A0A087Y9R6_POEFO Loading...

Origin recognition complex subunit 2

Component of the origin recognition complex (ORC) that binds origins of replication. DNA-binding is ATP-dependent. ORC is required to assemble the pre-replication complex necessary to initiate DNA replication.

AlphaFold DB , UniProt , Accession A0A087Y9R6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 586 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	35.1	Very low	232 Å²	232	164.6 Å²	164.6	100%	1.143	87%	0.865	S	S	*	*				0	76.2	0	-75.1	168.3	147.7	0	0	106.9
2	T	35.5	Very low	35.5	Very low	131 Å²	131	161.6 Å²	161.6	80%	0.804	86%	0.857	S	S	*	*				69.2	101	89	52.4	0	0	0	0	113
3	Q	33.6	Very low	35.9	Very low	200 Å²	200	161.5 Å²	161.5	94%	0.935	85%	0.845	S	S	*	*			trans	-159.4	110.7	135.5	-102.8	166.6	33.3	0	0	108.1
4	Q	33.6	Very low	36.1	Very low	190 Å²	190	164.9 Å²	164.9	89%	0.888	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-82.6	150.6	167.4	-74.1	176.1	-27.8	0	0	108.7
5	P	38.9	Very low	37.1	Very low	124 Å²	124	159.3 Å²	159.3	81%	0.805	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-79.3	136.9	174.6	32	-30.3	0	0	0	110.9
6	E	33.3	Very low	38	Very low	200 Å²	200	152.5 Å²	152.5	94%	0.935	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-63.6	127.9	177.2	-69.8	178.5	151.7	0	0	111.2	S8	E6-S8 PolarHBondContact O-N 3Å
7	M	32.9	Very low	38.8	Very low	179 Å²	179	152.2 Å²	152.2	88%	0.882	81%	0.806	S	S	*	*			trans	-76.3	115.5	168.4	-71.4	-159	-79.1	0	0	109.2	V9	M7-V9 PolarHBondContact O-N 3.45Å
8	S	37.9	Very low	39.8	Very low	111 Å²	111	146.8 Å²	146.8	78%	0.776	79%	0.793	S	S	*	*			trans	-68.4	109	169.9	55.2	0	0	0	0	109.9	E6 L10	E6-S8 PolarHBondContact O-N 3Å; S8-L10 PolarHBondContact O-N 3.49Å
9	V	34.5	Very low	40.4	Very low	131 Å²	131	144.7 Å²	144.7	79%	0.794	78%	0.781	S	S	*	*			trans	-70.4	114.6	170.8	178.6	0	0	0	0	108.2	M7 E11	M7-V9 PolarHBondContact O-N 3.45Å; V9-E11 PolarHBondContact O-N 2.99Å
10	L	37.6	Very low	40.9	Very low	157 Å²	157	140.8 Å²	140.8	82%	0.822	76%	0.763	S	S	*	*			trans	-75.1	107.3	170	-76.5	160.1	0	0	0	108.6	S8	S8-L10 PolarHBondContact O-N 3.49Å
11	E	33.8	Very low	41.2	Very low	156 Å²	156	140 Å²	140	73%	0.729	76%	0.757	S	S	*	*			trans	-75.8	117.8	165.4	-90.5	-169	161.1	0	0	109.7	V9 K13	V9-E11 PolarHBondContact O-N 2.99Å; E11-K13 IonicContact OE2-NZ 3.29Å
12	V	39.1	Very low	41.9	Very low	128 Å²	128	137.1 Å²	137.1	78%	0.776	74%	0.741	S	S	*	*			trans	-91.8	115.5	170	179.7	0	0	0	0	108.1
13	K	41.3	Very low	42.5	Very low	161 Å²	161	139.1 Å²	139.1	70%	0.7	74%	0.741	S	S	*	*			trans	-106.6	128.2	169.9	-74.3	179.8	-178.6	169.9	0	109.3	E11 V15	E11-K13 IonicContact OE2-NZ 3.29Å; K13-V15 PolarHBondContact O-N 2.97Å
14	F	39	Very low	43.1	Very low	208 Å²	208	135.5 Å²	135.5	91%	0.912	73%	0.727	S	S	*	*			trans	-73	121.9	172.1	-103.5	-93.1	0	0	0	109.5
15	V	50.5	Low	43.4	Very low	81 Å²	81	131.9 Å²	131.9	49%	0.491	72%	0.717	S	S	.	*			trans	-107	132.5	174.5	177.1	0	0	0	0	107	K13 D19	K13-V15 PolarHBondContact O-N 2.97Å; V15-D19 HydrophobicContact CG1-CB 3.57Å
16	G	52.4	Low	43.3	Very low	51 Å²	51	132.6 Å²	132.6	53%	0.526	71%	0.714	S	S	.	*			trans	-69.2	150	179.6	0	0	0	0	0	112.1	G18 D19	G16-G18 PolarHBondContact O-N 3.27Å; G16-D19 PolarHBondContact O-N 3.3Å
17	D	51	Low	43.5	Very low	147 Å²	147	132.4 Å²	132.4	79%	0.786	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-15.9	-170.1	-65.4	-24.7	0	0	0	115.7
18	G	56.4	Low	43.5	Very low	56 Å²	56	132.3 Å²	132.3	58%	0.577	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-35.3	175.4	0	0	0	0	0	114.2	G16	G16-G18 PolarHBondContact O-N 3.27Å
19	D	52.3	Low	43.2	Very low	106 Å²	106	136 Å²	136	57%	0.567	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-11.1	-173.5	-68	-16.9	0	0	0	112.6	V15 G16 L21	V15-D19 HydrophobicContact CG1-CB 3.57Å; G16-D19 PolarHBondContact O-N 3.3Å; D19-L21 VanDerWaalsContact C-N 3.27Å; D19-L21 PolarHBondContact O-N 3.25Å
20	V	49.5	Very low	42.9	Very low	67 Å²	67	133 Å²	133	41%	0.406	71%	0.707	S	S	.	*	H	α-helix	trans	-69.4	-27.9	174.8	178.4	0	0	0	0	111.3	E22 H23 I24	V20-E22 PolarHBondContact O-N 3.45Å; V20-H23 PolarHBondContact O-N 3Å; V20-I24 HydrophobicContact CG1-CD1 3.85Å; V20-I24 WeakPolarHBondContact O-CG1 3.4Å
21	L	46.5	Very low	42.5	Very low	125 Å²	125	132.4 Å²	132.4	65%	0.654	71%	0.71	S	S	*	*	H	α-helix	trans	-71.3	-27.1	-178.3	-76.7	165.4	0	0	0	113.5	D19 H23	D19-L21 VanDerWaalsContact C-N 3.27Å; D19-L21 PolarHBondContact O-N 3.25Å; L21-H23 VanDerWaalsContact C-N 3.32Å
22	E	50.4	Low	42.5	Very low	170 Å²	170	133.5 Å²	133.5	79%	0.794	72%	0.715	S	S	*	*	H	α-helix	trans	-79.8	-16.8	176.9	-64.3	-160.8	161.9	0	0	112.9	V20	V20-E22 PolarHBondContact O-N 3.45Å
23	H	47.2	Very low	42	Very low	174 Å²	174	135.1 Å²	135.1	81%	0.806	72%	0.72	S	S	*	*	H	α-helix	trans	-89.8	-11.7	179.2	-102.6	-70.2	0	0	0	114.6	V20 L21	V20-H23 PolarHBondContact O-N 3Å; L21-H23 VanDerWaalsContact C-N 3.32Å
24	I	46.4	Very low	41.4	Very low	124 Å²	124	131 Å²	131	64%	0.636	72%	0.723	S	S	*	*	S	Bend	trans	-96.4	-1.9	-175.5	-65.8	170.3	0	0	0	112.7	V20	V20-I24 HydrophobicContact CG1-CD1 3.85Å; V20-I24 WeakPolarHBondContact O-CG1 3.4Å
