A0A3B3UA31_9TELE Loading...

MAGUK p55 scaffold protein 2a

AlphaFold DB , UniProt , Accession A0A3B3UA31, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 553 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	30.5	Very low	225 Å²	225	130.9 Å²	130.9	100%	1.108	77%	0.769	S	S	*	*				0	141.5	0	-69.9	-173.6	176.1	0	0	107.6
2	P	39.3	Very low	30.9	Very low	120 Å²	120	128.8 Å²	128.8	78%	0.779	76%	0.762	S	S	*	*			cis	-55.9	152.8	6	-22.8	35.9	0	0	0	113.3
3	V	30.1	Very low	30.5	Very low	119 Å²	119	132.2 Å²	132.2	72%	0.721	77%	0.766	S	S	*	*				67.9	107.6	57.8	-178.3	0	0	0	0	109.8
4	A	28.6	Very low	30.2	Very low	87 Å²	87	131.6 Å²	131.6	72%	0.719	77%	0.765	S	S	*	*			cis	76	144.7	45.6	0	0	0	0	0	112.8
5	S	29.1	Very low	30	Very low	113 Å²	113	133 Å²	133	79%	0.79	77%	0.767	S	S	*	*			cis	-133.6	-163.6	-6.1	-65.9	0	0	0	0	107.6
6	T	28.4	Very low	29.7	Very low	123 Å²	123	134.4 Å²	134.4	76%	0.755	77%	0.771	S	S	*	*			cis	-143.6	172.2	8.2	50.8	0	0	0	0	108
7	R	27	Very low	29.5	Very low	200 Å²	200	130.8 Å²	130.8	76%	0.755	76%	0.761	S	S	*	*			cis	79	93.6	1	-151.8	-166.3	-143.8	-124.7	13.9	121	E9	R7-E9 IonicContact CZ-OE1 2.85Å; R7-E9 IonicContact NE-OE1 2.71Å; R7-E9 IonicContact NH1-OE1 3.83Å; R7-E9 PolarHBondContact NH1-OE1 3.23Å
8	T	28.4	Very low	29.5	Very low	127 Å²	127	133.7 Å²	133.7	78%	0.779	77%	0.769	S	S	*	*			trans	-159	125.5	140.8	23.2	0	0	0	0	106.7
9	E	27.7	Very low	29.3	Very low	126 Å²	126	133.3 Å²	133.3	59%	0.589	78%	0.775	S	S	*	*			cis	87.6	155.7	47.3	-76.1	179.6	-152.4	0	0	114	R7	R7-E9 IonicContact CZ-OE1 2.85Å; R7-E9 IonicContact NE-OE1 2.71Å; R7-E9 IonicContact NH1-OE1 3.83Å; R7-E9 PolarHBondContact NH1-OE1 3.23Å
10	P	37.2	Very low	29.1	Very low	106 Å²	106	134.5 Å²	134.5	69%	0.688	78%	0.778	S	S	*	*			cis	-139.2	151.4	-13.6	30.1	-9.2	0	0	0	117.5
11	A	25.7	Very low	29	Very low	94 Å²	94	133 Å²	133	78%	0.777	78%	0.776	S	S	*	*				53.4	-178.8	127.9	0	0	0	0	0	121.3
12	P	34.6	Very low	28.8	Very low	105 Å²	105	128.5 Å²	128.5	68%	0.682	76%	0.761	S	S	*	*			cis	-137.9	171.3	-4.7	42.2	-24.1	0	0	0	118.6
13	Q	26	Very low	28.2	Very low	174 Å²	174	129.4 Å²	129.4	81%	0.813	76%	0.764	S	S	*	*			trans	77.9	122.7	140.5	-81.9	169.4	-1.8	0	0	125.2
14	V	26.6	Very low	28	Very low	124 Å²	124	129 Å²	129	75%	0.752	77%	0.767	S	S	*	*				92.3	126.1	129.3	173.9	0	0	0	0	122
15	L	27.7	Very low	28.1	Very low	152 Å²	152	130 Å²	130	80%	0.796	77%	0.769	S	S	*	*			trans	-6.1	153.2	146.9	-46.5	171	0	0	0	117.4
16	D	25.1	Very low	28.2	Very low	155 Å²	155	130.5 Å²	130.5	83%	0.829	77%	0.767	S	S	*	*				-162.5	-159.5	50.6	-152.2	-10.9	0	0	0	114.9
17	A	25.6	Very low	28.7	Very low	74 Å²	74	132.1 Å²	132.1	61%	0.612	77%	0.769	S	S	*	*			trans	-70.3	155	-158.1	0	0	0	0	0	121.3
18	M	29.8	Very low	29.1	Very low	182 Å²	182	125 Å²	125	90%	0.897	75%	0.753	S	S	*	*			trans	32.1	117.6	138.4	-60.3	-69.8	-162.6	0	0	120.8
19	S	26.5	Very low	30	Very low	126 Å²	126	124.2 Å²	124.2	88%	0.881	75%	0.745	S	S	*	*			trans	-162.4	153.1	134.7	-11.4	0	0	0	0	111.9
20	D	25.4	Very low	30.8	Very low	158 Å²	158	124.4 Å²	124.4	85%	0.845	75%	0.75	S	S	*	*			trans	-77.5	143.5	176.2	-64.6	-73.5	0	0	0	113.4
21	S	25.3	Very low	31.1	Very low	104 Å²	104	125.9 Å²	125.9	73%	0.727	75%	0.751	S	S	*	*				164.7	137.4	115.6	-73	0	0	0	0	114
22	T	30	Very low	31.9	Very low	129 Å²	129	124.7 Å²	124.7	79%	0.791	73%	0.732	S	S	*	*			trans	25.7	100.8	149.8	58.4	0	0	0	0	120
23	T	26.8	Very low	32.3	Very low	139 Å²	139	124.3 Å²	124.3	85%	0.853	72%	0.723	S	S	*	*				-173	111.9	116	29.7	0	0	0	0	109.5
24	S	27.8	Very low	33.2	Very low	111 Å²	111	121.7 Å²	121.7	78%	0.776	71%	0.714	S	S	*	*			trans	-102.5	87.3	169.8	-165.6	0	0	0	0	109.5	T26	S24-T26 VanDerWaalsContact C-N 3.3Å; S24-T26 PolarHBondContact O-N 3.14Å
25	S	29	Very low	33.9	Very low	109 Å²	109	123.6 Å²	123.6	76%	0.762	71%	0.708	S	S	*	*			trans	-83.6	75.6	170.4	57.4	0	0	0	0	109.5	I27	S25-I27 PolarHBondContact O-N 2.99Å
26	T	32.8	Very low	34.4	Very low	122 Å²	122	120.6 Å²	120.6	75%	0.748	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-66.7	118.2	175.5	-40.6	0	0	0	0	109.2	S24 A28	S24-T26 VanDerWaalsContact C-N 3.3Å; S24-T26 PolarHBondContact O-N 3.14Å; T26-A28 PolarHBondContact O-N 2.94Å
27	I	38.1	Very low	35.1	Very low	157 Å²	157	118.6 Å²	118.6	81%	0.805	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-65.3	119.1	176.5	-61.4	171.3	0	0	0	107.8	S25	S25-I27 PolarHBondContact O-N 2.99Å
28	A	34.5	Very low	35.7	Very low	50 Å²	50	117 Å²	117	41%	0.413	67%	0.668	S	S	.	*	P	Polyproline II helix	trans	-66	147.3	174.2	0	0	0	0	0	110.3	T26 D32	T26-A28 PolarHBondContact O-N 2.94Å; A28-D32 HydrophobicContact CB-CB 4.37Å
29	N	47.9	Very low	36.1	Very low	112 Å²	112	113 Å²	113	60%	0.599	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-72.9	152.2	178.1	-52.1	-84.9	0	0	0	109.6	L31 D32 L33	N29-L31 PolarHBondContact O-N 2.97Å; N29-D32 WeakPolarHBondContact CB-OD2 3.5Å; N29-D32 PolarHBondContact N-OD2 3.26Å; N29-D32 VanDerWaalsContact N-OD2 3.08Å; N29-D32 PolarHBondContact ND2-OD2 3.03Å; N29-D32 WeakPolarHBondContact O-CA 3.31Å; N29-D32 WeakPolarHBondContact O-CB 3.25Å; N29-D32 PolarHBondContact O-N 2.9Å; N29-L33 PolarHBondContact O-N 3.49Å
30	D	44.6	Very low	36.5	Very low	130 Å²	130	114.5 Å²	114.5	70%	0.695	64%	0.644	S	S	*	*	H	α-helix	trans	-56.6	-26.3	178.1	-69	-56	0	0	0	113.1	L33 I34	D30-L33 PolarHBondContact O-N 3.2Å; D30-I34 WeakPolarHBondContact O-CD1 3.49Å; D30-I34 VanDerWaalsContact O-CG1 3.27Å; D30-I34 WeakPolarHBondContact O-CG1 3.42Å; D30-I34 PolarHBondContact O-N 3.48Å
31	L	44.4	Very low	37.2	Very low	136 Å²	136	113.2 Å²	113.2	71%	0.712	63%	0.632	S	S	*	*	H	α-helix	trans	-67.1	-37.4	174.4	-156.9	74.6	0	0	0	112.6	N29 I34 Y35	N29-L31 PolarHBondContact O-N 2.97Å; L31-I34 PolarHBondContact O-N 3.27Å; L31-Y35 WeakPolarHBondContact O-CB 3.46Å; L31-Y35 PolarHBondContact O-N 3.01Å
32	D	41.3	Very low	37.5	Very low	70 Å²	70	112 Å²	112	37%	0.374	62%	0.624	S	S	.	*	H	α-helix	trans	-71.8	-36	177.5	-53.5	-49	0	0	0	110.4	A28 N29 Y35 L36	A28-D32 HydrophobicContact CB-CB 4.37Å; N29-D32 WeakPolarHBondContact CB-OD2 3.5Å; N29-D32 PolarHBondContact N-OD2 3.26Å; N29-D32 VanDerWaalsContact N-OD2 3.08Å; N29-D32 PolarHBondContact ND2-OD2 3.03Å; N29-D32 WeakPolarHBondContact O-CA 3.31Å; N29-D32 WeakPolarHBondContact O-CB 3.25Å; N29-D32 PolarHBondContact O-N 2.9Å; D32-Y35 PolarHBondContact O-N 2.82Å; D32-L36 WeakPolarHBondContact O-CB 3.36Å; D32-L36 WeakPolarHBondContact O-CG 3.34Å; D32-L36 PolarHBondContact O-N 3.01Å
33	L	43	Very low	37.6	Very low	97 Å²	97	111.3 Å²	111.3	51%	0.508	62%	0.622	S	S	.	*	H	α-helix	trans	-65.6	-41.2	172.3	-88.8	155.4	0	0	0	112.5	N29 D30 Y35 K37	N29-L33 PolarHBondContact O-N 3.49Å; D30-L33 PolarHBondContact O-N 3.2Å; L33-Y35 VanDerWaalsContact C-N 3.34Å; L33-K37 VanDerWaalsContact O-CB 3.26Å; L33-K37 WeakPolarHBondContact O-CB 3.37Å; L33-K37 PolarHBondContact O-N 3.43Å
34	I	45.4	Very low	38	Very low	119 Å²	119	113.3 Å²	113.3	61%	0.61	63%	0.626	S	S	*	*	H	α-helix	trans	-63.2	-42.2	173.4	-70.8	160.4	0	0	0	110.8	D30 L31 K37 G38	D30-I34 WeakPolarHBondContact O-CD1 3.49Å; D30-I34 VanDerWaalsContact O-CG1 3.27Å; D30-I34 WeakPolarHBondContact O-CG1 3.42Å; D30-I34 PolarHBondContact O-N 3.48Å; L31-I34 PolarHBondContact O-N 3.27Å; I34-K37 PolarHBondContact O-N 2.96Å; I34-G38 PolarHBondContact O-N 3.5Å; I34-G38 VanDerWaalsContact O-N 3.08Å
35	Y	41.3	Very low	38.2	Very low	163 Å²	163	116.4 Å²	116.4	64%	0.639	63%	0.628	S	S	*	*	H	α-helix	trans	-63.8	-48.7	177.2	-178.8	-107.9	0	0	0	112.4	L31 D32 L33 K37 G38 I39	L31-Y35 WeakPolarHBondContact O-CB 3.46Å; L31-Y35 PolarHBondContact O-N 3.01Å; D32-Y35 PolarHBondContact O-N 2.82Å; L33-Y35 VanDerWaalsContact C-N 3.34Å; Y35-K37 VanDerWaalsContact C-N 3.33Å; Y35-K37 PolarHBondContact O-N 3.45Å; Y35-G38 PolarHBondContact O-N 3.04Å; Y35-I39 HydrophobicContact CD1-CD1 3.96Å; Y35-I39 HydrophobicContact CE1-CD1 3.53Å; Y35-I39 HydrophobicContact CE2-CD1 4.46Å; Y35-I39 PolarHBondContact O-N 2.8Å; Y35-I39 VanDerWaalsContact O-N 3.15Å
36	L	38.3	Very low	38.4	Very low	89 Å²	89	120.2 Å²	120.2	47%	0.466	63%	0.634	S	S	.	*	H	α-helix	trans	-62.2	-38.1	176.3	-76.7	165.2	0	0	0	112.4	D32 I39 M40	D32-L36 WeakPolarHBondContact O-CB 3.36Å; D32-L36 WeakPolarHBondContact O-CG 3.34Å; D32-L36 PolarHBondContact O-N 3.01Å; L36-I39 PolarHBondContact O-N 2.93Å; L36-M40 WeakPolarHBondContact O-CG 3.44Å; L36-M40 PolarHBondContact O-N 3.22Å
37	K	39.3	Very low	38.3	Very low	114 Å²	114	123.9 Å²	123.9	50%	0.496	64%	0.643	S	S	.	*	H	α-helix	trans	-65.1	-38.5	176.3	-166.3	169	-170.2	-70.2	0	112.1	L33 I34 Y35 I39 M40 E41	L33-K37 VanDerWaalsContact O-CB 3.26Å; L33-K37 WeakPolarHBondContact O-CB 3.37Å; L33-K37 PolarHBondContact O-N 3.43Å; I34-K37 PolarHBondContact O-N 2.96Å; Y35-K37 VanDerWaalsContact C-N 3.33Å; Y35-K37 PolarHBondContact O-N 3.45Å; K37-I39 VanDerWaalsContact C-N 3.32Å; K37-I39 PolarHBondContact O-N 3.02Å; K37-M40 PolarHBondContact O-N 2.83Å; K37-E41 WeakPolarHBondContact CE-OE1 3.26Å; K37-E41 HydrophobicContact CG-CG 4.34Å; K37-E41 WeakPolarHBondContact CG-OE2 3.22Å; K37-E41 IonicContact NZ-OE1 3.89Å; K37-E41 PolarHBondContact NZ-OE1 2.93Å; K37-E41 IonicContact NZ-OE2 2.66Å; K37-E41 PolarHBondContact NZ-OE2 3.47Å; K37-E41 WeakPolarHBondContact O-CB 3.42Å; K37-E41 PolarHBondContact O-N 3.02Å
38	G	39.4	Very low	38.1	Very low	41 Å²	41	122.9 Å²	122.9	42%	0.423	64%	0.635	S	S	.	*	H	α-helix	trans	-63.4	-33.5	172.3	0	0	0	0	0	113.9	I34 Y35 S42	I34-G38 PolarHBondContact O-N 3.5Å; I34-G38 VanDerWaalsContact O-N 3.08Å; Y35-G38 PolarHBondContact O-N 3.04Å; G38-S42 PolarHBondContact O-OG 2.75Å
39	I	37.9	Very low	37.9	Very low	96 Å²	96	125 Å²	125	49%	0.492	65%	0.646	S	S	.	*	H	α-helix	trans	-71.8	-38.6	173.8	-68	169.3	0	0	0	111.2	Y35 L36 K37	Y35-I39 HydrophobicContact CD1-CD1 3.96Å; Y35-I39 HydrophobicContact CE1-CD1 3.53Å; Y35-I39 HydrophobicContact CE2-CD1 4.46Å; Y35-I39 PolarHBondContact O-N 2.8Å; Y35-I39 VanDerWaalsContact O-N 3.15Å; L36-I39 PolarHBondContact O-N 2.93Å; K37-I39 VanDerWaalsContact C-N 3.32Å; K37-I39 PolarHBondContact O-N 3.02Å
40	M	34.5	Very low	37.2	Very low	159 Å²	159	125.8 Å²	125.8	78%	0.783	66%	0.658	S	S	*	*	H	α-helix	trans	-82.4	-20.2	-176.5	-70.1	-177.2	67.6	0	0	115.1	L36 K37	L36-M40 WeakPolarHBondContact O-CG 3.44Å; L36-M40 PolarHBondContact O-N 3.22Å; K37-M40 PolarHBondContact O-N 2.83Å
41	E	39.5	Very low	36.8	Very low	130 Å²	130	125.7 Å²	125.7	61%	0.607	65%	0.651	S	S	*	*	S	Bend	trans	-100.4	1.5	-179.5	-67.8	-177.7	152.2	0	0	114	K37	K37-E41 WeakPolarHBondContact CE-OE1 3.26Å; K37-E41 HydrophobicContact CG-CG 4.34Å; K37-E41 WeakPolarHBondContact CG-OE2 3.22Å; K37-E41 IonicContact NZ-OE1 3.89Å; K37-E41 PolarHBondContact NZ-OE1 2.93Å; K37-E41 IonicContact NZ-OE2 2.66Å; K37-E41 PolarHBondContact NZ-OE2 3.47Å; K37-E41 WeakPolarHBondContact O-CB 3.42Å; K37-E41 PolarHBondContact O-N 3.02Å
42	S	31.5	Very low	36.5	Very low	80 Å²	80	127.4 Å²	127.4	56%	0.559	66%	0.656	S	S	*	*	S	Bend	trans	-84.8	127.7	172.5	-63.6	0	0	0	0	110.9	G38	G38-S42 PolarHBondContact O-OG 2.75Å
43	P	32.7	Very low	36.5	Very low	113 Å²	113	129.5 Å²	129.5	73%	0.734	67%	0.673	S	S	*	*			trans	-61	143.6	173.8	-23.5	34.4	0	0	0	112.5	E45	P43-E45 VanDerWaalsContact C-N 3.26Å; P43-E45 PolarHBondContact O-N 3.36Å
44	L	34.6	Very low	36.7	Very low	181 Å²	181	135.7 Å²	135.7	95%	0.948	69%	0.69	S	S	*	*			trans	-76.8	74.4	172.4	-72.5	169.6	0	0	0	110.8
45	E	32.5	Very low	37.4	Very low	176 Å²	176	138.1 Å²	138.1	82%	0.822	70%	0.703	S	S	*	*			trans	-77.1	135.8	160	-65.8	-168.2	165.3	0	0	109.2	P43 E47	P43-E45 VanDerWaalsContact C-N 3.26Å; P43-E45 PolarHBondContact O-N 3.36Å; E45-E47 PolarHBondContact O-N 3.3Å
46	Q	33.5	Very low	38.4	Very low	189 Å²	189	135.1 Å²	135.1	88%	0.883	71%	0.706	S	S	*	*			trans	-75.2	113	-179.4	-63.2	173.5	-93.6	0	0	108.8	E48	Q46-E48 PolarHBondContact O-N 3.19Å
47	E	31.4	Very low	40	Very low	200 Å²	200	133 Å²	133	94%	0.935	70%	0.697	S	S	*	*			trans	-63.4	100.8	170.7	-71.7	-164.8	147.7	0	0	109.6	E45	E45-E47 PolarHBondContact O-N 3.3Å
48	E	33.1	Very low	41.8	Very low	135 Å²	135	134.4 Å²	134.4	63%	0.631	72%	0.716	S	S	*	*			trans	-57.6	149	161.5	-70.1	-173	110.3	0	0	109.7	Q46 K51	Q46-E48 PolarHBondContact O-N 3.19Å; E48-K51 WeakPolarHBondContact OE1-CE 3.29Å; E48-K51 IonicContact OE1-NZ 3.62Å; E48-K51 PolarHBondContact OE1-NZ 2.79Å; E48-K51 WeakPolarHBondContact OE2-CE 3.47Å; E48-K51 IonicContact OE2-NZ 3.59Å; E48-K51 PolarHBondContact OE2-NZ 3.01Å
49	S	29.4	Very low	43.6	Very low	94 Å²	94	138.8 Å²	138.8	66%	0.657	72%	0.719	S	S	*	*			trans	-51	145.8	170.2	50.1	0	0	0	0	111.1	K51	S49-K51 PolarHBondContact O-N 2.75Å
50	P	34.5	Very low	45.7	Very low	130 Å²	130	139.8 Å²	139.8	84%	0.844	72%	0.722	S	S	*	*			trans	-61.8	99.9	-176.9	25.3	-34.7	0	0	0	110.2	E52	P50-E52 PolarHBondContact O-N 2.95Å
51	K	34.7	Very low	48.2	Very low	127 Å²	127	135.3 Å²	135.3	55%	0.552	70%	0.701	S	S	*	*			trans	-60.3	125.3	-179.5	-77.4	171.6	176.8	164.8	0	109.5	E48 S49	E48-K51 WeakPolarHBondContact OE1-CE 3.29Å; E48-K51 IonicContact OE1-NZ 3.62Å; E48-K51 PolarHBondContact OE1-NZ 2.79Å; E48-K51 WeakPolarHBondContact OE2-CE 3.47Å; E48-K51 IonicContact OE2-NZ 3.59Å; E48-K51 PolarHBondContact OE2-NZ 3.01Å; S49-K51 PolarHBondContact O-N 2.75Å
52	E	39.8	Very low	50.5	Low	172 Å²	172	130.7 Å²	130.7	80%	0.804	68%	0.681	S	S	*	*			trans	-54.6	147.8	170.5	-62.9	-178.5	133.9	0	0	109.8	P50 R54	P50-E52 PolarHBondContact O-N 2.95Å; E52-R54 PolarHBondContact O-N 3.48Å
53	P	41.2	Very low	53.3	Low	114 Å²	114	128.5 Å²	128.5	74%	0.74	66%	0.664	S	S	*	*			trans	-62.3	106.4	179.2	26.5	-33.9	0	0	0	109.1	L55	P53-L55 PolarHBondContact O-N 3.06Å
54	R	46.7	Very low	55.9	Low	227 Å²	227	128.8 Å²	128.8	86%	0.857	66%	0.655	S	S	*	*			trans	-54.8	106	178.8	-78.6	-175.6	168.7	-172	-6.1	109.6	E52 S56	E52-R54 PolarHBondContact O-N 3.48Å; R54-S56 PolarHBondContact O-N 2.97Å
55	L	58.8	Low	58.5	Low	170 Å²	170	122.7 Å²	122.7	89%	0.89	62%	0.623	S	S	*	*			trans	-68	115.3	172.9	-61.9	176.5	0	0	0	107.9	P53	P53-L55 PolarHBondContact O-N 3.06Å
56	S	63.7	Low	61.3	Low	100 Å²	100	114.9 Å²	114.9	70%	0.699	59%	0.587	S	S	*	*			trans	-94.8	140.8	170.2	54.3	0	0	0	0	109.7	R54	R54-S56 PolarHBondContact O-N 2.97Å
57	P	72.2	Confident	63.9	Low	44 Å²	44	111.3 Å²	111.3	29%	0.286	57%	0.57	S	S	.	*			trans	-61.2	152.6	171.5	29.8	-36.4	0	0	0	110.7	E60 A106	P57-E60 HydrophobicContact CG-CG 4.13Å; P57-A106 HydrophobicContact CB-CB 3.49Å; P57-A106 VanDerWaalsContact CB-CB 3.49Å; P57-A106 HydrophobicContact CG-CB 3.86Å
58	V	76.6	Confident	66.8	Low	145 Å²	145	106.9 Å²	106.9	88%	0.879	55%	0.55	S	S	*	.	S	Bend	trans	-82.2	-28.5	179.3	-179.5	0	0	0	0	111.3
59	R	77	Confident	69.4	Low	133 Å²	133	103.8 Å²	103.8	50%	0.502	54%	0.537	S	S	.	.			trans	-154.1	167.9	172.1	-71.3	-165.6	174.4	-167.9	-3.2	109.1	H102	R59-H102 PolarHBondContact O-CE1 3.16Å; R59-H102 VanDerWaalsContact O-CE1 3.27Å
60	E	82	Confident	72.3	Confident	116 Å²	116	101 Å²	101	54%	0.542	51%	0.514	S	S	.	.	S	Bend	trans	-124	5.6	-179.8	-70.9	157	-144.8	0	0	112.5	P57 D103 A106	P57-E60 HydrophobicContact CG-CG 4.13Å; E60-D103 WeakPolarHBondContact O-CB 3.12Å; E60-A106 HydrophobicContact CB-CB 4.32Å; E60-A106 HydrophobicContact CG-CB 3.76Å
61	N	86.6	Confident	75	Confident	65 Å²	65	102.2 Å²	102.2	35%	0.348	50%	0.502	S	S	.	.			trans	-140.7	42.1	-170.9	74.7	-32.8	0	0	0	114.2	V63 E64 L65 D103	N61-V63 PolarHBondContact O-N 3.37Å; N61-E64 HydrophobicContact CB-CB 4.35Å; N61-E64 HydrophobicContact CB-CG 4.19Å; N61-E64 WeakPolarHBondContact CB-OE2 3.48Å; N61-E64 PolarHBondContact ND2-OE2 2.76Å; N61-E64 PolarHBondContact O-N 3.34Å; N61-L65 PolarHBondContact O-N 2.71Å; N61-D103 VanDerWaalsContact C-OD2 3.25Å; N61-D103 WeakPolarHBondContact CA-OD2 3.44Å
62	N	88.6	Confident	77.6	Confident	34 Å²	34	101.9 Å²	101.9	18%	0.182	51%	0.506	C	S	.	.	H	α-helix	trans	-64.1	-26.2	175	-67.7	-30.3	0	0	0	113.3	L65 L66 L99 H102 D103	N62-L65 PolarHBondContact O-N 3.12Å; N62-L66 WeakPolarHBondContact O-CB 3.32Å; N62-L66 PolarHBondContact O-N 2.92Å; N62-L99 HydrophobicContact CB-CD2 4.01Å; N62-H102 PolarHBondContact ND2-CE1 3.05Å; N62-H102 PolarHBondContact ND2-ND1 3.37Å; N62-H102 VanDerWaalsContact ND2-ND1 3.11Å; N62-D103 WeakPolarHBondContact CA-OD2 3.31Å; N62-D103 VanDerWaalsContact N-CG 3.3Å; N62-D103 PolarHBondContact N-OD1 3.26Å; N62-D103 VanDerWaalsContact N-OD1 3.11Å; N62-D103 PolarHBondContact N-OD2 2.99Å
63	V	89	Confident	79.8	Confident	33 Å²	33	95 Å²	95	20%	0.2	48%	0.475	C	S	.	.	H	α-helix	trans	-67.2	-39.8	174	176.7	0	0	0	0	111.6	N61 L66 Q67 L99 E100 D103	N61-V63 PolarHBondContact O-N 3.37Å; V63-L66 WeakPolarHBondContact O-CB 3.45Å; V63-L66 PolarHBondContact O-N 2.76Å; V63-Q67 WeakPolarHBondContact O-CG 3.35Å; V63-Q67 PolarHBondContact O-N 3.15Å; V63-L99 HydrophobicContact CG2-CB 4Å; V63-E100 HydrophobicContact CG2-CB 4.39Å; V63-E100 HydrophobicContact CG2-CG 3.75Å; V63-D103 WeakPolarHBondContact CG2-OD2 3.49Å; V63-D103 PolarHBondContact N-OD2 2.87Å
64	E	87.8	Confident	82	Confident	119 Å²	119	94.6 Å²	94.6	56%	0.556	47%	0.466	S	S	*	.	H	α-helix	trans	-64.2	-45.9	173.4	-61.8	-172.8	140.4	0	0	110.7	N61 L66 Q67 E68	N61-E64 HydrophobicContact CB-CB 4.35Å; N61-E64 HydrophobicContact CB-CG 4.19Å; N61-E64 WeakPolarHBondContact CB-OE2 3.48Å; N61-E64 PolarHBondContact ND2-OE2 2.76Å; N61-E64 PolarHBondContact O-N 3.34Å; E64-L66 VanDerWaalsContact C-N 3.27Å; E64-L66 PolarHBondContact O-N 3.24Å; E64-Q67 CarbonylContact O-C 3.59Å; E64-Q67 WeakPolarHBondContact O-CA 3.43Å; E64-Q67 WeakPolarHBondContact O-CB 3.34Å; E64-Q67 PolarHBondContact O-N 3.03Å; E64-E68 PolarHBondContact O-N 2.86Å
65	L	89.9	Confident	83.9	Confident	54 Å²	54	87.4 Å²	87.4	28%	0.283	45%	0.449	S	S	.	.	H	α-helix	trans	-59.3	-36.8	177.2	-177.6	65	0	0	0	112.1	N61 N62 Q67 E68 I69	N61-L65 PolarHBondContact O-N 2.71Å; N62-L65 PolarHBondContact O-N 3.12Å; L65-Q67 VanDerWaalsContact C-N 3.35Å; L65-E68 PolarHBondContact O-N 2.98Å; L65-I69 HydrophobicContact CD1-CD1 4.29Å; L65-I69 HydrophobicContact CG-CD1 3.94Å; L65-I69 WeakPolarHBondContact O-CB 3.25Å; L65-I69 VanDerWaalsContact O-CG1 3.27Å; L65-I69 WeakPolarHBondContact O-CG1 3.44Å; L65-I69 PolarHBondContact O-N 2.93Å
66	L	90.9	Very high	85.1	Confident	12 Å²	12	84.8 Å²	84.8	6%	0.063	43%	0.431	C	S	.	.	H	α-helix	trans	-61.4	-42.4	173.2	-169.4	75.2	0	0	0	111.6	N62 V63 E64 E68 I69 L70 L90 F95 Q96 L99	N62-L66 WeakPolarHBondContact O-CB 3.32Å; N62-L66 PolarHBondContact O-N 2.92Å; V63-L66 WeakPolarHBondContact O-CB 3.45Å; V63-L66 PolarHBondContact O-N 2.76Å; E64-L66 VanDerWaalsContact C-N 3.27Å; E64-L66 PolarHBondContact O-N 3.24Å; L66-E68 VanDerWaalsContact C-N 3.33Å; L66-I69 PolarHBondContact O-N 2.96Å; L66-L70 HydrophobicContact CG-CD1 4.13Å; L66-L70 WeakPolarHBondContact O-CB 3.28Å; L66-L70 WeakPolarHBondContact O-CG 3.32Å; L66-L70 PolarHBondContact O-N 2.95Å; L66-L90 HydrophobicContact CD1-CB 3.89Å; L66-L90 HydrophobicContact CD1-CD1 4.45Å; L66-L90 HydrophobicContact CD1-CD2 3.77Å; L66-L90 HydrophobicContact CD1-CG 4.23Å; L66-F95 HydrophobicContact CD1-CD1 4.39Å; L66-F95 HydrophobicContact CD1-CE1 3.96Å; L66-Q96 HydrophobicContact CD2-CG 3.97Å; L66-L99 HydrophobicContact CB-CD1 4.34Å; L66-L99 HydrophobicContact CD1-CD1 3.99Å; L66-L99 HydrophobicContact CD2-CD1 4.13Å; L66-L99 HydrophobicContact CG-CD1 4.39Å
67	Q	88.9	Confident	86	Confident	113 Å²	113	81.7 Å²	81.7	53%	0.528	41%	0.408	S	S	.	.	H	α-helix	trans	-73.6	-20.6	178.1	-64.7	177.7	21.5	0	0	113.5	V63 E64 L65 R71	V63-Q67 WeakPolarHBondContact O-CG 3.35Å; V63-Q67 PolarHBondContact O-N 3.15Å; E64-Q67 CarbonylContact O-C 3.59Å; E64-Q67 WeakPolarHBondContact O-CA 3.43Å; E64-Q67 WeakPolarHBondContact O-CB 3.34Å; E64-Q67 PolarHBondContact O-N 3.03Å; L65-Q67 VanDerWaalsContact C-N 3.35Å; Q67-R71 VanDerWaalsContact O-CB 3.29Å; Q67-R71 WeakPolarHBondContact O-CB 3.3Å; Q67-R71 PolarHBondContact O-NE 2.87Å; Q67-R71 PolarHBondContact O-NH2 2.85Å
68	E	90.5	Very high	86.2	Confident	108 Å²	108	88.3 Å²	88.3	51%	0.505	44%	0.435	S	S	.	.	H	α-helix	trans	-75.5	-50.8	166.1	-66.9	-170.5	146.2	0	0	110.4	E64 L65 L66 L70 R71 D72	E64-E68 PolarHBondContact O-N 2.86Å; L65-E68 PolarHBondContact O-N 2.98Å; L66-E68 VanDerWaalsContact C-N 3.33Å; E68-L70 PolarHBondContact O-N 2.92Å; E68-R71 WeakPolarHBondContact O-CB 3.5Å; E68-R71 PolarHBondContact O-N 3.41Å; E68-R71 VanDerWaalsContact O-N 3.08Å; E68-D72 PolarHBondContact O-N 3.36Å
69	I	89.7	Confident	86.5	Confident	69 Å²	69	91.5 Å²	91.5	35%	0.354	43%	0.431	S	S	.	.	H	α-helix	trans	-58.5	-43.6	180	-70.3	166.9	0	0	0	111.9	L65 L66 R71 D72 L73 L90	L65-I69 HydrophobicContact CD1-CD1 4.29Å; L65-I69 HydrophobicContact CG-CD1 3.94Å; L65-I69 WeakPolarHBondContact O-CB 3.25Å; L65-I69 VanDerWaalsContact O-CG1 3.27Å; L65-I69 WeakPolarHBondContact O-CG1 3.44Å; L65-I69 PolarHBondContact O-N 2.93Å; L66-I69 PolarHBondContact O-N 2.96Å; I69-R71 VanDerWaalsContact C-N 3.31Å; I69-R71 PolarHBondContact O-N 2.67Å; I69-D72 PolarHBondContact O-N 3.26Å; I69-L73 HydrophobicContact CG2-CD1 3.75Å; I69-L73 HydrophobicContact CG2-CG 4.38Å; I69-L73 WeakPolarHBondContact O-CB 3.33Å; I69-L73 VanDerWaalsContact O-CG 3.23Å; I69-L73 WeakPolarHBondContact O-CG 3.48Å; I69-L73 PolarHBondContact O-N 3.27Å; I69-L90 HydrophobicContact CG2-CD1 3.69Å
70	L	89.4	Confident	87.1	Confident	36 Å²	36	87.5 Å²	87.5	19%	0.188	42%	0.424	C	S	.	.	H	α-helix	trans	-65.1	-34.5	177.6	-74.9	171.2	0	0	0	112.7	L66 E68 L73 D74 A87 L90 T91	L66-L70 HydrophobicContact CG-CD1 4.13Å; L66-L70 WeakPolarHBondContact O-CB 3.28Å; L66-L70 WeakPolarHBondContact O-CG 3.32Å; L66-L70 PolarHBondContact O-N 2.95Å; E68-L70 PolarHBondContact O-N 2.92Å; L70-L73 PolarHBondContact O-N 3.45Å; L70-D74 PolarHBondContact O-N 3.01Å; L70-A87 HydrophobicContact CD2-CB 4.16Å; L70-L90 HydrophobicContact CD2-CB 3.9Å; L70-L90 HydrophobicContact CD2-CD1 4.37Å; L70-L90 HydrophobicContact CG-CB 4.45Å; L70-T91 HydrophobicContact CD1-CG2 3.89Å; L70-T91 HydrophobicContact CD2-CG2 3.91Å
71	R	90.6	Very high	87.1	Confident	156 Å²	156	89 Å²	89	59%	0.589	44%	0.435	S	S	*	.	H	α-helix	trans	-73	-36.9	178.7	-170.3	-168.3	-36.6	179.5	12.3	112.1	Q67 E68 I69	Q67-R71 VanDerWaalsContact O-CB 3.29Å; Q67-R71 WeakPolarHBondContact O-CB 3.3Å; Q67-R71 PolarHBondContact O-NE 2.87Å; Q67-R71 PolarHBondContact O-NH2 2.85Å; E68-R71 WeakPolarHBondContact O-CB 3.5Å; E68-R71 PolarHBondContact O-N 3.41Å; E68-R71 VanDerWaalsContact O-N 3.08Å; I69-R71 VanDerWaalsContact C-N 3.31Å; I69-R71 PolarHBondContact O-N 2.67Å
72	D	89.9	Confident	87.1	Confident	119 Å²	119	90.9 Å²	90.9	64%	0.636	45%	0.449	S	S	*	.	H	α-helix	trans	-74.1	-27.8	173	-79	0.1	0	0	0	112.2	E68 I69 F76	E68-D72 PolarHBondContact O-N 3.36Å; I69-D72 PolarHBondContact O-N 3.26Å; D72-F76 VanDerWaalsContact O-CD2 3.25Å; D72-F76 WeakPolarHBondContact O-CD2 3.44Å; D72-F76 WeakPolarHBondContact O-CE2 3.31Å
73	L	86.9	Confident	87	Confident	29 Å²	29	89.8 Å²	89.8	15%	0.152	45%	0.445	C	S	.	.	H	α-helix	trans	-78.7	-32.8	175.2	-77.8	170.4	0	0	0	113.9	I69 L70 P75 F76 T77 A83 L86 L90	I69-L73 HydrophobicContact CG2-CD1 3.75Å; I69-L73 HydrophobicContact CG2-CG 4.38Å; I69-L73 WeakPolarHBondContact O-CB 3.33Å; I69-L73 VanDerWaalsContact O-CG 3.23Å; I69-L73 WeakPolarHBondContact O-CG 3.48Å; I69-L73 PolarHBondContact O-N 3.27Å; L70-L73 PolarHBondContact O-N 3.45Å; L73-P75 VanDerWaalsContact C-CD 3.46Å; L73-F76 WeakPolarHBondContact O-CA 3.19Å; L73-F76 WeakPolarHBondContact O-CB 3.28Å; L73-F76 PolarHBondContact O-N 3.17Å; L73-T77 PolarHBondContact O-N 3.26Å; L73-T77 VanDerWaalsContact O-N 3.15Å; L73-A83 HydrophobicContact CD2-CB 4.37Å; L73-L86 HydrophobicContact CD1-CD2 3.86Å; L73-L86 HydrophobicContact CD1-CG 3.99Å; L73-L86 HydrophobicContact CD2-CD2 4.18Å; L73-L90 HydrophobicContact CD1-CD1 3.97Å
74	D	85.9	Confident	86.8	Confident	104 Å²	104	90.1 Å²	90.1	56%	0.556	45%	0.451	S	S	*	.	H	α-helix	trans	-47.2	-47.1	-174.7	179.9	65.3	0	0	0	114.2	L70 F76 T77	L70-D74 PolarHBondContact O-N 3.01Å; D74-F76 PolarHBondContact O-N 3.13Å; D74-T77 PolarHBondContact O-N 3.05Å; D74-T77 PolarHBondContact O-OG1 2.93Å
75	P	86.8	Confident	86.9	Confident	77 Å²	77	89.4 Å²	89.4	50%	0.5	45%	0.448	S	S	.	.	H	α-helix	trans	-63.4	-14.8	178	-21.7	34.5	0	0	0	115.3	L73	L73-P75 VanDerWaalsContact C-CD 3.46Å
76	F	85.3	Confident	86.8	Confident	115 Å²	115	90.4 Å²	90.4	50%	0.504	45%	0.453	S	S	.	.	H	α-helix	trans	-106.6	-17.4	-177.6	-56.3	-82	0	0	0	113.3	D72 L73 D74 Q78 R79 S80 A83	D72-F76 VanDerWaalsContact O-CD2 3.25Å; D72-F76 WeakPolarHBondContact O-CD2 3.44Å; D72-F76 WeakPolarHBondContact O-CE2 3.31Å; L73-F76 WeakPolarHBondContact O-CA 3.19Å; L73-F76 WeakPolarHBondContact O-CB 3.28Å; L73-F76 PolarHBondContact O-N 3.17Å; D74-F76 PolarHBondContact O-N 3.13Å; F76-Q78 VanDerWaalsContact C-N 3.27Å; F76-Q78 PolarHBondContact O-N 2.98Å; F76-R79 CarbonylContact O-C 3.59Å; F76-R79 WeakPolarHBondContact O-CA 3.45Å; F76-R79 PolarHBondContact O-N 3.16Å; F76-S80 PolarHBondContact O-N 3.11Å; F76-A83 HydrophobicContact CB-CB 4.08Å
77	T	80.7	Confident	86.7	Confident	35 Å²	35	90.6 Å²	90.6	22%	0.215	46%	0.456	C	S	.	.	H	α-helix	trans	-52.3	-43.6	177.7	58.8	0	0	0	0	112.3	L73 D74 R79 A87	L73-T77 PolarHBondContact O-N 3.26Å; L73-T77 VanDerWaalsContact O-N 3.15Å; D74-T77 PolarHBondContact O-N 3.05Å; D74-T77 PolarHBondContact O-OG1 2.93Å; T77-R79 PolarHBondContact O-N 3.02Å; T77-A87 HydrophobicContact CG2-CB 4.06Å
78	Q	78	Confident	86.7	Confident	183 Å²	183	91.8 Å²	91.8	86%	0.855	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	0.5	179	-57.6	-176.1	18.5	0	0	114.2	F76	F76-Q78 VanDerWaalsContact C-N 3.27Å; F76-Q78 PolarHBondContact O-N 2.98Å
79	R	82.7	Confident	86.7	Confident	212 Å²	212	89.7 Å²	89.7	80%	0.8	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.5	-10.8	-173.4	-64.7	-177.6	176.8	-178.5	2	114.3	F76 T77	F76-R79 CarbonylContact O-C 3.59Å; F76-R79 WeakPolarHBondContact O-CA 3.45Å; F76-R79 PolarHBondContact O-N 3.16Å; T77-R79 PolarHBondContact O-N 3.02Å
80	S	88.2	Confident	86.7	Confident	49 Å²	49	87.4 Å²	87.4	34%	0.343	44%	0.436	S	S	.	.			trans	-149.6	119.3	-179.4	177.1	0	0	0	0	110.1	F76 T82 A83 A84	F76-S80 PolarHBondContact O-N 3.11Å; S80-T82 PolarHBondContact O-N 3Å; S80-T82 PolarHBondContact OG-N 3.41Å; S80-A83 WeakPolarHBondContact O-CB 3.49Å; S80-A83 PolarHBondContact O-N 2.8Å; S80-A83 PolarHBondContact OG-N 2.8Å; S80-A84 PolarHBondContact O-N 3.09Å
81	D	83.3	Confident	86.7	Confident	147 Å²	147	89 Å²	89	79%	0.786	45%	0.447	S	S	*	.	H	α-helix	trans	-57.9	-32.6	176.4	-52.4	-53.5	0	0	0	111.5	A84 E85	D81-A84 PolarHBondContact O-N 2.88Å; D81-E85 WeakPolarHBondContact O-CB 3.41Å; D81-E85 PolarHBondContact O-N 3.36Å
82	T	86.7	Confident	86.8	Confident	104 Å²	104	85 Å²	85	64%	0.638	44%	0.435	S	S	*	.	H	α-helix	trans	-68.4	-34.9	174.9	-44.7	0	0	0	0	112.7	S80 L86	S80-T82 PolarHBondContact O-N 3Å; S80-T82 PolarHBondContact OG-N 3.41Å; T82-L86 VanDerWaalsContact O-CB 3.3Å; T82-L86 WeakPolarHBondContact O-CB 3.39Å; T82-L86 PolarHBondContact O-N 2.84Å
83	A	85.3	Confident	86.7	Confident	11 Å²	11	83.3 Å²	83.3	9%	0.091	43%	0.431	C	S	.	.	H	α-helix	trans	-72	-38.8	173.9	0	0	0	0	0	111.3	L73 F76 S80 A87	L73-A83 HydrophobicContact CD2-CB 4.37Å; F76-A83 HydrophobicContact CB-CB 4.08Å; S80-A83 WeakPolarHBondContact O-CB 3.49Å; S80-A83 PolarHBondContact O-N 2.8Å; S80-A83 PolarHBondContact OG-N 2.8Å; A83-A87 VanDerWaalsContact O-CB 3.32Å; A83-A87 WeakPolarHBondContact O-CB 3.22Å; A83-A87 PolarHBondContact O-N 3.47Å
84	A	85.5	Confident	86.7	Confident	40 Å²	40	89.4 Å²	89.4	33%	0.331	46%	0.458	S	S	.	.	H	α-helix	trans	-65	-41.2	173	0	0	0	0	0	112.4	S80 D81 R88	S80-A84 PolarHBondContact O-N 3.09Å; D81-A84 PolarHBondContact O-N 2.88Å; A84-R88 VanDerWaalsContact O-CB 3.28Å; A84-R88 WeakPolarHBondContact O-CB 3.49Å; A84-R88 PolarHBondContact O-N 2.97Å
85	E	89.2	Confident	86.7	Confident	104 Å²	104	87.8 Å²	87.8	49%	0.486	45%	0.446	S	S	.	.	H	α-helix	trans	-65.8	-45.3	175.1	177.3	162.8	-130.9	0	0	112	D81 R88 I89	D81-E85 WeakPolarHBondContact O-CB 3.41Å; D81-E85 PolarHBondContact O-N 3.36Å; E85-R88 WeakPolarHBondContact O-CB 3.19Å; E85-R88 PolarHBondContact O-N 3.42Å; E85-R88 IonicContact OE1-NH2 2.75Å; E85-I89 HydrophobicContact CG-CD1 3.88Å; E85-I89 WeakPolarHBondContact O-CG1 3.36Å; E85-I89 PolarHBondContact O-N 2.83Å
86	L	89.3	Confident	86.7	Confident	76 Å²	76	87.3 Å²	87.3	40%	0.398	44%	0.437	S	S	.	.	H	α-helix	trans	-60.1	-48.7	175.8	178.5	59.2	0	0	0	111	L73 T82 R88 I89 L90	L73-L86 HydrophobicContact CD1-CD2 3.86Å; L73-L86 HydrophobicContact CD1-CG 3.99Å; L73-L86 HydrophobicContact CD2-CD2 4.18Å; T82-L86 VanDerWaalsContact O-CB 3.3Å; T82-L86 WeakPolarHBondContact O-CB 3.39Å; T82-L86 PolarHBondContact O-N 2.84Å; L86-R88 VanDerWaalsContact C-N 3.34Å; L86-R88 PolarHBondContact O-N 3.37Å; L86-I89 PolarHBondContact O-N 2.91Å; L86-I89 VanDerWaalsContact O-N 3.16Å; L86-L90 HydrophobicContact CD1-CD1 3.98Å; L86-L90 HydrophobicContact CD1-CD2 4.49Å; L86-L90 HydrophobicContact CD1-CG 4.03Å; L86-L90 HydrophobicContact CG-CD1 3.95Å; L86-L90 HydrophobicContact CG-CG 4.39Å; L86-L90 WeakPolarHBondContact O-CB 3.39Å; L86-L90 VanDerWaalsContact O-CG 3.28Å; L86-L90 WeakPolarHBondContact O-CG 3.43Å; L86-L90 PolarHBondContact O-N 3.13Å
87	A	88.4	Confident	86.7	Confident	15 Å²	15	84.5 Å²	84.5	12%	0.124	43%	0.432	C	S	.	.	H	α-helix	trans	-56.4	-47.5	175.2	0	0	0	0	0	111.4	L70 T77 A83 I89 L90 T91	L70-A87 HydrophobicContact CD2-CB 4.16Å; T77-A87 HydrophobicContact CG2-CB 4.06Å; A83-A87 VanDerWaalsContact O-CB 3.32Å; A83-A87 WeakPolarHBondContact O-CB 3.22Å; A83-A87 PolarHBondContact O-N 3.47Å; A87-I89 VanDerWaalsContact C-N 3.29Å; A87-I89 PolarHBondContact O-N 3.09Å; A87-L90 PolarHBondContact O-N 3.44Å; A87-T91 WeakPolarHBondContact O-CG2 3.18Å; A87-T91 PolarHBondContact O-N 2.97Å; A87-T91 PolarHBondContact O-OG1 3.06Å; A87-T91 VanDerWaalsContact O-OG1 3.12Å
88	R	89.4	Confident	87.1	Confident	139 Å²	139	88 Å²	88	53%	0.525	45%	0.448	S	S	.	.	H	α-helix	trans	-58.4	-35.7	177.1	-175.1	-171.7	69	87.8	-1.3	113.3	A84 E85 L86 T91 Q92	A84-R88 VanDerWaalsContact O-CB 3.28Å; A84-R88 WeakPolarHBondContact O-CB 3.49Å; A84-R88 PolarHBondContact O-N 2.97Å; E85-R88 WeakPolarHBondContact O-CB 3.19Å; E85-R88 PolarHBondContact O-N 3.42Å; E85-R88 IonicContact OE1-NH2 2.75Å; L86-R88 VanDerWaalsContact C-N 3.34Å; L86-R88 PolarHBondContact O-N 3.37Å; R88-T91 PolarHBondContact O-OG1 2.88Å; R88-Q92 WeakPolarHBondContact O-CG 3.38Å
89	I	90.1	Very high	87.6	Confident	64 Å²	64	80.6 Å²	80.6	33%	0.328	42%	0.415	S	S	.	.	H	α-helix	trans	-71.8	-46.5	176.2	-69	164.3	0	0	0	110.4	E85 L86 A87 T91 Q92	E85-I89 HydrophobicContact CG-CD1 3.88Å; E85-I89 WeakPolarHBondContact O-CG1 3.36Å; E85-I89 PolarHBondContact O-N 2.83Å; L86-I89 PolarHBondContact O-N 2.91Å; L86-I89 VanDerWaalsContact O-N 3.16Å; A87-I89 VanDerWaalsContact C-N 3.29Å; A87-I89 PolarHBondContact O-N 3.09Å; I89-T91 PolarHBondContact O-N 2.67Å; I89-Q92 WeakPolarHBondContact O-CB 3.22Å; I89-Q92 WeakPolarHBondContact O-CG 3.17Å; I89-Q92 PolarHBondContact O-N 2.68Å; I89-Q92 VanDerWaalsContact O-N 3.09Å
90	L	89.1	Confident	87.8	Confident	20 Å²	20	75.4 Å²	75.4	11%	0.105	40%	0.399	C	S	.	.	H	α-helix	trans	-65.2	-23.9	178.9	-66.8	178.6	0	0	0	113	L66 I69 L70 L73 L86 A87 F95	L66-L90 HydrophobicContact CD1-CB 3.89Å; L66-L90 HydrophobicContact CD1-CD1 4.45Å; L66-L90 HydrophobicContact CD1-CD2 3.77Å; L66-L90 HydrophobicContact CD1-CG 4.23Å; I69-L90 HydrophobicContact CG2-CD1 3.69Å; L70-L90 HydrophobicContact CD2-CB 3.9Å; L70-L90 HydrophobicContact CD2-CD1 4.37Å; L70-L90 HydrophobicContact CG-CB 4.45Å; L73-L90 HydrophobicContact CD1-CD1 3.97Å; L86-L90 HydrophobicContact CD1-CD1 3.98Å; L86-L90 HydrophobicContact CD1-CD2 4.49Å; L86-L90 HydrophobicContact CD1-CG 4.03Å; L86-L90 HydrophobicContact CG-CD1 3.95Å; L86-L90 HydrophobicContact CG-CG 4.39Å; L86-L90 WeakPolarHBondContact O-CB 3.39Å; L86-L90 VanDerWaalsContact O-CG 3.28Å; L86-L90 WeakPolarHBondContact O-CG 3.43Å; L86-L90 PolarHBondContact O-N 3.13Å; A87-L90 PolarHBondContact O-N 3.44Å; L90-F95 HydrophobicContact CD2-CD1 4.21Å; L90-F95 HydrophobicContact CD2-CE1 3.47Å; L90-F95 VanDerWaalsContact CD2-CE1 3.47Å; L90-F95 HydrophobicContact CD2-CZ 3.93Å
91	T	90.1	Very high	87.6	Confident	69 Å²	69	77.1 Å²	77.1	42%	0.423	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	14.5	172.7	62.5	0	0	0	0	114.4	L70 A87 R88 I89	L70-T91 HydrophobicContact CD1-CG2 3.89Å; L70-T91 HydrophobicContact CD2-CG2 3.91Å; A87-T91 WeakPolarHBondContact O-CG2 3.18Å; A87-T91 PolarHBondContact O-N 2.97Å; A87-T91 PolarHBondContact O-OG1 3.06Å; A87-T91 VanDerWaalsContact O-OG1 3.12Å; R88-T91 PolarHBondContact O-OG1 2.88Å; I89-T91 PolarHBondContact O-N 2.67Å
92	Q	92.2	Very high	87.8	Confident	74 Å²	74	73.4 Å²	73.4	35%	0.346	39%	0.386	S	S	.	.			trans	-74.6	136.9	172.9	-68.4	-177.2	16.6	0	0	110.3	R88 I89 H94 F95 Q96	R88-Q92 WeakPolarHBondContact O-CG 3.38Å; I89-Q92 WeakPolarHBondContact O-CB 3.22Å; I89-Q92 WeakPolarHBondContact O-CG 3.17Å; I89-Q92 PolarHBondContact O-N 2.68Å; I89-Q92 VanDerWaalsContact O-N 3.09Å; Q92-H94 VanDerWaalsContact C-N 3.34Å; Q92-H94 PolarHBondContact O-N 2.91Å; Q92-F95 HydrophobicContact CB-CB 4.22Å; Q92-F95 WeakPolarHBondContact O-CB 3.41Å; Q92-F95 PolarHBondContact O-N 3.19Å; Q92-Q96 PolarHBondContact O-N 2.91Å
93	P	87.2	Confident	87.9	Confident	83 Å²	83	69.1 Å²	69.1	54%	0.539	36%	0.359	S	S	.	.	H	α-helix	trans	-58.3	-45	-176	21.7	-32.7	0	0	0	111.7	F95 Q96 S97	P93-F95 PolarHBondContact O-N 2.95Å; P93-Q96 PolarHBondContact O-N 2.94Å; P93-Q96 VanDerWaalsContact O-N 3.16Å; P93-S97 WeakPolarHBondContact O-CB 3.12Å; P93-S97 PolarHBondContact O-N 2.93Å; P93-S97 PolarHBondContact O-OG 3.44Å; P93-S97 VanDerWaalsContact O-OG 3.13Å
94	H	86.8	Confident	87.8	Confident	157 Å²	157	71.4 Å²	71.4	73%	0.727	37%	0.374	S	S	*	.	H	α-helix	trans	-61.2	-28.5	176.6	-53.4	-53.5	0	0	0	113.9	Q92 L98	Q92-H94 VanDerWaalsContact C-N 3.34Å; Q92-H94 PolarHBondContact O-N 2.91Å; H94-L98 VanDerWaalsContact O-CB 3.27Å; H94-L98 WeakPolarHBondContact O-CB 3.5Å; H94-L98 PolarHBondContact O-N 3.3Å
95	F	87.3	Confident	87.5	Confident	70 Å²	70	74.5 Å²	74.5	31%	0.307	39%	0.389	S	S	.	.	H	α-helix	trans	-79	-38.1	177	-167.9	-94.5	0	0	0	111.3	L66 L90 Q92 P93 L99	L66-F95 HydrophobicContact CD1-CD1 4.39Å; L66-F95 HydrophobicContact CD1-CE1 3.96Å; L90-F95 HydrophobicContact CD2-CD1 4.21Å; L90-F95 HydrophobicContact CD2-CE1 3.47Å; L90-F95 VanDerWaalsContact CD2-CE1 3.47Å; L90-F95 HydrophobicContact CD2-CZ 3.93Å; Q92-F95 HydrophobicContact CB-CB 4.22Å; Q92-F95 WeakPolarHBondContact O-CB 3.41Å; Q92-F95 PolarHBondContact O-N 3.19Å; P93-F95 PolarHBondContact O-N 2.95Å; F95-L99 HydrophobicContact CD1-CD1 4.13Å; F95-L99 HydrophobicContact CE1-CD1 3.68Å; F95-L99 HydrophobicContact CE1-CG 4.4Å; F95-L99 HydrophobicContact CZ-CD1 4.37Å; F95-L99 WeakPolarHBondContact O-CG 3.44Å; F95-L99 PolarHBondContact O-N 3.27Å
96	Q	86.8	Confident	87.1	Confident	66 Å²	66	70 Å²	70	31%	0.308	37%	0.369	S	S	.	.	H	α-helix	trans	-65.3	-52	173.8	-68.6	179.1	-33.9	0	0	110.9	L66 Q92 P93 L98 L99 E100	L66-Q96 HydrophobicContact CD2-CG 3.97Å; Q92-Q96 PolarHBondContact O-N 2.91Å; P93-Q96 PolarHBondContact O-N 2.94Å; P93-Q96 VanDerWaalsContact O-N 3.16Å; Q96-L98 PolarHBondContact O-N 3.12Å; Q96-L99 PolarHBondContact O-N 3.43Å; Q96-E100 WeakPolarHBondContact O-CG 3.36Å; Q96-E100 PolarHBondContact O-N 3.43Å
97	S	84.4	Confident	86.4	Confident	56 Å²	56	69.4 Å²	69.4	39%	0.392	37%	0.372	S	S	.	.	H	α-helix	trans	-61.7	-29	177.9	-55.1	0	0	0	0	113.6	P93 E100 T101	P93-S97 WeakPolarHBondContact O-CB 3.12Å; P93-S97 PolarHBondContact O-N 2.93Å; P93-S97 PolarHBondContact O-OG 3.44Å; P93-S97 VanDerWaalsContact O-OG 3.13Å; S97-E100 WeakPolarHBondContact CA-OE2 3.41Å; S97-T101 VanDerWaalsContact O-CB 3.23Å; S97-T101 WeakPolarHBondContact O-CB 3.41Å; S97-T101 PolarHBondContact O-N 3.17Å; S97-T101 PolarHBondContact O-OG1 3.29Å
98	L	89.5	Confident	85.4	Confident	108 Å²	108	76 Å²	76	57%	0.565	40%	0.4	S	S	*	.	H	α-helix	trans	-66.1	-40.6	171.7	177.7	63	0	0	0	112	H94 Q96 H102	H94-L98 VanDerWaalsContact O-CB 3.27Å; H94-L98 WeakPolarHBondContact O-CB 3.5Å; H94-L98 PolarHBondContact O-N 3.3Å; Q96-L98 PolarHBondContact O-N 3.12Å; L98-H102 WeakPolarHBondContact O-CB 3.28Å; L98-H102 PolarHBondContact O-N 2.91Å
99	L	88.9	Confident	83.6	Confident	29 Å²	29	73 Å²	73	15%	0.152	41%	0.405	C	S	.	.	H	α-helix	trans	-75	-37.2	177.6	-64.8	-179.9	0	0	0	112.1	N62 V63 L66 F95 Q96 H102 D103	N62-L99 HydrophobicContact CB-CD2 4.01Å; V63-L99 HydrophobicContact CG2-CB 4Å; L66-L99 HydrophobicContact CB-CD1 4.34Å; L66-L99 HydrophobicContact CD1-CD1 3.99Å; L66-L99 HydrophobicContact CD2-CD1 4.13Å; L66-L99 HydrophobicContact CG-CD1 4.39Å; F95-L99 HydrophobicContact CD1-CD1 4.13Å; F95-L99 HydrophobicContact CE1-CD1 3.68Å; F95-L99 HydrophobicContact CE1-CG 4.4Å; F95-L99 HydrophobicContact CZ-CD1 4.37Å; F95-L99 WeakPolarHBondContact O-CG 3.44Å; F95-L99 PolarHBondContact O-N 3.27Å; Q96-L99 PolarHBondContact O-N 3.43Å; L99-H102 WeakPolarHBondContact O-CB 3.5Å; L99-H102 PolarHBondContact O-N 3.41Å; L99-D103 WeakPolarHBondContact O-CB 3.38Å; L99-D103 PolarHBondContact O-N 3.27Å
100	E	86.1	Confident	81.3	Confident	102 Å²	102	73.6 Å²	73.6	48%	0.477	41%	0.414	S	S	.	.	H	α-helix	trans	-62.5	-44.1	172.2	-68.2	163.9	169.7	0	0	111.3	V63 Q96 S97 D103 S104	V63-E100 HydrophobicContact CG2-CB 4.39Å; V63-E100 HydrophobicContact CG2-CG 3.75Å; Q96-E100 WeakPolarHBondContact O-CG 3.36Å; Q96-E100 PolarHBondContact O-N 3.43Å; S97-E100 WeakPolarHBondContact CA-OE2 3.41Å; E100-D103 PolarHBondContact O-N 3.45Å; E100-S104 VanDerWaalsContact O-CB 3.25Å; E100-S104 WeakPolarHBondContact O-CB 3.45Å; E100-S104 PolarHBondContact O-N 3.36Å
