L305-L315 HydrophobicContact CG-CG 4.49Å; L305-F328 HydrophobicContact CD2-CE2 4.31Å; L305-I338 HydrophobicContact CB-CD1 3.62Å; L305-F340 HydrophobicContact CB-CE2 4.05Å; L305-F340 HydrophobicContact CB-CZ 4.07Å; L305-F340 HydrophobicContact CD1-CD1 4Å; L305-F340 HydrophobicContact CD1-CD2 4.22Å; L305-F340 HydrophobicContact CD1-CE1 3.47Å; L305-F340 VanDerWaalsContact CD1-CE1 3.47Å; L305-F340 HydrophobicContact CD1-CE2 3.71Å; L305-F340 HydrophobicContact CD1-CG 4.37Å; L305-F340 HydrophobicContact CD1-CZ 3.33Å; L305-F340 HydrophobicContact CG-CE1 3.99Å; L305-F340 HydrophobicContact CG-CE2 3.9Å; L305-F340 HydrophobicContact CG-CZ 3.42Å; L305-F340 VanDerWaalsContact CG-CZ 3.42Å; L305-F347 HydrophobicContact CD1-CB 3.79Å; L305-F347 HydrophobicContact CD1-CD1 3.93Å; L305-F347 HydrophobicContact CD1-CD2 3.76Å; L305-F347 HydrophobicContact CD1-CE1 4.4Å; L305-F347 HydrophobicContact CD1-CE2 4.28Å; L305-F347 HydrophobicContact CD1-CG 3.55Å; L305-F347 HydrophobicContact CD2-CZ 4.45Å
306	S	96.2	Very high	93.7	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	139.2	170	66.6	0	0	0	0	110.9	H287 I313 K314 W316	H287-S306 PolarHBondContact NE2-OG 2.89Å; S306-I313 CarbonylContact O-C 3.6Å; S306-I313 WeakPolarHBondContact O-CA 3.43Å; S306-I313 WeakPolarHBondContact O-CG2 3.44Å; S306-K314 PolarHBondContact N-O 3.46Å; S306-K314 PolarHBondContact O-N 3.18Å; S306-W316 PolarHBondContact OG-NE1 3.33Å
307	C	95.8	Very high	93.6	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	147.5	170.4	63.7	0	0	0	0	110.4	V291 S292 A293 I313 V335 I338	V291-C307 CarbonylContact C-O 3.58Å; V291-C307 WeakPolarHBondContact CA-O 3.41Å; V291-C307 VanDerWaalsContact CG1-O 3.28Å; V291-C307 WeakPolarHBondContact CG1-O 3.41Å; S292-C307 PolarHBondContact N-O 2.86Å; S292-C307 PolarHBondContact OG-O 2.91Å; S292-C307 PolarHBondContact OG-SG 2.77Å; A293-C307 PolarHBondContact N-SG 2.92Å; A293-C307 VanDerWaalsContact N-SG 3.42Å; A293-C307 PolarHBondContact O-N 2.91Å; A293-C307 VanDerWaalsContact O-N 3.14Å; C307-I313 HydrophobicContact CB-CG1 4.33Å; C307-V335 HydrophobicContact CB-CB 3.87Å; C307-V335 HydrophobicContact CB-CG1 3.58Å; C307-I338 HydrophobicContact CB-CD1 4.37Å; C307-I338 HydrophobicContact CB-CG1 4.34Å; C307-I338 HydrophobicContact CB-CG2 3.9Å
308	S	95.7	Very high	93.5	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	162.5	-175.2	172.7	0	0	0	0	112.7	H287 K289 G290 D310 C311 K312 V335	H287-S308 VanDerWaalsContact CE1-CB 3.47Å; H287-S308 WeakPolarHBondContact CE1-CB 3.34Å; H287-S308 WeakPolarHBondContact ND1-CB 3.36Å; K289-S308 PolarHBondContact O-OG 3.01Å; G290-S308 WeakPolarHBondContact O-CA 3.44Å; G290-S308 PolarHBondContact O-OG 3.07Å; S308-D310 VanDerWaalsContact CB-OD1 3.26Å; S308-D310 WeakPolarHBondContact CB-OD1 3.24Å; S308-D310 PolarHBondContact O-N 3.28Å; S308-D310 PolarHBondContact OG-N 3.07Å; S308-D310 PolarHBondContact OG-OD1 3.47Å; S308-C311 PolarHBondContact O-N 2.93Å; S308-K312 PolarHBondContact N-O 3.44Å; S308-V335 PolarHBondContact O-N 2.93Å
309	M	95.1	Very high	93.4	Very high	64 Å²	64	18.9 Å²	18.9	32%	0.315	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-4.8	171.5	-57.5	176.8	-175.8	0	0	113.7	K289 G290 C311 A334 W571	K289-M309 HydrophobicContact CB-CB 3.92Å; K289-M309 HydrophobicContact CD-CB 4.1Å; K289-M309 VanDerWaalsContact CD-O 3.27Å; K289-M309 WeakPolarHBondContact CD-O 3.49Å; G290-M309 PolarHBondContact O-N 2.78Å; M309-C311 PolarHBondContact O-N 2.84Å; M309-A334 HydrophobicContact CB-CB 4.09Å; M309-A334 HydrophobicContact CG-CB 4.34Å; M309-W571 HydrophobicContact CE-CD2 4.16Å; M309-W571 HydrophobicContact CE-CG 4.36Å; M309-W571 HydrophobicContact CE-CZ2 4.01Å
310	D	94.1	Very high	93.3	Very high	15 Å²	15	16.8 Å²	16.8	8%	0.08	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	10.6	173.3	70.9	4	0	0	0	114.3	H287 T288 K289 S308 K312	H287-D310 WeakPolarHBondContact CA-OD2 3.48Å; H287-D310 IonicContact CE1-OD1 3.02Å; H287-D310 IonicContact CG-OD2 3.78Å; H287-D310 IonicContact ND1-OD1 2.67Å; H287-D310 PolarHBondContact ND1-OD1 2.9Å; H287-D310 IonicContact ND1-OD2 3.58Å; H287-D310 PolarHBondContact ND1-OD2 2.9Å; T288-D310 PolarHBondContact N-OD2 2.8Å; T288-D310 VanDerWaalsContact N-OD2 3.1Å; T288-D310 WeakPolarHBondContact OG1-CB 3.21Å; K289-D310 HydrophobicContact CB-CB 4.17Å; K289-D310 HydrophobicContact CD-CB 4.38Å; K289-D310 HydrophobicContact CG-CB 4.28Å; S308-D310 VanDerWaalsContact CB-OD1 3.26Å; S308-D310 WeakPolarHBondContact CB-OD1 3.24Å; S308-D310 PolarHBondContact O-N 3.28Å; S308-D310 PolarHBondContact OG-N 3.07Å; S308-D310 PolarHBondContact OG-OD1 3.47Å; D310-K312 PolarHBondContact O-N 2.99Å; D310-K312 VanDerWaalsContact OD1-CB 3.26Å; D310-K312 WeakPolarHBondContact OD1-CB 3.23Å; D310-K312 PolarHBondContact OD1-N 2.83Å
311	C	94	Very high	93.1	Very high	28 Å²	28	21.9 Å²	21.9	19%	0.189	12%	0.123	C	C	.	.	S	Bend	trans	66	12.8	-178.3	-45.1	0	0	0	0	114.2	S308 M309 H331 S332 K333	S308-C311 PolarHBondContact O-N 2.93Å; M309-C311 PolarHBondContact O-N 2.84Å; C311-H331 WeakPolarHBondContact CB-O 3.48Å; C311-S332 PolarHBondContact SG-O 2.87Å; C311-S332 VanDerWaalsContact SG-O 3.37Å; C311-K333 VanDerWaalsContact SG-CA 3.54Å
312	K	95.3	Very high	93.1	Very high	72 Å²	72	24.4 Å²	24.4	31%	0.313	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	150.4	179.5	-54.9	171.8	-174.7	173.4	0	111.1	S308 D310 T327 I329	S308-K312 PolarHBondContact N-O 3.44Å; D310-K312 PolarHBondContact O-N 2.99Å; D310-K312 VanDerWaalsContact OD1-CB 3.26Å; D310-K312 WeakPolarHBondContact OD1-CB 3.23Å; D310-K312 PolarHBondContact OD1-N 2.83Å; K312-T327 HydrophobicContact CB-CG2 3.94Å; K312-T327 HydrophobicContact CD-CG2 4.12Å; K312-T327 HydrophobicContact CG-CG2 4.22Å; K312-I329 HydrophobicContact CG-CG1 4.31Å
313	I	96.8	Very high	93	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	139.6	168.3	-50.9	174	0	0	0	106.4	L305 S306 C307 T327 F328 V335 I338 F347	L305-I313 HydrophobicContact CD2-CG2 4.01Å; S306-I313 CarbonylContact O-C 3.6Å; S306-I313 WeakPolarHBondContact O-CA 3.43Å; S306-I313 WeakPolarHBondContact O-CG2 3.44Å; C307-I313 HydrophobicContact CB-CG1 4.33Å; I313-T327 CarbonylContact O-C 3.54Å; I313-T327 WeakPolarHBondContact O-CA 3.48Å; I313-F328 HydrophobicContact CB-CB 4.24Å; I313-F328 HydrophobicContact CB-CD2 4.31Å; I313-F328 HydrophobicContact CG2-CD2 4.41Å; I313-F328 PolarHBondContact N-O 3.3Å; I313-F328 PolarHBondContact O-N 3.02Å; I313-V335 HydrophobicContact CD1-CG1 4.09Å; I313-V335 HydrophobicContact CD1-CG2 4.32Å; I313-V335 HydrophobicContact CG1-CB 4.47Å; I313-V335 HydrophobicContact CG1-CG1 4.18Å; I313-V335 HydrophobicContact CG1-CG2 4.02Å; I313-I338 HydrophobicContact CD1-CG2 4.27Å; I313-F347 HydrophobicContact CD1-CE2 3.89Å; I313-F347 HydrophobicContact CG2-CE2 3.96Å; I313-F347 HydrophobicContact CG2-CZ 4.36Å
314	K	96.2	Very high	93	Very high	21 Å²	21	31.6 Å²	31.6	9%	0.091	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140.8	179	-73.6	-172.3	162.2	-158.6	0	111	G286 L305 S306 W316 R326 T327	G286-K314 WeakPolarHBondContact O-CE 3.11Å; G286-K314 PolarHBondContact O-NZ 2.85Å; L305-K314 WeakPolarHBondContact CA-O 3.26Å; S306-K314 PolarHBondContact N-O 3.46Å; S306-K314 PolarHBondContact O-N 3.18Å; K314-W316 HydrophobicContact CB-CZ2 4.03Å; K314-W316 HydrophobicContact CD-CH2 4.05Å; K314-W316 HydrophobicContact CD-CZ2 3.46Å; K314-W316 VanDerWaalsContact CD-CZ2 3.46Å; K314-W316 HydrophobicContact CG-CZ2 4.4Å; K314-R326 WeakPolarHBondContact CA-O 3.34Å; K314-T327 WeakPolarHBondContact CE-OG1 3.21Å; K314-T327 HydrophobicContact CG-CG2 4.18Å
315	L	95.8	Very high	92.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	127	173	-163.5	161.2	0	0	0	108	Y254 L303 L304 L305 L325 R326 F328	Y254-L315 HydrophobicContact CD2-CD2 4.3Å; Y254-L315 HydrophobicContact CE2-CD1 3.95Å; Y254-L315 HydrophobicContact CE2-CD2 3.91Å; L303-L315 HydrophobicContact CB-CD2 4.13Å; L303-L315 HydrophobicContact CD1-CD2 4.1Å; L303-L315 HydrophobicContact CD2-CD2 3.99Å; L303-L315 HydrophobicContact CG-CD2 4.28Å; L304-L315 CarbonylContact O-C 3.4Å; L304-L315 WeakPolarHBondContact O-CA 3.43Å; L305-L315 HydrophobicContact CD2-CB 3.75Å; L305-L315 HydrophobicContact CD2-CD1 4.1Å; L305-L315 HydrophobicContact CD2-CG 3.96Å; L305-L315 HydrophobicContact CG-CG 4.49Å; L315-L325 HydrophobicContact CD2-CB 3.93Å; L315-L325 HydrophobicContact CD2-CD1 3.46Å; L315-L325 VanDerWaalsContact CD2-CD1 3.46Å; L315-L325 HydrophobicContact CD2-CG 4.29Å; L315-L325 PolarHBondContact O-N 3.24Å; L315-R326 PolarHBondContact N-O 3.32Å; L315-R326 PolarHBondContact O-N 3.28Å; L315-F328 HydrophobicContact CB-CE2 4.06Å
316	W	95	Very high	92.7	Very high	9 Å²	9	32.7 Å²	32.7	3%	0.034	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	149.7	-175.9	-49.7	83.4	0	0	0	110.3	W284 L303 L304 S306 K314 R323 C324	W284-W316 HydrophobicContact CB-CD2 4.11Å; W284-W316 HydrophobicContact CB-CE3 3.86Å; W284-W316 HydrophobicContact CB-CH2 4.03Å; W284-W316 HydrophobicContact CB-CZ2 4.28Å; W284-W316 HydrophobicContact CB-CZ3 3.82Å; W284-W316 AromaticContact CD1-CD2 3.87Å; W284-W316 AromaticContact CD1-CE3 3.34Å; W284-W316 AromaticContact CD1-CZ3 3.93Å; W284-W316 HydrophobicContact CG-CD2 4.09Å; W284-W316 AromaticContact CG-CE3 3.85Å; W284-W316 HydrophobicContact CG-CE3 3.85Å; W284-W316 HydrophobicContact CG-CG 4.49Å; W284-W316 HydrophobicContact CG-CZ3 4.26Å; L303-W316 WeakPolarHBondContact CA-O 3.5Å; L304-W316 HydrophobicContact CB-CB 4.41Å; L304-W316 HydrophobicContact CD2-CB 4.26Å; L304-W316 VanDerWaalsContact CD2-CD1 3.42Å; L304-W316 HydrophobicContact CD2-CG 4.09Å; L304-W316 PolarHBondContact N-O 3.03Å; L304-W316 PolarHBondContact O-N 3.13Å; S306-W316 PolarHBondContact OG-NE1 3.33Å; K314-W316 HydrophobicContact CB-CZ2 4.03Å; K314-W316 HydrophobicContact CD-CH2 4.05Å; K314-W316 HydrophobicContact CD-CZ2 3.46Å; K314-W316 VanDerWaalsContact CD-CZ2 3.46Å; K314-W316 HydrophobicContact CG-CZ2 4.4Å; W316-R323 WeakPolarHBondContact CA-O 3.42Å; W316-C324 HydrophobicContact CD2-CB 4.41Å; W316-C324 HydrophobicContact CE3-CB 3.65Å; W316-C324 HydrophobicContact CH2-CB 4.24Å; W316-C324 HydrophobicContact CZ3-CB 3.56Å
317	E	92.8	Very high	92.7	Very high	54 Å²	54	32.9 Å²	32.9	25%	0.252	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	136.2	168.6	-160.8	-170.6	167.4	0	0	109.9	W284 Y319 R322 R323 L325	W284-E317 PolarHBondContact NE1-O 3.29Å; E317-Y319 VanDerWaalsContact CD-O 3.26Å; E317-Y319 WeakPolarHBondContact CG-O 3.47Å; E317-R322 WeakPolarHBondContact O-CA 3.47Å; E317-R323 PolarHBondContact N-O 3.11Å; E317-L325 HydrophobicContact CB-CD1 4.13Å; E317-L325 HydrophobicContact CB-CG 4.48Å
318	V	91.4	Very high	92.7	Very high	2 Å²	2	33 Å²	33	1%	0.012	17%	0.169	C	C	.	.	S	Bend	trans	-88.9	-33.5	177.1	179	0	0	0	0	111.7	L296 G301 H302 L304 R322 I567	L296-V318 HydrophobicContact CD2-CG2 3.92Å; G301-V318 WeakPolarHBondContact O-CG2 3.49Å; H302-V318 WeakPolarHBondContact O-CB 3.47Å; H302-V318 PolarHBondContact O-N 3.38Å; L304-V318 HydrophobicContact CB-CG2 3.8Å; V318-R322 PolarHBondContact O-NE 2.83Å; V318-I567 HydrophobicContact CG1-CD1 4.34Å; V318-I567 HydrophobicContact CG2-CD1 4.41Å
319	Y	87.9	Confident	92.6	Very high	21 Å²	21	35.3 Å²	35.3	8%	0.082	18%	0.181	C	C	.	.	S	Bend	trans	-101	-170.3	177.5	-61.9	-81.7	0	0	0	110.7	V261 L265 H302 E317 D321 R322 H559 E562	V261-Y319 HydrophobicContact CB-CD1 4.41Å; V261-Y319 HydrophobicContact CG1-CD1 3.68Å; V261-Y319 HydrophobicContact CG1-CE1 3.54Å; V261-Y319 HydrophobicContact CG1-CG 4.33Å; V261-Y319 HydrophobicContact CG2-CD1 3.75Å; V261-Y319 HydrophobicContact CG2-CD2 4.18Å; V261-Y319 HydrophobicContact CG2-CE1 4.38Å; V261-Y319 HydrophobicContact CG2-CG 3.64Å; L265-Y319 HydrophobicContact CD1-CD2 4.09Å; L265-Y319 HydrophobicContact CD1-CE2 3.76Å; L265-Y319 HydrophobicContact CD2-CE2 4.19Å; H302-Y319 HydrophobicContact CB-CD2 4.16Å; H302-Y319 HydrophobicContact CB-CE2 4.43Å; E317-Y319 VanDerWaalsContact CD-O 3.26Å; E317-Y319 WeakPolarHBondContact CG-O 3.47Å; Y319-D321 PolarHBondContact O-N 3.02Å; Y319-R322 PolarHBondContact O-N 2.77Å; Y319-R322 VanDerWaalsContact O-N 3.09Å; Y319-H559 AromaticContact CE2-NE2 3.81Å; Y319-H559 AromaticContact CZ-NE2 3.85Å; Y319-H559 PolarHBondContact OH-CE1 3.25Å; Y319-H559 PolarHBondContact OH-ND1 2.62Å; Y319-H559 PolarHBondContact OH-NE2 3.04Å; Y319-E562 PolarHBondContact OH-OE2 3Å
320	G	84.1	Confident	92.4	Very high	57 Å²	57	32.4 Å²	32.4	59%	0.588	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	-133.8	-179.4	0	0	0	0	0	113.4	R322	G320-R322 PolarHBondContact O-N 2.98Å
321	D	81.6	Confident	92.3	Very high	108 Å²	108	32.3 Å²	32.3	58%	0.578	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	1.1	-179.4	-77.5	-22.3	0	0	0	113.7	Y319 R323	Y319-D321 PolarHBondContact O-N 3.02Å; D321-R323 HydrophobicContact CB-CG 3.69Å; D321-R323 VanDerWaalsContact CB-NE 3.31Å; D321-R323 PolarHBondContact O-N 3.18Å; D321-R323 IonicContact OD2-CZ 2.99Å; D321-R323 IonicContact OD2-NE 2.62Å; D321-R323 PolarHBondContact OD2-NE 3.19Å; D321-R323 VanDerWaalsContact OD2-NE 3.13Å; D321-R323 IonicContact OD2-NH2 3.94Å; D321-R323 PolarHBondContact OD2-NH2 3.06Å
322	R	89.1	Confident	92.2	Very high	52 Å²	52	33.8 Å²	33.8	20%	0.196	18%	0.177	C	C	.	.			trans	56.6	34.7	175.6	-60.4	-174.1	-179.1	126.6	7.3	114.2	W284 E317 V318 Y319 G320	W284-R322 VanDerWaalsContact CD1-O 3.26Å; W284-R322 HydrophobicContact CZ2-CB 4.49Å; W284-R322 PolarHBondContact NE1-O 3.29Å; W284-R322 VanDerWaalsContact NE1-O 3.12Å; E317-R322 WeakPolarHBondContact O-CA 3.47Å; V318-R322 PolarHBondContact O-NE 2.83Å; Y319-R322 PolarHBondContact O-N 2.77Å; Y319-R322 VanDerWaalsContact O-N 3.09Å; G320-R322 PolarHBondContact O-N 2.98Å
323	R	91.1	Very high	92.1	Very high	135 Å²	135	33.8 Å²	33.8	51%	0.509	18%	0.177	S	C	.	.			trans	-73	155.5	-171.9	-61.3	173.2	-178.6	-174.1	0.3	111.3	W316 E317 D321 L325	W316-R323 WeakPolarHBondContact CA-O 3.42Å; E317-R323 PolarHBondContact N-O 3.11Å; D321-R323 HydrophobicContact CB-CG 3.69Å; D321-R323 VanDerWaalsContact CB-NE 3.31Å; D321-R323 PolarHBondContact O-N 3.18Å; D321-R323 IonicContact OD2-CZ 2.99Å; D321-R323 IonicContact OD2-NE 2.62Å; D321-R323 PolarHBondContact OD2-NE 3.19Å; D321-R323 VanDerWaalsContact OD2-NE 3.13Å; D321-R323 IonicContact OD2-NH2 3.94Å; D321-R323 PolarHBondContact OD2-NH2 3.06Å; R323-L325 PolarHBondContact O-N 3.43Å
324	C	93.1	Very high	92	Very high	24 Å²	24	34.7 Å²	34.7	16%	0.162	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	115	160.8	-171.7	0	0	0	0	107.1	H242 W316	H242-C324 WeakPolarHBondContact CB-O 3.29Å; W316-C324 HydrophobicContact CD2-CB 4.41Å; W316-C324 HydrophobicContact CE3-CB 3.65Å; W316-C324 HydrophobicContact CH2-CB 4.24Å; W316-C324 HydrophobicContact CZ3-CB 3.56Å
325	L	92.3	Very high	92	Very high	11 Å²	11	33.8 Å²	33.8	6%	0.058	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-56	-179.7	-70.8	164.6	0	0	0	110	L241 H242 V243 Y254 L303 L315 E317 R323	L241-L325 WeakPolarHBondContact CD1-O 3.39Å; H242-L325 PolarHBondContact N-O 3.04Å; V243-L325 HydrophobicContact CG1-CD2 3.85Å; V243-L325 HydrophobicContact CG2-CD2 4.12Å; Y254-L325 HydrophobicContact CD1-CD2 4.37Å; Y254-L325 HydrophobicContact CD2-CD1 3.91Å; Y254-L325 HydrophobicContact CE2-CD1 4.41Å; Y254-L325 HydrophobicContact CG-CD1 4.06Å; Y254-L325 HydrophobicContact CG-CD2 4.37Å; L303-L325 HydrophobicContact CD2-CD1 3.56Å; L315-L325 HydrophobicContact CD2-CB 3.93Å; L315-L325 HydrophobicContact CD2-CD1 3.46Å; L315-L325 VanDerWaalsContact CD2-CD1 3.46Å; L315-L325 HydrophobicContact CD2-CG 4.29Å; L315-L325 PolarHBondContact O-N 3.24Å; E317-L325 HydrophobicContact CB-CD1 4.13Å; E317-L325 HydrophobicContact CB-CG 4.48Å; R323-L325 PolarHBondContact O-N 3.43Å
326	R	93.5	Very high	92	Very high	12 Å²	12	36.3 Å²	36.3	5%	0.045	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	144.5	-177.8	-173.9	172.5	-77.4	145.4	-10.2	112.9	I240 L241 M246 Y254 K314 L315 F328 T361 E362 T363	I240-R326 CarbonylContact O-C 3.46Å; I240-R326 WeakPolarHBondContact O-CA 3.45Å; L241-R326 HydrophobicContact CD1-CB 4.32Å; M246-R326 PolarHBondContact SD-NH2 2.93Å; M246-R326 VanDerWaalsContact SD-NH2 3.38Å; Y254-R326 PolarHBondContact OH-NH1 2.9Å; K314-R326 WeakPolarHBondContact CA-O 3.34Å; L315-R326 PolarHBondContact N-O 3.32Å; L315-R326 PolarHBondContact O-N 3.28Å; R326-F328 HydrophobicContact CB-CE2 4.26Å; R326-F328 HydrophobicContact CB-CZ 4.5Å; R326-F328 HydrophobicContact CG-CD2 4.47Å; R326-F328 HydrophobicContact CG-CE2 4.14Å; R326-F328 HydrophobicContact CG-CZ 4.21Å; R326-T361 PolarHBondContact NH1-O 2.84Å; R326-E362 VanDerWaalsContact CZ-O 3.25Å; R326-E362 PolarHBondContact NH1-O 2.91Å; R326-E362 PolarHBondContact NH2-O 3.17Å; R326-T363 PolarHBondContact NH2-O 3.04Å
327	T	95.4	Very high	92	Very high	5 Å²	5	36.2 Å²	36.2	3%	0.031	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	132.6	162.7	-54.1	0	0	0	0	109.9	T239 I240 H242 K312 I313 K314 I329	T239-T327 WeakPolarHBondContact CA-O 3.05Å; I240-T327 PolarHBondContact N-O 2.82Å; I240-T327 PolarHBondContact O-N 3.4Å; H242-T327 PolarHBondContact NE2-OG1 3.07Å; K312-T327 HydrophobicContact CB-CG2 3.94Å; K312-T327 HydrophobicContact CD-CG2 4.12Å; K312-T327 HydrophobicContact CG-CG2 4.22Å; I313-T327 CarbonylContact O-C 3.54Å; I313-T327 WeakPolarHBondContact O-CA 3.48Å; K314-T327 WeakPolarHBondContact CE-OG1 3.21Å; K314-T327 HydrophobicContact CG-CG2 4.18Å; T327-I329 HydrophobicContact CG2-CD1 4.29Å; T327-I329 HydrophobicContact CG2-CG1 3.83Å
328	F	95.6	Very high	92.2	Very high	1 Å²	1	33.6 Å²	33.6	0%	0.004	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	130.8	169.4	-47.9	-109.3	0	0	0	109	T239 L305 I313 L315 R326 F347 W359	T239-F328 HydrophobicContact CG2-CB 4.38Å; T239-F328 HydrophobicContact CG2-CD1 3.89Å; T239-F328 HydrophobicContact CG2-CG 4.37Å; L305-F328 HydrophobicContact CD2-CE2 4.31Å; I313-F328 HydrophobicContact CB-CB 4.24Å; I313-F328 HydrophobicContact CB-CD2 4.31Å; I313-F328 HydrophobicContact CG2-CD2 4.41Å; I313-F328 PolarHBondContact N-O 3.3Å; I313-F328 PolarHBondContact O-N 3.02Å; L315-F328 HydrophobicContact CB-CE2 4.06Å; R326-F328 HydrophobicContact CB-CE2 4.26Å; R326-F328 HydrophobicContact CB-CZ 4.5Å; R326-F328 HydrophobicContact CG-CD2 4.47Å; R326-F328 HydrophobicContact CG-CE2 4.14Å; R326-F328 HydrophobicContact CG-CZ 4.21Å; F328-F347 HydrophobicContact CD1-CE1 4.05Å; F328-F347 AromaticContact CD1-CZ 3.7Å; F328-F347 HydrophobicContact CD1-CZ 3.7Å; F328-F347 HydrophobicContact CD2-CE1 4.48Å; F328-F347 AromaticContact CD2-CZ 3.87Å; F328-F347 HydrophobicContact CD2-CZ 3.87Å; F328-F347 AromaticContact CE1-CE1 3.47Å; F328-F347 HydrophobicContact CE1-CE1 3.47Å; F328-F347 VanDerWaalsContact CE1-CE1 3.47Å; F328-F347 AromaticContact CE1-CZ 3.6Å; F328-F347 HydrophobicContact CE1-CZ 3.6Å; F328-F347 HydrophobicContact CE2-CE1 4.03Å; F328-F347 AromaticContact CE2-CZ 3.84Å; F328-F347 HydrophobicContact CE2-CZ 3.84Å; F328-F347 AromaticContact CG-CZ 3.84Å; F328-F347 HydrophobicContact CG-CZ 3.84Å; F328-F347 AromaticContact CZ-CE1 3.49Å; F328-F347 HydrophobicContact CZ-CE1 3.49Å; F328-F347 VanDerWaalsContact CZ-CE1 3.49Å; F328-F347 AromaticContact CZ-CZ 3.71Å; F328-F347 HydrophobicContact CZ-CZ 3.71Å; F328-W359 HydrophobicContact CB-CE3 4.35Å; F328-W359 HydrophobicContact CB-CH2 4.35Å; F328-W359 HydrophobicContact CB-CZ3 4.27Å; F328-W359 HydrophobicContact CD1-CB 4.42Å; F328-W359 HydrophobicContact CD1-CD2 4.13Å; F328-W359 AromaticContact CD1-CE3 3.79Å; F328-W359 HydrophobicContact CD1-CE3 3.79Å; F328-W359 HydrophobicContact CD1-CG 4.43Å; F328-W359 HydrophobicContact CD1-CZ3 4.35Å; F328-W359 HydrophobicContact CE1-CB 4.45Å
329	I	94.3	Very high	92.4	Very high	50 Å²	50	34.3 Å²	34.3	26%	0.256	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	138	-178.9	-47.3	-179.7	0	0	0	107.5	E237 K238 I240 K312 T327	E237-I329 WeakPolarHBondContact CA-O 3.41Å; K238-I329 PolarHBondContact N-O 2.84Å; K238-I329 WeakPolarHBondContact O-CA 3.36Å; K238-I329 VanDerWaalsContact O-CB 3.26Å; K238-I329 WeakPolarHBondContact O-CB 3.4Å; K238-I329 PolarHBondContact O-N 3.37Å; K238-I329 VanDerWaalsContact O-O 3.11Å; I240-I329 HydrophobicContact CD1-CD1 3.85Å; I240-I329 HydrophobicContact CG1-CD1 4.42Å; K312-I329 HydrophobicContact CG-CG1 4.31Å; T327-I329 HydrophobicContact CG2-CD1 4.29Å; T327-I329 HydrophobicContact CG2-CG1 3.83Å
330	G	90.2	Very high	92.7	Very high	3 Å²	3	34.1 Å²	34.1	3%	0.031	18%	0.183	C	C	.	.			trans	158.2	-10.5	174.4	0	0	0	0	0	114.8	E236 K357	E236-G330 WeakPolarHBondContact O-CA 3.31Å; G330-K357 VanDerWaalsContact C-NZ 3.27Å; G330-K357 PolarHBondContact O-NZ 3.03Å
331	H	93.4	Very high	93.1	Very high	12 Å²	12	31.9 Å²	31.9	6%	0.056	16%	0.157	C	C	.	.			trans	-74	140	165.1	-77.9	-69.4	0	0	0	110.3	C311 V335 S349 A351 D353 Y355	C311-H331 WeakPolarHBondContact CB-O 3.48Å; H331-V335 HydrophobicContact CB-CG2 4.04Å; H331-S349 PolarHBondContact NE2-OG 3.21Å; H331-A351 HydrophobicContact CB-CB 4.1Å; H331-A351 WeakPolarHBondContact ND1-CB 3.45Å; H331-D353 WeakPolarHBondContact CA-OD2 3.46Å; H331-D353 WeakPolarHBondContact CB-OD2 3.28Å; H331-D353 IonicContact CE1-OD1 3.92Å; H331-D353 IonicContact CG-OD2 3.69Å; H331-D353 IonicContact ND1-OD1 3.01Å; H331-D353 PolarHBondContact ND1-OD1 2.94Å; H331-D353 IonicContact ND1-OD2 3.29Å; H331-D353 PolarHBondContact ND1-OD2 3.21Å; H331-Y355 PolarHBondContact CE1-O 2.74Å
332	S	91.7	Very high	93.5	Very high	60 Å²	60	29.3 Å²	29.3	42%	0.42	15%	0.146	S	C	.	.	S	Bend	trans	-75.3	-36.4	176.8	176.3	0	0	0	0	110.8	C311 D353	C311-S332 PolarHBondContact SG-O 2.87Å; C311-S332 VanDerWaalsContact SG-O 3.37Å; S332-D353 PolarHBondContact N-OD2 3.32Å
333	K	93.7	Very high	93.5	Very high	72 Å²	72	30 Å²	30	31%	0.313	16%	0.163	S	C	.	.	S	Bend	trans	-121.9	172	-176.1	-66.8	176	177.2	130.6	0	111.8	E232 C311 V335 Y352 D353	E232-K333 WeakPolarHBondContact OE1-CE 3.47Å; E232-K333 IonicContact OE1-NZ 3.16Å; E232-K333 PolarHBondContact OE1-NZ 2.91Å; E232-K333 WeakPolarHBondContact OE2-CE 3.41Å; E232-K333 IonicContact OE2-NZ 3.13Å; E232-K333 PolarHBondContact OE2-NZ 2.94Å; C311-K333 VanDerWaalsContact SG-CA 3.54Å; K333-V335 PolarHBondContact O-N 3.4Å; K333-Y352 WeakPolarHBondContact CD-O 3.26Å; K333-D353 HydrophobicContact CB-CB 4.07Å; K333-D353 HydrophobicContact CD-CB 4.48Å; K333-D353 HydrophobicContact CG-CB 4.31Å
334	A	94.9	Very high	93.4	Very high	20 Å²	20	23.6 Å²	23.6	17%	0.165	14%	0.139	C	C	.	.			trans	-47.7	133.9	178.8	0	0	0	0	0	112.3	M309 A351 Y352	M309-A334 HydrophobicContact CB-CB 4.09Å; M309-A334 HydrophobicContact CG-CB 4.34Å; A334-A351 WeakPolarHBondContact O-CA 3.39Å; A334-A351 WeakPolarHBondContact O-CB 3.35Å; A334-Y352 HydrophobicContact CB-CD2 3.92Å; A334-Y352 WeakPolarHBondContact O-CD2 3.47Å; A334-Y352 PolarHBondContact O-N 3.35Å
335	V	96	Very high	93.4	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.006	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	132.1	174.9	-174.6	0	0	0	0	107.9	S292 C307 S308 I313 H331 K333 I338 A350 A351	S292-V335 WeakPolarHBondContact CB-O 3.43Å; S292-V335 PolarHBondContact OG-O 3.11Å; C307-V335 HydrophobicContact CB-CB 3.87Å; C307-V335 HydrophobicContact CB-CG1 3.58Å; S308-V335 PolarHBondContact O-N 2.93Å; I313-V335 HydrophobicContact CD1-CG1 4.09Å; I313-V335 HydrophobicContact CD1-CG2 4.32Å; I313-V335 HydrophobicContact CG1-CB 4.47Å; I313-V335 HydrophobicContact CG1-CG1 4.18Å; I313-V335 HydrophobicContact CG1-CG2 4.02Å; H331-V335 HydrophobicContact CB-CG2 4.04Å; K333-V335 PolarHBondContact O-N 3.4Å; V335-I338 HydrophobicContact CG1-CG2 4.29Å; V335-A350 WeakPolarHBondContact CG1-O 3.4Å; V335-A351 HydrophobicContact CB-CB 4.45Å; V335-A351 HydrophobicContact CG2-CB 4.21Å
336	R	94.8	Very high	93.5	Very high	53 Å²	53	27.5 Å²	27.5	20%	0.2	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-44.8	-171.3	177.9	58.5	-166.5	106.8	-6.5	113.6	S292 A350 Y352 Y377 A511	S292-R336 PolarHBondContact O-NH1 3.34Å; R336-A350 PolarHBondContact N-O 2.83Å; R336-Y352 HydrophobicContact CB-CD2 4.42Å; R336-Y352 HydrophobicContact CB-CE2 3.98Å; R336-Y352 WeakPolarHBondContact CD-OH 3.32Å; R336-Y352 HydrophobicContact CG-CE2 4.34Å; R336-Y377 VanDerWaalsContact CG-O 3.28Å; R336-Y377 WeakPolarHBondContact CG-O 3.28Å; R336-A511 VanDerWaalsContact NH2-CB 3.27Å
337	D	95.3	Very high	93.7	Very high	7 Å²	7	26.9 Å²	26.9	4%	0.037	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	159.7	-177.5	-170.6	29.2	0	0	0	110.4	R295 A350 C378 V379	R295-D337 IonicContact CZ-OD1 2.66Å; R295-D337 IonicContact NE-OD1 2.69Å; R295-D337 IonicContact NH2-OD1 3.98Å; R295-D337 PolarHBondContact NH2-OD1 2.82Å; R295-D337 IonicContact NH2-OD2 3.98Å; D337-A350 PolarHBondContact O-N 2.8Å; D337-C378 WeakPolarHBondContact OD2-CA 3.33Å; D337-C378 PolarHBondContact OD2-SG 2.85Å; D337-V379 PolarHBondContact OD2-N 2.68Å