25	V	39.9	Very low	41.2	Very low	113 Å²	113	126.8 Å²	126.8	69%	0.685	73%	0.726	S	S	*	*	S	Bend	trans	-98.6	102.1	177.3	-172.8	0	0	0	0	110.4	K27	V25-K27 PolarHBondContact O-N 3.46Å
26	D	38.1	Very low	40.1	Very low	140 Å²	140	126 Å²	126	75%	0.749	74%	0.736	S	S	*	*			trans	-53.6	109.3	170.3	-84.7	-32.8	0	0	0	110.9	H28	D26-H28 PolarHBondContact O-N 2.65Å
27	K	37.5	Very low	39.2	Very low	195 Å²	195	129.1 Å²	129.1	85%	0.848	75%	0.749	S	S	*	*			trans	-72.1	93.7	167.8	-78.8	-177	178	174.3	0	109.1	V25 E29	V25-K27 PolarHBondContact O-N 3.46Å; K27-E29 PolarHBondContact O-N 2.85Å
28	H	32.4	Very low	38.2	Very low	177 Å²	177	129 Å²	129	82%	0.819	75%	0.754	S	S	*	*			trans	-76.6	98.9	158.1	-80.4	-67.4	0	0	0	109.5	D26	D26-H28 PolarHBondContact O-N 2.65Å
29	E	31	Very low	37	Very low	189 Å²	189	134.8 Å²	134.8	88%	0.883	77%	0.765	S	S	*	*			trans	-73.7	118.3	163.5	-74.9	-174.8	159.1	0	0	109.8	K27	K27-E29 PolarHBondContact O-N 2.85Å
30	G	29.2	Very low	35.9	Very low	67 Å²	67	142 Å²	142	69%	0.691	79%	0.785	S	S	*	*			trans	150.8	115.9	162.4	0	0	0	0	0	115.2
31	V	28.4	Very low	34.9	Very low	145 Å²	145	146.4 Å²	146.4	88%	0.879	81%	0.805	S	S	*	*			trans	94.1	110.1	160.9	-167.1	0	0	0	0	116.8
32	Q	34.5	Very low	33.9	Very low	179 Å²	179	145.8 Å²	145.8	84%	0.836	81%	0.806	S	S	*	*			trans	-58.3	132.3	165.8	-66.7	174.5	-14.7	0	0	110.9
33	N	28.8	Very low	32.8	Very low	162 Å²	162	147.4 Å²	147.4	87%	0.866	81%	0.811	S	S	*	*			trans	-172.8	134.3	144.3	-93.7	-25.9	0	0	0	112.9
34	G	27.7	Very low	31.8	Very low	75 Å²	75	148.6 Å²	148.6	77%	0.773	81%	0.814	S	S	*	*			trans	80.7	107.2	138.2	0	0	0	0	0	118.7	G36	G34-G36 PolarHBondContact O-N 2.94Å
35	A	35.4	Very low	30.9	Very low	119 Å²	119	152.1 Å²	152.1	98%	0.983	82%	0.824	S	S	*	*			trans	-53.1	131	166	0	0	0	0	0	112.8
36	G	27.8	Very low	30.4	Very low	66 Å²	66	151.6 Å²	151.6	68%	0.68	83%	0.826	S	S	*	*			trans	-168.4	113.4	170.8	0	0	0	0	0	110.9	G34	G34-G36 PolarHBondContact O-N 2.94Å
37	S	32.3	Very low	30.1	Very low	116 Å²	116	151.1 Å²	151.1	81%	0.811	83%	0.831	S	S	*	*			trans	-64.5	127.5	-178	57.7	0	0	0	0	112.7
38	V	30.3	Very low	29.6	Very low	145 Å²	145	146.7 Å²	146.7	88%	0.879	83%	0.83	S	S	*	*			trans	-115.5	124.9	165.5	-178.2	0	0	0	0	109.3
39	Q	31.8	Very low	29.3	Very low	177 Å²	177	142 Å²	142	83%	0.827	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-73.4	126.9	-171.5	-65.1	171.3	-12	0	0	111.4
40	R	29.7	Very low	29.1	Very low	258 Å²	258	142.5 Å²	142.5	97%	0.974	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-76.9	117.1	163.8	-90.3	-179.1	177.4	170	-1.5	109.5
41	L	27.1	Very low	29	Very low	158 Å²	158	149.8 Å²	149.8	83%	0.827	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-90.2	144.6	168.3	-146.2	76.8	0	0	0	109.1
42	V	26.9	Very low	28.8	Very low	112 Å²	112	146.6 Å²	146.6	68%	0.679	84%	0.841	S	S	*	*			trans	89.1	93.3	175.4	-162.4	0	0	0	0	115.8	F44	V42-F44 HydrophobicContact CG1-CD2 3.78Å; V42-F44 HydrophobicContact CG1-CE2 3.55Å; V42-F44 HydrophobicContact CG1-CZ 4.39Å
43	K	26.8	Very low	28.2	Very low	205 Å²	205	145.9 Å²	145.9	89%	0.891	84%	0.837	S	S	*	*			trans	-100.9	121.1	156.9	-77.5	-179.1	176.2	179.7	0	107.9
44	F	26.5	Very low	28.1	Very low	198 Å²	198	144.9 Å²	144.9	87%	0.868	84%	0.836	S	S	*	*			trans	-82.3	127.4	164.2	-83.8	-84.5	0	0	0	109.6	V42	V42-F44 HydrophobicContact CG1-CD2 3.78Å; V42-F44 HydrophobicContact CG1-CE2 3.55Å; V42-F44 HydrophobicContact CG1-CZ 4.39Å
45	K	28	Very low	28	Very low	198 Å²	198	148.4 Å²	148.4	86%	0.861	83%	0.833	S	S	*	*			trans	-95.8	114.2	-177.1	-172	178.6	-179.3	-178.8	0	108.5
46	S	28.9	Very low	27.5	Very low	103 Å²	103	150 Å²	150	72%	0.72	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-66.5	140	170.1	18.8	0	0	0	0	111
47	P	31.1	Very low	27.5	Very low	130 Å²	130	155.9 Å²	155.9	84%	0.844	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-77.6	126.9	174.6	27.8	-28.2	0	0	0	110.7
48	A	28.2	Very low	27.3	Very low	102 Å²	102	158.7 Å²	158.7	84%	0.843	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-66.8	143.4	172.2	0	0	0	0	0	111.2
49	G	25.4	Very low	27.1	Very low	77 Å²	77	160.1 Å²	160.1	79%	0.794	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-76.4	169.3	-170	0	0	0	0	0	116.8
50	Q	27.1	Very low	26.8	Very low	200 Å²	200	158.8 Å²	158.8	94%	0.935	84%	0.835	S	S	*	*			trans	-109	120.2	152.4	-88.3	-179.6	-17.2	0	0	107.7
51	K	26.1	Very low	26.6	Very low	221 Å²	221	154.6 Å²	154.6	96%	0.961	83%	0.827	S	S	*	*			trans	-76.7	134.4	171.1	-79.7	-177.2	171.4	-174.7	0	109.8
52	G	24.9	Very low	26.5	Very low	78 Å²	78	155.6 Å²	155.6	80%	0.804	83%	0.827	S	S	*	*			trans	-140.2	120.2	160.7	0	0	0	0	0	108.5
53	H	22.4	Very low	26.5	Very low	163 Å²	163	158 Å²	158	76%	0.755	83%	0.831	S	S	*	*			trans	-67.1	134.5	-172.3	-151.1	-67.5	0	0	0	112.7	E55	H53-E55 IonicContact CE1-OE1 3.97Å
54	V	26.7	Very low	26.5	Very low	141 Å²	141	154.2 Å²	154.2	86%	0.855	82%	0.82	S	S	*	*			trans	-163.9	146.3	136.8	177.9	0	0	0	0	108.1
55	E	24.7	Very low	26.7	Very low	150 Å²	150	148.4 Å²	148.4	70%	0.701	82%	0.817	S	S	*	*			trans	-82.4	158.7	-160.1	-63.8	159.1	164	0	0	115.8	H53	H53-E55 IonicContact CE1-OE1 3.97Å
56	D	25.3	Very low	26.9	Very low	152 Å²	152	145 Å²	145	81%	0.813	81%	0.812	S	S	*	*			trans	10.6	132.6	152.3	-58.3	-31	0	0	0	121.3
