A0A096MNZ8_PAPAN Loading...

Calnexin

Calcium-binding protein that interacts with newly synthesized monoglucosylated glycoproteins in the endoplasmic reticulum. It may act in assisting protein assembly and/or in the retention within the ER of unassembled protein subunits. It seems to play a major role in the quality control apparatus of the ER by the retention of incorrectly folded proteins. Associated with partial T-cell antigen receptor complexes that escape the ER of immature thymocytes, it may function as a signaling complex regulating thymocyte maturation. Additionally it may play a role in receptor-mediated endocytosis at the synapse.

AlphaFold DB , UniProt , Accession A0A096MNZ8, Species PAPAN (Papio anubis, Olive baboon), Gene CANX, Length 592 aa.

Structure Viewer

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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	48.7	Very low	44.8	Very low	206 Å²	206	139.8 Å²	139.8	100%	1.015	72%	0.718	S	S	*	*				0	32.2	0	-160	-178	-68.2	0	0	111.9
2	E	47.5	Very low	44.5	Very low	155 Å²	155	136.4 Å²	136.4	72%	0.724	71%	0.708	S	S	*	*			trans	-94.9	-29.7	-157.5	-63.2	68.8	-140.1	0	0	114.6	K4 W5	E2-K4 PolarHBondContact O-N 3.33Å; E2-W5 PolarHBondContact O-N 2.92Å; E2-W5 VanDerWaalsContact O-N 3.09Å
3	G	42.8	Very low	44	Very low	70 Å²	70	136.6 Å²	136.6	72%	0.722	71%	0.709	S	S	*	*	H	α-helix	trans	-60.6	-14	-169.9	0	0	0	0	0	116.5
4	K	44.4	Very low	43.6	Very low	177 Å²	177	131.7 Å²	131.7	77%	0.77	71%	0.709	S	S	*	*	H	α-helix	trans	-86.8	-11.8	178	-68.2	-162.7	173	-166.2	0	114.8	E2	E2-K4 PolarHBondContact O-N 3.33Å
5	W	45.3	Very low	43.1	Very low	201 Å²	201	130.4 Å²	130.4	76%	0.761	71%	0.707	S	S	*	*	H	α-helix	trans	-86.8	-30.9	178.5	-86.3	68.3	0	0	0	113.5	E2 L7 C8 M9	E2-W5 PolarHBondContact O-N 2.92Å; E2-W5 VanDerWaalsContact O-N 3.09Å; W5-L7 PolarHBondContact O-N 3.09Å; W5-C8 PolarHBondContact O-N 3.49Å; W5-M9 WeakPolarHBondContact O-CG 3.47Å; W5-M9 PolarHBondContact O-N 3.24Å
6	L	46.3	Very low	42.5	Very low	134 Å²	134	129.2 Å²	129.2	70%	0.702	71%	0.705	S	S	*	*	H	α-helix	trans	-65.2	-40	-179.6	-120.3	71.9	0	0	0	112.9	C8 M9 L10	L6-C8 PolarHBondContact O-N 3.46Å; L6-M9 PolarHBondContact O-N 3.48Å; L6-L10 PolarHBondContact O-N 3.46Å
7	L	44.4	Very low	42.3	Very low	124 Å²	124	131.6 Å²	131.6	65%	0.649	72%	0.715	S	S	*	*	H	α-helix	trans	-68.5	-33.5	-178.9	-130.5	74.8	0	0	0	112.7	W5 L11	W5-L7 PolarHBondContact O-N 3.09Å; L7-L11 PolarHBondContact O-N 3.33Å
8	C	42	Very low	41.7	Very low	81 Å²	81	131.4 Å²	131.4	55%	0.547	72%	0.718	S	S	.	*	H	α-helix	trans	-72.7	-33.9	175.2	-66.3	0	0	0	0	112.5	W5 L6 L10 L11 V12	W5-C8 PolarHBondContact O-N 3.49Å; L6-C8 PolarHBondContact O-N 3.46Å; C8-L10 VanDerWaalsContact C-N 3.35Å; C8-L10 PolarHBondContact O-N 3.38Å; C8-L11 PolarHBondContact O-N 3.49Å; C8-V12 WeakPolarHBondContact O-CG2 3.41Å; C8-V12 PolarHBondContact O-N 3.33Å
9	M	43.8	Very low	41.1	Very low	126 Å²	126	134.3 Å²	134.3	62%	0.621	73%	0.726	S	S	*	*	H	α-helix	trans	-61.4	-42.2	174.8	-74	-80.4	-95.9	0	0	112	W5 L6 L11 V12 L13	W5-M9 WeakPolarHBondContact O-CG 3.47Å; W5-M9 PolarHBondContact O-N 3.24Å; L6-M9 PolarHBondContact O-N 3.48Å; M9-L11 VanDerWaalsContact C-N 3.34Å; M9-L11 PolarHBondContact O-N 3.24Å; M9-V12 PolarHBondContact O-N 3.34Å; M9-L13 PolarHBondContact O-N 3.23Å
10	L	46.1	Very low	40.4	Very low	127 Å²	127	133 Å²	133	67%	0.665	73%	0.734	S	S	*	*	H	α-helix	trans	-66.3	-32.6	179.1	-79.3	162.4	0	0	0	113.4	L6 C8	L6-L10 PolarHBondContact O-N 3.46Å; C8-L10 VanDerWaalsContact C-N 3.35Å; C8-L10 PolarHBondContact O-N 3.38Å
11	L	42.1	Very low	39.8	Very low	137 Å²	137	135.3 Å²	135.3	72%	0.717	74%	0.74	S	S	*	*	H	α-helix	trans	-77.7	-23.7	176.8	-84.9	162.7	0	0	0	113.9	L7 C8 M9	L7-L11 PolarHBondContact O-N 3.33Å; C8-L11 PolarHBondContact O-N 3.49Å; M9-L11 VanDerWaalsContact C-N 3.34Å; M9-L11 PolarHBondContact O-N 3.24Å
12	V	40.6	Very low	38.9	Very low	99 Å²	99	132.7 Å²	132.7	60%	0.6	73%	0.73	S	S	*	*	H	α-helix	trans	-85.6	-24.3	178.2	173.4	0	0	0	0	112.3	C8 M9 G14	C8-V12 WeakPolarHBondContact O-CG2 3.41Å; C8-V12 PolarHBondContact O-N 3.33Å; M9-V12 PolarHBondContact O-N 3.34Å; V12-G14 PolarHBondContact O-N 3.37Å
13	L	37.8	Very low	37.9	Very low	139 Å²	139	128.5 Å²	128.5	73%	0.728	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-72.5	-12.7	172.8	-86	159.2	0	0	0	113.9	M9	M9-L13 PolarHBondContact O-N 3.23Å
14	G	39.2	Very low	37.3	Very low	68 Å²	68	131.5 Å²	131.5	70%	0.701	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-81.5	-6	-179.9	0	0	0	0	0	116	V12	V12-G14 PolarHBondContact O-N 3.37Å
15	T	34.9	Very low	36.5	Very low	112 Å²	112	130.8 Å²	130.8	69%	0.687	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-125.1	20.1	-170	58	0	0	0	0	114.7
16	V	34.7	Very low	35.9	Very low	111 Å²	111	127.2 Å²	127.2	67%	0.673	72%	0.724	S	S	*	*			trans	-119	46.4	-173.4	-160.8	0	0	0	0	113
17	I	38.9	Very low	35.1	Very low	171 Å²	171	128.5 Å²	128.5	88%	0.877	73%	0.731	S	S	*	*	S	Bend	trans	-142.3	50.6	159.5	-39.7	177.9	0	0	0	111.3
18	V	32.1	Very low	34.5	Very low	127 Å²	127	128.3 Å²	128.3	77%	0.77	74%	0.735	S	S	*	*	S	Bend	trans	-141.5	154.1	161.3	-178.8	0	0	0	0	107.8
19	E	28.7	Very low	34	Very low	187 Å²	187	131.7 Å²	131.7	87%	0.874	75%	0.746	S	S	*	*			trans	63.3	94.3	173.7	-83.9	164.2	-162.4	0	0	117.6
20	A	28.1	Very low	33.2	Very low	107 Å²	107	132.5 Å²	132.5	88%	0.884	75%	0.753	S	S	*	*			trans	-148.4	52.8	160.8	0	0	0	0	0	112.8
21	H	28	Very low	32.7	Very low	183 Å²	183	134.3 Å²	134.3	85%	0.847	76%	0.761	S	S	*	*			trans	-158.6	107.1	148.7	-150.2	-61	0	0	0	111.3
22	D	30	Very low	32.2	Very low	150 Å²	150	135.7 Å²	135.7	80%	0.802	76%	0.764	S	S	*	*			trans	-99.3	155.1	160.5	-170.9	8.7	0	0	0	108.4
23	G	26.4	Very low	31.8	Very low	67 Å²	67	137.8 Å²	137.8	69%	0.691	77%	0.772	S	S	*	*			trans	-179.3	54.7	-165.6	0	0	0	0	0	113.1
24	H	29.2	Very low	31.6	Very low	133 Å²	133	138.1 Å²	138.1	62%	0.616	78%	0.775	S	S	*	*			trans	-77.8	128.9	176.5	165.5	77.6	0	0	0	112.4	D26	H24-D26 VanDerWaalsContact CE1-CG 3.45Å; H24-D26 IonicContact CE1-OD1 3.59Å; H24-D26 IonicContact CE1-OD2 3.33Å; H24-D26 PolarHBondContact CE1-OD2 3.47Å; H24-D26 IonicContact NE2-OD2 3.91Å
25	D	29.2	Very low	31.3	Very low	163 Å²	163	141.8 Å²	141.8	87%	0.872	78%	0.777	S	S	*	*			trans	-141.2	125.7	153.9	-93.5	-43.6	0	0	0	107
26	D	31.3	Very low	31.2	Very low	126 Å²	126	144.1 Å²	144.1	67%	0.674	79%	0.786	S	S	*	*			trans	-85.9	142.8	168.8	-80.1	-33.2	0	0	0	109.8	H24	H24-D26 VanDerWaalsContact CE1-CG 3.45Å; H24-D26 IonicContact CE1-OD1 3.59Å; H24-D26 IonicContact CE1-OD2 3.33Å; H24-D26 PolarHBondContact CE1-OD2 3.47Å; H24-D26 IonicContact NE2-OD2 3.91Å
27	D	30.5	Very low	31	Very low	161 Å²	161	145.3 Å²	145.3	86%	0.861	79%	0.788	S	S	*	*			trans	-152.2	139	152.2	-128.9	-22.3	0	0	0	111.3
28	V	31.2	Very low	30.7	Very low	120 Å²	120	143.9 Å²	143.9	73%	0.727	79%	0.787	S	S	*	*			trans	-124.5	120.9	-170.9	174.5	0	0	0	0	110.4
29	I	30.7	Very low	30.5	Very low	152 Å²	152	144.2 Å²	144.2	78%	0.779	78%	0.783	S	S	*	*			trans	-140.3	119.8	169.6	-60.8	-176.4	0	0	0	110.2
30	D	28.8	Very low	30.6	Very low	143 Å²	143	143.3 Å²	143.3	77%	0.765	78%	0.779	S	S	*	*			trans	-74.5	143.6	167	-62.7	-65.7	0	0	0	111.8
31	I	33.7	Very low	30.7	Very low	164 Å²	164	146.9 Å²	146.9	84%	0.841	78%	0.777	S	S	*	*			trans	-138.5	125.5	152.8	-63.1	-174	0	0	0	108
32	E	32.9	Very low	30.8	Very low	166 Å²	166	144.7 Å²	144.7	78%	0.776	78%	0.777	S	S	*	*			trans	-92.6	167.9	176.1	-63.5	176	115.9	0	0	112
33	D	32.4	Very low	30.9	Very low	143 Å²	143	146.5 Å²	146.5	77%	0.765	78%	0.78	S	S	*	*			trans	64.4	147.3	166.9	-58.1	-23.7	0	0	0	117.2
34	D	33.1	Very low	31	Very low	147 Å²	147	151.2 Å²	151.2	79%	0.786	79%	0.789	S	S	*	*			cis	-146.8	173.2	29.8	-142	-27.3	0	0	0	112.9
35	L	32.6	Very low	30.9	Very low	144 Å²	144	150.4 Å²	150.4	75%	0.754	80%	0.799	S	S	*	*			trans	-90.4	156.6	-177	-60.4	94.9	0	0	0	114.2
36	D	32	Very low	31	Very low	162 Å²	162	151.9 Å²	151.9	87%	0.866	80%	0.798	S	S	*	*				-167.4	164.4	119.2	-112.4	-18.9	0	0	0	113.5
37	D	31.6	Very low	31.1	Very low	136 Å²	136	151.9 Å²	151.9	73%	0.727	81%	0.805	S	S	*	*			trans	-68.6	154	-169.7	-78.8	-47.2	0	0	0	116.8
38	V	31.6	Very low	31.1	Very low	141 Å²	141	151.9 Å²	151.9	86%	0.855	80%	0.804	S	S	*	*				-173.4	137.2	108.2	147.7	0	0	0	0	112.5
39	I	29.5	Very low	31.1	Very low	134 Å²	134	151.9 Å²	151.9	69%	0.687	81%	0.805	S	S	*	*			trans	-86.1	145.4	178.5	-57.9	152.7	0	0	0	107.3
40	E	29.4	Very low	31.5	Very low	168 Å²	168	151.3 Å²	151.3	79%	0.785	81%	0.808	S	S	*	*				-174.9	176.9	65.7	-156.9	149.5	-141.3	0	0	113.3
41	E	30.5	Very low	31.8	Very low	181 Å²	181	148.6 Å²	148.6	85%	0.846	81%	0.806	S	S	*	*			trans	77.3	141	167.3	-56.6	-155.2	153	0	0	119.4
42	V	29.6	Very low	32.2	Very low	138 Å²	138	146.1 Å²	146.1	84%	0.836	80%	0.801	S	S	*	*			trans	-150.4	127.2	-163.4	-174.4	0	0	0	0	108.6
43	E	31.8	Very low	32.6	Very low	187 Å²	187	144.4 Å²	144.4	87%	0.874	80%	0.804	S	S	*	*			trans	-128.8	147.4	163	-75.9	-159.4	121.9	0	0	110.8	S45	E43-S45 PolarHBondContact O-N 2.87Å
44	D	29.1	Very low	33.1	Very low	166 Å²	166	142.2 Å²	142.2	89%	0.888	80%	0.8	S	S	*	*			trans	-65.9	121.9	-162.3	-82.2	-67.6	0	0	0	114.8
45	S	27.7	Very low	33.6	Very low	116 Å²	116	139.8 Å²	139.8	81%	0.811	79%	0.794	S	S	*	*			trans	-102.8	105.8	167.1	-65.6	0	0	0	0	110.7	E43	E43-S45 PolarHBondContact O-N 2.87Å
46	K	32	Very low	34.1	Very low	195 Å²	195	138.7 Å²	138.7	85%	0.848	80%	0.796	S	S	*	*			trans	-78.1	128	166	-72.7	-179	-179.8	174.4	0	109.5	D48	K46-D48 PolarHBondContact O-N 3.47Å
47	P	33.2	Very low	35.2	Very low	126 Å²	126	139.4 Å²	139.4	82%	0.818	79%	0.791	S	S	*	*			trans	-76.4	112.5	171.2	30.4	-31.2	0	0	0	109
48	D	29.6	Very low	36.6	Very low	160 Å²	160	136.1 Å²	136.1	86%	0.856	78%	0.776	S	S	*	*			trans	-80	154.1	172.7	-132.6	-38	0	0	0	111.4	K46	K46-D48 PolarHBondContact O-N 3.47Å
49	T	31.9	Very low	38.4	Very low	120 Å²	120	135.5 Å²	135.5	74%	0.736	77%	0.773	S	S	*	*			trans	-78.6	142.1	-163	-60.4	0	0	0	0	112.7	A51	T49-A51 PolarHBondContact O-N 2.87Å
50	T	37.8	Very low	40.6	Very low	140 Å²	140	130.5 Å²	130.5	86%	0.859	75%	0.746	S	S	*	*			trans	-56.8	108.7	174.6	41.8	0	0	0	0	112
51	A	35.1	Very low	42.9	Very low	87 Å²	87	129.1 Å²	129.1	72%	0.719	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-70.5	148.8	169.6	0	0	0	0	0	111.4	T49	T49-A51 PolarHBondContact O-N 2.87Å
52	P	42.9	Very low	45.2	Very low	112 Å²	112	122.2 Å²	122.2	73%	0.727	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-65	156.1	172.6	29.5	-35.9	0	0	0	111.4	S54	P52-S54 PolarHBondContact O-N 2.86Å
53	P	42	Very low	47.6	Very low	130 Å²	130	116 Å²	116	84%	0.844	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-58.9	124.9	-177.7	23.7	-32.8	0	0	0	110.8
54	S	41.9	Very low	50.1	Low	96 Å²	96	111.6 Å²	111.6	67%	0.671	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-64.8	144.6	177.8	54.5	0	0	0	0	110.8	P52	P52-S54 PolarHBondContact O-N 2.86Å
55	S	43.2	Very low	52.7	Low	96 Å²	96	106.2 Å²	106.2	67%	0.671	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-51.6	148.7	168.7	46.3	0	0	0	0	112	K57	S55-K57 PolarHBondContact O-N 3.45Å
56	P	44.2	Very low	55.1	Low	122 Å²	122	105.4 Å²	105.4	79%	0.792	62%	0.623	S	S	*	*			trans	-64.4	102.9	-176.6	26.5	-34.2	0	0	0	109.9	V58	P56-V58 PolarHBondContact O-N 2.87Å
57	K	55.2	Low	57.6	Low	176 Å²	176	97.8 Å²	97.8	77%	0.765	60%	0.6	S	S	*	*			trans	-64.4	107.5	175.1	-67.6	-174.4	178.8	-176.4	0	108.4	S55 T59	S55-K57 PolarHBondContact O-N 3.45Å; K57-T59 PolarHBondContact O-N 2.92Å; K57-T59 VanDerWaalsContact O-N 3.08Å
58	V	61.2	Low	60.1	Low	68 Å²	68	98 Å²	98	41%	0.412	59%	0.59	S	S	.	*			trans	-64.2	108.6	173.4	178.1	0	0	0	0	107.5	P56 Y60 L114 L457	P56-V58 PolarHBondContact O-N 2.87Å; V58-Y60 PolarHBondContact O-N 3.17Å; V58-L114 HydrophobicContact CB-CD2 3.84Å; V58-L114 HydrophobicContact CG1-CD2 3.78Å; V58-L457 HydrophobicContact CG1-CD1 3.69Å; V58-L457 HydrophobicContact CG1-CD2 4.46Å; V58-L457 HydrophobicContact CG1-CG 4.17Å
59	T	68.1	Low	63.1	Low	128 Å²	128	91.3 Å²	91.3	79%	0.785	56%	0.555	S	S	*	*			trans	-72.9	108.3	177.5	-55.7	0	0	0	0	108.8	K57	K57-T59 PolarHBondContact O-N 2.92Å; K57-T59 VanDerWaalsContact O-N 3.08Å
60	Y	76.4	Confident	66	Low	29 Å²	29	87 Å²	87	11%	0.114	53%	0.526	C	S	.	.			trans	-58.2	146.4	173.6	175.2	-109.1	0	0	0	111.5	V58 P63 D76 L114 D117 L457	V58-Y60 PolarHBondContact O-N 3.17Å; Y60-P63 WeakPolarHBondContact OH-CD 3.07Å; Y60-D76 WeakPolarHBondContact CE1-OD1 3.18Å; Y60-D76 VanDerWaalsContact CZ-OD1 3.29Å; Y60-D76 PolarHBondContact OH-OD1 3.37Å; Y60-L114 HydrophobicContact CD2-CD1 4.44Å; Y60-D117 HydrophobicContact CD1-CB 4.32Å; Y60-D117 HydrophobicContact CD2-CB 4.32Å; Y60-D117 HydrophobicContact CE1-CB 4.34Å; Y60-D117 HydrophobicContact CE2-CB 4.36Å; Y60-D117 HydrophobicContact CG-CB 4.32Å; Y60-L457 HydrophobicContact CD2-CD2 4.13Å
61	K	77.4	Confident	68.7	Low	138 Å²	138	80.9 Å²	80.9	60%	0.6	49%	0.487	S	S	*	.			trans	-145.2	121.4	178.1	175.6	-167.3	161.4	-114.8	0	108.2
62	A	78.1	Confident	71.5	Confident	37 Å²	37	78.2 Å²	78.2	31%	0.306	47%	0.465	S	S	.	.			trans	-39	123.5	171.6	0	0	0	0	0	112.5	D76	A62-D76 HydrophobicContact CB-CB 4.17Å; A62-D76 VanDerWaalsContact CB-CG 3.48Å; A62-D76 WeakPolarHBondContact CB-OD2 3.17Å
63	P	81.3	Confident	73.9	Confident	7 Å²	7	73.6 Å²	73.6	5%	0.045	43%	0.434	C	S	.	.			trans	-65	149	174.9	27.1	-33.1	0	0	0	110.3	Y60 N437 W450 D453	Y60-P63 WeakPolarHBondContact OH-CD 3.07Å; P63-N437 WeakPolarHBondContact CG-OD1 3.46Å; P63-W450 HydrophobicContact CB-CD2 4.18Å; P63-W450 HydrophobicContact CB-CE3 3.74Å; P63-W450 HydrophobicContact CB-CH2 4.15Å; P63-W450 HydrophobicContact CB-CZ3 3.71Å; P63-W450 HydrophobicContact CG-CD2 4.4Å; P63-W450 HydrophobicContact CG-CE3 4.17Å; P63-W450 HydrophobicContact CG-CH2 3.69Å; P63-W450 HydrophobicContact CG-CZ2 3.97Å; P63-W450 HydrophobicContact CG-CZ3 3.8Å; P63-W450 WeakPolarHBondContact O-CZ3 3.27Å; P63-D453 HydrophobicContact CB-CB 4Å
64	V	83.9	Confident	76.2	Confident	94 Å²	94	68 Å²	68	57%	0.57	40%	0.398	S	S	*	.			trans	-131	123	-177.4	-179.5	0	0	0	0	108.8	T66	V64-T66 PolarHBondContact O-N 3.34Å
65	P	82.9	Confident	78.4	Confident	53 Å²	53	63.5 Å²	63.5	34%	0.344	37%	0.366	S	S	.	.			trans	-68.8	124.4	-172.5	27.2	-33.7	0	0	0	112	G67 V69 W450	P65-G67 PolarHBondContact O-N 2.85Å; P65-V69 HydrophobicContact CB-CG2 3.6Å; P65-V69 HydrophobicContact CG-CG2 4.44Å; P65-W450 HydrophobicContact CB-CE3 4.44Å
66	T	79.4	Confident	80.4	Confident	99 Å²	99	61.3 Å²	61.3	61%	0.607	35%	0.347	S	S	*	.	S	Bend	trans	-66.6	-17.5	-177.9	-37.1	0	0	0	0	114.1	V64 D449	V64-T66 PolarHBondContact O-N 3.34Å; T66-D449 PolarHBondContact OG1-OD2 2.82Å
67	G	82.9	Confident	82.2	Confident	35 Å²	35	64.1 Å²	64.1	36%	0.361	34%	0.342	S	S	.	.	S	Bend	trans	-142.5	-164.5	-170.7	0	0	0	0	0	115.5	P65	P65-G67 PolarHBondContact O-N 2.85Å
68	E	86.8	Confident	83.3	Confident	131 Å²	131	57.3 Å²	57.3	61%	0.612	32%	0.322	S	S	*	.			trans	-73.1	125.8	173.7	-76.2	-138.8	131.1	0	0	111.3	K137 C441	E68-K137 IonicContact OE1-NZ 3.73Å; E68-K137 PolarHBondContact OE1-NZ 2.86Å; E68-K137 IonicContact OE2-NZ 2.83Å; E68-K137 PolarHBondContact OE2-NZ 3.38Å; E68-C441 PolarHBondContact O-SG 3.35Å
69	V	92.1	Very high	84.5	Confident	20 Å²	20	57.2 Å²	57.2	12%	0.121	32%	0.322	C	S	.	.			trans	-129.7	142.6	-178.4	-170.2	0	0	0	0	110.8	P65 F71 A72 I439 I440 C441 V446	P65-V69 HydrophobicContact CB-CG2 3.6Å; P65-V69 HydrophobicContact CG-CG2 4.44Å; V69-F71 WeakPolarHBondContact CG1-O 3.29Å; V69-A72 HydrophobicContact CG1-CB 4.15Å; V69-I439 HydrophobicContact CG1-CD1 4.17Å; V69-I439 HydrophobicContact CG1-CG1 3.72Å; V69-I439 HydrophobicContact CG2-CD1 4.39Å; V69-I440 WeakPolarHBondContact CG1-O 3.44Å; V69-C441 HydrophobicContact CG1-CB 4.41Å; V69-V446 HydrophobicContact CG2-CG1 3.91Å
70	Y	93.4	Very high	85.4	Confident	29 Å²	29	53.5 Å²	53.5	11%	0.114	30%	0.297	C	S	.	.	S	Bend	trans	-84	-34.2	-178.6	-65.1	-103.3	0	0	0	111.9	N136 K137 F139 K144 I440 A442	Y70-N136 WeakPolarHBondContact O-CB 3.19Å; Y70-N136 PolarHBondContact O-N 3.34Å; Y70-K137 HydrophobicContact CD1-CB 4.2Å; Y70-K137 WeakPolarHBondContact CD1-O 3.31Å; Y70-F139 HydrophobicContact CD1-CB 4.17Å; Y70-F139 AromaticContact CD1-CD2 3.83Å; Y70-F139 HydrophobicContact CD1-CD2 3.83Å; Y70-F139 HydrophobicContact CD1-CG 4.47Å; Y70-F139 HydrophobicContact CD2-CD2 4.02Å; Y70-F139 HydrophobicContact CD2-CE2 4.42Å; Y70-F139 HydrophobicContact CE1-CB 4.41Å; Y70-F139 AromaticContact CE1-CD2 3.72Å; Y70-F139 HydrophobicContact CE1-CD2 3.72Å; Y70-F139 HydrophobicContact CE1-CE2 4.43Å; Y70-F139 HydrophobicContact CE1-CG 4.41Å; Y70-F139 AromaticContact CE2-CD2 3.93Å; Y70-F139 HydrophobicContact CE2-CD2 3.93Å; Y70-F139 HydrophobicContact CE2-CE2 4.04Å; Y70-F139 AromaticContact CG-CD2 3.99Å; Y70-F139 HydrophobicContact CG-CD2 3.99Å; Y70-F139 AromaticContact CZ-CD2 3.78Å; Y70-K144 PolarHBondContact OH-NZ 2.9Å; Y70-I440 WeakPolarHBondContact CB-O 3.5Å; Y70-I440 PolarHBondContact N-O 2.88Å; Y70-A442 HydrophobicContact CE2-CB 3.99Å
71	F	95.1	Very high	85.8	Confident	12 Å²	12	55.9 Å²	55.9	5%	0.053	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	137.7	170	-172.8	-97.7	0	0	0	109.9	V69 D73 W83 A133 L135 V422 F438 I439 I440	V69-F71 WeakPolarHBondContact CG1-O 3.29Å; F71-D73 HydrophobicContact CE1-CB 3.81Å; F71-D73 HydrophobicContact CZ-CB 3.89Å; F71-W83 HydrophobicContact CE1-CZ2 4.07Å; F71-W83 AromaticContact CZ-CZ2 3.82Å; F71-W83 HydrophobicContact CZ-CZ2 3.82Å; F71-A133 HydrophobicContact CE2-CB 3.62Å; F71-A133 HydrophobicContact CZ-CB 3.69Å; F71-L135 HydrophobicContact CB-CD1 4.36Å; F71-L135 HydrophobicContact CB-CG 4.17Å; F71-V422 HydrophobicContact CD1-CG1 4.13Å; F71-V422 HydrophobicContact CD2-CG1 4.31Å; F71-V422 HydrophobicContact CE1-CG1 3.92Å; F71-V422 HydrophobicContact CE2-CG1 4.11Å; F71-V422 HydrophobicContact CG-CG1 4.31Å; F71-V422 HydrophobicContact CZ-CG1 3.91Å; F71-F438 HydrophobicContact CD1-CB 4.18Å; F71-F438 HydrophobicContact CE1-CB 3.85Å; F71-I439 CarbonylContact O-C 3.54Å; F71-I439 WeakPolarHBondContact O-CA 3.46Å; F71-I440 HydrophobicContact CB-CB 4.06Å; F71-I440 HydrophobicContact CB-CD1 4.11Å; F71-I440 HydrophobicContact CB-CG1 4.1Å; F71-I440 PolarHBondContact N-O 3.27Å; F71-I440 PolarHBondContact O-N 3.42Å
72	A	93.8	Very high	86.2	Confident	30 Å²	30	51.7 Å²	51.7	25%	0.248	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	125.7	171.7	0	0	0	0	0	108.5	V69 F438 W450	V69-A72 HydrophobicContact CG1-CB 4.15Å; A72-F438 CarbonylContact C-O 3.55Å; A72-F438 VanDerWaalsContact CA-O 3.25Å; A72-F438 WeakPolarHBondContact CA-O 3.38Å; A72-W450 HydrophobicContact CB-CH2 4.34Å
73	D	93.3	Very high	86.9	Confident	15 Å²	15	50.7 Å²	50.7	8%	0.08	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	131	172.1	-151.6	-9.8	0	0	0	111	F71 F75 W83 N437 F438	F71-D73 HydrophobicContact CE1-CB 3.81Å; F71-D73 HydrophobicContact CZ-CB 3.89Å; D73-F75 PolarHBondContact OD1-N 3.25Å; D73-W83 PolarHBondContact OD2-NE1 3.37Å; D73-N437 CarbonylContact O-C 3.55Å; D73-N437 WeakPolarHBondContact O-CA 3.45Å; D73-N437 PolarHBondContact O-N 2.93Å; D73-F438 PolarHBondContact N-O 2.72Å; D73-F438 PolarHBondContact O-N 3.31Å
74	S	89.2	Confident	87.5	Confident	13 Å²	13	53.4 Å²	53.4	9%	0.091	32%	0.316	C	S	.	.			trans	-126.9	10.5	-176.6	50.9	0	0	0	0	111.7	D76 D436 N437	S74-D76 WeakPolarHBondContact CB-OD2 3.27Å; S74-D76 PolarHBondContact O-N 2.83Å; S74-D76 PolarHBondContact OG-OD2 2.92Å; S74-D436 VanDerWaalsContact C-OD1 3.31Å; S74-D436 WeakPolarHBondContact CA-OD1 3.45Å; S74-N437 WeakPolarHBondContact CB-OD1 3.29Å
75	F	89.3	Confident	87.8	Confident	1 Å²	1	52.4 Å²	52.4	0%	0.004	31%	0.307	C	S	.	.			trans	49.7	3.9	176.9	-54.6	-80.3	0	0	0	118.9	D73 R77 G78 W83 V106 K118 L120 F438	D73-F75 PolarHBondContact OD1-N 3.25Å; F75-R77 PolarHBondContact O-N 3.48Å; F75-G78 PolarHBondContact O-N 3.33Å; F75-W83 AromaticContact CE1-CD1 3.82Å; F75-W83 HydrophobicContact CE1-CD2 4.49Å; F75-W83 AromaticContact CE1-CE2 3.77Å; F75-W83 HydrophobicContact CE1-CZ2 4.23Å; F75-W83 AromaticContact CE1-NE1 3.32Å; F75-W83 VanDerWaalsContact CE1-NE1 3.32Å; F75-W83 AromaticContact CZ-CE2 3.71Å; F75-W83 AromaticContact CZ-CZ2 3.68Å; F75-W83 HydrophobicContact CZ-CZ2 3.68Å; F75-W83 AromaticContact CZ-NE1 3.69Å; F75-V106 HydrophobicContact CB-CG1 3.94Å; F75-V106 HydrophobicContact CD1-CG2 4.17Å; F75-K118 WeakPolarHBondContact CB-O 3.48Å; F75-L120 HydrophobicContact CD1-CB 4.36Å; F75-L120 HydrophobicContact CD2-CB 4.19Å; F75-L120 HydrophobicContact CE1-CB 3.86Å; F75-L120 HydrophobicContact CE1-CD2 4.42Å; F75-L120 HydrophobicContact CE2-CB 3.66Å; F75-L120 HydrophobicContact CZ-CB 3.49Å; F75-L120 VanDerWaalsContact CZ-CB 3.49Å; F75-L120 HydrophobicContact CZ-CD2 3.94Å; F75-L120 HydrophobicContact CZ-CG 4.28Å; F75-F438 AromaticContact CE2-CD2 3.64Å; F75-F438 HydrophobicContact CE2-CD2 3.64Å; F75-F438 AromaticContact CE2-CE2 3.7Å; F75-F438 HydrophobicContact CE2-CE2 3.7Å; F75-F438 AromaticContact CZ-CD2 3.92Å; F75-F438 HydrophobicContact CZ-CD2 3.92Å; F75-F438 AromaticContact CZ-CE2 3.89Å; F75-F438 HydrophobicContact CZ-CE2 3.89Å
76	D	84.1	Confident	88.2	Confident	50 Å²	50	50.3 Å²	50.3	27%	0.267	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.9	-23.5	179.2	-58	-65.2	0	0	0	114.7	Y60 A62 S74 G78	Y60-D76 WeakPolarHBondContact CE1-OD1 3.18Å; Y60-D76 VanDerWaalsContact CZ-OD1 3.29Å; Y60-D76 PolarHBondContact OH-OD1 3.37Å; A62-D76 HydrophobicContact CB-CB 4.17Å; A62-D76 VanDerWaalsContact CB-CG 3.48Å; A62-D76 WeakPolarHBondContact CB-OD2 3.17Å; S74-D76 WeakPolarHBondContact CB-OD2 3.27Å; S74-D76 PolarHBondContact O-N 2.83Å; S74-D76 PolarHBondContact OG-OD2 2.92Å; D76-G78 PolarHBondContact O-N 3.04Å
77	R	82.2	Confident	88.4	Confident	181 Å²	181	52.1 Å²	52.1	68%	0.683	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-13.4	176.4	-58.8	179.4	-172.9	137.1	9.5	113.1	F75 T79	F75-R77 PolarHBondContact O-N 3.48Å; R77-T79 VanDerWaalsContact C-N 3.25Å; R77-T79 PolarHBondContact O-N 3.49Å
78	G	78.9	Confident	88.3	Confident	34 Å²	34	50.8 Å²	50.8	35%	0.351	28%	0.279	S	S	.	.	S	Bend	trans	69	18.9	-178.2	0	0	0	0	0	114	F75 D76	F75-G78 PolarHBondContact O-N 3.33Å; D76-G78 PolarHBondContact O-N 3.04Å
79	T	86.3	Confident	87.7	Confident	66 Å²	66	49.4 Å²	49.4	41%	0.405	27%	0.271	S	S	.	.	S	Bend	trans	-144.7	149.2	-174.7	62	0	0	0	0	112.4	R77 S81	R77-T79 VanDerWaalsContact C-N 3.25Å; R77-T79 PolarHBondContact O-N 3.49Å; T79-S81 WeakPolarHBondContact CB-OG 3.24Å; T79-S81 PolarHBondContact O-N 2.78Å; T79-S81 WeakPolarHBondContact OG1-CB 3.48Å; T79-S81 PolarHBondContact OG1-OG 3.5Å
80	L	86.1	Confident	86.6	Confident	49 Å²	49	51 Å²	51	26%	0.257	28%	0.276	S	S	.	.			trans	-71.4	31	172.7	-62.9	168.9	0	0	0	113.1	G82 W83 L85 V106 L120 I131	L80-G82 PolarHBondContact O-N 3.24Å; L80-W83 PolarHBondContact O-N 2.96Å; L80-W83 VanDerWaalsContact O-N 3.11Å; L80-L85 HydrophobicContact CD1-CD1 4.23Å; L80-V106 HydrophobicContact CD2-CG2 3.49Å; L80-V106 VanDerWaalsContact CD2-CG2 3.49Å; L80-V106 HydrophobicContact CG-CG2 3.86Å; L80-L120 HydrophobicContact CD2-CD1 3.49Å; L80-L120 VanDerWaalsContact CD2-CD1 3.49Å; L80-I131 HydrophobicContact CD2-CD1 4.11Å
81	S	84.3	Confident	84.9	Confident	79 Å²	79	55.2 Å²	55.2	55%	0.552	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	82.3	-168	-67.6	0	0	0	0	113.1	T79	T79-S81 WeakPolarHBondContact CB-OG 3.24Å; T79-S81 PolarHBondContact O-N 2.78Å; T79-S81 WeakPolarHBondContact OG1-CB 3.48Å; T79-S81 PolarHBondContact OG1-OG 3.5Å
82	G	86.3	Confident	83.2	Confident	51 Å²	51	60.3 Å²	60.3	53%	0.526	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	144.8	-17.1	-176.6	0	0	0	0	0	112.4	L80	L80-G82 PolarHBondContact O-N 3.24Å
83	W	93.5	Very high	81.5	Confident	15 Å²	15	61.2 Å²	61.2	6%	0.057	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	143.9	179.2	-65.5	78	0	0	0	111.3	F71 D73 F75 L80 L120 I131 S132 A133 V422 L424 F438	F71-W83 HydrophobicContact CE1-CZ2 4.07Å; F71-W83 AromaticContact CZ-CZ2 3.82Å; F71-W83 HydrophobicContact CZ-CZ2 3.82Å; D73-W83 PolarHBondContact OD2-NE1 3.37Å; F75-W83 AromaticContact CE1-CD1 3.82Å; F75-W83 HydrophobicContact CE1-CD2 4.49Å; F75-W83 AromaticContact CE1-CE2 3.77Å; F75-W83 HydrophobicContact CE1-CZ2 4.23Å; F75-W83 AromaticContact CE1-NE1 3.32Å; F75-W83 VanDerWaalsContact CE1-NE1 3.32Å; F75-W83 AromaticContact CZ-CE2 3.71Å; F75-W83 AromaticContact CZ-CZ2 3.68Å; F75-W83 HydrophobicContact CZ-CZ2 3.68Å; F75-W83 AromaticContact CZ-NE1 3.69Å; L80-W83 PolarHBondContact O-N 2.96Å; L80-W83 VanDerWaalsContact O-N 3.11Å; W83-L120 HydrophobicContact CZ3-CD2 4.41Å; W83-I131 HydrophobicContact CB-CD1 3.77Å; W83-I131 HydrophobicContact CB-CG1 3.99Å; W83-I131 HydrophobicContact CE3-CD1 4.36Å; W83-I131 HydrophobicContact CE3-CG1 4.1Å; W83-I131 HydrophobicContact CE3-CG2 4.04Å; W83-I131 HydrophobicContact CG-CD1 4.44Å; W83-I131 HydrophobicContact CZ3-CG2 4.28Å; W83-S132 CarbonylContact C-O 3.59Å; W83-S132 WeakPolarHBondContact CA-O 3.44Å; W83-A133 HydrophobicContact CD2-CB 3.58Å; W83-A133 HydrophobicContact CE3-CB 3.85Å; W83-A133 HydrophobicContact CG-CB 3.96Å; W83-A133 HydrophobicContact CH2-CB 4.4Å; W83-A133 HydrophobicContact CZ2-CB 4.14Å; W83-A133 HydrophobicContact CZ3-CB 4.25Å; W83-V422 HydrophobicContact CH2-CG1 4.27Å; W83-L424 HydrophobicContact CH2-CD1 4.39Å; W83-L424 HydrophobicContact CZ3-CD1 4.12Å; W83-F438 HydrophobicContact CH2-CD2 4.19Å; W83-F438 HydrophobicContact CH2-CE2 4.07Å; W83-F438 HydrophobicContact CH2-CZ 4.36Å; W83-F438 AromaticContact CZ2-CD2 3.98Å; W83-F438 HydrophobicContact CZ2-CD2 3.98Å; W83-F438 HydrophobicContact CZ2-CE2 4.18Å
84	I	93	Very high	79.9	Confident	64 Å²	64	66.8 Å²	66.8	33%	0.328	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	118.9	-177.2	-62.3	174.8	0	0	0	107	I131 S132 L176 D177	I84-I131 CarbonylContact O-C 3.48Å; I84-I131 WeakPolarHBondContact O-CA 3.17Å; I84-I131 WeakPolarHBondContact O-CG1 3.4Å; I84-S132 PolarHBondContact N-O 2.98Å; I84-S132 PolarHBondContact O-N 3.45Å; I84-L176 HydrophobicContact CB-CB 4.31Å; I84-L176 HydrophobicContact CD1-CB 3.95Å; I84-L176 HydrophobicContact CD1-CD1 4.09Å; I84-L176 HydrophobicContact CG2-CB 4.23Å; I84-D177 WeakPolarHBondContact CG2-OD1 3.27Å
85	L	91.8	Very high	78.4	Confident	73 Å²	73	71 Å²	71	38%	0.382	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	132.9	172.1	-72.8	78.8	0	0	0	108.9	L80 I131	L80-L85 HydrophobicContact CD1-CD1 4.23Å; L85-I131 HydrophobicContact CD1-CD1 3.81Å; L85-I131 HydrophobicContact CD1-CG1 4.13Å; L85-I131 HydrophobicContact CG-CD1 4.07Å; L85-I131 HydrophobicContact CG-CG1 4.07Å
86	S	90.3	Very high	76.8	Confident	10 Å²	10	79.2 Å²	79.2	7%	0.07	42%	0.421	C	S	.	.			trans	-65.4	146.9	177.3	-172.1	0	0	0	0	111.7	A88 A130 F179	S86-A88 VanDerWaalsContact OG-CB 3.25Å; S86-A88 WeakPolarHBondContact OG-CB 3.07Å; S86-A88 PolarHBondContact OG-N 2.8Å; S86-A130 PolarHBondContact N-O 3.34Å; S86-F179 WeakPolarHBondContact CB-O 3.42Å; S86-F179 PolarHBondContact OG-N 3.09Å; S86-F179 PolarHBondContact OG-O 3.3Å
87	K	84.8	Confident	75.6	Confident	137 Å²	137	80.6 Å²	80.6	60%	0.596	43%	0.427	S	S	*	.			trans	-111.1	11.8	169.6	-52	-176.9	-176.9	75.1	0	111.4	D177 Q178	K87-D177 PolarHBondContact N-O 3.48Å; K87-D177 IonicContact NZ-OD1 3.58Å; K87-D177 PolarHBondContact NZ-OD1 2.89Å; K87-D177 IonicContact NZ-OD2 2.76Å; K87-D177 PolarHBondContact NZ-OD2 3.05Å; K87-Q178 PolarHBondContact O-NE2 2.83Å
88	A	79.7	Confident	74.7	Confident	7 Å²	7	72.1 Å²	72.1	6%	0.058	40%	0.396	C	S	.	.			trans	-70.1	167.6	-179.1	0	0	0	0	0	112.6	S86 Y100 H180	S86-A88 VanDerWaalsContact OG-CB 3.25Å; S86-A88 WeakPolarHBondContact OG-CB 3.07Å; S86-A88 PolarHBondContact OG-N 2.8Å; A88-Y100 HydrophobicContact CB-CD2 4.12Å; A88-H180 HydrophobicContact CB-CB 3.95Å
89	K	74.6	Confident	74.3	Confident	101 Å²	101	74.3 Å²	74.3	44%	0.439	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-123.4	157.7	158.6	-64.4	-170.5	-177.7	-174.5	0	109.3	D95 A98 K99	K89-D95 IonicContact NZ-OD1 3.33Å; K89-D95 PolarHBondContact NZ-OD1 3.17Å; K89-A98 CarbonylContact C-O 3.56Å; K89-A98 WeakPolarHBondContact CA-O 3.43Å; K89-K99 HydrophobicContact CD-CG 4.44Å; K89-K99 HydrophobicContact CG-CG 4.35Å
90	K	68	Low	73.8	Confident	53 Å²	53	72 Å²	72	23%	0.23	38%	0.38	C	S	.	.			trans	-88.3	122.5	168.5	-179.5	173.8	177.4	-173.6	0	109.7	D92 T93 A98 D181	K90-D92 VanDerWaalsContact C-N 3.33Å; K90-D92 PolarHBondContact O-N 3.39Å; K90-T93 WeakPolarHBondContact CD-OG1 3.36Å; K90-T93 WeakPolarHBondContact CE-OG1 3.43Å; K90-A98 PolarHBondContact N-O 3.32Å; K90-A98 WeakPolarHBondContact O-CB 3.08Å; K90-D181 VanDerWaalsContact CE-OD2 3.22Å; K90-D181 WeakPolarHBondContact CE-OD2 3.49Å
91	D	58.2	Low	73.4	Confident	119 Å²	119	73.4 Å²	73.4	64%	0.636	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-29.1	-171.1	-47.5	-65.1	0	0	0	114.2	K182	D91-K182 IonicContact OD2-NZ 2.7Å; D91-K182 PolarHBondContact OD2-NZ 3.39Å
92	D	59.5	Low	73.3	Confident	119 Å²	119	69.9 Å²	69.9	64%	0.636	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	42.7	-167.7	-53.3	-66.7	0	0	0	112.4	K90 K182	K90-D92 VanDerWaalsContact C-N 3.33Å; K90-D92 PolarHBondContact O-N 3.39Å; D92-K182 WeakPolarHBondContact OD2-CE 3.4Å; D92-K182 IonicContact OD2-NZ 3.98Å; D92-K182 PolarHBondContact OD2-NZ 3.44Å
93	T	58.7	Low	73.4	Confident	49 Å²	49	73.5 Å²	73.5	30%	0.301	37%	0.365	S	S	.	.	S	Bend	trans	-153.1	154.4	-177	-61.1	0	0	0	0	110.6	K90 I97 A98	K90-T93 WeakPolarHBondContact CD-OG1 3.36Å; K90-T93 WeakPolarHBondContact CE-OG1 3.43Å; T93-I97 HydrophobicContact CG2-CB 3.87Å; T93-I97 HydrophobicContact CG2-CG2 3.81Å; T93-A98 HydrophobicContact CG2-CB 4.48Å
94	D	59.4	Low	73.4	Confident	131 Å²	131	73.4 Å²	73.4	70%	0.701	37%	0.365	S	S	*	.			trans	-53.1	139.1	177.7	-83.1	-56.4	0	0	0	112.6	E96 I97 A98	D94-E96 PolarHBondContact O-N 3.08Å; D94-I97 PolarHBondContact O-N 3.02Å; D94-A98 VanDerWaalsContact O-CB 3.27Å; D94-A98 WeakPolarHBondContact O-CB 2.99Å; D94-A98 PolarHBondContact O-N 2.91Å
95	D	58.3	Low	73.3	Confident	101 Å²	101	74.3 Å²	74.3	54%	0.54	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-22.2	-170.5	-127.9	-43.5	0	0	0	113.8	K89 K99	K89-D95 IonicContact NZ-OD1 3.33Å; K89-D95 PolarHBondContact NZ-OD1 3.17Å; D95-K99 PolarHBondContact O-NZ 3.2Å
96	E	55.9	Low	73.3	Confident	175 Å²	175	72.1 Å²	72.1	82%	0.818	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-32.4	175.7	-61.7	-165.3	153.6	0	0	113.6	D94	D94-E96 PolarHBondContact O-N 3.08Å
97	I	58.9	Low	73.3	Confident	79 Å²	79	75.6 Å²	75.6	41%	0.405	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-28.6	-178.8	-60.4	172.8	0	0	0	111	T93 D94 K99 H128 W427	T93-I97 HydrophobicContact CG2-CB 3.87Å; T93-I97 HydrophobicContact CG2-CG2 3.81Å; D94-I97 PolarHBondContact O-N 3.02Å; I97-K99 PolarHBondContact O-N 3.32Å; I97-H128 PolarHBondContact O-CD2 2.82Å; I97-W427 HydrophobicContact CG2-CH2 4.36Å; I97-W427 HydrophobicContact CG2-CZ3 4.05Å
98	A	61.5	Low	73.6	Confident	3 Å²	3	72.3 Å²	72.3	3%	0.025	36%	0.361	C	S	.	.	S	Bend	trans	-61.6	-10.3	-178.2	0	0	0	0	0	115.7	K89 K90 T93 D94	K89-A98 CarbonylContact C-O 3.56Å; K89-A98 WeakPolarHBondContact CA-O 3.43Å; K90-A98 PolarHBondContact N-O 3.32Å; K90-A98 WeakPolarHBondContact O-CB 3.08Å; T93-A98 HydrophobicContact CG2-CB 4.48Å; D94-A98 VanDerWaalsContact O-CB 3.27Å; D94-A98 WeakPolarHBondContact O-CB 2.99Å; D94-A98 PolarHBondContact O-N 2.91Å
99	K	71.4	Confident	73.9	Confident	79 Å²	79	73 Å²	73	34%	0.343	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-91.5	134.4	-177.5	-56	-171.8	-172.1	79.3	0	110.5	K89 D95 I97 D101	K89-K99 HydrophobicContact CD-CG 4.44Å; K89-K99 HydrophobicContact CG-CG 4.35Å; D95-K99 PolarHBondContact O-NZ 3.2Å; I97-K99 PolarHBondContact O-N 3.32Å; K99-D101 HydrophobicContact CB-CB 4.12Å; K99-D101 PolarHBondContact O-N 3.16Å
100	Y	75.7	Confident	74.3	Confident	19 Å²	19	73.9 Å²	73.9	8%	0.075	37%	0.368	C	S	.	.			trans	-76.9	64.8	166.9	-70.8	-76.7	0	0	0	110.7	A88 H128 A130 H180 D181 E425	A88-Y100 HydrophobicContact CB-CD2 4.12Å; Y100-H128 CarbonylContact C-O 3.53Å; Y100-H128 WeakPolarHBondContact CA-O 3.42Å; Y100-H128 HydrophobicContact CD1-CB 3.65Å; Y100-H128 HydrophobicContact CE1-CB 3.74Å; Y100-H128 HydrophobicContact CG-CB 4.46Å; Y100-A130 HydrophobicContact CD1-CB 3.31Å; Y100-A130 HydrophobicContact CD2-CB 4.45Å; Y100-A130 HydrophobicContact CE1-CB 3.84Å; Y100-A130 HydrophobicContact CG-CB 3.67Å; Y100-H180 HydrophobicContact CE2-CB 3.71Å; Y100-D181 PolarHBondContact OH-N 3.07Å; Y100-E425 HydrophobicContact CE1-CG 3.59Å; Y100-E425 WeakPolarHBondContact CE1-OE1 3.47Å; Y100-E425 VanDerWaalsContact OH-CD 3.28Å; Y100-E425 PolarHBondContact OH-OE1 3.01Å
101	D	78.6	Confident	74.6	Confident	77 Å²	77	78.5 Å²	78.5	41%	0.412	39%	0.39	S	S	.	.			trans	-105.8	13	-174.2	89.1	-25.7	0	0	0	114	K99 K127 H128	K99-D101 HydrophobicContact CB-CB 4.12Å; K99-D101 PolarHBondContact O-N 3.16Å; D101-K127 VanDerWaalsContact OD1-CD 3.27Å; D101-K127 WeakPolarHBondContact OD1-CD 3.48Å; D101-K127 WeakPolarHBondContact OD1-CE 3.39Å; D101-K127 IonicContact OD1-NZ 2.66Å; D101-K127 PolarHBondContact OD1-NZ 3.33Å; D101-K127 IonicContact OD2-NZ 3.31Å; D101-K127 PolarHBondContact OD2-NZ 2.67Å; D101-H128 PolarHBondContact N-O 3.47Å
102	G	82.3	Confident	75.4	Confident	6 Å²	6	74.5 Å²	74.5	6%	0.062	37%	0.371	C	S	.	.			trans	-67.7	135.4	169.8	0	0	0	0	0	112.9	H128 H129	G102-H128 PolarHBondContact N-O 3.3Å; G102-H128 VanDerWaalsContact N-O 3.12Å; G102-H129 WeakPolarHBondContact CA-CD2 3.31Å; G102-H129 VanDerWaalsContact CA-NE2 3.29Å; G102-H129 WeakPolarHBondContact CA-NE2 3.14Å
103	K	88.3	Confident	76.2	Confident	127 Å²	127	73.3 Å²	73.3	55%	0.552	36%	0.36	S	S	*	.			trans	-85	142.1	-178.1	-65.3	-177.4	172.6	-170.4	0	113.4	M123 S124 H129	K103-M123 HydrophobicContact CB-CB 4.28Å; K103-M123 PolarHBondContact O-N 2.89Å; K103-S124 WeakPolarHBondContact CB-OG 3.25Å; K103-S124 PolarHBondContact N-OG 2.83Å; K103-H129 PolarHBondContact N-NE2 3.48Å; K103-H129 PolarHBondContact O-CD2 2.94Å
104	W	91.7	Very high	77.1	Confident	13 Å²	13	71.1 Å²	71.1	5%	0.049	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	133.4	170.2	-63	97.9	0	0	0	109.8	L120 V121 L122 H129 I131 L424 L426 F435	W104-L120 HydrophobicContact CB-CD1 3.95Å; W104-L120 HydrophobicContact CD2-CD1 4.11Å; W104-L120 HydrophobicContact CD2-CG 4.5Å; W104-L120 HydrophobicContact CE3-CD1 3.56Å; W104-L120 HydrophobicContact CE3-CD2 4.02Å; W104-L120 HydrophobicContact CE3-CG 3.58Å; W104-L120 HydrophobicContact CG-CD1 4.33Å; W104-L120 HydrophobicContact CZ3-CD1 4.3Å; W104-L120 HydrophobicContact CZ3-CD2 3.96Å; W104-L120 HydrophobicContact CZ3-CG 3.81Å; W104-V121 WeakPolarHBondContact CA-O 3.44Å; W104-L122 HydrophobicContact CE3-CB 4.23Å; W104-L122 HydrophobicContact CH2-CB 4.4Å; W104-L122 HydrophobicContact CH2-CD1 4.02Å; W104-L122 HydrophobicContact CH2-CG 4.49Å; W104-L122 HydrophobicContact CZ2-CD1 4.47Å; W104-L122 HydrophobicContact CZ3-CB 3.88Å; W104-L122 HydrophobicContact CZ3-CD1 4.35Å; W104-L122 HydrophobicContact CZ3-CG 4.41Å; W104-H129 HydrophobicContact CZ2-CB 3.61Å; W104-I131 HydrophobicContact CB-CD1 4.18Å; W104-I131 HydrophobicContact CD2-CB 4.43Å; W104-I131 HydrophobicContact CD2-CG2 3.91Å; W104-I131 VanDerWaalsContact CE2-CG2 3.42Å; W104-I131 HydrophobicContact CE3-CG2 4.46Å; W104-I131 HydrophobicContact CG-CB 4.41Å; W104-I131 HydrophobicContact CG-CD1 4.02Å; W104-I131 HydrophobicContact CG-CG2 4.36Å; W104-I131 HydrophobicContact CH2-CG2 4.1Å; W104-I131 HydrophobicContact CZ2-CB 4.35Å; W104-I131 HydrophobicContact CZ2-CG2 3.52Å; W104-L424 HydrophobicContact CH2-CB 3.94Å; W104-L424 HydrophobicContact CH2-CD1 3.85Å; W104-L424 HydrophobicContact CH2-CG 4.49Å; W104-L424 HydrophobicContact CZ2-CB 4.09Å; W104-L424 HydrophobicContact CZ3-CD1 4.23Å; W104-L426 HydrophobicContact CH2-CD1 4.19Å; W104-F435 HydrophobicContact CH2-CE2 4.24Å; W104-F435 HydrophobicContact CZ3-CD2 4.04Å; W104-F435 AromaticContact CZ3-CE2 4Å; W104-F435 HydrophobicContact CZ3-CE2 4Å
105	E	91.9	Very high	78	Confident	83 Å²	83	69.6 Å²	69.6	39%	0.388	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	160.5	176.2	-62.8	180	-171.7	0	0	108.6	V121 M123	E105-V121 PolarHBondContact N-O 3.4Å; E105-V121 VanDerWaalsContact N-O 3.16Å; E105-V121 PolarHBondContact O-N 3.26Å; E105-M123 HydrophobicContact CB-CG 3.92Å; E105-M123 HydrophobicContact CG-CG 3.98Å
106	V	92.3	Very high	79	Confident	26 Å²	26	66.2 Å²	66.2	16%	0.158	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	109.9	176.9	173.7	0	0	0	0	108.1	F75 L80 K118 G119	F75-V106 HydrophobicContact CB-CG1 3.94Å; F75-V106 HydrophobicContact CD1-CG2 4.17Å; L80-V106 HydrophobicContact CD2-CG2 3.49Å; L80-V106 VanDerWaalsContact CD2-CG2 3.49Å; L80-V106 HydrophobicContact CG-CG2 3.86Å; V106-K118 HydrophobicContact CG1-CB 4.18Å; V106-G119 WeakPolarHBondContact CA-O 3.16Å
107	D	90.1	Very high	80.4	Confident	84 Å²	84	57.9 Å²	57.9	45%	0.449	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	174.2	-173.5	-153	2	0	0	0	111.9	K118 G119	D107-K118 WeakPolarHBondContact O-CA 3.34Å; D107-K118 IonicContact OD1-NZ 2.67Å; D107-G119 PolarHBondContact N-O 2.83Å; D107-G119 PolarHBondContact O-N 3.43Å
108	E	89.8	Confident	81.9	Confident	67 Å²	67	56.3 Å²	56.3	31%	0.313	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	154	177.3	-62.2	171.8	-130.6	0	0	110.4	G116 D117 K118	E108-G116 PolarHBondContact OE2-N 2.91Å; E108-D117 WeakPolarHBondContact CG-O 3.41Å; E108-K118 HydrophobicContact CG-CD 4.4Å; E108-K118 HydrophobicContact CG-CG 3.54Å; E108-K118 VanDerWaalsContact OE1-CE 3.26Å; E108-K118 WeakPolarHBondContact OE1-CE 3.37Å; E108-K118 IonicContact OE1-NZ 2.81Å; E108-K118 PolarHBondContact OE1-NZ 3.46Å