101	T	84.4	Confident	79	Confident	85 Å²	85	82.5 Å²	82.5	52%	0.521	46%	0.455	S	S	.	.	H	α-helix	trans	-64	-42.8	174.4	-57.4	0	0	0	0	111.2	S97 S104 V105	S97-T101 VanDerWaalsContact O-CB 3.23Å; S97-T101 WeakPolarHBondContact O-CB 3.41Å; S97-T101 PolarHBondContact O-N 3.17Å; S97-T101 PolarHBondContact O-OG1 3.29Å; T101-S104 PolarHBondContact O-N 3.37Å; T101-V105 WeakPolarHBondContact O-CG2 3.27Å; T101-V105 PolarHBondContact O-N 3.39Å
102	H	87.4	Confident	76.7	Confident	70 Å²	70	83.1 Å²	83.1	32%	0.324	46%	0.462	S	S	.	.	H	α-helix	trans	-57.9	-52	175.3	168.6	-77	0	0	0	111.4	R59 N62 L98 L99 S104 V105 A106	R59-H102 PolarHBondContact O-CE1 3.16Å; R59-H102 VanDerWaalsContact O-CE1 3.27Å; N62-H102 PolarHBondContact ND2-CE1 3.05Å; N62-H102 PolarHBondContact ND2-ND1 3.37Å; N62-H102 VanDerWaalsContact ND2-ND1 3.11Å; L98-H102 WeakPolarHBondContact O-CB 3.28Å; L98-H102 PolarHBondContact O-N 2.91Å; L99-H102 WeakPolarHBondContact O-CB 3.5Å; L99-H102 PolarHBondContact O-N 3.41Å; H102-S104 VanDerWaalsContact C-N 3.35Å; H102-S104 PolarHBondContact O-N 2.87Å; H102-V105 PolarHBondContact O-N 2.85Å; H102-A106 WeakPolarHBondContact O-CB 3.49Å; H102-A106 PolarHBondContact O-N 2.95Å
103	D	87.8	Confident	73.9	Confident	14 Å²	14	88.6 Å²	88.6	8%	0.075	49%	0.487	C	S	.	.	H	α-helix	trans	-68.9	-34.1	-175.8	-70.1	-6.4	0	0	0	111.7	E60 N61 N62 V63 L99 E100 A106 S107	E60-D103 WeakPolarHBondContact O-CB 3.12Å; N61-D103 VanDerWaalsContact C-OD2 3.25Å; N61-D103 WeakPolarHBondContact CA-OD2 3.44Å; N62-D103 WeakPolarHBondContact CA-OD2 3.31Å; N62-D103 VanDerWaalsContact N-CG 3.3Å; N62-D103 PolarHBondContact N-OD1 3.26Å; N62-D103 VanDerWaalsContact N-OD1 3.11Å; N62-D103 PolarHBondContact N-OD2 2.99Å; V63-D103 WeakPolarHBondContact CG2-OD2 3.49Å; V63-D103 PolarHBondContact N-OD2 2.87Å; L99-D103 WeakPolarHBondContact O-CB 3.38Å; L99-D103 PolarHBondContact O-N 3.27Å; E100-D103 PolarHBondContact O-N 3.45Å; D103-A106 PolarHBondContact O-N 3.01Å; D103-S107 VanDerWaalsContact O-CB 3.29Å; D103-S107 WeakPolarHBondContact O-CB 3.46Å; D103-S107 PolarHBondContact O-N 3.35Å; D103-S107 PolarHBondContact O-OG 3.09Å
104	S	83.4	Confident	71.5	Confident	58 Å²	58	89.5 Å²	89.5	41%	0.406	49%	0.493	S	S	.	.	H	α-helix	trans	-62.4	-44.1	171.4	-176.7	0	0	0	0	112.9	E100 T101 H102 S107	E100-S104 VanDerWaalsContact O-CB 3.25Å; E100-S104 WeakPolarHBondContact O-CB 3.45Å; E100-S104 PolarHBondContact O-N 3.36Å; T101-S104 PolarHBondContact O-N 3.37Å; H102-S104 VanDerWaalsContact C-N 3.35Å; H102-S104 PolarHBondContact O-N 2.87Å; S104-S107 PolarHBondContact O-OG 3.01Å
105	V	80.6	Confident	69	Low	106 Å²	106	86.5 Å²	86.5	64%	0.642	49%	0.488	S	S	*	.	H	α-helix	trans	-69.7	-38.5	175	171.1	0	0	0	0	111.5	T101 H102	T101-V105 WeakPolarHBondContact O-CG2 3.27Å; T101-V105 PolarHBondContact O-N 3.39Å; H102-V105 PolarHBondContact O-N 2.85Å
106	A	80.4	Confident	66.5	Low	8 Å²	8	87.4 Å²	87.4	7%	0.066	50%	0.503	C	S	.	.	H	α-helix	trans	-67	-44.1	-179.1	0	0	0	0	0	112.4	P57 E60 H102 D103 Q108	P57-A106 HydrophobicContact CB-CB 3.49Å; P57-A106 VanDerWaalsContact CB-CB 3.49Å; P57-A106 HydrophobicContact CG-CB 3.86Å; E60-A106 HydrophobicContact CB-CB 4.32Å; E60-A106 HydrophobicContact CG-CB 3.76Å; H102-A106 WeakPolarHBondContact O-CB 3.49Å; H102-A106 PolarHBondContact O-N 2.95Å; D103-A106 PolarHBondContact O-N 3.01Å; A106-Q108 PolarHBondContact O-N 2.74Å; A106-Q108 VanDerWaalsContact O-N 3.16Å
107	S	74.9	Confident	64	Low	65 Å²	65	90.8 Å²	90.8	46%	0.455	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	4.1	-178.2	56.9	0	0	0	0	115	D103 S104 A109	D103-S107 VanDerWaalsContact O-CB 3.29Å; D103-S107 WeakPolarHBondContact O-CB 3.46Å; D103-S107 PolarHBondContact O-N 3.35Å; D103-S107 PolarHBondContact O-OG 3.09Å; S104-S107 PolarHBondContact O-OG 3.01Å; S107-A109 VanDerWaalsContact C-N 3.27Å; S107-A109 PolarHBondContact O-N 2.82Å
108	Q	66.4	Low	61.6	Low	153 Å²	153	93 Å²	93	72%	0.715	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	33.4	176.3	-56.6	-174.8	14.6	0	0	114.5	A106 C110	A106-Q108 PolarHBondContact O-N 2.74Å; A106-Q108 VanDerWaalsContact O-N 3.16Å; Q108-C110 PolarHBondContact O-N 3.27Å
109	A	51.5	Low	58.9	Low	76 Å²	76	94.1 Å²	94.1	63%	0.628	55%	0.551	S	S	*	*			trans	-63	-7.1	171.5	0	0	0	0	0	113.9	S107	S107-A109 VanDerWaalsContact C-N 3.27Å; S107-A109 PolarHBondContact O-N 2.82Å
110	C	42.5	Very low	56	Low	76 Å²	76	97.8 Å²	97.8	51%	0.514	58%	0.578	S	S	.	*			trans	-106.7	82.1	175.8	-63.8	0	0	0	0	112.3	Q108 S112	Q108-C110 PolarHBondContact O-N 3.27Å; C110-S112 PolarHBondContact O-N 3.05Å
111	E	40.7	Very low	53.4	Low	207 Å²	207	99.8 Å²	99.8	97%	0.967	60%	0.597	S	S	*	*	S	Bend	trans	-73	42.1	155.2	-76.9	-154.4	133.5	0	0	111.8
112	S	41.1	Very low	50.9	Low	82 Å²	82	101.2 Å²	101.2	57%	0.573	60%	0.602	S	S	*	*	S	Bend	trans	-151.9	118.3	169.2	58.6	0	0	0	0	107.5	C110	C110-S112 PolarHBondContact O-N 3.05Å
113	Q	34.7	Very low	48.3	Very low	189 Å²	189	106.3 Å²	106.3	88%	0.883	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-54.8	123.3	174.5	-177.9	175.3	-1.3	0	0	108.9
114	P	36.2	Very low	45.5	Very low	102 Å²	102	114.2 Å²	114.2	66%	0.662	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-63.5	142	-176.1	25.5	-33.9	0	0	0	110.1
115	P	34.4	Very low	42.9	Very low	95 Å²	95	120.8 Å²	120.8	62%	0.617	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-61.7	157.9	172.2	27.8	-34.1	0	0	0	110.6
116	S	34.8	Very low	40.8	Very low	89 Å²	89	124.6 Å²	124.6	62%	0.622	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-52.3	150.8	173.8	-61	0	0	0	0	111.4	C118	S116-C118 PolarHBondContact O-N 2.92Å
117	P	34.8	Very low	38.4	Very low	136 Å²	136	130.9 Å²	130.9	88%	0.883	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	67.3	-170.1	32	-37.9	0	0	0	113.3
118	C	33.9	Very low	36.3	Very low	102 Å²	102	133.2 Å²	133.2	69%	0.689	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.6	-33.3	178.9	-62.6	0	0	0	0	112.3	S116	S116-C118 PolarHBondContact O-N 2.92Å
119	D	32.4	Very low	34.8	Very low	132 Å²	132	134.8 Å²	134.8	71%	0.706	75%	0.753	S	S	*	*	S	Bend	trans	-115.7	49.7	-162.1	-56.5	-56.8	0	0	0	113.3
120	C	28.3	Very low	33.6	Very low	106 Å²	106	137.2 Å²	137.2	72%	0.716	76%	0.76	S	S	*	*			trans	-135.9	62.1	-177	-61.8	0	0	0	0	113.9
121	V	31.1	Very low	33.2	Very low	145 Å²	145	140.4 Å²	140.4	88%	0.879	78%	0.778	S	S	*	*			trans	-151.4	92.4	157.3	-106.7	0	0	0	0	110.7
122	D	32.6	Very low	32.6	Very low	115 Å²	115	137.6 Å²	137.6	62%	0.615	77%	0.769	S	S	*	*			trans	-151.5	139.8	152.4	-116.4	-41.8	0	0	0	108.4	H222	D122-H222 IonicContact OD2-CE1 3.74Å
123	H	31.1	Very low	32.4	Very low	177 Å²	177	139.2 Å²	139.2	82%	0.819	78%	0.778	S	S	*	*			trans	63.8	129.4	-174.2	-55.2	-42.3	0	0	0	115.6
124	E	29.5	Very low	32.4	Very low	179 Å²	179	134.9 Å²	134.9	84%	0.836	78%	0.775	S	S	*	*			cis	-142.4	142.6	2	-57.3	179.8	115	0	0	111
125	Q	29	Very low	32.7	Very low	197 Å²	197	135.4 Å²	135.4	92%	0.921	77%	0.771	S	S	*	*				-167.8	143.6	129	-111.1	172.4	13.6	0	0	112.6
126	E	36.9	Very low	33.3	Very low	186 Å²	186	135.3 Å²	135.3	87%	0.869	77%	0.77	S	S	*	*			trans	-82.5	-176	171.8	-62.4	-175	115.1	0	0	111.7
127	D	30.7	Very low	34.1	Very low	140 Å²	140	135.4 Å²	135.4	75%	0.749	77%	0.771	S	S	*	*			trans	64.7	78.4	174.8	-89.5	-21.4	0	0	0	117.7
128	S	29.8	Very low	35.2	Very low	114 Å²	114	135.3 Å²	135.3	80%	0.797	76%	0.763	S	S	*	*			trans	-142.9	113	140.1	-82.3	0	0	0	0	110.9	T130	S128-T130 PolarHBondContact O-N 3.04Å; S128-T130 VanDerWaalsContact O-N 3.1Å
129	Q	34.6	Very low	36.9	Very low	185 Å²	185	131.5 Å²	131.5	86%	0.864	74%	0.739	S	S	*	*			trans	-81.9	88.2	-172.4	-66.3	-178	4.9	0	0	112.7
130	T	27.5	Very low	39.1	Very low	128 Å²	128	130 Å²	130	79%	0.785	73%	0.73	S	S	*	*			trans	-118.6	109.5	164.9	30.5	0	0	0	0	110.4	S128 N132	S128-T130 PolarHBondContact O-N 3.04Å; S128-T130 VanDerWaalsContact O-N 3.1Å; T130-N132 PolarHBondContact O-N 3.31Å
131	T	32.8	Very low	41.8	Very low	143 Å²	143	129.2 Å²	129.2	88%	0.877	71%	0.712	S	S	*	*			trans	-70.4	100.7	-174.2	50.4	0	0	0	0	112.8
132	N	28.8	Very low	44.4	Very low	147 Å²	147	128.4 Å²	128.4	79%	0.786	70%	0.7	S	S	*	*			trans	-127	140.8	152.9	-82.5	-44.8	0	0	0	108.5	T130 A134	T130-N132 PolarHBondContact O-N 3.31Å; N132-A134 PolarHBondContact O-N 2.73Å
133	P	35.8	Very low	46.9	Very low	116 Å²	116	123.1 Å²	123.1	75%	0.753	67%	0.672	S	S	*	*			trans	-74	110.7	178.9	29.6	-32.7	0	0	0	110.1	L135	P133-L135 PolarHBondContact O-N 2.83Å
134	A	35.5	Very low	49.4	Very low	99 Å²	99	116.9 Å²	116.9	82%	0.818	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-59.8	123.2	170	0	0	0	0	0	109.9	N132	N132-A134 PolarHBondContact O-N 2.73Å
135	L	43.4	Very low	51.9	Low	112 Å²	112	108.3 Å²	108.3	59%	0.586	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-69.3	149.2	165.2	-103.1	65.3	0	0	0	109	P133 A139	P133-L135 PolarHBondContact O-N 2.83Å; L135-A139 HydrophobicContact CB-CB 4.47Å; L135-A139 HydrophobicContact CD2-CB 4.18Å
136	P	46.8	Very low	54.4	Low	93 Å²	93	108.2 Å²	108.2	60%	0.604	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-63.4	144.6	175.3	27.6	-34.5	0	0	0	110.8	D138 A139	P136-D138 PolarHBondContact O-N 2.75Å; P136-A139 VanDerWaalsContact O-CB 3.24Å; P136-A139 WeakPolarHBondContact O-CB 3.32Å; P136-A139 PolarHBondContact O-N 2.88Å
137	S	51.8	Low	56.5	Low	91 Å²	91	99.9 Å²	99.9	64%	0.636	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.4	-22.8	-176.9	-152.4	0	0	0	0	114.1	A139	S137-A139 VanDerWaalsContact C-N 3.31Å; S137-A139 PolarHBondContact O-N 2.87Å
138	D	57.3	Low	58.8	Low	134 Å²	134	97.4 Å²	97.4	72%	0.717	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	13.6	179.6	-56.3	-49.3	0	0	0	114.2	P136 I140	P136-D138 PolarHBondContact O-N 2.75Å; D138-I140 PolarHBondContact O-N 2.81Å
139	A	68.8	Low	60.7	Low	23 Å²	23	95 Å²	95	19%	0.19	55%	0.545	C	S	.	.			trans	-71.8	80.1	-175.7	0	0	0	0	0	113.3	L135 P136 S137 R141 P219	L135-A139 HydrophobicContact CB-CB 4.47Å; L135-A139 HydrophobicContact CD2-CB 4.18Å; P136-A139 VanDerWaalsContact O-CB 3.24Å; P136-A139 WeakPolarHBondContact O-CB 3.32Å; P136-A139 PolarHBondContact O-N 2.88Å; S137-A139 VanDerWaalsContact C-N 3.31Å; S137-A139 PolarHBondContact O-N 2.87Å; A139-R141 PolarHBondContact O-N 2.88Å; A139-R141 VanDerWaalsContact O-N 3.13Å; A139-P219 WeakPolarHBondContact O-CD 3.32Å
140	I	79.4	Confident	62.2	Low	99 Å²	99	89.8 Å²	89.8	51%	0.508	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-55.6	117.1	176.8	-58.9	175.9	0	0	0	110.9	D138 K216 I217 L218	D138-I140 PolarHBondContact O-N 2.81Å; I140-K216 HydrophobicContact CG2-CB 3.8Å; I140-K216 HydrophobicContact CG2-CD 4.21Å; I140-K216 HydrophobicContact CG2-CG 4.34Å; I140-I217 CarbonylContact C-O 3.56Å; I140-I217 WeakPolarHBondContact CA-O 3.36Å; I140-L218 HydrophobicContact CG1-CD1 4.41Å
141	R	85.2	Confident	64.5	Low	91 Å²	91	88 Å²	88	34%	0.343	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	131.3	176.6	-178.2	174.3	174.4	-125.1	-2.3	109.3	A139 V143 L180 I217 P219	A139-R141 PolarHBondContact O-N 2.88Å; A139-R141 VanDerWaalsContact O-N 3.13Å; R141-V143 HydrophobicContact CG-CG2 4.1Å; R141-L180 PolarHBondContact NH1-O 3.28Å; R141-L180 PolarHBondContact NH2-O 2.84Å; R141-I217 HydrophobicContact CB-CD1 4.47Å; R141-I217 HydrophobicContact CB-CG1 3.92Å; R141-I217 HydrophobicContact CG-CG1 4.46Å; R141-I217 PolarHBondContact N-O 3.49Å; R141-I217 WeakPolarHBondContact O-CG1 3.35Å; R141-I217 PolarHBondContact O-N 2.82Å; R141-P219 HydrophobicContact CB-CG 4.35Å
142	M	84.3	Confident	66.5	Low	127 Å²	127	88.6 Å²	88.6	63%	0.626	52%	0.515	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	132.1	171.4	-59.2	-143.7	-57.7	0	0	110.5	L215 K216	M142-L215 CarbonylContact C-O 3.6Å; M142-L215 WeakPolarHBondContact CA-O 3.32Å; M142-K216 HydrophobicContact CG-CG 4.04Å; M142-K216 HydrophobicContact SD-CD 4.21Å; M142-K216 HydrophobicContact SD-CG 3.87Å
143	V	84.9	Confident	68.6	Low	5 Å²	5	82 Å²	82	3%	0.03	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	119.6	-175.8	-179	0	0	0	0	109.6	R141 I145 L180 L181 L215 I217	R141-V143 HydrophobicContact CG-CG2 4.1Å; V143-I145 HydrophobicContact CG1-CD1 3.74Å; V143-I145 HydrophobicContact CG1-CG1 3.94Å; V143-L180 HydrophobicContact CG1-CB 3.67Å; V143-L180 HydrophobicContact CG1-CD1 4.02Å; V143-L180 HydrophobicContact CG1-CG 4.37Å; V143-L181 HydrophobicContact CB-CD2 4.15Å; V143-L181 HydrophobicContact CG1-CD2 3.93Å; V143-L181 HydrophobicContact CG2-CD2 4.06Å; V143-L215 PolarHBondContact N-O 2.95Å; V143-L215 PolarHBondContact O-N 2.95Å; V143-I217 HydrophobicContact CG2-CD1 3.84Å; V143-I217 HydrophobicContact CG2-CG1 4.22Å
144	G	84.1	Confident	70.6	Confident	45 Å²	45	77 Å²	77	46%	0.464	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	111	174.8	0	0	0	0	0	111.2	V213	G144-V213 WeakPolarHBondContact CA-O 3.46Å
145	I	83.5	Confident	72.8	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	131.9	179.9	-71.1	135.9	0	0	0	109.7	V143 L153 I174 I175 L180 L181 I212 V213 L215	V143-I145 HydrophobicContact CG1-CD1 3.74Å; V143-I145 HydrophobicContact CG1-CG1 3.94Å; I145-L153 HydrophobicContact CG2-CD2 3.65Å; I145-I174 HydrophobicContact CG2-CG2 4.05Å; I145-I175 HydrophobicContact CB-CD1 4.39Å; I145-I175 HydrophobicContact CD1-CD1 3.62Å; I145-I175 HydrophobicContact CG1-CD1 3.67Å; I145-I175 HydrophobicContact CG2-CD1 3.81Å; I145-L180 HydrophobicContact CG1-CD1 4.42Å; I145-L181 HydrophobicContact CD1-CD1 3.83Å; I145-L181 HydrophobicContact CD1-CD2 4.32Å; I145-L181 HydrophobicContact CD1-CG 4.13Å; I145-I212 WeakPolarHBondContact O-CA 3.46Å; I145-V213 PolarHBondContact N-O 2.98Å; I145-V213 PolarHBondContact O-N 3.14Å; I145-L215 HydrophobicContact CD1-CD1 3.41Å; I145-L215 VanDerWaalsContact CD1-CD1 3.41Å; I145-L215 HydrophobicContact CD1-CG 3.96Å
146	R	81.1	Confident	74.5	Confident	195 Å²	195	70.9 Å²	70.9	74%	0.736	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	119.1	175	-167.8	179.5	-178	-153.6	-0.6	110	I174 G211	R146-I174 WeakPolarHBondContact O-CG2 3.46Å; R146-G211 CarbonylContact C-O 3.58Å; R146-G211 WeakPolarHBondContact CA-O 3.24Å
147	K	79.9	Confident	76.2	Confident	10 Å²	10	69.7 Å²	69.7	4%	0.043	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	137.1	-176	178.2	178.1	-179.9	-67.3	0	111.4	E151 L153 L206 A209 G211 V213	K147-E151 WeakPolarHBondContact CE-O 3.45Å; K147-E151 PolarHBondContact NZ-O 3.2Å; K147-L153 HydrophobicContact CB-CD2 4.03Å; K147-L153 HydrophobicContact CD-CD2 3.96Å; K147-L153 HydrophobicContact CD-CG 4.35Å; K147-L153 HydrophobicContact CG-CD2 4.04Å; K147-L206 WeakPolarHBondContact CE-O 3.43Å; K147-L206 PolarHBondContact NZ-O 3.3Å; K147-A209 PolarHBondContact NZ-O 3.1Å; K147-G211 PolarHBondContact N-O 3.49Å; K147-G211 PolarHBondContact O-N 3.38Å; K147-V213 HydrophobicContact CB-CG2 4.18Å; K147-V213 HydrophobicContact CD-CG2 4.24Å
148	V	78.5	Confident	77.6	Confident	88 Å²	88	69.3 Å²	69.3	53%	0.533	38%	0.379	S	S	.	.			trans	-88.7	151.5	172	-171.4	0	0	0	0	110.5	G150 E151	V148-G150 PolarHBondContact O-N 3.26Å; V148-E151 HydrophobicContact CB-CB 4.07Å; V148-E151 WeakPolarHBondContact CB-OE2 3.19Å; V148-E151 VanDerWaalsContact CG2-OE2 3.29Å; V148-E151 WeakPolarHBondContact CG2-OE2 3.45Å; V148-E151 PolarHBondContact O-N 2.81Å
149	A	71.1	Confident	78.8	Confident	65 Å²	65	66.9 Å²	66.9	54%	0.537	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	133.1	172.6	0	0	0	0	0	110.7	E151 S210	A149-E151 PolarHBondContact O-N 3.17Å; A149-S210 PolarHBondContact N-OG 3.24Å
150	G	66.3	Low	79.1	Confident	74 Å²	74	70.3 Å²	70.3	76%	0.763	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	-11.6	-178.1	0	0	0	0	0	116	V148	V148-G150 PolarHBondContact O-N 3.26Å
151	E	74.4	Confident	78.7	Confident	92 Å²	92	70.1 Å²	70.1	43%	0.43	40%	0.403	S	S	.	.			trans	-87.2	143	178.4	-165.3	176	-157.2	0	0	111.6	K147 V148 A149 I174	K147-E151 WeakPolarHBondContact CE-O 3.45Å; K147-E151 PolarHBondContact NZ-O 3.2Å; V148-E151 HydrophobicContact CB-CB 4.07Å; V148-E151 WeakPolarHBondContact CB-OE2 3.19Å; V148-E151 VanDerWaalsContact CG2-OE2 3.29Å; V148-E151 WeakPolarHBondContact CG2-OE2 3.45Å; V148-E151 PolarHBondContact O-N 2.81Å; A149-E151 PolarHBondContact O-N 3.17Å; E151-I174 HydrophobicContact CG-CD1 3.93Å
152	H	75.3	Confident	78.1	Confident	154 Å²	154	68 Å²	68	71%	0.713	41%	0.409	S	S	*	.			trans	-89.2	145.6	174.9	-61.5	-70.9	0	0	0	111	G154	H152-G154 PolarHBondContact O-N 2.87Å; H152-G154 VanDerWaalsContact O-N 3.15Å
153	L	74.1	Confident	77.9	Confident	10 Å²	10	64.7 Å²	64.7	5%	0.052	39%	0.392	C	S	.	.			trans	-65	-17.2	178.4	-70.4	-173.2	0	0	0	114.2	I145 K147 V155 I174 I175 L206	I145-L153 HydrophobicContact CG2-CD2 3.65Å; K147-L153 HydrophobicContact CB-CD2 4.03Å; K147-L153 HydrophobicContact CD-CD2 3.96Å; K147-L153 HydrophobicContact CD-CG 4.35Å; K147-L153 HydrophobicContact CG-CD2 4.04Å; L153-V155 HydrophobicContact CB-CG2 3.94Å; L153-I174 HydrophobicContact CD2-CB 4.5Å; L153-I174 HydrophobicContact CD2-CD1 4.11Å; L153-I174 HydrophobicContact CD2-CG2 4.35Å; L153-I174 PolarHBondContact O-N 3.44Å; L153-I175 HydrophobicContact CB-CG1 4.07Å; L153-I175 WeakPolarHBondContact O-CG1 3.43Å; L153-I175 PolarHBondContact O-N 3.41Å; L153-L206 HydrophobicContact CD1-CD1 4.04Å; L153-L206 HydrophobicContact CD1-CD2 3.8Å
154	G	77.8	Confident	77.7	Confident	9 Å²	9	64.5 Å²	64.5	9%	0.093	39%	0.391	C	S	.	.	S	Bend	trans	77.1	37.5	-175.3	0	0	0	0	0	113	H152 L170	H152-G154 PolarHBondContact O-N 2.87Å; H152-G154 VanDerWaalsContact O-N 3.15Å; G154-L170 WeakPolarHBondContact O-CB 3.32Å; G154-L170 PolarHBondContact O-N 2.74Å
155	V	79.9	Confident	77.8	Confident	22 Å²	22	63 Å²	63	13%	0.133	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	151.8	177	-67.5	0	0	0	0	110.9	L153 F157 R168 I169 I175	L153-V155 HydrophobicContact CB-CG2 3.94Å; V155-F157 HydrophobicContact CB-CZ 4.39Å; V155-F157 HydrophobicContact CG2-CE1 3.93Å; V155-F157 HydrophobicContact CG2-CE2 3.96Å; V155-F157 HydrophobicContact CG2-CZ 3.37Å; V155-R168 CarbonylContact C-O 3.55Å; V155-R168 WeakPolarHBondContact CA-O 3.41Å; V155-I169 HydrophobicContact CG1-CB 4.36Å; V155-I169 HydrophobicContact CG1-CG1 4.01Å; V155-I169 HydrophobicContact CG1-CG2 4.16Å; V155-I175 HydrophobicContact CG1-CB 3.75Å; V155-I175 HydrophobicContact CG1-CG1 3.7Å; V155-I175 HydrophobicContact CG1-CG2 3.86Å
156	T	79.5	Confident	77.9	Confident	62 Å²	62	63 Å²	63	38%	0.38	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	150.7	168.6	66.9	0	0	0	0	110.3	A167 R168	T156-A167 PolarHBondContact O-N 2.87Å; T156-R168 PolarHBondContact N-O 3.02Å; T156-R168 PolarHBondContact O-N 2.74Å; T156-R168 WeakPolarHBondContact OG1-CB 3.36Å; T156-R168 PolarHBondContact OG1-N 3.26Å
157	F	82.2	Confident	77.8	Confident	67 Å²	67	55.3 Å²	55.3	29%	0.294	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	146.6	-177.8	-51.4	-74.9	0	0	0	110.4	V155 L164 V165 I166 I187 L202 L206	V155-F157 HydrophobicContact CB-CZ 4.39Å; V155-F157 HydrophobicContact CG2-CE1 3.93Å; V155-F157 HydrophobicContact CG2-CE2 3.96Å; V155-F157 HydrophobicContact CG2-CZ 3.37Å; F157-L164 HydrophobicContact CB-CD1 3.8Å; F157-V165 CarbonylContact C-O 3.53Å; F157-V165 VanDerWaalsContact CA-O 3.31Å; F157-V165 WeakPolarHBondContact CA-O 3.34Å; F157-I166 HydrophobicContact CD1-CG1 4.02Å; F157-I166 HydrophobicContact CE1-CD1 4.48Å; F157-I166 HydrophobicContact CE1-CG1 3.9Å; F157-I187 HydrophobicContact CD1-CD1 4.16Å; F157-I187 HydrophobicContact CE1-CD1 3.43Å; F157-I187 VanDerWaalsContact CE1-CD1 3.43Å; F157-I187 HydrophobicContact CE1-CG1 4.49Å; F157-I187 HydrophobicContact CZ-CD1 4.04Å; F157-L202 HydrophobicContact CD1-CD2 4.12Å; F157-L202 HydrophobicContact CD2-CD2 3.66Å; F157-L202 HydrophobicContact CE1-CD2 4.09Å; F157-L202 HydrophobicContact CE2-CD2 3.61Å; F157-L202 HydrophobicContact CE2-CG 4.45Å; F157-L202 HydrophobicContact CG-CD2 3.92Å; F157-L202 HydrophobicContact CZ-CD2 3.83Å; F157-L206 HydrophobicContact CE2-CD1 4.15Å; F157-L206 HydrophobicContact CZ-CD1 4.27Å
158	K	82.8	Confident	77.7	Confident	84 Å²	84	60.5 Å²	60.5	37%	0.365	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	152.9	169.7	62.2	-173.8	178.7	152.2	0	109.1	E160 V165 A167	K158-E160 HydrophobicContact CD-CG 4.19Å; K158-E160 WeakPolarHBondContact CD-OE1 3.23Å; K158-E160 WeakPolarHBondContact CE-OE1 3.42Å; K158-E160 WeakPolarHBondContact CE-OE2 3.35Å; K158-E160 HydrophobicContact CG-CG 4.21Å; K158-E160 IonicContact NZ-OE1 2.95Å; K158-E160 PolarHBondContact NZ-OE1 3.37Å; K158-E160 IonicContact NZ-OE2 2.71Å; K158-E160 PolarHBondContact NZ-OE2 3.35Å; K158-V165 HydrophobicContact CG-CB 3.95Å; K158-V165 PolarHBondContact N-O 2.86Å; K158-V165 PolarHBondContact O-N 2.9Å; K158-A167 HydrophobicContact CB-CB 3.96Å; K158-A167 HydrophobicContact CD-CB 3.85Å; K158-A167 HydrophobicContact CG-CB 3.81Å
159	V	81.8	Confident	77.7	Confident	82 Å²	82	58.2 Å²	58.2	50%	0.497	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	117.5	172.1	-179.9	0	0	0	0	108.1	E163 L164 P199	V159-E163 WeakPolarHBondContact CA-O 3.43Å; V159-L164 HydrophobicContact CG2-CD1 4.07Å; V159-P199 HydrophobicContact CG2-CB 4.11Å; V159-P199 HydrophobicContact CG2-CG 3.91Å
160	E	76.1	Confident	77.9	Confident	95 Å²	95	59.3 Å²	59.3	44%	0.444	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	130.6	179.7	-73.5	178.6	158.5	0	0	109	K158 G162 E163 V165	K158-E160 HydrophobicContact CD-CG 4.19Å; K158-E160 WeakPolarHBondContact CD-OE1 3.23Å; K158-E160 WeakPolarHBondContact CE-OE1 3.42Å; K158-E160 WeakPolarHBondContact CE-OE2 3.35Å; K158-E160 HydrophobicContact CG-CG 4.21Å; K158-E160 IonicContact NZ-OE1 2.95Å; K158-E160 PolarHBondContact NZ-OE1 3.37Å; K158-E160 IonicContact NZ-OE2 2.71Å; K158-E160 PolarHBondContact NZ-OE2 3.35Å; E160-G162 PolarHBondContact O-N 3.12Å; E160-E163 PolarHBondContact N-O 3.28Å; E160-E163 WeakPolarHBondContact O-CB 3.43Å; E160-E163 PolarHBondContact O-N 2.75Å; E160-V165 HydrophobicContact CB-CG2 4.25Å
161	G	70.6	Confident	77.9	Confident	96 Å²	96	61.3 Å²	61.3	99%	0.99	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	1.3	-176.4	0	0	0	0	0	116.2
162	G	71.8	Confident	77.6	Confident	45 Å²	45	59 Å²	59	46%	0.464	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	93	11.5	-167.2	0	0	0	0	0	113.9	E160	E160-G162 PolarHBondContact O-N 3.12Å
163	E	80.2	Confident	77.7	Confident	58 Å²	58	52.3 Å²	52.3	27%	0.271	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	151.8	177	-66.5	-67.2	170.7	0	0	111.1	V159 E160 I186 K188	V159-E163 WeakPolarHBondContact CA-O 3.43Å; E160-E163 PolarHBondContact N-O 3.28Å; E160-E163 WeakPolarHBondContact O-CB 3.43Å; E160-E163 PolarHBondContact O-N 2.75Å; E163-I186 HydrophobicContact CB-CG2 3.85Å; E163-I186 HydrophobicContact CG-CG2 4.45Å; E163-I186 WeakPolarHBondContact OE2-CG2 3.48Å; E163-K188 IonicContact OE1-NZ 3.82Å; E163-K188 PolarHBondContact OE1-NZ 2.94Å; E163-K188 WeakPolarHBondContact OE2-CE 3.47Å; E163-K188 IonicContact OE2-NZ 3.81Å; E163-K188 PolarHBondContact OE2-NZ 3.15Å
164	L	81.6	Confident	77.9	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	92.3	-172	-170.6	48.8	0	0	0	111.5	F157 V159 I187 V195 P199 L202	F157-L164 HydrophobicContact CB-CD1 3.8Å; V159-L164 HydrophobicContact CG2-CD1 4.07Å; L164-I187 PolarHBondContact O-N 2.83Å; L164-V195 HydrophobicContact CD2-CB 4.14Å; L164-V195 HydrophobicContact CD2-CG2 4.01Å; L164-P199 HydrophobicContact CD1-CB 3.91Å; L164-P199 HydrophobicContact CD2-CB 4.25Å; L164-L202 HydrophobicContact CD2-CB 3.93Å; L164-L202 HydrophobicContact CD2-CD2 3.5Å; L164-L202 HydrophobicContact CD2-CG 4.29Å; L164-L202 HydrophobicContact CG-CD2 4.09Å
165	V	85.2	Confident	78	Confident	12 Å²	12	52 Å²	52	7%	0.073	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	139	-168.1	-169.3	0	0	0	0	111.2	F157 K158 E160 A167 I186	F157-V165 CarbonylContact C-O 3.53Å; F157-V165 VanDerWaalsContact CA-O 3.31Å; F157-V165 WeakPolarHBondContact CA-O 3.34Å; K158-V165 HydrophobicContact CG-CB 3.95Å; K158-V165 PolarHBondContact N-O 2.86Å; K158-V165 PolarHBondContact O-N 2.9Å; E160-V165 HydrophobicContact CB-CG2 4.25Å; V165-A167 PolarHBondContact O-N 2.84Å; V165-I186 HydrophobicContact CG2-CG1 4.35Å
166	I	85.5	Confident	77.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	115.6	170.4	-60.8	-175.9	0	0	0	109.4	F157 I169 L181 G184 D185	F157-I166 HydrophobicContact CD1-CG1 4.02Å; F157-I166 HydrophobicContact CE1-CD1 4.48Å; F157-I166 HydrophobicContact CE1-CG1 3.9Å; I166-I169 HydrophobicContact CG2-CG1 4.11Å; I166-L181 HydrophobicContact CD1-CB 3.73Å; I166-L181 HydrophobicContact CD1-CD1 3.74Å; I166-L181 HydrophobicContact CD1-CG 4.25Å; I166-G184 PolarHBondContact O-N 3.3Å; I166-D185 HydrophobicContact CD1-CB 4.02Å; I166-D185 HydrophobicContact CG1-CB 4.41Å; I166-D185 PolarHBondContact N-O 3.04Å
167	A	79.1	Confident	77.7	Confident	35 Å²	35	58.1 Å²	58.1	29%	0.289	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	-36.2	-176.6	0	0	0	0	0	113	T156 K158 V165 V183	T156-A167 PolarHBondContact O-N 2.87Å; K158-A167 HydrophobicContact CB-CB 3.96Å; K158-A167 HydrophobicContact CD-CB 3.85Å; K158-A167 HydrophobicContact CG-CB 3.81Å; V165-A167 PolarHBondContact O-N 2.84Å; A167-V183 WeakPolarHBondContact O-CG1 3.4Å
168	R	77.3	Confident	77.5	Confident	118 Å²	118	58.4 Å²	58.4	45%	0.445	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	147	179.6	-175.1	175.2	-80.8	-155.4	-13.8	110.6	V155 T156 D267	V155-R168 CarbonylContact C-O 3.55Å; V155-R168 WeakPolarHBondContact CA-O 3.41Å; T156-R168 PolarHBondContact N-O 3.02Å; T156-R168 PolarHBondContact O-N 2.74Å; T156-R168 WeakPolarHBondContact OG1-CB 3.36Å; T156-R168 PolarHBondContact OG1-N 3.26Å; R168-D267 IonicContact CZ-OD2 2.66Å; R168-D267 IonicContact NH1-OD2 2.74Å; R168-D267 PolarHBondContact NH1-OD2 3.19Å; R168-D267 IonicContact NH2-OD1 2.75Å; R168-D267 IonicContact NH2-OD2 2.75Å; R168-D267 PolarHBondContact NH2-OD2 3.27Å
169	I	80.1	Confident	77.1	Confident	40 Å²	40	56.6 Å²	56.6	21%	0.205	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	136.3	168	-52.7	177.3	0	0	0	107.5	V155 I166 I175 D176 L181 V183	V155-I169 HydrophobicContact CG1-CB 4.36Å; V155-I169 HydrophobicContact CG1-CG1 4.01Å; V155-I169 HydrophobicContact CG1-CG2 4.16Å; I166-I169 HydrophobicContact CG2-CG1 4.11Å; I169-I175 HydrophobicContact CD1-CG2 4.08Å; I169-I175 HydrophobicContact CG2-CB 4.28Å; I169-I175 HydrophobicContact CG2-CG2 4.09Å; I169-D176 HydrophobicContact CG2-CB 3.93Å; I169-L181 WeakPolarHBondContact CD1-O 3.3Å; I169-V183 HydrophobicContact CD1-CG2 4.37Å; I169-V183 HydrophobicContact CG1-CG2 3.99Å
170	L	74.1	Confident	77	Confident	88 Å²	88	55.2 Å²	55.2	46%	0.461	33%	0.332	S	S	.	.			trans	-92.3	121.6	179.4	-58	-178.7	0	0	0	109.5	G154 G172 G173	G154-L170 WeakPolarHBondContact O-CB 3.32Å; G154-L170 PolarHBondContact O-N 2.74Å; L170-G172 PolarHBondContact O-N 3.48Å; L170-G173 PolarHBondContact O-N 3.1Å
171	H	66.9	Low	77.3	Confident	116 Å²	116	50.9 Å²	50.9	54%	0.537	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	135.8	-177.5	-167.1	48.9	0	0	0	111.7	G173 D176	H171-G173 VanDerWaalsContact C-N 3.28Å; H171-G173 PolarHBondContact O-N 2.87Å; H171-D176 IonicContact CE1-OD1 3.27Å; H171-D176 IonicContact CE1-OD2 3.47Å; H171-D176 IonicContact CG-OD1 2.66Å; H171-D176 IonicContact CG-OD2 2.67Å; H171-D176 VanDerWaalsContact ND1-CG 3.31Å; H171-D176 IonicContact ND1-OD1 3.08Å; H171-D176 PolarHBondContact ND1-OD1 3.07Å; H171-D176 IonicContact ND1-OD2 2.75Å; H171-D176 PolarHBondContact ND1-OD2 3.45Å
172	G	68.1	Low	77.8	Confident	43 Å²	43	49.8 Å²	49.8	44%	0.443	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	-6.6	-171.4	0	0	0	0	0	115.3	L170 D176 Q177	L170-G172 PolarHBondContact O-N 3.48Å; G172-D176 PolarHBondContact N-OD2 2.88Å; G172-Q177 PolarHBondContact O-NE2 3.41Å
173	G	76.3	Confident	78.4	Confident	15 Å²	15	51.5 Å²	51.5	16%	0.155	28%	0.282	C	S	.	.	S	Bend	trans	-72.4	169.1	175.3	0	0	0	0	0	114	L170 H171 I175 D176 Q177	L170-G173 PolarHBondContact O-N 3.1Å; H171-G173 VanDerWaalsContact C-N 3.28Å; H171-G173 PolarHBondContact O-N 2.87Å; G173-I175 VanDerWaalsContact C-N 3.27Å; G173-I175 PolarHBondContact O-N 2.91Å; G173-D176 PolarHBondContact O-N 3.35Å; G173-Q177 WeakPolarHBondContact O-CG 3.18Å; G173-Q177 PolarHBondContact O-N 3.24Å
174	I	78.4	Confident	78.3	Confident	12 Å²	12	49.7 Å²	49.7	6%	0.062	28%	0.279	C	S	.	.	H	α-helix	trans	-53	-44.1	-178.4	-60.5	176.8	0	0	0	111.8	I145 R146 E151 L153 Q178	I145-I174 HydrophobicContact CG2-CG2 4.05Å; R146-I174 WeakPolarHBondContact O-CG2 3.46Å; E151-I174 HydrophobicContact CG-CD1 3.93Å; L153-I174 HydrophobicContact CD2-CB 4.5Å; L153-I174 HydrophobicContact CD2-CD1 4.11Å; L153-I174 HydrophobicContact CD2-CG2 4.35Å; L153-I174 PolarHBondContact O-N 3.44Å; I174-Q178 VanDerWaalsContact CG2-NE2 3.27Å; I174-Q178 WeakPolarHBondContact O-CB 3.4Å; I174-Q178 VanDerWaalsContact O-CG 3.27Å; I174-Q178 WeakPolarHBondContact O-CG 3.26Å; I174-Q178 PolarHBondContact O-N 3.11Å; I174-Q178 VanDerWaalsContact O-N 3.13Å
175	I	80.8	Confident	78.5	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-71.7	-40.6	-178.4	-62.5	-55.4	0	0	0	112.2	I145 L153 V155 I169 G173 Q178 G179 L181	I145-I175 HydrophobicContact CB-CD1 4.39Å; I145-I175 HydrophobicContact CD1-CD1 3.62Å; I145-I175 HydrophobicContact CG1-CD1 3.67Å; I145-I175 HydrophobicContact CG2-CD1 3.81Å; L153-I175 HydrophobicContact CB-CG1 4.07Å; L153-I175 WeakPolarHBondContact O-CG1 3.43Å; L153-I175 PolarHBondContact O-N 3.41Å; V155-I175 HydrophobicContact CG1-CB 3.75Å; V155-I175 HydrophobicContact CG1-CG1 3.7Å; V155-I175 HydrophobicContact CG1-CG2 3.86Å; I169-I175 HydrophobicContact CD1-CG2 4.08Å; I169-I175 HydrophobicContact CG2-CB 4.28Å; I169-I175 HydrophobicContact CG2-CG2 4.09Å; G173-I175 VanDerWaalsContact C-N 3.27Å; G173-I175 PolarHBondContact O-N 2.91Å; I175-Q178 PolarHBondContact O-N 3.44Å; I175-G179 PolarHBondContact O-N 2.65Å; I175-L181 HydrophobicContact CD1-CD1 3.72Å; I175-L181 HydrophobicContact CD1-CG 4.26Å; I175-L181 HydrophobicContact CG1-CD1 4.13Å; I175-L181 HydrophobicContact CG2-CB 3.76Å; I175-L181 HydrophobicContact CG2-CD1 4.09Å; I175-L181 HydrophobicContact CG2-CG 4.12Å
176	D	75.8	Confident	78.6	Confident	59 Å²	59	50.8 Å²	50.8	32%	0.316	28%	0.284	S	S	.	.	H	α-helix	trans	-61.7	-43.2	175.6	177	89.3	0	0	0	111.4	I169 H171 G172 G173 Q178	I169-D176 HydrophobicContact CG2-CB 3.93Å; H171-D176 IonicContact CE1-OD1 3.27Å; H171-D176 IonicContact CE1-OD2 3.47Å; H171-D176 IonicContact CG-OD1 2.66Å; H171-D176 IonicContact CG-OD2 2.67Å; H171-D176 VanDerWaalsContact ND1-CG 3.31Å; H171-D176 IonicContact ND1-OD1 3.08Å; H171-D176 PolarHBondContact ND1-OD1 3.07Å; H171-D176 IonicContact ND1-OD2 2.75Å; H171-D176 PolarHBondContact ND1-OD2 3.45Å; G172-D176 PolarHBondContact N-OD2 2.88Å; G173-D176 PolarHBondContact O-N 3.35Å; D176-Q178 VanDerWaalsContact C-N 3.32Å; D176-Q178 PolarHBondContact O-N 2.91Å
177	Q	77.4	Confident	78.6	Confident	152 Å²	152	50.9 Å²	50.9	71%	0.71	29%	0.285	S	S	*	.	H	α-helix	trans	-66.7	-29.4	174.9	-67.8	-179.4	35	0	0	113.8	G172 G173	G172-Q177 PolarHBondContact O-NE2 3.41Å; G173-Q177 WeakPolarHBondContact O-CG 3.18Å; G173-Q177 PolarHBondContact O-N 3.24Å
178	Q	77.4	Confident	78.9	Confident	73 Å²	73	51.9 Å²	51.9	34%	0.341	28%	0.282	S	S	.	.	H	α-helix	trans	-92	-23.5	-177.4	-71.8	175.9	23.5	0	0	113.1	I174 I175 D176 L180	I174-Q178 VanDerWaalsContact CG2-NE2 3.27Å; I174-Q178 WeakPolarHBondContact O-CB 3.4Å; I174-Q178 VanDerWaalsContact O-CG 3.27Å; I174-Q178 WeakPolarHBondContact O-CG 3.26Å; I174-Q178 PolarHBondContact O-N 3.11Å; I174-Q178 VanDerWaalsContact O-N 3.13Å; I175-Q178 PolarHBondContact O-N 3.44Å; D176-Q178 VanDerWaalsContact C-N 3.32Å; D176-Q178 PolarHBondContact O-N 2.91Å; Q178-L180 HydrophobicContact CB-CD1 4.1Å; Q178-L180 HydrophobicContact CB-CG 4.03Å; Q178-L180 PolarHBondContact O-N 3.34Å
179	G	74.2	Confident	79.4	Confident	46 Å²	46	48.6 Å²	48.6	47%	0.474	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	24.9	179.3	0	0	0	0	0	114.1	I175	I175-G179 PolarHBondContact O-N 2.65Å
180	L	79.4	Confident	79.6	Confident	54 Å²	54	46.7 Å²	46.7	28%	0.283	26%	0.262	S	S	.	.			trans	-93.8	-24	-171.2	-69.4	178.5	0	0	0	114.2	R141 V143 I145 Q178	R141-L180 PolarHBondContact NH1-O 3.28Å; R141-L180 PolarHBondContact NH2-O 2.84Å; V143-L180 HydrophobicContact CG1-CB 3.67Å; V143-L180 HydrophobicContact CG1-CD1 4.02Å; V143-L180 HydrophobicContact CG1-CG 4.37Å; I145-L180 HydrophobicContact CG1-CD1 4.42Å; Q178-L180 HydrophobicContact CB-CD1 4.1Å; Q178-L180 HydrophobicContact CB-CG 4.03Å; Q178-L180 PolarHBondContact O-N 3.34Å
181	L	83.8	Confident	80	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.016	26%	0.258	C	S	.	.			trans	-123.8	153.7	177.3	-49.6	174.4	0	0	0	109.3	V143 I145 I166 I169 I175 D185 L215 I217	V143-L181 HydrophobicContact CB-CD2 4.15Å; V143-L181 HydrophobicContact CG1-CD2 3.93Å; V143-L181 HydrophobicContact CG2-CD2 4.06Å; I145-L181 HydrophobicContact CD1-CD1 3.83Å; I145-L181 HydrophobicContact CD1-CD2 4.32Å; I145-L181 HydrophobicContact CD1-CG 4.13Å; I166-L181 HydrophobicContact CD1-CB 3.73Å; I166-L181 HydrophobicContact CD1-CD1 3.74Å; I166-L181 HydrophobicContact CD1-CG 4.25Å; I169-L181 WeakPolarHBondContact CD1-O 3.3Å; I175-L181 HydrophobicContact CD1-CD1 3.72Å; I175-L181 HydrophobicContact CD1-CG 4.26Å; I175-L181 HydrophobicContact CG1-CD1 4.13Å; I175-L181 HydrophobicContact CG2-CB 3.76Å; I175-L181 HydrophobicContact CG2-CD1 4.09Å; I175-L181 HydrophobicContact CG2-CG 4.12Å; L181-D185 WeakPolarHBondContact CA-OD2 3.36Å; L181-L215 HydrophobicContact CD1-CD1 3.77Å; L181-L215 HydrophobicContact CD2-CD1 4.16Å; L181-I217 HydrophobicContact CD2-CD1 3.83Å; L181-I217 HydrophobicContact CD2-CG2 4.18Å
182	H	81.1	Confident	80.4	Confident	74 Å²	74	43.1 Å²	43.1	34%	0.343	26%	0.262	S	S	.	.			trans	-123.1	162.9	176.9	-55.1	95.9	0	0	0	111.4	G184 D185 T224	H182-G184 PolarHBondContact O-N 3.13Å; H182-D185 PolarHBondContact N-OD2 3.17Å; H182-D185 WeakPolarHBondContact O-CB 3.42Å; H182-D185 PolarHBondContact O-N 3.41Å; H182-T224 HydrophobicContact CB-CG2 4.38Å
183	V	83	Confident	81	Confident	80 Å²	80	47.9 Å²	47.9	49%	0.485	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	134.4	168.6	177.9	0	0	0	0	108.3	A167 I169	A167-V183 WeakPolarHBondContact O-CG1 3.4Å; I169-V183 HydrophobicContact CD1-CG2 4.37Å; I169-V183 HydrophobicContact CG1-CG2 3.99Å
184	G	78	Confident	81.1	Confident	20 Å²	20	51.7 Å²	51.7	21%	0.206	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.2	-19	-173.3	0	0	0	0	0	115.2	I166 H182 I186 S220	I166-G184 PolarHBondContact O-N 3.3Å; H182-G184 PolarHBondContact O-N 3.13Å; G184-I186 PolarHBondContact O-N 3.07Å; G184-S220 VanDerWaalsContact C-CB 3.43Å; G184-S220 WeakPolarHBondContact O-CB 3.47Å
185	D	85.9	Confident	81.1	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.011	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-58.9	137.6	175.3	-76.4	-17.9	0	0	0	110.8	I166 L181 H182 I217 P219 S220	I166-D185 HydrophobicContact CD1-CB 4.02Å; I166-D185 HydrophobicContact CG1-CB 4.41Å; I166-D185 PolarHBondContact N-O 3.04Å; L181-D185 WeakPolarHBondContact CA-OD2 3.36Å; H182-D185 PolarHBondContact N-OD2 3.17Å; H182-D185 WeakPolarHBondContact O-CB 3.42Å; H182-D185 PolarHBondContact O-N 3.41Å; D185-I217 HydrophobicContact CB-CD1 4.26Å; D185-I217 WeakPolarHBondContact OD2-CD1 3.36Å; D185-P219 VanDerWaalsContact OD1-CA 3.32Å; D185-P219 WeakPolarHBondContact OD1-CA 3.42Å; D185-S220 PolarHBondContact OD1-N 3.3Å
186	I	87.4	Confident	80.4	Confident	36 Å²	36	52.3 Å²	52.3	19%	0.185	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	121.6	-178.9	-50.3	-177.7	0	0	0	109.4	E163 V165 G184 I217 L218	E163-I186 HydrophobicContact CB-CG2 3.85Å; E163-I186 HydrophobicContact CG-CG2 4.45Å; E163-I186 WeakPolarHBondContact OE2-CG2 3.48Å; V165-I186 HydrophobicContact CG2-CG1 4.35Å; G184-I186 PolarHBondContact O-N 3.07Å; I186-I217 CarbonylContact O-C 3.59Å; I186-I217 WeakPolarHBondContact O-CA 3.33Å; I186-I217 WeakPolarHBondContact O-CB 3.43Å; I186-L218 HydrophobicContact CB-CB 4.07Å; I186-L218 HydrophobicContact CD1-CD2 4.35Å; I186-L218 PolarHBondContact N-O 2.83Å; I186-L218 PolarHBondContact O-N 3.22Å
187	I	86.6	Confident	79.8	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	120.4	175.8	-54.1	-174.5	0	0	0	109.9	F157 L164 V190 V195 L202 L215 I217	F157-I187 HydrophobicContact CD1-CD1 4.16Å; F157-I187 HydrophobicContact CE1-CD1 3.43Å; F157-I187 VanDerWaalsContact CE1-CD1 3.43Å; F157-I187 HydrophobicContact CE1-CG1 4.49Å; F157-I187 HydrophobicContact CZ-CD1 4.04Å; L164-I187 PolarHBondContact O-N 2.83Å; I187-V190 HydrophobicContact CG2-CG2 3.78Å; I187-V195 HydrophobicContact CB-CG2 4.32Å; I187-V195 HydrophobicContact CG2-CG2 3.66Å; I187-L202 HydrophobicContact CD1-CD2 4.36Å; I187-L215 HydrophobicContact CD1-CD1 4.08Å; I187-I217 HydrophobicContact CG1-CG2 4.13Å
188	K	85.6	Confident	79.4	Confident	56 Å²	56	52.9 Å²	52.9	24%	0.243	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	-46.9	176.2	-66.8	-64.3	-168.4	172.4	0	112.3	E163 D194 V195 K216	E163-K188 IonicContact OE1-NZ 3.82Å; E163-K188 PolarHBondContact OE1-NZ 2.94Å; E163-K188 WeakPolarHBondContact OE2-CE 3.47Å; E163-K188 IonicContact OE2-NZ 3.81Å; E163-K188 PolarHBondContact OE2-NZ 3.15Å; K188-D194 WeakPolarHBondContact O-CA 3.42Å; K188-V195 PolarHBondContact O-N 2.84Å; K188-K216 PolarHBondContact N-O 2.87Å