57	E	27.9	Very low	27.3	Very low	189 Å²	189	150.1 Å²	150.1	88%	0.883	82%	0.817	S	S	*	*				-175.9	142.4	111.3	-98.3	-178.4	-179.5	0	0	112.1
58	Q	27.1	Very low	27.8	Very low	176 Å²	176	149.5 Å²	149.5	82%	0.822	81%	0.806	S	S	*	*			trans	-64.7	149.6	174.6	-81.5	101	-2.9	0	0	113.1
59	L	27.2	Very low	28.5	Very low	175 Å²	175	151.7 Å²	151.7	92%	0.916	80%	0.799	S	S	*	*				-179.3	135.3	126.1	-92.8	163	0	0	0	111.3
60	D	25.3	Very low	29.2	Very low	148 Å²	148	155.3 Å²	155.3	79%	0.791	80%	0.796	S	S	*	*			trans	-73.4	142	178.1	-62.5	-51	0	0	0	112.7
61	Q	25.8	Very low	29.9	Very low	171 Å²	171	147.6 Å²	147.6	80%	0.799	77%	0.77	S	S	*	*				163.2	124.2	118.5	-88.2	169.2	24.6	0	0	113.5
62	E	24.9	Very low	30.5	Very low	179 Å²	179	145 Å²	145	84%	0.836	76%	0.755	S	S	*	*			trans	66.5	146.1	141.5	-59.9	-175.5	175.3	0	0	122.9
63	E	26	Very low	31.5	Very low	163 Å²	163	145.5 Å²	145.5	76%	0.762	74%	0.738	S	S	*	*			trans	96.1	115.5	161.3	-71.3	-159.6	128.6	0	0	121.7
64	N	27	Very low	32.4	Very low	124 Å²	124	147.8 Å²	147.8	66%	0.663	74%	0.74	S	S	*	*			trans	66.4	94.7	133.2	-57.4	-27.8	0	0	0	118.7	V66	N64-V66 VanDerWaalsContact C-N 3.31Å; N64-V66 PolarHBondContact O-N 3.09Å
65	G	29.8	Very low	33.4	Very low	77 Å²	77	147 Å²	147	79%	0.794	74%	0.735	S	S	*	*			trans	-68.8	81.2	163.4	0	0	0	0	0	112.6
66	V	33	Very low	34.2	Very low	125 Å²	125	144.9 Å²	144.9	76%	0.758	73%	0.729	S	S	*	*			trans	-90.9	100.5	158.9	178.7	0	0	0	0	106.8	N64 D68	N64-V66 VanDerWaalsContact C-N 3.31Å; N64-V66 PolarHBondContact O-N 3.09Å; V66-D68 PolarHBondContact O-N 3.33Å; V66-D68 VanDerWaalsContact O-N 3.12Å
67	Y	36.7	Very low	35.1	Very low	212 Å²	212	141 Å²	141	83%	0.831	73%	0.725	S	S	*	*			trans	-68.9	107	175.4	-81.2	-84.7	0	0	0	110.8	Q69	Y67-Q69 PolarHBondContact O-N 3.46Å; Y67-Q69 VanDerWaalsContact O-N 3.08Å
68	D	43.3	Very low	35.7	Very low	116 Å²	116	136.9 Å²	136.9	62%	0.62	71%	0.712	S	S	*	*			trans	16.2	72.4	145.3	-152.4	0.2	0	0	0	118	V66 Q70 G71	V66-D68 PolarHBondContact O-N 3.33Å; V66-D68 VanDerWaalsContact O-N 3.12Å; D68-Q70 PolarHBondContact O-N 3.45Å; D68-G71 PolarHBondContact OD1-N 3.19Å
69	Q	42.4	Very low	35.8	Very low	148 Å²	148	136.5 Å²	136.5	69%	0.692	71%	0.711	S	S	*	*	H	α-helix	trans	-70.3	-14.3	168.6	-74.3	177.4	-7.2	0	0	112.8	Y67 Y72 I73	Y67-Q69 PolarHBondContact O-N 3.46Å; Y67-Q69 VanDerWaalsContact O-N 3.08Å; Q69-Y72 PolarHBondContact O-N 3.17Å; Q69-I73 WeakPolarHBondContact O-CD1 3.32Å; Q69-I73 VanDerWaalsContact O-CG1 3.3Å; Q69-I73 WeakPolarHBondContact O-CG1 3.29Å; Q69-I73 PolarHBondContact O-N 3.37Å
70	Q	39	Very low	36.2	Very low	153 Å²	153	135.9 Å²	135.9	72%	0.715	71%	0.708	S	S	*	*	H	α-helix	trans	-78.6	-30.5	-175	-68.5	172.9	-0.2	0	0	112.3	D68 Y72 R74	D68-Q70 PolarHBondContact O-N 3.45Å; Q70-Y72 VanDerWaalsContact C-N 3.34Å; Q70-R74 WeakPolarHBondContact O-CB 3.37Å; Q70-R74 PolarHBondContact O-N 3.01Å
71	G	42	Very low	36.5	Very low	38 Å²	38	136.3 Å²	136.3	39%	0.392	71%	0.711	S	S	.	*	H	α-helix	trans	-67.2	-32.8	171.5	0	0	0	0	0	113.6	D68 V75	D68-G71 PolarHBondContact OD1-N 3.19Å; G71-V75 WeakPolarHBondContact O-CG2 3.46Å
72	Y	39.9	Very low	36.7	Very low	168 Å²	168	131 Å²	131	66%	0.659	70%	0.702	S	S	*	*	H	α-helix	trans	-76.7	-38.3	-179.4	-165.6	-104	0	0	0	112.2	Q69 Q70 R74 V75 L76	Q69-Y72 PolarHBondContact O-N 3.17Å; Q70-Y72 VanDerWaalsContact C-N 3.34Å; Y72-R74 VanDerWaalsContact C-N 3.32Å; Y72-R74 PolarHBondContact O-N 2.89Å; Y72-V75 PolarHBondContact O-N 3.44Å; Y72-L76 HydrophobicContact CD1-CD1 3.93Å; Y72-L76 HydrophobicContact CE1-CD1 3.56Å; Y72-L76 PolarHBondContact O-N 3.48Å
73	I	45.4	Very low	37	Very low	87 Å²	87	131.2 Å²	131.2	45%	0.446	70%	0.703	S	S	.	*	H	α-helix	trans	-68.8	-33.1	177.4	-65.1	166.8	0	0	0	111	Q69 V75 L76	Q69-I73 WeakPolarHBondContact O-CD1 3.32Å; Q69-I73 VanDerWaalsContact O-CG1 3.3Å; Q69-I73 WeakPolarHBondContact O-CG1 3.29Å; Q69-I73 PolarHBondContact O-N 3.37Å; I73-V75 VanDerWaalsContact C-N 3.3Å; I73-V75 PolarHBondContact O-N 2.67Å; I73-L76 PolarHBondContact O-N 3.26Å
74	R	40.2	Very low	37.1	Very low	211 Å²	211	131.3 Å²	131.3	80%	0.796	71%	0.708	S	S	*	*	H	α-helix	trans	-72	-20.4	177.8	-158.5	178.2	-80.1	-176.5	-4	113.7	Q70 Y72	Q70-R74 WeakPolarHBondContact O-CB 3.37Å; Q70-R74 PolarHBondContact O-N 3.01Å; Y72-R74 VanDerWaalsContact C-N 3.32Å; Y72-R74 PolarHBondContact O-N 2.89Å
75	V	48.8	Very low	37.4	Very low	124 Å²	124	133.9 Å²	133.9	75%	0.752	72%	0.716	S	S	*	*	H	α-helix	trans	-83.4	-22.4	173.7	173.4	0	0	0	0	112	G71 Y72 I73	G71-V75 WeakPolarHBondContact O-CG2 3.46Å; Y72-V75 PolarHBondContact O-N 3.44Å; I73-V75 VanDerWaalsContact C-N 3.3Å; I73-V75 PolarHBondContact O-N 2.67Å
76	L	40.8	Very low	37.5	Very low	107 Å²	107	137.8 Å²	137.8	56%	0.56	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	6.7	-176.8	-71.8	172.3	0	0	0	115	Y72 I73 T78	Y72-L76 HydrophobicContact CD1-CD1 3.93Å; Y72-L76 HydrophobicContact CE1-CD1 3.56Å; Y72-L76 PolarHBondContact O-N 3.48Å; I73-L76 PolarHBondContact O-N 3.26Å; L76-T78 PolarHBondContact O-N 3.24Å
77	G	44.2	Very low	37.2	Very low	71 Å²	71	135.2 Å²	135.2	73%	0.732	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.5	35.2	160.9	0	0	0	0	0	115.7
78	T	40.3	Very low	37.1	Very low	102 Å²	102	133.8 Å²	133.8	63%	0.626	72%	0.724	S	S	*	*			trans	-116.6	78.4	172.5	56.5	0	0	0	0	110.9	L76	L76-T78 PolarHBondContact O-N 3.24Å