109	M	86.2	Confident	83.4	Confident	22 Å²	22	56.1 Å²	56.1	11%	0.108	28%	0.283	C	S	.	.			trans	-62.4	139.7	174.9	-67.1	178.1	-79.2	0	0	110.9	E111 S112 D117 T235 F434 K458	M109-E111 PolarHBondContact O-N 3.45Å; M109-S112 WeakPolarHBondContact O-CB 3.15Å; M109-S112 PolarHBondContact O-N 2.95Å; M109-D117 VanDerWaalsContact CE-OD2 3.27Å; M109-D117 WeakPolarHBondContact CE-OD2 3.48Å; M109-T235 PolarHBondContact SD-OG1 2.88Å; M109-T235 VanDerWaalsContact SD-OG1 3.4Å; M109-F434 HydrophobicContact CB-CE2 4.44Å; M109-F434 HydrophobicContact CE-CE1 4.42Å; M109-F434 HydrophobicContact CE-CZ 4.35Å; M109-F434 HydrophobicContact CG-CD1 3.95Å; M109-F434 HydrophobicContact CG-CD2 3.48Å; M109-F434 VanDerWaalsContact CG-CD2 3.48Å; M109-F434 HydrophobicContact CG-CE1 3.87Å; M109-F434 HydrophobicContact CG-CE2 3.4Å; M109-F434 HydrophobicContact CG-CG 3.78Å; M109-F434 HydrophobicContact CG-CZ 3.6Å; M109-F434 HydrophobicContact SD-CD1 4.13Å; M109-F434 HydrophobicContact SD-CE1 3.99Å; M109-F434 HydrophobicContact SD-CG 4.48Å; M109-F434 HydrophobicContact SD-CZ 4.21Å; M109-K458 HydrophobicContact CE-CD 4.47Å
110	K	82.6	Confident	84.5	Confident	119 Å²	119	52.4 Å²	52.4	52%	0.517	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-32.5	-178.9	-68.2	177.9	-175.4	-178.7	0	113.6	N156 D432	K110-N156 PolarHBondContact NZ-OD1 2.72Å; K110-D432 WeakPolarHBondContact CE-OD1 3.03Å; K110-D432 IonicContact NZ-OD1 3.95Å; K110-D432 PolarHBondContact NZ-OD1 2.89Å; K110-D432 VanDerWaalsContact NZ-OD1 3.15Å; K110-D432 IonicContact NZ-OD2 3.65Å; K110-D432 PolarHBondContact NZ-OD2 2.81Å
111	E	76.1	Confident	85.4	Confident	150 Å²	150	51.7 Å²	51.7	70%	0.701	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	25.2	178.6	-64.1	-167.5	-157	0	0	112.9	M109 K113	M109-E111 PolarHBondContact O-N 3.45Å; E111-K113 WeakPolarHBondContact O-CD 3.27Å; E111-K113 WeakPolarHBondContact O-CE 3.46Å; E111-K113 PolarHBondContact O-N 3.49Å; E111-K113 PolarHBondContact O-NZ 3.23Å; E111-K113 IonicContact OE2-NZ 3.27Å
112	S	73.9	Confident	86	Confident	35 Å²	35	48 Å²	48	25%	0.245	25%	0.245	C	C	.	.			trans	-52.9	130.2	-175.4	-172.6	0	0	0	0	112.9	M109 L114	M109-S112 WeakPolarHBondContact O-CB 3.15Å; M109-S112 PolarHBondContact O-N 2.95Å; S112-L114 PolarHBondContact OG-N 2.88Å; S112-L114 VanDerWaalsContact OG-N 3.1Å; S112-L114 PolarHBondContact OG-O 2.64Å
113	K	75.7	Confident	86.4	Confident	94 Å²	94	50.9 Å²	50.9	41%	0.409	26%	0.258	S	S	.	.	S	Bend	trans	-89.2	-9	169.7	-45	-53.8	179.7	-130.8	0	112.2	E111 A461 D462 A465	E111-K113 WeakPolarHBondContact O-CD 3.27Å; E111-K113 WeakPolarHBondContact O-CE 3.46Å; E111-K113 PolarHBondContact O-N 3.49Å; E111-K113 PolarHBondContact O-NZ 3.23Å; E111-K113 IonicContact OE2-NZ 3.27Å; K113-A461 HydrophobicContact CB-CB 4.21Å; K113-D462 WeakPolarHBondContact CG-OD1 3.47Å; K113-A465 HydrophobicContact CD-CB 4.16Å; K113-A465 HydrophobicContact CG-CB 4.17Å
114	L	78.8	Confident	86.5	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.021	24%	0.237	C	C	.	.	S	Bend	trans	-120.4	95.1	-179.9	-71.2	178.9	0	0	0	110.2	V58 Y60 S112 G116 D117 L457 K458 A461	V58-L114 HydrophobicContact CB-CD2 3.84Å; V58-L114 HydrophobicContact CG1-CD2 3.78Å; Y60-L114 HydrophobicContact CD2-CD1 4.44Å; S112-L114 PolarHBondContact OG-N 2.88Å; S112-L114 VanDerWaalsContact OG-N 3.1Å; S112-L114 PolarHBondContact OG-O 2.64Å; L114-G116 PolarHBondContact O-N 2.91Å; L114-D117 HydrophobicContact CB-CB 4.17Å; L114-D117 WeakPolarHBondContact O-CB 3.35Å; L114-D117 PolarHBondContact O-N 3.3Å; L114-L457 HydrophobicContact CD1-CB 4.47Å; L114-L457 HydrophobicContact CD1-CD2 4.31Å; L114-L457 HydrophobicContact CD1-CG 4.02Å; L114-K458 HydrophobicContact CD1-CB 4.33Å; L114-K458 HydrophobicContact CD1-CG 4.05Å; L114-A461 HydrophobicContact CD1-CB 4.12Å; L114-A461 HydrophobicContact CD2-CB 3.8Å; L114-A461 HydrophobicContact CG-CB 3.75Å
115	P	78.2	Confident	86.4	Confident	99 Å²	99	52 Å²	52	64%	0.643	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	132.2	-179.1	27.2	-33.9	0	0	0	110.9
116	G	79.1	Confident	86.2	Confident	30 Å²	30	50 Å²	50	31%	0.309	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	-8.4	-174.8	0	0	0	0	0	115.7	E108 L114 K118	E108-G116 PolarHBondContact OE2-N 2.91Å; L114-G116 PolarHBondContact O-N 2.91Å; G116-K118 PolarHBondContact O-N 3.17Å
117	D	85.9	Confident	85.9	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.265	C	S	.	.			trans	-72.6	111.9	167.1	-179	48	0	0	0	109.5	Y60 E108 M109 L114 K458	Y60-D117 HydrophobicContact CD1-CB 4.32Å; Y60-D117 HydrophobicContact CD2-CB 4.32Å; Y60-D117 HydrophobicContact CE1-CB 4.34Å; Y60-D117 HydrophobicContact CE2-CB 4.36Å; Y60-D117 HydrophobicContact CG-CB 4.32Å; E108-D117 WeakPolarHBondContact CG-O 3.41Å; M109-D117 VanDerWaalsContact CE-OD2 3.27Å; M109-D117 WeakPolarHBondContact CE-OD2 3.48Å; L114-D117 HydrophobicContact CB-CB 4.17Å; L114-D117 WeakPolarHBondContact O-CB 3.35Å; L114-D117 PolarHBondContact O-N 3.3Å; D117-K458 VanDerWaalsContact CG-CE 3.5Å; D117-K458 VanDerWaalsContact CG-NZ 3.25Å; D117-K458 WeakPolarHBondContact OD1-CE 3.32Å; D117-K458 IonicContact OD1-NZ 2.67Å; D117-K458 PolarHBondContact OD1-NZ 3.13Å; D117-K458 WeakPolarHBondContact OD2-CD 3.33Å; D117-K458 WeakPolarHBondContact OD2-CE 2.97Å; D117-K458 IonicContact OD2-NZ 2.91Å; D117-K458 PolarHBondContact OD2-NZ 3.31Å
118	K	90.5	Very high	85.8	Confident	45 Å²	45	49 Å²	49	20%	0.196	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	139.7	-173.2	-74.7	180	-174.6	-68.5	0	110.3	F75 V106 D107 E108 G116	F75-K118 WeakPolarHBondContact CB-O 3.48Å; V106-K118 HydrophobicContact CG1-CB 4.18Å; D107-K118 WeakPolarHBondContact O-CA 3.34Å; D107-K118 IonicContact OD1-NZ 2.67Å; E108-K118 HydrophobicContact CG-CD 4.4Å; E108-K118 HydrophobicContact CG-CG 3.54Å; E108-K118 VanDerWaalsContact OE1-CE 3.26Å; E108-K118 WeakPolarHBondContact OE1-CE 3.37Å; E108-K118 IonicContact OE1-NZ 2.81Å; E108-K118 PolarHBondContact OE1-NZ 3.46Å; G116-K118 PolarHBondContact O-N 3.17Å
119	G	92.3	Very high	85.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	172.5	178.7	0	0	0	0	0	112.5	V106 D107 F434 F435	V106-G119 WeakPolarHBondContact CA-O 3.16Å; D107-G119 PolarHBondContact N-O 2.83Å; D107-G119 PolarHBondContact O-N 3.43Å; G119-F434 VanDerWaalsContact CA-CE2 3.49Å; G119-F434 VanDerWaalsContact CA-CZ 3.47Å; G119-F434 VanDerWaalsContact N-CE2 3.27Å; G119-F435 CarbonylContact C-O 3.51Å; G119-F435 WeakPolarHBondContact CA-O 3.46Å
120	L	94.6	Very high	86.2	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	116.3	173.5	173.1	65.9	0	0	0	109.6	F75 L80 W83 W104 I131 L424 F435	F75-L120 HydrophobicContact CD1-CB 4.36Å; F75-L120 HydrophobicContact CD2-CB 4.19Å; F75-L120 HydrophobicContact CE1-CB 3.86Å; F75-L120 HydrophobicContact CE1-CD2 4.42Å; F75-L120 HydrophobicContact CE2-CB 3.66Å; F75-L120 HydrophobicContact CZ-CB 3.49Å; F75-L120 VanDerWaalsContact CZ-CB 3.49Å; F75-L120 HydrophobicContact CZ-CD2 3.94Å; F75-L120 HydrophobicContact CZ-CG 4.28Å; L80-L120 HydrophobicContact CD2-CD1 3.49Å; L80-L120 VanDerWaalsContact CD2-CD1 3.49Å; W83-L120 HydrophobicContact CZ3-CD2 4.41Å; W104-L120 HydrophobicContact CB-CD1 3.95Å; W104-L120 HydrophobicContact CD2-CD1 4.11Å; W104-L120 HydrophobicContact CD2-CG 4.5Å; W104-L120 HydrophobicContact CE3-CD1 3.56Å; W104-L120 HydrophobicContact CE3-CD2 4.02Å; W104-L120 HydrophobicContact CE3-CG 3.58Å; W104-L120 HydrophobicContact CG-CD1 4.33Å; W104-L120 HydrophobicContact CZ3-CD1 4.3Å; W104-L120 HydrophobicContact CZ3-CD2 3.96Å; W104-L120 HydrophobicContact CZ3-CG 3.81Å; L120-I131 HydrophobicContact CD1-CD1 4.31Å; L120-I131 HydrophobicContact CD2-CG2 4.25Å; L120-L424 HydrophobicContact CD2-CD1 3.53Å; L120-F435 HydrophobicContact CB-CB 4.33Å; L120-F435 PolarHBondContact N-O 3.35Å; L120-F435 PolarHBondContact O-N 2.76Å
121	V	93.9	Very high	86.8	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.03	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129	-175.4	-168.2	0	0	0	0	111.6	W104 E105 M123 I433 F434	W104-V121 WeakPolarHBondContact CA-O 3.44Å; E105-V121 PolarHBondContact N-O 3.4Å; E105-V121 VanDerWaalsContact N-O 3.16Å; E105-V121 PolarHBondContact O-N 3.26Å; V121-M123 HydrophobicContact CB-CG 4.45Å; V121-M123 HydrophobicContact CB-SD 4.06Å; V121-M123 HydrophobicContact CG1-CG 4.33Å; V121-M123 HydrophobicContact CG1-SD 3.55Å; V121-M123 VanDerWaalsContact CG1-SD 3.55Å; V121-M123 PolarHBondContact O-N 3.24Å; V121-I433 WeakPolarHBondContact CA-O 3.47Å; V121-F434 HydrophobicContact CG2-CD2 3.8Å
122	L	92.8	Very high	87.7	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	98.7	173.1	-171.8	154.1	0	0	0	109.3	W104 H129 L426 S431 D432 I433 F435	W104-L122 HydrophobicContact CE3-CB 4.23Å; W104-L122 HydrophobicContact CH2-CB 4.4Å; W104-L122 HydrophobicContact CH2-CD1 4.02Å; W104-L122 HydrophobicContact CH2-CG 4.49Å; W104-L122 HydrophobicContact CZ2-CD1 4.47Å; W104-L122 HydrophobicContact CZ3-CB 3.88Å; W104-L122 HydrophobicContact CZ3-CD1 4.35Å; W104-L122 HydrophobicContact CZ3-CG 4.41Å; L122-H129 HydrophobicContact CD1-CB 4.19Å; L122-L426 HydrophobicContact CD1-CB 4.36Å; L122-L426 HydrophobicContact CD1-CD1 4.07Å; L122-S431 CarbonylContact O-C 3.59Å; L122-D432 PolarHBondContact O-N 2.79Å; L122-I433 HydrophobicContact CB-CB 4.17Å; L122-I433 PolarHBondContact N-O 2.67Å; L122-F435 HydrophobicContact CB-CE2 4.32Å
123	M	90.3	Very high	88.7	Confident	65 Å²	65	30.5 Å²	30.5	32%	0.32	16%	0.161	S	C	.	.			trans	-88	-15.2	-165.6	-68.6	-63.9	-83.1	0	0	114.9	K103 E105 V121	K103-M123 HydrophobicContact CB-CB 4.28Å; K103-M123 PolarHBondContact O-N 2.89Å; E105-M123 HydrophobicContact CB-CG 3.92Å; E105-M123 HydrophobicContact CG-CG 3.98Å; V121-M123 HydrophobicContact CB-CG 4.45Å; V121-M123 HydrophobicContact CB-SD 4.06Å; V121-M123 HydrophobicContact CG1-CG 4.33Å; V121-M123 HydrophobicContact CG1-SD 3.55Å; V121-M123 VanDerWaalsContact CG1-SD 3.55Å; V121-M123 PolarHBondContact O-N 3.24Å
124	S	89.8	Confident	89.6	Confident	18 Å²	18	33.1 Å²	33.1	13%	0.126	17%	0.172	C	C	.	.			trans	-107.1	135.1	-170.2	-47.3	0	0	0	0	113.9	K103 H129	K103-S124 WeakPolarHBondContact CB-OG 3.25Å; K103-S124 PolarHBondContact N-OG 2.83Å; S124-H129 WeakPolarHBondContact CB-NE2 3.47Å; S124-H129 PolarHBondContact O-CE1 2.81Å
125	R	89.8	Confident	90.4	Very high	145 Å²	145	33.5 Å²	33.5	55%	0.547	17%	0.174	S	C	.	.	S	Bend	trans	-82.5	140.7	174.5	-160.5	-178	-174.2	177.6	5.2	111.4	K127 E159 M429	R125-K127 PolarHBondContact O-N 3.3Å; R125-E159 IonicContact CZ-OE2 2.69Å; R125-E159 IonicContact NH2-OE1 2.96Å; R125-E159 IonicContact NH2-OE2 2.96Å; R125-E159 PolarHBondContact NH2-OE2 3.21Å; R125-M429 WeakPolarHBondContact CD-O 3.2Å; R125-M429 WeakPolarHBondContact CG-O 3.35Å; R125-M429 PolarHBondContact NE-O 3.22Å
126	A	86.8	Confident	91	Very high	42 Å²	42	34.6 Å²	34.6	35%	0.347	18%	0.175	S	C	.	.	S	Bend	trans	55	49	172.7	0	0	0	0	0	113.7	W427 S428 M429	A126-W427 HydrophobicContact CB-CH2 4.23Å; A126-W427 HydrophobicContact CB-CZ2 4.34Å; A126-W427 VanDerWaalsContact O-CH2 3.24Å; A126-W427 WeakPolarHBondContact O-CH2 3.25Å; A126-S428 WeakPolarHBondContact CA-O 3.2Å; A126-S428 PolarHBondContact N-O 3.06Å; A126-M429 HydrophobicContact CB-CE 4.41Å; A126-M429 HydrophobicContact CB-SD 3.86Å
127	K	87.4	Confident	91.6	Very high	67 Å²	67	37.5 Å²	37.5	29%	0.291	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	150.7	-179.9	-74.9	-172.4	169.9	-135.7	0	112.7	D101 R125 H129 W427	D101-K127 VanDerWaalsContact OD1-CD 3.27Å; D101-K127 WeakPolarHBondContact OD1-CD 3.48Å; D101-K127 WeakPolarHBondContact OD1-CE 3.39Å; D101-K127 IonicContact OD1-NZ 2.66Å; D101-K127 PolarHBondContact OD1-NZ 3.33Å; D101-K127 IonicContact OD2-NZ 3.31Å; D101-K127 PolarHBondContact OD2-NZ 2.67Å; R125-K127 PolarHBondContact O-N 3.3Å; K127-H129 PolarHBondContact O-CE1 3.02Å; K127-H129 PolarHBondContact O-ND1 3.2Å; K127-W427 VanDerWaalsContact C-CZ3 3.5Å; K127-W427 VanDerWaalsContact CA-CZ3 3.49Å
128	H	87.8	Confident	92	Very high	21 Å²	21	40.3 Å²	40.3	10%	0.097	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	128	167.1	-79.7	-79.1	0	0	0	110.1	I97 Y100 D101 G102 E425 L426 W427	I97-H128 PolarHBondContact O-CD2 2.82Å; Y100-H128 CarbonylContact C-O 3.53Å; Y100-H128 WeakPolarHBondContact CA-O 3.42Å; Y100-H128 HydrophobicContact CD1-CB 3.65Å; Y100-H128 HydrophobicContact CE1-CB 3.74Å; Y100-H128 HydrophobicContact CG-CB 4.46Å; D101-H128 PolarHBondContact N-O 3.47Å; G102-H128 PolarHBondContact N-O 3.3Å; G102-H128 VanDerWaalsContact N-O 3.12Å; H128-E425 IonicContact ND1-OE1 2.71Å; H128-L426 WeakPolarHBondContact CA-O 3.28Å; H128-W427 AromaticContact CD2-CE3 3.42Å; H128-W427 VanDerWaalsContact CD2-CE3 3.42Å; H128-W427 AromaticContact CD2-CZ3 3.71Å; H128-W427 AromaticContact CE1-CE3 3.89Å; H128-W427 AromaticContact CG-CE3 3.78Å; H128-W427 AromaticContact NE2-CE3 3.51Å
129	H	90.9	Very high	92.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.7	179.1	-65.8	73.7	0	0	0	108.7	G102 K103 W104 L122 S124 K127 E425 L426	G102-H129 WeakPolarHBondContact CA-CD2 3.31Å; G102-H129 VanDerWaalsContact CA-NE2 3.29Å; G102-H129 WeakPolarHBondContact CA-NE2 3.14Å; K103-H129 PolarHBondContact N-NE2 3.48Å; K103-H129 PolarHBondContact O-CD2 2.94Å; W104-H129 HydrophobicContact CZ2-CB 3.61Å; L122-H129 HydrophobicContact CD1-CB 4.19Å; S124-H129 WeakPolarHBondContact CB-NE2 3.47Å; S124-H129 PolarHBondContact O-CE1 2.81Å; K127-H129 PolarHBondContact O-CE1 3.02Å; K127-H129 PolarHBondContact O-ND1 3.2Å; H129-E425 CarbonylContact O-C 3.59Å; H129-E425 WeakPolarHBondContact O-CA 3.22Å; H129-L426 PolarHBondContact N-O 3.48Å; H129-L426 PolarHBondContact O-N 3.26Å
130	A	93.1	Very high	92.3	Very high	4 Å²	4	42.1 Å²	42.1	3%	0.033	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	118	173.9	0	0	0	0	0	111	S86 Y100 F179 L424 E425	S86-A130 PolarHBondContact N-O 3.34Å; Y100-A130 HydrophobicContact CD1-CB 3.31Å; Y100-A130 HydrophobicContact CD2-CB 4.45Å; Y100-A130 HydrophobicContact CE1-CB 3.84Å; Y100-A130 HydrophobicContact CG-CB 3.67Å; A130-F179 HydrophobicContact CB-CD1 4.08Å; A130-L424 VanDerWaalsContact CA-O 3.31Å; A130-L424 WeakPolarHBondContact CA-O 3.29Å; A130-E425 HydrophobicContact CB-CG 4.24Å
131	I	94.4	Very high	92.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	144.6	175.5	-160.7	178	0	0	0	109.5	L80 W83 I84 L85 W104 L120 G423 L424	L80-I131 HydrophobicContact CD2-CD1 4.11Å; W83-I131 HydrophobicContact CB-CD1 3.77Å; W83-I131 HydrophobicContact CB-CG1 3.99Å; W83-I131 HydrophobicContact CE3-CD1 4.36Å; W83-I131 HydrophobicContact CE3-CG1 4.1Å; W83-I131 HydrophobicContact CE3-CG2 4.04Å; W83-I131 HydrophobicContact CG-CD1 4.44Å; W83-I131 HydrophobicContact CZ3-CG2 4.28Å; I84-I131 CarbonylContact O-C 3.48Å; I84-I131 WeakPolarHBondContact O-CA 3.17Å; I84-I131 WeakPolarHBondContact O-CG1 3.4Å; L85-I131 HydrophobicContact CD1-CD1 3.81Å; L85-I131 HydrophobicContact CD1-CG1 4.13Å; L85-I131 HydrophobicContact CG-CD1 4.07Å; L85-I131 HydrophobicContact CG-CG1 4.07Å; W104-I131 HydrophobicContact CB-CD1 4.18Å; W104-I131 HydrophobicContact CD2-CB 4.43Å; W104-I131 HydrophobicContact CD2-CG2 3.91Å; W104-I131 VanDerWaalsContact CE2-CG2 3.42Å; W104-I131 HydrophobicContact CE3-CG2 4.46Å; W104-I131 HydrophobicContact CG-CB 4.41Å; W104-I131 HydrophobicContact CG-CD1 4.02Å; W104-I131 HydrophobicContact CG-CG2 4.36Å; W104-I131 HydrophobicContact CH2-CG2 4.1Å; W104-I131 HydrophobicContact CZ2-CB 4.35Å; W104-I131 HydrophobicContact CZ2-CG2 3.52Å; L120-I131 HydrophobicContact CD1-CD1 4.31Å; L120-I131 HydrophobicContact CD2-CG2 4.25Å; I131-G423 CarbonylContact O-C 3.6Å; I131-G423 WeakPolarHBondContact O-CA 3.27Å; I131-L424 HydrophobicContact CG2-CB 4.12Å; I131-L424 HydrophobicContact CG2-CD1 4.08Å; I131-L424 PolarHBondContact N-O 2.65Å; I131-L424 PolarHBondContact O-N 3.04Å
132	S	95.4	Very high	92	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	150.8	-178.2	62.4	0	0	0	0	113.3	W83 I84 V422	W83-S132 CarbonylContact C-O 3.59Å; W83-S132 WeakPolarHBondContact CA-O 3.44Å; I84-S132 PolarHBondContact N-O 2.98Å; I84-S132 PolarHBondContact O-N 3.45Å; S132-V422 CarbonylContact C-O 3.56Å; S132-V422 WeakPolarHBondContact CA-O 3.07Å; S132-V422 VanDerWaalsContact CB-O 3.28Å; S132-V422 WeakPolarHBondContact CB-O 3.41Å
133	A	95.4	Very high	91.9	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.008	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	149	176.9	0	0	0	0	0	111	F71 W83 A421 V422	F71-A133 HydrophobicContact CE2-CB 3.62Å; F71-A133 HydrophobicContact CZ-CB 3.69Å; W83-A133 HydrophobicContact CD2-CB 3.58Å; W83-A133 HydrophobicContact CE3-CB 3.85Å; W83-A133 HydrophobicContact CG-CB 3.96Å; W83-A133 HydrophobicContact CH2-CB 4.4Å; W83-A133 HydrophobicContact CZ2-CB 4.14Å; W83-A133 HydrophobicContact CZ3-CB 4.25Å; A133-A421 CarbonylContact O-C 3.54Å; A133-A421 VanDerWaalsContact O-CA 3.25Å; A133-A421 WeakPolarHBondContact O-CA 3.46Å; A133-A421 VanDerWaalsContact O-CB 3.27Å; A133-A421 WeakPolarHBondContact O-CB 3.09Å; A133-V422 HydrophobicContact CB-CG1 4.09Å; A133-V422 PolarHBondContact N-O 3.4Å; A133-V422 PolarHBondContact O-N 3.39Å
134	K	94.8	Very high	92	Very high	150 Å²	150	52.3 Å²	52.3	65%	0.652	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	138.3	-176.6	-166.4	171.3	-176.5	167.3	0	111.3	L176	K134-L176 HydrophobicContact CB-CD1 4.19Å
135	L	94.4	Very high	92.3	Very high	12 Å²	12	53 Å²	53	6%	0.063	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	147.1	174	-92.1	65.1	0	0	0	111.6	F71 K137 F139 F419 S420 V422 I440	F71-L135 HydrophobicContact CB-CD1 4.36Å; F71-L135 HydrophobicContact CB-CG 4.17Å; L135-K137 VanDerWaalsContact C-N 3.29Å; L135-K137 WeakPolarHBondContact CB-O 3.33Å; L135-K137 PolarHBondContact O-N 3.42Å; L135-F139 HydrophobicContact CD2-CB 4.31Å; L135-F419 HydrophobicContact CD1-CD2 4.27Å; L135-F419 HydrophobicContact CD1-CE2 4.18Å; L135-F419 HydrophobicContact CD2-CD2 3.76Å; L135-F419 HydrophobicContact CD2-CE2 3.44Å; L135-F419 VanDerWaalsContact CD2-CE2 3.44Å; L135-F419 HydrophobicContact CD2-CZ 4.28Å; L135-F419 HydrophobicContact CG-CE2 4.44Å; L135-S420 PolarHBondContact N-O 2.66Å; L135-V422 HydrophobicContact CD1-CB 4.37Å; L135-I440 HydrophobicContact CD1-CD1 4.3Å
136	N	92.3	Very high	92.6	Very high	122 Å²	122	46 Å²	46	65%	0.652	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-63	-37.2	173.8	-66.3	-36	0	0	0	111.8	Y70	Y70-N136 WeakPolarHBondContact O-CB 3.19Å; Y70-N136 PolarHBondContact O-N 3.34Å
137	K	92.1	Very high	93.1	Very high	90 Å²	90	44.1 Å²	44.1	39%	0.391	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	133.2	174.6	-56.8	177.8	-169.9	175.5	0	107.4	E68 Y70 L135 F139	E68-K137 IonicContact OE1-NZ 3.73Å; E68-K137 PolarHBondContact OE1-NZ 2.86Å; E68-K137 IonicContact OE2-NZ 2.83Å; E68-K137 PolarHBondContact OE2-NZ 3.38Å; Y70-K137 HydrophobicContact CD1-CB 4.2Å; Y70-K137 WeakPolarHBondContact CD1-O 3.31Å; L135-K137 VanDerWaalsContact C-N 3.29Å; L135-K137 WeakPolarHBondContact CB-O 3.33Å; L135-K137 PolarHBondContact O-N 3.42Å; K137-F139 PolarHBondContact O-N 2.83Å
138	P	93.8	Very high	93.6	Very high	59 Å²	59	41.2 Å²	41.2	38%	0.383	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59	137.1	172.5	-23.3	34	0	0	0	111.3	K170 F419	P138-K170 HydrophobicContact CB-CD 4.15Å; P138-F419 WeakPolarHBondContact CA-O 3.34Å
139	F	94.7	Very high	94	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	138.1	177	-170.2	-84.9	0	0	0	110.2	Y70 L135 K137 F141 L146 P418 F419 A442	Y70-F139 HydrophobicContact CD1-CB 4.17Å; Y70-F139 AromaticContact CD1-CD2 3.83Å; Y70-F139 HydrophobicContact CD1-CD2 3.83Å; Y70-F139 HydrophobicContact CD1-CG 4.47Å; Y70-F139 HydrophobicContact CD2-CD2 4.02Å; Y70-F139 HydrophobicContact CD2-CE2 4.42Å; Y70-F139 HydrophobicContact CE1-CB 4.41Å; Y70-F139 AromaticContact CE1-CD2 3.72Å; Y70-F139 HydrophobicContact CE1-CD2 3.72Å; Y70-F139 HydrophobicContact CE1-CE2 4.43Å; Y70-F139 HydrophobicContact CE1-CG 4.41Å; Y70-F139 AromaticContact CE2-CD2 3.93Å; Y70-F139 HydrophobicContact CE2-CD2 3.93Å; Y70-F139 HydrophobicContact CE2-CE2 4.04Å; Y70-F139 AromaticContact CG-CD2 3.99Å; Y70-F139 HydrophobicContact CG-CD2 3.99Å; Y70-F139 AromaticContact CZ-CD2 3.78Å; L135-F139 HydrophobicContact CD2-CB 4.31Å; K137-F139 PolarHBondContact O-N 2.83Å; F139-F141 HydrophobicContact CD1-CD1 4.39Å; F139-F141 HydrophobicContact CD1-CD2 4.25Å; F139-F141 HydrophobicContact CD1-CE1 4.23Å; F139-F141 HydrophobicContact CD1-CE2 4.07Å; F139-F141 HydrophobicContact CD1-CG 4.39Å; F139-F141 HydrophobicContact CD1-CZ 4.06Å; F139-F141 AromaticContact CE1-CD1 3.86Å; F139-F141 HydrophobicContact CE1-CD1 3.86Å; F139-F141 HydrophobicContact CE1-CD2 4.45Å; F139-F141 AromaticContact CE1-CE1 3.91Å; F139-F141 HydrophobicContact CE1-CE1 3.91Å; F139-F141 HydrophobicContact CE1-CE2 4.48Å; F139-F141 HydrophobicContact CE1-CG 4.14Å; F139-F141 HydrophobicContact CE1-CZ 4.22Å; F139-L146 HydrophobicContact CD1-CD1 4.32Å; F139-L146 HydrophobicContact CD2-CD1 4.06Å; F139-L146 HydrophobicContact CE1-CB 3.91Å; F139-L146 HydrophobicContact CE1-CD1 4.17Å; F139-L146 HydrophobicContact CE2-CB 4.38Å; F139-L146 HydrophobicContact CE2-CD1 3.89Å; F139-L146 HydrophobicContact CG-CD1 4.28Å; F139-L146 HydrophobicContact CZ-CB 3.69Å; F139-L146 HydrophobicContact CZ-CD1 3.96Å; F139-L146 HydrophobicContact CZ-CG 4.42Å; F139-P418 WeakPolarHBondContact O-CA 3.27Å; F139-P418 WeakPolarHBondContact O-CB 3.43Å; F139-F419 HydrophobicContact CB-CD1 3.94Å; F139-F419 HydrophobicContact CB-CE1 3.45Å; F139-F419 VanDerWaalsContact CB-CE1 3.45Å; F139-F419 HydrophobicContact CB-CE2 4.14Å; F139-F419 HydrophobicContact CB-CG 4.44Å; F139-F419 HydrophobicContact CB-CZ 3.55Å; F139-F419 HydrophobicContact CD1-CD1 4.3Å; F139-F419 AromaticContact CD1-CE1 3.61Å; F139-F419 HydrophobicContact CD1-CE1 3.61Å; F139-F419 HydrophobicContact CD1-CZ 4.29Å; F139-F419 HydrophobicContact CG-CD1 4.45Å; F139-F419 AromaticContact CG-CE1 3.64Å; F139-F419 HydrophobicContact CG-CE1 3.64Å; F139-F419 AromaticContact CG-CZ 3.88Å; F139-F419 HydrophobicContact CG-CZ 3.88Å; F139-F419 PolarHBondContact N-O 2.98Å; F139-F419 PolarHBondContact O-N 3.09Å; F139-A442 HydrophobicContact CE2-CB 4.47Å
140	L	94.3	Very high	94.3	Very high	83 Å²	83	40.2 Å²	40.2	44%	0.435	21%	0.208	S	C	.	.			trans	-121.2	132.8	177.8	-53.3	-177.3	0	0	0	109.1	D142 P418	L140-D142 PolarHBondContact O-N 3.31Å; L140-P418 HydrophobicContact CD2-CB 3.56Å; L140-P418 HydrophobicContact CD2-CG 4.21Å
141	F	92.8	Very high	94.5	Very high	14 Å²	14	40.1 Å²	40.1	6%	0.061	21%	0.207	C	C	.	.			trans	-87	85.8	177.3	-61.9	-93	0	0	0	109.9	F139 L146 T186 I187 L242 F414 M416 T417 F419	F139-F141 HydrophobicContact CD1-CD1 4.39Å; F139-F141 HydrophobicContact CD1-CD2 4.25Å; F139-F141 HydrophobicContact CD1-CE1 4.23Å; F139-F141 HydrophobicContact CD1-CE2 4.07Å; F139-F141 HydrophobicContact CD1-CG 4.39Å; F139-F141 HydrophobicContact CD1-CZ 4.06Å; F139-F141 AromaticContact CE1-CD1 3.86Å; F139-F141 HydrophobicContact CE1-CD1 3.86Å; F139-F141 HydrophobicContact CE1-CD2 4.45Å; F139-F141 AromaticContact CE1-CE1 3.91Å; F139-F141 HydrophobicContact CE1-CE1 3.91Å; F139-F141 HydrophobicContact CE1-CE2 4.48Å; F139-F141 HydrophobicContact CE1-CG 4.14Å; F139-F141 HydrophobicContact CE1-CZ 4.22Å; F141-L146 HydrophobicContact CE1-CB 4.25Å; F141-L146 HydrophobicContact CE1-CD2 3.76Å; F141-L146 HydrophobicContact CZ-CD2 3.93Å; F141-T186 HydrophobicContact CE2-CG2 3.88Å; F141-T186 HydrophobicContact CZ-CG2 4.02Å; F141-I187 HydrophobicContact CE1-CD1 4.3Å; F141-I187 HydrophobicContact CZ-CD1 4.16Å; F141-L242 HydrophobicContact CE1-CD2 4.35Å; F141-F414 HydrophobicContact CB-CD1 4.17Å; F141-F414 HydrophobicContact CB-CE1 3.85Å; F141-F414 HydrophobicContact CB-CZ 4.27Å; F141-F414 WeakPolarHBondContact CB-O 3.39Å; F141-F414 HydrophobicContact CD1-CD2 4.38Å; F141-F414 HydrophobicContact CD1-CE1 4.2Å; F141-F414 AromaticContact CD1-CE2 3.9Å; F141-F414 HydrophobicContact CD1-CE2 3.9Å; F141-F414 AromaticContact CD1-CZ 3.78Å; F141-F414 HydrophobicContact CD1-CZ 3.78Å; F141-F414 WeakPolarHBondContact CD1-O 3.36Å; F141-F414 WeakPolarHBondContact CG-O 3.23Å; F141-M416 HydrophobicContact CD1-CE 4.49Å; F141-M416 HydrophobicContact CD1-CG 3.84Å; F141-M416 HydrophobicContact CD1-SD 4.26Å; F141-M416 HydrophobicContact CD2-CG 3.57Å; F141-M416 HydrophobicContact CE1-CE 4.31Å; F141-M416 HydrophobicContact CE1-CG 3.8Å; F141-M416 HydrophobicContact CE1-SD 3.74Å; F141-M416 HydrophobicContact CE2-CG 3.54Å; F141-M416 HydrophobicContact CE2-SD 4.21Å; F141-M416 HydrophobicContact CG-CG 3.74Å; F141-M416 HydrophobicContact CZ-CG 3.65Å; F141-M416 HydrophobicContact CZ-SD 3.72Å; F141-T417 WeakPolarHBondContact CE2-O 3.3Å; F141-F419 AromaticContact CE2-CD1 3.8Å; F141-F419 HydrophobicContact CE2-CD1 3.8Å; F141-F419 HydrophobicContact CE2-CE1 4.15Å; F141-F419 AromaticContact CZ-CD1 3.82Å; F141-F419 HydrophobicContact CZ-CD1 3.82Å; F141-F419 AromaticContact CZ-CE1 3.8Å; F141-F419 HydrophobicContact CZ-CE1 3.8Å
142	D	88.9	Confident	94.5	Very high	75 Å²	75	40.1 Å²	40.1	40%	0.401	21%	0.207	S	C	.	.	S	Bend	trans	-115.1	-65.2	-177.9	56.3	27.1	0	0	0	114.2	L140 K144	L140-D142 PolarHBondContact O-N 3.31Å; D142-K144 PolarHBondContact OD1-N 3.37Å
143	T	90	Very high	94.4	Very high	110 Å²	110	40.6 Å²	40.6	68%	0.675	21%	0.21	S	C	*	.	S	Bend	trans	-152.6	-15.3	-166	56.1	0	0	0	0	112.6	P244	T143-P244 WeakPolarHBondContact O-CG 3.43Å
144	K	93.4	Very high	94.4	Very high	85 Å²	85	40.8 Å²	40.8	37%	0.37	21%	0.21	S	C	.	.	S	Bend	trans	-93.1	140.7	174.1	-67.8	-172.2	178.5	-167.8	0	110.5	Y70 D142 F414 A442	Y70-K144 PolarHBondContact OH-NZ 2.9Å; D142-K144 PolarHBondContact OD1-N 3.37Å; K144-F414 VanDerWaalsContact O-CZ 3.23Å; K144-F414 WeakPolarHBondContact O-CZ 3.49Å; K144-A442 HydrophobicContact CB-CB 4.01Å; K144-A442 HydrophobicContact CD-CB 3.92Å; K144-A442 HydrophobicContact CG-CB 4.48Å
145	P	95.8	Very high	94.1	Very high	32 Å²	32	34.8 Å²	34.8	21%	0.208	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-65.1	156.1	168.8	31.2	-35.3	0	0	0	110.6	L242 A442	P145-L242 CarbonylContact C-O 3.29Å; P145-L242 VanDerWaalsContact CA-O 3.27Å; P145-L242 WeakPolarHBondContact CA-O 3.33Å; P145-L242 WeakPolarHBondContact CB-O 3.4Å; P145-A442 WeakPolarHBondContact CG-O 3.34Å; P145-A442 WeakPolarHBondContact O-CA 3.21Å; P145-A442 WeakPolarHBondContact O-CB 3.49Å
146	L	96.4	Very high	93.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	131	166.2	171.9	63.3	0	0	0	108.6	F139 F141 V148 L167 I187 L242 F419 I440	F139-L146 HydrophobicContact CD1-CD1 4.32Å; F139-L146 HydrophobicContact CD2-CD1 4.06Å; F139-L146 HydrophobicContact CE1-CB 3.91Å; F139-L146 HydrophobicContact CE1-CD1 4.17Å; F139-L146 HydrophobicContact CE2-CB 4.38Å; F139-L146 HydrophobicContact CE2-CD1 3.89Å; F139-L146 HydrophobicContact CG-CD1 4.28Å; F139-L146 HydrophobicContact CZ-CB 3.69Å; F139-L146 HydrophobicContact CZ-CD1 3.96Å; F139-L146 HydrophobicContact CZ-CG 4.42Å; F141-L146 HydrophobicContact CE1-CB 4.25Å; F141-L146 HydrophobicContact CE1-CD2 3.76Å; F141-L146 HydrophobicContact CZ-CD2 3.93Å; L146-V148 HydrophobicContact CD1-CG2 3.83Å; L146-V148 HydrophobicContact CD2-CG2 4.25Å; L146-V148 HydrophobicContact CG-CG2 4.02Å; L146-L167 HydrophobicContact CD2-CD1 3.99Å; L146-I187 HydrophobicContact CD2-CD1 3.55Å; L146-L242 HydrophobicContact CB-CB 4.41Å; L146-L242 PolarHBondContact N-O 2.92Å; L146-L242 PolarHBondContact O-N 3.42Å; L146-F419 HydrophobicContact CD1-CE1 3.92Å; L146-F419 HydrophobicContact CD1-CZ 3.71Å; L146-F419 HydrophobicContact CD2-CE1 3.95Å; L146-F419 HydrophobicContact CD2-CZ 4.37Å; L146-I440 HydrophobicContact CD1-CG2 3.91Å
147	I	96.9	Very high	93.5	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	125.2	169.1	-46.8	-178	0	0	0	108.5	T239 L240 I241 I440 C441 R444 V447	I147-T239 HydrophobicContact CG2-CG2 4.19Å; I147-L240 WeakPolarHBondContact CA-O 3.48Å; I147-I241 HydrophobicContact CG1-CG2 4.31Å; I147-I440 WeakPolarHBondContact O-CA 3.46Å; I147-C441 PolarHBondContact N-O 3.09Å; I147-C441 PolarHBondContact O-N 3Å; I147-R444 HydrophobicContact CD1-CB 3.78Å; I147-V447 HydrophobicContact CB-CG2 4.19Å; I147-V447 HydrophobicContact CG2-CB 4.22Å; I147-V447 HydrophobicContact CG2-CG1 3.95Å; I147-V447 HydrophobicContact CG2-CG2 3.9Å
148	V	97.4	Very high	93.3	Very high	5 Å²	5	28.8 Å²	28.8	3%	0.03	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	124.8	175.6	179.6	0	0	0	0	108	L146 L167 T239 L240 I440	L146-V148 HydrophobicContact CD1-CG2 3.83Å; L146-V148 HydrophobicContact CD2-CG2 4.25Å; L146-V148 HydrophobicContact CG-CG2 4.02Å; V148-L167 HydrophobicContact CG2-CD1 3.94Å; V148-L167 HydrophobicContact CG2-CD2 4.48Å; V148-T239 CarbonylContact O-C 3.59Å; V148-T239 WeakPolarHBondContact O-CA 3.46Å; V148-L240 PolarHBondContact N-O 3.26Å; V148-L240 PolarHBondContact O-N 3.03Å; V148-I440 HydrophobicContact CG1-CG1 4.37Å; V148-I440 HydrophobicContact CG2-CG1 4.26Å; V148-I440 HydrophobicContact CG2-CG2 4.3Å
149	Q	97.6	Very high	93.2	Very high	1 Å²	1	31 Å²	31	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	143.3	178.3	176.8	-174.2	-83.1	0	0	110.3	L237 Y238 T239 F438 I439 V447	Q149-L237 HydrophobicContact CG-CD1 3.55Å; Q149-L237 HydrophobicContact CG-CD2 4.42Å; Q149-L237 HydrophobicContact CG-CG 3.94Å; Q149-Y238 VanDerWaalsContact CA-O 3.26Å; Q149-Y238 WeakPolarHBondContact CA-O 3.34Å; Q149-T239 HydrophobicContact CB-CG2 4.23Å; Q149-T239 PolarHBondContact OE1-OG1 2.94Å; Q149-F438 WeakPolarHBondContact O-CA 3.33Å; Q149-I439 HydrophobicContact CB-CG2 3.72Å; Q149-I439 HydrophobicContact CG-CG2 4.34Å; Q149-I439 PolarHBondContact N-O 3.06Å; Q149-I439 PolarHBondContact O-N 2.99Å; Q149-V447 HydrophobicContact CB-CG1 3.86Å; Q149-V447 VanDerWaalsContact CD-CG1 3.5Å; Q149-V447 HydrophobicContact CG-CG1 4.33Å; Q149-V447 VanDerWaalsContact OE1-CG1 3.23Å
150	Y	97.3	Very high	93	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	162.9	171.7	69.1	-72.3	0	0	0	111.1	V152 A163 Y164 V165 F189 G190 Y238 F435 F438	Y150-V152 HydrophobicContact CD2-CG2 3.82Å; Y150-V152 HydrophobicContact CE2-CG2 3.32Å; Y150-A163 PolarHBondContact OH-O 3.05Å; Y150-Y164 WeakPolarHBondContact OH-CA 3.34Å; Y150-V165 HydrophobicContact CD1-CG2 4.01Å; Y150-V165 HydrophobicContact CD2-CG2 4.2Å; Y150-V165 HydrophobicContact CE1-CB 4.26Å; Y150-V165 HydrophobicContact CE1-CG2 3.64Å; Y150-V165 HydrophobicContact CE2-CG2 3.82Å; Y150-V165 HydrophobicContact CG-CG2 4.28Å; Y150-F189 HydrophobicContact CE1-CD1 4.04Å; Y150-F189 HydrophobicContact CE1-CE1 4.1Å; Y150-F189 PolarHBondContact OH-O 2.84Å; Y150-G190 WeakPolarHBondContact OH-CA 3.29Å; Y150-Y238 PolarHBondContact N-O 2.76Å; Y150-Y238 PolarHBondContact O-N 2.78Å; Y150-F435 HydrophobicContact CD2-CD1 4.27Å; Y150-F435 HydrophobicContact CE2-CD1 4.04Å; Y150-F435 HydrophobicContact CE2-CE1 4.32Å; Y150-F438 HydrophobicContact CD2-CD1 4.19Å; Y150-F438 AromaticContact CD2-CE1 3.54Å; Y150-F438 HydrophobicContact CD2-CE1 3.54Å; Y150-F438 HydrophobicContact CD2-CZ 4.11Å; Y150-F438 HydrophobicContact CE2-CE1 4.28Å; Y150-F438 AromaticContact CG-CD1 3.85Å; Y150-F438 HydrophobicContact CG-CD1 3.85Å; Y150-F438 AromaticContact CG-CE1 3.67Å; Y150-F438 HydrophobicContact CG-CE1 3.67Å
151	E	95.5	Very high	92.8	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	145.7	176.8	-67.9	171.9	-148.9	0	0	111.4	T235 H236 L237 F435 D436 N437 W455 K458	E151-T235 HydrophobicContact CB-CG2 3.9Å; E151-T235 HydrophobicContact CG-CG2 4.21Å; E151-T235 WeakPolarHBondContact OE2-CG2 3.37Å; E151-H236 WeakPolarHBondContact CA-O 3.48Å; E151-L237 HydrophobicContact CG-CD1 3.73Å; E151-F435 WeakPolarHBondContact O-CA 3.3Å; E151-D436 HydrophobicContact CB-CB 4.41Å; E151-D436 PolarHBondContact N-O 2.93Å; E151-D436 PolarHBondContact O-N 2.95Å; E151-N437 HydrophobicContact CG-CB 4.31Å; E151-N437 WeakPolarHBondContact OE1-CB 3.35Å; E151-N437 PolarHBondContact OE1-ND2 3.17Å; E151-W455 HydrophobicContact CG-CB 4.2Å; E151-W455 WeakPolarHBondContact OE1-CA 3.39Å; E151-W455 WeakPolarHBondContact OE1-CB 3.16Å; E151-W455 PolarHBondContact OE1-N 2.81Å; E151-W455 VanDerWaalsContact OE1-N 3.14Å; E151-K458 IonicContact OE1-NZ 3.91Å; E151-K458 VanDerWaalsContact OE2-CD 3.29Å; E151-K458 WeakPolarHBondContact OE2-CD 3.36Å; E151-K458 WeakPolarHBondContact OE2-CE 3.38Å; E151-K458 IonicContact OE2-NZ 3.17Å; E151-K458 PolarHBondContact OE2-NZ 3.03Å
152	V	95.6	Very high	92.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	133.3	166.5	-175.2	0	0	0	0	109.7	Y150 F154 A163 P191 H236 Y238 I433 F434 F435	Y150-V152 HydrophobicContact CD2-CG2 3.82Å; Y150-V152 HydrophobicContact CE2-CG2 3.32Å; V152-F154 HydrophobicContact CG1-CD1 4.35Å; V152-F154 HydrophobicContact CG1-CD2 4.45Å; V152-F154 HydrophobicContact CG1-CE1 3.94Å; V152-F154 HydrophobicContact CG1-CE2 4.06Å; V152-F154 HydrophobicContact CG1-CZ 3.79Å; V152-A163 HydrophobicContact CG1-CB 3.78Å; V152-A163 HydrophobicContact CG2-CB 4.3Å; V152-P191 HydrophobicContact CG2-CG 4.17Å; V152-H236 PolarHBondContact N-O 3.15Å; V152-H236 PolarHBondContact O-N 2.83Å; V152-Y238 HydrophobicContact CB-CD2 4.2Å; V152-Y238 HydrophobicContact CB-CE2 3.91Å; V152-Y238 HydrophobicContact CG2-CD2 4.03Å; V152-Y238 HydrophobicContact CG2-CE2 4.17Å; V152-I433 HydrophobicContact CG1-CG2 3.82Å; V152-F434 WeakPolarHBondContact CA-O 3.38Å; V152-F435 HydrophobicContact CG2-CD1 4Å; V152-F435 HydrophobicContact CG2-CE1 4.09Å
153	N	94.1	Very high	92.9	Very high	11 Å²	11	24.4 Å²	24.4	6%	0.059	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.6	165.5	-176.4	-47.8	0	0	0	110.2	Q155 K233 K234 T235 F434	N153-Q155 PolarHBondContact O-N 3.24Å; N153-Q155 VanDerWaalsContact OD1-CA 3.27Å; N153-Q155 WeakPolarHBondContact OD1-CA 3.48Å; N153-Q155 VanDerWaalsContact OD1-CG 3.28Å; N153-Q155 WeakPolarHBondContact OD1-CG 3.41Å; N153-Q155 PolarHBondContact OD1-N 3.35Å; N153-K233 PolarHBondContact ND2-O 3.42Å; N153-K233 PolarHBondContact OD1-O 2.84Å; N153-K234 PolarHBondContact ND2-O 2.89Å; N153-T235 HydrophobicContact CB-CG2 4.34Å; N153-T235 WeakPolarHBondContact CB-OG1 3.21Å; N153-T235 PolarHBondContact ND2-N 2.96Å; N153-T235 PolarHBondContact ND2-OG1 2.98Å; N153-F434 HydrophobicContact CB-CB 4.26Å; N153-F434 HydrophobicContact CB-CD1 4.5Å; N153-F434 PolarHBondContact N-O 3.06Å; N153-F434 PolarHBondContact O-N 3.33Å
154	F	93.4	Very high	93.2	Very high	4 Å²	4	20.8 Å²	20.8	2%	0.018	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	77.2	172.6	-57.6	-73.3	0	0	0	110.1	V152 N156 G157 I158 A163 P191 F230 I433	V152-F154 HydrophobicContact CG1-CD1 4.35Å; V152-F154 HydrophobicContact CG1-CD2 4.45Å; V152-F154 HydrophobicContact CG1-CE1 3.94Å; V152-F154 HydrophobicContact CG1-CE2 4.06Å; V152-F154 HydrophobicContact CG1-CZ 3.79Å; F154-N156 VanDerWaalsContact C-N 3.28Å; F154-N156 PolarHBondContact O-N 3Å; F154-N156 VanDerWaalsContact O-N 3.13Å; F154-G157 WeakPolarHBondContact O-CA 3.38Å; F154-G157 PolarHBondContact O-N 2.96Å; F154-I158 HydrophobicContact CB-CB 4.37Å; F154-I158 HydrophobicContact CB-CG2 4.09Å; F154-I158 HydrophobicContact CD1-CB 3.76Å; F154-I158 HydrophobicContact CD1-CD1 3.78Å; F154-I158 HydrophobicContact CD1-CG1 4.4Å; F154-I158 HydrophobicContact CD1-CG2 3.58Å; F154-I158 HydrophobicContact CD2-CG2 3.98Å; F154-I158 HydrophobicContact CE1-CB 4.26Å; F154-I158 HydrophobicContact CE1-CD1 3.52Å; F154-I158 HydrophobicContact CE1-CG1 4.5Å; F154-I158 HydrophobicContact CE1-CG2 3.9Å; F154-I158 HydrophobicContact CE2-CG2 4.27Å; F154-I158 HydrophobicContact CG-CB 4.14Å; F154-I158 HydrophobicContact CG-CG2 3.62Å; F154-I158 HydrophobicContact CZ-CD1 4.4Å; F154-I158 HydrophobicContact CZ-CG2 4.22Å; F154-A163 HydrophobicContact CE1-CB 3.72Å; F154-A163 HydrophobicContact CZ-CB 3.86Å; F154-P191 HydrophobicContact CZ-CB 4.24Å; F154-P191 HydrophobicContact CZ-CG 4.23Å; F154-F230 HydrophobicContact CD2-CD1 4.36Å; F154-F230 AromaticContact CE2-CD1 3.61Å; F154-F230 HydrophobicContact CE2-CD1 3.61Å; F154-F230 HydrophobicContact CE2-CE1 4.08Å; F154-F230 HydrophobicContact CE2-CG 4.13Å; F154-F230 AromaticContact CZ-CD1 3.82Å; F154-F230 HydrophobicContact CZ-CD1 3.82Å; F154-F230 AromaticContact CZ-CE1 3.99Å; F154-F230 HydrophobicContact CZ-CE1 3.99Å; F154-I433 HydrophobicContact CD1-CD1 4.22Å; F154-I433 HydrophobicContact CD1-CG1 4.13Å; F154-I433 HydrophobicContact CD1-CG2 3.91Å; F154-I433 HydrophobicContact CE1-CD1 4.24Å; F154-I433 HydrophobicContact CE1-CG2 4Å
155	Q	89.3	Confident	93.4	Very high	25 Å²	25	16.8 Å²	16.8	12%	0.117	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-35.5	-166.5	-63.5	178.2	89.5	0	0	114.3	N153 K233 D432 F434	N153-Q155 PolarHBondContact O-N 3.24Å; N153-Q155 VanDerWaalsContact OD1-CA 3.27Å; N153-Q155 WeakPolarHBondContact OD1-CA 3.48Å; N153-Q155 VanDerWaalsContact OD1-CG 3.28Å; N153-Q155 WeakPolarHBondContact OD1-CG 3.41Å; N153-Q155 PolarHBondContact OD1-N 3.35Å; Q155-K233 WeakPolarHBondContact O-CD 3.34Å; Q155-D432 HydrophobicContact CB-CB 4.35Å; Q155-D432 WeakPolarHBondContact CB-O 3.45Å; Q155-D432 WeakPolarHBondContact CG-O 3.24Å; Q155-D432 PolarHBondContact NE2-O 2.82Å; Q155-F434 HydrophobicContact CG-CB 4.47Å
156	N	88	Confident	93.4	Very high	73 Å²	73	15.9 Å²	15.9	39%	0.39	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-5.1	176.5	-60.2	-32.9	0	0	0	113.1	K110 F154 S431 D432	K110-N156 PolarHBondContact NZ-OD1 2.72Å; F154-N156 VanDerWaalsContact C-N 3.28Å; F154-N156 PolarHBondContact O-N 3Å; F154-N156 VanDerWaalsContact O-N 3.13Å; N156-S431 PolarHBondContact ND2-O 3.46Å; N156-S431 PolarHBondContact ND2-OG 3.06Å; N156-D432 PolarHBondContact ND2-OD2 2.85Å
157	G	85.8	Confident	93.5	Very high	17 Å²	17	16 Å²	16	18%	0.175	9%	0.085	C	C	.	.			trans	76.3	167.5	-151.9	0	0	0	0	0	112	F154	F154-G157 WeakPolarHBondContact O-CA 3.38Å; F154-G157 PolarHBondContact O-N 2.96Å