189	E	86.6	Confident	79	Confident	49 Å²	49	52.2 Å²	52.2	23%	0.229	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	151	178.7	-63.8	174.7	-141.7	0	0	112.8	R193 L215 K216	E189-R193 CarbonylContact C-O 3.54Å; E189-R193 WeakPolarHBondContact CA-O 3.07Å; E189-R193 WeakPolarHBondContact CB-O 3.19Å; E189-L215 CarbonylContact O-C 3.59Å; E189-L215 WeakPolarHBondContact O-CA 3.48Å; E189-K216 HydrophobicContact CB-CB 4Å; E189-K216 HydrophobicContact CB-CD 4.25Å; E189-K216 HydrophobicContact CB-CG 4.11Å; E189-K216 HydrophobicContact CG-CD 4.24Å; E189-K216 PolarHBondContact N-O 2.75Å; E189-K216 PolarHBondContact O-N 3.16Å; E189-K216 WeakPolarHBondContact OE1-CD 3.43Å; E189-K216 IonicContact OE1-NZ 3.55Å; E189-K216 PolarHBondContact OE1-NZ 2.91Å; E189-K216 WeakPolarHBondContact OE2-CD 3.45Å; E189-K216 WeakPolarHBondContact OE2-CE 3.05Å; E189-K216 IonicContact OE2-NZ 3.41Å; E189-K216 PolarHBondContact OE2-NZ 3.27Å
190	V	84.9	Confident	78.8	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	124.5	169.1	-179.5	0	0	0	0	109.7	I187 G192 R193 V195 L202 E205 V213 L215	I187-V190 HydrophobicContact CG2-CG2 3.78Å; V190-G192 PolarHBondContact O-N 3.34Å; V190-R193 PolarHBondContact N-O 2.91Å; V190-R193 PolarHBondContact O-N 3.4Å; V190-V195 HydrophobicContact CB-CG1 4.25Å; V190-V195 HydrophobicContact CG2-CG1 4.07Å; V190-V195 HydrophobicContact CG2-CG2 4.17Å; V190-L202 HydrophobicContact CB-CD1 4.34Å; V190-L202 HydrophobicContact CG2-CD1 3.33Å; V190-E205 HydrophobicContact CG1-CB 4.47Å; V190-V213 HydrophobicContact CG1-CG1 3.78Å; V190-L215 HydrophobicContact CB-CD2 4.13Å; V190-L215 HydrophobicContact CG1-CD2 3.94Å; V190-L215 HydrophobicContact CG2-CD2 3.4Å
191	N	82.3	Confident	78.5	Confident	69 Å²	69	57.5 Å²	57.5	37%	0.369	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	23.3	-177.7	-57.2	-29.7	0	0	0	114.3	E205 V213 V214	N191-E205 PolarHBondContact ND2-OE2 3.09Å; N191-V213 WeakPolarHBondContact OD1-CA 3.25Å; N191-V214 PolarHBondContact N-O 2.91Å; N191-V214 PolarHBondContact OD1-N 3.09Å
192	G	76.4	Confident	78	Confident	61 Å²	61	57.5 Å²	57.5	63%	0.629	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.8	8.2	-176	0	0	0	0	0	115.5	V190	V190-G192 PolarHBondContact O-N 3.34Å
193	R	79.5	Confident	77.5	Confident	142 Å²	142	58.7 Å²	58.7	54%	0.536	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	135.1	164	-56.3	-168.2	-162.5	-113.6	18.9	110.1	E189 V190 E205	E189-R193 CarbonylContact C-O 3.54Å; E189-R193 WeakPolarHBondContact CA-O 3.07Å; E189-R193 WeakPolarHBondContact CB-O 3.19Å; V190-R193 PolarHBondContact N-O 2.91Å; V190-R193 PolarHBondContact O-N 3.4Å; R193-E205 IonicContact CZ-OE1 3.67Å; R193-E205 VanDerWaalsContact NE-CD 3.32Å; R193-E205 IonicContact NE-OE1 2.75Å; R193-E205 PolarHBondContact NE-OE1 3Å; R193-E205 IonicContact NH2-OE1 3.84Å; R193-E205 PolarHBondContact NH2-OE1 3.03Å
194	D	79.1	Confident	77.2	Confident	96 Å²	96	61.4 Å²	61.4	51%	0.513	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	135.6	166.8	-169.9	-18.7	0	0	0	109.9	K188 S196	K188-D194 WeakPolarHBondContact O-CA 3.42Å; D194-S196 VanDerWaalsContact OD1-CB 3.31Å; D194-S196 WeakPolarHBondContact OD1-CB 3.35Å; D194-S196 PolarHBondContact OD1-N 2.9Å; D194-S196 PolarHBondContact OD1-OG 3.38Å; D194-S196 PolarHBondContact OD2-OG 2.96Å
195	V	77.9	Confident	77.1	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.012	31%	0.314	C	S	.	.			trans	-122.4	2.8	178.1	-63.8	0	0	0	0	113.4	L164 I187 K188 V190 Q197 V201 L202	L164-V195 HydrophobicContact CD2-CB 4.14Å; L164-V195 HydrophobicContact CD2-CG2 4.01Å; I187-V195 HydrophobicContact CB-CG2 4.32Å; I187-V195 HydrophobicContact CG2-CG2 3.66Å; K188-V195 PolarHBondContact O-N 2.84Å; V190-V195 HydrophobicContact CB-CG1 4.25Å; V190-V195 HydrophobicContact CG2-CG1 4.07Å; V190-V195 HydrophobicContact CG2-CG2 4.17Å; V195-Q197 VanDerWaalsContact C-N 3.33Å; V195-Q197 PolarHBondContact O-N 3.24Å; V195-V201 HydrophobicContact CG1-CG1 4.3Å; V195-L202 HydrophobicContact CB-CB 4.26Å; V195-L202 HydrophobicContact CG1-CB 4.13Å
196	S	65.4	Low	76.5	Confident	23 Å²	23	62.9 Å²	62.9	16%	0.161	32%	0.318	C	S	.	.	S	Bend	trans	-59	-42.3	179.4	58.9	0	0	0	0	112.4	D194	D194-S196 VanDerWaalsContact OD1-CB 3.31Å; D194-S196 WeakPolarHBondContact OD1-CB 3.35Å; D194-S196 PolarHBondContact OD1-N 2.9Å; D194-S196 PolarHBondContact OD1-OG 3.38Å; D194-S196 PolarHBondContact OD2-OG 2.96Å
197	Q	64.5	Low	75.8	Confident	181 Å²	181	67.1 Å²	67.1	85%	0.846	34%	0.337	S	S	*	.	S	Bend	trans	-83.2	-18.3	-172.6	-61.1	-172.5	3.8	0	0	115.2	V195	V195-Q197 VanDerWaalsContact C-N 3.33Å; V195-Q197 PolarHBondContact O-N 3.24Å
198	D	69.2	Low	75.1	Confident	42 Å²	42	71.1 Å²	71.1	23%	0.225	37%	0.37	C	S	.	.			trans	-152.2	109.9	179.5	-166.3	-21.4	0	0	0	113	R200 V201	D198-R200 PolarHBondContact O-N 3.04Å; D198-R200 VanDerWaalsContact O-N 3.14Å; D198-R200 WeakPolarHBondContact OD1-CB 3.42Å; D198-R200 WeakPolarHBondContact OD1-CG 3.44Å; D198-R200 IonicContact OD1-CZ 2.64Å; D198-R200 PolarHBondContact OD1-N 3.18Å; D198-R200 IonicContact OD1-NE 3.53Å; D198-R200 PolarHBondContact OD1-NE 3.03Å; D198-R200 IonicContact OD1-NH2 2.83Å; D198-R200 IonicContact OD2-CZ 3.75Å; D198-R200 VanDerWaalsContact OD2-CZ 3.27Å; D198-R200 IonicContact OD2-NE 2.65Å; D198-R200 PolarHBondContact OD2-NE 3.28Å; D198-R200 VanDerWaalsContact OD2-NE 3.08Å; D198-R200 IonicContact OD2-NH2 3.25Å; D198-R200 PolarHBondContact OD2-NH2 3.25Å; D198-V201 HydrophobicContact CB-CG2 4.04Å; D198-V201 PolarHBondContact O-N 3.35Å
199	P	67.6	Low	74.5	Confident	59 Å²	59	69.2 Å²	69.2	38%	0.383	37%	0.365	S	S	.	.	H	α-helix	trans	-66.9	-14	179.8	30.5	-38.2	0	0	0	113.7	V159 L164 V201 L202 L203	V159-P199 HydrophobicContact CG2-CB 4.11Å; V159-P199 HydrophobicContact CG2-CG 3.91Å; L164-P199 HydrophobicContact CD1-CB 3.91Å; L164-P199 HydrophobicContact CD2-CB 4.25Å; P199-V201 VanDerWaalsContact C-N 3.35Å; P199-L202 WeakPolarHBondContact O-CB 3.45Å; P199-L202 PolarHBondContact O-N 2.9Å; P199-L203 PolarHBondContact O-N 3.02Å
200	R	70.5	Confident	73.8	Confident	164 Å²	164	70.7 Å²	70.7	62%	0.619	38%	0.381	S	S	*	.	H	α-helix	trans	-70.3	-34.3	175.9	-60.6	171.6	-69.1	-171.2	2.8	111.3	D198 L202 L203 E204	D198-R200 PolarHBondContact O-N 3.04Å; D198-R200 VanDerWaalsContact O-N 3.14Å; D198-R200 WeakPolarHBondContact OD1-CB 3.42Å; D198-R200 WeakPolarHBondContact OD1-CG 3.44Å; D198-R200 IonicContact OD1-CZ 2.64Å; D198-R200 PolarHBondContact OD1-N 3.18Å; D198-R200 IonicContact OD1-NE 3.53Å; D198-R200 PolarHBondContact OD1-NE 3.03Å; D198-R200 IonicContact OD1-NH2 2.83Å; D198-R200 IonicContact OD2-CZ 3.75Å; D198-R200 VanDerWaalsContact OD2-CZ 3.27Å; D198-R200 IonicContact OD2-NE 2.65Å; D198-R200 PolarHBondContact OD2-NE 3.28Å; D198-R200 VanDerWaalsContact OD2-NE 3.08Å; D198-R200 IonicContact OD2-NH2 3.25Å; D198-R200 PolarHBondContact OD2-NH2 3.25Å; R200-L202 VanDerWaalsContact C-N 3.31Å; R200-L202 PolarHBondContact O-N 2.9Å; R200-L203 PolarHBondContact O-N 2.92Å; R200-L203 VanDerWaalsContact O-N 3.1Å; R200-E204 WeakPolarHBondContact O-CG 3.41Å; R200-E204 PolarHBondContact O-N 3.32Å
201	V	72.6	Confident	73.6	Confident	47 Å²	47	72.2 Å²	72.2	29%	0.285	40%	0.396	S	S	.	.	H	α-helix	trans	-62.9	-39.8	176.1	179.7	0	0	0	0	110.5	V195 D198 P199 E205	V195-V201 HydrophobicContact CG1-CG1 4.3Å; D198-V201 HydrophobicContact CB-CG2 4.04Å; D198-V201 PolarHBondContact O-N 3.35Å; P199-V201 VanDerWaalsContact C-N 3.35Å; V201-E205 WeakPolarHBondContact O-CB 3.36Å; V201-E205 PolarHBondContact O-N 3.08Å
202	L	74.1	Confident	73.5	Confident	3 Å²	3	75.1 Å²	75.1	2%	0.016	41%	0.41	C	S	.	.	H	α-helix	trans	-59.1	-47.4	171.4	176	65.7	0	0	0	111.4	F157 L164 I187 V190 V195 P199 R200 L206	F157-L202 HydrophobicContact CD1-CD2 4.12Å; F157-L202 HydrophobicContact CD2-CD2 3.66Å; F157-L202 HydrophobicContact CE1-CD2 4.09Å; F157-L202 HydrophobicContact CE2-CD2 3.61Å; F157-L202 HydrophobicContact CE2-CG 4.45Å; F157-L202 HydrophobicContact CG-CD2 3.92Å; F157-L202 HydrophobicContact CZ-CD2 3.83Å; L164-L202 HydrophobicContact CD2-CB 3.93Å; L164-L202 HydrophobicContact CD2-CD2 3.5Å; L164-L202 HydrophobicContact CD2-CG 4.29Å; L164-L202 HydrophobicContact CG-CD2 4.09Å; I187-L202 HydrophobicContact CD1-CD2 4.36Å; V190-L202 HydrophobicContact CB-CD1 4.34Å; V190-L202 HydrophobicContact CG2-CD1 3.33Å; V195-L202 HydrophobicContact CB-CB 4.26Å; V195-L202 HydrophobicContact CG1-CB 4.13Å; P199-L202 WeakPolarHBondContact O-CB 3.45Å; P199-L202 PolarHBondContact O-N 2.9Å; R200-L202 VanDerWaalsContact C-N 3.31Å; R200-L202 PolarHBondContact O-N 2.9Å; L202-L206 HydrophobicContact CD1-CD1 3.67Å; L202-L206 HydrophobicContact CD1-CG 3.84Å; L202-L206 HydrophobicContact CD2-CD1 4.5Å; L202-L206 HydrophobicContact CG-CD1 3.89Å; L202-L206 HydrophobicContact CG-CG 4.33Å; L202-L206 VanDerWaalsContact O-CB 3.28Å; L202-L206 WeakPolarHBondContact O-CB 3.39Å; L202-L206 VanDerWaalsContact O-CG 3.27Å; L202-L206 WeakPolarHBondContact O-CG 3.25Å; L202-L206 PolarHBondContact O-N 3.39Å
203	L	70.4	Confident	73.9	Confident	99 Å²	99	72.2 Å²	72.2	52%	0.518	38%	0.381	S	S	.	.	H	α-helix	trans	-67.2	-42	-176.4	-174.3	60.5	0	0	0	112.3	P199 R200 Q207	P199-L203 PolarHBondContact O-N 3.02Å; R200-L203 PolarHBondContact O-N 2.92Å; R200-L203 VanDerWaalsContact O-N 3.1Å; L203-Q207 HydrophobicContact CD1-CG 4.35Å; L203-Q207 WeakPolarHBondContact O-CB 3.38Å; L203-Q207 VanDerWaalsContact O-CG 3.23Å; L203-Q207 WeakPolarHBondContact O-CG 3.38Å; L203-Q207 PolarHBondContact O-N 3.03Å
204	E	75.7	Confident	74.1	Confident	137 Å²	137	68.3 Å²	68.3	64%	0.64	37%	0.372	S	S	*	.	H	α-helix	trans	-64.6	-48.2	176.4	-72.3	179.2	-169.4	0	0	111.8	R200 Q207 A208	R200-E204 WeakPolarHBondContact O-CG 3.41Å; R200-E204 PolarHBondContact O-N 3.32Å; E204-Q207 PolarHBondContact O-N 2.98Å; E204-A208 WeakPolarHBondContact O-CB 3.05Å; E204-A208 PolarHBondContact O-N 3Å
205	E	76.1	Confident	74.5	Confident	36 Å²	36	63.9 Å²	63.9	17%	0.168	35%	0.349	C	S	.	.	H	α-helix	trans	-63.3	-42.4	176.6	-81.4	-72.5	143.5	0	0	112.1	V190 N191 R193 V201 A208 A209	V190-E205 HydrophobicContact CG1-CB 4.47Å; N191-E205 PolarHBondContact ND2-OE2 3.09Å; R193-E205 IonicContact CZ-OE1 3.67Å; R193-E205 VanDerWaalsContact NE-CD 3.32Å; R193-E205 IonicContact NE-OE1 2.75Å; R193-E205 PolarHBondContact NE-OE1 3Å; R193-E205 IonicContact NH2-OE1 3.84Å; R193-E205 PolarHBondContact NH2-OE1 3.03Å; V201-E205 WeakPolarHBondContact O-CB 3.36Å; V201-E205 PolarHBondContact O-N 3.08Å; E205-A208 PolarHBondContact O-N 2.95Å; E205-A209 WeakPolarHBondContact O-CB 3.28Å; E205-A209 PolarHBondContact O-N 3.31Å
206	L	74.3	Confident	74.9	Confident	17 Å²	17	66.6 Å²	66.6	9%	0.089	36%	0.36	C	S	.	.	H	α-helix	trans	-66.9	-35.8	175.9	-73.4	-177.4	0	0	0	112.5	K147 L153 F157 L202 V213	K147-L206 WeakPolarHBondContact CE-O 3.43Å; K147-L206 PolarHBondContact NZ-O 3.3Å; L153-L206 HydrophobicContact CD1-CD1 4.04Å; L153-L206 HydrophobicContact CD1-CD2 3.8Å; F157-L206 HydrophobicContact CE2-CD1 4.15Å; F157-L206 HydrophobicContact CZ-CD1 4.27Å; L202-L206 HydrophobicContact CD1-CD1 3.67Å; L202-L206 HydrophobicContact CD1-CG 3.84Å; L202-L206 HydrophobicContact CD2-CD1 4.5Å; L202-L206 HydrophobicContact CG-CD1 3.89Å; L202-L206 HydrophobicContact CG-CG 4.33Å; L202-L206 VanDerWaalsContact O-CB 3.28Å; L202-L206 WeakPolarHBondContact O-CB 3.39Å; L202-L206 VanDerWaalsContact O-CG 3.27Å; L202-L206 WeakPolarHBondContact O-CG 3.25Å; L202-L206 PolarHBondContact O-N 3.39Å; L206-V213 HydrophobicContact CD2-CG1 3.94Å; L206-V213 HydrophobicContact CD2-CG2 4.42Å
207	Q	72.8	Confident	76	Confident	125 Å²	125	65.5 Å²	65.5	58%	0.584	35%	0.352	S	S	*	.	H	α-helix	trans	-67.8	-43.8	175.3	-76.9	178.8	15.1	0	0	111.6	L203 E204	L203-Q207 HydrophobicContact CD1-CG 4.35Å; L203-Q207 WeakPolarHBondContact O-CB 3.38Å; L203-Q207 VanDerWaalsContact O-CG 3.23Å; L203-Q207 WeakPolarHBondContact O-CG 3.38Å; L203-Q207 PolarHBondContact O-N 3.03Å; E204-Q207 PolarHBondContact O-N 2.98Å
208	A	71.7	Confident	77.1	Confident	85 Å²	85	58.7 Å²	58.7	70%	0.702	32%	0.322	S	S	*	.	H	α-helix	trans	-71.4	-31.4	178.8	0	0	0	0	0	113.5	E204 E205	E204-A208 WeakPolarHBondContact O-CB 3.05Å; E204-A208 PolarHBondContact O-N 3Å; E205-A208 PolarHBondContact O-N 2.95Å
209	A	72.1	Confident	77.6	Confident	16 Å²	16	57.5 Å²	57.5	13%	0.132	32%	0.316	C	S	.	.			trans	-73	137	-174.6	0	0	0	0	0	113.8	K147 E205 V213	K147-A209 PolarHBondContact NZ-O 3.1Å; E205-A209 WeakPolarHBondContact O-CB 3.28Å; E205-A209 PolarHBondContact O-N 3.31Å; A209-V213 HydrophobicContact CB-CG2 3.76Å
210	S	73.5	Confident	77.9	Confident	81 Å²	81	56.6 Å²	56.6	57%	0.566	31%	0.311	S	S	*	.			trans	-142.2	135.5	172.5	180	0	0	0	0	108.4	A149	A149-S210 PolarHBondContact N-OG 3.24Å
211	G	79.5	Confident	77.3	Confident	32 Å²	32	55.7 Å²	55.7	33%	0.33	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	109.9	-129.9	-172.6	0	0	0	0	0	112.2	R146 K147	R146-G211 CarbonylContact C-O 3.58Å; R146-G211 WeakPolarHBondContact CA-O 3.24Å; K147-G211 PolarHBondContact N-O 3.49Å; K147-G211 PolarHBondContact O-N 3.38Å
212	I	80.6	Confident	76.5	Confident	129 Å²	129	59.3 Å²	59.3	66%	0.662	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.5	118.4	177.6	-58.7	173.5	0	0	0	108.4	I145 V214	I145-I212 WeakPolarHBondContact O-CA 3.46Å; I212-V214 HydrophobicContact CG2-CG2 4.29Å
213	V	83.9	Confident	75	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.006	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	129.6	168.5	179.6	0	0	0	0	107.7	G144 I145 K147 V190 N191 L206 A209 L215	G144-V213 WeakPolarHBondContact CA-O 3.46Å; I145-V213 PolarHBondContact N-O 2.98Å; I145-V213 PolarHBondContact O-N 3.14Å; K147-V213 HydrophobicContact CB-CG2 4.18Å; K147-V213 HydrophobicContact CD-CG2 4.24Å; V190-V213 HydrophobicContact CG1-CG1 3.78Å; N191-V213 WeakPolarHBondContact OD1-CA 3.25Å; L206-V213 HydrophobicContact CD2-CG1 3.94Å; L206-V213 HydrophobicContact CD2-CG2 4.42Å; A209-V213 HydrophobicContact CB-CG2 3.76Å; V213-L215 HydrophobicContact CG1-CD2 3.79Å; V213-L215 HydrophobicContact CG1-CG 4.44Å
214	V	85.4	Confident	73.8	Confident	60 Å²	60	67.3 Å²	67.3	36%	0.364	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115.9	174.7	-177.8	0	0	0	0	108.9	N191 I212	N191-V214 PolarHBondContact N-O 2.91Å; N191-V214 PolarHBondContact OD1-N 3.09Å; I212-V214 HydrophobicContact CG2-CG2 4.29Å
215	L	87.2	Confident	72.4	Confident	2 Å²	2	68 Å²	68	1%	0.01	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	140	172.3	-51.4	-178.7	0	0	0	109.5	M142 V143 I145 L181 I187 E189 V190 V213 I217	M142-L215 CarbonylContact C-O 3.6Å; M142-L215 WeakPolarHBondContact CA-O 3.32Å; V143-L215 PolarHBondContact N-O 2.95Å; V143-L215 PolarHBondContact O-N 2.95Å; I145-L215 HydrophobicContact CD1-CD1 3.41Å; I145-L215 VanDerWaalsContact CD1-CD1 3.41Å; I145-L215 HydrophobicContact CD1-CG 3.96Å; L181-L215 HydrophobicContact CD1-CD1 3.77Å; L181-L215 HydrophobicContact CD2-CD1 4.16Å; I187-L215 HydrophobicContact CD1-CD1 4.08Å; E189-L215 CarbonylContact O-C 3.59Å; E189-L215 WeakPolarHBondContact O-CA 3.48Å; V190-L215 HydrophobicContact CB-CD2 4.13Å; V190-L215 HydrophobicContact CG1-CD2 3.94Å; V190-L215 HydrophobicContact CG2-CD2 3.4Å; V213-L215 HydrophobicContact CG1-CD2 3.79Å; V213-L215 HydrophobicContact CG1-CG 4.44Å; L215-I217 HydrophobicContact CB-CG2 4.09Å
216	K	86.4	Confident	71.2	Confident	59 Å²	59	71.1 Å²	71.1	26%	0.257	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	124	155.8	-62.3	-168.4	-169.4	151.7	0	108.1	I140 M142 K188 E189	I140-K216 HydrophobicContact CG2-CB 3.8Å; I140-K216 HydrophobicContact CG2-CD 4.21Å; I140-K216 HydrophobicContact CG2-CG 4.34Å; M142-K216 HydrophobicContact CG-CG 4.04Å; M142-K216 HydrophobicContact SD-CD 4.21Å; M142-K216 HydrophobicContact SD-CG 3.87Å; K188-K216 PolarHBondContact N-O 2.87Å; E189-K216 HydrophobicContact CB-CB 4Å; E189-K216 HydrophobicContact CB-CD 4.25Å; E189-K216 HydrophobicContact CB-CG 4.11Å; E189-K216 HydrophobicContact CG-CD 4.24Å; E189-K216 PolarHBondContact N-O 2.75Å; E189-K216 PolarHBondContact O-N 3.16Å; E189-K216 WeakPolarHBondContact OE1-CD 3.43Å; E189-K216 IonicContact OE1-NZ 3.55Å; E189-K216 PolarHBondContact OE1-NZ 2.91Å; E189-K216 WeakPolarHBondContact OE2-CD 3.45Å; E189-K216 WeakPolarHBondContact OE2-CE 3.05Å; E189-K216 IonicContact OE2-NZ 3.41Å; E189-K216 PolarHBondContact OE2-NZ 3.27Å
217	I	88.2	Confident	70.4	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	147.9	179.4	68.2	174.4	0	0	0	110.9	I140 R141 V143 L181 D185 I186 I187 L215 P219	I140-I217 CarbonylContact C-O 3.56Å; I140-I217 WeakPolarHBondContact CA-O 3.36Å; R141-I217 HydrophobicContact CB-CD1 4.47Å; R141-I217 HydrophobicContact CB-CG1 3.92Å; R141-I217 HydrophobicContact CG-CG1 4.46Å; R141-I217 PolarHBondContact N-O 3.49Å; R141-I217 WeakPolarHBondContact O-CG1 3.35Å; R141-I217 PolarHBondContact O-N 2.82Å; V143-I217 HydrophobicContact CG2-CD1 3.84Å; V143-I217 HydrophobicContact CG2-CG1 4.22Å; L181-I217 HydrophobicContact CD2-CD1 3.83Å; L181-I217 HydrophobicContact CD2-CG2 4.18Å; D185-I217 HydrophobicContact CB-CD1 4.26Å; D185-I217 WeakPolarHBondContact OD2-CD1 3.36Å; I186-I217 CarbonylContact O-C 3.59Å; I186-I217 WeakPolarHBondContact O-CA 3.33Å; I186-I217 WeakPolarHBondContact O-CB 3.43Å; I187-I217 HydrophobicContact CG1-CG2 4.13Å; L215-I217 HydrophobicContact CB-CG2 4.09Å; I217-P219 WeakPolarHBondContact O-CD 3.48Å
218	L	86.4	Confident	70.2	Confident	39 Å²	39	77.3 Å²	77.3	20%	0.204	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	113.3	152.5	-151.1	78.7	0	0	0	106.2	I140 I186	I140-L218 HydrophobicContact CG1-CD1 4.41Å; I186-L218 HydrophobicContact CB-CB 4.07Å; I186-L218 HydrophobicContact CD1-CD2 4.35Å; I186-L218 PolarHBondContact N-O 2.83Å; I186-L218 PolarHBondContact O-N 3.22Å
219	P	80.4	Confident	70.7	Confident	16 Å²	16	79.2 Å²	79.2	10%	0.104	42%	0.419	C	S	.	.			trans	-68.3	133.6	177.3	28.8	-33.2	0	0	0	109.7	A139 R141 D185 I217 Y221	A139-P219 WeakPolarHBondContact O-CD 3.32Å; R141-P219 HydrophobicContact CB-CG 4.35Å; D185-P219 VanDerWaalsContact OD1-CA 3.32Å; D185-P219 WeakPolarHBondContact OD1-CA 3.42Å; I217-P219 WeakPolarHBondContact O-CD 3.48Å; P219-Y221 HydrophobicContact CB-CE2 4.47Å; P219-Y221 HydrophobicContact CG-CD2 4.32Å; P219-Y221 HydrophobicContact CG-CE2 3.65Å; P219-Y221 PolarHBondContact O-N 2.99Å
220	S	74.1	Confident	71.6	Confident	40 Å²	40	79.6 Å²	79.6	28%	0.28	42%	0.42	S	S	.	.			trans	-81.3	108.9	171.5	-175.5	0	0	0	0	109.4	G184 D185 H222	G184-S220 VanDerWaalsContact C-CB 3.43Å; G184-S220 WeakPolarHBondContact O-CB 3.47Å; D185-S220 PolarHBondContact OD1-N 3.3Å; S220-H222 PolarHBondContact O-N 2.76Å; S220-H222 VanDerWaalsContact O-N 3.07Å
221	Y	58.4	Low	72.7	Confident	145 Å²	145	77.3 Å²	77.3	57%	0.569	40%	0.4	S	S	*	.			trans	-79.9	34.3	179	-70.4	-73.6	0	0	0	113.5	P219 E223	P219-Y221 HydrophobicContact CB-CE2 4.47Å; P219-Y221 HydrophobicContact CG-CD2 4.32Å; P219-Y221 HydrophobicContact CG-CE2 3.65Å; P219-Y221 PolarHBondContact O-N 2.99Å; Y221-E223 PolarHBondContact O-N 2.62Å
222	H	55	Low	73.4	Confident	124 Å²	124	76.8 Å²	76.8	57%	0.574	39%	0.388	S	S	*	.			trans	-64.8	128.8	153.4	-81.7	-77.2	0	0	0	107.9	D122 S220 T224	D122-H222 IonicContact OD2-CE1 3.74Å; S220-H222 PolarHBondContact O-N 2.76Å; S220-H222 VanDerWaalsContact O-N 3.07Å; H222-T224 PolarHBondContact O-N 2.78Å
223	E	43.2	Very low	74.1	Confident	183 Å²	183	72.6 Å²	72.6	86%	0.855	37%	0.365	S	S	*	.			trans	-59.4	109.6	159.2	-69.6	-162.4	143.3	0	0	107.1	Y221 I225	Y221-E223 PolarHBondContact O-N 2.62Å; E223-I225 PolarHBondContact O-N 2.95Å
224	T	45	Very low	74.6	Confident	87 Å²	87	72.6 Å²	72.6	53%	0.534	37%	0.365	S	S	.	.			trans	-67.7	89.5	175.4	56	0	0	0	0	108	H182 H222 P226	H182-T224 HydrophobicContact CB-CG2 4.38Å; H222-T224 PolarHBondContact O-N 2.78Å; T224-P226 VanDerWaalsContact O-CD 3.26Å; T224-P226 WeakPolarHBondContact O-CD 3.3Å
225	I	46.9	Very low	74.9	Confident	150 Å²	150	70.6 Å²	70.6	77%	0.769	35%	0.352	S	S	*	.			trans	-47.5	115.1	171.3	-59.9	177.1	0	0	0	106	E223 P227	E223-I225 PolarHBondContact O-N 2.95Å; I225-P227 VanDerWaalsContact O-N 3.14Å
226	P	49.6	Very low	75	Confident	102 Å²	102	71.5 Å²	71.5	66%	0.662	36%	0.355	S	S	*	.			trans	-56.2	126.1	-172.8	-28.2	35.7	0	0	0	109.1	T224 R228	T224-P226 VanDerWaalsContact O-CD 3.26Å; T224-P226 WeakPolarHBondContact O-CD 3.3Å; P226-R228 PolarHBondContact O-N 3.41Å; P226-R228 VanDerWaalsContact O-N 3.11Å
227	P	57.5	Low	75.3	Confident	113 Å²	113	73.9 Å²	73.9	73%	0.734	37%	0.371	S	S	*	.			trans	-54.3	123.8	-168.8	18.9	-32	0	0	0	109.5	I225 Q229	I225-P227 VanDerWaalsContact O-N 3.14Å; P227-Q229 PolarHBondContact O-N 2.78Å
228	R	68.2	Low	75.7	Confident	160 Å²	160	74.5 Å²	74.5	60%	0.604	37%	0.373	S	S	*	.			trans	-48.4	112.7	-170.7	172.9	176.9	165.8	146.7	-6.8	109.1	P226 V230 E342	P226-R228 PolarHBondContact O-N 3.41Å; P226-R228 VanDerWaalsContact O-N 3.11Å; R228-V230 HydrophobicContact CG-CG2 4.38Å; R228-V230 PolarHBondContact O-N 2.87Å; R228-E342 IonicContact CZ-OE1 3.67Å; R228-E342 IonicContact NE-OE1 2.73Å; R228-E342 IonicContact NH2-OE1 3.27Å; R228-E342 PolarHBondContact NH2-OE1 2.88Å; R228-E342 IonicContact NH2-OE2 3.31Å
229	Q	82.9	Confident	76.1	Confident	124 Å²	124	75 Å²	75	58%	0.579	38%	0.376	S	S	*	.			trans	-72.5	96.5	-178.3	-62.5	-172.4	8	0	0	108.9	P227 F231	P227-Q229 PolarHBondContact O-N 2.78Å; Q229-F231 HydrophobicContact CB-CD2 4.44Å; Q229-F231 HydrophobicContact CB-CE2 3.57Å; Q229-F231 HydrophobicContact CB-CZ 3.93Å; Q229-F231 VanDerWaalsContact O-CD2 3.25Å; Q229-F231 WeakPolarHBondContact O-CD2 3.18Å; Q229-F231 WeakPolarHBondContact O-CE2 3.42Å
230	V	91.5	Very high	76.7	Confident	25 Å²	25	74.8 Å²	74.8	15%	0.152	37%	0.374	C	S	.	.			trans	-79.9	130.5	174.8	179.1	0	0	0	0	108.7	R228 F232 I263 E342	R228-V230 HydrophobicContact CG-CG2 4.38Å; R228-V230 PolarHBondContact O-N 2.87Å; V230-F232 HydrophobicContact CG1-CD1 4.31Å; V230-F232 HydrophobicContact CG1-CE1 3.87Å; V230-F232 HydrophobicContact CG1-CE2 4.44Å; V230-F232 HydrophobicContact CG1-CZ 3.94Å; V230-I263 HydrophobicContact CB-CB 4.36Å; V230-I263 HydrophobicContact CG1-CB 4.43Å; V230-I263 HydrophobicContact CG1-CG1 4.18Å; V230-I263 PolarHBondContact O-N 3.39Å; V230-E342 HydrophobicContact CG1-CG 4.14Å
231	F	95.4	Very high	77.6	Confident	33 Å²	33	75.8 Å²	75.8	15%	0.145	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130.9	172.8	-58.2	-92	0	0	0	109.2	Q229 I260 L261 Q262 V277 E342 V343 W546	Q229-F231 HydrophobicContact CB-CD2 4.44Å; Q229-F231 HydrophobicContact CB-CE2 3.57Å; Q229-F231 HydrophobicContact CB-CZ 3.93Å; Q229-F231 VanDerWaalsContact O-CD2 3.25Å; Q229-F231 WeakPolarHBondContact O-CD2 3.18Å; Q229-F231 WeakPolarHBondContact O-CE2 3.42Å; F231-I260 HydrophobicContact CB-CG2 4.15Å; F231-L261 CarbonylContact C-O 3.57Å; F231-L261 VanDerWaalsContact CA-O 3.25Å; F231-L261 WeakPolarHBondContact CA-O 3.18Å; F231-Q262 HydrophobicContact CD1-CB 3.72Å; F231-Q262 HydrophobicContact CD1-CG 4.01Å; F231-Q262 HydrophobicContact CE1-CB 3.6Å; F231-Q262 HydrophobicContact CE1-CG 3.63Å; F231-Q262 HydrophobicContact CZ-CG 4.17Å; F231-V277 HydrophobicContact CD1-CG2 3.62Å; F231-V277 HydrophobicContact CE1-CG2 3.87Å; F231-E342 WeakPolarHBondContact O-CA 3.16Å; F231-V343 HydrophobicContact CB-CG2 4.08Å; F231-V343 PolarHBondContact O-N 3.5Å; F231-W546 HydrophobicContact CB-CH2 4.02Å; F231-W546 HydrophobicContact CB-CZ3 3.66Å; F231-W546 AromaticContact CD1-CH2 3.59Å; F231-W546 HydrophobicContact CD1-CH2 3.59Å; F231-W546 HydrophobicContact CD1-CZ2 4.48Å; F231-W546 HydrophobicContact CD1-CZ3 4.13Å; F231-W546 AromaticContact CD2-CH2 3.88Å; F231-W546 HydrophobicContact CD2-CH2 3.88Å; F231-W546 AromaticContact CD2-CZ3 3.82Å; F231-W546 HydrophobicContact CD2-CZ3 3.82Å; F231-W546 AromaticContact CE1-CH2 3.94Å; F231-W546 HydrophobicContact CE1-CH2 3.94Å; F231-W546 HydrophobicContact CE2-CH2 4.21Å; F231-W546 HydrophobicContact CE2-CZ3 4.5Å; F231-W546 AromaticContact CG-CH2 3.56Å; F231-W546 HydrophobicContact CG-CH2 3.56Å; F231-W546 AromaticContact CG-CZ3 3.62Å; F231-W546 HydrophobicContact CG-CZ3 3.62Å; F231-W546 HydrophobicContact CZ-CH2 4.25Å
232	F	95.6	Very high	79.2	Confident	21 Å²	21	74.8 Å²	74.8	9%	0.092	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	135.4	173.3	-70.5	-36.2	0	0	0	110.7	V230 I260 L261 I263 W272 Y340 E341 E342	V230-F232 HydrophobicContact CG1-CD1 4.31Å; V230-F232 HydrophobicContact CG1-CE1 3.87Å; V230-F232 HydrophobicContact CG1-CE2 4.44Å; V230-F232 HydrophobicContact CG1-CZ 3.94Å; F232-I260 WeakPolarHBondContact O-CA 3.33Å; F232-L261 PolarHBondContact N-O 3.3Å; F232-L261 PolarHBondContact O-N 3.45Å; F232-I263 HydrophobicContact CB-CD1 4.31Å; F232-I263 HydrophobicContact CB-CG1 4.49Å; F232-I263 HydrophobicContact CD2-CD1 3.53Å; F232-I263 HydrophobicContact CD2-CG1 3.44Å; F232-I263 VanDerWaalsContact CD2-CG1 3.44Å; F232-I263 HydrophobicContact CE2-CD1 4.22Å; F232-I263 HydrophobicContact CE2-CG1 3.79Å; F232-I263 HydrophobicContact CG-CD1 4.23Å; F232-I263 HydrophobicContact CG-CG1 4.05Å; F232-W272 HydrophobicContact CD2-CE3 4.44Å; F232-W272 HydrophobicContact CD2-CZ3 4.04Å; F232-W272 HydrophobicContact CE2-CE3 4.03Å; F232-W272 HydrophobicContact CE2-CH2 4.05Å; F232-W272 AromaticContact CE2-CZ3 3.47Å; F232-W272 HydrophobicContact CE2-CZ3 3.47Å; F232-W272 VanDerWaalsContact CE2-CZ3 3.47Å; F232-W272 HydrophobicContact CZ-CZ3 4.38Å; F232-Y340 HydrophobicContact CB-CD1 4.26Å; F232-Y340 HydrophobicContact CB-CG 4.46Å; F232-Y340 HydrophobicContact CD2-CG 4.31Å; F232-Y340 HydrophobicContact CG-CG 4.49Å; F232-E341 CarbonylContact C-O 3.54Å; F232-E341 WeakPolarHBondContact CA-O 3.4Å; F232-E342 HydrophobicContact CD1-CB 4.11Å; F232-E342 HydrophobicContact CD1-CG 4.27Å; F232-E342 HydrophobicContact CE1-CB 3.92Å; F232-E342 HydrophobicContact CE1-CG 4Å
233	K	95.2	Very high	80.9	Confident	41 Å²	41	69.5 Å²	69.5	18%	0.178	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	130.1	161.6	179.8	174.4	-177.6	-177	0	109.4	H235 D259 I260 Y340 E341 V343	K233-H235 PolarHBondContact O-CD2 2.85Å; K233-D259 CarbonylContact C-O 3.55Å; K233-D259 WeakPolarHBondContact CA-O 3.43Å; K233-I260 HydrophobicContact CB-CD1 3.66Å; K233-I260 HydrophobicContact CD-CD1 4.2Å; K233-I260 HydrophobicContact CG-CD1 3.74Å; K233-Y340 VanDerWaalsContact O-CA 3.31Å; K233-Y340 WeakPolarHBondContact O-CA 3.36Å; K233-E341 HydrophobicContact CB-CB 4.45Å; K233-E341 PolarHBondContact N-O 2.99Å; K233-E341 PolarHBondContact O-N 3.39Å; K233-V343 HydrophobicContact CB-CG1 3.94Å; K233-V343 HydrophobicContact CB-CG2 4.32Å
234	C	94.6	Very high	83.1	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	134.8	176.6	-64.2	0	0	0	0	111.6	F255 G258 D259 L261	C234-F255 HydrophobicContact CB-CD2 3.54Å; C234-F255 HydrophobicContact CB-CE2 3.72Å; C234-F255 HydrophobicContact CB-CG 4.46Å; C234-F255 WeakPolarHBondContact SG-CD2 3.45Å; C234-F255 VanDerWaalsContact SG-CE2 3.55Å; C234-G258 PolarHBondContact O-N 2.91Å; C234-D259 PolarHBondContact N-O 3.38Å; C234-L261 VanDerWaalsContact SG-CD1 3.58Å
235	H	90.7	Very high	85.2	Confident	19 Å²	19	67.9 Å²	67.9	9%	0.088	36%	0.364	C	S	.	.			trans	-115.8	15	179.6	-70.8	-84.3	0	0	0	113.7	K233 L338 L339 E341 H515	K233-H235 PolarHBondContact O-CD2 2.85Å; H235-L338 HydrophobicContact CB-CG 4.36Å; H235-L338 WeakPolarHBondContact CB-O 3.44Å; H235-L339 PolarHBondContact N-O 2.89Å; H235-E341 VanDerWaalsContact NE2-CB 3.34Å; H235-E341 WeakPolarHBondContact NE2-CB 3.4Å; H235-E341 IonicContact NE2-OE2 3.13Å; H235-H515 HydrophobicContact CB-CB 4.2Å; H235-H515 PolarHBondContact CE1-O 2.75Å; H235-H515 VanDerWaalsContact CE1-O 3.23Å; H235-H515 WeakPolarHBondContact ND1-CB 3.22Å; H235-H515 PolarHBondContact ND1-O 3.45Å
236	Y	90.7	Very high	87.1	Confident	21 Å²	21	61.4 Å²	61.4	8%	0.082	33%	0.331	C	S	.	.	S	Bend	trans	-152.1	163.7	170.9	73.7	-72.1	0	0	0	109.8	F255 T257 E291 L339 Y340	Y236-F255 HydrophobicContact CD1-CE2 4.36Å; Y236-F255 HydrophobicContact CE1-CE2 4.02Å; Y236-F255 AromaticContact CE1-CZ 3.99Å; Y236-F255 HydrophobicContact CE1-CZ 3.99Å; Y236-F255 HydrophobicContact CE2-CE2 4.44Å; Y236-F255 HydrophobicContact CE2-CZ 4.34Å; Y236-F255 AromaticContact CZ-CZ 3.75Å; Y236-F255 VanDerWaalsContact O-CE2 3.3Å; Y236-F255 WeakPolarHBondContact O-CE2 3.44Å; Y236-T257 VanDerWaalsContact CA-OG1 3.26Å; Y236-T257 WeakPolarHBondContact CA-OG1 3.48Å; Y236-E291 HydrophobicContact CE1-CG 4.31Å; Y236-E291 HydrophobicContact CE2-CG 3.86Å; Y236-L339 HydrophobicContact CD1-CB 4.24Å; Y236-L339 HydrophobicContact CD1-CD2 3.74Å; Y236-L339 HydrophobicContact CE1-CB 4.13Å; Y236-L339 HydrophobicContact CE1-CD2 3.95Å; Y236-L339 HydrophobicContact CG-CD2 4.28Å; Y236-Y340 HydrophobicContact CE1-CE1 4.12Å; Y236-Y340 HydrophobicContact CE1-CE2 4.44Å; Y236-Y340 AromaticContact CE1-CZ 3.97Å; Y236-Y340 PolarHBondContact OH-OH 3.32Å
237	D	92.9	Very high	88.8	Confident	108 Å²	108	61.2 Å²	61.2	58%	0.578	33%	0.33	S	S	*	.			trans	-89	139	176.3	-43.5	-41.1	0	0	0	110.6	T257	D237-T257 PolarHBondContact N-OG1 3.44Å; D237-T257 VanDerWaalsContact OD1-CB 3.29Å; D237-T257 WeakPolarHBondContact OD1-CB 3.44Å; D237-T257 PolarHBondContact OD1-N 3.28Å; D237-T257 PolarHBondContact OD1-OG1 3.01Å
238	Y	94.9	Very high	90.1	Very high	13 Å²	13	58.7 Å²	58.7	5%	0.051	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-131.9	125.5	177.7	178.2	-111.4	0	0	0	112.2	P240 D243 L253 R254 F255 P286	Y238-P240 HydrophobicContact CE1-CB 3.99Å; Y238-P240 HydrophobicContact CE1-CG 4.41Å; Y238-D243 HydrophobicContact CE2-CB 4.12Å; Y238-D243 VanDerWaalsContact CE2-OD2 3.24Å; Y238-D243 WeakPolarHBondContact CE2-OD2 3.4Å; Y238-D243 WeakPolarHBondContact OH-CB 3.29Å; Y238-D243 PolarHBondContact OH-OD2 3.02Å; Y238-L253 WeakPolarHBondContact CD1-O 3.28Å; Y238-R254 WeakPolarHBondContact O-CA 3.49Å; Y238-R254 WeakPolarHBondContact O-CG 3.39Å; Y238-F255 VanDerWaalsContact CB-CE1 3.47Å; Y238-F255 HydrophobicContact CD1-CD1 4.07Å; Y238-F255 AromaticContact CD1-CE1 3.69Å; Y238-F255 HydrophobicContact CD1-CE1 3.69Å; Y238-F255 HydrophobicContact CD1-CZ 4.35Å; Y238-F255 HydrophobicContact CG-CD1 4.44Å; Y238-F255 AromaticContact CG-CE1 3.86Å; Y238-F255 HydrophobicContact CG-CE1 3.86Å; Y238-F255 HydrophobicContact CG-CZ 4.05Å; Y238-F255 PolarHBondContact N-O 3.45Å; Y238-F255 PolarHBondContact O-N 2.88Å; Y238-F255 VanDerWaalsContact O-N 3.16Å; Y238-P286 HydrophobicContact CD1-CG 4.39Å; Y238-P286 HydrophobicContact CD2-CG 3.71Å; Y238-P286 HydrophobicContact CE1-CG 4.15Å; Y238-P286 HydrophobicContact CE2-CG 3.42Å; Y238-P286 VanDerWaalsContact CE2-CG 3.42Å; Y238-P286 HydrophobicContact CG-CG 4.19Å
239	D	95.2	Very high	91	Very high	51 Å²	51	55.7 Å²	55.7	27%	0.273	31%	0.305	S	S	.	.			trans	-123.1	109.1	176	-176.3	-1.6	0	0	0	111.2	A241 N242 D243	D239-A241 PolarHBondContact O-N 3Å; D239-A241 VanDerWaalsContact OD1-CB 3.22Å; D239-A241 WeakPolarHBondContact OD1-CB 3.33Å; D239-A241 PolarHBondContact OD1-N 2.74Å; D239-N242 PolarHBondContact O-N 3.42Å; D239-N242 VanDerWaalsContact O-N 3.08Å; D239-N242 PolarHBondContact OD2-ND2 2.79Å; D239-D243 PolarHBondContact O-N 2.88Å
240	P	93.6	Very high	91.1	Very high	10 Å²	10	58.9 Å²	58.9	7%	0.065	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-16.2	179.4	28.9	-35.7	0	0	0	113.4	Y238 N242 D243 I246 R254	Y238-P240 HydrophobicContact CE1-CB 3.99Å; Y238-P240 HydrophobicContact CE1-CG 4.41Å; P240-N242 PolarHBondContact O-N 2.81Å; P240-D243 PolarHBondContact O-N 2.66Å; P240-I246 HydrophobicContact CB-CD1 3.83Å; P240-R254 HydrophobicContact CG-CB 4.5Å
241	A	93.5	Very high	90.9	Very high	61 Å²	61	59.6 Å²	59.6	50%	0.504	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-32.1	172.2	0	0	0	0	0	111.8	D239 K249	D239-A241 PolarHBondContact O-N 3Å; D239-A241 VanDerWaalsContact OD1-CB 3.22Å; D239-A241 WeakPolarHBondContact OD1-CB 3.33Å; D239-A241 PolarHBondContact OD1-N 2.74Å; A241-K249 PolarHBondContact O-NZ 2.95Å
242	N	92.2	Very high	90.7	Very high	124 Å²	124	58.9 Å²	58.9	66%	0.663	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-19.3	179.9	-61.3	-48.8	0	0	0	113.2	D239 P240	D239-N242 PolarHBondContact O-N 3.42Å; D239-N242 VanDerWaalsContact O-N 3.08Å; D239-N242 PolarHBondContact OD2-ND2 2.79Å; P240-N242 PolarHBondContact O-N 2.81Å
243	D	90.3	Very high	90.7	Very high	13 Å²	13	59 Å²	59	7%	0.07	33%	0.332	C	S	.	.			trans	-71.2	128.5	179.8	-158.8	-46.4	0	0	0	111.9	Y238 D239 P240 L245 I246 K249 W271 R294	Y238-D243 HydrophobicContact CE2-CB 4.12Å; Y238-D243 VanDerWaalsContact CE2-OD2 3.24Å; Y238-D243 WeakPolarHBondContact CE2-OD2 3.4Å; Y238-D243 WeakPolarHBondContact OH-CB 3.29Å; Y238-D243 PolarHBondContact OH-OD2 3.02Å; D239-D243 PolarHBondContact O-N 2.88Å; P240-D243 PolarHBondContact O-N 2.66Å; D243-L245 WeakPolarHBondContact OD1-CA 3.48Å; D243-L245 PolarHBondContact OD1-N 3.16Å; D243-I246 HydrophobicContact CB-CB 4.27Å; D243-I246 HydrophobicContact CB-CG2 3.99Å; D243-I246 PolarHBondContact OD1-N 2.97Å; D243-K249 WeakPolarHBondContact O-CE 3.47Å; D243-K249 PolarHBondContact O-NZ 2.98Å; D243-W271 WeakPolarHBondContact OD2-CH2 3.34Å; D243-R294 IonicContact OD1-NH2 3.28Å; D243-R294 PolarHBondContact OD1-NH2 2.9Å; D243-R294 IonicContact OD2-CZ 2.83Å; D243-R294 VanDerWaalsContact OD2-CZ 3.29Å; D243-R294 IonicContact OD2-NH1 3.6Å; D243-R294 PolarHBondContact OD2-NH1 2.88Å; D243-R294 IonicContact OD2-NH2 3.94Å; D243-R294 PolarHBondContact OD2-NH2 3.2Å
244	T	88.9	Confident	90.7	Very high	130 Å²	130	63.2 Å²	63.2	80%	0.798	35%	0.347	S	S	*	.	S	Bend	trans	-100.3	-5.1	179.2	53.3	0	0	0	0	113.8
245	L	88	Confident	90.7	Very high	107 Å²	107	63.3 Å²	63.3	56%	0.56	35%	0.347	S	S	*	.	S	Bend	trans	-107.2	-10.9	-178.2	-58.1	175.8	0	0	0	112.7	D243 W271	D243-L245 WeakPolarHBondContact OD1-CA 3.48Å; D243-L245 PolarHBondContact OD1-N 3.16Å; L245-W271 HydrophobicContact CB-CZ2 4.25Å; L245-W271 WeakPolarHBondContact O-CZ2 3.4Å
246	I	87.9	Confident	90.9	Very high	14 Å²	14	66.7 Å²	66.7	7%	0.072	36%	0.363	C	S	.	.			trans	-64.8	129.5	176.9	-168.9	173	0	0	0	111	P240 D243 C248 K249 G252 W271 L284	P240-I246 HydrophobicContact CB-CD1 3.83Å; D243-I246 HydrophobicContact CB-CB 4.27Å; D243-I246 HydrophobicContact CB-CG2 3.99Å; D243-I246 PolarHBondContact OD1-N 2.97Å; I246-C248 VanDerWaalsContact C-N 3.25Å; I246-C248 WeakPolarHBondContact CD1-O 3.27Å; I246-C248 PolarHBondContact O-N 3.5Å; I246-K249 HydrophobicContact CG2-CB 4.44Å; I246-K249 HydrophobicContact CG2-CG 3.7Å; I246-G252 VanDerWaalsContact CD1-CA 3.45Å; I246-W271 VanDerWaalsContact CA-CZ2 3.43Å; I246-W271 HydrophobicContact CB-CH2 3.62Å; I246-W271 HydrophobicContact CB-CZ2 4.03Å; I246-W271 HydrophobicContact CB-CZ3 4.05Å; I246-W271 HydrophobicContact CD1-CZ3 4.24Å; I246-W271 HydrophobicContact CG1-CE3 4.34Å; I246-W271 HydrophobicContact CG1-CH2 3.99Å; I246-W271 HydrophobicContact CG1-CZ2 4.48Å; I246-W271 HydrophobicContact CG1-CZ3 3.91Å; I246-L284 HydrophobicContact CD1-CB 4.35Å; I246-L284 HydrophobicContact CG1-CD1 4.49Å
247	P	84.4	Confident	90.9	Very high	98 Å²	98	69.2 Å²	69.2	64%	0.636	38%	0.381	S	S	*	.	S	Bend	trans	-60.5	-31.4	-177.3	-26.9	35.2	0	0	0	114.4
248	C	85.4	Confident	90.8	Very high	59 Å²	59	65.6 Å²	65.6	40%	0.399	37%	0.369	S	S	.	.			trans	-149.7	120.2	173.6	179.4	0	0	0	0	109.2	I246 E250 A251	I246-C248 VanDerWaalsContact C-N 3.25Å; I246-C248 WeakPolarHBondContact CD1-O 3.27Å; I246-C248 PolarHBondContact O-N 3.5Å; C248-E250 VanDerWaalsContact C-N 3.32Å; C248-E250 PolarHBondContact O-N 3.24Å; C248-A251 HydrophobicContact CB-CB 4Å; C248-A251 PolarHBondContact O-N 2.99Å
249	K	86.6	Confident	90.7	Very high	97 Å²	97	67.6 Å²	67.6	42%	0.422	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-64.6	-35.6	-178.5	-65.2	-176.2	-178.9	-98.6	0	112.8	A241 D243 I246 A251 G252	A241-K249 PolarHBondContact O-NZ 2.95Å; D243-K249 WeakPolarHBondContact O-CE 3.47Å; D243-K249 PolarHBondContact O-NZ 2.98Å; I246-K249 HydrophobicContact CG2-CB 4.44Å; I246-K249 HydrophobicContact CG2-CG 3.7Å; K249-A251 PolarHBondContact O-N 3.38Å; K249-G252 PolarHBondContact O-N 3.19Å; K249-G252 VanDerWaalsContact O-N 3.11Å
250	E	85.7	Confident	90.8	Very high	191 Å²	191	66.3 Å²	66.3	89%	0.893	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-67.9	-23.9	178.6	-61.1	176.9	-173.7	0	0	112.6	C248 G252	C248-E250 VanDerWaalsContact C-N 3.32Å; C248-E250 PolarHBondContact O-N 3.24Å; E250-G252 VanDerWaalsContact C-N 3.35Å
251	A	87.4	Confident	90.9	Very high	41 Å²	41	65.9 Å²	65.9	34%	0.339	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-86.3	-3	174.1	0	0	0	0	0	113.4	C248 K249 G283 L284	C248-A251 HydrophobicContact CB-CB 4Å; C248-A251 PolarHBondContact O-N 2.99Å; K249-A251 PolarHBondContact O-N 3.38Å; A251-G283 CarbonylContact O-C 3.46Å; A251-G283 VanDerWaalsContact O-CA 3.24Å; A251-G283 WeakPolarHBondContact O-CA 3.41Å; A251-L284 HydrophobicContact CB-CD1 4.26Å; A251-L284 HydrophobicContact CB-CG 4.47Å; A251-L284 PolarHBondContact O-N 3.16Å
252	G	91	Very high	91	Very high	18 Å²	18	64.2 Å²	64.2	19%	0.186	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-79.8	138.1	-177.6	0	0	0	0	0	113.4	I246 K249 E250 L284	I246-G252 VanDerWaalsContact CD1-CA 3.45Å; K249-G252 PolarHBondContact O-N 3.19Å; K249-G252 VanDerWaalsContact O-N 3.11Å; E250-G252 VanDerWaalsContact C-N 3.35Å; G252-L284 WeakPolarHBondContact CA-O 3.45Å