79	E	30.7	Very low	36.6	Very low	168 Å²	168	133.4 Å²	133.4	79%	0.785	73%	0.73	S	S	*	*			trans	-129.3	101.9	152.5	-75.7	-170.3	173.2	0	0	107.4
80	N	34.9	Very low	36.3	Very low	162 Å²	162	131.8 Å²	131.8	87%	0.866	74%	0.735	S	S	*	*			trans	-93.6	90.5	172	-165.1	43.1	0	0	0	105.5	G82	N80-G82 PolarHBondContact O-N 3.25Å
81	D	31.6	Very low	36.1	Very low	157 Å²	157	130.1 Å²	130.1	84%	0.84	74%	0.735	S	S	*	*			trans	-76.7	110.1	162.4	-87.2	-25.9	0	0	0	107
82	G	29.3	Very low	35.8	Very low	60 Å²	60	131.2 Å²	131.2	62%	0.619	74%	0.741	S	S	*	*			trans	-71.8	130.7	173.4	0	0	0	0	0	110.5	N80	N80-G82 PolarHBondContact O-N 3.25Å
83	E	32	Very low	35.7	Very low	182 Å²	182	125.7 Å²	125.7	85%	0.85	74%	0.735	S	S	*	*				173.4	109.3	128.2	-92.3	169.4	-163.4	0	0	107.6
84	D	28.8	Very low	35.5	Very low	165 Å²	165	125.5 Å²	125.5	88%	0.882	75%	0.746	S	S	*	*			trans	146.5	139.6	140.7	-70.6	-23.5	0	0	0	113.5
85	E	33	Very low	35.6	Very low	178 Å²	178	119.1 Å²	119.1	83%	0.832	73%	0.734	S	S	*	*			trans	-60.6	160.2	-164.7	-69	176.9	131.7	0	0	117.3
86	D	30.8	Very low	35.3	Very low	159 Å²	159	119.3 Å²	119.3	85%	0.85	73%	0.73	S	S	*	*			trans	72.7	116.1	152.2	-73.8	-19.2	0	0	0	120.2
87	G	28.3	Very low	35.1	Very low	72 Å²	72	121.7 Å²	121.7	74%	0.742	74%	0.736	S	S	*	*			trans	139.9	112.4	146.1	0	0	0	0	0	116.5	S89	G87-S89 PolarHBondContact O-N 3.14Å
88	L	34.1	Very low	34.7	Very low	182 Å²	182	124.2 Å²	124.2	95%	0.953	74%	0.737	S	S	*	*			trans	-36.7	128.3	154.8	-109	77	0	0	0	112.2
89	S	31.9	Very low	34.5	Very low	107 Å²	107	128 Å²	128	75%	0.748	75%	0.745	S	S	*	*			trans	-159.6	123.2	141.2	55.5	0	0	0	0	114.1	G87 V91	G87-S89 PolarHBondContact O-N 3.14Å; S89-V91 PolarHBondContact O-N 2.88Å
90	S	36.9	Very low	34.9	Very low	114 Å²	114	128.9 Å²	128.9	80%	0.797	75%	0.749	S	S	*	*			trans	-21.8	108.3	152.7	159.8	0	0	0	0	114.5	A92	S90-A92 PolarHBondContact O-N 3.2Å; S90-A92 VanDerWaalsContact O-N 3.15Å
91	V	35.2	Very low	35.2	Very low	118 Å²	118	129.8 Å²	129.8	72%	0.715	75%	0.746	S	S	*	*			trans	-73.9	103.2	162	179.5	0	0	0	0	107.8	S89 G93	S89-V91 PolarHBondContact O-N 2.88Å; V91-G93 PolarHBondContact O-N 3.02Å
92	A	35.2	Very low	35.5	Very low	62 Å²	62	129.4 Å²	129.4	51%	0.512	74%	0.744	S	S	.	*			trans	-62.1	127.9	177.5	0	0	0	0	0	110.8	S90 A94 S95	S90-A92 PolarHBondContact O-N 3.2Å; S90-A92 VanDerWaalsContact O-N 3.15Å; A92-A94 PolarHBondContact O-N 3.15Å; A92-S95 PolarHBondContact O-N 3.32Å; A92-S95 VanDerWaalsContact O-N 3.14Å; A92-S95 PolarHBondContact O-OG 2.91Å; A92-S95 VanDerWaalsContact O-OG 3.11Å
93	G	37.7	Very low	36.1	Very low	52 Å²	52	138 Å²	138	54%	0.536	76%	0.757	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.4	0.8	-179.8	0	0	0	0	0	116.6	V91 S95	V91-G93 PolarHBondContact O-N 3.02Å; G93-S95 VanDerWaalsContact C-N 3.3Å
94	A	41.3	Very low	36.9	Very low	82 Å²	82	139.1 Å²	139.1	68%	0.678	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-17.6	170.6	0	0	0	0	0	113.6	A92	A92-A94 PolarHBondContact O-N 3.15Å
95	S	41.2	Very low	37.7	Very low	78 Å²	78	134.4 Å²	134.4	55%	0.545	74%	0.744	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	-16.5	177.1	56.8	0	0	0	0	113.8	A92 G93	A92-S95 PolarHBondContact O-N 3.32Å; A92-S95 VanDerWaalsContact O-N 3.14Å; A92-S95 PolarHBondContact O-OG 2.91Å; A92-S95 VanDerWaalsContact O-OG 3.11Å; G93-S95 VanDerWaalsContact C-N 3.3Å
96	I	44	Very low	38.7	Very low	128 Å²	128	131.3 Å²	131.3	66%	0.656	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-30.5	-177.9	-59	172.8	0	0	0	111.1
97	F	35.4	Very low	40	Very low	156 Å²	156	126.6 Å²	126.6	68%	0.684	71%	0.712	S	S	*	*			trans	-111.9	88.5	176.7	-68.5	-80	0	0	0	111.8	F99	F97-F99 PolarHBondContact O-N 2.9Å
98	T	37.1	Very low	40.9	Very low	125 Å²	125	130.8 Å²	130.8	77%	0.767	72%	0.715	S	S	*	*			trans	-83.2	91.9	168.3	50.1	0	0	0	0	110.1	Q100	T98-Q100 PolarHBondContact O-N 2.77Å
99	F	34.7	Very low	42	Very low	181 Å²	181	124.6 Å²	124.6	79%	0.794	69%	0.69	S	S	*	*			trans	-64.6	106.7	164.6	-87	-89	0	0	0	108.9	F97 K101	F97-F99 PolarHBondContact O-N 2.9Å; F99-K101 PolarHBondContact O-N 3.27Å
100	Q	38.6	Very low	43.5	Very low	186 Å²	186	124.2 Å²	124.2	87%	0.869	68%	0.679	S	S	*	*			trans	-65.7	83.1	165.6	-88.2	-171	-6.1	0	0	109.6	T98 N102	T98-Q100 PolarHBondContact O-N 2.77Å; Q100-N102 PolarHBondContact O-N 3.21Å
101	K	42.3	Very low	44.7	Very low	181 Å²	181	121.9 Å²	121.9	79%	0.787	66%	0.66	S	S	*	*			trans	-71	106.4	159.4	-91.1	-178.3	176.9	172.5	0	107.2	F99 R103	F99-K101 PolarHBondContact O-N 3.27Å; K101-R103 PolarHBondContact O-N 3.07Å
102	N	38.7	Very low	45.5	Very low	150 Å²	150	119 Å²	119	80%	0.802	65%	0.65	S	S	*	*			trans	-57	93	156.9	-90.8	-22	0	0	0	107.6	Q100 R104	Q100-N102 PolarHBondContact O-N 3.21Å; N102-R104 PolarHBondContact O-N 2.92Å
103	R	41.3	Very low	46.6	Very low	239 Å²	239	119 Å²	119	90%	0.902	65%	0.645	S	S	*	*			trans	-66.5	86.5	170.5	-80.9	-170.7	169.3	-175	-1.2	107.4	K101 G105	K101-R103 PolarHBondContact O-N 3.07Å; R103-G105 PolarHBondContact O-N 3.33Å
104	R	47.6	Very low	47.6	Very low	207 Å²	207	119.9 Å²	119.9	78%	0.781	64%	0.644	S	S	*	*			trans	-65.6	92.4	158.1	-72.6	-173.7	-179.2	178.6	1.8	106.5	N102 N106 S107	N102-R104 PolarHBondContact O-N 2.92Å; R104-N106 PolarHBondContact O-N 3.27Å; R104-S107 PolarHBondContact O-N 3.36Å