158	I	89.3	Confident	93.4	Very high	7 Å²	7	15.9 Å²	15.9	4%	0.036	9%	0.085	C	C	.	.			trans	-128.2	129.9	179.8	-179.8	160.2	0	0	0	112.2	F154 G161 K193 F230 I433	F154-I158 HydrophobicContact CB-CB 4.37Å; F154-I158 HydrophobicContact CB-CG2 4.09Å; F154-I158 HydrophobicContact CD1-CB 3.76Å; F154-I158 HydrophobicContact CD1-CD1 3.78Å; F154-I158 HydrophobicContact CD1-CG1 4.4Å; F154-I158 HydrophobicContact CD1-CG2 3.58Å; F154-I158 HydrophobicContact CD2-CG2 3.98Å; F154-I158 HydrophobicContact CE1-CB 4.26Å; F154-I158 HydrophobicContact CE1-CD1 3.52Å; F154-I158 HydrophobicContact CE1-CG1 4.5Å; F154-I158 HydrophobicContact CE1-CG2 3.9Å; F154-I158 HydrophobicContact CE2-CG2 4.27Å; F154-I158 HydrophobicContact CG-CB 4.14Å; F154-I158 HydrophobicContact CG-CG2 3.62Å; F154-I158 HydrophobicContact CZ-CD1 4.4Å; F154-I158 HydrophobicContact CZ-CG2 4.22Å; I158-G161 WeakPolarHBondContact CD1-O 3.44Å; I158-K193 HydrophobicContact CG2-CD 4.1Å; I158-K193 WeakPolarHBondContact O-CD 3.43Å; I158-K193 WeakPolarHBondContact O-CE 3.38Å; I158-K193 PolarHBondContact O-NZ 3.43Å; I158-F230 HydrophobicContact CG2-CB 4.06Å; I158-F230 HydrophobicContact CG2-CD1 3.87Å; I158-F230 HydrophobicContact CG2-CG 4.47Å; I158-I433 HydrophobicContact CD1-CD1 3.98Å
159	E	89.8	Confident	93.3	Very high	106 Å²	106	16 Å²	16	50%	0.495	9%	0.086	S	C	.	.	S	Bend	trans	-91.4	-57.5	179.6	-63.7	171.9	148.9	0	0	110.9	R125 G195 T430	R125-E159 IonicContact CZ-OE2 2.69Å; R125-E159 IonicContact NH2-OE1 2.96Å; R125-E159 IonicContact NH2-OE2 2.96Å; R125-E159 PolarHBondContact NH2-OE2 3.21Å; E159-G195 PolarHBondContact O-N 2.92Å; E159-T430 HydrophobicContact CB-CG2 4.15Å; E159-T430 HydrophobicContact CG-CG2 3.93Å
160	C	91.5	Very high	93.1	Very high	28 Å²	28	21.2 Å²	21.2	19%	0.189	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	122.6	172.9	177.3	0	0	0	0	110	K193 C194 M429	C160-K193 CarbonylContact C-O 3.56Å; C160-K193 VanDerWaalsContact CA-O 3.27Å; C160-K193 WeakPolarHBondContact CA-O 3.27Å; C160-C194 HydrophobicContact CB-CB 3.92Å; C160-C194 WeakPolarHBondContact CB-SG 3.49Å; C160-C194 WeakPolarHBondContact SG-CB 3.15Å; C160-C194 CovalentContact SG-SG 2.05Å; C160-C194 PolarHBondContact SG-SG 2.89Å; C160-M429 HydrophobicContact CB-CG 4.25Å; C160-M429 VanDerWaalsContact O-CB 3.29Å; C160-M429 WeakPolarHBondContact O-CB 3.22Å; C160-M429 PolarHBondContact O-N 2.86Å
161	G	90.3	Very high	92.6	Very high	3 Å²	3	23.5 Å²	23.5	3%	0.031	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.4	159.9	178.8	0	0	0	0	0	112.6	I158 K193 W427	I158-G161 WeakPolarHBondContact CD1-O 3.44Å; G161-K193 PolarHBondContact N-O 3.26Å; G161-K193 PolarHBondContact O-N 3.38Å; G161-K193 VanDerWaalsContact O-N 3.1Å; G161-W427 WeakPolarHBondContact CA-O 3.42Å
162	G	89.9	Confident	92	Very high	2 Å²	2	29.8 Å²	29.8	2%	0.021	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	153.4	175.4	0	0	0	0	0	112.7	D192 W427	G162-D192 VanDerWaalsContact CA-OD1 3.28Å; G162-D192 WeakPolarHBondContact CA-OD1 3.41Å; G162-D192 PolarHBondContact N-OD1 3.28Å; G162-W427 PolarHBondContact N-O 2.83Å
163	A	94.7	Very high	91.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.201	C	C	.	.			trans	-137.7	36.6	166.2	0	0	0	0	0	111.3	Y150 V152 F154 P191 I433 F435	Y150-A163 PolarHBondContact OH-O 3.05Å; V152-A163 HydrophobicContact CG1-CB 3.78Å; V152-A163 HydrophobicContact CG2-CB 4.3Å; F154-A163 HydrophobicContact CE1-CB 3.72Å; F154-A163 HydrophobicContact CZ-CB 3.86Å; A163-P191 CarbonylContact C-O 3.59Å; A163-P191 HydrophobicContact CB-CG 4.08Å; A163-P191 PolarHBondContact N-O 2.71Å; A163-I433 HydrophobicContact CB-CG2 4.16Å; A163-F435 HydrophobicContact CB-CE1 3.67Å; A163-F435 HydrophobicContact CB-CZ 3.66Å
164	Y	95.8	Very high	90.9	Very high	34 Å²	34	39.3 Å²	39.3	13%	0.133	21%	0.208	C	C	.	.			trans	-91.7	153.2	179.1	50.2	-102	0	0	0	114	Y150 M188 F189 P191 D192 H201 E425 L426	Y150-Y164 WeakPolarHBondContact OH-CA 3.34Å; Y164-M188 HydrophobicContact CD2-CG 3.74Å; Y164-M188 HydrophobicContact CD2-SD 3.52Å; Y164-M188 VanDerWaalsContact CD2-SD 3.52Å; Y164-M188 HydrophobicContact CE2-CG 4.39Å; Y164-M188 HydrophobicContact CE2-SD 3.6Å; Y164-M188 HydrophobicContact CG-CG 4.17Å; Y164-M188 HydrophobicContact CG-SD 4.06Å; Y164-F189 CarbonylContact C-O 3.53Å; Y164-F189 WeakPolarHBondContact CA-O 3.22Å; Y164-F189 WeakPolarHBondContact CB-O 3.17Å; Y164-P191 PolarHBondContact N-O 2.81Å; Y164-D192 HydrophobicContact CD1-CB 3.99Å; Y164-D192 HydrophobicContact CE1-CB 4.22Å; Y164-H201 AromaticContact CD1-CD2 3.9Å; Y164-E425 WeakPolarHBondContact CE2-O 3.42Å; Y164-L426 HydrophobicContact CD1-CD2 4.28Å; Y164-L426 HydrophobicContact CD2-CD2 3.82Å; Y164-L426 HydrophobicContact CE1-CD2 4.26Å; Y164-L426 HydrophobicContact CE2-CD2 3.74Å; Y164-L426 HydrophobicContact CG-CD2 4.1Å; Y164-L426 WeakPolarHBondContact O-CD2 3.37Å
165	V	97	Very high	90.7	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	137.4	176.3	172.3	0	0	0	0	110.6	Y150 L167 M188 F189 V422 L424 F438	Y150-V165 HydrophobicContact CD1-CG2 4.01Å; Y150-V165 HydrophobicContact CD2-CG2 4.2Å; Y150-V165 HydrophobicContact CE1-CB 4.26Å; Y150-V165 HydrophobicContact CE1-CG2 3.64Å; Y150-V165 HydrophobicContact CE2-CG2 3.82Å; Y150-V165 HydrophobicContact CG-CG2 4.28Å; V165-L167 HydrophobicContact CG1-CD2 4.03Å; V165-M188 CarbonylContact O-C 3.37Å; V165-M188 VanDerWaalsContact O-CA 3.31Å; V165-M188 WeakPolarHBondContact O-CA 3.41Å; V165-F189 PolarHBondContact N-O 2.62Å; V165-F189 PolarHBondContact O-N 2.81Å; V165-V422 HydrophobicContact CG1-CG2 3.35Å; V165-L424 HydrophobicContact CG2-CD2 3.77Å; V165-F438 HydrophobicContact CG2-CD1 4.37Å; V165-F438 HydrophobicContact CG2-CE1 3.67Å
166	K	97	Very high	90.7	Very high	13 Å²	13	42.9 Å²	42.9	6%	0.057	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125.4	169.7	-60.7	-176	-173	-172.9	0	109.9	L168 F179 M188 G423 E425	K166-L168 HydrophobicContact CB-CD2 3.92Å; K166-F179 HydrophobicContact CD-CZ 4.48Å; K166-M188 HydrophobicContact CD-CE 4.34Å; K166-M188 HydrophobicContact CG-CB 4.4Å; K166-M188 HydrophobicContact CG-CE 4.43Å; K166-M188 HydrophobicContact CG-CG 3.97Å; K166-M188 HydrophobicContact CG-SD 4.48Å; K166-G423 PolarHBondContact N-O 2.62Å; K166-G423 PolarHBondContact O-N 3.31Å; K166-E425 HydrophobicContact CD-CB 4.3Å; K166-E425 IonicContact NZ-OE2 2.94Å; K166-E425 PolarHBondContact NZ-OE2 2.6Å
167	L	96.8	Very high	90.8	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	107.2	173.1	-55.3	-174.7	0	0	0	108.9	L146 V148 V165 Y185 T186 I187 F419 V422 I440	L146-L167 HydrophobicContact CD2-CD1 3.99Å; V148-L167 HydrophobicContact CG2-CD1 3.94Å; V148-L167 HydrophobicContact CG2-CD2 4.48Å; V165-L167 HydrophobicContact CG1-CD2 4.03Å; L167-Y185 CarbonylContact O-C 3.48Å; L167-Y185 WeakPolarHBondContact O-CA 3.39Å; L167-Y185 WeakPolarHBondContact O-CB 3.36Å; L167-T186 PolarHBondContact O-N 2.88Å; L167-I187 HydrophobicContact CB-CB 4.44Å; L167-I187 HydrophobicContact CD1-CB 3.93Å; L167-I187 HydrophobicContact CD1-CD1 4.24Å; L167-I187 HydrophobicContact CD1-CG2 4.32Å; L167-I187 HydrophobicContact CG-CB 4.26Å; L167-I187 PolarHBondContact N-O 2.67Å; L167-F419 HydrophobicContact CB-CB 4.23Å; L167-F419 HydrophobicContact CB-CD1 4.3Å; L167-F419 HydrophobicContact CB-CD2 3.82Å; L167-F419 HydrophobicContact CB-CE2 4.19Å; L167-F419 HydrophobicContact CB-CG 3.88Å; L167-F419 HydrophobicContact CD1-CD1 4.23Å; L167-F419 HydrophobicContact CD1-CD2 4.37Å; L167-F419 HydrophobicContact CD1-CE1 3.83Å; L167-F419 HydrophobicContact CD1-CE2 3.96Å; L167-F419 HydrophobicContact CD1-CG 4.5Å; L167-F419 HydrophobicContact CD1-CZ 3.7Å; L167-F419 HydrophobicContact CD2-CD2 4.38Å; L167-F419 HydrophobicContact CD2-CE2 4.02Å; L167-F419 HydrophobicContact CG-CD2 4.41Å; L167-F419 HydrophobicContact CG-CE2 4.28Å; L167-V422 HydrophobicContact CD2-CG2 4.2Å; L167-I440 HydrophobicContact CD2-CD1 3.99Å
168	L	96.2	Very high	90.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	123.9	-167.3	-49.8	-175.5	0	0	0	111.8	K166 L174 L176 F179 F419 S420 A421	K166-L168 HydrophobicContact CB-CD2 3.92Å; L168-L174 HydrophobicContact CB-CD1 4.05Å; L168-L174 HydrophobicContact CB-CD2 4.39Å; L168-L174 HydrophobicContact CD1-CD1 4.42Å; L168-L176 HydrophobicContact CD1-CD2 3.95Å; L168-F179 HydrophobicContact CD1-CD2 3.87Å; L168-F179 HydrophobicContact CD1-CE2 3.89Å; L168-F179 HydrophobicContact CD1-CG 4.24Å; L168-F179 HydrophobicContact CD1-CZ 4.23Å; L168-F179 HydrophobicContact CD2-CD2 4.14Å; L168-F179 HydrophobicContact CD2-CE2 3.43Å; L168-F179 VanDerWaalsContact CD2-CE2 3.43Å; L168-F179 HydrophobicContact CD2-CZ 3.86Å; L168-F179 HydrophobicContact CG-CE2 4.31Å; L168-F419 WeakPolarHBondContact O-CA 3.25Å; L168-F419 VanDerWaalsContact O-CB 3.28Å; L168-F419 WeakPolarHBondContact O-CB 3.5Å; L168-S420 PolarHBondContact O-N 2.92Å; L168-A421 HydrophobicContact CB-CB 4.16Å; L168-A421 HydrophobicContact CD1-CB 4.15Å; L168-A421 HydrophobicContact CG-CB 4.4Å; L168-A421 PolarHBondContact N-O 3.06Å
169	S	94.7	Very high	91	Very high	8 Å²	8	45.7 Å²	45.7	6%	0.056	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	141.1	-173.5	-63.2	0	0	0	0	111.6	T171 P184 Y185 T186	S169-T171 VanDerWaalsContact C-N 3.29Å; S169-T171 PolarHBondContact O-N 3.35Å; S169-P184 WeakPolarHBondContact CB-O 3.22Å; S169-P184 PolarHBondContact N-O 3.11Å; S169-P184 PolarHBondContact OG-O 2.88Å; S169-Y185 WeakPolarHBondContact OG-CA 3.33Å; S169-Y185 PolarHBondContact OG-O 2.76Å; S169-T186 PolarHBondContact OG-N 2.84Å; S169-T186 VanDerWaalsContact OG-N 3.16Å; S169-T186 PolarHBondContact OG-OG1 2.9Å
170	K	92.4	Very high	90.9	Very high	111 Å²	111	42.8 Å²	42.8	48%	0.483	22%	0.223	S	C	.	.			trans	-75.5	76.7	-179.7	-173.2	-161.8	174.1	-173	0	111.3	P138 P418 S420	P138-K170 HydrophobicContact CB-CD 4.15Å; K170-P418 HydrophobicContact CB-CG 4.34Å; K170-P418 WeakPolarHBondContact CB-O 3.22Å; K170-P418 HydrophobicContact CD-CB 4.49Å; K170-P418 HydrophobicContact CD-CG 4.29Å; K170-P418 PolarHBondContact N-O 3.25Å; K170-S420 WeakPolarHBondContact CA-OG 3.09Å
171	T	88.3	Confident	90.7	Very high	48 Å²	48	43.2 Å²	43.2	29%	0.294	22%	0.223	S	C	.	.			trans	-89.6	156.2	166.8	62.8	0	0	0	0	110.5	S169 E173 L174 P184	S169-T171 VanDerWaalsContact C-N 3.29Å; S169-T171 PolarHBondContact O-N 3.35Å; T171-E173 PolarHBondContact O-N 3.47Å; T171-L174 PolarHBondContact OG1-N 3.43Å; T171-P184 HydrophobicContact CG2-CB 4.45Å; T171-P184 HydrophobicContact CG2-CG 3.89Å
172	P	82.4	Confident	90.6	Very high	132 Å²	132	47.5 Å²	47.5	86%	0.857	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-14.4	170.8	30.4	-35.5	0	0	0	112.9
173	E	80.8	Confident	90.7	Very high	170 Å²	170	48 Å²	48	79%	0.794	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.6	10.1	-176.5	-68.8	157.2	-162.2	0	0	112.4	T171 D175	T171-E173 PolarHBondContact O-N 3.47Å; E173-D175 PolarHBondContact O-N 2.86Å
174	L	86.3	Confident	90.6	Very high	41 Å²	41	50.4 Å²	50.4	22%	0.215	26%	0.259	C	S	.	.			trans	-70.2	92	-179.2	-177.6	67.1	0	0	0	111.1	L168 T171 L176 T183 S420 A421	L168-L174 HydrophobicContact CB-CD1 4.05Å; L168-L174 HydrophobicContact CB-CD2 4.39Å; L168-L174 HydrophobicContact CD1-CD1 4.42Å; T171-L174 PolarHBondContact OG1-N 3.43Å; L174-L176 HydrophobicContact CD1-CD2 4.2Å; L174-L176 HydrophobicContact CD2-CD2 4.28Å; L174-L176 HydrophobicContact CG-CD2 4.03Å; L174-T183 HydrophobicContact CD1-CG2 4.26Å; L174-S420 WeakPolarHBondContact CD2-OG 3.2Å; L174-A421 HydrophobicContact CD2-CB 4.23Å
175	D	88.5	Confident	90.6	Very high	88 Å²	88	49 Å²	49	47%	0.471	25%	0.254	S	S	.	.			trans	-93.1	122	167.5	-172	8.1	0	0	0	111	E173 D177 Q178	E173-D175 PolarHBondContact O-N 2.86Å; D175-D177 WeakPolarHBondContact OD1-CB 3.15Å; D175-D177 PolarHBondContact OD1-N 3.02Å; D175-Q178 HydrophobicContact CB-CB 4.41Å; D175-Q178 PolarHBondContact O-N 3.09Å
176	L	89.2	Confident	90.5	Very high	17 Å²	17	49 Å²	49	9%	0.089	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-80.9	-21.1	179.3	-59.2	-175.6	0	0	0	112.1	I84 K134 L168 L174 Q178 A421	I84-L176 HydrophobicContact CB-CB 4.31Å; I84-L176 HydrophobicContact CD1-CB 3.95Å; I84-L176 HydrophobicContact CD1-CD1 4.09Å; I84-L176 HydrophobicContact CG2-CB 4.23Å; K134-L176 HydrophobicContact CB-CD1 4.19Å; L168-L176 HydrophobicContact CD1-CD2 3.95Å; L174-L176 HydrophobicContact CD1-CD2 4.2Å; L174-L176 HydrophobicContact CD2-CD2 4.28Å; L174-L176 HydrophobicContact CG-CD2 4.03Å; L176-Q178 PolarHBondContact O-N 3.03Å; L176-A421 HydrophobicContact CD1-CB 4.14Å; L176-A421 HydrophobicContact CD2-CB 3.67Å
177	D	89.4	Confident	90.5	Very high	57 Å²	57	48.3 Å²	48.3	31%	0.305	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-73.2	-12.1	172.1	-106.1	-0.7	0	0	0	112.4	I84 K87 D175	I84-D177 WeakPolarHBondContact CG2-OD1 3.27Å; K87-D177 PolarHBondContact N-O 3.48Å; K87-D177 IonicContact NZ-OD1 3.58Å; K87-D177 PolarHBondContact NZ-OD1 2.89Å; K87-D177 IonicContact NZ-OD2 2.76Å; K87-D177 PolarHBondContact NZ-OD2 3.05Å; D175-D177 WeakPolarHBondContact OD1-CB 3.15Å; D175-D177 PolarHBondContact OD1-N 3.02Å
178	Q	89.3	Confident	90.5	Very high	96 Å²	96	49 Å²	49	45%	0.449	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-121.2	28.2	177.8	-64.6	-66.4	-92	0	0	112.9	K87 D175 L176 H180	K87-Q178 PolarHBondContact O-NE2 2.83Å; D175-Q178 HydrophobicContact CB-CB 4.41Å; D175-Q178 PolarHBondContact O-N 3.09Å; L176-Q178 PolarHBondContact O-N 3.03Å; Q178-H180 PolarHBondContact O-CD2 3.32Å; Q178-H180 PolarHBondContact O-N 3.48Å
179	F	90.3	Very high	90.6	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.009	26%	0.255	C	S	.	.			trans	-65.8	125	177	176.5	-142.1	0	0	0	112.4	S86 A130 K166 L168 T183 E425	S86-F179 WeakPolarHBondContact CB-O 3.42Å; S86-F179 PolarHBondContact OG-N 3.09Å; S86-F179 PolarHBondContact OG-O 3.3Å; A130-F179 HydrophobicContact CB-CD1 4.08Å; K166-F179 HydrophobicContact CD-CZ 4.48Å; L168-F179 HydrophobicContact CD1-CD2 3.87Å; L168-F179 HydrophobicContact CD1-CE2 3.89Å; L168-F179 HydrophobicContact CD1-CG 4.24Å; L168-F179 HydrophobicContact CD1-CZ 4.23Å; L168-F179 HydrophobicContact CD2-CD2 4.14Å; L168-F179 HydrophobicContact CD2-CE2 3.43Å; L168-F179 VanDerWaalsContact CD2-CE2 3.43Å; L168-F179 HydrophobicContact CD2-CZ 3.86Å; L168-F179 HydrophobicContact CG-CE2 4.31Å; F179-T183 HydrophobicContact CD2-CG2 4.01Å; F179-T183 HydrophobicContact CE2-CG2 4.48Å; F179-E425 HydrophobicContact CE1-CB 3.82Å; F179-E425 HydrophobicContact CE2-CB 4.12Å; F179-E425 HydrophobicContact CZ-CB 3.5Å; F179-E425 HydrophobicContact CZ-CG 4.49Å
180	H	89.1	Confident	90.7	Very high	45 Å²	45	48.8 Å²	48.8	21%	0.208	25%	0.252	C	S	.	.			trans	-150.8	174.2	-177.6	75.4	111.9	0	0	0	113.4	A88 Y100 Q178 K182 T183	A88-H180 HydrophobicContact CB-CB 3.95Å; Y100-H180 HydrophobicContact CE2-CB 3.71Å; Q178-H180 PolarHBondContact O-CD2 3.32Å; Q178-H180 PolarHBondContact O-N 3.48Å; H180-K182 PolarHBondContact ND1-N 3.49Å; H180-K182 PolarHBondContact O-N 3.18Å; H180-T183 PolarHBondContact CD2-OG1 3.06Å; H180-T183 VanDerWaalsContact CD2-OG1 3.25Å; H180-T183 PolarHBondContact N-OG1 2.91Å; H180-T183 WeakPolarHBondContact O-CB 3.48Å; H180-T183 PolarHBondContact O-N 2.97Å; H180-T183 PolarHBondContact O-OG1 3.23Å
181	D	86.6	Confident	90.8	Very high	37 Å²	37	43.5 Å²	43.5	20%	0.198	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-40.9	-50.2	-179.9	66	-25.5	0	0	0	116.2	K90 Y100 T183 E425	K90-D181 VanDerWaalsContact CE-OD2 3.22Å; K90-D181 WeakPolarHBondContact CE-OD2 3.49Å; Y100-D181 PolarHBondContact OH-N 3.07Å; D181-T183 VanDerWaalsContact C-N 3.32Å; D181-T183 PolarHBondContact O-N 3.29Å; D181-E425 WeakPolarHBondContact CA-OE2 3.08Å
182	K	88.4	Confident	91.1	Very high	94 Å²	94	42.7 Å²	42.7	41%	0.409	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-0.6	-177	-48.2	163.1	-164.2	166.6	0	113.8	D91 D92 H180	D91-K182 IonicContact OD2-NZ 2.7Å; D91-K182 PolarHBondContact OD2-NZ 3.39Å; D92-K182 WeakPolarHBondContact OD2-CE 3.4Å; D92-K182 IonicContact OD2-NZ 3.98Å; D92-K182 PolarHBondContact OD2-NZ 3.44Å; H180-K182 PolarHBondContact ND1-N 3.49Å; H180-K182 PolarHBondContact O-N 3.18Å
183	T	91.6	Very high	91.6	Very high	12 Å²	12	37.1 Å²	37.1	7%	0.074	19%	0.185	C	C	.	.	S	Bend	trans	-54.9	132.7	-178.9	-56.8	0	0	0	0	110.2	L174 F179 H180 D181 Y185	L174-T183 HydrophobicContact CD1-CG2 4.26Å; F179-T183 HydrophobicContact CD2-CG2 4.01Å; F179-T183 HydrophobicContact CE2-CG2 4.48Å; H180-T183 PolarHBondContact CD2-OG1 3.06Å; H180-T183 VanDerWaalsContact CD2-OG1 3.25Å; H180-T183 PolarHBondContact N-OG1 2.91Å; H180-T183 WeakPolarHBondContact O-CB 3.48Å; H180-T183 PolarHBondContact O-N 2.97Å; H180-T183 PolarHBondContact O-OG1 3.23Å; D181-T183 VanDerWaalsContact C-N 3.32Å; D181-T183 PolarHBondContact O-N 3.29Å; T183-Y185 PolarHBondContact O-N 3.27Å; T183-Y185 VanDerWaalsContact O-N 3.08Å
184	P	93.2	Very high	92.1	Very high	50 Å²	50	32.5 Å²	32.5	33%	0.325	17%	0.171	S	C	.	.			trans	-63.9	115.9	-179.4	25.7	-34.4	0	0	0	110.9	S169 T171	S169-P184 WeakPolarHBondContact CB-O 3.22Å; S169-P184 PolarHBondContact N-O 3.11Å; S169-P184 PolarHBondContact OG-O 2.88Å; T171-P184 HydrophobicContact CG2-CB 4.45Å; T171-P184 HydrophobicContact CG2-CG 3.89Å
185	Y	95.3	Very high	92.3	Very high	5 Å²	5	32.6 Å²	32.6	2%	0.02	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	157	173.9	71.1	-88.5	0	0	0	110.2	L167 S169 T183 M188 R205 E216	L167-Y185 CarbonylContact O-C 3.48Å; L167-Y185 WeakPolarHBondContact O-CA 3.39Å; L167-Y185 WeakPolarHBondContact O-CB 3.36Å; S169-Y185 WeakPolarHBondContact OG-CA 3.33Å; S169-Y185 PolarHBondContact OG-O 2.76Å; T183-Y185 PolarHBondContact O-N 3.27Å; T183-Y185 VanDerWaalsContact O-N 3.08Å; Y185-M188 HydrophobicContact CD2-CB 4.17Å; Y185-M188 HydrophobicContact CE1-CE 4.05Å; Y185-M188 HydrophobicContact CE2-CB 3.7Å; Y185-M188 HydrophobicContact CE2-CE 3.93Å; Y185-M188 WeakPolarHBondContact OH-CE 3.44Å; Y185-R205 HydrophobicContact CE2-CG 4.12Å; Y185-R205 VanDerWaalsContact CZ-CD 3.49Å; Y185-R205 VanDerWaalsContact O-CD 3.3Å; Y185-R205 WeakPolarHBondContact O-CD 3.36Å; Y185-E216 WeakPolarHBondContact CE1-OE1 3.45Å; Y185-E216 VanDerWaalsContact CZ-OE1 3.3Å; Y185-E216 PolarHBondContact OH-OE1 2.57Å; Y185-E216 PolarHBondContact OH-OE2 3.27Å
186	T	95.9	Very high	92.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-50	178.4	-63.6	0	0	0	0	110.6	F141 L167 S169 F204 R205 M416 T417	F141-T186 HydrophobicContact CE2-CG2 3.88Å; F141-T186 HydrophobicContact CZ-CG2 4.02Å; L167-T186 PolarHBondContact O-N 2.88Å; S169-T186 PolarHBondContact OG-N 2.84Å; S169-T186 VanDerWaalsContact OG-N 3.16Å; S169-T186 PolarHBondContact OG-OG1 2.9Å; T186-F204 CarbonylContact O-C 3.6Å; T186-F204 VanDerWaalsContact O-CA 3.3Å; T186-F204 WeakPolarHBondContact O-CA 3.33Å; T186-R205 PolarHBondContact O-N 3.14Å; T186-M416 HydrophobicContact CG2-CB 4.11Å; T186-M416 HydrophobicContact CG2-CG 3.48Å; T186-M416 VanDerWaalsContact CG2-CG 3.48Å; T186-M416 HydrophobicContact CG2-SD 3.43Å; T186-M416 WeakPolarHBondContact CG2-SD 3.37Å; T186-T417 WeakPolarHBondContact CB-O 3.45Å; T186-T417 WeakPolarHBondContact CG2-O 3.16Å; T186-T417 PolarHBondContact OG1-O 3.2Å; T186-T417 PolarHBondContact OG1-OG1 3.43Å
187	I	96.9	Very high	92.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	141.7	178.9	-70.8	161.9	0	0	0	109	F141 L146 L167 F189 F202 I203 F204 L240 L242 M416	F141-I187 HydrophobicContact CE1-CD1 4.3Å; F141-I187 HydrophobicContact CZ-CD1 4.16Å; L146-I187 HydrophobicContact CD2-CD1 3.55Å; L167-I187 HydrophobicContact CB-CB 4.44Å; L167-I187 HydrophobicContact CD1-CB 3.93Å; L167-I187 HydrophobicContact CD1-CD1 4.24Å; L167-I187 HydrophobicContact CD1-CG2 4.32Å; L167-I187 HydrophobicContact CG-CB 4.26Å; L167-I187 PolarHBondContact N-O 2.67Å; I187-F189 HydrophobicContact CG2-CB 4.16Å; I187-F202 HydrophobicContact CG1-CE2 4.37Å; I187-F202 HydrophobicContact CG2-CD2 4.11Å; I187-F202 HydrophobicContact CG2-CE2 3.99Å; I187-I203 CarbonylContact C-O 3.53Å; I187-I203 VanDerWaalsContact CA-O 3.27Å; I187-I203 WeakPolarHBondContact CA-O 3.42Å; I187-F204 HydrophobicContact CG1-CB 3.89Å; I187-L240 HydrophobicContact CG2-CD2 4.06Å; I187-L242 HydrophobicContact CD1-CD2 4.21Å; I187-M416 HydrophobicContact CD1-SD 3.77Å; I187-M416 HydrophobicContact CG1-SD 3.85Å
188	M	96.9	Very high	92.5	Very high	16 Å²	16	38.1 Å²	38.1	8%	0.079	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	129	160.5	-173.1	-176.2	-31.8	0	0	108.1	Y164 V165 K166 Y185 F202 I203	Y164-M188 HydrophobicContact CD2-CG 3.74Å; Y164-M188 HydrophobicContact CD2-SD 3.52Å; Y164-M188 VanDerWaalsContact CD2-SD 3.52Å; Y164-M188 HydrophobicContact CE2-CG 4.39Å; Y164-M188 HydrophobicContact CE2-SD 3.6Å; Y164-M188 HydrophobicContact CG-CG 4.17Å; Y164-M188 HydrophobicContact CG-SD 4.06Å; V165-M188 CarbonylContact O-C 3.37Å; V165-M188 VanDerWaalsContact O-CA 3.31Å; V165-M188 WeakPolarHBondContact O-CA 3.41Å; K166-M188 HydrophobicContact CD-CE 4.34Å; K166-M188 HydrophobicContact CG-CB 4.4Å; K166-M188 HydrophobicContact CG-CE 4.43Å; K166-M188 HydrophobicContact CG-CG 3.97Å; K166-M188 HydrophobicContact CG-SD 4.48Å; Y185-M188 HydrophobicContact CD2-CB 4.17Å; Y185-M188 HydrophobicContact CE1-CE 4.05Å; Y185-M188 HydrophobicContact CE2-CB 3.7Å; Y185-M188 HydrophobicContact CE2-CE 3.93Å; Y185-M188 WeakPolarHBondContact OH-CE 3.44Å; M188-F202 WeakPolarHBondContact O-CA 3.38Å; M188-I203 HydrophobicContact CB-CB 4.28Å; M188-I203 HydrophobicContact CE-CD1 4.27Å; M188-I203 PolarHBondContact N-O 3.45Å; M188-I203 PolarHBondContact O-N 3.5Å; M188-I203 HydrophobicContact SD-CD1 4.2Å
189	F	97.4	Very high	92.7	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.018	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	132.7	-177.1	172	-115.6	0	0	0	111.3	Y150 Y164 V165 I187 L200 H201 F202 L240 I250	Y150-F189 HydrophobicContact CE1-CD1 4.04Å; Y150-F189 HydrophobicContact CE1-CE1 4.1Å; Y150-F189 PolarHBondContact OH-O 2.84Å; Y164-F189 CarbonylContact C-O 3.53Å; Y164-F189 WeakPolarHBondContact CA-O 3.22Å; Y164-F189 WeakPolarHBondContact CB-O 3.17Å; V165-F189 PolarHBondContact N-O 2.62Å; V165-F189 PolarHBondContact O-N 2.81Å; I187-F189 HydrophobicContact CG2-CB 4.16Å; F189-L200 HydrophobicContact CE2-CD1 3.94Å; F189-L200 HydrophobicContact CZ-CD1 4.4Å; F189-H201 CarbonylContact C-O 3.58Å; F189-H201 VanDerWaalsContact CA-O 3.28Å; F189-H201 WeakPolarHBondContact CA-O 3.14Å; F189-H201 WeakPolarHBondContact CD2-O 3.15Å; F189-F202 HydrophobicContact CD2-CB 4.41Å; F189-L240 HydrophobicContact CB-CD2 4.05Å; F189-L240 HydrophobicContact CD1-CB 3.75Å; F189-L240 HydrophobicContact CD2-CB 3.89Å; F189-L240 HydrophobicContact CD2-CD2 4.2Å; F189-L240 HydrophobicContact CD2-CG 4.43Å; F189-L240 HydrophobicContact CE1-CB 3.73Å; F189-L240 HydrophobicContact CE2-CB 3.89Å; F189-L240 HydrophobicContact CG-CB 3.84Å; F189-L240 HydrophobicContact CG-CD2 3.98Å; F189-L240 HydrophobicContact CG-CG 4.48Å; F189-L240 HydrophobicContact CZ-CB 3.81Å; F189-I250 HydrophobicContact CE2-CD1 4.39Å; F189-I250 HydrophobicContact CE2-CG1 4.42Å; F189-I250 HydrophobicContact CE2-CG2 3.66Å; F189-I250 HydrophobicContact CZ-CG2 4Å
190	G	95.9	Very high	92.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	139.3	178.5	166.9	0	0	0	0	0	116.1	Y150 L200 H201	Y150-G190 WeakPolarHBondContact OH-CA 3.29Å; G190-L200 VanDerWaalsContact C-CD1 3.41Å; G190-H201 PolarHBondContact N-O 2.86Å; G190-H201 PolarHBondContact O-N 3.11Å
191	P	95.4	Very high	93.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	142.8	-177.5	26.9	-34.6	0	0	0	112.9	V152 F154 A163 Y164 K199 F230 Y238	V152-P191 HydrophobicContact CG2-CG 4.17Å; F154-P191 HydrophobicContact CZ-CB 4.24Å; F154-P191 HydrophobicContact CZ-CG 4.23Å; A163-P191 CarbonylContact C-O 3.59Å; A163-P191 HydrophobicContact CB-CG 4.08Å; A163-P191 PolarHBondContact N-O 2.71Å; Y164-P191 PolarHBondContact N-O 2.81Å; P191-K199 WeakPolarHBondContact CA-O 3.19Å; P191-F230 HydrophobicContact CB-CE1 3.62Å; P191-F230 HydrophobicContact CB-CE2 4.39Å; P191-F230 HydrophobicContact CB-CZ 3.44Å; P191-F230 VanDerWaalsContact CB-CZ 3.44Å; P191-Y238 HydrophobicContact CB-CE1 3.86Å; P191-Y238 HydrophobicContact CG-CD1 4.22Å; P191-Y238 HydrophobicContact CG-CD2 4.22Å; P191-Y238 HydrophobicContact CG-CE1 3.82Å; P191-Y238 HydrophobicContact CG-CE2 3.84Å; P191-Y238 HydrophobicContact CG-CG 4.4Å
192	D	94.3	Very high	93.6	Very high	30 Å²	30	35 Å²	35	16%	0.16	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	139.7	174.6	-175.1	41.9	0	0	0	109.3	G162 Y164 K199 H201	G162-D192 VanDerWaalsContact CA-OD1 3.28Å; G162-D192 WeakPolarHBondContact CA-OD1 3.41Å; G162-D192 PolarHBondContact N-OD1 3.28Å; Y164-D192 HydrophobicContact CD1-CB 3.99Å; Y164-D192 HydrophobicContact CE1-CB 4.22Å; D192-K199 HydrophobicContact CB-CB 4.38Å; D192-K199 PolarHBondContact N-O 3.27Å; D192-K199 WeakPolarHBondContact O-CA 3.37Å; D192-K199 PolarHBondContact O-N 3Å; D192-H201 WeakPolarHBondContact CB-CD2 3.23Å; D192-H201 VanDerWaalsContact CB-NE2 3.32Å; D192-H201 WeakPolarHBondContact CB-NE2 3.27Å; D192-H201 IonicContact OD2-CD2 2.68Å; D192-H201 IonicContact OD2-CE1 3.88Å; D192-H201 IonicContact OD2-NE2 3.92Å; D192-H201 PolarHBondContact OD2-NE2 2.87Å
193	K	92.9	Very high	94	Very high	16 Å²	16	30.8 Å²	30.8	7%	0.07	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	139.9	178.7	-179.1	-171.2	172.9	-177.3	0	110	I158 C160 G161 G195 D197 Y198 F230	I158-K193 HydrophobicContact CG2-CD 4.1Å; I158-K193 WeakPolarHBondContact O-CD 3.43Å; I158-K193 WeakPolarHBondContact O-CE 3.38Å; I158-K193 PolarHBondContact O-NZ 3.43Å; C160-K193 CarbonylContact C-O 3.56Å; C160-K193 VanDerWaalsContact CA-O 3.27Å; C160-K193 WeakPolarHBondContact CA-O 3.27Å; G161-K193 PolarHBondContact N-O 3.26Å; G161-K193 PolarHBondContact O-N 3.38Å; G161-K193 VanDerWaalsContact O-N 3.1Å; K193-G195 WeakPolarHBondContact CE-O 3.48Å; K193-D197 WeakPolarHBondContact CA-O 3.21Å; K193-Y198 HydrophobicContact CD-CD1 3.86Å; K193-Y198 HydrophobicContact CD-CE1 3.54Å; K193-Y198 WeakPolarHBondContact CE-OH 3.38Å; K193-Y198 HydrophobicContact CG-CD1 4.04Å; K193-Y198 HydrophobicContact CG-CE1 4.14Å; K193-Y198 PolarHBondContact NZ-OH 2.78Å; K193-F230 HydrophobicContact CB-CD1 3.73Å; K193-F230 HydrophobicContact CB-CE1 3.77Å; K193-F230 HydrophobicContact CD-CB 4.21Å; K193-F230 HydrophobicContact CD-CD1 4.19Å; K193-F230 HydrophobicContact CD-CG 4.43Å; K193-F230 HydrophobicContact CG-CD1 4.48Å
194	C	92.1	Very high	94.1	Very high	72 Å²	72	30.2 Å²	30.2	49%	0.486	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	117.6	158.7	-159.6	0	0	0	0	111.3	C160 E196 D197	C160-C194 HydrophobicContact CB-CB 3.92Å; C160-C194 WeakPolarHBondContact CB-SG 3.49Å; C160-C194 WeakPolarHBondContact SG-CB 3.15Å; C160-C194 CovalentContact SG-SG 2.05Å; C160-C194 PolarHBondContact SG-SG 2.89Å; C194-E196 PolarHBondContact O-N 2.88Å; C194-D197 PolarHBondContact N-O 3.34Å; C194-D197 PolarHBondContact O-N 3.1Å; C194-D197 VanDerWaalsContact O-N 3.13Å
195	G	89.3	Confident	94.2	Very high	44 Å²	44	29.9 Å²	29.9	45%	0.454	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	-115.3	-175.3	0	0	0	0	0	111.1	E159 K193	E159-G195 PolarHBondContact O-N 2.92Å; K193-G195 WeakPolarHBondContact CE-O 3.48Å
196	E	89.9	Confident	94	Very high	176 Å²	176	30.1 Å²	30.1	82%	0.822	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-1.4	177	-57.1	-163.9	128.1	0	0	113.8	C194 Y198	C194-E196 PolarHBondContact O-N 2.88Å; E196-Y198 WeakPolarHBondContact O-CD2 3.31Å; E196-Y198 WeakPolarHBondContact O-CE2 3.35Å; E196-Y198 PolarHBondContact O-N 2.61Å
197	D	90.8	Very high	93.8	Very high	56 Å²	56	35.2 Å²	35.2	30%	0.299	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	92.1	178.8	-163	4.7	0	0	0	110	K193 C194 K199 R221	K193-D197 WeakPolarHBondContact CA-O 3.21Å; C194-D197 PolarHBondContact N-O 3.34Å; C194-D197 PolarHBondContact O-N 3.1Å; C194-D197 VanDerWaalsContact O-N 3.13Å; D197-K199 VanDerWaalsContact CG-CE 3.48Å; D197-K199 WeakPolarHBondContact OD1-CE 3.42Å; D197-K199 IonicContact OD1-NZ 3.29Å; D197-K199 WeakPolarHBondContact OD2-CE 3.37Å; D197-K199 IonicContact OD2-NZ 3.29Å; D197-K199 PolarHBondContact OD2-NZ 2.94Å; D197-R221 IonicContact OD1-CZ 2.71Å; D197-R221 VanDerWaalsContact OD1-CZ 3.23Å; D197-R221 IonicContact OD1-NH1 3.2Å; D197-R221 PolarHBondContact OD1-NH1 2.99Å; D197-R221 IonicContact OD1-NH2 3.53Å; D197-R221 PolarHBondContact OD1-NH2 3.04Å; D197-R221 IonicContact OD2-NH2 3.41Å; D197-R221 PolarHBondContact OD2-NH2 2.98Å
198	Y	91.8	Very high	93.3	Very high	45 Å²	45	36.1 Å²	36.1	18%	0.176	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	125.2	174.7	-56.7	-95.8	0	0	0	109.8	K193 E196 K227 F230 T231	K193-Y198 HydrophobicContact CD-CD1 3.86Å; K193-Y198 HydrophobicContact CD-CE1 3.54Å; K193-Y198 WeakPolarHBondContact CE-OH 3.38Å; K193-Y198 HydrophobicContact CG-CD1 4.04Å; K193-Y198 HydrophobicContact CG-CE1 4.14Å; K193-Y198 PolarHBondContact NZ-OH 2.78Å; E196-Y198 WeakPolarHBondContact O-CD2 3.31Å; E196-Y198 WeakPolarHBondContact O-CE2 3.35Å; E196-Y198 PolarHBondContact O-N 2.61Å; Y198-K227 HydrophobicContact CE1-CB 4.4Å; Y198-K227 HydrophobicContact CE1-CG 4.11Å; Y198-K227 HydrophobicContact CE2-CB 4.46Å; Y198-K227 HydrophobicContact CE2-CD 4.44Å; Y198-K227 HydrophobicContact CE2-CG 4.15Å; Y198-F230 HydrophobicContact CD1-CB 3.95Å; Y198-F230 AromaticContact CD1-CD2 3.73Å; Y198-F230 HydrophobicContact CD1-CD2 3.73Å; Y198-F230 HydrophobicContact CD1-CE2 4.31Å; Y198-F230 AromaticContact CD1-CG 3.87Å; Y198-F230 HydrophobicContact CD1-CG 3.87Å; Y198-F230 HydrophobicContact CE1-CB 3.92Å; Y198-F230 HydrophobicContact CE1-CG 4.34Å; Y198-T231 HydrophobicContact CE1-CG2 4.44Å
199	K	91.9	Very high	92.9	Very high	62 Å²	62	39.6 Å²	39.6	27%	0.27	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	146.5	-178.8	-68.7	178.6	-175.4	130.9	0	111.8	P191 D192 D197 F230	P191-K199 WeakPolarHBondContact CA-O 3.19Å; D192-K199 HydrophobicContact CB-CB 4.38Å; D192-K199 PolarHBondContact N-O 3.27Å; D192-K199 WeakPolarHBondContact O-CA 3.37Å; D192-K199 PolarHBondContact O-N 3Å; D197-K199 VanDerWaalsContact CG-CE 3.48Å; D197-K199 WeakPolarHBondContact OD1-CE 3.42Å; D197-K199 IonicContact OD1-NZ 3.29Å; D197-K199 WeakPolarHBondContact OD2-CE 3.37Å; D197-K199 IonicContact OD2-NZ 3.29Å; D197-K199 PolarHBondContact OD2-NZ 2.94Å; K199-F230 WeakPolarHBondContact O-CZ 3.27Å
200	L	94.4	Very high	92.3	Very high	15 Å²	15	44.8 Å²	44.8	8%	0.079	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	98.5	162.3	179.9	45.5	0	0	0	106.4	F189 G190 F202 L226 Y238 I250 V252 V257	F189-L200 HydrophobicContact CE2-CD1 3.94Å; F189-L200 HydrophobicContact CZ-CD1 4.4Å; G190-L200 VanDerWaalsContact C-CD1 3.41Å; L200-F202 PolarHBondContact O-N 3.01Å; L200-L226 HydrophobicContact CB-CD1 3.78Å; L200-Y238 HydrophobicContact CD1-CD1 3.83Å; L200-Y238 HydrophobicContact CD1-CE1 4.19Å; L200-Y238 HydrophobicContact CD2-CD1 4.37Å; L200-I250 HydrophobicContact CD2-CG2 3.55Å; L200-I250 HydrophobicContact CG-CG2 4.09Å; L200-V252 HydrophobicContact CD2-CG2 3.71Å; L200-V257 HydrophobicContact CD2-CG2 3.84Å
201	H	95.3	Very high	91.8	Very high	34 Å²	34	47.9 Å²	47.9	16%	0.157	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	131.6	-179.6	-72.8	-55.2	0	0	0	109.4	Y164 F189 G190 D192 I203	Y164-H201 AromaticContact CD1-CD2 3.9Å; F189-H201 CarbonylContact C-O 3.58Å; F189-H201 VanDerWaalsContact CA-O 3.28Å; F189-H201 WeakPolarHBondContact CA-O 3.14Å; F189-H201 WeakPolarHBondContact CD2-O 3.15Å; G190-H201 PolarHBondContact N-O 2.86Å; G190-H201 PolarHBondContact O-N 3.11Å; D192-H201 WeakPolarHBondContact CB-CD2 3.23Å; D192-H201 VanDerWaalsContact CB-NE2 3.32Å; D192-H201 WeakPolarHBondContact CB-NE2 3.27Å; D192-H201 IonicContact OD2-CD2 2.68Å; D192-H201 IonicContact OD2-CE1 3.88Å; D192-H201 IonicContact OD2-NE2 3.92Å; D192-H201 PolarHBondContact OD2-NE2 2.87Å; H201-I203 HydrophobicContact CB-CD1 4.27Å; H201-I203 HydrophobicContact CB-CG1 4.27Å
202	F	96.3	Very high	91.4	Very high	3 Å²	3	49.4 Å²	49.4	1%	0.013	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	110.1	151.3	171.1	-139.5	0	0	0	106.4	I187 M188 F189 L200 A219 L240 L242 F248 I250 L262 M266	I187-F202 HydrophobicContact CG1-CE2 4.37Å; I187-F202 HydrophobicContact CG2-CD2 4.11Å; I187-F202 HydrophobicContact CG2-CE2 3.99Å; M188-F202 WeakPolarHBondContact O-CA 3.38Å; F189-F202 HydrophobicContact CD2-CB 4.41Å; L200-F202 PolarHBondContact O-N 3.01Å; F202-A219 HydrophobicContact CB-CB 3.97Å; F202-A219 HydrophobicContact CD1-CB 3.89Å; F202-A219 HydrophobicContact CG-CB 4.32Å; F202-A219 WeakPolarHBondContact O-CB 3.25Å; F202-A219 PolarHBondContact O-N 3.47Å; F202-L240 HydrophobicContact CD1-CD1 4.14Å; F202-L240 HydrophobicContact CD2-CD1 4.01Å; F202-L240 HydrophobicContact CD2-CD2 3.72Å; F202-L240 HydrophobicContact CE1-CD1 4.18Å; F202-L240 HydrophobicContact CE2-CD1 4.07Å; F202-L240 HydrophobicContact CE2-CD2 3.65Å; F202-L240 HydrophobicContact CG-CD1 4.07Å; F202-L240 HydrophobicContact CZ-CD1 4.16Å; F202-L240 HydrophobicContact CZ-CD2 4.4Å; F202-L242 HydrophobicContact CZ-CD1 4.31Å; F202-F248 AromaticContact CD1-CD2 3.76Å; F202-F248 HydrophobicContact CD1-CD2 3.76Å; F202-F248 AromaticContact CD1-CE2 3.99Å; F202-F248 HydrophobicContact CD1-CE2 3.99Å; F202-F248 HydrophobicContact CD1-CG 4.08Å; F202-F248 HydrophobicContact CD1-CZ 4.46Å; F202-F248 HydrophobicContact CE1-CB 3.84Å; F202-F248 AromaticContact CE1-CD1 3.94Å; F202-F248 HydrophobicContact CE1-CD1 3.94Å; F202-F248 AromaticContact CE1-CD2 3.78Å; F202-F248 HydrophobicContact CE1-CD2 3.78Å; F202-F248 HydrophobicContact CE1-CE1 4.43Å; F202-F248 HydrophobicContact CE1-CE2 4.3Å; F202-F248 AromaticContact CE1-CG 3.58Å; F202-F248 HydrophobicContact CE1-CG 3.58Å; F202-I250 HydrophobicContact CB-CD1 3.67Å; F202-I250 HydrophobicContact CD1-CD1 4.3Å; F202-I250 HydrophobicContact CG-CD1 4.3Å; F202-L262 HydrophobicContact CE1-CD2 4.07Å; F202-L262 HydrophobicContact CZ-CD2 4.04Å; F202-M266 HydrophobicContact CD1-CE 3.79Å; F202-M266 HydrophobicContact CE1-CE 3.53Å; F202-M266 HydrophobicContact CZ-CE 4.3Å
203	I	95.8	Very high	91.1	Very high	6 Å²	6	53.7 Å²	53.7	3%	0.031	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	134	-176.5	-48.5	170.6	0	0	0	106.8	I187 M188 H201 E216 K217 H218	I187-I203 CarbonylContact C-O 3.53Å; I187-I203 VanDerWaalsContact CA-O 3.27Å; I187-I203 WeakPolarHBondContact CA-O 3.42Å; M188-I203 HydrophobicContact CB-CB 4.28Å; M188-I203 HydrophobicContact CE-CD1 4.27Å; M188-I203 PolarHBondContact N-O 3.45Å; M188-I203 PolarHBondContact O-N 3.5Å; M188-I203 HydrophobicContact SD-CD1 4.2Å; H201-I203 HydrophobicContact CB-CD1 4.27Å; H201-I203 HydrophobicContact CB-CG1 4.27Å; I203-E216 HydrophobicContact CG2-CB 4.06Å; I203-E216 HydrophobicContact CG2-CG 4.46Å; I203-K217 WeakPolarHBondContact CA-O 3.16Å; I203-H218 WeakPolarHBondContact CD1-ND1 3.26Å; I203-H218 WeakPolarHBondContact CG1-ND1 3.44Å
204	F	94.9	Very high	91	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	150.7	169	79.6	-75	0	0	0	111.6	T186 I187 H206 K217 L262 M266 V270 P413 M416	T186-F204 CarbonylContact O-C 3.6Å; T186-F204 VanDerWaalsContact O-CA 3.3Å; T186-F204 WeakPolarHBondContact O-CA 3.33Å; I187-F204 HydrophobicContact CG1-CB 3.89Å; F204-H206 HydrophobicContact CD2-CB 4.47Å; F204-H206 HydrophobicContact CE2-CB 3.92Å; F204-H206 HydrophobicContact CZ-CB 4.49Å; F204-H206 PolarHBondContact O-N 3.22Å; F204-K217 HydrophobicContact CD1-CB 3.94Å; F204-K217 HydrophobicContact CE1-CB 3.63Å; F204-K217 HydrophobicContact CE1-CG 4.33Å; F204-K217 HydrophobicContact CZ-CB 4.13Å; F204-K217 HydrophobicContact CZ-CG 4.33Å; F204-K217 PolarHBondContact N-O 2.89Å; F204-K217 PolarHBondContact O-N 3.44Å; F204-L262 HydrophobicContact CD1-CD2 4.2Å; F204-L262 HydrophobicContact CE1-CB 4.38Å; F204-L262 HydrophobicContact CE1-CD2 3.82Å; F204-L262 HydrophobicContact CE1-CG 4.5Å; F204-L262 HydrophobicContact CE2-CD1 4.45Å; F204-L262 HydrophobicContact CZ-CB 4.19Å; F204-L262 HydrophobicContact CZ-CD1 4.21Å; F204-L262 HydrophobicContact CZ-CD2 4.23Å; F204-L262 HydrophobicContact CZ-CG 4.46Å; F204-M266 HydrophobicContact CD1-CE 4.16Å; F204-M266 HydrophobicContact CD1-SD 4.03Å; F204-M266 HydrophobicContact CE1-CE 4.01Å; F204-M266 HydrophobicContact CE1-CG 3.9Å; F204-M266 HydrophobicContact CE1-SD 3.7Å; F204-V270 HydrophobicContact CE1-CG2 4.38Å; F204-V270 HydrophobicContact CZ-CG2 3.68Å; F204-P413 HydrophobicContact CE2-CB 4.34Å; F204-P413 HydrophobicContact CZ-CB 4.4Å; F204-M416 HydrophobicContact CB-CE 4.48Å; F204-M416 HydrophobicContact CB-SD 4.3Å; F204-M416 HydrophobicContact CD2-CE 3.79Å; F204-M416 HydrophobicContact CD2-SD 4.24Å; F204-M416 HydrophobicContact CE2-CE 4.32Å; F204-M416 HydrophobicContact CG-CE 4.3Å
205	R	93.8	Very high	91	Very high	44 Å²	44	58 Å²	58	17%	0.166	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	91.1	-177.7	-80	176.7	58.9	164.1	0	110.5	Y185 T186 Y214 E215 E216	Y185-R205 HydrophobicContact CE2-CG 4.12Å; Y185-R205 VanDerWaalsContact CZ-CD 3.49Å; Y185-R205 VanDerWaalsContact O-CD 3.3Å; Y185-R205 WeakPolarHBondContact O-CD 3.36Å; T186-R205 PolarHBondContact O-N 3.14Å; R205-Y214 HydrophobicContact CB-CD1 4.41Å; R205-E215 WeakPolarHBondContact CA-O 3.49Å; R205-E216 HydrophobicContact CG-CG 3.51Å; R205-E216 IonicContact NH1-OE1 2.65Å
206	H	92.2	Very high	91.2	Very high	10 Å²	10	59.6 Å²	59.6	5%	0.046	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	140.8	173.4	179.5	68.9	0	0	0	110.2	F204 Y214 E215 K217 F408 D410	F204-H206 HydrophobicContact CD2-CB 4.47Å; F204-H206 HydrophobicContact CE2-CB 3.92Å; F204-H206 HydrophobicContact CZ-CB 4.49Å; F204-H206 PolarHBondContact O-N 3.22Å; H206-Y214 WeakPolarHBondContact O-CA 3.47Å; H206-E215 PolarHBondContact N-O 3.42Å; H206-E215 PolarHBondContact O-N 2.88Å; H206-K217 HydrophobicContact CB-CG 3.87Å; H206-F408 AromaticContact NE2-CE2 3.44Å; H206-F408 WeakPolarHBondContact NE2-CE2 3.19Å; H206-F408 AromaticContact NE2-CZ 3.63Å; H206-D410 IonicContact CE1-OD2 3.91Å; H206-D410 PolarHBondContact CE1-OD2 3.4Å; H206-D410 VanDerWaalsContact CE1-OD2 3.31Å; H206-D410 IonicContact ND1-OD2 2.79Å
207	K	90.6	Very high	91.4	Very high	106 Å²	106	51.4 Å²	51.4	46%	0.461	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	111.4	176.4	-171.2	-170.6	176.9	-176.4	0	109.6	G212 L213 Y214	K207-G212 VanDerWaalsContact CE-O 3.23Å; K207-G212 WeakPolarHBondContact CE-O 3.43Å; K207-L213 CarbonylContact C-O 3.5Å; K207-L213 WeakPolarHBondContact CA-O 3.43Å; K207-Y214 HydrophobicContact CB-CD1 3.86Å; K207-Y214 HydrophobicContact CB-CE1 3.65Å; K207-Y214 HydrophobicContact CD-CE1 4.17Å; K207-Y214 HydrophobicContact CD-CE2 4.44Å; K207-Y214 HydrophobicContact CG-CD1 4.22Å; K207-Y214 HydrophobicContact CG-CE1 3.92Å; K207-Y214 HydrophobicContact CG-CE2 4.37Å
