A0A096N566_PAPAN Loading...

Tissue factor pathway inhibitor

Inhibits factor X (X(a)) directly and, in a Xa-dependent way, inhibits VIIa/tissue factor activity, presumably by forming a quaternary Xa/LACI/VIIa/TF complex. It possesses an antithrombotic action and also the ability to associate with lipoproteins in plasma.

AlphaFold DB , UniProt , Accession A0A096N566, Species PAPAN (Papio anubis, Olive baboon), Gene TFPI, Length 304 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	36.5	Very low	37.5	Very low	244 Å²	244	165 Å²	165	100%	1.202	83%	0.825	S	S	*	*				0	173.4	0	-68	177.8	-178.2	0	0	108.8
2	I	35.7	Very low	37.3	Very low	162 Å²	162	171.9 Å²	171.9	83%	0.831	83%	0.834	S	S	*	*			trans	-128.7	149.9	-167.4	-73.8	171.9	0	0	0	108.1
3	Y	37.3	Very low	37.2	Very low	201 Å²	201	168.7 Å²	168.7	79%	0.788	83%	0.831	S	S	*	*			cis	-106.7	-121.5	7.5	-152.5	157.1	0	0	0	111.3
4	T	36.2	Very low	37.2	Very low	118 Å²	118	163.7 Å²	163.7	72%	0.724	82%	0.821	S	S	*	*			cis	-155	158.4	2.3	-36.5	0	0	0	0	109.2
5	M	38.6	Very low	37.4	Very low	155 Å²	155	164.1 Å²	164.1	76%	0.764	82%	0.824	S	S	*	*			trans	-132.6	179.8	170.8	-48.9	-155.2	90.4	0	0	109.6
6	K	37	Very low	37.1	Very low	198 Å²	198	160.2 Å²	160.2	86%	0.861	82%	0.816	S	S	*	*			cis	-161.9	-179.5	33.1	-136.3	161.9	-171	177.6	0	111.8
7	K	39.8	Very low	36.9	Very low	192 Å²	192	160.4 Å²	160.4	84%	0.835	82%	0.818	S	S	*	*			trans	-92.8	145.3	-173.2	-64.8	-178.5	178	-178.9	0	114.6
8	V	42.9	Very low	37	Very low	120 Å²	120	159 Å²	159	73%	0.727	81%	0.812	S	S	*	*				24	148.5	126.4	-164.7	0	0	0	0	120.3
9	H	38.7	Very low	37	Very low	178 Å²	178	157.9 Å²	157.9	82%	0.824	81%	0.807	S	S	*	*			trans	100.2	145.8	168.3	-64.3	-84.6	0	0	0	115.9
10	A	35.8	Very low	36.9	Very low	74 Å²	74	156.7 Å²	156.7	61%	0.612	80%	0.802	S	S	*	*			cis	-171.2	170.7	-21.9	0	0	0	0	0	111.2
11	L	33.9	Very low	37.1	Very low	173 Å²	173	157.7 Å²	157.7	91%	0.906	81%	0.809	S	S	*	*			trans	72.9	147.1	157.9	-70.2	161.4	0	0	0	120.3
12	W	35.2	Very low	37.4	Very low	248 Å²	248	150.6 Å²	150.6	94%	0.939	79%	0.789	S	S	*	*			trans	-78.7	160.1	165.9	-64.3	-22.6	0	0	0	111.5
13	V	35.7	Very low	37.8	Very low	130 Å²	130	148.5 Å²	148.5	79%	0.788	79%	0.786	S	S	*	*				178.7	141.1	110.9	151.5	0	0	0	0	110.4
14	S	37.9	Very low	38.1	Very low	99 Å²	99	143.7 Å²	143.7	69%	0.692	79%	0.787	S	S	*	*			trans	19.4	130.5	161.9	-55	0	0	0	0	122.1
15	I	39.5	Very low	38.3	Very low	169 Å²	169	143.3 Å²	143.3	87%	0.867	79%	0.787	S	S	*	*				-163.3	154.2	103.4	-97.8	158.3	0	0	0	109.9
16	C	33.1	Very low	38.3	Very low	102 Å²	102	144.1 Å²	144.1	69%	0.689	79%	0.794	S	S	*	*			trans	-94.9	165.3	-167.8	-51.9	0	0	0	0	114.1
17	L	33.7	Very low	38.2	Very low	164 Å²	164	142.1 Å²	142.1	86%	0.859	79%	0.793	S	S	*	*			trans	70.9	138.5	163.8	-58.5	152.9	0	0	0	114
18	L	37.8	Very low	38.1	Very low	135 Å²	135	137 Å²	137	71%	0.707	79%	0.786	S	S	*	*			cis	-144.5	144.5	25.5	-83.8	174.4	0	0	0	112.5
19	L	38.5	Very low	37.8	Very low	138 Å²	138	139.3 Å²	139.3	72%	0.723	79%	0.794	S	S	*	*			trans	59.5	144.3	146.1	-53.6	166.9	0	0	0	118.1
20	N	34.7	Very low	37.7	Very low	133 Å²	133	136.3 Å²	136.3	71%	0.711	79%	0.794	S	S	*	*			cis	-160.5	137.1	-1.6	-121.3	-12.5	0	0	0	109.3
21	L	41.3	Very low	38.1	Very low	178 Å²	178	141.7 Å²	141.7	93%	0.932	81%	0.806	S	S	*	*			trans	173.6	144.4	143	-96.3	161.8	0	0	0	109.1
22	A	43	Very low	38.4	Very low	96 Å²	96	142.5 Å²	142.5	79%	0.793	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-86	142.5	-163.8	0	0	0	0	0	114.1
23	P	43.9	Very low	38.3	Very low	118 Å²	118	138 Å²	138	77%	0.766	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-84.4	150.9	171.9	34.7	-33.9	0	0	0	112.2
24	A	42.9	Very low	38.4	Very low	99 Å²	99	140.7 Å²	140.7	82%	0.818	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-78.7	136.9	159.2	0	0	0	0	0	109.1
25	P	40.5	Very low	38.3	Very low	111 Å²	111	143.7 Å²	143.7	72%	0.721	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-80.9	135.6	-170.2	30.8	-34.6	0	0	0	113.2
26	L	38.7	Very low	38	Very low	171 Å²	171	144.6 Å²	144.6	90%	0.895	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-87.4	129.1	143.5	-74.8	169.2	0	0	0	107.1
27	N	34.1	Very low	37.9	Very low	157 Å²	157	145 Å²	145	84%	0.84	80%	0.799	S	S	*	*			trans	-124.5	146.7	161.4	-82	-13.2	0	0	0	108.4
28	A	38.2	Very low	38.3	Very low	85 Å²	85	143.9 Å²	143.9	70%	0.702	79%	0.793	S	S	*	*			trans	-114.1	172.5	166.6	0	0	0	0	0	108.9
29	D	37	Very low	38.3	Very low	167 Å²	167	145 Å²	145	89%	0.893	80%	0.798	S	S	*	*			trans	65.1	141.1	-176.2	-48.2	-24.7	0	0	0	113.1
30	S	35.4	Very low	38.3	Very low	116 Å²	116	143 Å²	143	81%	0.811	79%	0.791	S	S	*	*			cis	-134.2	174	27.7	57.7	0	0	0	0	114.9
31	E	45.4	Very low	38.7	Very low	186 Å²	186	144.3 Å²	144.3	87%	0.869	80%	0.799	S	S	*	*			trans	-72.9	141.2	164.3	-58.8	171	137	0	0	110.9
32	E	39.1	Very low	38.9	Very low	191 Å²	191	141.2 Å²	141.2	89%	0.893	79%	0.788	S	S	*	*			trans	-174.8	157.2	138.2	-104.1	171.2	-153.1	0	0	109.4
33	D	33.8	Very low	39.2	Very low	154 Å²	154	145 Å²	145	82%	0.824	79%	0.788	S	S	*	*			trans	-86.7	-165.2	-153.4	-63.8	-79.2	0	0	0	117.3
34	E	37.7	Very low	39.4	Very low	186 Å²	186	145 Å²	145	87%	0.869	78%	0.782	S	S	*	*			trans	77.5	134.4	171.7	-59.1	-176.3	-172.3	0	0	117.2
35	E	35.7	Very low	40	Very low	161 Å²	161	144.1 Å²	144.1	75%	0.752	77%	0.767	S	S	*	*			cis	-158.4	174.1	-20.9	-150.2	-152.6	126.9	0	0	108.5
36	Y	33.6	Very low	40.7	Very low	189 Å²	189	144.1 Å²	144.1	74%	0.741	77%	0.768	S	S	*	*			trans	61.3	113.3	160.7	-124.8	-120.8	0	0	0	117.3
37	T	31.5	Very low	41.5	Very low	109 Å²	109	138.9 Å²	138.9	67%	0.669	74%	0.74	S	S	*	*				-143.6	129.9	51.2	27.2	0	0	0	0	111.9	I39	T37-I39 PolarHBondContact O-N 3.46Å
38	I	40.7	Very low	42.6	Very low	142 Å²	142	135 Å²	135	73%	0.728	72%	0.716	S	S	*	*			trans	-71	97.5	165.2	-58.8	173	0	0	0	107.2	T40	I38-T40 HydrophobicContact CG2-CG2 4.37Å; I38-T40 PolarHBondContact O-N 3.08Å
39	I	39.6	Very low	43.9	Very low	158 Å²	158	131.4 Å²	131.4	81%	0.81	69%	0.685	S	S	*	*			trans	-65.9	96.9	156.9	-60.8	179.4	0	0	0	105.2	T37 D41	T37-I39 PolarHBondContact O-N 3.46Å; I39-D41 PolarHBondContact O-N 3Å; I39-D41 VanDerWaalsContact O-N 3.14Å
40	T	37.7	Very low	45.4	Very low	95 Å²	95	126.7 Å²	126.7	58%	0.583	66%	0.658	S	S	*	*			trans	-49.8	120.3	-178	49.5	0	0	0	0	110	I38 T42	I38-T40 HydrophobicContact CG2-CG2 4.37Å; I38-T40 PolarHBondContact O-N 3.08Å; T40-T42 VanDerWaalsContact C-N 3.34Å; T40-T42 PolarHBondContact O-N 3.39Å; T40-T42 PolarHBondContact O-OG1 3.38Å; T40-T42 VanDerWaalsContact O-OG1 3.11Å
41	D	43.8	Very low	47.5	Very low	162 Å²	162	123.5 Å²	123.5	87%	0.866	63%	0.63	S	S	*	*			trans	-47.8	105.7	161.7	-92.5	-53.4	0	0	0	107.2	I39 E43	I39-D41 PolarHBondContact O-N 3Å; I39-D41 VanDerWaalsContact O-N 3.14Å; D41-E43 PolarHBondContact O-N 3.36Å
42	T	45.5	Very low	49.1	Very low	113 Å²	113	115.2 Å²	115.2	69%	0.693	59%	0.593	S	S	*	*			trans	-81.4	77.9	-177.1	-60.2	0	0	0	0	105	T40 L44	T40-T42 VanDerWaalsContact C-N 3.34Å; T40-T42 PolarHBondContact O-N 3.39Å; T40-T42 PolarHBondContact O-OG1 3.38Å; T40-T42 VanDerWaalsContact O-OG1 3.11Å; T42-L44 VanDerWaalsContact C-N 3.35Å; T42-L44 WeakPolarHBondContact O-CA 3.35Å; T42-L44 PolarHBondContact O-N 3.09Å
43	E	47.9	Very low	51.3	Low	174 Å²	174	108 Å²	108	81%	0.813	56%	0.559	S	S	*	*			trans	-47.8	96.2	-158.3	-170.2	-178.5	-162.3	0	0	110.3	D41 P45	D41-E43 PolarHBondContact O-N 3.36Å; E43-P45 WeakPolarHBondContact O-CA 3.45Å; E43-P45 WeakPolarHBondContact O-CD 3.37Å
44	L	48.7	Very low	54.1	Low	120 Å²	120	100.7 Å²	100.7	63%	0.628	52%	0.52	S	S	*	.			trans	-70.9	104	-153.1	-114.6	174.8	0	0	0	107.4	T42 R77	T42-L44 VanDerWaalsContact C-N 3.35Å; T42-L44 WeakPolarHBondContact O-CA 3.35Å; T42-L44 PolarHBondContact O-N 3.09Å; L44-R77 PolarHBondContact O-NH2 2.9Å
45	P	55.4	Low	56.4	Low	79 Å²	79	92.5 Å²	92.5	51%	0.513	48%	0.484	S	S	.	.			trans	-56.8	135.5	-145.5	12.7	-29.3	0	0	0	110.6	E43 L47 R77	E43-P45 WeakPolarHBondContact O-CA 3.45Å; E43-P45 WeakPolarHBondContact O-CD 3.37Å; P45-L47 PolarHBondContact O-N 3.46Å; P45-R77 PolarHBondContact O-NH2 3.1Å
46	P	54.9	Low	59	Low	112 Å²	112	87.7 Å²	87.7	73%	0.727	46%	0.46	S	S	*	.			trans	-50.2	136.6	-157.3	12.1	-28.2	0	0	0	111.4	K48	P46-K48 PolarHBondContact O-N 3.19Å
47	L	55.9	Low	61.6	Low	60 Å²	60	86.5 Å²	86.5	31%	0.314	46%	0.459	S	S	.	.			trans	-71.7	72.5	-173.9	-81.5	171.9	0	0	0	111.3	P45 L49 I74 R77	P45-L47 PolarHBondContact O-N 3.46Å; L47-L49 VanDerWaalsContact C-N 3.35Å; L47-L49 HydrophobicContact CB-CG 4.35Å; L47-L49 PolarHBondContact O-N 3.04Å; L47-I74 HydrophobicContact CD1-CB 4.04Å; L47-I74 HydrophobicContact CD1-CG2 4.43Å; L47-I74 WeakPolarHBondContact CD1-O 3.42Å; L47-R77 HydrophobicContact CD1-CG 4.29Å; L47-R77 HydrophobicContact CD2-CG 4.33Å
48	K	57.4	Low	64.7	Low	75 Å²	75	83.7 Å²	83.7	33%	0.326	44%	0.443	S	S	.	.			trans	-59.6	102.9	155.3	-130.5	-177	-171.5	-176	0	106.1	P46 R106 M162 N164	P46-K48 PolarHBondContact O-N 3.19Å; K48-R106 PolarHBondContact O-NH2 2.83Å; K48-M162 HydrophobicContact CB-CE 4.46Å; K48-M162 HydrophobicContact CB-CG 4.27Å; K48-M162 HydrophobicContact CD-CG 4.12Å; K48-M162 VanDerWaalsContact CE-O 3.32Å; K48-M162 WeakPolarHBondContact CE-O 3.17Å; K48-M162 HydrophobicContact CG-CG 3.91Å; K48-M162 PolarHBondContact NZ-O 2.79Å; K48-M162 VanDerWaalsContact O-CE 3.27Å; K48-M162 WeakPolarHBondContact O-CE 3.27Å; K48-N164 WeakPolarHBondContact CE-O 3.14Å; K48-N164 PolarHBondContact NZ-O 2.83Å
49	L	66.4	Low	67.3	Low	10 Å²	10	80.2 Å²	80.2	5%	0.052	43%	0.426	C	S	.	.			trans	-97.1	145.9	177	-70.6	163.2	0	0	0	108.4	L47 H51 C54 A55 F72 I74 M162	L47-L49 VanDerWaalsContact C-N 3.35Å; L47-L49 HydrophobicContact CB-CG 4.35Å; L47-L49 PolarHBondContact O-N 3.04Å; L49-H51 WeakPolarHBondContact CB-O 3.32Å; L49-H51 PolarHBondContact O-N 3.08Å; L49-C54 HydrophobicContact CD1-CB 4.17Å; L49-C54 HydrophobicContact CD2-CB 4.29Å; L49-A55 HydrophobicContact CD1-CB 3.75Å; L49-F72 HydrophobicContact CD2-CD1 4.3Å; L49-F72 HydrophobicContact CD2-CE1 3.74Å; L49-F72 HydrophobicContact CD2-CZ 4.43Å; L49-I74 HydrophobicContact CD1-CG2 4.14Å; L49-M162 WeakPolarHBondContact O-CG 3.34Å; L49-M162 PolarHBondContact O-N 3.14Å
50	M	68.1	Low	70.1	Confident	68 Å²	68	76.7 Å²	76.7	34%	0.335	41%	0.409	S	S	.	.	S	Bend	trans	-62	-32.1	176.4	-166.3	167.2	78.2	0	0	111.3	L127 M162	M50-L127 WeakPolarHBondContact O-CD1 3.34Å; M50-M162 HydrophobicContact CB-SD 4.44Å
51	H	79.3	Confident	72.9	Confident	49 Å²	49	73.3 Å²	73.3	23%	0.227	39%	0.392	C	S	.	.	S	Bend	trans	-133.1	136.8	172.7	-51.3	104.1	0	0	0	110.7	L49 F53 C54 V103	L49-H51 WeakPolarHBondContact CB-O 3.32Å; L49-H51 PolarHBondContact O-N 3.08Å; H51-F53 VanDerWaalsContact C-N 3.3Å; H51-F53 HydrophobicContact CB-CD1 3.75Å; H51-F53 HydrophobicContact CB-CD2 4.42Å; H51-F53 HydrophobicContact CB-CE1 3.41Å; H51-F53 VanDerWaalsContact CB-CE1 3.41Å; H51-F53 HydrophobicContact CB-CE2 4.12Å; H51-F53 HydrophobicContact CB-CG 4.24Å; H51-F53 HydrophobicContact CB-CZ 3.6Å; H51-F53 AromaticContact CD2-CE1 3.83Å; H51-F53 AromaticContact CG-CE1 3.64Å; H51-F53 AromaticContact CG-CZ 3.63Å; H51-F53 AromaticContact ND1-CZ 3.92Å; H51-F53 PolarHBondContact O-N 3.17Å; H51-C54 WeakPolarHBondContact O-CB 3.14Å; H51-C54 PolarHBondContact O-N 3.04Å; H51-V103 PolarHBondContact ND1-O 3.45Å
52	S	79	Confident	75.3	Confident	13 Å²	13	71 Å²	71	9%	0.091	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-60.9	-36.7	177.6	57.3	0	0	0	0	113.4	C54 A55 D130 G160	S52-C54 PolarHBondContact O-N 3.08Å; S52-C54 VanDerWaalsContact O-N 3.14Å; S52-A55 WeakPolarHBondContact O-CB 3.17Å; S52-A55 PolarHBondContact O-N 3.4Å; S52-D130 WeakPolarHBondContact CB-OD2 3.47Å; S52-D130 PolarHBondContact OG-OD2 3.33Å; S52-G160 VanDerWaalsContact CA-O 3.24Å; S52-G160 WeakPolarHBondContact CA-O 3.39Å; S52-G160 VanDerWaalsContact CB-O 3.27Å; S52-G160 WeakPolarHBondContact CB-O 3.44Å
53	F	85.2	Confident	77.7	Confident	39 Å²	39	68.2 Å²	68.2	17%	0.171	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-63.5	-21.7	-176.6	62.8	-107.6	0	0	0	113.2	H51 A55 F56 Q91 N92 F94 V103	H51-F53 VanDerWaalsContact C-N 3.3Å; H51-F53 HydrophobicContact CB-CD1 3.75Å; H51-F53 HydrophobicContact CB-CD2 4.42Å; H51-F53 HydrophobicContact CB-CE1 3.41Å; H51-F53 VanDerWaalsContact CB-CE1 3.41Å; H51-F53 HydrophobicContact CB-CE2 4.12Å; H51-F53 HydrophobicContact CB-CG 4.24Å; H51-F53 HydrophobicContact CB-CZ 3.6Å; H51-F53 AromaticContact CD2-CE1 3.83Å; H51-F53 AromaticContact CG-CE1 3.64Å; H51-F53 AromaticContact CG-CZ 3.63Å; H51-F53 AromaticContact ND1-CZ 3.92Å; H51-F53 PolarHBondContact O-N 3.17Å; F53-A55 PolarHBondContact O-N 3.27Å; F53-F56 HydrophobicContact CB-CD2 3.71Å; F53-F56 HydrophobicContact CB-CE2 3.56Å; F53-F56 HydrophobicContact CB-CG 4.44Å; F53-F56 HydrophobicContact CB-CZ 4.16Å; F53-F56 WeakPolarHBondContact O-CB 3.36Å; F53-F56 PolarHBondContact O-N 3.31Å; F53-Q91 HydrophobicContact CB-CB 3.72Å; F53-Q91 HydrophobicContact CD1-CB 4.23Å; F53-Q91 HydrophobicContact CD2-CB 3.83Å; F53-Q91 HydrophobicContact CG-CB 3.68Å; F53-N92 WeakPolarHBondContact O-CB 3.28Å; F53-F94 HydrophobicContact CE2-CE1 4.46Å; F53-F94 HydrophobicContact CE2-CZ 4.11Å; F53-V103 HydrophobicContact CE2-CG1 3.87Å; F53-V103 HydrophobicContact CZ-CG1 3.89Å
54	C	91.4	Very high	80	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-57.5	-17.9	170.2	-64.5	0	0	0	0	112.7	L49 H51 S52 F72 N92 C104	L49-C54 HydrophobicContact CD1-CB 4.17Å; L49-C54 HydrophobicContact CD2-CB 4.29Å; H51-C54 WeakPolarHBondContact O-CB 3.14Å; H51-C54 PolarHBondContact O-N 3.04Å; S52-C54 PolarHBondContact O-N 3.08Å; S52-C54 VanDerWaalsContact O-N 3.14Å; C54-F72 HydrophobicContact CB-CB 4.34Å; C54-F72 HydrophobicContact CB-CD1 4.1Å; C54-F72 HydrophobicContact CB-CG 4.49Å; C54-F72 WeakPolarHBondContact O-CD1 3.14Å; C54-F72 VanDerWaalsContact O-O 3.14Å; C54-N92 PolarHBondContact O-ND2 3.16Å; C54-N92 VanDerWaalsContact O-ND2 3.08Å; C54-C104 HydrophobicContact CB-CB 3.73Å; C54-C104 WeakPolarHBondContact CB-SG 3.32Å; C54-C104 VanDerWaalsContact SG-CA 3.51Å; C54-C104 WeakPolarHBondContact SG-CB 2.99Å; C54-C104 CovalentContact SG-SG 2.04Å; C54-C104 PolarHBondContact SG-SG 3.35Å
55	A	86.6	Confident	82.3	Confident	14 Å²	14	66.4 Å²	66.4	12%	0.116	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-96.3	1.3	175.9	0	0	0	0	0	115.1	L49 S52 F53 I74 L159	L49-A55 HydrophobicContact CD1-CB 3.75Å; S52-A55 WeakPolarHBondContact O-CB 3.17Å; S52-A55 PolarHBondContact O-N 3.4Å; F53-A55 PolarHBondContact O-N 3.27Å; A55-I74 HydrophobicContact CB-CD1 4.3Å; A55-I74 HydrophobicContact CB-CG2 3.76Å; A55-L159 HydrophobicContact CB-CD1 3.98Å; A55-L159 HydrophobicContact CB-CD2 3.43Å; A55-L159 VanDerWaalsContact CB-CD2 3.43Å; A55-L159 HydrophobicContact CB-CG 4.23Å
56	F	90	Very high	84.3	Confident	60 Å²	60	69.8 Å²	69.8	26%	0.263	38%	0.376	S	S	.	.	S	Bend	trans	-72.4	145	172.5	-60.1	-17.6	0	0	0	110.2	F53 N90 N92 L159	F53-F56 HydrophobicContact CB-CD2 3.71Å; F53-F56 HydrophobicContact CB-CE2 3.56Å; F53-F56 HydrophobicContact CB-CG 4.44Å; F53-F56 HydrophobicContact CB-CZ 4.16Å; F53-F56 WeakPolarHBondContact O-CB 3.36Å; F53-F56 PolarHBondContact O-N 3.31Å; F56-N90 WeakPolarHBondContact CB-OD1 3.23Å; F56-N90 HydrophobicContact CD2-CB 4.08Å; F56-N92 HydrophobicContact CB-CB 4.27Å; F56-N92 PolarHBondContact O-ND2 3.09Å; F56-L159 HydrophobicContact CD1-CD1 4.26Å; F56-L159 HydrophobicContact CE1-CD1 4.2Å
57	K	89.2	Confident	86.3	Confident	165 Å²	165	67.9 Å²	67.9	72%	0.717	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-64.1	154.2	173.7	-69.5	-171.9	177.8	-173.6	0	110.5	N90	K57-N90 PolarHBondContact O-ND2 3.44Å
58	P	95.5	Very high	88.3	Confident	50 Å²	50	71.3 Å²	71.3	33%	0.325	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-57.4	142.1	167.5	26.2	-32.5	0	0	0	109.1	F71 F82	P58-F71 HydrophobicContact CB-CB 4.37Å; P58-F71 HydrophobicContact CB-CD1 3.91Å; P58-F71 HydrophobicContact CB-CD2 4.12Å; P58-F71 HydrophobicContact CB-CE1 4.22Å; P58-F71 HydrophobicContact CB-CE2 4.42Å; P58-F71 HydrophobicContact CB-CG 3.86Å; P58-F71 HydrophobicContact CB-CZ 4.48Å; P58-F71 HydrophobicContact CG-CD1 4.21Å; P58-F71 HydrophobicContact CG-CD2 4.04Å; P58-F71 HydrophobicContact CG-CE1 4.04Å; P58-F71 HydrophobicContact CG-CE2 3.87Å; P58-F71 HydrophobicContact CG-CG 4.21Å; P58-F71 HydrophobicContact CG-CZ 3.88Å; P58-F82 HydrophobicContact CB-CB 4.14Å; P58-F82 HydrophobicContact CB-CD1 4.15Å; P58-F82 HydrophobicContact CB-CD2 3.72Å; P58-F82 HydrophobicContact CB-CE1 4.42Å; P58-F82 HydrophobicContact CB-CE2 4.04Å; P58-F82 HydrophobicContact CB-CG 3.76Å; P58-F82 HydrophobicContact CB-CZ 4.36Å
59	D	96.7	Very high	90.2	Very high	69 Å²	69	69.7 Å²	69.7	37%	0.369	36%	0.363	S	S	.	.			trans	-139.1	102.4	-177.3	179.7	4	0	0	0	109.1	G61 G89 N90	D59-G61 PolarHBondContact O-N 3.03Å; D59-G61 WeakPolarHBondContact OD1-CA 3.49Å; D59-G61 PolarHBondContact OD1-N 2.95Å; D59-G89 WeakPolarHBondContact O-CA 3.35Å; D59-G89 VanDerWaalsContact OD2-CA 3.32Å; D59-G89 WeakPolarHBondContact OD2-CA 3.47Å; D59-N90 VanDerWaalsContact CB-ND2 3.3Å; D59-N90 WeakPolarHBondContact CB-ND2 3.39Å
60	D	97.1	Very high	91.7	Very high	84 Å²	84	70.8 Å²	70.8	45%	0.449	37%	0.367	S	S	.	.			trans	-61	-28	178.8	-55.2	6.7	0	0	0	111.1	F82 I83 Y84 G85	D60-F82 WeakPolarHBondContact OD1-CD2 3.43Å; D60-I83 WeakPolarHBondContact CB-O 2.99Å; D60-Y84 WeakPolarHBondContact O-CD2 3.01Å; D60-G85 WeakPolarHBondContact O-CA 3.16Å; D60-G85 PolarHBondContact O-N 2.9Å