105	G	47.2	Very low	48.6	Very low	65 Å²	65	123.1 Å²	123.1	67%	0.67	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.1	130.9	170.4	0	0	0	0	0	109.1	R103 S107	R103-G105 PolarHBondContact O-N 3.33Å; G105-S107 PolarHBondContact O-N 3.5Å
106	N	54.3	Low	48.9	Very low	114 Å²	114	123 Å²	123	61%	0.61	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	72	5.8	174.7	-55.7	-11.1	0	0	0	117.9	R104 M108 A109 N110	R104-N106 PolarHBondContact O-N 3.27Å; N106-M108 PolarHBondContact O-N 2.98Å; N106-A109 HydrophobicContact CB-CB 4.4Å; N106-A109 PolarHBondContact O-N 2.7Å; N106-N110 WeakPolarHBondContact O-CB 3.48Å; N106-N110 PolarHBondContact O-N 3.27Å; N106-N110 PolarHBondContact O-ND2 3.14Å; N106-N110 PolarHBondContact O-OD1 3.45Å
107	S	57.2	Low	49.2	Very low	59 Å²	59	127.3 Å²	127.3	41%	0.413	66%	0.66	S	S	.	*	H	α-helix	trans	-61.8	-44.3	177.3	-165.5	0	0	0	0	112.6	R104 G105 N110 T111	R104-S107 PolarHBondContact O-N 3.36Å; G105-S107 PolarHBondContact O-N 3.5Å; S107-N110 PolarHBondContact O-N 3.31Å; S107-T111 WeakPolarHBondContact O-CG2 3.41Å; S107-T111 PolarHBondContact O-N 3.12Å; S107-T111 PolarHBondContact O-OG1 3.12Å
108	M	46.5	Very low	49.7	Very low	160 Å²	160	125.8 Å²	125.8	79%	0.788	66%	0.664	S	S	*	*	H	α-helix	trans	-70.7	-32.7	176.2	-77.9	-80.4	-72.3	0	0	112.9	N106 T111 A112	N106-M108 PolarHBondContact O-N 2.98Å; M108-T111 WeakPolarHBondContact CA-OG1 3.39Å; M108-T111 PolarHBondContact O-OG1 3.12Å; M108-A112 VanDerWaalsContact O-CB 3.25Å; M108-A112 WeakPolarHBondContact O-CB 3.36Å; M108-A112 PolarHBondContact O-N 3.49Å
109	A	58.4	Low	49.8	Very low	52 Å²	52	126.5 Å²	126.5	43%	0.43	67%	0.671	S	S	.	*	H	α-helix	trans	-72.5	-33.6	176.1	0	0	0	0	0	111.6	N106 S113	N106-A109 HydrophobicContact CB-CB 4.4Å; N106-A109 PolarHBondContact O-N 2.7Å; A109-S113 VanDerWaalsContact O-CB 3.28Å; A109-S113 WeakPolarHBondContact O-CB 3.5Å; A109-S113 PolarHBondContact O-N 3.33Å; A109-S113 PolarHBondContact O-OG 3.47Å
110	N	62.4	Low	50	Low	99 Å²	99	121.1 Å²	121.1	53%	0.529	67%	0.667	S	S	.	*	H	α-helix	trans	-73.5	-35.6	176.6	-68.4	-13.5	0	0	0	111.8	N106 S107 S113 S114	N106-N110 WeakPolarHBondContact O-CB 3.48Å; N106-N110 PolarHBondContact O-N 3.27Å; N106-N110 PolarHBondContact O-ND2 3.14Å; N106-N110 PolarHBondContact O-OD1 3.45Å; S107-N110 PolarHBondContact O-N 3.31Å; N110-S113 VanDerWaalsContact CA-OG 3.3Å; N110-S113 WeakPolarHBondContact CA-OG 3.41Å; N110-S113 PolarHBondContact O-OG 3.09Å; N110-S113 VanDerWaalsContact O-OG 3.12Å; N110-S114 WeakPolarHBondContact O-CB 3.26Å; N110-S114 PolarHBondContact O-N 2.95Å; N110-S114 PolarHBondContact O-OG 3.46Å
111	T	62.4	Low	49.9	Very low	65 Å²	65	122.4 Å²	122.4	40%	0.399	67%	0.669	S	S	.	*	H	α-helix	trans	-73.1	-39.2	172.7	53.3	0	0	0	0	111.9	S107 M108 S113 S114 L115	S107-T111 WeakPolarHBondContact O-CG2 3.41Å; S107-T111 PolarHBondContact O-N 3.12Å; S107-T111 PolarHBondContact O-OG1 3.12Å; M108-T111 WeakPolarHBondContact CA-OG1 3.39Å; M108-T111 PolarHBondContact O-OG1 3.12Å; T111-S113 VanDerWaalsContact C-N 3.34Å; T111-S113 PolarHBondContact O-N 3.45Å; T111-S114 PolarHBondContact O-N 3.04Å; T111-S114 PolarHBondContact O-OG 3.08Å; T111-L115 WeakPolarHBondContact O-CB 3.43Å; T111-L115 WeakPolarHBondContact O-CD1 3.16Å; T111-L115 WeakPolarHBondContact O-CG 3.44Å; T111-L115 PolarHBondContact O-N 2.95Å
112	A	51	Low	49.3	Very low	59 Å²	59	119.6 Å²	119.6	49%	0.488	67%	0.672	S	S	.	*	H	α-helix	trans	-63.4	-39.4	173.3	0	0	0	0	0	112.2	M108 A116	M108-A112 VanDerWaalsContact O-CB 3.25Å; M108-A112 WeakPolarHBondContact O-CB 3.36Å; M108-A112 PolarHBondContact O-N 3.49Å; A112-A116 WeakPolarHBondContact O-CB 3.31Å; A112-A116 PolarHBondContact O-N 3.14Å; A112-A116 VanDerWaalsContact O-N 3.07Å
113	S	58.5	Low	48.9	Very low	60 Å²	60	118.9 Å²	118.9	42%	0.42	67%	0.673	S	S	.	*	H	α-helix	trans	-76.7	-25.7	177.5	55.6	0	0	0	0	113.9	A109 N110 T111	A109-S113 VanDerWaalsContact O-CB 3.28Å; A109-S113 WeakPolarHBondContact O-CB 3.5Å; A109-S113 PolarHBondContact O-N 3.33Å; A109-S113 PolarHBondContact O-OG 3.47Å; N110-S113 VanDerWaalsContact CA-OG 3.3Å; N110-S113 WeakPolarHBondContact CA-OG 3.41Å; N110-S113 PolarHBondContact O-OG 3.09Å; N110-S113 VanDerWaalsContact O-OG 3.12Å; T111-S113 VanDerWaalsContact C-N 3.34Å; T111-S113 PolarHBondContact O-N 3.45Å
114	S	60.4	Low	48.4	Very low	72 Å²	72	113 Å²	113	50%	0.503	67%	0.668	S	S	.	*	H	α-helix	trans	-73.4	-37.7	170.6	70	0	0	0	0	111.9	N110 T111 A116	N110-S114 WeakPolarHBondContact O-CB 3.26Å; N110-S114 PolarHBondContact O-N 2.95Å; N110-S114 PolarHBondContact O-OG 3.46Å; T111-S114 PolarHBondContact O-N 3.04Å; T111-S114 PolarHBondContact O-OG 3.08Å; S114-A116 VanDerWaalsContact C-N 3.34Å
115	L	60.9	Low	47.6	Very low	150 Å²	150	111.2 Å²	111.2	79%	0.785	67%	0.674	S	S	*	*	H	α-helix	trans	-71.5	-25.7	175.9	-76	162.2	0	0	0	113.2	T111 R117	T111-L115 WeakPolarHBondContact O-CB 3.43Å; T111-L115 WeakPolarHBondContact O-CD1 3.16Å; T111-L115 WeakPolarHBondContact O-CG 3.44Å; T111-L115 PolarHBondContact O-N 2.95Å; L115-R117 VanDerWaalsContact C-N 3.33Å; L115-R117 PolarHBondContact O-N 3.41Å