338	I	96.2	Very high	93.7	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	147	-176.3	43.3	161.7	0	0	0	110.2	A293 R295 L305 C307 I313 V335 L348	A293-I338 HydrophobicContact CB-CG1 4.44Å; R295-I338 HydrophobicContact CB-CD1 4.18Å; R295-I338 HydrophobicContact CG-CD1 3.84Å; R295-I338 HydrophobicContact CG-CG1 3.76Å; R295-I338 WeakPolarHBondContact CG-O 3.27Å; R295-I338 PolarHBondContact NE-O 2.67Å; R295-I338 VanDerWaalsContact NE-O 3.09Å; L305-I338 HydrophobicContact CB-CD1 3.62Å; C307-I338 HydrophobicContact CB-CD1 4.37Å; C307-I338 HydrophobicContact CB-CG1 4.34Å; C307-I338 HydrophobicContact CB-CG2 3.9Å; I313-I338 HydrophobicContact CD1-CG2 4.27Å; V335-I338 HydrophobicContact CG1-CG2 4.29Å; I338-L348 WeakPolarHBondContact CA-O 3.39Å
339	C	95.6	Very high	93.7	Very high	17 Å²	17	26.6 Å²	26.6	12%	0.115	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	129.8	174.3	-165.4	0	0	0	0	110.7	F347 L348 V379 F381	C339-F347 CarbonylContact O-C 3.57Å; C339-F347 VanDerWaalsContact O-CA 3.27Å; C339-F347 WeakPolarHBondContact O-CA 3.39Å; C339-F347 WeakPolarHBondContact O-CB 3.41Å; C339-L348 PolarHBondContact N-O 2.82Å; C339-L348 PolarHBondContact O-N 2.92Å; C339-V379 WeakPolarHBondContact CB-O 3.33Å; C339-F381 HydrophobicContact CB-CD2 4.42Å
340	F	95.1	Very high	93.8	Very high	16 Å²	16	24.2 Å²	24.2	7%	0.07	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	156.2	164.6	-73.5	-80.3	0	0	0	110.9	R295 L296 F297 P298 L305 F347 T361 F381	R295-F340 HydrophobicContact CB-CD2 4.32Å; R295-F340 HydrophobicContact CB-CE2 4.34Å; L296-F340 WeakPolarHBondContact O-CD2 3.39Å; L296-F340 WeakPolarHBondContact O-CE2 3.45Å; F297-F340 HydrophobicContact CD2-CD1 4.41Å; F297-F340 AromaticContact CD2-CE1 3.75Å; F297-F340 HydrophobicContact CD2-CE1 3.75Å; F297-F340 AromaticContact CD2-CZ 3.8Å; F297-F340 HydrophobicContact CD2-CZ 3.8Å; F297-F340 HydrophobicContact CE2-CE1 4.13Å; P298-F340 HydrophobicContact CG-CB 4.13Å; P298-F340 HydrophobicContact CG-CG 4.48Å; L305-F340 HydrophobicContact CB-CE2 4.05Å; L305-F340 HydrophobicContact CB-CZ 4.07Å; L305-F340 HydrophobicContact CD1-CD1 4Å; L305-F340 HydrophobicContact CD1-CD2 4.22Å; L305-F340 HydrophobicContact CD1-CE1 3.47Å; L305-F340 VanDerWaalsContact CD1-CE1 3.47Å; L305-F340 HydrophobicContact CD1-CE2 3.71Å; L305-F340 HydrophobicContact CD1-CG 4.37Å; L305-F340 HydrophobicContact CD1-CZ 3.33Å; L305-F340 HydrophobicContact CG-CE1 3.99Å; L305-F340 HydrophobicContact CG-CE2 3.9Å; L305-F340 HydrophobicContact CG-CZ 3.42Å; L305-F340 VanDerWaalsContact CG-CZ 3.42Å; F340-F347 HydrophobicContact CD1-CB 4.11Å; F340-T361 HydrophobicContact CD1-CG2 4.28Å; F340-T361 HydrophobicContact CE1-CG2 3.93Å; F340-F381 VanDerWaalsContact C-CD2 3.42Å; F340-F381 WeakPolarHBondContact O-CD2 3.47Å
341	N	93.2	Very high	94	Very high	10 Å²	10	24.1 Å²	24.1	5%	0.053	14%	0.141	C	C	.	.			trans	-71.4	167.5	157.3	70.2	-16.7	0	0	0	110.2	P298 A343 G344 T345 Q346 F381	P298-N341 WeakPolarHBondContact CG-O 3.41Å; N341-A343 VanDerWaalsContact C-N 3.28Å; N341-A343 PolarHBondContact O-N 3.29Å; N341-G344 PolarHBondContact O-N 3.09Å; N341-G344 VanDerWaalsContact O-N 3.11Å; N341-G344 WeakPolarHBondContact OD1-CA 3.47Å; N341-G344 PolarHBondContact OD1-N 3.13Å; N341-T345 PolarHBondContact ND2-OG1 3.13Å; N341-T345 PolarHBondContact OD1-N 3.24Å; N341-Q346 PolarHBondContact N-O 2.89Å; N341-Q346 PolarHBondContact ND2-N 2.94Å; N341-Q346 PolarHBondContact OD1-N 2.78Å; N341-Q346 PolarHBondContact OD1-O 3.43Å; N341-F381 HydrophobicContact CB-CD1 4.01Å; N341-F381 HydrophobicContact CB-CD2 4.17Å; N341-F381 HydrophobicContact CB-CE1 3.88Å; N341-F381 HydrophobicContact CB-CE2 4.05Å; N341-F381 HydrophobicContact CB-CG 4.13Å; N341-F381 HydrophobicContact CB-CZ 3.89Å
342	T	89.8	Confident	94.1	Very high	54 Å²	54	27.8 Å²	27.8	33%	0.331	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-32.7	-174.9	-58.8	0	0	0	0	112.8	P298 P383 Q388	P298-T342 WeakPolarHBondContact CB-O 3.36Å; P298-T342 WeakPolarHBondContact CG-O 3.31Å; T342-P383 WeakPolarHBondContact OG1-CA 3.35Å; T342-P383 PolarHBondContact OG1-O 3.26Å; T342-Q388 PolarHBondContact OG1-NE2 3.13Å
343	A	89	Confident	94	Very high	68 Å²	68	25.2 Å²	25.2	56%	0.562	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-14.4	176.8	0	0	0	0	0	114.3	N341 T345	N341-A343 VanDerWaalsContact C-N 3.28Å; N341-A343 PolarHBondContact O-N 3.29Å; A343-T345 VanDerWaalsContact C-N 3.26Å; A343-T345 HydrophobicContact CB-CG2 4.42Å; A343-T345 PolarHBondContact O-N 3.2Å
344	G	89.4	Confident	94	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	S	Bend	trans	75.2	-1.9	-176	0	0	0	0	0	116.4	F297 P298 N341 Q346 T361	F297-G344 VanDerWaalsContact CE2-O 3.31Å; F297-G344 WeakPolarHBondContact CE2-O 3.37Å; P298-G344 VanDerWaalsContact CG-CA 3.44Å; N341-G344 PolarHBondContact O-N 3.09Å; N341-G344 VanDerWaalsContact O-N 3.11Å; N341-G344 WeakPolarHBondContact OD1-CA 3.47Å; N341-G344 PolarHBondContact OD1-N 3.13Å; G344-Q346 VanDerWaalsContact C-N 3.33Å; G344-Q346 PolarHBondContact O-N 3.23Å; G344-T361 WeakPolarHBondContact O-CG2 3.23Å; G344-T361 PolarHBondContact O-OG1 2.85Å
345	T	92.6	Very high	93.9	Very high	60 Å²	60	29.4 Å²	29.4	37%	0.368	15%	0.147	S	C	.	.	S	Bend	trans	-68.7	-27.9	178.6	55	0	0	0	0	113.7	L255 N341 A343 T361	L255-T345 HydrophobicContact CD1-CG2 4.47Å; N341-T345 PolarHBondContact ND2-OG1 3.13Å; N341-T345 PolarHBondContact OD1-N 3.24Å; A343-T345 VanDerWaalsContact C-N 3.26Å; A343-T345 HydrophobicContact CB-CG2 4.42Å; A343-T345 PolarHBondContact O-N 3.2Å; T345-T361 VanDerWaalsContact C-OG1 3.25Å; T345-T361 PolarHBondContact O-N 3.17Å; T345-T361 PolarHBondContact O-OG1 3.14Å
346	Q	94.8	Very high	93.9	Very high	56 Å²	56	29.5 Å²	29.5	26%	0.262	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	155.1	-178.1	-63.1	177.8	-5.2	0	0	110.6	N341 G344 L358 W359 I367	N341-Q346 PolarHBondContact N-O 2.89Å; N341-Q346 PolarHBondContact ND2-N 2.94Å; N341-Q346 PolarHBondContact OD1-N 2.78Å; N341-Q346 PolarHBondContact OD1-O 3.43Å; G344-Q346 VanDerWaalsContact C-N 3.33Å; G344-Q346 PolarHBondContact O-N 3.23Å; Q346-L358 HydrophobicContact CB-CD1 4.03Å; Q346-W359 WeakPolarHBondContact CA-O 3.41Å; Q346-I367 HydrophobicContact CG-CD1 3.96Å
347	F	96	Very high	93.9	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	149.4	170.5	71.2	-80	0	0	0	112.1	L305 I313 F328 C339 F340 W359 T361	L305-F347 HydrophobicContact CD1-CB 3.79Å; L305-F347 HydrophobicContact CD1-CD1 3.93Å; L305-F347 HydrophobicContact CD1-CD2 3.76Å; L305-F347 HydrophobicContact CD1-CE1 4.4Å; L305-F347 HydrophobicContact CD1-CE2 4.28Å; L305-F347 HydrophobicContact CD1-CG 3.55Å; L305-F347 HydrophobicContact CD2-CZ 4.45Å; I313-F347 HydrophobicContact CD1-CE2 3.89Å; I313-F347 HydrophobicContact CG2-CE2 3.96Å; I313-F347 HydrophobicContact CG2-CZ 4.36Å; F328-F347 HydrophobicContact CD1-CE1 4.05Å; F328-F347 AromaticContact CD1-CZ 3.7Å; F328-F347 HydrophobicContact CD1-CZ 3.7Å; F328-F347 HydrophobicContact CD2-CE1 4.48Å; F328-F347 AromaticContact CD2-CZ 3.87Å; F328-F347 HydrophobicContact CD2-CZ 3.87Å; F328-F347 AromaticContact CE1-CE1 3.47Å; F328-F347 HydrophobicContact CE1-CE1 3.47Å; F328-F347 VanDerWaalsContact CE1-CE1 3.47Å; F328-F347 AromaticContact CE1-CZ 3.6Å; F328-F347 HydrophobicContact CE1-CZ 3.6Å; F328-F347 HydrophobicContact CE2-CE1 4.03Å; F328-F347 AromaticContact CE2-CZ 3.84Å; F328-F347 HydrophobicContact CE2-CZ 3.84Å; F328-F347 AromaticContact CG-CZ 3.84Å; F328-F347 HydrophobicContact CG-CZ 3.84Å; F328-F347 AromaticContact CZ-CE1 3.49Å; F328-F347 HydrophobicContact CZ-CE1 3.49Å; F328-F347 VanDerWaalsContact CZ-CE1 3.49Å; F328-F347 AromaticContact CZ-CZ 3.71Å; F328-F347 HydrophobicContact CZ-CZ 3.71Å; C339-F347 CarbonylContact O-C 3.57Å; C339-F347 VanDerWaalsContact O-CA 3.27Å; C339-F347 WeakPolarHBondContact O-CA 3.39Å; C339-F347 WeakPolarHBondContact O-CB 3.41Å; F340-F347 HydrophobicContact CD1-CB 4.11Å; F347-W359 HydrophobicContact CD1-CB 3.76Å; F347-W359 HydrophobicContact CD2-CB 4.32Å; F347-W359 HydrophobicContact CD2-CG 4.5Å; F347-W359 HydrophobicContact CE1-CB 3.3Å; F347-W359 HydrophobicContact CE1-CG 4.06Å; F347-W359 HydrophobicContact CE2-CB 3.88Å; F347-W359 AromaticContact CE2-CD1 3.48Å; F347-W359 VanDerWaalsContact CE2-CD1 3.48Å; F347-W359 AromaticContact CE2-CG 3.8Å; F347-W359 HydrophobicContact CE2-CG 3.8Å; F347-W359 HydrophobicContact CG-CB 4.28Å; F347-W359 HydrophobicContact CZ-CB 3.37Å; F347-W359 AromaticContact CZ-CD1 3.76Å; F347-W359 HydrophobicContact CZ-CD2 4.39Å; F347-W359 AromaticContact CZ-CG 3.57Å; F347-W359 HydrophobicContact CZ-CG 3.57Å; F347-W359 PolarHBondContact N-O 2.95Å; F347-W359 PolarHBondContact O-N 3.38Å; F347-T361 HydrophobicContact CD1-CG2 3.49Å; F347-T361 VanDerWaalsContact CD1-CG2 3.49Å; F347-T361 HydrophobicContact CE1-CG2 4.07Å
348	L	96.1	Very high	93.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	143.8	171.8	-76.5	162.7	0	0	0	110	I338 C339 K357 L358 F370 V379 F381 F391	I338-L348 WeakPolarHBondContact CA-O 3.39Å; C339-L348 PolarHBondContact N-O 2.82Å; C339-L348 PolarHBondContact O-N 2.92Å; L348-K357 WeakPolarHBondContact CA-O 3.48Å; L348-L358 HydrophobicContact CD2-CB 3.85Å; L348-L358 HydrophobicContact CD2-CD1 3.96Å; L348-L358 HydrophobicContact CG-CD1 3.99Å; L348-F370 HydrophobicContact CD2-CE2 4.21Å; L348-V379 HydrophobicContact CB-CG1 3.77Å; L348-V379 HydrophobicContact CD1-CG1 3.74Å; L348-V379 HydrophobicContact CG-CG1 4.36Å; L348-F381 HydrophobicContact CB-CE2 3.93Å; L348-F381 HydrophobicContact CD1-CD1 4.37Å; L348-F381 HydrophobicContact CD1-CD2 3.78Å; L348-F381 HydrophobicContact CD1-CE1 4.06Å; L348-F381 HydrophobicContact CD1-CE2 3.42Å; L348-F381 VanDerWaalsContact CD1-CE2 3.42Å; L348-F381 HydrophobicContact CD1-CG 4.26Å; L348-F381 HydrophobicContact CD1-CZ 3.58Å; L348-F381 HydrophobicContact CG-CD2 4.27Å; L348-F381 HydrophobicContact CG-CE2 3.49Å; L348-F381 VanDerWaalsContact CG-CE2 3.49Å; L348-F381 HydrophobicContact CG-CZ 3.67Å; L348-F391 HydrophobicContact CD1-CB 3.44Å; L348-F391 VanDerWaalsContact CD1-CB 3.44Å; L348-F391 HydrophobicContact CD1-CD1 3.6Å; L348-F391 HydrophobicContact CD1-CD2 3.6Å; L348-F391 HydrophobicContact CD1-CE1 4.18Å; L348-F391 HydrophobicContact CD1-CE2 4.19Å; L348-F391 HydrophobicContact CD1-CG 3.26Å; L348-F391 HydrophobicContact CD1-CZ 4.45Å; L348-F391 HydrophobicContact CD2-CD1 4.4Å; L348-F391 HydrophobicContact CD2-CE1 4.19Å; L348-F391 HydrophobicContact CD2-CZ 4.24Å
349	S	95.8	Very high	93.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	133.7	170.6	59.3	0	0	0	0	111.8	H331 L356 K357 W359	H331-S349 PolarHBondContact NE2-OG 3.21Å; S349-L356 WeakPolarHBondContact O-CA 3.44Å; S349-K357 PolarHBondContact N-O 3.28Å; S349-K357 PolarHBondContact O-N 2.73Å; S349-W359 PolarHBondContact OG-NE1 3.09Å
350	A	95.6	Very high	93.9	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	133.7	171.3	0	0	0	0	0	110.4	V335 R336 D337 L356 P376 V379	V335-A350 WeakPolarHBondContact CG1-O 3.4Å; R336-A350 PolarHBondContact N-O 2.83Å; D337-A350 PolarHBondContact O-N 2.8Å; A350-L356 HydrophobicContact CB-CD2 4.01Å; A350-P376 HydrophobicContact CB-CB 3.72Å; A350-P376 HydrophobicContact CB-CG 3.65Å; A350-V379 HydrophobicContact CB-CG2 3.48Å; A350-V379 VanDerWaalsContact CB-CG2 3.48Å
351	A	95.4	Very high	93.7	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	162.5	179.2	0	0	0	0	0	113.1	H331 A334 V335 D353 R354	H331-A351 HydrophobicContact CB-CB 4.1Å; H331-A351 WeakPolarHBondContact ND1-CB 3.45Å; A334-A351 WeakPolarHBondContact O-CA 3.39Å; A334-A351 WeakPolarHBondContact O-CB 3.35Å; V335-A351 HydrophobicContact CB-CB 4.45Å; V335-A351 HydrophobicContact CG2-CB 4.21Å; A351-D353 WeakPolarHBondContact CB-OD1 3.37Å; A351-D353 PolarHBondContact O-N 3.31Å; A351-R354 PolarHBondContact O-N 3.19Å
352	Y	94.4	Very high	93.6	Very high	90 Å²	90	29.4 Å²	29.4	35%	0.353	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-1.5	177.9	-72.8	-75.5	0	0	0	114.2	K333 A334 R336 R354 V375 Y377	K333-Y352 WeakPolarHBondContact CD-O 3.26Å; A334-Y352 HydrophobicContact CB-CD2 3.92Å; A334-Y352 WeakPolarHBondContact O-CD2 3.47Å; A334-Y352 PolarHBondContact O-N 3.35Å; R336-Y352 HydrophobicContact CB-CD2 4.42Å; R336-Y352 HydrophobicContact CB-CE2 3.98Å; R336-Y352 WeakPolarHBondContact CD-OH 3.32Å; R336-Y352 HydrophobicContact CG-CE2 4.34Å; Y352-R354 PolarHBondContact O-N 3.26Å; Y352-V375 HydrophobicContact CD1-CG1 3.7Å; Y352-V375 HydrophobicContact CE1-CG1 4.17Å; Y352-V375 HydrophobicContact CG-CG1 4.48Å; Y352-Y377 HydrophobicContact CE1-CE1 4.23Å
353	D	91.5	Very high	93.5	Very high	6 Å²	6	30.5 Å²	30.5	3%	0.032	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	3.3	173.5	64	9.1	0	0	0	113.6	H331 S332 K333 A351 Y355	H331-D353 WeakPolarHBondContact CA-OD2 3.46Å; H331-D353 WeakPolarHBondContact CB-OD2 3.28Å; H331-D353 IonicContact CE1-OD1 3.92Å; H331-D353 IonicContact CG-OD2 3.69Å; H331-D353 IonicContact ND1-OD1 3.01Å; H331-D353 PolarHBondContact ND1-OD1 2.94Å; H331-D353 IonicContact ND1-OD2 3.29Å; H331-D353 PolarHBondContact ND1-OD2 3.21Å; S332-D353 PolarHBondContact N-OD2 3.32Å; K333-D353 HydrophobicContact CB-CB 4.07Å; K333-D353 HydrophobicContact CD-CB 4.48Å; K333-D353 HydrophobicContact CG-CB 4.31Å; A351-D353 WeakPolarHBondContact CB-OD1 3.37Å; A351-D353 PolarHBondContact O-N 3.31Å; D353-Y355 HydrophobicContact CB-CD2 4.45Å; D353-Y355 WeakPolarHBondContact O-CD2 3.25Å; D353-Y355 PolarHBondContact O-N 3.13Å; D353-Y355 PolarHBondContact OD1-N 3.38Å
354	R	92.6	Very high	93.5	Very high	131 Å²	131	27.3 Å²	27.3	49%	0.494	13%	0.128	S	C	.	.	S	Bend	trans	71.7	9.2	-179.5	-48.9	156.3	176.3	-178.4	2.1	113.8	A351 Y352 T371 R373 K374 V375	A351-R354 PolarHBondContact O-N 3.19Å; Y352-R354 PolarHBondContact O-N 3.26Å; R354-T371 PolarHBondContact O-OG1 3.22Å; R354-R373 WeakPolarHBondContact CD-O 3.39Å; R354-K374 WeakPolarHBondContact CA-O 3.27Å; R354-K374 VanDerWaalsContact CB-O 3.31Å; R354-K374 WeakPolarHBondContact CB-O 3.39Å; R354-V375 HydrophobicContact CG-CG2 3.91Å
355	Y	93.5	Very high	93.6	Very high	49 Å²	49	33.7 Å²	33.7	19%	0.192	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	138.3	172.9	-69.3	-87.6	0	0	0	111.4	H331 D353 R369 T371	H331-Y355 PolarHBondContact CE1-O 2.74Å; D353-Y355 HydrophobicContact CB-CD2 4.45Å; D353-Y355 WeakPolarHBondContact O-CD2 3.25Å; D353-Y355 PolarHBondContact O-N 3.13Å; D353-Y355 PolarHBondContact OD1-N 3.38Å; Y355-R369 HydrophobicContact CD1-CB 4.47Å; Y355-T371 HydrophobicContact CE1-CG2 4.16Å
356	L	95.1	Very high	93.7	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.01	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	133.3	160.9	-67	149.9	0	0	0	106.6	S349 A350 R369 F370 P376 V379 F391 A393	S349-L356 WeakPolarHBondContact O-CA 3.44Å; A350-L356 HydrophobicContact CB-CD2 4.01Å; L356-R369 WeakPolarHBondContact O-CA 3.26Å; L356-F370 HydrophobicContact CB-CB 4.07Å; L356-F370 HydrophobicContact CB-CD2 4.2Å; L356-F370 HydrophobicContact CD1-CB 4.32Å; L356-F370 PolarHBondContact N-O 2.9Å; L356-F370 PolarHBondContact O-N 2.87Å; L356-P376 HydrophobicContact CD2-CB 3.74Å; L356-P376 HydrophobicContact CD2-CG 3.94Å; L356-P376 HydrophobicContact CG-CB 4.13Å; L356-P376 HydrophobicContact CG-CG 4.02Å; L356-V379 HydrophobicContact CD2-CG2 3.29Å; L356-F391 HydrophobicContact CD1-CE2 4.13Å; L356-F391 HydrophobicContact CD2-CE2 4.48Å; L356-A393 HydrophobicContact CD1-CB 4.03Å; L356-A393 HydrophobicContact CD2-CB 4.14Å
357	K	95.3	Very high	93.6	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.009	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.7	178.3	-66.9	-170.9	179.9	-155	0	110.7	E237 G330 L348 S349 W359 R369	E237-K357 WeakPolarHBondContact OE1-CD 3.39Å; E237-K357 WeakPolarHBondContact OE1-CE 3.45Å; E237-K357 IonicContact OE1-NZ 3.67Å; E237-K357 PolarHBondContact OE1-NZ 3.02Å; G330-K357 VanDerWaalsContact C-NZ 3.27Å; G330-K357 PolarHBondContact O-NZ 3.03Å; L348-K357 WeakPolarHBondContact CA-O 3.48Å; S349-K357 PolarHBondContact N-O 3.28Å; S349-K357 PolarHBondContact O-N 2.73Å; K357-W359 HydrophobicContact CB-CZ2 4.31Å; K357-W359 HydrophobicContact CD-CH2 4.47Å; K357-W359 HydrophobicContact CD-CZ2 3.68Å; K357-R369 HydrophobicContact CG-CG 4.35Å
358	L	96.1	Very high	93.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	121.9	170.4	179.3	67.5	0	0	0	108.5	Q346 L348 C366 I367 S368 F370 F381 I405	Q346-L358 HydrophobicContact CB-CD1 4.03Å; L348-L358 HydrophobicContact CD2-CB 3.85Å; L348-L358 HydrophobicContact CD2-CD1 3.96Å; L348-L358 HydrophobicContact CG-CD1 3.99Å; L358-C366 CarbonylContact O-C 3.59Å; L358-C366 WeakPolarHBondContact O-CA 3.04Å; L358-I367 HydrophobicContact CB-CB 4.5Å; L358-I367 HydrophobicContact CD2-CB 4.03Å; L358-I367 HydrophobicContact CD2-CD1 4.19Å; L358-I367 HydrophobicContact CD2-CG2 4.03Å; L358-I367 HydrophobicContact CG-CB 4.12Å; L358-I367 HydrophobicContact CG-CD1 4.11Å; L358-I367 PolarHBondContact O-N 2.99Å; L358-S368 PolarHBondContact N-O 2.95Å; L358-S368 PolarHBondContact O-N 2.87Å; L358-F370 HydrophobicContact CB-CE2 4.03Å; L358-F381 HydrophobicContact CD1-CZ 3.7Å; L358-I405 HydrophobicContact CD1-CD1 4.4Å; L358-I405 HydrophobicContact CD2-CB 4.45Å; L358-I405 HydrophobicContact CD2-CD1 4.18Å; L358-I405 HydrophobicContact CD2-CG1 4.25Å; L358-I405 HydrophobicContact CD2-CG2 3.39Å
359	W	95.8	Very high	93.3	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.008	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	139.5	-179.1	-59.7	92.2	0	0	0	110.2	E237 T239 F328 Q346 F347 S349 K357 G364 Q365 C366	E237-W359 HydrophobicContact CB-CH2 4.39Å; E237-W359 HydrophobicContact CG-CH2 3.89Å; E237-W359 HydrophobicContact CG-CZ3 4.37Å; T239-W359 HydrophobicContact CG2-CZ3 4.29Å; F328-W359 HydrophobicContact CB-CE3 4.35Å; F328-W359 HydrophobicContact CB-CH2 4.35Å; F328-W359 HydrophobicContact CB-CZ3 4.27Å; F328-W359 HydrophobicContact CD1-CB 4.42Å; F328-W359 HydrophobicContact CD1-CD2 4.13Å; F328-W359 AromaticContact CD1-CE3 3.79Å; F328-W359 HydrophobicContact CD1-CE3 3.79Å; F328-W359 HydrophobicContact CD1-CG 4.43Å; F328-W359 HydrophobicContact CD1-CZ3 4.35Å; F328-W359 HydrophobicContact CE1-CB 4.45Å; Q346-W359 WeakPolarHBondContact CA-O 3.41Å; F347-W359 HydrophobicContact CD1-CB 3.76Å; F347-W359 HydrophobicContact CD2-CB 4.32Å; F347-W359 HydrophobicContact CD2-CG 4.5Å; F347-W359 HydrophobicContact CE1-CB 3.3Å; F347-W359 HydrophobicContact CE1-CG 4.06Å; F347-W359 HydrophobicContact CE2-CB 3.88Å; F347-W359 AromaticContact CE2-CD1 3.48Å; F347-W359 VanDerWaalsContact CE2-CD1 3.48Å; F347-W359 AromaticContact CE2-CG 3.8Å; F347-W359 HydrophobicContact CE2-CG 3.8Å; F347-W359 HydrophobicContact CG-CB 4.28Å; F347-W359 HydrophobicContact CZ-CB 3.37Å; F347-W359 AromaticContact CZ-CD1 3.76Å; F347-W359 HydrophobicContact CZ-CD2 4.39Å; F347-W359 AromaticContact CZ-CG 3.57Å; F347-W359 HydrophobicContact CZ-CG 3.57Å; F347-W359 PolarHBondContact N-O 2.95Å; F347-W359 PolarHBondContact O-N 3.38Å; S349-W359 PolarHBondContact OG-NE1 3.09Å; K357-W359 HydrophobicContact CB-CZ2 4.31Å; K357-W359 HydrophobicContact CD-CH2 4.47Å; K357-W359 HydrophobicContact CD-CZ2 3.68Å; W359-G364 VanDerWaalsContact CE3-O 3.32Å; W359-Q365 WeakPolarHBondContact CA-O 3.34Å; W359-C366 HydrophobicContact CD2-CB 4.33Å; W359-C366 HydrophobicContact CE3-CB 3.82Å; W359-C366 HydrophobicContact CH2-CB 4.3Å; W359-C366 HydrophobicContact CZ3-CB 3.81Å
360	D	94.7	Very high	93.1	Very high	31 Å²	31	38.8 Å²	38.8	17%	0.166	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	128.3	161.3	179.5	9.5	0	0	0	109.5	E362 T363 G364 Q365 I367	D360-E362 PolarHBondContact OD1-N 3.03Å; D360-T363 WeakPolarHBondContact CB-OG1 3.42Å; D360-T363 VanDerWaalsContact CG-OG1 3.3Å; D360-T363 VanDerWaalsContact OD2-CB 3.24Å; D360-T363 WeakPolarHBondContact OD2-CB 3.48Å; D360-T363 WeakPolarHBondContact OD2-CG2 3.27Å; D360-T363 PolarHBondContact OD2-N 3.12Å; D360-T363 PolarHBondContact OD2-OG1 2.83Å; D360-G364 VanDerWaalsContact O-CA 3.31Å; D360-G364 WeakPolarHBondContact O-CA 3.37Å; D360-G364 PolarHBondContact O-N 2.62Å; D360-G364 VanDerWaalsContact O-N 3.17Å; D360-Q365 PolarHBondContact N-O 2.73Å; D360-I367 HydrophobicContact CB-CD1 3.97Å; D360-I367 HydrophobicContact CB-CG1 4.19Å
361	T	92.1	Very high	92.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-33	175.1	56.9	0	0	0	0	112.5	Y254 L255 R326 F340 G344 T345 F347	Y254-T361 PolarHBondContact OH-O 3.04Å; L255-T361 WeakPolarHBondContact CD1-OG1 3.48Å; R326-T361 PolarHBondContact NH1-O 2.84Å; F340-T361 HydrophobicContact CD1-CG2 4.28Å; F340-T361 HydrophobicContact CE1-CG2 3.93Å; G344-T361 WeakPolarHBondContact O-CG2 3.23Å; G344-T361 PolarHBondContact O-OG1 2.85Å; T345-T361 VanDerWaalsContact C-OG1 3.25Å; T345-T361 PolarHBondContact O-N 3.17Å; T345-T361 PolarHBondContact O-OG1 3.14Å; F347-T361 HydrophobicContact CD1-CG2 3.49Å; F347-T361 VanDerWaalsContact CD1-CG2 3.49Å; F347-T361 HydrophobicContact CE1-CG2 4.07Å
362	E	89.6	Confident	92.3	Very high	66 Å²	66	43.6 Å²	43.6	31%	0.308	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-45.9	-172.1	-62.1	-157	148.9	0	0	113.7	M246 S253 L255 R326 D360	M246-E362 HydrophobicContact CE-CB 4.31Å; M246-E362 WeakPolarHBondContact CE-O 3.36Å; S253-E362 WeakPolarHBondContact CB-OE1 3.33Å; S253-E362 PolarHBondContact OG-OE1 3.42Å; L255-E362 HydrophobicContact CD1-CG 3.37Å; L255-E362 WeakPolarHBondContact CD1-OE1 3.42Å; L255-E362 HydrophobicContact CG-CG 3.83Å; R326-E362 VanDerWaalsContact CZ-O 3.25Å; R326-E362 PolarHBondContact NH1-O 2.91Å; R326-E362 PolarHBondContact NH2-O 3.17Å; D360-E362 PolarHBondContact OD1-N 3.03Å
363	T	88.6	Confident	92	Very high	78 Å²	78	48.8 Å²	48.8	48%	0.479	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-30.5	175.8	62	0	0	0	0	112.5	R326 D360 Q365	R326-T363 PolarHBondContact NH2-O 3.04Å; D360-T363 WeakPolarHBondContact CB-OG1 3.42Å; D360-T363 VanDerWaalsContact CG-OG1 3.3Å; D360-T363 VanDerWaalsContact OD2-CB 3.24Å; D360-T363 WeakPolarHBondContact OD2-CB 3.48Å; D360-T363 WeakPolarHBondContact OD2-CG2 3.27Å; D360-T363 PolarHBondContact OD2-N 3.12Å; D360-T363 PolarHBondContact OD2-OG1 2.83Å; T363-Q365 VanDerWaalsContact C-N 3.32Å; T363-Q365 WeakPolarHBondContact OG1-CB 3.38Å; T363-Q365 PolarHBondContact OG1-N 2.85Å; T363-Q365 VanDerWaalsContact OG1-N 3.08Å
364	G	88.7	Confident	92	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.246	C	C	.	.			trans	90.8	-9.6	-167.3	0	0	0	0	0	113.7	T239 W359 D360	T239-G364 WeakPolarHBondContact CG2-O 3.5Å; W359-G364 VanDerWaalsContact CE3-O 3.32Å; D360-G364 VanDerWaalsContact O-CA 3.31Å; D360-G364 WeakPolarHBondContact O-CA 3.37Å; D360-G364 PolarHBondContact O-N 2.62Å; D360-G364 VanDerWaalsContact O-N 3.17Å
365	Q	91.9	Very high	92.1	Very high	134 Å²	134	48.1 Å²	48.1	63%	0.626	23%	0.23	S	C	*	.			trans	-68.5	140.3	-171.3	-170.9	166.6	-12.9	0	0	111.9	W359 D360 T363 I367	W359-Q365 WeakPolarHBondContact CA-O 3.34Å; D360-Q365 PolarHBondContact N-O 2.73Å; T363-Q365 VanDerWaalsContact C-N 3.32Å; T363-Q365 WeakPolarHBondContact OG1-CB 3.38Å; T363-Q365 PolarHBondContact OG1-N 2.85Å; T363-Q365 VanDerWaalsContact OG1-N 3.08Å; Q365-I367 PolarHBondContact O-N 3.23Å
366	C	93.4	Very high	92.2	Very high	17 Å²	17	45.8 Å²	45.8	12%	0.115	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	113.5	164.7	-172.6	0	0	0	0	108.1	E237 L358 W359	E237-C366 HydrophobicContact CG-CB 4.21Å; E237-C366 VanDerWaalsContact OE1-CB 3.3Å; E237-C366 WeakPolarHBondContact OE1-CB 3.31Å; E237-C366 PolarHBondContact OE1-SG 3.31Å; E237-C366 WeakPolarHBondContact OE2-CB 3.08Å; L358-C366 CarbonylContact O-C 3.59Å; L358-C366 WeakPolarHBondContact O-CA 3.04Å; W359-C366 HydrophobicContact CD2-CB 4.33Å; W359-C366 HydrophobicContact CE3-CB 3.82Å; W359-C366 HydrophobicContact CH2-CB 4.3Å; W359-C366 HydrophobicContact CZ3-CB 3.81Å
367	I	93.3	Very high	92.2	Very high	82 Å²	82	48.8 Å²	48.8	42%	0.421	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	-45.4	-179	-60.2	166.9	0	0	0	109.7	Q346 L358 D360 Q365	Q346-I367 HydrophobicContact CG-CD1 3.96Å; L358-I367 HydrophobicContact CB-CB 4.5Å; L358-I367 HydrophobicContact CD2-CB 4.03Å; L358-I367 HydrophobicContact CD2-CD1 4.19Å; L358-I367 HydrophobicContact CD2-CG2 4.03Å; L358-I367 HydrophobicContact CG-CB 4.12Å; L358-I367 HydrophobicContact CG-CD1 4.11Å; L358-I367 PolarHBondContact O-N 2.99Å; D360-I367 HydrophobicContact CB-CD1 3.97Å; D360-I367 HydrophobicContact CB-CG1 4.19Å; Q365-I367 PolarHBondContact O-N 3.23Å
368	S	92.4	Very high	92.1	Very high	31 Å²	31	48.8 Å²	48.8	22%	0.217	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	153.4	-176	-171.1	0	0	0	0	112.6	L358	L358-S368 PolarHBondContact N-O 2.95Å; L358-S368 PolarHBondContact O-N 2.87Å
369	R	92.8	Very high	92.1	Very high	91 Å²	91	48.8 Å²	48.8	34%	0.343	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	128	174.2	-72.6	177.5	166	78.7	-6.9	108.7	G235 E237 Y355 L356 K357	G235-R369 PolarHBondContact O-NH2 2.87Å; G235-R369 VanDerWaalsContact O-NH2 3.09Å; E237-R369 IonicContact OE1-CZ 3.73Å; E237-R369 IonicContact OE1-NE 3.9Å; E237-R369 IonicContact OE1-NH1 2.85Å; E237-R369 PolarHBondContact OE1-NH1 2.82Å; E237-R369 IonicContact OE1-NH2 3.24Å; E237-R369 PolarHBondContact OE1-NH2 3.39Å; E237-R369 IonicContact OE2-CZ 2.92Å; E237-R369 IonicContact OE2-NH1 3.59Å; E237-R369 PolarHBondContact OE2-NH1 2.85Å; E237-R369 IonicContact OE2-NH2 3.49Å; E237-R369 PolarHBondContact OE2-NH2 3.32Å; Y355-R369 HydrophobicContact CD1-CB 4.47Å; L356-R369 WeakPolarHBondContact O-CA 3.26Å; K357-R369 HydrophobicContact CG-CG 4.35Å