208	N	88.4	Confident	91.6	Very high	20 Å²	20	52.2 Å²	52.2	11%	0.107	26%	0.257	C	S	.	.			trans	-55.8	121.5	177.6	178.3	-42.2	0	0	0	110.1	K210 T211 G212 L213 F408	N208-K210 VanDerWaalsContact C-N 3.3Å; N208-K210 PolarHBondContact O-N 3Å; N208-K210 WeakPolarHBondContact OD1-CA 3.35Å; N208-K210 WeakPolarHBondContact OD1-CB 3.37Å; N208-K210 PolarHBondContact OD1-N 2.88Å; N208-T211 WeakPolarHBondContact CB-OG1 3.39Å; N208-T211 PolarHBondContact ND2-OG1 3.13Å; N208-T211 PolarHBondContact OD1-N 2.87Å; N208-T211 PolarHBondContact OD1-OG1 3.1Å; N208-G212 VanDerWaalsContact O-CA 3.26Å; N208-G212 WeakPolarHBondContact O-CA 3.31Å; N208-G212 PolarHBondContact O-N 2.62Å; N208-L213 PolarHBondContact N-O 2.89Å; N208-F408 HydrophobicContact CB-CE1 4.26Å; N208-F408 WeakPolarHBondContact ND2-CE1 3.47Å
209	P	87.3	Confident	91.7	Very high	88 Å²	88	51 Å²	51	57%	0.571	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-17.6	-173.3	28.9	-35.5	0	0	0	113.9	F408	P209-F408 VanDerWaalsContact CD-CD2 3.47Å; P209-F408 HydrophobicContact CG-CB 3.92Å; P209-F408 HydrophobicContact CG-CD1 4.42Å; P209-F408 HydrophobicContact CG-CD2 3.49Å; P209-F408 VanDerWaalsContact CG-CD2 3.49Å; P209-F408 HydrophobicContact CG-CE2 4.09Å; P209-F408 HydrophobicContact CG-CG 3.69Å
210	K	85.4	Confident	91.7	Very high	114 Å²	114	52.6 Å²	52.6	50%	0.496	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-54.4	174.2	-79.6	178.7	160.8	179.5	0	112.1	N208 P405 F407 F408	N208-K210 VanDerWaalsContact C-N 3.3Å; N208-K210 PolarHBondContact O-N 3Å; N208-K210 WeakPolarHBondContact OD1-CA 3.35Å; N208-K210 WeakPolarHBondContact OD1-CB 3.37Å; N208-K210 PolarHBondContact OD1-N 2.88Å; K210-P405 PolarHBondContact NZ-O 3.02Å; K210-F407 WeakPolarHBondContact CE-O 3.29Å; K210-F407 PolarHBondContact NZ-O 2.67Å; K210-F408 HydrophobicContact CD-CB 4.38Å; K210-F408 HydrophobicContact CG-CB 4.45Å
211	T	85.6	Confident	91.4	Very high	65 Å²	65	59.1 Å²	59.1	40%	0.399	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-19.5	-170.7	65.6	0	0	0	0	113	N208 L213	N208-T211 WeakPolarHBondContact CB-OG1 3.39Å; N208-T211 PolarHBondContact ND2-OG1 3.13Å; N208-T211 PolarHBondContact OD1-N 2.87Å; N208-T211 PolarHBondContact OD1-OG1 3.1Å; T211-L213 PolarHBondContact O-N 2.95Å; T211-L213 PolarHBondContact OG1-N 2.86Å
212	G	85.8	Confident	91.1	Very high	31 Å²	31	58.4 Å²	58.4	32%	0.32	29%	0.285	S	S	.	.			trans	74.1	-1.4	-175.6	0	0	0	0	0	114.8	K207 N208	K207-G212 VanDerWaalsContact CE-O 3.23Å; K207-G212 WeakPolarHBondContact CE-O 3.43Å; N208-G212 VanDerWaalsContact O-CA 3.26Å; N208-G212 WeakPolarHBondContact O-CA 3.31Å; N208-G212 PolarHBondContact O-N 2.62Å
213	L	89.3	Confident	90.4	Very high	121 Å²	121	66.7 Å²	66.7	63%	0.634	33%	0.33	S	S	*	.			trans	-70.4	152.6	176	-61.5	175	0	0	0	111	K207 N208 T211	K207-L213 CarbonylContact C-O 3.5Å; K207-L213 WeakPolarHBondContact CA-O 3.43Å; N208-L213 PolarHBondContact N-O 2.89Å; T211-L213 PolarHBondContact O-N 2.95Å; T211-L213 PolarHBondContact OG1-N 2.86Å
214	Y	90.6	Very high	89.9	Confident	106 Å²	106	68.4 Å²	68.4	42%	0.416	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	137.7	170.6	-67.5	-90.8	0	0	0	109.8	R205 H206 K207 T417	R205-Y214 HydrophobicContact CB-CD1 4.41Å; H206-Y214 WeakPolarHBondContact O-CA 3.47Å; K207-Y214 HydrophobicContact CB-CD1 3.86Å; K207-Y214 HydrophobicContact CB-CE1 3.65Å; K207-Y214 HydrophobicContact CD-CE1 4.17Å; K207-Y214 HydrophobicContact CD-CE2 4.44Å; K207-Y214 HydrophobicContact CG-CD1 4.22Å; K207-Y214 HydrophobicContact CG-CE1 3.92Å; K207-Y214 HydrophobicContact CG-CE2 4.37Å; Y214-T417 HydrophobicContact CE1-CG2 3.8Å; Y214-T417 WeakPolarHBondContact OH-CG2 3.5Å
215	E	91.4	Very high	89.5	Confident	73 Å²	73	73.7 Å²	73.7	34%	0.341	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	139.9	176.7	-163	-166.4	146.5	0	0	108.8	R205 H206 K217 P268	R205-E215 WeakPolarHBondContact CA-O 3.49Å; H206-E215 PolarHBondContact N-O 3.42Å; H206-E215 PolarHBondContact O-N 2.88Å; E215-K217 VanDerWaalsContact CD-CE 3.45Å; E215-K217 WeakPolarHBondContact OE1-CE 3.46Å; E215-K217 IonicContact OE1-NZ 2.65Å; E215-K217 PolarHBondContact OE1-NZ 2.81Å; E215-K217 WeakPolarHBondContact OE2-CE 3.39Å; E215-K217 IonicContact OE2-NZ 3.54Å; E215-K217 PolarHBondContact OE2-NZ 2.84Å; E215-P268 WeakPolarHBondContact OE1-CG 3.49Å
216	E	94.1	Very high	89.3	Confident	77 Å²	77	72.1 Å²	72.1	36%	0.36	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	123.5	178.7	-73.3	175.6	174.4	0	0	109.6	Y185 I203 R205	Y185-E216 WeakPolarHBondContact CE1-OE1 3.45Å; Y185-E216 VanDerWaalsContact CZ-OE1 3.3Å; Y185-E216 PolarHBondContact OH-OE1 2.57Å; Y185-E216 PolarHBondContact OH-OE2 3.27Å; I203-E216 HydrophobicContact CG2-CB 4.06Å; I203-E216 HydrophobicContact CG2-CG 4.46Å; R205-E216 HydrophobicContact CG-CG 3.51Å; R205-E216 IonicContact NH1-OE1 2.65Å
217	K	93.9	Very high	89.2	Confident	4 Å²	4	76.6 Å²	76.6	2%	0.017	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	113	-178.2	-57.7	-68.7	175.2	-177.2	0	107.6	I203 F204 H206 E215 M266 P268 P269 V270	I203-K217 WeakPolarHBondContact CA-O 3.16Å; F204-K217 HydrophobicContact CD1-CB 3.94Å; F204-K217 HydrophobicContact CE1-CB 3.63Å; F204-K217 HydrophobicContact CE1-CG 4.33Å; F204-K217 HydrophobicContact CZ-CB 4.13Å; F204-K217 HydrophobicContact CZ-CG 4.33Å; F204-K217 PolarHBondContact N-O 2.89Å; F204-K217 PolarHBondContact O-N 3.44Å; H206-K217 HydrophobicContact CB-CG 3.87Å; E215-K217 VanDerWaalsContact CD-CE 3.45Å; E215-K217 WeakPolarHBondContact OE1-CE 3.46Å; E215-K217 IonicContact OE1-NZ 2.65Å; E215-K217 PolarHBondContact OE1-NZ 2.81Å; E215-K217 WeakPolarHBondContact OE2-CE 3.39Å; E215-K217 IonicContact OE2-NZ 3.54Å; E215-K217 PolarHBondContact OE2-NZ 2.84Å; K217-M266 HydrophobicContact CB-CB 4.45Å; K217-M266 HydrophobicContact CB-SD 4.35Å; K217-P268 WeakPolarHBondContact CD-O 3.45Å; K217-P269 PolarHBondContact NZ-O 2.68Å; K217-V270 HydrophobicContact CG-CG2 4.43Å
218	H	94.8	Very high	89.1	Confident	72 Å²	72	74.8 Å²	74.8	33%	0.333	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	132.9	-175.7	-56.8	-108.6	0	0	0	110.2	I203 M266 T267	I203-H218 WeakPolarHBondContact CD1-ND1 3.26Å; I203-H218 WeakPolarHBondContact CG1-ND1 3.44Å; H218-M266 CarbonylContact O-C 3.56Å; H218-M266 WeakPolarHBondContact O-CA 3.27Å; H218-T267 WeakPolarHBondContact CB-O 3.28Å; H218-T267 PolarHBondContact N-O 3.19Å; H218-T267 PolarHBondContact O-N 2.91Å
219	A	94	Very high	89.2	Confident	20 Å²	20	75.8 Å²	75.8	17%	0.165	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	148.9	171.5	0	0	0	0	0	111.1	F202 F248 D265 M266	F202-A219 HydrophobicContact CB-CB 3.97Å; F202-A219 HydrophobicContact CD1-CB 3.89Å; F202-A219 HydrophobicContact CG-CB 4.32Å; F202-A219 WeakPolarHBondContact O-CB 3.25Å; F202-A219 PolarHBondContact O-N 3.47Å; A219-F248 HydrophobicContact CB-CE2 4.38Å; A219-F248 HydrophobicContact CB-CZ 4.17Å; A219-D265 WeakPolarHBondContact CA-O 3.45Å; A219-M266 VanDerWaalsContact CA-SD 3.6Å; A219-M266 HydrophobicContact CB-CE 3.81Å; A219-M266 HydrophobicContact CB-SD 4.21Å; A219-M266 PolarHBondContact N-SD 3.11Å; A219-M266 VanDerWaalsContact N-SD 3.38Å
220	K	91.9	Very high	89.2	Confident	96 Å²	96	71.8 Å²	71.8	42%	0.417	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-55.8	144.3	165.8	-68.9	170.7	-173	160.7	0	109.9	N258 N264 D265	K220-N258 PolarHBondContact O-ND2 3.4Å; K220-N264 WeakPolarHBondContact CE-O 3.35Å; K220-N264 PolarHBondContact NZ-O 3.46Å; K220-D265 HydrophobicContact CD-CB 4.14Å; K220-D265 PolarHBondContact N-O 2.9Å; K220-D265 IonicContact NZ-OD1 2.67Å; K220-D265 PolarHBondContact NZ-OD1 3.02Å
221	R	88.4	Confident	89.3	Confident	151 Å²	151	69.6 Å²	69.6	57%	0.57	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-58.3	144.4	173.1	-65.9	179.9	-179.6	-116.5	6.9	109.5	D197	D197-R221 IonicContact OD1-CZ 2.71Å; D197-R221 VanDerWaalsContact OD1-CZ 3.23Å; D197-R221 IonicContact OD1-NH1 3.2Å; D197-R221 PolarHBondContact OD1-NH1 2.99Å; D197-R221 IonicContact OD1-NH2 3.53Å; D197-R221 PolarHBondContact OD1-NH2 3.04Å; D197-R221 IonicContact OD2-NH2 3.41Å; D197-R221 PolarHBondContact OD2-NH2 2.98Å
222	P	87.7	Confident	89.4	Confident	20 Å²	20	69.7 Å²	69.7	13%	0.13	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-67.5	152.5	169.9	29.2	-33.7	0	0	0	111.3	A224 L226 V257 N258	P222-A224 VanDerWaalsContact C-N 3.28Å; P222-L226 HydrophobicContact CG-CD1 3.88Å; P222-L226 HydrophobicContact CG-CD2 4.12Å; P222-L226 HydrophobicContact CG-CG 4.14Å; P222-V257 WeakPolarHBondContact CB-O 3.39Å; P222-N258 HydrophobicContact CB-CB 4.05Å
223	D	82.4	Confident	89.6	Confident	176 Å²	176	73.6 Å²	73.6	94%	0.941	36%	0.364	S	S	*	.	S	Bend	trans	-79.5	-10.5	172	-61.1	-48.8	0	0	0	112.9
224	A	85.8	Confident	89.6	Confident	42 Å²	42	71.8 Å²	71.8	35%	0.347	35%	0.351	S	S	.	.	S	Bend	trans	-76.8	139.2	178.5	0	0	0	0	0	112	P222 L226 V257	P222-A224 VanDerWaalsContact C-N 3.28Å; A224-L226 PolarHBondContact O-N 2.97Å; A224-V257 HydrophobicContact CB-CB 4.28Å; A224-V257 HydrophobicContact CB-CG1 4.49Å
225	D	87.1	Confident	89.7	Confident	112 Å²	112	67.1 Å²	67.1	60%	0.599	33%	0.334	S	S	*	.			trans	-66.5	116.1	171.5	-176.8	13	0	0	0	110.2	K227	D225-K227 WeakPolarHBondContact OD1-CB 3.47Å; D225-K227 PolarHBondContact OD1-N 3.26Å
226	L	88.8	Confident	89.9	Confident	10 Å²	10	64 Å²	64	5%	0.052	32%	0.319	C	S	.	.			trans	-88.9	-10.3	178.6	-59.5	-179.5	0	0	0	113.1	L200 P222 A224 T228 Y229 F230	L200-L226 HydrophobicContact CB-CD1 3.78Å; P222-L226 HydrophobicContact CG-CD1 3.88Å; P222-L226 HydrophobicContact CG-CD2 4.12Å; P222-L226 HydrophobicContact CG-CG 4.14Å; A224-L226 PolarHBondContact O-N 2.97Å; L226-T228 VanDerWaalsContact C-N 3.29Å; L226-T228 PolarHBondContact O-N 3.39Å; L226-Y229 HydrophobicContact CB-CD2 4.35Å; L226-Y229 HydrophobicContact CD2-CD2 4.15Å; L226-Y229 HydrophobicContact CD2-CE2 4.11Å; L226-Y229 WeakPolarHBondContact O-CD2 3.42Å; L226-Y229 PolarHBondContact O-N 2.84Å; L226-F230 HydrophobicContact CB-CE2 4.17Å; L226-F230 VanDerWaalsContact O-CD2 3.32Å; L226-F230 WeakPolarHBondContact O-CD2 3.32Å
227	K	89.6	Confident	90	Very high	104 Å²	104	60.3 Å²	60.3	45%	0.452	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-57.9	-35.8	-166	-179.7	173.4	178.7	175.8	0	114.2	Y198 D225 F230 T231	Y198-K227 HydrophobicContact CE1-CB 4.4Å; Y198-K227 HydrophobicContact CE1-CG 4.11Å; Y198-K227 HydrophobicContact CE2-CB 4.46Å; Y198-K227 HydrophobicContact CE2-CD 4.44Å; Y198-K227 HydrophobicContact CE2-CG 4.15Å; D225-K227 WeakPolarHBondContact OD1-CB 3.47Å; D225-K227 PolarHBondContact OD1-N 3.26Å; K227-F230 PolarHBondContact O-N 2.88Å; K227-T231 WeakPolarHBondContact O-CG2 3.35Å; K227-T231 PolarHBondContact O-OG1 2.85Å
228	T	88.8	Confident	90.1	Very high	69 Å²	69	60.3 Å²	60.3	42%	0.423	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-56.7	-49.6	178.1	47.2	0	0	0	0	111.6	L226 F230 T231 D232	L226-T228 VanDerWaalsContact C-N 3.29Å; L226-T228 PolarHBondContact O-N 3.39Å; T228-F230 PolarHBondContact O-N 2.87Å; T228-T231 PolarHBondContact O-N 3.24Å; T228-T231 PolarHBondContact O-OG1 2.83Å; T228-D232 PolarHBondContact O-N 3.06Å; T228-D232 VanDerWaalsContact O-N 3.09Å
229	Y	89.9	Confident	90.2	Very high	40 Å²	40	56.9 Å²	56.9	16%	0.157	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-63.4	-5.8	-175.7	-48.1	-60.8	0	0	0	115.6	L226 H236 V252	L226-Y229 HydrophobicContact CB-CD2 4.35Å; L226-Y229 HydrophobicContact CD2-CD2 4.15Å; L226-Y229 HydrophobicContact CD2-CE2 4.11Å; L226-Y229 WeakPolarHBondContact O-CD2 3.42Å; L226-Y229 PolarHBondContact O-N 2.84Å; Y229-H236 AromaticContact CD1-CE1 3.75Å; Y229-H236 AromaticContact CD1-CG 3.85Å; Y229-H236 AromaticContact CD1-ND1 3.6Å; Y229-H236 PolarHBondContact O-CD2 2.99Å; Y229-V252 HydrophobicContact CD1-CG1 3.75Å; Y229-V252 HydrophobicContact CD2-CG1 4.13Å; Y229-V252 HydrophobicContact CE1-CB 4.5Å; Y229-V252 HydrophobicContact CE1-CG1 3.61Å; Y229-V252 HydrophobicContact CE2-CB 4.37Å; Y229-V252 HydrophobicContact CE2-CG1 4.03Å; Y229-V252 HydrophobicContact CG-CG1 4.01Å
230	F	88.8	Confident	90.4	Very high	4 Å²	4	56 Å²	56	2%	0.018	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-116.8	-1.2	176.8	-64.9	-101.9	0	0	0	113.1	F154 I158 P191 K193 Y198 K199 L226 K227 T228	F154-F230 HydrophobicContact CD2-CD1 4.36Å; F154-F230 AromaticContact CE2-CD1 3.61Å; F154-F230 HydrophobicContact CE2-CD1 3.61Å; F154-F230 HydrophobicContact CE2-CE1 4.08Å; F154-F230 HydrophobicContact CE2-CG 4.13Å; F154-F230 AromaticContact CZ-CD1 3.82Å; F154-F230 HydrophobicContact CZ-CD1 3.82Å; F154-F230 AromaticContact CZ-CE1 3.99Å; F154-F230 HydrophobicContact CZ-CE1 3.99Å; I158-F230 HydrophobicContact CG2-CB 4.06Å; I158-F230 HydrophobicContact CG2-CD1 3.87Å; I158-F230 HydrophobicContact CG2-CG 4.47Å; P191-F230 HydrophobicContact CB-CE1 3.62Å; P191-F230 HydrophobicContact CB-CE2 4.39Å; P191-F230 HydrophobicContact CB-CZ 3.44Å; P191-F230 VanDerWaalsContact CB-CZ 3.44Å; K193-F230 HydrophobicContact CB-CD1 3.73Å; K193-F230 HydrophobicContact CB-CE1 3.77Å; K193-F230 HydrophobicContact CD-CB 4.21Å; K193-F230 HydrophobicContact CD-CD1 4.19Å; K193-F230 HydrophobicContact CD-CG 4.43Å; K193-F230 HydrophobicContact CG-CD1 4.48Å; Y198-F230 HydrophobicContact CD1-CB 3.95Å; Y198-F230 AromaticContact CD1-CD2 3.73Å; Y198-F230 HydrophobicContact CD1-CD2 3.73Å; Y198-F230 HydrophobicContact CD1-CE2 4.31Å; Y198-F230 AromaticContact CD1-CG 3.87Å; Y198-F230 HydrophobicContact CD1-CG 3.87Å; Y198-F230 HydrophobicContact CE1-CB 3.92Å; Y198-F230 HydrophobicContact CE1-CG 4.34Å; K199-F230 WeakPolarHBondContact O-CZ 3.27Å; L226-F230 HydrophobicContact CB-CE2 4.17Å; L226-F230 VanDerWaalsContact O-CD2 3.32Å; L226-F230 WeakPolarHBondContact O-CD2 3.32Å; K227-F230 PolarHBondContact O-N 2.88Å; T228-F230 PolarHBondContact O-N 2.87Å
231	T	87.1	Confident	90.7	Very high	68 Å²	68	52 Å²	52	42%	0.417	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.6	-21.4	-168	56.3	0	0	0	0	115.4	Y198 K227 T228 K233	Y198-T231 HydrophobicContact CE1-CG2 4.44Å; K227-T231 WeakPolarHBondContact O-CG2 3.35Å; K227-T231 PolarHBondContact O-OG1 2.85Å; T228-T231 PolarHBondContact O-N 3.24Å; T228-T231 PolarHBondContact O-OG1 2.83Å; T231-K233 VanDerWaalsContact C-N 3.32Å
232	D	87.6	Confident	91	Very high	67 Å²	67	44.8 Å²	44.8	36%	0.358	23%	0.234	S	C	.	.	S	Bend	trans	-79.8	-11	177.2	73.1	-5.1	0	0	0	114.3	T228 K234 H236	T228-D232 PolarHBondContact O-N 3.06Å; T228-D232 VanDerWaalsContact O-N 3.09Å; D232-K234 VanDerWaalsContact C-N 3.28Å; D232-K234 HydrophobicContact CB-CG 4.46Å; D232-K234 PolarHBondContact O-N 3.17Å; D232-K234 PolarHBondContact OD1-N 2.92Å; D232-H236 IonicContact OD1-CE1 2.9Å; D232-H236 IonicContact OD1-NE2 3.83Å; D232-H236 PolarHBondContact OD1-NE2 3.48Å; D232-H236 IonicContact OD2-CE1 3.79Å; D232-H236 PolarHBondContact OD2-CE1 2.96Å; D232-H236 IonicContact OD2-NE2 2.68Å; D232-H236 PolarHBondContact OD2-NE2 2.85Å
233	K	89.5	Confident	91.4	Very high	113 Å²	113	45.7 Å²	45.7	49%	0.491	24%	0.238	S	C	.	.			trans	64.8	21.7	-177.6	-50.9	170.4	177.7	178.6	0	114.6	N153 Q155 T231	N153-K233 PolarHBondContact ND2-O 3.42Å; N153-K233 PolarHBondContact OD1-O 2.84Å; Q155-K233 WeakPolarHBondContact O-CD 3.34Å; T231-K233 VanDerWaalsContact C-N 3.32Å
234	K	89.9	Confident	92	Very high	83 Å²	83	39.7 Å²	39.7	36%	0.361	21%	0.208	S	C	.	.			trans	-91.6	170.9	178.3	-64.9	-176.2	176.7	-179.9	0	111.8	N153 D232 E466	N153-K234 PolarHBondContact ND2-O 2.89Å; D232-K234 VanDerWaalsContact C-N 3.28Å; D232-K234 HydrophobicContact CB-CG 4.46Å; D232-K234 PolarHBondContact O-N 3.17Å; D232-K234 PolarHBondContact OD1-N 2.92Å; K234-E466 IonicContact NZ-OE1 2.82Å; K234-E466 PolarHBondContact NZ-OE1 2.99Å
235	T	92	Very high	92.3	Very high	9 Å²	9	42.5 Å²	42.5	6%	0.055	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	112.9	179.3	-52.8	0	0	0	0	109.4	M109 E151 N153 W455	M109-T235 PolarHBondContact SD-OG1 2.88Å; M109-T235 VanDerWaalsContact SD-OG1 3.4Å; E151-T235 HydrophobicContact CB-CG2 3.9Å; E151-T235 HydrophobicContact CG-CG2 4.21Å; E151-T235 WeakPolarHBondContact OE2-CG2 3.37Å; N153-T235 HydrophobicContact CB-CG2 4.34Å; N153-T235 WeakPolarHBondContact CB-OG1 3.21Å; N153-T235 PolarHBondContact ND2-N 2.96Å; N153-T235 PolarHBondContact ND2-OG1 2.98Å; T235-W455 PolarHBondContact O-NE1 2.88Å
236	H	95.1	Very high	92.6	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.028	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	142.9	-178.7	-62.2	-63.4	0	0	0	112.1	E151 V152 Y229 D232 Y238 V252 D253	E151-H236 WeakPolarHBondContact CA-O 3.48Å; V152-H236 PolarHBondContact N-O 3.15Å; V152-H236 PolarHBondContact O-N 2.83Å; Y229-H236 AromaticContact CD1-CE1 3.75Å; Y229-H236 AromaticContact CD1-CG 3.85Å; Y229-H236 AromaticContact CD1-ND1 3.6Å; Y229-H236 PolarHBondContact O-CD2 2.99Å; D232-H236 IonicContact OD1-CE1 2.9Å; D232-H236 IonicContact OD1-NE2 3.83Å; D232-H236 PolarHBondContact OD1-NE2 3.48Å; D232-H236 IonicContact OD2-CE1 3.79Å; D232-H236 PolarHBondContact OD2-CE1 2.96Å; D232-H236 IonicContact OD2-NE2 2.68Å; D232-H236 PolarHBondContact OD2-NE2 2.85Å; H236-Y238 HydrophobicContact CB-CD2 4.45Å; H236-Y238 HydrophobicContact CB-CE2 3.69Å; H236-Y238 WeakPolarHBondContact O-CD2 3.45Å; H236-V252 HydrophobicContact CB-CG1 4.33Å; H236-D253 WeakPolarHBondContact CA-OD1 3.11Å; H236-D253 WeakPolarHBondContact CB-OD1 3.35Å; H236-D253 IonicContact CE1-OD2 2.7Å; H236-D253 IonicContact CG-OD1 2.76Å; H236-D253 IonicContact ND1-OD1 3.81Å; H236-D253 PolarHBondContact ND1-OD1 3.04Å; H236-D253 IonicContact ND1-OD2 3.44Å; H236-D253 PolarHBondContact ND1-OD2 2.65Å
237	L	96.4	Very high	92.9	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	108.8	-175.8	-174.7	70.2	0	0	0	110.3	Q149 E151 V252 D253 Q254 A451 W455	Q149-L237 HydrophobicContact CG-CD1 3.55Å; Q149-L237 HydrophobicContact CG-CD2 4.42Å; Q149-L237 HydrophobicContact CG-CG 3.94Å; E151-L237 HydrophobicContact CG-CD1 3.73Å; L237-V252 CarbonylContact O-C 3.34Å; L237-V252 WeakPolarHBondContact O-CA 3.32Å; L237-D253 PolarHBondContact N-OD1 3.27Å; L237-D253 PolarHBondContact O-N 2.92Å; L237-Q254 HydrophobicContact CD2-CG 4.28Å; L237-A451 HydrophobicContact CD2-CB 3.69Å; L237-W455 HydrophobicContact CB-CB 4.43Å; L237-W455 HydrophobicContact CB-CD2 3.77Å; L237-W455 HydrophobicContact CB-CE3 4.38Å; L237-W455 HydrophobicContact CB-CG 3.8Å; L237-W455 HydrophobicContact CB-CZ2 4.41Å; L237-W455 HydrophobicContact CD1-CB 4.08Å; L237-W455 HydrophobicContact CD1-CG 4.33Å; L237-W455 HydrophobicContact CD2-CB 4.23Å; L237-W455 HydrophobicContact CD2-CD2 3.99Å; L237-W455 HydrophobicContact CD2-CE3 3.86Å; L237-W455 HydrophobicContact CD2-CG 4.18Å; L237-W455 HydrophobicContact CD2-CZ3 4.47Å; L237-W455 HydrophobicContact CG-CB 4.49Å; L237-W455 HydrophobicContact CG-CD2 4.43Å; L237-W455 HydrophobicContact CG-CG 4.34Å
238	Y	97	Very high	93.1	Very high	3 Å²	3	33.7 Å²	33.7	1%	0.012	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	120.9	-179.1	-66.1	-91.2	0	0	0	110.2	Q149 Y150 V152 P191 L200 H236 V252	Q149-Y238 VanDerWaalsContact CA-O 3.26Å; Q149-Y238 WeakPolarHBondContact CA-O 3.34Å; Y150-Y238 PolarHBondContact N-O 2.76Å; Y150-Y238 PolarHBondContact O-N 2.78Å; V152-Y238 HydrophobicContact CB-CD2 4.2Å; V152-Y238 HydrophobicContact CB-CE2 3.91Å; V152-Y238 HydrophobicContact CG2-CD2 4.03Å; V152-Y238 HydrophobicContact CG2-CE2 4.17Å; P191-Y238 HydrophobicContact CB-CE1 3.86Å; P191-Y238 HydrophobicContact CG-CD1 4.22Å; P191-Y238 HydrophobicContact CG-CD2 4.22Å; P191-Y238 HydrophobicContact CG-CE1 3.82Å; P191-Y238 HydrophobicContact CG-CE2 3.84Å; P191-Y238 HydrophobicContact CG-CG 4.4Å; L200-Y238 HydrophobicContact CD1-CD1 3.83Å; L200-Y238 HydrophobicContact CD1-CE1 4.19Å; L200-Y238 HydrophobicContact CD2-CD1 4.37Å; H236-Y238 HydrophobicContact CB-CD2 4.45Å; H236-Y238 HydrophobicContact CB-CE2 3.69Å; H236-Y238 WeakPolarHBondContact O-CD2 3.45Å; Y238-V252 HydrophobicContact CD1-CG2 3.8Å; Y238-V252 HydrophobicContact CE1-CG1 4.28Å; Y238-V252 HydrophobicContact CE1-CG2 3.87Å
239	T	97.5	Very high	93.5	Very high	1 Å²	1	34 Å²	34	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.9	-178.3	-49.6	0	0	0	0	111	I147 V148 Q149 I250 L251	I147-T239 HydrophobicContact CG2-CG2 4.19Å; V148-T239 CarbonylContact O-C 3.59Å; V148-T239 WeakPolarHBondContact O-CA 3.46Å; Q149-T239 HydrophobicContact CB-CG2 4.23Å; Q149-T239 PolarHBondContact OE1-OG1 2.94Å; T239-I250 WeakPolarHBondContact O-CA 3.45Å; T239-L251 HydrophobicContact CG2-CD1 4.4Å; T239-L251 PolarHBondContact N-O 2.71Å; T239-L251 PolarHBondContact O-N 2.68Å
240	L	97.5	Very high	93.8	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	122.5	167	173.7	66.1	0	0	0	109	I147 V148 I187 F189 F202 I250	I147-L240 WeakPolarHBondContact CA-O 3.48Å; V148-L240 PolarHBondContact N-O 3.26Å; V148-L240 PolarHBondContact O-N 3.03Å; I187-L240 HydrophobicContact CG2-CD2 4.06Å; F189-L240 HydrophobicContact CB-CD2 4.05Å; F189-L240 HydrophobicContact CD1-CB 3.75Å; F189-L240 HydrophobicContact CD2-CB 3.89Å; F189-L240 HydrophobicContact CD2-CD2 4.2Å; F189-L240 HydrophobicContact CD2-CG 4.43Å; F189-L240 HydrophobicContact CE1-CB 3.73Å; F189-L240 HydrophobicContact CE2-CB 3.89Å; F189-L240 HydrophobicContact CG-CB 3.84Å; F189-L240 HydrophobicContact CG-CD2 3.98Å; F189-L240 HydrophobicContact CG-CG 4.48Å; F189-L240 HydrophobicContact CZ-CB 3.81Å; F202-L240 HydrophobicContact CD1-CD1 4.14Å; F202-L240 HydrophobicContact CD2-CD1 4.01Å; F202-L240 HydrophobicContact CD2-CD2 3.72Å; F202-L240 HydrophobicContact CE1-CD1 4.18Å; F202-L240 HydrophobicContact CE2-CD1 4.07Å; F202-L240 HydrophobicContact CE2-CD2 3.65Å; F202-L240 HydrophobicContact CG-CD1 4.07Å; F202-L240 HydrophobicContact CZ-CD1 4.16Å; F202-L240 HydrophobicContact CZ-CD2 4.4Å; L240-I250 HydrophobicContact CD1-CG1 3.99Å
241	I	97	Very high	94.1	Very high	12 Å²	12	32.2 Å²	32.2	6%	0.062	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	132.9	160.9	-41.5	179.9	0	0	0	108	I147 F248 E249 L251 R444	I147-I241 HydrophobicContact CG1-CG2 4.31Å; I241-F248 VanDerWaalsContact O-CA 3.32Å; I241-F248 WeakPolarHBondContact O-CA 3.34Å; I241-E249 HydrophobicContact CB-CB 4.26Å; I241-E249 HydrophobicContact CD1-CB 4.16Å; I241-E249 WeakPolarHBondContact CD1-OE2 3.32Å; I241-E249 HydrophobicContact CG1-CB 4.34Å; I241-E249 PolarHBondContact N-O 3.32Å; I241-E249 PolarHBondContact O-N 3.4Å; I241-L251 HydrophobicContact CD1-CD1 3.92Å; I241-L251 HydrophobicContact CG1-CD1 3.94Å; I241-R444 VanDerWaalsContact CD1-NH1 3.29Å
242	L	96.6	Very high	94.5	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	118.9	167.6	179.5	66.5	0	0	0	110	F141 P145 L146 I187 F202 F248 L262 F414 M416	F141-L242 HydrophobicContact CE1-CD2 4.35Å; P145-L242 CarbonylContact C-O 3.29Å; P145-L242 VanDerWaalsContact CA-O 3.27Å; P145-L242 WeakPolarHBondContact CA-O 3.33Å; P145-L242 WeakPolarHBondContact CB-O 3.4Å; L146-L242 HydrophobicContact CB-CB 4.41Å; L146-L242 PolarHBondContact N-O 2.92Å; L146-L242 PolarHBondContact O-N 3.42Å; I187-L242 HydrophobicContact CD1-CD2 4.21Å; F202-L242 HydrophobicContact CZ-CD1 4.31Å; L242-F248 HydrophobicContact CD1-CB 3.83Å; L242-L262 HydrophobicContact CD1-CD1 4.07Å; L242-L262 HydrophobicContact CD1-CD2 3.77Å; L242-L262 HydrophobicContact CD1-CG 4.03Å; L242-F414 HydrophobicContact CD1-CD2 4.48Å; L242-F414 HydrophobicContact CD2-CD2 3.97Å; L242-F414 HydrophobicContact CD2-CE2 4.1Å; L242-F414 HydrophobicContact CG-CD2 3.8Å; L242-F414 HydrophobicContact CG-CE2 3.88Å; L242-M416 HydrophobicContact CD2-CE 3.58Å; L242-M416 HydrophobicContact CD2-SD 4.49Å
243	N	95.3	Very high	94.8	Very high	40 Å²	40	26.8 Å²	26.8	21%	0.214	14%	0.136	C	C	.	.			trans	-97.6	154.1	-173.3	-65.6	-44.9	0	0	0	112.7	D245 N246 S247 F414	N243-D245 WeakPolarHBondContact CB-OD1 3.43Å; N243-D245 PolarHBondContact O-N 2.98Å; N243-D245 VanDerWaalsContact O-N 3.13Å; N243-N246 PolarHBondContact O-N 2.96Å; N243-N246 VanDerWaalsContact O-N 3.1Å; N243-S247 WeakPolarHBondContact CB-OG 3.26Å; N243-S247 PolarHBondContact N-O 2.91Å; N243-S247 PolarHBondContact ND2-OG 3.45Å; N243-F414 WeakPolarHBondContact O-CD2 3.44Å
244	P	93.9	Very high	94.9	Very high	49 Å²	49	24.7 Å²	24.7	32%	0.318	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-12.2	179.4	-21.4	33.6	0	0	0	115.9	T143 N246 F414	T143-P244 WeakPolarHBondContact O-CG 3.43Å; P244-N246 PolarHBondContact O-N 3.25Å; P244-F414 HydrophobicContact CB-CD1 4.18Å; P244-F414 HydrophobicContact CB-CE1 4.1Å; P244-F414 HydrophobicContact CB-CZ 4.48Å; P244-F414 HydrophobicContact CG-CE1 4.22Å; P244-F414 HydrophobicContact CG-CZ 4.22Å
245	D	92.6	Very high	95	Very high	102 Å²	102	24.1 Å²	24.1	55%	0.545	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	9.5	174.2	65.4	-2.8	0	0	0	113.2	N243 S247 N261	N243-D245 WeakPolarHBondContact CB-OD1 3.43Å; N243-D245 PolarHBondContact O-N 2.98Å; N243-D245 VanDerWaalsContact O-N 3.13Å; D245-S247 PolarHBondContact O-N 3.41Å; D245-S247 VanDerWaalsContact OD1-CB 3.27Å; D245-S247 WeakPolarHBondContact OD1-CB 3.37Å; D245-S247 PolarHBondContact OD1-N 2.84Å; D245-S247 PolarHBondContact OD1-OG 3.38Å; D245-S247 PolarHBondContact OD2-OG 3.38Å; D245-N261 PolarHBondContact O-ND2 2.95Å
246	N	93	Very high	95.1	Very high	11 Å²	11	27.6 Å²	27.6	6%	0.059	16%	0.155	C	C	.	.	S	Bend	trans	68.1	8.6	-173	-42.1	-72.9	0	0	0	114.8	N243 P244 N261 L262 L411 P413 F414	N243-N246 PolarHBondContact O-N 2.96Å; N243-N246 VanDerWaalsContact O-N 3.1Å; P244-N246 PolarHBondContact O-N 3.25Å; N246-N261 VanDerWaalsContact C-ND2 3.33Å; N246-N261 CarbonylContact O-C 3.6Å; N246-N261 VanDerWaalsContact O-CA 3.31Å; N246-N261 WeakPolarHBondContact O-CA 3.31Å; N246-N261 VanDerWaalsContact O-CG 3.31Å; N246-N261 PolarHBondContact O-ND2 2.89Å; N246-L262 HydrophobicContact CB-CB 4.13Å; N246-L262 HydrophobicContact CB-CD1 4.24Å; N246-L262 HydrophobicContact CB-CG 4.15Å; N246-L262 PolarHBondContact O-N 3.46Å; N246-L411 PolarHBondContact ND2-O 3.42Å; N246-P413 HydrophobicContact CB-CG 4.47Å; N246-P413 WeakPolarHBondContact OD1-CD 3.26Å; N246-P413 WeakPolarHBondContact OD1-CG 3.38Å; N246-F414 WeakPolarHBondContact OD1-CB 3.42Å; N246-F414 PolarHBondContact OD1-N 3.06Å
247	S	95.3	Very high	95	Very high	27 Å²	27	28.1 Å²	28.1	19%	0.189	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	146.4	167.9	67.7	0	0	0	0	111.2	N243 D245 G260	N243-S247 WeakPolarHBondContact CB-OG 3.26Å; N243-S247 PolarHBondContact N-O 2.91Å; N243-S247 PolarHBondContact ND2-OG 3.45Å; D245-S247 PolarHBondContact O-N 3.41Å; D245-S247 VanDerWaalsContact OD1-CB 3.27Å; D245-S247 WeakPolarHBondContact OD1-CB 3.37Å; D245-S247 PolarHBondContact OD1-N 2.84Å; D245-S247 PolarHBondContact OD1-OG 3.38Å; D245-S247 PolarHBondContact OD2-OG 3.38Å; S247-G260 WeakPolarHBondContact CA-O 3.18Å
248	F	95.6	Very high	94.9	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.009	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	148.8	172.5	70.6	-92.1	0	0	0	110.7	F202 A219 I241 L242 I250 S259 G260 L262 D265 M266	F202-F248 AromaticContact CD1-CD2 3.76Å; F202-F248 HydrophobicContact CD1-CD2 3.76Å; F202-F248 AromaticContact CD1-CE2 3.99Å; F202-F248 HydrophobicContact CD1-CE2 3.99Å; F202-F248 HydrophobicContact CD1-CG 4.08Å; F202-F248 HydrophobicContact CD1-CZ 4.46Å; F202-F248 HydrophobicContact CE1-CB 3.84Å; F202-F248 AromaticContact CE1-CD1 3.94Å; F202-F248 HydrophobicContact CE1-CD1 3.94Å; F202-F248 AromaticContact CE1-CD2 3.78Å; F202-F248 HydrophobicContact CE1-CD2 3.78Å; F202-F248 HydrophobicContact CE1-CE1 4.43Å; F202-F248 HydrophobicContact CE1-CE2 4.3Å; F202-F248 AromaticContact CE1-CG 3.58Å; F202-F248 HydrophobicContact CE1-CG 3.58Å; A219-F248 HydrophobicContact CB-CE2 4.38Å; A219-F248 HydrophobicContact CB-CZ 4.17Å; I241-F248 VanDerWaalsContact O-CA 3.32Å; I241-F248 WeakPolarHBondContact O-CA 3.34Å; L242-F248 HydrophobicContact CD1-CB 3.83Å; F248-I250 HydrophobicContact CD2-CD1 4.5Å; F248-I250 HydrophobicContact CD2-CG1 4.23Å; F248-I250 HydrophobicContact CE2-CD1 4.42Å; F248-S259 VanDerWaalsContact O-CA 3.31Å; F248-S259 WeakPolarHBondContact O-CA 3.05Å; F248-G260 WeakPolarHBondContact CD1-O 3.42Å; F248-G260 VanDerWaalsContact CE1-C 3.44Å; F248-G260 PolarHBondContact N-O 3.39Å; F248-G260 PolarHBondContact O-N 2.95Å; F248-L262 HydrophobicContact CD1-CD2 4.17Å; F248-D265 HydrophobicContact CE1-CB 4.12Å; F248-D265 HydrophobicContact CZ-CB 4.21Å; F248-M266 HydrophobicContact CD1-CE 4.23Å; F248-M266 HydrophobicContact CE1-CE 3.8Å; F248-M266 HydrophobicContact CZ-CE 4.2Å
249	E	95.7	Very high	94.8	Very high	75 Å²	75	32.6 Å²	32.6	35%	0.35	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	134.3	174.3	-62.6	-179	166.8	0	0	108.5	I241 L251	I241-E249 HydrophobicContact CB-CB 4.26Å; I241-E249 HydrophobicContact CD1-CB 4.16Å; I241-E249 WeakPolarHBondContact CD1-OE2 3.32Å; I241-E249 HydrophobicContact CG1-CB 4.34Å; I241-E249 PolarHBondContact N-O 3.32Å; I241-E249 PolarHBondContact O-N 3.4Å; E249-L251 HydrophobicContact CB-CD1 4.15Å
250	I	96.3	Very high	94.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122.6	173.8	-53.1	178.5	0	0	0	107.5	F189 L200 F202 T239 L240 F248 V257 N258	F189-I250 HydrophobicContact CE2-CD1 4.39Å; F189-I250 HydrophobicContact CE2-CG1 4.42Å; F189-I250 HydrophobicContact CE2-CG2 3.66Å; F189-I250 HydrophobicContact CZ-CG2 4Å; L200-I250 HydrophobicContact CD2-CG2 3.55Å; L200-I250 HydrophobicContact CG-CG2 4.09Å; F202-I250 HydrophobicContact CB-CD1 3.67Å; F202-I250 HydrophobicContact CD1-CD1 4.3Å; F202-I250 HydrophobicContact CG-CD1 4.3Å; T239-I250 WeakPolarHBondContact O-CA 3.45Å; L240-I250 HydrophobicContact CD1-CG1 3.99Å; F248-I250 HydrophobicContact CD2-CD1 4.5Å; F248-I250 HydrophobicContact CD2-CG1 4.23Å; F248-I250 HydrophobicContact CE2-CD1 4.42Å; I250-V257 HydrophobicContact CB-CG2 4.4Å; I250-V257 HydrophobicContact CG2-CG2 4.09Å; I250-V257 WeakPolarHBondContact O-CG2 3.43Å; I250-V257 PolarHBondContact O-N 3.24Å; I250-N258 HydrophobicContact CB-CB 3.95Å; I250-N258 HydrophobicContact CD1-CB 4.06Å; I250-N258 HydrophobicContact CG1-CB 4.19Å; I250-N258 PolarHBondContact N-O 3.26Å; I250-N258 PolarHBondContact O-N 3Å
251	L	95.4	Very high	94.4	Very high	7 Å²	7	35.2 Å²	35.2	4%	0.037	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	138.1	177.3	-54.1	80.4	0	0	0	109.7	T239 I241 E249 S255 V256	T239-L251 HydrophobicContact CG2-CD1 4.4Å; T239-L251 PolarHBondContact N-O 2.71Å; T239-L251 PolarHBondContact O-N 2.68Å; I241-L251 HydrophobicContact CD1-CD1 3.92Å; I241-L251 HydrophobicContact CG1-CD1 3.94Å; E249-L251 HydrophobicContact CB-CD1 4.15Å; L251-S255 CarbonylContact C-O 3.43Å; L251-S255 WeakPolarHBondContact CA-O 3.39Å; L251-V256 HydrophobicContact CD2-CG2 4.13Å; L251-V256 HydrophobicContact CG-CG2 3.96Å
252	V	95.4	Very high	94.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130.8	165.6	-179.2	0	0	0	0	106.9	L200 Y229 H236 L237 Y238 Q254 S255 V257	L200-V252 HydrophobicContact CD2-CG2 3.71Å; Y229-V252 HydrophobicContact CD1-CG1 3.75Å; Y229-V252 HydrophobicContact CD2-CG1 4.13Å; Y229-V252 HydrophobicContact CE1-CB 4.5Å; Y229-V252 HydrophobicContact CE1-CG1 3.61Å; Y229-V252 HydrophobicContact CE2-CB 4.37Å; Y229-V252 HydrophobicContact CE2-CG1 4.03Å; Y229-V252 HydrophobicContact CG-CG1 4.01Å; H236-V252 HydrophobicContact CB-CG1 4.33Å; L237-V252 CarbonylContact O-C 3.34Å; L237-V252 WeakPolarHBondContact O-CA 3.32Å; Y238-V252 HydrophobicContact CD1-CG2 3.8Å; Y238-V252 HydrophobicContact CE1-CG1 4.28Å; Y238-V252 HydrophobicContact CE1-CG2 3.87Å; V252-Q254 VanDerWaalsContact C-N 3.27Å; V252-Q254 PolarHBondContact O-N 2.65Å; V252-S255 PolarHBondContact N-O 2.88Å; V252-S255 WeakPolarHBondContact O-CA 3.46Å; V252-S255 WeakPolarHBondContact O-CB 3.43Å; V252-S255 PolarHBondContact O-N 3.29Å; V252-S255 VanDerWaalsContact O-O 3.12Å; V252-V257 HydrophobicContact CB-CG1 4.01Å; V252-V257 HydrophobicContact CB-CG2 4.46Å; V252-V257 HydrophobicContact CG2-CG1 4.16Å; V252-V257 HydrophobicContact CG2-CG2 3.78Å
253	D	93.6	Very high	93.8	Very high	22 Å²	22	36.7 Å²	36.7	12%	0.118	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	41.9	179.9	-72.1	14.5	0	0	0	113.1	H236 L237 S255 W455 K459	H236-D253 WeakPolarHBondContact CA-OD1 3.11Å; H236-D253 WeakPolarHBondContact CB-OD1 3.35Å; H236-D253 IonicContact CE1-OD2 2.7Å; H236-D253 IonicContact CG-OD1 2.76Å; H236-D253 IonicContact ND1-OD1 3.81Å; H236-D253 PolarHBondContact ND1-OD1 3.04Å; H236-D253 IonicContact ND1-OD2 3.44Å; H236-D253 PolarHBondContact ND1-OD2 2.65Å; L237-D253 PolarHBondContact N-OD1 3.27Å; L237-D253 PolarHBondContact O-N 2.92Å; D253-S255 PolarHBondContact O-N 3.03Å; D253-S255 VanDerWaalsContact O-N 3.11Å; D253-W455 HydrophobicContact CB-CH2 3.67Å; D253-W455 HydrophobicContact CB-CZ2 3.52Å; D253-W455 WeakPolarHBondContact OD1-CZ2 3.23Å; D253-K459 IonicContact OD2-NZ 2.91Å; D253-K459 PolarHBondContact OD2-NZ 2.7Å
254	Q	91.1	Very high	93.4	Very high	69 Å²	69	40.4 Å²	40.4	32%	0.322	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	6.4	-171.9	-54.3	-176.5	20	0	0	115.6	L237 V252 N452 W455	L237-Q254 HydrophobicContact CD2-CG 4.28Å; V252-Q254 VanDerWaalsContact C-N 3.27Å; V252-Q254 PolarHBondContact O-N 2.65Å; Q254-N452 PolarHBondContact NE2-OD1 3.1Å; Q254-W455 HydrophobicContact CG-CE3 4.5Å; Q254-W455 HydrophobicContact CG-CZ3 3.85Å
255	S	92.4	Very high	93.3	Very high	70 Å²	70	40 Å²	40	49%	0.49	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	131.1	177.5	-56.2	0	0	0	0	110.8	L251 V252 D253 V257	L251-S255 CarbonylContact C-O 3.43Å; L251-S255 WeakPolarHBondContact CA-O 3.39Å; V252-S255 PolarHBondContact N-O 2.88Å; V252-S255 WeakPolarHBondContact O-CA 3.46Å; V252-S255 WeakPolarHBondContact O-CB 3.43Å; V252-S255 PolarHBondContact O-N 3.29Å; V252-S255 VanDerWaalsContact O-O 3.12Å; D253-S255 PolarHBondContact O-N 3.03Å; D253-S255 VanDerWaalsContact O-N 3.11Å; S255-V257 PolarHBondContact O-N 3.06Å
256	V	94.6	Very high	93.2	Very high	82 Å²	82	35.4 Å²	35.4	50%	0.497	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	117.6	178.1	-175.9	0	0	0	0	109.7	L251	L251-V256 HydrophobicContact CD2-CG2 4.13Å; L251-V256 HydrophobicContact CG-CG2 3.96Å
257	V	94.1	Very high	93.1	Very high	17 Å²	17	39 Å²	39	10%	0.103	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	-22.8	176.8	-61.9	0	0	0	0	112.9	L200 P222 A224 I250 V252 S255	L200-V257 HydrophobicContact CD2-CG2 3.84Å; P222-V257 WeakPolarHBondContact CB-O 3.39Å; A224-V257 HydrophobicContact CB-CB 4.28Å; A224-V257 HydrophobicContact CB-CG1 4.49Å; I250-V257 HydrophobicContact CB-CG2 4.4Å; I250-V257 HydrophobicContact CG2-CG2 4.09Å; I250-V257 WeakPolarHBondContact O-CG2 3.43Å; I250-V257 PolarHBondContact O-N 3.24Å; V252-V257 HydrophobicContact CB-CG1 4.01Å; V252-V257 HydrophobicContact CB-CG2 4.46Å; V252-V257 HydrophobicContact CG2-CG1 4.16Å; V252-V257 HydrophobicContact CG2-CG2 3.78Å; S255-V257 PolarHBondContact O-N 3.06Å
258	N	93.8	Very high	92.9	Very high	22 Å²	22	40.4 Å²	40.4	12%	0.118	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	145.4	176.1	-155.2	-19.2	0	0	0	109.9	K220 P222 I250	K220-N258 PolarHBondContact O-ND2 3.4Å; P222-N258 HydrophobicContact CB-CB 4.05Å; I250-N258 HydrophobicContact CB-CB 3.95Å; I250-N258 HydrophobicContact CD1-CB 4.06Å; I250-N258 HydrophobicContact CG1-CB 4.19Å; I250-N258 PolarHBondContact N-O 3.26Å; I250-N258 PolarHBondContact O-N 3Å
259	S	94.2	Very high	92.6	Very high	77 Å²	77	43.5 Å²	43.5	54%	0.538	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	141.7	173.3	58.4	0	0	0	0	110.2	F248	F248-S259 VanDerWaalsContact O-CA 3.31Å; F248-S259 WeakPolarHBondContact O-CA 3.05Å
260	G	93	Very high	92.2	Very high	19 Å²	19	40 Å²	40	20%	0.196	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.5	-164.2	-177.8	0	0	0	0	0	113.1	S247 F248 D265	S247-G260 WeakPolarHBondContact CA-O 3.18Å; F248-G260 WeakPolarHBondContact CD1-O 3.42Å; F248-G260 VanDerWaalsContact CE1-C 3.44Å; F248-G260 PolarHBondContact N-O 3.39Å; F248-G260 PolarHBondContact O-N 2.95Å; G260-D265 WeakPolarHBondContact CA-OD2 3.43Å
261	N	93.8	Very high	91.8	Very high	37 Å²	37	41.7 Å²	41.7	20%	0.198	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	138.6	176.3	-167.7	-77.5	0	0	0	111.8	D245 N246 L263 N264 D265	D245-N261 PolarHBondContact O-ND2 2.95Å; N246-N261 VanDerWaalsContact C-ND2 3.33Å; N246-N261 CarbonylContact O-C 3.6Å; N246-N261 VanDerWaalsContact O-CA 3.31Å; N246-N261 WeakPolarHBondContact O-CA 3.31Å; N246-N261 VanDerWaalsContact O-CG 3.31Å; N246-N261 PolarHBondContact O-ND2 2.89Å; N261-L263 PolarHBondContact O-N 3.4Å; N261-L263 WeakPolarHBondContact OD1-CB 3.32Å; N261-L263 PolarHBondContact OD1-N 2.82Å; N261-N264 PolarHBondContact O-N 3.05Å; N261-N264 VanDerWaalsContact O-N 3.09Å; N261-D265 PolarHBondContact N-OD2 2.92Å; N261-D265 PolarHBondContact O-N 2.84Å
262	L	91.3	Very high	91.4	Very high	0 Å²	0	43 Å²	43	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-28.1	-179.4	-59.2	-176.4	0	0	0	113.5	F202 F204 L242 N246 F248 M266 V270 P413 M416	F202-L262 HydrophobicContact CE1-CD2 4.07Å; F202-L262 HydrophobicContact CZ-CD2 4.04Å; F204-L262 HydrophobicContact CD1-CD2 4.2Å; F204-L262 HydrophobicContact CE1-CB 4.38Å; F204-L262 HydrophobicContact CE1-CD2 3.82Å; F204-L262 HydrophobicContact CE1-CG 4.5Å; F204-L262 HydrophobicContact CE2-CD1 4.45Å; F204-L262 HydrophobicContact CZ-CB 4.19Å; F204-L262 HydrophobicContact CZ-CD1 4.21Å; F204-L262 HydrophobicContact CZ-CD2 4.23Å; F204-L262 HydrophobicContact CZ-CG 4.46Å; L242-L262 HydrophobicContact CD1-CD1 4.07Å; L242-L262 HydrophobicContact CD1-CD2 3.77Å; L242-L262 HydrophobicContact CD1-CG 4.03Å; N246-L262 HydrophobicContact CB-CB 4.13Å; N246-L262 HydrophobicContact CB-CD1 4.24Å; N246-L262 HydrophobicContact CB-CG 4.15Å; N246-L262 PolarHBondContact O-N 3.46Å; F248-L262 HydrophobicContact CD1-CD2 4.17Å; L262-M266 HydrophobicContact CD2-CE 3.75Å; L262-M266 WeakPolarHBondContact O-CG 3.38Å; L262-V270 WeakPolarHBondContact O-CG2 3.42Å; L262-P413 HydrophobicContact CB-CG 3.92Å; L262-P413 HydrophobicContact CD1-CB 4.2Å; L262-P413 HydrophobicContact CD1-CG 4.1Å; L262-M416 HydrophobicContact CD1-CE 4.28Å