61	G	96.3	Very high	93.1	Very high	23 Å²	23	68.4 Å²	68.4	24%	0.237	36%	0.355	C	S	.	.			trans	72.2	-178.9	-174.6	0	0	0	0	0	114.3	D59 C63 C87	D59-G61 PolarHBondContact O-N 3.03Å; D59-G61 WeakPolarHBondContact OD1-CA 3.49Å; D59-G61 PolarHBondContact OD1-N 2.95Å; G61-C63 VanDerWaalsContact C-N 3.34Å; G61-C63 PolarHBondContact O-N 3.09Å; G61-C87 WeakPolarHBondContact CA-O 3.25Å
62	P	94.2	Very high	93.8	Very high	114 Å²	114	66.4 Å²	66.4	74%	0.74	35%	0.345	S	S	*	.	S	Bend	trans	-82.5	-4.2	-171.7	31.8	-35.5	0	0	0	114.9
63	C	97.3	Very high	94.4	Very high	55 Å²	55	67.1 Å²	67.1	37%	0.372	35%	0.348	S	S	.	.			trans	-89.3	165.6	177.6	-72.5	0	0	0	0	111.9	G61 G85 C87	G61-C63 VanDerWaalsContact C-N 3.34Å; G61-C63 PolarHBondContact O-N 3.09Å; C63-G85 CarbonylContact C-O 3.54Å; C63-G85 WeakPolarHBondContact CB-O 3.23Å; C63-G85 VanDerWaalsContact O-CA 3.25Å; C63-G85 WeakPolarHBondContact O-CA 3.4Å; C63-C87 HydrophobicContact CB-CB 3.88Å; C63-C87 WeakPolarHBondContact CB-SG 3.48Å; C63-C87 WeakPolarHBondContact SG-CB 2.98Å; C63-C87 CovalentContact SG-SG 2.03Å; C63-C87 PolarHBondContact SG-SG 3.25Å
64	K	96.6	Very high	94.3	Very high	208 Å²	208	67.3 Å²	67.3	90%	0.904	35%	0.35	S	S	*	.			trans	-121.9	28.3	-171.8	-57.3	-170.4	179.4	-174.6	0	114.6	G85	K64-G85 PolarHBondContact N-O 3.1Å
65	A	96.1	Very high	93.8	Very high	47 Å²	47	75.5 Å²	75.5	39%	0.388	39%	0.386	S	S	.	.			trans	-72.4	156.7	166.8	0	0	0	0	0	110.3	M67 G85	A65-M67 HydrophobicContact CB-CG 3.94Å; A65-M67 HydrophobicContact CB-SD 4.34Å; A65-G85 VanDerWaalsContact CB-O 3.27Å; A65-G85 WeakPolarHBondContact CB-O 3.12Å; A65-G85 PolarHBondContact N-O 3.5Å; A65-G85 WeakPolarHBondContact O-CA 3.16Å
66	I	96.8	Very high	93.7	Very high	150 Å²	150	77.9 Å²	77.9	77%	0.769	40%	0.399	S	S	*	.			trans	-107.3	77.6	175.8	-56.3	178	0	0	0	107.5	I83	I66-I83 HydrophobicContact CB-CG2 4.29Å; I66-I83 HydrophobicContact CG2-CD1 4.13Å; I66-I83 HydrophobicContact CG2-CG2 3.87Å
67	M	97.3	Very high	93.3	Very high	72 Å²	72	78.5 Å²	78.5	36%	0.355	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	106.9	-179.5	-55.8	-178	67	0	0	110.1	A65 R69 Y84	A65-M67 HydrophobicContact CB-CG 3.94Å; A65-M67 HydrophobicContact CB-SD 4.34Å; M67-R69 PolarHBondContact O-N 3.37Å; M67-Y84 HydrophobicContact CB-CD1 4.43Å; M67-Y84 VanDerWaalsContact CB-O 3.3Å; M67-Y84 WeakPolarHBondContact CB-O 3.44Å; M67-Y84 PolarHBondContact N-O 3.5Å; M67-Y84 VanDerWaalsContact N-O 3.09Å; M67-Y84 PolarHBondContact O-N 2.93Å; M67-Y84 HydrophobicContact SD-CD1 4.24Å
68	K	97.9	Very high	93.2	Very high	133 Å²	133	76.5 Å²	76.5	58%	0.578	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.9	129.9	168.6	-75.5	-169	165.7	-144.8	0	110.2	E81 I83	K68-E81 WeakPolarHBondContact CD-OE2 3.42Å; K68-E81 VanDerWaalsContact CE-OE2 3.22Å; K68-E81 WeakPolarHBondContact CE-OE2 3.27Å; K68-E81 IonicContact NZ-OE1 3.56Å; K68-E81 IonicContact NZ-OE2 2.65Å; K68-E81 PolarHBondContact NZ-OE2 3.37Å; K68-I83 HydrophobicContact CG-CD1 4.08Å
69	R	98	Very high	93.2	Very high	41 Å²	41	74.8 Å²	74.8	16%	0.155	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	163.4	175.6	-70.6	-67.6	170	136.9	-17.8	109.3	M67 E81 F82 Y84 R93 F94 E95	M67-R69 PolarHBondContact O-N 3.37Å; R69-E81 CarbonylContact O-C 3.56Å; R69-E81 WeakPolarHBondContact O-CA 3.23Å; R69-F82 HydrophobicContact CB-CD1 4.08Å; R69-F82 HydrophobicContact CB-CE1 3.7Å; R69-F82 HydrophobicContact CB-CZ 4.22Å; R69-F82 PolarHBondContact N-O 3.39Å; R69-F82 PolarHBondContact O-N 3.39Å; R69-Y84 HydrophobicContact CG-CD1 4.25Å; R69-Y84 HydrophobicContact CG-CG 4.35Å; R69-R93 HydrophobicContact CB-CG 3.78Å; R69-R93 HydrophobicContact CG-CG 3.77Å; R69-F94 WeakPolarHBondContact CD-O 3.37Å; R69-E95 VanDerWaalsContact CZ-CG 3.4Å; R69-E95 IonicContact CZ-OE1 3.15Å; R69-E95 IonicContact NH1-OE1 2.84Å; R69-E95 PolarHBondContact NH1-OE1 2.83Å; R69-E95 IonicContact NH2-OE1 2.7Å; R69-E95 PolarHBondContact NH2-OE1 2.81Å
70	F	98.1	Very high	93.2	Very high	32 Å²	32	74.2 Å²	74.2	14%	0.14	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	146.2	176.4	-63.1	-92.9	0	0	0	111.1	E80 E81 R93 F94 L97 C100	F70-E80 CarbonylContact C-O 3.57Å; F70-E80 VanDerWaalsContact CA-O 3.24Å; F70-E80 WeakPolarHBondContact CA-O 3.42Å; F70-E81 HydrophobicContact CD1-CG 3.88Å; F70-E81 HydrophobicContact CE1-CG 3.33Å; F70-E81 HydrophobicContact CZ-CG 3.74Å; F70-R93 CarbonylContact O-C 3.57Å; F70-R93 WeakPolarHBondContact O-CA 3.15Å; F70-F94 HydrophobicContact CB-CB 4.33Å; F70-F94 PolarHBondContact N-O 3.03Å; F70-F94 WeakPolarHBondContact O-CD2 3.37Å; F70-F94 PolarHBondContact O-N 3.33Å; F70-L97 HydrophobicContact CD1-CB 3.97Å; F70-L97 HydrophobicContact CD1-CD1 3.86Å; F70-L97 HydrophobicContact CE1-CB 3.73Å; F70-L97 HydrophobicContact CE1-CD1 4.05Å; F70-L97 HydrophobicContact CE1-CG 4.37Å; F70-L97 HydrophobicContact CE2-CB 4.49Å; F70-L97 HydrophobicContact CG-CB 4.44Å; F70-L97 HydrophobicContact CZ-CB 4.02Å; F70-C100 HydrophobicContact CB-CB 4.04Å
71	F	96.8	Very high	93.2	Very high	19 Å²	19	75 Å²	75	8%	0.083	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	155.4	170.6	78.9	-77.2	0	0	0	109.9	P58 N73 C79 E80 F82 N92 C100	P58-F71 HydrophobicContact CB-CB 4.37Å; P58-F71 HydrophobicContact CB-CD1 3.91Å; P58-F71 HydrophobicContact CB-CD2 4.12Å; P58-F71 HydrophobicContact CB-CE1 4.22Å; P58-F71 HydrophobicContact CB-CE2 4.42Å; P58-F71 HydrophobicContact CB-CG 3.86Å; P58-F71 HydrophobicContact CB-CZ 4.48Å; P58-F71 HydrophobicContact CG-CD1 4.21Å; P58-F71 HydrophobicContact CG-CD2 4.04Å; P58-F71 HydrophobicContact CG-CE1 4.04Å; P58-F71 HydrophobicContact CG-CE2 3.87Å; P58-F71 HydrophobicContact CG-CG 4.21Å; P58-F71 HydrophobicContact CG-CZ 3.88Å; F71-N73 HydrophobicContact CD2-CB 4.42Å; F71-N73 HydrophobicContact CE2-CB 3.58Å; F71-N73 HydrophobicContact CZ-CB 3.94Å; F71-C79 CarbonylContact O-C 3.56Å; F71-C79 VanDerWaalsContact O-CA 3.32Å; F71-C79 WeakPolarHBondContact O-CA 3.43Å; F71-E80 HydrophobicContact CD1-CB 4.2Å; F71-E80 WeakPolarHBondContact CD1-O 3.26Å; F71-E80 HydrophobicContact CE1-CB 3.6Å; F71-E80 HydrophobicContact CZ-CB 3.99Å; F71-E80 WeakPolarHBondContact CZ-OE2 3.32Å; F71-E80 PolarHBondContact N-O 2.93Å; F71-E80 PolarHBondContact O-N 3.16Å; F71-F82 HydrophobicContact CB-CD1 4Å; F71-F82 HydrophobicContact CB-CE1 3.98Å; F71-F82 HydrophobicContact CD1-CB 4.04Å; F71-F82 AromaticContact CD1-CD1 3.76Å; F71-F82 HydrophobicContact CD1-CD1 3.76Å; F71-F82 HydrophobicContact CD1-CG 4.19Å; F71-F82 HydrophobicContact CE1-CB 4.27Å; F71-F82 HydrophobicContact CG-CD1 4.28Å; F71-N92 WeakPolarHBondContact CB-O 3.14Å; F71-C100 VanDerWaalsContact C-SG 3.56Å
72	F	94.1	Very high	93.3	Very high	7 Å²	7	75 Å²	75	3%	0.031	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	118.4	171.2	-174.2	-103.9	0	0	0	110.5	L49 C54 I74 R77 Q78 N92 C104 T105	L49-F72 HydrophobicContact CD2-CD1 4.3Å; L49-F72 HydrophobicContact CD2-CE1 3.74Å; L49-F72 HydrophobicContact CD2-CZ 4.43Å; C54-F72 HydrophobicContact CB-CB 4.34Å; C54-F72 HydrophobicContact CB-CD1 4.1Å; C54-F72 HydrophobicContact CB-CG 4.49Å; C54-F72 WeakPolarHBondContact O-CD1 3.14Å; C54-F72 VanDerWaalsContact O-O 3.14Å; F72-I74 HydrophobicContact CD1-CG2 3.96Å; F72-I74 HydrophobicContact CE1-CG2 3.93Å; F72-R77 VanDerWaalsContact CE2-C 3.44Å; F72-R77 WeakPolarHBondContact CE2-O 3.43Å; F72-R77 HydrophobicContact CZ-CB 4.32Å; F72-Q78 WeakPolarHBondContact CD2-O 3.42Å; F72-N92 PolarHBondContact N-ND2 2.84Å; F72-N92 PolarHBondContact N-OD1 2.82Å; F72-N92 PolarHBondContact O-ND2 2.77Å; F72-C104 HydrophobicContact CB-CB 3.6Å; F72-C104 HydrophobicContact CD1-CB 4.15Å; F72-C104 HydrophobicContact CD2-CB 3.71Å; F72-C104 HydrophobicContact CE2-CB 4.43Å; F72-C104 HydrophobicContact CG-CB 3.53Å; F72-T105 HydrophobicContact CD2-CG2 4.26Å; F72-T105 HydrophobicContact CE2-CG2 3.81Å
73	N	90.1	Very high	93.5	Very high	27 Å²	27	72.9 Å²	72.9	14%	0.144	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	112.5	173.8	-177.7	-15.4	0	0	0	109.5	F71 F75 T76 R77 Q78 E80	F71-N73 HydrophobicContact CD2-CB 4.42Å; F71-N73 HydrophobicContact CE2-CB 3.58Å; F71-N73 HydrophobicContact CZ-CB 3.94Å; N73-F75 VanDerWaalsContact C-N 3.27Å; N73-F75 PolarHBondContact O-N 3.27Å; N73-F75 WeakPolarHBondContact OD1-CB 3.08Å; N73-F75 WeakPolarHBondContact OD1-CD2 3.27Å; N73-F75 PolarHBondContact OD1-N 3.1Å; N73-T76 WeakPolarHBondContact CB-OG1 3.19Å; N73-T76 VanDerWaalsContact CG-OG1 3.31Å; N73-T76 PolarHBondContact O-OG1 3.07Å; N73-R77 WeakPolarHBondContact O-CA 3.24Å; N73-R77 PolarHBondContact O-N 2.7Å; N73-Q78 PolarHBondContact N-O 3.29Å; N73-Q78 PolarHBondContact O-N 3.42Å; N73-E80 HydrophobicContact CB-CG 4.38Å; N73-E80 WeakPolarHBondContact CB-OE1 3.36Å; N73-E80 WeakPolarHBondContact CB-OE2 3.31Å; N73-E80 VanDerWaalsContact ND2-CD 3.28Å; N73-E80 PolarHBondContact ND2-OE1 2.03Å; N73-E80 VanDerWaalsContact ND2-OE1 3.08Å; N73-E80 PolarHBondContact ND2-OE2 3.17Å
74	I	84.4	Confident	93.5	Very high	43 Å²	43	71.3 Å²	71.3	22%	0.221	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-22.9	-179.6	55.4	173.4	0	0	0	114.4	L47 L49 A55 F72	L47-I74 HydrophobicContact CD1-CB 4.04Å; L47-I74 HydrophobicContact CD1-CG2 4.43Å; L47-I74 WeakPolarHBondContact CD1-O 3.42Å; L49-I74 HydrophobicContact CD1-CG2 4.14Å; A55-I74 HydrophobicContact CB-CD1 4.3Å; A55-I74 HydrophobicContact CB-CG2 3.76Å; F72-I74 HydrophobicContact CD1-CG2 3.96Å; F72-I74 HydrophobicContact CE1-CG2 3.93Å
75	F	80.6	Confident	93.5	Very high	172 Å²	172	61.7 Å²	61.7	75%	0.754	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-44.5	-177.5	-57.7	-74.5	0	0	0	111.2	N73 R77	N73-F75 VanDerWaalsContact C-N 3.27Å; N73-F75 PolarHBondContact O-N 3.27Å; N73-F75 WeakPolarHBondContact OD1-CB 3.08Å; N73-F75 WeakPolarHBondContact OD1-CD2 3.27Å; N73-F75 PolarHBondContact OD1-N 3.1Å; F75-R77 VanDerWaalsContact C-N 3.34Å
76	T	84.8	Confident	93.5	Very high	64 Å²	64	61 Å²	61	39%	0.393	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-15.3	173	59.3	0	0	0	0	112.8	N73 Q78 E80	N73-T76 WeakPolarHBondContact CB-OG1 3.19Å; N73-T76 VanDerWaalsContact CG-OG1 3.31Å; N73-T76 PolarHBondContact O-OG1 3.07Å; T76-Q78 PolarHBondContact O-N 2.03Å; T76-Q78 PolarHBondContact OG1-N 2.99Å; T76-E80 WeakPolarHBondContact CB-OE1 3.48Å; T76-E80 VanDerWaalsContact CG2-OE1 3.25Å; T76-E80 WeakPolarHBondContact CG2-OE1 3.22Å; T76-E80 PolarHBondContact OG1-OE1 2.88Å
77	R	80.4	Confident	93.4	Very high	74 Å²	74	55.7 Å²	55.7	28%	0.279	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	30.7	-171	-58.6	-178.6	172.7	-151.2	-6.5	112.9	L44 P45 L47 F72 N73 F75	L44-R77 PolarHBondContact O-NH2 2.9Å; P45-R77 PolarHBondContact O-NH2 3.1Å; L47-R77 HydrophobicContact CD1-CG 4.29Å; L47-R77 HydrophobicContact CD2-CG 4.33Å; F72-R77 VanDerWaalsContact CE2-C 3.44Å; F72-R77 WeakPolarHBondContact CE2-O 3.43Å; F72-R77 HydrophobicContact CZ-CB 4.32Å; N73-R77 WeakPolarHBondContact O-CA 3.24Å; N73-R77 PolarHBondContact O-N 2.7Å; F75-R77 VanDerWaalsContact C-N 3.34Å
78	Q	88.4	Confident	93.4	Very high	122 Å²	122	54.6 Å²	54.6	57%	0.57	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.8	166.9	-174.8	-70.2	177.8	43.3	0	0	112.5	F72 N73 T76	F72-Q78 WeakPolarHBondContact CD2-O 3.42Å; N73-Q78 PolarHBondContact N-O 3.29Å; N73-Q78 PolarHBondContact O-N 3.42Å; T76-Q78 PolarHBondContact O-N 2.03Å; T76-Q78 PolarHBondContact OG1-N 2.99Å
79	C	94.9	Very high	93.2	Very high	14 Å²	14	49.5 Å²	49.5	10%	0.095	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	122.8	172.2	-77.1	0	0	0	0	110.1	F71 L97 C100 K101	F71-C79 CarbonylContact O-C 3.56Å; F71-C79 VanDerWaalsContact O-CA 3.32Å; F71-C79 WeakPolarHBondContact O-CA 3.43Å; C79-L97 HydrophobicContact CB-CD1 3.52Å; C79-L97 WeakPolarHBondContact O-CD1 3.31Å; C79-C100 HydrophobicContact CB-CB 3.7Å; C79-C100 WeakPolarHBondContact CB-SG 3.44Å; C79-C100 WeakPolarHBondContact SG-CB 3.03Å; C79-C100 CovalentContact SG-SG 2.03Å; C79-C100 PolarHBondContact SG-SG 2.94Å; C79-K101 HydrophobicContact CB-CG 4.25Å; C79-K101 PolarHBondContact SG-N 2.94Å; C79-K101 VanDerWaalsContact SG-N 3.36Å
80	E	96.9	Very high	93	Very high	57 Å²	57	49.3 Å²	49.3	27%	0.266	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	152.7	-169.1	-72.7	167.7	-160.3	0	0	111.1	F70 F71 N73 T76	F70-E80 CarbonylContact C-O 3.57Å; F70-E80 VanDerWaalsContact CA-O 3.24Å; F70-E80 WeakPolarHBondContact CA-O 3.42Å; F71-E80 HydrophobicContact CD1-CB 4.2Å; F71-E80 WeakPolarHBondContact CD1-O 3.26Å; F71-E80 HydrophobicContact CE1-CB 3.6Å; F71-E80 HydrophobicContact CZ-CB 3.99Å; F71-E80 WeakPolarHBondContact CZ-OE2 3.32Å; F71-E80 PolarHBondContact N-O 2.93Å; F71-E80 PolarHBondContact O-N 3.16Å; N73-E80 HydrophobicContact CB-CG 4.38Å; N73-E80 WeakPolarHBondContact CB-OE1 3.36Å; N73-E80 WeakPolarHBondContact CB-OE2 3.31Å; N73-E80 VanDerWaalsContact ND2-CD 3.28Å; N73-E80 PolarHBondContact ND2-OE1 2.03Å; N73-E80 VanDerWaalsContact ND2-OE1 3.08Å; N73-E80 PolarHBondContact ND2-OE2 3.17Å; T76-E80 WeakPolarHBondContact CB-OE1 3.48Å; T76-E80 VanDerWaalsContact CG2-OE1 3.25Å; T76-E80 WeakPolarHBondContact CG2-OE1 3.22Å; T76-E80 PolarHBondContact OG1-OE1 2.88Å
81	E	97.7	Very high	92.8	Very high	102 Å²	102	53.5 Å²	53.5	48%	0.477	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	142	175.1	-74.6	-169.2	-164	0	0	112.1	K68 R69 F70	K68-E81 WeakPolarHBondContact CD-OE2 3.42Å; K68-E81 VanDerWaalsContact CE-OE2 3.22Å; K68-E81 WeakPolarHBondContact CE-OE2 3.27Å; K68-E81 IonicContact NZ-OE1 3.56Å; K68-E81 IonicContact NZ-OE2 2.65Å; K68-E81 PolarHBondContact NZ-OE2 3.37Å; R69-E81 CarbonylContact O-C 3.56Å; R69-E81 WeakPolarHBondContact O-CA 3.23Å; F70-E81 HydrophobicContact CD1-CG 3.88Å; F70-E81 HydrophobicContact CE1-CG 3.33Å; F70-E81 HydrophobicContact CZ-CG 3.74Å
82	F	97.6	Very high	92.8	Very high	21 Å²	21	52.6 Å²	52.6	9%	0.092	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	170.3	165.7	83.5	-75.5	0	0	0	111.7	P58 D60 R69 F71 R93	P58-F82 HydrophobicContact CB-CB 4.14Å; P58-F82 HydrophobicContact CB-CD1 4.15Å; P58-F82 HydrophobicContact CB-CD2 3.72Å; P58-F82 HydrophobicContact CB-CE1 4.42Å; P58-F82 HydrophobicContact CB-CE2 4.04Å; P58-F82 HydrophobicContact CB-CG 3.76Å; P58-F82 HydrophobicContact CB-CZ 4.36Å; D60-F82 WeakPolarHBondContact OD1-CD2 3.43Å; R69-F82 HydrophobicContact CB-CD1 4.08Å; R69-F82 HydrophobicContact CB-CE1 3.7Å; R69-F82 HydrophobicContact CB-CZ 4.22Å; R69-F82 PolarHBondContact N-O 3.39Å; R69-F82 PolarHBondContact O-N 3.39Å; F71-F82 HydrophobicContact CB-CD1 4Å; F71-F82 HydrophobicContact CB-CE1 3.98Å; F71-F82 HydrophobicContact CD1-CB 4.04Å; F71-F82 AromaticContact CD1-CD1 3.76Å; F71-F82 HydrophobicContact CD1-CD1 3.76Å; F71-F82 HydrophobicContact CD1-CG 4.19Å; F71-F82 HydrophobicContact CE1-CB 4.27Å; F71-F82 HydrophobicContact CG-CD1 4.28Å; F82-R93 HydrophobicContact CE1-CB 4.2Å; F82-R93 HydrophobicContact CE1-CG 3.92Å; F82-R93 HydrophobicContact CZ-CB 4.03Å; F82-R93 HydrophobicContact CZ-CG 3.69Å
83	I	97.9	Very high	92.9	Very high	70 Å²	70	55.2 Å²	55.2	36%	0.359	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	102	-179.9	-57.3	-57	0	0	0	109.8	D60 I66 K68	D60-I83 WeakPolarHBondContact CB-O 2.99Å; I66-I83 HydrophobicContact CB-CG2 4.29Å; I66-I83 HydrophobicContact CG2-CD1 4.13Å; I66-I83 HydrophobicContact CG2-CG2 3.87Å; K68-I83 HydrophobicContact CG-CD1 4.08Å
84	Y	98.2	Very high	93.3	Very high	23 Å²	23	54.5 Å²	54.5	9%	0.09	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	127.7	172.1	174.8	-129.3	0	0	0	111.1	D60 M67 R69 G86 C87 G88 R93	D60-Y84 WeakPolarHBondContact O-CD2 3.01Å; M67-Y84 HydrophobicContact CB-CD1 4.43Å; M67-Y84 VanDerWaalsContact CB-O 3.3Å; M67-Y84 WeakPolarHBondContact CB-O 3.44Å; M67-Y84 PolarHBondContact N-O 3.5Å; M67-Y84 VanDerWaalsContact N-O 3.09Å; M67-Y84 PolarHBondContact O-N 2.93Å; M67-Y84 HydrophobicContact SD-CD1 4.24Å; R69-Y84 HydrophobicContact CG-CD1 4.25Å; R69-Y84 HydrophobicContact CG-CG 4.35Å; Y84-G86 VanDerWaalsContact CE1-CA 3.43Å; Y84-G86 VanDerWaalsContact CZ-C 3.42Å; Y84-G86 PolarHBondContact O-N 2.98Å; Y84-C87 WeakPolarHBondContact CE2-O 3.4Å; Y84-C87 WeakPolarHBondContact OH-CA 3.21Å; Y84-C87 PolarHBondContact OH-N 2.93Å; Y84-G88 PolarHBondContact OH-N 3.27Å; Y84-G88 PolarHBondContact OH-O 3.24Å; Y84-R93 VanDerWaalsContact CG-CD 3.5Å; Y84-R93 PolarHBondContact OH-NH1 2.93Å
85	G	97.3	Very high	93.8	Very high	5 Å²	5	58.8 Å²	58.8	5%	0.052	31%	0.308	C	S	.	.			trans	-66.8	-10.2	178.4	0	0	0	0	0	115.1	D60 C63 K64 A65	D60-G85 WeakPolarHBondContact O-CA 3.16Å; D60-G85 PolarHBondContact O-N 2.9Å; C63-G85 CarbonylContact C-O 3.54Å; C63-G85 WeakPolarHBondContact CB-O 3.23Å; C63-G85 VanDerWaalsContact O-CA 3.25Å; C63-G85 WeakPolarHBondContact O-CA 3.4Å; K64-G85 PolarHBondContact N-O 3.1Å; A65-G85 VanDerWaalsContact CB-O 3.27Å; A65-G85 WeakPolarHBondContact CB-O 3.12Å; A65-G85 PolarHBondContact N-O 3.5Å; A65-G85 WeakPolarHBondContact O-CA 3.16Å
86	G	95	Very high	94.5	Very high	32 Å²	32	52.5 Å²	52.5	33%	0.33	29%	0.285	S	S	.	.	S	Bend	trans	96.5	-5.4	172.4	0	0	0	0	0	116.1	Y84	Y84-G86 VanDerWaalsContact CE1-CA 3.43Å; Y84-G86 VanDerWaalsContact CZ-C 3.42Å; Y84-G86 PolarHBondContact O-N 2.98Å