370	F	93.4	Very high	92.1	Very high	3 Å²	3	50.6 Å²	50.6	1%	0.013	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	141.8	170.7	-39.5	-99.4	0	0	0	108.9	L348 L356 L358 F391 W403 I405	L348-F370 HydrophobicContact CD2-CE2 4.21Å; L356-F370 HydrophobicContact CB-CB 4.07Å; L356-F370 HydrophobicContact CB-CD2 4.2Å; L356-F370 HydrophobicContact CD1-CB 4.32Å; L356-F370 PolarHBondContact N-O 2.9Å; L356-F370 PolarHBondContact O-N 2.87Å; L358-F370 HydrophobicContact CB-CE2 4.03Å; F370-F391 HydrophobicContact CB-CZ 4.35Å; F370-F391 HydrophobicContact CD1-CE1 4.19Å; F370-F391 HydrophobicContact CD1-CZ 4.13Å; F370-F391 AromaticContact CD2-CE1 3.9Å; F370-F391 HydrophobicContact CD2-CE1 3.9Å; F370-F391 AromaticContact CD2-CZ 3.59Å; F370-F391 HydrophobicContact CD2-CZ 3.59Å; F370-F391 AromaticContact CE1-CE1 3.95Å; F370-F391 HydrophobicContact CE1-CE1 3.95Å; F370-F391 HydrophobicContact CE1-CZ 4.35Å; F370-F391 AromaticContact CE2-CE1 3.68Å; F370-F391 HydrophobicContact CE2-CE1 3.68Å; F370-F391 AromaticContact CE2-CZ 3.87Å; F370-F391 HydrophobicContact CE2-CZ 3.87Å; F370-F391 HydrophobicContact CG-CE1 4.18Å; F370-F391 AromaticContact CG-CZ 3.76Å; F370-F391 HydrophobicContact CG-CZ 3.76Å; F370-F391 AromaticContact CZ-CE1 3.71Å; F370-F391 HydrophobicContact CZ-CE1 3.71Å; F370-F391 HydrophobicContact CZ-CZ 4.25Å; F370-W403 HydrophobicContact CB-CD2 4.05Å; F370-W403 HydrophobicContact CB-CE3 4.08Å; F370-W403 HydrophobicContact CB-CH2 4.32Å; F370-W403 HydrophobicContact CB-CZ2 4.29Å; F370-W403 HydrophobicContact CB-CZ3 4.22Å; F370-W403 HydrophobicContact CD1-CB 4.41Å; F370-W403 HydrophobicContact CD1-CD2 4.09Å; F370-W403 AromaticContact CD1-CE3 3.72Å; F370-W403 HydrophobicContact CD1-CE3 3.72Å; F370-W403 HydrophobicContact CD1-CG 4.43Å; F370-W403 HydrophobicContact CD1-CZ3 4.33Å; F370-W403 HydrophobicContact CG-CD2 4.39Å; F370-W403 HydrophobicContact CG-CE3 4.32Å; F370-I405 HydrophobicContact CZ-CB 4.38Å; F370-I405 HydrophobicContact CZ-CG1 4.02Å
371	T	89.6	Confident	92.1	Very high	63 Å²	63	49.4 Å²	49.4	39%	0.387	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	137.7	179.9	-176.3	0	0	0	0	110.4	R354 Y355 R373 W403	R354-T371 PolarHBondContact O-OG1 3.22Å; Y355-T371 HydrophobicContact CE1-CG2 4.16Å; T371-R373 PolarHBondContact OG1-N 3.03Å; T371-W403 WeakPolarHBondContact O-CH2 3.15Å
372	N	84.1	Confident	92.1	Very high	38 Å²	38	49.4 Å²	49.4	20%	0.203	23%	0.234	C	C	.	.			trans	-120.8	18.8	171.3	-155	-12.7	0	0	0	111.5	K374 M395 W403	N372-K374 WeakPolarHBondContact O-CG 3.36Å; N372-K374 PolarHBondContact O-N 2.86Å; N372-M395 HydrophobicContact CB-CE 4.14Å; N372-W403 HydrophobicContact CB-CZ2 4.24Å
373	R	87.7	Confident	92.1	Very high	198 Å²	198	48 Å²	48	75%	0.747	23%	0.231	S	C	*	.	S	Bend	trans	56	2.6	-171.6	-55.8	179.1	172.2	-173.1	-4.2	115.6	R354 T371	R354-R373 WeakPolarHBondContact CD-O 3.39Å; T371-R373 PolarHBondContact OG1-N 3.03Å
374	K	92	Very high	92.1	Very high	97 Å²	97	46 Å²	46	42%	0.422	22%	0.217	S	C	.	.	S	Bend	trans	-114.6	161	178.2	-56.5	-58.5	-176.3	179.4	0	110.1	R354 N372 P376 M395 D397	R354-K374 WeakPolarHBondContact CA-O 3.27Å; R354-K374 VanDerWaalsContact CB-O 3.31Å; R354-K374 WeakPolarHBondContact CB-O 3.39Å; N372-K374 WeakPolarHBondContact O-CG 3.36Å; N372-K374 PolarHBondContact O-N 2.86Å; K374-P376 WeakPolarHBondContact O-CD 3.44Å; K374-M395 HydrophobicContact CB-CE 3.88Å; K374-M395 WeakPolarHBondContact O-CE 3.44Å; K374-D397 HydrophobicContact CD-CB 4.04Å; K374-D397 HydrophobicContact CG-CB 3.92Å
375	V	94.3	Very high	92	Very high	26 Å²	26	54 Å²	54	16%	0.158	25%	0.254	C	S	.	.			trans	-84.2	125.8	-177.7	172.4	0	0	0	0	110	Y352 R354 S396	Y352-V375 HydrophobicContact CD1-CG1 3.7Å; Y352-V375 HydrophobicContact CE1-CG1 4.17Å; Y352-V375 HydrophobicContact CG-CG1 4.48Å; R354-V375 HydrophobicContact CG-CG2 3.91Å; V375-S396 PolarHBondContact N-OG 2.86Å; V375-S396 WeakPolarHBondContact O-CB 3.41Å; V375-S396 PolarHBondContact O-N 2.92Å; V375-S396 PolarHBondContact O-OG 2.81Å
376	P	95.8	Very high	91.8	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	133.9	166	33	-35.2	0	0	0	110.8	A350 L356 K374 M395	A350-P376 HydrophobicContact CB-CB 3.72Å; A350-P376 HydrophobicContact CB-CG 3.65Å; L356-P376 HydrophobicContact CD2-CB 3.74Å; L356-P376 HydrophobicContact CD2-CG 3.94Å; L356-P376 HydrophobicContact CG-CB 4.13Å; L356-P376 HydrophobicContact CG-CG 4.02Å; K374-P376 WeakPolarHBondContact O-CD 3.44Å; P376-M395 HydrophobicContact CB-CE 4.22Å; P376-M395 HydrophobicContact CB-SD 3.82Å
377	Y	94.7	Very high	91.5	Very high	65 Å²	65	56.2 Å²	56.2	26%	0.255	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	-39.1	177.2	-84.6	-79.8	0	0	0	113.1	R336 Y352 G394 A420 V421	R336-Y377 VanDerWaalsContact CG-O 3.28Å; R336-Y377 WeakPolarHBondContact CG-O 3.28Å; Y352-Y377 HydrophobicContact CE1-CE1 4.23Å; Y377-G394 PolarHBondContact N-O 3.03Å; Y377-A420 HydrophobicContact CD2-CB 4.26Å; Y377-A420 HydrophobicContact CE2-CB 3.88Å; Y377-V421 VanDerWaalsContact CB-O 3.27Å; Y377-V421 WeakPolarHBondContact CB-O 3.37Å
378	C	93.5	Very high	91.3	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.014	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	147.7	180	179.6	0	0	0	0	110.2	D337 A393 G394 N422	D337-C378 WeakPolarHBondContact OD2-CA 3.33Å; D337-C378 PolarHBondContact OD2-SG 2.85Å; C378-A393 WeakPolarHBondContact O-CA 3.41Å; C378-G394 PolarHBondContact O-N 3.08Å; C378-N422 WeakPolarHBondContact CB-O 3.49Å
379	V	95.7	Very high	91.2	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	139.4	176.5	-178.9	0	0	0	0	109.7	D337 C339 L348 A350 L356 F391 V392 A393	D337-V379 PolarHBondContact OD2-N 2.68Å; C339-V379 WeakPolarHBondContact CB-O 3.33Å; L348-V379 HydrophobicContact CB-CG1 3.77Å; L348-V379 HydrophobicContact CD1-CG1 3.74Å; L348-V379 HydrophobicContact CG-CG1 4.36Å; A350-V379 HydrophobicContact CB-CG2 3.48Å; A350-V379 VanDerWaalsContact CB-CG2 3.48Å; L356-V379 HydrophobicContact CD2-CG2 3.29Å; V379-F391 HydrophobicContact CG1-CD2 4.01Å; V379-V392 WeakPolarHBondContact CA-O 3.4Å; V379-A393 HydrophobicContact CG2-CB 4.3Å
380	K	95.4	Very high	91.3	Very high	40 Å²	40	51 Å²	51	17%	0.174	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	134.1	167.3	-63.7	-65.1	175.7	-171.7	0	110.4	F391 V392 I424 F426	K380-F391 WeakPolarHBondContact O-CA 3.28Å; K380-F391 WeakPolarHBondContact O-CB 3.43Å; K380-V392 HydrophobicContact CB-CG1 4.04Å; K380-V392 PolarHBondContact N-O 2.86Å; K380-V392 WeakPolarHBondContact O-CG1 3.31Å; K380-V392 PolarHBondContact O-N 2.93Å; K380-I424 WeakPolarHBondContact CE-O 3.45Å; K380-I424 HydrophobicContact CG-CB 4.15Å; K380-I424 HydrophobicContact CG-CG2 4.28Å; K380-I424 VanDerWaalsContact CG-O 3.26Å; K380-I424 WeakPolarHBondContact CG-O 3.35Å; K380-F426 HydrophobicContact CB-CD2 4.11Å; K380-F426 HydrophobicContact CB-CE2 3.67Å
381	F	94.8	Very high	91.4	Very high	6 Å²	6	50.9 Å²	50.9	3%	0.026	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	149.9	158.5	-86.4	-87.6	0	0	0	109.9	C339 F340 N341 L348 L358 P383 F391 I405 F426	C339-F381 HydrophobicContact CB-CD2 4.42Å; F340-F381 VanDerWaalsContact C-CD2 3.42Å; F340-F381 WeakPolarHBondContact O-CD2 3.47Å; N341-F381 HydrophobicContact CB-CD1 4.01Å; N341-F381 HydrophobicContact CB-CD2 4.17Å; N341-F381 HydrophobicContact CB-CE1 3.88Å; N341-F381 HydrophobicContact CB-CE2 4.05Å; N341-F381 HydrophobicContact CB-CG 4.13Å; N341-F381 HydrophobicContact CB-CZ 3.89Å; L348-F381 HydrophobicContact CB-CE2 3.93Å; L348-F381 HydrophobicContact CD1-CD1 4.37Å; L348-F381 HydrophobicContact CD1-CD2 3.78Å; L348-F381 HydrophobicContact CD1-CE1 4.06Å; L348-F381 HydrophobicContact CD1-CE2 3.42Å; L348-F381 VanDerWaalsContact CD1-CE2 3.42Å; L348-F381 HydrophobicContact CD1-CG 4.26Å; L348-F381 HydrophobicContact CD1-CZ 3.58Å; L348-F381 HydrophobicContact CG-CD2 4.27Å; L348-F381 HydrophobicContact CG-CE2 3.49Å; L348-F381 VanDerWaalsContact CG-CE2 3.49Å; L348-F381 HydrophobicContact CG-CZ 3.67Å; L358-F381 HydrophobicContact CD1-CZ 3.7Å; F381-P383 WeakPolarHBondContact O-CD 3.32Å; F381-F391 HydrophobicContact CD1-CB 4.38Å; F381-I405 HydrophobicContact CD1-CD1 4.34Å; F381-I405 HydrophobicContact CE1-CD1 3.44Å; F381-I405 VanDerWaalsContact CE1-CD1 3.44Å; F381-I405 HydrophobicContact CZ-CD1 4.09Å; F381-F426 WeakPolarHBondContact O-CE2 3.17Å
382	N	92.9	Very high	91.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.224	C	C	.	.			trans	-61.8	126.7	160	-169.5	-27.8	0	0	0	108.1	D384 K387 Q388 L390 F426 W447	N382-D384 VanDerWaalsContact C-N 3.3Å; N382-D384 PolarHBondContact O-N 3.29Å; N382-D384 WeakPolarHBondContact OD1-CB 3.47Å; N382-D384 PolarHBondContact OD1-N 3.44Å; N382-D384 VanDerWaalsContact OD1-N 3.07Å; N382-K387 HydrophobicContact CB-CB 4.36Å; N382-K387 WeakPolarHBondContact ND2-CE 3.33Å; N382-Q388 PolarHBondContact O-NE2 3.33Å; N382-L390 WeakPolarHBondContact CB-O 3.43Å; N382-L390 PolarHBondContact N-O 3.25Å; N382-F426 HydrophobicContact CB-CZ 4.31Å; N382-W447 HydrophobicContact CB-CH2 3.99Å; N382-W447 HydrophobicContact CB-CZ2 4.16Å; N382-W447 VanDerWaalsContact ND2-CZ2 3.26Å; N382-W447 WeakPolarHBondContact ND2-CZ2 3.25Å
383	P	88.7	Confident	92.3	Very high	37 Å²	37	46 Å²	46	24%	0.24	21%	0.214	C	C	.	.			trans	-76	-16	-178	-12.3	28	0	0	0	113.7	T342 F381 Q388 F426 N430	T342-P383 WeakPolarHBondContact OG1-CA 3.35Å; T342-P383 PolarHBondContact OG1-O 3.26Å; F381-P383 WeakPolarHBondContact O-CD 3.32Å; P383-Q388 PolarHBondContact O-NE2 3.01Å; P383-F426 VanDerWaalsContact CD-CG 3.49Å; P383-F426 HydrophobicContact CG-CB 3.85Å; P383-F426 HydrophobicContact CG-CD1 4.3Å; P383-F426 HydrophobicContact CG-CD2 3.81Å; P383-F426 HydrophobicContact CG-CE2 4.44Å; P383-F426 HydrophobicContact CG-CG 3.72Å; P383-N430 HydrophobicContact CG-CB 4.36Å; P383-N430 WeakPolarHBondContact CG-OD1 3.48Å
384	D	89.3	Confident	92.7	Very high	36 Å²	36	36.6 Å²	36.6	19%	0.193	18%	0.178	C	C	.	.	S	Bend	trans	-66.2	133.6	178.9	-75.7	-13.4	0	0	0	112.4	N382 D386 K387 Q388 N430	N382-D384 VanDerWaalsContact C-N 3.3Å; N382-D384 PolarHBondContact O-N 3.29Å; N382-D384 WeakPolarHBondContact OD1-CB 3.47Å; N382-D384 PolarHBondContact OD1-N 3.44Å; N382-D384 VanDerWaalsContact OD1-N 3.07Å; D384-D386 VanDerWaalsContact C-N 3.32Å; D384-D386 PolarHBondContact O-N 3.06Å; D384-K387 HydrophobicContact CB-CB 4.37Å; D384-K387 PolarHBondContact O-N 2.76Å; D384-K387 VanDerWaalsContact O-N 3.11Å; D384-K387 WeakPolarHBondContact OD2-CE 3.45Å; D384-K387 IonicContact OD2-NZ 2.69Å; D384-K387 PolarHBondContact OD2-NZ 2.8Å; D384-Q388 PolarHBondContact O-N 3.1Å; D384-Q388 PolarHBondContact O-NE2 3.42Å; D384-N430 VanDerWaalsContact OD1-CB 3.23Å; D384-N430 WeakPolarHBondContact OD1-CB 3.28Å; D384-N430 PolarHBondContact OD1-ND2 3.23Å
385	E	85.9	Confident	92.8	Very high	167 Å²	167	32 Å²	32	78%	0.78	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-60.1	-40.2	-178.9	-62	-171.8	170.1	0	0	112.3	K387 Q388	E385-K387 PolarHBondContact O-N 3.06Å; E385-Q388 WeakPolarHBondContact O-CG 3.21Å
386	D	87.8	Confident	92.8	Very high	142 Å²	142	32.8 Å²	32.8	76%	0.759	17%	0.165	S	C	*	.	G	3₁₀ helix	trans	-60.1	-27.5	177.7	-57.2	-36.7	0	0	0	113.8	D384	D384-D386 VanDerWaalsContact C-N 3.32Å; D384-D386 PolarHBondContact O-N 3.06Å
387	K	87.9	Confident	92.7	Very high	55 Å²	55	34.9 Å²	34.9	24%	0.239	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-121.7	21	-164.3	-66.5	178.2	-64.4	-67.5	0	113	N382 D384 E385 N389 L390	N382-K387 HydrophobicContact CB-CB 4.36Å; N382-K387 WeakPolarHBondContact ND2-CE 3.33Å; D384-K387 HydrophobicContact CB-CB 4.37Å; D384-K387 PolarHBondContact O-N 2.76Å; D384-K387 VanDerWaalsContact O-N 3.11Å; D384-K387 WeakPolarHBondContact OD2-CE 3.45Å; D384-K387 IonicContact OD2-NZ 2.69Å; D384-K387 PolarHBondContact OD2-NZ 2.8Å; E385-K387 PolarHBondContact O-N 3.06Å; K387-N389 PolarHBondContact O-N 3.22Å; K387-L390 PolarHBondContact O-N 3.4Å
388	Q	88.1	Confident	92.7	Very high	39 Å²	39	36 Å²	36	18%	0.182	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-18	179.4	-70.6	-60.5	-64.8	0	0	114.9	T342 N382 P383 D384 E385 L390	T342-Q388 PolarHBondContact OG1-NE2 3.13Å; N382-Q388 PolarHBondContact O-NE2 3.33Å; P383-Q388 PolarHBondContact O-NE2 3.01Å; D384-Q388 PolarHBondContact O-N 3.1Å; D384-Q388 PolarHBondContact O-NE2 3.42Å; E385-Q388 WeakPolarHBondContact O-CG 3.21Å; Q388-L390 VanDerWaalsContact C-N 3.28Å
389	N	91.4	Very high	92.7	Very high	33 Å²	33	38.1 Å²	38.1	18%	0.176	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-13.5	173.3	65.1	-61.7	0	0	0	113.5	K387 D404 I405 R406	K387-N389 PolarHBondContact O-N 3.22Å; N389-D404 PolarHBondContact ND2-OD1 2.67Å; N389-I405 VanDerWaalsContact O-CB 3.31Å; N389-I405 WeakPolarHBondContact O-CB 3.42Å; N389-I405 VanDerWaalsContact O-CG1 3.28Å; N389-I405 WeakPolarHBondContact O-CG1 3.47Å; N389-I405 PolarHBondContact O-N 2.62Å; N389-R406 HydrophobicContact CB-CG 4.16Å
390	L	94.6	Very high	92.8	Very high	23 Å²	23	38.1 Å²	38.1	12%	0.12	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	133.6	179.1	-60.4	174	0	0	0	110.7	N382 K387 Q388 W403 D404 V411 W447	N382-L390 WeakPolarHBondContact CB-O 3.43Å; N382-L390 PolarHBondContact N-O 3.25Å; K387-L390 PolarHBondContact O-N 3.4Å; Q388-L390 VanDerWaalsContact C-N 3.28Å; L390-W403 WeakPolarHBondContact CA-O 3.47Å; L390-D404 HydrophobicContact CD2-CB 3.91Å; L390-V411 HydrophobicContact CD2-CG2 4.05Å; L390-W447 HydrophobicContact CB-CH2 4.15Å; L390-W447 HydrophobicContact CB-CZ2 3.69Å; L390-W447 HydrophobicContact CD1-CZ2 3.79Å; L390-W447 HydrophobicContact CG-CZ2 4.37Å
391	F	95.4	Very high	92.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	160.3	170	73.9	-91.8	0	0	0	111.1	L348 L356 F370 V379 K380 F381 A393 Q402 W403 I405	L348-F391 HydrophobicContact CD1-CB 3.44Å; L348-F391 VanDerWaalsContact CD1-CB 3.44Å; L348-F391 HydrophobicContact CD1-CD1 3.6Å; L348-F391 HydrophobicContact CD1-CD2 3.6Å; L348-F391 HydrophobicContact CD1-CE1 4.18Å; L348-F391 HydrophobicContact CD1-CE2 4.19Å; L348-F391 HydrophobicContact CD1-CG 3.26Å; L348-F391 HydrophobicContact CD1-CZ 4.45Å; L348-F391 HydrophobicContact CD2-CD1 4.4Å; L348-F391 HydrophobicContact CD2-CE1 4.19Å; L348-F391 HydrophobicContact CD2-CZ 4.24Å; L356-F391 HydrophobicContact CD1-CE2 4.13Å; L356-F391 HydrophobicContact CD2-CE2 4.48Å; F370-F391 HydrophobicContact CB-CZ 4.35Å; F370-F391 HydrophobicContact CD1-CE1 4.19Å; F370-F391 HydrophobicContact CD1-CZ 4.13Å; F370-F391 AromaticContact CD2-CE1 3.9Å; F370-F391 HydrophobicContact CD2-CE1 3.9Å; F370-F391 AromaticContact CD2-CZ 3.59Å; F370-F391 HydrophobicContact CD2-CZ 3.59Å; F370-F391 AromaticContact CE1-CE1 3.95Å; F370-F391 HydrophobicContact CE1-CE1 3.95Å; F370-F391 HydrophobicContact CE1-CZ 4.35Å; F370-F391 AromaticContact CE2-CE1 3.68Å; F370-F391 HydrophobicContact CE2-CE1 3.68Å; F370-F391 AromaticContact CE2-CZ 3.87Å; F370-F391 HydrophobicContact CE2-CZ 3.87Å; F370-F391 HydrophobicContact CG-CE1 4.18Å; F370-F391 AromaticContact CG-CZ 3.76Å; F370-F391 HydrophobicContact CG-CZ 3.76Å; F370-F391 AromaticContact CZ-CE1 3.71Å; F370-F391 HydrophobicContact CZ-CE1 3.71Å; F370-F391 HydrophobicContact CZ-CZ 4.25Å; V379-F391 HydrophobicContact CG1-CD2 4.01Å; K380-F391 WeakPolarHBondContact O-CA 3.28Å; K380-F391 WeakPolarHBondContact O-CB 3.43Å; F381-F391 HydrophobicContact CD1-CB 4.38Å; F391-A393 HydrophobicContact CE2-CB 4.46Å; F391-Q402 WeakPolarHBondContact O-CA 3.45Å; F391-W403 HydrophobicContact CD1-CB 4.03Å; F391-W403 HydrophobicContact CE1-CB 3.46Å; F391-W403 VanDerWaalsContact CE1-CB 3.46Å; F391-W403 HydrophobicContact CE1-CG 4.17Å; F391-W403 HydrophobicContact CE2-CB 4Å; F391-W403 AromaticContact CE2-CD1 3.63Å; F391-W403 HydrophobicContact CE2-CG 4.01Å; F391-W403 HydrophobicContact CZ-CB 3.44Å; F391-W403 VanDerWaalsContact CZ-CB 3.44Å; F391-W403 AromaticContact CZ-CD1 3.72Å; F391-W403 AromaticContact CZ-CG 3.63Å; F391-W403 HydrophobicContact CZ-CG 3.63Å; F391-W403 PolarHBondContact N-O 3.07Å; F391-W403 PolarHBondContact O-N 3.14Å; F391-I405 HydrophobicContact CD1-CD1 3.95Å; F391-I405 HydrophobicContact CD1-CG1 3.64Å; F391-I405 HydrophobicContact CE1-CG1 3.85Å
392	V	96	Very high	92.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	132.4	-177.3	69.1	0	0	0	0	110.1	V379 K380 I400 I424 F426 W447	V379-V392 WeakPolarHBondContact CA-O 3.4Å; K380-V392 HydrophobicContact CB-CG1 4.04Å; K380-V392 PolarHBondContact N-O 2.86Å; K380-V392 WeakPolarHBondContact O-CG1 3.31Å; K380-V392 PolarHBondContact O-N 2.93Å; V392-I400 HydrophobicContact CG2-CG2 3.13Å; V392-I424 HydrophobicContact CG1-CD1 4.18Å; V392-I424 HydrophobicContact CG1-CG2 3.92Å; V392-I424 HydrophobicContact CG2-CD1 3.98Å; V392-F426 HydrophobicContact CG1-CE2 3.97Å; V392-F426 HydrophobicContact CG1-CZ 3.98Å; V392-W447 HydrophobicContact CB-CZ3 4.34Å
393	A	96.3	Very high	93.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.5	-179.9	0	0	0	0	0	110.8	L356 C378 V379 F391 M395 I400 V401	L356-A393 HydrophobicContact CD1-CB 4.03Å; L356-A393 HydrophobicContact CD2-CB 4.14Å; C378-A393 WeakPolarHBondContact O-CA 3.41Å; V379-A393 HydrophobicContact CG2-CB 4.3Å; F391-A393 HydrophobicContact CE2-CB 4.46Å; A393-M395 HydrophobicContact CB-SD 3.95Å; A393-I400 WeakPolarHBondContact O-CA 3.4Å; A393-V401 PolarHBondContact N-O 3.01Å; A393-V401 PolarHBondContact O-N 2.88Å
394	G	95.7	Very high	93.4	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	120.1	171.6	0	0	0	0	0	110	Y377 C378	Y377-G394 PolarHBondContact N-O 3.03Å; C378-G394 PolarHBondContact O-N 3.08Å
395	M	95.5	Very high	93.6	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	161	-170.3	-54.9	-59.9	-63.7	0	0	112.9	N372 K374 P376 A393 D397 K399 V401 V421	N372-M395 HydrophobicContact CB-CE 4.14Å; K374-M395 HydrophobicContact CB-CE 3.88Å; K374-M395 WeakPolarHBondContact O-CE 3.44Å; P376-M395 HydrophobicContact CB-CE 4.22Å; P376-M395 HydrophobicContact CB-SD 3.82Å; A393-M395 HydrophobicContact CB-SD 3.95Å; M395-D397 VanDerWaalsContact C-N 3.28Å; M395-D397 WeakPolarHBondContact CB-OD1 3.19Å; M395-D397 PolarHBondContact O-N 2.86Å; M395-K399 VanDerWaalsContact CB-O 3.29Å; M395-K399 WeakPolarHBondContact CB-O 3.37Å; M395-K399 PolarHBondContact N-O 3.4Å; M395-V401 HydrophobicContact CG-CB 4.32Å; M395-V401 HydrophobicContact CG-CG2 3.72Å; M395-V421 PolarHBondContact O-N 3.02Å
396	S	94.4	Very high	93.9	Very high	42 Å²	42	37.2 Å²	37.2	29%	0.294	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-24.2	176.5	63.2	0	0	0	0	114.2	V375 K398	V375-S396 PolarHBondContact N-OG 2.86Å; V375-S396 WeakPolarHBondContact O-CB 3.41Å; V375-S396 PolarHBondContact O-N 2.92Å; V375-S396 PolarHBondContact O-OG 2.81Å; S396-K398 PolarHBondContact O-N 3.49Å
397	D	92.6	Very high	94.1	Very high	44 Å²	44	33.7 Å²	33.7	24%	0.235	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89	25.9	-178.4	67.6	-27.6	0	0	0	112.9	K374 M395 K399	K374-D397 HydrophobicContact CD-CB 4.04Å; K374-D397 HydrophobicContact CG-CB 3.92Å; M395-D397 VanDerWaalsContact C-N 3.28Å; M395-D397 WeakPolarHBondContact CB-OD1 3.19Å; M395-D397 PolarHBondContact O-N 2.86Å; D397-K399 PolarHBondContact O-N 2.64Å; D397-K399 VanDerWaalsContact O-N 3.07Å
398	K	93.9	Very high	94.2	Very high	90 Å²	90	32.6 Å²	32.6	39%	0.391	17%	0.166	S	C	.	.	S	Bend	trans	71.8	-17.6	180	-39.3	164.1	-176.1	-165.1	0	114.5	S396 H417 L418 G419 V421	S396-K398 PolarHBondContact O-N 3.49Å; K398-H417 HydrophobicContact CB-CB 4.3Å; K398-H417 WeakPolarHBondContact CB-O 3.36Å; K398-H417 WeakPolarHBondContact O-CB 3.37Å; K398-L418 VanDerWaalsContact CD-O 3.31Å; K398-L418 WeakPolarHBondContact CD-O 3.49Å; K398-L418 WeakPolarHBondContact CE-O 3.22Å; K398-L418 PolarHBondContact NZ-O 3.38Å; K398-G419 WeakPolarHBondContact CA-O 2.97Å; K398-G419 WeakPolarHBondContact CB-O 3.31Å; K398-V421 WeakPolarHBondContact O-CG2 3.44Å
399	K	95.3	Very high	94.3	Very high	45 Å²	45	37 Å²	37	20%	0.196	19%	0.187	C	C	.	.			trans	-71.9	147.1	178.9	-65.9	-174.5	173.6	-167.4	0	111.5	M395 D397 V401 E413 D415	M395-K399 VanDerWaalsContact CB-O 3.29Å; M395-K399 WeakPolarHBondContact CB-O 3.37Å; M395-K399 PolarHBondContact N-O 3.4Å; D397-K399 PolarHBondContact O-N 2.64Å; D397-K399 VanDerWaalsContact O-N 3.07Å; K399-V401 HydrophobicContact CB-CG2 4.02Å; K399-E413 IonicContact NZ-OE1 2.73Å; K399-E413 IonicContact NZ-OE2 3.58Å; K399-E413 PolarHBondContact NZ-OE2 2.9Å; K399-D415 VanDerWaalsContact CE-CG 3.5Å; K399-D415 WeakPolarHBondContact CE-OD2 3.39Å; K399-D415 HydrophobicContact CG-CB 4.19Å; K399-D415 IonicContact NZ-OD2 2.62Å
400	I	96.8	Very high	94.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	132.8	155.2	-55.2	178.8	0	0	0	106.2	V392 A393 E413 Y414 V421 I424 F433 S435 W445	V392-I400 HydrophobicContact CG2-CG2 3.13Å; A393-I400 WeakPolarHBondContact O-CA 3.4Å; I400-E413 WeakPolarHBondContact O-CA 3.46Å; I400-Y414 HydrophobicContact CB-CD2 4.11Å; I400-Y414 HydrophobicContact CB-CG 4.38Å; I400-Y414 HydrophobicContact CG2-CD2 4.18Å; I400-Y414 PolarHBondContact N-O 3.4Å; I400-Y414 PolarHBondContact O-N 2.94Å; I400-V421 HydrophobicContact CD1-CG1 4.1Å; I400-V421 HydrophobicContact CG1-CB 4.4Å; I400-V421 HydrophobicContact CG1-CG1 3.98Å; I400-V421 HydrophobicContact CG1-CG2 3.82Å; I400-I424 HydrophobicContact CD1-CD1 4.36Å; I400-I424 HydrophobicContact CG1-CD1 4.48Å; I400-I424 HydrophobicContact CG2-CD1 3.68Å; I400-F433 HydrophobicContact CD1-CE2 3.93Å; I400-F433 HydrophobicContact CG2-CE2 4.36Å; I400-S435 VanDerWaalsContact CD1-CB 3.43Å; I400-W445 HydrophobicContact CD1-CZ2 4.38Å
401	V	96.5	Very high	94.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.6	-173.6	-173.6	0	0	0	0	109.1	A393 M395 K399 W403 I410	A393-V401 PolarHBondContact N-O 3.01Å; A393-V401 PolarHBondContact O-N 2.88Å; M395-V401 HydrophobicContact CG-CB 4.32Å; M395-V401 HydrophobicContact CG-CG2 3.72Å; K399-V401 HydrophobicContact CB-CG2 4.02Å; V401-W403 HydrophobicContact CG1-CZ2 4.37Å; V401-I410 HydrophobicContact CG1-CB 4.31Å; V401-I410 HydrophobicContact CG1-CD1 3.92Å; V401-I410 HydrophobicContact CG1-CG1 3.82Å; V401-I410 HydrophobicContact CG1-CG2 3.65Å
402	Q	96.1	Very high	94.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	128.2	176.5	179.3	-179.7	-41.2	0	0	109.2	F391 V411 Q412 Y414 W447 D448	F391-Q402 WeakPolarHBondContact O-CA 3.45Å; Q402-V411 HydrophobicContact CG-CB 4.37Å; Q402-V411 PolarHBondContact O-N 2.77Å; Q402-Q412 HydrophobicContact CB-CB 4.14Å; Q402-Q412 PolarHBondContact N-O 3.2Å; Q402-Q412 PolarHBondContact O-N 3.16Å; Q402-Y414 HydrophobicContact CB-CE2 4.13Å; Q402-Y414 PolarHBondContact OE1-OH 2.56Å; Q402-W447 HydrophobicContact CG-CH2 4.08Å; Q402-W447 HydrophobicContact CG-CZ2 4.24Å; Q402-D448 PolarHBondContact NE2-OD1 2.75Å
403	W	95.9	Very high	94.4	Very high	13 Å²	13	46.3 Å²	46.3	5%	0.049	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	146.9	-177.5	-68.5	86.4	0	0	0	110.4	F370 T371 N372 L390 F391 V401 G408 E409 I410	F370-W403 HydrophobicContact CB-CD2 4.05Å; F370-W403 HydrophobicContact CB-CE3 4.08Å; F370-W403 HydrophobicContact CB-CH2 4.32Å; F370-W403 HydrophobicContact CB-CZ2 4.29Å; F370-W403 HydrophobicContact CB-CZ3 4.22Å; F370-W403 HydrophobicContact CD1-CB 4.41Å; F370-W403 HydrophobicContact CD1-CD2 4.09Å; F370-W403 AromaticContact CD1-CE3 3.72Å; F370-W403 HydrophobicContact CD1-CE3 3.72Å; F370-W403 HydrophobicContact CD1-CG 4.43Å; F370-W403 HydrophobicContact CD1-CZ3 4.33Å; F370-W403 HydrophobicContact CG-CD2 4.39Å; F370-W403 HydrophobicContact CG-CE3 4.32Å; T371-W403 WeakPolarHBondContact O-CH2 3.15Å; N372-W403 HydrophobicContact CB-CZ2 4.24Å; L390-W403 WeakPolarHBondContact CA-O 3.47Å; F391-W403 HydrophobicContact CD1-CB 4.03Å; F391-W403 HydrophobicContact CE1-CB 3.46Å; F391-W403 VanDerWaalsContact CE1-CB 3.46Å; F391-W403 HydrophobicContact CE1-CG 4.17Å; F391-W403 HydrophobicContact CE2-CB 4Å; F391-W403 AromaticContact CE2-CD1 3.63Å; F391-W403 HydrophobicContact CE2-CG 4.01Å; F391-W403 HydrophobicContact CZ-CB 3.44Å; F391-W403 VanDerWaalsContact CZ-CB 3.44Å; F391-W403 AromaticContact CZ-CD1 3.72Å; F391-W403 AromaticContact CZ-CG 3.63Å; F391-W403 HydrophobicContact CZ-CG 3.63Å; F391-W403 PolarHBondContact N-O 3.07Å; F391-W403 PolarHBondContact O-N 3.14Å; V401-W403 HydrophobicContact CG1-CZ2 4.37Å; W403-G408 VanDerWaalsContact CZ3-O 3.25Å; W403-G408 WeakPolarHBondContact CZ3-O 3.26Å; W403-E409 VanDerWaalsContact CE3-C 3.45Å; W403-I410 HydrophobicContact CD2-CG1 4Å; W403-I410 HydrophobicContact CE3-CG1 3.89Å; W403-I410 HydrophobicContact CH2-CD1 3.91Å; W403-I410 HydrophobicContact CH2-CG1 3.47Å; W403-I410 VanDerWaalsContact CH2-CG1 3.47Å; W403-I410 HydrophobicContact CZ2-CD1 3.9Å; W403-I410 HydrophobicContact CZ2-CG1 3.57Å; W403-I410 HydrophobicContact CZ3-CG1 3.63Å