263	L	89.6	Confident	91	Very high	42 Å²	42	46.3 Å²	46.3	22%	0.22	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-32.2	-177.9	-66.8	168.8	0	0	0	113.5	N261 V270 D410 P413	N261-L263 PolarHBondContact O-N 3.4Å; N261-L263 WeakPolarHBondContact OD1-CB 3.32Å; N261-L263 PolarHBondContact OD1-N 2.82Å; L263-V270 HydrophobicContact CD2-CG1 4.45Å; L263-D410 WeakPolarHBondContact CD2-O 3.24Å; L263-P413 HydrophobicContact CD2-CG 3.74Å; L263-P413 HydrophobicContact CG-CG 4.09Å
264	N	87.7	Confident	90.7	Very high	118 Å²	118	52.9 Å²	52.9	63%	0.631	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	-25.9	-167.5	-61.5	-31.9	0	0	0	113.7	K220 N261	K220-N264 WeakPolarHBondContact CE-O 3.35Å; K220-N264 PolarHBondContact NZ-O 3.46Å; N261-N264 PolarHBondContact O-N 3.05Å; N261-N264 VanDerWaalsContact O-N 3.09Å
265	D	91	Very high	90.7	Very high	41 Å²	41	54.7 Å²	54.7	22%	0.219	31%	0.313	C	S	.	.	S	Bend	trans	-111	27.3	-168.6	-56.5	-57.4	0	0	0	113.1	A219 K220 F248 G260 N261	A219-D265 WeakPolarHBondContact CA-O 3.45Å; K220-D265 HydrophobicContact CD-CB 4.14Å; K220-D265 PolarHBondContact N-O 2.9Å; K220-D265 IonicContact NZ-OD1 2.67Å; K220-D265 PolarHBondContact NZ-OD1 3.02Å; F248-D265 HydrophobicContact CE1-CB 4.12Å; F248-D265 HydrophobicContact CZ-CB 4.21Å; G260-D265 WeakPolarHBondContact CA-OD2 3.43Å; N261-D265 PolarHBondContact N-OD2 2.92Å; N261-D265 PolarHBondContact O-N 2.84Å
266	M	90.9	Very high	90.7	Very high	6 Å²	6	54.1 Å²	54.1	3%	0.03	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	139.7	-178.1	-69.3	-71.3	162.5	0	0	111.4	F202 F204 K217 H218 A219 F248 L262 P268 P269	F202-M266 HydrophobicContact CD1-CE 3.79Å; F202-M266 HydrophobicContact CE1-CE 3.53Å; F202-M266 HydrophobicContact CZ-CE 4.3Å; F204-M266 HydrophobicContact CD1-CE 4.16Å; F204-M266 HydrophobicContact CD1-SD 4.03Å; F204-M266 HydrophobicContact CE1-CE 4.01Å; F204-M266 HydrophobicContact CE1-CG 3.9Å; F204-M266 HydrophobicContact CE1-SD 3.7Å; K217-M266 HydrophobicContact CB-CB 4.45Å; K217-M266 HydrophobicContact CB-SD 4.35Å; H218-M266 CarbonylContact O-C 3.56Å; H218-M266 WeakPolarHBondContact O-CA 3.27Å; A219-M266 VanDerWaalsContact CA-SD 3.6Å; A219-M266 HydrophobicContact CB-CE 3.81Å; A219-M266 HydrophobicContact CB-SD 4.21Å; A219-M266 PolarHBondContact N-SD 3.11Å; A219-M266 VanDerWaalsContact N-SD 3.38Å; F248-M266 HydrophobicContact CD1-CE 4.23Å; F248-M266 HydrophobicContact CE1-CE 3.8Å; F248-M266 HydrophobicContact CZ-CE 4.2Å; L262-M266 HydrophobicContact CD2-CE 3.75Å; L262-M266 WeakPolarHBondContact O-CG 3.38Å; M266-P268 CarbonylContact C-O 3.59Å; M266-P268 CarbonylContact O-C 3.51Å; M266-P269 WeakPolarHBondContact O-CA 3.08Å
267	T	90.9	Very high	90.5	Very high	86 Å²	86	55.1 Å²	55.1	53%	0.528	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	121.1	178.3	-58.5	0	0	0	0	109.1	H218	H218-T267 WeakPolarHBondContact CB-O 3.28Å; H218-T267 PolarHBondContact N-O 3.19Å; H218-T267 PolarHBondContact O-N 2.91Å
268	P	91.1	Very high	90.4	Very high	56 Å²	56	56.1 Å²	56.1	36%	0.364	31%	0.308	S	S	.	.	S	Bend	cis	-58.4	160.2	-12.8	-20.4	34.4	0	0	0	112	E215 K217 M266	E215-P268 WeakPolarHBondContact OE1-CG 3.49Å; K217-P268 WeakPolarHBondContact CD-O 3.45Å; M266-P268 CarbonylContact C-O 3.59Å; M266-P268 CarbonylContact O-C 3.51Å
269	P	88.7	Confident	90.3	Very high	68 Å²	68	59.9 Å²	59.9	44%	0.442	33%	0.334	S	S	.	.			trans	-62.5	149.5	176.3	27.5	-35.6	0	0	0	111	K217 M266	K217-P269 PolarHBondContact NZ-O 2.68Å; M266-P269 WeakPolarHBondContact O-CA 3.08Å
270	V	87.5	Confident	90.1	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.342	C	S	.	.	S	Bend	trans	-59.4	-53.5	177.6	169.3	0	0	0	0	110.7	F204 K217 L262 L263 F408 P413	F204-V270 HydrophobicContact CE1-CG2 4.38Å; F204-V270 HydrophobicContact CZ-CG2 3.68Å; K217-V270 HydrophobicContact CG-CG2 4.43Å; L262-V270 WeakPolarHBondContact O-CG2 3.42Å; L263-V270 HydrophobicContact CD2-CG1 4.45Å; V270-F408 VanDerWaalsContact O-CZ 3.24Å; V270-F408 WeakPolarHBondContact O-CZ 3.21Å; V270-P413 HydrophobicContact CG1-CB 4Å; V270-P413 HydrophobicContact CG1-CG 4.36Å; V270-P413 HydrophobicContact CG2-CB 4.41Å
271	N	88.3	Confident	90.1	Very high	37 Å²	37	64.4 Å²	64.4	20%	0.198	34%	0.343	C	S	.	.	S	Bend	trans	-86.7	120.1	175.7	-67.6	-35.8	0	0	0	109	D410	N271-D410 PolarHBondContact ND2-O 2.85Å; N271-D410 PolarHBondContact OD1-N 3.37Å; N271-D410 PolarHBondContact OD1-O 3.29Å
272	P	86.6	Confident	90	Very high	35 Å²	35	71.6 Å²	71.6	23%	0.227	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-64.9	160.5	175.2	29.2	-36.6	0	0	0	110.9	F407 F408	P272-F407 HydrophobicContact CG-CD2 4.48Å; P272-F407 VanDerWaalsContact O-CD2 3.29Å; P272-F407 WeakPolarHBondContact O-CD2 3.29Å; P272-F407 WeakPolarHBondContact O-CE2 3.17Å; P272-F408 VanDerWaalsContact CD-CE1 3.49Å; P272-F408 HydrophobicContact CG-CD1 3.86Å; P272-F408 HydrophobicContact CG-CE1 3.84Å
273	S	87.1	Confident	90	Very high	68 Å²	68	75.8 Å²	75.8	48%	0.476	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-61.9	140.7	178.2	56.6	0	0	0	0	111.7	E275 N404	S273-E275 WeakPolarHBondContact CB-O 3.16Å; S273-E275 PolarHBondContact O-N 2.85Å; S273-E275 PolarHBondContact OG-O 3.18Å; S273-N404 WeakPolarHBondContact O-CB 3.45Å; S273-N404 PolarHBondContact O-ND2 2.88Å
274	R	87.8	Confident	90.2	Very high	161 Å²	161	76.2 Å²	76.2	61%	0.608	39%	0.39	S	S	*	.	S	Bend	trans	-63.4	-25.3	176.2	-72.6	177.1	177.9	177.5	-1.1	113	N404 F407 E409	R274-N404 PolarHBondContact O-N 2.79Å; R274-F407 HydrophobicContact CB-CD2 4.3Å; R274-F407 HydrophobicContact CB-CE2 4.4Å; R274-F407 HydrophobicContact CG-CD1 4.28Å; R274-F407 HydrophobicContact CG-CD2 3.68Å; R274-F407 HydrophobicContact CG-CE1 3.97Å; R274-F407 HydrophobicContact CG-CE2 3.34Å; R274-F407 HydrophobicContact CG-CG 4.15Å; R274-F407 HydrophobicContact CG-CZ 3.51Å; R274-E409 IonicContact CZ-OE1 3.7Å; R274-E409 IonicContact NE-OE1 3.06Å; R274-E409 IonicContact NH2-OE1 3.46Å; R274-E409 PolarHBondContact NH2-OE1 3.18Å; R274-E409 IonicContact NH2-OE2 3.38Å
275	E	91.1	Very high	90.3	Very high	107 Å²	107	80.4 Å²	80.4	50%	0.5	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	145.9	175.8	-63.7	175.4	168.7	0	0	109.4	S273 K401 I402	S273-E275 WeakPolarHBondContact CB-O 3.16Å; S273-E275 PolarHBondContact O-N 2.85Å; S273-E275 PolarHBondContact OG-O 3.18Å; E275-K401 HydrophobicContact CB-CB 4.25Å; E275-K401 HydrophobicContact CB-CD 4.35Å; E275-K401 VanDerWaalsContact OE2-CD 3.25Å; E275-K401 WeakPolarHBondContact OE2-CD 3.41Å; E275-I402 CarbonylContact C-O 3.56Å; E275-I402 VanDerWaalsContact CA-O 3.28Å; E275-I402 WeakPolarHBondContact CA-O 3.44Å
276	I	91.1	Very high	90.3	Very high	57 Å²	57	84.4 Å²	84.4	29%	0.292	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	159.5	168.6	54	177.9	0	0	0	109	K401 I402 N404	I276-K401 CarbonylContact O-C 3.51Å; I276-K401 WeakPolarHBondContact O-CA 2.93Å; I276-I402 HydrophobicContact CG1-CD1 4.37Å; I276-I402 HydrophobicContact CG1-CG1 3.91Å; I276-I402 PolarHBondContact N-O 3.28Å; I276-I402 PolarHBondContact O-N 3.01Å; I276-N404 HydrophobicContact CG1-CB 4.26Å; I276-N404 HydrophobicContact CG2-CB 4.01Å
277	E	91.6	Very high	90.3	Very high	104 Å²	104	87.4 Å²	87.4	49%	0.486	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	136.5	169.3	-75.9	178.2	-170	0	0	109.5	P279 P399	E277-P279 WeakPolarHBondContact O-CD 3.5Å; E277-P399 HydrophobicContact CB-CB 3.96Å; E277-P399 HydrophobicContact CB-CG 4.12Å; E277-P399 HydrophobicContact CG-CB 4.35Å; E277-P399 HydrophobicContact CG-CG 4.42Å
278	D	91.8	Very high	90.3	Very high	38 Å²	38	84.6 Å²	84.6	20%	0.203	42%	0.42	C	S	.	.			trans	-71.5	115.2	-176.9	-171.3	-19.3	0	0	0	110.4	E280 D281 R400 I402	D278-E280 PolarHBondContact O-N 2.83Å; D278-E280 PolarHBondContact OD1-N 2.87Å; D278-D281 HydrophobicContact CB-CB 3.84Å; D278-D281 PolarHBondContact O-N 2.91Å; D278-R400 VanDerWaalsContact CB-O 3.29Å; D278-R400 WeakPolarHBondContact CB-O 3.44Å; D278-R400 PolarHBondContact N-O 3.5Å; D278-I402 HydrophobicContact CB-CD1 4.04Å; D278-I402 HydrophobicContact CB-CG1 4.12Å; D278-I402 HydrophobicContact CB-CG2 3.95Å
279	P	90.7	Very high	90.4	Very high	101 Å²	101	85 Å²	85	66%	0.656	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-14	-176.3	31.5	-36.6	0	0	0	113.5	E277	E277-P279 WeakPolarHBondContact O-CD 3.5Å
280	E	90.6	Very high	90.4	Very high	150 Å²	150	88.6 Å²	88.6	70%	0.701	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-14.1	175.8	-62.3	-61.8	144.3	0	0	112.4	D278	D278-E280 PolarHBondContact O-N 2.83Å; D278-E280 PolarHBondContact OD1-N 2.87Å
281	D	92.6	Very high	90.6	Very high	41 Å²	41	92.1 Å²	92.1	22%	0.219	45%	0.445	C	S	.	.			trans	-75.9	142.6	175	-166.5	23.7	0	0	0	111.1	D278 P399 R400	D278-D281 HydrophobicContact CB-CB 3.84Å; D278-D281 PolarHBondContact O-N 2.91Å; D281-P399 HydrophobicContact CB-CB 4.42Å; D281-R400 WeakPolarHBondContact OD2-CB 3.29Å; D281-R400 VanDerWaalsContact OD2-CD 3.24Å; D281-R400 WeakPolarHBondContact OD2-CD 3.46Å; D281-R400 WeakPolarHBondContact OD2-CG 3.36Å; D281-R400 PolarHBondContact OD2-N 2.91Å
282	R	91.2	Very high	90.9	Very high	188 Å²	188	95.3 Å²	95.3	71%	0.709	46%	0.457	S	S	*	.			trans	-141.7	141.9	-170.2	-63.9	-174	-176.5	-156	-1.7	111.4	P284	R282-P284 WeakPolarHBondContact O-CD 3.16Å
283	K	91.9	Very high	91.1	Very high	88 Å²	88	95.1 Å²	95.1	38%	0.383	45%	0.454	S	S	.	.			trans	-53.7	122.1	174.8	-172.1	-173.8	170.7	-165	0	110.5	W287 E289 W397	K283-W287 WeakPolarHBondContact CE-O 3.07Å; K283-W287 HydrophobicContact CG-CB 4.21Å; K283-W287 PolarHBondContact NZ-O 3.35Å; K283-E289 VanDerWaalsContact CE-CD 3.48Å; K283-E289 WeakPolarHBondContact CE-OE2 3.43Å; K283-E289 IonicContact NZ-OE2 3.68Å; K283-E289 PolarHBondContact NZ-OE2 3.43Å; K283-W397 HydrophobicContact CB-CD2 3.68Å; K283-W397 HydrophobicContact CB-CE3 3.71Å; K283-W397 HydrophobicContact CB-CG 4.05Å; K283-W397 HydrophobicContact CB-CZ3 4.18Å; K283-W397 HydrophobicContact CD-CB 4.21Å; K283-W397 HydrophobicContact CG-CB 3.88Å; K283-W397 HydrophobicContact CG-CD2 3.98Å; K283-W397 HydrophobicContact CG-CE3 4.32Å; K283-W397 HydrophobicContact CG-CG 3.77Å; K283-W397 VanDerWaalsContact N-CZ2 3.32Å
284	P	93.1	Very high	91.4	Very high	50 Å²	50	95.2 Å²	95.2	33%	0.325	45%	0.453	S	S	.	.			trans	-63.8	146.8	172.9	-21.9	33.8	0	0	0	112.2	R282 D286 W287	R282-P284 WeakPolarHBondContact O-CD 3.16Å; P284-D286 WeakPolarHBondContact CB-OD1 3.16Å; P284-D286 PolarHBondContact O-N 2.85Å; P284-W287 HydrophobicContact CB-CB 4.29Å; P284-W287 WeakPolarHBondContact O-CB 3.21Å; P284-W287 PolarHBondContact O-N 3.09Å; P284-W287 VanDerWaalsContact O-N 3.13Å
285	E	90.3	Very high	91.5	Very high	206 Å²	206	89.4 Å²	89.4	96%	0.963	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-24.1	178.9	-63.8	-177.1	169	0	0	112.6
286	D	90.9	Very high	91.4	Very high	125 Å²	125	89.4 Å²	89.4	67%	0.668	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	0.9	175.7	60.7	-46.5	0	0	0	114.2	P284 D288 Q394	P284-D286 WeakPolarHBondContact CB-OD1 3.16Å; P284-D286 PolarHBondContact O-N 2.85Å; D286-D288 PolarHBondContact O-N 3.19Å; D286-Q394 PolarHBondContact O-NE2 3.04Å; D286-Q394 VanDerWaalsContact O-NE2 3.11Å
287	W	91.3	Very high	91.2	Very high	70 Å²	70	95 Å²	95	27%	0.265	47%	0.468	S	S	.	.			trans	-85.2	100.9	178.4	-166.5	-69.1	0	0	0	111.9	K283 P284 Q394 G395 W397	K283-W287 WeakPolarHBondContact CE-O 3.07Å; K283-W287 HydrophobicContact CG-CB 4.21Å; K283-W287 PolarHBondContact NZ-O 3.35Å; P284-W287 HydrophobicContact CB-CB 4.29Å; P284-W287 WeakPolarHBondContact O-CB 3.21Å; P284-W287 PolarHBondContact O-N 3.09Å; P284-W287 VanDerWaalsContact O-N 3.13Å; W287-Q394 HydrophobicContact CD2-CB 3.84Å; W287-Q394 VanDerWaalsContact CE2-CB 3.48Å; W287-Q394 HydrophobicContact CE3-CB 4.28Å; W287-Q394 HydrophobicContact CG-CB 4.35Å; W287-Q394 HydrophobicContact CH2-CB 4.14Å; W287-Q394 HydrophobicContact CZ2-CB 3.67Å; W287-Q394 WeakPolarHBondContact CZ2-O 3.32Å; W287-Q394 HydrophobicContact CZ3-CB 4.41Å; W287-G395 PolarHBondContact NE1-O 2.76Å; W287-W397 HydrophobicContact CD2-CB 4.32Å; W287-W397 AromaticContact CD2-CD1 3.77Å; W287-W397 HydrophobicContact CD2-CG 4.44Å; W287-W397 AromaticContact CE2-CD1 3.95Å; W287-W397 AromaticContact CE3-CD1 3.99Å; W287-W397 HydrophobicContact CG-CB 4.18Å
288	D	91.4	Very high	91.1	Very high	27 Å²	27	91.4 Å²	91.4	14%	0.144	46%	0.456	C	S	.	.	B	Isolated β-bridge	trans	-85.5	117.9	178.2	-157.9	-12.3	0	0	0	112.1	D286 R290 N390 Q394	D286-D288 PolarHBondContact O-N 3.19Å; D288-R290 WeakPolarHBondContact OD1-CB 3.5Å; D288-R290 WeakPolarHBondContact OD1-CG 3.41Å; D288-R290 IonicContact OD1-CZ 3.88Å; D288-R290 PolarHBondContact OD1-N 2.92Å; D288-R290 IonicContact OD1-NE 2.7Å; D288-R290 PolarHBondContact OD1-NE 2.93Å; D288-R290 IonicContact OD1-NH2 2.63Å; D288-R290 IonicContact OD2-CZ 3.67Å; D288-R290 IonicContact OD2-NE 2.68Å; D288-R290 PolarHBondContact OD2-NE 3.4Å; D288-R290 IonicContact OD2-NH2 2.84Å; D288-R290 PolarHBondContact OD2-NH2 3.01Å; D288-N390 PolarHBondContact OD2-ND2 2.97Å; D288-Q394 PolarHBondContact O-N 2.79Å
289	E	91.9	Very high	91	Very high	64 Å²	64	95.3 Å²	95.3	30%	0.299	48%	0.481	S	S	.	.			trans	-100.8	0.9	179.4	-58.8	177.5	124.7	0	0	112.2	K283 P291 Y393 W397	K283-E289 VanDerWaalsContact CE-CD 3.48Å; K283-E289 WeakPolarHBondContact CE-OE2 3.43Å; K283-E289 IonicContact NZ-OE2 3.68Å; K283-E289 PolarHBondContact NZ-OE2 3.43Å; E289-P291 VanDerWaalsContact O-CD 3.23Å; E289-P291 WeakPolarHBondContact O-CD 3.46Å; E289-Y393 VanDerWaalsContact O-CE2 3.27Å; E289-Y393 WeakPolarHBondContact O-CE2 3.27Å; E289-W397 WeakPolarHBondContact OE1-CB 3.17Å; E289-W397 PolarHBondContact OE1-N 3.46Å
290	R	90.5	Very high	90.8	Very high	144 Å²	144	94 Å²	94	54%	0.543	47%	0.465	S	S	.	.			trans	-79.2	112.1	179.3	-60.3	171.2	-64	170.7	6.3	108.4	D288 K292 I293 N390	D288-R290 WeakPolarHBondContact OD1-CB 3.5Å; D288-R290 WeakPolarHBondContact OD1-CG 3.41Å; D288-R290 IonicContact OD1-CZ 3.88Å; D288-R290 PolarHBondContact OD1-N 2.92Å; D288-R290 IonicContact OD1-NE 2.7Å; D288-R290 PolarHBondContact OD1-NE 2.93Å; D288-R290 IonicContact OD1-NH2 2.63Å; D288-R290 IonicContact OD2-CZ 3.67Å; D288-R290 IonicContact OD2-NE 2.68Å; D288-R290 PolarHBondContact OD2-NE 3.4Å; D288-R290 IonicContact OD2-NH2 2.84Å; D288-R290 PolarHBondContact OD2-NH2 3.01Å; R290-K292 VanDerWaalsContact C-N 3.26Å; R290-K292 PolarHBondContact O-N 2.79Å; R290-I293 HydrophobicContact CB-CG2 4.35Å; R290-N390 VanDerWaalsContact O-CB 3.23Å; R290-N390 WeakPolarHBondContact O-CB 3.33Å; R290-N390 PolarHBondContact O-ND2 3.24Å
291	P	91.8	Very high	90.7	Very high	73 Å²	73	89.3 Å²	89.3	47%	0.474	45%	0.447	S	S	.	.	S	Bend	trans	-68.8	-29	-179.1	28.6	-35.4	0	0	0	111.8	E289 N390 Y393	E289-P291 VanDerWaalsContact O-CD 3.23Å; E289-P291 WeakPolarHBondContact O-CD 3.46Å; P291-N390 PolarHBondContact O-N 2.89Å; P291-Y393 HydrophobicContact CB-CD1 4.43Å; P291-Y393 HydrophobicContact CB-CE1 4.2Å; P291-Y393 HydrophobicContact CB-CE2 4.31Å
292	K	93.1	Very high	90.3	Very high	105 Å²	105	96 Å²	96	46%	0.457	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	146.8	175.3	-55.7	-175.3	-169.9	-88.8	0	110.6	R290 M387 I388 D389	R290-K292 VanDerWaalsContact C-N 3.26Å; R290-K292 PolarHBondContact O-N 2.79Å; K292-M387 HydrophobicContact CB-CB 4.26Å; K292-M387 HydrophobicContact CB-CE 3.99Å; K292-M387 HydrophobicContact CD-CB 4.48Å; K292-M387 WeakPolarHBondContact O-CE 3.43Å; K292-I388 CarbonylContact C-O 3.59Å; K292-I388 WeakPolarHBondContact CA-O 3.28Å; K292-I388 WeakPolarHBondContact CB-O 3.34Å; K292-D389 WeakPolarHBondContact CG-OD1 3.07Å; K292-D389 IonicContact NZ-OD1 2.7Å; K292-D389 PolarHBondContact NZ-OD1 3.5Å
293	I	92	Very high	89.9	Confident	30 Å²	30	92.3 Å²	92.3	15%	0.154	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	156	175.5	53	173.5	0	0	0	110.1	R290 D295 M387 I388 N390	R290-I293 HydrophobicContact CB-CG2 4.35Å; I293-D295 PolarHBondContact O-N 3.13Å; I293-M387 CarbonylContact O-C 3.54Å; I293-M387 WeakPolarHBondContact O-CA 3.06Å; I293-I388 HydrophobicContact CG1-CG1 4.04Å; I293-I388 PolarHBondContact N-O 2.7Å; I293-I388 PolarHBondContact O-N 3.44Å; I293-N390 HydrophobicContact CD1-CB 4.33Å; I293-N390 HydrophobicContact CG1-CB 4.03Å; I293-N390 HydrophobicContact CG2-CB 4Å
294	P	91.9	Very high	89.6	Confident	70 Å²	70	91.4 Å²	91.4	46%	0.455	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.4	132.5	162.7	-29.9	38.7	0	0	0	111.4	P296 P385 M387	P294-P296 WeakPolarHBondContact O-CD 3.3Å; P294-P385 HydrophobicContact CB-CG 3.73Å; P294-M387 HydrophobicContact CG-SD 4.05Å
295	D	91.3	Very high	89.2	Confident	40 Å²	40	93 Å²	93	21%	0.214	48%	0.477	C	S	.	.			trans	-59.9	118.8	171.3	-175.7	-15.6	0	0	0	110.2	I293 E297 A298 P386 I388	I293-D295 PolarHBondContact O-N 3.13Å; D295-E297 PolarHBondContact OD1-N 3.2Å; D295-A298 HydrophobicContact CB-CB 3.73Å; D295-A298 PolarHBondContact OD1-N 2.93Å; D295-P386 HydrophobicContact CB-CG 3.87Å; D295-P386 WeakPolarHBondContact CB-O 3.36Å; D295-P386 PolarHBondContact N-O 2.82Å; D295-I388 HydrophobicContact CB-CD1 4.41Å; D295-I388 HydrophobicContact CB-CG1 4.37Å; D295-I388 HydrophobicContact CB-CG2 4.01Å
296	P	88.3	Confident	89	Confident	106 Å²	106	86.2 Å²	86.2	69%	0.688	45%	0.446	S	S	*	.	S	Bend	trans	-80.5	-13.3	-179.4	34.5	-36.2	0	0	0	113.6	P294	P294-P296 WeakPolarHBondContact O-CD 3.3Å
297	E	87.7	Confident	88.7	Confident	176 Å²	176	87.8 Å²	87.8	82%	0.822	45%	0.454	S	S	*	.	S	Bend	trans	-93.6	-16.8	174.6	-59.5	-159.9	110.8	0	0	112	D295 V299	D295-E297 PolarHBondContact OD1-N 3.2Å; E297-V299 PolarHBondContact O-N 3.39Å
298	A	89.3	Confident	88.4	Confident	28 Å²	28	85 Å²	85	23%	0.231	45%	0.445	C	S	.	.			trans	-68	123.2	172.4	0	0	0	0	0	111.7	D295 W383 P385 P386	D295-A298 HydrophobicContact CB-CB 3.73Å; D295-A298 PolarHBondContact OD1-N 2.93Å; A298-W383 HydrophobicContact CB-CH2 3.99Å; A298-W383 HydrophobicContact CB-CZ2 4.26Å; A298-W383 WeakPolarHBondContact O-CH2 3.28Å; A298-P385 HydrophobicContact CB-CB 4Å; A298-P386 HydrophobicContact CB-CG 4.12Å
299	V	88.5	Confident	88.2	Confident	119 Å²	119	87.2 Å²	87.2	72%	0.721	46%	0.461	S	S	*	.			trans	-112.2	143	174.6	-177.2	0	0	0	0	109.3	E297 P301	E297-V299 PolarHBondContact O-N 3.39Å; V299-P301 WeakPolarHBondContact O-CD 3.33Å
300	K	88	Confident	88	Confident	75 Å²	75	86.3 Å²	86.3	33%	0.326	47%	0.465	S	S	.	.			trans	-54	123.8	172.5	179.6	-174.7	169.6	-174.2	0	110.3	W304 E306 W383	K300-W304 WeakPolarHBondContact CE-O 3.4Å; K300-W304 HydrophobicContact CG-CB 4.34Å; K300-W304 PolarHBondContact NZ-O 2.85Å; K300-E306 WeakPolarHBondContact CD-OE2 3.42Å; K300-E306 VanDerWaalsContact CE-OE2 3.28Å; K300-E306 WeakPolarHBondContact CE-OE2 3.27Å; K300-E306 IonicContact NZ-OE2 3.85Å; K300-E306 PolarHBondContact NZ-OE2 2.92Å; K300-W383 HydrophobicContact CB-CD2 3.84Å; K300-W383 HydrophobicContact CB-CE3 3.74Å; K300-W383 HydrophobicContact CB-CG 4.21Å; K300-W383 HydrophobicContact CB-CZ3 4.2Å; K300-W383 HydrophobicContact CD-CB 4.33Å; K300-W383 HydrophobicContact CG-CB 3.98Å; K300-W383 HydrophobicContact CG-CD2 4.11Å; K300-W383 HydrophobicContact CG-CE3 4.37Å; K300-W383 HydrophobicContact CG-CG 3.94Å
301	P	87.9	Confident	88	Confident	50 Å²	50	83.9 Å²	83.9	33%	0.325	46%	0.458	S	S	.	.			trans	-63.5	144.6	176.1	-24.7	35.5	0	0	0	113.3	V299 D303 W304	V299-P301 WeakPolarHBondContact O-CD 3.33Å; P301-D303 WeakPolarHBondContact CB-OD1 3.49Å; P301-D303 PolarHBondContact O-N 2.82Å; P301-W304 HydrophobicContact CB-CB 4.48Å; P301-W304 WeakPolarHBondContact O-CB 3.31Å; P301-W304 PolarHBondContact O-N 3.35Å
302	D	83.8	Confident	87.9	Confident	181 Å²	181	83.1 Å²	83.1	97%	0.968	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-21.3	177.9	-66	-45.7	0	0	0	113.2	W304	D302-W304 VanDerWaalsContact C-N 3.28Å
303	D	83.4	Confident	87.7	Confident	111 Å²	111	81.2 Å²	81.2	59%	0.594	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	5.3	175.9	74.8	-63.3	0	0	0	113.4	P301 K380	P301-D303 WeakPolarHBondContact CB-OD1 3.49Å; P301-D303 PolarHBondContact O-N 2.82Å; D303-K380 PolarHBondContact O-NZ 3.38Å; D303-K380 IonicContact OD2-NZ 3.58Å; D303-K380 PolarHBondContact OD2-NZ 2.74Å
304	W	85.7	Confident	87.6	Confident	69 Å²	69	81.3 Å²	81.3	26%	0.261	45%	0.449	S	S	.	.			trans	-101.1	88.3	-179.2	-161.4	-61.5	0	0	0	111.6	K300 P301 D302 K380 G381 W383	K300-W304 WeakPolarHBondContact CE-O 3.4Å; K300-W304 HydrophobicContact CG-CB 4.34Å; K300-W304 PolarHBondContact NZ-O 2.85Å; P301-W304 HydrophobicContact CB-CB 4.48Å; P301-W304 WeakPolarHBondContact O-CB 3.31Å; P301-W304 PolarHBondContact O-N 3.35Å; D302-W304 VanDerWaalsContact C-N 3.28Å; W304-K380 HydrophobicContact CD2-CB 3.75Å; W304-K380 HydrophobicContact CD2-CD 3.84Å; W304-K380 HydrophobicContact CD2-CG 4.42Å; W304-K380 VanDerWaalsContact CE2-CB 3.4Å; W304-K380 HydrophobicContact CE3-CB 4.2Å; W304-K380 HydrophobicContact CE3-CD 3.77Å; W304-K380 HydrophobicContact CG-CB 4.26Å; W304-K380 HydrophobicContact CG-CD 4.18Å; W304-K380 HydrophobicContact CH2-CB 4.09Å; W304-K380 HydrophobicContact CZ2-CB 3.62Å; W304-K380 WeakPolarHBondContact CZ2-O 3.46Å; W304-K380 HydrophobicContact CZ3-CB 4.35Å; W304-K380 HydrophobicContact CZ3-CD 4.29Å; W304-G381 PolarHBondContact NE1-O 2.96Å; W304-W383 HydrophobicContact CD2-CB 4.17Å; W304-W383 AromaticContact CD2-CD1 3.63Å; W304-W383 HydrophobicContact CD2-CG 4.29Å; W304-W383 AromaticContact CE2-CD1 3.86Å; W304-W383 AromaticContact CE3-CD1 3.71Å; W304-W383 HydrophobicContact CG-CB 4.14Å; W304-W383 HydrophobicContact CG-CG 4.48Å; W304-W383 HydrophobicContact CZ2-CB 4.41Å
305	D	84.8	Confident	87.3	Confident	85 Å²	85	86.4 Å²	86.4	46%	0.455	47%	0.467	S	S	.	.			trans	-71.8	130.6	168.7	-165.4	-13.1	0	0	0	110.3	D307 A308	D305-D307 PolarHBondContact OD1-N 3.31Å; D305-A308 HydrophobicContact CB-CB 3.93Å; D305-A308 PolarHBondContact OD1-N 3.09Å
306	E	84.8	Confident	87	Confident	63 Å²	63	93 Å²	93	29%	0.294	50%	0.496	S	S	.	.	S	Bend	trans	-108.9	-15.5	176.7	-68.1	-177.9	107.1	0	0	112.7	K300 K382 W383	K300-E306 WeakPolarHBondContact CD-OE2 3.42Å; K300-E306 VanDerWaalsContact CE-OE2 3.28Å; K300-E306 WeakPolarHBondContact CE-OE2 3.27Å; K300-E306 IonicContact NZ-OE2 3.85Å; K300-E306 PolarHBondContact NZ-OE2 2.92Å; E306-K382 VanDerWaalsContact OE1-CA 3.24Å; E306-K382 WeakPolarHBondContact OE1-CA 3.27Å; E306-W383 PolarHBondContact OE1-N 2.62Å
307	D	84.8	Confident	86.8	Confident	158 Å²	158	88.9 Å²	88.9	85%	0.845	47%	0.471	S	S	*	.	S	Bend	trans	-92.7	-13.5	176.8	-65.3	-54.5	0	0	0	111.3	D305	D305-D307 PolarHBondContact OD1-N 3.31Å
308	A	85.9	Confident	86.7	Confident	10 Å²	10	86.4 Å²	86.4	8%	0.083	47%	0.468	C	S	.	.	S	Bend	trans	-49.7	126.2	166.1	0	0	0	0	0	111.1	D305 Y379	D305-A308 HydrophobicContact CB-CB 3.93Å; D305-A308 PolarHBondContact OD1-N 3.09Å; A308-Y379 WeakPolarHBondContact O-CD2 3.18Å
309	P	87.1	Confident	86.5	Confident	74 Å²	74	88.6 Å²	88.6	48%	0.481	47%	0.472	S	S	.	.			trans	-73.7	146.4	178.6	31	-35.7	0	0	0	110.7	K311 I312 N376	P309-K311 WeakPolarHBondContact CB-O 3.28Å; P309-K311 PolarHBondContact O-N 3.01Å; P309-I312 HydrophobicContact CG-CG2 4.04Å; P309-N376 WeakPolarHBondContact O-CB 3.44Å; P309-N376 PolarHBondContact O-ND2 2.97Å
310	A	87.6	Confident	86.4	Confident	45 Å²	45	85.6 Å²	85.6	37%	0.372	46%	0.456	S	S	.	.	S	Bend	trans	-61.4	-29.7	178.7	0	0	0	0	0	113.5	N376 Y379	A310-N376 PolarHBondContact O-N 2.93Å; A310-Y379 HydrophobicContact CB-CD1 3.85Å; A310-Y379 HydrophobicContact CB-CD2 4.18Å; A310-Y379 HydrophobicContact CB-CE1 3.68Å; A310-Y379 HydrophobicContact CB-CE2 4.02Å; A310-Y379 HydrophobicContact CB-CG 4.09Å
311	K	90.4	Very high	86.1	Confident	94 Å²	94	91.3 Å²	91.3	41%	0.409	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	148.1	175.9	-67.1	179	172.5	-73.5	0	110.8	P309 M373 I374 D375	P309-K311 WeakPolarHBondContact CB-O 3.28Å; P309-K311 PolarHBondContact O-N 3.01Å; K311-M373 HydrophobicContact CB-CB 4.05Å; K311-M373 HydrophobicContact CB-CE 4Å; K311-M373 HydrophobicContact CD-CB 4.08Å; K311-M373 PolarHBondContact NZ-O 3.08Å; K311-I374 CarbonylContact C-O 3.59Å; K311-I374 WeakPolarHBondContact CA-O 3.25Å; K311-I374 WeakPolarHBondContact CB-O 3.33Å; K311-D375 WeakPolarHBondContact CE-OD1 3.35Å; K311-D375 WeakPolarHBondContact CG-OD1 3.35Å; K311-D375 IonicContact NZ-OD1 2.64Å; K311-D375 PolarHBondContact NZ-OD1 3.18Å; K311-D375 IonicContact NZ-OD2 2.6Å
312	I	88.9	Confident	85.8	Confident	56 Å²	56	91.4 Å²	91.4	29%	0.287	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	152.9	174.1	51.9	179.3	0	0	0	109.5	P309 D314 M373 I374 N376	P309-I312 HydrophobicContact CG-CG2 4.04Å; I312-D314 PolarHBondContact O-N 2.81Å; I312-M373 CarbonylContact O-C 3.52Å; I312-M373 WeakPolarHBondContact O-CA 3.34Å; I312-I374 HydrophobicContact CG1-CG1 4.03Å; I312-I374 PolarHBondContact N-O 2.89Å; I312-I374 WeakPolarHBondContact O-CG1 3.46Å; I312-I374 PolarHBondContact O-N 3.46Å; I312-N376 HydrophobicContact CD1-CB 4.38Å; I312-N376 HydrophobicContact CG1-CB 4.22Å; I312-N376 HydrophobicContact CG2-CB 4.08Å
313	P	89.5	Confident	85.9	Confident	66 Å²	66	85.7 Å²	85.7	43%	0.429	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	134.6	172.7	-19.1	31.7	0	0	0	110	E315 R371 M373	P313-E315 PolarHBondContact O-N 2.93Å; P313-R371 HydrophobicContact CB-CB 4.13Å; P313-M373 HydrophobicContact CB-SD 4.09Å; P313-M373 HydrophobicContact CG-CE 4.41Å; P313-M373 HydrophobicContact CG-SD 3.83Å
314	D	89.4	Confident	86	Confident	32 Å²	32	83.3 Å²	83.3	17%	0.171	45%	0.445	C	S	.	.			trans	-67.6	120.2	171	-171.9	-19.5	0	0	0	109.4	I312 E316 A317 R371 P372 I374	I312-D314 PolarHBondContact O-N 2.81Å; D314-E316 WeakPolarHBondContact OD1-CA 3.35Å; D314-E316 PolarHBondContact OD1-N 2.84Å; D314-A317 HydrophobicContact CB-CB 3.69Å; D314-A317 VanDerWaalsContact CG-CB 3.47Å; D314-A317 PolarHBondContact OD1-N 2.98Å; D314-R371 WeakPolarHBondContact O-CD 3.44Å; D314-R371 PolarHBondContact O-NH1 2.7Å; D314-P372 HydrophobicContact CB-CG 4.04Å; D314-P372 WeakPolarHBondContact CB-O 3.5Å; D314-P372 PolarHBondContact N-O 2.7Å; D314-I374 HydrophobicContact CB-CD1 4.25Å; D314-I374 HydrophobicContact CB-CG1 4.17Å; D314-I374 HydrophobicContact CB-CG2 3.98Å
315	E	86.1	Confident	85.9	Confident	176 Å²	176	83.4 Å²	83.4	82%	0.822	45%	0.451	S	S	*	.	S	Bend	trans	-83.1	-28.5	176.1	-63.9	-160.1	148	0	0	112.5	P313 R371	P313-E315 PolarHBondContact O-N 2.93Å; E315-R371 PolarHBondContact O-NH1 3.38Å
316	E	84.2	Confident	85.8	Confident	180 Å²	180	87.2 Å²	87.2	84%	0.841	47%	0.472	S	S	*	.	S	Bend	trans	-76	-28.3	177.4	-58.3	-161.2	131.6	0	0	111.6	D314 T318	D314-E316 WeakPolarHBondContact OD1-CA 3.35Å; D314-E316 PolarHBondContact OD1-N 2.84Å; E316-T318 PolarHBondContact O-N 3.03Å; E316-T318 VanDerWaalsContact O-N 3.1Å
317	A	85.3	Confident	85.7	Confident	19 Å²	19	87 Å²	87	16%	0.157	47%	0.471	C	S	.	.			trans	-57.9	113.3	173	0	0	0	0	0	112.1	D314 R371 P372	D314-A317 HydrophobicContact CB-CB 3.69Å; D314-A317 VanDerWaalsContact CG-CB 3.47Å; D314-A317 PolarHBondContact OD1-N 2.98Å; A317-R371 PolarHBondContact O-NH1 2.91Å; A317-P372 HydrophobicContact CB-CG 3.51Å
318	T	85.4	Confident	85.8	Confident	124 Å²	124	82.7 Å²	82.7	76%	0.761	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-94.5	137.3	169.9	54.4	0	0	0	0	111	E316	E316-T318 PolarHBondContact O-N 3.03Å; E316-T318 VanDerWaalsContact O-N 3.1Å
319	K	85.1	Confident	85.7	Confident	73 Å²	73	87.4 Å²	87.4	32%	0.317	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-57.6	133.2	173.5	-178.3	174.5	167	-175.3	0	111.6	W323 D325 W369	K319-W323 HydrophobicContact CG-CB 4.36Å; K319-D325 IonicContact NZ-OD1 2.67Å; K319-D325 PolarHBondContact NZ-OD1 2.88Å; K319-D325 IonicContact NZ-OD2 2.65Å; K319-D325 PolarHBondContact NZ-OD2 2.82Å; K319-W369 HydrophobicContact CB-CD2 3.65Å; K319-W369 HydrophobicContact CB-CE3 3.74Å; K319-W369 HydrophobicContact CB-CG 4.25Å; K319-W369 HydrophobicContact CB-CH2 3.94Å; K319-W369 HydrophobicContact CB-CZ2 3.89Å; K319-W369 HydrophobicContact CB-CZ3 3.88Å; K319-W369 HydrophobicContact CD-CB 3.8Å; K319-W369 HydrophobicContact CD-CD2 3.88Å; K319-W369 HydrophobicContact CD-CE3 3.99Å; K319-W369 HydrophobicContact CD-CG 3.8Å; K319-W369 HydrophobicContact CG-CB 4.21Å; K319-W369 HydrophobicContact CG-CD2 3.66Å; K319-W369 HydrophobicContact CG-CE3 4.08Å; K319-W369 HydrophobicContact CG-CG 3.71Å
320	P	86.6	Confident	85.8	Confident	57 Å²	57	89.6 Å²	89.6	37%	0.37	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-60	141	176.5	-25.3	34.9	0	0	0	113.6	G322 W323 P364	P320-G322 PolarHBondContact O-N 2.98Å; P320-W323 HydrophobicContact CG-CE3 4.3Å; P320-P364 HydrophobicContact CB-CB 3.83Å; P320-P364 HydrophobicContact CB-CG 4.38Å; P320-P364 HydrophobicContact CG-CB 4.49Å
321	E	81.8	Confident	85.8	Confident	194 Å²	194	89.2 Å²	89.2	91%	0.907	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	128	170.7	-64	-169.7	166.7	0	0	110.3
322	G	81.4	Confident	85.8	Confident	53 Å²	53	88.3 Å²	88.3	55%	0.546	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.7	0.8	-179.1	0	0	0	0	0	116	P320 P364	P320-G322 PolarHBondContact O-N 2.98Å; G322-P364 WeakPolarHBondContact O-CD 3.33Å
323	W	86	Confident	85.8	Confident	60 Å²	60	87.8 Å²	87.8	23%	0.227	47%	0.465	C	S	.	.			trans	-60.8	137.4	171.1	-172.7	-71.3	0	0	0	112.1	K319 P320 C366 G367 W369	K319-W323 HydrophobicContact CG-CB 4.36Å; P320-W323 HydrophobicContact CG-CE3 4.3Å; W323-C366 VanDerWaalsContact CZ2-O 3.25Å; W323-C366 WeakPolarHBondContact CZ2-O 3.28Å; W323-C366 PolarHBondContact NE1-O 2.79Å; W323-G367 PolarHBondContact NE1-O 2.84Å; W323-W369 HydrophobicContact CD2-CB 4.28Å; W323-W369 AromaticContact CD2-CD1 3.86Å; W323-W369 HydrophobicContact CD2-CG 4.41Å; W323-W369 AromaticContact CE2-CD1 3.85Å; W323-W369 AromaticContact CE3-CD1 3.8Å; W323-W369 HydrophobicContact CG-CB 4.5Å; W323-W369 AromaticContact CH2-CD1 3.81Å; W323-W369 HydrophobicContact CZ2-CB 4.23Å; W323-W369 AromaticContact CZ2-CD1 3.84Å; W323-W369 HydrophobicContact CZ2-CG 4.47Å; W323-W369 AromaticContact CZ3-CD1 3.77Å
324	L	86	Confident	85.7	Confident	61 Å²	61	89.6 Å²	89.6	32%	0.319	48%	0.477	S	S	.	.	B	Isolated β-bridge	trans	-102.3	91.2	-173.3	-57.3	177.9	0	0	0	112.2	D326 E327 A363 G365 C366 G367	L324-D326 PolarHBondContact O-N 2.82Å; L324-E327 HydrophobicContact CB-CB 4.15Å; L324-E327 HydrophobicContact CB-CG 4.45Å; L324-A363 HydrophobicContact CD1-CB 3.77Å; L324-A363 HydrophobicContact CG-CB 3.94Å; L324-G365 PolarHBondContact N-O 3.38Å; L324-C366 CarbonylContact O-C 3.52Å; L324-C366 WeakPolarHBondContact O-CA 3.45Å; L324-G367 PolarHBondContact O-N 2.91Å
325	D	82.3	Confident	85.5	Confident	72 Å²	72	95.2 Å²	95.2	39%	0.385	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-37.2	-178.5	-58.5	-83.9	0	0	0	114.4	K319 E327	K319-D325 IonicContact NZ-OD1 2.67Å; K319-D325 PolarHBondContact NZ-OD1 2.88Å; K319-D325 IonicContact NZ-OD2 2.65Å; K319-D325 PolarHBondContact NZ-OD2 2.82Å; D325-E327 VanDerWaalsContact C-N 3.31Å; D325-E327 PolarHBondContact O-N 2.82Å
326	D	82.9	Confident	85.6	Confident	165 Å²	165	88.2 Å²	88.2	88%	0.882	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-8.8	-172.6	-61.4	-56	0	0	0	113.5	L324	L324-D326 PolarHBondContact O-N 2.82Å
327	E	83.5	Confident	85.7	Confident	59 Å²	59	88.1 Å²	88.1	28%	0.276	48%	0.479	S	S	.	.	S	Bend	trans	-105.9	126.1	178	-70.3	-75.1	173.5	0	0	109	L324 D325 N357 K359 G367	L324-E327 HydrophobicContact CB-CB 4.15Å; L324-E327 HydrophobicContact CB-CG 4.45Å; D325-E327 VanDerWaalsContact C-N 3.31Å; D325-E327 PolarHBondContact O-N 2.82Å; E327-N357 PolarHBondContact OE2-ND2 2.72Å; E327-K359 VanDerWaalsContact CD-CD 3.42Å; E327-K359 HydrophobicContact CG-CD 4.18Å; E327-K359 WeakPolarHBondContact OE1-CD 3.44Å; E327-K359 IonicContact OE1-NZ 3.69Å; E327-K359 PolarHBondContact OE1-NZ 2.91Å; E327-K359 VanDerWaalsContact OE2-CD 3.26Å; E327-K359 WeakPolarHBondContact OE2-CD 3.3Å; E327-K359 IonicContact OE2-NZ 2.67Å; E327-K359 PolarHBondContact OE2-NZ 3.44Å; E327-G367 WeakPolarHBondContact O-CA 3.37Å; E327-G367 PolarHBondContact O-N 3.25Å
328	P	85.6	Confident	85.8	Confident	66 Å²	66	90.9 Å²	90.9	43%	0.429	49%	0.487	S	S	.	.			trans	-70.2	148.4	178.8	32.1	-36.4	0	0	0	110.7	Y330 V331 N357	P328-Y330 WeakPolarHBondContact CB-O 3.2Å; P328-Y330 WeakPolarHBondContact CG-O 3.49Å; P328-Y330 PolarHBondContact O-N 2.84Å; P328-V331 HydrophobicContact CG-CG1 3.96Å; P328-N357 VanDerWaalsContact O-CB 3.25Å; P328-N357 WeakPolarHBondContact O-CB 3.36Å; P328-N357 PolarHBondContact O-ND2 2.87Å
329	E	84.6	Confident	86.1	Confident	110 Å²	110	88.2 Å²	88.2	51%	0.514	47%	0.472	S	S	.	.	S	Bend	trans	-61.3	-34.7	177.7	-172.6	-179.9	-168.4	0	0	112.1	N357 C366	E329-N357 WeakPolarHBondContact O-CB 3.4Å; E329-N357 PolarHBondContact O-N 2.86Å; E329-C366 HydrophobicContact CB-CB 4.41Å
330	Y	88.6	Confident	86.1	Confident	120 Å²	120	94.9 Å²	94.9	47%	0.471	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	152.6	175.3	-57	-94.1	0	0	0	111.2	P328 I355	P328-Y330 WeakPolarHBondContact CB-O 3.2Å; P328-Y330 WeakPolarHBondContact CG-O 3.49Å; P328-Y330 PolarHBondContact O-N 2.84Å; Y330-I355 CarbonylContact C-O 3.47Å; Y330-I355 WeakPolarHBondContact CA-O 3.46Å
331	V	88.8	Confident	86.3	Confident	36 Å²	36	99.9 Å²	99.9	22%	0.218	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	152.8	173.1	-70.4	0	0	0	0	109.6	P328 D333 Q354 I355 N357	P328-V331 HydrophobicContact CG-CG1 3.96Å; V331-D333 PolarHBondContact O-N 3.44Å; V331-Q354 WeakPolarHBondContact O-CA 3.4Å; V331-I355 HydrophobicContact CG2-CG1 4Å; V331-I355 PolarHBondContact N-O 3.37Å; V331-I355 WeakPolarHBondContact O-CG1 3.48Å; V331-I355 PolarHBondContact O-N 2.86Å; V331-N357 HydrophobicContact CG1-CB 4.04Å; V331-N357 HydrophobicContact CG2-CB 4.25Å
332	P	90	Very high	86.6	Confident	75 Å²	75	94.8 Å²	94.8	49%	0.487	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	136	169.5	25	-33.9	0	0	0	110.6	P334 A352	P332-P334 WeakPolarHBondContact O-CD 3.5Å; P332-A352 HydrophobicContact CB-CB 3.88Å
333	D	89.7	Confident	86.9	Confident	45 Å²	45	96.4 Å²	96.4	24%	0.241	50%	0.497	C	S	.	.			trans	-60.5	119.8	176.1	-168.7	-27.1	0	0	0	110.7	V331 D335 A336 P353 I355	V331-D333 PolarHBondContact O-N 3.44Å; D333-D335 VanDerWaalsContact C-N 3.29Å; D333-D335 PolarHBondContact O-N 2.92Å; D333-D335 PolarHBondContact OD1-N 2.86Å; D333-A336 HydrophobicContact CB-CB 3.82Å; D333-P353 HydrophobicContact CB-CG 4.07Å; D333-P353 WeakPolarHBondContact CB-O 3.44Å; D333-P353 PolarHBondContact N-O 3.48Å; D333-I355 HydrophobicContact CB-CD1 4.3Å; D333-I355 HydrophobicContact CB-CG1 4.3Å; D333-I355 HydrophobicContact CB-CG2 3.95Å
334	P	85.9	Confident	87.1	Confident	105 Å²	105	99.2 Å²	99.2	68%	0.682	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-17.2	-179.2	32.3	-36.9	0	0	0	113.7	P332	P332-P334 WeakPolarHBondContact O-CD 3.5Å
335	D	85.5	Confident	87.1	Confident	149 Å²	149	103.3 Å²	103.3	80%	0.797	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-0.1	-179.8	-67.8	-35.1	0	0	0	112.1	D333	D333-D335 VanDerWaalsContact C-N 3.29Å; D333-D335 PolarHBondContact O-N 2.92Å; D333-D335 PolarHBondContact OD1-N 2.86Å
336	A	88.1	Confident	87.5	Confident	29 Å²	29	107.1 Å²	107.1	24%	0.24	55%	0.552	C	S	.	*	P	Polyproline II helix	trans	-81.3	120.4	175	0	0	0	0	0	112.1	D333 W350 P353	D333-A336 HydrophobicContact CB-CB 3.82Å; A336-W350 HydrophobicContact CB-CH2 4.27Å; A336-W350 HydrophobicContact CB-CZ2 4.48Å; A336-W350 WeakPolarHBondContact O-CH2 3.47Å; A336-P353 HydrophobicContact CB-CG 3.8Å
337	E	87.8	Confident	87.5	Confident	179 Å²	179	103.7 Å²	103.7	84%	0.836	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-100	145.3	172.5	-63	-171.4	146.5	0	0	111.4
338	K	86.4	Confident	87.7	Confident	76 Å²	76	102.2 Å²	102.2	33%	0.33	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-63.2	129	174.4	-178.7	-175.9	173.5	-167.3	0	110.2	W342 E344 W350	K338-W342 WeakPolarHBondContact CE-O 3.46Å; K338-W342 HydrophobicContact CG-CB 4.41Å; K338-W342 PolarHBondContact NZ-O 2.88Å; K338-E344 IonicContact NZ-OE1 2.67Å; K338-E344 PolarHBondContact NZ-OE1 2.83Å; K338-W350 HydrophobicContact CB-CD2 3.76Å; K338-W350 HydrophobicContact CB-CE3 3.83Å; K338-W350 HydrophobicContact CB-CG 4.18Å; K338-W350 HydrophobicContact CB-CZ2 4.46Å; K338-W350 HydrophobicContact CB-CZ3 4.22Å; K338-W350 HydrophobicContact CD-CB 3.98Å; K338-W350 HydrophobicContact CD-CG 4.22Å; K338-W350 HydrophobicContact CG-CB 4.04Å; K338-W350 HydrophobicContact CG-CD2 3.87Å; K338-W350 HydrophobicContact CG-CE3 4.32Å; K338-W350 HydrophobicContact CG-CG 3.72Å
339	P	90.7	Very high	87.9	Confident	68 Å²	68	107.6 Å²	107.6	44%	0.442	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-59.4	140.5	175.6	-24.3	34.3	0	0	0	113.3	D341 W342	P339-D341 PolarHBondContact O-N 2.79Å; P339-D341 VanDerWaalsContact O-N 3.16Å; P339-W342 HydrophobicContact CB-CB 4.41Å; P339-W342 PolarHBondContact O-N 3.32Å
340	E	86.6	Confident	88.1	Confident	214 Å²	214	105.7 Å²	105.7	100%	1	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-20.5	179.7	-63.6	-169.6	149.1	0	0	114.1
341	D	89.7	Confident	88	Confident	162 Å²	162	108 Å²	108	87%	0.866	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	9	-176.7	-151.1	36.5	0	0	0	113	P339	P339-D341 PolarHBondContact O-N 2.79Å; P339-D341 VanDerWaalsContact O-N 3.16Å
342	W	88.1	Confident	88	Confident	87 Å²	87	107.3 Å²	107.3	33%	0.33	56%	0.555	S	S	.	*			trans	-91.3	115.6	-178.5	-176.7	-61.4	0	0	0	112.4	K338 P339 D347 G348 W350	K338-W342 WeakPolarHBondContact CE-O 3.46Å; K338-W342 HydrophobicContact CG-CB 4.41Å; K338-W342 PolarHBondContact NZ-O 2.88Å; P339-W342 HydrophobicContact CB-CB 4.41Å; P339-W342 PolarHBondContact O-N 3.32Å; W342-D347 HydrophobicContact CD2-CB 4.12Å; W342-D347 HydrophobicContact CG-CB 4.39Å; W342-D347 HydrophobicContact CZ2-CB 3.98Å; W342-G348 PolarHBondContact NE1-O 3.44Å; W342-W350 HydrophobicContact CD2-CB 4.42Å; W342-W350 AromaticContact CD2-CD1 3.67Å; W342-W350 HydrophobicContact CD2-CG 4.42Å; W342-W350 AromaticContact CE2-CD1 3.81Å; W342-W350 AromaticContact CE3-CD1 3.73Å; W342-W350 HydrophobicContact CZ2-CB 4.45Å; W342-W350 AromaticContact CZ3-CD1 3.95Å