253	L	94.8	Very high	91.1	Very high	22 Å²	22	59 Å²	59	12%	0.115	33%	0.325	C	S	.	.			trans	-94.1	110.9	175.2	-172.9	73	0	0	0	110.2	Y238 L261 A274 L284 I285	Y238-L253 WeakPolarHBondContact CD1-O 3.28Å; L253-L261 HydrophobicContact CD2-CD1 4.18Å; L253-L261 HydrophobicContact CD2-CD2 3.85Å; L253-A274 HydrophobicContact CD2-CB 4.11Å; L253-L284 PolarHBondContact N-O 2.84Å; L253-I285 HydrophobicContact CB-CG2 3.84Å; L253-I285 HydrophobicContact CD2-CG2 4.03Å; L253-I285 HydrophobicContact CG-CG2 4.41Å
254	R	95.9	Very high	91	Very high	130 Å²	130	60.7 Å²	60.7	49%	0.491	34%	0.335	S	S	.	.			trans	-71.3	138.3	171.1	-172.2	174.8	-178.6	-82.4	-11.2	110.5	Y238 P240 E256 H276	Y238-R254 WeakPolarHBondContact O-CA 3.49Å; Y238-R254 WeakPolarHBondContact O-CG 3.39Å; P240-R254 HydrophobicContact CG-CB 4.5Å; R254-E256 IonicContact CZ-OE1 3.62Å; R254-E256 IonicContact NH1-OE1 3.61Å; R254-E256 PolarHBondContact NH1-OE1 3.49Å; R254-E256 IonicContact NH2-OE1 3.13Å; R254-E256 PolarHBondContact NH2-OE1 2.83Å; R254-H276 PolarHBondContact O-NE2 3.19Å
255	F	95.7	Very high	90.9	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.009	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-148.9	159.4	173.7	62	-100.2	0	0	0	111.6	C234 Y236 Y238 D259 L261 I285 Y340	C234-F255 HydrophobicContact CB-CD2 3.54Å; C234-F255 HydrophobicContact CB-CE2 3.72Å; C234-F255 HydrophobicContact CB-CG 4.46Å; C234-F255 WeakPolarHBondContact SG-CD2 3.45Å; C234-F255 VanDerWaalsContact SG-CE2 3.55Å; Y236-F255 HydrophobicContact CD1-CE2 4.36Å; Y236-F255 HydrophobicContact CE1-CE2 4.02Å; Y236-F255 AromaticContact CE1-CZ 3.99Å; Y236-F255 HydrophobicContact CE1-CZ 3.99Å; Y236-F255 HydrophobicContact CE2-CE2 4.44Å; Y236-F255 HydrophobicContact CE2-CZ 4.34Å; Y236-F255 AromaticContact CZ-CZ 3.75Å; Y236-F255 VanDerWaalsContact O-CE2 3.3Å; Y236-F255 WeakPolarHBondContact O-CE2 3.44Å; Y238-F255 VanDerWaalsContact CB-CE1 3.47Å; Y238-F255 HydrophobicContact CD1-CD1 4.07Å; Y238-F255 AromaticContact CD1-CE1 3.69Å; Y238-F255 HydrophobicContact CD1-CE1 3.69Å; Y238-F255 HydrophobicContact CD1-CZ 4.35Å; Y238-F255 HydrophobicContact CG-CD1 4.44Å; Y238-F255 AromaticContact CG-CE1 3.86Å; Y238-F255 HydrophobicContact CG-CE1 3.86Å; Y238-F255 HydrophobicContact CG-CZ 4.05Å; Y238-F255 PolarHBondContact N-O 3.45Å; Y238-F255 PolarHBondContact O-N 2.88Å; Y238-F255 VanDerWaalsContact O-N 3.16Å; F255-D259 VanDerWaalsContact CA-OD2 3.3Å; F255-D259 WeakPolarHBondContact CA-OD2 3.43Å; F255-D259 HydrophobicContact CB-CB 4.25Å; F255-D259 WeakPolarHBondContact CB-OD2 3.29Å; F255-L261 HydrophobicContact CB-CD1 4.44Å; F255-L261 HydrophobicContact CB-CD2 4.47Å; F255-L261 HydrophobicContact CD1-CD1 3.8Å; F255-L261 HydrophobicContact CE1-CD1 4.22Å; F255-L261 HydrophobicContact CG-CD1 4.17Å; F255-I285 HydrophobicContact CD1-CG2 3.84Å; F255-I285 HydrophobicContact CE1-CB 3.91Å; F255-I285 HydrophobicContact CE1-CG2 3.59Å; F255-Y340 HydrophobicContact CE2-CE1 4.31Å; F255-Y340 AromaticContact CZ-CE1 3.84Å; F255-Y340 HydrophobicContact CZ-CE1 3.84Å; F255-Y340 WeakPolarHBondContact CZ-OH 3.46Å
256	E	93.9	Very high	90.9	Very high	90 Å²	90	55.7 Å²	55.7	42%	0.421	30%	0.302	S	S	.	.			trans	-121.8	163.4	-179.7	-64.2	-177.8	-172.6	0	0	111.3	R254 G258 D259	R254-E256 IonicContact CZ-OE1 3.62Å; R254-E256 IonicContact NH1-OE1 3.61Å; R254-E256 PolarHBondContact NH1-OE1 3.49Å; R254-E256 IonicContact NH2-OE1 3.13Å; R254-E256 PolarHBondContact NH2-OE1 2.83Å; E256-G258 PolarHBondContact O-N 3.22Å; E256-D259 PolarHBondContact N-OD2 2.92Å; E256-D259 WeakPolarHBondContact O-CB 3.38Å; E256-D259 PolarHBondContact O-N 3.32Å; E256-D259 VanDerWaalsContact O-N 3.1Å
257	T	90.9	Very high	90.8	Very high	74 Å²	74	59.5 Å²	59.5	45%	0.454	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	109.7	-176	-60.7	0	0	0	0	111.3	Y236 D237	Y236-T257 VanDerWaalsContact CA-OG1 3.26Å; Y236-T257 WeakPolarHBondContact CA-OG1 3.48Å; D237-T257 PolarHBondContact N-OG1 3.44Å; D237-T257 VanDerWaalsContact OD1-CB 3.29Å; D237-T257 WeakPolarHBondContact OD1-CB 3.44Å; D237-T257 PolarHBondContact OD1-N 3.28Å; D237-T257 PolarHBondContact OD1-OG1 3.01Å
258	G	90.1	Very high	90.9	Very high	33 Å²	33	58.7 Å²	58.7	34%	0.34	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	121.2	-18.8	-177.4	0	0	0	0	0	114.3	C234 E256	C234-G258 PolarHBondContact O-N 2.91Å; E256-G258 PolarHBondContact O-N 3.22Å
259	D	94.1	Very high	90.9	Very high	54 Å²	54	60.3 Å²	60.3	29%	0.289	32%	0.32	S	S	.	.			trans	-58.6	147.4	179.8	-74.4	-13.5	0	0	0	112.3	K233 C234 F255 E256 H276	K233-D259 CarbonylContact C-O 3.55Å; K233-D259 WeakPolarHBondContact CA-O 3.43Å; C234-D259 PolarHBondContact N-O 3.38Å; F255-D259 VanDerWaalsContact CA-OD2 3.3Å; F255-D259 WeakPolarHBondContact CA-OD2 3.43Å; F255-D259 HydrophobicContact CB-CB 4.25Å; F255-D259 WeakPolarHBondContact CB-OD2 3.29Å; E256-D259 PolarHBondContact N-OD2 2.92Å; E256-D259 WeakPolarHBondContact O-CB 3.38Å; E256-D259 PolarHBondContact O-N 3.32Å; E256-D259 VanDerWaalsContact O-N 3.1Å; D259-H276 IonicContact OD2-CE1 2.63Å; D259-H276 PolarHBondContact OD2-CE1 3.21Å
260	I	95.9	Very high	91	Very high	25 Å²	25	58.5 Å²	58.5	13%	0.128	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	116.6	174.4	-43.5	-59.9	0	0	0	109.3	F231 F232 K233 V277 V343 W546	F231-I260 HydrophobicContact CB-CG2 4.15Å; F232-I260 WeakPolarHBondContact O-CA 3.33Å; K233-I260 HydrophobicContact CB-CD1 3.66Å; K233-I260 HydrophobicContact CD-CD1 4.2Å; K233-I260 HydrophobicContact CG-CD1 3.74Å; I260-V277 HydrophobicContact CB-CB 4.47Å; I260-V277 HydrophobicContact CB-CG2 4.01Å; I260-V277 HydrophobicContact CG2-CG2 3.77Å; I260-V277 WeakPolarHBondContact O-CB 3.31Å; I260-V277 VanDerWaalsContact O-CG2 3.31Å; I260-V277 WeakPolarHBondContact O-CG2 3.19Å; I260-V277 PolarHBondContact O-N 3.06Å; I260-V277 VanDerWaalsContact O-N 3.14Å; I260-V343 HydrophobicContact CD1-CG2 4.4Å; I260-V343 HydrophobicContact CG2-CG2 3.93Å; I260-W546 HydrophobicContact CD1-CB 4.39Å; I260-W546 HydrophobicContact CD1-CG 4.29Å; I260-W546 HydrophobicContact CG1-CD2 4.35Å; I260-W546 HydrophobicContact CG1-CG 4.07Å; I260-W546 HydrophobicContact CG2-CD2 4Å; I260-W546 HydrophobicContact CG2-CE3 4.15Å; I260-W546 HydrophobicContact CG2-CH2 4.18Å; I260-W546 HydrophobicContact CG2-CZ2 4.03Å; I260-W546 HydrophobicContact CG2-CZ3 4.23Å
261	L	96.4	Very high	91.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	130.5	179.3	-58.1	-174.4	0	0	0	110.3	F231 F232 C234 L253 F255 I263 A274 R275 H276 I285	F231-L261 CarbonylContact C-O 3.57Å; F231-L261 VanDerWaalsContact CA-O 3.25Å; F231-L261 WeakPolarHBondContact CA-O 3.18Å; F232-L261 PolarHBondContact N-O 3.3Å; F232-L261 PolarHBondContact O-N 3.45Å; C234-L261 VanDerWaalsContact SG-CD1 3.58Å; L253-L261 HydrophobicContact CD2-CD1 4.18Å; L253-L261 HydrophobicContact CD2-CD2 3.85Å; F255-L261 HydrophobicContact CB-CD1 4.44Å; F255-L261 HydrophobicContact CB-CD2 4.47Å; F255-L261 HydrophobicContact CD1-CD1 3.8Å; F255-L261 HydrophobicContact CE1-CD1 4.22Å; F255-L261 HydrophobicContact CG-CD1 4.17Å; L261-I263 HydrophobicContact CB-CD1 4.23Å; L261-A274 HydrophobicContact CB-CB 4.26Å; L261-A274 HydrophobicContact CD1-CB 4.29Å; L261-R275 CarbonylContact C-O 3.59Å; L261-R275 WeakPolarHBondContact CA-O 3.45Å; L261-H276 WeakPolarHBondContact CD2-ND1 3.23Å; L261-I285 HydrophobicContact CD1-CD1 3.95Å; L261-I285 HydrophobicContact CD1-CG2 4.04Å
262	Q	95.2	Very high	91.6	Very high	27 Å²	27	50 Å²	50	13%	0.126	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	125.4	162.1	-172.8	179.1	9	0	0	108.6	F231 A274 R275	F231-Q262 HydrophobicContact CD1-CB 3.72Å; F231-Q262 HydrophobicContact CD1-CG 4.01Å; F231-Q262 HydrophobicContact CE1-CB 3.6Å; F231-Q262 HydrophobicContact CE1-CG 3.63Å; F231-Q262 HydrophobicContact CZ-CG 4.17Å; Q262-A274 CarbonylContact O-C 3.48Å; Q262-A274 VanDerWaalsContact O-CA 3.26Å; Q262-A274 WeakPolarHBondContact O-CA 3.4Å; Q262-R275 HydrophobicContact CB-CG 4.1Å; Q262-R275 PolarHBondContact N-O 2.97Å; Q262-R275 PolarHBondContact O-N 3.13Å; Q262-R275 VanDerWaalsContact OE1-CZ 3.29Å
263	I	93.9	Very high	91.7	Very high	14 Å²	14	52.7 Å²	52.7	7%	0.072	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	131.2	175.9	-46	-55.6	0	0	0	109	V230 F232 L261 Q266 A274 I285	V230-I263 HydrophobicContact CB-CB 4.36Å; V230-I263 HydrophobicContact CG1-CB 4.43Å; V230-I263 HydrophobicContact CG1-CG1 4.18Å; V230-I263 PolarHBondContact O-N 3.39Å; F232-I263 HydrophobicContact CB-CD1 4.31Å; F232-I263 HydrophobicContact CB-CG1 4.49Å; F232-I263 HydrophobicContact CD2-CD1 3.53Å; F232-I263 HydrophobicContact CD2-CG1 3.44Å; F232-I263 VanDerWaalsContact CD2-CG1 3.44Å; F232-I263 HydrophobicContact CE2-CD1 4.22Å; F232-I263 HydrophobicContact CE2-CG1 3.79Å; F232-I263 HydrophobicContact CG-CD1 4.23Å; F232-I263 HydrophobicContact CG-CG1 4.05Å; L261-I263 HydrophobicContact CB-CD1 4.23Å; I263-Q266 HydrophobicContact CG2-CG 3.53Å; I263-A274 HydrophobicContact CD1-CB 3.77Å; I263-I285 HydrophobicContact CD1-CD1 4.05Å
264	V	89.8	Confident	91.7	Very high	49 Å²	49	51.7 Å²	51.7	30%	0.297	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-36.3	-175.8	-178.1	0	0	0	0	110.6	Q273 R275 A282	V264-Q273 HydrophobicContact CB-CB 4.39Å; V264-Q273 PolarHBondContact N-O 3.22Å; V264-R275 HydrophobicContact CG2-CG 4.34Å; V264-A282 HydrophobicContact CG2-CB 4.42Å
265	N	85.9	Confident	91.6	Very high	50 Å²	50	49.6 Å²	49.6	27%	0.267	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	138.1	-179.4	-169.1	-3	0	0	0	111.1	D267 W272 Q273	N265-D267 VanDerWaalsContact OD1-CB 3.31Å; N265-D267 WeakPolarHBondContact OD1-CB 3.46Å; N265-D267 PolarHBondContact OD1-N 2.97Å; N265-D267 PolarHBondContact OD1-OD1 3.2Å; N265-W272 WeakPolarHBondContact O-CA 3.22Å; N265-Q273 HydrophobicContact CB-CB 3.91Å; N265-Q273 HydrophobicContact CB-CG 4.07Å; N265-Q273 VanDerWaalsContact CB-OE1 3.27Å; N265-Q273 PolarHBondContact N-O 3.2Å; N265-Q273 VanDerWaalsContact N-O 3.15Å; N265-Q273 PolarHBondContact ND2-OE1 2.88Å; N265-Q273 PolarHBondContact O-N 2.84Å
266	Q	88.7	Confident	91.6	Very high	82 Å²	82	51.9 Å²	51.9	38%	0.383	27%	0.271	S	S	.	.			trans	-122.2	5	177.2	-61.6	-173.8	25.7	0	0	113.6	I263 D268 W272	I263-Q266 HydrophobicContact CG2-CG 3.53Å; Q266-D268 VanDerWaalsContact C-N 3.3Å; Q266-D268 PolarHBondContact O-N 3.16Å; Q266-W272 HydrophobicContact CB-CG 4.42Å; Q266-W272 HydrophobicContact CG-CD2 4.23Å; Q266-W272 HydrophobicContact CG-CG 4.19Å
267	D	84.9	Confident	91.4	Very high	94 Å²	94	50.1 Å²	50.1	50%	0.503	27%	0.267	S	S	.	.			trans	-56.9	-36.9	-176.1	-81.7	16.2	0	0	0	114	R168 N265 V269	R168-D267 IonicContact CZ-OD2 2.66Å; R168-D267 IonicContact NH1-OD2 2.74Å; R168-D267 PolarHBondContact NH1-OD2 3.19Å; R168-D267 IonicContact NH2-OD1 2.75Å; R168-D267 IonicContact NH2-OD2 2.75Å; R168-D267 PolarHBondContact NH2-OD2 3.27Å; N265-D267 VanDerWaalsContact OD1-CB 3.31Å; N265-D267 WeakPolarHBondContact OD1-CB 3.46Å; N265-D267 PolarHBondContact OD1-N 2.97Å; N265-D267 PolarHBondContact OD1-OD1 3.2Å; D267-V269 PolarHBondContact O-N 3.29Å
268	D	86.1	Confident	91.1	Very high	80 Å²	80	56 Å²	56	43%	0.428	29%	0.289	S	S	.	.	S	Bend	trans	-80.8	120.7	176.1	-171.7	-69.1	0	0	0	110.5	Q266 N270 W271	Q266-D268 VanDerWaalsContact C-N 3.3Å; Q266-D268 PolarHBondContact O-N 3.16Å; D268-N270 PolarHBondContact O-N 3.2Å; D268-N270 VanDerWaalsContact O-N 3.08Å; D268-N270 WeakPolarHBondContact OD1-CA 3.46Å; D268-N270 PolarHBondContact OD1-N 2.96Å; D268-W271 WeakPolarHBondContact CB-O 3.29Å; D268-W271 PolarHBondContact O-N 3.05Å; D268-W271 PolarHBondContact OD1-N 3.05Å
269	V	86.3	Confident	90.6	Very high	93 Å²	93	56.5 Å²	56.5	56%	0.564	29%	0.294	S	S	*	.	S	Bend	trans	-58.3	-21.7	-177.3	168.3	0	0	0	0	113.3	D267 S287 M289	D267-V269 PolarHBondContact O-N 3.29Å; V269-S287 WeakPolarHBondContact O-CB 3.42Å; V269-S287 PolarHBondContact O-OG 3.23Å; V269-M289 HydrophobicContact CG1-CE 3.33Å; V269-M289 HydrophobicContact CG1-SD 4.18Å; V269-M289 WeakPolarHBondContact O-CE 3.42Å
270	N	88	Confident	89.9	Confident	59 Å²	59	57 Å²	57	32%	0.316	31%	0.311	S	S	.	.	S	Bend	trans	-114.9	-27.4	-178	-55.2	-74.7	0	0	0	113.8	D268 S287 L290	D268-N270 PolarHBondContact O-N 3.2Å; D268-N270 VanDerWaalsContact O-N 3.08Å; D268-N270 WeakPolarHBondContact OD1-CA 3.46Å; D268-N270 PolarHBondContact OD1-N 2.96Å; N270-S287 WeakPolarHBondContact CA-OG 3.35Å; N270-S287 WeakPolarHBondContact O-CB 3.33Å; N270-S287 PolarHBondContact O-N 2.84Å; N270-S287 PolarHBondContact O-OG 3.37Å; N270-L290 HydrophobicContact CB-CB 4.4Å; N270-L290 HydrophobicContact CB-CD2 4.24Å; N270-L290 VanDerWaalsContact O-CD2 3.22Å; N270-L290 WeakPolarHBondContact O-CD2 3.22Å
271	W	92.7	Very high	89.4	Confident	27 Å²	27	60.7 Å²	60.7	10%	0.102	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	95.7	-169.5	-67	106.3	0	0	0	113.5	D243 L245 I246 D268 L284 I285 P286 L290	D243-W271 WeakPolarHBondContact OD2-CH2 3.34Å; L245-W271 HydrophobicContact CB-CZ2 4.25Å; L245-W271 WeakPolarHBondContact O-CZ2 3.4Å; I246-W271 VanDerWaalsContact CA-CZ2 3.43Å; I246-W271 HydrophobicContact CB-CH2 3.62Å; I246-W271 HydrophobicContact CB-CZ2 4.03Å; I246-W271 HydrophobicContact CB-CZ3 4.05Å; I246-W271 HydrophobicContact CD1-CZ3 4.24Å; I246-W271 HydrophobicContact CG1-CE3 4.34Å; I246-W271 HydrophobicContact CG1-CH2 3.99Å; I246-W271 HydrophobicContact CG1-CZ2 4.48Å; I246-W271 HydrophobicContact CG1-CZ3 3.91Å; D268-W271 WeakPolarHBondContact CB-O 3.29Å; D268-W271 PolarHBondContact O-N 3.05Å; D268-W271 PolarHBondContact OD1-N 3.05Å; W271-L284 HydrophobicContact CB-CD2 4.43Å; W271-L284 HydrophobicContact CE3-CB 4.26Å; W271-I285 WeakPolarHBondContact CA-O 3.31Å; W271-P286 HydrophobicContact CH2-CG 4.46Å; W271-P286 HydrophobicContact CZ3-CB 4.44Å; W271-P286 HydrophobicContact CZ3-CG 4.01Å; W271-L290 HydrophobicContact CD2-CD2 4.28Å; W271-L290 HydrophobicContact CH2-CD2 3.95Å; W271-L290 HydrophobicContact CZ2-CD2 3.57Å; W271-L290 HydrophobicContact CZ3-CD2 4.45Å
272	W	94.2	Very high	89.1	Confident	26 Å²	26	62.8 Å²	62.8	10%	0.098	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	149	177.2	-63	-20.3	0	0	0	111.8	F232 N265 Q266 L284 I285 Q288 Y340	F232-W272 HydrophobicContact CD2-CE3 4.44Å; F232-W272 HydrophobicContact CD2-CZ3 4.04Å; F232-W272 HydrophobicContact CE2-CE3 4.03Å; F232-W272 HydrophobicContact CE2-CH2 4.05Å; F232-W272 AromaticContact CE2-CZ3 3.47Å; F232-W272 HydrophobicContact CE2-CZ3 3.47Å; F232-W272 VanDerWaalsContact CE2-CZ3 3.47Å; F232-W272 HydrophobicContact CZ-CZ3 4.38Å; N265-W272 WeakPolarHBondContact O-CA 3.22Å; Q266-W272 HydrophobicContact CB-CG 4.42Å; Q266-W272 HydrophobicContact CG-CD2 4.23Å; Q266-W272 HydrophobicContact CG-CG 4.19Å; W272-L284 WeakPolarHBondContact O-CA 3.3Å; W272-I285 HydrophobicContact CB-CD1 4.41Å; W272-I285 HydrophobicContact CB-CG1 3.91Å; W272-I285 HydrophobicContact CE3-CD1 4.48Å; W272-I285 PolarHBondContact N-O 2.91Å; W272-I285 PolarHBondContact O-N 3.22Å; W272-Q288 HydrophobicContact CH2-CB 3.53Å; W272-Q288 HydrophobicContact CZ2-CB 4.29Å; W272-Q288 HydrophobicContact CZ3-CB 4.04Å; W272-Y340 HydrophobicContact CE3-CE2 4.4Å; W272-Y340 AromaticContact CZ3-CD2 3.91Å; W272-Y340 HydrophobicContact CZ3-CD2 3.91Å; W272-Y340 HydrophobicContact CZ3-CE2 4.05Å
273	Q	91.9	Very high	89	Confident	76 Å²	76	62 Å²	62	36%	0.355	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	126	171	-55.2	-177.3	-75.6	0	0	109.2	V264 N265 G283 L284	V264-Q273 HydrophobicContact CB-CB 4.39Å; V264-Q273 PolarHBondContact N-O 3.22Å; N265-Q273 HydrophobicContact CB-CB 3.91Å; N265-Q273 HydrophobicContact CB-CG 4.07Å; N265-Q273 VanDerWaalsContact CB-OE1 3.27Å; N265-Q273 PolarHBondContact N-O 3.2Å; N265-Q273 VanDerWaalsContact N-O 3.15Å; N265-Q273 PolarHBondContact ND2-OE1 2.88Å; N265-Q273 PolarHBondContact O-N 2.84Å; Q273-G283 WeakPolarHBondContact CA-O 3.46Å; Q273-L284 HydrophobicContact CG-CD2 4.06Å
274	A	95.2	Very high	89	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	168.5	-179	0	0	0	0	0	111.4	L253 L261 Q262 I263 A282 G283 I285	L253-A274 HydrophobicContact CD2-CB 4.11Å; L261-A274 HydrophobicContact CB-CB 4.26Å; L261-A274 HydrophobicContact CD1-CB 4.29Å; Q262-A274 CarbonylContact O-C 3.48Å; Q262-A274 VanDerWaalsContact O-CA 3.26Å; Q262-A274 WeakPolarHBondContact O-CA 3.4Å; I263-A274 HydrophobicContact CD1-CB 3.77Å; A274-A282 CarbonylContact O-C 3.58Å; A274-A282 VanDerWaalsContact O-CA 3.25Å; A274-A282 WeakPolarHBondContact O-CA 3.33Å; A274-G283 PolarHBondContact N-O 3.24Å; A274-G283 PolarHBondContact O-N 2.95Å; A274-I285 HydrophobicContact CB-CD1 3.7Å; A274-I285 HydrophobicContact CB-CG1 4.1Å; A274-I285 HydrophobicContact CB-CG2 4.29Å
275	R	94.3	Very high	89.3	Confident	86 Å²	86	60.5 Å²	60.5	33%	0.325	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	156.2	169.6	65.6	-177.9	-178.1	-167.1	0.5	110.8	L261 Q262 V264	L261-R275 CarbonylContact C-O 3.59Å; L261-R275 WeakPolarHBondContact CA-O 3.45Å; Q262-R275 HydrophobicContact CB-CG 4.1Å; Q262-R275 PolarHBondContact N-O 2.97Å; Q262-R275 PolarHBondContact O-N 3.13Å; Q262-R275 VanDerWaalsContact OE1-CZ 3.29Å; V264-R275 HydrophobicContact CG2-CG 4.34Å
276	H	94.3	Very high	89.7	Confident	50 Å²	50	58.1 Å²	58.1	23%	0.231	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	142	173.1	-79.6	-68.5	0	0	0	111.6	R254 D259 L261 E278 G279	R254-H276 PolarHBondContact O-NE2 3.19Å; D259-H276 IonicContact OD2-CE1 2.63Å; D259-H276 PolarHBondContact OD2-CE1 3.21Å; L261-H276 WeakPolarHBondContact CD2-ND1 3.23Å; H276-E278 PolarHBondContact O-N 3.11Å; H276-G279 PolarHBondContact O-N 3.3Å
277	V	90.9	Very high	89.9	Confident	53 Å²	53	54.3 Å²	54.3	32%	0.321	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-27.4	176.1	157.2	0	0	0	0	112.8	F231 I260 G279 W546	F231-V277 HydrophobicContact CD1-CG2 3.62Å; F231-V277 HydrophobicContact CE1-CG2 3.87Å; I260-V277 HydrophobicContact CB-CB 4.47Å; I260-V277 HydrophobicContact CB-CG2 4.01Å; I260-V277 HydrophobicContact CG2-CG2 3.77Å; I260-V277 WeakPolarHBondContact O-CB 3.31Å; I260-V277 VanDerWaalsContact O-CG2 3.31Å; I260-V277 WeakPolarHBondContact O-CG2 3.19Å; I260-V277 PolarHBondContact O-N 3.06Å; I260-V277 VanDerWaalsContact O-N 3.14Å; V277-G279 PolarHBondContact O-N 3.3Å; V277-W546 HydrophobicContact CG1-CZ2 3.87Å; V277-W546 HydrophobicContact CG2-CH2 4.22Å; V277-W546 HydrophobicContact CG2-CZ2 3.89Å
278	E	83.6	Confident	90.1	Very high	199 Å²	199	53.4 Å²	53.4	93%	0.93	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-10.8	177.6	-53	-161.2	149.5	0	0	113.2	H276	H276-E278 PolarHBondContact O-N 3.11Å
279	G	79.3	Confident	90.1	Very high	43 Å²	43	52.6 Å²	52.6	44%	0.443	30%	0.303	S	S	.	.			trans	119.9	-174.2	179.3	0	0	0	0	0	113.3	H276 V277	H276-G279 PolarHBondContact O-N 3.3Å; V277-G279 PolarHBondContact O-N 3.3Å
280	G	80.9	Confident	90.2	Very high	63 Å²	63	49 Å²	49	65%	0.649	28%	0.281	S	S	*	.			trans	111.2	176.4	-178	0	0	0	0	0	113.9
281	S	84	Confident	90.3	Very high	104 Å²	104	47.2 Å²	47.2	73%	0.727	27%	0.27	S	S	*	.			trans	-71.2	152.8	173.4	48.2	0	0	0	0	111.6
282	A	91.2	Very high	89.9	Confident	44 Å²	44	49.3 Å²	49.3	36%	0.364	28%	0.282	S	S	.	.			trans	-69.1	145	167.7	0	0	0	0	0	111	V264 A274	V264-A282 HydrophobicContact CG2-CB 4.42Å; A274-A282 CarbonylContact O-C 3.58Å; A274-A282 VanDerWaalsContact O-CA 3.25Å; A274-A282 WeakPolarHBondContact O-CA 3.33Å
283	G	92.6	Very high	89.4	Confident	10 Å²	10	52.8 Å²	52.8	10%	0.103	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	171.2	175.6	0	0	0	0	0	111.7	A251 Q273 A274	A251-G283 CarbonylContact O-C 3.46Å; A251-G283 VanDerWaalsContact O-CA 3.24Å; A251-G283 WeakPolarHBondContact O-CA 3.41Å; Q273-G283 WeakPolarHBondContact CA-O 3.46Å; A274-G283 PolarHBondContact N-O 3.24Å; A274-G283 PolarHBondContact O-N 2.95Å
284	L	93.4	Very high	89.1	Confident	31 Å²	31	52 Å²	52	16%	0.162	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	131.5	-176.6	-59.8	177.4	0	0	0	111.4	I246 A251 G252 L253 W271 W272 Q273	I246-L284 HydrophobicContact CD1-CB 4.35Å; I246-L284 HydrophobicContact CG1-CD1 4.49Å; A251-L284 HydrophobicContact CB-CD1 4.26Å; A251-L284 HydrophobicContact CB-CG 4.47Å; A251-L284 PolarHBondContact O-N 3.16Å; G252-L284 WeakPolarHBondContact CA-O 3.45Å; L253-L284 PolarHBondContact N-O 2.84Å; W271-L284 HydrophobicContact CB-CD2 4.43Å; W271-L284 HydrophobicContact CE3-CB 4.26Å; W272-L284 WeakPolarHBondContact O-CA 3.3Å; Q273-L284 HydrophobicContact CG-CD2 4.06Å
285	I	96.5	Very high	88.2	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	153	167.6	63.1	173.3	0	0	0	110	L253 F255 L261 I263 W271 W272 A274 S287 Y340	L253-I285 HydrophobicContact CB-CG2 3.84Å; L253-I285 HydrophobicContact CD2-CG2 4.03Å; L253-I285 HydrophobicContact CG-CG2 4.41Å; F255-I285 HydrophobicContact CD1-CG2 3.84Å; F255-I285 HydrophobicContact CE1-CB 3.91Å; F255-I285 HydrophobicContact CE1-CG2 3.59Å; L261-I285 HydrophobicContact CD1-CD1 3.95Å; L261-I285 HydrophobicContact CD1-CG2 4.04Å; I263-I285 HydrophobicContact CD1-CD1 4.05Å; W271-I285 WeakPolarHBondContact CA-O 3.31Å; W272-I285 HydrophobicContact CB-CD1 4.41Å; W272-I285 HydrophobicContact CB-CG1 3.91Å; W272-I285 HydrophobicContact CE3-CD1 4.48Å; W272-I285 PolarHBondContact N-O 2.91Å; W272-I285 PolarHBondContact O-N 3.22Å; A274-I285 HydrophobicContact CB-CD1 3.7Å; A274-I285 HydrophobicContact CB-CG1 4.1Å; A274-I285 HydrophobicContact CB-CG2 4.29Å; I285-S287 PolarHBondContact O-N 3.03Å; I285-Y340 HydrophobicContact CD1-CE1 4.28Å
286	P	95.1	Very high	87	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	131.8	170.8	-21.7	34.1	0	0	0	110.1	Y238 W271 L290 E291 Y340	Y238-P286 HydrophobicContact CD1-CG 4.39Å; Y238-P286 HydrophobicContact CD2-CG 3.71Å; Y238-P286 HydrophobicContact CE1-CG 4.15Å; Y238-P286 HydrophobicContact CE2-CG 3.42Å; Y238-P286 VanDerWaalsContact CE2-CG 3.42Å; Y238-P286 HydrophobicContact CG-CG 4.19Å; W271-P286 HydrophobicContact CH2-CG 4.46Å; W271-P286 HydrophobicContact CZ3-CB 4.44Å; W271-P286 HydrophobicContact CZ3-CG 4.01Å; P286-L290 HydrophobicContact CB-CD2 4.11Å; P286-E291 HydrophobicContact CB-CB 4.28Å; P286-Y340 WeakPolarHBondContact O-CE2 3.39Å; P286-Y340 PolarHBondContact O-OH 3.45Å
287	S	91.8	Very high	85.2	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.014	35%	0.345	C	S	.	.			trans	-61.6	155.4	168.8	77.6	0	0	0	0	110.3	V269 N270 I285 M289 L290 E291	V269-S287 WeakPolarHBondContact O-CB 3.42Å; V269-S287 PolarHBondContact O-OG 3.23Å; N270-S287 WeakPolarHBondContact CA-OG 3.35Å; N270-S287 WeakPolarHBondContact O-CB 3.33Å; N270-S287 PolarHBondContact O-N 2.84Å; N270-S287 PolarHBondContact O-OG 3.37Å; I285-S287 PolarHBondContact O-N 3.03Å; S287-M289 PolarHBondContact O-N 3.25Å; S287-L290 PolarHBondContact O-N 2.9Å; S287-L290 VanDerWaalsContact O-N 3.13Å; S287-L290 PolarHBondContact OG-N 3.3Å; S287-L290 VanDerWaalsContact OG-N 3.1Å; S287-E291 PolarHBondContact O-N 3.49Å; S287-E291 VanDerWaalsContact O-N 3.12Å
288	Q	89.8	Confident	83.3	Confident	76 Å²	76	62.8 Å²	62.8	36%	0.355	36%	0.358	S	S	.	.	H	α-helix	trans	-50.7	-46.9	174.5	177.8	174.8	-21.5	0	0	111.4	W272 L290 E291 E292 L339 Y340	W272-Q288 HydrophobicContact CH2-CB 3.53Å; W272-Q288 HydrophobicContact CZ2-CB 4.29Å; W272-Q288 HydrophobicContact CZ3-CB 4.04Å; Q288-L290 PolarHBondContact O-N 3.03Å; Q288-E291 PolarHBondContact O-N 3.14Å; Q288-E292 HydrophobicContact CG-CG 4.23Å; Q288-E292 VanDerWaalsContact CG-OE1 3.29Å; Q288-E292 WeakPolarHBondContact CG-OE1 3.35Å; Q288-E292 PolarHBondContact NE2-OE1 2.9Å; Q288-E292 WeakPolarHBondContact O-CB 3.48Å; Q288-E292 VanDerWaalsContact O-CG 3.3Å; Q288-E292 WeakPolarHBondContact O-CG 3.47Å; Q288-E292 PolarHBondContact O-N 2.94Å; Q288-L339 HydrophobicContact CG-CD1 4.35Å; Q288-Y340 HydrophobicContact CB-CD2 4.16Å
289	M	86.2	Confident	81.3	Confident	62 Å²	62	62.2 Å²	62.2	31%	0.305	35%	0.352	S	S	.	.	H	α-helix	trans	-69.7	-30.2	-177.7	-169.7	-141.3	50.2	0	0	113.2	V269 S287 K293	V269-M289 HydrophobicContact CG1-CE 3.33Å; V269-M289 HydrophobicContact CG1-SD 4.18Å; V269-M289 WeakPolarHBondContact O-CE 3.42Å; S287-M289 PolarHBondContact O-N 3.25Å; M289-K293 HydrophobicContact CE-CD 4.29Å; M289-K293 WeakPolarHBondContact O-CB 3.47Å; M289-K293 WeakPolarHBondContact O-CD 3.46Å; M289-K293 WeakPolarHBondContact O-CG 3.07Å; M289-K293 PolarHBondContact O-N 2.74Å; M289-K293 VanDerWaalsContact O-N 3.16Å; M289-K293 WeakPolarHBondContact SD-CE 3.26Å; M289-K293 PolarHBondContact SD-NZ 2.86Å
290	L	88.9	Confident	79.6	Confident	18 Å²	18	68.9 Å²	68.9	9%	0.094	37%	0.369	C	S	.	.	H	α-helix	trans	-65.8	-45.6	172.3	175.1	60.9	0	0	0	111	N270 W271 P286 S287 Q288 K293 R294	N270-L290 HydrophobicContact CB-CB 4.4Å; N270-L290 HydrophobicContact CB-CD2 4.24Å; N270-L290 VanDerWaalsContact O-CD2 3.22Å; N270-L290 WeakPolarHBondContact O-CD2 3.22Å; W271-L290 HydrophobicContact CD2-CD2 4.28Å; W271-L290 HydrophobicContact CH2-CD2 3.95Å; W271-L290 HydrophobicContact CZ2-CD2 3.57Å; W271-L290 HydrophobicContact CZ3-CD2 4.45Å; P286-L290 HydrophobicContact CB-CD2 4.11Å; S287-L290 PolarHBondContact O-N 2.9Å; S287-L290 VanDerWaalsContact O-N 3.13Å; S287-L290 PolarHBondContact OG-N 3.3Å; S287-L290 VanDerWaalsContact OG-N 3.1Å; Q288-L290 PolarHBondContact O-N 3.03Å; L290-K293 PolarHBondContact O-N 2.87Å; L290-R294 WeakPolarHBondContact O-CG 3.24Å; L290-R294 PolarHBondContact O-N 3.47Å
291	E	89	Confident	77.5	Confident	21 Å²	21	72.9 Å²	72.9	10%	0.098	38%	0.376	C	S	.	.	H	α-helix	trans	-77.7	-31.8	-176	-166.3	67.2	-156.6	0	0	112.9	Y236 P286 S287 Q288 R294 K295 L339	Y236-E291 HydrophobicContact CE1-CG 4.31Å; Y236-E291 HydrophobicContact CE2-CG 3.86Å; P286-E291 HydrophobicContact CB-CB 4.28Å; S287-E291 PolarHBondContact O-N 3.49Å; S287-E291 VanDerWaalsContact O-N 3.12Å; Q288-E291 PolarHBondContact O-N 3.14Å; E291-R294 PolarHBondContact O-N 2.82Å; E291-R294 WeakPolarHBondContact OE2-CD 3.36Å; E291-R294 IonicContact OE2-CZ 3.55Å; E291-R294 IonicContact OE2-NE 2.74Å; E291-R294 IonicContact OE2-NH1 3.44Å; E291-R294 PolarHBondContact OE2-NH1 3.24Å; E291-K295 HydrophobicContact CG-CD 4.4Å; E291-K295 WeakPolarHBondContact O-CG 3.45Å; E291-K295 PolarHBondContact O-N 3.42Å; E291-K295 WeakPolarHBondContact OE1-CE 3.44Å; E291-K295 IonicContact OE1-NZ 3.67Å; E291-K295 PolarHBondContact OE1-NZ 3.13Å; E291-L339 HydrophobicContact CB-CD1 3.92Å; E291-L339 HydrophobicContact CG-CD1 4.13Å; E291-L339 HydrophobicContact CG-CD2 3.95Å
292	E	85.6	Confident	75.4	Confident	72 Å²	72	73.8 Å²	73.8	34%	0.336	38%	0.377	S	S	.	.	H	α-helix	trans	-57.6	-48.8	165.2	-78.9	175.1	-178.2	0	0	111.3	Q288 R294 K295 A296 L339	Q288-E292 HydrophobicContact CG-CG 4.23Å; Q288-E292 VanDerWaalsContact CG-OE1 3.29Å; Q288-E292 WeakPolarHBondContact CG-OE1 3.35Å; Q288-E292 PolarHBondContact NE2-OE1 2.9Å; Q288-E292 WeakPolarHBondContact O-CB 3.48Å; Q288-E292 VanDerWaalsContact O-CG 3.3Å; Q288-E292 WeakPolarHBondContact O-CG 3.47Å; Q288-E292 PolarHBondContact O-N 2.94Å; E292-R294 PolarHBondContact O-N 2.76Å; E292-K295 PolarHBondContact O-N 3.14Å; E292-A296 VanDerWaalsContact O-CB 3.22Å; E292-A296 WeakPolarHBondContact O-CB 3.39Å; E292-A296 PolarHBondContact O-N 3.42Å; E292-L339 HydrophobicContact CG-CD1 3.84Å
293	K	83.1	Confident	72.7	Confident	99 Å²	99	79 Å²	79	43%	0.43	39%	0.393	S	S	.	.	H	α-helix	trans	-58.5	-47.4	176.6	-76.1	169.3	-175.9	177.9	0	111.3	M289 L290 K295 A296 F297	M289-K293 HydrophobicContact CE-CD 4.29Å; M289-K293 WeakPolarHBondContact O-CB 3.47Å; M289-K293 WeakPolarHBondContact O-CD 3.46Å; M289-K293 WeakPolarHBondContact O-CG 3.07Å; M289-K293 PolarHBondContact O-N 2.74Å; M289-K293 VanDerWaalsContact O-N 3.16Å; M289-K293 WeakPolarHBondContact SD-CE 3.26Å; M289-K293 PolarHBondContact SD-NZ 2.86Å; L290-K293 PolarHBondContact O-N 2.87Å; K293-K295 VanDerWaalsContact C-N 3.34Å; K293-K295 PolarHBondContact O-N 2.89Å; K293-A296 PolarHBondContact O-N 2.96Å; K293-F297 WeakPolarHBondContact O-CD2 3.46Å; K293-F297 PolarHBondContact O-N 3.24Å
294	R	84.6	Confident	70	Confident	58 Å²	58	86.2 Å²	86.2	22%	0.219	43%	0.429	C	S	.	.	H	α-helix	trans	-54	-49.5	176.6	-73.5	162.9	172.1	-165.7	-6.3	111.3	D243 L290 E291 E292	D243-R294 IonicContact OD1-NH2 3.28Å; D243-R294 PolarHBondContact OD1-NH2 2.9Å; D243-R294 IonicContact OD2-CZ 2.83Å; D243-R294 VanDerWaalsContact OD2-CZ 3.29Å; D243-R294 IonicContact OD2-NH1 3.6Å; D243-R294 PolarHBondContact OD2-NH1 2.88Å; D243-R294 IonicContact OD2-NH2 3.94Å; D243-R294 PolarHBondContact OD2-NH2 3.2Å; L290-R294 WeakPolarHBondContact O-CG 3.24Å; L290-R294 PolarHBondContact O-N 3.47Å; E291-R294 PolarHBondContact O-N 2.82Å; E291-R294 WeakPolarHBondContact OE2-CD 3.36Å; E291-R294 IonicContact OE2-CZ 3.55Å; E291-R294 IonicContact OE2-NE 2.74Å; E291-R294 IonicContact OE2-NH1 3.44Å; E291-R294 PolarHBondContact OE2-NH1 3.24Å; E292-R294 PolarHBondContact O-N 2.76Å
295	K	77.6	Confident	67	Low	65 Å²	65	88.9 Å²	88.9	28%	0.283	46%	0.455	S	S	.	.	H	α-helix	trans	-76	-25.9	-177.6	-66.6	176	-172.3	168.1	0	113.4	E291 E292 K293 I337 L339	E291-K295 HydrophobicContact CG-CD 4.4Å; E291-K295 WeakPolarHBondContact O-CG 3.45Å; E291-K295 PolarHBondContact O-N 3.42Å; E291-K295 WeakPolarHBondContact OE1-CE 3.44Å; E291-K295 IonicContact OE1-NZ 3.67Å; E291-K295 PolarHBondContact OE1-NZ 3.13Å; E292-K295 PolarHBondContact O-N 3.14Å; K293-K295 VanDerWaalsContact C-N 3.34Å; K293-K295 PolarHBondContact O-N 2.89Å; K295-I337 HydrophobicContact CB-CD1 3.77Å; K295-I337 HydrophobicContact CD-CG2 4.03Å; K295-L339 HydrophobicContact CD-CD2 3.99Å
296	A	67.8	Low	64.1	Low	77 Å²	77	94.9 Å²	94.9	64%	0.636	49%	0.494	S	S	*	.	H	α-helix	trans	-71.5	-30.8	175.6	0	0	0	0	0	113.7	E292 K293	E292-A296 VanDerWaalsContact O-CB 3.22Å; E292-A296 WeakPolarHBondContact O-CB 3.39Å; E292-A296 PolarHBondContact O-N 3.42Å; K293-A296 PolarHBondContact O-N 2.96Å
297	F	56.9	Low	61.5	Low	178 Å²	178	100 Å²	100	78%	0.781	54%	0.536	S	S	*	.	H	α-helix	trans	-84.5	-12.6	176.1	-69.2	-62.2	0	0	0	114.1	K293 K299	K293-F297 WeakPolarHBondContact O-CD2 3.46Å; K293-F297 PolarHBondContact O-N 3.24Å; F297-K299 PolarHBondContact O-N 3.42Å
298	V	50.7	Low	58.7	Low	97 Å²	97	103.4 Å²	103.4	59%	0.588	57%	0.572	S	S	*	*	S	Bend	trans	-70.6	110.5	168.1	176.6	0	0	0	0	108.9	K300	V298-K300 PolarHBondContact O-N 3.36Å
299	K	41.8	Very low	56.2	Low	187 Å²	187	107.1 Å²	107.1	81%	0.813	59%	0.594	S	S	*	*			trans	-59.7	102.4	158.1	-75.3	-179.6	179.6	173.4	0	107.4	F297 D301	F297-K299 PolarHBondContact O-N 3.42Å; K299-D301 PolarHBondContact O-N 3.33Å; K299-D301 VanDerWaalsContact O-N 3.07Å
300	K	45	Very low	53.7	Low	183 Å²	183	111.2 Å²	111.2	80%	0.796	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-54.9	116.4	162.4	-108	177.4	177.9	170.5	0	106.8	V298 V302	V298-K300 PolarHBondContact O-N 3.36Å; K300-V302 PolarHBondContact O-N 2.93Å
301	D	36.7	Very low	51.3	Low	146 Å²	146	115.9 Å²	115.9	78%	0.781	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-55.7	126.5	-177	-78.1	-56.8	0	0	0	109.9	K299 E303	K299-D301 PolarHBondContact O-N 3.33Å; K299-D301 VanDerWaalsContact O-N 3.07Å; D301-E303 PolarHBondContact O-N 3.48Å
302	V	39.7	Very low	48.5	Very low	124 Å²	124	122 Å²	122	75%	0.752	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-64.6	118.6	170.2	175.1	0	0	0	0	105.9	K300 L304	K300-V302 PolarHBondContact O-N 2.93Å; V302-L304 PolarHBondContact O-N 3.37Å
303	E	33.3	Very low	46	Very low	152 Å²	152	122.1 Å²	122.1	71%	0.71	71%	0.709	S	S	*	*			trans	-46.6	104.5	173.7	-74.4	-178.7	136.7	0	0	108.3	D301 A305 K508	D301-E303 PolarHBondContact O-N 3.48Å; E303-A305 VanDerWaalsContact C-N 3.27Å; E303-A305 PolarHBondContact O-N 2.87Å; E303-K508 IonicContact OE1-NZ 2.9Å; E303-K508 PolarHBondContact OE1-NZ 2.78Å; E303-K508 IonicContact OE2-NZ 3.75Å
304	L	35.8	Very low	43.8	Very low	163 Å²	163	126.2 Å²	126.2	85%	0.853	73%	0.734	S	S	*	*			trans	-72.2	88.1	-178.1	-88.8	130.7	0	0	0	108	V302	V302-L304 PolarHBondContact O-N 3.37Å
305	A	32.3	Very low	41.4	Very low	87 Å²	87	126.3 Å²	126.3	72%	0.719	75%	0.754	S	S	*	*			trans	-48.8	129.4	169.3	0	0	0	0	0	108.7	E303 A307	E303-A305 VanDerWaalsContact C-N 3.27Å; E303-A305 PolarHBondContact O-N 2.87Å; A305-A307 PolarHBondContact O-N 2.83Å
306	P	35	Very low	39.6	Very low	125 Å²	125	129.8 Å²	129.8	81%	0.812	78%	0.78	S	S	*	*			trans	-59.5	142	-170.8	23.1	-33.6	0	0	0	110.8	G308	P306-G308 PolarHBondContact O-N 2.75Å
307	A	39.8	Very low	38.2	Very low	107 Å²	107	135.5 Å²	135.5	88%	0.884	79%	0.791	S	S	*	*			trans	-63.3	90.3	-164.9	0	0	0	0	0	113.9	A305	A305-A307 PolarHBondContact O-N 2.83Å
308	G	33.7	Very low	37.3	Very low	74 Å²	74	136.5 Å²	136.5	76%	0.763	80%	0.795	S	S	*	*			trans	-80.8	133.4	164.1	0	0	0	0	0	111	P306	P306-G308 PolarHBondContact O-N 2.75Å
309	N	36.3	Very low	36.9	Very low	154 Å²	154	142 Å²	142	82%	0.824	81%	0.811	S	S	*	*			trans	-73.7	155	-165.3	-94.9	-24.5	0	0	0	116.4
310	L	33.3	Very low	36.9	Very low	148 Å²	148	141.7 Å²	141.7	78%	0.775	81%	0.809	S	S	*	*			trans	76.2	104.1	157.2	-96	71.4	0	0	0	120.8
311	C	38.8	Very low	36.7	Very low	117 Å²	117	143.1 Å²	143.1	79%	0.791	82%	0.816	S	S	*	*				38.9	108	129.7	-58.5	0	0	0	0	120.9
312	T	31.1	Very low	37	Very low	150 Å²	150	141 Å²	141	92%	0.92	80%	0.802	S	S	*	*			trans	-165.2	136.4	133.6	5.3	0	0	0	0	113.3
313	G	33	Very low	37.1	Very low	74 Å²	74	143 Å²	143	76%	0.763	81%	0.805	S	S	*	*			trans	66.2	103	153.6	0	0	0	0	0	119.8	G315	G313-G315 PolarHBondContact O-N 3.11Å
314	L	37	Very low	37.2	Very low	184 Å²	184	143.3 Å²	143.3	96%	0.963	80%	0.801	S	S	*	*			trans	-72	73.2	161.7	-79.1	170.2	0	0	0	111.5	V316	L314-V316 PolarHBondContact O-N 2.91Å
315	G	33.1	Very low	37.5	Very low	61 Å²	61	138.9 Å²	138.9	63%	0.629	78%	0.781	S	S	*	*			trans	-73.4	102.2	175.4	0	0	0	0	0	112.1	G313 K317	G313-G315 PolarHBondContact O-N 3.11Å; G315-K317 PolarHBondContact O-N 3.33Å
316	V	39.6	Very low	38	Very low	138 Å²	138	139.7 Å²	139.7	84%	0.836	78%	0.777	S	S	*	*			trans	-62.2	99.5	172	179.9	0	0	0	0	109.5	L314 K318	L314-V316 PolarHBondContact O-N 2.91Å; V316-K318 PolarHBondContact O-N 3.02Å
317	K	39.8	Very low	38.6	Very low	197 Å²	197	138.7 Å²	138.7	86%	0.857	77%	0.769	S	S	*	*			trans	-66.7	98.3	177.5	-70	-177.4	179.9	177	0	109.5	G315 K319	G315-K317 PolarHBondContact O-N 3.33Å; K317-K319 PolarHBondContact O-N 3.11Å
318	K	38.5	Very low	38.8	Very low	198 Å²	198	139.9 Å²	139.9	86%	0.861	75%	0.754	S	S	*	*			trans	-47.2	124	170	-76.9	-176.3	172.9	-179	0	109.5	V316 K320	V316-K318 PolarHBondContact O-N 3.02Å; K318-K320 PolarHBondContact O-N 2.68Å
319	K	41.9	Very low	39.5	Very low	212 Å²	212	137.5 Å²	137.5	92%	0.922	72%	0.724	S	S	*	*			trans	-57.5	103.2	172.5	-88.3	-174	172.7	-179.1	0	109	K317 K321	K317-K319 PolarHBondContact O-N 3.11Å; K319-K321 PolarHBondContact O-N 2.91Å
320	K	40.8	Very low	40.2	Very low	181 Å²	181	132.7 Å²	132.7	79%	0.787	71%	0.705	S	S	*	*			trans	-73.9	109.4	174.4	-133.7	-179.9	-175	-178.8	0	107.1	K318 M322	K318-K320 PolarHBondContact O-N 2.68Å; K320-M322 VanDerWaalsContact C-N 3.35Å; K320-M322 PolarHBondContact O-N 2.96Å
321	K	42	Very low	40.5	Very low	214 Å²	214	131.9 Å²	131.9	93%	0.93	70%	0.697	S	S	*	*			trans	-64.1	100.1	163.4	-80.5	-169.8	173.8	-173.9	0	107.1	K319	K319-K321 PolarHBondContact O-N 2.91Å
322	M	42.8	Very low	40.8	Very low	101 Å²	101	130.9 Å²	130.9	50%	0.498	68%	0.68	S	S	.	*	P	Polyproline II helix	trans	-89.8	133.9	167.2	-82.7	-178.4	57.9	0	0	108.6	K320 K328	K320-M322 VanDerWaalsContact C-N 3.35Å; K320-M322 PolarHBondContact O-N 2.96Å; M322-K328 HydrophobicContact CE-CD 4.28Å
323	M	40.8	Very low	41.6	Very low	165 Å²	165	125.6 Å²	125.6	81%	0.813	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-70.9	150.1	168.1	-60.8	-130.3	-62.9	0	0	109.6	V325	M323-V325 PolarHBondContact O-N 2.99Å
324	Y	35.9	Very low	42.3	Very low	159 Å²	159	130.9 Å²	130.9	62%	0.624	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-61.9	127.7	174.2	-172.2	-91.6	0	0	0	110	N329	Y324-N329 PolarHBondContact OH-ND2 3.26Å
325	V	42.2	Very low	42.9	Very low	70 Å²	70	129 Å²	129	42%	0.424	63%	0.629	S	S	.	*			trans	-142.7	110.2	178.2	176.9	0	0	0	0	107.2	M323 T327 K328 N329	M323-V325 PolarHBondContact O-N 2.99Å; V325-T327 PolarHBondContact O-N 3.38Å; V325-K328 PolarHBondContact O-N 2.83Å; V325-N329 PolarHBondContact O-OD1 3.31Å
326	T	42.7	Very low	44	Very low	104 Å²	104	132.2 Å²	132.2	64%	0.638	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-49.7	-35.6	-171.8	-38.6	0	0	0	0	113.5	K328 N329	T326-K328 PolarHBondContact O-N 3.4Å; T326-N329 WeakPolarHBondContact CA-OD1 3.42Å; T326-N329 PolarHBondContact O-N 2.74Å; T326-N329 PolarHBondContact O-OD1 3.06Å
327	T	47.1	Very low	45.5	Very low	104 Å²	104	128.9 Å²	128.9	64%	0.638	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-68.8	1.4	177.4	-20.9	0	0	0	0	114.7	V325 Y420	V325-T327 PolarHBondContact O-N 3.38Å; T327-Y420 WeakPolarHBondContact CG2-OH 3.47Å
328	K	44.3	Very low	47.5	Very low	132 Å²	132	122 Å²	122	57%	0.574	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-132.4	19.6	179.9	-64.1	-167.8	176.7	-173.6	0	113.2	M322 V325 T326 A330	M322-K328 HydrophobicContact CE-CD 4.28Å; V325-K328 PolarHBondContact O-N 2.83Å; T326-K328 PolarHBondContact O-N 3.4Å; K328-A330 PolarHBondContact O-N 2.84Å; K328-A330 VanDerWaalsContact O-N 3.14Å