116	A	48.6	Very low	46.8	Very low	76 Å²	76	111.5 Å²	111.5	63%	0.628	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-1.8	178.7	0	0	0	0	0	114.7	A112 S114 T118	A112-A116 WeakPolarHBondContact O-CB 3.31Å; A112-A116 PolarHBondContact O-N 3.14Å; A112-A116 VanDerWaalsContact O-N 3.07Å; S114-A116 VanDerWaalsContact C-N 3.34Å; A116-T118 PolarHBondContact O-N 3.41Å
117	R	48.9	Very low	45.7	Very low	217 Å²	217	112.6 Å²	112.6	82%	0.819	69%	0.69	S	S	*	*			trans	-83.6	96	179.7	-75.3	-177.4	177.8	-173.3	0	111.7	L115	L115-R117 VanDerWaalsContact C-N 3.33Å; L115-R117 PolarHBondContact O-N 3.41Å
118	T	46	Very low	44.3	Very low	125 Å²	125	114.5 Å²	114.5	77%	0.767	71%	0.709	S	S	*	*			trans	-85.6	154.4	155.2	48.2	0	0	0	0	109.9	A116 G120	A116-T118 PolarHBondContact O-N 3.41Å; T118-G120 PolarHBondContact O-N 3.32Å; T118-G120 VanDerWaalsContact O-N 3.09Å
119	P	39.7	Very low	43.5	Very low	140 Å²	140	115.8 Å²	115.8	91%	0.909	71%	0.713	S	S	*	*	S	Bend	trans	-78.1	104	-169.4	31	-31.3	0	0	0	110.3
120	G	39	Very low	42.5	Very low	68 Å²	68	119.4 Å²	119.4	70%	0.701	73%	0.733	S	S	*	*	S	Bend	trans	161.7	104.1	168.4	0	0	0	0	0	113.8	T118	T118-G120 PolarHBondContact O-N 3.32Å; T118-G120 VanDerWaalsContact O-N 3.09Å
121	K	35.8	Very low	40.9	Very low	212 Å²	212	120.7 Å²	120.7	92%	0.922	75%	0.748	S	S	*	*			trans	82.9	112.6	167.1	-106.1	162.2	178.6	171.3	0	117.9
122	S	30	Very low	39.2	Very low	122 Å²	122	123.9 Å²	123.9	85%	0.853	77%	0.768	S	S	*	*			trans	-85.7	135.3	170.7	51.9	0	0	0	0	111.8
123	V	31.5	Very low	38.5	Very low	135 Å²	135	127 Å²	127	82%	0.818	78%	0.783	S	S	*	*			trans	-127.1	128.9	164.6	-177.7	0	0	0	0	108.2
124	S	30	Very low	37	Very low	115 Å²	115	130.8 Å²	130.8	80%	0.804	80%	0.804	S	S	*	*			trans	-95.6	133.9	179.1	53.4	0	0	0	0	111.3
125	L	31.3	Very low	35.5	Very low	171 Å²	171	138.8 Å²	138.8	90%	0.895	82%	0.823	S	S	*	*			trans	-125.6	128.8	167.4	-69	172.9	0	0	0	109.3
126	G	29.8	Very low	34	Very low	71 Å²	71	137.9 Å²	137.9	73%	0.732	82%	0.823	S	S	*	*			trans	-87.1	169.8	178.4	0	0	0	0	0	113.5
127	P	31.2	Very low	33	Very low	137 Å²	137	137.7 Å²	137.7	89%	0.89	83%	0.829	S	S	*	*			trans	-89.3	135.5	-165.1	34.2	-31.1	0	0	0	112.7
128	A	28.4	Very low	32.1	Very low	99 Å²	99	138.3 Å²	138.3	82%	0.818	83%	0.831	S	S	*	*			trans	-138.2	129	162.7	0	0	0	0	0	109.4
129	E	30.1	Very low	31.3	Very low	186 Å²	186	140.1 Å²	140.1	87%	0.869	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-72.7	150.9	-178.4	-62.6	-179	153.2	0	0	112.8
130	P	36.8	Very low	30.8	Very low	129 Å²	129	141.6 Å²	141.6	84%	0.838	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-99.2	123.2	170.2	33.1	-26.2	0	0	0	112.8
131	C	27.7	Very low	30.4	Very low	125 Å²	125	148.2 Å²	148.2	85%	0.845	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-90	128	164.5	-76.5	0	0	0	0	111.1
132	T	28.3	Very low	30.1	Very low	133 Å²	133	141.4 Å²	141.4	82%	0.816	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-73.9	155.2	164.8	43.4	0	0	0	0	112
133	P	34.5	Very low	30.1	Very low	124 Å²	124	144 Å²	144	81%	0.805	82%	0.823	S	S	*	*			trans	-129	130.3	140.8	33.3	-20.3	0	0	0	113.2
134	T	28.8	Very low	30.1	Very low	140 Å²	140	143.9 Å²	143.9	86%	0.859	82%	0.817	S	S	*	*			trans	-65	142.4	162.3	5.9	0	0	0	0	111.2
135	R	28.7	Very low	30	Very low	239 Å²	239	149.8 Å²	149.8	90%	0.902	82%	0.821	S	S	*	*			trans	-154.1	137.3	145.8	-138.1	174.2	78.7	177.2	2.9	114
136	T	27.9	Very low	29.9	Very low	131 Å²	131	148.1 Å²	148.1	80%	0.804	82%	0.818	S	S	*	*			trans	-71	157.8	178.5	44	0	0	0	0	114
137	G	28.2	Very low	30.4	Very low	72 Å²	72	150.1 Å²	150.1	74%	0.742	82%	0.819	S	S	*	*				103.8	105.1	129.1	0	0	0	0	0	120.1
138	R	29.9	Very low	30.5	Very low	230 Å²	230	152.3 Å²	152.3	87%	0.868	82%	0.817	S	S	*	*				75.3	127.1	128.8	-94.8	179.6	174.1	-178.8	1.5	122.7
139	H	28.8	Very low	30.5	Very low	164 Å²	164	158.1 Å²	158.1	76%	0.759	82%	0.818	S	S	*	*			trans	95.9	144	138.2	-77.4	-63	0	0	0	122.6
140	H	30.9	Very low	30.5	Very low	171 Å²	171	157.1 Å²	157.1	79%	0.792	82%	0.816	S	S	*	*			trans	-97.7	163.1	-160.3	-100.1	-26.2	0	0	0	113.9
141	K	30.6	Very low	30.5	Very low	207 Å²	207	159.3 Å²	159.3	90%	0.9	81%	0.813	S	S	*	*			trans	86.7	136.6	141	-87.7	177.9	175.9	-176.7	0	120.9
142	G	28.1	Very low	30.6	Very low	69 Å²	69	163.3 Å²	163.3	71%	0.711	82%	0.816	S	S	*	*			trans	121.4	75.1	155	0	0	0	0	0	114.2
143	E	30.6	Very low	30.7	Very low	175 Å²	175	163.1 Å²	163.1	82%	0.818	81%	0.814	S	S	*	*				66.5	117.8	97.2	-85.4	-165.9	162.4	0	0	118.5
144	I	30.4	Very low	30.5	Very low	134 Å²	134	168.6 Å²	168.6	69%	0.687	82%	0.819	S	S	*	*			trans	65.3	116.6	136.5	-46.8	161.3	0	0	0	119
145	R	29.8	Very low	30.4	Very low	239 Å²	239	171.3 Å²	171.3	90%	0.902	82%	0.819	S	S	*	*				174.2	117.9	122.1	-94.8	169.4	177.3	-168.9	-1.8	112.5
146	T	29.2	Very low	30.6	Very low	135 Å²	135	166.5 Å²	166.5	83%	0.828	82%	0.816	S	S	*	*			trans	-78.1	151.6	155.8	49.3	0	0	0	0	109.8
147	P	40	Very low	30.9	Very low	114 Å²	114	164.7 Å²	164.7	74%	0.74	81%	0.809	S	S	*	*				-153.2	158.7	89	34.2	-12.4	0	0	0	118.1
148	Q	32	Very low	31.1	Very low	182 Å²	182	166.9 Å²	166.9	85%	0.85	81%	0.808	S	S	*	*			trans	61.9	101.4	141.5	-66.7	-177.3	2.3	0	0	123.2