343	D	89.2	Confident	88	Confident	86 Å²	86	107.1 Å²	107.1	46%	0.46	55%	0.553	S	S	.	*			trans	-100.8	115.6	-176.3	-168.9	-24.3	0	0	0	111.1	D345 M346 D347	D343-D345 PolarHBondContact O-N 2.86Å; D343-D345 PolarHBondContact OD1-N 2.78Å; D343-M346 HydrophobicContact CB-CB 4.29Å; D343-M346 PolarHBondContact O-N 2.91Å; D343-M346 VanDerWaalsContact O-N 3.13Å; D343-D347 PolarHBondContact N-OD2 2.89Å; D343-D347 WeakPolarHBondContact O-CB 3.08Å; D343-D347 PolarHBondContact O-N 2.76Å
344	E	88.3	Confident	88.1	Confident	120 Å²	120	110 Å²	110	56%	0.561	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-18.7	-177.2	-76.9	158.1	-151	0	0	114	K338 G348	K338-E344 IonicContact NZ-OE1 2.67Å; K338-E344 PolarHBondContact NZ-OE1 2.83Å; E344-G348 WeakPolarHBondContact CA-O 3.43Å; E344-G348 WeakPolarHBondContact O-CA 3.44Å
345	D	87.8	Confident	88.2	Confident	146 Å²	146	107.9 Å²	107.9	78%	0.781	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-17.1	176.4	-162	59.5	0	0	0	112.5	D343	D343-D345 PolarHBondContact O-N 2.86Å; D343-D345 PolarHBondContact OD1-N 2.78Å
346	M	89.1	Confident	88.3	Confident	153 Å²	153	103.6 Å²	103.6	75%	0.754	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	-45.7	-177.9	-68.4	-76.2	-177.4	0	0	113.1	D343	D343-M346 HydrophobicContact CB-CB 4.29Å; D343-M346 PolarHBondContact O-N 2.91Å; D343-M346 VanDerWaalsContact O-N 3.13Å
347	D	84.4	Confident	88.2	Confident	93 Å²	93	102.4 Å²	102.4	50%	0.497	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-16.6	-174.2	-52	-49.2	0	0	0	112.4	W342 D343	W342-D347 HydrophobicContact CD2-CB 4.12Å; W342-D347 HydrophobicContact CG-CB 4.39Å; W342-D347 HydrophobicContact CZ2-CB 3.98Å; D343-D347 PolarHBondContact N-OD2 2.89Å; D343-D347 WeakPolarHBondContact O-CB 3.08Å; D343-D347 PolarHBondContact O-N 2.76Å
348	G	87.8	Confident	88.1	Confident	27 Å²	27	97.9 Å²	97.9	28%	0.278	51%	0.509	S	S	.	.			trans	92.5	-178.2	178.7	0	0	0	0	0	114.8	W342 E344 W350	W342-G348 PolarHBondContact NE1-O 3.44Å; E344-G348 WeakPolarHBondContact CA-O 3.43Å; E344-G348 WeakPolarHBondContact O-CA 3.44Å; G348-W350 PolarHBondContact O-N 2.88Å
349	E	89.3	Confident	87.8	Confident	179 Å²	179	99.1 Å²	99.1	84%	0.836	51%	0.514	S	S	*	.	S	Bend	trans	-61.5	126.9	175.4	-67.8	-173.2	-175.8	0	0	110.1	E351	E349-E351 PolarHBondContact O-N 2.89Å
350	W	88.2	Confident	87.4	Confident	70 Å²	70	96.9 Å²	96.9	27%	0.265	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-78.5	117	-177.9	-179.9	81.9	0	0	0	111.1	A336 K338 W342 G348 A352	A336-W350 HydrophobicContact CB-CH2 4.27Å; A336-W350 HydrophobicContact CB-CZ2 4.48Å; A336-W350 WeakPolarHBondContact O-CH2 3.47Å; K338-W350 HydrophobicContact CB-CD2 3.76Å; K338-W350 HydrophobicContact CB-CE3 3.83Å; K338-W350 HydrophobicContact CB-CG 4.18Å; K338-W350 HydrophobicContact CB-CZ2 4.46Å; K338-W350 HydrophobicContact CB-CZ3 4.22Å; K338-W350 HydrophobicContact CD-CB 3.98Å; K338-W350 HydrophobicContact CD-CG 4.22Å; K338-W350 HydrophobicContact CG-CB 4.04Å; K338-W350 HydrophobicContact CG-CD2 3.87Å; K338-W350 HydrophobicContact CG-CE3 4.32Å; K338-W350 HydrophobicContact CG-CG 3.72Å; W342-W350 HydrophobicContact CD2-CB 4.42Å; W342-W350 AromaticContact CD2-CD1 3.67Å; W342-W350 HydrophobicContact CD2-CG 4.42Å; W342-W350 AromaticContact CE2-CD1 3.81Å; W342-W350 AromaticContact CE3-CD1 3.73Å; W342-W350 HydrophobicContact CZ2-CB 4.45Å; W342-W350 AromaticContact CZ3-CD1 3.95Å; G348-W350 PolarHBondContact O-N 2.88Å; W350-A352 HydrophobicContact CH2-CB 3.71Å; W350-A352 HydrophobicContact CZ2-CB 4.4Å; W350-A352 HydrophobicContact CZ3-CB 3.97Å
351	E	86.7	Confident	87.1	Confident	169 Å²	169	94.5 Å²	94.5	79%	0.79	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-98.8	136.6	169.7	-64.3	-168.2	156.3	0	0	110.8	E349	E349-E351 PolarHBondContact O-N 2.89Å
352	A	89.1	Confident	86.6	Confident	21 Å²	21	91.9 Å²	91.9	17%	0.174	48%	0.483	C	S	.	.	P	Polyproline II helix	trans	-68.3	142	176.3	0	0	0	0	0	111.2	P332 W350 Q354	P332-A352 HydrophobicContact CB-CB 3.88Å; W350-A352 HydrophobicContact CH2-CB 3.71Å; W350-A352 HydrophobicContact CZ2-CB 4.4Å; W350-A352 HydrophobicContact CZ3-CB 3.97Å; A352-Q354 PolarHBondContact O-NE2 2.78Å
353	P	90.4	Very high	86.4	Confident	71 Å²	71	88.9 Å²	88.9	46%	0.461	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-57.3	141	178.7	24.8	-34.1	0	0	0	111.1	D333 A336	D333-P353 HydrophobicContact CB-CG 4.07Å; D333-P353 WeakPolarHBondContact CB-O 3.44Å; D333-P353 PolarHBondContact N-O 3.48Å; A336-P353 HydrophobicContact CB-CG 3.8Å
354	Q	91	Very high	86.1	Confident	105 Å²	105	88.3 Å²	88.3	49%	0.491	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	116.1	-176.7	-63.3	-58.9	-65	0	0	110.3	V331 A352	V331-Q354 WeakPolarHBondContact O-CA 3.4Å; A352-Q354 PolarHBondContact O-NE2 2.78Å
355	I	88.1	Confident	85.8	Confident	61 Å²	61	83.3 Å²	83.3	31%	0.313	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	152.8	174.3	58.2	168.9	0	0	0	110.4	Y330 V331 D333 N357	Y330-I355 CarbonylContact C-O 3.47Å; Y330-I355 WeakPolarHBondContact CA-O 3.46Å; V331-I355 HydrophobicContact CG2-CG1 4Å; V331-I355 PolarHBondContact N-O 3.37Å; V331-I355 WeakPolarHBondContact O-CG1 3.48Å; V331-I355 PolarHBondContact O-N 2.86Å; D333-I355 HydrophobicContact CB-CD1 4.3Å; D333-I355 HydrophobicContact CB-CG1 4.3Å; D333-I355 HydrophobicContact CB-CG2 3.95Å; I355-N357 PolarHBondContact O-N 3.03Å
356	A	87.8	Confident	85.6	Confident	59 Å²	59	76.7 Å²	76.7	49%	0.488	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	132.3	173.5	0	0	0	0	0	109.9	P358	A356-P358 WeakPolarHBondContact O-CD 3.43Å
357	N	85.1	Confident	85.3	Confident	5 Å²	5	70 Å²	70	3%	0.027	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-68.3	118.9	-176.6	175.4	-5.1	0	0	0	109.9	E327 P328 E329 V331 I355 K359 C360	E327-N357 PolarHBondContact OE2-ND2 2.72Å; P328-N357 VanDerWaalsContact O-CB 3.25Å; P328-N357 WeakPolarHBondContact O-CB 3.36Å; P328-N357 PolarHBondContact O-ND2 2.87Å; E329-N357 WeakPolarHBondContact O-CB 3.4Å; E329-N357 PolarHBondContact O-N 2.86Å; V331-N357 HydrophobicContact CG1-CB 4.04Å; V331-N357 HydrophobicContact CG2-CB 4.25Å; I355-N357 PolarHBondContact O-N 3.03Å; N357-K359 PolarHBondContact O-N 3.16Å; N357-K359 WeakPolarHBondContact OD1-CB 3.14Å; N357-K359 WeakPolarHBondContact OD1-CG 3.33Å; N357-K359 PolarHBondContact OD1-N 3.15Å; N357-C360 VanDerWaalsContact CB-SG 3.58Å; N357-C360 WeakPolarHBondContact O-CA 3.45Å; N357-C360 WeakPolarHBondContact O-CB 3.35Å; N357-C360 PolarHBondContact O-N 2.67Å
358	P	85.9	Confident	85.4	Confident	84 Å²	84	71.6 Å²	71.6	55%	0.545	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-12.9	-172.1	25.7	-35.1	0	0	0	113.9	A356 C360	A356-P358 WeakPolarHBondContact O-CD 3.43Å; P358-C360 VanDerWaalsContact C-N 3.29Å
359	K	81.6	Confident	85.2	Confident	101 Å²	101	72.9 Å²	72.9	44%	0.439	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-34.6	168.6	-60.2	169.9	-169.1	167.6	0	111.4	E327 N357 S362	E327-K359 VanDerWaalsContact CD-CD 3.42Å; E327-K359 HydrophobicContact CG-CD 4.18Å; E327-K359 WeakPolarHBondContact OE1-CD 3.44Å; E327-K359 IonicContact OE1-NZ 3.69Å; E327-K359 PolarHBondContact OE1-NZ 2.91Å; E327-K359 VanDerWaalsContact OE2-CD 3.26Å; E327-K359 WeakPolarHBondContact OE2-CD 3.3Å; E327-K359 IonicContact OE2-NZ 2.67Å; E327-K359 PolarHBondContact OE2-NZ 3.44Å; N357-K359 PolarHBondContact O-N 3.16Å; N357-K359 WeakPolarHBondContact OD1-CB 3.14Å; N357-K359 WeakPolarHBondContact OD1-CG 3.33Å; N357-K359 PolarHBondContact OD1-N 3.15Å; K359-S362 PolarHBondContact O-N 3.45Å; K359-S362 VanDerWaalsContact O-N 3.17Å; K359-S362 PolarHBondContact O-OG 3.04Å
360	C	82.4	Confident	84.9	Confident	21 Å²	21	72.2 Å²	72.2	14%	0.142	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-74.2	-26.2	-173.3	-54.7	0	0	0	0	112.7	N357 P358 S362 A363 C366	N357-C360 VanDerWaalsContact CB-SG 3.58Å; N357-C360 WeakPolarHBondContact O-CA 3.45Å; N357-C360 WeakPolarHBondContact O-CB 3.35Å; N357-C360 PolarHBondContact O-N 2.67Å; P358-C360 VanDerWaalsContact C-N 3.29Å; C360-S362 PolarHBondContact O-N 2.82Å; C360-A363 PolarHBondContact O-N 3.06Å; C360-A363 VanDerWaalsContact O-N 3.08Å; C360-A363 VanDerWaalsContact O-O 3.07Å; C360-C366 VanDerWaalsContact CA-SG 3.52Å; C360-C366 HydrophobicContact CB-CB 3.83Å; C360-C366 WeakPolarHBondContact CB-SG 3.46Å; C360-C366 WeakPolarHBondContact SG-CB 3.41Å; C360-C366 CovalentContact SG-SG 2.01Å; C360-C366 PolarHBondContact SG-SG 3.01Å
361	E	80.4	Confident	84.8	Confident	164 Å²	164	73.9 Å²	73.9	77%	0.766	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-58.1	-25.4	169	-59.6	-173.6	161.5	0	0	112.9
362	S	78.9	Confident	84.9	Confident	107 Å²	107	69 Å²	69	75%	0.748	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-94	0.9	179.2	75.7	0	0	0	0	114.5	K359 C360	K359-S362 PolarHBondContact O-N 3.45Å; K359-S362 VanDerWaalsContact O-N 3.17Å; K359-S362 PolarHBondContact O-OG 3.04Å; C360-S362 PolarHBondContact O-N 2.82Å
363	A	82.1	Confident	85	Confident	25 Å²	25	72.5 Å²	72.5	21%	0.207	40%	0.403	C	S	.	.	S	Bend	trans	-126.3	165.2	-174.8	0	0	0	0	0	111.9	L324 C360 G365	L324-A363 HydrophobicContact CD1-CB 3.77Å; L324-A363 HydrophobicContact CG-CB 3.94Å; C360-A363 PolarHBondContact O-N 3.06Å; C360-A363 VanDerWaalsContact O-N 3.08Å; C360-A363 VanDerWaalsContact O-O 3.07Å; A363-G365 PolarHBondContact O-N 2.87Å
364	P	83.1	Confident	85	Confident	74 Å²	74	72.8 Å²	72.8	48%	0.481	40%	0.4	S	S	.	.	S	Bend	trans	-68.4	-9.4	174.2	-19.8	33.6	0	0	0	114.9	P320 G322	P320-P364 HydrophobicContact CB-CB 3.83Å; P320-P364 HydrophobicContact CB-CG 4.38Å; P320-P364 HydrophobicContact CG-CB 4.49Å; G322-P364 WeakPolarHBondContact O-CD 3.33Å
365	G	83.1	Confident	85	Confident	15 Å²	15	73 Å²	73	16%	0.155	41%	0.405	C	S	.	.			trans	155.2	170.4	-178.6	0	0	0	0	0	112.4	L324 A363	L324-G365 PolarHBondContact N-O 3.38Å; A363-G365 PolarHBondContact O-N 2.87Å
366	C	83.4	Confident	85	Confident	7 Å²	7	71 Å²	71	5%	0.047	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-138.7	168.2	-172.7	-83.9	0	0	0	0	112.3	W323 L324 E329 C360	W323-C366 VanDerWaalsContact CZ2-O 3.25Å; W323-C366 WeakPolarHBondContact CZ2-O 3.28Å; W323-C366 PolarHBondContact NE1-O 2.79Å; L324-C366 CarbonylContact O-C 3.52Å; L324-C366 WeakPolarHBondContact O-CA 3.45Å; E329-C366 HydrophobicContact CB-CB 4.41Å; C360-C366 VanDerWaalsContact CA-SG 3.52Å; C360-C366 HydrophobicContact CB-CB 3.83Å; C360-C366 WeakPolarHBondContact CB-SG 3.46Å; C360-C366 WeakPolarHBondContact SG-CB 3.41Å; C360-C366 CovalentContact SG-SG 2.01Å; C360-C366 PolarHBondContact SG-SG 3.01Å
367	G	83.6	Confident	84.9	Confident	12 Å²	12	73.8 Å²	73.8	12%	0.124	41%	0.408	C	S	.	.	S	Bend	trans	70.1	-171.7	-179.7	0	0	0	0	0	113	W323 L324 E327 W369	W323-G367 PolarHBondContact NE1-O 2.84Å; L324-G367 PolarHBondContact O-N 2.91Å; E327-G367 WeakPolarHBondContact O-CA 3.37Å; E327-G367 PolarHBondContact O-N 3.25Å; G367-W369 PolarHBondContact O-N 3.16Å
368	V	84.9	Confident	84.9	Confident	127 Å²	127	79 Å²	79	77%	0.77	44%	0.436	S	S	*	.	S	Bend	trans	-67	107.5	-178.7	-178.1	0	0	0	0	109.9	Q370	V368-Q370 PolarHBondContact O-N 2.8Å; V368-Q370 VanDerWaalsContact O-N 3.11Å
369	W	84.1	Confident	85	Confident	53 Å²	53	80.4 Å²	80.4	20%	0.201	43%	0.431	C	S	.	.			trans	-57.7	115.8	-179.6	178.4	72	0	0	0	111.8	K319 W323 G367 R371	K319-W369 HydrophobicContact CB-CD2 3.65Å; K319-W369 HydrophobicContact CB-CE3 3.74Å; K319-W369 HydrophobicContact CB-CG 4.25Å; K319-W369 HydrophobicContact CB-CH2 3.94Å; K319-W369 HydrophobicContact CB-CZ2 3.89Å; K319-W369 HydrophobicContact CB-CZ3 3.88Å; K319-W369 HydrophobicContact CD-CB 3.8Å; K319-W369 HydrophobicContact CD-CD2 3.88Å; K319-W369 HydrophobicContact CD-CE3 3.99Å; K319-W369 HydrophobicContact CD-CG 3.8Å; K319-W369 HydrophobicContact CG-CB 4.21Å; K319-W369 HydrophobicContact CG-CD2 3.66Å; K319-W369 HydrophobicContact CG-CE3 4.08Å; K319-W369 HydrophobicContact CG-CG 3.71Å; W323-W369 HydrophobicContact CD2-CB 4.28Å; W323-W369 AromaticContact CD2-CD1 3.86Å; W323-W369 HydrophobicContact CD2-CG 4.41Å; W323-W369 AromaticContact CE2-CD1 3.85Å; W323-W369 AromaticContact CE3-CD1 3.8Å; W323-W369 HydrophobicContact CG-CB 4.5Å; W323-W369 AromaticContact CH2-CD1 3.81Å; W323-W369 HydrophobicContact CZ2-CB 4.23Å; W323-W369 AromaticContact CZ2-CD1 3.84Å; W323-W369 HydrophobicContact CZ2-CG 4.47Å; W323-W369 AromaticContact CZ3-CD1 3.77Å; G367-W369 PolarHBondContact O-N 3.16Å; W369-R371 HydrophobicContact CE3-CG 4.42Å; W369-R371 HydrophobicContact CH2-CB 4.44Å; W369-R371 HydrophobicContact CH2-CG 3.48Å; W369-R371 VanDerWaalsContact CH2-CG 3.48Å; W369-R371 HydrophobicContact CZ2-CG 4.24Å; W369-R371 HydrophobicContact CZ3-CG 3.57Å
370	Q	83	Confident	85	Confident	166 Å²	166	79.7 Å²	79.7	78%	0.776	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-91.2	137.1	170.8	-58.1	-170.4	19.7	0	0	109.6	V368	V368-Q370 PolarHBondContact O-N 2.8Å; V368-Q370 VanDerWaalsContact O-N 3.11Å
371	R	86.8	Confident	85.2	Confident	105 Å²	105	79.1 Å²	79.1	40%	0.396	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-63.2	138.5	171.1	-79.3	176.7	174.3	-83.2	-3.6	109.5	P313 D314 E315 A317 W369	P313-R371 HydrophobicContact CB-CB 4.13Å; D314-R371 WeakPolarHBondContact O-CD 3.44Å; D314-R371 PolarHBondContact O-NH1 2.7Å; E315-R371 PolarHBondContact O-NH1 3.38Å; A317-R371 PolarHBondContact O-NH1 2.91Å; W369-R371 HydrophobicContact CE3-CG 4.42Å; W369-R371 HydrophobicContact CH2-CB 4.44Å; W369-R371 HydrophobicContact CH2-CG 3.48Å; W369-R371 VanDerWaalsContact CH2-CG 3.48Å; W369-R371 HydrophobicContact CZ2-CG 4.24Å; W369-R371 HydrophobicContact CZ3-CG 3.57Å
372	P	87.9	Confident	85.5	Confident	66 Å²	66	79.4 Å²	79.4	43%	0.429	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-61.1	146	171.4	26.7	-32.1	0	0	0	110	D314 A317	D314-P372 HydrophobicContact CB-CG 4.04Å; D314-P372 WeakPolarHBondContact CB-O 3.5Å; D314-P372 PolarHBondContact N-O 2.7Å; A317-P372 HydrophobicContact CB-CG 3.51Å
373	M	91.5	Very high	85.9	Confident	95 Å²	95	77.1 Å²	77.1	47%	0.468	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	100.6	-173.3	-67.8	-68.1	-66.1	0	0	110.1	K311 I312 P313	K311-M373 HydrophobicContact CB-CB 4.05Å; K311-M373 HydrophobicContact CB-CE 4Å; K311-M373 HydrophobicContact CD-CB 4.08Å; K311-M373 PolarHBondContact NZ-O 3.08Å; I312-M373 CarbonylContact O-C 3.52Å; I312-M373 WeakPolarHBondContact O-CA 3.34Å; P313-M373 HydrophobicContact CB-SD 4.09Å; P313-M373 HydrophobicContact CG-CE 4.41Å; P313-M373 HydrophobicContact CG-SD 3.83Å
374	I	89.4	Confident	86.1	Confident	76 Å²	76	84 Å²	84	39%	0.39	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	153	177	55.4	171.4	0	0	0	111.2	K311 I312 D314	K311-I374 CarbonylContact C-O 3.59Å; K311-I374 WeakPolarHBondContact CA-O 3.25Å; K311-I374 WeakPolarHBondContact CB-O 3.33Å; I312-I374 HydrophobicContact CG1-CG1 4.03Å; I312-I374 PolarHBondContact N-O 2.89Å; I312-I374 WeakPolarHBondContact O-CG1 3.46Å; I312-I374 PolarHBondContact O-N 3.46Å; D314-I374 HydrophobicContact CB-CD1 4.25Å; D314-I374 HydrophobicContact CB-CG1 4.17Å; D314-I374 HydrophobicContact CB-CG2 3.98Å
375	D	91.1	Very high	86.4	Confident	110 Å²	110	82.3 Å²	82.3	59%	0.588	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	132.6	179	-59.9	-44.6	0	0	0	110.6	K311 P377	K311-D375 WeakPolarHBondContact CE-OD1 3.35Å; K311-D375 WeakPolarHBondContact CG-OD1 3.35Å; K311-D375 IonicContact NZ-OD1 2.64Å; K311-D375 PolarHBondContact NZ-OD1 3.18Å; K311-D375 IonicContact NZ-OD2 2.6Å; D375-P377 WeakPolarHBondContact O-CD 3.32Å
376	N	88.6	Confident	86.8	Confident	18 Å²	18	85 Å²	85	10%	0.096	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-77.2	117.5	-173.8	176.3	3.6	0	0	0	110.9	P309 A310 I312 N378 Y379	P309-N376 WeakPolarHBondContact O-CB 3.44Å; P309-N376 PolarHBondContact O-ND2 2.97Å; A310-N376 PolarHBondContact O-N 2.93Å; I312-N376 HydrophobicContact CD1-CB 4.38Å; I312-N376 HydrophobicContact CG1-CB 4.22Å; I312-N376 HydrophobicContact CG2-CB 4.08Å; N376-N378 PolarHBondContact O-N 2.68Å; N376-N378 PolarHBondContact OD1-N 3.46Å; N376-N378 PolarHBondContact OD1-ND2 2.97Å; N376-Y379 WeakPolarHBondContact O-CB 3.38Å; N376-Y379 PolarHBondContact O-N 3.46Å
377	P	86.4	Confident	87.2	Confident	119 Å²	119	89.8 Å²	89.8	77%	0.773	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-17.1	-178.7	-24.2	35.5	0	0	0	114.8	D375	D375-P377 WeakPolarHBondContact O-CD 3.32Å
378	N	85.4	Confident	87.7	Confident	114 Å²	114	92.2 Å²	92.2	61%	0.61	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-5.1	177.8	-55.1	-73.3	0	0	0	113.1	N376 K380	N376-N378 PolarHBondContact O-N 2.68Å; N376-N378 PolarHBondContact OD1-N 3.46Å; N376-N378 PolarHBondContact OD1-ND2 2.97Å; N378-K380 PolarHBondContact O-N 2.77Å
379	Y	87.3	Confident	88.1	Confident	113 Å²	113	91.4 Å²	91.4	44%	0.443	45%	0.452	S	S	.	.			trans	-73.6	113.1	-179.2	179.8	-111.6	0	0	0	111.6	A308 A310 N376 G381	A308-Y379 WeakPolarHBondContact O-CD2 3.18Å; A310-Y379 HydrophobicContact CB-CD1 3.85Å; A310-Y379 HydrophobicContact CB-CD2 4.18Å; A310-Y379 HydrophobicContact CB-CE1 3.68Å; A310-Y379 HydrophobicContact CB-CE2 4.02Å; A310-Y379 HydrophobicContact CB-CG 4.09Å; N376-Y379 WeakPolarHBondContact O-CB 3.38Å; N376-Y379 PolarHBondContact O-N 3.46Å; Y379-G381 VanDerWaalsContact CZ-CA 3.48Å
380	K	82.4	Confident	88.4	Confident	87 Å²	87	89.6 Å²	89.6	38%	0.378	45%	0.446	S	S	.	.			trans	-105.8	-5.6	174.6	-61.5	174.5	-177.4	164.4	0	112.9	D303 W304 N378	D303-K380 PolarHBondContact O-NZ 3.38Å; D303-K380 IonicContact OD2-NZ 3.58Å; D303-K380 PolarHBondContact OD2-NZ 2.74Å; W304-K380 HydrophobicContact CD2-CB 3.75Å; W304-K380 HydrophobicContact CD2-CD 3.84Å; W304-K380 HydrophobicContact CD2-CG 4.42Å; W304-K380 VanDerWaalsContact CE2-CB 3.4Å; W304-K380 HydrophobicContact CE3-CB 4.2Å; W304-K380 HydrophobicContact CE3-CD 3.77Å; W304-K380 HydrophobicContact CG-CB 4.26Å; W304-K380 HydrophobicContact CG-CD 4.18Å; W304-K380 HydrophobicContact CH2-CB 4.09Å; W304-K380 HydrophobicContact CZ2-CB 3.62Å; W304-K380 WeakPolarHBondContact CZ2-O 3.46Å; W304-K380 HydrophobicContact CZ3-CB 4.35Å; W304-K380 HydrophobicContact CZ3-CD 4.29Å; N378-K380 PolarHBondContact O-N 2.77Å
381	G	85.7	Confident	88.8	Confident	9 Å²	9	87.4 Å²	87.4	9%	0.093	45%	0.447	C	S	.	.			trans	69.9	-164.2	-174.3	0	0	0	0	0	112.7	W304 Y379	W304-G381 PolarHBondContact NE1-O 2.96Å; Y379-G381 VanDerWaalsContact CZ-CA 3.48Å
382	K	86.4	Confident	88.9	Confident	170 Å²	170	86 Å²	86	74%	0.739	45%	0.453	S	S	*	.	S	Bend	trans	-75.4	129.9	177.3	-67.1	-170	177.1	-174.5	0	111.3	E306	E306-K382 VanDerWaalsContact OE1-CA 3.24Å; E306-K382 WeakPolarHBondContact OE1-CA 3.27Å
383	W	87.8	Confident	89.1	Confident	58 Å²	58	87.5 Å²	87.5	22%	0.22	45%	0.45	C	S	.	.			trans	-67.6	142.9	-179.6	-176	77	0	0	0	110.5	A298 K300 W304 E306 P385	A298-W383 HydrophobicContact CB-CH2 3.99Å; A298-W383 HydrophobicContact CB-CZ2 4.26Å; A298-W383 WeakPolarHBondContact O-CH2 3.28Å; K300-W383 HydrophobicContact CB-CD2 3.84Å; K300-W383 HydrophobicContact CB-CE3 3.74Å; K300-W383 HydrophobicContact CB-CG 4.21Å; K300-W383 HydrophobicContact CB-CZ3 4.2Å; K300-W383 HydrophobicContact CD-CB 4.33Å; K300-W383 HydrophobicContact CG-CB 3.98Å; K300-W383 HydrophobicContact CG-CD2 4.11Å; K300-W383 HydrophobicContact CG-CE3 4.37Å; K300-W383 HydrophobicContact CG-CG 3.94Å; W304-W383 HydrophobicContact CD2-CB 4.17Å; W304-W383 AromaticContact CD2-CD1 3.63Å; W304-W383 HydrophobicContact CD2-CG 4.29Å; W304-W383 AromaticContact CE2-CD1 3.86Å; W304-W383 AromaticContact CE3-CD1 3.71Å; W304-W383 HydrophobicContact CG-CB 4.14Å; W304-W383 HydrophobicContact CG-CG 4.48Å; W304-W383 HydrophobicContact CZ2-CB 4.41Å; E306-W383 PolarHBondContact OE1-N 2.62Å; W383-P385 HydrophobicContact CH2-CB 3.61Å; W383-P385 HydrophobicContact CH2-CG 4.39Å; W383-P385 HydrophobicContact CZ2-CB 4.25Å; W383-P385 HydrophobicContact CZ3-CB 3.99Å; W383-P385 HydrophobicContact CZ3-CG 4.28Å
384	K	87.3	Confident	88.9	Confident	170 Å²	170	87.3 Å²	87.3	74%	0.739	45%	0.448	S	S	*	.			trans	-132.6	131.7	173.3	-64.3	-179.7	-176.6	176.2	0	108.5
385	P	88.9	Confident	89	Confident	39 Å²	39	84.6 Å²	84.6	25%	0.253	44%	0.44	S	S	.	.			trans	-61.6	152.9	171.4	27.2	-35	0	0	0	110.5	P294 A298 W383	P294-P385 HydrophobicContact CB-CG 3.73Å; A298-P385 HydrophobicContact CB-CB 4Å; W383-P385 HydrophobicContact CH2-CB 3.61Å; W383-P385 HydrophobicContact CH2-CG 4.39Å; W383-P385 HydrophobicContact CZ2-CB 4.25Å; W383-P385 HydrophobicContact CZ3-CB 3.99Å; W383-P385 HydrophobicContact CZ3-CG 4.28Å
386	P	90.4	Very high	89	Confident	72 Å²	72	85.2 Å²	85.2	47%	0.468	44%	0.441	S	S	.	.			trans	-60.4	154.3	168.2	28.1	-33.3	0	0	0	110.5	D295 A298	D295-P386 HydrophobicContact CB-CG 3.87Å; D295-P386 WeakPolarHBondContact CB-O 3.36Å; D295-P386 PolarHBondContact N-O 2.82Å; A298-P386 HydrophobicContact CB-CG 4.12Å
387	M	93.1	Very high	89.2	Confident	106 Å²	106	86.6 Å²	86.6	52%	0.522	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	115.1	177.7	-65.7	-67.4	-66.4	0	0	109.5	K292 I293 P294	K292-M387 HydrophobicContact CB-CB 4.26Å; K292-M387 HydrophobicContact CB-CE 3.99Å; K292-M387 HydrophobicContact CD-CB 4.48Å; K292-M387 WeakPolarHBondContact O-CE 3.43Å; I293-M387 CarbonylContact O-C 3.54Å; I293-M387 WeakPolarHBondContact O-CA 3.06Å; P294-M387 HydrophobicContact CG-SD 4.05Å
388	I	92.6	Very high	89.4	Confident	63 Å²	63	88 Å²	88	32%	0.323	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	153.6	175.6	59.1	171.3	0	0	0	110.8	K292 I293 D295 N390	K292-I388 CarbonylContact C-O 3.59Å; K292-I388 WeakPolarHBondContact CA-O 3.28Å; K292-I388 WeakPolarHBondContact CB-O 3.34Å; I293-I388 HydrophobicContact CG1-CG1 4.04Å; I293-I388 PolarHBondContact N-O 2.7Å; I293-I388 PolarHBondContact O-N 3.44Å; D295-I388 HydrophobicContact CB-CD1 4.41Å; D295-I388 HydrophobicContact CB-CG1 4.37Å; D295-I388 HydrophobicContact CB-CG2 4.01Å; I388-N390 PolarHBondContact O-N 2.84Å
389	D	93.4	Very high	89.7	Confident	111 Å²	111	84 Å²	84	59%	0.594	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65	132.7	173.6	-60.2	-36.4	0	0	0	110	K292 P391	K292-D389 WeakPolarHBondContact CG-OD1 3.07Å; K292-D389 IonicContact NZ-OD1 2.7Å; K292-D389 PolarHBondContact NZ-OD1 3.5Å; D389-P391 VanDerWaalsContact O-CD 3.3Å; D389-P391 WeakPolarHBondContact O-CD 3.31Å
390	N	91.6	Very high	89.9	Confident	14 Å²	14	87.1 Å²	87.1	8%	0.075	43%	0.431	C	S	.	.			trans	-80.5	115.7	-168.8	179.2	6.6	0	0	0	111.7	D288 R290 P291 I293 I388 S392 Y393	D288-N390 PolarHBondContact OD2-ND2 2.97Å; R290-N390 VanDerWaalsContact O-CB 3.23Å; R290-N390 WeakPolarHBondContact O-CB 3.33Å; R290-N390 PolarHBondContact O-ND2 3.24Å; P291-N390 PolarHBondContact O-N 2.89Å; I293-N390 HydrophobicContact CD1-CB 4.33Å; I293-N390 HydrophobicContact CG1-CB 4.03Å; I293-N390 HydrophobicContact CG2-CB 4Å; I388-N390 PolarHBondContact O-N 2.84Å; N390-S392 PolarHBondContact O-N 3.03Å; N390-S392 VanDerWaalsContact O-N 3.1Å; N390-S392 PolarHBondContact OD1-N 3.19Å; N390-Y393 WeakPolarHBondContact O-CB 3.41Å; N390-Y393 PolarHBondContact O-N 3.13Å; N390-Y393 VanDerWaalsContact O-N 3.1Å
391	P	90.1	Very high	90.4	Very high	121 Å²	121	89.5 Å²	89.5	79%	0.786	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-17	-180	-21.1	34.4	0	0	0	114.3	D389	D389-P391 VanDerWaalsContact O-CD 3.3Å; D389-P391 WeakPolarHBondContact O-CD 3.31Å
392	S	90.6	Very high	90.7	Very high	74 Å²	74	91.6 Å²	91.6	52%	0.517	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	2.9	178.9	-57.6	0	0	0	0	113.8	N390 Q394	N390-S392 PolarHBondContact O-N 3.03Å; N390-S392 VanDerWaalsContact O-N 3.1Å; N390-S392 PolarHBondContact OD1-N 3.19Å; S392-Q394 PolarHBondContact O-N 3.1Å; S392-Q394 PolarHBondContact O-NE2 3.49Å
393	Y	91.7	Very high	90.9	Very high	98 Å²	98	88.7 Å²	88.7	38%	0.384	45%	0.448	S	S	.	.	B	Isolated β-bridge	trans	-65.6	117.1	-179.3	176.6	-125.1	0	0	0	111.2	E289 P291 N390 G395	E289-Y393 VanDerWaalsContact O-CE2 3.27Å; E289-Y393 WeakPolarHBondContact O-CE2 3.27Å; P291-Y393 HydrophobicContact CB-CD1 4.43Å; P291-Y393 HydrophobicContact CB-CE1 4.2Å; P291-Y393 HydrophobicContact CB-CE2 4.31Å; N390-Y393 WeakPolarHBondContact O-CB 3.41Å; N390-Y393 PolarHBondContact O-N 3.13Å; N390-Y393 VanDerWaalsContact O-N 3.1Å; Y393-G395 VanDerWaalsContact CZ-CA 3.5Å
394	Q	87.4	Confident	91	Very high	91 Å²	91	86.9 Å²	86.9	43%	0.425	44%	0.443	S	S	.	.			trans	-100.4	5.5	-177.2	-74.4	160.9	83.8	0	0	112.9	D286 W287 D288 S392	D286-Q394 PolarHBondContact O-NE2 3.04Å; D286-Q394 VanDerWaalsContact O-NE2 3.11Å; W287-Q394 HydrophobicContact CD2-CB 3.84Å; W287-Q394 VanDerWaalsContact CE2-CB 3.48Å; W287-Q394 HydrophobicContact CE3-CB 4.28Å; W287-Q394 HydrophobicContact CG-CB 4.35Å; W287-Q394 HydrophobicContact CH2-CB 4.14Å; W287-Q394 HydrophobicContact CZ2-CB 3.67Å; W287-Q394 WeakPolarHBondContact CZ2-O 3.32Å; W287-Q394 HydrophobicContact CZ3-CB 4.41Å; D288-Q394 PolarHBondContact O-N 2.79Å; S392-Q394 PolarHBondContact O-N 3.1Å; S392-Q394 PolarHBondContact O-NE2 3.49Å
395	G	90.1	Very high	90.9	Very high	20 Å²	20	83 Å²	83	21%	0.206	44%	0.435	C	S	.	.			trans	89	173.3	-168.3	0	0	0	0	0	112.1	W287 Y393 W397	W287-G395 PolarHBondContact NE1-O 2.76Å; Y393-G395 VanDerWaalsContact CZ-CA 3.5Å; G395-W397 PolarHBondContact O-N 3.19Å
396	I	91.3	Very high	90.7	Very high	122 Å²	122	85.3 Å²	85.3	63%	0.626	45%	0.445	S	S	*	.	S	Bend	trans	-68.4	126	168.7	-58.3	172.8	0	0	0	108
397	W	92.7	Very high	90.5	Very high	48 Å²	48	84.3 Å²	84.3	18%	0.182	43%	0.433	C	S	.	.			trans	-68.5	144.9	179.6	-177.3	83.8	0	0	0	110.7	K283 W287 E289 G395 P399	K283-W397 HydrophobicContact CB-CD2 3.68Å; K283-W397 HydrophobicContact CB-CE3 3.71Å; K283-W397 HydrophobicContact CB-CG 4.05Å; K283-W397 HydrophobicContact CB-CZ3 4.18Å; K283-W397 HydrophobicContact CD-CB 4.21Å; K283-W397 HydrophobicContact CG-CB 3.88Å; K283-W397 HydrophobicContact CG-CD2 3.98Å; K283-W397 HydrophobicContact CG-CE3 4.32Å; K283-W397 HydrophobicContact CG-CG 3.77Å; K283-W397 VanDerWaalsContact N-CZ2 3.32Å; W287-W397 HydrophobicContact CD2-CB 4.32Å; W287-W397 AromaticContact CD2-CD1 3.77Å; W287-W397 HydrophobicContact CD2-CG 4.44Å; W287-W397 AromaticContact CE2-CD1 3.95Å; W287-W397 AromaticContact CE3-CD1 3.99Å; W287-W397 HydrophobicContact CG-CB 4.18Å; E289-W397 WeakPolarHBondContact OE1-CB 3.17Å; E289-W397 PolarHBondContact OE1-N 3.46Å; G395-W397 PolarHBondContact O-N 3.19Å; W397-P399 HydrophobicContact CH2-CB 3.8Å; W397-P399 HydrophobicContact CH2-CG 3.66Å; W397-P399 HydrophobicContact CZ2-CB 4.39Å; W397-P399 HydrophobicContact CZ3-CB 4.32Å; W397-P399 HydrophobicContact CZ3-CG 3.67Å
398	K	90.8	Very high	90.3	Very high	148 Å²	148	80 Å²	80	64%	0.643	41%	0.412	S	S	*	.			trans	-138.2	143.2	171.6	-61.6	-168.7	178.8	-169.2	0	109.3
399	P	92.7	Very high	90.1	Very high	30 Å²	30	82.1 Å²	82.1	20%	0.195	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-59	149.9	175.5	-15.5	26	0	0	0	111.2	E277 D281 W397	E277-P399 HydrophobicContact CB-CB 3.96Å; E277-P399 HydrophobicContact CB-CG 4.12Å; E277-P399 HydrophobicContact CG-CB 4.35Å; E277-P399 HydrophobicContact CG-CG 4.42Å; D281-P399 HydrophobicContact CB-CB 4.42Å; W397-P399 HydrophobicContact CH2-CB 3.8Å; W397-P399 HydrophobicContact CH2-CG 3.66Å; W397-P399 HydrophobicContact CZ2-CB 4.39Å; W397-P399 HydrophobicContact CZ3-CB 4.32Å; W397-P399 HydrophobicContact CZ3-CG 3.67Å
400	R	90.6	Very high	89.8	Confident	179 Å²	179	78.9 Å²	78.9	68%	0.675	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-64.8	143.7	175	-68.4	160.9	70.8	-159.9	0.7	109.9	D278 D281	D278-R400 VanDerWaalsContact CB-O 3.29Å; D278-R400 WeakPolarHBondContact CB-O 3.44Å; D278-R400 PolarHBondContact N-O 3.5Å; D281-R400 WeakPolarHBondContact OD2-CB 3.29Å; D281-R400 VanDerWaalsContact OD2-CD 3.24Å; D281-R400 WeakPolarHBondContact OD2-CD 3.46Å; D281-R400 WeakPolarHBondContact OD2-CG 3.36Å; D281-R400 PolarHBondContact OD2-N 2.91Å
401	K	92.7	Very high	89.6	Confident	137 Å²	137	83.8 Å²	83.8	60%	0.596	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	131.2	176.7	-67.6	-168.8	179.1	-172.6	0	111	E275 I276	E275-K401 HydrophobicContact CB-CB 4.25Å; E275-K401 HydrophobicContact CB-CD 4.35Å; E275-K401 VanDerWaalsContact OE2-CD 3.25Å; E275-K401 WeakPolarHBondContact OE2-CD 3.41Å; I276-K401 CarbonylContact O-C 3.51Å; I276-K401 WeakPolarHBondContact O-CA 2.93Å
402	I	92.1	Very high	89.6	Confident	53 Å²	53	82.2 Å²	82.2	27%	0.272	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	149.7	175.7	55.8	170.1	0	0	0	110.5	E275 I276 D278 N404	E275-I402 CarbonylContact C-O 3.56Å; E275-I402 VanDerWaalsContact CA-O 3.28Å; E275-I402 WeakPolarHBondContact CA-O 3.44Å; I276-I402 HydrophobicContact CG1-CD1 4.37Å; I276-I402 HydrophobicContact CG1-CG1 3.91Å; I276-I402 PolarHBondContact N-O 3.28Å; I276-I402 PolarHBondContact O-N 3.01Å; D278-I402 HydrophobicContact CB-CD1 4.04Å; D278-I402 HydrophobicContact CB-CG1 4.12Å; D278-I402 HydrophobicContact CB-CG2 3.95Å; I402-N404 PolarHBondContact O-N 3.04Å
403	P	92.1	Very high	89.5	Confident	109 Å²	109	78.7 Å²	78.7	71%	0.708	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.5	129.4	174.6	-22.9	34.1	0	0	0	111.2	P405	P403-P405 WeakPolarHBondContact O-CD 3.45Å
404	N	88.4	Confident	89.5	Confident	20 Å²	20	74.2 Å²	74.2	11%	0.107	37%	0.369	C	S	.	.			trans	-72.5	117.9	-176.1	178.4	-3.4	0	0	0	111	S273 R274 I276 I402 D406 F407	S273-N404 WeakPolarHBondContact O-CB 3.45Å; S273-N404 PolarHBondContact O-ND2 2.88Å; R274-N404 PolarHBondContact O-N 2.79Å; I276-N404 HydrophobicContact CG1-CB 4.26Å; I276-N404 HydrophobicContact CG2-CB 4.01Å; I402-N404 PolarHBondContact O-N 3.04Å; N404-D406 PolarHBondContact O-N 3.37Å; N404-D406 PolarHBondContact OD1-N 2.69Å; N404-F407 HydrophobicContact CB-CB 4.1Å; N404-F407 VanDerWaalsContact O-CB 3.29Å; N404-F407 WeakPolarHBondContact O-CB 3.43Å; N404-F407 PolarHBondContact O-N 3.21Å; N404-F407 VanDerWaalsContact O-N 3.17Å
405	P	86.1	Confident	89.6	Confident	89 Å²	89	76.7 Å²	76.7	58%	0.578	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-29.9	-179.1	27.7	-35.2	0	0	0	112.6	K210 P403 F407	K210-P405 PolarHBondContact NZ-O 3.02Å; P403-P405 WeakPolarHBondContact O-CD 3.45Å; P405-F407 VanDerWaalsContact C-N 3.34Å
406	D	84.3	Confident	89.7	Confident	86 Å²	86	76.7 Å²	76.7	46%	0.46	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	0.5	179.9	-68.9	-56.6	0	0	0	113.2	N404 F408	N404-D406 PolarHBondContact O-N 3.37Å; N404-D406 PolarHBondContact OD1-N 2.69Å; D406-F408 PolarHBondContact O-N 2.89Å
407	F	86.6	Confident	89.7	Confident	52 Å²	52	72.4 Å²	72.4	23%	0.228	35%	0.348	C	S	.	.			trans	-53.1	123.6	-180	176.1	-106.8	0	0	0	112.7	K210 P272 R274 N404 P405 E409	K210-F407 WeakPolarHBondContact CE-O 3.29Å; K210-F407 PolarHBondContact NZ-O 2.67Å; P272-F407 HydrophobicContact CG-CD2 4.48Å; P272-F407 VanDerWaalsContact O-CD2 3.29Å; P272-F407 WeakPolarHBondContact O-CD2 3.29Å; P272-F407 WeakPolarHBondContact O-CE2 3.17Å; R274-F407 HydrophobicContact CB-CD2 4.3Å; R274-F407 HydrophobicContact CB-CE2 4.4Å; R274-F407 HydrophobicContact CG-CD1 4.28Å; R274-F407 HydrophobicContact CG-CD2 3.68Å; R274-F407 HydrophobicContact CG-CE1 3.97Å; R274-F407 HydrophobicContact CG-CE2 3.34Å; R274-F407 HydrophobicContact CG-CG 4.15Å; R274-F407 HydrophobicContact CG-CZ 3.51Å; N404-F407 HydrophobicContact CB-CB 4.1Å; N404-F407 VanDerWaalsContact O-CB 3.29Å; N404-F407 WeakPolarHBondContact O-CB 3.43Å; N404-F407 PolarHBondContact O-N 3.21Å; N404-F407 VanDerWaalsContact O-N 3.17Å; P405-F407 VanDerWaalsContact C-N 3.34Å; F407-E409 HydrophobicContact CE1-CB 4.32Å; F407-E409 HydrophobicContact CZ-CB 3.91Å; F407-E409 HydrophobicContact CZ-CG 4.44Å
408	F	88.1	Confident	89.8	Confident	15 Å²	15	72.1 Å²	72.1	7%	0.066	35%	0.353	C	S	.	.			trans	-133.1	162.5	169.5	68	-94.4	0	0	0	109.6	H206 N208 P209 K210 V270 P272 D406	H206-F408 AromaticContact NE2-CE2 3.44Å; H206-F408 WeakPolarHBondContact NE2-CE2 3.19Å; H206-F408 AromaticContact NE2-CZ 3.63Å; N208-F408 HydrophobicContact CB-CE1 4.26Å; N208-F408 WeakPolarHBondContact ND2-CE1 3.47Å; P209-F408 VanDerWaalsContact CD-CD2 3.47Å; P209-F408 HydrophobicContact CG-CB 3.92Å; P209-F408 HydrophobicContact CG-CD1 4.42Å; P209-F408 HydrophobicContact CG-CD2 3.49Å; P209-F408 VanDerWaalsContact CG-CD2 3.49Å; P209-F408 HydrophobicContact CG-CE2 4.09Å; P209-F408 HydrophobicContact CG-CG 3.69Å; K210-F408 HydrophobicContact CD-CB 4.38Å; K210-F408 HydrophobicContact CG-CB 4.45Å; V270-F408 VanDerWaalsContact O-CZ 3.24Å; V270-F408 WeakPolarHBondContact O-CZ 3.21Å; P272-F408 VanDerWaalsContact CD-CE1 3.49Å; P272-F408 HydrophobicContact CG-CD1 3.86Å; P272-F408 HydrophobicContact CG-CE1 3.84Å; D406-F408 PolarHBondContact O-N 2.89Å
409	E	87.9	Confident	90.1	Very high	107 Å²	107	65 Å²	65	50%	0.5	32%	0.322	S	S	.	.			trans	-133.5	101	-177.3	-167.2	159.2	-97	0	0	108.2	R274 F407 L411	R274-E409 IonicContact CZ-OE1 3.7Å; R274-E409 IonicContact NE-OE1 3.06Å; R274-E409 IonicContact NH2-OE1 3.46Å; R274-E409 PolarHBondContact NH2-OE1 3.18Å; R274-E409 IonicContact NH2-OE2 3.38Å; F407-E409 HydrophobicContact CE1-CB 4.32Å; F407-E409 HydrophobicContact CZ-CB 3.91Å; F407-E409 HydrophobicContact CZ-CG 4.44Å; E409-L411 HydrophobicContact CG-CD2 4.22Å
410	D	87.7	Confident	90.2	Very high	43 Å²	43	64.2 Å²	64.2	23%	0.23	32%	0.317	C	S	.	.			trans	-98	139.2	166.2	-171.8	6.3	0	0	0	109.1	H206 L263 N271 E412 P413	H206-D410 IonicContact CE1-OD2 3.91Å; H206-D410 PolarHBondContact CE1-OD2 3.4Å; H206-D410 VanDerWaalsContact CE1-OD2 3.31Å; H206-D410 IonicContact ND1-OD2 2.79Å; L263-D410 WeakPolarHBondContact CD2-O 3.24Å; N271-D410 PolarHBondContact ND2-O 2.85Å; N271-D410 PolarHBondContact OD1-N 3.37Å; N271-D410 PolarHBondContact OD1-O 3.29Å; D410-E412 PolarHBondContact OD1-N 2.9Å; D410-P413 WeakPolarHBondContact OD2-CA 3.4Å
411	L	88.5	Confident	90.4	Very high	117 Å²	117	55.7 Å²	55.7	61%	0.613	29%	0.285	S	S	*	.	S	Bend	trans	-116.6	-10.4	-179.4	-57.7	178.3	0	0	0	111.9	N246 E409	N246-L411 PolarHBondContact ND2-O 3.42Å; E409-L411 HydrophobicContact CG-CD2 4.22Å
412	E	88.8	Confident	90.6	Very high	88 Å²	88	49.3 Å²	49.3	41%	0.411	26%	0.257	S	S	.	.			trans	-129.9	49.6	-177.8	-59.4	-178.1	101	0	0	111.7	D410 F414 R415	D410-E412 PolarHBondContact OD1-N 2.9Å; E412-F414 PolarHBondContact O-N 2.87Å; E412-R415 PolarHBondContact O-N 2.76Å; E412-R415 IonicContact OE1-CZ 2.61Å; E412-R415 IonicContact OE1-NH1 3.26Å; E412-R415 PolarHBondContact OE1-NH1 2.92Å; E412-R415 IonicContact OE1-NH2 3.03Å; E412-R415 PolarHBondContact OE1-NH2 2.97Å; E412-R415 IonicContact OE2-CZ 2.84Å; E412-R415 IonicContact OE2-NH1 3.78Å; E412-R415 PolarHBondContact OE2-NH1 3.45Å; E412-R415 IonicContact OE2-NH2 3.96Å
413	P	88.7	Confident	90.8	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-14	-179.9	25.1	-36.5	0	0	0	114.5	F204 N246 L262 L263 V270 D410 R415	F204-P413 HydrophobicContact CE2-CB 4.34Å; F204-P413 HydrophobicContact CZ-CB 4.4Å; N246-P413 HydrophobicContact CB-CG 4.47Å; N246-P413 WeakPolarHBondContact OD1-CD 3.26Å; N246-P413 WeakPolarHBondContact OD1-CG 3.38Å; L262-P413 HydrophobicContact CB-CG 3.92Å; L262-P413 HydrophobicContact CD1-CB 4.2Å; L262-P413 HydrophobicContact CD1-CG 4.1Å; L263-P413 HydrophobicContact CD2-CG 3.74Å; L263-P413 HydrophobicContact CG-CG 4.09Å; V270-P413 HydrophobicContact CG1-CB 4Å; V270-P413 HydrophobicContact CG1-CG 4.36Å; V270-P413 HydrophobicContact CG2-CB 4.41Å; D410-P413 WeakPolarHBondContact OD2-CA 3.4Å; P413-R415 PolarHBondContact O-N 2.68Å
414	F	91.1	Very high	90.9	Very high	3 Å²	3	41.6 Å²	41.6	1%	0.013	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-35.5	164.1	179.7	-99.6	0	0	0	112.8	F141 K144 L242 N243 P244 N246 E412 M416	F141-F414 HydrophobicContact CB-CD1 4.17Å; F141-F414 HydrophobicContact CB-CE1 3.85Å; F141-F414 HydrophobicContact CB-CZ 4.27Å; F141-F414 WeakPolarHBondContact CB-O 3.39Å; F141-F414 HydrophobicContact CD1-CD2 4.38Å; F141-F414 HydrophobicContact CD1-CE1 4.2Å; F141-F414 AromaticContact CD1-CE2 3.9Å; F141-F414 HydrophobicContact CD1-CE2 3.9Å; F141-F414 AromaticContact CD1-CZ 3.78Å; F141-F414 HydrophobicContact CD1-CZ 3.78Å; F141-F414 WeakPolarHBondContact CD1-O 3.36Å; F141-F414 WeakPolarHBondContact CG-O 3.23Å; K144-F414 VanDerWaalsContact O-CZ 3.23Å; K144-F414 WeakPolarHBondContact O-CZ 3.49Å; L242-F414 HydrophobicContact CD1-CD2 4.48Å; L242-F414 HydrophobicContact CD2-CD2 3.97Å; L242-F414 HydrophobicContact CD2-CE2 4.1Å; L242-F414 HydrophobicContact CG-CD2 3.8Å; L242-F414 HydrophobicContact CG-CE2 3.88Å; N243-F414 WeakPolarHBondContact O-CD2 3.44Å; P244-F414 HydrophobicContact CB-CD1 4.18Å; P244-F414 HydrophobicContact CB-CE1 4.1Å; P244-F414 HydrophobicContact CB-CZ 4.48Å; P244-F414 HydrophobicContact CG-CE1 4.22Å; P244-F414 HydrophobicContact CG-CZ 4.22Å; N246-F414 WeakPolarHBondContact OD1-CB 3.42Å; N246-F414 PolarHBondContact OD1-N 3.06Å; E412-F414 PolarHBondContact O-N 2.87Å; F414-M416 PolarHBondContact O-N 2.78Å
415	R	90.8	Very high	91.2	Very high	143 Å²	143	41.1 Å²	41.1	54%	0.54	21%	0.208	S	C	.	.	S	Bend	trans	-76.2	48.1	-179.1	-62.7	-159.3	-175.2	116	15.4	113.9	E412 P413	E412-R415 PolarHBondContact O-N 2.76Å; E412-R415 IonicContact OE1-CZ 2.61Å; E412-R415 IonicContact OE1-NH1 3.26Å; E412-R415 PolarHBondContact OE1-NH1 2.92Å; E412-R415 IonicContact OE1-NH2 3.03Å; E412-R415 PolarHBondContact OE1-NH2 2.97Å; E412-R415 IonicContact OE2-CZ 2.84Å; E412-R415 IonicContact OE2-NH1 3.78Å; E412-R415 PolarHBondContact OE2-NH1 3.45Å; E412-R415 IonicContact OE2-NH2 3.96Å; P413-R415 PolarHBondContact O-N 2.68Å