87	C	95.8	Very high	95	Very high	40 Å²	40	51.7 Å²	51.7	27%	0.27	28%	0.278	S	S	.	.	S	Bend	trans	-145.9	156.2	168.7	77.2	0	0	0	0	111.6	G61 C63 Y84	G61-C87 WeakPolarHBondContact CA-O 3.25Å; C63-C87 HydrophobicContact CB-CB 3.88Å; C63-C87 WeakPolarHBondContact CB-SG 3.48Å; C63-C87 WeakPolarHBondContact SG-CB 2.98Å; C63-C87 CovalentContact SG-SG 2.03Å; C63-C87 PolarHBondContact SG-SG 3.25Å; Y84-C87 WeakPolarHBondContact CE2-O 3.4Å; Y84-C87 WeakPolarHBondContact OH-CA 3.21Å; Y84-C87 PolarHBondContact OH-N 2.93Å
88	G	95.8	Very high	95.5	Very high	48 Å²	48	54 Å²	54	50%	0.495	29%	0.292	S	S	.	.			trans	73.3	-131.3	-176.7	0	0	0	0	0	112	Y84 R93	Y84-G88 PolarHBondContact OH-N 3.27Å; Y84-G88 PolarHBondContact OH-O 3.24Å; G88-R93 PolarHBondContact O-NH1 3.16Å
89	G	94.3	Very high	95.7	Very high	27 Å²	27	52.2 Å²	52.2	28%	0.278	28%	0.284	S	S	.	.			trans	67.2	-175.6	-173.7	0	0	0	0	0	113.6	D59	D59-G89 WeakPolarHBondContact O-CA 3.35Å; D59-G89 VanDerWaalsContact OD2-CA 3.32Å; D59-G89 WeakPolarHBondContact OD2-CA 3.47Å
90	N	94.1	Very high	95.6	Very high	36 Å²	36	51.6 Å²	51.6	19%	0.193	28%	0.279	C	S	.	.			trans	-117.6	-170.3	176.2	69.6	70.3	0	0	0	112.3	F56 K57 D59 N92	F56-N90 WeakPolarHBondContact CB-OD1 3.23Å; F56-N90 HydrophobicContact CD2-CB 4.08Å; K57-N90 PolarHBondContact O-ND2 3.44Å; D59-N90 VanDerWaalsContact CB-ND2 3.3Å; D59-N90 WeakPolarHBondContact CB-ND2 3.39Å; N90-N92 WeakPolarHBondContact OD1-CB 3.46Å; N90-N92 PolarHBondContact OD1-N 3.3Å
91	Q	93.8	Very high	95.3	Very high	121 Å²	121	53 Å²	53	57%	0.565	29%	0.285	S	S	*	.	S	Bend	trans	-77.8	-13.9	-175	-68.3	142.4	-70.3	0	0	114.6	F53 R93	F53-Q91 HydrophobicContact CB-CB 3.72Å; F53-Q91 HydrophobicContact CD1-CB 4.23Å; F53-Q91 HydrophobicContact CD2-CB 3.83Å; F53-Q91 HydrophobicContact CG-CB 3.68Å; Q91-R93 PolarHBondContact O-N 2.86Å
92	N	95.9	Very high	94.8	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.29	C	S	.	.			trans	-79.1	57.7	175.4	-157.2	6.5	0	0	0	111.5	F53 C54 F56 F71 F72 N90 F94	F53-N92 WeakPolarHBondContact O-CB 3.28Å; C54-N92 PolarHBondContact O-ND2 3.16Å; C54-N92 VanDerWaalsContact O-ND2 3.08Å; F56-N92 HydrophobicContact CB-CB 4.27Å; F56-N92 PolarHBondContact O-ND2 3.09Å; F71-N92 WeakPolarHBondContact CB-O 3.14Å; F72-N92 PolarHBondContact N-ND2 2.84Å; F72-N92 PolarHBondContact N-OD1 2.82Å; F72-N92 PolarHBondContact O-ND2 2.77Å; N90-N92 WeakPolarHBondContact OD1-CB 3.46Å; N90-N92 PolarHBondContact OD1-N 3.3Å; N92-F94 WeakPolarHBondContact OD1-CE2 3.27Å
93	R	97.6	Very high	94.2	Very high	62 Å²	62	54.8 Å²	54.8	23%	0.234	29%	0.293	C	S	.	.			trans	-151.5	100.5	-172.2	-177.9	-171.7	59.2	-134.4	-10.6	111.7	R69 F70 F82 Y84 G88 Q91	R69-R93 HydrophobicContact CB-CG 3.78Å; R69-R93 HydrophobicContact CG-CG 3.77Å; F70-R93 CarbonylContact O-C 3.57Å; F70-R93 WeakPolarHBondContact O-CA 3.15Å; F82-R93 HydrophobicContact CE1-CB 4.2Å; F82-R93 HydrophobicContact CE1-CG 3.92Å; F82-R93 HydrophobicContact CZ-CB 4.03Å; F82-R93 HydrophobicContact CZ-CG 3.69Å; Y84-R93 VanDerWaalsContact CG-CD 3.5Å; Y84-R93 PolarHBondContact OH-NH1 2.93Å; G88-R93 PolarHBondContact O-NH1 3.16Å; Q91-R93 PolarHBondContact O-N 2.86Å
94	F	97.2	Very high	93.8	Very high	11 Å²	11	51.9 Å²	51.9	5%	0.048	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-106.3	157.8	-174.4	-52.3	-74.7	0	0	0	111.8	F53 R69 F70 N92 E99 C100 V103	F53-F94 HydrophobicContact CE2-CE1 4.46Å; F53-F94 HydrophobicContact CE2-CZ 4.11Å; R69-F94 WeakPolarHBondContact CD-O 3.37Å; F70-F94 HydrophobicContact CB-CB 4.33Å; F70-F94 PolarHBondContact N-O 3.03Å; F70-F94 WeakPolarHBondContact O-CD2 3.37Å; F70-F94 PolarHBondContact O-N 3.33Å; N92-F94 WeakPolarHBondContact OD1-CE2 3.27Å; F94-E99 WeakPolarHBondContact CA-OE2 3.41Å; F94-E99 HydrophobicContact CB-CB 4.22Å; F94-E99 HydrophobicContact CB-CG 4.19Å; F94-E99 WeakPolarHBondContact CB-OE2 3.35Å; F94-E99 HydrophobicContact CD1-CG 3.85Å; F94-E99 HydrophobicContact CG-CG 4.4Å; F94-C100 HydrophobicContact CB-CB 3.91Å; F94-C100 VanDerWaalsContact CD2-CA 3.48Å; F94-C100 HydrophobicContact CD2-CB 3.32Å; F94-C100 VanDerWaalsContact CD2-SG 3.54Å; F94-C100 HydrophobicContact CE2-CB 3.99Å; F94-C100 HydrophobicContact CG-CB 3.72Å; F94-V103 HydrophobicContact CE1-CB 3.82Å; F94-V103 HydrophobicContact CE1-CG1 3.77Å; F94-V103 HydrophobicContact CE1-CG2 4.07Å; F94-V103 HydrophobicContact CZ-CB 4.07Å; F94-V103 HydrophobicContact CZ-CG1 3.89Å
95	E	95.7	Very high	93.1	Very high	134 Å²	134	52 Å²	52	63%	0.626	28%	0.282	S	S	*	.	S	Bend	trans	-85.3	-24	178.9	-69.7	-167	171.3	0	0	113	R69 E99	R69-E95 VanDerWaalsContact CZ-CG 3.4Å; R69-E95 IonicContact CZ-OE1 3.15Å; R69-E95 IonicContact NH1-OE1 2.84Å; R69-E95 PolarHBondContact NH1-OE1 2.83Å; R69-E95 IonicContact NH2-OE1 2.7Å; R69-E95 PolarHBondContact NH2-OE1 2.81Å; E95-E99 PolarHBondContact N-OE2 3.31Å
96	S	96.1	Very high	91.7	Very high	39 Å²	39	57.2 Å²	57.2	27%	0.273	30%	0.3	S	S	.	.	S	Bend	trans	-139.1	162.8	174.1	97.6	0	0	0	0	113	E98 E99 C100	S96-E98 WeakPolarHBondContact CB-OE2 3.4Å; S96-E98 PolarHBondContact O-N 2.96Å; S96-E98 PolarHBondContact OG-N 3.16Å; S96-E98 PolarHBondContact OG-OE2 3.1Å; S96-E99 PolarHBondContact O-N 3.19Å; S96-E99 PolarHBondContact OG-N 3.18Å; S96-C100 PolarHBondContact O-N 3.32Å; S96-C100 VanDerWaalsContact O-N 3.12Å
97	L	93.6	Very high	89.9	Confident	47 Å²	47	61.2 Å²	61.2	25%	0.246	31%	0.314	C	S	.	.	H	α-helix	trans	-62.3	-35.6	175.9	-178	59.6	0	0	0	111.4	F70 C79 K101	F70-L97 HydrophobicContact CD1-CB 3.97Å; F70-L97 HydrophobicContact CD1-CD1 3.86Å; F70-L97 HydrophobicContact CE1-CB 3.73Å; F70-L97 HydrophobicContact CE1-CD1 4.05Å; F70-L97 HydrophobicContact CE1-CG 4.37Å; F70-L97 HydrophobicContact CE2-CB 4.49Å; F70-L97 HydrophobicContact CG-CB 4.44Å; F70-L97 HydrophobicContact CZ-CB 4.02Å; C79-L97 HydrophobicContact CB-CD1 3.52Å; C79-L97 WeakPolarHBondContact O-CD1 3.31Å; L97-K101 HydrophobicContact CD1-CD 4.46Å; L97-K101 HydrophobicContact CG-CD 4.2Å; L97-K101 WeakPolarHBondContact O-CB 3.35Å; L97-K101 VanDerWaalsContact O-CG 3.25Å; L97-K101 WeakPolarHBondContact O-CG 3.06Å; L97-K101 PolarHBondContact O-N 2.76Å
98	E	91.3	Very high	87.9	Confident	123 Å²	123	61.8 Å²	61.8	58%	0.575	31%	0.314	S	S	*	.	H	α-helix	trans	-71.7	-38.1	179.6	-55.2	66.3	-138.4	0	0	111.4	S96 K102	S96-E98 WeakPolarHBondContact CB-OE2 3.4Å; S96-E98 PolarHBondContact O-N 2.96Å; S96-E98 PolarHBondContact OG-N 3.16Å; S96-E98 PolarHBondContact OG-OE2 3.1Å; E98-K102 WeakPolarHBondContact O-CB 3.24Å; E98-K102 PolarHBondContact O-N 2.91Å
99	E	92.9	Very high	85.8	Confident	85 Å²	85	63.6 Å²	63.6	40%	0.397	32%	0.316	S	S	.	.	H	α-helix	trans	-63	-50	172.7	-175.2	-176	-145.1	0	0	110.5	F94 E95 S96 K101 K102 V103	F94-E99 WeakPolarHBondContact CA-OE2 3.41Å; F94-E99 HydrophobicContact CB-CB 4.22Å; F94-E99 HydrophobicContact CB-CG 4.19Å; F94-E99 WeakPolarHBondContact CB-OE2 3.35Å; F94-E99 HydrophobicContact CD1-CG 3.85Å; F94-E99 HydrophobicContact CG-CG 4.4Å; E95-E99 PolarHBondContact N-OE2 3.31Å; S96-E99 PolarHBondContact O-N 3.19Å; S96-E99 PolarHBondContact OG-N 3.18Å; E99-K101 PolarHBondContact O-N 2.76Å; E99-K102 PolarHBondContact O-N 2.84Å; E99-V103 WeakPolarHBondContact O-CG2 3.49Å; E99-V103 PolarHBondContact O-N 2.77Å
100	C	93.5	Very high	83.6	Confident	0 Å²	0	68 Å²	68	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-56.2	-50.1	176.7	179.7	0	0	0	0	112	F70 F71 C79 F94 S96 K102 V103 C104	F70-C100 HydrophobicContact CB-CB 4.04Å; F71-C100 VanDerWaalsContact C-SG 3.56Å; C79-C100 HydrophobicContact CB-CB 3.7Å; C79-C100 WeakPolarHBondContact CB-SG 3.44Å; C79-C100 WeakPolarHBondContact SG-CB 3.03Å; C79-C100 CovalentContact SG-SG 2.03Å; C79-C100 PolarHBondContact SG-SG 2.94Å; F94-C100 HydrophobicContact CB-CB 3.91Å; F94-C100 VanDerWaalsContact CD2-CA 3.48Å; F94-C100 HydrophobicContact CD2-CB 3.32Å; F94-C100 VanDerWaalsContact CD2-SG 3.54Å; F94-C100 HydrophobicContact CE2-CB 3.99Å; F94-C100 HydrophobicContact CG-CB 3.72Å; S96-C100 PolarHBondContact O-N 3.32Å; S96-C100 VanDerWaalsContact O-N 3.12Å; C100-K102 PolarHBondContact O-N 3.37Å; C100-V103 PolarHBondContact O-N 2.88Å; C100-C104 WeakPolarHBondContact O-CB 3.03Å; C100-C104 PolarHBondContact O-N 3.04Å
101	K	89.7	Confident	81.4	Confident	88 Å²	88	74.9 Å²	74.9	38%	0.383	36%	0.356	S	S	.	.	H	α-helix	trans	-58.6	-49.6	177.3	-75.2	172.6	178.2	176.6	0	110.8	C79 L97 E99 V103 C104 T105	C79-K101 HydrophobicContact CB-CG 4.25Å; C79-K101 PolarHBondContact SG-N 2.94Å; C79-K101 VanDerWaalsContact SG-N 3.36Å; L97-K101 HydrophobicContact CD1-CD 4.46Å; L97-K101 HydrophobicContact CG-CD 4.2Å; L97-K101 WeakPolarHBondContact O-CB 3.35Å; L97-K101 VanDerWaalsContact O-CG 3.25Å; L97-K101 WeakPolarHBondContact O-CG 3.06Å; L97-K101 PolarHBondContact O-N 2.76Å; E99-K101 PolarHBondContact O-N 2.76Å; K101-V103 PolarHBondContact O-N 2.72Å; K101-C104 PolarHBondContact O-N 3.21Å; K101-T105 HydrophobicContact CB-CG2 4.33Å; K101-T105 HydrophobicContact CG-CG2 4.09Å; K101-T105 PolarHBondContact O-N 3.33Å; K101-T105 PolarHBondContact O-OG1 2.94Å
102	K	86.7	Confident	79.3	Confident	132 Å²	132	73.9 Å²	73.9	57%	0.574	35%	0.354	S	S	*	.	H	α-helix	trans	-56.8	-36.1	179.5	-177.8	-168.8	169.5	-161.9	0	113.1	E98 E99 C100 N108	E98-K102 WeakPolarHBondContact O-CB 3.24Å; E98-K102 PolarHBondContact O-N 2.91Å; E99-K102 PolarHBondContact O-N 2.84Å; C100-K102 PolarHBondContact O-N 3.37Å; K102-N108 WeakPolarHBondContact CA-ND2 3.17Å; K102-N108 PolarHBondContact O-ND2 2.87Å
103	V	86.3	Confident	77.1	Confident	28 Å²	28	79.5 Å²	79.5	17%	0.17	38%	0.382	C	S	.	.	H	α-helix	trans	-88.4	-28.6	-175.7	177.1	0	0	0	0	113.2	H51 F53 F94 E99 C100 K101	H51-V103 PolarHBondContact ND1-O 3.45Å; F53-V103 HydrophobicContact CE2-CG1 3.87Å; F53-V103 HydrophobicContact CZ-CG1 3.89Å; F94-V103 HydrophobicContact CE1-CB 3.82Å; F94-V103 HydrophobicContact CE1-CG1 3.77Å; F94-V103 HydrophobicContact CE1-CG2 4.07Å; F94-V103 HydrophobicContact CZ-CB 4.07Å; F94-V103 HydrophobicContact CZ-CG1 3.89Å; E99-V103 WeakPolarHBondContact O-CG2 3.49Å; E99-V103 PolarHBondContact O-N 2.77Å; C100-V103 PolarHBondContact O-N 2.88Å; K101-V103 PolarHBondContact O-N 2.72Å
104	C	88.2	Confident	74.6	Confident	8 Å²	8	85.3 Å²	85.3	5%	0.054	41%	0.412	C	S	.	.	H	α-helix	trans	-126.1	-23	-169.6	-61.9	0	0	0	0	116.5	C54 F72 C100 K101	C54-C104 HydrophobicContact CB-CB 3.73Å; C54-C104 WeakPolarHBondContact CB-SG 3.32Å; C54-C104 VanDerWaalsContact SG-CA 3.51Å; C54-C104 WeakPolarHBondContact SG-CB 2.99Å; C54-C104 CovalentContact SG-SG 2.04Å; C54-C104 PolarHBondContact SG-SG 3.35Å; F72-C104 HydrophobicContact CB-CB 3.6Å; F72-C104 HydrophobicContact CD1-CB 4.15Å; F72-C104 HydrophobicContact CD2-CB 3.71Å; F72-C104 HydrophobicContact CE2-CB 4.43Å; F72-C104 HydrophobicContact CG-CB 3.53Å; C100-C104 WeakPolarHBondContact O-CB 3.03Å; C100-C104 PolarHBondContact O-N 3.04Å; K101-C104 PolarHBondContact O-N 3.21Å
105	T	84	Confident	71.8	Confident	26 Å²	26	89.7 Å²	89.7	16%	0.16	44%	0.44	C	S	.	.	S	Bend	trans	-88.2	154.6	175.2	67.7	0	0	0	0	112.1	F72 K101 D107	F72-T105 HydrophobicContact CD2-CG2 4.26Å; F72-T105 HydrophobicContact CE2-CG2 3.81Å; K101-T105 HydrophobicContact CB-CG2 4.33Å; K101-T105 HydrophobicContact CG-CG2 4.09Å; K101-T105 PolarHBondContact O-N 3.33Å; K101-T105 PolarHBondContact O-OG1 2.94Å; T105-D107 WeakPolarHBondContact CB-OD2 3.28Å; T105-D107 PolarHBondContact O-N 3Å; T105-D107 PolarHBondContact OG1-OD2 3.49Å
106	R	67.8	Low	69.4	Low	114 Å²	114	87.3 Å²	87.3	43%	0.43	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-79.1	1.1	-175.7	-67.9	-178.4	175.2	170.9	-2.1	113.9	K48 N108 V109	K48-R106 PolarHBondContact O-NH2 2.83Å; R106-N108 PolarHBondContact O-N 2.98Å; R106-N108 VanDerWaalsContact O-N 3.08Å; R106-V109 VanDerWaalsContact O-CG2 3.3Å; R106-V109 WeakPolarHBondContact O-CG2 3.46Å; R106-V109 PolarHBondContact O-N 3.43Å; R106-V109 VanDerWaalsContact O-N 3.07Å
107	D	57.1	Low	67.1	Low	117 Å²	117	92.9 Å²	92.9	63%	0.626	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-65.6	-16.7	-172.3	-50.7	-54.7	0	0	0	113.6	T105 V109	T105-D107 WeakPolarHBondContact CB-OD2 3.28Å; T105-D107 PolarHBondContact O-N 3Å; T105-D107 PolarHBondContact OG1-OD2 3.49Å; D107-V109 VanDerWaalsContact C-N 3.27Å; D107-V109 PolarHBondContact O-N 2.79Å
108	N	54	Low	64.8	Low	51 Å²	51	97.8 Å²	97.8	27%	0.273	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-74.3	-5.1	173.4	-81.7	-53.7	0	0	0	114.9	K102 R106 N110 R111	K102-N108 WeakPolarHBondContact CA-ND2 3.17Å; K102-N108 PolarHBondContact O-ND2 2.87Å; R106-N108 PolarHBondContact O-N 2.98Å; R106-N108 VanDerWaalsContact O-N 3.08Å; N108-N110 PolarHBondContact O-N 3.47Å; N108-N110 VanDerWaalsContact O-N 3.15Å; N108-R111 WeakPolarHBondContact O-CB 3.44Å; N108-R111 PolarHBondContact O-N 2.94Å; N108-R111 WeakPolarHBondContact OD1-CD 3.47Å
109	V	52.8	Low	63	Low	87 Å²	87	101.4 Å²	101.4	53%	0.527	51%	0.508	S	S	.	.	H	α-helix	trans	-53.1	-35.5	171.5	168.3	0	0	0	0	111.2	R106 D107 R111 I112	R106-V109 VanDerWaalsContact O-CG2 3.3Å; R106-V109 WeakPolarHBondContact O-CG2 3.46Å; R106-V109 PolarHBondContact O-N 3.43Å; R106-V109 VanDerWaalsContact O-N 3.07Å; D107-V109 VanDerWaalsContact C-N 3.27Å; D107-V109 PolarHBondContact O-N 2.79Å; V109-R111 VanDerWaalsContact C-N 3.28Å; V109-R111 PolarHBondContact O-N 3.34Å; V109-I112 WeakPolarHBondContact O-CB 3.39Å; V109-I112 PolarHBondContact O-N 2.55Å
110	N	48.3	Very low	61.8	Low	120 Å²	120	104.8 Å²	104.8	64%	0.642	52%	0.523	S	S	*	.	H	α-helix	trans	-75.3	-8.2	177.9	-69.9	-23.5	0	0	0	114.7	N108	N108-N110 PolarHBondContact O-N 3.47Å; N108-N110 VanDerWaalsContact O-N 3.15Å
111	R	47.7	Very low	61	Low	180 Å²	180	106 Å²	106	68%	0.679	53%	0.529	S	S	*	.	H	α-helix	trans	-81.2	-26.5	169.8	-68.1	-164.8	70	167.2	0.3	112.8	N108 V109 I113 Q114	N108-R111 WeakPolarHBondContact O-CB 3.44Å; N108-R111 PolarHBondContact O-N 2.94Å; N108-R111 WeakPolarHBondContact OD1-CD 3.47Å; V109-R111 VanDerWaalsContact C-N 3.28Å; V109-R111 PolarHBondContact O-N 3.34Å; R111-I113 PolarHBondContact O-N 3.07Å; R111-Q114 PolarHBondContact O-N 2.86Å
112	I	49.3	Very low	60.7	Low	100 Å²	100	104.1 Å²	104.1	51%	0.513	53%	0.526	S	S	.	.	H	α-helix	trans	-62.3	-30.4	176.4	-55.1	176	0	0	0	110.6	V109 Q114 T115	V109-I112 WeakPolarHBondContact O-CB 3.39Å; V109-I112 PolarHBondContact O-N 2.55Å; I112-Q114 VanDerWaalsContact C-N 3.31Å; I112-Q114 PolarHBondContact O-N 3.22Å; I112-T115 PolarHBondContact O-N 2.87Å; I112-T115 PolarHBondContact O-OG1 3.45Å
113	I	50.3	Low	60.3	Low	117 Å²	117	103.7 Å²	103.7	60%	0.6	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-72.5	-19.9	-176.5	-57.3	177.7	0	0	0	112.7	R111 A116	R111-I113 PolarHBondContact O-N 3.07Å; I113-A116 WeakPolarHBondContact O-CB 3.03Å
114	Q	43.3	Very low	60.1	Low	184 Å²	184	104.7 Å²	104.7	86%	0.86	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-95.6	-1.4	175.3	-75.2	-168.3	-6.6	0	0	114.7	R111 I112 A116	R111-Q114 PolarHBondContact O-N 2.86Å; I112-Q114 VanDerWaalsContact C-N 3.31Å; I112-Q114 PolarHBondContact O-N 3.22Å; Q114-A116 VanDerWaalsContact C-N 3.26Å
115	T	39.6	Very low	60.1	Low	103 Å²	103	104.3 Å²	104.3	63%	0.632	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-91.5	20.4	163.8	37.6	0	0	0	0	112.7	I112 L117	I112-T115 PolarHBondContact O-N 2.87Å; I112-T115 PolarHBondContact O-OG1 3.45Å; T115-L117 PolarHBondContact O-N 2.85Å
116	A	45.6	Very low	60.1	Low	84 Å²	84	107.3 Å²	107.3	69%	0.694	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	62.4	178.2	0	0	0	0	0	113.5	I113 Q114	I113-A116 WeakPolarHBondContact O-CB 3.03Å; Q114-A116 VanDerWaalsContact C-N 3.26Å
117	L	47.7	Very low	60.8	Low	156 Å²	156	103.7 Å²	103.7	82%	0.817	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-149	2.1	172.4	-116.2	169.3	0	0	0	114.6	T115	T115-L117 PolarHBondContact O-N 2.85Å
118	Q	44.3	Very low	62.3	Low	151 Å²	151	105.2 Å²	105.2	71%	0.706	53%	0.533	S	S	*	.	S	Bend	trans	-145.7	148.5	169.1	-117.8	112.3	105.5	0	0	110.5	E120	Q118-E120 VanDerWaalsContact C-N 3.32Å; Q118-E120 HydrophobicContact CB-CG 4.42Å; Q118-E120 PolarHBondContact O-N 2.84Å; Q118-E120 VanDerWaalsContact O-N 3.12Å
119	Q	54.7	Low	64.2	Low	199 Å²	199	107.4 Å²	107.4	93%	0.93	54%	0.541	S	S	*	.			trans	-84.2	72.8	176.7	-68.6	171.6	-35.3	0	0	109.9
120	E	67.4	Low	66	Low	155 Å²	155	104.8 Å²	104.8	72%	0.724	52%	0.524	S	S	*	.			trans	-105.2	136.9	172.8	-66	-169.8	171.4	0	0	110.7	Q118	Q118-E120 VanDerWaalsContact C-N 3.32Å; Q118-E120 HydrophobicContact CB-CG 4.42Å; Q118-E120 PolarHBondContact O-N 2.84Å; Q118-E120 VanDerWaalsContact O-N 3.12Å
121	K	76.9	Confident	68.1	Low	27 Å²	27	102.2 Å²	102.2	12%	0.117	51%	0.514	C	S	.	.			trans	-65.9	157.5	-179.2	61.6	-173.9	157.3	-143.9	0	112.8	C125 F126 Y143 C175 D177	K121-C125 HydrophobicContact CD-CB 3.9Å; K121-C125 HydrophobicContact CG-CB 4.06Å; K121-F126 HydrophobicContact CD-CZ 4.43Å; K121-F126 HydrophobicContact CG-CE2 4.01Å; K121-F126 HydrophobicContact CG-CZ 3.84Å; K121-Y143 PolarHBondContact NZ-OH 2.84Å; K121-C175 HydrophobicContact CD-CB 4.35Å; K121-C175 WeakPolarHBondContact CD-O 3.33Å; K121-C175 WeakPolarHBondContact CE-O 3.45Å; K121-C175 PolarHBondContact NZ-O 2.85Å; K121-D177 VanDerWaalsContact NZ-CG 3.34Å; K121-D177 IonicContact NZ-OD1 3.07Å; K121-D177 PolarHBondContact NZ-OD1 2.77Å; K121-D177 IonicContact NZ-OD2 3.22Å; K121-D177 PolarHBondContact NZ-OD2 3.07Å