329	N	48.4	Very low	49.9	Very low	25 Å²	25	112.7 Å²	112.7	13%	0.134	54%	0.536	C	S	.	.	G	3₁₀ helix	trans	-63	-21.5	-174.3	-76.3	9	0	0	0	114.5	Y324 V325 T326 E331 F332 D333	Y324-N329 PolarHBondContact OH-ND2 3.26Å; V325-N329 PolarHBondContact O-OD1 3.31Å; T326-N329 WeakPolarHBondContact CA-OD1 3.42Å; T326-N329 PolarHBondContact O-N 2.74Å; T326-N329 PolarHBondContact O-OD1 3.06Å; N329-E331 PolarHBondContact O-N 3.35Å; N329-F332 CarbonylContact O-C 3.58Å; N329-F332 WeakPolarHBondContact O-CA 3.38Å; N329-F332 WeakPolarHBondContact O-CB 3.47Å; N329-F332 PolarHBondContact O-N 2.93Å; N329-D333 VanDerWaalsContact C-CG 3.49Å; N329-D333 WeakPolarHBondContact CB-OD2 3.5Å; N329-D333 PolarHBondContact O-N 2.75Å
330	A	50.8	Low	52.3	Low	53 Å²	53	103.2 Å²	103.2	44%	0.438	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-57.8	-10.1	-174.4	0	0	0	0	0	117.3	K328 D333 R334	K328-A330 PolarHBondContact O-N 2.84Å; K328-A330 VanDerWaalsContact O-N 3.14Å; A330-D333 VanDerWaalsContact CA-OD2 3.25Å; A330-D333 WeakPolarHBondContact CA-OD2 3.27Å; A330-D333 PolarHBondContact N-OD2 3.23Å; A330-D333 VanDerWaalsContact N-OD2 3.1Å; A330-R334 PolarHBondContact O-NE 2.83Å
331	E	39.8	Very low	54.8	Low	130 Å²	130	95.8 Å²	95.8	61%	0.607	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-92.5	-33.6	167.6	-65.2	-170.7	148.1	0	0	112.7	N329 H335	N329-E331 PolarHBondContact O-N 3.35Å; E331-H335 PolarHBondContact O-CE1 3.27Å
332	F	44.4	Very low	57.3	Low	97 Å²	97	88.6 Å²	88.6	43%	0.425	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-39.3	173.1	-63.1	-82.8	0	0	0	112	N329 R334 H335	N329-F332 CarbonylContact O-C 3.58Å; N329-F332 WeakPolarHBondContact O-CA 3.38Å; N329-F332 WeakPolarHBondContact O-CB 3.47Å; N329-F332 PolarHBondContact O-N 2.93Å; F332-R334 PolarHBondContact O-N 3.14Å; F332-H335 PolarHBondContact O-N 3.23Å; F332-H335 PolarHBondContact O-ND1 2.89Å
333	D	48.5	Very low	59.7	Low	39 Å²	39	84 Å²	84	21%	0.209	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-53.9	-17.4	178.7	-68.3	-39.1	0	0	0	113.8	N329 A330 H335 K455	N329-D333 VanDerWaalsContact C-CG 3.49Å; N329-D333 WeakPolarHBondContact CB-OD2 3.5Å; N329-D333 PolarHBondContact O-N 2.75Å; A330-D333 VanDerWaalsContact CA-OD2 3.25Å; A330-D333 WeakPolarHBondContact CA-OD2 3.27Å; A330-D333 PolarHBondContact N-OD2 3.23Å; A330-D333 VanDerWaalsContact N-OD2 3.1Å; D333-H335 PolarHBondContact O-N 2.85Å; D333-K455 WeakPolarHBondContact OD1-CE 3.47Å; D333-K455 IonicContact OD1-NZ 3.16Å; D333-K455 PolarHBondContact OD1-NZ 2.96Å
334	R	47.8	Very low	62.2	Low	185 Å²	185	77.1 Å²	77.1	70%	0.698	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-69.7	-9.9	175.8	-56.3	-175.7	-175.2	-154	2.9	114.3	A330 F332	A330-R334 PolarHBondContact O-NE 2.83Å; F332-R334 PolarHBondContact O-N 3.14Å
335	H	49	Very low	65	Low	143 Å²	143	75.6 Å²	75.6	66%	0.662	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-111.4	-4	-175	-48.3	83.6	0	0	0	112.9	E331 F332 D333 I337	E331-H335 PolarHBondContact O-CE1 3.27Å; F332-H335 PolarHBondContact O-N 3.23Å; F332-H335 PolarHBondContact O-ND1 2.89Å; D333-H335 PolarHBondContact O-N 2.85Å; H335-I337 PolarHBondContact O-N 2.96Å
336	E	57.9	Low	67.3	Low	129 Å²	129	73.4 Å²	73.4	60%	0.603	36%	0.363	S	S	*	.			trans	-81.9	101	175.7	-173	171.4	-131.1	0	0	108.7	K455	E336-K455 IonicContact OE2-NZ 3.4Å; E336-K455 PolarHBondContact OE2-NZ 3.04Å
337	I	69.8	Low	69.8	Low	68 Å²	68	73.1 Å²	73.1	35%	0.349	36%	0.363	S	S	.	.			trans	-100.6	92.6	-178.2	-48.5	-178.2	0	0	0	108.6	K295 H335 L339	K295-I337 HydrophobicContact CB-CD1 3.77Å; K295-I337 HydrophobicContact CD-CG2 4.03Å; H335-I337 PolarHBondContact O-N 2.96Å; I337-L339 HydrophobicContact CG2-CD2 3.74Å; I337-L339 HydrophobicContact CG2-CG 3.9Å; I337-L339 PolarHBondContact O-N 3.05Å; I337-L339 VanDerWaalsContact O-N 3.15Å
338	L	82.2	Confident	72	Confident	52 Å²	52	71.2 Å²	71.2	27%	0.272	35%	0.352	S	S	.	.			trans	-69.2	111.6	172.1	-169	65.8	0	0	0	109.3	H235 E341 H515	H235-L338 HydrophobicContact CB-CG 4.36Å; H235-L338 WeakPolarHBondContact CB-O 3.44Å; L338-E341 HydrophobicContact CD1-CB 4.4Å; L338-H515 HydrophobicContact CD2-CB 4.3Å
339	L	89.6	Confident	74.3	Confident	3 Å²	3	67.2 Å²	67.2	2%	0.016	34%	0.335	C	S	.	.			trans	-108.4	-47.2	-179.6	-66.6	171.5	0	0	0	111.5	H235 Y236 Q288 E291 E292 K295 I337	H235-L339 PolarHBondContact N-O 2.89Å; Y236-L339 HydrophobicContact CD1-CB 4.24Å; Y236-L339 HydrophobicContact CD1-CD2 3.74Å; Y236-L339 HydrophobicContact CE1-CB 4.13Å; Y236-L339 HydrophobicContact CE1-CD2 3.95Å; Y236-L339 HydrophobicContact CG-CD2 4.28Å; Q288-L339 HydrophobicContact CG-CD1 4.35Å; E291-L339 HydrophobicContact CB-CD1 3.92Å; E291-L339 HydrophobicContact CG-CD1 4.13Å; E291-L339 HydrophobicContact CG-CD2 3.95Å; E292-L339 HydrophobicContact CG-CD1 3.84Å; K295-L339 HydrophobicContact CD-CD2 3.99Å; I337-L339 HydrophobicContact CG2-CD2 3.74Å; I337-L339 HydrophobicContact CG2-CG 3.9Å; I337-L339 PolarHBondContact O-N 3.05Å; I337-L339 VanDerWaalsContact O-N 3.15Å
340	Y	92.1	Very high	76.5	Confident	13 Å²	13	74 Å²	74	5%	0.051	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	140.2	179.3	-59.7	-63.8	0	0	0	108.3	F232 K233 Y236 F255 W272 I285 P286 Q288	F232-Y340 HydrophobicContact CB-CD1 4.26Å; F232-Y340 HydrophobicContact CB-CG 4.46Å; F232-Y340 HydrophobicContact CD2-CG 4.31Å; F232-Y340 HydrophobicContact CG-CG 4.49Å; K233-Y340 VanDerWaalsContact O-CA 3.31Å; K233-Y340 WeakPolarHBondContact O-CA 3.36Å; Y236-Y340 HydrophobicContact CE1-CE1 4.12Å; Y236-Y340 HydrophobicContact CE1-CE2 4.44Å; Y236-Y340 AromaticContact CE1-CZ 3.97Å; Y236-Y340 PolarHBondContact OH-OH 3.32Å; F255-Y340 HydrophobicContact CE2-CE1 4.31Å; F255-Y340 AromaticContact CZ-CE1 3.84Å; F255-Y340 HydrophobicContact CZ-CE1 3.84Å; F255-Y340 WeakPolarHBondContact CZ-OH 3.46Å; W272-Y340 HydrophobicContact CE3-CE2 4.4Å; W272-Y340 AromaticContact CZ3-CD2 3.91Å; W272-Y340 HydrophobicContact CZ3-CD2 3.91Å; W272-Y340 HydrophobicContact CZ3-CE2 4.05Å; I285-Y340 HydrophobicContact CD1-CE1 4.28Å; P286-Y340 WeakPolarHBondContact O-CE2 3.39Å; P286-Y340 PolarHBondContact O-OH 3.45Å; Q288-Y340 HydrophobicContact CB-CD2 4.16Å
341	E	92.6	Very high	78.6	Confident	25 Å²	25	72.1 Å²	72.1	12%	0.117	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	125.1	174.8	-177	178.8	-122.3	0	0	108.6	F232 K233 H235 L338 V343 R458 P548	F232-E341 CarbonylContact C-O 3.54Å; F232-E341 WeakPolarHBondContact CA-O 3.4Å; K233-E341 HydrophobicContact CB-CB 4.45Å; K233-E341 PolarHBondContact N-O 2.99Å; K233-E341 PolarHBondContact O-N 3.39Å; H235-E341 VanDerWaalsContact NE2-CB 3.34Å; H235-E341 WeakPolarHBondContact NE2-CB 3.4Å; H235-E341 IonicContact NE2-OE2 3.13Å; L338-E341 HydrophobicContact CD1-CB 4.4Å; E341-V343 HydrophobicContact CG-CG1 4.43Å; E341-V343 PolarHBondContact O-N 3.2Å; E341-R458 IonicContact OE1-CZ 3.29Å; E341-R458 VanDerWaalsContact OE1-CZ 3.25Å; E341-R458 IonicContact OE1-NE 2.97Å; E341-R458 PolarHBondContact OE1-NE 3.4Å; E341-R458 IonicContact OE1-NH2 2.73Å; E341-R458 PolarHBondContact OE1-NH2 3.37Å; E341-R458 IonicContact OE2-CZ 2.66Å; E341-R458 IonicContact OE2-NH2 3.67Å; E341-R458 PolarHBondContact OE2-NH2 2.84Å; E341-P548 HydrophobicContact CG-CB 4.42Å; E341-P548 HydrophobicContact CG-CG 4.46Å
342	E	93.8	Very high	81.3	Confident	64 Å²	64	69.2 Å²	69.2	30%	0.299	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	124.1	176	-155.6	-168.5	160.7	0	0	109.8	R228 V230 F231 F232 P548 V549	R228-E342 IonicContact CZ-OE1 3.67Å; R228-E342 IonicContact NE-OE1 2.73Å; R228-E342 IonicContact NH2-OE1 3.27Å; R228-E342 PolarHBondContact NH2-OE1 2.88Å; R228-E342 IonicContact NH2-OE2 3.31Å; V230-E342 HydrophobicContact CG1-CG 4.14Å; F231-E342 WeakPolarHBondContact O-CA 3.16Å; F232-E342 HydrophobicContact CD1-CB 4.11Å; F232-E342 HydrophobicContact CD1-CG 4.27Å; F232-E342 HydrophobicContact CE1-CB 3.92Å; F232-E342 HydrophobicContact CE1-CG 4Å; E342-P548 CarbonylContact O-C 3.48Å; E342-P548 WeakPolarHBondContact O-CA 3.38Å; E342-V549 HydrophobicContact CB-CB 4.22Å; E342-V549 HydrophobicContact CB-CG2 4.01Å; E342-V549 HydrophobicContact CG-CB 4.32Å; E342-V549 HydrophobicContact CG-CG2 3.68Å; E342-V549 PolarHBondContact O-N 2.88Å
343	V	95.1	Very high	83.8	Confident	5 Å²	5	64.6 Å²	64.6	3%	0.03	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	140.3	-174	-70.2	0	0	0	0	112.9	F231 K233 I260 E341 W546 V547	F231-V343 HydrophobicContact CB-CG2 4.08Å; F231-V343 PolarHBondContact O-N 3.5Å; K233-V343 HydrophobicContact CB-CG1 3.94Å; K233-V343 HydrophobicContact CB-CG2 4.32Å; I260-V343 HydrophobicContact CD1-CG2 4.4Å; I260-V343 HydrophobicContact CG2-CG2 3.93Å; E341-V343 HydrophobicContact CG-CG1 4.43Å; E341-V343 PolarHBondContact O-N 3.2Å; V343-W546 HydrophobicContact CB-CB 4.43Å; V343-W546 HydrophobicContact CB-CE3 4.03Å; V343-W546 HydrophobicContact CG2-CD2 4.36Å; V343-W546 HydrophobicContact CG2-CE3 3.66Å; V343-W546 HydrophobicContact CG2-CZ3 4.19Å; V343-V547 CarbonylContact C-O 3.41Å; V343-V547 WeakPolarHBondContact CA-O 3.41Å; V343-V547 WeakPolarHBondContact CB-O 3.33Å
344	A	93.4	Very high	86.2	Confident	19 Å²	19	62.7 Å²	62.7	16%	0.157	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	143	171.1	0	0	0	0	0	110.3	W546 V547 V549 V552	A344-W546 WeakPolarHBondContact O-CA 3.46Å; A344-V547 PolarHBondContact N-O 3.02Å; A344-V547 PolarHBondContact O-N 3.19Å; A344-V549 HydrophobicContact CB-CG2 4.22Å; A344-V552 HydrophobicContact CB-CG2 4.15Å
345	K	93.6	Very high	88.6	Confident	127 Å²	127	53.9 Å²	53.9	55%	0.552	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	104.6	173.9	-165.9	174.5	-170.2	171.3	0	109.9	P544 Q545 W546	K345-P544 HydrophobicContact CG-CB 4.36Å; K345-Q545 CarbonylContact C-O 3.56Å; K345-Q545 WeakPolarHBondContact CA-O 3.4Å; K345-W546 HydrophobicContact CB-CD2 4.01Å; K345-W546 HydrophobicContact CB-CE3 3.79Å; K345-W546 HydrophobicContact CB-CH2 3.79Å; K345-W546 HydrophobicContact CB-CZ2 3.99Å; K345-W546 HydrophobicContact CB-CZ3 3.69Å; K345-W546 HydrophobicContact CD-CH2 4.28Å; K345-W546 HydrophobicContact CD-CZ2 3.77Å; K345-W546 HydrophobicContact CG-CD2 4.28Å; K345-W546 HydrophobicContact CG-CZ2 4.21Å
346	V	91.6	Very high	90.9	Very high	24 Å²	24	47.1 Å²	47.1	15%	0.145	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	155.6	-178.6	-63.4	0	0	0	0	112.2	F349 P544 Q545 V547 V552	V346-F349 HydrophobicContact CG2-CD1 3.74Å; V346-F349 HydrophobicContact CG2-CE1 3.54Å; V346-P544 CarbonylContact O-C 3.59Å; V346-P544 VanDerWaalsContact O-CA 3.29Å; V346-P544 WeakPolarHBondContact O-CA 3.21Å; V346-P544 WeakPolarHBondContact O-CB 3.29Å; V346-Q545 HydrophobicContact CG2-CB 4.19Å; V346-Q545 WeakPolarHBondContact CG2-O 3.31Å; V346-Q545 PolarHBondContact N-O 3Å; V346-Q545 PolarHBondContact O-N 3.28Å; V346-V547 HydrophobicContact CB-CG2 4.43Å; V346-V547 HydrophobicContact CG1-CG2 3.75Å; V346-V547 HydrophobicContact CG2-CG1 4.04Å; V346-V547 HydrophobicContact CG2-CG2 3.78Å; V346-V552 HydrophobicContact CG1-CG2 3.64Å
347	P	93.2	Very high	92.8	Very high	99 Å²	99	41 Å²	41	64%	0.643	21%	0.206	S	C	*	.	P	Polyproline II helix	trans	-56.7	163	171.2	-24.9	35.3	0	0	0	113.3	F349	P347-F349 PolarHBondContact O-N 3.49Å
348	P	94.1	Very high	94	Very high	64 Å²	64	37.7 Å²	37.7	42%	0.416	19%	0.19	S	C	.	.	P	Polyproline II helix	trans	-57.8	127.1	178.9	-19.2	28.7	0	0	0	112.6	K542 N543	P348-K542 VanDerWaalsContact CG-O 3.28Å; P348-K542 WeakPolarHBondContact CG-O 3.45Å; P348-N543 WeakPolarHBondContact CA-O 3.32Å
349	F	93.5	Very high	94.6	Very high	47 Å²	47	35.3 Å²	35.3	21%	0.206	18%	0.177	C	C	.	.			trans	-140.2	157.1	178.1	75	-89.8	0	0	0	112.1	V346 P347 R351 L463 Q545 V547	V346-F349 HydrophobicContact CG2-CD1 3.74Å; V346-F349 HydrophobicContact CG2-CE1 3.54Å; P347-F349 PolarHBondContact O-N 3.49Å; F349-R351 HydrophobicContact CE2-CG 4.36Å; F349-L463 HydrophobicContact CD2-CD1 4.02Å; F349-L463 HydrophobicContact CE2-CB 4.17Å; F349-L463 HydrophobicContact CE2-CD1 3.84Å; F349-L463 HydrophobicContact CE2-CD2 4.06Å; F349-L463 HydrophobicContact CE2-CG 4.25Å; F349-L463 HydrophobicContact CZ-CD2 4.37Å; F349-Q545 HydrophobicContact CE1-CB 3.95Å; F349-Q545 HydrophobicContact CE1-CG 4.23Å; F349-Q545 PolarHBondContact O-NE2 3.49Å; F349-V547 HydrophobicContact CE1-CG1 3.71Å; F349-V547 HydrophobicContact CZ-CG1 3.78Å
350	K	93.1	Very high	94.5	Very high	167 Å²	167	42.6 Å²	42.6	73%	0.726	21%	0.211	S	C	*	.			trans	-84.7	123.1	176.7	-64.8	-179.6	-177.9	177.4	0	110.6
351	R	95.4	Very high	94.1	Very high	15 Å²	15	44.7 Å²	44.7	6%	0.057	24%	0.237	C	C	.	.			trans	-61.2	134.4	169.2	-66.1	-81.5	174.8	121.7	1.8	109.3	F349 L463 P464 Y465 D518 V540 Q545	F349-R351 HydrophobicContact CE2-CG 4.36Å; R351-L463 WeakPolarHBondContact CA-O 3.47Å; R351-L463 WeakPolarHBondContact CB-O 3.4Å; R351-L463 VanDerWaalsContact CD-O 3.22Å; R351-L463 WeakPolarHBondContact CD-O 3.48Å; R351-P464 WeakPolarHBondContact CD-O 3.23Å; R351-P464 PolarHBondContact NH1-O 2.9Å; R351-Y465 HydrophobicContact CG-CD2 4.32Å; R351-D518 IonicContact CZ-OD1 3.44Å; R351-D518 IonicContact NH1-OD1 2.67Å; R351-D518 PolarHBondContact NH1-OD1 2.91Å; R351-D518 IonicContact NH1-OD2 2.88Å; R351-D518 PolarHBondContact NH1-OD2 3.42Å; R351-D518 IonicContact NH2-OD1 3.56Å; R351-V540 HydrophobicContact CG-CG2 4.08Å; R351-Q545 VanDerWaalsContact CZ-OE1 3.3Å
352	K	96.6	Very high	93.9	Very high	68 Å²	68	43.7 Å²	43.7	30%	0.296	23%	0.232	S	C	.	.	S	Bend	trans	-83.3	-32.2	-174.2	-64.4	163.1	174.4	169	0	112	V439 V444 C445 S460 E461 F462 L463	K352-V439 HydrophobicContact CB-CG1 4Å; K352-V439 HydrophobicContact CB-CG2 3.93Å; K352-V439 HydrophobicContact CD-CG1 4.16Å; K352-V439 HydrophobicContact CG-CG1 3.89Å; K352-V444 WeakPolarHBondContact O-CA 3.2Å; K352-C445 PolarHBondContact O-N 2.74Å; K352-S460 PolarHBondContact NZ-O 3.18Å; K352-E461 WeakPolarHBondContact CD-O 3.3Å; K352-E461 WeakPolarHBondContact CE-O 3.45Å; K352-E461 PolarHBondContact NZ-O 3.06Å; K352-F462 WeakPolarHBondContact CB-O 3.37Å; K352-L463 HydrophobicContact CB-CB 4.33Å; K352-L463 HydrophobicContact CD-CB 4.09Å; K352-L463 HydrophobicContact CD-CD1 3.89Å; K352-L463 HydrophobicContact CD-CG 4.05Å; K352-L463 HydrophobicContact CG-CB 4.15Å; K352-L463 HydrophobicContact CG-CD1 4.11Å; K352-L463 HydrophobicContact CG-CG 4.47Å; K352-L463 PolarHBondContact N-O 2.71Å; K352-L463 VanDerWaalsContact N-O 3.17Å
353	T	97.9	Very high	93.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	146.5	-179.9	61.3	0	0	0	0	111.5	I435 C445 L447 F462 P464 Y465	T353-I435 HydrophobicContact CG2-CG2 3.64Å; T353-C445 CarbonylContact C-O 3.46Å; T353-C445 WeakPolarHBondContact CA-O 3.34Å; T353-C445 HydrophobicContact CG2-CB 4.24Å; T353-L447 HydrophobicContact CG2-CD1 4.4Å; T353-F462 HydrophobicContact CG2-CB 4.14Å; T353-F462 WeakPolarHBondContact CG2-O 3.27Å; T353-F462 PolarHBondContact N-O 3.48Å; T353-F462 PolarHBondContact OG1-O 3.48Å; T353-P464 VanDerWaalsContact OG1-CA 3.25Å; T353-P464 WeakPolarHBondContact OG1-CA 3.39Å; T353-Y465 PolarHBondContact O-N 3.16Å
354	L	98.3	Very high	93.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	112.1	170	171.4	66.3	0	0	0	107.2	L356 L371 F379 V444 C445 I446 L447 Y465 V467 V533 L537	L354-L356 HydrophobicContact CD1-CD2 4.28Å; L354-L356 HydrophobicContact CD2-CD2 4.25Å; L354-L356 HydrophobicContact CG-CD2 4.07Å; L354-L371 HydrophobicContact CD2-CD1 3.81Å; L354-F379 HydrophobicContact CD2-CE1 4.15Å; L354-V444 HydrophobicContact CB-CG1 3.87Å; L354-C445 PolarHBondContact N-O 2.73Å; L354-I446 HydrophobicContact CB-CG1 4.49Å; L354-I446 HydrophobicContact CD2-CD1 4.32Å; L354-I446 HydrophobicContact CD2-CG1 4.16Å; L354-I446 HydrophobicContact CD2-CG2 4.28Å; L354-I446 CarbonylContact O-C 3.52Å; L354-I446 WeakPolarHBondContact O-CA 3.25Å; L354-L447 PolarHBondContact O-N 3.27Å; L354-Y465 HydrophobicContact CD1-CD1 4.17Å; L354-V467 HydrophobicContact CD1-CG2 3.68Å; L354-V533 HydrophobicContact CD1-CG1 4.04Å; L354-V533 HydrophobicContact CD2-CG1 3.91Å; L354-L537 HydrophobicContact CD1-CD1 4.26Å; L354-L537 HydrophobicContact CD2-CD1 4.16Å
355	V	98.1	Very high	93.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	115.5	-175.6	-165.1	0	0	0	0	109	I357 L447 A449 L454 L457 P464 Y465 V466 V467	V355-I357 HydrophobicContact CG1-CD1 3.74Å; V355-I357 HydrophobicContact CG1-CG1 4.11Å; V355-L447 HydrophobicContact CG1-CB 4.48Å; V355-A449 HydrophobicContact CG1-CB 3.95Å; V355-L454 HydrophobicContact CB-CD2 4.5Å; V355-L454 HydrophobicContact CG1-CD2 3.94Å; V355-L457 HydrophobicContact CG1-CD1 3.93Å; V355-L457 HydrophobicContact CG2-CD1 3.89Å; V355-P464 HydrophobicContact CG2-CB 3.67Å; V355-Y465 PolarHBondContact N-O 3Å; V355-V466 HydrophobicContact CB-CG2 4.41Å; V355-V467 PolarHBondContact O-N 3.37Å
356	L	97.8	Very high	93.3	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	111.2	177.5	-57	-176.7	0	0	0	109.7	L354 R364 L367 K368 I446 L447 A449 V467	L354-L356 HydrophobicContact CD1-CD2 4.28Å; L354-L356 HydrophobicContact CD2-CD2 4.25Å; L354-L356 HydrophobicContact CG-CD2 4.07Å; L356-R364 HydrophobicContact CB-CB 4.5Å; L356-R364 HydrophobicContact CB-CG 4.41Å; L356-R364 VanDerWaalsContact O-CD 3.31Å; L356-R364 WeakPolarHBondContact O-CD 3.42Å; L356-L367 HydrophobicContact CD1-CD2 4.3Å; L356-L367 HydrophobicContact CD1-CG 4.45Å; L356-L367 HydrophobicContact CD2-CD2 4.16Å; L356-K368 HydrophobicContact CD1-CB 4Å; L356-I446 HydrophobicContact CD1-CG2 3.84Å; L356-I446 HydrophobicContact CG-CG2 4.08Å; L356-L447 PolarHBondContact N-O 2.83Å; L356-A449 PolarHBondContact O-N 3.46Å; L356-V467 HydrophobicContact CD2-CB 4.13Å
357	I	97.4	Very high	93.5	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	153.1	178	-55	-60.6	0	0	0	109	V355 A449 P451 L454 V466 V467 F468 L469 I509 F517	V355-I357 HydrophobicContact CG1-CD1 3.74Å; V355-I357 HydrophobicContact CG1-CG1 4.11Å; I357-A449 HydrophobicContact CD1-CB 4.14Å; I357-P451 HydrophobicContact CG2-CB 4.28Å; I357-P451 HydrophobicContact CG2-CG 3.87Å; I357-L454 HydrophobicContact CD1-CD1 4.35Å; I357-L454 HydrophobicContact CD1-CD2 4.05Å; I357-L454 HydrophobicContact CD1-CG 4.19Å; I357-L454 HydrophobicContact CG1-CD1 4.19Å; I357-L454 HydrophobicContact CG1-CD2 4.09Å; I357-L454 HydrophobicContact CG1-CG 4.42Å; I357-V466 HydrophobicContact CG1-CG1 3.95Å; I357-V467 PolarHBondContact N-O 3.03Å; I357-F468 HydrophobicContact CB-CD2 4.4Å; I357-F468 HydrophobicContact CG2-CD2 4.11Å; I357-F468 WeakPolarHBondContact O-CA 3.49Å; I357-L469 PolarHBondContact O-N 3Å; I357-I509 HydrophobicContact CG2-CG2 3.83Å; I357-F517 HydrophobicContact CB-CE1 4.34Å; I357-F517 HydrophobicContact CG2-CE1 3.98Å; I357-F517 HydrophobicContact CG2-CZ 4.09Å
358	G	95.2	Very high	93.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.8	162.8	-175.6	0	0	0	0	0	112.9	R364 L469	G358-R364 VanDerWaalsContact O-CZ 3.22Å; G358-R364 PolarHBondContact O-NE 2.96Å; G358-R364 PolarHBondContact O-NH2 2.89Å; G358-L469 WeakPolarHBondContact CA-O 3.25Å
359	A	93.7	Very high	93.6	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.008	23%	0.225	C	C	.	.			trans	-59.9	160.2	177.6	0	0	0	0	0	113.3	G361 V362 T502 E505	A359-G361 PolarHBondContact O-N 2.88Å; A359-V362 HydrophobicContact CB-CB 4.49Å; A359-V362 VanDerWaalsContact O-CG1 3.23Å; A359-V362 WeakPolarHBondContact O-CG1 3.4Å; A359-V362 PolarHBondContact O-N 3.4Å; A359-T502 HydrophobicContact CB-CG2 3.86Å; A359-T502 WeakPolarHBondContact CB-O 3.47Å; A359-E505 WeakPolarHBondContact CA-OE2 3.44Å; A359-E505 HydrophobicContact CB-CB 3.94Å; A359-E505 HydrophobicContact CB-CG 4.04Å; A359-E505 WeakPolarHBondContact CB-OE2 3.48Å
360	Q	87.9	Confident	93.6	Very high	156 Å²	156	45.7 Å²	45.7	73%	0.729	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	130.4	169.1	-179.3	168.2	-48.2	0	0	109.5	T502 E505	Q360-T502 WeakPolarHBondContact O-CG2 3.28Å; Q360-T502 PolarHBondContact O-OG1 3.12Å; Q360-T502 VanDerWaalsContact O-OG1 3.14Å; Q360-E505 PolarHBondContact N-OE2 3.42Å
361	G	83.6	Confident	93.8	Very high	57 Å²	57	37.7 Å²	37.7	59%	0.588	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	97.9	-25.2	-178.5	0	0	0	0	0	114.7	A359 G363	A359-G361 PolarHBondContact O-N 2.88Å; G361-G363 PolarHBondContact O-N 2.86Å
362	V	89.3	Confident	93.8	Very high	5 Å²	5	39 Å²	39	3%	0.03	20%	0.195	C	C	.	.	S	Bend	trans	-63.7	1.6	-174	85.7	0	0	0	0	115.9	A359 R364 L469 T502 N523	A359-V362 HydrophobicContact CB-CB 4.49Å; A359-V362 VanDerWaalsContact O-CG1 3.23Å; A359-V362 WeakPolarHBondContact O-CG1 3.4Å; A359-V362 PolarHBondContact O-N 3.4Å; V362-R364 HydrophobicContact CG1-CG 4Å; V362-L469 HydrophobicContact CG1-CB 3.88Å; V362-L469 HydrophobicContact CG2-CB 4.48Å; V362-T502 HydrophobicContact CB-CG2 4.45Å; V362-N523 PolarHBondContact O-ND2 3.24Å
363	G	89.2	Confident	93.7	Very high	12 Å²	12	42.3 Å²	42.3	12%	0.124	22%	0.215	C	C	.	.	S	Bend	trans	97.1	4	170.1	0	0	0	0	0	116.6	G361 R365 R366 L367	G361-G363 PolarHBondContact O-N 2.86Å; G363-R365 VanDerWaalsContact C-N 3.27Å; G363-R365 PolarHBondContact O-N 2.97Å; G363-R365 VanDerWaalsContact O-N 3.11Å; G363-R366 WeakPolarHBondContact O-CA 3.17Å; G363-R366 WeakPolarHBondContact O-CB 3.4Å; G363-R366 PolarHBondContact O-N 2.87Å; G363-L367 PolarHBondContact O-N 3.19Å
364	R	92.8	Very high	93.6	Very high	38 Å²	38	49.4 Å²	49.4	14%	0.143	24%	0.242	C	C	.	.	H	α-helix	trans	-41.4	-50.2	177	-67.1	-170.4	-88	149.6	-28.5	113.8	L356 G358 V362 R366 L367 K368 D448 A449 L469	L356-R364 HydrophobicContact CB-CB 4.5Å; L356-R364 HydrophobicContact CB-CG 4.41Å; L356-R364 VanDerWaalsContact O-CD 3.31Å; L356-R364 WeakPolarHBondContact O-CD 3.42Å; G358-R364 VanDerWaalsContact O-CZ 3.22Å; G358-R364 PolarHBondContact O-NE 2.96Å; G358-R364 PolarHBondContact O-NH2 2.89Å; V362-R364 HydrophobicContact CG1-CG 4Å; R364-R366 PolarHBondContact O-N 3.5Å; R364-L367 PolarHBondContact O-N 3.43Å; R364-K368 WeakPolarHBondContact O-CB 3.37Å; R364-K368 PolarHBondContact O-N 3.28Å; R364-D448 WeakPolarHBondContact CB-OD1 3.39Å; R364-D448 WeakPolarHBondContact CD-OD1 3.41Å; R364-D448 IonicContact CZ-OD1 2.74Å; R364-D448 IonicContact NE-OD1 2.73Å; R364-D448 IonicContact NH1-OD1 2.73Å; R364-D448 PolarHBondContact NH1-OD1 3.23Å; R364-A449 PolarHBondContact NH1-O 2.9Å; R364-L469 HydrophobicContact CB-CD1 4.45Å; R364-L469 HydrophobicContact CG-CD1 3.98Å
365	R	90.7	Very high	93.4	Very high	199 Å²	199	51.1 Å²	51.1	75%	0.751	25%	0.251	S	S	*	.	H	α-helix	trans	-62.1	-36.1	177.7	-68	179.8	-176.6	171.6	3.5	114.1	G363 A369 D448	G363-R365 VanDerWaalsContact C-N 3.27Å; G363-R365 PolarHBondContact O-N 2.97Å; G363-R365 VanDerWaalsContact O-N 3.11Å; R365-A369 VanDerWaalsContact O-CB 3.31Å; R365-A369 WeakPolarHBondContact O-CB 3.45Å; R365-A369 PolarHBondContact O-N 3.48Å; R365-D448 WeakPolarHBondContact CG-OD2 3.3Å; R365-D448 IonicContact NE-OD2 3.94Å; R365-D448 PolarHBondContact NE-OD2 2.88Å
366	R	91.1	Very high	93.3	Very high	120 Å²	120	54.3 Å²	54.3	45%	0.453	27%	0.272	S	S	.	.	H	α-helix	trans	-68.8	-41.3	176.4	-62.9	176.1	68	-171.5	-0.4	110.4	G363 R364 K370 L526	G363-R366 WeakPolarHBondContact O-CA 3.17Å; G363-R366 WeakPolarHBondContact O-CB 3.4Å; G363-R366 PolarHBondContact O-N 2.87Å; R364-R366 PolarHBondContact O-N 3.5Å; R366-K370 VanDerWaalsContact O-CB 3.32Å; R366-K370 WeakPolarHBondContact O-CB 3.49Å; R366-K370 PolarHBondContact O-N 3.4Å; R366-L526 HydrophobicContact CB-CD1 4.18Å; R366-L526 HydrophobicContact CB-CD2 3.84Å
367	L	94.6	Very high	93.1	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-65.5	-48.6	175.5	-178.6	63.1	0	0	0	111.4	L356 G363 R364 A369 K370 L371 L469 L526 T529 V533	L356-L367 HydrophobicContact CD1-CD2 4.3Å; L356-L367 HydrophobicContact CD1-CG 4.45Å; L356-L367 HydrophobicContact CD2-CD2 4.16Å; G363-L367 PolarHBondContact O-N 3.19Å; R364-L367 PolarHBondContact O-N 3.43Å; L367-A369 PolarHBondContact O-N 2.92Å; L367-K370 WeakPolarHBondContact O-CB 3.39Å; L367-K370 PolarHBondContact O-N 3.49Å; L367-K370 VanDerWaalsContact O-N 3.13Å; L367-L371 HydrophobicContact CD1-CD1 4.21Å; L367-L371 HydrophobicContact CD1-CG 4.35Å; L367-L371 HydrophobicContact CG-CD1 3.91Å; L367-L371 WeakPolarHBondContact O-CG 3.23Å; L367-L371 PolarHBondContact O-N 2.68Å; L367-L469 HydrophobicContact CB-CD1 4.41Å; L367-L469 HydrophobicContact CD2-CD1 3.81Å; L367-L469 HydrophobicContact CD2-CD2 3.94Å; L367-L469 HydrophobicContact CD2-CG 4.36Å; L367-L526 HydrophobicContact CB-CD1 4.05Å; L367-L526 HydrophobicContact CD1-CD1 4.34Å; L367-T529 HydrophobicContact CD1-CG2 4.11Å; L367-T529 HydrophobicContact CD2-CG2 3.79Å; L367-V533 HydrophobicContact CD2-CG2 4.35Å
368	K	95.1	Very high	93	Very high	32 Å²	32	65.6 Å²	65.6	14%	0.139	33%	0.326	C	S	.	.	H	α-helix	trans	-54.7	-50	174.7	175.3	164.1	175.3	161.7	0	112.2	L356 R364 K370 L371 L372 T381 I446 D448	L356-K368 HydrophobicContact CD1-CB 4Å; R364-K368 WeakPolarHBondContact O-CB 3.37Å; R364-K368 PolarHBondContact O-N 3.28Å; K368-K370 VanDerWaalsContact C-N 3.28Å; K368-K370 PolarHBondContact O-N 3.5Å; K368-L371 PolarHBondContact O-N 2.95Å; K368-L372 HydrophobicContact CG-CD1 3.91Å; K368-L372 WeakPolarHBondContact O-CD1 3.33Å; K368-L372 VanDerWaalsContact O-CG 3.27Å; K368-L372 WeakPolarHBondContact O-CG 3.35Å; K368-L372 PolarHBondContact O-N 3.01Å; K368-L372 VanDerWaalsContact O-N 3.09Å; K368-T381 WeakPolarHBondContact CE-OG1 3.31Å; K368-T381 PolarHBondContact NZ-OG1 3.32Å; K368-I446 HydrophobicContact CB-CG2 4.15Å; K368-I446 HydrophobicContact CD-CB 4.41Å; K368-I446 HydrophobicContact CD-CG2 3.93Å; K368-I446 WeakPolarHBondContact CE-O 3.37Å; K368-I446 HydrophobicContact CG-CB 4.33Å; K368-I446 HydrophobicContact CG-CG2 3.84Å; K368-I446 PolarHBondContact NZ-O 2.67Å; K368-D448 HydrophobicContact CD-CB 3.92Å
369	A	93.8	Very high	93.1	Very high	58 Å²	58	65.6 Å²	65.6	48%	0.479	33%	0.326	S	S	.	.	H	α-helix	trans	-60.8	-37.5	177.5	0	0	0	0	0	112.5	R365 L367 L373	R365-A369 VanDerWaalsContact O-CB 3.31Å; R365-A369 WeakPolarHBondContact O-CB 3.45Å; R365-A369 PolarHBondContact O-N 3.48Å; L367-A369 PolarHBondContact O-N 2.92Å; A369-L373 VanDerWaalsContact O-CB 3.28Å; A369-L373 WeakPolarHBondContact O-CB 3.5Å; A369-L373 PolarHBondContact O-N 3.29Å
370	K	94.9	Very high	93.3	Very high	31 Å²	31	65.6 Å²	65.6	14%	0.135	33%	0.326	C	S	.	.	H	α-helix	trans	-69.8	-43.6	178.8	-171.4	171.2	-170.5	166.9	0	113.1	R366 L367 K368 L373 R374 L526 D527 Y530	R366-K370 VanDerWaalsContact O-CB 3.32Å; R366-K370 WeakPolarHBondContact O-CB 3.49Å; R366-K370 PolarHBondContact O-N 3.4Å; L367-K370 WeakPolarHBondContact O-CB 3.39Å; L367-K370 PolarHBondContact O-N 3.49Å; L367-K370 VanDerWaalsContact O-N 3.13Å; K368-K370 VanDerWaalsContact C-N 3.28Å; K368-K370 PolarHBondContact O-N 3.5Å; K370-L373 PolarHBondContact O-N 2.83Å; K370-R374 HydrophobicContact CG-CG 4.32Å; K370-R374 WeakPolarHBondContact O-CB 3.26Å; K370-R374 VanDerWaalsContact O-CG 3.32Å; K370-R374 WeakPolarHBondContact O-CG 3.25Å; K370-R374 PolarHBondContact O-N 3.05Å; K370-L526 HydrophobicContact CD-CD2 4.27Å; K370-L526 HydrophobicContact CD-CG 3.88Å; K370-L526 WeakPolarHBondContact CD-O 3.48Å; K370-L526 PolarHBondContact NZ-O 2.7Å; K370-D527 VanDerWaalsContact CE-OD1 3.32Å; K370-D527 WeakPolarHBondContact CE-OD1 2.93Å; K370-D527 VanDerWaalsContact NZ-CA 3.33Å; K370-D527 IonicContact NZ-OD1 3.91Å; K370-D527 PolarHBondContact NZ-OD1 2.72Å; K370-D527 IonicContact NZ-OD2 2.95Å; K370-D527 PolarHBondContact NZ-OD2 2.91Å; K370-Y530 HydrophobicContact CD-CG 4.42Å; K370-Y530 HydrophobicContact CG-CD2 4.3Å
371	L	96.2	Very high	93.6	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-59.6	-49	174.9	-72	161.5	0	0	0	110.8	L354 L367 K368 L373 R374 D375 F379 I446 Y530	L354-L371 HydrophobicContact CD2-CD1 3.81Å; L367-L371 HydrophobicContact CD1-CD1 4.21Å; L367-L371 HydrophobicContact CD1-CG 4.35Å; L367-L371 HydrophobicContact CG-CD1 3.91Å; L367-L371 WeakPolarHBondContact O-CG 3.23Å; L367-L371 PolarHBondContact O-N 2.68Å; K368-L371 PolarHBondContact O-N 2.95Å; L371-L373 VanDerWaalsContact C-N 3.31Å; L371-L373 PolarHBondContact O-N 3.44Å; L371-R374 PolarHBondContact O-N 3.27Å; L371-D375 PolarHBondContact O-N 3.41Å; L371-F379 HydrophobicContact CB-CD2 3.96Å; L371-F379 HydrophobicContact CB-CE2 4.14Å; L371-F379 HydrophobicContact CB-CG 4.41Å; L371-F379 HydrophobicContact CD2-CD2 4.32Å; L371-F379 HydrophobicContact CD2-CE2 3.64Å; L371-F379 HydrophobicContact CD2-CZ 3.86Å; L371-F379 HydrophobicContact CG-CE2 4.48Å; L371-I446 HydrophobicContact CB-CD1 3.49Å; L371-I446 VanDerWaalsContact CB-CD1 3.49Å; L371-I446 HydrophobicContact CD1-CD1 3.84Å; L371-I446 HydrophobicContact CG-CD1 4.29Å; L371-Y530 HydrophobicContact CD2-CD2 3.62Å; L371-Y530 HydrophobicContact CD2-CE2 3.94Å; L371-Y530 HydrophobicContact CG-CD2 4.16Å
372	L	95.2	Very high	94	Very high	43 Å²	43	58.7 Å²	58.7	23%	0.225	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-34.8	177.5	-68	167.7	0	0	0	113.3	K368 P376 F379 T381 I446	K368-L372 HydrophobicContact CG-CD1 3.91Å; K368-L372 WeakPolarHBondContact O-CD1 3.33Å; K368-L372 VanDerWaalsContact O-CG 3.27Å; K368-L372 WeakPolarHBondContact O-CG 3.35Å; K368-L372 PolarHBondContact O-N 3.01Å; K368-L372 VanDerWaalsContact O-N 3.09Å; L372-P376 WeakPolarHBondContact O-CA 3.41Å; L372-P376 WeakPolarHBondContact O-CB 3.41Å; L372-F379 HydrophobicContact CD2-CB 4.04Å; L372-T381 HydrophobicContact CD1-CG2 3.64Å; L372-T381 HydrophobicContact CD2-CG2 4.14Å; L372-I446 HydrophobicContact CD2-CD1 4.3Å; L372-I446 HydrophobicContact CG-CD1 4.2Å
373	L	95.4	Very high	94.1	Very high	137 Å²	137	61.2 Å²	61.2	72%	0.717	30%	0.296	S	S	*	.	H	α-helix	trans	-80.7	-32.2	179.8	-176.4	147.2	0	0	0	113	A369 K370 L371	A369-L373 VanDerWaalsContact O-CB 3.28Å; A369-L373 WeakPolarHBondContact O-CB 3.5Å; A369-L373 PolarHBondContact O-N 3.29Å; K370-L373 PolarHBondContact O-N 2.83Å; L371-L373 VanDerWaalsContact C-N 3.31Å; L371-L373 PolarHBondContact O-N 3.44Å
374	R	95.6	Very high	94.2	Very high	149 Å²	149	62.9 Å²	62.9	56%	0.562	31%	0.305	S	S	*	.	H	α-helix	trans	-84.8	-41.5	-178.3	-71.9	-66.2	-166.4	167.8	4.2	113.3	K370 L371 P376 Y530	K370-R374 HydrophobicContact CG-CG 4.32Å; K370-R374 WeakPolarHBondContact O-CB 3.26Å; K370-R374 VanDerWaalsContact O-CG 3.32Å; K370-R374 WeakPolarHBondContact O-CG 3.25Å; K370-R374 PolarHBondContact O-N 3.05Å; L371-R374 PolarHBondContact O-N 3.27Å; R374-P376 VanDerWaalsContact C-CD 3.44Å; R374-Y530 HydrophobicContact CB-CE2 3.76Å; R374-Y530 WeakPolarHBondContact CB-OH 3.35Å; R374-Y530 HydrophobicContact CG-CE2 4.05Å
375	D	94.9	Very high	94.3	Very high	35 Å²	35	63.3 Å²	63.3	19%	0.187	31%	0.307	C	S	.	.			trans	-128.1	60.7	-178.2	-64.4	-71.1	0	0	0	112.1	L371 Q377 L378 F379 Y530 K534	L371-D375 PolarHBondContact O-N 3.41Å; D375-Q377 PolarHBondContact O-N 3.41Å; D375-L378 HydrophobicContact CB-CB 3.97Å; D375-L378 PolarHBondContact O-N 2.97Å; D375-F379 HydrophobicContact CB-CD2 3.8Å; D375-F379 HydrophobicContact CB-CE2 3.96Å; D375-F379 PolarHBondContact O-N 3.07Å; D375-Y530 PolarHBondContact OD2-OH 3.01Å; D375-Y530 VanDerWaalsContact OD2-OH 3.12Å; D375-K534 IonicContact OD1-NZ 3.45Å; D375-K534 PolarHBondContact OD1-NZ 3.44Å; D375-K534 WeakPolarHBondContact OD2-CE 3.39Å; D375-K534 IonicContact OD2-NZ 3.19Å; D375-K534 PolarHBondContact OD2-NZ 2.92Å
376	P	95.2	Very high	94.5	Very high	67 Å²	67	53.9 Å²	53.9	44%	0.435	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-15.6	-176.9	25.5	-35.6	0	0	0	114.8	L372 R374	L372-P376 WeakPolarHBondContact O-CA 3.41Å; L372-P376 WeakPolarHBondContact O-CB 3.41Å; R374-P376 VanDerWaalsContact C-CD 3.44Å
377	Q	94.3	Very high	94.7	Very high	173 Å²	173	48.9 Å²	48.9	81%	0.808	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-18.2	174.7	-58.9	-63.8	-7	0	0	113.1	D375	D375-Q377 PolarHBondContact O-N 3.41Å
378	L	94.9	Very high	94.6	Very high	64 Å²	64	50.1 Å²	50.1	34%	0.335	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-37.6	175.8	-179.4	59	0	0	0	111.2	D375 R443 V444	D375-L378 HydrophobicContact CB-CB 3.97Å; D375-L378 PolarHBondContact O-N 2.97Å; L378-R443 WeakPolarHBondContact O-CA 3.41Å; L378-V444 HydrophobicContact CD1-CG2 4.24Å; L378-V444 PolarHBondContact O-N 2.73Å
379	F	97.5	Very high	94.4	Very high	1 Å²	1	57.2 Å²	57.2	0%	0.004	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	142.7	-173.1	-61.7	-66.1	0	0	0	113.2	L354 L371 L372 D375 R443 V444 I446 L537	L354-F379 HydrophobicContact CD2-CE1 4.15Å; L371-F379 HydrophobicContact CB-CD2 3.96Å; L371-F379 HydrophobicContact CB-CE2 4.14Å; L371-F379 HydrophobicContact CB-CG 4.41Å; L371-F379 HydrophobicContact CD2-CD2 4.32Å; L371-F379 HydrophobicContact CD2-CE2 3.64Å; L371-F379 HydrophobicContact CD2-CZ 3.86Å; L371-F379 HydrophobicContact CG-CE2 4.48Å; L372-F379 HydrophobicContact CD2-CB 4.04Å; D375-F379 HydrophobicContact CB-CD2 3.8Å; D375-F379 HydrophobicContact CB-CE2 3.96Å; D375-F379 PolarHBondContact O-N 3.07Å; F379-R443 PolarHBondContact O-NH1 2.9Å; F379-V444 WeakPolarHBondContact CA-O 3.35Å; F379-V444 HydrophobicContact CD1-CB 3.94Å; F379-V444 HydrophobicContact CD1-CG1 4.37Å; F379-V444 HydrophobicContact CE1-CB 4.18Å; F379-V444 HydrophobicContact CE1-CG1 4.37Å; F379-I446 HydrophobicContact CB-CD1 3.77Å; F379-I446 HydrophobicContact CB-CG1 4.08Å; F379-I446 HydrophobicContact CD1-CD1 3.73Å; F379-I446 HydrophobicContact CD1-CG1 3.75Å; F379-I446 HydrophobicContact CD2-CD1 4.46Å; F379-I446 HydrophobicContact CE1-CD1 4.47Å; F379-I446 HydrophobicContact CG-CD1 3.74Å; F379-I446 HydrophobicContact CG-CG1 4.15Å; F379-L537 HydrophobicContact CE1-CD1 3.71Å; F379-L537 HydrophobicContact CZ-CD1 3.87Å
380	G	96.3	Very high	94.1	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	175.4	165.3	0	0	0	0	0	111.8	V444 I446	G380-V444 PolarHBondContact N-O 2.64Å; G380-I446 PolarHBondContact O-N 3.27Å
381	T	94.9	Very high	93.7	Very high	53 Å²	53	62.8 Å²	62.8	33%	0.325	31%	0.311	S	S	.	.			trans	-144	146.3	171.4	176.7	0	0	0	0	109.3	K368 L372	K368-T381 WeakPolarHBondContact CE-OG1 3.31Å; K368-T381 PolarHBondContact NZ-OG1 3.32Å; L372-T381 HydrophobicContact CD1-CG2 3.64Å; L372-T381 HydrophobicContact CD2-CG2 4.14Å
382	T	93.1	Very high	93.1	Very high	14 Å²	14	73.5 Å²	73.5	9%	0.086	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-62.7	156	168.2	57.6	0	0	0	0	111.9	L430 S434 I435 L447	T382-L430 VanDerWaalsContact CB-CD1 3.4Å; T382-L430 HydrophobicContact CG2-CD1 3.64Å; T382-L430 WeakPolarHBondContact OG1-CD1 3.4Å; T382-S434 WeakPolarHBondContact CG2-O 3.42Å; T382-I435 HydrophobicContact CG2-CB 4.42Å; T382-I435 HydrophobicContact CG2-CG1 3.81Å; T382-L447 HydrophobicContact CG2-CD2 4.18Å
383	I	90.4	Very high	92.3	Very high	58 Å²	58	75.1 Å²	75.1	30%	0.297	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-98.8	126	167.3	-62.4	158	0	0	0	107.8	S397 A401	I383-S397 VanDerWaalsContact CD1-O 3.25Å; I383-S397 WeakPolarHBondContact CD1-O 3.45Å; I383-A401 HydrophobicContact CG2-CB 4.12Å
384	P	92.3	Very high	91.5	Very high	47 Å²	47	71.7 Å²	71.7	31%	0.305	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-71.3	144.2	176.1	28.7	-33.7	0	0	0	111.5	M399 Y400 A401	P384-M399 WeakPolarHBondContact CD-O 3.32Å; P384-M399 WeakPolarHBondContact CG-O 3.49Å; P384-Y400 HydrophobicContact CB-CD1 4.09Å; P384-Y400 HydrophobicContact CB-CE1 4.17Å; P384-Y400 HydrophobicContact CG-CD1 3.68Å; P384-Y400 HydrophobicContact CG-CE1 3.72Å; P384-Y400 CarbonylContact O-C 3.58Å; P384-Y400 WeakPolarHBondContact O-CA 3.48Å; P384-A401 PolarHBondContact O-N 2.91Å
385	Y	93.9	Very high	90.3	Very high	48 Å²	48	73.6 Å²	73.6	19%	0.188	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	153.1	174.8	-74.6	-103.6	0	0	0	111.1	A401 T403 Y417 Y428 G429 K431	Y385-A401 VanDerWaalsContact CA-O 3.29Å; Y385-A401 WeakPolarHBondContact CA-O 3.48Å; Y385-A401 HydrophobicContact CD1-CB 3.64Å; Y385-A401 HydrophobicContact CD2-CB 4.28Å; Y385-A401 HydrophobicContact CE1-CB 3.52Å; Y385-A401 HydrophobicContact CE2-CB 4.16Å; Y385-A401 HydrophobicContact CG-CB 4.02Å; Y385-T403 HydrophobicContact CD1-CG2 4.42Å; Y385-Y417 VanDerWaalsContact CB-OH 3.31Å; Y385-Y417 WeakPolarHBondContact CB-OH 3.38Å; Y385-Y428 WeakPolarHBondContact O-CA 3.49Å; Y385-G429 PolarHBondContact N-O 2.77Å; Y385-G429 PolarHBondContact O-N 2.96Å; Y385-K431 HydrophobicContact CD1-CD 4.45Å; Y385-K431 HydrophobicContact CD2-CB 4.17Å; Y385-K431 HydrophobicContact CD2-CD 3.9Å; Y385-K431 HydrophobicContact CD2-CG 3.75Å; Y385-K431 HydrophobicContact CE1-CD 4.17Å; Y385-K431 HydrophobicContact CE2-CB 4.03Å; Y385-K431 HydrophobicContact CE2-CD 3.59Å; Y385-K431 HydrophobicContact CE2-CG 3.84Å; Y385-K431 HydrophobicContact CG-CD 4.32Å; Y385-K431 HydrophobicContact CG-CG 4.33Å
386	T	94.5	Very high	89.2	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	149.8	170.7	-175.1	0	0	0	0	113.3	R388 Y400 A401 F402 T403 L427 Y428	T386-R388 VanDerWaalsContact C-N 3.27Å; T386-R388 HydrophobicContact CG2-CB 3.96Å; T386-R388 WeakPolarHBondContact OG1-CB 3.28Å; T386-R388 PolarHBondContact OG1-N 2.76Å; T386-R388 VanDerWaalsContact OG1-N 3.09Å; T386-Y400 HydrophobicContact CG2-CD1 4.1Å; T386-Y400 HydrophobicContact CG2-CG 4.03Å; T386-A401 PolarHBondContact N-O 2.9Å; T386-F402 HydrophobicContact CG2-CD1 3.5Å; T386-F402 VanDerWaalsContact CG2-CD1 3.5Å; T386-F402 HydrophobicContact CG2-CE1 3.6Å; T386-T403 WeakPolarHBondContact O-CG2 3.44Å; T386-T403 PolarHBondContact O-N 2.87Å; T386-L427 CarbonylContact C-O 3.6Å; T386-L427 WeakPolarHBondContact CA-O 3.31Å; T386-L427 WeakPolarHBondContact CB-O 3.45Å; T386-L427 PolarHBondContact OG1-O 3.4Å; T386-Y428 HydrophobicContact CG2-CE1 4.23Å; T386-Y428 WeakPolarHBondContact OG1-CD1 3.43Å; T386-Y428 WeakPolarHBondContact OG1-CE1 3.18Å