416	M	90.8	Very high	91.5	Very high	20 Å²	20	36.9 Å²	36.9	10%	0.099	18%	0.18	C	C	.	.			trans	-71.2	178	175.8	65	-170.2	76	0	0	113	F141 T186 I187 F204 L242 L262 F414	F141-M416 HydrophobicContact CD1-CE 4.49Å; F141-M416 HydrophobicContact CD1-CG 3.84Å; F141-M416 HydrophobicContact CD1-SD 4.26Å; F141-M416 HydrophobicContact CD2-CG 3.57Å; F141-M416 HydrophobicContact CE1-CE 4.31Å; F141-M416 HydrophobicContact CE1-CG 3.8Å; F141-M416 HydrophobicContact CE1-SD 3.74Å; F141-M416 HydrophobicContact CE2-CG 3.54Å; F141-M416 HydrophobicContact CE2-SD 4.21Å; F141-M416 HydrophobicContact CG-CG 3.74Å; F141-M416 HydrophobicContact CZ-CG 3.65Å; F141-M416 HydrophobicContact CZ-SD 3.72Å; T186-M416 HydrophobicContact CG2-CB 4.11Å; T186-M416 HydrophobicContact CG2-CG 3.48Å; T186-M416 VanDerWaalsContact CG2-CG 3.48Å; T186-M416 HydrophobicContact CG2-SD 3.43Å; T186-M416 WeakPolarHBondContact CG2-SD 3.37Å; I187-M416 HydrophobicContact CD1-SD 3.77Å; I187-M416 HydrophobicContact CG1-SD 3.85Å; F204-M416 HydrophobicContact CB-CE 4.48Å; F204-M416 HydrophobicContact CB-SD 4.3Å; F204-M416 HydrophobicContact CD2-CE 3.79Å; F204-M416 HydrophobicContact CD2-SD 4.24Å; F204-M416 HydrophobicContact CE2-CE 4.32Å; F204-M416 HydrophobicContact CG-CE 4.3Å; L242-M416 HydrophobicContact CD2-CE 3.58Å; L242-M416 HydrophobicContact CD2-SD 4.49Å; L262-M416 HydrophobicContact CD1-CE 4.28Å; F414-M416 PolarHBondContact O-N 2.78Å
417	T	92.8	Very high	91.7	Very high	32 Å²	32	36.3 Å²	36.3	20%	0.196	17%	0.172	C	C	.	.			trans	-62.4	131.1	-178.3	40.3	0	0	0	0	112.3	F141 T186 Y214	F141-T417 WeakPolarHBondContact CE2-O 3.3Å; T186-T417 WeakPolarHBondContact CB-O 3.45Å; T186-T417 WeakPolarHBondContact CG2-O 3.16Å; T186-T417 PolarHBondContact OG1-O 3.2Å; T186-T417 PolarHBondContact OG1-OG1 3.43Å; Y214-T417 HydrophobicContact CE1-CG2 3.8Å; Y214-T417 WeakPolarHBondContact OH-CG2 3.5Å
418	P	94.9	Very high	91.8	Very high	42 Å²	42	33.8 Å²	33.8	27%	0.273	16%	0.161	S	C	.	.			trans	-61.3	148.9	174.7	27.1	-35.1	0	0	0	111.1	F139 L140 K170	F139-P418 WeakPolarHBondContact O-CA 3.27Å; F139-P418 WeakPolarHBondContact O-CB 3.43Å; L140-P418 HydrophobicContact CD2-CB 3.56Å; L140-P418 HydrophobicContact CD2-CG 4.21Å; K170-P418 HydrophobicContact CB-CG 4.34Å; K170-P418 WeakPolarHBondContact CB-O 3.22Å; K170-P418 HydrophobicContact CD-CB 4.49Å; K170-P418 HydrophobicContact CD-CG 4.29Å; K170-P418 PolarHBondContact N-O 3.25Å
419	F	95.8	Very high	91.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	157.2	179	69	-88.2	0	0	0	111.8	L135 P138 F139 F141 L146 L167 L168 I440	L135-F419 HydrophobicContact CD1-CD2 4.27Å; L135-F419 HydrophobicContact CD1-CE2 4.18Å; L135-F419 HydrophobicContact CD2-CD2 3.76Å; L135-F419 HydrophobicContact CD2-CE2 3.44Å; L135-F419 VanDerWaalsContact CD2-CE2 3.44Å; L135-F419 HydrophobicContact CD2-CZ 4.28Å; L135-F419 HydrophobicContact CG-CE2 4.44Å; P138-F419 WeakPolarHBondContact CA-O 3.34Å; F139-F419 HydrophobicContact CB-CD1 3.94Å; F139-F419 HydrophobicContact CB-CE1 3.45Å; F139-F419 VanDerWaalsContact CB-CE1 3.45Å; F139-F419 HydrophobicContact CB-CE2 4.14Å; F139-F419 HydrophobicContact CB-CG 4.44Å; F139-F419 HydrophobicContact CB-CZ 3.55Å; F139-F419 HydrophobicContact CD1-CD1 4.3Å; F139-F419 AromaticContact CD1-CE1 3.61Å; F139-F419 HydrophobicContact CD1-CE1 3.61Å; F139-F419 HydrophobicContact CD1-CZ 4.29Å; F139-F419 HydrophobicContact CG-CD1 4.45Å; F139-F419 AromaticContact CG-CE1 3.64Å; F139-F419 HydrophobicContact CG-CE1 3.64Å; F139-F419 AromaticContact CG-CZ 3.88Å; F139-F419 HydrophobicContact CG-CZ 3.88Å; F139-F419 PolarHBondContact N-O 2.98Å; F139-F419 PolarHBondContact O-N 3.09Å; F141-F419 AromaticContact CE2-CD1 3.8Å; F141-F419 HydrophobicContact CE2-CD1 3.8Å; F141-F419 HydrophobicContact CE2-CE1 4.15Å; F141-F419 AromaticContact CZ-CD1 3.82Å; F141-F419 HydrophobicContact CZ-CD1 3.82Å; F141-F419 AromaticContact CZ-CE1 3.8Å; F141-F419 HydrophobicContact CZ-CE1 3.8Å; L146-F419 HydrophobicContact CD1-CE1 3.92Å; L146-F419 HydrophobicContact CD1-CZ 3.71Å; L146-F419 HydrophobicContact CD2-CE1 3.95Å; L146-F419 HydrophobicContact CD2-CZ 4.37Å; L167-F419 HydrophobicContact CB-CB 4.23Å; L167-F419 HydrophobicContact CB-CD1 4.3Å; L167-F419 HydrophobicContact CB-CD2 3.82Å; L167-F419 HydrophobicContact CB-CE2 4.19Å; L167-F419 HydrophobicContact CB-CG 3.88Å; L167-F419 HydrophobicContact CD1-CD1 4.23Å; L167-F419 HydrophobicContact CD1-CD2 4.37Å; L167-F419 HydrophobicContact CD1-CE1 3.83Å; L167-F419 HydrophobicContact CD1-CE2 3.96Å; L167-F419 HydrophobicContact CD1-CG 4.5Å; L167-F419 HydrophobicContact CD1-CZ 3.7Å; L167-F419 HydrophobicContact CD2-CD2 4.38Å; L167-F419 HydrophobicContact CD2-CE2 4.02Å; L167-F419 HydrophobicContact CG-CD2 4.41Å; L167-F419 HydrophobicContact CG-CE2 4.28Å; L168-F419 WeakPolarHBondContact O-CA 3.25Å; L168-F419 VanDerWaalsContact O-CB 3.28Å; L168-F419 WeakPolarHBondContact O-CB 3.5Å; F419-I440 HydrophobicContact CE2-CD1 4.08Å; F419-I440 HydrophobicContact CE2-CG2 4.28Å; F419-I440 HydrophobicContact CZ-CG2 3.98Å
420	S	95.3	Very high	91.9	Very high	13 Å²	13	31.9 Å²	31.9	9%	0.091	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	-3.7	-173.6	51	0	0	0	0	116	L135 L168 K170 L174	L135-S420 PolarHBondContact N-O 2.66Å; L168-S420 PolarHBondContact O-N 2.92Å; K170-S420 WeakPolarHBondContact CA-OG 3.09Å; L174-S420 WeakPolarHBondContact CD2-OG 3.2Å
421	A	95.8	Very high	92	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	161	168.6	0	0	0	0	0	110.1	A133 L168 L174 L176	A133-A421 CarbonylContact O-C 3.54Å; A133-A421 VanDerWaalsContact O-CA 3.25Å; A133-A421 WeakPolarHBondContact O-CA 3.46Å; A133-A421 VanDerWaalsContact O-CB 3.27Å; A133-A421 WeakPolarHBondContact O-CB 3.09Å; L168-A421 HydrophobicContact CB-CB 4.16Å; L168-A421 HydrophobicContact CD1-CB 4.15Å; L168-A421 HydrophobicContact CG-CB 4.4Å; L168-A421 PolarHBondContact N-O 3.06Å; L174-A421 HydrophobicContact CD2-CB 4.23Å; L176-A421 HydrophobicContact CD1-CB 4.14Å; L176-A421 HydrophobicContact CD2-CB 3.67Å
422	V	96.6	Very high	92.2	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.012	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	140.1	171	63	0	0	0	0	107.6	F71 W83 S132 A133 L135 V165 L167 I440	F71-V422 HydrophobicContact CD1-CG1 4.13Å; F71-V422 HydrophobicContact CD2-CG1 4.31Å; F71-V422 HydrophobicContact CE1-CG1 3.92Å; F71-V422 HydrophobicContact CE2-CG1 4.11Å; F71-V422 HydrophobicContact CG-CG1 4.31Å; F71-V422 HydrophobicContact CZ-CG1 3.91Å; W83-V422 HydrophobicContact CH2-CG1 4.27Å; S132-V422 CarbonylContact C-O 3.56Å; S132-V422 WeakPolarHBondContact CA-O 3.07Å; S132-V422 VanDerWaalsContact CB-O 3.28Å; S132-V422 WeakPolarHBondContact CB-O 3.41Å; A133-V422 HydrophobicContact CB-CG1 4.09Å; A133-V422 PolarHBondContact N-O 3.4Å; A133-V422 PolarHBondContact O-N 3.39Å; L135-V422 HydrophobicContact CD1-CB 4.37Å; V165-V422 HydrophobicContact CG1-CG2 3.35Å; L167-V422 HydrophobicContact CD2-CG2 4.2Å; V422-I440 HydrophobicContact CB-CD1 4.32Å; V422-I440 HydrophobicContact CG2-CD1 4.39Å
423	G	95.6	Very high	92.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	144.8	-177	0	0	0	0	0	113.4	I131 K166	I131-G423 CarbonylContact O-C 3.6Å; I131-G423 WeakPolarHBondContact O-CA 3.27Å; K166-G423 PolarHBondContact N-O 2.62Å; K166-G423 PolarHBondContact O-N 3.31Å
424	L	95.5	Very high	92.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	110.3	171.3	-62.5	157.5	0	0	0	106.3	W83 W104 L120 A130 I131 V165 L426 F435 F438	W83-L424 HydrophobicContact CH2-CD1 4.39Å; W83-L424 HydrophobicContact CZ3-CD1 4.12Å; W104-L424 HydrophobicContact CH2-CB 3.94Å; W104-L424 HydrophobicContact CH2-CD1 3.85Å; W104-L424 HydrophobicContact CH2-CG 4.49Å; W104-L424 HydrophobicContact CZ2-CB 4.09Å; W104-L424 HydrophobicContact CZ3-CD1 4.23Å; L120-L424 HydrophobicContact CD2-CD1 3.53Å; A130-L424 VanDerWaalsContact CA-O 3.31Å; A130-L424 WeakPolarHBondContact CA-O 3.29Å; I131-L424 HydrophobicContact CG2-CB 4.12Å; I131-L424 HydrophobicContact CG2-CD1 4.08Å; I131-L424 PolarHBondContact N-O 2.65Å; I131-L424 PolarHBondContact O-N 3.04Å; V165-L424 HydrophobicContact CG2-CD2 3.77Å; L424-L426 HydrophobicContact CB-CD1 4.24Å; L424-L426 HydrophobicContact CB-CG 4.38Å; L424-L426 HydrophobicContact CD2-CD1 4.33Å; L424-F435 HydrophobicContact CD2-CD1 4.11Å; L424-F435 HydrophobicContact CD2-CE1 3.9Å; L424-F435 HydrophobicContact CD2-CZ 4.47Å; L424-F438 HydrophobicContact CD1-CZ 3.95Å; L424-F438 HydrophobicContact CD2-CZ 4.33Å
425	E	93.4	Very high	92.9	Very high	10 Å²	10	22.4 Å²	22.4	5%	0.047	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	104	171.5	-170.9	-89.1	141.4	0	0	107.5	Y100 H128 H129 A130 Y164 K166 F179 D181	Y100-E425 HydrophobicContact CE1-CG 3.59Å; Y100-E425 WeakPolarHBondContact CE1-OE1 3.47Å; Y100-E425 VanDerWaalsContact OH-CD 3.28Å; Y100-E425 PolarHBondContact OH-OE1 3.01Å; H128-E425 IonicContact ND1-OE1 2.71Å; H129-E425 CarbonylContact O-C 3.59Å; H129-E425 WeakPolarHBondContact O-CA 3.22Å; A130-E425 HydrophobicContact CB-CG 4.24Å; Y164-E425 WeakPolarHBondContact CE2-O 3.42Å; K166-E425 HydrophobicContact CD-CB 4.3Å; K166-E425 IonicContact NZ-OE2 2.94Å; K166-E425 PolarHBondContact NZ-OE2 2.6Å; F179-E425 HydrophobicContact CE1-CB 3.82Å; F179-E425 HydrophobicContact CE2-CB 4.12Å; F179-E425 HydrophobicContact CZ-CB 3.5Å; F179-E425 HydrophobicContact CZ-CG 4.49Å; D181-E425 WeakPolarHBondContact CA-OE2 3.08Å
426	L	92.8	Very high	93.1	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	139.9	-161	-60.6	178.5	0	0	0	111.2	W104 L122 H128 H129 Y164 L424 F435	W104-L426 HydrophobicContact CH2-CD1 4.19Å; L122-L426 HydrophobicContact CD1-CB 4.36Å; L122-L426 HydrophobicContact CD1-CD1 4.07Å; H128-L426 WeakPolarHBondContact CA-O 3.28Å; H129-L426 PolarHBondContact N-O 3.48Å; H129-L426 PolarHBondContact O-N 3.26Å; Y164-L426 HydrophobicContact CD1-CD2 4.28Å; Y164-L426 HydrophobicContact CD2-CD2 3.82Å; Y164-L426 HydrophobicContact CE1-CD2 4.26Å; Y164-L426 HydrophobicContact CE2-CD2 3.74Å; Y164-L426 HydrophobicContact CG-CD2 4.1Å; Y164-L426 WeakPolarHBondContact O-CD2 3.37Å; L424-L426 HydrophobicContact CB-CD1 4.24Å; L424-L426 HydrophobicContact CB-CG 4.38Å; L424-L426 HydrophobicContact CD2-CD1 4.33Å; L426-F435 HydrophobicContact CD1-CE1 4.27Å; L426-F435 HydrophobicContact CD1-CE2 4.23Å; L426-F435 HydrophobicContact CD1-CZ 3.54Å
427	W	89.4	Confident	93.2	Very high	74 Å²	74	14.7 Å²	14.7	28%	0.28	8%	0.079	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	139.6	159.1	174.4	-103.4	0	0	0	108.7	I97 A126 K127 H128 G161 G162 M429	I97-W427 HydrophobicContact CG2-CH2 4.36Å; I97-W427 HydrophobicContact CG2-CZ3 4.05Å; A126-W427 HydrophobicContact CB-CH2 4.23Å; A126-W427 HydrophobicContact CB-CZ2 4.34Å; A126-W427 VanDerWaalsContact O-CH2 3.24Å; A126-W427 WeakPolarHBondContact O-CH2 3.25Å; K127-W427 VanDerWaalsContact C-CZ3 3.5Å; K127-W427 VanDerWaalsContact CA-CZ3 3.49Å; H128-W427 AromaticContact CD2-CE3 3.42Å; H128-W427 VanDerWaalsContact CD2-CE3 3.42Å; H128-W427 AromaticContact CD2-CZ3 3.71Å; H128-W427 AromaticContact CE1-CE3 3.89Å; H128-W427 AromaticContact CG-CE3 3.78Å; H128-W427 AromaticContact NE2-CE3 3.51Å; G161-W427 WeakPolarHBondContact CA-O 3.42Å; G162-W427 PolarHBondContact N-O 2.83Å; W427-M429 HydrophobicContact CZ2-SD 3.77Å
428	S	88	Confident	93.3	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	134.1	173.6	-176.2	0	0	0	0	112.8	A126 T430	A126-S428 WeakPolarHBondContact CA-O 3.2Å; A126-S428 PolarHBondContact N-O 3.06Å; S428-T430 VanDerWaalsContact C-N 3.3Å; S428-T430 PolarHBondContact OG-N 2.05Å; S428-T430 PolarHBondContact OG-O 2.63Å; S428-T430 PolarHBondContact OG-OG1 3.12Å
429	M	89.6	Confident	93.4	Very high	69 Å²	69	11.5 Å²	11.5	34%	0.34	6%	0.058	S	C	.	.	S	Bend	trans	-83.2	-0.9	168.4	-65.8	-63.6	-68.1	0	0	113	R125 A126 C160 W427	R125-M429 WeakPolarHBondContact CD-O 3.2Å; R125-M429 WeakPolarHBondContact CG-O 3.35Å; R125-M429 PolarHBondContact NE-O 3.22Å; A126-M429 HydrophobicContact CB-CE 4.41Å; A126-M429 HydrophobicContact CB-SD 3.86Å; C160-M429 HydrophobicContact CB-CG 4.25Å; C160-M429 VanDerWaalsContact O-CB 3.29Å; C160-M429 WeakPolarHBondContact O-CB 3.22Å; C160-M429 PolarHBondContact O-N 2.86Å; W427-M429 HydrophobicContact CZ2-SD 3.77Å
430	T	88.4	Confident	93.4	Very high	12 Å²	12	11.6 Å²	11.6	7%	0.074	6%	0.058	C	C	.	.	S	Bend	trans	-131.5	134.8	178.5	46.9	0	0	0	0	111.6	E159 S428	E159-T430 HydrophobicContact CB-CG2 4.15Å; E159-T430 HydrophobicContact CG-CG2 3.93Å; S428-T430 VanDerWaalsContact C-N 3.3Å; S428-T430 PolarHBondContact OG-N 2.05Å; S428-T430 PolarHBondContact OG-O 2.63Å; S428-T430 PolarHBondContact OG-OG1 3.12Å
431	S	90.1	Very high	93.4	Very high	29 Å²	29	11 Å²	11	20%	0.203	5%	0.054	C	C	.	.	S	Bend	trans	-81.2	175.4	173.2	58.2	0	0	0	0	112	L122 N156 I433	L122-S431 CarbonylContact O-C 3.59Å; N156-S431 PolarHBondContact ND2-O 3.46Å; N156-S431 PolarHBondContact ND2-OG 3.06Å; S431-I433 PolarHBondContact O-N 3.47Å
432	D	91.6	Very high	93.3	Very high	23 Å²	23	12 Å²	12	12%	0.123	6%	0.062	C	C	.	.			trans	66.8	29.8	171.4	-45.9	-88.3	0	0	0	114.5	K110 L122 Q155 N156 F434	K110-D432 WeakPolarHBondContact CE-OD1 3.03Å; K110-D432 IonicContact NZ-OD1 3.95Å; K110-D432 PolarHBondContact NZ-OD1 2.89Å; K110-D432 VanDerWaalsContact NZ-OD1 3.15Å; K110-D432 IonicContact NZ-OD2 3.65Å; K110-D432 PolarHBondContact NZ-OD2 2.81Å; L122-D432 PolarHBondContact O-N 2.79Å; Q155-D432 HydrophobicContact CB-CB 4.35Å; Q155-D432 WeakPolarHBondContact CB-O 3.45Å; Q155-D432 WeakPolarHBondContact CG-O 3.24Å; Q155-D432 PolarHBondContact NE2-O 2.82Å; N156-D432 PolarHBondContact ND2-OD2 2.85Å; D432-F434 PolarHBondContact O-N 2.73Å
433	I	93.9	Very high	93.2	Very high	1 Å²	1	15.7 Å²	15.7	1%	0.005	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	120.1	165.1	-47.4	179.9	0	0	0	107.5	V121 L122 V152 F154 I158 A163 S431 F435	V121-I433 WeakPolarHBondContact CA-O 3.47Å; L122-I433 HydrophobicContact CB-CB 4.17Å; L122-I433 PolarHBondContact N-O 2.67Å; V152-I433 HydrophobicContact CG1-CG2 3.82Å; F154-I433 HydrophobicContact CD1-CD1 4.22Å; F154-I433 HydrophobicContact CD1-CG1 4.13Å; F154-I433 HydrophobicContact CD1-CG2 3.91Å; F154-I433 HydrophobicContact CE1-CD1 4.24Å; F154-I433 HydrophobicContact CE1-CG2 4Å; I158-I433 HydrophobicContact CD1-CD1 3.98Å; A163-I433 HydrophobicContact CB-CG2 4.16Å; S431-I433 PolarHBondContact O-N 3.47Å; I433-F435 HydrophobicContact CB-CE2 3.92Å; I433-F435 HydrophobicContact CB-CZ 4.42Å; I433-F435 HydrophobicContact CG2-CD2 4.22Å; I433-F435 HydrophobicContact CG2-CE1 4.46Å; I433-F435 HydrophobicContact CG2-CE2 3.51Å; I433-F435 HydrophobicContact CG2-CZ 3.65Å
434	F	94.3	Very high	93.1	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	132	-178.4	176.4	-78.9	0	0	0	109.4	M109 G119 V121 V152 N153 Q155 D432 D436	M109-F434 HydrophobicContact CB-CE2 4.44Å; M109-F434 HydrophobicContact CE-CE1 4.42Å; M109-F434 HydrophobicContact CE-CZ 4.35Å; M109-F434 HydrophobicContact CG-CD1 3.95Å; M109-F434 HydrophobicContact CG-CD2 3.48Å; M109-F434 VanDerWaalsContact CG-CD2 3.48Å; M109-F434 HydrophobicContact CG-CE1 3.87Å; M109-F434 HydrophobicContact CG-CE2 3.4Å; M109-F434 HydrophobicContact CG-CG 3.78Å; M109-F434 HydrophobicContact CG-CZ 3.6Å; M109-F434 HydrophobicContact SD-CD1 4.13Å; M109-F434 HydrophobicContact SD-CE1 3.99Å; M109-F434 HydrophobicContact SD-CG 4.48Å; M109-F434 HydrophobicContact SD-CZ 4.21Å; G119-F434 VanDerWaalsContact CA-CE2 3.49Å; G119-F434 VanDerWaalsContact CA-CZ 3.47Å; G119-F434 VanDerWaalsContact N-CE2 3.27Å; V121-F434 HydrophobicContact CG2-CD2 3.8Å; V152-F434 WeakPolarHBondContact CA-O 3.38Å; N153-F434 HydrophobicContact CB-CB 4.26Å; N153-F434 HydrophobicContact CB-CD1 4.5Å; N153-F434 PolarHBondContact N-O 3.06Å; N153-F434 PolarHBondContact O-N 3.33Å; Q155-F434 HydrophobicContact CG-CB 4.47Å; D432-F434 PolarHBondContact O-N 2.73Å; F434-D436 HydrophobicContact CD1-CB 4.4Å; F434-D436 HydrophobicContact CE1-CB 3.66Å; F434-D436 HydrophobicContact CZ-CB 4.27Å
435	F	95.6	Very high	92.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	135.1	-179.6	-62.3	-97.5	0	0	0	110.5	W104 G119 L120 L122 Y150 E151 V152 A163 L424 L426 I433 F438	W104-F435 HydrophobicContact CH2-CE2 4.24Å; W104-F435 HydrophobicContact CZ3-CD2 4.04Å; W104-F435 AromaticContact CZ3-CE2 4Å; W104-F435 HydrophobicContact CZ3-CE2 4Å; G119-F435 CarbonylContact C-O 3.51Å; G119-F435 WeakPolarHBondContact CA-O 3.46Å; L120-F435 HydrophobicContact CB-CB 4.33Å; L120-F435 PolarHBondContact N-O 3.35Å; L120-F435 PolarHBondContact O-N 2.76Å; L122-F435 HydrophobicContact CB-CE2 4.32Å; Y150-F435 HydrophobicContact CD2-CD1 4.27Å; Y150-F435 HydrophobicContact CE2-CD1 4.04Å; Y150-F435 HydrophobicContact CE2-CE1 4.32Å; E151-F435 WeakPolarHBondContact O-CA 3.3Å; V152-F435 HydrophobicContact CG2-CD1 4Å; V152-F435 HydrophobicContact CG2-CE1 4.09Å; A163-F435 HydrophobicContact CB-CE1 3.67Å; A163-F435 HydrophobicContact CB-CZ 3.66Å; L424-F435 HydrophobicContact CD2-CD1 4.11Å; L424-F435 HydrophobicContact CD2-CE1 3.9Å; L424-F435 HydrophobicContact CD2-CZ 4.47Å; L426-F435 HydrophobicContact CD1-CE1 4.27Å; L426-F435 HydrophobicContact CD1-CE2 4.23Å; L426-F435 HydrophobicContact CD1-CZ 3.54Å; I433-F435 HydrophobicContact CB-CE2 3.92Å; I433-F435 HydrophobicContact CB-CZ 4.42Å; I433-F435 HydrophobicContact CG2-CD2 4.22Å; I433-F435 HydrophobicContact CG2-CE1 4.46Å; I433-F435 HydrophobicContact CG2-CE2 3.51Å; I433-F435 HydrophobicContact CG2-CZ 3.65Å; F435-F438 HydrophobicContact CB-CE2 3.86Å; F435-F438 HydrophobicContact CB-CZ 3.73Å; F435-F438 HydrophobicContact CD1-CZ 4.16Å; F435-F438 HydrophobicContact CG-CZ 4.31Å
436	D	94.1	Very high	93	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	172.6	-179.1	-170.6	33.8	0	0	0	114.1	S74 E151 F434 F438 K458	S74-D436 VanDerWaalsContact C-OD1 3.31Å; S74-D436 WeakPolarHBondContact CA-OD1 3.45Å; E151-D436 HydrophobicContact CB-CB 4.41Å; E151-D436 PolarHBondContact N-O 2.93Å; E151-D436 PolarHBondContact O-N 2.95Å; F434-D436 HydrophobicContact CD1-CB 4.4Å; F434-D436 HydrophobicContact CE1-CB 3.66Å; F434-D436 HydrophobicContact CZ-CB 4.27Å; D436-F438 VanDerWaalsContact C-N 3.26Å; D436-F438 PolarHBondContact O-N 2.96Å; D436-F438 VanDerWaalsContact O-N 3.15Å; D436-K458 IonicContact OD2-NZ 2.97Å; D436-K458 PolarHBondContact OD2-NZ 2.87Å
437	N	93.5	Very high	93	Very high	1 Å²	1	28 Å²	28	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	52.7	38.1	171	-77.2	-41	0	0	0	114.6	P63 D73 S74 E151 I439 W450	P63-N437 WeakPolarHBondContact CG-OD1 3.46Å; D73-N437 CarbonylContact O-C 3.55Å; D73-N437 WeakPolarHBondContact O-CA 3.45Å; D73-N437 PolarHBondContact O-N 2.93Å; S74-N437 WeakPolarHBondContact CB-OD1 3.29Å; E151-N437 HydrophobicContact CG-CB 4.31Å; E151-N437 WeakPolarHBondContact OE1-CB 3.35Å; E151-N437 PolarHBondContact OE1-ND2 3.17Å; N437-I439 PolarHBondContact O-N 2.68Å; N437-I439 VanDerWaalsContact O-N 3.17Å; N437-W450 HydrophobicContact CB-CZ2 4.42Å; N437-W450 PolarHBondContact O-NE1 2.65Å; N437-W450 WeakPolarHBondContact OD1-CZ2 3.23Å
438	F	95.8	Very high	93.2	Very high	6 Å²	6	26.2 Å²	26.2	3%	0.026	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	114	173.5	-70.2	-77.7	0	0	0	110.7	F71 A72 D73 F75 W83 Q149 Y150 V165 L424 F435 D436	F71-F438 HydrophobicContact CD1-CB 4.18Å; F71-F438 HydrophobicContact CE1-CB 3.85Å; A72-F438 CarbonylContact C-O 3.55Å; A72-F438 VanDerWaalsContact CA-O 3.25Å; A72-F438 WeakPolarHBondContact CA-O 3.38Å; D73-F438 PolarHBondContact N-O 2.72Å; D73-F438 PolarHBondContact O-N 3.31Å; F75-F438 AromaticContact CE2-CD2 3.64Å; F75-F438 HydrophobicContact CE2-CD2 3.64Å; F75-F438 AromaticContact CE2-CE2 3.7Å; F75-F438 HydrophobicContact CE2-CE2 3.7Å; F75-F438 AromaticContact CZ-CD2 3.92Å; F75-F438 HydrophobicContact CZ-CD2 3.92Å; F75-F438 AromaticContact CZ-CE2 3.89Å; F75-F438 HydrophobicContact CZ-CE2 3.89Å; W83-F438 HydrophobicContact CH2-CD2 4.19Å; W83-F438 HydrophobicContact CH2-CE2 4.07Å; W83-F438 HydrophobicContact CH2-CZ 4.36Å; W83-F438 AromaticContact CZ2-CD2 3.98Å; W83-F438 HydrophobicContact CZ2-CD2 3.98Å; W83-F438 HydrophobicContact CZ2-CE2 4.18Å; Q149-F438 WeakPolarHBondContact O-CA 3.33Å; Y150-F438 HydrophobicContact CD2-CD1 4.19Å; Y150-F438 AromaticContact CD2-CE1 3.54Å; Y150-F438 HydrophobicContact CD2-CE1 3.54Å; Y150-F438 HydrophobicContact CD2-CZ 4.11Å; Y150-F438 HydrophobicContact CE2-CE1 4.28Å; Y150-F438 AromaticContact CG-CD1 3.85Å; Y150-F438 HydrophobicContact CG-CD1 3.85Å; Y150-F438 AromaticContact CG-CE1 3.67Å; Y150-F438 HydrophobicContact CG-CE1 3.67Å; V165-F438 HydrophobicContact CG2-CD1 4.37Å; V165-F438 HydrophobicContact CG2-CE1 3.67Å; L424-F438 HydrophobicContact CD1-CZ 3.95Å; L424-F438 HydrophobicContact CD2-CZ 4.33Å; F435-F438 HydrophobicContact CB-CE2 3.86Å; F435-F438 HydrophobicContact CB-CZ 3.73Å; F435-F438 HydrophobicContact CD1-CZ 4.16Å; F435-F438 HydrophobicContact CG-CZ 4.31Å; D436-F438 VanDerWaalsContact C-N 3.26Å; D436-F438 PolarHBondContact O-N 2.96Å; D436-F438 VanDerWaalsContact O-N 3.15Å
439	I	95.8	Very high	93.4	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	135.2	174.1	-172.3	166.5	0	0	0	111.5	V69 F71 Q149 N437 V447 W450	V69-I439 HydrophobicContact CG1-CD1 4.17Å; V69-I439 HydrophobicContact CG1-CG1 3.72Å; V69-I439 HydrophobicContact CG2-CD1 4.39Å; F71-I439 CarbonylContact O-C 3.54Å; F71-I439 WeakPolarHBondContact O-CA 3.46Å; Q149-I439 HydrophobicContact CB-CG2 3.72Å; Q149-I439 HydrophobicContact CG-CG2 4.34Å; Q149-I439 PolarHBondContact N-O 3.06Å; Q149-I439 PolarHBondContact O-N 2.99Å; N437-I439 PolarHBondContact O-N 2.68Å; N437-I439 VanDerWaalsContact O-N 3.17Å; I439-V447 HydrophobicContact CD1-CG2 4.36Å; I439-V447 HydrophobicContact CG2-CG1 4.15Å; I439-V447 HydrophobicContact CG2-CG2 4.48Å; I439-W450 HydrophobicContact CB-CG 4.35Å; I439-W450 HydrophobicContact CD1-CB 3.82Å; I439-W450 HydrophobicContact CD1-CD2 3.89Å; I439-W450 HydrophobicContact CD1-CE3 4.41Å; I439-W450 HydrophobicContact CD1-CG 3.62Å; I439-W450 HydrophobicContact CG2-CG 4.25Å
440	I	96.6	Very high	93.6	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.015	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	109	174.3	-55.3	-176.7	0	0	0	108.7	V69 Y70 F71 L135 L146 I147 V148 L167 F419 V422	V69-I440 WeakPolarHBondContact CG1-O 3.44Å; Y70-I440 WeakPolarHBondContact CB-O 3.5Å; Y70-I440 PolarHBondContact N-O 2.88Å; F71-I440 HydrophobicContact CB-CB 4.06Å; F71-I440 HydrophobicContact CB-CD1 4.11Å; F71-I440 HydrophobicContact CB-CG1 4.1Å; F71-I440 PolarHBondContact N-O 3.27Å; F71-I440 PolarHBondContact O-N 3.42Å; L135-I440 HydrophobicContact CD1-CD1 4.3Å; L146-I440 HydrophobicContact CD1-CG2 3.91Å; I147-I440 WeakPolarHBondContact O-CA 3.46Å; V148-I440 HydrophobicContact CG1-CG1 4.37Å; V148-I440 HydrophobicContact CG2-CG1 4.26Å; V148-I440 HydrophobicContact CG2-CG2 4.3Å; L167-I440 HydrophobicContact CD2-CD1 3.99Å; F419-I440 HydrophobicContact CE2-CD1 4.08Å; F419-I440 HydrophobicContact CE2-CG2 4.28Å; F419-I440 HydrophobicContact CZ-CG2 3.98Å; V422-I440 HydrophobicContact CB-CD1 4.32Å; V422-I440 HydrophobicContact CG2-CD1 4.39Å
441	C	95.2	Very high	93.8	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.007	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	-179.1	-175	-161.5	0	0	0	0	111.7	E68 V69 I147 V447	E68-C441 PolarHBondContact O-SG 3.35Å; V69-C441 HydrophobicContact CG1-CB 4.41Å; I147-C441 PolarHBondContact N-O 3.09Å; I147-C441 PolarHBondContact O-N 3Å; C441-V447 HydrophobicContact CB-CG2 3.53Å
442	A	94.3	Very high	93.9	Very high	20 Å²	20	28.6 Å²	28.6	17%	0.165	14%	0.136	C	C	.	.	S	Bend	trans	-130.3	3.4	175.8	0	0	0	0	0	113.1	Y70 F139 K144 P145	Y70-A442 HydrophobicContact CE2-CB 3.99Å; F139-A442 HydrophobicContact CE2-CB 4.47Å; K144-A442 HydrophobicContact CB-CB 4.01Å; K144-A442 HydrophobicContact CD-CB 3.92Å; K144-A442 HydrophobicContact CG-CB 4.48Å; P145-A442 WeakPolarHBondContact CG-O 3.34Å; P145-A442 WeakPolarHBondContact O-CA 3.21Å; P145-A442 WeakPolarHBondContact O-CB 3.49Å
443	D	94.3	Very high	93.8	Very high	80 Å²	80	31.1 Å²	31.1	43%	0.428	15%	0.15	S	C	.	.			trans	-119.1	124.4	171.9	-170.6	-32.4	0	0	0	108.1	R445 V446	D443-R445 VanDerWaalsContact C-N 3.28Å; D443-R445 PolarHBondContact O-N 3.29Å; D443-R445 WeakPolarHBondContact OD1-CB 3.27Å; D443-R445 PolarHBondContact OD1-N 2.82Å; D443-V446 HydrophobicContact CB-CB 4.45Å; D443-V446 HydrophobicContact CB-CG2 4Å; D443-V446 PolarHBondContact O-N 2.86Å
444	R	92.4	Very high	93.5	Very high	66 Å²	66	31 Å²	31	25%	0.249	15%	0.149	C	C	.	.	H	α-helix	trans	-62.4	-36.1	-178.5	176.6	58.8	-161.6	-141	8.9	111.7	I147 I241 V446 V447 D448	I147-R444 HydrophobicContact CD1-CB 3.78Å; I241-R444 VanDerWaalsContact CD1-NH1 3.29Å; R444-V446 PolarHBondContact O-N 2.87Å; R444-V447 PolarHBondContact O-N 2.83Å; R444-D448 WeakPolarHBondContact CG-OD2 3.3Å; R444-D448 IonicContact CZ-OD1 2.64Å; R444-D448 IonicContact CZ-OD2 3.68Å; R444-D448 IonicContact NE-OD1 3.85Å; R444-D448 PolarHBondContact NE-OD1 3.01Å; R444-D448 IonicContact NE-OD2 2.74Å; R444-D448 PolarHBondContact NE-OD2 3.37Å; R444-D448 IonicContact NH2-OD1 3.23Å; R444-D448 PolarHBondContact NH2-OD1 2.96Å; R444-D448 IonicContact NH2-OD2 2.62Å; R444-D448 PolarHBondContact O-N 2.82Å
445	R	92.9	Very high	93.4	Very high	188 Å²	188	31.6 Å²	31.6	71%	0.709	15%	0.152	S	C	*	.	H	α-helix	trans	-65.3	-40.8	-178.7	-65.3	177.3	176.1	167.8	-0.7	112.5	D443 V447 D448 D449	D443-R445 VanDerWaalsContact C-N 3.28Å; D443-R445 PolarHBondContact O-N 3.29Å; D443-R445 WeakPolarHBondContact OD1-CB 3.27Å; D443-R445 PolarHBondContact OD1-N 2.82Å; R445-V447 PolarHBondContact O-N 2.71Å; R445-D448 PolarHBondContact O-N 2.94Å; R445-D449 WeakPolarHBondContact O-CB 3.24Å; R445-D449 PolarHBondContact O-N 3.34Å
446	V	93.6	Very high	93.1	Very high	13 Å²	13	32.6 Å²	32.6	8%	0.079	16%	0.161	C	C	.	.	H	α-helix	trans	-65.1	-28.4	178.6	-178.9	0	0	0	0	111.3	V69 D443 R444 W450	V69-V446 HydrophobicContact CG2-CG1 3.91Å; D443-V446 HydrophobicContact CB-CB 4.45Å; D443-V446 HydrophobicContact CB-CG2 4Å; D443-V446 PolarHBondContact O-N 2.86Å; R444-V446 PolarHBondContact O-N 2.87Å; V446-W450 WeakPolarHBondContact O-CB 3.33Å; V446-W450 PolarHBondContact O-N 2.88Å
447	V	94.3	Very high	92.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-82.3	-38.2	175.7	179.3	0	0	0	0	111.7	I147 Q149 I439 C441 R444 R445 W450 A451	I147-V447 HydrophobicContact CB-CG2 4.19Å; I147-V447 HydrophobicContact CG2-CB 4.22Å; I147-V447 HydrophobicContact CG2-CG1 3.95Å; I147-V447 HydrophobicContact CG2-CG2 3.9Å; Q149-V447 HydrophobicContact CB-CG1 3.86Å; Q149-V447 VanDerWaalsContact CD-CG1 3.5Å; Q149-V447 HydrophobicContact CG-CG1 4.33Å; Q149-V447 VanDerWaalsContact OE1-CG1 3.23Å; I439-V447 HydrophobicContact CD1-CG2 4.36Å; I439-V447 HydrophobicContact CG2-CG1 4.15Å; I439-V447 HydrophobicContact CG2-CG2 4.48Å; C441-V447 HydrophobicContact CB-CG2 3.53Å; R444-V447 PolarHBondContact O-N 2.83Å; R445-V447 PolarHBondContact O-N 2.71Å; V447-W450 PolarHBondContact O-N 2.93Å; V447-A451 VanDerWaalsContact O-CB 3.27Å; V447-A451 WeakPolarHBondContact O-CB 3.11Å; V447-A451 PolarHBondContact O-N 3.05Å
448	D	92.9	Very high	92.4	Very high	38 Å²	38	35 Å²	35	20%	0.203	17%	0.174	C	C	.	.	H	α-helix	trans	-64.6	-44.1	172.8	-71.9	-43.1	0	0	0	112.1	R444 R445 W450 A451 N452	R444-D448 WeakPolarHBondContact CG-OD2 3.3Å; R444-D448 IonicContact CZ-OD1 2.64Å; R444-D448 IonicContact CZ-OD2 3.68Å; R444-D448 IonicContact NE-OD1 3.85Å; R444-D448 PolarHBondContact NE-OD1 3.01Å; R444-D448 IonicContact NE-OD2 2.74Å; R444-D448 PolarHBondContact NE-OD2 3.37Å; R444-D448 IonicContact NH2-OD1 3.23Å; R444-D448 PolarHBondContact NH2-OD1 2.96Å; R444-D448 IonicContact NH2-OD2 2.62Å; R444-D448 PolarHBondContact O-N 2.82Å; R445-D448 PolarHBondContact O-N 2.94Å; D448-W450 VanDerWaalsContact C-N 3.35Å; D448-W450 PolarHBondContact O-N 2.66Å; D448-A451 WeakPolarHBondContact O-CB 3.41Å; D448-A451 PolarHBondContact O-N 3.32Å; D448-N452 PolarHBondContact O-N 2.96Å; D448-N452 PolarHBondContact O-ND2 2.69Å
449	D	92.5	Very high	92	Very high	71 Å²	71	39.3 Å²	39.3	38%	0.38	19%	0.193	S	C	.	.	H	α-helix	trans	-57.3	-49.9	174.7	-69.8	-13.6	0	0	0	109.9	T66 R445 A451 N452 D453	T66-D449 PolarHBondContact OG1-OD2 2.82Å; R445-D449 WeakPolarHBondContact O-CB 3.24Å; R445-D449 PolarHBondContact O-N 3.34Å; D449-A451 PolarHBondContact O-N 3.26Å; D449-N452 PolarHBondContact O-N 2.84Å; D449-D453 PolarHBondContact O-N 2.76Å
450	W	92.9	Very high	91.5	Very high	9 Å²	9	42.1 Å²	42.1	3%	0.034	22%	0.216	C	C	.	.	H	α-helix	trans	-62.2	-39.7	177.2	178.4	-87.2	0	0	0	113	P63 P65 A72 N437 I439 V446 V447 D448 N452 G454	P63-W450 HydrophobicContact CB-CD2 4.18Å; P63-W450 HydrophobicContact CB-CE3 3.74Å; P63-W450 HydrophobicContact CB-CH2 4.15Å; P63-W450 HydrophobicContact CB-CZ3 3.71Å; P63-W450 HydrophobicContact CG-CD2 4.4Å; P63-W450 HydrophobicContact CG-CE3 4.17Å; P63-W450 HydrophobicContact CG-CH2 3.69Å; P63-W450 HydrophobicContact CG-CZ2 3.97Å; P63-W450 HydrophobicContact CG-CZ3 3.8Å; P63-W450 WeakPolarHBondContact O-CZ3 3.27Å; P65-W450 HydrophobicContact CB-CE3 4.44Å; A72-W450 HydrophobicContact CB-CH2 4.34Å; N437-W450 HydrophobicContact CB-CZ2 4.42Å; N437-W450 PolarHBondContact O-NE1 2.65Å; N437-W450 WeakPolarHBondContact OD1-CZ2 3.23Å; I439-W450 HydrophobicContact CB-CG 4.35Å; I439-W450 HydrophobicContact CD1-CB 3.82Å; I439-W450 HydrophobicContact CD1-CD2 3.89Å; I439-W450 HydrophobicContact CD1-CE3 4.41Å; I439-W450 HydrophobicContact CD1-CG 3.62Å; I439-W450 HydrophobicContact CG2-CG 4.25Å; V446-W450 WeakPolarHBondContact O-CB 3.33Å; V446-W450 PolarHBondContact O-N 2.88Å; V447-W450 PolarHBondContact O-N 2.93Å; D448-W450 VanDerWaalsContact C-N 3.35Å; D448-W450 PolarHBondContact O-N 2.66Å; W450-N452 VanDerWaalsContact C-N 3.28Å; W450-N452 PolarHBondContact O-N 2.83Å; W450-G454 PolarHBondContact O-N 3.44Å
451	A	93.4	Very high	90.9	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-35.7	175.2	0	0	0	0	0	112.5	L237 V447 D448 D449 W455 G456	L237-A451 HydrophobicContact CD2-CB 3.69Å; V447-A451 VanDerWaalsContact O-CB 3.27Å; V447-A451 WeakPolarHBondContact O-CB 3.11Å; V447-A451 PolarHBondContact O-N 3.05Å; D448-A451 WeakPolarHBondContact O-CB 3.41Å; D448-A451 PolarHBondContact O-N 3.32Å; D449-A451 PolarHBondContact O-N 3.26Å; A451-W455 PolarHBondContact O-N 3.24Å; A451-G456 PolarHBondContact O-N 3.05Å
452	N	91.4	Very high	90.2	Very high	78 Å²	78	44.6 Å²	44.6	42%	0.417	23%	0.231	S	C	.	.	I	π-helix	trans	-82.8	-37.9	-178.7	-69.3	-49.2	0	0	0	112.3	Q254 D448 D449 W450 G456 L457	Q254-N452 PolarHBondContact NE2-OD1 3.1Å; D448-N452 PolarHBondContact O-N 2.96Å; D448-N452 PolarHBondContact O-ND2 2.69Å; D449-N452 PolarHBondContact O-N 2.84Å; W450-N452 VanDerWaalsContact C-N 3.28Å; W450-N452 PolarHBondContact O-N 2.83Å; N452-G456 WeakPolarHBondContact O-CA 3.33Å; N452-L457 PolarHBondContact O-N 3.1Å
453	D	89.8	Confident	89.4	Confident	76 Å²	76	46 Å²	46	41%	0.406	25%	0.247	S	C	.	.	I	π-helix	trans	-66.7	-38.6	174	-90.1	8	0	0	0	112.2	P63 D449	P63-D453 HydrophobicContact CB-CB 4Å; D449-D453 PolarHBondContact O-N 2.76Å
454	G	88.4	Confident	88.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.261	C	S	.	.	I	π-helix	trans	-86.9	-104.6	176.2	0	0	0	0	0	112.5	W450 G456 L457 K458	W450-G454 PolarHBondContact O-N 3.44Å; G454-G456 PolarHBondContact O-N 3.47Å; G454-L457 VanDerWaalsContact O-CB 3.31Å; G454-L457 WeakPolarHBondContact O-CB 3.4Å; G454-L457 PolarHBondContact O-N 3.39Å; G454-K458 PolarHBondContact O-N 3.37Å
455	W	91.4	Very high	87	Confident	12 Å²	12	45.9 Å²	45.9	5%	0.045	27%	0.271	C	S	.	.	I	π-helix	trans	-43	-40.6	-179.8	178.5	79	0	0	0	115.5	E151 T235 L237 D253 Q254 A451 L457 K458 K459	E151-W455 HydrophobicContact CG-CB 4.2Å; E151-W455 WeakPolarHBondContact OE1-CA 3.39Å; E151-W455 WeakPolarHBondContact OE1-CB 3.16Å; E151-W455 PolarHBondContact OE1-N 2.81Å; E151-W455 VanDerWaalsContact OE1-N 3.14Å; T235-W455 PolarHBondContact O-NE1 2.88Å; L237-W455 HydrophobicContact CB-CB 4.43Å; L237-W455 HydrophobicContact CB-CD2 3.77Å; L237-W455 HydrophobicContact CB-CE3 4.38Å; L237-W455 HydrophobicContact CB-CG 3.8Å; L237-W455 HydrophobicContact CB-CZ2 4.41Å; L237-W455 HydrophobicContact CD1-CB 4.08Å; L237-W455 HydrophobicContact CD1-CG 4.33Å; L237-W455 HydrophobicContact CD2-CB 4.23Å; L237-W455 HydrophobicContact CD2-CD2 3.99Å; L237-W455 HydrophobicContact CD2-CE3 3.86Å; L237-W455 HydrophobicContact CD2-CG 4.18Å; L237-W455 HydrophobicContact CD2-CZ3 4.47Å; L237-W455 HydrophobicContact CG-CB 4.49Å; L237-W455 HydrophobicContact CG-CD2 4.43Å; L237-W455 HydrophobicContact CG-CG 4.34Å; D253-W455 HydrophobicContact CB-CH2 3.67Å; D253-W455 HydrophobicContact CB-CZ2 3.52Å; D253-W455 WeakPolarHBondContact OD1-CZ2 3.23Å; Q254-W455 HydrophobicContact CG-CE3 4.5Å; Q254-W455 HydrophobicContact CG-CZ3 3.85Å; A451-W455 PolarHBondContact O-N 3.24Å; W455-L457 VanDerWaalsContact C-N 3.29Å; W455-L457 PolarHBondContact O-N 2.88Å; W455-K458 WeakPolarHBondContact O-CB 3.48Å; W455-K458 PolarHBondContact O-N 3.11Å; W455-K458 VanDerWaalsContact O-N 3.09Å; W455-K459 HydrophobicContact CH2-CD 3.4Å; W455-K459 VanDerWaalsContact CH2-CD 3.4Å; W455-K459 HydrophobicContact CZ2-CD 3.25Å; W455-K459 HydrophobicContact CZ3-CD 4.1Å; W455-K459 WeakPolarHBondContact O-CB 3.4Å; W455-K459 PolarHBondContact O-N 2.68Å
456	G	89	Confident	85.7	Confident	20 Å²	20	41.4 Å²	41.4	21%	0.206	26%	0.259	C	S	.	.	I	π-helix	trans	-59.7	-38.2	178.2	0	0	0	0	0	112.9	A451 N452 G454 A460	A451-G456 PolarHBondContact O-N 3.05Å; N452-G456 WeakPolarHBondContact O-CA 3.33Å; G454-G456 PolarHBondContact O-N 3.47Å; G456-A460 VanDerWaalsContact O-CB 3.25Å; G456-A460 WeakPolarHBondContact O-CB 3.38Å; G456-A460 PolarHBondContact O-N 2.93Å
457	L	87.4	Confident	84.2	Confident	48 Å²	48	43.2 Å²	43.2	25%	0.251	27%	0.271	S	S	.	.	H	α-helix	trans	-68.3	-39.7	173.2	-168	66.9	0	0	0	111.6	V58 Y60 L114 N452 G454 W455 A460 A461	V58-L457 HydrophobicContact CG1-CD1 3.69Å; V58-L457 HydrophobicContact CG1-CD2 4.46Å; V58-L457 HydrophobicContact CG1-CG 4.17Å; Y60-L457 HydrophobicContact CD2-CD2 4.13Å; L114-L457 HydrophobicContact CD1-CB 4.47Å; L114-L457 HydrophobicContact CD1-CD2 4.31Å; L114-L457 HydrophobicContact CD1-CG 4.02Å; N452-L457 PolarHBondContact O-N 3.1Å; G454-L457 VanDerWaalsContact O-CB 3.31Å; G454-L457 WeakPolarHBondContact O-CB 3.4Å; G454-L457 PolarHBondContact O-N 3.39Å; W455-L457 VanDerWaalsContact C-N 3.29Å; W455-L457 PolarHBondContact O-N 2.88Å; L457-A460 PolarHBondContact O-N 3.33Å; L457-A461 WeakPolarHBondContact O-CB 3.32Å; L457-A461 PolarHBondContact O-N 3.01Å
458	K	86.6	Confident	82.9	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.017	30%	0.296	C	S	.	.	H	α-helix	trans	-62.5	-52.4	176.8	-47.4	-169.7	-171.7	-165.4	0	110.9	M109 L114 D117 E151 D436 G454 W455 A460 A461 D462	M109-K458 HydrophobicContact CE-CD 4.47Å; L114-K458 HydrophobicContact CD1-CB 4.33Å; L114-K458 HydrophobicContact CD1-CG 4.05Å; D117-K458 VanDerWaalsContact CG-CE 3.5Å; D117-K458 VanDerWaalsContact CG-NZ 3.25Å; D117-K458 WeakPolarHBondContact OD1-CE 3.32Å; D117-K458 IonicContact OD1-NZ 2.67Å; D117-K458 PolarHBondContact OD1-NZ 3.13Å; D117-K458 WeakPolarHBondContact OD2-CD 3.33Å; D117-K458 WeakPolarHBondContact OD2-CE 2.97Å; D117-K458 IonicContact OD2-NZ 2.91Å; D117-K458 PolarHBondContact OD2-NZ 3.31Å; E151-K458 IonicContact OE1-NZ 3.91Å; E151-K458 VanDerWaalsContact OE2-CD 3.29Å; E151-K458 WeakPolarHBondContact OE2-CD 3.36Å; E151-K458 WeakPolarHBondContact OE2-CE 3.38Å; E151-K458 IonicContact OE2-NZ 3.17Å; E151-K458 PolarHBondContact OE2-NZ 3.03Å; D436-K458 IonicContact OD2-NZ 2.97Å; D436-K458 PolarHBondContact OD2-NZ 2.87Å; G454-K458 PolarHBondContact O-N 3.37Å; W455-K458 WeakPolarHBondContact O-CB 3.48Å; W455-K458 PolarHBondContact O-N 3.11Å; W455-K458 VanDerWaalsContact O-N 3.09Å; K458-A460 VanDerWaalsContact C-N 3.3Å; K458-A460 PolarHBondContact O-N 2.84Å; K458-A461 WeakPolarHBondContact O-CB 3.38Å; K458-A461 PolarHBondContact O-N 2.85Å; K458-D462 PolarHBondContact O-N 3.32Å
459	K	87.3	Confident	81.8	Confident	96 Å²	96	49 Å²	49	42%	0.417	32%	0.317	S	S	.	.	H	α-helix	trans	-61.9	-33.8	177.2	-173.9	159.6	-176.4	162.5	0	113.1	D253 W455 G463	D253-K459 IonicContact OD2-NZ 2.91Å; D253-K459 PolarHBondContact OD2-NZ 2.7Å; W455-K459 HydrophobicContact CH2-CD 3.4Å; W455-K459 VanDerWaalsContact CH2-CD 3.4Å; W455-K459 HydrophobicContact CZ2-CD 3.25Å; W455-K459 HydrophobicContact CZ3-CD 4.1Å; W455-K459 WeakPolarHBondContact O-CB 3.4Å; W455-K459 PolarHBondContact O-N 2.68Å; K459-G463 PolarHBondContact O-N 2.8Å
460	A	85.3	Confident	80.7	Confident	60 Å²	60	50.7 Å²	50.7	50%	0.496	33%	0.33	S	S	.	.	H	α-helix	trans	-70.1	-37.5	172.6	0	0	0	0	0	112.6	G456 L457 K458 A464	G456-A460 VanDerWaalsContact O-CB 3.25Å; G456-A460 WeakPolarHBondContact O-CB 3.38Å; G456-A460 PolarHBondContact O-N 2.93Å; L457-A460 PolarHBondContact O-N 3.33Å; K458-A460 VanDerWaalsContact C-N 3.3Å; K458-A460 PolarHBondContact O-N 2.84Å; A460-A464 WeakPolarHBondContact O-CB 3.17Å; A460-A464 PolarHBondContact O-N 3.02Å
461	A	83	Confident	79.6	Confident	12 Å²	12	51.4 Å²	51.4	10%	0.099	34%	0.341	C	S	.	.	H	α-helix	trans	-69.5	-43.3	174.8	0	0	0	0	0	111.9	K113 L114 L457 K458 A464 A465	K113-A461 HydrophobicContact CB-CB 4.21Å; L114-A461 HydrophobicContact CD1-CB 4.12Å; L114-A461 HydrophobicContact CD2-CB 3.8Å; L114-A461 HydrophobicContact CG-CB 3.75Å; L457-A461 WeakPolarHBondContact O-CB 3.32Å; L457-A461 PolarHBondContact O-N 3.01Å; K458-A461 WeakPolarHBondContact O-CB 3.38Å; K458-A461 PolarHBondContact O-N 2.85Å; A461-A464 PolarHBondContact O-N 2.89Å; A461-A465 VanDerWaalsContact O-CB 3.31Å; A461-A465 WeakPolarHBondContact O-CB 3.32Å; A461-A465 PolarHBondContact O-N 3.43Å
462	D	80.5	Confident	78.7	Confident	44 Å²	44	56 Å²	56	24%	0.235	36%	0.362	C	S	.	.	H	α-helix	trans	-61.8	-50.9	174.8	-69.6	-29.2	0	0	0	111	K113 K458 A464 A465 E466	K113-D462 WeakPolarHBondContact CG-OD1 3.47Å; K458-D462 PolarHBondContact O-N 3.32Å; D462-A464 PolarHBondContact O-N 3.4Å; D462-A465 CarbonylContact O-C 3.53Å; D462-A465 PolarHBondContact O-N 3.3Å; D462-E466 PolarHBondContact O-N 3.21Å