122	P	82.8	Confident	70	Confident	48 Å²	48	94.9 Å²	94.9	31%	0.312	49%	0.494	S	S	.	.			trans	-54.5	143.4	-174.9	-27.3	35	0	0	0	114.4	F124 C125 T174	P122-F124 HydrophobicContact CB-CD1 3.67Å; P122-F124 HydrophobicContact CB-CD2 4.36Å; P122-F124 HydrophobicContact CB-CE1 3.33Å; P122-F124 HydrophobicContact CB-CE2 4.05Å; P122-F124 HydrophobicContact CB-CG 4.18Å; P122-F124 HydrophobicContact CB-CZ 3.54Å; P122-F124 HydrophobicContact CG-CE1 3.98Å; P122-F124 HydrophobicContact CG-CE2 4.42Å; P122-F124 HydrophobicContact CG-CZ 3.79Å; P122-F124 PolarHBondContact O-N 2.88Å; P122-C125 VanDerWaalsContact O-CB 3.25Å; P122-C125 WeakPolarHBondContact O-CB 3.16Å; P122-C125 PolarHBondContact O-N 2.84Å; P122-T174 HydrophobicContact CG-CG2 4.47Å
123	D	78	Confident	71.3	Confident	123 Å²	123	95.9 Å²	95.9	66%	0.658	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-47.7	-35.3	179.1	-74.2	-18.4	0	0	0	113.6	C125 F126	D123-C125 VanDerWaalsContact C-N 3.26Å; D123-C125 PolarHBondContact O-N 2.7Å; D123-F126 WeakPolarHBondContact O-CD2 3.33Å; D123-F126 PolarHBondContact O-N 3.23Å; D123-F126 VanDerWaalsContact O-N 3.15Å
124	F	81.9	Confident	73	Confident	49 Å²	49	93 Å²	93	22%	0.215	49%	0.489	C	S	.	.	G	3₁₀ helix	trans	-66.4	-23.5	179.8	59.9	-106.9	0	0	0	114.1	P122 F126 L127 M162 N163 F165 T174	P122-F124 HydrophobicContact CB-CD1 3.67Å; P122-F124 HydrophobicContact CB-CD2 4.36Å; P122-F124 HydrophobicContact CB-CE1 3.33Å; P122-F124 HydrophobicContact CB-CE2 4.05Å; P122-F124 HydrophobicContact CB-CG 4.18Å; P122-F124 HydrophobicContact CB-CZ 3.54Å; P122-F124 HydrophobicContact CG-CE1 3.98Å; P122-F124 HydrophobicContact CG-CE2 4.42Å; P122-F124 HydrophobicContact CG-CZ 3.79Å; P122-F124 PolarHBondContact O-N 2.88Å; F124-F126 PolarHBondContact O-N 2.94Å; F124-F126 VanDerWaalsContact O-N 3.12Å; F124-L127 HydrophobicContact CB-CD1 3.94Å; F124-L127 WeakPolarHBondContact O-CB 3.34Å; F124-L127 WeakPolarHBondContact O-CG 3.25Å; F124-L127 PolarHBondContact O-N 2.65Å; F124-M162 HydrophobicContact CB-CB 3.38Å; F124-M162 HydrophobicContact CB-CG 4.46Å; F124-M162 HydrophobicContact CB-SD 4.38Å; F124-M162 HydrophobicContact CD1-CB 4.1Å; F124-M162 HydrophobicContact CD1-SD 3.95Å; F124-M162 HydrophobicContact CD2-CB 4.14Å; F124-M162 HydrophobicContact CG-CB 3.64Å; F124-M162 HydrophobicContact CG-SD 4.41Å; F124-N163 WeakPolarHBondContact O-CB 3.48Å; F124-F165 HydrophobicContact CE2-CE1 4.39Å; F124-F165 AromaticContact CE2-CZ 4Å; F124-F165 HydrophobicContact CE2-CZ 4Å; F124-T174 HydrophobicContact CE2-CG2 3.7Å; F124-T174 HydrophobicContact CZ-CG2 3.8Å
125	C	88.4	Confident	75.2	Confident	0 Å²	0	95.4 Å²	95.4	0%	0	49%	0.49	C	S	.	.	G	3₁₀ helix	trans	-62.9	-15	173.9	-63.3	0	0	0	0	112.8	K121 P122 D123 Y143 C175	K121-C125 HydrophobicContact CD-CB 3.9Å; K121-C125 HydrophobicContact CG-CB 4.06Å; P122-C125 VanDerWaalsContact O-CB 3.25Å; P122-C125 WeakPolarHBondContact O-CB 3.16Å; P122-C125 PolarHBondContact O-N 2.84Å; D123-C125 VanDerWaalsContact C-N 3.26Å; D123-C125 PolarHBondContact O-N 2.7Å; C125-Y143 VanDerWaalsContact O-CD1 3.27Å; C125-Y143 WeakPolarHBondContact O-CD1 3.23Å; C125-C175 HydrophobicContact CB-CB 3.69Å; C125-C175 WeakPolarHBondContact CB-SG 3.4Å; C125-C175 VanDerWaalsContact SG-CA 3.54Å; C125-C175 WeakPolarHBondContact SG-CB 3.39Å; C125-C175 CovalentContact SG-SG 2.04Å; C125-C175 PolarHBondContact SG-SG 3.2Å
126	F	84.6	Confident	77.4	Confident	88 Å²	88	92 Å²	92	39%	0.386	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-96.2	-0.3	179.7	-57.1	-80.4	0	0	0	113.8	K121 D123 F124	K121-F126 HydrophobicContact CD-CZ 4.43Å; K121-F126 HydrophobicContact CG-CE2 4.01Å; K121-F126 HydrophobicContact CG-CZ 3.84Å; D123-F126 WeakPolarHBondContact O-CD2 3.33Å; D123-F126 PolarHBondContact O-N 3.23Å; D123-F126 VanDerWaalsContact O-N 3.15Å; F124-F126 PolarHBondContact O-N 2.94Å; F124-F126 VanDerWaalsContact O-N 3.12Å
127	L	81.8	Confident	79.6	Confident	39 Å²	39	97 Å²	97	20%	0.204	48%	0.479	C	S	.	.	S	Bend	trans	-76.8	153	176.1	-58.1	171	0	0	0	111.4	M50 F124 N161 N163	M50-L127 WeakPolarHBondContact O-CD1 3.34Å; F124-L127 HydrophobicContact CB-CD1 3.94Å; F124-L127 WeakPolarHBondContact O-CB 3.34Å; F124-L127 WeakPolarHBondContact O-CG 3.25Å; F124-L127 PolarHBondContact O-N 2.65Å; L127-N161 HydrophobicContact CD1-CB 4.07Å; L127-N163 HydrophobicContact CB-CB 4.2Å; L127-N163 PolarHBondContact O-ND2 2.82Å
128	E	88.9	Confident	81.9	Confident	149 Å²	149	92.9 Å²	92.9	70%	0.696	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-75.3	164.4	173	-61.5	-179	151.2	0	0	111.2	N161	E128-N161 PolarHBondContact O-ND2 3.32Å
129	E	93.6	Very high	84.4	Confident	97 Å²	97	89.4 Å²	89.4	45%	0.453	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-65.1	142.7	175	69.9	-82.9	-153	0	0	111.9	F142 F153	E129-F142 HydrophobicContact CB-CB 4.44Å; E129-F142 HydrophobicContact CB-CD1 3.88Å; E129-F142 HydrophobicContact CB-CD2 3.7Å; E129-F142 HydrophobicContact CB-CE1 3.96Å; E129-F142 HydrophobicContact CB-CE2 3.76Å; E129-F142 HydrophobicContact CB-CG 3.75Å; E129-F142 HydrophobicContact CB-CZ 3.89Å; E129-F142 HydrophobicContact CG-CE1 4.33Å; E129-F142 HydrophobicContact CG-CE2 4.32Å; E129-F142 HydrophobicContact CG-CZ 4.12Å; E129-F142 VanDerWaalsContact OE2-CE2 3.23Å; E129-F142 WeakPolarHBondContact OE2-CE2 2.98Å; E129-F142 WeakPolarHBondContact OE2-CZ 3.5Å; E129-F153 HydrophobicContact CB-CB 4.13Å; E129-F153 HydrophobicContact CB-CD1 4.42Å; E129-F153 HydrophobicContact CB-CD2 4.03Å; E129-F153 HydrophobicContact CB-CG 3.96Å; E129-F153 HydrophobicContact CG-CB 4.27Å
130	D	91.4	Very high	86.4	Confident	32 Å²	32	82.2 Å²	82.2	17%	0.171	41%	0.41	C	S	.	.			trans	-134.9	100.5	-176.3	-166.6	-32.1	0	0	0	111.5	S52 G132 F153 N161	S52-D130 WeakPolarHBondContact CB-OD2 3.47Å; S52-D130 PolarHBondContact OG-OD2 3.33Å; D130-G132 PolarHBondContact O-N 2.77Å; D130-G132 WeakPolarHBondContact OD1-CA 3.25Å; D130-G132 PolarHBondContact OD1-N 2.68Å; D130-F153 WeakPolarHBondContact O-CE2 3.42Å; D130-N161 HydrophobicContact CB-CB 4.45Å; D130-N161 WeakPolarHBondContact CB-ND2 3.27Å
131	P	92.4	Very high	87.8	Confident	66 Å²	66	77.7 Å²	77.7	43%	0.429	39%	0.387	S	S	.	.			trans	-59.6	-20.4	175.2	-26.9	36.6	0	0	0	114.6	K154 G156	P131-K154 WeakPolarHBondContact CB-O 3.05Å; P131-G156 VanDerWaalsContact O-CA 3.27Å; P131-G156 WeakPolarHBondContact O-CA 3.07Å; P131-G156 PolarHBondContact O-N 2.86Å
132	G	86.8	Confident	88.8	Confident	26 Å²	26	76.7 Å²	76.7	27%	0.268	38%	0.382	S	S	.	.			trans	69.6	-170.2	-171	0	0	0	0	0	113.8	D130 C158	D130-G132 PolarHBondContact O-N 2.77Å; D130-G132 WeakPolarHBondContact OD1-CA 3.25Å; D130-G132 PolarHBondContact OD1-N 2.68Å; G132-C158 WeakPolarHBondContact CA-O 3.27Å
133	I	76.3	Confident	89.3	Confident	121 Å²	121	74.5 Å²	74.5	62%	0.621	37%	0.368	S	S	*	.	S	Bend	trans	-92.9	-20.7	-174.1	-163.9	168.8	0	0	0	113.8	L159	I133-L159 HydrophobicContact CB-CD1 4.33Å; I133-L159 HydrophobicContact CG2-CD1 3.61Å; I133-L159 HydrophobicContact CG2-CG 4.05Å
134	C	86	Confident	90	Very high	57 Å²	57	69.8 Å²	69.8	39%	0.385	34%	0.343	S	S	.	.	S	Bend	trans	-73.9	159.1	179	-73.6	0	0	0	0	112.1	G156 C158	C134-G156 CarbonylContact C-O 3.55Å; C134-G156 WeakPolarHBondContact CB-O 3.01Å; C134-G156 WeakPolarHBondContact O-CA 3.27Å; C134-C158 HydrophobicContact CB-CB 3.89Å; C134-C158 WeakPolarHBondContact CB-SG 3.29Å; C134-C158 WeakPolarHBondContact SG-CB 3.01Å; C134-C158 CovalentContact SG-SG 2.03Å; C134-C158 PolarHBondContact SG-SG 3.29Å
135	R	89.6	Confident	90.1	Very high	233 Å²	233	70.1 Å²	70.1	88%	0.879	35%	0.347	S	S	*	.			trans	-107.3	22.6	-171.6	-61.2	-177.8	-179.4	174	0.1	114.1
136	G	85.6	Confident	89.8	Confident	33 Å²	33	78.1 Å²	78.1	34%	0.34	38%	0.384	S	S	.	.			trans	-67	164.6	170.9	0	0	0	0	0	112.4	G156	G136-G156 VanDerWaalsContact CA-O 3.28Å; G136-G156 WeakPolarHBondContact CA-O 3.43Å; G136-G156 PolarHBondContact N-O 3.19Å
137	Y	92.9	Very high	90	Very high	189 Å²	189	75.7 Å²	75.7	74%	0.741	38%	0.378	S	S	*	.			trans	-121	48	178.3	-73.3	-88.8	0	0	0	110.4	K154	Y137-K154 HydrophobicContact CD1-CD 4.23Å
138	I	95.2	Very high	90.4	Very high	68 Å²	68	79.2 Å²	79.2	35%	0.349	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	127.4	-179.1	-47.8	-173.6	0	0	0	108	R140 Y155	I138-R140 HydrophobicContact CG2-CG 4.09Å; I138-Y155 HydrophobicContact CB-CD1 4.4Å; I138-Y155 WeakPolarHBondContact CB-O 3.41Å; I138-Y155 HydrophobicContact CD1-CD1 4.41Å; I138-Y155 PolarHBondContact N-O 2.03Å; I138-Y155 PolarHBondContact O-N 2.9Å
139	T	96.4	Very high	90.5	Very high	79 Å²	79	77.3 Å²	77.3	49%	0.485	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	124.7	170.6	-60.6	0	0	0	0	108.2	R152	T139-R152 HydrophobicContact CG2-CB 4.13Å
140	R	97.4	Very high	90.7	Very high	48 Å²	48	73.2 Å²	73.2	18%	0.181	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	165.3	175.3	-71.4	-66.4	177.1	77.4	-10.3	109.8	I138 R152 F153 Y155 N164 F165 E166	I138-R140 HydrophobicContact CG2-CG 4.09Å; R140-R152 CarbonylContact O-C 3.18Å; R140-R152 WeakPolarHBondContact O-CA 3.48Å; R140-F153 HydrophobicContact CB-CD1 4.21Å; R140-F153 HydrophobicContact CB-CE1 3.64Å; R140-F153 HydrophobicContact CB-CZ 4Å; R140-F153 PolarHBondContact N-O 3.34Å; R140-F153 VanDerWaalsContact N-O 3.15Å; R140-F153 VanDerWaalsContact O-CD1 3.31Å; R140-F153 WeakPolarHBondContact O-CD1 3.23Å; R140-F153 PolarHBondContact O-N 3.35Å; R140-Y155 HydrophobicContact CG-CD1 3.97Å; R140-Y155 HydrophobicContact CG-CG 4.19Å; R140-N164 WeakPolarHBondContact CG-OD1 3.45Å; R140-N164 PolarHBondContact NH1-OD1 2.91Å; R140-F165 WeakPolarHBondContact CD-O 3.04Å; R140-E166 IonicContact CZ-OE1 2.72Å; R140-E166 VanDerWaalsContact CZ-OE1 3.22Å; R140-E166 IonicContact NE-OE1 2.65Å; R140-E166 PolarHBondContact NE-OE1 3.36Å; R140-E166 IonicContact NH2-OE1 2.67Å; R140-E166 PolarHBondContact NH2-OE1 3.3Å
141	Y	97.6	Very high	90.9	Very high	59 Å²	59	75 Å²	75	23%	0.231	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	147.8	-179.5	-60	-90.1	0	0	0	111.2	E151 R152 N164 F165 E166 L168	Y141-E151 CarbonylContact C-O 3.53Å; Y141-E151 VanDerWaalsContact CA-O 3.25Å; Y141-E151 WeakPolarHBondContact CA-O 3.21Å; Y141-R152 HydrophobicContact CD1-CB 4.02Å; Y141-R152 HydrophobicContact CE1-CB 3.81Å; Y141-N164 WeakPolarHBondContact O-CA 3.34Å; Y141-F165 PolarHBondContact N-O 2.86Å; Y141-F165 WeakPolarHBondContact O-CD2 3.38Å; Y141-F165 PolarHBondContact O-N 2.88Å; Y141-E166 WeakPolarHBondContact CD2-O 3.32Å; Y141-L168 HydrophobicContact CD1-CB 4.03Å; Y141-L168 HydrophobicContact CD1-CD1 3.77Å; Y141-L168 HydrophobicContact CE1-CB 3.87Å; Y141-L168 HydrophobicContact CE1-CD1 4.05Å; Y141-L168 HydrophobicContact CE1-CG 4.46Å; Y141-L168 HydrophobicContact CE2-CB 4.42Å; Y141-L168 HydrophobicContact CG-CB 4.37Å
142	F	96.8	Very high	91.1	Very high	6 Å²	6	81 Å²	81	3%	0.026	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	151.6	173.1	81.2	-70.3	0	0	0	109.2	E129 N144 C150 E151 F153 N163	E129-F142 HydrophobicContact CB-CB 4.44Å; E129-F142 HydrophobicContact CB-CD1 3.88Å; E129-F142 HydrophobicContact CB-CD2 3.7Å; E129-F142 HydrophobicContact CB-CE1 3.96Å; E129-F142 HydrophobicContact CB-CE2 3.76Å; E129-F142 HydrophobicContact CB-CG 3.75Å; E129-F142 HydrophobicContact CB-CZ 3.89Å; E129-F142 HydrophobicContact CG-CE1 4.33Å; E129-F142 HydrophobicContact CG-CE2 4.32Å; E129-F142 HydrophobicContact CG-CZ 4.12Å; E129-F142 VanDerWaalsContact OE2-CE2 3.23Å; E129-F142 WeakPolarHBondContact OE2-CE2 2.98Å; E129-F142 WeakPolarHBondContact OE2-CZ 3.5Å; F142-N144 HydrophobicContact CD2-CB 4.49Å; F142-N144 HydrophobicContact CE2-CB 3.74Å; F142-N144 HydrophobicContact CZ-CB 3.78Å; F142-N144 PolarHBondContact O-N 3.09Å; F142-C150 CarbonylContact O-C 3.55Å; F142-C150 WeakPolarHBondContact O-CA 3.05Å; F142-E151 HydrophobicContact CD1-CB 4.25Å; F142-E151 WeakPolarHBondContact CD1-O 2.97Å; F142-E151 HydrophobicContact CE1-CB 3.73Å; F142-E151 HydrophobicContact CZ-CB 4.37Å; F142-E151 PolarHBondContact N-O 2.85Å; F142-E151 PolarHBondContact O-N 3.12Å; F142-F153 HydrophobicContact CB-CD1 3.97Å; F142-F153 HydrophobicContact CB-CE1 4Å; F142-F153 HydrophobicContact CD1-CB 4.03Å; F142-F153 AromaticContact CD1-CD1 3.77Å; F142-F153 HydrophobicContact CD1-CD1 3.77Å; F142-F153 HydrophobicContact CD1-CG 4.2Å; F142-F153 HydrophobicContact CE1-CB 4.17Å; F142-F153 HydrophobicContact CG-CD1 4.22Å; F142-N163 WeakPolarHBondContact CB-O 3.17Å
143	Y	94.6	Very high	91.6	Very high	2 Å²	2	80.7 Å²	80.7	1%	0.008	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	110.4	171.1	-176.2	-96.2	0	0	0	109.7	K121 C125 N145 K148 N163 C171 C175 E176	K121-Y143 PolarHBondContact NZ-OH 2.84Å; C125-Y143 VanDerWaalsContact O-CD1 3.27Å; C125-Y143 WeakPolarHBondContact O-CD1 3.23Å; Y143-N145 HydrophobicContact CE1-CB 4.5Å; Y143-N145 PolarHBondContact O-N 2.72Å; Y143-K148 VanDerWaalsContact CE2-C 3.45Å; Y143-K148 VanDerWaalsContact CE2-O 3.24Å; Y143-K148 WeakPolarHBondContact CE2-O 3.47Å; Y143-K148 VanDerWaalsContact OH-CA 3.27Å; Y143-K148 WeakPolarHBondContact OH-CA 3.37Å; Y143-K148 WeakPolarHBondContact OH-CB 3.16Å; Y143-K148 WeakPolarHBondContact OH-CD 3.49Å; Y143-K148 PolarHBondContact OH-O 2.98Å; Y143-N163 PolarHBondContact N-OD1 3.07Å; Y143-N163 PolarHBondContact O-ND2 2.82Å; Y143-C171 PolarHBondContact N-SG 3.03Å; Y143-C175 VanDerWaalsContact CB-CB 3.49Å; Y143-C175 HydrophobicContact CD1-CB 4.38Å; Y143-C175 HydrophobicContact CD2-CB 3.6Å; Y143-C175 WeakPolarHBondContact CD2-O 3.4Å; Y143-C175 HydrophobicContact CE2-CB 4.42Å; Y143-C175 WeakPolarHBondContact CE2-O 3.48Å; Y143-C175 HydrophobicContact CG-CB 3.56Å; Y143-E176 HydrophobicContact CD2-CG 4.08Å; Y143-E176 HydrophobicContact CE2-CG 3.75Å
144	N	91.9	Very high	92.6	Very high	24 Å²	24	81.7 Å²	81.7	13%	0.128	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	104.9	174.8	-177.6	-18.7	0	0	0	109.4	F142 Q146 S147 K148 Q149 E151	F142-N144 HydrophobicContact CD2-CB 4.49Å; F142-N144 HydrophobicContact CE2-CB 3.74Å; F142-N144 HydrophobicContact CZ-CB 3.78Å; F142-N144 PolarHBondContact O-N 3.09Å; N144-Q146 PolarHBondContact O-N 2.84Å; N144-Q146 VanDerWaalsContact O-N 3.07Å; N144-Q146 WeakPolarHBondContact OD1-CA 3.45Å; N144-Q146 VanDerWaalsContact OD1-CB 3.23Å; N144-Q146 WeakPolarHBondContact OD1-CB 3.39Å; N144-Q146 WeakPolarHBondContact OD1-CG 3.48Å; N144-Q146 PolarHBondContact OD1-N 3.25Å; N144-S147 WeakPolarHBondContact CB-OG 3.45Å; N144-S147 PolarHBondContact O-N 2.81Å; N144-S147 PolarHBondContact OD1-N 3.38Å; N144-K148 WeakPolarHBondContact O-CA 3.17Å; N144-K148 PolarHBondContact O-N 2.79Å; N144-Q149 PolarHBondContact N-O 3.34Å; N144-E151 HydrophobicContact CB-CB 4.36Å; N144-E151 HydrophobicContact CB-CG 4.14Å; N144-E151 VanDerWaalsContact ND2-CD 3.3Å; N144-E151 PolarHBondContact ND2-OE1 3.12Å; N144-E151 PolarHBondContact ND2-OE2 2.04Å
145	N	83.1	Confident	93.1	Very high	57 Å²	57	80.2 Å²	80.2	31%	0.305	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-13.3	-179.4	-169.8	23.2	0	0	0	113.9	Y143 K148	Y143-N145 HydrophobicContact CE1-CB 4.5Å; Y143-N145 PolarHBondContact O-N 2.72Å; N145-K148 WeakPolarHBondContact O-CD 3.31Å; N145-K148 WeakPolarHBondContact O-CE 3.29Å; N145-K148 PolarHBondContact O-NZ 3.34Å; N145-K148 PolarHBondContact OD1-NZ 3.19Å
146	Q	82.9	Confident	93.1	Very high	167 Å²	167	69.4 Å²	69.4	78%	0.78	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-48.8	175.9	-47.8	-176.7	24.3	0	0	111.9	N144	N144-Q146 PolarHBondContact O-N 2.84Å; N144-Q146 VanDerWaalsContact O-N 3.07Å; N144-Q146 WeakPolarHBondContact OD1-CA 3.45Å; N144-Q146 VanDerWaalsContact OD1-CB 3.23Å; N144-Q146 WeakPolarHBondContact OD1-CB 3.39Å; N144-Q146 WeakPolarHBondContact OD1-CG 3.48Å; N144-Q146 PolarHBondContact OD1-N 3.25Å
147	S	89.6	Confident	93.1	Very high	38 Å²	38	69.6 Å²	69.6	27%	0.266	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-10.2	178.8	67.5	0	0	0	0	113.9	N144 Q149 E151	N144-S147 WeakPolarHBondContact CB-OG 3.45Å; N144-S147 PolarHBondContact O-N 2.81Å; N144-S147 PolarHBondContact OD1-N 3.38Å; S147-Q149 PolarHBondContact O-N 2.8Å; S147-Q149 PolarHBondContact O-NE2 2.93Å; S147-E151 WeakPolarHBondContact CB-OE1 3.38Å; S147-E151 PolarHBondContact OG-OE1 3.15Å
148	K	88.4	Confident	92.5	Very high	112 Å²	112	62.2 Å²	62.2	49%	0.487	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	23.5	-175.9	-55.8	-60.4	-179	-171	0	114.4	Y143 N144 N145	Y143-K148 VanDerWaalsContact CE2-C 3.45Å; Y143-K148 VanDerWaalsContact CE2-O 3.24Å; Y143-K148 WeakPolarHBondContact CE2-O 3.47Å; Y143-K148 VanDerWaalsContact OH-CA 3.27Å; Y143-K148 WeakPolarHBondContact OH-CA 3.37Å; Y143-K148 WeakPolarHBondContact OH-CB 3.16Å; Y143-K148 WeakPolarHBondContact OH-CD 3.49Å; Y143-K148 PolarHBondContact OH-O 2.98Å; N144-K148 WeakPolarHBondContact O-CA 3.17Å; N144-K148 PolarHBondContact O-N 2.79Å; N145-K148 WeakPolarHBondContact O-CD 3.31Å; N145-K148 WeakPolarHBondContact O-CE 3.29Å; N145-K148 PolarHBondContact O-NZ 3.34Å; N145-K148 PolarHBondContact OD1-NZ 3.19Å
149	Q	92.6	Very high	91.9	Very high	109 Å²	109	61.7 Å²	61.7	51%	0.509	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	155.3	-174.6	-74.3	160.2	87.8	0	0	111.4	N144 S147 E151 E176	N144-Q149 PolarHBondContact N-O 3.34Å; S147-Q149 PolarHBondContact O-N 2.8Å; S147-Q149 PolarHBondContact O-NE2 2.93Å; Q149-E151 PolarHBondContact O-N 2.82Å; Q149-E176 WeakPolarHBondContact CA-OE1 3.43Å