387	S	95	Very high	87.8	Confident	16 Å²	16	77.4 Å²	77.4	11%	0.112	39%	0.39	C	S	.	.	S	Bend	trans	-80.3	-4.9	168.5	79.9	0	0	0	0	113.9	T403 N426 L427	S387-T403 WeakPolarHBondContact CA-O 3.18Å; S387-N426 WeakPolarHBondContact OG-CA 3.35Å; S387-L427 PolarHBondContact N-O 3.11Å; S387-L427 PolarHBondContact OG-N 3.28Å
388	R	92.6	Very high	86.8	Confident	26 Å²	26	78.7 Å²	78.7	10%	0.098	39%	0.388	C	S	.	.	S	Bend	trans	-66.7	141.1	179.3	-173.5	-176.8	53.8	83.5	-17	110.7	T386 E394 F402 N426 Y428	T386-R388 VanDerWaalsContact C-N 3.27Å; T386-R388 HydrophobicContact CG2-CB 3.96Å; T386-R388 WeakPolarHBondContact OG1-CB 3.28Å; T386-R388 PolarHBondContact OG1-N 2.76Å; T386-R388 VanDerWaalsContact OG1-N 3.09Å; R388-E394 IonicContact CZ-OE1 2.75Å; R388-E394 IonicContact CZ-OE2 3.28Å; R388-E394 IonicContact NH1-OE1 3.35Å; R388-E394 IonicContact NH1-OE2 3.55Å; R388-E394 PolarHBondContact NH1-OE2 2.64Å; R388-E394 IonicContact NH2-OE1 2.64Å; R388-E394 PolarHBondContact NH2-OE1 2.92Å; R388-E394 IonicContact NH2-OE2 2.68Å; R388-E394 PolarHBondContact NH2-OE2 2.75Å; R388-F402 WeakPolarHBondContact O-CD1 3.49Å; R388-N426 VanDerWaalsContact CA-OD1 3.22Å; R388-N426 WeakPolarHBondContact CA-OD1 3.42Å; R388-N426 HydrophobicContact CB-CB 4.07Å; R388-Y428 WeakPolarHBondContact CD-OH 3.11Å; R388-Y428 PolarHBondContact NE-OH 3.31Å
389	K	90.8	Very high	86	Confident	181 Å²	181	82.3 Å²	82.3	79%	0.787	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-66.3	142.4	170.6	-63.9	-176	-179.2	-179.9	0	111.1	K391	K389-K391 PolarHBondContact O-N 2.86Å
390	P	88.6	Confident	85.6	Confident	72 Å²	72	85.5 Å²	85.5	47%	0.468	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-56.1	136.8	173.3	-21.2	29.2	0	0	0	111.9	F402	P390-F402 HydrophobicContact CB-CD2 4.2Å; P390-F402 HydrophobicContact CB-CE2 3.98Å; P390-F402 HydrophobicContact CB-CZ 4.18Å; P390-F402 HydrophobicContact CG-CB 4.27Å; P390-F402 HydrophobicContact CG-CD1 4.2Å; P390-F402 HydrophobicContact CG-CD2 3.66Å; P390-F402 HydrophobicContact CG-CE1 4.47Å; P390-F402 HydrophobicContact CG-CE2 3.97Å; P390-F402 HydrophobicContact CG-CG 3.78Å; P390-F402 HydrophobicContact CG-CZ 4.36Å
391	K	86.6	Confident	85.3	Confident	133 Å²	133	85.8 Å²	85.8	58%	0.578	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-77.9	153.9	170.1	-71.7	167.1	-179.5	179	0	109.6	K389 G393 E394	K389-K391 PolarHBondContact O-N 2.86Å; K391-G393 PolarHBondContact O-N 3.14Å; K391-E394 HydrophobicContact CB-CG 3.99Å; K391-E394 WeakPolarHBondContact CB-OE2 3.41Å; K391-E394 PolarHBondContact N-OE2 2.8Å; K391-E394 WeakPolarHBondContact O-CB 3.41Å; K391-E394 PolarHBondContact O-N 2.96Å
392	K	82.8	Confident	85.2	Confident	226 Å²	226	85 Å²	85	98%	0.983	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	106.1	-178.2	-153.7	178.1	-166.3	-177.2	0	110.1
393	G	78.7	Confident	85.3	Confident	76 Å²	76	85.6 Å²	85.6	78%	0.784	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	104	-7.1	-176.5	0	0	0	0	0	115.7	K391	K391-G393 PolarHBondContact O-N 3.14Å
394	E	77.9	Confident	85.5	Confident	66 Å²	66	86 Å²	86	31%	0.308	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-65.6	137	163.4	-73.7	179.9	147.1	0	0	109.2	R388 K391 F402	R388-E394 IonicContact CZ-OE1 2.75Å; R388-E394 IonicContact CZ-OE2 3.28Å; R388-E394 IonicContact NH1-OE1 3.35Å; R388-E394 IonicContact NH1-OE2 3.55Å; R388-E394 PolarHBondContact NH1-OE2 2.64Å; R388-E394 IonicContact NH2-OE1 2.64Å; R388-E394 PolarHBondContact NH2-OE1 2.92Å; R388-E394 IonicContact NH2-OE2 2.68Å; R388-E394 PolarHBondContact NH2-OE2 2.75Å; K391-E394 HydrophobicContact CB-CG 3.99Å; K391-E394 WeakPolarHBondContact CB-OE2 3.41Å; K391-E394 PolarHBondContact N-OE2 2.8Å; K391-E394 WeakPolarHBondContact O-CB 3.41Å; K391-E394 PolarHBondContact O-N 2.96Å; E394-F402 HydrophobicContact CB-CZ 4.5Å; E394-F402 WeakPolarHBondContact OE2-CZ 3.48Å
395	R	71.6	Confident	85.7	Confident	189 Å²	189	87.5 Å²	87.5	71%	0.713	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-99.8	139.1	171.4	-65.9	-172.7	-177.2	-173.7	0	109.2	R398	R395-R398 HydrophobicContact CB-CB 4.42Å
396	E	70.8	Confident	85.8	Confident	114 Å²	114	91.2 Å²	91.2	53%	0.533	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	143.1	172.5	-158.7	66.2	-112.1	0	0	111.2	R398 F402	E396-R398 PolarHBondContact O-N 3.1Å; E396-F402 VanDerWaalsContact OE1-CD2 3.31Å; E396-F402 WeakPolarHBondContact OE1-CD2 3.26Å; E396-F402 PolarHBondContact OE1-N 3.26Å; E396-F402 VanDerWaalsContact OE1-N 3.14Å
397	S	67.1	Low	85.9	Confident	68 Å²	68	96.9 Å²	96.9	48%	0.476	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	20.9	173.9	-55.2	0	0	0	0	116.7	I383 Y400	I383-S397 VanDerWaalsContact CD1-O 3.25Å; I383-S397 WeakPolarHBondContact CD1-O 3.45Å; S397-Y400 PolarHBondContact N-O 3.48Å
398	R	72.6	Confident	86	Confident	199 Å²	199	96.1 Å²	96.1	75%	0.751	47%	0.465	S	S	*	.	S	Bend	trans	-102.5	-28.4	179.1	-161.5	179.4	-173.6	-150.3	0.5	114.7	R395 E396	R395-R398 HydrophobicContact CB-CB 4.42Å; E396-R398 PolarHBondContact O-N 3.1Å
399	M	79.2	Confident	86.2	Confident	140 Å²	140	98.8 Å²	98.8	69%	0.69	48%	0.479	S	S	*	.	S	Bend	trans	-138.2	-39.1	-179.6	-76	-85.5	-76.7	0	0	110.5	P384	P384-M399 WeakPolarHBondContact CD-O 3.32Å; P384-M399 WeakPolarHBondContact CG-O 3.49Å
400	Y	87.6	Confident	86.5	Confident	68 Å²	68	92.4 Å²	92.4	27%	0.267	46%	0.46	S	S	.	.			trans	-136.5	155.2	170.2	-65.2	-84.6	0	0	0	109.6	P384 T386 S397 Y428	P384-Y400 HydrophobicContact CB-CD1 4.09Å; P384-Y400 HydrophobicContact CB-CE1 4.17Å; P384-Y400 HydrophobicContact CG-CD1 3.68Å; P384-Y400 HydrophobicContact CG-CE1 3.72Å; P384-Y400 CarbonylContact O-C 3.58Å; P384-Y400 WeakPolarHBondContact O-CA 3.48Å; T386-Y400 HydrophobicContact CG2-CD1 4.1Å; T386-Y400 HydrophobicContact CG2-CG 4.03Å; S397-Y400 PolarHBondContact N-O 3.48Å; Y400-Y428 HydrophobicContact CD1-CD1 4.13Å; Y400-Y428 HydrophobicContact CD1-CE1 4.27Å; Y400-Y428 AromaticContact CE1-CD1 3.63Å; Y400-Y428 HydrophobicContact CE1-CD1 3.63Å; Y400-Y428 AromaticContact CE1-CE1 3.8Å; Y400-Y428 HydrophobicContact CE1-CE1 3.8Å
401	A	91.3	Very high	86.9	Confident	7 Å²	7	89.2 Å²	89.2	6%	0.058	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	127.5	162.3	0	0	0	0	0	108.7	I383 P384 Y385 T386	I383-A401 HydrophobicContact CG2-CB 4.12Å; P384-A401 PolarHBondContact O-N 2.91Å; Y385-A401 VanDerWaalsContact CA-O 3.29Å; Y385-A401 WeakPolarHBondContact CA-O 3.48Å; Y385-A401 HydrophobicContact CD1-CB 3.64Å; Y385-A401 HydrophobicContact CD2-CB 4.28Å; Y385-A401 HydrophobicContact CE1-CB 3.52Å; Y385-A401 HydrophobicContact CE2-CB 4.16Å; Y385-A401 HydrophobicContact CG-CB 4.02Å; T386-A401 PolarHBondContact N-O 2.9Å
402	F	92.7	Very high	87.2	Confident	38 Å²	38	84.2 Å²	84.2	17%	0.167	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	134.9	-171.9	-62.5	-71.7	0	0	0	111.8	T386 R388 P390 E394 E396	T386-F402 HydrophobicContact CG2-CD1 3.5Å; T386-F402 VanDerWaalsContact CG2-CD1 3.5Å; T386-F402 HydrophobicContact CG2-CE1 3.6Å; R388-F402 WeakPolarHBondContact O-CD1 3.49Å; P390-F402 HydrophobicContact CB-CD2 4.2Å; P390-F402 HydrophobicContact CB-CE2 3.98Å; P390-F402 HydrophobicContact CB-CZ 4.18Å; P390-F402 HydrophobicContact CG-CB 4.27Å; P390-F402 HydrophobicContact CG-CD1 4.2Å; P390-F402 HydrophobicContact CG-CD2 3.66Å; P390-F402 HydrophobicContact CG-CE1 4.47Å; P390-F402 HydrophobicContact CG-CE2 3.97Å; P390-F402 HydrophobicContact CG-CG 3.78Å; P390-F402 HydrophobicContact CG-CZ 4.36Å; E394-F402 HydrophobicContact CB-CZ 4.5Å; E394-F402 WeakPolarHBondContact OE2-CZ 3.48Å; E396-F402 VanDerWaalsContact OE1-CD2 3.31Å; E396-F402 WeakPolarHBondContact OE1-CD2 3.26Å; E396-F402 PolarHBondContact OE1-N 3.26Å; E396-F402 VanDerWaalsContact OE1-N 3.14Å
403	T	93.9	Very high	87.8	Confident	26 Å²	26	82.1 Å²	82.1	16%	0.16	41%	0.409	C	S	.	.			trans	-140.2	165.6	-178.9	-176.5	0	0	0	0	111.5	Y385 T386 S387 M408	Y385-T403 HydrophobicContact CD1-CG2 4.42Å; T386-T403 WeakPolarHBondContact O-CG2 3.44Å; T386-T403 PolarHBondContact O-N 2.87Å; S387-T403 WeakPolarHBondContact CA-O 3.18Å; T403-M408 HydrophobicContact CG2-CB 4Å; T403-M408 HydrophobicContact CG2-CG 4.33Å; T403-M408 HydrophobicContact CG2-SD 3.85Å
404	S	95.6	Very high	88.6	Confident	67 Å²	67	83.8 Å²	83.8	47%	0.469	40%	0.4	S	S	.	.			trans	-77	147.7	170.3	70.1	0	0	0	0	110.8	N406 K407 M408	S404-N406 PolarHBondContact O-N 3.03Å; S404-K407 PolarHBondContact O-N 2.86Å; S404-K407 VanDerWaalsContact OG-CB 3.28Å; S404-K407 WeakPolarHBondContact OG-CB 3.29Å; S404-K407 PolarHBondContact OG-N 2.86Å; S404-M408 PolarHBondContact O-N 3.34Å
405	R	95.8	Very high	89.2	Confident	77 Å²	77	82.9 Å²	82.9	29%	0.291	41%	0.409	S	S	.	.	H	α-helix	trans	-57	-49	178.2	-172.3	171.6	174.9	126.8	11.7	111.4	K407 M408 E409 E422 G425 L427	R405-K407 VanDerWaalsContact C-N 3.3Å; R405-K407 PolarHBondContact O-N 3.16Å; R405-M408 CarbonylContact O-C 3.52Å; R405-M408 WeakPolarHBondContact O-CA 3.25Å; R405-M408 WeakPolarHBondContact O-CB 3.21Å; R405-M408 PolarHBondContact O-N 3.4Å; R405-E409 HydrophobicContact CG-CG 4.25Å; R405-E409 IonicContact CZ-OE1 2.76Å; R405-E409 IonicContact NE-OE1 3.69Å; R405-E409 PolarHBondContact NE-OE1 3.29Å; R405-E409 IonicContact NH2-OE1 3.14Å; R405-E409 PolarHBondContact NH2-OE1 3.25Å; R405-E409 VanDerWaalsContact NH2-OE1 3.16Å; R405-E409 WeakPolarHBondContact O-CG 3.46Å; R405-E409 PolarHBondContact O-N 3.05Å; R405-E422 IonicContact CZ-OE1 2.73Å; R405-E422 IonicContact CZ-OE2 2.7Å; R405-E422 IonicContact NH1-OE1 2.87Å; R405-E422 PolarHBondContact NH1-OE1 3.14Å; R405-E422 IonicContact NH1-OE2 2.67Å; R405-E422 PolarHBondContact NH1-OE2 2.81Å; R405-E422 IonicContact NH2-OE1 2.64Å; R405-E422 IonicContact NH2-OE2 2.71Å; R405-E422 PolarHBondContact NH2-OE2 3.13Å; R405-G425 PolarHBondContact NH1-O 2.97Å; R405-L427 HydrophobicContact CG-CD1 3.93Å; R405-L427 HydrophobicContact CG-CG 4.37Å
406	N	97.1	Very high	90.3	Very high	127 Å²	127	78.9 Å²	78.9	68%	0.679	39%	0.393	S	S	*	.	H	α-helix	trans	-57.8	-39.2	179.4	-52.5	38.9	0	0	0	112.7	S404 A410	S404-N406 PolarHBondContact O-N 3.03Å; N406-A410 WeakPolarHBondContact O-CB 3.36Å; N406-A410 PolarHBondContact O-N 2.88Å; N406-A410 VanDerWaalsContact O-N 3.09Å
407	K	96.5	Very high	91.5	Very high	118 Å²	118	74.1 Å²	74.1	51%	0.513	37%	0.371	S	S	.	.	H	α-helix	trans	-68.4	-41.8	175.2	-178.7	177.8	177.2	-176.4	0	110.9	S404 R405 A410 D411	S404-K407 PolarHBondContact O-N 2.86Å; S404-K407 VanDerWaalsContact OG-CB 3.28Å; S404-K407 WeakPolarHBondContact OG-CB 3.29Å; S404-K407 PolarHBondContact OG-N 2.86Å; R405-K407 VanDerWaalsContact C-N 3.3Å; R405-K407 PolarHBondContact O-N 3.16Å; K407-A410 PolarHBondContact O-N 3.35Å; K407-D411 WeakPolarHBondContact O-CB 3.49Å; K407-D411 VanDerWaalsContact O-CG 3.28Å; K407-D411 PolarHBondContact O-N 2.77Å
408	M	96.6	Very high	92.7	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-63.5	-42	177.9	-166.8	159.2	-175.3	0	0	111.9	T403 S404 R405 D411 I412 Y417 L427	T403-M408 HydrophobicContact CG2-CB 4Å; T403-M408 HydrophobicContact CG2-CG 4.33Å; T403-M408 HydrophobicContact CG2-SD 3.85Å; S404-M408 PolarHBondContact O-N 3.34Å; R405-M408 CarbonylContact O-C 3.52Å; R405-M408 WeakPolarHBondContact O-CA 3.25Å; R405-M408 WeakPolarHBondContact O-CB 3.21Å; R405-M408 PolarHBondContact O-N 3.4Å; M408-D411 PolarHBondContact O-N 2.63Å; M408-I412 HydrophobicContact CG-CD1 3.99Å; M408-I412 WeakPolarHBondContact O-CB 3.34Å; M408-I412 WeakPolarHBondContact O-CD1 3.44Å; M408-I412 WeakPolarHBondContact O-CG1 3.24Å; M408-I412 PolarHBondContact O-N 2.97Å; M408-Y417 HydrophobicContact CE-CE1 3.75Å; M408-Y417 HydrophobicContact CG-CE2 4.23Å; M408-L427 HydrophobicContact CB-CD1 4.28Å; M408-L427 HydrophobicContact CE-CB 3.95Å; M408-L427 HydrophobicContact CG-CB 4.22Å; M408-L427 HydrophobicContact CG-CD1 4.15Å; M408-L427 HydrophobicContact SD-CB 3.56Å; M408-L427 VanDerWaalsContact SD-CB 3.56Å
409	E	96.8	Very high	93.6	Very high	82 Å²	82	64.5 Å²	64.5	38%	0.383	33%	0.327	S	S	.	.	H	α-helix	trans	-66.1	-39	176.4	-69.6	170.6	157.3	0	0	112.3	R405 K413 L427	R405-E409 HydrophobicContact CG-CG 4.25Å; R405-E409 IonicContact CZ-OE1 2.76Å; R405-E409 IonicContact NE-OE1 3.69Å; R405-E409 PolarHBondContact NE-OE1 3.29Å; R405-E409 IonicContact NH2-OE1 3.14Å; R405-E409 PolarHBondContact NH2-OE1 3.25Å; R405-E409 VanDerWaalsContact NH2-OE1 3.16Å; R405-E409 WeakPolarHBondContact O-CG 3.46Å; R405-E409 PolarHBondContact O-N 3.05Å; E409-K413 WeakPolarHBondContact O-CB 3.25Å; E409-K413 PolarHBondContact O-N 2.99Å; E409-L427 HydrophobicContact CG-CD1 3.5Å
410	A	97.3	Very high	94.3	Very high	47 Å²	47	63.3 Å²	63.3	39%	0.388	32%	0.316	S	S	.	.	H	α-helix	trans	-66.9	-43.2	172.8	0	0	0	0	0	112.3	N406 K407 K413 N414	N406-A410 WeakPolarHBondContact O-CB 3.36Å; N406-A410 PolarHBondContact O-N 2.88Å; N406-A410 VanDerWaalsContact O-N 3.09Å; K407-A410 PolarHBondContact O-N 3.35Å; A410-K413 PolarHBondContact O-N 2.78Å; A410-N414 WeakPolarHBondContact O-CB 3.35Å; A410-N414 VanDerWaalsContact O-CG 3.24Å; A410-N414 PolarHBondContact O-N 3.1Å; A410-N414 PolarHBondContact O-OD1 3.07Å
411	D	96.4	Very high	94.5	Very high	5 Å²	5	61.9 Å²	61.9	3%	0.027	32%	0.321	C	S	.	.	H	α-helix	trans	-63.5	-39.8	176.4	-77.6	8	0	0	0	111.8	K407 M408 N414 G415 R416 Y417 K431	K407-D411 WeakPolarHBondContact O-CB 3.49Å; K407-D411 VanDerWaalsContact O-CG 3.28Å; K407-D411 PolarHBondContact O-N 2.77Å; M408-D411 PolarHBondContact O-N 2.63Å; D411-N414 CarbonylContact O-C 3.53Å; D411-N414 PolarHBondContact O-N 2.96Å; D411-G415 PolarHBondContact O-N 3.38Å; D411-R416 HydrophobicContact CB-CB 4.5Å; D411-R416 PolarHBondContact O-N 3.16Å; D411-R416 IonicContact OD1-CZ 2.76Å; D411-R416 IonicContact OD1-NE 3.9Å; D411-R416 IonicContact OD1-NH2 2.79Å; D411-R416 PolarHBondContact OD1-NH2 2.85Å; D411-Y417 HydrophobicContact CB-CD2 3.99Å; D411-Y417 HydrophobicContact CB-CE2 3.57Å; D411-K431 WeakPolarHBondContact OD2-CE 3.25Å; D411-K431 IonicContact OD2-NZ 3.66Å; D411-K431 PolarHBondContact OD2-NZ 2.86Å
412	I	93.8	Very high	94.6	Very high	28 Å²	28	66.7 Å²	66.7	14%	0.144	34%	0.343	C	S	.	.	H	α-helix	trans	-64.1	-47.5	173.8	-73.8	163.5	0	0	0	110.7	M408 N414 G415 Y417 Y420 L427	M408-I412 HydrophobicContact CG-CD1 3.99Å; M408-I412 WeakPolarHBondContact O-CB 3.34Å; M408-I412 WeakPolarHBondContact O-CD1 3.44Å; M408-I412 WeakPolarHBondContact O-CG1 3.24Å; M408-I412 PolarHBondContact O-N 2.97Å; I412-N414 PolarHBondContact O-N 2.78Å; I412-G415 PolarHBondContact O-N 3.27Å; I412-Y417 HydrophobicContact CB-CD2 4.48Å; I412-Y417 HydrophobicContact CG1-CD2 3.55Å; I412-Y417 HydrophobicContact CG1-CE2 4.13Å; I412-Y417 HydrophobicContact CG1-CG 3.84Å; I412-Y420 HydrophobicContact CD1-CD1 4.41Å; I412-Y420 HydrophobicContact CD1-CD2 3.9Å; I412-Y420 HydrophobicContact CD1-CG 3.76Å; I412-Y420 HydrophobicContact CG1-CD1 4.06Å; I412-Y420 HydrophobicContact CG1-CD2 4.37Å; I412-Y420 HydrophobicContact CG1-CG 3.92Å; I412-Y420 HydrophobicContact CG2-CD1 3.89Å; I412-Y420 HydrophobicContact CG2-CD2 4.01Å; I412-Y420 HydrophobicContact CG2-CE1 3.62Å; I412-Y420 HydrophobicContact CG2-CE2 3.75Å; I412-Y420 HydrophobicContact CG2-CG 4.08Å; I412-L427 HydrophobicContact CD1-CD1 4.35Å
413	K	94.5	Very high	94.4	Very high	183 Å²	183	71.8 Å²	71.8	80%	0.796	36%	0.362	S	S	*	.	H	α-helix	trans	-59.5	-32	177.1	-174.7	-178.2	175.3	-171.7	0	112.2	E409 A410 G415	E409-K413 WeakPolarHBondContact O-CB 3.25Å; E409-K413 PolarHBondContact O-N 2.99Å; A410-K413 PolarHBondContact O-N 2.78Å; K413-G415 VanDerWaalsContact C-N 3.29Å; K413-G415 PolarHBondContact O-N 3.46Å
414	N	95	Very high	94.2	Very high	111 Å²	111	77.3 Å²	77.3	59%	0.594	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	14.6	177	-64.4	-0.8	0	0	0	113.3	A410 D411 I412 R416	A410-N414 WeakPolarHBondContact O-CB 3.35Å; A410-N414 VanDerWaalsContact O-CG 3.24Å; A410-N414 PolarHBondContact O-N 3.1Å; A410-N414 PolarHBondContact O-OD1 3.07Å; D411-N414 CarbonylContact O-C 3.53Å; D411-N414 PolarHBondContact O-N 2.96Å; I412-N414 PolarHBondContact O-N 2.78Å; N414-R416 VanDerWaalsContact C-N 3.3Å; N414-R416 PolarHBondContact O-N 3.26Å
415	G	92	Very high	94	Very high	47 Å²	47	76.4 Å²	76.4	49%	0.485	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	7.6	172.9	0	0	0	0	0	116.2	D411 I412 K413 Y417 I432	D411-G415 PolarHBondContact O-N 3.38Å; I412-G415 PolarHBondContact O-N 3.27Å; K413-G415 VanDerWaalsContact C-N 3.29Å; K413-G415 PolarHBondContact O-N 3.46Å; G415-Y417 PolarHBondContact O-N 3.33Å; G415-Y417 VanDerWaalsContact O-N 3.14Å; G415-I432 WeakPolarHBondContact O-CD1 3.34Å
416	R	95.1	Very high	93.9	Very high	105 Å²	105	74.7 Å²	74.7	40%	0.396	38%	0.384	S	S	.	.			trans	-78.8	7.1	-173	-61.6	-164	-77.4	-156.8	-6.3	115.3	D411 N414 K431 I432	D411-R416 HydrophobicContact CB-CB 4.5Å; D411-R416 PolarHBondContact O-N 3.16Å; D411-R416 IonicContact OD1-CZ 2.76Å; D411-R416 IonicContact OD1-NE 3.9Å; D411-R416 IonicContact OD1-NH2 2.79Å; D411-R416 PolarHBondContact OD1-NH2 2.85Å; N414-R416 VanDerWaalsContact C-N 3.3Å; N414-R416 PolarHBondContact O-N 3.26Å; R416-K431 WeakPolarHBondContact O-CA 3.31Å; R416-I432 PolarHBondContact O-N 2.9Å
417	Y	94.1	Very high	93.8	Very high	13 Å²	13	69.1 Å²	69.1	5%	0.051	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	123.2	180	-83.4	-92.6	0	0	0	110.1	Y385 M408 D411 I412 G415 L430 K431	Y385-Y417 VanDerWaalsContact CB-OH 3.31Å; Y385-Y417 WeakPolarHBondContact CB-OH 3.38Å; M408-Y417 HydrophobicContact CE-CE1 3.75Å; M408-Y417 HydrophobicContact CG-CE2 4.23Å; D411-Y417 HydrophobicContact CB-CD2 3.99Å; D411-Y417 HydrophobicContact CB-CE2 3.57Å; I412-Y417 HydrophobicContact CB-CD2 4.48Å; I412-Y417 HydrophobicContact CG1-CD2 3.55Å; I412-Y417 HydrophobicContact CG1-CE2 4.13Å; I412-Y417 HydrophobicContact CG1-CG 3.84Å; G415-Y417 PolarHBondContact O-N 3.33Å; G415-Y417 VanDerWaalsContact O-N 3.14Å; Y417-L430 CarbonylContact C-O 3.56Å; Y417-L430 WeakPolarHBondContact CA-O 3.38Å; Y417-L430 WeakPolarHBondContact CD1-O 3.46Å; Y417-K431 HydrophobicContact CD1-CG 4.11Å; Y417-K431 HydrophobicContact CD2-CG 4.34Å; Y417-K431 HydrophobicContact CE1-CG 3.65Å; Y417-K431 HydrophobicContact CE2-CG 3.92Å; Y417-K431 HydrophobicContact CG-CG 4.43Å
418	L	92.4	Very high	93.7	Very high	15 Å²	15	65.6 Å²	65.6	8%	0.079	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	-43.2	172.4	176.8	68.4	0	0	0	110.6	L430 I432 I435 L447 V456 L457	L418-L430 HydrophobicContact CB-CG 4.43Å; L418-L430 HydrophobicContact CD2-CD2 3.94Å; L418-L430 HydrophobicContact CD2-CG 4.46Å; L418-L430 PolarHBondContact N-O 2.72Å; L418-I432 HydrophobicContact CB-CG1 4.15Å; L418-I435 HydrophobicContact CD2-CD1 3.89Å; L418-L447 HydrophobicContact CD2-CD1 4.26Å; L418-V456 HydrophobicContact CD1-CB 3.63Å; L418-V456 HydrophobicContact CD1-CG1 3.65Å; L418-V456 HydrophobicContact CD1-CG2 4.36Å; L418-L457 HydrophobicContact CD1-CD2 4.16Å; L418-L457 HydrophobicContact CD1-CG 3.98Å; L418-L457 HydrophobicContact CD2-CD1 4.1Å; L418-L457 HydrophobicContact CD2-CD2 3.91Å; L418-L457 HydrophobicContact CD2-CG 4.14Å
419	E	92.8	Very high	93.5	Very high	50 Å²	50	66 Å²	66	23%	0.234	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	141.8	177.6	-69.2	178.6	-179.7	0	0	109.6	G429 L430 A449 N450 S453	E419-G429 CarbonylContact O-C 3.53Å; E419-G429 WeakPolarHBondContact O-CA 3.43Å; E419-L430 HydrophobicContact CB-CB 4.34Å; E419-L430 PolarHBondContact O-N 3.34Å; E419-A449 VanDerWaalsContact OE1-CA 3.3Å; E419-A449 WeakPolarHBondContact OE1-CA 3.26Å; E419-A449 WeakPolarHBondContact OE1-CB 3.38Å; E419-N450 PolarHBondContact OE1-N 3.28Å; E419-S453 WeakPolarHBondContact CG-OG 3.48Å; E419-S453 WeakPolarHBondContact OE1-CB 3.29Å; E419-S453 PolarHBondContact OE1-OG 2.87Å
420	Y	93.8	Very high	93.4	Very high	116 Å²	116	63 Å²	63	46%	0.455	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	155	170.2	60.4	-88.9	0	0	0	111.1	T327 I412 Y428	T327-Y420 WeakPolarHBondContact CG2-OH 3.47Å; I412-Y420 HydrophobicContact CD1-CD1 4.41Å; I412-Y420 HydrophobicContact CD1-CD2 3.9Å; I412-Y420 HydrophobicContact CD1-CG 3.76Å; I412-Y420 HydrophobicContact CG1-CD1 4.06Å; I412-Y420 HydrophobicContact CG1-CD2 4.37Å; I412-Y420 HydrophobicContact CG1-CG 3.92Å; I412-Y420 HydrophobicContact CG2-CD1 3.89Å; I412-Y420 HydrophobicContact CG2-CD2 4.01Å; I412-Y420 HydrophobicContact CG2-CE1 3.62Å; I412-Y420 HydrophobicContact CG2-CE2 3.75Å; I412-Y420 HydrophobicContact CG2-CG 4.08Å; Y420-Y428 CarbonylContact C-O 3.55Å; Y420-Y428 VanDerWaalsContact CA-O 3.25Å; Y420-Y428 WeakPolarHBondContact CA-O 3.39Å
421	G	91.4	Very high	93.3	Very high	37 Å²	37	61.4 Å²	61.4	38%	0.381	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	169.4	177.8	0	0	0	0	0	111.7	L427 Y428	G421-L427 WeakPolarHBondContact O-CA 3.29Å; G421-Y428 PolarHBondContact N-O 2.78Å; G421-Y428 PolarHBondContact O-N 3.22Å
422	E	92.4	Very high	93.2	Very high	108 Å²	108	62.6 Å²	62.6	51%	0.505	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	133.1	179	-173.6	155.5	176.2	0	0	111.2	R405 G425 N426 L427	R405-E422 IonicContact CZ-OE1 2.73Å; R405-E422 IonicContact CZ-OE2 2.7Å; R405-E422 IonicContact NH1-OE1 2.87Å; R405-E422 PolarHBondContact NH1-OE1 3.14Å; R405-E422 IonicContact NH1-OE2 2.67Å; R405-E422 PolarHBondContact NH1-OE2 2.81Å; R405-E422 IonicContact NH2-OE1 2.64Å; R405-E422 IonicContact NH2-OE2 2.71Å; R405-E422 PolarHBondContact NH2-OE2 3.13Å; E422-G425 VanDerWaalsContact OE1-C 3.32Å; E422-G425 VanDerWaalsContact OE1-CA 3.29Å; E422-G425 WeakPolarHBondContact OE1-CA 3.43Å; E422-N426 WeakPolarHBondContact CA-O 3.3Å; E422-L427 HydrophobicContact CB-CD2 3.97Å; E422-L427 HydrophobicContact CG-CD2 4.29Å
423	Y	88.4	Confident	93.3	Very high	145 Å²	145	64.3 Å²	64.3	57%	0.569	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.5	131.6	178.3	-177.7	-101.4	0	0	0	109.9	G425 N426 Y428	Y423-G425 PolarHBondContact O-N 2.9Å; Y423-N426 PolarHBondContact N-O 2.81Å; Y423-N426 PolarHBondContact O-N 2.96Å; Y423-N426 VanDerWaalsContact O-O 3.08Å; Y423-Y428 HydrophobicContact CD1-CE2 4.32Å
424	E	91.6	Very high	93.3	Very high	142 Å²	142	55.6 Å²	55.6	66%	0.664	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	40.2	-175.4	-63.8	-178.6	140.5	0	0	113.6	N426	E424-N426 PolarHBondContact O-N 2.88Å; E424-N426 PolarHBondContact O-ND2 2.75Å
425	G	90.6	Very high	93.4	Very high	48 Å²	48	50.4 Å²	50.4	50%	0.495	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	8.9	-179	0	0	0	0	0	115.2	R405 E422 Y423	R405-G425 PolarHBondContact NH1-O 2.97Å; E422-G425 VanDerWaalsContact OE1-C 3.32Å; E422-G425 VanDerWaalsContact OE1-CA 3.29Å; E422-G425 WeakPolarHBondContact OE1-CA 3.43Å; Y423-G425 PolarHBondContact O-N 2.9Å
426	N	94.3	Very high	93.6	Very high	41 Å²	41	50.7 Å²	50.7	22%	0.219	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	138.8	-178.6	-65.9	-87.4	0	0	0	110.4	S387 R388 E422 Y423 E424 Y428	S387-N426 WeakPolarHBondContact OG-CA 3.35Å; R388-N426 VanDerWaalsContact CA-OD1 3.22Å; R388-N426 WeakPolarHBondContact CA-OD1 3.42Å; R388-N426 HydrophobicContact CB-CB 4.07Å; E422-N426 WeakPolarHBondContact CA-O 3.3Å; Y423-N426 PolarHBondContact N-O 2.81Å; Y423-N426 PolarHBondContact O-N 2.96Å; Y423-N426 VanDerWaalsContact O-O 3.08Å; E424-N426 PolarHBondContact O-N 2.88Å; E424-N426 PolarHBondContact O-ND2 2.75Å; N426-Y428 HydrophobicContact CB-CE2 3.95Å; N426-Y428 WeakPolarHBondContact O-CD2 3.32Å
427	L	94.2	Very high	93.6	Very high	11 Å²	11	50.8 Å²	50.8	6%	0.058	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	145.1	173.8	-62	178.5	0	0	0	110.5	T386 S387 R405 M408 E409 I412 G421 E422	T386-L427 CarbonylContact C-O 3.6Å; T386-L427 WeakPolarHBondContact CA-O 3.31Å; T386-L427 WeakPolarHBondContact CB-O 3.45Å; T386-L427 PolarHBondContact OG1-O 3.4Å; S387-L427 PolarHBondContact N-O 3.11Å; S387-L427 PolarHBondContact OG-N 3.28Å; R405-L427 HydrophobicContact CG-CD1 3.93Å; R405-L427 HydrophobicContact CG-CG 4.37Å; M408-L427 HydrophobicContact CB-CD1 4.28Å; M408-L427 HydrophobicContact CE-CB 3.95Å; M408-L427 HydrophobicContact CG-CB 4.22Å; M408-L427 HydrophobicContact CG-CD1 4.15Å; M408-L427 HydrophobicContact SD-CB 3.56Å; M408-L427 VanDerWaalsContact SD-CB 3.56Å; E409-L427 HydrophobicContact CG-CD1 3.5Å; I412-L427 HydrophobicContact CD1-CD1 4.35Å; G421-L427 WeakPolarHBondContact O-CA 3.29Å; E422-L427 HydrophobicContact CB-CD2 3.97Å; E422-L427 HydrophobicContact CG-CD2 4.29Å
428	Y	93.9	Very high	93.7	Very high	43 Å²	43	50.6 Å²	50.6	17%	0.169	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148	171.7	-67.2	-93.4	0	0	0	108.3	Y385 T386 R388 Y400 Y420 G421 Y423 N426	Y385-Y428 WeakPolarHBondContact O-CA 3.49Å; T386-Y428 HydrophobicContact CG2-CE1 4.23Å; T386-Y428 WeakPolarHBondContact OG1-CD1 3.43Å; T386-Y428 WeakPolarHBondContact OG1-CE1 3.18Å; R388-Y428 WeakPolarHBondContact CD-OH 3.11Å; R388-Y428 PolarHBondContact NE-OH 3.31Å; Y400-Y428 HydrophobicContact CD1-CD1 4.13Å; Y400-Y428 HydrophobicContact CD1-CE1 4.27Å; Y400-Y428 AromaticContact CE1-CD1 3.63Å; Y400-Y428 HydrophobicContact CE1-CD1 3.63Å; Y400-Y428 AromaticContact CE1-CE1 3.8Å; Y400-Y428 HydrophobicContact CE1-CE1 3.8Å; Y420-Y428 CarbonylContact C-O 3.55Å; Y420-Y428 VanDerWaalsContact CA-O 3.25Å; Y420-Y428 WeakPolarHBondContact CA-O 3.39Å; G421-Y428 PolarHBondContact N-O 2.78Å; G421-Y428 PolarHBondContact O-N 3.22Å; Y423-Y428 HydrophobicContact CD1-CE2 4.32Å; N426-Y428 HydrophobicContact CB-CE2 3.95Å; N426-Y428 WeakPolarHBondContact O-CD2 3.32Å
429	G	93.6	Very high	93.9	Very high	9 Å²	9	51.8 Å²	51.8	9%	0.093	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.6	164.9	179.1	0	0	0	0	0	115.1	Y385 E419	Y385-G429 PolarHBondContact N-O 2.77Å; Y385-G429 PolarHBondContact O-N 2.96Å; E419-G429 CarbonylContact O-C 3.53Å; E419-G429 WeakPolarHBondContact O-CA 3.43Å
430	L	94.1	Very high	94.1	Very high	19 Å²	19	57 Å²	57	10%	0.099	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	116.6	177.5	171	52.4	0	0	0	109.4	T382 Y417 L418 E419 L447	T382-L430 VanDerWaalsContact CB-CD1 3.4Å; T382-L430 HydrophobicContact CG2-CD1 3.64Å; T382-L430 WeakPolarHBondContact OG1-CD1 3.4Å; Y417-L430 CarbonylContact C-O 3.56Å; Y417-L430 WeakPolarHBondContact CA-O 3.38Å; Y417-L430 WeakPolarHBondContact CD1-O 3.46Å; L418-L430 HydrophobicContact CB-CG 4.43Å; L418-L430 HydrophobicContact CD2-CD2 3.94Å; L418-L430 HydrophobicContact CD2-CG 4.46Å; L418-L430 PolarHBondContact N-O 2.72Å; E419-L430 HydrophobicContact CB-CB 4.34Å; E419-L430 PolarHBondContact O-N 3.34Å; L430-L447 HydrophobicContact CD2-CD2 4.24Å
431	K	94.2	Very high	94.2	Very high	14 Å²	14	54.2 Å²	54.2	6%	0.061	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	147.2	173.5	-80.5	-166.8	154	-133.5	0	112.1	Y385 D411 R416 Y417 D433	Y385-K431 HydrophobicContact CD1-CD 4.45Å; Y385-K431 HydrophobicContact CD2-CB 4.17Å; Y385-K431 HydrophobicContact CD2-CD 3.9Å; Y385-K431 HydrophobicContact CD2-CG 3.75Å; Y385-K431 HydrophobicContact CE1-CD 4.17Å; Y385-K431 HydrophobicContact CE2-CB 4.03Å; Y385-K431 HydrophobicContact CE2-CD 3.59Å; Y385-K431 HydrophobicContact CE2-CG 3.84Å; Y385-K431 HydrophobicContact CG-CD 4.32Å; Y385-K431 HydrophobicContact CG-CG 4.33Å; D411-K431 WeakPolarHBondContact OD2-CE 3.25Å; D411-K431 IonicContact OD2-NZ 3.66Å; D411-K431 PolarHBondContact OD2-NZ 2.86Å; R416-K431 WeakPolarHBondContact O-CA 3.31Å; Y417-K431 HydrophobicContact CD1-CG 4.11Å; Y417-K431 HydrophobicContact CD2-CG 4.34Å; Y417-K431 HydrophobicContact CE1-CG 3.65Å; Y417-K431 HydrophobicContact CE2-CG 3.92Å; Y417-K431 HydrophobicContact CG-CG 4.43Å; K431-D433 HydrophobicContact CB-CB 4.34Å; K431-D433 HydrophobicContact CD-CB 4.49Å; K431-D433 WeakPolarHBondContact CD-OD2 3.37Å; K431-D433 IonicContact NZ-OD2 3.63Å; K431-D433 PolarHBondContact NZ-OD2 3.01Å
432	I	95.1	Very high	94.4	Very high	30 Å²	30	55.8 Å²	55.8	15%	0.154	31%	0.306	C	S	.	.	S	Bend	trans	-66.3	-48	168.6	-68.1	175.1	0	0	0	109.3	G415 R416 L418 S434 I435 H436 F462	G415-I432 WeakPolarHBondContact O-CD1 3.34Å; R416-I432 PolarHBondContact O-N 2.9Å; L418-I432 HydrophobicContact CB-CG1 4.15Å; I432-S434 PolarHBondContact O-N 2.95Å; I432-I435 VanDerWaalsContact O-CB 3.3Å; I432-I435 WeakPolarHBondContact O-CB 3.49Å; I432-I435 PolarHBondContact O-N 2.87Å; I432-H436 VanDerWaalsContact CG2-NE2 3.26Å; I432-H436 WeakPolarHBondContact CG2-NE2 3.38Å; I432-H436 PolarHBondContact O-CD2 2.96Å; I432-F462 HydrophobicContact CG2-CE1 4.13Å; I432-F462 HydrophobicContact CG2-CZ 3.81Å
433	D	95.1	Very high	94.6	Very high	63 Å²	63	54.7 Å²	54.7	34%	0.337	30%	0.297	S	S	.	.	H	α-helix	trans	-38.1	-50.4	175.2	-45.3	-18.6	0	0	0	112.7	K431 I435 H436 E437	K431-D433 HydrophobicContact CB-CB 4.34Å; K431-D433 HydrophobicContact CD-CB 4.49Å; K431-D433 WeakPolarHBondContact CD-OD2 3.37Å; K431-D433 IonicContact NZ-OD2 3.63Å; K431-D433 PolarHBondContact NZ-OD2 3.01Å; D433-I435 VanDerWaalsContact C-N 3.28Å; D433-I435 PolarHBondContact O-N 3.42Å; D433-H436 WeakPolarHBondContact O-CB 3.33Å; D433-H436 PolarHBondContact O-N 3.22Å; D433-H436 VanDerWaalsContact O-N 3.11Å; D433-E437 PolarHBondContact O-N 3.13Å; D433-E437 VanDerWaalsContact O-N 3.13Å
434	S	94.9	Very high	95.1	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.007	28%	0.275	C	S	.	.	H	α-helix	trans	-73.8	-9.4	-177.1	-65.6	0	0	0	0	116	T382 I432 E437 V438	T382-S434 WeakPolarHBondContact CG2-O 3.42Å; I432-S434 PolarHBondContact O-N 2.95Å; S434-E437 VanDerWaalsContact CA-OE2 3.22Å; S434-E437 WeakPolarHBondContact CA-OE2 3.5Å; S434-E437 VanDerWaalsContact CB-OE2 3.26Å; S434-E437 WeakPolarHBondContact CB-OE2 3.38Å; S434-E437 PolarHBondContact OG-OE2 2.82Å; S434-V438 WeakPolarHBondContact O-CG2 3.32Å
435	I	96.4	Very high	95.4	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-76.4	-43.4	168.3	-51.8	174.6	0	0	0	108.5	T353 T382 L418 I432 D433 V438 V439 C445 L447 L457 F462	T353-I435 HydrophobicContact CG2-CG2 3.64Å; T382-I435 HydrophobicContact CG2-CB 4.42Å; T382-I435 HydrophobicContact CG2-CG1 3.81Å; L418-I435 HydrophobicContact CD2-CD1 3.89Å; I432-I435 VanDerWaalsContact O-CB 3.3Å; I432-I435 WeakPolarHBondContact O-CB 3.49Å; I432-I435 PolarHBondContact O-N 2.87Å; D433-I435 VanDerWaalsContact C-N 3.28Å; D433-I435 PolarHBondContact O-N 3.42Å; I435-V438 PolarHBondContact O-N 2.9Å; I435-V439 WeakPolarHBondContact O-CG2 3.29Å; I435-V439 PolarHBondContact O-N 3.15Å; I435-V439 VanDerWaalsContact O-N 3.16Å; I435-C445 HydrophobicContact CG2-CB 4.26Å; I435-L447 HydrophobicContact CD1-CD1 4.15Å; I435-L447 HydrophobicContact CD1-CD2 4.45Å; I435-L447 HydrophobicContact CG1-CD2 4.29Å; I435-L457 HydrophobicContact CD1-CD2 4.43Å; I435-F462 HydrophobicContact CB-CE1 4.41Å; I435-F462 HydrophobicContact CD1-CE1 4.25Å; I435-F462 HydrophobicContact CG2-CD1 3.97Å; I435-F462 HydrophobicContact CG2-CE1 4.28Å
436	H	96.6	Very high	95.7	Very high	53 Å²	53	39.5 Å²	39.5	25%	0.245	22%	0.22	C	C	.	.	H	α-helix	trans	-62.8	-44.6	175.7	-54.5	-85.7	0	0	0	111.3	I432 D433 V438 V439 E440 E461 F462	I432-H436 VanDerWaalsContact CG2-NE2 3.26Å; I432-H436 WeakPolarHBondContact CG2-NE2 3.38Å; I432-H436 PolarHBondContact O-CD2 2.96Å; D433-H436 WeakPolarHBondContact O-CB 3.33Å; D433-H436 PolarHBondContact O-N 3.22Å; D433-H436 VanDerWaalsContact O-N 3.11Å; H436-V438 PolarHBondContact O-N 2.87Å; H436-V439 PolarHBondContact O-N 2.85Å; H436-E440 WeakPolarHBondContact O-CB 3.38Å; H436-E440 WeakPolarHBondContact O-CG 3.26Å; H436-E440 PolarHBondContact O-N 3Å; H436-E461 IonicContact CE1-OE1 2.96Å; H436-E461 PolarHBondContact CE1-OE1 2.8Å; H436-E461 VanDerWaalsContact CE1-OE1 3.27Å; H436-E461 IonicContact NE2-OE1 3.54Å; H436-F462 AromaticContact CE1-CE1 3.84Å; H436-F462 AromaticContact NE2-CE1 3.7Å
437	E	96	Very high	95.9	Very high	108 Å²	108	37.6 Å²	37.6	51%	0.505	21%	0.209	S	C	.	.	H	α-helix	trans	-49.5	-34.2	174.3	-68.6	172.4	164.1	0	0	113.3	D433 S434 A441	D433-E437 PolarHBondContact O-N 3.13Å; D433-E437 VanDerWaalsContact O-N 3.13Å; S434-E437 VanDerWaalsContact CA-OE2 3.22Å; S434-E437 WeakPolarHBondContact CA-OE2 3.5Å; S434-E437 VanDerWaalsContact CB-OE2 3.26Å; S434-E437 WeakPolarHBondContact CB-OE2 3.38Å; S434-E437 PolarHBondContact OG-OE2 2.82Å; E437-A441 WeakPolarHBondContact O-CB 3.47Å; E437-A441 PolarHBondContact O-N 2.88Å
438	V	96.6	Very high	95.8	Very high	8 Å²	8	38.7 Å²	38.7	5%	0.048	22%	0.215	C	C	.	.	H	α-helix	trans	-82.8	-38.1	178.8	176.2	0	0	0	0	112.2	S434 I435 H436 A441 R443 C445	S434-V438 WeakPolarHBondContact O-CG2 3.32Å; I435-V438 PolarHBondContact O-N 2.9Å; H436-V438 PolarHBondContact O-N 2.87Å; V438-A441 PolarHBondContact O-N 2.7Å; V438-R443 HydrophobicContact CG1-CB 4.24Å; V438-R443 PolarHBondContact O-N 3.03Å; V438-C445 HydrophobicContact CB-CB 3.85Å; V438-C445 HydrophobicContact CG1-CB 3.54Å
439	V	96.5	Very high	95.6	Very high	41 Å²	41	36.8 Å²	36.8	25%	0.248	21%	0.209	C	C	.	.	H	α-helix	trans	-72	-41.4	-180	173.4	0	0	0	0	111.4	K352 I435 H436 A441 G442 C445	K352-V439 HydrophobicContact CB-CG1 4Å; K352-V439 HydrophobicContact CB-CG2 3.93Å; K352-V439 HydrophobicContact CD-CG1 4.16Å; K352-V439 HydrophobicContact CG-CG1 3.89Å; I435-V439 WeakPolarHBondContact O-CG2 3.29Å; I435-V439 PolarHBondContact O-N 3.15Å; I435-V439 VanDerWaalsContact O-N 3.16Å; H436-V439 PolarHBondContact O-N 2.85Å; V439-A441 VanDerWaalsContact C-N 3.27Å; V439-A441 PolarHBondContact O-N 2.71Å; V439-G442 WeakPolarHBondContact O-CA 3.2Å; V439-G442 PolarHBondContact O-N 2.76Å; V439-C445 HydrophobicContact CG2-CB 4.44Å
440	E	96.5	Very high	95.5	Very high	159 Å²	159	40.2 Å²	40.2	74%	0.743	23%	0.225	S	C	*	.	H	α-helix	trans	-62.3	-34.2	172.9	-70.9	171.1	-167.2	0	0	111.7	H436 G442	H436-E440 WeakPolarHBondContact O-CB 3.38Å; H436-E440 WeakPolarHBondContact O-CG 3.26Å; H436-E440 PolarHBondContact O-N 3Å; E440-G442 PolarHBondContact O-N 3.16Å
441	A	96.1	Very high	95.3	Very high	57 Å²	57	39.8 Å²	39.8	47%	0.471	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	13.6	169.2	0	0	0	0	0	113.9	E437 V438 V439 R443	E437-A441 WeakPolarHBondContact O-CB 3.47Å; E437-A441 PolarHBondContact O-N 2.88Å; V438-A441 PolarHBondContact O-N 2.7Å; V439-A441 VanDerWaalsContact C-N 3.27Å; V439-A441 PolarHBondContact O-N 2.71Å; A441-R443 VanDerWaalsContact C-N 3.32Å; A441-R443 PolarHBondContact O-N 2.92Å
442	G	95.6	Very high	95.1	Very high	71 Å²	71	43.2 Å²	43.2	73%	0.732	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.1	13.4	172.8	0	0	0	0	0	115.6	V439 E440	V439-G442 WeakPolarHBondContact O-CA 3.2Å; V439-G442 PolarHBondContact O-N 2.76Å; E440-G442 PolarHBondContact O-N 3.16Å
443	R	97.1	Very high	94.9	Very high	84 Å²	84	42.1 Å²	42.1	32%	0.317	23%	0.234	S	C	.	.	S	Bend	trans	-117	150.2	-171.2	-68.7	178.4	-61.9	155.6	1.4	112.6	L378 F379 V438 A441 C445	L378-R443 WeakPolarHBondContact O-CA 3.41Å; F379-R443 PolarHBondContact O-NH1 2.9Å; V438-R443 HydrophobicContact CG1-CB 4.24Å; V438-R443 PolarHBondContact O-N 3.03Å; A441-R443 VanDerWaalsContact C-N 3.32Å; A441-R443 PolarHBondContact O-N 2.92Å; R443-C445 PolarHBondContact O-N 2.9Å
444	V	97.8	Very high	94.7	Very high	17 Å²	17	39.3 Å²	39.3	10%	0.103	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	118.6	172.4	-174.4	0	0	0	0	108.6	K352 L354 L378 F379 G380 I446	K352-V444 WeakPolarHBondContact O-CA 3.2Å; L354-V444 HydrophobicContact CB-CG1 3.87Å; L378-V444 HydrophobicContact CD1-CG2 4.24Å; L378-V444 PolarHBondContact O-N 2.73Å; F379-V444 WeakPolarHBondContact CA-O 3.35Å; F379-V444 HydrophobicContact CD1-CB 3.94Å; F379-V444 HydrophobicContact CD1-CG1 4.37Å; F379-V444 HydrophobicContact CE1-CB 4.18Å; F379-V444 HydrophobicContact CE1-CG1 4.37Å; G380-V444 PolarHBondContact N-O 2.64Å; V444-I446 PolarHBondContact O-N 2.73Å
445	C	98.1	Very high	94.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	118	-179.6	-173.1	0	0	0	0	111.2	K352 T353 L354 I435 V438 V439 R443	K352-C445 PolarHBondContact O-N 2.74Å; T353-C445 CarbonylContact C-O 3.46Å; T353-C445 WeakPolarHBondContact CA-O 3.34Å; T353-C445 HydrophobicContact CG2-CB 4.24Å; L354-C445 PolarHBondContact N-O 2.73Å; I435-C445 HydrophobicContact CG2-CB 4.26Å; V438-C445 HydrophobicContact CB-CB 3.85Å; V438-C445 HydrophobicContact CG1-CB 3.54Å; V439-C445 HydrophobicContact CG2-CB 4.44Å; R443-C445 PolarHBondContact O-N 2.9Å
446	I	98.1	Very high	94	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	114.3	178	-48.4	-175.6	0	0	0	110.4	L354 L356 K368 L371 L372 F379 G380 V444	L354-I446 HydrophobicContact CB-CG1 4.49Å; L354-I446 HydrophobicContact CD2-CD1 4.32Å; L354-I446 HydrophobicContact CD2-CG1 4.16Å; L354-I446 HydrophobicContact CD2-CG2 4.28Å; L354-I446 CarbonylContact O-C 3.52Å; L354-I446 WeakPolarHBondContact O-CA 3.25Å; L356-I446 HydrophobicContact CD1-CG2 3.84Å; L356-I446 HydrophobicContact CG-CG2 4.08Å; K368-I446 HydrophobicContact CB-CG2 4.15Å; K368-I446 HydrophobicContact CD-CB 4.41Å; K368-I446 HydrophobicContact CD-CG2 3.93Å; K368-I446 WeakPolarHBondContact CE-O 3.37Å; K368-I446 HydrophobicContact CG-CB 4.33Å; K368-I446 HydrophobicContact CG-CG2 3.84Å; K368-I446 PolarHBondContact NZ-O 2.67Å; L371-I446 HydrophobicContact CB-CD1 3.49Å; L371-I446 VanDerWaalsContact CB-CD1 3.49Å; L371-I446 HydrophobicContact CD1-CD1 3.84Å; L371-I446 HydrophobicContact CG-CD1 4.29Å; L372-I446 HydrophobicContact CD2-CD1 4.3Å; L372-I446 HydrophobicContact CG-CD1 4.2Å; F379-I446 HydrophobicContact CB-CD1 3.77Å; F379-I446 HydrophobicContact CB-CG1 4.08Å; F379-I446 HydrophobicContact CD1-CD1 3.73Å; F379-I446 HydrophobicContact CD1-CG1 3.75Å; F379-I446 HydrophobicContact CD2-CD1 4.46Å; F379-I446 HydrophobicContact CE1-CD1 4.47Å; F379-I446 HydrophobicContact CG-CD1 3.74Å; F379-I446 HydrophobicContact CG-CG1 4.15Å; G380-I446 PolarHBondContact O-N 3.27Å; V444-I446 PolarHBondContact O-N 2.73Å