404	D	95.3	Very high	94.4	Very high	25 Å²	25	46.3 Å²	46.3	13%	0.134	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	126	161.7	175.3	34.5	0	0	0	110.4	N389 L390 R406 S407 G408 E409 V411	N389-D404 PolarHBondContact ND2-OD1 2.67Å; L390-D404 HydrophobicContact CD2-CB 3.91Å; D404-R406 VanDerWaalsContact C-N 3.27Å; D404-R406 PolarHBondContact O-N 3.27Å; D404-R406 PolarHBondContact OD1-N 2.8Å; D404-R406 VanDerWaalsContact OD1-N 3.13Å; D404-R406 WeakPolarHBondContact OD2-CB 3.27Å; D404-S407 WeakPolarHBondContact OD2-CB 3.35Å; D404-S407 PolarHBondContact OD2-N 3.02Å; D404-G408 WeakPolarHBondContact O-CA 3.46Å; D404-G408 PolarHBondContact O-N 3.47Å; D404-E409 PolarHBondContact N-O 3.16Å; D404-V411 HydrophobicContact CB-CG2 3.73Å
405	I	93.9	Very high	94.4	Very high	26 Å²	26	50.5 Å²	50.5	13%	0.133	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-33	178.3	-72.5	168.5	0	0	0	111.8	L358 F370 F381 N389 F391	L358-I405 HydrophobicContact CD1-CD1 4.4Å; L358-I405 HydrophobicContact CD2-CB 4.45Å; L358-I405 HydrophobicContact CD2-CD1 4.18Å; L358-I405 HydrophobicContact CD2-CG1 4.25Å; L358-I405 HydrophobicContact CD2-CG2 3.39Å; F370-I405 HydrophobicContact CZ-CB 4.38Å; F370-I405 HydrophobicContact CZ-CG1 4.02Å; F381-I405 HydrophobicContact CD1-CD1 4.34Å; F381-I405 HydrophobicContact CE1-CD1 3.44Å; F381-I405 VanDerWaalsContact CE1-CD1 3.44Å; F381-I405 HydrophobicContact CZ-CD1 4.09Å; N389-I405 VanDerWaalsContact O-CB 3.31Å; N389-I405 WeakPolarHBondContact O-CB 3.42Å; N389-I405 VanDerWaalsContact O-CG1 3.28Å; N389-I405 WeakPolarHBondContact O-CG1 3.47Å; N389-I405 PolarHBondContact O-N 2.62Å; F391-I405 HydrophobicContact CD1-CD1 3.95Å; F391-I405 HydrophobicContact CD1-CG1 3.64Å; F391-I405 HydrophobicContact CE1-CG1 3.85Å
406	R	92.6	Very high	94.3	Very high	203 Å²	203	56.4 Å²	56.4	77%	0.766	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-48.3	-176.1	-55.5	176.5	-174.7	171.2	6.7	110.9	N389 D404	N389-R406 HydrophobicContact CB-CG 4.16Å; D404-R406 VanDerWaalsContact C-N 3.27Å; D404-R406 PolarHBondContact O-N 3.27Å; D404-R406 PolarHBondContact OD1-N 2.8Å; D404-R406 VanDerWaalsContact OD1-N 3.13Å; D404-R406 WeakPolarHBondContact OD2-CB 3.27Å
407	S	91	Very high	94.4	Very high	69 Å²	69	54.6 Å²	54.6	48%	0.483	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-27.5	179.8	-163.2	0	0	0	0	113.8	D404 E409	D404-S407 WeakPolarHBondContact OD2-CB 3.35Å; D404-S407 PolarHBondContact OD2-N 3.02Å; S407-E409 PolarHBondContact O-N 3.13Å
408	G	90.1	Very high	94.4	Very high	32 Å²	32	57.8 Å²	57.8	33%	0.33	28%	0.282	S	S	.	.			trans	73.7	10.9	-171.9	0	0	0	0	0	114.2	W403 D404	W403-G408 VanDerWaalsContact CZ3-O 3.25Å; W403-G408 WeakPolarHBondContact CZ3-O 3.26Å; D404-G408 WeakPolarHBondContact O-CA 3.46Å; D404-G408 PolarHBondContact O-N 3.47Å
409	E	91.9	Very high	94.4	Very high	132 Å²	132	54.2 Å²	54.2	62%	0.617	27%	0.271	S	S	*	.	S	Bend	trans	-107.6	160.7	-175.7	-66.3	-171.8	174.3	0	0	112.5	W403 D404 S407 V411	W403-E409 VanDerWaalsContact CE3-C 3.45Å; D404-E409 PolarHBondContact N-O 3.16Å; S407-E409 PolarHBondContact O-N 3.13Å; E409-V411 PolarHBondContact O-N 2.88Å
410	I	94.9	Very high	94.4	Very high	62 Å²	62	52.8 Å²	52.8	32%	0.318	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	117.8	174.1	-61.8	174.7	0	0	0	108	V401 W403 E413	V401-I410 HydrophobicContact CG1-CB 4.31Å; V401-I410 HydrophobicContact CG1-CD1 3.92Å; V401-I410 HydrophobicContact CG1-CG1 3.82Å; V401-I410 HydrophobicContact CG1-CG2 3.65Å; W403-I410 HydrophobicContact CD2-CG1 4Å; W403-I410 HydrophobicContact CE3-CG1 3.89Å; W403-I410 HydrophobicContact CH2-CD1 3.91Å; W403-I410 HydrophobicContact CH2-CG1 3.47Å; W403-I410 VanDerWaalsContact CH2-CG1 3.47Å; W403-I410 HydrophobicContact CZ2-CD1 3.9Å; W403-I410 HydrophobicContact CZ2-CG1 3.57Å; W403-I410 HydrophobicContact CZ3-CG1 3.63Å; I410-E413 HydrophobicContact CG2-CG 3.85Å
411	V	94.4	Very high	94.4	Very high	67 Å²	67	52.8 Å²	52.8	41%	0.406	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-47.5	176.4	178.1	0	0	0	0	110.3	L390 Q402 D404 E409	L390-V411 HydrophobicContact CD2-CG2 4.05Å; Q402-V411 HydrophobicContact CG-CB 4.37Å; Q402-V411 PolarHBondContact O-N 2.77Å; D404-V411 HydrophobicContact CB-CG2 3.73Å; E409-V411 PolarHBondContact O-N 2.88Å
412	Q	94.3	Very high	94.3	Very high	59 Å²	59	54.1 Å²	54.1	28%	0.276	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	141.5	-173.6	-167.1	54.4	57.6	0	0	112	Q402 Y414 P450	Q402-Q412 HydrophobicContact CB-CB 4.14Å; Q402-Q412 PolarHBondContact N-O 3.2Å; Q402-Q412 PolarHBondContact O-N 3.16Å; Q412-Y414 HydrophobicContact CB-CE2 4.3Å; Q412-Y414 HydrophobicContact CG-CE2 4.1Å; Q412-P450 HydrophobicContact CG-CB 4.39Å
413	E	95.3	Very high	94.3	Very high	63 Å²	63	54.7 Å²	54.7	29%	0.294	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	137.6	170	-60.7	-168.6	150	0	0	110.5	K399 I400 I410 P450	K399-E413 IonicContact NZ-OE1 2.73Å; K399-E413 IonicContact NZ-OE2 3.58Å; K399-E413 PolarHBondContact NZ-OE2 2.9Å; I400-E413 WeakPolarHBondContact O-CA 3.46Å; I410-E413 HydrophobicContact CG2-CG 3.85Å; E413-P450 VanDerWaalsContact O-CB 3.3Å; E413-P450 WeakPolarHBondContact O-CB 3.13Å
414	Y	96.1	Very high	94.3	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	106.6	174.5	-47.3	-115	0	0	0	108.3	I400 Q402 Q412 F433 W445 D448 I449	I400-Y414 HydrophobicContact CB-CD2 4.11Å; I400-Y414 HydrophobicContact CB-CG 4.38Å; I400-Y414 HydrophobicContact CG2-CD2 4.18Å; I400-Y414 PolarHBondContact N-O 3.4Å; I400-Y414 PolarHBondContact O-N 2.94Å; Q402-Y414 HydrophobicContact CB-CE2 4.13Å; Q402-Y414 PolarHBondContact OE1-OH 2.56Å; Q412-Y414 HydrophobicContact CB-CE2 4.3Å; Q412-Y414 HydrophobicContact CG-CE2 4.1Å; Y414-F433 AromaticContact CD1-CZ 3.93Å; Y414-F433 HydrophobicContact CD1-CZ 3.93Å; Y414-F433 HydrophobicContact CD2-CZ 4.37Å; Y414-F433 AromaticContact CE1-CE1 3.84Å; Y414-F433 HydrophobicContact CE1-CE1 3.84Å; Y414-F433 AromaticContact CE1-CZ 3.59Å; Y414-F433 HydrophobicContact CE1-CZ 3.59Å; Y414-F433 HydrophobicContact CE2-CZ 4.1Å; Y414-F433 HydrophobicContact CG-CZ 4.33Å; Y414-F433 AromaticContact CZ-CE1 3.83Å; Y414-F433 AromaticContact CZ-CZ 3.7Å; Y414-W445 HydrophobicContact CD1-CB 4.44Å; Y414-W445 AromaticContact CD1-CD2 3.89Å; Y414-W445 HydrophobicContact CD1-CD2 3.89Å; Y414-W445 AromaticContact CD1-CE3 3.58Å; Y414-W445 HydrophobicContact CD1-CE3 3.58Å; Y414-W445 HydrophobicContact CD1-CG 4.29Å; Y414-W445 HydrophobicContact CD1-CZ3 4.02Å; Y414-W445 HydrophobicContact CE1-CB 4.37Å; Y414-W445 HydrophobicContact CE1-CE3 4.48Å; Y414-W445 HydrophobicContact CG-CE3 4.35Å; Y414-W445 HydrophobicContact CG-CZ3 4.44Å; Y414-D448 WeakPolarHBondContact OH-CA 3.43Å; Y414-D448 PolarHBondContact OH-N 2.85Å; Y414-I449 WeakPolarHBondContact CD1-O 3.29Å; Y414-I449 VanDerWaalsContact CE1-O 3.24Å; Y414-I449 WeakPolarHBondContact CE1-O 3.39Å
415	D	95.3	Very high	94.3	Very high	87 Å²	87	53.6 Å²	53.6	47%	0.465	27%	0.274	S	S	.	.			trans	-119.5	47.4	-166.1	-164.6	17.3	0	0	0	112.7	K399	K399-D415 VanDerWaalsContact CE-CG 3.5Å; K399-D415 WeakPolarHBondContact CE-OD2 3.39Å; K399-D415 HydrophobicContact CG-CB 4.19Å; K399-D415 IonicContact NZ-OD2 2.62Å
416	R	94.2	Very high	94.3	Very high	125 Å²	125	53 Å²	53	47%	0.472	27%	0.271	S	S	.	.			trans	-106.7	-11.1	176.5	-53.6	-61.5	-172.8	96.8	-10	114.4	R443 W445 D452	R416-R443 PolarHBondContact O-NE 3.41Å; R416-R443 PolarHBondContact O-NH2 3.06Å; R416-W445 HydrophobicContact CB-CH2 3.6Å; R416-W445 HydrophobicContact CB-CZ3 4.24Å; R416-W445 HydrophobicContact CG-CH2 3.81Å; R416-W445 HydrophobicContact CG-CZ3 3.95Å; R416-D452 WeakPolarHBondContact CG-OD1 3.37Å
417	H	95.4	Very high	94.3	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.019	24%	0.235	C	C	.	.			trans	-74	151.3	176.4	-71.4	-64.7	0	0	0	112.3	K398 V421 S435 S437 R443 W445	K398-H417 HydrophobicContact CB-CB 4.3Å; K398-H417 WeakPolarHBondContact CB-O 3.36Å; K398-H417 WeakPolarHBondContact O-CB 3.37Å; H417-V421 HydrophobicContact CB-CG2 4.39Å; H417-S435 PolarHBondContact CE1-OG 3.4Å; H417-S435 VanDerWaalsContact CE1-OG 3.31Å; H417-S435 PolarHBondContact NE2-OG 3.08Å; H417-S437 PolarHBondContact CE1-OG 3.23Å; H417-S437 PolarHBondContact ND1-OG 3.35Å; H417-R443 WeakPolarHBondContact ND1-CD 3.3Å; H417-R443 PolarHBondContact ND1-NH1 2.69Å; H417-W445 AromaticContact CD2-CZ2 3.95Å; H417-W445 AromaticContact NE2-CZ2 3.84Å
418	L	94.3	Very high	94.1	Very high	111 Å²	111	42.4 Å²	42.4	58%	0.581	22%	0.224	S	C	*	.	S	Bend	trans	-104.2	-15.8	-178	-59.8	174	0	0	0	113.4	K398 D439	K398-L418 VanDerWaalsContact CD-O 3.31Å; K398-L418 WeakPolarHBondContact CD-O 3.49Å; K398-L418 WeakPolarHBondContact CE-O 3.22Å; K398-L418 PolarHBondContact NZ-O 3.38Å; L418-D439 HydrophobicContact CB-CB 3.84Å; L418-D439 WeakPolarHBondContact CB-OD2 3.11Å; L418-D439 PolarHBondContact N-OD2 3Å
419	G	93.8	Very high	93.8	Very high	15 Å²	15	49.7 Å²	49.7	16%	0.155	25%	0.249	C	C	.	.	S	Bend	trans	-132.4	178.9	176.7	0	0	0	0	0	112.2	K398	K398-G419 WeakPolarHBondContact CA-O 2.97Å; K398-G419 WeakPolarHBondContact CB-O 3.31Å
420	A	94.8	Very high	93.6	Very high	15 Å²	15	45.5 Å²	45.5	12%	0.124	23%	0.231	C	C	.	.			trans	-57.2	142.1	178	0	0	0	0	0	111.5	Y377 S437 D438	Y377-A420 HydrophobicContact CD2-CB 4.26Å; Y377-A420 HydrophobicContact CE2-CB 3.88Å; A420-S437 CarbonylContact O-C 3.51Å; A420-S437 WeakPolarHBondContact O-CA 3.16Å; A420-S437 WeakPolarHBondContact O-CB 3.32Å; A420-D438 PolarHBondContact O-N 3.02Å
421	V	96.3	Very high	93.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	117.2	-179.3	-175.8	0	0	0	0	109.2	Y377 M395 K398 I400 H417 I424 T436	Y377-V421 VanDerWaalsContact CB-O 3.27Å; Y377-V421 WeakPolarHBondContact CB-O 3.37Å; M395-V421 PolarHBondContact O-N 3.02Å; K398-V421 WeakPolarHBondContact O-CG2 3.44Å; I400-V421 HydrophobicContact CD1-CG1 4.1Å; I400-V421 HydrophobicContact CG1-CB 4.4Å; I400-V421 HydrophobicContact CG1-CG1 3.98Å; I400-V421 HydrophobicContact CG1-CG2 3.82Å; H417-V421 HydrophobicContact CB-CG2 4.39Å; V421-I424 HydrophobicContact CG1-CG1 4.27Å; V421-T436 CarbonylContact C-O 3.59Å; V421-T436 WeakPolarHBondContact CA-O 3.45Å; V421-T436 WeakPolarHBondContact CG1-O 3.45Å
422	N	94.8	Very high	93.3	Very high	28 Å²	28	47.7 Å²	47.7	15%	0.15	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-46.5	-172.3	-80.1	-45	0	0	0	113.3	C378 T436 D438 S463	C378-N422 WeakPolarHBondContact CB-O 3.49Å; N422-T436 PolarHBondContact N-O 3.49Å; N422-D438 PolarHBondContact ND2-OD1 3.39Å; N422-S463 PolarHBondContact ND2-OG 2.92Å; N422-S463 VanDerWaalsContact ND2-OG 3.13Å
423	T	95.1	Very high	93.3	Very high	13 Å²	13	44.9 Å²	44.9	8%	0.08	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	158.2	179.9	-170.9	0	0	0	0	112.7	S435 T436 V467	T423-S435 WeakPolarHBondContact O-CA 3.42Å; T423-T436 HydrophobicContact CG2-CG2 3.94Å; T423-T436 VanDerWaalsContact CG2-OG1 3.28Å; T423-T436 WeakPolarHBondContact CG2-OG1 3.41Å; T423-T436 PolarHBondContact N-OG1 2.88Å; T423-T436 PolarHBondContact O-N 3.32Å; T423-V467 HydrophobicContact CG2-CB 3.87Å; T423-V467 HydrophobicContact CG2-CG2 3.79Å
424	I	96.3	Very high	93.3	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	135.7	179.3	-58.8	175.8	0	0	0	108.3	K380 V392 I400 V421 F433 V434	K380-I424 WeakPolarHBondContact CE-O 3.45Å; K380-I424 HydrophobicContact CG-CB 4.15Å; K380-I424 HydrophobicContact CG-CG2 4.28Å; K380-I424 VanDerWaalsContact CG-O 3.26Å; K380-I424 WeakPolarHBondContact CG-O 3.35Å; V392-I424 HydrophobicContact CG1-CD1 4.18Å; V392-I424 HydrophobicContact CG1-CG2 3.92Å; V392-I424 HydrophobicContact CG2-CD1 3.98Å; I400-I424 HydrophobicContact CD1-CD1 4.36Å; I400-I424 HydrophobicContact CG1-CD1 4.48Å; I400-I424 HydrophobicContact CG2-CD1 3.68Å; V421-I424 HydrophobicContact CG1-CG1 4.27Å; I424-F433 HydrophobicContact CG2-CB 4.23Å; I424-F433 HydrophobicContact CG2-CD2 3.78Å; I424-F433 HydrophobicContact CG2-CG 4.28Å; I424-V434 WeakPolarHBondContact CA-O 3.44Å
425	V	95.1	Very high	93.3	Very high	14 Å²	14	42 Å²	42	9%	0.085	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	124.9	179.5	178.8	0	0	0	0	109.1	V427 F433 V434 V467 L469 L476	V425-V427 HydrophobicContact CG1-CG2 4.49Å; V425-F433 CarbonylContact O-C 3.55Å; V425-F433 WeakPolarHBondContact O-CA 3.5Å; V425-V434 PolarHBondContact N-O 3.22Å; V425-V434 PolarHBondContact O-N 3.41Å; V425-V467 HydrophobicContact CB-CG1 4.5Å; V425-V467 HydrophobicContact CG2-CB 3.93Å; V425-V467 HydrophobicContact CG2-CG1 3.96Å; V425-V467 VanDerWaalsContact CG2-O 3.24Å; V425-V467 WeakPolarHBondContact CG2-O 3.37Å; V425-L469 HydrophobicContact CG1-CB 3.83Å; V425-L476 HydrophobicContact CG1-CD2 3.96Å
426	F	94.5	Very high	93.3	Very high	15 Å²	15	37.9 Å²	37.9	7%	0.066	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	144.9	172.9	-76.8	-90.5	0	0	0	111.3	K380 F381 N382 P383 V392 N430 F433 W447	K380-F426 HydrophobicContact CB-CD2 4.11Å; K380-F426 HydrophobicContact CB-CE2 3.67Å; F381-F426 WeakPolarHBondContact O-CE2 3.17Å; N382-F426 HydrophobicContact CB-CZ 4.31Å; P383-F426 VanDerWaalsContact CD-CG 3.49Å; P383-F426 HydrophobicContact CG-CB 3.85Å; P383-F426 HydrophobicContact CG-CD1 4.3Å; P383-F426 HydrophobicContact CG-CD2 3.81Å; P383-F426 HydrophobicContact CG-CE2 4.44Å; P383-F426 HydrophobicContact CG-CG 3.72Å; V392-F426 HydrophobicContact CG1-CE2 3.97Å; V392-F426 HydrophobicContact CG1-CZ 3.98Å; F426-N430 HydrophobicContact CD1-CB 4.37Å; F426-N430 WeakPolarHBondContact CD1-O 3.31Å; F426-F433 HydrophobicContact CD1-CB 4.12Å; F426-F433 HydrophobicContact CE1-CB 4.35Å; F426-F433 HydrophobicContact CG-CB 4.37Å; F426-W447 AromaticContact CE1-CE3 3.6Å; F426-W447 HydrophobicContact CE1-CE3 3.6Å; F426-W447 AromaticContact CE1-CZ3 3.68Å; F426-W447 HydrophobicContact CE1-CZ3 3.68Å; F426-W447 AromaticContact CZ-CE3 3.96Å; F426-W447 HydrophobicContact CZ-CE3 3.96Å; F426-W447 HydrophobicContact CZ-CH2 4.35Å; F426-W447 AromaticContact CZ-CZ3 3.51Å; F426-W447 HydrophobicContact CZ-CZ3 3.51Å
427	V	92.3	Very high	93.3	Very high	2 Å²	2	32 Å²	32	1%	0.012	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	160.2	-172.6	-174.2	0	0	0	0	109.1	V425 N430 R432 V434 L469 L476 A490 F494	V425-V427 HydrophobicContact CG1-CG2 4.49Å; V427-N430 PolarHBondContact O-N 3Å; V427-R432 PolarHBondContact N-O 3.12Å; V427-R432 CarbonylContact O-C 3.6Å; V427-R432 PolarHBondContact O-N 3.21Å; V427-R432 VanDerWaalsContact O-N 3.17Å; V427-V434 HydrophobicContact CG2-CB 4.3Å; V427-V434 HydrophobicContact CG2-CG2 3.66Å; V427-L469 HydrophobicContact CG1-CD1 4.47Å; V427-L469 HydrophobicContact CG2-CD1 4.3Å; V427-L476 HydrophobicContact CG2-CD1 4.29Å; V427-L476 HydrophobicContact CG2-CD2 3.91Å; V427-A490 HydrophobicContact CG1-CB 3.73Å; V427-F494 HydrophobicContact CG1-CE1 3.99Å; V427-F494 HydrophobicContact CG1-CZ 4.03Å
428	D	87.4	Confident	93.2	Very high	47 Å²	47	35.6 Å²	35.6	25%	0.251	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	56.2	170.4	-151.3	33.4	0	0	0	111.6	N430 R431 R432	D428-N430 VanDerWaalsContact C-N 3.26Å; D428-N430 PolarHBondContact O-N 2.87Å; D428-R431 WeakPolarHBondContact O-CB 3.33Å; D428-R431 PolarHBondContact O-N 3.03Å; D428-R432 HydrophobicContact CB-CB 4.22Å; D428-R432 HydrophobicContact CB-CG 4.46Å; D428-R432 WeakPolarHBondContact OD2-CD 3.24Å; D428-R432 IonicContact OD2-CZ 3.03Å; D428-R432 IonicContact OD2-NE 2.96Å; D428-R432 IonicContact OD2-NH1 3.18Å; D428-R432 PolarHBondContact OD2-NH1 3.28Å
429	E	84.1	Confident	93.1	Very high	184 Å²	184	32 Å²	32	86%	0.86	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	46.3	-176.7	-65	169.4	-168.1	0	0	111.6	R431	E429-R431 PolarHBondContact O-N 2.8Å
430	N	87.4	Confident	93.1	Very high	44 Å²	44	36 Å²	36	24%	0.235	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	-7.9	-179.8	-46.2	-39.2	0	0	0	116.6	P383 D384 F426 V427 D428 R432	P383-N430 HydrophobicContact CG-CB 4.36Å; P383-N430 WeakPolarHBondContact CG-OD1 3.48Å; D384-N430 VanDerWaalsContact OD1-CB 3.23Å; D384-N430 WeakPolarHBondContact OD1-CB 3.28Å; D384-N430 PolarHBondContact OD1-ND2 3.23Å; F426-N430 HydrophobicContact CD1-CB 4.37Å; F426-N430 WeakPolarHBondContact CD1-O 3.31Å; V427-N430 PolarHBondContact O-N 3Å; D428-N430 VanDerWaalsContact C-N 3.26Å; D428-N430 PolarHBondContact O-N 2.87Å; N430-R432 PolarHBondContact O-N 3.4Å; N430-R432 VanDerWaalsContact O-N 3.13Å
431	R	89.6	Confident	93.1	Very high	142 Å²	142	35.2 Å²	35.2	54%	0.536	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-28.3	177.1	-178.9	-177.9	163.5	173.3	-2.5	112.6	D428 E429 E446 W447	D428-R431 WeakPolarHBondContact O-CB 3.33Å; D428-R431 PolarHBondContact O-N 3.03Å; E429-R431 PolarHBondContact O-N 2.8Å; R431-E446 IonicContact CZ-OE2 2.73Å; R431-E446 IonicContact NE-OE2 3.05Å; R431-E446 IonicContact NH2-OE1 3.28Å; R431-E446 PolarHBondContact NH2-OE1 3.43Å; R431-E446 IonicContact NH2-OE2 2.67Å; R431-E446 PolarHBondContact NH2-OE2 3.09Å; R431-W447 WeakPolarHBondContact O-CB 3.43Å; R431-W447 PolarHBondContact O-N 3.28Å
432	R	92.3	Very high	93	Very high	34 Å²	34	35.4 Å²	35.4	13%	0.128	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	159.6	-176.9	-69.8	171.2	173	154	-7.3	110.6	V427 D428 N430 W445 E446 F453	V427-R432 PolarHBondContact N-O 3.12Å; V427-R432 CarbonylContact O-C 3.6Å; V427-R432 PolarHBondContact O-N 3.21Å; V427-R432 VanDerWaalsContact O-N 3.17Å; D428-R432 HydrophobicContact CB-CB 4.22Å; D428-R432 HydrophobicContact CB-CG 4.46Å; D428-R432 WeakPolarHBondContact OD2-CD 3.24Å; D428-R432 IonicContact OD2-CZ 3.03Å; D428-R432 IonicContact OD2-NE 2.96Å; D428-R432 IonicContact OD2-NH1 3.18Å; D428-R432 PolarHBondContact OD2-NH1 3.28Å; N430-R432 PolarHBondContact O-N 3.4Å; N430-R432 VanDerWaalsContact O-N 3.13Å; R432-W445 VanDerWaalsContact CA-O 3.23Å; R432-W445 WeakPolarHBondContact CA-O 3.43Å; R432-W445 VanDerWaalsContact CB-O 3.27Å; R432-W445 WeakPolarHBondContact CB-O 3.42Å; R432-W445 WeakPolarHBondContact CG-O 3.4Å; R432-E446 HydrophobicContact CG-CG 4.3Å; R432-E446 IonicContact CZ-OE1 3.75Å; R432-E446 IonicContact NE-OE1 2.81Å; R432-E446 PolarHBondContact NE-OE1 3.12Å; R432-E446 IonicContact NH2-OE1 3.73Å; R432-E446 PolarHBondContact NH2-OE1 3.33Å; R432-F453 HydrophobicContact CG-CE1 4.11Å
433	F	94.8	Very high	93	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	142.7	166.4	65.2	-89	0	0	0	111.5	I400 Y414 I424 V425 F426 V444 W445 W447	I400-F433 HydrophobicContact CD1-CE2 3.93Å; I400-F433 HydrophobicContact CG2-CE2 4.36Å; Y414-F433 AromaticContact CD1-CZ 3.93Å; Y414-F433 HydrophobicContact CD1-CZ 3.93Å; Y414-F433 HydrophobicContact CD2-CZ 4.37Å; Y414-F433 AromaticContact CE1-CE1 3.84Å; Y414-F433 HydrophobicContact CE1-CE1 3.84Å; Y414-F433 AromaticContact CE1-CZ 3.59Å; Y414-F433 HydrophobicContact CE1-CZ 3.59Å; Y414-F433 HydrophobicContact CE2-CZ 4.1Å; Y414-F433 HydrophobicContact CG-CZ 4.33Å; Y414-F433 AromaticContact CZ-CE1 3.83Å; Y414-F433 AromaticContact CZ-CZ 3.7Å; I424-F433 HydrophobicContact CG2-CB 4.23Å; I424-F433 HydrophobicContact CG2-CD2 3.78Å; I424-F433 HydrophobicContact CG2-CG 4.28Å; V425-F433 CarbonylContact O-C 3.55Å; V425-F433 WeakPolarHBondContact O-CA 3.5Å; F426-F433 HydrophobicContact CD1-CB 4.12Å; F426-F433 HydrophobicContact CE1-CB 4.35Å; F426-F433 HydrophobicContact CG-CB 4.37Å; F433-V444 WeakPolarHBondContact O-CA 3.44Å; F433-W445 HydrophobicContact CD1-CB 4.19Å; F433-W445 HydrophobicContact CD2-CB 4.35Å; F433-W445 AromaticContact CD2-CD1 3.6Å; F433-W445 HydrophobicContact CD2-CG 4.26Å; F433-W445 HydrophobicContact CE1-CB 3.76Å; F433-W445 HydrophobicContact CE1-CG 4.34Å; F433-W445 HydrophobicContact CE2-CB 3.96Å; F433-W445 AromaticContact CE2-CD1 3.2Å; F433-W445 AromaticContact CE2-CG 3.67Å; F433-W445 HydrophobicContact CE2-CG 3.67Å; F433-W445 AromaticContact CE2-NE1 3.83Å; F433-W445 HydrophobicContact CG-CB 4.47Å; F433-W445 HydrophobicContact CZ-CB 3.64Å; F433-W445 AromaticContact CZ-CD1 3.75Å; F433-W445 AromaticContact CZ-CG 3.71Å; F433-W445 HydrophobicContact CZ-CG 3.71Å; F433-W445 PolarHBondContact N-O 3.36Å; F433-W445 VanDerWaalsContact N-O 3.09Å; F433-W445 PolarHBondContact O-N 3.09Å; F433-W447 HydrophobicContact CD1-CE3 4.09Å; F433-W447 HydrophobicContact CE1-CE3 4.17Å
434	V	95.5	Very high	93	Very high	2 Å²	2	34 Å²	34	1%	0.012	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	138	169.4	178.1	0	0	0	0	107.6	I424 V425 V427 L442 V444 L476 F494	I424-V434 WeakPolarHBondContact CA-O 3.44Å; V425-V434 PolarHBondContact N-O 3.22Å; V425-V434 PolarHBondContact O-N 3.41Å; V427-V434 HydrophobicContact CG2-CB 4.3Å; V427-V434 HydrophobicContact CG2-CG2 3.66Å; V434-L442 HydrophobicContact CG1-CB 4.47Å; V434-L442 HydrophobicContact CG1-CD2 4.38Å; V434-V444 HydrophobicContact CG2-CB 4.41Å; V434-V444 HydrophobicContact CG2-CG1 3.79Å; V434-V444 HydrophobicContact CG2-CG2 4.02Å; V434-L476 HydrophobicContact CG2-CD1 3.78Å; V434-F494 HydrophobicContact CG2-CD1 4.14Å; V434-F494 HydrophobicContact CG2-CE1 3.67Å
435	S	95.6	Very high	92.9	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	149.3	174.6	61.9	0	0	0	0	110.2	I400 H417 T423 R443 W445	I400-S435 VanDerWaalsContact CD1-CB 3.43Å; H417-S435 PolarHBondContact CE1-OG 3.4Å; H417-S435 VanDerWaalsContact CE1-OG 3.31Å; H417-S435 PolarHBondContact NE2-OG 3.08Å; T423-S435 WeakPolarHBondContact O-CA 3.42Å; S435-R443 PolarHBondContact N-O 2.88Å; S435-R443 PolarHBondContact O-N 2.99Å; S435-R443 PolarHBondContact OG-O 3.37Å; S435-R443 VanDerWaalsContact OG-O 3.08Å; S435-W445 PolarHBondContact OG-NE1 3.11Å
436	T	95.3	Very high	92.9	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.006	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	155.5	178.1	77.1	0	0	0	0	110.9	V421 N422 T423 L442 M464 V467	V421-T436 CarbonylContact C-O 3.59Å; V421-T436 WeakPolarHBondContact CA-O 3.45Å; V421-T436 WeakPolarHBondContact CG1-O 3.45Å; N422-T436 PolarHBondContact N-O 3.49Å; T423-T436 HydrophobicContact CG2-CG2 3.94Å; T423-T436 VanDerWaalsContact CG2-OG1 3.28Å; T423-T436 WeakPolarHBondContact CG2-OG1 3.41Å; T423-T436 PolarHBondContact N-OG1 2.88Å; T423-T436 PolarHBondContact O-N 3.32Å; T436-L442 HydrophobicContact CG2-CD2 3.26Å; T436-M464 VanDerWaalsContact CB-O 3.31Å; T436-M464 WeakPolarHBondContact CB-O 3.34Å; T436-M464 HydrophobicContact CG2-CB 4.3Å; T436-M464 PolarHBondContact OG1-O 2.88Å; T436-V467 HydrophobicContact CG2-CB 4.43Å; T436-V467 HydrophobicContact CG2-CG2 3.31Å
437	S	94.8	Very high	92.8	Very high	0 Å²	0	36 Å²	36	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	161.2	-173.3	38.8	0	0	0	0	111.8	H417 A420 D439 K440 S441	H417-S437 PolarHBondContact CE1-OG 3.23Å; H417-S437 PolarHBondContact ND1-OG 3.35Å; A420-S437 CarbonylContact O-C 3.51Å; A420-S437 WeakPolarHBondContact O-CA 3.16Å; A420-S437 WeakPolarHBondContact O-CB 3.32Å; S437-D439 WeakPolarHBondContact CB-OD1 3.25Å; S437-D439 PolarHBondContact O-N 3.33Å; S437-D439 VanDerWaalsContact O-N 3.16Å; S437-D439 PolarHBondContact OG-OD1 3.13Å; S437-K440 PolarHBondContact O-N 2.97Å; S437-K440 VanDerWaalsContact O-N 3.07Å; S437-S441 PolarHBondContact OG-OG 3.02Å
438	D	93.6	Very high	92.8	Very high	81 Å²	81	39.7 Å²	39.7	43%	0.433	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-11.7	178	-79.4	-25.9	0	0	0	114.4	A420 N422 K440 S463	A420-D438 PolarHBondContact O-N 3.02Å; N422-D438 PolarHBondContact ND2-OD1 3.39Å; D438-K440 PolarHBondContact O-N 2.85Å; D438-K440 VanDerWaalsContact O-N 3.13Å; D438-S463 PolarHBondContact OD1-OG 3.12Å
439	D	92.4	Very high	93.1	Very high	35 Å²	35	41.4 Å²	41.4	19%	0.187	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	6.5	168.3	73.6	2	0	0	0	113.9	L418 S437 S441 R443	L418-D439 HydrophobicContact CB-CB 3.84Å; L418-D439 WeakPolarHBondContact CB-OD2 3.11Å; L418-D439 PolarHBondContact N-OD2 3Å; S437-D439 WeakPolarHBondContact CB-OD1 3.25Å; S437-D439 PolarHBondContact O-N 3.33Å; S437-D439 VanDerWaalsContact O-N 3.16Å; S437-D439 PolarHBondContact OG-OD1 3.13Å; D439-S441 PolarHBondContact O-N 2.87Å; D439-S441 WeakPolarHBondContact OD1-CB 3.28Å; D439-S441 PolarHBondContact OD1-N 3.46Å; D439-S441 VanDerWaalsContact OD1-N 3.14Å; D439-S441 PolarHBondContact OD1-OG 3.21Å; D439-S441 PolarHBondContact OD2-OG 2.82Å; D439-R443 IonicContact OD1-NH1 3.75Å; D439-R443 IonicContact OD2-CZ 2.67Å; D439-R443 IonicContact OD2-NH1 3.86Å; D439-R443 PolarHBondContact OD2-NH1 3.43Å; D439-R443 IonicContact OD2-NH2 2.65Å
440	K	93.5	Very high	93.6	Very high	98 Å²	98	34.9 Å²	34.9	43%	0.426	17%	0.166	S	C	.	.	S	Bend	trans	68.9	14.2	176.1	-44	172.8	-178	-176.9	0	114.3	S437 D438 M461	S437-K440 PolarHBondContact O-N 2.97Å; S437-K440 VanDerWaalsContact O-N 3.07Å; D438-K440 PolarHBondContact O-N 2.85Å; D438-K440 VanDerWaalsContact O-N 3.13Å; K440-M461 WeakPolarHBondContact CD-O 3.34Å