150	C	96.2	Very high	91.3	Very high	12 Å²	12	58.1 Å²	58.1	8%	0.081	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	118	169.2	-74.4	0	0	0	0	111.4	F142 L168 C171 K172 E176	F142-C150 CarbonylContact O-C 3.55Å; F142-C150 WeakPolarHBondContact O-CA 3.05Å; C150-L168 HydrophobicContact CB-CD1 3.58Å; C150-L168 WeakPolarHBondContact O-CD1 3.44Å; C150-C171 HydrophobicContact CB-CB 3.7Å; C150-C171 WeakPolarHBondContact CB-SG 3.5Å; C150-C171 WeakPolarHBondContact SG-CB 3.2Å; C150-C171 PolarHBondContact SG-O 3.33Å; C150-C171 CovalentContact SG-SG 2.03Å; C150-C171 PolarHBondContact SG-SG 3.29Å; C150-K172 HydrophobicContact CB-CG 4.06Å; C150-K172 PolarHBondContact SG-N 2.77Å; C150-K172 VanDerWaalsContact SG-N 3.35Å; C150-E176 PolarHBondContact N-OE1 3.47Å
151	E	97.1	Very high	90.7	Very high	69 Å²	69	56.6 Å²	56.6	32%	0.322	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	156.7	-176.5	-73.7	177.9	-165.4	0	0	111	Y141 F142 N144 S147 Q149	Y141-E151 CarbonylContact C-O 3.53Å; Y141-E151 VanDerWaalsContact CA-O 3.25Å; Y141-E151 WeakPolarHBondContact CA-O 3.21Å; F142-E151 HydrophobicContact CD1-CB 4.25Å; F142-E151 WeakPolarHBondContact CD1-O 2.97Å; F142-E151 HydrophobicContact CE1-CB 3.73Å; F142-E151 HydrophobicContact CZ-CB 4.37Å; F142-E151 PolarHBondContact N-O 2.85Å; F142-E151 PolarHBondContact O-N 3.12Å; N144-E151 HydrophobicContact CB-CB 4.36Å; N144-E151 HydrophobicContact CB-CG 4.14Å; N144-E151 VanDerWaalsContact ND2-CD 3.3Å; N144-E151 PolarHBondContact ND2-OE1 3.12Å; N144-E151 PolarHBondContact ND2-OE2 2.04Å; S147-E151 WeakPolarHBondContact CB-OE1 3.38Å; S147-E151 PolarHBondContact OG-OE1 3.15Å; Q149-E151 PolarHBondContact O-N 2.82Å
152	R	97	Very high	90.1	Very high	192 Å²	192	55.6 Å²	55.6	73%	0.725	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	133.6	179	70	-173.2	-179.7	117.4	2.4	111.2	T139 R140 Y141	T139-R152 HydrophobicContact CG2-CB 4.13Å; R140-R152 CarbonylContact O-C 3.18Å; R140-R152 WeakPolarHBondContact O-CA 3.48Å; Y141-R152 HydrophobicContact CD1-CB 4.02Å; Y141-R152 HydrophobicContact CE1-CB 3.81Å
153	F	96.9	Very high	89.9	Confident	19 Å²	19	55.3 Å²	55.3	8%	0.083	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	171	173.8	79.8	-76.6	0	0	0	111.5	E129 D130 R140 F142 Y155 N164	E129-F153 HydrophobicContact CB-CB 4.13Å; E129-F153 HydrophobicContact CB-CD1 4.42Å; E129-F153 HydrophobicContact CB-CD2 4.03Å; E129-F153 HydrophobicContact CB-CG 3.96Å; E129-F153 HydrophobicContact CG-CB 4.27Å; D130-F153 WeakPolarHBondContact O-CE2 3.42Å; R140-F153 HydrophobicContact CB-CD1 4.21Å; R140-F153 HydrophobicContact CB-CE1 3.64Å; R140-F153 HydrophobicContact CB-CZ 4Å; R140-F153 PolarHBondContact N-O 3.34Å; R140-F153 VanDerWaalsContact N-O 3.15Å; R140-F153 VanDerWaalsContact O-CD1 3.31Å; R140-F153 WeakPolarHBondContact O-CD1 3.23Å; R140-F153 PolarHBondContact O-N 3.35Å; F142-F153 HydrophobicContact CB-CD1 3.97Å; F142-F153 HydrophobicContact CB-CE1 4Å; F142-F153 HydrophobicContact CD1-CB 4.03Å; F142-F153 AromaticContact CD1-CD1 3.77Å; F142-F153 HydrophobicContact CD1-CD1 3.77Å; F142-F153 HydrophobicContact CD1-CG 4.2Å; F142-F153 HydrophobicContact CE1-CB 4.17Å; F142-F153 HydrophobicContact CG-CD1 4.22Å; F153-Y155 HydrophobicContact CE2-CD2 4.36Å; F153-N164 HydrophobicContact CZ-CB 4.22Å
154	K	96.6	Very high	89.9	Confident	143 Å²	143	55.9 Å²	55.9	62%	0.622	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	109.1	175.3	-67.3	-178.7	179.6	-178.7	0	109.2	P131 Y137	P131-K154 WeakPolarHBondContact CB-O 3.05Å; Y137-K154 HydrophobicContact CD1-CD 4.23Å
155	Y	96.1	Very high	90.1	Very high	25 Å²	25	55 Å²	55	10%	0.098	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	131.4	173.7	177.2	-123.7	0	0	0	110.7	I138 R140 F153 G157 C158 L159 N164	I138-Y155 HydrophobicContact CB-CD1 4.4Å; I138-Y155 WeakPolarHBondContact CB-O 3.41Å; I138-Y155 HydrophobicContact CD1-CD1 4.41Å; I138-Y155 PolarHBondContact N-O 2.03Å; I138-Y155 PolarHBondContact O-N 2.9Å; R140-Y155 HydrophobicContact CG-CD1 3.97Å; R140-Y155 HydrophobicContact CG-CG 4.19Å; F153-Y155 HydrophobicContact CE2-CD2 4.36Å; Y155-G157 VanDerWaalsContact CE1-CA 3.44Å; Y155-G157 PolarHBondContact O-N 3.43Å; Y155-C158 VanDerWaalsContact OH-C 3.23Å; Y155-C158 WeakPolarHBondContact OH-CA 3.38Å; Y155-C158 PolarHBondContact OH-N 2.92Å; Y155-L159 PolarHBondContact OH-N 3.32Å; Y155-L159 PolarHBondContact OH-O 3.21Å; Y155-L159 VanDerWaalsContact OH-O 3.08Å; Y155-N164 VanDerWaalsContact CD2-ND2 3.27Å; Y155-N164 WeakPolarHBondContact CD2-ND2 3.27Å; Y155-N164 WeakPolarHBondContact CE2-ND2 3.44Å
156	G	90.9	Very high	90.6	Very high	6 Å²	6	58 Å²	58	6%	0.062	28%	0.282	C	S	.	.			trans	-72.5	-11.4	-176.8	0	0	0	0	0	114.9	P131 C134 G136	P131-G156 VanDerWaalsContact O-CA 3.27Å; P131-G156 WeakPolarHBondContact O-CA 3.07Å; P131-G156 PolarHBondContact O-N 2.86Å; C134-G156 CarbonylContact C-O 3.55Å; C134-G156 WeakPolarHBondContact CB-O 3.01Å; C134-G156 WeakPolarHBondContact O-CA 3.27Å; G136-G156 VanDerWaalsContact CA-O 3.28Å; G136-G156 WeakPolarHBondContact CA-O 3.43Å; G136-G156 PolarHBondContact N-O 3.19Å
157	G	84.6	Confident	91.2	Very high	37 Å²	37	53 Å²	53	38%	0.381	26%	0.263	S	S	.	.	S	Bend	trans	95.2	-7	178.3	0	0	0	0	0	115.6	Y155	Y155-G157 VanDerWaalsContact CE1-CA 3.44Å; Y155-G157 PolarHBondContact O-N 3.43Å
158	C	80.2	Confident	91.4	Very high	35 Å²	35	53.4 Å²	53.4	24%	0.236	26%	0.262	C	S	.	.	S	Bend	trans	-145.9	154.5	169.6	77.9	0	0	0	0	112.3	G132 C134 Y155	G132-C158 WeakPolarHBondContact CA-O 3.27Å; C134-C158 HydrophobicContact CB-CB 3.89Å; C134-C158 WeakPolarHBondContact CB-SG 3.29Å; C134-C158 WeakPolarHBondContact SG-CB 3.01Å; C134-C158 CovalentContact SG-SG 2.03Å; C134-C158 PolarHBondContact SG-SG 3.29Å; Y155-C158 VanDerWaalsContact OH-C 3.23Å; Y155-C158 WeakPolarHBondContact OH-CA 3.38Å; Y155-C158 PolarHBondContact OH-N 2.92Å
159	L	83.7	Confident	91.7	Very high	56 Å²	56	53.4 Å²	53.4	29%	0.293	26%	0.263	S	S	.	.			trans	64	-128.6	-174.1	-45.5	-169.4	0	0	0	111.8	A55 F56 I133 Y155	A55-L159 HydrophobicContact CB-CD1 3.98Å; A55-L159 HydrophobicContact CB-CD2 3.43Å; A55-L159 VanDerWaalsContact CB-CD2 3.43Å; A55-L159 HydrophobicContact CB-CG 4.23Å; F56-L159 HydrophobicContact CD1-CD1 4.26Å; F56-L159 HydrophobicContact CE1-CD1 4.2Å; I133-L159 HydrophobicContact CB-CD1 4.33Å; I133-L159 HydrophobicContact CG2-CD1 3.61Å; I133-L159 HydrophobicContact CG2-CG 4.05Å; Y155-L159 PolarHBondContact OH-N 3.32Å; Y155-L159 PolarHBondContact OH-O 3.21Å; Y155-L159 VanDerWaalsContact OH-O 3.08Å
160	G	84.1	Confident	91.7	Very high	4 Å²	4	51.7 Å²	51.7	4%	0.041	26%	0.256	C	S	.	.			trans	72.9	-177.4	-168.6	0	0	0	0	0	113	S52	S52-G160 VanDerWaalsContact CA-O 3.24Å; S52-G160 WeakPolarHBondContact CA-O 3.39Å; S52-G160 VanDerWaalsContact CB-O 3.27Å; S52-G160 WeakPolarHBondContact CB-O 3.44Å
161	N	85	Confident	91.7	Very high	16 Å²	16	51.1 Å²	51.1	9%	0.086	25%	0.252	C	S	.	.			trans	-114.8	-175	-179.8	74.5	51.5	0	0	0	111.8	L127 E128 D130 N163 N164	L127-N161 HydrophobicContact CD1-CB 4.07Å; E128-N161 PolarHBondContact O-ND2 3.32Å; D130-N161 HydrophobicContact CB-CB 4.45Å; D130-N161 WeakPolarHBondContact CB-ND2 3.27Å; N161-N163 VanDerWaalsContact C-N 3.33Å; N161-N163 PolarHBondContact O-N 2.03Å; N161-N163 WeakPolarHBondContact OD1-CA 3.47Å; N161-N163 VanDerWaalsContact OD1-CB 3.29Å; N161-N163 WeakPolarHBondContact OD1-CB 3.32Å; N161-N163 PolarHBondContact OD1-N 3.15Å; N161-N164 WeakPolarHBondContact O-CB 3.42Å
162	M	84	Confident	91.5	Very high	39 Å²	39	51 Å²	51	19%	0.192	25%	0.25	C	S	.	.	S	Bend	trans	-70.9	-19.3	-176.6	-84.9	176.7	178.4	0	0	115.4	K48 L49 M50 F124 N164	K48-M162 HydrophobicContact CB-CE 4.46Å; K48-M162 HydrophobicContact CB-CG 4.27Å; K48-M162 HydrophobicContact CD-CG 4.12Å; K48-M162 VanDerWaalsContact CE-O 3.32Å; K48-M162 WeakPolarHBondContact CE-O 3.17Å; K48-M162 HydrophobicContact CG-CG 3.91Å; K48-M162 PolarHBondContact NZ-O 2.79Å; K48-M162 VanDerWaalsContact O-CE 3.27Å; K48-M162 WeakPolarHBondContact O-CE 3.27Å; L49-M162 WeakPolarHBondContact O-CG 3.34Å; L49-M162 PolarHBondContact O-N 3.14Å; M50-M162 HydrophobicContact CB-SD 4.44Å; F124-M162 HydrophobicContact CB-CB 3.38Å; F124-M162 HydrophobicContact CB-CG 4.46Å; F124-M162 HydrophobicContact CB-SD 4.38Å; F124-M162 HydrophobicContact CD1-CB 4.1Å; F124-M162 HydrophobicContact CD1-SD 3.95Å; F124-M162 HydrophobicContact CD2-CB 4.14Å; F124-M162 HydrophobicContact CG-CB 3.64Å; F124-M162 HydrophobicContact CG-SD 4.41Å; M162-N164 PolarHBondContact O-N 3.42Å
163	N	93.6	Very high	91.1	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.253	C	S	.	.			trans	-77.6	56.5	173.7	-157.8	5	0	0	0	111.4	F124 L127 F142 Y143 N161 F165	F124-N163 WeakPolarHBondContact O-CB 3.48Å; L127-N163 HydrophobicContact CB-CB 4.2Å; L127-N163 PolarHBondContact O-ND2 2.82Å; F142-N163 WeakPolarHBondContact CB-O 3.17Å; Y143-N163 PolarHBondContact N-OD1 3.07Å; Y143-N163 PolarHBondContact O-ND2 2.82Å; N161-N163 VanDerWaalsContact C-N 3.33Å; N161-N163 PolarHBondContact O-N 2.03Å; N161-N163 WeakPolarHBondContact OD1-CA 3.47Å; N161-N163 VanDerWaalsContact OD1-CB 3.29Å; N161-N163 WeakPolarHBondContact OD1-CB 3.32Å; N161-N163 PolarHBondContact OD1-N 3.15Å; N163-F165 WeakPolarHBondContact OD1-CE2 3.47Å
164	N	94.3	Very high	90.7	Very high	14 Å²	14	50.2 Å²	50.2	8%	0.075	26%	0.263	C	S	.	.			trans	-143.8	112	-175.4	-175.9	-26.2	0	0	0	107.9	K48 R140 Y141 F153 Y155 N161 M162	K48-N164 WeakPolarHBondContact CE-O 3.14Å; K48-N164 PolarHBondContact NZ-O 2.83Å; R140-N164 WeakPolarHBondContact CG-OD1 3.45Å; R140-N164 PolarHBondContact NH1-OD1 2.91Å; Y141-N164 WeakPolarHBondContact O-CA 3.34Å; F153-N164 HydrophobicContact CZ-CB 4.22Å; Y155-N164 VanDerWaalsContact CD2-ND2 3.27Å; Y155-N164 WeakPolarHBondContact CD2-ND2 3.27Å; Y155-N164 WeakPolarHBondContact CE2-ND2 3.44Å; N161-N164 WeakPolarHBondContact O-CB 3.42Å; M162-N164 PolarHBondContact O-N 3.42Å
165	F	96.3	Very high	90.4	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.018	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-124.3	146.5	-174.1	-55.6	-79.9	0	0	0	109.8	F124 R140 Y141 N163 E170 C171 T174 C175	F124-F165 HydrophobicContact CE2-CE1 4.39Å; F124-F165 AromaticContact CE2-CZ 4Å; F124-F165 HydrophobicContact CE2-CZ 4Å; R140-F165 WeakPolarHBondContact CD-O 3.04Å; Y141-F165 PolarHBondContact N-O 2.86Å; Y141-F165 WeakPolarHBondContact O-CD2 3.38Å; Y141-F165 PolarHBondContact O-N 2.88Å; N163-F165 WeakPolarHBondContact OD1-CE2 3.47Å; F165-E170 WeakPolarHBondContact CA-OE2 3.46Å; F165-E170 HydrophobicContact CB-CB 4.34Å; F165-E170 HydrophobicContact CB-CG 4.3Å; F165-E170 HydrophobicContact CD1-CB 4.46Å; F165-E170 HydrophobicContact CD1-CG 3.75Å; F165-E170 WeakPolarHBondContact CD1-OE1 3.13Å; F165-E170 HydrophobicContact CG-CG 4.46Å; F165-C171 HydrophobicContact CB-CB 3.84Å; F165-C171 HydrophobicContact CD1-CB 4.44Å; F165-C171 HydrophobicContact CD2-CB 3.34Å; F165-C171 VanDerWaalsContact CD2-SG 3.51Å; F165-C171 HydrophobicContact CE2-CB 3.92Å; F165-C171 HydrophobicContact CG-CB 3.64Å; F165-T174 HydrophobicContact CE1-CG2 3.89Å; F165-T174 HydrophobicContact CZ-CG2 3.98Å; F165-C175 VanDerWaalsContact CZ-SG 3.58Å
166	E	92.6	Very high	90	Very high	122 Å²	122	44.9 Å²	44.9	57%	0.57	24%	0.241	S	C	*	.	S	Bend	trans	-75.4	-40.7	179.7	-171.4	117.1	-100.1	0	0	111.5	R140 Y141 E170	R140-E166 IonicContact CZ-OE1 2.72Å; R140-E166 VanDerWaalsContact CZ-OE1 3.22Å; R140-E166 IonicContact NE-OE1 2.65Å; R140-E166 PolarHBondContact NE-OE1 3.36Å; R140-E166 IonicContact NH2-OE1 2.67Å; R140-E166 PolarHBondContact NH2-OE1 3.3Å; Y141-E166 WeakPolarHBondContact CD2-O 3.32Å; E166-E170 PolarHBondContact N-OE2 3.43Å
167	T	95.7	Very high	89.3	Confident	60 Å²	60	48.8 Å²	48.8	37%	0.368	26%	0.261	S	S	.	.	S	Bend	trans	-115.5	161.1	-179.4	67.6	0	0	0	0	112.2	E169 E170 C171	T167-E169 VanDerWaalsContact C-N 3.28Å; T167-E170 VanDerWaalsContact OG1-CB 3.23Å; T167-E170 WeakPolarHBondContact OG1-CB 2.99Å; T167-E170 PolarHBondContact OG1-N 3.05Å; T167-C171 PolarHBondContact O-N 2.86Å
168	L	94.6	Very high	88.1	Confident	47 Å²	47	50.8 Å²	50.8	25%	0.246	28%	0.282	C	S	.	.	H	α-helix	trans	-66	-40	174.2	179.1	62.4	0	0	0	109.8	Y141 C150 C171 K172	Y141-L168 HydrophobicContact CD1-CB 4.03Å; Y141-L168 HydrophobicContact CD1-CD1 3.77Å; Y141-L168 HydrophobicContact CE1-CB 3.87Å; Y141-L168 HydrophobicContact CE1-CD1 4.05Å; Y141-L168 HydrophobicContact CE1-CG 4.46Å; Y141-L168 HydrophobicContact CE2-CB 4.42Å; Y141-L168 HydrophobicContact CG-CB 4.37Å; C150-L168 HydrophobicContact CB-CD1 3.58Å; C150-L168 WeakPolarHBondContact O-CD1 3.44Å; L168-C171 WeakPolarHBondContact O-CB 3.04Å; L168-C171 PolarHBondContact O-N 2.98Å; L168-K172 HydrophobicContact CD1-CG 4.46Å; L168-K172 HydrophobicContact CG-CD 4.13Å; L168-K172 HydrophobicContact CG-CG 4.43Å; L168-K172 VanDerWaalsContact O-CG 3.29Å; L168-K172 WeakPolarHBondContact O-CG 3.38Å; L168-K172 PolarHBondContact O-N 2.82Å
169	E	93	Very high	87	Confident	112 Å²	112	56.9 Å²	56.9	52%	0.523	31%	0.311	S	S	.	.	H	α-helix	trans	-65.5	-41.4	-177	-64.1	64.1	-142	0	0	111.7	T167 K172 N173	T167-E169 VanDerWaalsContact C-N 3.28Å; E169-K172 PolarHBondContact O-N 3.02Å; E169-N173 WeakPolarHBondContact O-CB 3.39Å; E169-N173 PolarHBondContact O-N 2.74Å; E169-N173 PolarHBondContact O-ND2 3.16Å
170	E	93.7	Very high	85.1	Confident	74 Å²	74	62 Å²	62	35%	0.346	34%	0.338	S	S	.	.	H	α-helix	trans	-59.6	-48	173.4	-175.1	-161.3	169.9	0	0	111.2	F165 E166 T167 T174	F165-E170 WeakPolarHBondContact CA-OE2 3.46Å; F165-E170 HydrophobicContact CB-CB 4.34Å; F165-E170 HydrophobicContact CB-CG 4.3Å; F165-E170 HydrophobicContact CD1-CB 4.46Å; F165-E170 HydrophobicContact CD1-CG 3.75Å; F165-E170 WeakPolarHBondContact CD1-OE1 3.13Å; F165-E170 HydrophobicContact CG-CG 4.46Å; E166-E170 PolarHBondContact N-OE2 3.43Å; T167-E170 VanDerWaalsContact OG1-CB 3.23Å; T167-E170 WeakPolarHBondContact OG1-CB 2.99Å; T167-E170 PolarHBondContact OG1-N 3.05Å; E170-T174 WeakPolarHBondContact O-CB 3.28Å; E170-T174 PolarHBondContact O-N 3.28Å; E170-T174 VanDerWaalsContact O-N 3.16Å; E170-T174 PolarHBondContact O-OG1 2.92Å
171	C	95.1	Very high	83.4	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-59.5	-48.1	175.6	180	0	0	0	0	111.4	Y143 C150 F165 T167 L168 T174 C175	Y143-C171 PolarHBondContact N-SG 3.03Å; C150-C171 HydrophobicContact CB-CB 3.7Å; C150-C171 WeakPolarHBondContact CB-SG 3.5Å; C150-C171 WeakPolarHBondContact SG-CB 3.2Å; C150-C171 PolarHBondContact SG-O 3.33Å; C150-C171 CovalentContact SG-SG 2.03Å; C150-C171 PolarHBondContact SG-SG 3.29Å; F165-C171 HydrophobicContact CB-CB 3.84Å; F165-C171 HydrophobicContact CD1-CB 4.44Å; F165-C171 HydrophobicContact CD2-CB 3.34Å; F165-C171 VanDerWaalsContact CD2-SG 3.51Å; F165-C171 HydrophobicContact CE2-CB 3.92Å; F165-C171 HydrophobicContact CG-CB 3.64Å; T167-C171 PolarHBondContact O-N 2.86Å; L168-C171 WeakPolarHBondContact O-CB 3.04Å; L168-C171 PolarHBondContact O-N 2.98Å; C171-T174 PolarHBondContact O-N 3.37Å; C171-C175 PolarHBondContact O-N 3.3Å
172	K	92.9	Very high	81.1	Confident	66 Å²	66	73.5 Å²	73.5	29%	0.287	41%	0.407	S	S	.	.	H	α-helix	trans	-60.5	-51.3	-178.6	-74.1	-175.4	172.8	-78	0	111.4	C150 L168 E169 T174 C175 E176	C150-K172 HydrophobicContact CB-CG 4.06Å; C150-K172 PolarHBondContact SG-N 2.77Å; C150-K172 VanDerWaalsContact SG-N 3.35Å; L168-K172 HydrophobicContact CD1-CG 4.46Å; L168-K172 HydrophobicContact CG-CD 4.13Å; L168-K172 HydrophobicContact CG-CG 4.43Å; L168-K172 VanDerWaalsContact O-CG 3.29Å; L168-K172 WeakPolarHBondContact O-CG 3.38Å; L168-K172 PolarHBondContact O-N 2.82Å; E169-K172 PolarHBondContact O-N 3.02Å; K172-T174 PolarHBondContact O-N 3.32Å; K172-T174 VanDerWaalsContact O-N 3.14Å; K172-C175 PolarHBondContact O-N 2.52Å; K172-E176 HydrophobicContact CB-CB 4.38Å; K172-E176 HydrophobicContact CG-CG 4.31Å; K172-E176 IonicContact NZ-OE1 3.29Å; K172-E176 PolarHBondContact NZ-OE1 3.34Å; K172-E176 IonicContact NZ-OE2 2.68Å; K172-E176 PolarHBondContact NZ-OE2 2.76Å; K172-E176 WeakPolarHBondContact O-CB 3.2Å; K172-E176 PolarHBondContact O-N 3.3Å
173	N	89.6	Confident	78.9	Confident	146 Å²	146	78.9 Å²	78.9	78%	0.781	43%	0.432	S	S	*	.	H	α-helix	trans	-64.7	-18.8	-179.4	-65.1	-22.1	0	0	0	113.3	E169	E169-N173 WeakPolarHBondContact O-CB 3.39Å; E169-N173 PolarHBondContact O-N 2.74Å; E169-N173 PolarHBondContact O-ND2 3.16Å
174	T	89.1	Confident	76.2	Confident	48 Å²	48	84.7 Å²	84.7	29%	0.294	47%	0.467	S	S	.	.	H	α-helix	trans	-96	-33.4	178	-50.6	0	0	0	0	113.3	P122 F124 F165 E170 C171 K172	P122-T174 HydrophobicContact CG-CG2 4.47Å; F124-T174 HydrophobicContact CE2-CG2 3.7Å; F124-T174 HydrophobicContact CZ-CG2 3.8Å; F165-T174 HydrophobicContact CE1-CG2 3.89Å; F165-T174 HydrophobicContact CZ-CG2 3.98Å; E170-T174 WeakPolarHBondContact O-CB 3.28Å; E170-T174 PolarHBondContact O-N 3.28Å; E170-T174 VanDerWaalsContact O-N 3.16Å; E170-T174 PolarHBondContact O-OG1 2.92Å; C171-T174 PolarHBondContact O-N 3.37Å; K172-T174 PolarHBondContact O-N 3.32Å; K172-T174 VanDerWaalsContact O-N 3.14Å