447	L	96.5	Very high	93.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	132	176.1	-53.2	-176.8	0	0	0	109.7	T353 L354 V355 L356 T382 L418 L430 I435 A449 L457	T353-L447 HydrophobicContact CG2-CD1 4.4Å; L354-L447 PolarHBondContact O-N 3.27Å; V355-L447 HydrophobicContact CG1-CB 4.48Å; L356-L447 PolarHBondContact N-O 2.83Å; T382-L447 HydrophobicContact CG2-CD2 4.18Å; L418-L447 HydrophobicContact CD2-CD1 4.26Å; L430-L447 HydrophobicContact CD2-CD2 4.24Å; I435-L447 HydrophobicContact CD1-CD1 4.15Å; I435-L447 HydrophobicContact CD1-CD2 4.45Å; I435-L447 HydrophobicContact CG1-CD2 4.29Å; L447-A449 HydrophobicContact CB-CB 4.49Å; L447-L457 HydrophobicContact CD1-CD1 3.77Å; L447-L457 HydrophobicContact CD1-CD2 3.63Å; L447-L457 HydrophobicContact CD1-CG 4.38Å
448	D	93.1	Very high	93.7	Very high	35 Å²	35	40.6 Å²	40.6	19%	0.187	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	76.8	174.8	177.4	32.4	0	0	0	107	R364 R365 K368	R364-D448 WeakPolarHBondContact CB-OD1 3.39Å; R364-D448 WeakPolarHBondContact CD-OD1 3.41Å; R364-D448 IonicContact CZ-OD1 2.74Å; R364-D448 IonicContact NE-OD1 2.73Å; R364-D448 IonicContact NH1-OD1 2.73Å; R364-D448 PolarHBondContact NH1-OD1 3.23Å; R365-D448 WeakPolarHBondContact CG-OD2 3.3Å; R365-D448 IonicContact NE-OD2 3.94Å; R365-D448 PolarHBondContact NE-OD2 2.88Å; K368-D448 HydrophobicContact CD-CB 3.92Å
449	A	89.6	Confident	93.5	Very high	3 Å²	3	42.3 Å²	42.3	3%	0.025	24%	0.237	C	C	.	.			trans	-101.5	171.5	-156.4	0	0	0	0	0	113.5	V355 L356 I357 R364 E419 L447	V355-A449 HydrophobicContact CG1-CB 3.95Å; L356-A449 PolarHBondContact O-N 3.46Å; I357-A449 HydrophobicContact CD1-CB 4.14Å; R364-A449 PolarHBondContact NH1-O 2.9Å; E419-A449 VanDerWaalsContact OE1-CA 3.3Å; E419-A449 WeakPolarHBondContact OE1-CA 3.26Å; E419-A449 WeakPolarHBondContact OE1-CB 3.38Å; L447-A449 HydrophobicContact CB-CB 4.49Å
450	N	90.7	Very high	93.3	Very high	81 Å²	81	43.1 Å²	43.1	43%	0.433	25%	0.245	S	C	.	.			trans	-81.8	143.3	162.2	-168.9	-68	0	0	0	110	E419 Q452 S453	E419-N450 PolarHBondContact OE1-N 3.28Å; N450-Q452 PolarHBondContact O-N 3.5Å; N450-Q452 VanDerWaalsContact O-N 3.14Å; N450-Q452 WeakPolarHBondContact OD1-CB 2.96Å; N450-Q452 VanDerWaalsContact OD1-CG 3.32Å; N450-Q452 WeakPolarHBondContact OD1-CG 3.46Å; N450-Q452 PolarHBondContact OD1-N 2.9Å; N450-S453 VanDerWaalsContact O-CB 3.31Å; N450-S453 WeakPolarHBondContact O-CB 3.5Å; N450-S453 PolarHBondContact O-N 2.85Å; N450-S453 PolarHBondContact O-OG 3.44Å
451	P	91.2	Very high	93.2	Very high	9 Å²	9	40.1 Å²	40.1	6%	0.058	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-49.7	-34.7	172	-25.1	28.7	0	0	0	114.9	I357 S453 L454 I509 F513	I357-P451 HydrophobicContact CG2-CB 4.28Å; I357-P451 HydrophobicContact CG2-CG 3.87Å; P451-S453 PolarHBondContact O-N 2.85Å; P451-L454 VanDerWaalsContact O-CB 3.29Å; P451-L454 WeakPolarHBondContact O-CB 3.43Å; P451-L454 WeakPolarHBondContact O-CD1 3.44Å; P451-L454 WeakPolarHBondContact O-CG 3.13Å; P451-L454 PolarHBondContact O-N 2.74Å; P451-I509 HydrophobicContact CG-CD1 3.94Å; P451-I509 HydrophobicContact CG-CG1 3.94Å; P451-I509 HydrophobicContact CG-CG2 3.96Å; P451-F513 HydrophobicContact CB-CB 4.48Å; P451-F513 HydrophobicContact CB-CD1 3.81Å; P451-F513 HydrophobicContact CB-CD2 3.5Å; P451-F513 VanDerWaalsContact CB-CD2 3.5Å; P451-F513 HydrophobicContact CB-CE1 3.84Å; P451-F513 HydrophobicContact CB-CE2 3.54Å; P451-F513 HydrophobicContact CB-CG 3.66Å; P451-F513 HydrophobicContact CB-CZ 3.72Å; P451-F513 HydrophobicContact CG-CD2 4.34Å; P451-F513 HydrophobicContact CG-CE2 4.39Å
452	Q	88.8	Confident	93.2	Very high	86 Å²	86	37.7 Å²	37.7	40%	0.402	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-62.2	-31.5	178.7	-62.4	-66.5	-3.1	0	0	112.9	N450 L454 K455 F513	N450-Q452 PolarHBondContact O-N 3.5Å; N450-Q452 VanDerWaalsContact O-N 3.14Å; N450-Q452 WeakPolarHBondContact OD1-CB 2.96Å; N450-Q452 VanDerWaalsContact OD1-CG 3.32Å; N450-Q452 WeakPolarHBondContact OD1-CG 3.46Å; N450-Q452 PolarHBondContact OD1-N 2.9Å; Q452-L454 PolarHBondContact O-N 2.9Å; Q452-L454 VanDerWaalsContact O-N 3.16Å; Q452-K455 PolarHBondContact O-N 2.86Å; Q452-F513 HydrophobicContact CG-CZ 4.49Å
453	S	91.2	Very high	93.2	Very high	8 Å²	8	35.6 Å²	35.6	6%	0.056	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-66.1	-16.2	-179	-50.5	0	0	0	0	112.9	E419 N450 P451 K455 V456 L457	E419-S453 WeakPolarHBondContact CG-OG 3.48Å; E419-S453 WeakPolarHBondContact OE1-CB 3.29Å; E419-S453 PolarHBondContact OE1-OG 2.87Å; N450-S453 VanDerWaalsContact O-CB 3.31Å; N450-S453 WeakPolarHBondContact O-CB 3.5Å; N450-S453 PolarHBondContact O-N 2.85Å; N450-S453 PolarHBondContact O-OG 3.44Å; P451-S453 PolarHBondContact O-N 2.85Å; S453-K455 PolarHBondContact O-N 2.78Å; S453-V456 PolarHBondContact O-N 3.27Å; S453-V456 VanDerWaalsContact O-N 3.11Å; S453-L457 WeakPolarHBondContact O-CG 3.31Å; S453-L457 PolarHBondContact O-N 3.25Å
454	L	91.5	Very high	93.2	Very high	3 Å²	3	31.7 Å²	31.7	2%	0.016	17%	0.167	C	C	.	.	H	α-helix	trans	-59.2	-32.1	174.3	-63.2	172.7	0	0	0	112.6	V355 I357 P451 Q452 V456 L457 R458 V466 F513 F516 F517	V355-L454 HydrophobicContact CB-CD2 4.5Å; V355-L454 HydrophobicContact CG1-CD2 3.94Å; I357-L454 HydrophobicContact CD1-CD1 4.35Å; I357-L454 HydrophobicContact CD1-CD2 4.05Å; I357-L454 HydrophobicContact CD1-CG 4.19Å; I357-L454 HydrophobicContact CG1-CD1 4.19Å; I357-L454 HydrophobicContact CG1-CD2 4.09Å; I357-L454 HydrophobicContact CG1-CG 4.42Å; P451-L454 VanDerWaalsContact O-CB 3.29Å; P451-L454 WeakPolarHBondContact O-CB 3.43Å; P451-L454 WeakPolarHBondContact O-CD1 3.44Å; P451-L454 WeakPolarHBondContact O-CG 3.13Å; P451-L454 PolarHBondContact O-N 2.74Å; Q452-L454 PolarHBondContact O-N 2.9Å; Q452-L454 VanDerWaalsContact O-N 3.16Å; L454-V456 PolarHBondContact O-N 2.94Å; L454-L457 PolarHBondContact O-N 3.45Å; L454-R458 WeakPolarHBondContact O-CB 3.5Å; L454-R458 PolarHBondContact O-N 2.84Å; L454-V466 HydrophobicContact CD1-CG1 4.33Å; L454-V466 HydrophobicContact CD2-CB 4.45Å; L454-V466 HydrophobicContact CD2-CG1 3.67Å; L454-V466 HydrophobicContact CD2-CG2 3.83Å; L454-F513 HydrophobicContact CD1-CB 4.46Å; L454-F513 HydrophobicContact CD1-CD1 4.37Å; L454-F516 HydrophobicContact CB-CD2 4.32Å; L454-F516 HydrophobicContact CB-CG 4.37Å; L454-F516 HydrophobicContact CD1-CB 3.84Å; L454-F516 HydrophobicContact CD1-CD2 4.02Å; L454-F516 HydrophobicContact CD1-CG 4.17Å; L454-F517 HydrophobicContact CD1-CE1 4.11Å
455	K	86.3	Confident	93.1	Very high	75 Å²	75	31.7 Å²	31.7	33%	0.326	17%	0.165	S	C	.	.	H	α-helix	trans	-62.9	-27	176.5	-73.9	177.4	167.8	-97	0	113.2	D333 E336 Q452 S453 F516	D333-K455 WeakPolarHBondContact OD1-CE 3.47Å; D333-K455 IonicContact OD1-NZ 3.16Å; D333-K455 PolarHBondContact OD1-NZ 2.96Å; E336-K455 IonicContact OE2-NZ 3.4Å; E336-K455 PolarHBondContact OE2-NZ 3.04Å; Q452-K455 PolarHBondContact O-N 2.86Å; S453-K455 PolarHBondContact O-N 2.78Å; K455-F516 HydrophobicContact CG-CZ 4.48Å
456	V	90.5	Very high	93.1	Very high	69 Å²	69	31.8 Å²	31.8	42%	0.418	17%	0.166	S	C	.	.	H	α-helix	trans	-92	-31.5	174.8	-177.2	0	0	0	0	111	L418 S453 L454	L418-V456 HydrophobicContact CD1-CB 3.63Å; L418-V456 HydrophobicContact CD1-CG1 3.65Å; L418-V456 HydrophobicContact CD1-CG2 4.36Å; S453-V456 PolarHBondContact O-N 3.27Å; S453-V456 VanDerWaalsContact O-N 3.11Å; L454-V456 PolarHBondContact O-N 2.94Å
457	L	93.6	Very high	93.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-82.3	-22.7	-175.6	-69.6	170.3	0	0	0	115.1	V355 L418 I435 L447 S453 L454 T459 F462 P464	V355-L457 HydrophobicContact CG1-CD1 3.93Å; V355-L457 HydrophobicContact CG2-CD1 3.89Å; L418-L457 HydrophobicContact CD1-CD2 4.16Å; L418-L457 HydrophobicContact CD1-CG 3.98Å; L418-L457 HydrophobicContact CD2-CD1 4.1Å; L418-L457 HydrophobicContact CD2-CD2 3.91Å; L418-L457 HydrophobicContact CD2-CG 4.14Å; I435-L457 HydrophobicContact CD1-CD2 4.43Å; L447-L457 HydrophobicContact CD1-CD1 3.77Å; L447-L457 HydrophobicContact CD1-CD2 3.63Å; L447-L457 HydrophobicContact CD1-CG 4.38Å; S453-L457 WeakPolarHBondContact O-CG 3.31Å; S453-L457 PolarHBondContact O-N 3.25Å; L454-L457 PolarHBondContact O-N 3.45Å; L457-T459 PolarHBondContact O-N 3.29Å; L457-F462 HydrophobicContact CD2-CB 4.17Å; L457-F462 HydrophobicContact CD2-CD1 4.35Å; L457-F462 HydrophobicContact CD2-CD2 4.02Å; L457-F462 HydrophobicContact CD2-CG 3.9Å; L457-P464 WeakPolarHBondContact O-CD 3.42Å; L457-P464 VanDerWaalsContact O-CG 3.23Å; L457-P464 WeakPolarHBondContact O-CG 3.49Å
458	R	91.6	Very high	93.2	Very high	46 Å²	46	31.8 Å²	31.8	17%	0.174	17%	0.166	C	C	.	.	S	Bend	trans	-76.1	55.3	-174.6	-162.3	-168.6	-173.3	70.4	-3.2	113.6	E341 L454 F516 W551	E341-R458 IonicContact OE1-CZ 3.29Å; E341-R458 VanDerWaalsContact OE1-CZ 3.25Å; E341-R458 IonicContact OE1-NE 2.97Å; E341-R458 PolarHBondContact OE1-NE 3.4Å; E341-R458 IonicContact OE1-NH2 2.73Å; E341-R458 PolarHBondContact OE1-NH2 3.37Å; E341-R458 IonicContact OE2-CZ 2.66Å; E341-R458 IonicContact OE2-NH2 3.67Å; E341-R458 PolarHBondContact OE2-NH2 2.84Å; L454-R458 WeakPolarHBondContact O-CB 3.5Å; L454-R458 PolarHBondContact O-N 2.84Å; R458-F516 PolarHBondContact NH1-O 2.95Å; R458-W551 HydrophobicContact CG-CZ2 3.86Å; R458-W551 PolarHBondContact O-NE1 3.25Å
459	T	93.1	Very high	93.4	Very high	45 Å²	45	30.1 Å²	30.1	28%	0.276	16%	0.157	S	C	.	.	S	Bend	trans	-131	162.4	-176	63.5	0	0	0	0	112.5	L457 E461 F462 L463	L457-T459 PolarHBondContact O-N 3.29Å; T459-E461 PolarHBondContact O-N 3.23Å; T459-E461 WeakPolarHBondContact OG1-CB 3.5Å; T459-E461 PolarHBondContact OG1-N 3.19Å; T459-F462 PolarHBondContact O-N 2.99Å; T459-F462 WeakPolarHBondContact OG1-CD2 3.42Å; T459-L463 PolarHBondContact O-N 3.15Å
460	S	92.9	Very high	93.6	Very high	57 Å²	57	33.3 Å²	33.3	40%	0.399	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-19.9	169.2	44.1	0	0	0	0	113.7	K352 L463	K352-S460 PolarHBondContact NZ-O 3.18Å; S460-L463 WeakPolarHBondContact O-CG 3.46Å
461	E	93.9	Very high	93.8	Very high	97 Å²	97	29.9 Å²	29.9	45%	0.453	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-51.1	173.4	-176.2	174.8	-149.3	0	0	111.5	K352 H436 T459	K352-E461 WeakPolarHBondContact CD-O 3.3Å; K352-E461 WeakPolarHBondContact CE-O 3.45Å; K352-E461 PolarHBondContact NZ-O 3.06Å; H436-E461 IonicContact CE1-OE1 2.96Å; H436-E461 PolarHBondContact CE1-OE1 2.8Å; H436-E461 VanDerWaalsContact CE1-OE1 3.27Å; H436-E461 IonicContact NE2-OE1 3.54Å; T459-E461 PolarHBondContact O-N 3.23Å; T459-E461 WeakPolarHBondContact OG1-CB 3.5Å; T459-E461 PolarHBondContact OG1-N 3.19Å
462	F	95.9	Very high	93.8	Very high	5 Å²	5	29.6 Å²	29.6	2%	0.022	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-13.3	-174.6	-55	-66.9	0	0	0	115.1	K352 T353 I432 I435 H436 L457 T459 P464	K352-F462 WeakPolarHBondContact CB-O 3.37Å; T353-F462 HydrophobicContact CG2-CB 4.14Å; T353-F462 WeakPolarHBondContact CG2-O 3.27Å; T353-F462 PolarHBondContact N-O 3.48Å; T353-F462 PolarHBondContact OG1-O 3.48Å; I432-F462 HydrophobicContact CG2-CE1 4.13Å; I432-F462 HydrophobicContact CG2-CZ 3.81Å; I435-F462 HydrophobicContact CB-CE1 4.41Å; I435-F462 HydrophobicContact CD1-CE1 4.25Å; I435-F462 HydrophobicContact CG2-CD1 3.97Å; I435-F462 HydrophobicContact CG2-CE1 4.28Å; H436-F462 AromaticContact CE1-CE1 3.84Å; H436-F462 AromaticContact NE2-CE1 3.7Å; L457-F462 HydrophobicContact CD2-CB 4.17Å; L457-F462 HydrophobicContact CD2-CD1 4.35Å; L457-F462 HydrophobicContact CD2-CD2 4.02Å; L457-F462 HydrophobicContact CD2-CG 3.9Å; T459-F462 PolarHBondContact O-N 2.99Å; T459-F462 WeakPolarHBondContact OG1-CD2 3.42Å; F462-P464 VanDerWaalsContact C-N 3.32Å; F462-P464 VanDerWaalsContact O-N 3.13Å
463	L	95.5	Very high	93.9	Very high	27 Å²	27	31.9 Å²	31.9	14%	0.141	17%	0.167	C	C	.	.			trans	33.6	59.2	-179.7	-64.9	175	0	0	0	112.8	F349 R351 K352 T459 S460 W551	F349-L463 HydrophobicContact CD2-CD1 4.02Å; F349-L463 HydrophobicContact CE2-CB 4.17Å; F349-L463 HydrophobicContact CE2-CD1 3.84Å; F349-L463 HydrophobicContact CE2-CD2 4.06Å; F349-L463 HydrophobicContact CE2-CG 4.25Å; F349-L463 HydrophobicContact CZ-CD2 4.37Å; R351-L463 WeakPolarHBondContact CA-O 3.47Å; R351-L463 WeakPolarHBondContact CB-O 3.4Å; R351-L463 VanDerWaalsContact CD-O 3.22Å; R351-L463 WeakPolarHBondContact CD-O 3.48Å; K352-L463 HydrophobicContact CB-CB 4.33Å; K352-L463 HydrophobicContact CD-CB 4.09Å; K352-L463 HydrophobicContact CD-CD1 3.89Å; K352-L463 HydrophobicContact CD-CG 4.05Å; K352-L463 HydrophobicContact CG-CB 4.15Å; K352-L463 HydrophobicContact CG-CD1 4.11Å; K352-L463 HydrophobicContact CG-CG 4.47Å; K352-L463 PolarHBondContact N-O 2.71Å; K352-L463 VanDerWaalsContact N-O 3.17Å; T459-L463 PolarHBondContact O-N 3.15Å; S460-L463 WeakPolarHBondContact O-CG 3.46Å; L463-W551 HydrophobicContact CD2-CD2 4.15Å; L463-W551 HydrophobicContact CD2-CE3 3.47Å; L463-W551 VanDerWaalsContact CD2-CE3 3.47Å; L463-W551 HydrophobicContact CD2-CZ3 3.85Å
464	P	96.9	Very high	93.9	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.013	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	144.7	-169.4	30.7	-39	0	0	0	111.9	R351 T353 V355 L457 F462 V466 W551	R351-P464 WeakPolarHBondContact CD-O 3.23Å; R351-P464 PolarHBondContact NH1-O 2.9Å; T353-P464 VanDerWaalsContact OG1-CA 3.25Å; T353-P464 WeakPolarHBondContact OG1-CA 3.39Å; V355-P464 HydrophobicContact CG2-CB 3.67Å; L457-P464 WeakPolarHBondContact O-CD 3.42Å; L457-P464 VanDerWaalsContact O-CG 3.23Å; L457-P464 WeakPolarHBondContact O-CG 3.49Å; F462-P464 VanDerWaalsContact C-N 3.32Å; F462-P464 VanDerWaalsContact O-N 3.13Å; P464-V466 HydrophobicContact CB-CG2 4.09Å; P464-V466 HydrophobicContact CG-CG2 4.42Å; P464-W551 HydrophobicContact CG-CH2 4.07Å; P464-W551 HydrophobicContact CG-CZ2 4.17Å
465	Y	97.4	Very high	93.8	Very high	17 Å²	17	39.3 Å²	39.3	7%	0.067	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	112.7	157.2	-162.5	-109.1	0	0	0	108.2	R351 T353 L354 V355 V467 D518 L519 A536 L537 V540	R351-Y465 HydrophobicContact CG-CD2 4.32Å; T353-Y465 PolarHBondContact O-N 3.16Å; L354-Y465 HydrophobicContact CD1-CD1 4.17Å; V355-Y465 PolarHBondContact N-O 3Å; Y465-V467 HydrophobicContact CD1-CG2 3.81Å; Y465-V467 HydrophobicContact CE1-CG2 3.88Å; Y465-D518 WeakPolarHBondContact CA-OD2 3.42Å; Y465-D518 HydrophobicContact CD2-CB 3.69Å; Y465-D518 HydrophobicContact CE1-CB 4.46Å; Y465-D518 HydrophobicContact CE2-CB 3.32Å; Y465-D518 HydrophobicContact CG-CB 4.38Å; Y465-L519 HydrophobicContact CE1-CB 4.22Å; Y465-L519 HydrophobicContact CE1-CD2 4.23Å; Y465-A536 HydrophobicContact CE1-CB 3.91Å; Y465-L537 HydrophobicContact CD1-CD2 3.69Å; Y465-L537 HydrophobicContact CD1-CG 4.19Å; Y465-L537 HydrophobicContact CG-CD2 3.8Å; Y465-V540 HydrophobicContact CD2-CG1 4.45Å; Y465-V540 HydrophobicContact CD2-CG2 4.46Å; Y465-V540 HydrophobicContact CE2-CG1 3.87Å
466	V	97.5	Very high	94	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.018	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	107.9	-170.8	-173.4	0	0	0	0	109.8	V355 I357 L454 P464 F517 D518 L519	V355-V466 HydrophobicContact CB-CG2 4.41Å; I357-V466 HydrophobicContact CG1-CG1 3.95Å; L454-V466 HydrophobicContact CD1-CG1 4.33Å; L454-V466 HydrophobicContact CD2-CB 4.45Å; L454-V466 HydrophobicContact CD2-CG1 3.67Å; L454-V466 HydrophobicContact CD2-CG2 3.83Å; P464-V466 HydrophobicContact CB-CG2 4.09Å; P464-V466 HydrophobicContact CG-CG2 4.42Å; V466-F517 HydrophobicContact CG1-CD1 3.7Å; V466-F517 HydrophobicContact CG1-CE1 4.39Å; V466-D518 PolarHBondContact N-OD2 2.71Å; V466-D518 PolarHBondContact O-N 3.43Å; V466-L519 PolarHBondContact O-N 3.15Å
467	V	98	Very high	93.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	118.9	177.1	-178.4	0	0	0	0	109.5	L354 V355 L356 I357 Y465 L469 L519 I521 V533	L354-V467 HydrophobicContact CD1-CG2 3.68Å; V355-V467 PolarHBondContact O-N 3.37Å; L356-V467 HydrophobicContact CD2-CB 4.13Å; I357-V467 PolarHBondContact N-O 3.03Å; Y465-V467 HydrophobicContact CD1-CG2 3.81Å; Y465-V467 HydrophobicContact CE1-CG2 3.88Å; V467-L469 HydrophobicContact CG1-CD2 4.14Å; V467-L519 CarbonylContact C-O 3.53Å; V467-L519 WeakPolarHBondContact CA-O 3.49Å; V467-L519 HydrophobicContact CG2-CB 4.39Å; V467-L519 HydrophobicContact CG2-CD2 4.34Å; V467-I521 HydrophobicContact CG1-CD1 4.06Å; V467-I521 HydrophobicContact CG1-CG1 4.5Å; V467-V533 HydrophobicContact CG1-CG2 3.89Å; V467-V533 HydrophobicContact CG2-CG1 4.45Å; V467-V533 HydrophobicContact CG2-CG2 4.24Å
468	F	97.8	Very high	93.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	120.7	170.2	176.4	-120.1	0	0	0	110.6	I357 Q470 S506 I509 Q510 F517 L519 T520 I521	I357-F468 HydrophobicContact CB-CD2 4.4Å; I357-F468 HydrophobicContact CG2-CD2 4.11Å; I357-F468 WeakPolarHBondContact O-CA 3.49Å; F468-Q470 HydrophobicContact CD1-CB 4.07Å; F468-Q470 HydrophobicContact CE1-CB 3.6Å; F468-Q470 HydrophobicContact CE1-CG 4.03Å; F468-Q470 HydrophobicContact CZ-CB 4.28Å; F468-Q470 PolarHBondContact O-N 2.85Å; F468-S506 WeakPolarHBondContact CZ-O 3.29Å; F468-I509 HydrophobicContact CD2-CG2 3.96Å; F468-I509 HydrophobicContact CE2-CB 4.02Å; F468-I509 HydrophobicContact CE2-CG2 3.46Å; F468-I509 VanDerWaalsContact CE2-CG2 3.46Å; F468-I509 HydrophobicContact CZ-CB 4.49Å; F468-I509 HydrophobicContact CZ-CG2 4.27Å; F468-Q510 HydrophobicContact CE1-CB 3.88Å; F468-Q510 HydrophobicContact CE1-CG 4.43Å; F468-Q510 VanDerWaalsContact CE1-OE1 3.24Å; F468-Q510 HydrophobicContact CZ-CB 4.09Å; F468-F517 HydrophobicContact CB-CB 4.46Å; F468-F517 HydrophobicContact CB-CD1 4.22Å; F468-F517 HydrophobicContact CB-CD2 3.29Å; F468-F517 HydrophobicContact CB-CE1 4.31Å; F468-F517 HydrophobicContact CB-CE2 3.41Å; F468-F517 VanDerWaalsContact CB-CE2 3.41Å; F468-F517 HydrophobicContact CB-CG 3.75Å; F468-F517 HydrophobicContact CB-CZ 3.94Å; F468-F517 AromaticContact CD1-CD2 3.92Å; F468-F517 HydrophobicContact CD1-CD2 3.92Å; F468-F517 AromaticContact CD1-CE2 3.6Å; F468-F517 HydrophobicContact CD1-CE2 3.6Å; F468-F517 HydrophobicContact CD2-CD2 4.45Å; F468-F517 AromaticContact CD2-CE2 3.67Å; F468-F517 HydrophobicContact CD2-CE2 3.67Å; F468-F517 AromaticContact CD2-CZ 3.82Å; F468-F517 HydrophobicContact CD2-CZ 3.82Å; F468-F517 HydrophobicContact CE1-CE2 4.26Å; F468-F517 HydrophobicContact CE2-CE2 4.31Å; F468-F517 HydrophobicContact CE2-CZ 4.46Å; F468-F517 AromaticContact CG-CD2 3.67Å; F468-F517 HydrophobicContact CG-CD2 3.67Å; F468-F517 AromaticContact CG-CE2 3.27Å; F468-F517 HydrophobicContact CG-CE2 3.27Å; F468-F517 AromaticContact CG-CZ 3.87Å; F468-F517 HydrophobicContact CG-CZ 3.87Å; F468-L519 PolarHBondContact N-O 3.46Å; F468-T520 HydrophobicContact CD1-CG2 3.77Å; F468-T520 HydrophobicContact CE1-CG2 4.4Å; F468-T520 WeakPolarHBondContact O-CA 3.49Å; F468-I521 PolarHBondContact O-N 3.12Å
469	L	96.8	Very high	93.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	100.6	167.2	-60	-170.5	0	0	0	108.4	I357 G358 V362 R364 L367 V467 I521 T529	I357-L469 PolarHBondContact O-N 3Å; G358-L469 WeakPolarHBondContact CA-O 3.25Å; V362-L469 HydrophobicContact CG1-CB 3.88Å; V362-L469 HydrophobicContact CG2-CB 4.48Å; R364-L469 HydrophobicContact CB-CD1 4.45Å; R364-L469 HydrophobicContact CG-CD1 3.98Å; L367-L469 HydrophobicContact CB-CD1 4.41Å; L367-L469 HydrophobicContact CD2-CD1 3.81Å; L367-L469 HydrophobicContact CD2-CD2 3.94Å; L367-L469 HydrophobicContact CD2-CG 4.36Å; V467-L469 HydrophobicContact CG1-CD2 4.14Å; L469-I521 CarbonylContact C-O 3.6Å; L469-I521 WeakPolarHBondContact CA-O 3.28Å; L469-I521 HydrophobicContact CD2-CB 4.35Å; L469-T529 HydrophobicContact CD2-CG2 3.76Å
470	Q	95.8	Very high	92.9	Very high	70 Å²	70	40.7 Å²	40.7	33%	0.327	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	141.5	173	-175	172.8	-18.8	0	0	109.6	F468 T520 I521 V522 N523	F468-Q470 HydrophobicContact CD1-CB 4.07Å; F468-Q470 HydrophobicContact CE1-CB 3.6Å; F468-Q470 HydrophobicContact CE1-CG 4.03Å; F468-Q470 HydrophobicContact CZ-CB 4.28Å; F468-Q470 PolarHBondContact O-N 2.85Å; Q470-T520 HydrophobicContact CB-CG2 4.05Å; Q470-I521 PolarHBondContact N-O 3.31Å; Q470-V522 HydrophobicContact CB-CG2 4.3Å; Q470-V522 HydrophobicContact CG-CG2 4.38Å; Q470-N523 PolarHBondContact O-N 3.4Å
471	S	93.9	Very high	92.4	Very high	8 Å²	8	39 Å²	39	6%	0.056	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-64.7	134.2	169.1	-170.9	0	0	0	0	110.3	S506	S471-S506 PolarHBondContact N-OG 2.81Å
472	P	91.4	Very high	91.9	Very high	4 Å²	4	40 Å²	40	3%	0.026	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-54.3	161.4	155.7	-19.4	30.9	0	0	0	111.1	V476 M480 V522 E524	P472-V476 HydrophobicContact CB-CB 3.94Å; P472-V476 HydrophobicContact CB-CG1 3.79Å; P472-M480 HydrophobicContact CG-SD 4.05Å; P472-V522 HydrophobicContact CB-CG1 4.07Å; P472-V522 HydrophobicContact CG-CG1 3.96Å; P472-E524 HydrophobicContact CB-CG 4.3Å; P472-E524 HydrophobicContact CG-CG 4.03Å
473	D	91.1	Very high	91.4	Very high	133 Å²	133	43 Å²	43	71%	0.711	23%	0.228	S	C	*	.	P	Polyproline II helix	trans	-56.1	152.1	172.5	-71.3	-35	0	0	0	111.6	E475 V476 L477	D473-E475 VanDerWaalsContact C-N 3.33Å; D473-E475 PolarHBondContact O-N 2.89Å; D473-V476 HydrophobicContact CB-CG2 4.42Å; D473-V476 WeakPolarHBondContact O-CA 3.24Å; D473-V476 WeakPolarHBondContact O-CB 3.49Å; D473-V476 PolarHBondContact O-N 2.78Å; D473-L477 PolarHBondContact O-N 2.92Å
474	F	90.1	Very high	90.6	Very high	43 Å²	43	42.4 Å²	42.4	19%	0.189	23%	0.227	C	C	.	.	H	α-helix	trans	-49.6	-48.1	-172	172.5	-99.3	0	0	0	113.6	V476 L477 K478 D496 L499 Q500	F474-V476 PolarHBondContact O-N 3.43Å; F474-L477 PolarHBondContact O-N 2.83Å; F474-K478 HydrophobicContact CE1-CD 3.92Å; F474-K478 HydrophobicContact CZ-CD 3.96Å; F474-K478 WeakPolarHBondContact O-CB 3.37Å; F474-K478 PolarHBondContact O-N 2.9Å; F474-D496 HydrophobicContact CE2-CB 4.38Å; F474-D496 WeakPolarHBondContact CE2-O 3.01Å; F474-D496 HydrophobicContact CZ-CB 3.97Å; F474-L499 HydrophobicContact CD2-CB 4.19Å; F474-L499 HydrophobicContact CE2-CB 3.87Å; F474-Q500 HydrophobicContact CD2-CB 4.24Å; F474-Q500 HydrophobicContact CE2-CB 4.16Å
475	E	90.9	Very high	89.9	Confident	125 Å²	125	44.9 Å²	44.9	58%	0.584	24%	0.242	S	C	*	.	H	α-helix	trans	-66.9	-35.9	179.7	-63.8	-58.6	152.3	0	0	112.8	D473 K478 A479	D473-E475 VanDerWaalsContact C-N 3.33Å; D473-E475 PolarHBondContact O-N 2.89Å; E475-K478 PolarHBondContact O-N 3.28Å; E475-A479 WeakPolarHBondContact O-CB 3.46Å; E475-A479 PolarHBondContact O-N 2.97Å
476	V	88.6	Confident	89	Confident	56 Å²	56	50.3 Å²	50.3	34%	0.339	27%	0.268	S	S	.	.	H	α-helix	trans	-68.2	-47.8	175.8	-178.7	0	0	0	0	109.9	P472 D473 F474 K478 A479 M480	P472-V476 HydrophobicContact CB-CB 3.94Å; P472-V476 HydrophobicContact CB-CG1 3.79Å; D473-V476 HydrophobicContact CB-CG2 4.42Å; D473-V476 WeakPolarHBondContact O-CA 3.24Å; D473-V476 WeakPolarHBondContact O-CB 3.49Å; D473-V476 PolarHBondContact O-N 2.78Å; F474-V476 PolarHBondContact O-N 3.43Å; V476-K478 VanDerWaalsContact C-N 3.27Å; V476-K478 PolarHBondContact O-N 3.19Å; V476-A479 PolarHBondContact O-N 2.81Å; V476-M480 HydrophobicContact CG1-CG 4.48Å; V476-M480 HydrophobicContact CG1-SD 4.09Å; V476-M480 WeakPolarHBondContact O-CB 3.35Å; V476-M480 VanDerWaalsContact O-CG 3.24Å; V476-M480 WeakPolarHBondContact O-CG 3.31Å; V476-M480 PolarHBondContact O-N 3.04Å
477	L	87.1	Confident	88	Confident	20 Å²	20	53.6 Å²	53.6	11%	0.105	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-37.6	176.9	-174.1	73.1	0	0	0	111.6	D473 F474 N481 L499 T502	D473-L477 PolarHBondContact O-N 2.92Å; F474-L477 PolarHBondContact O-N 2.83Å; L477-N481 WeakPolarHBondContact O-CB 3.34Å; L477-N481 PolarHBondContact O-N 2.8Å; L477-L499 HydrophobicContact CD2-CB 4.29Å; L477-L499 HydrophobicContact CD2-CD2 3.86Å; L477-L499 HydrophobicContact CG-CD2 3.97Å; L477-T502 HydrophobicContact CD2-CG2 3.98Å
478	K	88.3	Confident	86.7	Confident	69 Å²	69	56.6 Å²	56.6	30%	0.3	33%	0.326	S	S	.	.	H	α-helix	trans	-67.9	-46.7	176.6	-176	171.1	175.7	176.2	0	112.4	F474 E475 V476 M480 N481 H482 D496 L499	F474-K478 HydrophobicContact CE1-CD 3.92Å; F474-K478 HydrophobicContact CZ-CD 3.96Å; F474-K478 WeakPolarHBondContact O-CB 3.37Å; F474-K478 PolarHBondContact O-N 2.9Å; E475-K478 PolarHBondContact O-N 3.28Å; V476-K478 VanDerWaalsContact C-N 3.27Å; V476-K478 PolarHBondContact O-N 3.19Å; K478-M480 PolarHBondContact O-N 2.99Å; K478-N481 PolarHBondContact O-N 2.87Å; K478-H482 PolarHBondContact O-N 3.26Å; K478-D496 WeakPolarHBondContact CE-OD1 3.48Å; K478-D496 VanDerWaalsContact NZ-CG 3.32Å; K478-D496 IonicContact NZ-OD1 2.99Å; K478-D496 PolarHBondContact NZ-OD1 3.39Å; K478-D496 IonicContact NZ-OD2 2.84Å; K478-D496 PolarHBondContact NZ-OD2 3.27Å; K478-L499 HydrophobicContact CB-CD1 3.87Å; K478-L499 HydrophobicContact CG-CD1 3.97Å
479	A	86.9	Confident	85.4	Confident	57 Å²	57	60.7 Å²	60.7	47%	0.471	35%	0.351	S	S	.	.	H	α-helix	trans	-59.7	-45.2	172.7	0	0	0	0	0	111.6	E475 V476 N481 H482 S483	E475-A479 WeakPolarHBondContact O-CB 3.46Å; E475-A479 PolarHBondContact O-N 2.97Å; V476-A479 PolarHBondContact O-N 2.81Å; A479-N481 VanDerWaalsContact C-N 3.31Å; A479-N481 PolarHBondContact O-N 2.86Å; A479-H482 PolarHBondContact O-N 2.89Å; A479-S483 PolarHBondContact O-N 3.21Å; A479-S483 PolarHBondContact O-OG 2.85Å
480	M	84.2	Confident	84.1	Confident	62 Å²	62	62.8 Å²	62.8	31%	0.305	36%	0.363	S	S	.	.	H	α-helix	trans	-60.6	-36.5	174.5	-73.1	176.8	64.1	0	0	113	P472 V476 K478 A484 N523 E524	P472-M480 HydrophobicContact CG-SD 4.05Å; V476-M480 HydrophobicContact CG1-CG 4.48Å; V476-M480 HydrophobicContact CG1-SD 4.09Å; V476-M480 WeakPolarHBondContact O-CB 3.35Å; V476-M480 VanDerWaalsContact O-CG 3.24Å; V476-M480 WeakPolarHBondContact O-CG 3.31Å; V476-M480 PolarHBondContact O-N 3.04Å; K478-M480 PolarHBondContact O-N 2.99Å; M480-A484 WeakPolarHBondContact O-CB 3.17Å; M480-A484 PolarHBondContact O-N 2.95Å; M480-N523 WeakPolarHBondContact CE-O 3.11Å; M480-E524 WeakPolarHBondContact CE-O 3.44Å; M480-E524 HydrophobicContact SD-CB 4.5Å
481	N	83.3	Confident	82.5	Confident	22 Å²	22	66.6 Å²	66.6	12%	0.118	39%	0.392	C	S	.	.	H	α-helix	trans	-66.7	-46.3	175.5	-163.3	-98.7	0	0	0	111.1	L477 K478 A479 A484 V485 L494 L499	L477-N481 WeakPolarHBondContact O-CB 3.34Å; L477-N481 PolarHBondContact O-N 2.8Å; K478-N481 PolarHBondContact O-N 2.87Å; A479-N481 VanDerWaalsContact C-N 3.31Å; A479-N481 PolarHBondContact O-N 2.86Å; N481-A484 PolarHBondContact O-N 3.01Å; N481-V485 WeakPolarHBondContact O-CG2 3.11Å; N481-V485 PolarHBondContact O-N 2.9Å; N481-L494 WeakPolarHBondContact ND2-CG 3.44Å; N481-L494 PolarHBondContact OD1-N 3.44Å; N481-L499 HydrophobicContact CB-CD2 4.24Å
482	H	83.8	Confident	81.4	Confident	118 Å²	118	71.4 Å²	71.4	55%	0.546	41%	0.412	S	S	.	.	H	α-helix	trans	-56.9	-54.5	177.5	-164	-83.1	0	0	0	111.2	K478 A479 A484 V485 E486	K478-H482 PolarHBondContact O-N 3.26Å; A479-H482 PolarHBondContact O-N 2.89Å; H482-A484 VanDerWaalsContact C-N 3.28Å; H482-A484 PolarHBondContact O-N 2.83Å; H482-V485 WeakPolarHBondContact O-CB 3.36Å; H482-V485 PolarHBondContact O-N 3.38Å; H482-E486 IonicContact CE1-OE1 3.86Å; H482-E486 PolarHBondContact CE1-OE1 2.66Å; H482-E486 VanDerWaalsContact CE1-OE1 3.28Å; H482-E486 IonicContact CE1-OE2 2.67Å; H482-E486 IonicContact CG-OE2 2.74Å; H482-E486 IonicContact ND1-OE1 3.43Å; H482-E486 PolarHBondContact ND1-OE1 2.85Å; H482-E486 IonicContact ND1-OE2 3.91Å; H482-E486 PolarHBondContact ND1-OE2 3.46Å; H482-E486 WeakPolarHBondContact O-CG 3.34Å; H482-E486 PolarHBondContact O-N 3.5Å
483	S	83.4	Confident	80.7	Confident	68 Å²	68	73.9 Å²	73.9	48%	0.476	43%	0.433	S	S	.	.	H	α-helix	trans	-65.8	-27.4	179.3	-59.7	0	0	0	0	113.7	A479 E486 A487	A479-S483 PolarHBondContact O-N 3.21Å; A479-S483 PolarHBondContact O-OG 2.85Å; S483-E486 WeakPolarHBondContact CA-OE2 3.34Å; S483-A487 WeakPolarHBondContact O-CB 3.48Å; S483-A487 PolarHBondContact O-N 3.21Å
484	A	80.5	Confident	80.2	Confident	14 Å²	14	70.1 Å²	70.1	12%	0.116	41%	0.412	C	S	.	.	H	α-helix	trans	-73.1	-26.2	172.8	0	0	0	0	0	113.2	M480 N481 H482 V489 V490	M480-A484 WeakPolarHBondContact O-CB 3.17Å; M480-A484 PolarHBondContact O-N 2.95Å; N481-A484 PolarHBondContact O-N 3.01Å; H482-A484 VanDerWaalsContact C-N 3.28Å; H482-A484 PolarHBondContact O-N 2.83Å; A484-V489 WeakPolarHBondContact O-CA 3.31Å; A484-V489 WeakPolarHBondContact O-CB 3.35Å; A484-V489 PolarHBondContact O-N 2.85Å; A484-V490 HydrophobicContact CB-CB 4.46Å; A484-V490 HydrophobicContact CB-CG2 3.9Å; A484-V490 PolarHBondContact O-N 3.43Å
485	V	81.5	Confident	80	Confident	53 Å²	53	71.5 Å²	71.5	32%	0.321	42%	0.424	S	S	.	.	H	α-helix	trans	-78.2	-45.3	171	173.4	0	0	0	0	110.5	N481 H482 A487 G488 V490 A493	N481-V485 WeakPolarHBondContact O-CG2 3.11Å; N481-V485 PolarHBondContact O-N 2.9Å; H482-V485 WeakPolarHBondContact O-CB 3.36Å; H482-V485 PolarHBondContact O-N 3.38Å; V485-A487 VanDerWaalsContact C-N 3.31Å; V485-A487 PolarHBondContact O-N 2.91Å; V485-G488 PolarHBondContact O-N 3.06Å; V485-V490 HydrophobicContact CG2-CB 4.33Å; V485-A493 HydrophobicContact CG2-CB 4.1Å
486	E	77.7	Confident	80	Confident	131 Å²	131	69.2 Å²	69.2	61%	0.612	42%	0.416	S	S	*	.	H	α-helix	trans	-58.5	-41	175.8	-69.1	172.9	120.3	0	0	112.3	H482 S483 G488	H482-E486 IonicContact CE1-OE1 3.86Å; H482-E486 PolarHBondContact CE1-OE1 2.66Å; H482-E486 VanDerWaalsContact CE1-OE1 3.28Å; H482-E486 IonicContact CE1-OE2 2.67Å; H482-E486 IonicContact CG-OE2 2.74Å; H482-E486 IonicContact ND1-OE1 3.43Å; H482-E486 PolarHBondContact ND1-OE1 2.85Å; H482-E486 IonicContact ND1-OE2 3.91Å; H482-E486 PolarHBondContact ND1-OE2 3.46Å; H482-E486 WeakPolarHBondContact O-CG 3.34Å; H482-E486 PolarHBondContact O-N 3.5Å; S483-E486 WeakPolarHBondContact CA-OE2 3.34Å; E486-G488 PolarHBondContact O-N 2.86Å
487	A	76.9	Confident	80	Confident	73 Å²	73	72.4 Å²	72.4	60%	0.603	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	2.6	175.1	0	0	0	0	0	114.2	S483 V485 V489	S483-A487 WeakPolarHBondContact O-CB 3.48Å; S483-A487 PolarHBondContact O-N 3.21Å; V485-A487 VanDerWaalsContact C-N 3.31Å; V485-A487 PolarHBondContact O-N 2.91Å; A487-V489 HydrophobicContact CB-CG2 3.96Å; A487-V489 PolarHBondContact O-N 2.75Å
488	G	71.9	Confident	80.1	Confident	62 Å²	62	74.7 Å²	74.7	64%	0.639	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	12.8	-179.5	0	0	0	0	0	115.1	V485 E486	V485-G488 PolarHBondContact O-N 3.06Å; E486-G488 PolarHBondContact O-N 2.86Å
489	V	70.1	Confident	80.2	Confident	87 Å²	87	71.5 Å²	71.5	53%	0.527	42%	0.424	S	S	.	.	S	Bend	trans	-79.1	-25.3	-177.8	-178.5	0	0	0	0	111.5	A484 A487	A484-V489 WeakPolarHBondContact O-CA 3.31Å; A484-V489 WeakPolarHBondContact O-CB 3.35Å; A484-V489 PolarHBondContact O-N 2.85Å; A487-V489 HydrophobicContact CB-CG2 3.96Å; A487-V489 PolarHBondContact O-N 2.75Å
490	V	68.2	Low	80.5	Confident	43 Å²	43	72.4 Å²	72.4	26%	0.261	42%	0.418	S	S	.	.			trans	-128.8	127.8	177.4	-178.8	0	0	0	0	109.5	A484 V485 K492	A484-V490 HydrophobicContact CB-CB 4.46Å; A484-V490 HydrophobicContact CB-CG2 3.9Å; A484-V490 PolarHBondContact O-N 3.43Å; V485-V490 HydrophobicContact CG2-CB 4.33Å; V490-K492 VanDerWaalsContact CG1-O 3.3Å; V490-K492 WeakPolarHBondContact CG1-O 3.35Å
491	T	62.1	Low	80.9	Confident	151 Å²	151	76.7 Å²	76.7	93%	0.926	43%	0.431	S	S	*	.	S	Bend	trans	-86.3	-7.5	-172.7	52.5	0	0	0	0	115.1
492	K	71.9	Confident	81.3	Confident	108 Å²	108	76 Å²	76	47%	0.47	43%	0.428	S	S	.	.	S	Bend	trans	-138.8	119	177.5	-174.1	-122.6	176.8	-171.3	0	108.8	V490 L494 E498	V490-K492 VanDerWaalsContact CG1-O 3.3Å; V490-K492 WeakPolarHBondContact CG1-O 3.35Å; K492-L494 PolarHBondContact O-N 3.1Å; K492-E498 IonicContact NZ-OE1 2.74Å; K492-E498 PolarHBondContact NZ-OE1 3.08Å; K492-E498 IonicContact NZ-OE2 2.68Å; K492-E498 PolarHBondContact NZ-OE2 2.67Å
493	A	75.6	Confident	81.8	Confident	57 Å²	57	71.3 Å²	71.3	47%	0.471	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-57.6	138	165.9	0	0	0	0	0	109.6	V485	V485-A493 HydrophobicContact CG2-CB 4.1Å
494	L	80.9	Confident	82.4	Confident	54 Å²	54	71.7 Å²	71.7	28%	0.283	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-80.2	146.7	170.8	-64.1	179.4	0	0	0	109	N481 K492 E498 L499	N481-L494 WeakPolarHBondContact ND2-CG 3.44Å; N481-L494 PolarHBondContact OD1-N 3.44Å; K492-L494 PolarHBondContact O-N 3.1Å; L494-E498 VanDerWaalsContact CA-OE2 3.28Å; L494-E498 WeakPolarHBondContact CA-OE2 3.5Å; L494-E498 HydrophobicContact CB-CB 4.15Å; L494-E498 HydrophobicContact CD2-CB 4.42Å; L494-E498 WeakPolarHBondContact CD2-OE2 3.49Å; L494-L499 HydrophobicContact CB-CD2 3.82Å; L494-L499 HydrophobicContact CB-CG 3.98Å; L494-L499 HydrophobicContact CD1-CD2 3.81Å; L494-L499 HydrophobicContact CG-CD2 4.44Å
495	T	87.2	Confident	83	Confident	71 Å²	71	74.8 Å²	74.8	44%	0.436	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-75.6	155.5	172.1	64.4	0	0	0	0	110.5	E497 E498 L499	T495-E497 PolarHBondContact O-N 3.13Å; T495-E497 VanDerWaalsContact O-N 3.13Å; T495-E498 PolarHBondContact N-OE2 2.85Å; T495-E498 WeakPolarHBondContact O-CA 3.45Å; T495-E498 WeakPolarHBondContact O-CB 3.49Å; T495-E498 PolarHBondContact O-N 3.45Å; T495-E498 WeakPolarHBondContact OG1-CG 3.37Å; T495-E498 PolarHBondContact OG1-N 3.16Å; T495-L499 WeakPolarHBondContact O-CG 3.36Å; T495-L499 PolarHBondContact O-N 3.34Å
496	D	89.4	Confident	83.7	Confident	78 Å²	78	72.5 Å²	72.5	42%	0.417	40%	0.403	S	S	.	.	H	α-helix	trans	-51.6	-34.6	171.6	-74.8	15.5	0	0	0	111.9	F474 K478 L499 Q500	F474-D496 HydrophobicContact CE2-CB 4.38Å; F474-D496 WeakPolarHBondContact CE2-O 3.01Å; F474-D496 HydrophobicContact CZ-CB 3.97Å; K478-D496 WeakPolarHBondContact CE-OD1 3.48Å; K478-D496 VanDerWaalsContact NZ-CG 3.32Å; K478-D496 IonicContact NZ-OD1 2.99Å; K478-D496 PolarHBondContact NZ-OD1 3.39Å; K478-D496 IonicContact NZ-OD2 2.84Å; K478-D496 PolarHBondContact NZ-OD2 3.27Å; D496-L499 PolarHBondContact O-N 3.15Å; D496-Q500 WeakPolarHBondContact O-CB 3.37Å; D496-Q500 PolarHBondContact O-N 3.4Å
497	E	90.4	Very high	84.5	Confident	123 Å²	123	69.2 Å²	69.2	58%	0.575	40%	0.398	S	S	*	.	H	α-helix	trans	-65.9	-40.8	172.1	-67.3	-175.7	-138.5	0	0	114	T495 L499 R501	T495-E497 PolarHBondContact O-N 3.13Å; T495-E497 VanDerWaalsContact O-N 3.13Å; E497-L499 VanDerWaalsContact C-N 3.31Å; E497-R501 WeakPolarHBondContact O-CB 3.43Å; E497-R501 WeakPolarHBondContact O-CD 3.46Å; E497-R501 WeakPolarHBondContact O-CG 3.21Å; E497-R501 PolarHBondContact O-N 3.29Å; E497-R501 VanDerWaalsContact O-N 3.12Å; E497-R501 PolarHBondContact O-NE 3.19Å; E497-R501 IonicContact OE2-CZ 3.26Å; E497-R501 IonicContact OE2-NH2 3.78Å; E497-R501 PolarHBondContact OE2-NH2 3.2Å
498	E	88.7	Confident	85.3	Confident	67 Å²	67	71.5 Å²	71.5	31%	0.313	39%	0.394	S	S	.	.	H	α-helix	trans	-66.7	-36.2	176.2	-73.3	171.8	143.8	0	0	110.9	K492 L494 T495 T502	K492-E498 IonicContact NZ-OE1 2.74Å; K492-E498 PolarHBondContact NZ-OE1 3.08Å; K492-E498 IonicContact NZ-OE2 2.68Å; K492-E498 PolarHBondContact NZ-OE2 2.67Å; L494-E498 VanDerWaalsContact CA-OE2 3.28Å; L494-E498 WeakPolarHBondContact CA-OE2 3.5Å; L494-E498 HydrophobicContact CB-CB 4.15Å; L494-E498 HydrophobicContact CD2-CB 4.42Å; L494-E498 WeakPolarHBondContact CD2-OE2 3.49Å; T495-E498 PolarHBondContact N-OE2 2.85Å; T495-E498 WeakPolarHBondContact O-CA 3.45Å; T495-E498 WeakPolarHBondContact O-CB 3.49Å; T495-E498 PolarHBondContact O-N 3.45Å; T495-E498 WeakPolarHBondContact OG1-CG 3.37Å; T495-E498 PolarHBondContact OG1-N 3.16Å; E498-T502 PolarHBondContact O-N 2.82Å; E498-T502 PolarHBondContact O-OG1 2.73Å
499	L	90.1	Very high	86.3	Confident	3 Å²	3	69.1 Å²	69.1	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-70.5	-47.8	176.9	-63.6	174.8	0	0	0	112	F474 L477 K478 N481 L494 T495 D496 E497 R501 T502 C503	F474-L499 HydrophobicContact CD2-CB 4.19Å; F474-L499 HydrophobicContact CE2-CB 3.87Å; L477-L499 HydrophobicContact CD2-CB 4.29Å; L477-L499 HydrophobicContact CD2-CD2 3.86Å; L477-L499 HydrophobicContact CG-CD2 3.97Å; K478-L499 HydrophobicContact CB-CD1 3.87Å; K478-L499 HydrophobicContact CG-CD1 3.97Å; N481-L499 HydrophobicContact CB-CD2 4.24Å; L494-L499 HydrophobicContact CB-CD2 3.82Å; L494-L499 HydrophobicContact CB-CG 3.98Å; L494-L499 HydrophobicContact CD1-CD2 3.81Å; L494-L499 HydrophobicContact CG-CD2 4.44Å; T495-L499 WeakPolarHBondContact O-CG 3.36Å; T495-L499 PolarHBondContact O-N 3.34Å; D496-L499 PolarHBondContact O-N 3.15Å; E497-L499 VanDerWaalsContact C-N 3.31Å; L499-R501 VanDerWaalsContact C-N 3.33Å; L499-R501 PolarHBondContact O-N 2.92Å; L499-T502 WeakPolarHBondContact O-CA 3.22Å; L499-T502 VanDerWaalsContact O-CB 3.25Å; L499-T502 WeakPolarHBondContact O-CB 3.49Å; L499-T502 PolarHBondContact O-N 2.83Å; L499-C503 PolarHBondContact O-N 2.97Å; L499-C503 VanDerWaalsContact O-N 3.16Å; L499-C503 PolarHBondContact O-SG 3.03Å
500	Q	92.9	Very high	87.3	Confident	76 Å²	76	68.4 Å²	68.4	36%	0.355	36%	0.358	S	S	.	.	H	α-helix	trans	-61.1	-42	177.4	-174.4	61.1	49.4	0	0	111.4	F474 D496 T502 C503 D504	F474-Q500 HydrophobicContact CD2-CB 4.24Å; F474-Q500 HydrophobicContact CE2-CB 4.16Å; D496-Q500 WeakPolarHBondContact O-CB 3.37Å; D496-Q500 PolarHBondContact O-N 3.4Å; Q500-T502 PolarHBondContact O-N 2.92Å; Q500-C503 WeakPolarHBondContact O-CB 3.48Å; Q500-C503 PolarHBondContact O-N 2.84Å; Q500-D504 PolarHBondContact NE2-OD1 2.99Å; Q500-D504 VanDerWaalsContact O-CG 3.23Å; Q500-D504 PolarHBondContact O-N 3.21Å