441	S	93.7	Very high	93.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.175	C	C	.	.			trans	-99.8	157.6	179.8	74.3	0	0	0	0	113.5	S437 D439 R443 Y455 I456	S437-S441 PolarHBondContact OG-OG 3.02Å; D439-S441 PolarHBondContact O-N 2.87Å; D439-S441 WeakPolarHBondContact OD1-CB 3.28Å; D439-S441 PolarHBondContact OD1-N 3.46Å; D439-S441 VanDerWaalsContact OD1-N 3.14Å; D439-S441 PolarHBondContact OD1-OG 3.21Å; D439-S441 PolarHBondContact OD2-OG 2.82Å; S441-R443 PolarHBondContact OG-NH1 3.09Å; S441-Y455 VanDerWaalsContact CB-CE2 3.49Å; S441-I456 CarbonylContact C-O 3.57Å; S441-I456 VanDerWaalsContact CA-O 3.28Å; S441-I456 WeakPolarHBondContact CA-O 3.15Å
442	L	94.3	Very high	94.1	Very high	3 Å²	3	30.7 Å²	30.7	2%	0.016	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	128.6	156.4	-56	177.8	0	0	0	107.9	V434 T436 I456 M461 M464 F488	V434-L442 HydrophobicContact CG1-CB 4.47Å; V434-L442 HydrophobicContact CG1-CD2 4.38Å; T436-L442 HydrophobicContact CG2-CD2 3.26Å; L442-I456 HydrophobicContact CB-CB 4.25Å; L442-I456 HydrophobicContact CB-CD1 4.4Å; L442-I456 PolarHBondContact N-O 3.41Å; L442-I456 PolarHBondContact O-N 2.89Å; L442-M461 HydrophobicContact CG-CE 4.46Å; L442-M464 HydrophobicContact CD1-SD 4.32Å; L442-M464 HydrophobicContact CD2-CE 3.51Å; L442-M464 HydrophobicContact CD2-SD 3.76Å; L442-M464 HydrophobicContact CG-CE 3.71Å; L442-M464 HydrophobicContact CG-SD 4.07Å; L442-F488 HydrophobicContact CD1-CD1 3.99Å; L442-F488 HydrophobicContact CD1-CD2 3.75Å; L442-F488 HydrophobicContact CD1-CE1 3.83Å; L442-F488 HydrophobicContact CD1-CE2 3.57Å; L442-F488 HydrophobicContact CD1-CG 3.95Å; L442-F488 HydrophobicContact CD1-CZ 3.61Å
443	R	95.1	Very high	93.9	Very high	13 Å²	13	33 Å²	33	5%	0.049	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	129.9	167	-70.1	-173.9	173.7	80.5	-2.4	109.6	R416 H417 S435 D439 S441 W445 D452 Y455	R416-R443 PolarHBondContact O-NE 3.41Å; R416-R443 PolarHBondContact O-NH2 3.06Å; H417-R443 WeakPolarHBondContact ND1-CD 3.3Å; H417-R443 PolarHBondContact ND1-NH1 2.69Å; S435-R443 PolarHBondContact N-O 2.88Å; S435-R443 PolarHBondContact O-N 2.99Å; S435-R443 PolarHBondContact OG-O 3.37Å; S435-R443 VanDerWaalsContact OG-O 3.08Å; D439-R443 IonicContact OD1-NH1 3.75Å; D439-R443 IonicContact OD2-CZ 2.67Å; D439-R443 IonicContact OD2-NH1 3.86Å; D439-R443 PolarHBondContact OD2-NH1 3.43Å; D439-R443 IonicContact OD2-NH2 2.65Å; S441-R443 PolarHBondContact OG-NH1 3.09Å; R443-W445 HydrophobicContact CB-CZ2 3.93Å; R443-W445 HydrophobicContact CG-CZ2 4.5Å; R443-D452 HydrophobicContact CB-CB 4.1Å; R443-D452 VanDerWaalsContact CD-OD2 3.25Å; R443-D452 WeakPolarHBondContact CD-OD2 3.17Å; R443-D452 HydrophobicContact CG-CB 4.28Å; R443-D452 IonicContact NE-OD2 3.79Å; R443-D452 PolarHBondContact NE-OD2 3.5Å; R443-Y455 HydrophobicContact CG-CD2 4.01Å
444	V	95.1	Very high	93.8	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129.6	173.3	-155	0	0	0	0	109.1	F433 V434 D452 F453 K454 F494	F433-V444 WeakPolarHBondContact O-CA 3.44Å; V434-V444 HydrophobicContact CG2-CB 4.41Å; V434-V444 HydrophobicContact CG2-CG1 3.79Å; V434-V444 HydrophobicContact CG2-CG2 4.02Å; V444-D452 WeakPolarHBondContact O-CA 3.03Å; V444-F453 HydrophobicContact CB-CD1 4.32Å; V444-F453 HydrophobicContact CB-CE1 3.61Å; V444-F453 HydrophobicContact CB-CZ 3.79Å; V444-F453 HydrophobicContact CG1-CD1 4.48Å; V444-F453 HydrophobicContact CG1-CE1 3.42Å; V444-F453 VanDerWaalsContact CG1-CE1 3.42Å; V444-F453 HydrophobicContact CG1-CZ 3.63Å; V444-F453 VanDerWaalsContact O-CD1 3.28Å; V444-F453 WeakPolarHBondContact O-CD1 3.41Å; V444-F453 PolarHBondContact O-N 2.9Å; V444-F453 VanDerWaalsContact O-N 3.13Å; V444-K454 HydrophobicContact CB-CB 4.07Å; V444-K454 HydrophobicContact CG2-CB 3.95Å; V444-K454 HydrophobicContact CG2-CG 4.26Å; V444-K454 PolarHBondContact N-O 2.83Å; V444-K454 PolarHBondContact O-N 2.9Å; V444-F494 HydrophobicContact CG1-CE1 3.92Å; V444-F494 HydrophobicContact CG1-CE2 4.08Å; V444-F494 HydrophobicContact CG1-CZ 3.7Å; V444-F494 HydrophobicContact CG2-CB 4.44Å; V444-F494 HydrophobicContact CG2-CD1 3.84Å; V444-F494 HydrophobicContact CG2-CD2 4.17Å; V444-F494 HydrophobicContact CG2-CE1 4.09Å; V444-F494 HydrophobicContact CG2-CE2 4.45Å; V444-F494 HydrophobicContact CG2-CG 3.88Å; V444-F494 HydrophobicContact CG2-CZ 4.4Å
445	W	95.1	Very high	93.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	149.6	-175.2	-47.5	87.9	0	0	0	109.2	I400 Y414 R416 H417 R432 F433 S435 R443 D452	I400-W445 HydrophobicContact CD1-CZ2 4.38Å; Y414-W445 HydrophobicContact CD1-CB 4.44Å; Y414-W445 AromaticContact CD1-CD2 3.89Å; Y414-W445 HydrophobicContact CD1-CD2 3.89Å; Y414-W445 AromaticContact CD1-CE3 3.58Å; Y414-W445 HydrophobicContact CD1-CE3 3.58Å; Y414-W445 HydrophobicContact CD1-CG 4.29Å; Y414-W445 HydrophobicContact CD1-CZ3 4.02Å; Y414-W445 HydrophobicContact CE1-CB 4.37Å; Y414-W445 HydrophobicContact CE1-CE3 4.48Å; Y414-W445 HydrophobicContact CG-CE3 4.35Å; Y414-W445 HydrophobicContact CG-CZ3 4.44Å; R416-W445 HydrophobicContact CB-CH2 3.6Å; R416-W445 HydrophobicContact CB-CZ3 4.24Å; R416-W445 HydrophobicContact CG-CH2 3.81Å; R416-W445 HydrophobicContact CG-CZ3 3.95Å; H417-W445 AromaticContact CD2-CZ2 3.95Å; H417-W445 AromaticContact NE2-CZ2 3.84Å; R432-W445 VanDerWaalsContact CA-O 3.23Å; R432-W445 WeakPolarHBondContact CA-O 3.43Å; R432-W445 VanDerWaalsContact CB-O 3.27Å; R432-W445 WeakPolarHBondContact CB-O 3.42Å; R432-W445 WeakPolarHBondContact CG-O 3.4Å; F433-W445 HydrophobicContact CD1-CB 4.19Å; F433-W445 HydrophobicContact CD2-CB 4.35Å; F433-W445 AromaticContact CD2-CD1 3.6Å; F433-W445 HydrophobicContact CD2-CG 4.26Å; F433-W445 HydrophobicContact CE1-CB 3.76Å; F433-W445 HydrophobicContact CE1-CG 4.34Å; F433-W445 HydrophobicContact CE2-CB 3.96Å; F433-W445 AromaticContact CE2-CD1 3.2Å; F433-W445 AromaticContact CE2-CG 3.67Å; F433-W445 HydrophobicContact CE2-CG 3.67Å; F433-W445 AromaticContact CE2-NE1 3.83Å; F433-W445 HydrophobicContact CG-CB 4.47Å; F433-W445 HydrophobicContact CZ-CB 3.64Å; F433-W445 AromaticContact CZ-CD1 3.75Å; F433-W445 AromaticContact CZ-CG 3.71Å; F433-W445 HydrophobicContact CZ-CG 3.71Å; F433-W445 PolarHBondContact N-O 3.36Å; F433-W445 VanDerWaalsContact N-O 3.09Å; F433-W445 PolarHBondContact O-N 3.09Å; S435-W445 PolarHBondContact OG-NE1 3.11Å; R443-W445 HydrophobicContact CB-CZ2 3.93Å; R443-W445 HydrophobicContact CG-CZ2 4.5Å; W445-D452 HydrophobicContact CD2-CB 4.04Å; W445-D452 HydrophobicContact CE3-CB 3.75Å; W445-D452 VanDerWaalsContact CE3-N 3.31Å; W445-D452 HydrophobicContact CH2-CB 4.14Å; W445-D452 HydrophobicContact CZ2-CB 4.35Å; W445-D452 HydrophobicContact CZ3-CB 3.8Å
446	E	94	Very high	93.6	Very high	36 Å²	36	43.1 Å²	43.1	17%	0.168	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	145.8	158.2	-53.9	-136.5	151	0	0	108	R431 R432 I449 F453	R431-E446 IonicContact CZ-OE2 2.73Å; R431-E446 IonicContact NE-OE2 3.05Å; R431-E446 IonicContact NH2-OE1 3.28Å; R431-E446 PolarHBondContact NH2-OE1 3.43Å; R431-E446 IonicContact NH2-OE2 2.67Å; R431-E446 PolarHBondContact NH2-OE2 3.09Å; R432-E446 HydrophobicContact CG-CG 4.3Å; R432-E446 IonicContact CZ-OE1 3.75Å; R432-E446 IonicContact NE-OE1 2.81Å; R432-E446 PolarHBondContact NE-OE1 3.12Å; R432-E446 IonicContact NH2-OE1 3.73Å; R432-E446 PolarHBondContact NH2-OE1 3.33Å; E446-I449 HydrophobicContact CB-CB 4.36Å; E446-I449 HydrophobicContact CB-CD1 4.11Å; E446-I449 PolarHBondContact O-N 3.23Å; E446-F453 HydrophobicContact CG-CD1 3.97Å; E446-F453 HydrophobicContact CG-CE1 4.46Å
447	W	93.5	Very high	93.5	Very high	33 Å²	33	45.1 Å²	45.1	13%	0.125	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	140.9	176.9	-177.9	-98.6	0	0	0	111.1	N382 L390 V392 Q402 F426 R431 F433 I449	N382-W447 HydrophobicContact CB-CH2 3.99Å; N382-W447 HydrophobicContact CB-CZ2 4.16Å; N382-W447 VanDerWaalsContact ND2-CZ2 3.26Å; N382-W447 WeakPolarHBondContact ND2-CZ2 3.25Å; L390-W447 HydrophobicContact CB-CH2 4.15Å; L390-W447 HydrophobicContact CB-CZ2 3.69Å; L390-W447 HydrophobicContact CD1-CZ2 3.79Å; L390-W447 HydrophobicContact CG-CZ2 4.37Å; V392-W447 HydrophobicContact CB-CZ3 4.34Å; Q402-W447 HydrophobicContact CG-CH2 4.08Å; Q402-W447 HydrophobicContact CG-CZ2 4.24Å; F426-W447 AromaticContact CE1-CE3 3.6Å; F426-W447 HydrophobicContact CE1-CE3 3.6Å; F426-W447 AromaticContact CE1-CZ3 3.68Å; F426-W447 HydrophobicContact CE1-CZ3 3.68Å; F426-W447 AromaticContact CZ-CE3 3.96Å; F426-W447 HydrophobicContact CZ-CE3 3.96Å; F426-W447 HydrophobicContact CZ-CH2 4.35Å; F426-W447 AromaticContact CZ-CZ3 3.51Å; F426-W447 HydrophobicContact CZ-CZ3 3.51Å; R431-W447 WeakPolarHBondContact O-CB 3.43Å; R431-W447 PolarHBondContact O-N 3.28Å; F433-W447 HydrophobicContact CD1-CE3 4.09Å; F433-W447 HydrophobicContact CE1-CE3 4.17Å; W447-I449 PolarHBondContact O-N 3.16Å; W447-I449 VanDerWaalsContact O-N 3.11Å
448	D	91.8	Very high	93.2	Very high	81 Å²	81	50.1 Å²	50.1	43%	0.433	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	-4.8	-179.1	-130.9	38.1	0	0	0	115.9	Q402 Y414	Q402-D448 PolarHBondContact NE2-OD1 2.75Å; Y414-D448 WeakPolarHBondContact OH-CA 3.43Å; Y414-D448 PolarHBondContact OH-N 2.85Å
449	I	93.6	Very high	93.1	Very high	82 Å²	82	53 Å²	53	42%	0.421	27%	0.273	S	S	.	.			trans	-107.2	113.8	-175.4	-61.7	177.5	0	0	0	110.5	Y414 E446 W447 V451	Y414-I449 WeakPolarHBondContact CD1-O 3.29Å; Y414-I449 VanDerWaalsContact CE1-O 3.24Å; Y414-I449 WeakPolarHBondContact CE1-O 3.39Å; E446-I449 HydrophobicContact CB-CB 4.36Å; E446-I449 HydrophobicContact CB-CD1 4.11Å; E446-I449 PolarHBondContact O-N 3.23Å; W447-I449 PolarHBondContact O-N 3.16Å; W447-I449 VanDerWaalsContact O-N 3.11Å; I449-V451 HydrophobicContact CG2-CB 4.35Å; I449-V451 PolarHBondContact O-N 2.99Å
450	P	93.9	Very high	92.9	Very high	47 Å²	47	55.5 Å²	55.5	31%	0.305	29%	0.293	S	S	.	.			trans	-75.1	18.6	-173.3	32.5	-38.8	0	0	0	115.4	Q412 E413	Q412-P450 HydrophobicContact CG-CB 4.39Å; E413-P450 VanDerWaalsContact O-CB 3.3Å; E413-P450 WeakPolarHBondContact O-CB 3.13Å
451	V	94	Very high	92.7	Very high	71 Å²	71	51.2 Å²	51.2	43%	0.43	28%	0.275	S	S	.	.	S	Bend	trans	-119.8	125.9	-179.4	-178.4	0	0	0	0	108.9	I449 F453	I449-V451 HydrophobicContact CG2-CB 4.35Å; I449-V451 PolarHBondContact O-N 2.99Å; V451-F453 PolarHBondContact O-N 3Å
452	D	93.3	Very high	92.6	Very high	28 Å²	28	54.9 Å²	54.9	15%	0.15	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	112.9	176.2	53.7	-37.8	0	0	0	110.1	R416 R443 V444 W445 K454	R416-D452 WeakPolarHBondContact CG-OD1 3.37Å; R443-D452 HydrophobicContact CB-CB 4.1Å; R443-D452 VanDerWaalsContact CD-OD2 3.25Å; R443-D452 WeakPolarHBondContact CD-OD2 3.17Å; R443-D452 HydrophobicContact CG-CB 4.28Å; R443-D452 IonicContact NE-OD2 3.79Å; R443-D452 PolarHBondContact NE-OD2 3.5Å; V444-D452 WeakPolarHBondContact O-CA 3.03Å; W445-D452 HydrophobicContact CD2-CB 4.04Å; W445-D452 HydrophobicContact CE3-CB 3.75Å; W445-D452 VanDerWaalsContact CE3-N 3.31Å; W445-D452 HydrophobicContact CH2-CB 4.14Å; W445-D452 HydrophobicContact CZ2-CB 4.35Å; W445-D452 HydrophobicContact CZ3-CB 3.8Å; D452-K454 PolarHBondContact O-N 3.27Å
453	F	88.8	Confident	92.5	Very high	83 Å²	83	55.4 Å²	55.4	36%	0.364	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	-22.5	177	81.6	-92.7	0	0	0	111.7	R432 V444 E446 V451 F494	R432-F453 HydrophobicContact CG-CE1 4.11Å; V444-F453 HydrophobicContact CB-CD1 4.32Å; V444-F453 HydrophobicContact CB-CE1 3.61Å; V444-F453 HydrophobicContact CB-CZ 3.79Å; V444-F453 HydrophobicContact CG1-CD1 4.48Å; V444-F453 HydrophobicContact CG1-CE1 3.42Å; V444-F453 VanDerWaalsContact CG1-CE1 3.42Å; V444-F453 HydrophobicContact CG1-CZ 3.63Å; V444-F453 VanDerWaalsContact O-CD1 3.28Å; V444-F453 WeakPolarHBondContact O-CD1 3.41Å; V444-F453 PolarHBondContact O-N 2.9Å; V444-F453 VanDerWaalsContact O-N 3.13Å; E446-F453 HydrophobicContact CG-CD1 3.97Å; E446-F453 HydrophobicContact CG-CE1 4.46Å; V451-F453 PolarHBondContact O-N 3Å; F453-F494 HydrophobicContact CE2-CD2 4.48Å; F453-F494 HydrophobicContact CE2-CE2 4.29Å; F453-F494 HydrophobicContact CZ-CD2 4.26Å; F453-F494 AromaticContact CZ-CE2 3.73Å; F453-F494 HydrophobicContact CZ-CE2 3.73Å; F453-F494 HydrophobicContact CZ-CZ 4.45Å
454	K	92.7	Very high	92.4	Very high	83 Å²	83	54.8 Å²	54.8	36%	0.361	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	108.4	180	-171.9	57.8	176.4	161.7	0	112.7	V444 D452 I456 F494	V444-K454 HydrophobicContact CB-CB 4.07Å; V444-K454 HydrophobicContact CG2-CB 3.95Å; V444-K454 HydrophobicContact CG2-CG 4.26Å; V444-K454 PolarHBondContact N-O 2.83Å; V444-K454 PolarHBondContact O-N 2.9Å; D452-K454 PolarHBondContact O-N 3.27Å; K454-I456 HydrophobicContact CG-CD1 4.31Å; K454-I456 HydrophobicContact CG-CG1 4.19Å; K454-F494 HydrophobicContact CG-CB 4.33Å
455	Y	93.6	Very high	92.3	Very high	109 Å²	109	55.3 Å²	55.3	43%	0.427	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	135.8	166	-179.8	-111.7	0	0	0	111.1	S441 R443 A457	S441-Y455 VanDerWaalsContact CB-CE2 3.49Å; R443-Y455 HydrophobicContact CG-CD2 4.01Å; Y455-A457 HydrophobicContact CE1-CB 3.81Å; Y455-A457 HydrophobicContact CE2-CB 4.21Å; Y455-A457 VanDerWaalsContact OH-CB 3.3Å; Y455-A457 WeakPolarHBondContact OH-CB 3.4Å
456	I	93.7	Very high	92.3	Very high	22 Å²	22	55.9 Å²	55.9	11%	0.113	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	111.8	173.2	-57.4	159.7	0	0	0	108.4	S441 L442 K454 M461 F488 F494	S441-I456 CarbonylContact C-O 3.57Å; S441-I456 VanDerWaalsContact CA-O 3.28Å; S441-I456 WeakPolarHBondContact CA-O 3.15Å; L442-I456 HydrophobicContact CB-CB 4.25Å; L442-I456 HydrophobicContact CB-CD1 4.4Å; L442-I456 PolarHBondContact N-O 3.41Å; L442-I456 PolarHBondContact O-N 2.89Å; K454-I456 HydrophobicContact CG-CD1 4.31Å; K454-I456 HydrophobicContact CG-CG1 4.19Å; I456-M461 HydrophobicContact CG2-CE 4.24Å; I456-M461 HydrophobicContact CG2-SD 4.13Å; I456-F488 HydrophobicContact CD1-CD1 4.45Å; I456-F488 HydrophobicContact CG2-CE1 4.1Å; I456-F494 HydrophobicContact CD1-CB 3.62Å; I456-F494 WeakPolarHBondContact CD1-O 3.44Å
457	A	93.1	Very high	92.3	Very high	42 Å²	42	54.5 Å²	54.5	35%	0.347	30%	0.296	S	S	.	.			trans	-143.9	127	165.1	0	0	0	0	0	108.4	Y455	Y455-A457 HydrophobicContact CE1-CB 3.81Å; Y455-A457 HydrophobicContact CE2-CB 4.21Å; Y455-A457 VanDerWaalsContact OH-CB 3.3Å; Y455-A457 WeakPolarHBondContact OH-CB 3.4Å
458	E	88.9	Confident	92.4	Very high	105 Å²	105	54 Å²	54	49%	0.491	30%	0.296	S	S	.	.			trans	-112.8	144.9	166.7	-63.4	-173.1	176.7	0	0	108.2	S460 M461	E458-S460 PolarHBondContact O-N 2.9Å; E458-M461 HydrophobicContact CB-CG 4.08Å; E458-M461 HydrophobicContact CB-SD 4.02Å; E458-M461 HydrophobicContact CG-SD 4.19Å; E458-M461 WeakPolarHBondContact O-CB 3.49Å; E458-M461 PolarHBondContact O-N 3.16Å
459	P	91	Very high	92.6	Very high	141 Å²	141	52.7 Å²	52.7	92%	0.916	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-21.4	178.1	-26.5	35.4	0	0	0	114.6
460	S	88.3	Confident	92.6	Very high	88 Å²	88	48.9 Å²	48.9	62%	0.615	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-20.2	174.2	179.4	0	0	0	0	114	E458 H462	E458-S460 PolarHBondContact O-N 2.9Å; S460-H462 PolarHBondContact O-ND1 2.8Å
461	M	89	Confident	92.4	Very high	8 Å²	8	50.1 Å²	50.1	4%	0.039	28%	0.277	C	S	.	.			trans	-75.1	151.5	-178	-72.1	170.7	58.4	0	0	110.8	K440 L442 I456 E458 M464 F488	K440-M461 WeakPolarHBondContact CD-O 3.34Å; L442-M461 HydrophobicContact CG-CE 4.46Å; I456-M461 HydrophobicContact CG2-CE 4.24Å; I456-M461 HydrophobicContact CG2-SD 4.13Å; E458-M461 HydrophobicContact CB-CG 4.08Å; E458-M461 HydrophobicContact CB-SD 4.02Å; E458-M461 HydrophobicContact CG-SD 4.19Å; E458-M461 WeakPolarHBondContact O-CB 3.49Å; E458-M461 PolarHBondContact O-N 3.16Å; M461-M464 HydrophobicContact CE-CE 3.41Å; M461-M464 VanDerWaalsContact CE-CE 3.41Å; M461-M464 HydrophobicContact CE-SD 3.94Å; M461-F488 HydrophobicContact CE-CZ 3.94Å; M461-F488 HydrophobicContact SD-CZ 4.47Å
462	H	92.2	Very high	92.2	Very high	78 Å²	78	50.6 Å²	50.6	36%	0.361	28%	0.277	S	S	.	.			trans	-116.1	172.5	174.6	-71.4	67	0	0	0	109.8	S460 M464 M481 D482	S460-H462 PolarHBondContact O-ND1 2.8Å; H462-M464 PolarHBondContact O-N 2.9Å; H462-M481 HydrophobicContact CB-CB 4.16Å; H462-D482 HydrophobicContact CB-CB 4.4Å
463	S	91.9	Very high	92.1	Very high	14 Å²	14	50.3 Å²	50.3	10%	0.098	28%	0.281	C	S	.	.			trans	-56.9	138	175	-176.6	0	0	0	0	109.6	N422 D438 P465 M481	N422-S463 PolarHBondContact ND2-OG 2.92Å; N422-S463 VanDerWaalsContact ND2-OG 3.13Å; D438-S463 PolarHBondContact OD1-OG 3.12Å; S463-P465 VanDerWaalsContact O-CD 3.29Å; S463-P465 WeakPolarHBondContact O-CD 3.2Å; S463-M481 WeakPolarHBondContact O-CG 3.12Å; S463-M481 PolarHBondContact O-N 3.02Å
464	M	93.4	Very high	92.2	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.286	C	S	.	.			trans	-112.4	87.2	179.9	-71.5	156.3	-70.2	0	0	109.2	T436 L442 M461 H462 A466 C478 Q479 F488	T436-M464 VanDerWaalsContact CB-O 3.31Å; T436-M464 WeakPolarHBondContact CB-O 3.34Å; T436-M464 HydrophobicContact CG2-CB 4.3Å; T436-M464 PolarHBondContact OG1-O 2.88Å; L442-M464 HydrophobicContact CD1-SD 4.32Å; L442-M464 HydrophobicContact CD2-CE 3.51Å; L442-M464 HydrophobicContact CD2-SD 3.76Å; L442-M464 HydrophobicContact CG-CE 3.71Å; L442-M464 HydrophobicContact CG-SD 4.07Å; M461-M464 HydrophobicContact CE-CE 3.41Å; M461-M464 VanDerWaalsContact CE-CE 3.41Å; M461-M464 HydrophobicContact CE-SD 3.94Å; H462-M464 PolarHBondContact O-N 2.9Å; M464-A466 VanDerWaalsContact C-N 3.29Å; M464-A466 PolarHBondContact O-N 3.12Å; M464-C478 HydrophobicContact CB-CB 4.34Å; M464-C478 HydrophobicContact CG-CB 4.04Å; M464-C478 HydrophobicContact SD-CB 3.79Å; M464-Q479 WeakPolarHBondContact CA-O 3.31Å; M464-Q479 WeakPolarHBondContact CB-O 3.4Å; M464-F488 HydrophobicContact SD-CE2 4.27Å
465	P	93.1	Very high	92.3	Very high	10 Å²	10	50.8 Å²	50.8	7%	0.065	28%	0.281	C	S	.	.			trans	-72.5	-21.1	-170.7	30.2	-39.3	0	0	0	113.7	S463 Q479 M481 Y510 A511	S463-P465 VanDerWaalsContact O-CD 3.29Å; S463-P465 WeakPolarHBondContact O-CD 3.2Å; P465-Q479 WeakPolarHBondContact CD-O 3.43Å; P465-M481 HydrophobicContact CB-CE 4.12Å; P465-M481 HydrophobicContact CG-CE 3.71Å; P465-M481 HydrophobicContact CG-CG 4.41Å; P465-M481 HydrophobicContact CG-SD 4.18Å; P465-Y510 WeakPolarHBondContact CG-O 3.48Å; P465-A511 HydrophobicContact CB-CB 3.66Å; P465-A511 HydrophobicContact CG-CB 4.24Å
466	A	93.8	Very high	92.4	Very high	12 Å²	12	45.6 Å²	45.6	10%	0.099	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	133	179.4	0	0	0	0	0	110.8	M464 Q479 C512	M464-A466 VanDerWaalsContact C-N 3.29Å; M464-A466 PolarHBondContact O-N 3.12Å; A466-Q479 HydrophobicContact CB-CB 4.32Å; A466-Q479 PolarHBondContact O-N 2.69Å; A466-C512 WeakPolarHBondContact CB-O 3.46Å
467	V	95.4	Very high	92.5	Very high	8 Å²	8	44.6 Å²	44.6	5%	0.048	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	140.8	176.4	-178.1	0	0	0	0	108.1	T423 V425 T436 L476 A477 C478	T423-V467 HydrophobicContact CG2-CB 3.87Å; T423-V467 HydrophobicContact CG2-CG2 3.79Å; V425-V467 HydrophobicContact CB-CG1 4.5Å; V425-V467 HydrophobicContact CG2-CB 3.93Å; V425-V467 HydrophobicContact CG2-CG1 3.96Å; V425-V467 VanDerWaalsContact CG2-O 3.24Å; V425-V467 WeakPolarHBondContact CG2-O 3.37Å; T436-V467 HydrophobicContact CG2-CB 4.43Å; T436-V467 HydrophobicContact CG2-CG2 3.31Å; V467-L476 HydrophobicContact CG1-CB 4.31Å; V467-L476 HydrophobicContact CG1-CD2 3.95Å; V467-A477 CarbonylContact C-O 3.57Å; V467-A477 VanDerWaalsContact CA-O 3.25Å; V467-A477 WeakPolarHBondContact CA-O 3.43Å; V467-C478 HydrophobicContact CG2-CB 3.99Å
468	T	95.1	Very high	92.5	Very high	21 Å²	21	42.6 Å²	42.6	13%	0.129	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	146.8	171.8	46.8	0	0	0	0	111.1	L476 A477 Q513 V514	T468-L476 CarbonylContact O-C 3.54Å; T468-L476 WeakPolarHBondContact O-CA 3.49Å; T468-A477 PolarHBondContact N-O 3.15Å; T468-A477 PolarHBondContact O-N 2.99Å; T468-Q513 HydrophobicContact CG2-CG 4.24Å; T468-V514 WeakPolarHBondContact CB-O 3.14Å; T468-V514 WeakPolarHBondContact CG2-O 3.39Å; T468-V514 PolarHBondContact OG1-O 2.84Å
469	L	95.3	Very high	92.8	Very high	55 Å²	55	37.6 Å²	37.6	29%	0.288	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	139.4	174.1	-172	70.8	0	0	0	109.1	V425 V427 L476 A490	V425-L469 HydrophobicContact CG1-CB 3.83Å; V427-L469 HydrophobicContact CG1-CD1 4.47Å; V427-L469 HydrophobicContact CG2-CD1 4.3Å; L469-L476 HydrophobicContact CB-CD2 4.35Å; L469-L476 HydrophobicContact CD1-CD2 3.76Å; L469-L476 HydrophobicContact CD1-CG 4.16Å; L469-A490 HydrophobicContact CD1-CB 4.04Å
470	S	94	Very high	92.9	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.014	17%	0.172	C	C	.	.			trans	-62.1	146.7	169.3	63.5	0	0	0	0	111.3	N472 G473 K474 W475	S470-N472 PolarHBondContact O-N 2.84Å; S470-G473 PolarHBondContact O-N 3.23Å; S470-G473 PolarHBondContact OG-N 3.38Å; S470-K474 PolarHBondContact OG-N 3.48Å; S470-K474 VanDerWaalsContact OG-N 3.12Å; S470-W475 WeakPolarHBondContact CB-O 3.36Å; S470-W475 PolarHBondContact N-O 2.66Å; S470-W475 PolarHBondContact OG-N 3.17Å; S470-W475 PolarHBondContact OG-O 3.17Å
471	P	90.8	Very high	93.2	Very high	72 Å²	72	28.9 Å²	28.9	47%	0.468	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-35.4	173.5	-29.5	34.2	0	0	0	113.9	G473 F516	P471-G473 VanDerWaalsContact C-N 3.26Å; P471-G473 PolarHBondContact O-N 2.92Å; P471-F516 HydrophobicContact CG-CB 4.36Å
472	N	89.4	Confident	93.3	Very high	81 Å²	81	30.5 Å²	30.5	43%	0.433	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	4.4	179	-66.6	-19.2	0	0	0	115.1	S470 K474 M520	S470-N472 PolarHBondContact O-N 2.84Å; N472-K474 HydrophobicContact CB-CD 4.48Å; N472-K474 PolarHBondContact O-N 3.27Å; N472-M520 HydrophobicContact CB-SD 3.9Å; N472-M520 PolarHBondContact ND2-SD 2.88Å
473	G	90.1	Very high	93.3	Very high	22 Å²	22	29.3 Å²	29.3	23%	0.227	16%	0.159	C	C	.	.	S	Bend	trans	62.2	5.8	-176.8	0	0	0	0	0	116.2	S470 P471 A490	S470-G473 PolarHBondContact O-N 3.23Å; S470-G473 PolarHBondContact OG-N 3.38Å; P471-G473 VanDerWaalsContact C-N 3.26Å; P471-G473 PolarHBondContact O-N 2.92Å; G473-A490 WeakPolarHBondContact O-CB 3.43Å
474	K	92.1	Very high	93.3	Very high	105 Å²	105	30.2 Å²	30.2	46%	0.457	16%	0.161	S	C	.	.	S	Bend	trans	-92.7	-27.8	-169.4	-82.9	170.9	-177.3	174.7	0	114.8	S470 N472 A490 Q491	S470-K474 PolarHBondContact OG-N 3.48Å; S470-K474 VanDerWaalsContact OG-N 3.12Å; N472-K474 HydrophobicContact CB-CD 4.48Å; N472-K474 PolarHBondContact O-N 3.27Å; K474-A490 WeakPolarHBondContact O-CB 3.47Å; K474-A490 PolarHBondContact O-N 2.85Å; K474-Q491 HydrophobicContact CG-CG 4.35Å
475	W	94.4	Very high	93.4	Very high	71 Å²	71	30.2 Å²	30.2	27%	0.269	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	145.1	-170.2	-55.9	99.6	0	0	0	111.2	S470 I487 F488 N497 M520 W537	S470-W475 WeakPolarHBondContact CB-O 3.36Å; S470-W475 PolarHBondContact N-O 2.66Å; S470-W475 PolarHBondContact OG-N 3.17Å; S470-W475 PolarHBondContact OG-O 3.17Å; W475-I487 HydrophobicContact CB-CG2 4.22Å; W475-I487 HydrophobicContact CD2-CG2 4.08Å; W475-I487 HydrophobicContact CE3-CG2 3.48Å; W475-I487 VanDerWaalsContact CE3-CG2 3.48Å; W475-I487 HydrophobicContact CG-CG2 4.41Å; W475-I487 HydrophobicContact CZ3-CG2 4.2Å; W475-F488 WeakPolarHBondContact CA-O 3.43Å; W475-N497 WeakPolarHBondContact CH2-ND2 3.46Å; W475-N497 HydrophobicContact CZ3-CB 3.98Å; W475-M520 HydrophobicContact CB-CE 4.48Å; W475-M520 HydrophobicContact CG-CE 4.37Å; W475-W537 HydrophobicContact CB-CH2 3.98Å; W475-W537 HydrophobicContact CB-CZ2 4.42Å; W475-W537 AromaticContact CD1-CZ2 3.6Å; W475-W537 HydrophobicContact CD2-CH2 4.08Å; W475-W537 HydrophobicContact CD2-CZ2 4.01Å; W475-W537 AromaticContact CE2-CZ2 3.98Å; W475-W537 AromaticContact CG-CH2 3.74Å; W475-W537 HydrophobicContact CG-CH2 3.74Å; W475-W537 AromaticContact CG-CZ2 3.75Å; W475-W537 HydrophobicContact CG-CZ2 3.75Å; W475-W537 AromaticContact NE1-CZ2 3.71Å
476	L	95.3	Very high	93.5	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122.9	170.2	-68.7	154.3	0	0	0	107.9	V425 V427 V434 V467 T468 L469 I487 F488 A490 F494	V425-L476 HydrophobicContact CG1-CD2 3.96Å; V427-L476 HydrophobicContact CG2-CD1 4.29Å; V427-L476 HydrophobicContact CG2-CD2 3.91Å; V434-L476 HydrophobicContact CG2-CD1 3.78Å; V467-L476 HydrophobicContact CG1-CB 4.31Å; V467-L476 HydrophobicContact CG1-CD2 3.95Å; T468-L476 CarbonylContact O-C 3.54Å; T468-L476 WeakPolarHBondContact O-CA 3.49Å; L469-L476 HydrophobicContact CB-CD2 4.35Å; L469-L476 HydrophobicContact CD1-CD2 3.76Å; L469-L476 HydrophobicContact CD1-CG 4.16Å; L476-I487 WeakPolarHBondContact O-CA 3.31Å; L476-F488 HydrophobicContact CB-CB 4.31Å; L476-F488 PolarHBondContact N-O 3.01Å; L476-F488 PolarHBondContact O-N 3.27Å; L476-A490 HydrophobicContact CD1-CB 4.17Å; L476-A490 HydrophobicContact CG-CB 4.12Å; L476-F494 HydrophobicContact CD1-CD1 4.11Å; L476-F494 HydrophobicContact CD1-CE1 4.07Å