175	C	89.9	Confident	73.3	Confident	1 Å²	1	89.8 Å²	89.8	1%	0.007	50%	0.495	C	S	.	.	H	α-helix	trans	-135.3	-14.1	-166.1	-61.4	0	0	0	0	116.4	K121 C125 Y143 F165 C171 K172	K121-C175 HydrophobicContact CD-CB 4.35Å; K121-C175 WeakPolarHBondContact CD-O 3.33Å; K121-C175 WeakPolarHBondContact CE-O 3.45Å; K121-C175 PolarHBondContact NZ-O 2.85Å; C125-C175 HydrophobicContact CB-CB 3.69Å; C125-C175 WeakPolarHBondContact CB-SG 3.4Å; C125-C175 VanDerWaalsContact SG-CA 3.54Å; C125-C175 WeakPolarHBondContact SG-CB 3.39Å; C125-C175 CovalentContact SG-SG 2.04Å; C125-C175 PolarHBondContact SG-SG 3.2Å; Y143-C175 VanDerWaalsContact CB-CB 3.49Å; Y143-C175 HydrophobicContact CD1-CB 4.38Å; Y143-C175 HydrophobicContact CD2-CB 3.6Å; Y143-C175 WeakPolarHBondContact CD2-O 3.4Å; Y143-C175 HydrophobicContact CE2-CB 4.42Å; Y143-C175 WeakPolarHBondContact CE2-O 3.48Å; Y143-C175 HydrophobicContact CG-CB 3.56Å; F165-C175 VanDerWaalsContact CZ-SG 3.58Å; C171-C175 PolarHBondContact O-N 3.3Å; K172-C175 PolarHBondContact O-N 2.52Å
176	E	88.1	Confident	70.6	Confident	55 Å²	55	96 Å²	96	26%	0.257	53%	0.528	S	S	.	.	S	Bend	trans	-87.4	121	167.1	-80.1	-178.9	-156.3	0	0	109.2	Y143 Q149 C150 K172 G178	Y143-E176 HydrophobicContact CD2-CG 4.08Å; Y143-E176 HydrophobicContact CE2-CG 3.75Å; Q149-E176 WeakPolarHBondContact CA-OE1 3.43Å; C150-E176 PolarHBondContact N-OE1 3.47Å; K172-E176 HydrophobicContact CB-CB 4.38Å; K172-E176 HydrophobicContact CG-CG 4.31Å; K172-E176 IonicContact NZ-OE1 3.29Å; K172-E176 PolarHBondContact NZ-OE1 3.34Å; K172-E176 IonicContact NZ-OE2 2.68Å; K172-E176 PolarHBondContact NZ-OE2 2.76Å; K172-E176 WeakPolarHBondContact O-CB 3.2Å; K172-E176 PolarHBondContact O-N 3.3Å; E176-G178 PolarHBondContact O-N 2.67Å
177	D	76.3	Confident	67.8	Low	88 Å²	88	101.9 Å²	101.9	47%	0.471	55%	0.547	S	S	.	.			trans	-69.2	126.8	-174.1	-46.8	-72.3	0	0	0	110	K121 L179	K121-D177 VanDerWaalsContact NZ-CG 3.34Å; K121-D177 IonicContact NZ-OD1 3.07Å; K121-D177 PolarHBondContact NZ-OD1 2.77Å; K121-D177 IonicContact NZ-OD2 3.22Å; K121-D177 PolarHBondContact NZ-OD2 3.07Å; D177-L179 VanDerWaalsContact C-N 3.29Å; D177-L179 PolarHBondContact O-N 3.18Å
178	G	59.3	Low	64.8	Low	80 Å²	80	101.6 Å²	101.6	83%	0.825	56%	0.556	S	S	*	*			trans	-69.9	69.3	-169.3	0	0	0	0	0	115.2	E176 N180	E176-G178 PolarHBondContact O-N 2.67Å; G178-N180 VanDerWaalsContact C-N 3.26Å; G178-N180 PolarHBondContact O-N 3.3Å
179	L	55.3	Low	61.8	Low	163 Å²	163	105.4 Å²	105.4	85%	0.853	58%	0.581	S	S	*	*			trans	-75	69.1	178.4	-69.5	-179.7	0	0	0	112.9	D177	D177-L179 VanDerWaalsContact C-N 3.29Å; D177-L179 PolarHBondContact O-N 3.18Å
180	N	44.9	Very low	58.8	Low	162 Å²	162	108.7 Å²	108.7	87%	0.866	60%	0.596	S	S	*	*	S	Bend	trans	-155.4	107.3	154.6	-102.1	-42.2	0	0	0	113	G178	G178-N180 VanDerWaalsContact C-N 3.26Å; G178-N180 PolarHBondContact O-N 3.3Å
181	G	47.9	Very low	55.8	Low	72 Å²	72	112.8 Å²	112.8	74%	0.742	62%	0.62	S	S	*	*			trans	63.4	96.9	144.2	0	0	0	0	0	119
182	F	36.2	Very low	52.9	Low	190 Å²	190	119.5 Å²	119.5	83%	0.833	66%	0.656	S	S	*	*				-118.3	103.8	129.4	-149.6	-84.3	0	0	0	109.5	V184	F182-V184 HydrophobicContact CD1-CG2 3.93Å; F182-V184 HydrophobicContact CE1-CG2 4.45Å; F182-V184 PolarHBondContact O-N 3.32Å
183	Q	38.4	Very low	49.8	Very low	153 Å²	153	122.4 Å²	122.4	72%	0.715	68%	0.679	S	S	*	*			trans	-73.3	117.9	167.9	-69.6	175.8	-90.5	0	0	108.3	D185	Q183-D185 PolarHBondContact NE2-OD2 3.02Å; Q183-D185 PolarHBondContact O-N 3.21Å
184	V	36.9	Very low	46.9	Very low	122 Å²	122	121.1 Å²	121.1	74%	0.739	68%	0.676	S	S	*	*			trans	-92.9	59.2	166.5	-170.3	0	0	0	0	108.6	F182 N186	F182-V184 HydrophobicContact CD1-CG2 3.93Å; F182-V184 HydrophobicContact CE1-CG2 4.45Å; F182-V184 PolarHBondContact O-N 3.32Å; V184-N186 PolarHBondContact O-N 3.38Å; V184-N186 VanDerWaalsContact O-N 3.16Å
185	D	33.9	Very low	44.2	Very low	121 Å²	121	125.9 Å²	125.9	65%	0.647	70%	0.699	S	S	*	*			trans	-85.1	85.5	175.2	-74.9	-37.2	0	0	0	109.6	Q183	Q183-D185 PolarHBondContact NE2-OD2 3.02Å; Q183-D185 PolarHBondContact O-N 3.21Å
186	N	38.3	Very low	41.4	Very low	135 Å²	135	133.5 Å²	133.5	72%	0.722	74%	0.74	S	S	*	*			trans	8.1	126.9	164.5	-66.8	-91.1	0	0	0	119.8	V184	V184-N186 PolarHBondContact O-N 3.38Å; V184-N186 VanDerWaalsContact O-N 3.16Å
187	Y	34.4	Very low	38.7	Very low	245 Å²	245	135.5 Å²	135.5	96%	0.961	76%	0.76	S	S	*	*	S	Bend	trans	-67.7	126.3	136.1	-113.1	-96.2	0	0	0	108.4
188	G	32.1	Very low	36.4	Very low	54 Å²	54	140.7 Å²	140.7	56%	0.557	78%	0.782	S	S	*	*			trans	-93.3	153.8	-154.5	0	0	0	0	0	118.1
189	T	33	Very low	35.2	Very low	126 Å²	126	143.3 Å²	143.3	77%	0.773	78%	0.782	S	S	*	*				50.2	113.7	124.4	-47.9	0	0	0	0	119.8
190	Q	30.4	Very low	34.1	Very low	181 Å²	181	141.7 Å²	141.7	85%	0.846	78%	0.781	S	S	*	*				-128.6	111.5	117.7	-78	-159.9	25.5	0	0	110.9
191	L	30.2	Very low	33.5	Very low	160 Å²	160	142.6 Å²	142.6	84%	0.838	78%	0.78	S	S	*	*			trans	-160.5	139.5	147	-106.9	169.9	0	0	0	107.1
192	N	33.9	Very low	33.3	Very low	141 Å²	141	144.4 Å²	144.4	75%	0.754	78%	0.781	S	S	*	*			trans	-103.9	174	-160.5	-73.4	-52.9	0	0	0	114
193	V	28.5	Very low	32.9	Very low	128 Å²	128	141.4 Å²	141.4	78%	0.776	78%	0.779	S	S	*	*			trans	101	90.4	155.8	-168.1	0	0	0	0	118.3
194	V	28.4	Very low	33.7	Very low	119 Å²	119	143.6 Å²	143.6	72%	0.721	79%	0.786	S	S	*	*				55	109.5	129.3	-172.5	0	0	0	0	120.6
195	N	32.7	Very low	33.6	Very low	147 Å²	147	144.2 Å²	144.2	79%	0.786	79%	0.789	S	S	*	*			trans	15.9	134	133.4	-47.8	-10.4	0	0	0	120.3
196	N	30.6	Very low	34.1	Very low	162 Å²	162	143.6 Å²	143.6	87%	0.866	79%	0.792	S	S	*	*				-154.5	163.4	102.4	-143.1	-17.1	0	0	0	113
197	S	31.5	Very low	35.2	Very low	96 Å²	96	143 Å²	143	67%	0.671	80%	0.799	S	S	*	*			trans	-99.5	135.4	-164.8	-58.8	0	0	0	0	115.2
198	Q	28	Very low	35.6	Very low	197 Å²	197	138.7 Å²	138.7	92%	0.921	79%	0.785	S	S	*	*			trans	-163.3	133.9	143.7	-111.6	146.1	97.4	0	0	111.2
199	T	33.4	Very low	36	Very low	135 Å²	135	143.8 Å²	143.8	83%	0.828	79%	0.792	S	S	*	*			trans	-89.6	154.1	176	46.2	0	0	0	0	111.4
200	P	32.4	Very low	36.9	Very low	129 Å²	129	144.6 Å²	144.6	84%	0.838	79%	0.787	S	S	*	*				-127.3	168.9	120.4	3	18.4	0	0	0	113.3
201	Q	32.2	Very low	38	Very low	182 Å²	182	138.1 Å²	138.1	85%	0.85	76%	0.756	S	S	*	*			trans	-85.9	151.3	-173.5	-62.9	171	-72.1	0	0	114.3
202	S	43	Very low	39.4	Very low	109 Å²	109	136.9 Å²	136.9	76%	0.762	75%	0.746	S	S	*	*			trans	11.6	113.6	137.2	-171.6	0	0	0	0	118.1
203	T	28.9	Very low	41	Very low	128 Å²	128	131.2 Å²	131.2	79%	0.785	72%	0.721	S	S	*	*			trans	-123.6	114.6	156.2	48.3	0	0	0	0	110
204	K	55.8	Low	43.6	Very low	199 Å²	199	127.6 Å²	127.6	87%	0.865	70%	0.7	S	S	*	*			trans	-66	135	170.3	-64	179.7	178.6	-178.1	0	109.4
205	V	34.2	Very low	46.1	Very low	134 Å²	134	126.5 Å²	126.5	81%	0.812	70%	0.698	S	S	*	*			trans	-116.4	134.7	164.9	-177.4	0	0	0	0	108
206	P	43.3	Very low	48.6	Very low	109 Å²	109	123.1 Å²	123.1	71%	0.708	67%	0.674	S	S	*	*			trans	-103.8	160.7	-152.7	3	19.7	0	0	0	114.5	F208	P206-F208 PolarHBondContact O-N 3.07Å
207	S	61.8	Low	51.4	Low	122 Å²	122	115.4 Å²	115.4	85%	0.853	63%	0.633	S	S	*	*			trans	-57.8	123	156.4	173.1	0	0	0	0	110.1
208	F	43.9	Very low	54	Low	155 Å²	155	115 Å²	115	68%	0.68	62%	0.622	S	S	*	*			trans	-162.4	113.7	167.9	-154.8	-104.7	0	0	0	112.3	P206	P206-F208 PolarHBondContact O-N 3.07Å
209	F	40.7	Very low	56.8	Low	161 Å²	161	106.9 Å²	106.9	71%	0.706	59%	0.589	S	S	*	*			trans	173.9	63.3	135.8	-86.9	-52.8	0	0	0	110.6	F271	F209-F271 HydrophobicContact CD1-CD1 4.19Å; F209-F271 AromaticContact CD1-CE1 3.69Å; F209-F271 HydrophobicContact CD1-CE1 3.69Å; F209-F271 HydrophobicContact CD1-CZ 4.12Å; F209-F271 HydrophobicContact CE1-CE1 4.43Å
210	E	51.5	Low	59.4	Low	143 Å²	143	105.1 Å²	105.1	67%	0.668	58%	0.58	S	S	*	*			trans	-69.7	129.6	170.4	-164.4	179.1	151.3	0	0	110.2	H212 F271	E210-H212 PolarHBondContact O-N 2.89Å; E210-H212 VanDerWaalsContact O-N 3.16Å; E210-H212 IonicContact OE1-CE1 3.29Å; E210-H212 PolarHBondContact OE1-CE1 3.15Å; E210-H212 VanDerWaalsContact OE1-CE1 3.29Å; E210-H212 IonicContact OE1-ND1 3.91Å; E210-F271 WeakPolarHBondContact O-CE1 3.33Å
211	F	52.3	Low	62.1	Low	44 Å²	44	100.8 Å²	100.8	19%	0.193	56%	0.555	C	S	.	*			trans	-84.3	89.5	-175.3	178.8	-102.2	0	0	0	111.5	G213 C217 L218 Y235 F271	F211-G213 VanDerWaalsContact CE1-CA 3.49Å; F211-G213 PolarHBondContact O-N 2.03Å; F211-C217 HydrophobicContact CE1-CB 3.97Å; F211-C217 HydrophobicContact CZ-CB 3.73Å; F211-L218 HydrophobicContact CB-CD2 4.5Å; F211-L218 HydrophobicContact CD1-CD1 4.03Å; F211-L218 HydrophobicContact CD1-CD2 3.51Å; F211-L218 HydrophobicContact CD1-CG 3.82Å; F211-L218 HydrophobicContact CE1-CD2 3.74Å; F211-L218 HydrophobicContact CE1-CG 3.93Å; F211-L218 HydrophobicContact CG-CD2 3.94Å; F211-L218 HydrophobicContact CZ-CD2 4.35Å; F211-Y235 AromaticContact CE2-CE1 3.83Å; F211-Y235 HydrophobicContact CE2-CE1 3.83Å; F211-Y235 HydrophobicContact CZ-CE1 4.17Å; F211-F271 HydrophobicContact CD2-CE2 4.12Å; F211-F271 HydrophobicContact CD2-CZ 4.29Å
212	H	60.3	Low	65	Low	135 Å²	135	95.4 Å²	95.4	63%	0.625	53%	0.532	S	S	*	.			trans	-78.7	53.6	172.2	-62.3	-46.5	0	0	0	112.8	E210 G270	E210-H212 PolarHBondContact O-N 2.89Å; E210-H212 VanDerWaalsContact O-N 3.16Å; E210-H212 IonicContact OE1-CE1 3.29Å; E210-H212 PolarHBondContact OE1-CE1 3.15Å; E210-H212 VanDerWaalsContact OE1-CE1 3.29Å; E210-H212 IonicContact OE1-ND1 3.91Å; H212-G270 WeakPolarHBondContact O-CA 3.25Å
213	G	68.1	Low	67.3	Low	22 Å²	22	96.6 Å²	96.6	23%	0.227	52%	0.52	C	S	.	.	S	Bend	trans	-115.4	176.8	170.2	0	0	0	0	0	112.3	F211 S215	F211-G213 VanDerWaalsContact CE1-CA 3.49Å; F211-G213 PolarHBondContact O-N 2.03Å; G213-S215 PolarHBondContact O-N 2.76Å
214	P	82.2	Confident	70.3	Confident	51 Å²	51	91.1 Å²	91.1	33%	0.331	49%	0.489	S	S	.	.			trans	-59.5	130.5	171.9	-18.2	30.8	0	0	0	110.2	W216 C217	P214-W216 HydrophobicContact CB-CD2 4.07Å; P214-W216 HydrophobicContact CB-CG 4.2Å; P214-W216 HydrophobicContact CB-CZ2 4.07Å; P214-W216 VanDerWaalsContact CB-NE1 3.34Å; P214-W216 HydrophobicContact CG-CZ2 4.29Å; P214-W216 PolarHBondContact O-N 3.22Å; P214-W216 VanDerWaalsContact O-N 3.17Å; P214-C217 VanDerWaalsContact O-CB 3.23Å; P214-C217 WeakPolarHBondContact O-CB 3.42Å; P214-C217 PolarHBondContact O-N 3.24Å
215	S	80.4	Confident	71.6	Confident	97 Å²	97	89.5 Å²	89.5	68%	0.678	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-55.1	-37.6	-174.2	50	0	0	0	0	112.9	G213 C217 L218	G213-S215 PolarHBondContact O-N 2.76Å; S215-C217 PolarHBondContact O-N 2.89Å; S215-C217 VanDerWaalsContact O-N 3.16Å; S215-L218 VanDerWaalsContact O-CB 3.26Å; S215-L218 WeakPolarHBondContact O-CB 3.41Å; S215-L218 PolarHBondContact O-N 3.48Å
216	W	85.1	Confident	74.4	Confident	76 Å²	76	86 Å²	86	29%	0.288	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-61.1	-20.9	176.9	55	-103.6	0	0	0	114.6	P214 L218 A219 E254 N255 F257 A266	P214-W216 HydrophobicContact CB-CD2 4.07Å; P214-W216 HydrophobicContact CB-CG 4.2Å; P214-W216 HydrophobicContact CB-CZ2 4.07Å; P214-W216 VanDerWaalsContact CB-NE1 3.34Å; P214-W216 HydrophobicContact CG-CZ2 4.29Å; P214-W216 PolarHBondContact O-N 3.22Å; P214-W216 VanDerWaalsContact O-N 3.17Å; W216-L218 PolarHBondContact O-N 3.32Å; W216-A219 VanDerWaalsContact O-CB 3.31Å; W216-A219 WeakPolarHBondContact O-CB 3.36Å; W216-A219 PolarHBondContact O-N 2.86Å; W216-A219 VanDerWaalsContact O-N 3.1Å; W216-E254 HydrophobicContact CB-CB 3.91Å; W216-E254 WeakPolarHBondContact CB-OE2 2.98Å; W216-E254 HydrophobicContact CD2-CB 3.82Å; W216-E254 HydrophobicContact CE3-CB 3.78Å; W216-E254 HydrophobicContact CG-CB 3.9Å; W216-E254 VanDerWaalsContact CG-OE2 3.24Å; W216-E254 HydrophobicContact CZ3-CB 4.4Å; W216-E254 WeakPolarHBondContact CZ3-O 3.41Å; W216-N255 WeakPolarHBondContact O-CB 3.01Å; W216-F257 HydrophobicContact CE3-CZ 4.46Å; W216-F257 AromaticContact CH2-CE1 3.83Å; W216-F257 HydrophobicContact CH2-CE1 3.83Å; W216-F257 AromaticContact CH2-CZ 3.69Å; W216-F257 HydrophobicContact CH2-CZ 3.69Å; W216-F257 AromaticContact CZ3-CE1 3.8Å; W216-F257 HydrophobicContact CZ3-CE1 3.8Å; W216-F257 HydrophobicContact CZ3-CE2 4.1Å; W216-F257 AromaticContact CZ3-CZ 3.3Å; W216-F257 HydrophobicContact CZ3-CZ 3.3Å; W216-A266 HydrophobicContact CH2-CB 3.99Å
217	C	90.4	Very high	76.8	Confident	0 Å²	0	92.4 Å²	92.4	0%	0	48%	0.48	C	S	.	.	G	3₁₀ helix	trans	-64.5	-14.7	169.6	-71.8	0	0	0	0	113.6	F211 P214 S215 Y235 N255 C267	F211-C217 HydrophobicContact CE1-CB 3.97Å; F211-C217 HydrophobicContact CZ-CB 3.73Å; P214-C217 VanDerWaalsContact O-CB 3.23Å; P214-C217 WeakPolarHBondContact O-CB 3.42Å; P214-C217 PolarHBondContact O-N 3.24Å; S215-C217 PolarHBondContact O-N 2.89Å; S215-C217 VanDerWaalsContact O-N 3.16Å; C217-Y235 HydrophobicContact CB-CD1 4.26Å; C217-Y235 WeakPolarHBondContact O-CD1 3.04Å; C217-N255 PolarHBondContact O-ND2 2.99Å; C217-C267 HydrophobicContact CB-CB 3.58Å; C217-C267 WeakPolarHBondContact CB-SG 3.19Å; C217-C267 WeakPolarHBondContact SG-CA 3.2Å; C217-C267 WeakPolarHBondContact SG-CB 3.17Å; C217-C267 CovalentContact SG-SG 2.03Å; C217-C267 PolarHBondContact SG-SG 2.65Å
218	L	86.3	Confident	78.3	Confident	86 Å²	86	88.6 Å²	88.6	45%	0.45	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-87.8	-15	174.8	-56.4	179	0	0	0	112.9	F211 S215 W216	F211-L218 HydrophobicContact CB-CD2 4.5Å; F211-L218 HydrophobicContact CD1-CD1 4.03Å; F211-L218 HydrophobicContact CD1-CD2 3.51Å; F211-L218 HydrophobicContact CD1-CG 3.82Å; F211-L218 HydrophobicContact CE1-CD2 3.74Å; F211-L218 HydrophobicContact CE1-CG 3.93Å; F211-L218 HydrophobicContact CG-CD2 3.94Å; F211-L218 HydrophobicContact CZ-CD2 4.35Å; S215-L218 VanDerWaalsContact O-CB 3.26Å; S215-L218 WeakPolarHBondContact O-CB 3.41Å; S215-L218 PolarHBondContact O-N 3.48Å; W216-L218 PolarHBondContact O-N 3.32Å
219	A	86.4	Confident	80.7	Confident	27 Å²	27	85.5 Å²	85.5	22%	0.223	45%	0.446	C	S	.	.	S	Bend	trans	-65.3	149.9	-178.1	0	0	0	0	0	111.9	W216 N253 N255	W216-A219 VanDerWaalsContact O-CB 3.31Å; W216-A219 WeakPolarHBondContact O-CB 3.36Å; W216-A219 PolarHBondContact O-N 2.86Å; W216-A219 VanDerWaalsContact O-N 3.1Å; A219-N253 HydrophobicContact CB-CB 4.49Å; A219-N255 HydrophobicContact CB-CB 4.43Å; A219-N255 PolarHBondContact O-ND2 2.81Å
220	P	87.5	Confident	83.3	Confident	99 Å²	99	81.4 Å²	81.4	64%	0.643	43%	0.43	S	S	*	.			trans	-67.4	167	178.7	29	-35.9	0	0	0	112.5	D222 N253	P220-D222 PolarHBondContact O-N 3.38Å; P220-N253 PolarHBondContact O-ND2 2.03Å
221	A	90.1	Very high	85.4	Confident	37 Å²	37	80 Å²	80	31%	0.306	43%	0.427	S	S	.	.			trans	-71.3	87.4	174.3	0	0	0	0	0	111.3	R223 Y234 F245	A221-R223 PolarHBondContact O-N 3.05Å; A221-Y234 HydrophobicContact CB-CD1 3.58Å; A221-Y234 HydrophobicContact CB-CD2 3.71Å; A221-Y234 HydrophobicContact CB-CE1 3.76Å; A221-Y234 HydrophobicContact CB-CE2 3.87Å; A221-Y234 HydrophobicContact CB-CG 3.55Å; A221-F245 HydrophobicContact CB-CB 4.24Å; A221-F245 HydrophobicContact CB-CD1 4.4Å; A221-F245 HydrophobicContact CB-CD2 4.26Å; A221-F245 HydrophobicContact CB-CG 4.07Å
222	D	91.9	Very high	87.5	Confident	69 Å²	69	80.2 Å²	80.2	37%	0.369	43%	0.426	S	S	.	.			trans	-80.3	119.6	178.4	-175.5	5.8	0	0	0	111.6	P220 G224 F245 G252 N253	P220-D222 PolarHBondContact O-N 3.38Å; D222-G224 VanDerWaalsContact C-N 3.29Å; D222-G224 PolarHBondContact O-N 2.91Å; D222-G224 PolarHBondContact OD1-N 3.14Å; D222-F245 VanDerWaalsContact O-CE2 3.25Å; D222-F245 WeakPolarHBondContact O-CE2 3.33Å; D222-G252 WeakPolarHBondContact OD2-CA 3.24Å; D222-N253 WeakPolarHBondContact CB-ND2 3.4Å
223	R	92.9	Very high	89.3	Confident	134 Å²	134	76 Å²	76	51%	0.506	41%	0.406	S	S	.	.			trans	-67.1	-28.8	175.9	-179.8	163.7	-167.4	-173.9	4	112.1	A221 N229 K246 Y247 S248	A221-R223 PolarHBondContact O-N 3.05Å; R223-N229 PolarHBondContact NH2-OD1 3.25Å; R223-K246 WeakPolarHBondContact CG-O 3.49Å; R223-Y247 WeakPolarHBondContact O-CD2 3.48Å; R223-S248 WeakPolarHBondContact O-CB 3.3Å; R223-S248 PolarHBondContact O-N 2.85Å; R223-S248 PolarHBondContact O-OG 3.08Å
224	G	90.6	Very high	90.6	Very high	14 Å²	14	76.6 Å²	76.6	14%	0.144	40%	0.402	C	S	.	.			trans	71.3	-175.5	-171.1	0	0	0	0	0	113.7	D222 S248 C250	D222-G224 VanDerWaalsContact C-N 3.29Å; D222-G224 PolarHBondContact O-N 2.91Å; D222-G224 PolarHBondContact OD1-N 3.14Å; G224-S248 WeakPolarHBondContact CA-OG 3.3Å; G224-S248 PolarHBondContact O-OG 3.41Å; G224-C250 CarbonylContact C-O 3.48Å; G224-C250 VanDerWaalsContact CA-O 3.28Å; G224-C250 WeakPolarHBondContact CA-O 3.39Å
225	L	83.3	Confident	91.1	Very high	164 Å²	164	74.6 Å²	74.6	86%	0.859	39%	0.388	S	S	*	.	S	Bend	trans	-103	-3.2	-158.9	-57.1	177.2	0	0	0	115.6	S248 C250	L225-S248 PolarHBondContact N-OG 3.19Å; L225-C250 PolarHBondContact N-O 2.78Å
226	C	94.4	Very high	91.4	Very high	60 Å²	60	71.6 Å²	71.6	41%	0.405	36%	0.364	S	S	.	.	S	Bend	trans	-87.4	-164.4	-177.7	-85.3	0	0	0	0	112.9	S248 C250	C226-S248 CarbonylContact C-O 3.54Å; C226-S248 WeakPolarHBondContact CB-O 3.05Å; C226-S248 PolarHBondContact N-OG 2.87Å; C226-S248 VanDerWaalsContact N-OG 3.09Å; C226-S248 WeakPolarHBondContact O-CB 3.04Å; C226-C250 HydrophobicContact CB-CB 3.94Å; C226-C250 WeakPolarHBondContact CB-SG 3.14Å; C226-C250 WeakPolarHBondContact SG-CB 3.16Å; C226-C250 CovalentContact SG-SG 2.03Å; C226-C250 PolarHBondContact SG-SG 3.31Å
227	R	92.8	Very high	91.2	Very high	244 Å²	244	70.2 Å²	70.2	92%	0.921	37%	0.366	S	S	*	.	S	Bend	trans	-122.1	4.8	-173.9	-62.9	-175.4	-180	179.7	0.1	115.8	S248	R227-S248 PolarHBondContact N-O 3.3Å