501	R	92.8	Very high	88.3	Confident	151 Å²	151	70.7 Å²	70.7	57%	0.57	38%	0.382	S	S	*	.	H	α-helix	trans	-59.8	-33	174.3	-70.2	169.4	-153.4	-162.4	9.2	112.6	E497 L499 E505	E497-R501 WeakPolarHBondContact O-CB 3.43Å; E497-R501 WeakPolarHBondContact O-CD 3.46Å; E497-R501 WeakPolarHBondContact O-CG 3.21Å; E497-R501 PolarHBondContact O-N 3.29Å; E497-R501 VanDerWaalsContact O-N 3.12Å; E497-R501 PolarHBondContact O-NE 3.19Å; E497-R501 IonicContact OE2-CZ 3.26Å; E497-R501 IonicContact OE2-NH2 3.78Å; E497-R501 PolarHBondContact OE2-NH2 3.2Å; L499-R501 VanDerWaalsContact C-N 3.33Å; L499-R501 PolarHBondContact O-N 2.92Å; R501-E505 WeakPolarHBondContact O-CB 3.22Å; R501-E505 PolarHBondContact O-N 3.07Å
502	T	92.4	Very high	89.4	Confident	8 Å²	8	66 Å²	66	5%	0.049	36%	0.357	C	S	.	.	H	α-helix	trans	-65.7	-42	174.4	-55.5	0	0	0	0	111	A359 Q360 V362 L477 E498 L499 Q500 S506	A359-T502 HydrophobicContact CB-CG2 3.86Å; A359-T502 WeakPolarHBondContact CB-O 3.47Å; Q360-T502 WeakPolarHBondContact O-CG2 3.28Å; Q360-T502 PolarHBondContact O-OG1 3.12Å; Q360-T502 VanDerWaalsContact O-OG1 3.14Å; V362-T502 HydrophobicContact CB-CG2 4.45Å; L477-T502 HydrophobicContact CD2-CG2 3.98Å; E498-T502 PolarHBondContact O-N 2.82Å; E498-T502 PolarHBondContact O-OG1 2.73Å; L499-T502 WeakPolarHBondContact O-CA 3.22Å; L499-T502 VanDerWaalsContact O-CB 3.25Å; L499-T502 WeakPolarHBondContact O-CB 3.49Å; L499-T502 PolarHBondContact O-N 2.83Å; Q500-T502 PolarHBondContact O-N 2.92Å; T502-S506 VanDerWaalsContact O-CB 3.26Å; T502-S506 WeakPolarHBondContact O-CB 3.34Å; T502-S506 PolarHBondContact O-N 3.46Å
503	C	94.1	Very high	90.2	Very high	20 Å²	20	62 Å²	62	14%	0.135	34%	0.341	C	S	.	.	H	α-helix	trans	-66.3	-48.1	175.6	-58.3	0	0	0	0	111.7	L499 Q500 E505 S506 A507	L499-C503 PolarHBondContact O-N 2.97Å; L499-C503 VanDerWaalsContact O-N 3.16Å; L499-C503 PolarHBondContact O-SG 3.03Å; Q500-C503 WeakPolarHBondContact O-CB 3.48Å; Q500-C503 PolarHBondContact O-N 2.84Å; C503-E505 PolarHBondContact O-N 3.11Å; C503-S506 WeakPolarHBondContact O-CB 3.42Å; C503-S506 PolarHBondContact O-N 3.42Å; C503-A507 PolarHBondContact O-N 3.21Å
504	D	94.3	Very high	90.9	Very high	76 Å²	76	60.4 Å²	60.4	41%	0.406	33%	0.329	S	S	.	.	H	α-helix	trans	-61.9	-44.1	179.6	-62.1	-15	0	0	0	111.9	Q500 A507 K508	Q500-D504 PolarHBondContact NE2-OD1 2.99Å; Q500-D504 VanDerWaalsContact O-CG 3.23Å; Q500-D504 PolarHBondContact O-N 3.21Å; D504-A507 PolarHBondContact O-N 3.5Å; D504-K508 WeakPolarHBondContact O-CB 3.33Å; D504-K508 VanDerWaalsContact O-CG 3.32Å; D504-K508 WeakPolarHBondContact O-CG 3.42Å; D504-K508 PolarHBondContact O-N 2.93Å
505	E	94.3	Very high	91.1	Very high	79 Å²	79	60.2 Å²	60.2	37%	0.369	33%	0.327	S	S	.	.	H	α-helix	trans	-64.2	-41.1	175.1	-175	-176.5	-157	0	0	110.8	A359 Q360 R501 C503 A507 K508 I509	A359-E505 WeakPolarHBondContact CA-OE2 3.44Å; A359-E505 HydrophobicContact CB-CB 3.94Å; A359-E505 HydrophobicContact CB-CG 4.04Å; A359-E505 WeakPolarHBondContact CB-OE2 3.48Å; Q360-E505 PolarHBondContact N-OE2 3.42Å; R501-E505 WeakPolarHBondContact O-CB 3.22Å; R501-E505 PolarHBondContact O-N 3.07Å; C503-E505 PolarHBondContact O-N 3.11Å; E505-A507 PolarHBondContact O-N 3.37Å; E505-K508 PolarHBondContact O-N 3.23Å; E505-I509 HydrophobicContact CG-CD1 3.78Å; E505-I509 HydrophobicContact CG-CG1 4.28Å; E505-I509 WeakPolarHBondContact O-CB 3.42Å; E505-I509 VanDerWaalsContact O-CG1 3.28Å; E505-I509 WeakPolarHBondContact O-CG1 3.42Å; E505-I509 PolarHBondContact O-N 2.63Å
506	S	95.4	Very high	91.2	Very high	4 Å²	4	57.9 Å²	57.9	3%	0.028	31%	0.31	C	S	.	.	H	α-helix	trans	-60.1	-46.9	176.7	-176.9	0	0	0	0	111.5	F468 S471 T502 C503 I509 Q510	F468-S506 WeakPolarHBondContact CZ-O 3.29Å; S471-S506 PolarHBondContact N-OG 2.81Å; T502-S506 VanDerWaalsContact O-CB 3.26Å; T502-S506 WeakPolarHBondContact O-CB 3.34Å; T502-S506 PolarHBondContact O-N 3.46Å; C503-S506 WeakPolarHBondContact O-CB 3.42Å; C503-S506 PolarHBondContact O-N 3.42Å; S506-I509 PolarHBondContact O-N 3.08Å; S506-Q510 PolarHBondContact O-N 2.62Å
507	A	94.5	Very high	91.4	Very high	62 Å²	62	55 Å²	55	51%	0.512	29%	0.294	S	S	.	.	H	α-helix	trans	-62.2	-42.9	176.4	0	0	0	0	0	111.9	C503 D504 E505 I509 Q510 A511	C503-A507 PolarHBondContact O-N 3.21Å; D504-A507 PolarHBondContact O-N 3.5Å; E505-A507 PolarHBondContact O-N 3.37Å; A507-I509 PolarHBondContact O-N 2.66Å; A507-Q510 PolarHBondContact O-N 2.87Å; A507-A511 WeakPolarHBondContact O-CB 3.45Å; A507-A511 PolarHBondContact O-N 2.85Å
508	K	93.3	Very high	91.6	Very high	121 Å²	121	51.5 Å²	51.5	53%	0.526	28%	0.279	S	S	.	.	H	α-helix	trans	-66.3	-35.5	177.8	-73	-179.3	175.2	-161.2	0	112.8	E303 D504 E505 A512	E303-K508 IonicContact OE1-NZ 2.9Å; E303-K508 PolarHBondContact OE1-NZ 2.78Å; E303-K508 IonicContact OE2-NZ 3.75Å; D504-K508 WeakPolarHBondContact O-CB 3.33Å; D504-K508 VanDerWaalsContact O-CG 3.32Å; D504-K508 WeakPolarHBondContact O-CG 3.42Å; D504-K508 PolarHBondContact O-N 2.93Å; E505-K508 PolarHBondContact O-N 3.23Å; K508-A512 VanDerWaalsContact O-CB 3.29Å; K508-A512 WeakPolarHBondContact O-CB 3.01Å; K508-A512 PolarHBondContact O-N 2.89Å; K508-A512 VanDerWaalsContact O-N 3.16Å
509	I	93.1	Very high	91.9	Very high	12 Å²	12	50.2 Å²	50.2	6%	0.062	27%	0.274	C	S	.	.	H	α-helix	trans	-68.4	-46.4	174	-70.3	171.6	0	0	0	111	I357 P451 F468 E505 S506 A507 A511 A512 F513 F517	I357-I509 HydrophobicContact CG2-CG2 3.83Å; P451-I509 HydrophobicContact CG-CD1 3.94Å; P451-I509 HydrophobicContact CG-CG1 3.94Å; P451-I509 HydrophobicContact CG-CG2 3.96Å; F468-I509 HydrophobicContact CD2-CG2 3.96Å; F468-I509 HydrophobicContact CE2-CB 4.02Å; F468-I509 HydrophobicContact CE2-CG2 3.46Å; F468-I509 VanDerWaalsContact CE2-CG2 3.46Å; F468-I509 HydrophobicContact CZ-CB 4.49Å; F468-I509 HydrophobicContact CZ-CG2 4.27Å; E505-I509 HydrophobicContact CG-CD1 3.78Å; E505-I509 HydrophobicContact CG-CG1 4.28Å; E505-I509 WeakPolarHBondContact O-CB 3.42Å; E505-I509 VanDerWaalsContact O-CG1 3.28Å; E505-I509 WeakPolarHBondContact O-CG1 3.42Å; E505-I509 PolarHBondContact O-N 2.63Å; S506-I509 PolarHBondContact O-N 3.08Å; A507-I509 PolarHBondContact O-N 2.66Å; I509-A511 PolarHBondContact O-N 2.79Å; I509-A512 PolarHBondContact O-N 3.46Å; I509-F513 PolarHBondContact O-N 3.4Å; I509-F517 HydrophobicContact CG2-CZ 3.93Å
510	Q	92.3	Very high	92.2	Very high	73 Å²	73	52.7 Å²	52.7	34%	0.341	29%	0.29	S	S	.	.	H	α-helix	trans	-58.7	-46.4	176.6	179.2	63.3	23.7	0	0	111.4	F468 S506 A507 A512 G514	F468-Q510 HydrophobicContact CE1-CB 3.88Å; F468-Q510 HydrophobicContact CE1-CG 4.43Å; F468-Q510 VanDerWaalsContact CE1-OE1 3.24Å; F468-Q510 HydrophobicContact CZ-CB 4.09Å; S506-Q510 PolarHBondContact O-N 2.62Å; A507-Q510 PolarHBondContact O-N 2.87Å; Q510-A512 VanDerWaalsContact C-N 3.33Å; Q510-A512 PolarHBondContact O-N 2.89Å; Q510-G514 VanDerWaalsContact O-CA 3.31Å; Q510-G514 WeakPolarHBondContact O-CA 3.24Å; Q510-G514 PolarHBondContact O-N 2.86Å
511	A	88	Confident	92.4	Very high	91 Å²	91	50 Å²	50	75%	0.752	28%	0.278	S	S	*	.	H	α-helix	trans	-68.5	-26.7	-178.9	0	0	0	0	0	114.2	A507 I509	A507-A511 WeakPolarHBondContact O-CB 3.45Å; A507-A511 PolarHBondContact O-N 2.85Å; I509-A511 PolarHBondContact O-N 2.79Å
512	A	86.7	Confident	92.5	Very high	51 Å²	51	45.7 Å²	45.7	42%	0.421	27%	0.268	S	S	.	.	H	α-helix	trans	-96.2	-30.4	-178.5	0	0	0	0	0	114	K508 I509 Q510 H515	K508-A512 VanDerWaalsContact O-CB 3.29Å; K508-A512 WeakPolarHBondContact O-CB 3.01Å; K508-A512 PolarHBondContact O-N 2.89Å; K508-A512 VanDerWaalsContact O-N 3.16Å; I509-A512 PolarHBondContact O-N 3.46Å; Q510-A512 VanDerWaalsContact C-N 3.33Å; Q510-A512 PolarHBondContact O-N 2.89Å; A512-H515 PolarHBondContact O-CE1 2.86Å; A512-H515 VanDerWaalsContact O-CE1 3.29Å
513	F	88.9	Confident	92.3	Very high	26 Å²	26	46 Å²	46	11%	0.114	27%	0.269	C	S	.	.	H	α-helix	trans	-125.7	0.8	-171.2	-60.8	-89.4	0	0	0	114.3	P451 Q452 L454 I509 H515 F516 F517	P451-F513 HydrophobicContact CB-CB 4.48Å; P451-F513 HydrophobicContact CB-CD1 3.81Å; P451-F513 HydrophobicContact CB-CD2 3.5Å; P451-F513 VanDerWaalsContact CB-CD2 3.5Å; P451-F513 HydrophobicContact CB-CE1 3.84Å; P451-F513 HydrophobicContact CB-CE2 3.54Å; P451-F513 HydrophobicContact CB-CG 3.66Å; P451-F513 HydrophobicContact CB-CZ 3.72Å; P451-F513 HydrophobicContact CG-CD2 4.34Å; P451-F513 HydrophobicContact CG-CE2 4.39Å; Q452-F513 HydrophobicContact CG-CZ 4.49Å; L454-F513 HydrophobicContact CD1-CB 4.46Å; L454-F513 HydrophobicContact CD1-CD1 4.37Å; I509-F513 PolarHBondContact O-N 3.4Å; F513-H515 PolarHBondContact O-N 3.19Å; F513-F516 HydrophobicContact CB-CD2 4.23Å; F513-F516 AromaticContact CD1-CD2 3.92Å; F513-F516 HydrophobicContact CD1-CD2 3.92Å; F513-F516 HydrophobicContact CD1-CE2 4.02Å; F513-F516 WeakPolarHBondContact O-CB 3.43Å; F513-F516 PolarHBondContact O-N 2.94Å; F513-F517 HydrophobicContact CB-CE1 3.77Å; F513-F517 HydrophobicContact CB-CZ 3.74Å; F513-F517 WeakPolarHBondContact O-CD1 3.34Å; F513-F517 VanDerWaalsContact O-CE1 3.32Å; F513-F517 WeakPolarHBondContact O-CE1 3.27Å
514	G	88.8	Confident	92	Very high	22 Å²	22	50.6 Å²	50.6	23%	0.227	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-51.7	-33.7	-176	0	0	0	0	0	114.9	Q510 F516 F517	Q510-G514 VanDerWaalsContact O-CA 3.31Å; Q510-G514 WeakPolarHBondContact O-CA 3.24Å; Q510-G514 PolarHBondContact O-N 2.86Å; G514-F516 PolarHBondContact O-N 3.32Å; G514-F517 PolarHBondContact O-N 2.91Å; G514-F517 VanDerWaalsContact O-N 3.14Å
515	H	86.1	Confident	91.8	Very high	51 Å²	51	49.8 Å²	49.8	24%	0.236	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-63.6	-21	177	58.6	-99.3	0	0	0	114.3	H235 L338 A512 F513	H235-H515 HydrophobicContact CB-CB 4.2Å; H235-H515 PolarHBondContact CE1-O 2.75Å; H235-H515 VanDerWaalsContact CE1-O 3.23Å; H235-H515 WeakPolarHBondContact ND1-CB 3.22Å; H235-H515 PolarHBondContact ND1-O 3.45Å; L338-H515 HydrophobicContact CD2-CB 4.3Å; A512-H515 PolarHBondContact O-CE1 2.86Å; A512-H515 VanDerWaalsContact O-CE1 3.29Å; F513-H515 PolarHBondContact O-N 3.19Å
516	F	89.6	Confident	91.5	Very high	21 Å²	21	47.6 Å²	47.6	9%	0.092	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-84.5	-14.8	175.8	-69.9	-59.2	0	0	0	114.2	L454 K455 R458 F513 G514	L454-F516 HydrophobicContact CB-CD2 4.32Å; L454-F516 HydrophobicContact CB-CG 4.37Å; L454-F516 HydrophobicContact CD1-CB 3.84Å; L454-F516 HydrophobicContact CD1-CD2 4.02Å; L454-F516 HydrophobicContact CD1-CG 4.17Å; K455-F516 HydrophobicContact CG-CZ 4.48Å; R458-F516 PolarHBondContact NH1-O 2.95Å; F513-F516 HydrophobicContact CB-CD2 4.23Å; F513-F516 AromaticContact CD1-CD2 3.92Å; F513-F516 HydrophobicContact CD1-CD2 3.92Å; F513-F516 HydrophobicContact CD1-CE2 4.02Å; F513-F516 WeakPolarHBondContact O-CB 3.43Å; F513-F516 PolarHBondContact O-N 2.94Å; G514-F516 PolarHBondContact O-N 3.32Å
517	F	93.1	Very high	91.4	Very high	17 Å²	17	50.3 Å²	50.3	8%	0.075	29%	0.29	C	S	.	.			trans	-81.1	133.6	-169	-54.6	-18.8	0	0	0	111.3	I357 L454 V466 F468 I509 F513 G514	I357-F517 HydrophobicContact CB-CE1 4.34Å; I357-F517 HydrophobicContact CG2-CE1 3.98Å; I357-F517 HydrophobicContact CG2-CZ 4.09Å; L454-F517 HydrophobicContact CD1-CE1 4.11Å; V466-F517 HydrophobicContact CG1-CD1 3.7Å; V466-F517 HydrophobicContact CG1-CE1 4.39Å; F468-F517 HydrophobicContact CB-CB 4.46Å; F468-F517 HydrophobicContact CB-CD1 4.22Å; F468-F517 HydrophobicContact CB-CD2 3.29Å; F468-F517 HydrophobicContact CB-CE1 4.31Å; F468-F517 HydrophobicContact CB-CE2 3.41Å; F468-F517 VanDerWaalsContact CB-CE2 3.41Å; F468-F517 HydrophobicContact CB-CG 3.75Å; F468-F517 HydrophobicContact CB-CZ 3.94Å; F468-F517 AromaticContact CD1-CD2 3.92Å; F468-F517 HydrophobicContact CD1-CD2 3.92Å; F468-F517 AromaticContact CD1-CE2 3.6Å; F468-F517 HydrophobicContact CD1-CE2 3.6Å; F468-F517 HydrophobicContact CD2-CD2 4.45Å; F468-F517 AromaticContact CD2-CE2 3.67Å; F468-F517 HydrophobicContact CD2-CE2 3.67Å; F468-F517 AromaticContact CD2-CZ 3.82Å; F468-F517 HydrophobicContact CD2-CZ 3.82Å; F468-F517 HydrophobicContact CE1-CE2 4.26Å; F468-F517 HydrophobicContact CE2-CE2 4.31Å; F468-F517 HydrophobicContact CE2-CZ 4.46Å; F468-F517 AromaticContact CG-CD2 3.67Å; F468-F517 HydrophobicContact CG-CD2 3.67Å; F468-F517 AromaticContact CG-CE2 3.27Å; F468-F517 HydrophobicContact CG-CE2 3.27Å; F468-F517 AromaticContact CG-CZ 3.87Å; F468-F517 HydrophobicContact CG-CZ 3.87Å; I509-F517 HydrophobicContact CG2-CZ 3.93Å; F513-F517 HydrophobicContact CB-CE1 3.77Å; F513-F517 HydrophobicContact CB-CZ 3.74Å; F513-F517 WeakPolarHBondContact O-CD1 3.34Å; F513-F517 VanDerWaalsContact O-CE1 3.32Å; F513-F517 WeakPolarHBondContact O-CE1 3.27Å; G514-F517 PolarHBondContact O-N 2.91Å; G514-F517 VanDerWaalsContact O-N 3.14Å
518	D	93.8	Very high	91.4	Very high	50 Å²	50	52.2 Å²	52.2	27%	0.267	29%	0.288	S	S	.	.	S	Bend	trans	-85.6	-21.4	169.8	-62	-87.3	0	0	0	111.4	R351 Y465 V466	R351-D518 IonicContact CZ-OD1 3.44Å; R351-D518 IonicContact NH1-OD1 2.67Å; R351-D518 PolarHBondContact NH1-OD1 2.91Å; R351-D518 IonicContact NH1-OD2 2.88Å; R351-D518 PolarHBondContact NH1-OD2 3.42Å; R351-D518 IonicContact NH2-OD1 3.56Å; Y465-D518 WeakPolarHBondContact CA-OD2 3.42Å; Y465-D518 HydrophobicContact CD2-CB 3.69Å; Y465-D518 HydrophobicContact CE1-CB 4.46Å; Y465-D518 HydrophobicContact CE2-CB 3.32Å; Y465-D518 HydrophobicContact CG-CB 4.38Å; V466-D518 PolarHBondContact N-OD2 2.71Å; V466-D518 PolarHBondContact O-N 3.43Å
519	L	95.5	Very high	91.5	Very high	40 Å²	40	46.6 Å²	46.6	21%	0.209	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	131	-177.1	178.3	61.2	0	0	0	112	Y465 V466 V467 F468 I521 T532 A536	Y465-L519 HydrophobicContact CE1-CB 4.22Å; Y465-L519 HydrophobicContact CE1-CD2 4.23Å; V466-L519 PolarHBondContact O-N 3.15Å; V467-L519 CarbonylContact C-O 3.53Å; V467-L519 WeakPolarHBondContact CA-O 3.49Å; V467-L519 HydrophobicContact CG2-CB 4.39Å; V467-L519 HydrophobicContact CG2-CD2 4.34Å; F468-L519 PolarHBondContact N-O 3.46Å; L519-I521 HydrophobicContact CD1-CG1 4.35Å; L519-I521 HydrophobicContact CD2-CD1 3.91Å; L519-I521 HydrophobicContact CD2-CG1 4.21Å; L519-I521 HydrophobicContact CG-CD1 4.23Å; L519-I521 HydrophobicContact CG-CG1 3.98Å; L519-T532 HydrophobicContact CD2-CG2 4.46Å; L519-A536 HydrophobicContact CD2-CB 3.71Å
520	T	96.2	Very high	91.6	Very high	56 Å²	56	47.5 Å²	47.5	34%	0.344	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	135.7	169.7	-69.6	0	0	0	0	110.3	F468 Q470	F468-T520 HydrophobicContact CD1-CG2 3.77Å; F468-T520 HydrophobicContact CE1-CG2 4.4Å; F468-T520 WeakPolarHBondContact O-CA 3.49Å; Q470-T520 HydrophobicContact CB-CG2 4.05Å
521	I	96.6	Very high	91.8	Very high	20 Å²	20	50.3 Å²	50.3	10%	0.103	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	128.4	176	-53	170.3	0	0	0	109.5	V467 F468 L469 Q470 L519 N523 T529 T532 V533	V467-I521 HydrophobicContact CG1-CD1 4.06Å; V467-I521 HydrophobicContact CG1-CG1 4.5Å; F468-I521 PolarHBondContact O-N 3.12Å; L469-I521 CarbonylContact C-O 3.6Å; L469-I521 WeakPolarHBondContact CA-O 3.28Å; L469-I521 HydrophobicContact CD2-CB 4.35Å; Q470-I521 PolarHBondContact N-O 3.31Å; L519-I521 HydrophobicContact CD1-CG1 4.35Å; L519-I521 HydrophobicContact CD2-CD1 3.91Å; L519-I521 HydrophobicContact CD2-CG1 4.21Å; L519-I521 HydrophobicContact CG-CD1 4.23Å; L519-I521 HydrophobicContact CG-CG1 3.98Å; I521-N523 PolarHBondContact O-N 3.25Å; I521-T529 HydrophobicContact CD1-CG2 4.14Å; I521-T529 HydrophobicContact CG2-CG2 4.07Å; I521-T532 HydrophobicContact CD1-CG2 3.84Å; I521-T532 HydrophobicContact CG1-CG2 4.26Å; I521-V533 HydrophobicContact CD1-CG2 3.54Å
522	V	95.6	Very high	92.3	Very high	59 Å²	59	49 Å²	49	36%	0.358	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	114.4	166.7	-171.7	0	0	0	0	108.4	Q470 P472 E524	Q470-V522 HydrophobicContact CB-CG2 4.3Å; Q470-V522 HydrophobicContact CG-CG2 4.38Å; P472-V522 HydrophobicContact CB-CG1 4.07Å; P472-V522 HydrophobicContact CG-CG1 3.96Å; V522-E524 VanDerWaalsContact C-N 3.32Å; V522-E524 HydrophobicContact CG1-CG 4.01Å; V522-E524 PolarHBondContact O-N 3.19Å
523	N	88.6	Confident	92.7	Very high	14 Å²	14	46.6 Å²	46.6	8%	0.075	24%	0.237	C	C	.	.			trans	-84.9	68.2	-170.7	-178.3	34.8	0	0	0	112.8	V362 Q470 M480 I521 T529	V362-N523 PolarHBondContact O-ND2 3.24Å; Q470-N523 PolarHBondContact O-N 3.4Å; M480-N523 WeakPolarHBondContact CE-O 3.11Å; I521-N523 PolarHBondContact O-N 3.25Å; N523-T529 PolarHBondContact OD1-OG1 3.46Å
524	E	88.4	Confident	93.1	Very high	117 Å²	117	47.5 Å²	47.5	55%	0.547	24%	0.241	S	C	.	.	S	Bend	trans	-79	-45.1	173.2	-58.4	-175.9	163.5	0	0	111.6	P472 M480 V522	P472-E524 HydrophobicContact CB-CG 4.3Å; P472-E524 HydrophobicContact CG-CG 4.03Å; M480-E524 WeakPolarHBondContact CE-O 3.44Å; M480-E524 HydrophobicContact SD-CB 4.5Å; V522-E524 VanDerWaalsContact C-N 3.32Å; V522-E524 HydrophobicContact CG1-CG 4.01Å; V522-E524 PolarHBondContact O-N 3.19Å
525	N	88.8	Confident	93.4	Very high	60 Å²	60	48.9 Å²	48.9	32%	0.321	25%	0.25	S	S	.	.			trans	-122	118.9	-177	-175.2	-18.8	0	0	0	111.6	D527 E528 T529	N525-D527 VanDerWaalsContact C-N 3.32Å; N525-D527 PolarHBondContact O-N 3.43Å; N525-D527 PolarHBondContact OD1-N 2.65Å; N525-E528 HydrophobicContact CB-CB 4.12Å; N525-E528 HydrophobicContact CB-CG 4.48Å; N525-E528 VanDerWaalsContact CB-OE2 3.26Å; N525-E528 WeakPolarHBondContact CB-OE2 3.11Å; N525-E528 PolarHBondContact ND2-OE1 3.14Å; N525-E528 PolarHBondContact ND2-OE2 2.83Å; N525-E528 PolarHBondContact O-N 3.19Å; N525-T529 WeakPolarHBondContact O-CB 3.49Å; N525-T529 PolarHBondContact O-N 3.27Å; N525-T529 PolarHBondContact O-OG1 3.08Å
526	L	88.8	Confident	93.9	Very high	33 Å²	33	47.2 Å²	47.2	17%	0.173	25%	0.245	C	C	.	.	H	α-helix	trans	-73.1	-18	-176.8	-171.6	64.1	0	0	0	113.5	R366 L367 K370 Y530	R366-L526 HydrophobicContact CB-CD1 4.18Å; R366-L526 HydrophobicContact CB-CD2 3.84Å; L367-L526 HydrophobicContact CB-CD1 4.05Å; L367-L526 HydrophobicContact CD1-CD1 4.34Å; K370-L526 HydrophobicContact CD-CD2 4.27Å; K370-L526 HydrophobicContact CD-CG 3.88Å; K370-L526 WeakPolarHBondContact CD-O 3.48Å; K370-L526 PolarHBondContact NZ-O 2.7Å; L526-Y530 WeakPolarHBondContact O-CB 3.34Å
527	D	91.9	Very high	94.2	Very high	61 Å²	61	47.1 Å²	47.1	33%	0.326	25%	0.245	S	C	.	.	H	α-helix	trans	-82.8	-36.1	171.2	-84.7	-73.8	0	0	0	112	K370 N525 R531	K370-D527 VanDerWaalsContact CE-OD1 3.32Å; K370-D527 WeakPolarHBondContact CE-OD1 2.93Å; K370-D527 VanDerWaalsContact NZ-CA 3.33Å; K370-D527 IonicContact NZ-OD1 3.91Å; K370-D527 PolarHBondContact NZ-OD1 2.72Å; K370-D527 IonicContact NZ-OD2 2.95Å; K370-D527 PolarHBondContact NZ-OD2 2.91Å; N525-D527 VanDerWaalsContact C-N 3.32Å; N525-D527 PolarHBondContact O-N 3.43Å; N525-D527 PolarHBondContact OD1-N 2.65Å; D527-R531 WeakPolarHBondContact O-CG 3.37Å; D527-R531 PolarHBondContact O-N 2.71Å; D527-R531 VanDerWaalsContact O-N 3.15Å
528	E	94.8	Very high	94.3	Very high	101 Å²	101	50.1 Å²	50.1	47%	0.472	26%	0.26	S	S	.	.	H	α-helix	trans	-74.7	-48	177.5	-76.1	149.8	-161.8	0	0	111.3	N525 Y530 R531 T532	N525-E528 HydrophobicContact CB-CB 4.12Å; N525-E528 HydrophobicContact CB-CG 4.48Å; N525-E528 VanDerWaalsContact CB-OE2 3.26Å; N525-E528 WeakPolarHBondContact CB-OE2 3.11Å; N525-E528 PolarHBondContact ND2-OE1 3.14Å; N525-E528 PolarHBondContact ND2-OE2 2.83Å; N525-E528 PolarHBondContact O-N 3.19Å; E528-Y530 PolarHBondContact O-N 2.9Å; E528-R531 VanDerWaalsContact CG-NH1 3.29Å; E528-R531 WeakPolarHBondContact O-CA 3.21Å; E528-R531 WeakPolarHBondContact O-CB 3.49Å; E528-R531 PolarHBondContact O-N 2.75Å; E528-R531 IonicContact OE1-NH1 2.85Å; E528-T532 PolarHBondContact O-N 3.02Å; E528-T532 PolarHBondContact O-OG1 2.9Å; E528-T532 VanDerWaalsContact O-OG1 3.09Å
529	T	95.4	Very high	94.3	Very high	4 Å²	4	51.2 Å²	51.2	3%	0.025	27%	0.268	C	S	.	.	H	α-helix	trans	-52.8	-40.3	173.3	-57.7	0	0	0	0	112	L367 L469 I521 N523 N525 V533	L367-T529 HydrophobicContact CD1-CG2 4.11Å; L367-T529 HydrophobicContact CD2-CG2 3.79Å; L469-T529 HydrophobicContact CD2-CG2 3.76Å; I521-T529 HydrophobicContact CD1-CG2 4.14Å; I521-T529 HydrophobicContact CG2-CG2 4.07Å; N523-T529 PolarHBondContact OD1-OG1 3.46Å; N525-T529 WeakPolarHBondContact O-CB 3.49Å; N525-T529 PolarHBondContact O-N 3.27Å; N525-T529 PolarHBondContact O-OG1 3.08Å; T529-V533 WeakPolarHBondContact O-CG2 3.46Å; T529-V533 PolarHBondContact O-N 2.89Å
530	Y	96	Very high	94.2	Very high	31 Å²	31	50.4 Å²	50.4	12%	0.122	27%	0.265	C	S	.	.	H	α-helix	trans	-63.8	-44.7	174	157.8	-93.3	0	0	0	112.8	K370 L371 R374 D375 L526 E528 K534	K370-Y530 HydrophobicContact CD-CG 4.42Å; K370-Y530 HydrophobicContact CG-CD2 4.3Å; L371-Y530 HydrophobicContact CD2-CD2 3.62Å; L371-Y530 HydrophobicContact CD2-CE2 3.94Å; L371-Y530 HydrophobicContact CG-CD2 4.16Å; R374-Y530 HydrophobicContact CB-CE2 3.76Å; R374-Y530 WeakPolarHBondContact CB-OH 3.35Å; R374-Y530 HydrophobicContact CG-CE2 4.05Å; D375-Y530 PolarHBondContact OD2-OH 3.01Å; D375-Y530 VanDerWaalsContact OD2-OH 3.12Å; L526-Y530 WeakPolarHBondContact O-CB 3.34Å; E528-Y530 PolarHBondContact O-N 2.9Å; Y530-K534 WeakPolarHBondContact O-CB 3.49Å; Y530-K534 PolarHBondContact O-N 3.1Å; Y530-K534 VanDerWaalsContact O-N 3.13Å
531	R	96.5	Very high	94.1	Very high	132 Å²	132	49.7 Å²	49.7	50%	0.498	26%	0.262	S	S	.	.	H	α-helix	trans	-64.2	-44.3	176.5	-69.1	171.2	-156.1	133.3	2.9	111.3	D527 E528 K534 A535	D527-R531 WeakPolarHBondContact O-CG 3.37Å; D527-R531 PolarHBondContact O-N 2.71Å; D527-R531 VanDerWaalsContact O-N 3.15Å; E528-R531 VanDerWaalsContact CG-NH1 3.29Å; E528-R531 WeakPolarHBondContact O-CA 3.21Å; E528-R531 WeakPolarHBondContact O-CB 3.49Å; E528-R531 PolarHBondContact O-N 2.75Å; E528-R531 IonicContact OE1-NH1 2.85Å; R531-K534 PolarHBondContact O-N 3.44Å; R531-A535 WeakPolarHBondContact O-CB 3.36Å; R531-A535 PolarHBondContact O-N 3.3Å
532	T	97.5	Very high	94	Very high	64 Å²	64	54.6 Å²	54.6	39%	0.393	28%	0.283	S	S	.	.	H	α-helix	trans	-62.2	-48.3	-179.4	-56	0	0	0	0	111.5	L519 I521 E528 K534 A535 A536	L519-T532 HydrophobicContact CD2-CG2 4.46Å; I521-T532 HydrophobicContact CD1-CG2 3.84Å; I521-T532 HydrophobicContact CG1-CG2 4.26Å; E528-T532 PolarHBondContact O-N 3.02Å; E528-T532 PolarHBondContact O-OG1 2.9Å; E528-T532 VanDerWaalsContact O-OG1 3.09Å; T532-K534 VanDerWaalsContact C-N 3.33Å; T532-K534 PolarHBondContact O-N 2.84Å; T532-A535 PolarHBondContact O-N 2.92Å; T532-A536 WeakPolarHBondContact O-CB 3.09Å; T532-A536 PolarHBondContact O-N 3.28Å
533	V	96.9	Very high	93.9	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.4	-40.4	176.1	171.3	0	0	0	0	111.9	L354 L367 V467 I521 T529 L537	L354-V533 HydrophobicContact CD1-CG1 4.04Å; L354-V533 HydrophobicContact CD2-CG1 3.91Å; L367-V533 HydrophobicContact CD2-CG2 4.35Å; V467-V533 HydrophobicContact CG1-CG2 3.89Å; V467-V533 HydrophobicContact CG2-CG1 4.45Å; V467-V533 HydrophobicContact CG2-CG2 4.24Å; I521-V533 HydrophobicContact CD1-CG2 3.54Å; T529-V533 WeakPolarHBondContact O-CG2 3.46Å; T529-V533 PolarHBondContact O-N 2.89Å; V533-L537 HydrophobicContact CG1-CD1 4.25Å; V533-L537 WeakPolarHBondContact O-CG 3.23Å; V533-L537 PolarHBondContact O-N 2.89Å
534	K	95.6	Very high	94.2	Very high	45 Å²	45	58.7 Å²	58.7	20%	0.196	31%	0.306	C	S	.	.	H	α-helix	trans	-66.4	-46.1	176.9	-173.2	171.4	-174.1	167.9	0	112.1	D375 Y530 R531 T532 A536 L537 E538	D375-K534 IonicContact OD1-NZ 3.45Å; D375-K534 PolarHBondContact OD1-NZ 3.44Å; D375-K534 WeakPolarHBondContact OD2-CE 3.39Å; D375-K534 IonicContact OD2-NZ 3.19Å; D375-K534 PolarHBondContact OD2-NZ 2.92Å; Y530-K534 WeakPolarHBondContact O-CB 3.49Å; Y530-K534 PolarHBondContact O-N 3.1Å; Y530-K534 VanDerWaalsContact O-N 3.13Å; R531-K534 PolarHBondContact O-N 3.44Å; T532-K534 VanDerWaalsContact C-N 3.33Å; T532-K534 PolarHBondContact O-N 2.84Å; K534-A536 VanDerWaalsContact C-N 3.32Å; K534-A536 PolarHBondContact O-N 2.67Å; K534-L537 PolarHBondContact O-N 3.45Å; K534-E538 WeakPolarHBondContact O-CB 3.34Å; K534-E538 PolarHBondContact O-N 3.21Å
535	A	96.4	Very high	94.5	Very high	51 Å²	51	53.6 Å²	53.6	42%	0.421	28%	0.282	S	S	.	.	H	α-helix	trans	-61.7	-40.4	177.9	0	0	0	0	0	111.7	R531 T532 E538 T539	R531-A535 WeakPolarHBondContact O-CB 3.36Å; R531-A535 PolarHBondContact O-N 3.3Å; T532-A535 PolarHBondContact O-N 2.92Å; A535-E538 PolarHBondContact O-N 3.15Å; A535-T539 VanDerWaalsContact O-CB 3.31Å; A535-T539 WeakPolarHBondContact O-CB 3.48Å; A535-T539 PolarHBondContact O-N 3.24Å; A535-T539 PolarHBondContact O-OG1 2.95Å
536	A	96.3	Very high	94.7	Very high	15 Å²	15	53.8 Å²	53.8	12%	0.124	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-48.4	175.2	0	0	0	0	0	112.6	Y465 L519 T532 K534 E538 T539 V540	Y465-A536 HydrophobicContact CE1-CB 3.91Å; L519-A536 HydrophobicContact CD2-CB 3.71Å; T532-A536 WeakPolarHBondContact O-CB 3.09Å; T532-A536 PolarHBondContact O-N 3.28Å; K534-A536 VanDerWaalsContact C-N 3.32Å; K534-A536 PolarHBondContact O-N 2.67Å; A536-E538 VanDerWaalsContact C-N 3.34Å; A536-E538 PolarHBondContact O-N 3.08Å; A536-T539 WeakPolarHBondContact O-CB 3.43Å; A536-T539 PolarHBondContact O-N 3.45Å; A536-T539 VanDerWaalsContact O-N 3.1Å; A536-V540 PolarHBondContact O-N 3.39Å
537	L	95.6	Very high	94.9	Very high	19 Å²	19	52.4 Å²	52.4	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-60.7	-40.7	174.6	-75.4	173.5	0	0	0	112.5	L354 F379 Y465 V533 K534 T539 V540 S541	L354-L537 HydrophobicContact CD1-CD1 4.26Å; L354-L537 HydrophobicContact CD2-CD1 4.16Å; F379-L537 HydrophobicContact CE1-CD1 3.71Å; F379-L537 HydrophobicContact CZ-CD1 3.87Å; Y465-L537 HydrophobicContact CD1-CD2 3.69Å; Y465-L537 HydrophobicContact CD1-CG 4.19Å; Y465-L537 HydrophobicContact CG-CD2 3.8Å; V533-L537 HydrophobicContact CG1-CD1 4.25Å; V533-L537 WeakPolarHBondContact O-CG 3.23Å; V533-L537 PolarHBondContact O-N 2.89Å; K534-L537 PolarHBondContact O-N 3.45Å; L537-T539 VanDerWaalsContact C-N 3.32Å; L537-V540 WeakPolarHBondContact O-CG2 3.5Å; L537-S541 WeakPolarHBondContact O-CB 3.37Å; L537-S541 PolarHBondContact O-N 2.64Å; L537-S541 VanDerWaalsContact O-N 3.12Å; L537-S541 PolarHBondContact O-OG 3.26Å
538	E	94.6	Very high	94.9	Very high	81 Å²	81	50 Å²	50	38%	0.379	26%	0.259	S	S	.	.	H	α-helix	trans	-64.3	-37.3	173.4	-79.2	-166.7	-135	0	0	112.1	K534 A535 A536 S541 K542	K534-E538 WeakPolarHBondContact O-CB 3.34Å; K534-E538 PolarHBondContact O-N 3.21Å; A535-E538 PolarHBondContact O-N 3.15Å; A536-E538 VanDerWaalsContact C-N 3.34Å; A536-E538 PolarHBondContact O-N 3.08Å; E538-S541 WeakPolarHBondContact CA-OG 3.41Å; E538-S541 PolarHBondContact O-N 2.99Å; E538-S541 PolarHBondContact O-OG 2.94Å; E538-K542 WeakPolarHBondContact O-CD 3.27Å; E538-K542 VanDerWaalsContact O-CG 3.24Å; E538-K542 WeakPolarHBondContact O-CG 3.26Å; E538-K542 PolarHBondContact O-N 3.42Å; E538-K542 IonicContact OE2-NZ 2.71Å; E538-K542 PolarHBondContact OE2-NZ 2.96Å
539	T	95.3	Very high	94.7	Very high	73 Å²	73	46 Å²	46	45%	0.448	24%	0.242	S	C	.	.	H	α-helix	trans	-66.8	-49.3	-178.5	-61.4	0	0	0	0	110.8	A535 A536 L537 S541 K542 N543	A535-T539 VanDerWaalsContact O-CB 3.31Å; A535-T539 WeakPolarHBondContact O-CB 3.48Å; A535-T539 PolarHBondContact O-N 3.24Å; A535-T539 PolarHBondContact O-OG1 2.95Å; A536-T539 WeakPolarHBondContact O-CB 3.43Å; A536-T539 PolarHBondContact O-N 3.45Å; A536-T539 VanDerWaalsContact O-N 3.1Å; L537-T539 VanDerWaalsContact C-N 3.32Å; T539-S541 VanDerWaalsContact C-N 3.28Å; T539-S541 PolarHBondContact O-N 2.96Å; T539-K542 PolarHBondContact O-N 2.89Å; T539-N543 WeakPolarHBondContact CG2-ND2 3.37Å; T539-N543 WeakPolarHBondContact O-CB 3.46Å; T539-N543 PolarHBondContact O-N 3.45Å; T539-N543 PolarHBondContact O-ND2 3.04Å
540	V	93.3	Very high	94.4	Very high	23 Å²	23	51 Å²	51	14%	0.139	27%	0.272	C	S	.	.	H	α-helix	trans	-64.7	-32.5	175.5	-59.5	0	0	0	0	112.1	R351 Y465 A536 L537 K542 Q545	R351-V540 HydrophobicContact CG-CG2 4.08Å; Y465-V540 HydrophobicContact CD2-CG1 4.45Å; Y465-V540 HydrophobicContact CD2-CG2 4.46Å; Y465-V540 HydrophobicContact CE2-CG1 3.87Å; A536-V540 PolarHBondContact O-N 3.39Å; L537-V540 WeakPolarHBondContact O-CG2 3.5Å; V540-K542 PolarHBondContact O-N 3.46Å; V540-Q545 HydrophobicContact CB-CG 4.11Å; V540-Q545 PolarHBondContact O-NE2 2.65Å
541	S	92.9	Very high	94.1	Very high	40 Å²	40	50.8 Å²	50.8	28%	0.28	27%	0.271	S	S	.	.	H	α-helix	trans	-70.3	-15.3	177.2	77.9	0	0	0	0	115	L537 E538 T539	L537-S541 WeakPolarHBondContact O-CB 3.37Å; L537-S541 PolarHBondContact O-N 2.64Å; L537-S541 VanDerWaalsContact O-N 3.12Å; L537-S541 PolarHBondContact O-OG 3.26Å; E538-S541 WeakPolarHBondContact CA-OG 3.41Å; E538-S541 PolarHBondContact O-N 2.99Å; E538-S541 PolarHBondContact O-OG 2.94Å; T539-S541 VanDerWaalsContact C-N 3.28Å; T539-S541 PolarHBondContact O-N 2.96Å
542	K	94.7	Very high	93.5	Very high	124 Å²	124	47.9 Å²	47.9	54%	0.539	27%	0.268	S	S	.	.	H	α-helix	trans	-111.2	-26.8	-175.6	-66.4	166.7	-165.4	171.8	0	113.3	P348 E538 T539 V540	P348-K542 VanDerWaalsContact CG-O 3.28Å; P348-K542 WeakPolarHBondContact CG-O 3.45Å; E538-K542 WeakPolarHBondContact O-CD 3.27Å; E538-K542 VanDerWaalsContact O-CG 3.24Å; E538-K542 WeakPolarHBondContact O-CG 3.26Å; E538-K542 PolarHBondContact O-N 3.42Å; E538-K542 IonicContact OE2-NZ 2.71Å; E538-K542 PolarHBondContact OE2-NZ 2.96Å; T539-K542 PolarHBondContact O-N 2.89Å; V540-K542 PolarHBondContact O-N 3.46Å
543	N	94.6	Very high	92.2	Very high	86 Å²	86	54.1 Å²	54.1	46%	0.46	29%	0.29	S	S	.	.	S	Bend	trans	-106.7	152.6	-176.4	-64.9	-31.6	0	0	0	112.1	P348 T539	P348-N543 WeakPolarHBondContact CA-O 3.32Å; T539-N543 WeakPolarHBondContact CG2-ND2 3.37Å; T539-N543 WeakPolarHBondContact O-CB 3.46Å; T539-N543 PolarHBondContact O-N 3.45Å; T539-N543 PolarHBondContact O-ND2 3.04Å
544	P	94.2	Very high	91.9	Very high	72 Å²	72	56.8 Å²	56.8	47%	0.468	31%	0.305	S	S	.	.			trans	-56.6	143.1	169.3	-23.2	34.1	0	0	0	111	K345 V346	K345-P544 HydrophobicContact CG-CB 4.36Å; V346-P544 CarbonylContact O-C 3.59Å; V346-P544 VanDerWaalsContact O-CA 3.29Å; V346-P544 WeakPolarHBondContact O-CA 3.21Å; V346-P544 WeakPolarHBondContact O-CB 3.29Å
545	Q	93.6	Very high	91.7	Very high	10 Å²	10	57.4 Å²	57.4	5%	0.047	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	144.2	-175.4	-70.9	173	59.7	0	0	110.9	K345 V346 F349 R351 V540 V547	K345-Q545 CarbonylContact C-O 3.56Å; K345-Q545 WeakPolarHBondContact CA-O 3.4Å; V346-Q545 HydrophobicContact CG2-CB 4.19Å; V346-Q545 WeakPolarHBondContact CG2-O 3.31Å; V346-Q545 PolarHBondContact N-O 3Å; V346-Q545 PolarHBondContact O-N 3.28Å; F349-Q545 HydrophobicContact CE1-CB 3.95Å; F349-Q545 HydrophobicContact CE1-CG 4.23Å; F349-Q545 PolarHBondContact O-NE2 3.49Å; R351-Q545 VanDerWaalsContact CZ-OE1 3.3Å; V540-Q545 HydrophobicContact CB-CG 4.11Å; V540-Q545 PolarHBondContact O-NE2 2.65Å; Q545-V547 HydrophobicContact CB-CG1 4.32Å
546	W	93.6	Very high	91.5	Very high	64 Å²	64	57.8 Å²	57.8	24%	0.242	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	128	159.6	-66.8	103.8	0	0	0	108.6	F231 I260 V277 V343 A344 K345	F231-W546 HydrophobicContact CB-CH2 4.02Å; F231-W546 HydrophobicContact CB-CZ3 3.66Å; F231-W546 AromaticContact CD1-CH2 3.59Å; F231-W546 HydrophobicContact CD1-CH2 3.59Å; F231-W546 HydrophobicContact CD1-CZ2 4.48Å; F231-W546 HydrophobicContact CD1-CZ3 4.13Å; F231-W546 AromaticContact CD2-CH2 3.88Å; F231-W546 HydrophobicContact CD2-CH2 3.88Å; F231-W546 AromaticContact CD2-CZ3 3.82Å; F231-W546 HydrophobicContact CD2-CZ3 3.82Å; F231-W546 AromaticContact CE1-CH2 3.94Å; F231-W546 HydrophobicContact CE1-CH2 3.94Å; F231-W546 HydrophobicContact CE2-CH2 4.21Å; F231-W546 HydrophobicContact CE2-CZ3 4.5Å; F231-W546 AromaticContact CG-CH2 3.56Å; F231-W546 HydrophobicContact CG-CH2 3.56Å; F231-W546 AromaticContact CG-CZ3 3.62Å; F231-W546 HydrophobicContact CG-CZ3 3.62Å; F231-W546 HydrophobicContact CZ-CH2 4.25Å; I260-W546 HydrophobicContact CD1-CB 4.39Å; I260-W546 HydrophobicContact CD1-CG 4.29Å; I260-W546 HydrophobicContact CG1-CD2 4.35Å; I260-W546 HydrophobicContact CG1-CG 4.07Å; I260-W546 HydrophobicContact CG2-CD2 4Å; I260-W546 HydrophobicContact CG2-CE3 4.15Å; I260-W546 HydrophobicContact CG2-CH2 4.18Å; I260-W546 HydrophobicContact CG2-CZ2 4.03Å; I260-W546 HydrophobicContact CG2-CZ3 4.23Å; V277-W546 HydrophobicContact CG1-CZ2 3.87Å; V277-W546 HydrophobicContact CG2-CH2 4.22Å; V277-W546 HydrophobicContact CG2-CZ2 3.89Å; V343-W546 HydrophobicContact CB-CB 4.43Å; V343-W546 HydrophobicContact CB-CE3 4.03Å; V343-W546 HydrophobicContact CG2-CD2 4.36Å; V343-W546 HydrophobicContact CG2-CE3 3.66Å; V343-W546 HydrophobicContact CG2-CZ3 4.19Å; A344-W546 WeakPolarHBondContact O-CA 3.46Å; K345-W546 HydrophobicContact CB-CD2 4.01Å; K345-W546 HydrophobicContact CB-CE3 3.79Å; K345-W546 HydrophobicContact CB-CH2 3.79Å; K345-W546 HydrophobicContact CB-CZ2 3.99Å; K345-W546 HydrophobicContact CB-CZ3 3.69Å; K345-W546 HydrophobicContact CD-CH2 4.28Å; K345-W546 HydrophobicContact CD-CZ2 3.77Å; K345-W546 HydrophobicContact CG-CD2 4.28Å; K345-W546 HydrophobicContact CG-CZ2 4.21Å
547	V	93.3	Very high	91.2	Very high	5 Å²	5	60.3 Å²	60.3	3%	0.03	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	154.9	177.4	-64.7	0	0	0	0	109.6	V343 A344 V346 F349 Q545 W551 V552	V343-V547 CarbonylContact C-O 3.41Å; V343-V547 WeakPolarHBondContact CA-O 3.41Å; V343-V547 WeakPolarHBondContact CB-O 3.33Å; A344-V547 PolarHBondContact N-O 3.02Å; A344-V547 PolarHBondContact O-N 3.19Å; V346-V547 HydrophobicContact CB-CG2 4.43Å; V346-V547 HydrophobicContact CG1-CG2 3.75Å; V346-V547 HydrophobicContact CG2-CG1 4.04Å; V346-V547 HydrophobicContact CG2-CG2 3.78Å; F349-V547 HydrophobicContact CE1-CG1 3.71Å; F349-V547 HydrophobicContact CZ-CG1 3.78Å; Q545-V547 HydrophobicContact CB-CG1 4.32Å; V547-W551 HydrophobicContact CB-CD2 4.41Å; V547-W551 HydrophobicContact CB-CE3 3.79Å; V547-W551 HydrophobicContact CB-CZ3 4.39Å; V547-W551 HydrophobicContact CG1-CE3 3.82Å; V547-W551 HydrophobicContact CG1-CZ3 4.05Å; V547-W551 HydrophobicContact CG2-CB 4.46Å; V547-V552 HydrophobicContact CG2-CG2 3.7Å
548	P	92.6	Very high	90.9	Very high	9 Å²	9	62.9 Å²	62.9	6%	0.058	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53	141.5	173.4	-24.4	33.7	0	0	0	111.6	E341 E342 T550 W551	E341-P548 HydrophobicContact CG-CB 4.42Å; E341-P548 HydrophobicContact CG-CG 4.46Å; E342-P548 CarbonylContact O-C 3.48Å; E342-P548 WeakPolarHBondContact O-CA 3.38Å; P548-T550 PolarHBondContact O-N 3.08Å; P548-W551 HydrophobicContact CB-CG 4.3Å; P548-W551 HydrophobicContact CG-CD2 4.25Å; P548-W551 HydrophobicContact CG-CG 4.36Å; P548-W551 HydrophobicContact CG-CZ2 4.4Å; P548-W551 WeakPolarHBondContact O-CB 3.5Å; P548-W551 PolarHBondContact O-N 2.95Å
549	V	90.6	Very high	90.7	Very high	19 Å²	19	61.7 Å²	61.7	12%	0.115	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-56.8	-34.8	177.2	158.7	0	0	0	0	111.5	E342 A344 W551 V552 F553	E342-V549 HydrophobicContact CB-CB 4.22Å; E342-V549 HydrophobicContact CB-CG2 4.01Å; E342-V549 HydrophobicContact CG-CB 4.32Å; E342-V549 HydrophobicContact CG-CG2 3.68Å; E342-V549 PolarHBondContact O-N 2.88Å; A344-V549 HydrophobicContact CB-CG2 4.22Å; V549-W551 PolarHBondContact O-N 3.23Å; V549-V552 PolarHBondContact O-N 3.19Å; V549-F553 HydrophobicContact CG1-CD2 3.71Å; V549-F553 HydrophobicContact CG1-CE2 4.31Å; V549-F553 HydrophobicContact CG1-CG 4.49Å; V549-F553 PolarHBondContact O-N 2.66Å
550	T	87.9	Confident	90.3	Very high	108 Å²	108	60.9 Å²	60.9	66%	0.663	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-65.9	-0.3	173.1	57.5	0	0	0	0	115.1	P548	P548-T550 PolarHBondContact O-N 3.08Å
551	W	90.4	Very high	90.1	Very high	27 Å²	27	63.8 Å²	63.8	10%	0.102	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-98.6	-5.5	169.6	-67.4	15.3	0	0	0	113	R458 L463 P464 V547 P548 V549	R458-W551 HydrophobicContact CG-CZ2 3.86Å; R458-W551 PolarHBondContact O-NE1 3.25Å; L463-W551 HydrophobicContact CD2-CD2 4.15Å; L463-W551 HydrophobicContact CD2-CE3 3.47Å; L463-W551 VanDerWaalsContact CD2-CE3 3.47Å; L463-W551 HydrophobicContact CD2-CZ3 3.85Å; P464-W551 HydrophobicContact CG-CH2 4.07Å; P464-W551 HydrophobicContact CG-CZ2 4.17Å; V547-W551 HydrophobicContact CB-CD2 4.41Å; V547-W551 HydrophobicContact CB-CE3 3.79Å; V547-W551 HydrophobicContact CB-CZ3 4.39Å; V547-W551 HydrophobicContact CG1-CE3 3.82Å; V547-W551 HydrophobicContact CG1-CZ3 4.05Å; V547-W551 HydrophobicContact CG2-CB 4.46Å; P548-W551 HydrophobicContact CB-CG 4.3Å; P548-W551 HydrophobicContact CG-CD2 4.25Å; P548-W551 HydrophobicContact CG-CG 4.36Å; P548-W551 HydrophobicContact CG-CZ2 4.4Å; P548-W551 WeakPolarHBondContact O-CB 3.5Å; P548-W551 PolarHBondContact O-N 2.95Å; V549-W551 PolarHBondContact O-N 3.23Å
552	V	83.8	Confident	89.9	Confident	70 Å²	70	65.8 Å²	65.8	42%	0.424	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.4	-34.3	-170.5	-176.6	0	0	0	0	112.3	A344 V346 V547 V549	A344-V552 HydrophobicContact CB-CG2 4.15Å; V346-V552 HydrophobicContact CG1-CG2 3.64Å; V547-V552 HydrophobicContact CG2-CG2 3.7Å; V549-V552 PolarHBondContact O-N 3.19Å
553	F	69.4	Low	89.5	Confident	195 Å²	195	60.5 Å²	60.5	86%	0.855	32%	0.315	S	S	*	.			trans	-117.6	0	-179.7	-56.4	-92.2	0	0	0	110.4	V549	V549-F553 HydrophobicContact CG1-CD2 3.71Å; V549-F553 HydrophobicContact CG1-CE2 4.31Å; V549-F553 HydrophobicContact CG1-CG 4.49Å; V549-F553 PolarHBondContact O-N 2.66Å

Retrieved 553 of 553 residues in 116.7 ms (Link to these results)

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