477	A	95.6	Very high	93.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	111.2	166	0	0	0	0	0	108.8	V467 T468 I485 I487 V514 F516	V467-A477 CarbonylContact C-O 3.57Å; V467-A477 VanDerWaalsContact CA-O 3.25Å; V467-A477 WeakPolarHBondContact CA-O 3.43Å; T468-A477 PolarHBondContact N-O 3.15Å; T468-A477 PolarHBondContact O-N 2.99Å; A477-I485 HydrophobicContact CB-CG2 3.89Å; A477-I487 HydrophobicContact CB-CD1 3.88Å; A477-V514 HydrophobicContact CB-CB 4.39Å; A477-V514 HydrophobicContact CB-CG1 3.7Å; A477-F516 HydrophobicContact CB-CE2 3.58Å; A477-F516 HydrophobicContact CB-CZ 3.54Å
478	C	94.5	Very high	93.6	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	113.3	173.1	-56.5	0	0	0	0	108.4	M464 V467 S480 I485 L486 F488	M464-C478 HydrophobicContact CB-CB 4.34Å; M464-C478 HydrophobicContact CG-CB 4.04Å; M464-C478 HydrophobicContact SD-CB 3.79Å; V467-C478 HydrophobicContact CG2-CB 3.99Å; C478-S480 PolarHBondContact O-N 3.24Å; C478-I485 WeakPolarHBondContact O-CA 3.48Å; C478-L486 PolarHBondContact N-O 2.56Å; C478-L486 PolarHBondContact O-N 3.36Å; C478-F488 HydrophobicContact CB-CD2 4.27Å; C478-F488 HydrophobicContact CB-CE2 4.17Å; C478-F488 VanDerWaalsContact SG-CD2 3.6Å
479	Q	94.2	Very high	93.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	124	166.1	-174.4	-179.1	78	0	0	107.9	M464 P465 A466 V507 Y510 C512 V514 S525	M464-Q479 WeakPolarHBondContact CA-O 3.31Å; M464-Q479 WeakPolarHBondContact CB-O 3.4Å; P465-Q479 WeakPolarHBondContact CD-O 3.43Å; A466-Q479 HydrophobicContact CB-CB 4.32Å; A466-Q479 PolarHBondContact O-N 2.69Å; Q479-V507 HydrophobicContact CG-CG2 4.01Å; Q479-Y510 PolarHBondContact OE1-O 3.05Å; Q479-C512 PolarHBondContact NE2-O 3.49Å; Q479-C512 VanDerWaalsContact NE2-O 3.09Å; Q479-C512 PolarHBondContact OE1-O 2.99Å; Q479-C512 VanDerWaalsContact OE1-O 3.09Å; Q479-V514 HydrophobicContact CB-CG2 3.82Å; Q479-V514 HydrophobicContact CG-CG2 4.45Å; Q479-S525 PolarHBondContact NE2-OG 3.1Å
480	S	94	Very high	93.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	140	175.9	169.1	0	0	0	0	109.7	C478 D482 N483 Q484	C478-S480 PolarHBondContact O-N 3.24Å; S480-D482 WeakPolarHBondContact CB-OD1 3.2Å; S480-D482 PolarHBondContact O-N 3.07Å; S480-D482 PolarHBondContact OG-OD1 3.02Å; S480-N483 PolarHBondContact O-N 2.88Å; S480-Q484 WeakPolarHBondContact CB-O 3.37Å; S480-Q484 PolarHBondContact N-O 2.87Å
481	M	92.9	Very high	92.4	Very high	46 Å²	46	31.1 Å²	31.1	23%	0.227	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-10.9	-180	-73.7	-67.9	-163	0	0	114.2	H462 S463 P465 N483 G509	H462-M481 HydrophobicContact CB-CB 4.16Å; S463-M481 WeakPolarHBondContact O-CG 3.12Å; S463-M481 PolarHBondContact O-N 3.02Å; P465-M481 HydrophobicContact CB-CE 4.12Å; P465-M481 HydrophobicContact CG-CE 3.71Å; P465-M481 HydrophobicContact CG-CG 4.41Å; P465-M481 HydrophobicContact CG-SD 4.18Å; M481-N483 PolarHBondContact O-N 3.28Å; M481-G509 PolarHBondContact SD-N 2.89Å
482	D	91.3	Very high	91.6	Very high	42 Å²	42	33.4 Å²	33.4	23%	0.225	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	18.8	174.2	78.5	-34.8	0	0	0	114.3	H462 S480 Q484	H462-D482 HydrophobicContact CB-CB 4.4Å; S480-D482 WeakPolarHBondContact CB-OD1 3.2Å; S480-D482 PolarHBondContact O-N 3.07Å; S480-D482 PolarHBondContact OG-OD1 3.02Å; D482-Q484 WeakPolarHBondContact OD1-CB 3.34Å; D482-Q484 PolarHBondContact OD2-NE2 3.43Å
483	N	92.7	Very high	91.2	Very high	54 Å²	54	38.3 Å²	38.3	29%	0.289	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	65	34.3	-178.4	-57.4	-51.8	0	0	0	114	S480 M481 H505 M506 V507 A508	S480-N483 PolarHBondContact O-N 2.88Å; M481-N483 PolarHBondContact O-N 3.28Å; N483-H505 WeakPolarHBondContact CB-O 3.16Å; N483-H505 PolarHBondContact O-CE1 3.15Å; N483-M506 WeakPolarHBondContact OD1-CA 3.47Å; N483-V507 PolarHBondContact OD1-N 2.84Å; N483-A508 PolarHBondContact OD1-N 3.28Å; N483-A508 VanDerWaalsContact OD1-N 3.12Å
484	Q	92.9	Very high	91.1	Very high	32 Å²	32	37.5 Å²	37.5	15%	0.15	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	147.7	179.7	-49.2	-177.3	42	0	0	111.1	S480 D482 L486 I501 F502 K503	S480-Q484 WeakPolarHBondContact CB-O 3.37Å; S480-Q484 PolarHBondContact N-O 2.87Å; D482-Q484 WeakPolarHBondContact OD1-CB 3.34Å; D482-Q484 PolarHBondContact OD2-NE2 3.43Å; Q484-L486 HydrophobicContact CB-CD2 4.12Å; Q484-I501 HydrophobicContact CB-CG2 4.28Å; Q484-I501 VanDerWaalsContact OE1-CG2 3.22Å; Q484-F502 WeakPolarHBondContact CA-O 3.28Å; Q484-K503 VanDerWaalsContact CD-CE 3.45Å; Q484-K503 HydrophobicContact CG-CD 4.09Å; Q484-K503 HydrophobicContact CG-CG 4.08Å
485	I	95.5	Very high	90.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	117.9	163.8	-57.5	161.1	0	0	0	106.9	A477 C478 I487 F502 V514 V523 W535	A477-I485 HydrophobicContact CB-CG2 3.89Å; C478-I485 WeakPolarHBondContact O-CA 3.48Å; I485-I487 HydrophobicContact CG2-CD1 4.1Å; I485-F502 HydrophobicContact CB-CB 4.11Å; I485-F502 HydrophobicContact CB-CD2 4.09Å; I485-F502 HydrophobicContact CD1-CB 4.31Å; I485-F502 HydrophobicContact CG2-CD2 4.24Å; I485-F502 PolarHBondContact N-O 3.25Å; I485-F502 PolarHBondContact O-N 2.98Å; I485-V514 HydrophobicContact CD1-CG1 3.95Å; I485-V514 HydrophobicContact CD1-CG2 3.79Å; I485-V514 HydrophobicContact CG1-CG2 3.9Å; I485-V514 HydrophobicContact CG2-CG1 4.24Å; I485-V514 HydrophobicContact CG2-CG2 4.5Å; I485-V523 HydrophobicContact CD1-CG1 4.13Å; I485-W535 HydrophobicContact CD1-CE3 4.15Å; I485-W535 HydrophobicContact CD1-CH2 3.93Å; I485-W535 HydrophobicContact CD1-CZ3 3.6Å
486	L	95	Very high	90.8	Very high	12 Å²	12	39.6 Å²	39.6	6%	0.063	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	130.1	179.2	-55.6	-176.6	0	0	0	109.3	C478 Q484 F488 L496 I501	C478-L486 PolarHBondContact N-O 2.56Å; C478-L486 PolarHBondContact O-N 3.36Å; Q484-L486 HydrophobicContact CB-CD2 4.12Å; L486-F488 HydrophobicContact CB-CE2 3.86Å; L486-L496 HydrophobicContact CB-CD1 3.98Å; L486-L496 HydrophobicContact CD1-CD1 4.05Å; L486-L496 HydrophobicContact CD2-CD1 4.24Å; L486-L496 HydrophobicContact CG-CD1 4.31Å; L486-I501 HydrophobicContact CD2-CG2 4.4Å
487	I	95.9	Very high	90.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	122	179.9	-62.2	-49.5	0	0	0	110.8	W475 L476 A477 I485 L496 N497 K500 F502 F516 W537	W475-I487 HydrophobicContact CB-CG2 4.22Å; W475-I487 HydrophobicContact CD2-CG2 4.08Å; W475-I487 HydrophobicContact CE3-CG2 3.48Å; W475-I487 VanDerWaalsContact CE3-CG2 3.48Å; W475-I487 HydrophobicContact CG-CG2 4.41Å; W475-I487 HydrophobicContact CZ3-CG2 4.2Å; L476-I487 WeakPolarHBondContact O-CA 3.31Å; A477-I487 HydrophobicContact CB-CD1 3.88Å; I485-I487 HydrophobicContact CG2-CD1 4.1Å; I487-L496 CarbonylContact O-C 3.59Å; I487-L496 WeakPolarHBondContact O-CA 3.44Å; I487-N497 HydrophobicContact CG2-CB 4.34Å; I487-N497 PolarHBondContact O-N 3.35Å; I487-K500 HydrophobicContact CB-CB 3.86Å; I487-K500 WeakPolarHBondContact CB-O 3.44Å; I487-K500 HydrophobicContact CG1-CB 3.78Å; I487-K500 WeakPolarHBondContact CG1-O 3.32Å; I487-K500 HydrophobicContact CG2-CB 4.19Å; I487-F502 HydrophobicContact CD1-CD2 4.37Å; I487-F502 HydrophobicContact CD1-CE2 3.9Å; I487-F502 HydrophobicContact CG1-CD2 4.26Å; I487-F502 HydrophobicContact CG1-CE2 3.68Å; I487-F516 HydrophobicContact CD1-CZ 4.46Å; I487-W537 HydrophobicContact CD1-CH2 4.34Å; I487-W537 HydrophobicContact CD1-CZ3 3.84Å; I487-W537 HydrophobicContact CG1-CH2 4.14Å; I487-W537 HydrophobicContact CG1-CZ3 3.82Å; I487-W537 HydrophobicContact CG2-CH2 3.74Å; I487-W537 HydrophobicContact CG2-CZ3 4.3Å
488	F	94.3	Very high	90.2	Very high	3 Å²	3	49.2 Å²	49.2	1%	0.013	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	140.5	172.7	-65.6	-96.2	0	0	0	110.8	L442 I456 M461 M464 W475 L476 C478 L486 A490 L496	L442-F488 HydrophobicContact CD1-CD1 3.99Å; L442-F488 HydrophobicContact CD1-CD2 3.75Å; L442-F488 HydrophobicContact CD1-CE1 3.83Å; L442-F488 HydrophobicContact CD1-CE2 3.57Å; L442-F488 HydrophobicContact CD1-CG 3.95Å; L442-F488 HydrophobicContact CD1-CZ 3.61Å; I456-F488 HydrophobicContact CD1-CD1 4.45Å; I456-F488 HydrophobicContact CG2-CE1 4.1Å; M461-F488 HydrophobicContact CE-CZ 3.94Å; M461-F488 HydrophobicContact SD-CZ 4.47Å; M464-F488 HydrophobicContact SD-CE2 4.27Å; W475-F488 WeakPolarHBondContact CA-O 3.43Å; L476-F488 HydrophobicContact CB-CB 4.31Å; L476-F488 PolarHBondContact N-O 3.01Å; L476-F488 PolarHBondContact O-N 3.27Å; C478-F488 HydrophobicContact CB-CD2 4.27Å; C478-F488 HydrophobicContact CB-CE2 4.17Å; C478-F488 VanDerWaalsContact SG-CD2 3.6Å; L486-F488 HydrophobicContact CB-CE2 3.86Å; F488-A490 PolarHBondContact O-N 3.07Å; F488-L496 HydrophobicContact CD1-CB 4.02Å; F488-L496 HydrophobicContact CE1-CB 3.72Å; F488-L496 HydrophobicContact CE1-CD1 4.16Å; F488-L496 HydrophobicContact CE1-CG 4.44Å; F488-L496 HydrophobicContact CE2-CD1 4.23Å; F488-L496 HydrophobicContact CZ-CB 4.23Å; F488-L496 HydrophobicContact CZ-CD1 3.78Å; F488-L496 HydrophobicContact CZ-CG 4.47Å
489	G	92.9	Very high	90	Very high	18 Å²	18	57.9 Å²	57.9	19%	0.186	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	117	174.7	0	0	0	0	0	111.6	F494 R495	G489-F494 VanDerWaalsContact O-CA 3.25Å; G489-F494 WeakPolarHBondContact O-CA 3.37Å; G489-F494 PolarHBondContact O-N 3.43Å; G489-R495 PolarHBondContact N-O 2.87Å
490	A	86.8	Confident	89.9	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-31.7	-166.1	0	0	0	0	0	114.6	V427 L469 G473 K474 L476 F488 N492 F494	V427-A490 HydrophobicContact CG1-CB 3.73Å; L469-A490 HydrophobicContact CD1-CB 4.04Å; G473-A490 WeakPolarHBondContact O-CB 3.43Å; K474-A490 WeakPolarHBondContact O-CB 3.47Å; K474-A490 PolarHBondContact O-N 2.85Å; L476-A490 HydrophobicContact CD1-CB 4.17Å; L476-A490 HydrophobicContact CG-CB 4.12Å; F488-A490 PolarHBondContact O-N 3.07Å; A490-N492 PolarHBondContact O-N 2.87Å; A490-F494 VanDerWaalsContact O-CE1 3.31Å; A490-F494 WeakPolarHBondContact O-CE1 3.44Å; A490-F494 WeakPolarHBondContact O-CZ 3.4Å
491	Q	79.4	Confident	89.9	Confident	94 Å²	94	61.9 Å²	61.9	44%	0.439	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	9.5	-163.4	-70.6	-175.6	-34.5	0	0	116.9	K474	K474-Q491 HydrophobicContact CG-CG 4.35Å
492	N	73.6	Confident	90	Very high	120 Å²	120	59.7 Å²	59.7	64%	0.642	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-179.3	-64.4	170.4	-108.1	-66	0	0	0	113.9	A490 F494	A490-N492 PolarHBondContact O-N 2.87Å; N492-F494 VanDerWaalsContact O-CD2 3.22Å; N492-F494 WeakPolarHBondContact O-CD2 3.42Å; N492-F494 WeakPolarHBondContact O-CE2 3.47Å
493	R	82.4	Confident	90	Very high	184 Å²	184	63.2 Å²	63.2	69%	0.694	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-10.3	-165.2	-64.5	-173.9	-178.3	176.6	0.7	114.2	R495	R493-R495 HydrophobicContact CB-CG 4.07Å; R493-R495 PolarHBondContact O-N 2.56Å; R493-R495 VanDerWaalsContact O-N 3.08Å
494	F	87.1	Confident	89.8	Confident	5 Å²	5	62.8 Å²	62.8	2%	0.022	30%	0.295	C	S	.	.			trans	44.7	41.2	-176.7	-61.7	-91.6	0	0	0	113.2	V427 V434 V444 F453 K454 I456 L476 G489 A490 N492	V427-F494 HydrophobicContact CG1-CE1 3.99Å; V427-F494 HydrophobicContact CG1-CZ 4.03Å; V434-F494 HydrophobicContact CG2-CD1 4.14Å; V434-F494 HydrophobicContact CG2-CE1 3.67Å; V444-F494 HydrophobicContact CG1-CE1 3.92Å; V444-F494 HydrophobicContact CG1-CE2 4.08Å; V444-F494 HydrophobicContact CG1-CZ 3.7Å; V444-F494 HydrophobicContact CG2-CB 4.44Å; V444-F494 HydrophobicContact CG2-CD1 3.84Å; V444-F494 HydrophobicContact CG2-CD2 4.17Å; V444-F494 HydrophobicContact CG2-CE1 4.09Å; V444-F494 HydrophobicContact CG2-CE2 4.45Å; V444-F494 HydrophobicContact CG2-CG 3.88Å; V444-F494 HydrophobicContact CG2-CZ 4.4Å; F453-F494 HydrophobicContact CE2-CD2 4.48Å; F453-F494 HydrophobicContact CE2-CE2 4.29Å; F453-F494 HydrophobicContact CZ-CD2 4.26Å; F453-F494 AromaticContact CZ-CE2 3.73Å; F453-F494 HydrophobicContact CZ-CE2 3.73Å; F453-F494 HydrophobicContact CZ-CZ 4.45Å; K454-F494 HydrophobicContact CG-CB 4.33Å; I456-F494 HydrophobicContact CD1-CB 3.62Å; I456-F494 WeakPolarHBondContact CD1-O 3.44Å; L476-F494 HydrophobicContact CD1-CD1 4.11Å; L476-F494 HydrophobicContact CD1-CE1 4.07Å; G489-F494 VanDerWaalsContact O-CA 3.25Å; G489-F494 WeakPolarHBondContact O-CA 3.37Å; G489-F494 PolarHBondContact O-N 3.43Å; A490-F494 VanDerWaalsContact O-CE1 3.31Å; A490-F494 WeakPolarHBondContact O-CE1 3.44Å; A490-F494 WeakPolarHBondContact O-CZ 3.4Å; N492-F494 VanDerWaalsContact O-CD2 3.22Å; N492-F494 WeakPolarHBondContact O-CD2 3.42Å; N492-F494 WeakPolarHBondContact O-CE2 3.47Å
495	R	88.9	Confident	89.8	Confident	175 Å²	175	61.8 Å²	61.8	66%	0.66	29%	0.29	S	S	*	.			trans	-89.3	139.6	178	-69.8	-175	-179.1	-167.2	-1.9	110.3	G489 R493	G489-R495 PolarHBondContact N-O 2.87Å; R493-R495 HydrophobicContact CB-CG 4.07Å; R493-R495 PolarHBondContact O-N 2.56Å; R493-R495 VanDerWaalsContact O-N 3.08Å
496	L	91.7	Very high	89.6	Confident	46 Å²	46	65.9 Å²	65.9	24%	0.241	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	130	172.7	-177.1	142.5	0	0	0	110.5	L486 I487 F488 K498	L486-L496 HydrophobicContact CB-CD1 3.98Å; L486-L496 HydrophobicContact CD1-CD1 4.05Å; L486-L496 HydrophobicContact CD2-CD1 4.24Å; L486-L496 HydrophobicContact CG-CD1 4.31Å; I487-L496 CarbonylContact O-C 3.59Å; I487-L496 WeakPolarHBondContact O-CA 3.44Å; F488-L496 HydrophobicContact CD1-CB 4.02Å; F488-L496 HydrophobicContact CE1-CB 3.72Å; F488-L496 HydrophobicContact CE1-CD1 4.16Å; F488-L496 HydrophobicContact CE1-CG 4.44Å; F488-L496 HydrophobicContact CE2-CD1 4.23Å; F488-L496 HydrophobicContact CZ-CB 4.23Å; F488-L496 HydrophobicContact CZ-CD1 3.78Å; F488-L496 HydrophobicContact CZ-CG 4.47Å; L496-K498 HydrophobicContact CD2-CB 4.45Å; L496-K498 HydrophobicContact CD2-CG 3.67Å; L496-K498 PolarHBondContact O-N 3.16Å
497	N	90.1	Very high	89.4	Confident	38 Å²	38	65.3 Å²	65.3	20%	0.203	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	95	177.3	-173.7	-5.6	0	0	0	110.3	W475 I487 K499 K500	W475-N497 WeakPolarHBondContact CH2-ND2 3.46Å; W475-N497 HydrophobicContact CZ3-CB 3.98Å; I487-N497 HydrophobicContact CG2-CB 4.34Å; I487-N497 PolarHBondContact O-N 3.35Å; N497-K499 PolarHBondContact O-N 3.08Å; N497-K499 WeakPolarHBondContact OD1-CB 3.11Å; N497-K499 PolarHBondContact OD1-N 3.31Å; N497-K500 HydrophobicContact CB-CB 4.38Å; N497-K500 WeakPolarHBondContact ND2-CG 3.45Å; N497-K500 PolarHBondContact O-N 2.87Å
498	K	88.8	Confident	88.9	Confident	165 Å²	165	67.9 Å²	67.9	72%	0.717	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.7	-15.3	-179.1	-61.6	-171.5	178	-171.2	0	114.4	L496	L496-K498 HydrophobicContact CD2-CB 4.45Å; L496-K498 HydrophobicContact CD2-CG 3.67Å; L496-K498 PolarHBondContact O-N 3.16Å
499	K	90.1	Very high	88.5	Confident	181 Å²	181	70.8 Å²	70.8	79%	0.787	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	-10.1	174.1	-58.4	-175.5	179.5	-176.5	0	113.7	N497	N497-K499 PolarHBondContact O-N 3.08Å; N497-K499 WeakPolarHBondContact OD1-CB 3.11Å; N497-K499 PolarHBondContact OD1-N 3.31Å
500	K	92.3	Very high	88.5	Confident	36 Å²	36	73.4 Å²	73.4	16%	0.157	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	83.3	-175.6	-62.5	-61.1	177	-168.7	0	109.4	I487 N497 W537 K538 T540	I487-K500 HydrophobicContact CB-CB 3.86Å; I487-K500 WeakPolarHBondContact CB-O 3.44Å; I487-K500 HydrophobicContact CG1-CB 3.78Å; I487-K500 WeakPolarHBondContact CG1-O 3.32Å; I487-K500 HydrophobicContact CG2-CB 4.19Å; N497-K500 HydrophobicContact CB-CB 4.38Å; N497-K500 WeakPolarHBondContact ND2-CG 3.45Å; N497-K500 PolarHBondContact O-N 2.87Å; K500-W537 WeakPolarHBondContact CE-O 3.45Å; K500-W537 PolarHBondContact NZ-O 2.95Å; K500-K538 PolarHBondContact NZ-O 2.84Å; K500-T540 HydrophobicContact CD-CG2 3.54Å
501	I	93.3	Very high	88.8	Confident	49 Å²	49	74.4 Å²	74.4	25%	0.251	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	118.7	177	-55.7	175.3	0	0	0	106.9	Q484 L486 K503	Q484-I501 HydrophobicContact CB-CG2 4.28Å; Q484-I501 VanDerWaalsContact OE1-CG2 3.22Å; L486-I501 HydrophobicContact CD2-CG2 4.4Å; I501-K503 HydrophobicContact CG2-CD 4.5Å; I501-K503 HydrophobicContact CG2-CG 4.07Å
502	F	94.7	Very high	89.5	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	123.4	-179.3	-54	-85.2	0	0	0	109.8	Q484 I485 I487 H505 V523 W535 D536 W537 T540	Q484-F502 WeakPolarHBondContact CA-O 3.28Å; I485-F502 HydrophobicContact CB-CB 4.11Å; I485-F502 HydrophobicContact CB-CD2 4.09Å; I485-F502 HydrophobicContact CD1-CB 4.31Å; I485-F502 HydrophobicContact CG2-CD2 4.24Å; I485-F502 PolarHBondContact N-O 3.25Å; I485-F502 PolarHBondContact O-N 2.98Å; I487-F502 HydrophobicContact CD1-CD2 4.37Å; I487-F502 HydrophobicContact CD1-CE2 3.9Å; I487-F502 HydrophobicContact CG1-CD2 4.26Å; I487-F502 HydrophobicContact CG1-CE2 3.68Å; F502-H505 PolarHBondContact O-CE1 2.89Å; F502-V523 HydrophobicContact CE1-CG2 4.22Å; F502-V523 HydrophobicContact CE2-CG2 4.01Å; F502-V523 HydrophobicContact CZ-CG2 3.78Å; F502-W535 HydrophobicContact CB-CD2 3.94Å; F502-W535 HydrophobicContact CB-CE3 4.49Å; F502-W535 HydrophobicContact CB-CG 4.01Å; F502-W535 HydrophobicContact CD1-CB 3.39Å; F502-W535 AromaticContact CD1-CD1 3.81Å; F502-W535 HydrophobicContact CD1-CD2 4.23Å; F502-W535 AromaticContact CD1-CG 3.54Å; F502-W535 HydrophobicContact CD1-CG 3.54Å; F502-W535 HydrophobicContact CE1-CB 3.79Å; F502-W535 HydrophobicContact CE1-CG 4.41Å; F502-W535 HydrophobicContact CG-CB 4.33Å; F502-W535 HydrophobicContact CG-CD2 4.39Å; F502-W535 HydrophobicContact CG-CG 4.14Å; F502-D536 WeakPolarHBondContact CE1-O 3.43Å; F502-W537 HydrophobicContact CE2-CE3 4Å; F502-W537 AromaticContact CE2-CZ3 3.92Å; F502-W537 HydrophobicContact CE2-CZ3 3.92Å; F502-W537 AromaticContact CZ-CE3 3.55Å; F502-W537 HydrophobicContact CZ-CE3 3.55Å; F502-W537 AromaticContact CZ-CZ3 3.93Å; F502-W537 HydrophobicContact CZ-CZ3 3.93Å; F502-T540 HydrophobicContact CE1-CG2 3.98Å; F502-T540 HydrophobicContact CZ-CG2 4.24Å
503	K	92.4	Very high	90.5	Very high	115 Å²	115	65.5 Å²	65.5	50%	0.5	33%	0.327	S	S	.	.			trans	-126.2	170.2	-179.4	-49	-159.4	-171.7	-151.1	0	110.7	Q484 I501 W535	Q484-K503 VanDerWaalsContact CD-CE 3.45Å; Q484-K503 HydrophobicContact CG-CD 4.09Å; Q484-K503 HydrophobicContact CG-CG 4.08Å; I501-K503 HydrophobicContact CG2-CD 4.5Å; I501-K503 HydrophobicContact CG2-CG 4.07Å; K503-W535 PolarHBondContact O-NE1 3.18Å
504	G	88.6	Confident	91.1	Very high	45 Å²	45	56.7 Å²	56.7	46%	0.464	29%	0.294	S	S	.	.	S	Bend	trans	101.2	10.1	177.2	0	0	0	0	0	115.2
505	H	91.4	Very high	91.5	Very high	11 Å²	11	57.8 Å²	57.8	5%	0.051	30%	0.3	C	S	.	.			trans	-110.6	166.7	170.4	61.9	-72.8	0	0	0	110.5	N483 F502 D527 N533 W535	N483-H505 WeakPolarHBondContact CB-O 3.16Å; N483-H505 PolarHBondContact O-CE1 3.15Å; F502-H505 PolarHBondContact O-CE1 2.89Å; H505-D527 WeakPolarHBondContact CA-OD2 3.46Å; H505-D527 VanDerWaalsContact CB-OD1 3.25Å; H505-D527 WeakPolarHBondContact CB-OD1 3.21Å; H505-N533 VanDerWaalsContact CB-ND2 3.27Å; H505-N533 WeakPolarHBondContact CB-ND2 3.31Å; H505-W535 HydrophobicContact CB-CH2 3.76Å; H505-W535 HydrophobicContact CB-CZ2 3.75Å; H505-W535 AromaticContact CG-CH2 3.62Å; H505-W535 AromaticContact CG-CZ2 3.69Å; H505-W535 AromaticContact ND1-CH2 3.49Å; H505-W535 WeakPolarHBondContact ND1-CH2 3.37Å; H505-W535 AromaticContact ND1-CZ2 3.24Å; H505-W535 WeakPolarHBondContact ND1-CZ2 3.49Å
506	M	92.1	Very high	91.9	Very high	86 Å²	86	49.6 Å²	49.6	42%	0.424	27%	0.269	S	S	.	.			trans	-130.6	113.9	176.5	-169.5	179.4	85.5	0	0	111.3	N483 D527 G528 N529	N483-M506 WeakPolarHBondContact OD1-CA 3.47Å; M506-D527 PolarHBondContact N-OD2 3.44Å; M506-G528 PolarHBondContact O-N 3.09Å; M506-N529 WeakPolarHBondContact CE-ND2 3.35Å; M506-N529 WeakPolarHBondContact CE-OD1 3.49Å
507	V	89.8	Confident	92	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.257	C	S	.	.			trans	-138.5	5.6	-170.3	-69.5	0	0	0	0	113.8	Q479 N483 G509 Y510 G526	Q479-V507 HydrophobicContact CG-CG2 4.01Å; N483-V507 PolarHBondContact OD1-N 2.84Å; V507-G509 PolarHBondContact O-N 3.21Å; V507-G509 VanDerWaalsContact O-N 3.15Å; V507-Y510 PolarHBondContact O-N 3.1Å; V507-G526 WeakPolarHBondContact CG1-O 3.43Å
508	A	85.3	Confident	92.1	Very high	54 Å²	54	45.9 Å²	45.9	45%	0.446	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	120.8	172.7	0	0	0	0	0	112	N483 Y510	N483-A508 PolarHBondContact OD1-N 3.28Å; N483-A508 VanDerWaalsContact OD1-N 3.12Å; A508-Y510 WeakPolarHBondContact O-CD2 3.48Å
509	G	87.7	Confident	92.3	Very high	64 Å²	64	39.9 Å²	39.9	66%	0.66	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.3	-1.6	-177.6	0	0	0	0	0	115.7	M481 V507	M481-G509 PolarHBondContact SD-N 2.89Å; V507-G509 PolarHBondContact O-N 3.21Å; V507-G509 VanDerWaalsContact O-N 3.15Å
510	Y	92.8	Very high	92.4	Very high	73 Å²	73	31.9 Å²	31.9	29%	0.286	19%	0.191	S	C	.	.			trans	-118.5	149.5	-176.6	-59	-67.1	0	0	0	112.6	P465 Q479 V507 A508 V552 W571	P465-Y510 WeakPolarHBondContact CG-O 3.48Å; Q479-Y510 PolarHBondContact OE1-O 3.05Å; V507-Y510 PolarHBondContact O-N 3.1Å; A508-Y510 WeakPolarHBondContact O-CD2 3.48Å; Y510-V552 HydrophobicContact CD1-CB 4.49Å; Y510-V552 HydrophobicContact CD1-CG1 3.78Å; Y510-V552 HydrophobicContact CD1-CG2 4Å; Y510-V552 HydrophobicContact CD2-CG1 4.48Å; Y510-V552 HydrophobicContact CE1-CB 4.43Å; Y510-V552 HydrophobicContact CE1-CG1 4.18Å; Y510-V552 HydrophobicContact CE1-CG2 3.49Å; Y510-V552 VanDerWaalsContact CE1-CG2 3.49Å; Y510-V552 HydrophobicContact CE2-CG2 4.2Å; Y510-V552 HydrophobicContact CG-CG1 3.95Å; Y510-W571 AromaticContact CD1-CH2 3.88Å; Y510-W571 HydrophobicContact CD1-CH2 3.88Å; Y510-W571 HydrophobicContact CD1-CZ2 4.3Å; Y510-W571 HydrophobicContact CD1-CZ3 4.27Å; Y510-W571 HydrophobicContact CE1-CE3 4.47Å; Y510-W571 AromaticContact CE1-CH2 3.71Å; Y510-W571 HydrophobicContact CE1-CH2 3.71Å; Y510-W571 AromaticContact CE1-CZ3 3.69Å; Y510-W571 HydrophobicContact CE1-CZ3 3.69Å
511	A	91.6	Very high	92.4	Very high	21 Å²	21	32 Å²	32	17%	0.174	20%	0.196	C	C	.	.			trans	-106.3	62.6	179.7	0	0	0	0	0	110.1	R336 P465	R336-A511 VanDerWaalsContact NH2-CB 3.27Å; P465-A511 HydrophobicContact CB-CB 3.66Å; P465-A511 HydrophobicContact CG-CB 4.24Å
512	C	93.9	Very high	92.6	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-80.9	131.6	-177.1	-32.4	0	0	0	0	110.3	A466 Q479 V514 G526 C553 I554	A466-C512 WeakPolarHBondContact CB-O 3.46Å; Q479-C512 PolarHBondContact NE2-O 3.49Å; Q479-C512 VanDerWaalsContact NE2-O 3.09Å; Q479-C512 PolarHBondContact OE1-O 2.99Å; Q479-C512 VanDerWaalsContact OE1-O 3.09Å; C512-V514 PolarHBondContact O-N 3.36Å; C512-G526 VanDerWaalsContact CB-O 3.26Å; C512-G526 WeakPolarHBondContact CB-O 3.48Å; C512-G526 PolarHBondContact SG-O 2.82Å; C512-G526 VanDerWaalsContact SG-O 3.39Å; C512-C553 PolarHBondContact SG-O 3.39Å; C512-C553 VanDerWaalsContact SG-O 3.36Å; C512-I554 CarbonylContact C-O 3.56Å; C512-I554 WeakPolarHBondContact CA-O 3.33Å; C512-I554 WeakPolarHBondContact CB-O 3.25Å
513	Q	94.9	Very high	92.7	Very high	27 Å²	27	31 Å²	31	13%	0.126	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-66	131.5	174.3	-176.5	172.7	-19.5	0	0	110.1	R295 T468 I554	R295-Q513 VanDerWaalsContact NH1-CD 3.35Å; T468-Q513 HydrophobicContact CG2-CG 4.24Å; Q513-I554 PolarHBondContact N-O 3.45Å
514	V	95.6	Very high	92.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	145.3	167.2	178	0	0	0	0	107.8	T468 A477 Q479 I485 C512 V523 I524	T468-V514 WeakPolarHBondContact CB-O 3.14Å; T468-V514 WeakPolarHBondContact CG2-O 3.39Å; T468-V514 PolarHBondContact OG1-O 2.84Å; A477-V514 HydrophobicContact CB-CB 4.39Å; A477-V514 HydrophobicContact CB-CG1 3.7Å; Q479-V514 HydrophobicContact CB-CG2 3.82Å; Q479-V514 HydrophobicContact CG-CG2 4.45Å; I485-V514 HydrophobicContact CD1-CG1 3.95Å; I485-V514 HydrophobicContact CD1-CG2 3.79Å; I485-V514 HydrophobicContact CG1-CG2 3.9Å; I485-V514 HydrophobicContact CG2-CG1 4.24Å; I485-V514 HydrophobicContact CG2-CG2 4.5Å; C512-V514 PolarHBondContact O-N 3.36Å; V514-V523 HydrophobicContact CG1-CG1 3.6Å; V514-I524 CarbonylContact C-O 3.6Å; V514-I524 VanDerWaalsContact CA-O 3.28Å; V514-I524 WeakPolarHBondContact CA-O 3.28Å; V514-I524 WeakPolarHBondContact CG1-O 3.24Å
515	D	96.4	Very high	93.2	Very high	27 Å²	27	23.4 Å²	23.4	14%	0.144	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	165.3	171.7	-156.5	7.1	0	0	0	111.5	V523 I524 V557 W558	D515-V523 WeakPolarHBondContact O-CA 3.16Å; D515-I524 HydrophobicContact CB-CD1 4.1Å; D515-I524 HydrophobicContact CB-CG1 3.82Å; D515-I524 PolarHBondContact N-O 3.43Å; D515-I524 WeakPolarHBondContact O-CG1 3.34Å; D515-I524 PolarHBondContact O-N 2.81Å; D515-V557 VanDerWaalsContact OD2-CA 3.31Å; D515-V557 WeakPolarHBondContact OD2-CA 3.34Å; D515-W558 PolarHBondContact OD2-N 2.88Å
516	F	95.8	Very high	93.4	Very high	3 Å²	3	22.9 Å²	22.9	1%	0.013	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	150.9	176.8	-67.3	-88.8	0	0	0	110.2	P471 A477 I487 M520 Y522 V523 W537 W558	P471-F516 HydrophobicContact CG-CB 4.36Å; A477-F516 HydrophobicContact CB-CE2 3.58Å; A477-F516 HydrophobicContact CB-CZ 3.54Å; I487-F516 HydrophobicContact CD1-CZ 4.46Å; F516-M520 HydrophobicContact CD1-CE 3.83Å; F516-M520 HydrophobicContact CE1-CE 3.74Å; F516-M520 HydrophobicContact CZ-CE 4.46Å; F516-Y522 WeakPolarHBondContact CA-O 3.41Å; F516-V523 HydrophobicContact CD1-CG2 3.86Å; F516-V523 HydrophobicContact CE1-CG2 3.83Å; F516-W537 HydrophobicContact CD1-CE3 4.47Å; F516-W537 AromaticContact CE1-CE3 3.82Å; F516-W537 HydrophobicContact CE1-CE3 3.82Å; F516-W537 HydrophobicContact CE1-CH2 4.17Å; F516-W537 AromaticContact CE1-CZ3 3.57Å; F516-W537 HydrophobicContact CE1-CZ3 3.57Å; F516-W537 HydrophobicContact CZ-CZ3 4.26Å; F516-W558 WeakPolarHBondContact O-CB 3.47Å