228	A	92.8	Very high	90.5	Very high	42 Å²	42	76.6 Å²	76.6	35%	0.347	41%	0.405	S	S	.	.			trans	-72.8	172.5	173.3	0	0	0	0	0	111.9	Y247 S248	A228-Y247 CarbonylContact C-O 3.57Å; A228-S248 WeakPolarHBondContact CA-O 3.39Å; A228-S248 WeakPolarHBondContact CB-O 3.04Å; A228-S248 PolarHBondContact N-O 3.49Å; A228-S248 WeakPolarHBondContact O-CA 3.24Å
229	N	95.1	Very high	90.3	Very high	91 Å²	91	76 Å²	76	49%	0.487	40%	0.401	S	S	.	.			trans	-135.4	45.7	179.2	-74.3	-63.2	0	0	0	111.5	R223 K246	R223-N229 PolarHBondContact NH2-OD1 3.25Å; N229-K246 HydrophobicContact CB-CD 4.42Å; N229-K246 WeakPolarHBondContact O-CD 3.49Å; N229-K246 PolarHBondContact O-NZ 2.96Å
230	E	94.8	Very high	90.1	Very high	75 Å²	75	76 Å²	76	35%	0.35	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	138.8	179.1	-71.2	-178.4	-130.9	0	0	111.5	R232 K246 Y247	E230-R232 HydrophobicContact CB-CG 4.33Å; E230-R232 PolarHBondContact O-N 2.81Å; E230-R232 IonicContact OE1-NH2 2.77Å; E230-R232 IonicContact OE2-CZ 3.16Å; E230-R232 IonicContact OE2-NE 2.77Å; E230-R232 PolarHBondContact OE2-NE 2.04Å; E230-R232 IonicContact OE2-NH2 3.79Å; E230-R232 PolarHBondContact OE2-NH2 2.97Å; E230-K246 WeakPolarHBondContact O-CA 3.39Å; E230-Y247 PolarHBondContact N-O 3.08Å; E230-Y247 PolarHBondContact O-N 2.7Å
231	N	96.1	Very high	90	Very high	114 Å²	114	77.8 Å²	77.8	61%	0.61	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80	106.2	169.1	-70.8	-24.2	0	0	0	108.8	K246	N231-K246 WeakPolarHBondContact OD1-CE 3.39Å; N231-K246 PolarHBondContact OD1-NZ 2.84Å
232	R	96.5	Very high	90.2	Very high	48 Å²	48	76.3 Å²	76.3	18%	0.181	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	172.1	173.2	-63.5	-64.9	-169.8	94.9	-1.4	110.1	E230 P244 F245 Y247 N256 F257	E230-R232 HydrophobicContact CB-CG 4.33Å; E230-R232 PolarHBondContact O-N 2.81Å; E230-R232 IonicContact OE1-NH2 2.77Å; E230-R232 IonicContact OE2-CZ 3.16Å; E230-R232 IonicContact OE2-NE 2.77Å; E230-R232 PolarHBondContact OE2-NE 2.04Å; E230-R232 IonicContact OE2-NH2 3.79Å; E230-R232 PolarHBondContact OE2-NH2 2.97Å; R232-P244 CarbonylContact O-C 3.56Å; R232-P244 WeakPolarHBondContact O-CA 3.19Å; R232-F245 HydrophobicContact CB-CD1 4.03Å; R232-F245 HydrophobicContact CB-CE1 3.52Å; R232-F245 HydrophobicContact CB-CZ 3.83Å; R232-F245 PolarHBondContact N-O 2.9Å; R232-F245 PolarHBondContact O-N 3.18Å; R232-Y247 HydrophobicContact CG-CD1 4.02Å; R232-Y247 HydrophobicContact CG-CG 3.99Å; R232-N256 WeakPolarHBondContact CB-OD1 3.45Å; R232-N256 WeakPolarHBondContact CD-OD1 3.3Å; R232-N256 WeakPolarHBondContact CG-OD1 3.14Å; R232-N256 PolarHBondContact NH1-OD1 3.34Å; R232-F257 CarbonylContact C-O 3.52Å; R232-F257 WeakPolarHBondContact CA-O 3.41Å
233	F	97	Very high	90.4	Very high	45 Å²	45	79.4 Å²	79.4	20%	0.197	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	145.4	174.7	-67.1	-94.7	0	0	0	110.8	R243 P244 F257 S259 K260 C263	F233-R243 CarbonylContact C-O 3.58Å; F233-R243 VanDerWaalsContact CA-O 3.27Å; F233-R243 WeakPolarHBondContact CA-O 3.36Å; F233-P244 HydrophobicContact CD1-CB 4.13Å; F233-P244 HydrophobicContact CE1-CB 3.85Å; F233-P244 HydrophobicContact CE1-CG 4.46Å; F233-P244 HydrophobicContact CZ-CB 4.35Å; F233-F257 HydrophobicContact CB-CB 4.32Å; F233-F257 PolarHBondContact N-O 2.83Å; F233-F257 WeakPolarHBondContact O-CD2 3.19Å; F233-F257 PolarHBondContact O-N 3.02Å; F233-S259 VanDerWaalsContact CD2-C 3.47Å; F233-K260 HydrophobicContact CD1-CB 3.78Å; F233-K260 HydrophobicContact CD1-CG 4.11Å; F233-K260 HydrophobicContact CD2-CB 4.49Å; F233-K260 VanDerWaalsContact CD2-N 3.27Å; F233-K260 HydrophobicContact CE1-CB 3.68Å; F233-K260 HydrophobicContact CE1-CD 4.28Å; F233-K260 HydrophobicContact CE1-CG 4.12Å; F233-K260 HydrophobicContact CE2-CB 4.39Å; F233-K260 HydrophobicContact CG-CB 4.2Å; F233-K260 HydrophobicContact CZ-CB 4Å; F233-C263 HydrophobicContact CB-CB 4.27Å
234	Y	96.1	Very high	90.5	Very high	36 Å²	36	77 Å²	77	14%	0.141	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	153.3	170.4	83.1	-73.6	0	0	0	109.9	A221 N236 C242 R243 F245 N255	A221-Y234 HydrophobicContact CB-CD1 3.58Å; A221-Y234 HydrophobicContact CB-CD2 3.71Å; A221-Y234 HydrophobicContact CB-CE1 3.76Å; A221-Y234 HydrophobicContact CB-CE2 3.87Å; A221-Y234 HydrophobicContact CB-CG 3.55Å; Y234-N236 HydrophobicContact CE2-CB 3.77Å; Y234-N236 PolarHBondContact OH-ND2 3.44Å; Y234-C242 CarbonylContact O-C 3.37Å; Y234-C242 VanDerWaalsContact O-CA 3.23Å; Y234-C242 WeakPolarHBondContact O-CA 3.27Å; Y234-R243 HydrophobicContact CD1-CB 4.14Å; Y234-R243 WeakPolarHBondContact CD1-O 3.25Å; Y234-R243 HydrophobicContact CE1-CB 3.64Å; Y234-R243 PolarHBondContact N-O 3.23Å; Y234-R243 PolarHBondContact O-N 2.71Å; Y234-F245 HydrophobicContact CD1-CB 4.3Å; Y234-F245 HydrophobicContact CD1-CD1 4.03Å; Y234-F245 HydrophobicContact CD1-CG 4.47Å; Y234-F245 HydrophobicContact CG-CD1 4.44Å; Y234-N255 VanDerWaalsContact CA-O 3.27Å; Y234-N255 WeakPolarHBondContact CA-O 3.42Å; Y234-N255 WeakPolarHBondContact CB-O 3.35Å
235	Y	93.1	Very high	90.7	Very high	9 Å²	9	77.6 Å²	77.6	4%	0.035	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	117.9	171	-174	-106.6	0	0	0	109.8	F211 C217 N255 C263 C267 K268	F211-Y235 AromaticContact CE2-CE1 3.83Å; F211-Y235 HydrophobicContact CE2-CE1 3.83Å; F211-Y235 HydrophobicContact CZ-CE1 4.17Å; C217-Y235 HydrophobicContact CB-CD1 4.26Å; C217-Y235 WeakPolarHBondContact O-CD1 3.04Å; Y235-N255 PolarHBondContact N-OD1 2.77Å; Y235-N255 PolarHBondContact O-ND2 2.77Å; Y235-C263 PolarHBondContact N-SG 2.89Å; Y235-C267 HydrophobicContact CD1-CB 3.67Å; Y235-C267 HydrophobicContact CD2-CB 3.56Å; Y235-C267 HydrophobicContact CE1-CB 4.19Å; Y235-C267 HydrophobicContact CE2-CB 4.12Å; Y235-C267 HydrophobicContact CG-CB 3.31Å; Y235-K268 HydrophobicContact CE2-CB 4.46Å
236	N	86.2	Confident	91.3	Very high	33 Å²	33	74.3 Å²	74.3	18%	0.176	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	109.8	167.8	-175.9	-47.9	0	0	0	108.2	Y234 V238 I239 G240 K241	Y234-N236 HydrophobicContact CE2-CB 3.77Å; Y234-N236 PolarHBondContact OH-ND2 3.44Å; N236-V238 PolarHBondContact OD1-N 3.25Å; N236-I239 HydrophobicContact CB-CD1 4.09Å; N236-I239 HydrophobicContact CB-CG1 3.78Å; N236-I239 PolarHBondContact OD1-N 3.02Å; N236-G240 PolarHBondContact O-N 3.33Å; N236-K241 PolarHBondContact N-O 3.12Å; N236-K241 PolarHBondContact O-N 3.18Å; N236-K241 VanDerWaalsContact O-N 3.1Å
237	S	80.4	Confident	91.4	Very high	47 Å²	47	72.4 Å²	72.4	33%	0.329	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-47	-177.8	50.6	0	0	0	0	112.5	I239 G240	S237-I239 PolarHBondContact O-N 2.92Å; S237-I239 VanDerWaalsContact O-N 3.16Å; S237-G240 PolarHBondContact O-N 3.25Å
238	V	76.6	Confident	91.5	Very high	135 Å²	135	60.9 Å²	60.9	82%	0.818	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-36.8	-178.8	-173.8	0	0	0	0	112.5	N236	N236-V238 PolarHBondContact OD1-N 3.25Å
239	I	81.3	Confident	91.4	Very high	74 Å²	74	60.5 Å²	60.5	38%	0.379	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	2.5	178.4	69.7	172.9	0	0	0	114.2	N236 S237 K241 R243	N236-I239 HydrophobicContact CB-CD1 4.09Å; N236-I239 HydrophobicContact CB-CG1 3.78Å; N236-I239 PolarHBondContact OD1-N 3.02Å; S237-I239 PolarHBondContact O-N 2.92Å; S237-I239 VanDerWaalsContact O-N 3.16Å; I239-K241 VanDerWaalsContact C-N 3.29Å; I239-K241 HydrophobicContact CD1-CB 4.04Å; I239-K241 HydrophobicContact CD1-CD 4.36Å; I239-K241 HydrophobicContact CG1-CB 3.98Å; I239-K241 HydrophobicContact CG1-CD 4.46Å; I239-K241 WeakPolarHBondContact O-CG 2.94Å; I239-K241 PolarHBondContact O-N 3.47Å; I239-R243 HydrophobicContact CD1-CG 4.11Å
240	G	81.7	Confident	91.1	Very high	27 Å²	27	58.6 Å²	58.6	28%	0.278	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	28.6	-178	0	0	0	0	0	115.8	N236 S237	N236-G240 PolarHBondContact O-N 3.33Å; S237-G240 PolarHBondContact O-N 3.25Å
241	K	87.4	Confident	91.1	Very high	135 Å²	135	57.5 Å²	57.5	59%	0.587	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.9	140	-169.1	-67.1	160.7	-169.7	170.3	0	113.4	N236 I239 R243	N236-K241 PolarHBondContact N-O 3.12Å; N236-K241 PolarHBondContact O-N 3.18Å; N236-K241 VanDerWaalsContact O-N 3.1Å; I239-K241 VanDerWaalsContact C-N 3.29Å; I239-K241 HydrophobicContact CD1-CB 4.04Å; I239-K241 HydrophobicContact CD1-CD 4.36Å; I239-K241 HydrophobicContact CG1-CB 3.98Å; I239-K241 HydrophobicContact CG1-CD 4.46Å; I239-K241 WeakPolarHBondContact O-CG 2.94Å; I239-K241 PolarHBondContact O-N 3.47Å; K241-R243 PolarHBondContact O-N 2.58Å
242	C	94	Very high	90.8	Very high	7 Å²	7	53.5 Å²	53.5	5%	0.047	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	121.2	168.2	-64.9	0	0	0	0	111.9	Y234 K260 C263 L264	Y234-C242 CarbonylContact O-C 3.37Å; Y234-C242 VanDerWaalsContact O-CA 3.23Å; Y234-C242 WeakPolarHBondContact O-CA 3.27Å; C242-K260 HydrophobicContact CB-CG 4.05Å; C242-C263 HydrophobicContact CB-CB 3.78Å; C242-C263 WeakPolarHBondContact CB-SG 3.49Å; C242-C263 WeakPolarHBondContact SG-CB 3.33Å; C242-C263 CovalentContact SG-SG 2.03Å; C242-C263 PolarHBondContact SG-SG 2.86Å; C242-L264 HydrophobicContact CB-CD2 4.31Å; C242-L264 HydrophobicContact CB-CG 4.24Å; C242-L264 PolarHBondContact SG-N 3.42Å
243	R	95.1	Very high	90.7	Very high	133 Å²	133	53.5 Å²	53.5	50%	0.502	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	150.3	176.6	-70.5	-175	70.7	159.1	1.7	110.8	F233 Y234 I239 K241	F233-R243 CarbonylContact C-O 3.58Å; F233-R243 VanDerWaalsContact CA-O 3.27Å; F233-R243 WeakPolarHBondContact CA-O 3.36Å; Y234-R243 HydrophobicContact CD1-CB 4.14Å; Y234-R243 WeakPolarHBondContact CD1-O 3.25Å; Y234-R243 HydrophobicContact CE1-CB 3.64Å; Y234-R243 PolarHBondContact N-O 3.23Å; Y234-R243 PolarHBondContact O-N 2.71Å; I239-R243 HydrophobicContact CD1-CG 4.11Å; K241-R243 PolarHBondContact O-N 2.58Å
244	P	94.4	Very high	90.6	Very high	83 Å²	83	57.6 Å²	57.6	54%	0.539	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	152.2	171	32.4	-34.5	0	0	0	111.3	R232 F233	R232-P244 CarbonylContact O-C 3.56Å; R232-P244 WeakPolarHBondContact O-CA 3.19Å; F233-P244 HydrophobicContact CD1-CB 4.13Å; F233-P244 HydrophobicContact CE1-CB 3.85Å; F233-P244 HydrophobicContact CE1-CG 4.46Å; F233-P244 HydrophobicContact CZ-CB 4.35Å
245	F	96.1	Very high	90.5	Very high	27 Å²	27	56 Å²	56	12%	0.118	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	171.7	168.7	79.4	-79	0	0	0	110.9	A221 D222 R232 Y234 Y247 N256	A221-F245 HydrophobicContact CB-CB 4.24Å; A221-F245 HydrophobicContact CB-CD1 4.4Å; A221-F245 HydrophobicContact CB-CD2 4.26Å; A221-F245 HydrophobicContact CB-CG 4.07Å; D222-F245 VanDerWaalsContact O-CE2 3.25Å; D222-F245 WeakPolarHBondContact O-CE2 3.33Å; R232-F245 HydrophobicContact CB-CD1 4.03Å; R232-F245 HydrophobicContact CB-CE1 3.52Å; R232-F245 HydrophobicContact CB-CZ 3.83Å; R232-F245 PolarHBondContact N-O 2.9Å; R232-F245 PolarHBondContact O-N 3.18Å; Y234-F245 HydrophobicContact CD1-CB 4.3Å; Y234-F245 HydrophobicContact CD1-CD1 4.03Å; Y234-F245 HydrophobicContact CD1-CG 4.47Å; Y234-F245 HydrophobicContact CG-CD1 4.44Å; F245-Y247 HydrophobicContact CE2-CD2 4.38Å; F245-N256 HydrophobicContact CZ-CB 4.21Å
246	K	96.2	Very high	90.6	Very high	96 Å²	96	56.8 Å²	56.8	42%	0.417	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	115.2	175.4	-70.1	-58.1	-160.6	174.1	0	110.3	R223 N229 E230 N231	R223-K246 WeakPolarHBondContact CG-O 3.49Å; N229-K246 HydrophobicContact CB-CD 4.42Å; N229-K246 WeakPolarHBondContact O-CD 3.49Å; N229-K246 PolarHBondContact O-NZ 2.96Å; E230-K246 WeakPolarHBondContact O-CA 3.39Å; N231-K246 WeakPolarHBondContact OD1-CE 3.39Å; N231-K246 PolarHBondContact OD1-NZ 2.84Å
247	Y	96.4	Very high	91.1	Very high	20 Å²	20	55.9 Å²	55.9	8%	0.078	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	144.4	174.9	177	-117.6	0	0	0	111.1	R223 A228 E230 R232 F245 G249 C250 G251 N256	R223-Y247 WeakPolarHBondContact O-CD2 3.48Å; A228-Y247 CarbonylContact C-O 3.57Å; E230-Y247 PolarHBondContact N-O 3.08Å; E230-Y247 PolarHBondContact O-N 2.7Å; R232-Y247 HydrophobicContact CG-CD1 4.02Å; R232-Y247 HydrophobicContact CG-CG 3.99Å; F245-Y247 HydrophobicContact CE2-CD2 4.38Å; Y247-G249 VanDerWaalsContact CE1-C 3.4Å; Y247-G249 VanDerWaalsContact CZ-C 3.48Å; Y247-G249 PolarHBondContact OH-O 2.89Å; Y247-C250 VanDerWaalsContact OH-C 3.3Å; Y247-C250 WeakPolarHBondContact OH-CA 3.34Å; Y247-C250 PolarHBondContact OH-N 2.91Å; Y247-G251 PolarHBondContact OH-O 2.59Å; Y247-G251 VanDerWaalsContact OH-O 3.04Å; Y247-N256 WeakPolarHBondContact CD2-ND2 3.39Å; Y247-N256 WeakPolarHBondContact CE2-ND2 3.25Å
248	S	94.1	Very high	91.9	Very high	1 Å²	1	58 Å²	58	1%	0.007	33%	0.331	C	S	.	.			trans	-82.5	-14.5	-172.9	69.9	0	0	0	0	115.2	R223 G224 L225 C226 R227 A228 C250	R223-S248 WeakPolarHBondContact O-CB 3.3Å; R223-S248 PolarHBondContact O-N 2.85Å; R223-S248 PolarHBondContact O-OG 3.08Å; G224-S248 WeakPolarHBondContact CA-OG 3.3Å; G224-S248 PolarHBondContact O-OG 3.41Å; L225-S248 PolarHBondContact N-OG 3.19Å; C226-S248 CarbonylContact C-O 3.54Å; C226-S248 WeakPolarHBondContact CB-O 3.05Å; C226-S248 PolarHBondContact N-OG 2.87Å; C226-S248 VanDerWaalsContact N-OG 3.09Å; C226-S248 WeakPolarHBondContact O-CB 3.04Å; R227-S248 PolarHBondContact N-O 3.3Å; A228-S248 WeakPolarHBondContact CA-O 3.39Å; A228-S248 WeakPolarHBondContact CB-O 3.04Å; A228-S248 PolarHBondContact N-O 3.49Å; A228-S248 WeakPolarHBondContact O-CA 3.24Å; S248-C250 PolarHBondContact OG-O 2.95Å
249	G	90.6	Very high	92.9	Very high	35 Å²	35	53.6 Å²	53.6	36%	0.361	31%	0.307	S	S	.	.	S	Bend	trans	102.7	-22.3	-175.9	0	0	0	0	0	114.8	Y247	Y247-G249 VanDerWaalsContact CE1-C 3.4Å; Y247-G249 VanDerWaalsContact CZ-C 3.48Å; Y247-G249 PolarHBondContact OH-O 2.89Å
250	C	90.1	Very high	93.5	Very high	50 Å²	50	55.6 Å²	55.6	34%	0.338	31%	0.313	S	S	.	.	S	Bend	trans	-146.3	159.1	177.1	75.8	0	0	0	0	113.7	G224 L225 C226 Y247 S248	G224-C250 CarbonylContact C-O 3.48Å; G224-C250 VanDerWaalsContact CA-O 3.28Å; G224-C250 WeakPolarHBondContact CA-O 3.39Å; L225-C250 PolarHBondContact N-O 2.78Å; C226-C250 HydrophobicContact CB-CB 3.94Å; C226-C250 WeakPolarHBondContact CB-SG 3.14Å; C226-C250 WeakPolarHBondContact SG-CB 3.16Å; C226-C250 CovalentContact SG-SG 2.03Å; C226-C250 PolarHBondContact SG-SG 3.31Å; Y247-C250 VanDerWaalsContact OH-C 3.3Å; Y247-C250 WeakPolarHBondContact OH-CA 3.34Å; Y247-C250 PolarHBondContact OH-N 2.91Å; S248-C250 PolarHBondContact OG-O 2.95Å
251	G	93.4	Very high	94	Very high	53 Å²	53	63.7 Å²	63.7	55%	0.546	34%	0.335	S	S	.	.			trans	71.5	-141.3	-171.2	0	0	0	0	0	110.9	Y247	Y247-G251 PolarHBondContact OH-O 2.59Å; Y247-G251 VanDerWaalsContact OH-O 3.04Å
252	G	91.3	Very high	94.3	Very high	30 Å²	30	60.5 Å²	60.5	31%	0.309	32%	0.322	S	S	.	.			trans	83.8	-179.8	-175.1	0	0	0	0	0	112.8	D222	D222-G252 WeakPolarHBondContact OD2-CA 3.24Å
253	N	93.3	Very high	94.3	Very high	47 Å²	47	60.1 Å²	60.1	25%	0.251	32%	0.32	S	S	.	.			trans	-115.4	176.3	167.3	67.3	54.9	0	0	0	111	A219 P220 D222 N255 N256	A219-N253 HydrophobicContact CB-CB 4.49Å; P220-N253 PolarHBondContact O-ND2 2.03Å; D222-N253 WeakPolarHBondContact CB-ND2 3.4Å; N253-N255 PolarHBondContact O-N 2.82Å; N253-N255 VanDerWaalsContact OD1-CB 3.24Å; N253-N255 WeakPolarHBondContact OD1-CB 3.32Å; N253-N255 PolarHBondContact OD1-N 3.31Å; N253-N256 VanDerWaalsContact O-CB 3.31Å; N253-N256 WeakPolarHBondContact O-CB 3.4Å
254	E	94.3	Very high	94.1	Very high	132 Å²	132	56.8 Å²	56.8	62%	0.617	31%	0.311	S	S	*	.	S	Bend	trans	-69.6	-11	-173.4	-53.8	177.9	123.8	0	0	114.1	W216 N256	W216-E254 HydrophobicContact CB-CB 3.91Å; W216-E254 WeakPolarHBondContact CB-OE2 2.98Å; W216-E254 HydrophobicContact CD2-CB 3.82Å; W216-E254 HydrophobicContact CE3-CB 3.78Å; W216-E254 HydrophobicContact CG-CB 3.9Å; W216-E254 VanDerWaalsContact CG-OE2 3.24Å; W216-E254 HydrophobicContact CZ3-CB 4.4Å; W216-E254 WeakPolarHBondContact CZ3-O 3.41Å; E254-N256 PolarHBondContact O-N 3.09Å
255	N	94.8	Very high	93.9	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.005	31%	0.312	C	S	.	.			trans	-75.6	42	175.2	-156.1	1.1	0	0	0	112.5	W216 C217 A219 Y234 Y235 N253 F257	W216-N255 WeakPolarHBondContact O-CB 3.01Å; C217-N255 PolarHBondContact O-ND2 2.99Å; A219-N255 HydrophobicContact CB-CB 4.43Å; A219-N255 PolarHBondContact O-ND2 2.81Å; Y234-N255 VanDerWaalsContact CA-O 3.27Å; Y234-N255 WeakPolarHBondContact CA-O 3.42Å; Y234-N255 WeakPolarHBondContact CB-O 3.35Å; Y235-N255 PolarHBondContact N-OD1 2.77Å; Y235-N255 PolarHBondContact O-ND2 2.77Å; N253-N255 PolarHBondContact O-N 2.82Å; N253-N255 VanDerWaalsContact OD1-CB 3.24Å; N253-N255 WeakPolarHBondContact OD1-CB 3.32Å; N253-N255 PolarHBondContact OD1-N 3.31Å; N255-F257 WeakPolarHBondContact OD1-CE2 3.47Å
256	N	95.9	Very high	93.6	Very high	27 Å²	27	59.9 Å²	59.9	14%	0.144	32%	0.318	C	S	.	.			trans	-132.3	96.2	-167.7	-178.7	-11	0	0	0	110.2	R232 F245 Y247 N253 E254	R232-N256 WeakPolarHBondContact CB-OD1 3.45Å; R232-N256 WeakPolarHBondContact CD-OD1 3.3Å; R232-N256 WeakPolarHBondContact CG-OD1 3.14Å; R232-N256 PolarHBondContact NH1-OD1 3.34Å; F245-N256 HydrophobicContact CZ-CB 4.21Å; Y247-N256 WeakPolarHBondContact CD2-ND2 3.39Å; Y247-N256 WeakPolarHBondContact CE2-ND2 3.25Å; N253-N256 VanDerWaalsContact O-CB 3.31Å; N253-N256 WeakPolarHBondContact O-CB 3.4Å; E254-N256 PolarHBondContact O-N 3.09Å