149	R	29	Very low	31.3	Very low	221 Å²	221	161.8 Å²	161.8	83%	0.834	80%	0.803	S	S	*	*				45.7	96.9	112.3	-150.4	179.8	-175.2	-168.7	2.2	119.3
150	I	31.3	Very low	32.1	Very low	165 Å²	165	159.6 Å²	159.6	85%	0.846	80%	0.803	S	S	*	*			trans	-133.3	123.1	148.7	-64	179.5	0	0	0	109.3
151	K	35.7	Very low	32.1	Very low	175 Å²	175	158.8 Å²	158.8	76%	0.761	80%	0.799	S	S	*	*			trans	-67.8	139.1	175.1	-70.3	172.5	174.4	176.5	0	110.5
152	K	29.7	Very low	32.1	Very low	210 Å²	210	157.1 Å²	157.1	91%	0.913	79%	0.787	S	S	*	*			trans	-155.8	142.4	144.4	-107.8	165.1	-169.5	-176.3	0	112.2
153	V	29.8	Very low	32.4	Very low	129 Å²	129	162.5 Å²	162.5	78%	0.782	80%	0.799	S	S	*	*			trans	-76.9	142.9	-159.7	165.7	0	0	0	0	113.2	F155	V153-F155 HydrophobicContact CG1-CD2 4.16Å
154	R	30.9	Very low	32.6	Very low	238 Å²	238	163 Å²	163	90%	0.898	79%	0.793	S	S	*	*			trans	-64.7	135.2	161.5	-83	177.9	166.9	173.9	-4.4	110.3
155	F	26	Very low	32.8	Very low	198 Å²	198	164.2 Å²	164.2	87%	0.868	79%	0.794	S	S	*	*			trans	-160.7	126.5	142.1	-104	-76.6	0	0	0	109.7	V153	V153-F155 HydrophobicContact CG1-CD2 4.16Å
156	V	34.4	Very low	32.9	Very low	137 Å²	137	162.1 Å²	162.1	83%	0.83	79%	0.786	S	S	*	*			trans	-101	122.8	170.3	175.4	0	0	0	0	107.4
157	S	33.4	Very low	33	Very low	94 Å²	94	162.3 Å²	162.3	66%	0.657	78%	0.781	S	S	*	*			trans	-63	121.6	172	46.6	0	0	0	0	111.4
158	T	31.7	Very low	32.5	Very low	117 Å²	117	163.1 Å²	163.1	72%	0.718	78%	0.784	S	S	*	*				50.5	123.2	87.2	63	0	0	0	0	112.5
159	T	35.2	Very low	32.5	Very low	124 Å²	124	160.6 Å²	160.6	76%	0.761	78%	0.781	S	S	*	*			cis	165.5	-171.4	41.3	19.7	0	0	0	0	107.3
160	P	46.1	Very low	33	Very low	118 Å²	118	155.6 Å²	155.6	77%	0.766	78%	0.777	S	S	*	*			cis	-136.3	170.7	-17.8	21.7	3.5	0	0	0	116.2
161	H	29.3	Very low	32.9	Very low	153 Å²	153	152.6 Å²	152.6	71%	0.708	77%	0.771	S	S	*	*			trans	-62.3	154.4	167.7	-172.2	-0.9	0	0	0	115.2
162	R	32.3	Very low	32.6	Very low	172 Å²	172	151 Å²	151	65%	0.649	77%	0.77	S	S	*	*				115.7	120.6	121.8	-143.8	165.9	-153.3	-171.5	6.1	118.3
163	L	33.3	Very low	32.7	Very low	183 Å²	183	152 Å²	152	96%	0.958	77%	0.768	S	S	*	*			trans	-150	145	133.4	-98.9	166.8	0	0	0	109.3
164	R	34.2	Very low	32.6	Very low	184 Å²	184	151 Å²	151	69%	0.694	77%	0.767	S	S	*	*			trans	-136.2	160.1	-156.1	-172.1	-170.2	-177.6	168.7	2.8	110
165	K	36.1	Very low	32.5	Very low	161 Å²	161	147.8 Å²	147.8	70%	0.7	77%	0.767	S	S	*	*			trans	106.7	140.1	151.2	-64.7	-173.2	175.8	175.6	0	114.7
166	R	31.8	Very low	32.6	Very low	195 Å²	195	143.4 Å²	143.4	74%	0.736	76%	0.761	S	S	*	*			cis	-173.8	158.8	5.8	-126.1	-177.4	162.7	-179.4	-6.3	112.4
167	L	31	Very low	32.4	Very low	138 Å²	138	144 Å²	144	72%	0.723	76%	0.76	S	S	*	*			trans	80.1	131	148.8	-64.8	159.7	0	0	0	118
168	T	29.2	Very low	32.4	Very low	131 Å²	131	145.4 Å²	145.4	80%	0.804	77%	0.769	S	S	*	*			cis	-159	163.2	37.7	32.9	0	0	0	0	112.6
169	T	32.8	Very low	32.4	Very low	130 Å²	130	149.2 Å²	149.2	80%	0.798	78%	0.779	S	S	*	*			trans	-93.1	-169.5	-167.1	52.3	0	0	0	0	115.1
170	P	39.5	Very low	32.3	Very low	116 Å²	116	151.1 Å²	151.1	75%	0.753	78%	0.784	S	S	*	*			cis	-134.7	175.9	-14.7	28	-4.1	0	0	0	116.7
171	S	27.8	Very low	31.6	Very low	101 Å²	101	151.1 Å²	151.1	71%	0.706	79%	0.787	S	S	*	*			trans	114.2	123.7	139.7	109.7	0	0	0	0	120
172	L	30.9	Very low	31.9	Very low	143 Å²	143	149.3 Å²	149.3	75%	0.749	79%	0.788	S	S	*	*			trans	82.9	111.5	142.6	-65.3	173	0	0	0	121.6
173	R	30.7	Very low	31.7	Very low	230 Å²	230	146.3 Å²	146.3	87%	0.868	79%	0.794	S	S	*	*			trans	95.6	135	140.1	-66.5	-180	179.6	-174.1	-0.1	118.1
174	S	27.7	Very low	31.5	Very low	108 Å²	108	145.2 Å²	145.2	76%	0.755	79%	0.789	S	S	*	*			trans	-100.4	116.8	-169.8	169.5	0	0	0	0	106.7
175	D	28.3	Very low	31.4	Very low	170 Å²	170	140.6 Å²	140.6	91%	0.909	79%	0.785	S	S	*	*			trans	-96.2	111.7	169.1	-72.4	-28.7	0	0	0	108.3
176	S	28.4	Very low	31.2	Very low	107 Å²	107	142.3 Å²	142.3	75%	0.748	80%	0.796	S	S	*	*			trans	-109.6	138.8	171.7	-175.3	0	0	0	0	107.7
177	D	31.4	Very low	31.4	Very low	150 Å²	150	141.5 Å²	141.5	80%	0.802	80%	0.8	S	S	*	*			trans	-45.7	137.9	174.7	-60.2	-49	0	0	0	114
178	S	32.5	Very low	31.4	Very low	122 Å²	122	142.4 Å²	142.4	85%	0.853	81%	0.806	S	S	*	*				164.7	143.1	125.3	46	0	0	0	0	112.1
179	E	32.6	Very low	31.4	Very low	198 Å²	198	139.7 Å²	139.7	93%	0.925	80%	0.804	S	S	*	*			trans	-77.2	161.8	-172.5	-64.6	-178.1	151.6	0	0	113.6
180	L	32.4	Very low	31.4	Very low	164 Å²	164	142.7 Å²	142.7	86%	0.859	81%	0.809	S	S	*	*			trans	-76.9	144.5	-159.9	-65.5	153.9	0	0	0	115
181	S	32.4	Very low	30.9	Very low	118 Å²	118	147 Å²	147	83%	0.825	82%	0.819	S	S	*	*			trans	-132.2	147.6	137.5	-68.1	0	0	0	0	107.3
182	P	35	Very low	31.1	Very low	114 Å²	114	150.9 Å²	150.9	74%	0.74	83%	0.826	S	S	*	*				-145.7	141.2	104.7	34.6	-17.1	0	0	0	112.2
183	S	27.9	Very low	31.1	Very low	110 Å²	110	152.5 Å²	152.5	77%	0.769	83%	0.829	S	S	*	*				53.1	109.2	77.6	-158.6	0	0	0	0	114.2
184	D	28.5	Very low	31	Very low	160 Å²	160	149.2 Å²	149.2	86%	0.856	82%	0.824	S	S	*	*			trans	-153.4	146.6	139.4	-154.9	10.2	0	0	0	110.6
185	S	33.2	Very low	31	Very low	87 Å²	87	151.4 Å²	151.4	61%	0.608	83%	0.827	S	S	*	*			trans	-149.6	128.6	-154.8	39.7	0	0	0	0	107.2