517	S	95.1	Very high	93.4	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.122	C	C	.	.			trans	-66.4	146.9	159.7	65.7	0	0	0	0	109.8	D519 M520 S521 Y522	S517-D519 WeakPolarHBondContact CB-OD1 3.35Å; S517-D519 PolarHBondContact O-N 3.34Å; S517-D519 VanDerWaalsContact O-N 3.16Å; S517-D519 PolarHBondContact OG-OD1 3.15Å; S517-M520 WeakPolarHBondContact O-CA 3.26Å; S517-M520 PolarHBondContact O-N 2.85Å; S517-S521 PolarHBondContact OG-N 3.28Å; S517-S521 VanDerWaalsContact OG-N 3.08Å; S517-Y522 PolarHBondContact N-O 3.44Å; S517-Y522 PolarHBondContact OG-N 3.01Å
518	P	92.4	Very high	93.6	Very high	7 Å²	7	19.6 Å²	19.6	5%	0.045	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-38.6	-179	-32.9	35.1	0	0	0	115	P270 P271 M520 H559 P560	P270-P518 HydrophobicContact CB-CB 3.86Å; P271-P518 HydrophobicContact CG-CB 4.12Å; P271-P518 HydrophobicContact CG-CG 4.4Å; P518-M520 VanDerWaalsContact C-N 3.26Å; P518-M520 PolarHBondContact O-N 2.96Å; P518-H559 WeakPolarHBondContact CG-O 3.47Å; P518-P560 WeakPolarHBondContact CB-O 3.07Å; P518-P560 WeakPolarHBondContact CG-O 3.1Å
519	D	91.4	Very high	93.9	Very high	38 Å²	38	20.7 Å²	20.7	20%	0.203	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-0.9	178.5	69.2	-15.5	0	0	0	114.2	C274 S517 S521	C274-D519 WeakPolarHBondContact CB-OD1 3.33Å; C274-D519 PolarHBondContact N-OD2 2.99Å; C274-D519 VanDerWaalsContact SG-CG 3.52Å; C274-D519 PolarHBondContact SG-OD1 2.95Å; C274-D519 VanDerWaalsContact SG-OD1 3.35Å; S517-D519 WeakPolarHBondContact CB-OD1 3.35Å; S517-D519 PolarHBondContact O-N 3.34Å; S517-D519 VanDerWaalsContact O-N 3.16Å; S517-D519 PolarHBondContact OG-OD1 3.15Å; D519-S521 PolarHBondContact O-N 2.97Å; D519-S521 VanDerWaalsContact OD1-CB 3.28Å; D519-S521 WeakPolarHBondContact OD1-CB 3.39Å; D519-S521 PolarHBondContact OD1-N 3.32Å; D519-S521 PolarHBondContact OD1-OG 2.8Å; D519-S521 VanDerWaalsContact OD2-CB 3.24Å; D519-S521 WeakPolarHBondContact OD2-CB 3.41Å; D519-S521 PolarHBondContact OD2-OG 2.81Å
520	M	92.5	Very high	94.2	Very high	13 Å²	13	17.7 Å²	17.7	6%	0.064	10%	0.096	C	C	.	.	S	Bend	trans	56.7	23.6	-168.4	-67.8	-157.9	74.9	0	0	115.2	N472 W475 F516 S517 P518 W537	N472-M520 HydrophobicContact CB-SD 3.9Å; N472-M520 PolarHBondContact ND2-SD 2.88Å; W475-M520 HydrophobicContact CB-CE 4.48Å; W475-M520 HydrophobicContact CG-CE 4.37Å; F516-M520 HydrophobicContact CD1-CE 3.83Å; F516-M520 HydrophobicContact CE1-CE 3.74Å; F516-M520 HydrophobicContact CZ-CE 4.46Å; S517-M520 WeakPolarHBondContact O-CA 3.26Å; S517-M520 PolarHBondContact O-N 2.85Å; P518-M520 VanDerWaalsContact C-N 3.26Å; P518-M520 PolarHBondContact O-N 2.96Å; M520-W537 HydrophobicContact CE-CD2 4.07Å; M520-W537 HydrophobicContact CE-CE3 4.44Å; M520-W537 HydrophobicContact CE-CH2 4.03Å; M520-W537 HydrophobicContact CE-CZ2 3.62Å; M520-W537 HydrophobicContact CE-CZ3 4.43Å; M520-W537 WeakPolarHBondContact O-CB 3.45Å
521	S	93.3	Very high	94.3	Very high	38 Å²	38	18 Å²	18	27%	0.266	10%	0.098	S	C	.	.	S	Bend	trans	-70.1	-35	171.4	-72.9	0	0	0	0	112.9	S517 D519 W537	S517-S521 PolarHBondContact OG-N 3.28Å; S517-S521 VanDerWaalsContact OG-N 3.08Å; D519-S521 PolarHBondContact O-N 2.97Å; D519-S521 VanDerWaalsContact OD1-CB 3.28Å; D519-S521 WeakPolarHBondContact OD1-CB 3.39Å; D519-S521 PolarHBondContact OD1-N 3.32Å; D519-S521 PolarHBondContact OD1-OG 2.8Å; D519-S521 VanDerWaalsContact OD2-CB 3.24Å; D519-S521 WeakPolarHBondContact OD2-CB 3.41Å; D519-S521 PolarHBondContact OD2-OG 2.81Å; S521-W537 WeakPolarHBondContact O-CB 3.49Å; S521-W537 PolarHBondContact O-N 2.83Å
522	Y	95.8	Very high	94.5	Very high	29 Å²	29	17 Å²	17	11%	0.114	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	156.4	-171.5	-51.4	-63	0	0	0	113.2	C274 L276 F516 S517 I534 W535 Y543 W558	C274-Y522 HydrophobicContact CB-CD2 4.16Å; C274-Y522 HydrophobicContact CB-CE2 4.16Å; L276-Y522 HydrophobicContact CD1-CD1 4.26Å; L276-Y522 HydrophobicContact CD1-CD2 4.46Å; L276-Y522 HydrophobicContact CD1-CE1 3.62Å; L276-Y522 HydrophobicContact CD1-CE2 3.83Å; L276-Y522 WeakPolarHBondContact CD1-OH 3.43Å; L276-Y522 HydrophobicContact CG-CE1 4.45Å; L276-Y522 HydrophobicContact CG-CE2 4.49Å; F516-Y522 WeakPolarHBondContact CA-O 3.41Å; S517-Y522 PolarHBondContact N-O 3.44Å; S517-Y522 PolarHBondContact OG-N 3.01Å; Y522-I534 HydrophobicContact CD1-CG2 4.42Å; Y522-I534 HydrophobicContact CG-CG2 4.28Å; Y522-W535 VanDerWaalsContact CA-O 3.24Å; Y522-W535 WeakPolarHBondContact CA-O 3.48Å; Y522-Y543 HydrophobicContact CD1-CD2 4.31Å; Y522-Y543 AromaticContact CE1-CD2 3.93Å; Y522-Y543 HydrophobicContact CE1-CD2 3.93Å; Y522-Y543 HydrophobicContact CE1-CE2 4.14Å; Y522-W558 AromaticContact CD2-CH2 3.72Å; Y522-W558 HydrophobicContact CD2-CH2 3.72Å; Y522-W558 HydrophobicContact CD2-CZ2 4.41Å; Y522-W558 HydrophobicContact CD2-CZ3 4.26Å; Y522-W558 HydrophobicContact CG-CH2 4.35Å; Y522-W558 HydrophobicContact CG-CZ3 4.49Å
523	V	96.8	Very high	94.6	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	136.6	167.5	-177.8	0	0	0	0	107.9	I485 F502 V514 D515 F516 I534 W535 W537	I485-V523 HydrophobicContact CD1-CG1 4.13Å; F502-V523 HydrophobicContact CE1-CG2 4.22Å; F502-V523 HydrophobicContact CE2-CG2 4.01Å; F502-V523 HydrophobicContact CZ-CG2 3.78Å; V514-V523 HydrophobicContact CG1-CG1 3.6Å; D515-V523 WeakPolarHBondContact O-CA 3.16Å; F516-V523 HydrophobicContact CD1-CG2 3.86Å; F516-V523 HydrophobicContact CE1-CG2 3.83Å; V523-I534 WeakPolarHBondContact O-CA 3.38Å; V523-W535 HydrophobicContact CB-CE3 4.43Å; V523-W535 HydrophobicContact CG1-CE3 4.39Å; V523-W535 PolarHBondContact N-O 3.4Å; V523-W535 PolarHBondContact O-N 2.98Å; V523-W537 HydrophobicContact CG2-CE3 3.7Å; V523-W537 HydrophobicContact CG2-CZ3 4.34Å
524	I	96.3	Very high	94.7	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	143.8	177.7	61.9	171.1	0	0	0	111.7	V514 D515 L532 N533 I534 A556 W558 V566	V514-I524 CarbonylContact C-O 3.6Å; V514-I524 VanDerWaalsContact CA-O 3.28Å; V514-I524 WeakPolarHBondContact CA-O 3.28Å; V514-I524 WeakPolarHBondContact CG1-O 3.24Å; D515-I524 HydrophobicContact CB-CD1 4.1Å; D515-I524 HydrophobicContact CB-CG1 3.82Å; D515-I524 PolarHBondContact N-O 3.43Å; D515-I524 WeakPolarHBondContact O-CG1 3.34Å; D515-I524 PolarHBondContact O-N 2.81Å; I524-L532 HydrophobicContact CB-CD1 4.36Å; I524-N533 WeakPolarHBondContact CA-O 3.27Å; I524-I534 HydrophobicContact CG2-CB 4.36Å; I524-I534 HydrophobicContact CG2-CD1 4.37Å; I524-I534 HydrophobicContact CG2-CG1 3.96Å; I524-I534 HydrophobicContact CG2-CG2 4.02Å; I524-A556 HydrophobicContact CD1-CB 4.03Å; I524-A556 HydrophobicContact CG1-CB 4.26Å; I524-W558 HydrophobicContact CD1-CB 4.24Å; I524-W558 HydrophobicContact CD1-CE3 4Å; I524-W558 HydrophobicContact CG1-CE3 4.35Å; I524-W558 HydrophobicContact CG2-CE3 3.61Å; I524-W558 HydrophobicContact CG2-CZ3 3.5Å; I524-W558 VanDerWaalsContact CG2-CZ3 3.5Å; I524-V566 HydrophobicContact CD1-CG1 3.53Å; I524-V566 HydrophobicContact CD1-CG2 4.15Å
525	S	96	Very high	94.8	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	143.5	170.9	-174.8	0	0	0	0	110.6	Q479 N533	Q479-S525 PolarHBondContact NE2-OG 3.1Å; S525-N533 PolarHBondContact N-O 2.76Å; S525-N533 PolarHBondContact O-N 2.82Å
526	G	95	Very high	94.7	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	156.1	162.7	0	0	0	0	0	112.5	V507 C512 C553	V507-G526 WeakPolarHBondContact CG1-O 3.43Å; C512-G526 VanDerWaalsContact CB-O 3.26Å; C512-G526 WeakPolarHBondContact CB-O 3.48Å; C512-G526 PolarHBondContact SG-O 2.82Å; C512-G526 VanDerWaalsContact SG-O 3.39Å; G526-C553 CarbonylContact C-O 3.51Å; G526-C553 WeakPolarHBondContact CA-O 3.49Å
527	D	93.7	Very high	94.7	Very high	4 Å²	4	16.5 Å²	16.5	2%	0.021	9%	0.086	C	C	.	.			trans	-117.3	158	179.1	-80	34.2	0	0	0	113.2	H505 M506 N529 G530 K531 N533 C553	H505-D527 WeakPolarHBondContact CA-OD2 3.46Å; H505-D527 VanDerWaalsContact CB-OD1 3.25Å; H505-D527 WeakPolarHBondContact CB-OD1 3.21Å; M506-D527 PolarHBondContact N-OD2 3.44Å; D527-N529 HydrophobicContact CB-CB 4.39Å; D527-N529 PolarHBondContact O-N 3.41Å; D527-N529 VanDerWaalsContact O-N 3.15Å; D527-G530 PolarHBondContact O-N 2.77Å; D527-K531 HydrophobicContact CB-CB 4.35Å; D527-K531 PolarHBondContact N-O 2.89Å; D527-N533 PolarHBondContact OD1-ND2 2.87Å; D527-N533 PolarHBondContact OD2-ND2 2.76Å; D527-C553 PolarHBondContact N-O 2.88Å; D527-C553 PolarHBondContact O-N 3.38Å
528	G	93	Very high	94.6	Very high	13 Å²	13	24.8 Å²	24.8	13%	0.134	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-30.4	162.8	0	0	0	0	0	113.6	M506 G530 V552	M506-G528 PolarHBondContact O-N 3.09Å; G528-G530 VanDerWaalsContact C-N 3.28Å; G528-G530 PolarHBondContact O-N 2.82Å; G528-V552 WeakPolarHBondContact O-CG2 3.27Å
529	N	92.5	Very high	94.5	Very high	78 Å²	78	28.1 Å²	28.1	42%	0.417	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	7	177	-68.4	-41.1	0	0	0	114.6	M506 D527 K531	M506-N529 WeakPolarHBondContact CE-ND2 3.35Å; M506-N529 WeakPolarHBondContact CE-OD1 3.49Å; D527-N529 HydrophobicContact CB-CB 4.39Å; D527-N529 PolarHBondContact O-N 3.41Å; D527-N529 VanDerWaalsContact O-N 3.15Å; N529-K531 HydrophobicContact CB-CD 4.42Å; N529-K531 HydrophobicContact CB-CG 4.36Å; N529-K531 PolarHBondContact O-N 3.36Å
530	G	92.9	Very high	94.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.146	C	C	.	.	S	Bend	trans	70.4	9.9	-176.9	0	0	0	0	0	114.8	D527 G528 A548 H549 K551	D527-G530 PolarHBondContact O-N 2.77Å; G528-G530 VanDerWaalsContact C-N 3.28Å; G528-G530 PolarHBondContact O-N 2.82Å; G530-A548 PolarHBondContact O-N 2.94Å; G530-H549 PolarHBondContact O-N 2.67Å; G530-K551 WeakPolarHBondContact CA-O 3.41Å
531	K	95.4	Very high	94.7	Very high	79 Å²	79	34.6 Å²	34.6	34%	0.343	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	145.5	177.3	-63.4	177.5	-175.6	174.9	0	110.2	D527 N529 R545 F546	D527-K531 HydrophobicContact CB-CB 4.35Å; D527-K531 PolarHBondContact N-O 2.89Å; N529-K531 HydrophobicContact CB-CD 4.42Å; N529-K531 HydrophobicContact CB-CG 4.36Å; N529-K531 PolarHBondContact O-N 3.36Å; K531-R545 HydrophobicContact CB-CG 4.48Å; K531-R545 HydrophobicContact CD-CG 4.14Å; K531-F546 CarbonylContact C-O 3.5Å; K531-F546 VanDerWaalsContact CA-O 3.23Å; K531-F546 WeakPolarHBondContact CA-O 3.48Å; K531-F546 WeakPolarHBondContact CB-O 3.24Å
532	L	96.1	Very high	94.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	126.1	161.8	-175.1	72.3	0	0	0	107.4	I524 I534 R545 F546 A548 A556 V566 T568	I524-L532 HydrophobicContact CB-CD1 4.36Å; L532-I534 HydrophobicContact CD2-CD1 4.16Å; L532-I534 HydrophobicContact CD2-CG1 4.29Å; L532-I534 HydrophobicContact CG-CG1 4.33Å; L532-R545 WeakPolarHBondContact O-CA 3.01Å; L532-F546 HydrophobicContact CB-CE1 4.44Å; L532-F546 HydrophobicContact CB-CE2 4.17Å; L532-F546 HydrophobicContact CB-CZ 4.09Å; L532-F546 HydrophobicContact CD2-CE1 3.96Å; L532-F546 HydrophobicContact CD2-CE2 4.31Å; L532-F546 HydrophobicContact CD2-CZ 3.54Å; L532-F546 HydrophobicContact CG-CZ 4.39Å; L532-F546 PolarHBondContact N-O 2.67Å; L532-F546 PolarHBondContact O-N 3.2Å; L532-A548 HydrophobicContact CB-CB 4.15Å; L532-A556 HydrophobicContact CD1-CB 3.75Å; L532-V566 HydrophobicContact CD2-CG1 3.98Å; L532-T568 HydrophobicContact CD1-CG2 3.88Å; L532-T568 HydrophobicContact CD2-CG2 4.11Å; L532-T568 HydrophobicContact CG-CG2 4.43Å
533	N	96.1	Very high	94.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	135.2	174.2	-76.2	-53.3	0	0	0	109.9	H505 I524 S525 D527 W535 L542 R545	H505-N533 VanDerWaalsContact CB-ND2 3.27Å; H505-N533 WeakPolarHBondContact CB-ND2 3.31Å; I524-N533 WeakPolarHBondContact CA-O 3.27Å; S525-N533 PolarHBondContact N-O 2.76Å; S525-N533 PolarHBondContact O-N 2.82Å; D527-N533 PolarHBondContact OD1-ND2 2.87Å; D527-N533 PolarHBondContact OD2-ND2 2.76Å; N533-W535 HydrophobicContact CB-CE3 4.4Å; N533-W535 HydrophobicContact CB-CH2 3.35Å; N533-W535 HydrophobicContact CB-CZ2 3.69Å; N533-W535 HydrophobicContact CB-CZ3 3.75Å; N533-L542 HydrophobicContact CB-CD1 3.75Å; N533-R545 WeakPolarHBondContact OD1-CB 3.33Å; N533-R545 WeakPolarHBondContact OD1-CD 3.29Å; N533-R545 WeakPolarHBondContact OD1-CG 3.17Å
534	I	96.6	Very high	94.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	116.3	-179.2	-47.3	-172	0	0	0	108.5	L276 P277 Y522 V523 I524 L532 Y543 S544 F546	L276-I534 HydrophobicContact CB-CD1 4.49Å; L276-I534 HydrophobicContact CD2-CB 4.04Å; L276-I534 HydrophobicContact CD2-CD1 4.22Å; L276-I534 HydrophobicContact CD2-CG2 3.7Å; L276-I534 HydrophobicContact CG-CD1 4.47Å; L276-I534 HydrophobicContact CG-CG2 4.09Å; P277-I534 HydrophobicContact CG-CD1 4.27Å; Y522-I534 HydrophobicContact CD1-CG2 4.42Å; Y522-I534 HydrophobicContact CG-CG2 4.28Å; V523-I534 WeakPolarHBondContact O-CA 3.38Å; I524-I534 HydrophobicContact CG2-CB 4.36Å; I524-I534 HydrophobicContact CG2-CD1 4.37Å; I524-I534 HydrophobicContact CG2-CG1 3.96Å; I524-I534 HydrophobicContact CG2-CG2 4.02Å; L532-I534 HydrophobicContact CD2-CD1 4.16Å; L532-I534 HydrophobicContact CD2-CG1 4.29Å; L532-I534 HydrophobicContact CG-CG1 4.33Å; I534-Y543 PolarHBondContact O-N 2.89Å; I534-S544 PolarHBondContact N-O 3.25Å; I534-S544 PolarHBondContact O-N 2.9Å; I534-S544 VanDerWaalsContact O-N 3.15Å; I534-F546 HydrophobicContact CD1-CE1 4.21Å
535	W	96.8	Very high	94.2	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	149.8	176.3	-61.1	-96.8	0	0	0	111.7	I485 F502 K503 H505 Y522 V523 N533 W537 K541 L542	I485-W535 HydrophobicContact CD1-CE3 4.15Å; I485-W535 HydrophobicContact CD1-CH2 3.93Å; I485-W535 HydrophobicContact CD1-CZ3 3.6Å; F502-W535 HydrophobicContact CB-CD2 3.94Å; F502-W535 HydrophobicContact CB-CE3 4.49Å; F502-W535 HydrophobicContact CB-CG 4.01Å; F502-W535 HydrophobicContact CD1-CB 3.39Å; F502-W535 AromaticContact CD1-CD1 3.81Å; F502-W535 HydrophobicContact CD1-CD2 4.23Å; F502-W535 AromaticContact CD1-CG 3.54Å; F502-W535 HydrophobicContact CD1-CG 3.54Å; F502-W535 HydrophobicContact CE1-CB 3.79Å; F502-W535 HydrophobicContact CE1-CG 4.41Å; F502-W535 HydrophobicContact CG-CB 4.33Å; F502-W535 HydrophobicContact CG-CD2 4.39Å; F502-W535 HydrophobicContact CG-CG 4.14Å; K503-W535 PolarHBondContact O-NE1 3.18Å; H505-W535 HydrophobicContact CB-CH2 3.76Å; H505-W535 HydrophobicContact CB-CZ2 3.75Å; H505-W535 AromaticContact CG-CH2 3.62Å; H505-W535 AromaticContact CG-CZ2 3.69Å; H505-W535 AromaticContact ND1-CH2 3.49Å; H505-W535 WeakPolarHBondContact ND1-CH2 3.37Å; H505-W535 AromaticContact ND1-CZ2 3.24Å; H505-W535 WeakPolarHBondContact ND1-CZ2 3.49Å; Y522-W535 VanDerWaalsContact CA-O 3.24Å; Y522-W535 WeakPolarHBondContact CA-O 3.48Å; V523-W535 HydrophobicContact CB-CE3 4.43Å; V523-W535 HydrophobicContact CG1-CE3 4.39Å; V523-W535 PolarHBondContact N-O 3.4Å; V523-W535 PolarHBondContact O-N 2.98Å; N533-W535 HydrophobicContact CB-CE3 4.4Å; N533-W535 HydrophobicContact CB-CH2 3.35Å; N533-W535 HydrophobicContact CB-CZ2 3.69Å; N533-W535 HydrophobicContact CB-CZ3 3.75Å; W535-W537 PolarHBondContact O-N 3.49Å; W535-K541 WeakPolarHBondContact CA-O 3.34Å; W535-L542 VanDerWaalsContact CD1-CA 3.48Å; W535-L542 HydrophobicContact CD2-CD1 4.12Å; W535-L542 HydrophobicContact CG-CD1 4.27Å; W535-L542 HydrophobicContact CZ2-CD1 4.14Å
536	D	95.9	Very high	94.1	Very high	14 Å²	14	50.3 Å²	50.3	8%	0.075	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	122.5	162	-172.8	1.5	0	0	0	110.6	F502 K538 T539 T540 K541 Y543	F502-D536 WeakPolarHBondContact CE1-O 3.43Å; D536-K538 VanDerWaalsContact C-N 3.25Å; D536-K538 PolarHBondContact O-N 2.88Å; D536-K538 WeakPolarHBondContact OD1-CB 3.38Å; D536-K538 PolarHBondContact OD1-N 2.99Å; D536-T539 VanDerWaalsContact CB-OG1 3.31Å; D536-T539 WeakPolarHBondContact CB-OG1 3.45Å; D536-T539 VanDerWaalsContact CG-N 3.28Å; D536-T539 WeakPolarHBondContact OD2-CB 3.38Å; D536-T539 WeakPolarHBondContact OD2-CG2 3.05Å; D536-T539 PolarHBondContact OD2-N 3.4Å; D536-T539 PolarHBondContact OD2-OG1 2.61Å; D536-T540 WeakPolarHBondContact O-CA 3.46Å; D536-T540 PolarHBondContact O-N 2.82Å; D536-K541 PolarHBondContact N-O 3.19Å; D536-Y543 HydrophobicContact CB-CD2 3.55Å; D536-Y543 HydrophobicContact CB-CE2 3.36Å; D536-Y543 HydrophobicContact CB-CG 4.47Å
537	W	94.3	Very high	94.1	Very high	33 Å²	33	55.9 Å²	55.9	13%	0.125	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-36.4	170.3	176.5	-113.8	0	0	0	111.8	W475 I487 K500 F502 F516 M520 S521 V523 W535	W475-W537 HydrophobicContact CB-CH2 3.98Å; W475-W537 HydrophobicContact CB-CZ2 4.42Å; W475-W537 AromaticContact CD1-CZ2 3.6Å; W475-W537 HydrophobicContact CD2-CH2 4.08Å; W475-W537 HydrophobicContact CD2-CZ2 4.01Å; W475-W537 AromaticContact CE2-CZ2 3.98Å; W475-W537 AromaticContact CG-CH2 3.74Å; W475-W537 HydrophobicContact CG-CH2 3.74Å; W475-W537 AromaticContact CG-CZ2 3.75Å; W475-W537 HydrophobicContact CG-CZ2 3.75Å; W475-W537 AromaticContact NE1-CZ2 3.71Å; I487-W537 HydrophobicContact CD1-CH2 4.34Å; I487-W537 HydrophobicContact CD1-CZ3 3.84Å; I487-W537 HydrophobicContact CG1-CH2 4.14Å; I487-W537 HydrophobicContact CG1-CZ3 3.82Å; I487-W537 HydrophobicContact CG2-CH2 3.74Å; I487-W537 HydrophobicContact CG2-CZ3 4.3Å; K500-W537 WeakPolarHBondContact CE-O 3.45Å; K500-W537 PolarHBondContact NZ-O 2.95Å; F502-W537 HydrophobicContact CE2-CE3 4Å; F502-W537 AromaticContact CE2-CZ3 3.92Å; F502-W537 HydrophobicContact CE2-CZ3 3.92Å; F502-W537 AromaticContact CZ-CE3 3.55Å; F502-W537 HydrophobicContact CZ-CE3 3.55Å; F502-W537 AromaticContact CZ-CZ3 3.93Å; F502-W537 HydrophobicContact CZ-CZ3 3.93Å; F516-W537 HydrophobicContact CD1-CE3 4.47Å; F516-W537 AromaticContact CE1-CE3 3.82Å; F516-W537 HydrophobicContact CE1-CE3 3.82Å; F516-W537 HydrophobicContact CE1-CH2 4.17Å; F516-W537 AromaticContact CE1-CZ3 3.57Å; F516-W537 HydrophobicContact CE1-CZ3 3.57Å; F516-W537 HydrophobicContact CZ-CZ3 4.26Å; M520-W537 HydrophobicContact CE-CD2 4.07Å; M520-W537 HydrophobicContact CE-CE3 4.44Å; M520-W537 HydrophobicContact CE-CH2 4.03Å; M520-W537 HydrophobicContact CE-CZ2 3.62Å; M520-W537 HydrophobicContact CE-CZ3 4.43Å; M520-W537 WeakPolarHBondContact O-CB 3.45Å; S521-W537 WeakPolarHBondContact O-CB 3.49Å; S521-W537 PolarHBondContact O-N 2.83Å; V523-W537 HydrophobicContact CG2-CE3 3.7Å; V523-W537 HydrophobicContact CG2-CZ3 4.34Å; W535-W537 PolarHBondContact O-N 3.49Å
538	K	92.8	Very high	94.1	Very high	175 Å²	175	55.8 Å²	55.8	76%	0.761	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-53.2	-174.7	-169.5	173.8	-179.3	177.1	0	112.5	K500 D536	K500-K538 PolarHBondContact NZ-O 2.84Å; D536-K538 VanDerWaalsContact C-N 3.25Å; D536-K538 PolarHBondContact O-N 2.88Å; D536-K538 WeakPolarHBondContact OD1-CB 3.38Å; D536-K538 PolarHBondContact OD1-N 2.99Å
539	T	92.3	Very high	94.2	Very high	77 Å²	77	55.2 Å²	55.2	47%	0.472	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-8.4	-179.4	65.2	0	0	0	0	114.8	D536 K541	D536-T539 VanDerWaalsContact CB-OG1 3.31Å; D536-T539 WeakPolarHBondContact CB-OG1 3.45Å; D536-T539 VanDerWaalsContact CG-N 3.28Å; D536-T539 WeakPolarHBondContact OD2-CB 3.38Å; D536-T539 WeakPolarHBondContact OD2-CG2 3.05Å; D536-T539 PolarHBondContact OD2-N 3.4Å; D536-T539 PolarHBondContact OD2-OG1 2.61Å; T539-K541 PolarHBondContact O-N 3.12Å; T539-K541 VanDerWaalsContact O-N 3.11Å
540	T	92.7	Very high	94.2	Very high	43 Å²	43	57.2 Å²	57.2	26%	0.264	27%	0.265	S	S	.	.			trans	61.9	5.6	-174.3	65	0	0	0	0	115.7	K500 F502 D536	K500-T540 HydrophobicContact CD-CG2 3.54Å; F502-T540 HydrophobicContact CE1-CG2 3.98Å; F502-T540 HydrophobicContact CZ-CG2 4.24Å; D536-T540 WeakPolarHBondContact O-CA 3.46Å; D536-T540 PolarHBondContact O-N 2.82Å
541	K	93.7	Very high	94.3	Very high	144 Å²	144	63.1 Å²	63.1	63%	0.626	29%	0.29	S	S	*	.			trans	-77.1	140	179.2	-167.9	175.3	-180	179.3	0	110.3	W535 D536 T539 Y543	W535-K541 WeakPolarHBondContact CA-O 3.34Å; D536-K541 PolarHBondContact N-O 3.19Å; T539-K541 PolarHBondContact O-N 3.12Å; T539-K541 VanDerWaalsContact O-N 3.11Å; K541-Y543 PolarHBondContact O-N 2.89Å
542	L	95.3	Very high	94.2	Very high	41 Å²	41	59.8 Å²	59.8	22%	0.215	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	112.8	166.9	-178.7	67.7	0	0	0	108.2	N533 W535 R545	N533-L542 HydrophobicContact CB-CD1 3.75Å; W535-L542 VanDerWaalsContact CD1-CA 3.48Å; W535-L542 HydrophobicContact CD2-CD1 4.12Å; W535-L542 HydrophobicContact CG-CD1 4.27Å; W535-L542 HydrophobicContact CZ2-CD1 4.14Å; L542-R545 HydrophobicContact CD2-CB 4.3Å
543	Y	92.3	Very high	94.2	Very high	134 Å²	134	59.8 Å²	59.8	53%	0.525	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-49.4	-178.4	-99.3	-38.5	0	0	0	112	Y522 I534 D536 K541	Y522-Y543 HydrophobicContact CD1-CD2 4.31Å; Y522-Y543 AromaticContact CE1-CD2 3.93Å; Y522-Y543 HydrophobicContact CE1-CD2 3.93Å; Y522-Y543 HydrophobicContact CE1-CE2 4.14Å; I534-Y543 PolarHBondContact O-N 2.89Å; D536-Y543 HydrophobicContact CB-CD2 3.55Å; D536-Y543 HydrophobicContact CB-CE2 3.36Å; D536-Y543 HydrophobicContact CB-CG 4.47Å; K541-Y543 PolarHBondContact O-N 2.89Å
544	S	91.7	Very high	94.1	Very high	36 Å²	36	60.1 Å²	60.1	25%	0.252	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	146.5	-178	-170.9	0	0	0	0	110.7	I534	I534-S544 PolarHBondContact N-O 3.25Å; I534-S544 PolarHBondContact O-N 2.9Å; I534-S544 VanDerWaalsContact O-N 3.15Å
545	R	94.1	Very high	93.9	Very high	143 Å²	143	60.1 Å²	60.1	54%	0.54	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	111.2	177.2	171.8	170.7	58.2	-168.6	-3.4	108.2	K531 L532 N533 L542	K531-R545 HydrophobicContact CB-CG 4.48Å; K531-R545 HydrophobicContact CD-CG 4.14Å; L532-R545 WeakPolarHBondContact O-CA 3.01Å; N533-R545 WeakPolarHBondContact OD1-CB 3.33Å; N533-R545 WeakPolarHBondContact OD1-CD 3.29Å; N533-R545 WeakPolarHBondContact OD1-CG 3.17Å; L542-R545 HydrophobicContact CD2-CB 4.3Å
546	F	93.8	Very high	93.8	Very high	42 Å²	42	60.1 Å²	60.1	18%	0.184	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	157.9	176.5	62.5	-95.4	0	0	0	110.7	K531 L532 I534 A548 W578	K531-F546 CarbonylContact C-O 3.5Å; K531-F546 VanDerWaalsContact CA-O 3.23Å; K531-F546 WeakPolarHBondContact CA-O 3.48Å; K531-F546 WeakPolarHBondContact CB-O 3.24Å; L532-F546 HydrophobicContact CB-CE1 4.44Å; L532-F546 HydrophobicContact CB-CE2 4.17Å; L532-F546 HydrophobicContact CB-CZ 4.09Å; L532-F546 HydrophobicContact CD2-CE1 3.96Å; L532-F546 HydrophobicContact CD2-CE2 4.31Å; L532-F546 HydrophobicContact CD2-CZ 3.54Å; L532-F546 HydrophobicContact CG-CZ 4.39Å; L532-F546 PolarHBondContact N-O 2.67Å; L532-F546 PolarHBondContact O-N 3.2Å; I534-F546 HydrophobicContact CD1-CE1 4.21Å; F546-A548 HydrophobicContact CD2-CB 4.49Å; F546-A548 HydrophobicContact CE2-CB 4.18Å; F546-A548 PolarHBondContact O-N 2.93Å; F546-W578 HydrophobicContact CD2-CE3 4.27Å; F546-W578 HydrophobicContact CD2-CH2 4.19Å; F546-W578 AromaticContact CD2-CZ3 3.98Å; F546-W578 HydrophobicContact CD2-CZ3 3.98Å; F546-W578 AromaticContact CE2-CD2 3.59Å; F546-W578 HydrophobicContact CE2-CD2 3.59Å; F546-W578 AromaticContact CE2-CE2 3.82Å; F546-W578 AromaticContact CE2-CE3 3.44Å; F546-W578 HydrophobicContact CE2-CE3 3.44Å; F546-W578 VanDerWaalsContact CE2-CE3 3.44Å; F546-W578 HydrophobicContact CE2-CG 4.3Å; F546-W578 AromaticContact CE2-CH2 3.84Å; F546-W578 HydrophobicContact CE2-CH2 3.84Å; F546-W578 AromaticContact CE2-CZ2 3.97Å; F546-W578 HydrophobicContact CE2-CZ2 3.97Å; F546-W578 AromaticContact CE2-CZ3 3.56Å; F546-W578 HydrophobicContact CE2-CZ3 3.56Å; F546-W578 AromaticContact CZ-CD2 3.93Å; F546-W578 HydrophobicContact CZ-CD2 3.93Å; F546-W578 AromaticContact CZ-CE3 3.92Å; F546-W578 HydrophobicContact CZ-CE3 3.92Å; F546-W578 HydrophobicContact CZ-CG 4.21Å; F546-W578 HydrophobicContact CZ-CZ3 4.45Å
547	K	94.5	Very high	93.9	Very high	118 Å²	118	60 Å²	60	51%	0.513	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	114.9	176.6	-173.8	178.5	172.9	-172.8	0	108.6	H549 D550	K547-H549 WeakPolarHBondContact CE-O 3.19Å; K547-H549 WeakPolarHBondContact CG-O 3.47Å; K547-D550 WeakPolarHBondContact CE-OD1 3.24Å; K547-D550 IonicContact NZ-OD1 2.62Å; K547-D550 PolarHBondContact NZ-OD1 3.25Å
548	A	93.1	Very high	93.9	Very high	2 Å²	2	58.8 Å²	58.8	2%	0.017	27%	0.273	C	S	.	.			trans	-93.3	-47.6	-179.3	0	0	0	0	0	111.4	G530 L532 F546 K576 W578	G530-A548 PolarHBondContact O-N 2.94Å; L532-A548 HydrophobicContact CB-CB 4.15Å; F546-A548 HydrophobicContact CD2-CB 4.49Å; F546-A548 HydrophobicContact CE2-CB 4.18Å; F546-A548 PolarHBondContact O-N 2.93Å; A548-K576 WeakPolarHBondContact O-CD 3.24Å; A548-K576 WeakPolarHBondContact O-CE 3.49Å; A548-K576 PolarHBondContact O-NZ 3.19Å; A548-W578 VanDerWaalsContact CA-CZ2 3.42Å; A548-W578 HydrophobicContact CB-CH2 4.36Å; A548-W578 HydrophobicContact CB-CZ2 3.6Å