463	G	77.9	Confident	77.9	Confident	49 Å²	49	56 Å²	56	51%	0.505	36%	0.361	S	S	.	.	H	α-helix	trans	-68	-15.7	178.4	0	0	0	0	0	115	K459	K459-G463 PolarHBondContact O-N 2.8Å
464	A	72.1	Confident	77.2	Confident	88 Å²	88	55.7 Å²	55.7	73%	0.727	36%	0.358	S	S	*	.	H	α-helix	trans	-92.4	-16.7	169.9	0	0	0	0	0	113.2	A460 A461 D462	A460-A464 WeakPolarHBondContact O-CB 3.17Å; A460-A464 PolarHBondContact O-N 3.02Å; A461-A464 PolarHBondContact O-N 2.89Å; D462-A464 PolarHBondContact O-N 3.4Å
465	A	63.8	Low	76.7	Confident	56 Å²	56	61.2 Å²	61.2	46%	0.463	38%	0.384	S	S	.	.	H	α-helix	trans	-92.3	-24.7	173.5	0	0	0	0	0	112.4	K113 A461 D462	K113-A465 HydrophobicContact CD-CB 4.16Å; K113-A465 HydrophobicContact CG-CB 4.17Å; A461-A465 VanDerWaalsContact O-CB 3.31Å; A461-A465 WeakPolarHBondContact O-CB 3.32Å; A461-A465 PolarHBondContact O-N 3.43Å; D462-A465 CarbonylContact O-C 3.53Å; D462-A465 PolarHBondContact O-N 3.3Å
466	E	66.1	Low	75.9	Confident	94 Å²	94	62.1 Å²	62.1	44%	0.439	39%	0.394	S	S	.	.	S	Bend	trans	-58.8	129.1	168	-77.3	-168.7	156.9	0	0	109.9	K234 D462 G468	K234-E466 IonicContact NZ-OE1 2.82Å; K234-E466 PolarHBondContact NZ-OE1 2.99Å; D462-E466 PolarHBondContact O-N 3.21Å; E466-G468 PolarHBondContact O-N 3.35Å
467	P	62.1	Low	75.5	Confident	52 Å²	52	61.2 Å²	61.2	34%	0.338	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-61.9	126.3	173.2	22.9	-29.3	0	0	0	108.9	Q472	P467-Q472 HydrophobicContact CB-CG 4.39Å; P467-Q472 HydrophobicContact CG-CG 3.98Å; P467-Q472 WeakPolarHBondContact O-CG 3.35Å; P467-Q472 PolarHBondContact O-NE2 2.68Å
468	G	67.6	Low	75.1	Confident	52 Å²	52	65.6 Å²	65.6	54%	0.536	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-59.5	167.8	169.6	0	0	0	0	0	111.1	E466 V470 G471 Q472	E466-G468 PolarHBondContact O-N 3.35Å; G468-V470 CarbonylContact O-C 3.58Å; G468-V470 PolarHBondContact O-N 3.21Å; G468-G471 WeakPolarHBondContact O-CA 3.09Å; G468-G471 PolarHBondContact O-N 3.08Å; G468-Q472 PolarHBondContact O-N 3.17Å
469	V	69.9	Low	75	Confident	106 Å²	106	72.5 Å²	72.5	64%	0.642	44%	0.436	S	S	*	.	H	α-helix	trans	-45.3	-40	-170.9	-175.2	0	0	0	0	114.2	Q472 M473	V469-Q472 PolarHBondContact O-N 2.69Å; V469-M473 HydrophobicContact CG1-SD 4.32Å; V469-M473 VanDerWaalsContact O-CG 3.27Å; V469-M473 WeakPolarHBondContact O-CG 3.38Å; V469-M473 PolarHBondContact O-N 2.75Å
470	V	68.6	Low	74.9	Confident	107 Å²	107	74.4 Å²	74.4	65%	0.648	44%	0.44	S	S	*	.	H	α-helix	trans	-66.1	-39.7	176.7	-177.5	0	0	0	0	112.5	G468 M473 I474	G468-V470 CarbonylContact O-C 3.58Å; G468-V470 PolarHBondContact O-N 3.21Å; V470-M473 PolarHBondContact O-N 2.79Å; V470-I474 HydrophobicContact CG1-CD1 4.14Å; V470-I474 VanDerWaalsContact O-CG1 3.3Å; V470-I474 WeakPolarHBondContact O-CG1 3.47Å; V470-I474 PolarHBondContact O-N 3.17Å
471	G	69.8	Low	74.9	Confident	25 Å²	25	75.8 Å²	75.8	26%	0.258	45%	0.445	S	S	.	.	H	α-helix	trans	-67.5	-42.5	174.7	0	0	0	0	0	112.5	G468 M473 I474 E475	G468-G471 WeakPolarHBondContact O-CA 3.09Å; G468-G471 PolarHBondContact O-N 3.08Å; G471-M473 VanDerWaalsContact C-N 3.26Å; G471-M473 PolarHBondContact O-N 3.24Å; G471-I474 PolarHBondContact O-N 3.38Å; G471-I474 VanDerWaalsContact O-N 3.09Å; G471-E475 WeakPolarHBondContact O-CB 3.41Å; G471-E475 PolarHBondContact O-N 2.81Å
472	Q	74.5	Confident	75.1	Confident	97 Å²	97	82.8 Å²	82.8	45%	0.453	47%	0.469	S	S	.	.	H	α-helix	trans	-59.4	-38.1	173.6	-74.4	172.7	-2.6	0	0	111.9	P467 G468 V469 A476	P467-Q472 HydrophobicContact CB-CG 4.39Å; P467-Q472 HydrophobicContact CG-CG 3.98Å; P467-Q472 WeakPolarHBondContact O-CG 3.35Å; P467-Q472 PolarHBondContact O-NE2 2.68Å; G468-Q472 PolarHBondContact O-N 3.17Å; V469-Q472 PolarHBondContact O-N 2.69Å; Q472-A476 WeakPolarHBondContact O-CB 3.11Å; Q472-A476 PolarHBondContact O-N 2.63Å
473	M	74.1	Confident	75.3	Confident	79 Å²	79	81.9 Å²	81.9	39%	0.389	46%	0.464	S	S	.	.	H	α-helix	trans	-65.6	-44.3	173.2	-69.2	174.6	87.6	0	0	111.4	V469 V470 G471 A477 Y487	V469-M473 HydrophobicContact CG1-SD 4.32Å; V469-M473 VanDerWaalsContact O-CG 3.27Å; V469-M473 WeakPolarHBondContact O-CG 3.38Å; V469-M473 PolarHBondContact O-N 2.75Å; V470-M473 PolarHBondContact O-N 2.79Å; G471-M473 VanDerWaalsContact C-N 3.26Å; G471-M473 PolarHBondContact O-N 3.24Å; M473-A477 WeakPolarHBondContact O-CB 3.21Å; M473-A477 PolarHBondContact O-N 2.96Å; M473-Y487 HydrophobicContact CB-CE2 3.78Å; M473-Y487 HydrophobicContact CE-CD1 3.75Å; M473-Y487 HydrophobicContact CE-CE1 3.48Å; M473-Y487 VanDerWaalsContact CE-CE1 3.48Å; M473-Y487 HydrophobicContact CE-CE2 4.36Å; M473-Y487 HydrophobicContact CE-CG 4.31Å; M473-Y487 HydrophobicContact CG-CE2 4.48Å; M473-Y487 WeakPolarHBondContact O-CE2 3.34Å
474	I	76.1	Confident	75.6	Confident	69 Å²	69	84.7 Å²	84.7	35%	0.354	46%	0.459	S	S	.	.	H	α-helix	trans	-61.2	-50.6	177.4	-69.3	164.5	0	0	0	111	V470 G471 A476 A477 E478 W484	V470-I474 HydrophobicContact CG1-CD1 4.14Å; V470-I474 VanDerWaalsContact O-CG1 3.3Å; V470-I474 WeakPolarHBondContact O-CG1 3.47Å; V470-I474 PolarHBondContact O-N 3.17Å; G471-I474 PolarHBondContact O-N 3.38Å; G471-I474 VanDerWaalsContact O-N 3.09Å; I474-A476 PolarHBondContact O-N 3.03Å; I474-A477 CarbonylContact O-C 3.5Å; I474-A477 WeakPolarHBondContact O-CA 3.21Å; I474-A477 PolarHBondContact O-N 3.02Å; I474-E478 PolarHBondContact O-N 2.92Å; I474-W484 HydrophobicContact CG1-CH2 4.08Å; I474-W484 HydrophobicContact CG2-CH2 4.41Å; I474-W484 HydrophobicContact CG2-CZ2 4.23Å
475	E	78.3	Confident	76.3	Confident	115 Å²	115	84.8 Å²	84.8	54%	0.537	45%	0.45	S	S	.	.	H	α-helix	trans	-59.8	-46.6	179.5	-175.6	172.8	-153.9	0	0	111.8	G471 A477 E478 E479	G471-E475 WeakPolarHBondContact O-CB 3.41Å; G471-E475 PolarHBondContact O-N 2.81Å; E475-A477 PolarHBondContact O-N 2.95Å; E475-E478 PolarHBondContact O-N 3.43Å; E475-E478 VanDerWaalsContact O-N 3.11Å; E475-E479 PolarHBondContact O-N 3.31Å
476	A	74.9	Confident	77.3	Confident	32 Å²	32	84.9 Å²	84.9	26%	0.264	45%	0.445	S	S	.	.	H	α-helix	trans	-61.5	-31.5	174.5	0	0	0	0	0	112.8	Q472 I474 R480 L483	Q472-A476 WeakPolarHBondContact O-CB 3.11Å; Q472-A476 PolarHBondContact O-N 2.63Å; I474-A476 PolarHBondContact O-N 3.03Å; A476-R480 VanDerWaalsContact O-CB 3.31Å; A476-R480 WeakPolarHBondContact O-CB 3.49Å; A476-R480 PolarHBondContact O-N 2.86Å; A476-L483 HydrophobicContact CB-CD1 4.1Å
477	A	79.1	Confident	78.3	Confident	0 Å²	0	82.7 Å²	82.7	0%	0	43%	0.433	C	S	.	.	H	α-helix	trans	-83.2	-18.2	176.5	0	0	0	0	0	113.8	M473 I474 E475 R480 P481 L483 W484 Y487	M473-A477 WeakPolarHBondContact O-CB 3.21Å; M473-A477 PolarHBondContact O-N 2.96Å; I474-A477 CarbonylContact O-C 3.5Å; I474-A477 WeakPolarHBondContact O-CA 3.21Å; I474-A477 PolarHBondContact O-N 3.02Å; E475-A477 PolarHBondContact O-N 2.95Å; A477-R480 CarbonylContact O-C 3.59Å; A477-R480 VanDerWaalsContact O-C 3.29Å; A477-P481 WeakPolarHBondContact O-CA 3.18Å; A477-L483 HydrophobicContact CB-CB 3.9Å; A477-W484 HydrophobicContact CB-CD2 3.96Å; A477-W484 HydrophobicContact CB-CG 3.94Å; A477-W484 HydrophobicContact CB-CZ2 4.28Å; A477-W484 VanDerWaalsContact O-CD1 3.25Å; A477-W484 PolarHBondContact O-NE1 3.43Å; A477-Y487 HydrophobicContact CB-CD2 4.27Å; A477-Y487 HydrophobicContact CB-CE2 3.85Å
478	E	80.5	Confident	79.4	Confident	141 Å²	141	85.3 Å²	85.3	66%	0.659	44%	0.443	S	S	*	.	H	α-helix	trans	-73.9	-42.3	165.1	-71	-175.9	177.8	0	0	111	I474 E475 R480	I474-E478 PolarHBondContact O-N 2.92Å; E475-E478 PolarHBondContact O-N 3.43Å; E475-E478 VanDerWaalsContact O-N 3.11Å; E478-R480 VanDerWaalsContact C-N 3.31Å; E478-R480 PolarHBondContact O-N 3.26Å
479	E	82.9	Confident	80.3	Confident	148 Å²	148	87.6 Å²	87.6	69%	0.692	44%	0.442	S	S	*	.	H	α-helix	trans	-61.5	-38.8	168.4	-73.1	-157.5	148.7	0	0	112.5	E475	E475-E479 PolarHBondContact O-N 3.31Å
480	R	86.1	Confident	81	Confident	136 Å²	136	86.7 Å²	86.7	51%	0.513	44%	0.437	S	S	.	.			trans	-130	82.6	-170.2	-56.3	-178.5	-172.4	-147.1	-1.8	110.9	A476 A477 E478 W482 L483	A476-R480 VanDerWaalsContact O-CB 3.31Å; A476-R480 WeakPolarHBondContact O-CB 3.49Å; A476-R480 PolarHBondContact O-N 2.86Å; A477-R480 CarbonylContact O-C 3.59Å; A477-R480 VanDerWaalsContact O-C 3.29Å; E478-R480 VanDerWaalsContact C-N 3.31Å; E478-R480 PolarHBondContact O-N 3.26Å; R480-W482 PolarHBondContact O-N 3.07Å; R480-L483 HydrophobicContact CB-CD1 3.97Å; R480-L483 HydrophobicContact CB-CG 4.1Å; R480-L483 WeakPolarHBondContact O-CB 3.41Å; R480-L483 PolarHBondContact O-N 3.21Å
481	P	85.1	Confident	81.8	Confident	90 Å²	90	86.1 Å²	86.1	58%	0.584	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-18.7	-173.7	-31.1	37	0	0	0	116.8	A477 L483 W484	A477-P481 WeakPolarHBondContact O-CA 3.18Å; P481-L483 VanDerWaalsContact C-N 3.32Å; P481-W484 PolarHBondContact O-N 2.88Å
482	W	86.5	Confident	82.3	Confident	159 Å²	159	87.2 Å²	87.2	60%	0.602	44%	0.441	S	S	*	.	H	α-helix	trans	-71.3	-23.3	173.8	66.7	-91.4	0	0	0	113.4	R480 W484 V485 V486	R480-W482 PolarHBondContact O-N 3.07Å; W482-W484 VanDerWaalsContact C-N 3.27Å; W482-W484 PolarHBondContact O-N 2.96Å; W482-V485 WeakPolarHBondContact O-CB 3.48Å; W482-V485 PolarHBondContact O-N 3.33Å; W482-V486 HydrophobicContact CE3-CG2 3.8Å; W482-V486 HydrophobicContact CZ3-CG2 3.83Å; W482-V486 PolarHBondContact O-N 2.84Å
483	L	85.6	Confident	82.8	Confident	25 Å²	25	87.3 Å²	87.3	13%	0.131	44%	0.444	C	S	.	.	H	α-helix	trans	-65.1	-29.9	175.2	-71.4	178.9	0	0	0	112.1	A476 A477 R480 P481 V485 V486 Y487	A476-L483 HydrophobicContact CB-CD1 4.1Å; A477-L483 HydrophobicContact CB-CB 3.9Å; R480-L483 HydrophobicContact CB-CD1 3.97Å; R480-L483 HydrophobicContact CB-CG 4.1Å; R480-L483 WeakPolarHBondContact O-CB 3.41Å; R480-L483 PolarHBondContact O-N 3.21Å; P481-L483 VanDerWaalsContact C-N 3.32Å; L483-V485 PolarHBondContact O-N 2.92Å; L483-V486 WeakPolarHBondContact O-CB 3.43Å; L483-V486 PolarHBondContact O-N 2.71Å; L483-V486 VanDerWaalsContact O-N 3.09Å; L483-Y487 HydrophobicContact CB-CE2 4.08Å; L483-Y487 WeakPolarHBondContact O-CD2 3.44Å; L483-Y487 VanDerWaalsContact O-CG 3.24Å; L483-Y487 PolarHBondContact O-N 2.89Å
484	W	84.7	Confident	83.2	Confident	108 Å²	108	86.5 Å²	86.5	41%	0.409	44%	0.444	S	S	.	.	H	α-helix	trans	-56.8	-39.3	169.9	-76	109.9	0	0	0	112.2	I474 A477 P481 W482 Y487 I488	I474-W484 HydrophobicContact CG1-CH2 4.08Å; I474-W484 HydrophobicContact CG2-CH2 4.41Å; I474-W484 HydrophobicContact CG2-CZ2 4.23Å; A477-W484 HydrophobicContact CB-CD2 3.96Å; A477-W484 HydrophobicContact CB-CG 3.94Å; A477-W484 HydrophobicContact CB-CZ2 4.28Å; A477-W484 VanDerWaalsContact O-CD1 3.25Å; A477-W484 PolarHBondContact O-NE1 3.43Å; P481-W484 PolarHBondContact O-N 2.88Å; W482-W484 VanDerWaalsContact C-N 3.27Å; W482-W484 PolarHBondContact O-N 2.96Å; W484-Y487 PolarHBondContact O-N 3.1Å; W484-I488 VanDerWaalsContact O-CB 3.27Å; W484-I488 WeakPolarHBondContact O-CB 3.25Å; W484-I488 WeakPolarHBondContact O-CD1 3.42Å; W484-I488 WeakPolarHBondContact O-CG1 3.49Å; W484-I488 PolarHBondContact O-N 2.89Å
485	V	84.9	Confident	83.6	Confident	89 Å²	89	86.9 Å²	86.9	54%	0.539	45%	0.45	S	S	.	.	H	α-helix	trans	-66.6	-40	176.6	-173.4	0	0	0	0	110.6	W482 L483 L489	W482-V485 WeakPolarHBondContact O-CB 3.48Å; W482-V485 PolarHBondContact O-N 3.33Å; L483-V485 PolarHBondContact O-N 2.92Å; V485-L489 HydrophobicContact CG1-CD1 4.15Å; V485-L489 WeakPolarHBondContact O-CB 3.2Å; V485-L489 VanDerWaalsContact O-CG 3.3Å; V485-L489 WeakPolarHBondContact O-CG 3.47Å; V485-L489 PolarHBondContact O-N 3.26Å
486	V	86.4	Confident	83.9	Confident	58 Å²	58	87.6 Å²	87.6	35%	0.352	45%	0.451	S	S	.	.	H	α-helix	trans	-64.1	-47.9	176	-179	0	0	0	0	111.1	W482 L483 L489 T490	W482-V486 HydrophobicContact CE3-CG2 3.8Å; W482-V486 HydrophobicContact CZ3-CG2 3.83Å; W482-V486 PolarHBondContact O-N 2.84Å; L483-V486 WeakPolarHBondContact O-CB 3.43Å; L483-V486 PolarHBondContact O-N 2.71Å; L483-V486 VanDerWaalsContact O-N 3.09Å; V486-L489 PolarHBondContact O-N 3.47Å; V486-T490 HydrophobicContact CG1-CG2 4.34Å; V486-T490 WeakPolarHBondContact O-CG2 3.44Å; V486-T490 PolarHBondContact O-N 2.92Å; V486-T490 PolarHBondContact O-OG1 3.38Å
487	Y	86.9	Confident	84.3	Confident	49 Å²	49	90.1 Å²	90.1	19%	0.192	46%	0.46	C	S	.	.	H	α-helix	trans	-67.7	-39	-179.9	-58.4	-23.3	0	0	0	112.6	M473 A477 L483 W484 L489 T490 V491	M473-Y487 HydrophobicContact CB-CE2 3.78Å; M473-Y487 HydrophobicContact CE-CD1 3.75Å; M473-Y487 HydrophobicContact CE-CE1 3.48Å; M473-Y487 VanDerWaalsContact CE-CE1 3.48Å; M473-Y487 HydrophobicContact CE-CE2 4.36Å; M473-Y487 HydrophobicContact CE-CG 4.31Å; M473-Y487 HydrophobicContact CG-CE2 4.48Å; M473-Y487 WeakPolarHBondContact O-CE2 3.34Å; A477-Y487 HydrophobicContact CB-CD2 4.27Å; A477-Y487 HydrophobicContact CB-CE2 3.85Å; L483-Y487 HydrophobicContact CB-CE2 4.08Å; L483-Y487 WeakPolarHBondContact O-CD2 3.44Å; L483-Y487 VanDerWaalsContact O-CG 3.24Å; L483-Y487 PolarHBondContact O-N 2.89Å; W484-Y487 PolarHBondContact O-N 3.1Å; Y487-L489 VanDerWaalsContact C-N 3.32Å; Y487-L489 PolarHBondContact O-N 3.38Å; Y487-T490 WeakPolarHBondContact CA-OG1 3.39Å; Y487-T490 PolarHBondContact O-N 2.87Å; Y487-T490 PolarHBondContact O-OG1 2.85Å; Y487-V491 WeakPolarHBondContact O-CB 2.99Å; Y487-V491 WeakPolarHBondContact O-CG2 2.93Å; Y487-V491 PolarHBondContact O-N 2.88Å
488	I	85.8	Confident	84.5	Confident	107 Å²	107	94.3 Å²	94.3	55%	0.549	49%	0.485	S	S	.	.	H	α-helix	trans	-62.6	-41.5	172.6	-70.5	166.2	0	0	0	109.9	W484 A492	W484-I488 VanDerWaalsContact O-CB 3.27Å; W484-I488 WeakPolarHBondContact O-CB 3.25Å; W484-I488 WeakPolarHBondContact O-CD1 3.42Å; W484-I488 WeakPolarHBondContact O-CG1 3.49Å; W484-I488 PolarHBondContact O-N 2.89Å; I488-A492 HydrophobicContact CG2-CB 4.48Å; I488-A492 WeakPolarHBondContact O-CA 3.35Å; I488-A492 WeakPolarHBondContact O-CB 3.19Å; I488-A492 PolarHBondContact O-N 3.46Å
489	L	85.8	Confident	84.6	Confident	100 Å²	100	92 Å²	92	52%	0.524	48%	0.477	S	S	.	.	H	α-helix	trans	-66	-48.4	175.1	-76.5	168.9	0	0	0	112.5	V485 V486 Y487 V491 L493	V485-L489 HydrophobicContact CG1-CD1 4.15Å; V485-L489 WeakPolarHBondContact O-CB 3.2Å; V485-L489 VanDerWaalsContact O-CG 3.3Å; V485-L489 WeakPolarHBondContact O-CG 3.47Å; V485-L489 PolarHBondContact O-N 3.26Å; V486-L489 PolarHBondContact O-N 3.47Å; Y487-L489 VanDerWaalsContact C-N 3.32Å; Y487-L489 PolarHBondContact O-N 3.38Å; L489-V491 VanDerWaalsContact C-N 3.28Å; L489-V491 PolarHBondContact O-N 3.45Å; L489-L493 WeakPolarHBondContact O-CB 3.47Å; L489-L493 PolarHBondContact O-N 2.01Å
490	T	83.4	Confident	84.4	Confident	87 Å²	87	88.6 Å²	88.6	53%	0.534	46%	0.462	S	S	.	.	H	α-helix	trans	-68.8	-23.1	-176.8	56.1	0	0	0	0	113.6	V486 Y487 P494	V486-T490 HydrophobicContact CG1-CG2 4.34Å; V486-T490 WeakPolarHBondContact O-CG2 3.44Å; V486-T490 PolarHBondContact O-N 2.92Å; V486-T490 PolarHBondContact O-OG1 3.38Å; Y487-T490 WeakPolarHBondContact CA-OG1 3.39Å; Y487-T490 PolarHBondContact O-N 2.87Å; Y487-T490 PolarHBondContact O-OG1 2.85Å; T490-P494 WeakPolarHBondContact O-CD 3.41Å; T490-P494 WeakPolarHBondContact O-CG 3.46Å
491	V	85.3	Confident	84	Confident	94 Å²	94	91.1 Å²	91.1	57%	0.57	48%	0.478	S	S	*	.	H	α-helix	trans	-92.5	-49.7	172.6	178.4	0	0	0	0	111.8	Y487 L489 P494 V495	Y487-V491 WeakPolarHBondContact O-CB 2.99Å; Y487-V491 WeakPolarHBondContact O-CG2 2.93Å; Y487-V491 PolarHBondContact O-N 2.88Å; L489-V491 VanDerWaalsContact C-N 3.28Å; L489-V491 PolarHBondContact O-N 3.45Å; V491-P494 WeakPolarHBondContact O-CD 3.5Å; V491-P494 WeakPolarHBondContact O-CG 3.25Å; V491-V495 WeakPolarHBondContact O-CB 2.79Å; V491-V495 VanDerWaalsContact O-CG2 3.24Å; V491-V495 WeakPolarHBondContact O-CG2 3.28Å; V491-V495 PolarHBondContact O-N 3.02Å
492	A	82.3	Confident	83.2	Confident	49 Å²	49	91.2 Å²	91.2	41%	0.405	48%	0.479	S	S	.	.	H	α-helix	trans	-73.3	-31.1	-173.2	0	0	0	0	0	113	I488 V495 F496	I488-A492 HydrophobicContact CG2-CB 4.48Å; I488-A492 WeakPolarHBondContact O-CA 3.35Å; I488-A492 WeakPolarHBondContact O-CB 3.19Å; I488-A492 PolarHBondContact O-N 3.46Å; A492-V495 PolarHBondContact O-N 2.91Å; A492-F496 WeakPolarHBondContact O-CB 3.49Å; A492-F496 PolarHBondContact O-N 3.46Å
493	L	83.8	Confident	82.1	Confident	99 Å²	99	88.3 Å²	88.3	52%	0.518	48%	0.482	S	S	.	.	H	α-helix	trans	-65.5	-51.7	178.9	-168.3	151.8	0	0	0	112.4	L489 V495 F496 L497	L489-L493 WeakPolarHBondContact O-CB 3.47Å; L489-L493 PolarHBondContact O-N 2.01Å; L493-V495 PolarHBondContact O-N 2.98Å; L493-F496 PolarHBondContact O-N 2.83Å; L493-L497 HydrophobicContact CD2-CD1 3.66Å; L493-L497 HydrophobicContact CD2-CG 4.27Å; L493-L497 WeakPolarHBondContact O-CG 3.4Å; L493-L497 PolarHBondContact O-N 3.22Å
494	P	83.5	Confident	80.7	Confident	61 Å²	61	91.6 Å²	91.6	40%	0.396	51%	0.507	S	S	.	.	H	α-helix	trans	-65.6	-36.2	174	23.7	-31.9	0	0	0	112.7	T490 V491 F496 L497 V498	T490-P494 WeakPolarHBondContact O-CD 3.41Å; T490-P494 WeakPolarHBondContact O-CG 3.46Å; V491-P494 WeakPolarHBondContact O-CD 3.5Å; V491-P494 WeakPolarHBondContact O-CG 3.25Å; P494-F496 PolarHBondContact O-N 3.2Å; P494-L497 PolarHBondContact O-N 3.06Å; P494-V498 WeakPolarHBondContact O-CB 3.4Å; P494-V498 VanDerWaalsContact O-CG2 3.29Å; P494-V498 WeakPolarHBondContact O-CG2 3.33Å; P494-V498 PolarHBondContact O-N 3.05Å
495	V	84.1	Confident	79	Confident	78 Å²	78	89 Å²	89	47%	0.473	51%	0.514	S	S	.	.	H	α-helix	trans	-62.7	-41.7	174.2	169.4	0	0	0	0	111.4	V491 A492 L493 V498 I499	V491-V495 WeakPolarHBondContact O-CB 2.79Å; V491-V495 VanDerWaalsContact O-CG2 3.24Å; V491-V495 WeakPolarHBondContact O-CG2 3.28Å; V491-V495 PolarHBondContact O-N 3.02Å; A492-V495 PolarHBondContact O-N 2.91Å; L493-V495 PolarHBondContact O-N 2.98Å; V495-V498 PolarHBondContact O-N 2.7Å; V495-I499 HydrophobicContact CG1-CD1 3.8Å; V495-I499 HydrophobicContact CG1-CG1 4.49Å; V495-I499 WeakPolarHBondContact O-CB 3.38Å; V495-I499 VanDerWaalsContact O-CG1 3.27Å; V495-I499 WeakPolarHBondContact O-CG1 3.47Å; V495-I499 PolarHBondContact O-N 2.87Å
496	F	83.6	Confident	77.1	Confident	129 Å²	129	93.2 Å²	93.2	57%	0.566	53%	0.525	S	S	*	.	H	α-helix	trans	-66.3	-41.3	176.2	179.1	-108.6	0	0	0	112.2	A492 L493 P494 I499 L500	A492-F496 WeakPolarHBondContact O-CB 3.49Å; A492-F496 PolarHBondContact O-N 3.46Å; L493-F496 PolarHBondContact O-N 2.83Å; P494-F496 PolarHBondContact O-N 3.2Å; F496-I499 PolarHBondContact O-N 3.36Å; F496-L500 HydrophobicContact CD1-CD1 3.91Å; F496-L500 HydrophobicContact CE1-CD1 3.45Å; F496-L500 VanDerWaalsContact CE1-CD1 3.45Å; F496-L500 HydrophobicContact CE1-CG 4.31Å; F496-L500 HydrophobicContact CE2-CD1 4.41Å; F496-L500 HydrophobicContact CE2-CG 4.47Å; F496-L500 HydrophobicContact CZ-CD1 3.74Å; F496-L500 HydrophobicContact CZ-CG 4.23Å; F496-L500 WeakPolarHBondContact O-CB 3.45Å; F496-L500 WeakPolarHBondContact O-CG 3.24Å; F496-L500 PolarHBondContact O-N 2.93Å
497	L	84.1	Confident	74.9	Confident	85 Å²	85	100.5 Å²	100.5	45%	0.445	55%	0.552	S	S	.	*	H	α-helix	trans	-62.5	-42.3	172.9	-72	176.3	0	0	0	111.9	L493 P494 L500 F501	L493-L497 HydrophobicContact CD2-CD1 3.66Å; L493-L497 HydrophobicContact CD2-CG 4.27Å; L493-L497 WeakPolarHBondContact O-CG 3.4Å; L493-L497 PolarHBondContact O-N 3.22Å; P494-L497 PolarHBondContact O-N 3.06Å; L497-L500 PolarHBondContact O-N 2.98Å; L497-F501 WeakPolarHBondContact O-CB 3.45Å; L497-F501 PolarHBondContact O-N 3.26Å
498	V	83.8	Confident	72.8	Confident	89 Å²	89	105 Å²	105	54%	0.539	58%	0.575	S	S	.	*	H	α-helix	trans	-64.2	-43.1	175.1	168.6	0	0	0	0	111.1	P494 V495 F501 C502	P494-V498 WeakPolarHBondContact O-CB 3.4Å; P494-V498 VanDerWaalsContact O-CG2 3.29Å; P494-V498 WeakPolarHBondContact O-CG2 3.33Å; P494-V498 PolarHBondContact O-N 3.05Å; V495-V498 PolarHBondContact O-N 2.7Å; V498-F501 PolarHBondContact O-N 3.06Å; V498-C502 WeakPolarHBondContact O-CB 3.49Å; V498-C502 PolarHBondContact O-N 3.16Å; V498-C502 PolarHBondContact O-SG 3.02Å
499	I	81.3	Confident	70.5	Confident	93 Å²	93	105.7 Å²	105.7	48%	0.477	58%	0.584	S	S	.	*	H	α-helix	trans	-63.2	-42.3	175.2	-70.9	166.9	0	0	0	110.6	V495 F496 C503	V495-I499 HydrophobicContact CG1-CD1 3.8Å; V495-I499 HydrophobicContact CG1-CG1 4.49Å; V495-I499 WeakPolarHBondContact O-CB 3.38Å; V495-I499 VanDerWaalsContact O-CG1 3.27Å; V495-I499 WeakPolarHBondContact O-CG1 3.47Å; V495-I499 PolarHBondContact O-N 2.87Å; F496-I499 PolarHBondContact O-N 3.36Å; I499-C503 HydrophobicContact CG2-CB 4.42Å; I499-C503 WeakPolarHBondContact O-CA 3.45Å; I499-C503 WeakPolarHBondContact O-CB 3.26Å; I499-C503 PolarHBondContact O-N 2.64Å
500	L	79.1	Confident	68.1	Low	75 Å²	75	106.8 Å²	106.8	39%	0.393	60%	0.6	S	S	.	*	H	α-helix	trans	-60.9	-51.2	175.8	-81.1	173.7	0	0	0	111.7	F496 L497 S504	F496-L500 HydrophobicContact CD1-CD1 3.91Å; F496-L500 HydrophobicContact CE1-CD1 3.45Å; F496-L500 VanDerWaalsContact CE1-CD1 3.45Å; F496-L500 HydrophobicContact CE1-CG 4.31Å; F496-L500 HydrophobicContact CE2-CD1 4.41Å; F496-L500 HydrophobicContact CE2-CG 4.47Å; F496-L500 HydrophobicContact CZ-CD1 3.74Å; F496-L500 HydrophobicContact CZ-CG 4.23Å; F496-L500 WeakPolarHBondContact O-CB 3.45Å; F496-L500 WeakPolarHBondContact O-CG 3.24Å; F496-L500 PolarHBondContact O-N 2.93Å; L497-L500 PolarHBondContact O-N 2.98Å; L500-S504 WeakPolarHBondContact O-CB 3.32Å; L500-S504 PolarHBondContact O-N 3.11Å; L500-S504 VanDerWaalsContact O-N 3.17Å; L500-S504 PolarHBondContact O-OG 2.81Å
501	F	77.2	Confident	65.6	Low	190 Å²	190	106.8 Å²	106.8	83%	0.833	61%	0.609	S	S	*	*	H	α-helix	trans	-69.4	-32.6	-178.8	-100.9	-94.7	0	0	0	114.3	L497 V498	L497-F501 WeakPolarHBondContact O-CB 3.45Å; L497-F501 PolarHBondContact O-N 3.26Å; V498-F501 PolarHBondContact O-N 3.06Å
502	C	69.4	Low	63.1	Low	92 Å²	92	110.9 Å²	110.9	62%	0.622	63%	0.625	S	S	*	*	H	α-helix	trans	-91.2	-32.2	-177.3	-70.1	0	0	0	0	113.5	V498	V498-C502 WeakPolarHBondContact O-CB 3.49Å; V498-C502 PolarHBondContact O-N 3.16Å; V498-C502 PolarHBondContact O-SG 3.02Å
503	C	63.3	Low	60.7	Low	97 Å²	97	115.4 Å²	115.4	66%	0.655	64%	0.637	S	S	*	*	H	α-helix	trans	-105.1	-17.1	-172.7	-58.4	0	0	0	0	114.6	I499 G505	I499-C503 HydrophobicContact CG2-CB 4.42Å; I499-C503 WeakPolarHBondContact O-CA 3.45Å; I499-C503 WeakPolarHBondContact O-CB 3.26Å; I499-C503 PolarHBondContact O-N 2.64Å; C503-G505 PolarHBondContact O-N 2.81Å
504	S	56.1	Low	58.4	Low	95 Å²	95	118.5 Å²	118.5	66%	0.664	64%	0.643	S	S	*	*			trans	-80.1	55.4	177.3	-54.2	0	0	0	0	112.1	L500	L500-S504 WeakPolarHBondContact O-CB 3.32Å; L500-S504 PolarHBondContact O-N 3.11Å; L500-S504 VanDerWaalsContact O-N 3.17Å; L500-S504 PolarHBondContact O-OG 2.81Å
505	G	49	Very low	55.9	Low	54 Å²	54	123.3 Å²	123.3	56%	0.557	66%	0.658	S	S	*	*			trans	-132.9	33.5	-157.2	0	0	0	0	0	117.7	C503	C503-G505 PolarHBondContact O-N 2.81Å
506	K	45.9	Very low	53.5	Low	176 Å²	176	128.5 Å²	128.5	77%	0.765	67%	0.674	S	S	*	*			trans	174.1	137.4	152.4	-97.1	149.8	-171.2	176.4	0	114.9
507	K	38.7	Very low	51.2	Low	212 Å²	212	127.8 Å²	127.8	92%	0.922	68%	0.68	S	S	*	*			trans	-141.5	141.2	149.1	-79.1	-171.7	177.4	176.2	0	108.7
508	Q	43.2	Very low	48.7	Very low	143 Å²	143	130.7 Å²	130.7	67%	0.668	70%	0.696	S	S	*	*			trans	-158.7	158.4	-165.4	-72	-167.5	-119.1	0	0	111.6
509	T	37.4	Very low	46.5	Very low	121 Å²	121	130.5 Å²	130.5	74%	0.742	70%	0.704	S	S	*	*			cis	-166	132.8	-27.1	27.8	0	0	0	0	108.2
510	S	34.9	Very low	44.6	Very low	123 Å²	123	132.1 Å²	132.1	86%	0.86	72%	0.721	S	S	*	*			trans	-160.6	147.3	171.8	42.1	0	0	0	0	110.8
511	A	31.5	Very low	42.6	Very low	88 Å²	88	137.2 Å²	137.2	73%	0.727	74%	0.742	S	S	*	*			cis	-158.9	175.1	-6.4	0	0	0	0	0	112.3
512	M	32.6	Very low	41.1	Very low	180 Å²	180	133 Å²	133	89%	0.887	73%	0.734	S	S	*	*			trans	101.4	129.3	151.2	-134.2	166.1	-64.9	0	0	119.8
513	E	32.6	Very low	39.3	Very low	143 Å²	143	135.3 Å²	135.3	67%	0.668	74%	0.74	S	S	*	*			trans	-74.3	175.9	-176.2	-55.4	159.9	101.8	0	0	112.6
514	Y	34.3	Very low	37.8	Very low	165 Å²	165	136.2 Å²	136.2	65%	0.647	74%	0.742	S	S	*	*			cis	-175.1	149.9	46	-127.6	-57.7	0	0	0	115.2
515	K	31.3	Very low	36.6	Very low	161 Å²	161	139.2 Å²	139.2	70%	0.7	74%	0.744	S	S	*	*			trans	74	124.8	144.6	-100.2	150.7	-169.5	156.4	0	123.3
516	K	34.8	Very low	35.6	Very low	187 Å²	187	143.1 Å²	143.1	81%	0.813	75%	0.748	S	S	*	*				29.9	143.3	125.8	-60.7	-168.5	173.9	-167.4	0	120.5
517	T	35.8	Very low	34.8	Very low	114 Å²	114	142.1 Å²	142.1	70%	0.699	75%	0.746	S	S	*	*			cis	-158.1	-162.3	-9	27.9	0	0	0	0	107.1
518	D	30.5	Very low	34.3	Very low	147 Å²	147	140.1 Å²	140.1	79%	0.786	74%	0.739	S	S	*	*			cis	-160.9	-170.1	18.3	-132.3	-62.1	0	0	0	112.4
519	A	37.2	Very low	33.5	Very low	85 Å²	85	141.6 Å²	141.6	70%	0.702	75%	0.746	S	S	*	*			trans	-85.6	171.1	-176.5	0	0	0	0	0	114
520	P	42.3	Very low	33	Very low	127 Å²	127	141.9 Å²	141.9	83%	0.825	74%	0.739	S	S	*	*			cis	-139.4	178.9	39.4	41.8	-21.6	0	0	0	118.8
521	Q	37.3	Very low	32.5	Very low	181 Å²	181	142.3 Å²	142.3	85%	0.846	73%	0.725	S	S	*	*			trans	-77.8	-177.6	171.5	-76.4	-170.3	-69.7	0	0	112.6
522	P	45.1	Very low	32.1	Very low	101 Å²	101	145.7 Å²	145.7	66%	0.656	73%	0.726	S	S	*	*			cis	-152.2	-174.5	23.3	44.8	-22	0	0	0	120.4
523	D	31.3	Very low	31.7	Very low	141 Å²	141	144.1 Å²	144.1	75%	0.754	72%	0.717	S	S	*	*			trans	63.4	145.9	138.7	-76.4	1	0	0	0	122.4
524	V	32.6	Very low	31.8	Very low	116 Å²	116	146.2 Å²	146.2	70%	0.703	73%	0.727	S	S	*	*			cis	-153.3	164.6	-6	-146	0	0	0	0	109.6
525	K	29.5	Very low	31.4	Very low	158 Å²	158	146.1 Å²	146.1	69%	0.687	73%	0.73	S	S	*	*			trans	67.3	159.4	148.1	-89.7	175.5	178.8	-78.4	0	118.4
526	E	29.3	Very low	31.1	Very low	137 Å²	137	144 Å²	144	64%	0.64	73%	0.726	S	S	*	*			cis	-149.2	-150	-13.8	-160.4	130	-119.7	0	0	110.3
527	E	29.2	Very low	30.7	Very low	155 Å²	155	142.7 Å²	142.7	72%	0.724	72%	0.72	S	S	*	*			trans	-83.2	157.7	-162.6	-66.5	152.8	145.8	0	0	116.8
528	E	27	Very low	30.3	Very low	169 Å²	169	140.8 Å²	140.8	79%	0.79	72%	0.723	S	S	*	*			trans	55.5	147.1	139.2	-72	-178.9	158.5	0	0	124.5
529	E	27.4	Very low	30.1	Very low	174 Å²	174	140.2 Å²	140.2	81%	0.813	72%	0.72	S	S	*	*			trans	60.4	153.2	156.6	-70	-171.7	167.8	0	0	119.2
530	E	26.2	Very low	29.8	Very low	127 Å²	127	143.6 Å²	143.6	59%	0.593	72%	0.721	S	S	*	*			cis	-149.9	166.5	-19.6	-133.1	-159.9	158.6	0	0	109.1
531	K	24.2	Very low	29.3	Very low	132 Å²	132	145.2 Å²	145.2	57%	0.574	72%	0.718	S	S	*	*			trans	54.8	134.1	146	-80.1	180	171.9	89.4	0	124
532	E	24.1	Very low	29	Very low	159 Å²	159	144.5 Å²	144.5	74%	0.743	72%	0.715	S	S	*	*				93.2	144.3	125.6	-78.1	166	-162.7	0	0	124
533	E	24.3	Very low	28.2	Very low	147 Å²	147	148.9 Å²	148.9	69%	0.687	73%	0.727	S	S	*	*			trans	46.1	106.5	167.2	-59.6	-149.6	164.6	0	0	120.4	K535	E533-K535 IonicContact OE2-NZ 2.77Å; E533-K535 PolarHBondContact OE2-NZ 2.96Å
534	E	33.6	Very low	28	Very low	188 Å²	188	145.4 Å²	145.4	88%	0.879	72%	0.723	S	S	*	*			trans	-53.4	145.1	142.5	-59.1	-178.1	127.9	0	0	110.5
535	K	26	Very low	27.9	Very low	163 Å²	163	149 Å²	149	71%	0.709	73%	0.733	S	S	*	*			trans	-155.3	130.2	145.2	-122.2	169.6	-151.7	119.2	0	115.9	E533	E533-K535 IonicContact OE2-NZ 2.77Å; E533-K535 PolarHBondContact OE2-NZ 2.96Å
536	D	26.5	Very low	27.9	Very low	117 Å²	117	147.6 Å²	147.6	63%	0.626	73%	0.729	S	S	*	*			trans	96.5	128.5	130.4	-137	13	0	0	0	119.5
537	K	26.2	Very low	27.8	Very low	158 Å²	158	148.4 Å²	148.4	69%	0.687	73%	0.73	S	S	*	*			trans	56.7	118.8	158.5	-71	161.3	-174.7	73.4	0	120.4
538	G	26.4	Very low	27.6	Very low	74 Å²	74	147.5 Å²	147.5	76%	0.763	73%	0.729	S	S	*	*			trans	-106.6	170.6	131.6	0	0	0	0	0	110.2
539	D	27.6	Very low	27.5	Very low	135 Å²	135	148.5 Å²	148.5	72%	0.722	73%	0.734	S	S	*	*			trans	-131.9	154	172.7	-59	-45.1	0	0	0	105.5
540	E	30.5	Very low	27.4	Very low	156 Å²	156	149 Å²	149	73%	0.729	74%	0.737	S	S	*	*			cis	-161.8	158.3	-3.4	-111.9	165.7	170.7	0	0	107.3
541	E	30.7	Very low	27.4	Very low	161 Å²	161	152.5 Å²	152.5	75%	0.752	75%	0.75	S	S	*	*			trans	36.5	157.2	145.8	-57.7	179.9	167.3	0	0	122.5
542	E	30.9	Very low	27.7	Very low	167 Å²	167	155.2 Å²	155.2	78%	0.78	77%	0.765	S	S	*	*			cis	-159.8	166.2	-27.3	-94.2	-166.9	143.5	0	0	103.4
543	E	28.2	Very low	27.9	Very low	193 Å²	193	155.6 Å²	155.6	90%	0.902	76%	0.764	S	S	*	*			cis	-153	172.3	31.8	-58.3	169.5	133.1	0	0	106.4
544	G	28.8	Very low	28.1	Very low	67 Å²	67	152.4 Å²	152.4	69%	0.691	76%	0.758	S	S	*	*			cis	168.7	147	-3.6	0	0	0	0	0	110.3
545	E	30	Very low	27.8	Very low	192 Å²	192	150 Å²	150	90%	0.897	75%	0.751	S	S	*	*			trans	61.9	149.4	170.6	-61.5	-170.1	157	0	0	118.6
546	E	29.3	Very low	27.9	Very low	128 Å²	128	146.5 Å²	146.5	60%	0.598	75%	0.752	S	S	*	*			cis	-152.5	152.2	-4.1	-136.9	-153.4	172.6	0	0	111.7
547	K	27.1	Very low	28.1	Very low	154 Å²	154	149.2 Å²	149.2	67%	0.67	76%	0.761	S	S	*	*			trans	59.1	157.3	156	-74.4	-168.2	179.8	75	0	120.4
548	L	24.4	Very low	28.3	Very low	136 Å²	136	150.2 Å²	150.2	71%	0.712	77%	0.768	S	S	*	*			cis	-169.9	128	-33	-156.3	174.6	0	0	0	106.5
549	E	24.2	Very low	28.3	Very low	191 Å²	191	154.3 Å²	154.3	89%	0.893	77%	0.772	S	S	*	*			trans	-150.5	145	155.8	-148.2	167.2	-129.7	0	0	110.6
550	E	27.1	Very low	28.2	Very low	185 Å²	185	151 Å²	151	86%	0.864	77%	0.77	S	S	*	*			trans	-80.7	158.7	-172.9	-66.7	-178.8	104.5	0	0	112.9
551	K	26	Very low	27.9	Very low	200 Å²	200	146.9 Å²	146.9	87%	0.87	77%	0.77	S	S	*	*			trans	-136.4	115.8	179.6	-161.8	170.7	-170.7	171.8	0	112
552	Q	30	Very low	27.5	Very low	189 Å²	189	145.8 Å²	145.8	88%	0.883	77%	0.774	S	S	*	*			trans	-67.2	135.4	171.8	-71.4	-179.3	-27.5	0	0	111.7
553	K	28.7	Very low	27.3	Very low	167 Å²	167	143.8 Å²	143.8	73%	0.726	77%	0.773	S	S	*	*			trans	-174.8	158.2	162.2	-105	-154.5	149.9	-111.9	0	108.4	D555	K553-D555 IonicContact NZ-OD1 2.62Å; K553-D555 PolarHBondContact NZ-OD1 2.99Å; K553-D555 IonicContact NZ-OD2 2.63Å
554	S	28.5	Very low	27.2	Very low	80 Å²	80	139.5 Å²	139.5	56%	0.559	76%	0.764	S	S	*	*			cis	174.7	-172.4	-19	52	0	0	0	0	108.2
555	D	25.8	Very low	27.4	Very low	137 Å²	137	145.5 Å²	145.5	73%	0.733	78%	0.775	S	S	*	*			cis	-128.9	-101.4	5.7	-71.4	-84.9	0	0	0	113.3	K553	K553-D555 IonicContact NZ-OD1 2.62Å; K553-D555 PolarHBondContact NZ-OD1 2.99Å; K553-D555 IonicContact NZ-OD2 2.63Å
556	A	28.1	Very low	27.3	Very low	89 Å²	89	145.3 Å²	145.3	74%	0.736	77%	0.773	S	S	*	*			trans	-143.8	-161.5	-171	0	0	0	0	0	109.8
557	E	31.6	Very low	27.4	Very low	174 Å²	174	148.1 Å²	148.1	81%	0.813	79%	0.787	S	S	*	*			cis	-154.6	174.2	30.6	-72.7	-178	134.9	0	0	112.8
558	E	30	Very low	27.4	Very low	180 Å²	180	147.9 Å²	147.9	84%	0.841	79%	0.788	S	S	*	*			trans	11.3	154.4	155	-53.4	-172.9	146.6	0	0	122
559	D	27.4	Very low	27.6	Very low	159 Å²	159	147 Å²	147	85%	0.85	78%	0.784	S	S	*	*			cis	-159.5	165.1	22.2	-176.1	26.2	0	0	0	112.3
560	G	24.8	Very low	27.8	Very low	65 Å²	65	147.9 Å²	147.9	67%	0.67	78%	0.779	S	S	*	*			trans	77.5	99.3	132	0	0	0	0	0	123.4
561	G	23.5	Very low	28	Very low	70 Å²	70	146.2 Å²	146.2	72%	0.722	77%	0.769	S	S	*	*				114	92.7	121.1	0	0	0	0	0	123.1
562	T	23.8	Very low	28.4	Very low	138 Å²	138	142.4 Å²	142.4	85%	0.847	77%	0.765	S	S	*	*			trans	71.3	142.2	132.9	-17.6	0	0	0	0	122.9
563	V	25.1	Very low	28.2	Very low	126 Å²	126	142.9 Å²	142.9	76%	0.764	76%	0.764	S	S	*	*			trans	93.4	144	157.8	-167	0	0	0	0	118.2
564	S	28	Very low	28.3	Very low	102 Å²	102	139.6 Å²	139.6	71%	0.713	77%	0.768	S	S	*	*			trans	64.9	112.3	165.1	38.4	0	0	0	0	119.2
565	Q	32.3	Very low	28.3	Very low	194 Å²	194	144.9 Å²	144.9	91%	0.907	78%	0.784	S	S	*	*			trans	-77.2	131.1	148.6	-61.1	165.4	-87.1	0	0	108.4
566	E	28.3	Very low	28.6	Very low	187 Å²	187	147.5 Å²	147.5	87%	0.874	79%	0.791	S	S	*	*			trans	-126.7	132.1	155.5	-69.2	-166.5	142	0	0	107.5
567	E	30.5	Very low	28.7	Very low	188 Å²	188	150.3 Å²	150.3	88%	0.879	79%	0.794	S	S	*	*			trans	-85.6	119.6	176.2	-64.9	-171.9	142.6	0	0	109.5	D569	E567-D569 PolarHBondContact O-N 2.6Å; E567-D569 VanDerWaalsContact O-N 3.09Å
568	E	27.7	Very low	28.6	Very low	148 Å²	148	151 Å²	151	69%	0.692	80%	0.797	S	S	*	*			trans	-77.6	94.7	173.6	-169.7	-177.7	-119	0	0	110	R570	E568-R570 VanDerWaalsContact C-N 3.29Å; E568-R570 HydrophobicContact CG-CG 4.32Å; E568-R570 PolarHBondContact O-N 3.32Å; E568-R570 IonicContact OE2-CZ 2.76Å; E568-R570 IonicContact OE2-NE 3.42Å; E568-R570 PolarHBondContact OE2-NE 3.49Å; E568-R570 IonicContact OE2-NH2 2.68Å; E568-R570 PolarHBondContact OE2-NH2 3.5Å
569	D	28.3	Very low	28.9	Very low	118 Å²	118	148.4 Å²	148.4	63%	0.631	79%	0.788	S	S	*	*			trans	-65.2	78.3	178.9	-173.1	9.7	0	0	0	111.7	E567 K571	E567-D569 PolarHBondContact O-N 2.6Å; E567-D569 VanDerWaalsContact O-N 3.09Å; D569-K571 VanDerWaalsContact C-N 3.27Å; D569-K571 PolarHBondContact O-N 2.86Å; D569-K571 IonicContact OD1-NZ 3.15Å; D569-K571 PolarHBondContact OD1-NZ 2.67Å; D569-K571 IonicContact OD2-NZ 2.87Å; D569-K571 PolarHBondContact OD2-NZ 2.65Å
570	R	29.3	Very low	29.1	Very low	209 Å²	209	148.4 Å²	148.4	79%	0.789	79%	0.787	S	S	*	*			trans	-70.4	74.4	178.2	-73.5	-170.1	175.6	-164.8	-1.6	112.6	E568	E568-R570 VanDerWaalsContact C-N 3.29Å; E568-R570 HydrophobicContact CG-CG 4.32Å; E568-R570 PolarHBondContact O-N 3.32Å; E568-R570 IonicContact OE2-CZ 2.76Å; E568-R570 IonicContact OE2-NE 3.42Å; E568-R570 PolarHBondContact OE2-NE 3.49Å; E568-R570 IonicContact OE2-NH2 2.68Å; E568-R570 PolarHBondContact OE2-NH2 3.5Å
571	K	30.6	Very low	29.4	Very low	150 Å²	150	152.4 Å²	152.4	65%	0.652	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-70.9	134.9	165.3	-75.7	-176.5	174.5	66.2	0	110.9	D569	D569-K571 VanDerWaalsContact C-N 3.27Å; D569-K571 PolarHBondContact O-N 2.86Å; D569-K571 IonicContact OD1-NZ 3.15Å; D569-K571 PolarHBondContact OD1-NZ 2.67Å; D569-K571 IonicContact OD2-NZ 2.87Å; D569-K571 PolarHBondContact OD2-NZ 2.65Å
572	P	33.6	Very low	29.9	Very low	121 Å²	121	160.6 Å²	160.6	79%	0.786	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-71.3	153.5	-178.8	30.1	-35.5	0	0	0	111.8
573	K	27.6	Very low	30.4	Very low	199 Å²	199	159.3 Å²	159.3	87%	0.865	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-71.5	149.7	158.6	-87.2	-177.1	173.4	179.7	0	109.3
574	A	29.5	Very low	31	Very low	97 Å²	97	159.2 Å²	159.2	80%	0.802	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-69.7	131	165.6	0	0	0	0	0	110
575	E	29.6	Very low	31.3	Very low	191 Å²	191	166.2 Å²	166.2	89%	0.893	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-98.6	143.4	153	-65.6	-179.2	142.3	0	0	106.5
576	E	31.9	Very low	31.4	Very low	192 Å²	192	164.8 Å²	164.8	90%	0.897	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-87.4	149.1	-175.2	-64.7	-178.1	132.1	0	0	111.2	E578	E576-E578 PolarHBondContact O-N 2.78Å
577	D	30.1	Very low	31.9	Very low	149 Å²	149	167.1 Å²	167.1	80%	0.797	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-66.9	122.8	-166.6	-63.4	-85.2	0	0	0	114.9	I579	D577-I579 HydrophobicContact CB-CD1 4.35Å; D577-I579 HydrophobicContact CB-CG1 4.24Å
578	E	29.9	Very low	32.6	Very low	188 Å²	188	167.8 Å²	167.8	88%	0.879	81%	0.811	S	S	*	*			trans	-111	82.6	159.5	-162.4	170.5	-124.5	0	0	111.1	E576 L580	E576-E578 PolarHBondContact O-N 2.78Å; E578-L580 PolarHBondContact O-N 3.13Å
579	I	35	Very low	33.4	Very low	125 Å²	125	167 Å²	167	64%	0.641	82%	0.818	S	S	*	*			trans	-78.3	109.8	-178.5	-65.7	168.8	0	0	0	110.5	D577 N581	D577-I579 HydrophobicContact CB-CD1 4.35Å; D577-I579 HydrophobicContact CB-CG1 4.24Å; I579-N581 PolarHBondContact O-N 3.03Å
580	L	32.6	Very low	34.1	Very low	159 Å²	159	171.9 Å²	171.9	83%	0.832	83%	0.828	S	S	*	*			trans	-61.9	96	172	-74.5	169.8	0	0	0	112	E578 R582	E578-L580 PolarHBondContact O-N 3.13Å; L580-R582 PolarHBondContact O-N 3.21Å
581	N	31.4	Very low	34.7	Very low	149 Å²	149	173.2 Å²	173.2	80%	0.797	83%	0.833	S	S	*	*			trans	-64.5	97.8	177.2	-89.2	-52.1	0	0	0	112.4	I579 S583	I579-N581 PolarHBondContact O-N 3.03Å; N581-S583 PolarHBondContact O-N 3.4Å
582	R	33.5	Very low	35.2	Very low	243 Å²	243	177.4 Å²	177.4	92%	0.917	86%	0.855	S	S	*	*			trans	-76.9	106.2	167.7	-77.5	-176.8	168.8	177.8	-1.9	110.9	L580	L580-R582 PolarHBondContact O-N 3.21Å
583	S	34.8	Very low	35.3	Very low	111 Å²	111	180.2 Å²	180.2	78%	0.776	86%	0.858	S	S	*	*			trans	-55.3	126.7	-175.7	-57.1	0	0	0	0	114.7	N581	N581-S583 PolarHBondContact O-N 3.4Å
584	P	36.3	Very low	35.7	Very low	123 Å²	123	179.2 Å²	179.2	80%	0.799	86%	0.858	S	S	*	*			trans	-78.3	123.4	176.7	29.7	-33.2	0	0	0	112.3	N586	P584-N586 PolarHBondContact O-N 2.87Å; P584-N586 VanDerWaalsContact O-N 3.07Å
585	R	34.2	Very low	36.1	Very low	249 Å²	249	183.8 Å²	183.8	94%	0.94	86%	0.861	S	S	*	*			trans	-65.4	105.4	175.6	-90.2	-179	166.1	165.5	-3.4	112	R587	R585-R587 PolarHBondContact O-N 3.35Å
586	N	35	Very low	36.4	Very low	165 Å²	165	183.4 Å²	183.4	88%	0.882	86%	0.859	S	S	*	*			trans	-75.1	105	-176.9	-141.6	-19.2	0	0	0	112	P584	P584-N586 PolarHBondContact O-N 2.87Å; P584-N586 VanDerWaalsContact O-N 3.07Å
587	R	37.9	Very low	36.7	Very low	236 Å²	236	182.8 Å²	182.8	89%	0.891	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-82.2	119.1	174.6	-85.7	-177.5	167.9	172.2	-2.5	110.5	R585	R585-R587 PolarHBondContact O-N 3.35Å
588	K	46	Very low	37.2	Very low	202 Å²	202	185.1 Å²	185.1	88%	0.878	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-61.4	135.1	176.5	-70.5	-178.4	177.7	176.7	0	111.9
589	P	45.2	Very low	37.7	Very low	130 Å²	130	184.9 Å²	184.9	84%	0.844	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-73.5	138.1	167	31.2	-33.4	0	0	0	110.3
590	R	41.5	Very low	37.9	Very low	222 Å²	222	189.5 Å²	189.5	84%	0.838	88%	0.877	S	S	*	*	P	Polyproline II helix	trans	-94.4	132.7	170.9	-178	175.2	175	156.1	0.3	109.7	E592	R590-E592 PolarHBondContact NE-O 2.67Å; R590-E592 PolarHBondContact NH2-O 3.04Å
591	R	43.3	Very low	38.3	Very low	236 Å²	236	192 Å²	192	89%	0.891	88%	0.88	S	S	*	*			trans	-110.3	145.8	159.3	-85.8	-174.5	169.4	-180	-2.6	108.3
592	E	41.1	Very low	39	Very low	238 Å²	238	195.9 Å²	195.9	100%	1.112	89%	0.888	S	S	*	*			trans	67.2	0	-176.9	-56.8	-179.2	-165.2	0	0	115.4	R590	R590-E592 PolarHBondContact NE-O 2.67Å; R590-E592 PolarHBondContact NH2-O 3.04Å

Retrieved 592 of 592 residues in 786.1 ms (Link to these results)

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