257	F	96.6	Very high	93.2	Very high	13 Å²	13	55.3 Å²	55.3	6%	0.057	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-108.5	146.3	-173.1	-58.7	-79	0	0	0	112.5	W216 R232 F233 N255 S259 E262 C263 A266 C267	W216-F257 HydrophobicContact CE3-CZ 4.46Å; W216-F257 AromaticContact CH2-CE1 3.83Å; W216-F257 HydrophobicContact CH2-CE1 3.83Å; W216-F257 AromaticContact CH2-CZ 3.69Å; W216-F257 HydrophobicContact CH2-CZ 3.69Å; W216-F257 AromaticContact CZ3-CE1 3.8Å; W216-F257 HydrophobicContact CZ3-CE1 3.8Å; W216-F257 HydrophobicContact CZ3-CE2 4.1Å; W216-F257 AromaticContact CZ3-CZ 3.3Å; W216-F257 HydrophobicContact CZ3-CZ 3.3Å; R232-F257 CarbonylContact C-O 3.52Å; R232-F257 WeakPolarHBondContact CA-O 3.41Å; F233-F257 HydrophobicContact CB-CB 4.32Å; F233-F257 PolarHBondContact N-O 2.83Å; F233-F257 WeakPolarHBondContact O-CD2 3.19Å; F233-F257 PolarHBondContact O-N 3.02Å; N255-F257 WeakPolarHBondContact OD1-CE2 3.47Å; F257-S259 VanDerWaalsContact C-N 3.26Å; F257-S259 PolarHBondContact O-N 2.85Å; F257-E262 HydrophobicContact CB-CB 4.44Å; F257-E262 HydrophobicContact CB-CG 4.49Å; F257-E262 HydrophobicContact CD1-CB 4.37Å; F257-E262 HydrophobicContact CD1-CG 3.79Å; F257-C263 HydrophobicContact CB-CB 3.89Å; F257-C263 HydrophobicContact CD1-CB 4.37Å; F257-C263 VanDerWaalsContact CD2-CA 3.46Å; F257-C263 HydrophobicContact CD2-CB 3.26Å; F257-C263 HydrophobicContact CE2-CB 3.73Å; F257-C263 HydrophobicContact CG-CB 3.59Å; F257-C263 HydrophobicContact CZ-CB 4.41Å; F257-A266 HydrophobicContact CE1-CB 3.59Å; F257-A266 HydrophobicContact CZ-CB 3.58Å; F257-C267 VanDerWaalsContact CZ-SG 3.58Å
258	T	96.8	Very high	92.3	Very high	91 Å²	91	60.3 Å²	60.3	56%	0.558	32%	0.321	S	S	*	.	S	Bend	trans	-69.7	-26	175	65.9	0	0	0	0	112.3	E262	T258-E262 PolarHBondContact N-OE2 2.98Å; T258-E262 PolarHBondContact OG1-OE2 2.94Å
259	S	96.2	Very high	91.1	Very high	43 Å²	43	68.4 Å²	68.4	30%	0.301	36%	0.355	S	S	.	.	S	Bend	trans	-146.3	151	-177.6	71.3	0	0	0	0	113.9	F233 F257 R261 E262 C263	F233-S259 VanDerWaalsContact CD2-C 3.47Å; F257-S259 VanDerWaalsContact C-N 3.26Å; F257-S259 PolarHBondContact O-N 2.85Å; S259-R261 PolarHBondContact O-N 3.47Å; S259-R261 VanDerWaalsContact O-N 3.17Å; S259-E262 WeakPolarHBondContact O-CB 3.36Å; S259-E262 PolarHBondContact O-N 3.43Å; S259-E262 VanDerWaalsContact O-N 3.09Å; S259-E262 VanDerWaalsContact OG-CB 3.32Å; S259-E262 WeakPolarHBondContact OG-CB 3.46Å; S259-E262 PolarHBondContact OG-N 2.89Å; S259-C263 PolarHBondContact O-N 3.36Å; S259-C263 VanDerWaalsContact O-N 3.09Å
260	K	94.1	Very high	89.4	Confident	117 Å²	117	67.2 Å²	67.2	51%	0.509	34%	0.344	S	S	.	.	H	α-helix	trans	-54.4	-34.4	173.1	-163.6	177	-176.6	178.1	0	112.7	F233 C242 L264	F233-K260 HydrophobicContact CD1-CB 3.78Å; F233-K260 HydrophobicContact CD1-CG 4.11Å; F233-K260 HydrophobicContact CD2-CB 4.49Å; F233-K260 VanDerWaalsContact CD2-N 3.27Å; F233-K260 HydrophobicContact CE1-CB 3.68Å; F233-K260 HydrophobicContact CE1-CD 4.28Å; F233-K260 HydrophobicContact CE1-CG 4.12Å; F233-K260 HydrophobicContact CE2-CB 4.39Å; F233-K260 HydrophobicContact CG-CB 4.2Å; F233-K260 HydrophobicContact CZ-CB 4Å; C242-K260 HydrophobicContact CB-CG 4.05Å; K260-L264 HydrophobicContact CG-CD1 4.19Å; K260-L264 WeakPolarHBondContact O-CB 3.44Å; K260-L264 WeakPolarHBondContact O-CD1 3.37Å; K260-L264 WeakPolarHBondContact O-CG 3.46Å; K260-L264 PolarHBondContact O-N 3.28Å
261	R	93.5	Very high	88	Confident	197 Å²	197	68.7 Å²	68.7	74%	0.743	35%	0.345	S	S	*	.	H	α-helix	trans	-69.9	-36	179.8	-173.3	180	-174.3	-172.1	3.4	112.3	S259 R265	S259-R261 PolarHBondContact O-N 3.47Å; S259-R261 VanDerWaalsContact O-N 3.17Å; R261-R265 WeakPolarHBondContact O-CB 3.22Å; R261-R265 PolarHBondContact O-N 3.08Å; R261-R265 VanDerWaalsContact O-N 3.1Å
262	E	93.8	Very high	85.8	Confident	67 Å²	67	74 Å²	74	31%	0.313	36%	0.358	S	S	.	.	H	α-helix	trans	-70.2	-50.1	177	-173.9	176	-123.5	0	0	110.8	F257 T258 S259 L264 R265 A266	F257-E262 HydrophobicContact CB-CB 4.44Å; F257-E262 HydrophobicContact CB-CG 4.49Å; F257-E262 HydrophobicContact CD1-CB 4.37Å; F257-E262 HydrophobicContact CD1-CG 3.79Å; T258-E262 PolarHBondContact N-OE2 2.98Å; T258-E262 PolarHBondContact OG1-OE2 2.94Å; S259-E262 WeakPolarHBondContact O-CB 3.36Å; S259-E262 PolarHBondContact O-N 3.43Å; S259-E262 VanDerWaalsContact O-N 3.09Å; S259-E262 VanDerWaalsContact OG-CB 3.32Å; S259-E262 WeakPolarHBondContact OG-CB 3.46Å; S259-E262 PolarHBondContact OG-N 2.89Å; E262-L264 VanDerWaalsContact C-N 3.31Å; E262-L264 PolarHBondContact O-N 3.32Å; E262-R265 WeakPolarHBondContact O-CA 3.41Å; E262-R265 WeakPolarHBondContact O-CB 3.34Å; E262-R265 PolarHBondContact O-N 3.37Å; E262-A266 PolarHBondContact O-N 2.03Å
263	C	93.4	Very high	83.3	Confident	0 Å²	0	81.2 Å²	81.2	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-51.6	-47.7	171.9	175.2	0	0	0	0	112.7	F233 Y235 C242 F257 S259 R265 A266 C267	F233-C263 HydrophobicContact CB-CB 4.27Å; Y235-C263 PolarHBondContact N-SG 2.89Å; C242-C263 HydrophobicContact CB-CB 3.78Å; C242-C263 WeakPolarHBondContact CB-SG 3.49Å; C242-C263 WeakPolarHBondContact SG-CB 3.33Å; C242-C263 CovalentContact SG-SG 2.03Å; C242-C263 PolarHBondContact SG-SG 2.86Å; F257-C263 HydrophobicContact CB-CB 3.89Å; F257-C263 HydrophobicContact CD1-CB 4.37Å; F257-C263 VanDerWaalsContact CD2-CA 3.46Å; F257-C263 HydrophobicContact CD2-CB 3.26Å; F257-C263 HydrophobicContact CE2-CB 3.73Å; F257-C263 HydrophobicContact CG-CB 3.59Å; F257-C263 HydrophobicContact CZ-CB 4.41Å; S259-C263 PolarHBondContact O-N 3.36Å; S259-C263 VanDerWaalsContact O-N 3.09Å; C263-R265 VanDerWaalsContact C-N 3.29Å; C263-R265 PolarHBondContact O-N 2.8Å; C263-A266 PolarHBondContact O-N 2.95Å; C263-C267 PolarHBondContact O-N 3.35Å
264	L	91.2	Very high	80.6	Confident	62 Å²	62	90.1 Å²	90.1	33%	0.325	41%	0.414	S	S	.	.	H	α-helix	trans	-66.8	-29.2	177.6	-71.4	169.1	0	0	0	112.7	C242 K260 E262 K268	C242-L264 HydrophobicContact CB-CD2 4.31Å; C242-L264 HydrophobicContact CB-CG 4.24Å; C242-L264 PolarHBondContact SG-N 3.42Å; K260-L264 HydrophobicContact CG-CD1 4.19Å; K260-L264 WeakPolarHBondContact O-CB 3.44Å; K260-L264 WeakPolarHBondContact O-CD1 3.37Å; K260-L264 WeakPolarHBondContact O-CG 3.46Å; K260-L264 PolarHBondContact O-N 3.28Å; E262-L264 VanDerWaalsContact C-N 3.31Å; E262-L264 PolarHBondContact O-N 3.32Å; L264-K268 HydrophobicContact CD2-CB 4.11Å; L264-K268 HydrophobicContact CD2-CD 3.72Å; L264-K268 HydrophobicContact CD2-CG 4.5Å; L264-K268 VanDerWaalsContact O-CB 3.28Å; L264-K268 WeakPolarHBondContact O-CB 3.45Å; L264-K268 PolarHBondContact O-N 2.57Å
265	R	89.5	Confident	78.1	Confident	144 Å²	144	92 Å²	92	54%	0.543	43%	0.427	S	S	.	.	H	α-helix	trans	-71.4	-41.2	177.1	-174.4	-166.8	-66.8	129.3	-7.8	111.5	R261 E262 C263	R261-R265 WeakPolarHBondContact O-CB 3.22Å; R261-R265 PolarHBondContact O-N 3.08Å; R261-R265 VanDerWaalsContact O-N 3.1Å; E262-R265 WeakPolarHBondContact O-CA 3.41Å; E262-R265 WeakPolarHBondContact O-CB 3.34Å; E262-R265 PolarHBondContact O-N 3.37Å; C263-R265 VanDerWaalsContact C-N 3.29Å; C263-R265 PolarHBondContact O-N 2.8Å
266	A	89.7	Confident	75.5	Confident	31 Å²	31	96.3 Å²	96.3	26%	0.256	46%	0.457	S	S	.	.	H	α-helix	trans	-74.8	-60.3	179.5	0	0	0	0	0	111.5	W216 F257 E262 C263	W216-A266 HydrophobicContact CH2-CB 3.99Å; F257-A266 HydrophobicContact CE1-CB 3.59Å; F257-A266 HydrophobicContact CZ-CB 3.58Å; E262-A266 PolarHBondContact O-N 2.03Å; C263-A266 PolarHBondContact O-N 2.95Å
267	C	87.4	Confident	73.3	Confident	0 Å²	0	105.2 Å²	105.2	0%	0	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-29.8	-164.6	-57.4	0	0	0	0	114.8	C217 Y235 F257 C263 K269	C217-C267 HydrophobicContact CB-CB 3.58Å; C217-C267 WeakPolarHBondContact CB-SG 3.19Å; C217-C267 WeakPolarHBondContact SG-CA 3.2Å; C217-C267 WeakPolarHBondContact SG-CB 3.17Å; C217-C267 CovalentContact SG-SG 2.03Å; C217-C267 PolarHBondContact SG-SG 2.65Å; Y235-C267 HydrophobicContact CD1-CB 3.67Å; Y235-C267 HydrophobicContact CD2-CB 3.56Å; Y235-C267 HydrophobicContact CE1-CB 4.19Å; Y235-C267 HydrophobicContact CE2-CB 4.12Å; Y235-C267 HydrophobicContact CG-CB 3.31Å; F257-C267 VanDerWaalsContact CZ-SG 3.58Å; C263-C267 PolarHBondContact O-N 3.35Å; C267-K269 VanDerWaalsContact C-N 3.28Å; C267-K269 PolarHBondContact O-N 3.42Å
268	K	79	Confident	70.6	Confident	126 Å²	126	108.2 Å²	108.2	55%	0.548	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-79.6	-8.7	-179.6	-161.8	173.2	176.5	-179.4	0	113.4	Y235 L264 G270	Y235-K268 HydrophobicContact CE2-CB 4.46Å; L264-K268 HydrophobicContact CD2-CB 4.11Å; L264-K268 HydrophobicContact CD2-CD 3.72Å; L264-K268 HydrophobicContact CD2-CG 4.5Å; L264-K268 VanDerWaalsContact O-CB 3.28Å; L264-K268 WeakPolarHBondContact O-CB 3.45Å; L264-K268 PolarHBondContact O-N 2.57Å; K268-G270 VanDerWaalsContact C-N 3.31Å; K268-G270 PolarHBondContact O-N 3.41Å
269	K	67.9	Low	68	Low	170 Å²	170	107.4 Å²	107.4	74%	0.739	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-79	-5.7	179.9	-91.2	-163.7	168.1	-163.2	0	115.2	C267 F271	C267-K269 VanDerWaalsContact C-N 3.28Å; C267-K269 PolarHBondContact O-N 3.42Å; K269-F271 PolarHBondContact O-N 3.44Å; K269-F271 VanDerWaalsContact O-N 3.08Å
270	G	55.8	Low	65.1	Low	11 Å²	11	112.2 Å²	112.2	11%	0.113	56%	0.56	C	S	.	*	G	3₁₀ helix	trans	-67.8	-1.5	179.1	0	0	0	0	0	116	H212 K268	H212-G270 WeakPolarHBondContact O-CA 3.25Å; K268-G270 VanDerWaalsContact C-N 3.31Å; K268-G270 PolarHBondContact O-N 3.41Å
271	F	60.7	Low	63	Low	81 Å²	81	114.1 Å²	114.1	36%	0.355	58%	0.575	S	S	.	*			trans	-121.3	98.1	175.5	-65.2	-66.5	0	0	0	111.5	F209 E210 F211 K269	F209-F271 HydrophobicContact CD1-CD1 4.19Å; F209-F271 AromaticContact CD1-CE1 3.69Å; F209-F271 HydrophobicContact CD1-CE1 3.69Å; F209-F271 HydrophobicContact CD1-CZ 4.12Å; F209-F271 HydrophobicContact CE1-CE1 4.43Å; E210-F271 WeakPolarHBondContact O-CE1 3.33Å; F211-F271 HydrophobicContact CD2-CE2 4.12Å; F211-F271 HydrophobicContact CD2-CZ 4.29Å; K269-F271 PolarHBondContact O-N 3.44Å; K269-F271 VanDerWaalsContact O-N 3.08Å
272	I	47.4	Very low	60.3	Low	163 Å²	163	113.3 Å²	113.3	84%	0.836	58%	0.576	S	S	*	*			trans	176.6	101.8	133.2	-84.5	149.4	0	0	0	107.4
273	Q	37.8	Very low	58	Low	182 Å²	182	115 Å²	115	85%	0.85	59%	0.591	S	S	*	*			trans	-139	133.3	143.8	-71	-160	23.2	0	0	107.6
274	R	37.1	Very low	55.3	Low	234 Å²	234	123.3 Å²	123.3	88%	0.883	63%	0.627	S	S	*	*			trans	-90.5	119.5	168.6	-77.1	-177.6	171.6	-177.9	-3.6	107.8	S276	R274-S276 PolarHBondContact O-N 3.24Å; R274-S276 VanDerWaalsContact O-N 3.08Å
275	I	42.1	Very low	52.8	Low	171 Å²	171	131 Å²	131	88%	0.877	65%	0.652	S	S	*	*			trans	-77	94.4	168.8	-56.7	178.8	0	0	0	108.1
276	S	40.5	Very low	50.9	Low	92 Å²	92	134.3 Å²	134.3	64%	0.643	67%	0.67	S	S	*	*			trans	-134.7	114.3	163.5	57.8	0	0	0	0	108.6	R274	R274-S276 PolarHBondContact O-N 3.24Å; R274-S276 VanDerWaalsContact O-N 3.08Å
277	K	48.9	Very low	48.6	Very low	215 Å²	215	144.7 Å²	144.7	94%	0.935	70%	0.703	S	S	*	*			trans	-61.6	142.1	174.5	-61.3	177.9	-178.4	178	0	109.4
278	G	39.4	Very low	46.7	Very low	76 Å²	76	154.1 Å²	154.1	78%	0.784	74%	0.744	S	S	*	*			trans	125.3	100.4	-176.6	0	0	0	0	0	110.6
279	G	42.1	Very low	44.9	Very low	74 Å²	74	158 Å²	158	76%	0.763	76%	0.761	S	S	*	*			trans	-87.7	160.5	-173.2	0	0	0	0	0	113.7
280	L	35.2	Very low	43.7	Very low	144 Å²	144	158.6 Å²	158.6	75%	0.754	77%	0.766	S	S	*	*			trans	-148.1	124.5	142.9	-144.6	87.7	0	0	0	110.6	K282	L280-K282 HydrophobicContact CD2-CD 4.41Å; L280-K282 VanDerWaalsContact CD2-CE 3.49Å; L280-K282 HydrophobicContact CD2-CG 4.17Å; L280-K282 PolarHBondContact O-N 2.87Å
281	I	50.3	Low	43.3	Very low	157 Å²	157	169.3 Å²	169.3	81%	0.805	80%	0.803	S	S	*	*			trans	-71.9	111.1	172.2	-61.8	172.1	0	0	0	108.2	T283	I281-T283 HydrophobicContact CG2-CG2 4.05Å
282	K	37	Very low	42.6	Very low	180 Å²	180	171.8 Å²	171.8	78%	0.783	83%	0.825	S	S	*	*			trans	-117.5	85.5	166.4	-72.2	-168.5	178.3	-178.8	0	110.7	L280	L280-K282 HydrophobicContact CD2-CD 4.41Å; L280-K282 VanDerWaalsContact CD2-CE 3.49Å; L280-K282 HydrophobicContact CD2-CG 4.17Å; L280-K282 PolarHBondContact O-N 2.87Å
283	T	45.8	Very low	42.6	Very low	102 Å²	102	173.4 Å²	173.4	63%	0.626	83%	0.826	S	S	*	*			trans	-67.5	175.3	159.1	57.4	0	0	0	0	110.5	I281	I281-T283 HydrophobicContact CG2-CG2 4.05Å
284	K	37	Very low	43.1	Very low	174 Å²	174	170.7 Å²	170.7	76%	0.757	82%	0.816	S	S	*	*			trans	83.8	140.6	177.6	-53.9	161.3	-172.6	172	0	113.2
285	R	38.7	Very low	43.5	Very low	225 Å²	225	163.7 Å²	163.7	85%	0.849	81%	0.808	S	S	*	*			cis	-151.1	137.8	2.3	-125.8	161.9	-175.9	171.3	-3.4	110.7	R287	R285-R287 PolarHBondContact O-N 2.76Å
286	K	49.1	Very low	43.9	Very low	212 Å²	212	165.2 Å²	165.2	92%	0.922	80%	0.804	S	S	*	*			trans	-73	90.8	177.4	-167.7	177	-172.3	175.7	0	110.2	K288	K286-K288 PolarHBondContact O-N 2.9Å; K286-K288 VanDerWaalsContact O-N 3.1Å
287	R	42	Very low	44.2	Very low	249 Å²	249	169.7 Å²	169.7	94%	0.94	82%	0.815	S	S	*	*			trans	-70.8	102.6	175.7	-102.8	-177.1	169.7	166.2	-2.9	110.4	R285 K289	R285-R287 PolarHBondContact O-N 2.76Å; R287-K289 PolarHBondContact O-N 2.79Å
288	K	46.8	Very low	44.1	Very low	198 Å²	198	167 Å²	167	86%	0.861	81%	0.806	S	S	*	*			trans	-64.1	122.4	174.8	-165.8	176.4	-175.8	-178.4	0	108.8	K286 Q290	K286-K288 PolarHBondContact O-N 2.9Å; K286-K288 VanDerWaalsContact O-N 3.1Å; K288-Q290 PolarHBondContact O-N 3.08Å; K288-Q290 VanDerWaalsContact O-N 3.09Å
289	K	42	Very low	44.6	Very low	207 Å²	207	169.7 Å²	169.7	90%	0.9	81%	0.806	S	S	*	*			trans	-66.4	108.8	170.9	-103.5	-167.3	175.5	-173.1	0	108.4	R287	R287-K289 PolarHBondContact O-N 2.79Å
290	Q	42.9	Very low	44.9	Very low	184 Å²	184	174.2 Å²	174.2	86%	0.86	81%	0.805	S	S	*	*			trans	-77.8	125.8	171.2	-166.5	162.7	-7.8	0	0	108	K288 V292	K288-Q290 PolarHBondContact O-N 3.08Å; K288-Q290 VanDerWaalsContact O-N 3.09Å; Q290-V292 PolarHBondContact O-N 2.82Å
291	R	46.6	Very low	45.7	Very low	236 Å²	236	173.1 Å²	173.1	89%	0.891	81%	0.805	S	S	*	*			trans	-76	114.7	173.1	-78.6	-177.8	169.8	-178.7	-5.1	108	K293	R291-K293 PolarHBondContact O-N 3.11Å
292	V	45.4	Very low	45.7	Very low	132 Å²	132	174.8 Å²	174.8	80%	0.8	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-68.9	120.9	162.7	-179.7	0	0	0	0	106.8	Q290	Q290-V292 PolarHBondContact O-N 2.82Å
293	K	47.4	Very low	46.1	Very low	197 Å²	197	173.9 Å²	173.9	86%	0.857	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-85	125.3	162	-73.8	-176	174.2	-172.9	0	106.6	R291	R291-K293 PolarHBondContact O-N 3.11Å
294	I	48.2	Very low	46.2	Very low	125 Å²	125	181.5 Å²	181.5	64%	0.641	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-81.1	117	161.5	-60.9	173.3	0	0	0	105.3	Y296	I294-Y296 HydrophobicContact CG2-CD2 4.34Å; I294-Y296 HydrophobicContact CG2-CE1 4.22Å; I294-Y296 HydrophobicContact CG2-CE2 3.91Å
295	A	45.8	Very low	46.6	Very low	88 Å²	88	181.9 Å²	181.9	73%	0.727	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-96.8	134.5	163.5	0	0	0	0	0	107.1
296	Y	50.4	Low	47.1	Very low	203 Å²	203	179.6 Å²	179.6	80%	0.796	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-96.6	129.3	167.1	-61.4	-87.1	0	0	0	106.7	I294	I294-Y296 HydrophobicContact CG2-CD2 4.34Å; I294-Y296 HydrophobicContact CG2-CE1 4.22Å; I294-Y296 HydrophobicContact CG2-CE2 3.91Å
297	E	46.3	Very low	46.9	Very low	185 Å²	185	177.8 Å²	177.8	86%	0.864	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-89.7	132.4	171	-68.3	-177.4	144.2	0	0	108.9	V299	E297-V299 PolarHBondContact O-N 2.81Å
298	E	46.9	Very low	47.2	Very low	160 Å²	160	173.6 Å²	173.6	75%	0.748	84%	0.836	S	S	*	*			trans	-79.1	111.1	-179.9	-66.2	-179.1	158.8	0	0	109.8	F300	E298-F300 HydrophobicContact CB-CD2 4.22Å; E298-F300 HydrophobicContact CB-CE2 4.02Å; E298-F300 PolarHBondContact O-N 3.14Å
299	V	50.6	Low	47.3	Very low	131 Å²	131	172.1 Å²	172.1	79%	0.794	83%	0.834	S	S	*	*			trans	-77.3	90.9	177.8	-177.6	0	0	0	0	109.7	E297 V301	E297-V299 PolarHBondContact O-N 2.81Å; V299-V301 HydrophobicContact CG1-CG2 4.3Å; V299-V301 PolarHBondContact O-N 2.93Å; V299-V301 VanDerWaalsContact O-N 3.08Å
300	F	48.1	Very low	47.6	Very low	169 Å²	169	169.8 Å²	169.8	74%	0.741	83%	0.83	S	S	*	*			trans	-70.3	95.5	169.1	-82.9	-93.1	0	0	0	111	E298 K302	E298-F300 HydrophobicContact CB-CD2 4.22Å; E298-F300 HydrophobicContact CB-CE2 4.02Å; E298-F300 PolarHBondContact O-N 3.14Å; F300-K302 PolarHBondContact O-N 3.01Å
301	V	51.6	Low	47.9	Very low	122 Å²	122	168.8 Å²	168.8	74%	0.739	83%	0.827	S	S	*	*			trans	-77.4	114.5	159.4	-177.3	0	0	0	0	107.9	V299	V299-V301 HydrophobicContact CG1-CG2 4.3Å; V299-V301 PolarHBondContact O-N 2.93Å; V299-V301 VanDerWaalsContact O-N 3.08Å
302	K	51.6	Low	48	Very low	192 Å²	192	163.6 Å²	163.6	84%	0.835	82%	0.823	S	S	*	*			trans	-83	134.5	165.8	-79.4	-175.3	173.8	-179.2	0	109.2	F300	F300-K302 PolarHBondContact O-N 3.01Å
303	N	45.5	Very low	48.3	Very low	161 Å²	161	166.3 Å²	166.3	86%	0.861	83%	0.825	S	S	*	*			trans	-64.7	151.4	173.1	-60.7	-10.5	0	0	0	111.2
304	M	46.7	Very low	48.3	Very low	262 Å²	262	163.5 Å²	163.5	100%	1.291	82%	0.822	S	S	*	*			trans	-142.4	0	157.4	-159.8	170.1	-169	0	0	108.5

Retrieved 304 of 304 residues in 489.4 ms (Link to these results)

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