549	H	95.1	Very high	94	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	24%	0.237	C	C	.	.			trans	-122.7	158.8	-176.7	-70.9	-89.5	0	0	0	111.1	G530 K547 K551 T568 G570 D572 L574	G530-H549 PolarHBondContact O-N 2.67Å; K547-H549 WeakPolarHBondContact CE-O 3.19Å; K547-H549 WeakPolarHBondContact CG-O 3.47Å; H549-K551 VanDerWaalsContact CB-O 3.29Å; H549-K551 WeakPolarHBondContact CB-O 3.16Å; H549-T568 PolarHBondContact CD2-OG1 2.99Å; H549-T568 WeakPolarHBondContact NE2-CB 3.15Å; H549-T568 PolarHBondContact NE2-O 2.79Å; H549-T568 PolarHBondContact NE2-OG1 2.97Å; H549-G570 PolarHBondContact CE1-N 3.42Å; H549-D572 WeakPolarHBondContact CB-OD2 3.41Å; H549-D572 IonicContact CE1-OD1 3.52Å; H549-D572 IonicContact CE1-OD2 2.93Å; H549-D572 IonicContact CG-OD1 2.82Å; H549-D572 IonicContact CG-OD2 2.59Å; H549-D572 VanDerWaalsContact ND1-CG 3.28Å; H549-D572 IonicContact ND1-OD1 2.8Å; H549-D572 PolarHBondContact ND1-OD1 3.39Å; H549-D572 IonicContact ND1-OD2 2.7Å; H549-D572 PolarHBondContact ND1-OD2 2.92Å; H549-L574 PolarHBondContact CE1-O 3.03Å; H549-L574 VanDerWaalsContact CE1-O 3.27Å
550	D	93.3	Very high	94	Very high	120 Å²	120	49 Å²	49	64%	0.642	23%	0.229	S	C	*	.	S	Bend	trans	-82.5	-23.4	175.6	-77.8	-48.2	0	0	0	113.2	K547	K547-D550 WeakPolarHBondContact CE-OD1 3.24Å; K547-D550 IonicContact NZ-OD1 2.62Å; K547-D550 PolarHBondContact NZ-OD1 3.25Å
551	K	93.8	Very high	93.9	Very high	123 Å²	123	47.7 Å²	47.7	54%	0.535	22%	0.22	S	C	.	.	S	Bend	trans	-111.3	-179.6	168.8	-59.7	-175.2	-167.8	168.1	0	109.8	G530 H549 C553 W571 D572	G530-K551 WeakPolarHBondContact CA-O 3.41Å; H549-K551 VanDerWaalsContact CB-O 3.29Å; H549-K551 WeakPolarHBondContact CB-O 3.16Å; K551-C553 PolarHBondContact O-N 2.91Å; K551-W571 HydrophobicContact CB-CB 4.1Å; K551-W571 HydrophobicContact CD-CB 4.36Å; K551-W571 WeakPolarHBondContact CD-O 3.32Å; K551-D572 HydrophobicContact CB-CB 4.4Å; K551-D572 HydrophobicContact CD-CB 4.49Å; K551-D572 HydrophobicContact CG-CB 4.35Å
552	V	94.1	Very high	93.7	Very high	9 Å²	9	42 Å²	42	6%	0.055	20%	0.195	C	C	.	.			trans	-39.3	127.8	172.9	-176.8	0	0	0	0	111.8	Y510 G528 I554 G570 W571	Y510-V552 HydrophobicContact CD1-CB 4.49Å; Y510-V552 HydrophobicContact CD1-CG1 3.78Å; Y510-V552 HydrophobicContact CD1-CG2 4Å; Y510-V552 HydrophobicContact CD2-CG1 4.48Å; Y510-V552 HydrophobicContact CE1-CB 4.43Å; Y510-V552 HydrophobicContact CE1-CG1 4.18Å; Y510-V552 HydrophobicContact CE1-CG2 3.49Å; Y510-V552 VanDerWaalsContact CE1-CG2 3.49Å; Y510-V552 HydrophobicContact CE2-CG2 4.2Å; Y510-V552 HydrophobicContact CG-CG1 3.95Å; G528-V552 WeakPolarHBondContact O-CG2 3.27Å; V552-I554 HydrophobicContact CG1-CD1 3.51Å; V552-I554 HydrophobicContact CG1-CG1 4.01Å; V552-G570 CarbonylContact O-C 3.55Å; V552-G570 WeakPolarHBondContact O-CA 3.39Å; V552-W571 HydrophobicContact CB-CB 4.48Å; V552-W571 HydrophobicContact CB-CD2 4.22Å; V552-W571 HydrophobicContact CB-CE3 4.3Å; V552-W571 HydrophobicContact CB-CG 4.32Å; V552-W571 HydrophobicContact CG2-CD2 4.44Å; V552-W571 HydrophobicContact CG2-CE3 4.01Å; V552-W571 HydrophobicContact CG2-CZ3 4.39Å; V552-W571 PolarHBondContact O-N 3.21Å
553	C	95.5	Very high	93.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	112.7	171.4	-176.3	0	0	0	0	107.8	C512 G526 D527 K551	C512-C553 PolarHBondContact SG-O 3.39Å; C512-C553 VanDerWaalsContact SG-O 3.36Å; G526-C553 CarbonylContact C-O 3.51Å; G526-C553 WeakPolarHBondContact CA-O 3.49Å; D527-C553 PolarHBondContact N-O 2.88Å; D527-C553 PolarHBondContact O-N 3.38Å; K551-C553 PolarHBondContact O-N 2.91Å
554	I	94.1	Very high	93.6	Very high	8 Å²	8	36.6 Å²	36.6	4%	0.041	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	-63.3	-176	-66.3	-65.4	0	0	0	110.2	S292 C512 Q513 V552 C569 W571	S292-I554 WeakPolarHBondContact O-CG2 3.48Å; C512-I554 CarbonylContact C-O 3.56Å; C512-I554 WeakPolarHBondContact CA-O 3.33Å; C512-I554 WeakPolarHBondContact CB-O 3.25Å; Q513-I554 PolarHBondContact N-O 3.45Å; V552-I554 HydrophobicContact CG1-CD1 3.51Å; V552-I554 HydrophobicContact CG1-CG1 4.01Å; I554-C569 PolarHBondContact N-O 3.12Å; I554-W571 HydrophobicContact CD1-CZ2 4.26Å; I554-W571 HydrophobicContact CG1-CG 4.43Å; I554-W571 VanDerWaalsContact CG1-NE1 3.29Å
555	G	92.8	Very high	93.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	129.5	-178.7	0	0	0	0	0	110.2	T568 C569	G555-T568 CarbonylContact O-C 3.59Å; G555-T568 WeakPolarHBondContact O-CA 3.39Å; G555-C569 VanDerWaalsContact CA-SG 3.54Å; G555-C569 PolarHBondContact N-O 3.38Å; G555-C569 VanDerWaalsContact N-O 3.16Å; G555-C569 PolarHBondContact N-SG 3.28Å; G555-C569 VanDerWaalsContact N-SG 3.41Å; G555-C569 PolarHBondContact O-N 3.39Å
556	A	95.8	Very high	93.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	124.1	161.6	0	0	0	0	0	106.8	I524 L532 I567	I524-A556 HydrophobicContact CD1-CB 4.03Å; I524-A556 HydrophobicContact CG1-CB 4.26Å; L532-A556 HydrophobicContact CD1-CB 3.75Å; A556-I567 WeakPolarHBondContact CA-O 3.28Å
557	V	96.1	Very high	93.9	Very high	11 Å²	11	27.1 Å²	27.1	7%	0.067	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	129.9	-178.7	177	0	0	0	0	108.9	V294 L296 D515 V566 I567	V294-V557 HydrophobicContact CG1-CG2 3.85Å; L296-V557 HydrophobicContact CD1-CG1 3.7Å; L296-V557 HydrophobicContact CG-CG1 3.94Å; D515-V557 VanDerWaalsContact OD2-CA 3.31Å; D515-V557 WeakPolarHBondContact OD2-CA 3.34Å; V557-V566 WeakPolarHBondContact O-CA 3.49Å; V557-I567 PolarHBondContact N-O 3.09Å; V557-I567 PolarHBondContact O-N 2.9Å
558	W	95.8	Very high	94.1	Very high	7 Å²	7	21.5 Å²	21.5	3%	0.027	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	138.9	172.1	-153.6	-64.7	0	0	0	109.5	C274 Y275 D515 F516 Y522 I524 E562 T563 V566	C274-W558 HydrophobicContact CB-CZ2 3.91Å; Y275-W558 WeakPolarHBondContact O-CH2 3.23Å; Y275-W558 WeakPolarHBondContact O-CZ2 3.41Å; D515-W558 PolarHBondContact OD2-N 2.88Å; F516-W558 WeakPolarHBondContact O-CB 3.47Å; Y522-W558 AromaticContact CD2-CH2 3.72Å; Y522-W558 HydrophobicContact CD2-CH2 3.72Å; Y522-W558 HydrophobicContact CD2-CZ2 4.41Å; Y522-W558 HydrophobicContact CD2-CZ3 4.26Å; Y522-W558 HydrophobicContact CG-CH2 4.35Å; Y522-W558 HydrophobicContact CG-CZ3 4.49Å; I524-W558 HydrophobicContact CD1-CB 4.24Å; I524-W558 HydrophobicContact CD1-CE3 4Å; I524-W558 HydrophobicContact CG1-CE3 4.35Å; I524-W558 HydrophobicContact CG2-CE3 3.61Å; I524-W558 HydrophobicContact CG2-CZ3 3.5Å; I524-W558 VanDerWaalsContact CG2-CZ3 3.5Å; W558-E562 PolarHBondContact NE1-O 2.8Å; W558-T563 WeakPolarHBondContact CZ2-O 3.03Å; W558-V566 HydrophobicContact CD2-CG2 3.7Å; W558-V566 HydrophobicContact CE3-CG2 3.65Å; W558-V566 HydrophobicContact CG-CG2 4.22Å; W558-V566 HydrophobicContact CH2-CG2 4.29Å; W558-V566 HydrophobicContact CZ2-CG2 4.35Å; W558-V566 HydrophobicContact CZ3-CG2 3.96Å
559	H	94.6	Very high	94.2	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.111	C	C	.	.			trans	-71.1	124.8	177.3	-172.7	-85.6	0	0	0	110.9	L296 G301 Y319 P518 H561 E562 K565	L296-H559 HydrophobicContact CD1-CB 4.49Å; G301-H559 PolarHBondContact O-NE2 3.13Å; Y319-H559 AromaticContact CE2-NE2 3.81Å; Y319-H559 AromaticContact CZ-NE2 3.85Å; Y319-H559 PolarHBondContact OH-CE1 3.25Å; Y319-H559 PolarHBondContact OH-ND1 2.62Å; Y319-H559 PolarHBondContact OH-NE2 3.04Å; P518-H559 WeakPolarHBondContact CG-O 3.47Å; H559-H561 VanDerWaalsContact C-N 3.26Å; H559-H561 AromaticContact CE1-CD2 3.97Å; H559-H561 PolarHBondContact ND1-N 2.75Å; H559-H561 PolarHBondContact O-N 2.96Å; H559-H561 VanDerWaalsContact O-N 3.12Å; H559-E562 HydrophobicContact CB-CB 4.16Å; H559-E562 PolarHBondContact ND1-N 3.38Å; H559-E562 IonicContact ND1-OE2 2.73Å; H559-E562 PolarHBondContact O-N 2.88Å; H559-K565 HydrophobicContact CB-CB 3.98Å; H559-K565 WeakPolarHBondContact CB-O 3.49Å; H559-K565 PolarHBondContact N-O 3.21Å
560	P	91.3	Very high	94.2	Very high	47 Å²	47	21.3 Å²	21.3	31%	0.305	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-31.5	-168.1	21.9	-33.5	0	0	0	114.3	P518	P518-P560 WeakPolarHBondContact CB-O 3.07Å; P518-P560 WeakPolarHBondContact CG-O 3.1Å
561	H	90.7	Very high	94.2	Very high	16 Å²	16	20 Å²	20	7%	0.074	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-15.1	-176.8	-56.3	-51.7	0	0	0	114.8	V263 L265 S267 L299 S300 H559	V263-H561 HydrophobicContact CG1-CB 3.99Å; L265-H561 HydrophobicContact CD2-CB 4.08Å; L265-H561 PolarHBondContact O-NE2 2.79Å; S267-H561 PolarHBondContact O-CE1 2.83Å; S267-H561 PolarHBondContact O-ND1 2.9Å; L299-H561 PolarHBondContact O-CE1 2.83Å; L299-H561 VanDerWaalsContact O-CE1 3.28Å; L299-H561 PolarHBondContact O-NE2 2.91Å; S300-H561 WeakPolarHBondContact CA-NE2 3.46Å; S300-H561 PolarHBondContact O-CD2 2.71Å; H559-H561 VanDerWaalsContact C-N 3.26Å; H559-H561 AromaticContact CE1-CD2 3.97Å; H559-H561 PolarHBondContact ND1-N 2.75Å; H559-H561 PolarHBondContact O-N 2.96Å; H559-H561 VanDerWaalsContact O-N 3.12Å
562	E	90.5	Very high	94.2	Very high	23 Å²	23	15.9 Å²	15.9	11%	0.107	8%	0.081	C	C	.	.			trans	-110	138.8	-170	-72.2	-169.8	127.8	0	0	111.7	V263 Y319 W558 H559 S564 K565	V263-E562 HydrophobicContact CG1-CG 4.44Å; V263-E562 HydrophobicContact CG2-CG 4.38Å; Y319-E562 PolarHBondContact OH-OE2 3Å; W558-E562 PolarHBondContact NE1-O 2.8Å; H559-E562 HydrophobicContact CB-CB 4.16Å; H559-E562 PolarHBondContact ND1-N 3.38Å; H559-E562 IonicContact ND1-OE2 2.73Å; H559-E562 PolarHBondContact O-N 2.88Å; E562-S564 PolarHBondContact O-N 2.57Å; E562-K565 HydrophobicContact CB-CB 4.12Å; E562-K565 HydrophobicContact CB-CG 4.15Å; E562-K565 IonicContact OE1-NZ 3.32Å; E562-K565 PolarHBondContact OE1-NZ 2.9Å; E562-K565 WeakPolarHBondContact OE2-CD 3.1Å; E562-K565 WeakPolarHBondContact OE2-CE 3.32Å; E562-K565 WeakPolarHBondContact OE2-CG 3.12Å; E562-K565 IonicContact OE2-NZ 4Å; E562-K565 PolarHBondContact OE2-NZ 3.15Å
563	T	91.7	Very high	94.2	Very high	53 Å²	53	15.6 Å²	15.6	33%	0.325	8%	0.08	S	C	.	.	S	Bend	trans	-71.5	-31.6	-166.7	55.1	0	0	0	0	113.9	P271 K273 C274 Y275 W558	P271-T563 HydrophobicContact CB-CG2 3.71Å; P271-T563 HydrophobicContact CG-CG2 4.24Å; K273-T563 WeakPolarHBondContact O-CB 3.48Å; K273-T563 WeakPolarHBondContact O-CG2 3.39Å; C274-T563 CarbonylContact C-O 3.56Å; C274-T563 WeakPolarHBondContact CA-O 3.22Å; C274-T563 VanDerWaalsContact CB-O 3.24Å; C274-T563 WeakPolarHBondContact CB-O 3.15Å; Y275-T563 PolarHBondContact N-O 3.11Å; W558-T563 WeakPolarHBondContact CZ2-O 3.03Å
564	S	93.1	Very high	94.2	Very high	9 Å²	9	17.8 Å²	17.8	6%	0.063	9%	0.091	C	C	.	.	S	Bend	trans	-118.4	-17.7	-173.8	-155.9	0	0	0	0	113.6	P277 E562 V566 D579	P277-S564 WeakPolarHBondContact CA-OG 3.31Å; P277-S564 WeakPolarHBondContact CB-O 3.4Å; P277-S564 WeakPolarHBondContact CD-O 3.16Å; E562-S564 PolarHBondContact O-N 2.57Å; S564-V566 PolarHBondContact O-N 2.84Å; S564-D579 WeakPolarHBondContact CB-OXT 3.16Å; S564-D579 PolarHBondContact OG-OXT 2.92Å
565	K	94.2	Very high	94.3	Very high	22 Å²	22	17.4 Å²	17.4	10%	0.096	9%	0.089	C	C	.	.			trans	-75.8	119.2	-166.4	-63.9	-134.3	-165.5	101.4	0	112.7	I281 H559 E562 L577 W578 D579	I281-K565 HydrophobicContact CD1-CD 4.09Å; H559-K565 HydrophobicContact CB-CB 3.98Å; H559-K565 WeakPolarHBondContact CB-O 3.49Å; H559-K565 PolarHBondContact N-O 3.21Å; E562-K565 HydrophobicContact CB-CB 4.12Å; E562-K565 HydrophobicContact CB-CG 4.15Å; E562-K565 IonicContact OE1-NZ 3.32Å; E562-K565 PolarHBondContact OE1-NZ 2.9Å; E562-K565 WeakPolarHBondContact OE2-CD 3.1Å; E562-K565 WeakPolarHBondContact OE2-CE 3.32Å; E562-K565 WeakPolarHBondContact OE2-CG 3.12Å; E562-K565 IonicContact OE2-NZ 4Å; E562-K565 PolarHBondContact OE2-NZ 3.15Å; K565-L577 HydrophobicContact CB-CD1 4.33Å; K565-L577 HydrophobicContact CD-CD1 3.96Å; K565-L577 HydrophobicContact CD-CD2 4.19Å; K565-L577 HydrophobicContact CD-CG 4.31Å; K565-W578 VanDerWaalsContact CA-O 3.27Å; K565-W578 WeakPolarHBondContact CA-O 3.33Å; K565-D579 HydrophobicContact CD-CB 4.38Å; K565-D579 HydrophobicContact CG-CB 4.24Å
566	V	96.3	Very high	94.5	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	136.1	175.3	177.5	0	0	0	0	109.4	P277 I524 L532 V557 W558 S564 T568 W578	P277-V566 HydrophobicContact CG-CB 4.16Å; P277-V566 HydrophobicContact CG-CG2 3.92Å; I524-V566 HydrophobicContact CD1-CG1 3.53Å; I524-V566 HydrophobicContact CD1-CG2 4.15Å; L532-V566 HydrophobicContact CD2-CG1 3.98Å; V557-V566 WeakPolarHBondContact O-CA 3.49Å; W558-V566 HydrophobicContact CD2-CG2 3.7Å; W558-V566 HydrophobicContact CE3-CG2 3.65Å; W558-V566 HydrophobicContact CG-CG2 4.22Å; W558-V566 HydrophobicContact CH2-CG2 4.29Å; W558-V566 HydrophobicContact CZ2-CG2 4.35Å; W558-V566 HydrophobicContact CZ3-CG2 3.96Å; S564-V566 PolarHBondContact O-N 2.84Å; V566-T568 HydrophobicContact CG1-CG2 4.17Å; V566-W578 PolarHBondContact N-O 3.02Å; V566-W578 PolarHBondContact O-N 2.9Å
567	I	96.8	Very high	94.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	126.5	176.5	-57.9	175.5	0	0	0	109	W284 L296 L304 V318 A556 V557 I575 K576 L577	W284-I567 HydrophobicContact CH2-CD1 4.2Å; W284-I567 HydrophobicContact CH2-CG1 4.47Å; W284-I567 HydrophobicContact CZ3-CG1 4.46Å; W284-I567 HydrophobicContact CZ3-CG2 3.94Å; L296-I567 HydrophobicContact CD2-CD1 3.74Å; L296-I567 HydrophobicContact CG-CD1 4.47Å; L304-I567 HydrophobicContact CD1-CD1 3.72Å; L304-I567 HydrophobicContact CD1-CG2 3.65Å; V318-I567 HydrophobicContact CG1-CD1 4.34Å; V318-I567 HydrophobicContact CG2-CD1 4.41Å; A556-I567 WeakPolarHBondContact CA-O 3.28Å; V557-I567 PolarHBondContact N-O 3.09Å; V557-I567 PolarHBondContact O-N 2.9Å; I567-I575 HydrophobicContact CG2-CG2 3.55Å; I567-K576 WeakPolarHBondContact CA-O 3.37Å; I567-L577 HydrophobicContact CD1-CD1 4.21Å; I567-L577 HydrophobicContact CG1-CD1 3.58Å
568	T	96.8	Very high	94.5	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	144.8	177.4	66	0	0	0	0	111.5	L532 H549 G555 V566 I575 K576 W578	L532-T568 HydrophobicContact CD1-CG2 3.88Å; L532-T568 HydrophobicContact CD2-CG2 4.11Å; L532-T568 HydrophobicContact CG-CG2 4.43Å; H549-T568 PolarHBondContact CD2-OG1 2.99Å; H549-T568 WeakPolarHBondContact NE2-CB 3.15Å; H549-T568 PolarHBondContact NE2-O 2.79Å; H549-T568 PolarHBondContact NE2-OG1 2.97Å; G555-T568 CarbonylContact O-C 3.59Å; G555-T568 WeakPolarHBondContact O-CA 3.39Å; V566-T568 HydrophobicContact CG1-CG2 4.17Å; T568-I575 CarbonylContact O-C 3.38Å; T568-I575 VanDerWaalsContact O-CA 3.31Å; T568-I575 WeakPolarHBondContact O-CA 3.44Å; T568-I575 WeakPolarHBondContact O-CG2 3.38Å; T568-K576 PolarHBondContact N-O 3.07Å; T568-K576 PolarHBondContact O-N 2.85Å; T568-W578 PolarHBondContact OG1-NE1 2.97Å
569	C	95.9	Very high	94.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	141.3	172	78.8	0	0	0	0	112	V291 V294 I554 G555 I575	V291-C569 HydrophobicContact CB-CB 3.88Å; V291-C569 HydrophobicContact CG1-CB 3.7Å; V294-C569 HydrophobicContact CB-CB 4.36Å; V294-C569 HydrophobicContact CG1-CB 4.35Å; I554-C569 PolarHBondContact N-O 3.12Å; G555-C569 VanDerWaalsContact CA-SG 3.54Å; G555-C569 PolarHBondContact N-O 3.38Å; G555-C569 VanDerWaalsContact N-O 3.16Å; G555-C569 PolarHBondContact N-SG 3.28Å; G555-C569 VanDerWaalsContact N-SG 3.41Å; G555-C569 PolarHBondContact O-N 3.39Å; C569-I575 HydrophobicContact CB-CB 4.46Å; C569-I575 HydrophobicContact CB-CG1 4.05Å; C569-I575 HydrophobicContact CB-CG2 4.2Å
570	G	94.4	Very high	94.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	168.7	-173.2	0	0	0	0	0	114.8	V291 H549 V552 D572 G573 L574	V291-G570 PolarHBondContact N-O 2.85Å; H549-G570 PolarHBondContact CE1-N 3.42Å; V552-G570 CarbonylContact O-C 3.55Å; V552-G570 WeakPolarHBondContact O-CA 3.39Å; G570-D572 WeakPolarHBondContact CA-OD1 3.28Å; G570-D572 PolarHBondContact O-N 3.13Å; G570-G573 PolarHBondContact O-N 2.85Å; G570-G573 VanDerWaalsContact O-N 3.17Å; G570-L574 PolarHBondContact N-O 2.74Å
571	W	94.4	Very high	94.4	Very high	92 Å²	92	20.7 Å²	20.7	35%	0.348	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-2.7	171.6	-76.4	6.8	0	0	0	113.8	G290 M309 Y510 K551 V552 I554	G290-W571 WeakPolarHBondContact CA-O 3.48Å; M309-W571 HydrophobicContact CE-CD2 4.16Å; M309-W571 HydrophobicContact CE-CG 4.36Å; M309-W571 HydrophobicContact CE-CZ2 4.01Å; Y510-W571 AromaticContact CD1-CH2 3.88Å; Y510-W571 HydrophobicContact CD1-CH2 3.88Å; Y510-W571 HydrophobicContact CD1-CZ2 4.3Å; Y510-W571 HydrophobicContact CD1-CZ3 4.27Å; Y510-W571 HydrophobicContact CE1-CE3 4.47Å; Y510-W571 AromaticContact CE1-CH2 3.71Å; Y510-W571 HydrophobicContact CE1-CH2 3.71Å; Y510-W571 AromaticContact CE1-CZ3 3.69Å; Y510-W571 HydrophobicContact CE1-CZ3 3.69Å; K551-W571 HydrophobicContact CB-CB 4.1Å; K551-W571 HydrophobicContact CD-CB 4.36Å; K551-W571 WeakPolarHBondContact CD-O 3.32Å; V552-W571 HydrophobicContact CB-CB 4.48Å; V552-W571 HydrophobicContact CB-CD2 4.22Å; V552-W571 HydrophobicContact CB-CE3 4.3Å; V552-W571 HydrophobicContact CB-CG 4.32Å; V552-W571 HydrophobicContact CG2-CD2 4.44Å; V552-W571 HydrophobicContact CG2-CE3 4.01Å; V552-W571 HydrophobicContact CG2-CZ3 4.39Å; V552-W571 PolarHBondContact O-N 3.21Å; I554-W571 HydrophobicContact CD1-CZ2 4.26Å; I554-W571 HydrophobicContact CG1-CG 4.43Å; I554-W571 VanDerWaalsContact CG1-NE1 3.29Å
572	D	93.7	Very high	94.6	Very high	37 Å²	37	21 Å²	21	20%	0.198	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-12.3	167.2	57.7	2	0	0	0	112.9	H549 K551 G570 L574	H549-D572 WeakPolarHBondContact CB-OD2 3.41Å; H549-D572 IonicContact CE1-OD1 3.52Å; H549-D572 IonicContact CE1-OD2 2.93Å; H549-D572 IonicContact CG-OD1 2.82Å; H549-D572 IonicContact CG-OD2 2.59Å; H549-D572 VanDerWaalsContact ND1-CG 3.28Å; H549-D572 IonicContact ND1-OD1 2.8Å; H549-D572 PolarHBondContact ND1-OD1 3.39Å; H549-D572 IonicContact ND1-OD2 2.7Å; H549-D572 PolarHBondContact ND1-OD2 2.92Å; K551-D572 HydrophobicContact CB-CB 4.4Å; K551-D572 HydrophobicContact CD-CB 4.49Å; K551-D572 HydrophobicContact CG-CB 4.35Å; G570-D572 WeakPolarHBondContact CA-OD1 3.28Å; G570-D572 PolarHBondContact O-N 3.13Å; D572-L574 VanDerWaalsContact C-N 3.32Å; D572-L574 PolarHBondContact OD1-N 3.39Å; D572-L574 VanDerWaalsContact OD1-N 3.15Å
573	G	93.6	Very high	94.8	Very high	2 Å²	2	20.9 Å²	20.9	2%	0.021	10%	0.102	C	C	.	.	S	Bend	trans	86.8	5.4	-179.9	0	0	0	0	0	113.4	K289 G570	K289-G573 WeakPolarHBondContact O-CA 3.42Å; G570-G573 PolarHBondContact O-N 2.85Å; G570-G573 VanDerWaalsContact O-N 3.17Å
574	L	95.9	Very high	95	Very high	46 Å²	46	18.9 Å²	18.9	24%	0.241	9%	0.089	C	C	.	.			trans	-99.3	151	178.9	-56.6	-179.1	0	0	0	110.7	V283 H549 G570 D572	V283-L574 HydrophobicContact CG1-CB 4.32Å; V283-L574 HydrophobicContact CG1-CD1 4.22Å; V283-L574 HydrophobicContact CG1-CD2 3.85Å; V283-L574 HydrophobicContact CG1-CG 4.35Å; H549-L574 PolarHBondContact CE1-O 3.03Å; H549-L574 VanDerWaalsContact CE1-O 3.27Å; G570-L574 PolarHBondContact N-O 2.74Å; D572-L574 VanDerWaalsContact C-N 3.32Å; D572-L574 PolarHBondContact OD1-N 3.39Å; D572-L574 VanDerWaalsContact OD1-N 3.15Å
575	I	96.6	Very high	95.2	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.005	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	132.2	165	-44.3	171.9	0	0	0	106.6	V283 W284 V291 L304 I567 T568 C569	V283-I575 WeakPolarHBondContact CA-O 3.47Å; W284-I575 HydrophobicContact CB-CB 4.16Å; W284-I575 HydrophobicContact CE3-CB 3.8Å; W284-I575 HydrophobicContact CE3-CG2 3.62Å; W284-I575 HydrophobicContact CZ3-CG2 4.01Å; W284-I575 PolarHBondContact N-O 2.78Å; W284-I575 PolarHBondContact O-N 2.91Å; V291-I575 HydrophobicContact CG1-CD1 4.47Å; V291-I575 HydrophobicContact CG1-CG1 4.44Å; V291-I575 HydrophobicContact CG2-CD1 4.45Å; V291-I575 HydrophobicContact CG2-CG1 3.97Å; L304-I575 HydrophobicContact CD1-CG2 4.34Å; L304-I575 HydrophobicContact CD2-CD1 3.96Å; I567-I575 HydrophobicContact CG2-CG2 3.55Å; T568-I575 CarbonylContact O-C 3.38Å; T568-I575 VanDerWaalsContact O-CA 3.31Å; T568-I575 WeakPolarHBondContact O-CA 3.44Å; T568-I575 WeakPolarHBondContact O-CG2 3.38Å; C569-I575 HydrophobicContact CB-CB 4.46Å; C569-I575 HydrophobicContact CB-CG1 4.05Å; C569-I575 HydrophobicContact CB-CG2 4.2Å
576	K	96.2	Very high	95.2	Very high	25 Å²	25	19.4 Å²	19.4	11%	0.109	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	134.5	-173.4	-67	179.8	171.3	-157.9	0	110.5	Q280 H282 V283 A548 I567 T568 W578	Q280-K576 HydrophobicContact CG-CB 4.28Å; Q280-K576 HydrophobicContact CG-CD 4.42Å; H282-K576 WeakPolarHBondContact O-CA 3.43Å; V283-K576 HydrophobicContact CG2-CG 4.48Å; A548-K576 WeakPolarHBondContact O-CD 3.24Å; A548-K576 WeakPolarHBondContact O-CE 3.49Å; A548-K576 PolarHBondContact O-NZ 3.19Å; I567-K576 WeakPolarHBondContact CA-O 3.37Å; T568-K576 PolarHBondContact N-O 3.07Å; T568-K576 PolarHBondContact O-N 2.85Å; K576-W578 HydrophobicContact CB-CZ2 4.04Å; K576-W578 HydrophobicContact CD-CH2 4.46Å; K576-W578 HydrophobicContact CD-CZ2 3.69Å
577	L	96.1	Very high	95.1	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	127.8	173.2	-178.3	67.3	0	0	0	109.3	Q280 I281 H282 W284 K565 I567	Q280-L577 CarbonylContact C-O 3.47Å; Q280-L577 WeakPolarHBondContact CA-O 3.21Å; I281-L577 HydrophobicContact CB-CD2 4.38Å; I281-L577 HydrophobicContact CD1-CD2 3.85Å; I281-L577 HydrophobicContact CD1-CG 4.09Å; I281-L577 PolarHBondContact N-O 3.05Å; H282-L577 HydrophobicContact CB-CB 4.1Å; H282-L577 PolarHBondContact O-N 2.83Å; W284-L577 HydrophobicContact CH2-CB 3.84Å; W284-L577 HydrophobicContact CH2-CD1 4.32Å; W284-L577 HydrophobicContact CH2-CD2 4.35Å; W284-L577 HydrophobicContact CH2-CG 4.4Å; W284-L577 HydrophobicContact CZ3-CB 3.82Å; K565-L577 HydrophobicContact CB-CD1 4.33Å; K565-L577 HydrophobicContact CD-CD1 3.96Å; K565-L577 HydrophobicContact CD-CD2 4.19Å; K565-L577 HydrophobicContact CD-CG 4.31Å; I567-L577 HydrophobicContact CD1-CD1 4.21Å; I567-L577 HydrophobicContact CG1-CD1 3.58Å
578	W	95.3	Very high	95	Very high	17 Å²	17	22.6 Å²	22.6	6%	0.064	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	145.9	179	-51.6	88.3	0	0	0	110.2	P277 K279 Q280 F546 A548 K565 V566 T568 K576	P277-W578 HydrophobicContact CB-CB 3.67Å; P277-W578 HydrophobicContact CG-CB 4.05Å; K279-W578 VanDerWaalsContact O-CA 3.31Å; K279-W578 WeakPolarHBondContact O-CA 3.23Å; Q280-W578 HydrophobicContact CB-CD2 4.39Å; Q280-W578 HydrophobicContact CB-CE3 3.76Å; Q280-W578 HydrophobicContact CB-CH2 3.98Å; Q280-W578 HydrophobicContact CB-CZ3 3.54Å; Q280-W578 HydrophobicContact CG-CD2 4.1Å; Q280-W578 HydrophobicContact CG-CE3 3.93Å; Q280-W578 HydrophobicContact CG-CH2 3.73Å; Q280-W578 HydrophobicContact CG-CZ2 3.89Å; Q280-W578 HydrophobicContact CG-CZ3 3.76Å; F546-W578 HydrophobicContact CD2-CE3 4.27Å; F546-W578 HydrophobicContact CD2-CH2 4.19Å; F546-W578 AromaticContact CD2-CZ3 3.98Å; F546-W578 HydrophobicContact CD2-CZ3 3.98Å; F546-W578 AromaticContact CE2-CD2 3.59Å; F546-W578 HydrophobicContact CE2-CD2 3.59Å; F546-W578 AromaticContact CE2-CE2 3.82Å; F546-W578 AromaticContact CE2-CE3 3.44Å; F546-W578 HydrophobicContact CE2-CE3 3.44Å; F546-W578 VanDerWaalsContact CE2-CE3 3.44Å; F546-W578 HydrophobicContact CE2-CG 4.3Å; F546-W578 AromaticContact CE2-CH2 3.84Å; F546-W578 HydrophobicContact CE2-CH2 3.84Å; F546-W578 AromaticContact CE2-CZ2 3.97Å; F546-W578 HydrophobicContact CE2-CZ2 3.97Å; F546-W578 AromaticContact CE2-CZ3 3.56Å; F546-W578 HydrophobicContact CE2-CZ3 3.56Å; F546-W578 AromaticContact CZ-CD2 3.93Å; F546-W578 HydrophobicContact CZ-CD2 3.93Å; F546-W578 AromaticContact CZ-CE3 3.92Å; F546-W578 HydrophobicContact CZ-CE3 3.92Å; F546-W578 HydrophobicContact CZ-CG 4.21Å; F546-W578 HydrophobicContact CZ-CZ3 4.45Å; A548-W578 VanDerWaalsContact CA-CZ2 3.42Å; A548-W578 HydrophobicContact CB-CH2 4.36Å; A548-W578 HydrophobicContact CB-CZ2 3.6Å; K565-W578 VanDerWaalsContact CA-O 3.27Å; K565-W578 WeakPolarHBondContact CA-O 3.33Å; V566-W578 PolarHBondContact N-O 3.02Å; V566-W578 PolarHBondContact O-N 2.9Å; T568-W578 PolarHBondContact OG1-NE1 2.97Å; K576-W578 HydrophobicContact CB-CZ2 4.04Å; K576-W578 HydrophobicContact CD-CH2 4.46Å; K576-W578 HydrophobicContact CD-CZ2 3.69Å
579	D	91.1	Very high	94.8	Very high	50 Å²	50	24.6 Å²	24.6	27%	0.267	11%	0.114	S	C	.	.			trans	-152	0	-178.5	178.5	63.7	0	0	0	111.8	P277 K278 K279 I281 S564 K565	P277-D579 VanDerWaalsContact CA-C 3.45Å; P277-D579 WeakPolarHBondContact CA-OXT 3.38Å; K278-D579 PolarHBondContact N-O 3.43Å; K279-D579 WeakPolarHBondContact CE-OD2 3.18Å; K279-D579 WeakPolarHBondContact CG-O 3.19Å; K279-D579 PolarHBondContact N-O 3.36Å; K279-D579 IonicContact NZ-OD2 3.46Å; K279-D579 PolarHBondContact NZ-OD2 3.48Å; K279-D579 PolarHBondContact O-N 2.91Å; I281-D579 HydrophobicContact CD1-CB 3.25Å; I281-D579 HydrophobicContact CG1-CB 3.66Å; S564-D579 WeakPolarHBondContact CB-OXT 3.16Å; S564-D579 PolarHBondContact OG-OXT 2.92Å; K565-D579 HydrophobicContact CD-CB 4.38Å; K565-D579 HydrophobicContact CG-CB 4.24Å

Retrieved 579 of 579 residues in 1042.1 ms (Link to these results)

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