186	E	32.1	Very low	31.1	Very low	197 Å²	197	151.7 Å²	151.7	92%	0.921	82%	0.823	S	S	*	*			trans	-149.6	126.7	150.6	-71.5	-151.2	164.7	0	0	110.8
187	E	34	Very low	31.1	Very low	177 Å²	177	154.8 Å²	154.8	83%	0.827	83%	0.826	S	S	*	*			trans	-62.8	163.2	154.9	-71	164.9	138.7	0	0	109
188	D	32.4	Very low	30.9	Very low	158 Å²	158	156.3 Å²	156.3	85%	0.845	83%	0.828	S	S	*	*			cis	-179.3	162.8	43.7	-133.7	-13.3	0	0	0	109.5
189	G	28.8	Very low	30.8	Very low	74 Å²	74	158.4 Å²	158.4	76%	0.763	83%	0.83	S	S	*	*			trans	121.7	97.9	147.4	0	0	0	0	0	119.5
190	E	33.1	Very low	30.8	Very low	193 Å²	193	160.2 Å²	160.2	90%	0.902	83%	0.828	S	S	*	*			trans	-101.5	133.5	151.9	-67.4	-179.6	169.3	0	0	108.5
191	E	28.8	Very low	30.8	Very low	205 Å²	205	160.2 Å²	160.2	96%	0.958	83%	0.828	S	S	*	*			trans	-160.4	151.4	148.1	-87.2	-165.8	-179.7	0	0	110.1
192	E	32.6	Very low	30.8	Very low	183 Å²	183	164.7 Å²	164.7	86%	0.855	83%	0.833	S	S	*	*			trans	-94	158.2	-168	-64.7	179.8	153.9	0	0	115.3
193	E	31.1	Very low	30.5	Very low	177 Å²	177	167.1 Å²	167.1	83%	0.827	83%	0.834	S	S	*	*			trans	63.5	149.5	149.4	-57.6	-127.7	162.4	0	0	125.1
194	E	28.8	Very low	30.5	Very low	162 Å²	162	171.4 Å²	171.4	76%	0.757	84%	0.839	S	S	*	*			trans	78.9	99.7	166.6	-59.7	-175.3	176.9	0	0	119.4
195	D	26.7	Very low	30.6	Very low	154 Å²	154	172.3 Å²	172.3	82%	0.824	84%	0.843	S	S	*	*				166.7	147.2	93	-96.3	-25.9	0	0	0	113.9
196	E	31.1	Very low	30.3	Very low	175 Å²	175	175.4 Å²	175.4	82%	0.818	85%	0.845	S	S	*	*			trans	-67.5	165.1	-179.1	-58.5	176.5	147.8	0	0	113.5
197	E	27.4	Very low	30.3	Very low	172 Å²	172	172.4 Å²	172.4	80%	0.804	83%	0.834	S	S	*	*			trans	93.7	94.3	168.9	-54.7	-70.8	171.7	0	0	117.7
198	E	28.4	Very low	29.9	Very low	182 Å²	182	171.3 Å²	171.3	85%	0.85	83%	0.834	S	S	*	*				174.7	67.1	113	-94.9	-165.2	160.9	0	0	111.3	R200	E198-R200 PolarHBondContact O-N 3.48Å
199	D	30.2	Very low	29.7	Very low	167 Å²	167	173.4 Å²	173.4	89%	0.893	84%	0.836	S	S	*	*			trans	-92.1	72.5	170.3	-140.3	2.9	0	0	0	109.4
200	R	33	Very low	29.5	Very low	236 Å²	236	179 Å²	179	89%	0.891	84%	0.842	S	S	*	*			trans	-147.7	18.6	-178.9	-92.4	-152.3	174.9	-165.3	0.9	119.5	E198	E198-R200 PolarHBondContact O-N 3.48Å
201	L	30.9	Very low	29.1	Very low	164 Å²	164	178.9 Å²	178.9	86%	0.859	84%	0.841	S	S	*	*	S	Bend	trans	-133.3	7.4	-177.9	-91.4	164.7	0	0	0	119.3
202	K	32.1	Very low	29.1	Very low	212 Å²	212	178.7 Å²	178.7	92%	0.922	84%	0.837	S	S	*	*	S	Bend	trans	-133.4	27.8	-178.7	-69.4	-173.3	-178.4	171.5	0	117.5
203	E	29.1	Very low	28.7	Very low	164 Å²	164	179 Å²	179	77%	0.766	84%	0.839	S	S	*	*	S	Bend	trans	-122.9	15.6	173.1	-135.4	-165.7	163.6	0	0	116.1
204	K	29.3	Very low	28.5	Very low	200 Å²	200	177.8 Å²	177.8	87%	0.87	84%	0.836	S	S	*	*	S	Bend	trans	-125.4	71.3	171.9	-76.1	-175.7	178.1	175.9	0	111.7
205	L	30.4	Very low	28.5	Very low	179 Å²	179	178 Å²	178	94%	0.937	84%	0.837	S	S	*	*			trans	-162.3	53.9	146.4	-93.1	176.5	0	0	0	108.2
206	K	27.1	Very low	28.4	Very low	153 Å²	153	180.8 Å²	180.8	67%	0.665	84%	0.842	S	S	*	*			trans	-56.5	152.2	157.9	-120	173.1	179.1	168.4	0	108.7
207	I	32	Very low	28.1	Very low	134 Å²	134	178.4 Å²	178.4	69%	0.687	84%	0.835	S	S	*	*			trans	70.4	90.6	143.3	-54.4	159.2	0	0	0	113.9
208	N	25.1	Very low	28	Very low	153 Å²	153	180.5 Å²	180.5	82%	0.818	84%	0.837	S	S	*	*			trans	-176	114.9	138.7	-93.5	-25.7	0	0	0	109.8
209	K	27.6	Very low	27.8	Very low	203 Å²	203	183.5 Å²	183.5	88%	0.883	84%	0.84	S	S	*	*			trans	125.4	50	161	-67.7	173.2	177	179.8	0	115
210	E	24.1	Very low	27.5	Very low	190 Å²	190	182 Å²	182	89%	0.888	84%	0.837	S	S	*	*			trans	-117.4	151.5	135	-72.9	-174.3	163.3	0	0	106.6
211	E	25.8	Very low	27.4	Very low	191 Å²	191	177 Å²	177	89%	0.893	84%	0.835	S	S	*	*			trans	88.8	80	-169.2	-55.2	-173.5	179.6	0	0	116.4
212	K	28	Very low	27.1	Very low	202 Å²	202	174 Å²	174	88%	0.878	83%	0.828	S	S	*	*				-176.9	111.6	125.6	-98.7	167.7	-171.5	-177.8	0	110.4
213	E	25.4	Very low	26.9	Very low	190 Å²	190	174 Å²	174	89%	0.888	83%	0.828	S	S	*	*				141.9	97.2	129.6	-68.9	-145.2	156	0	0	112.5
214	I	26.5	Very low	26.9	Very low	150 Å²	150	169.4 Å²	169.4	77%	0.769	83%	0.825	S	S	*	*			trans	-101.1	131.6	157.4	-62.7	175.6	0	0	0	106.6
215	H	27.8	Very low	26.8	Very low	168 Å²	168	165.1 Å²	165.1	78%	0.778	82%	0.82	S	S	*	*			trans	86.1	101.3	166.3	-63.4	-41.1	0	0	0	121.1
216	K	26.2	Very low	26.6	Very low	212 Å²	212	162 Å²	162	92%	0.922	81%	0.814	S	S	*	*				-162.2	145.7	123.3	-105.7	169.2	-173.2	176.7	0	111.5
217	N	24.3	Very low	26.7	Very low	125 Å²	125	159.7 Å²	159.7	67%	0.668	82%	0.823	S	S	*	*			trans	-92.8	166.6	-160.5	-63	-32.6	0	0	0	115.7
218	Y	25	Very low	26.6	Very low	216 Å²	216	157.5 Å²	157.5	85%	0.847	83%	0.825	S	S	*	*			trans	65.3	104.8	152	-60.3	-66.8	0	0	0	120.4
219	R	23.4	Very low	26.8	Very low	244 Å²	244	158.3 Å²	158.3	92%	0.921	83%	0.828	S	S	*	*				168.7	140.5	110.8	-96.9	179	171.7	178.3	-1.9	111.2
220	T	24	Very low	27	Very low	135 Å²	135	158.1 Å²	158.1	83%	0.828	83%	0.828	S	S	*	*			trans	-50.1	153.7	173	48.4	0	0	0	0	114
221	P	30.8	Very low	27.3	Very low	131 Å²	131	158.7 Å²	158.7	85%	0.851	83%	0.827	S	S	*	*				-132.3	159.8	121.8	22.8	-3.7	0	0	0	114.7
222	S	25.5	Very low	27.7	Very low	102 Å²	102	155.4 Å²	155.4	71%	0.713	82%	0.82	S	S	*	*			trans	-88.8	155	-163.9	54	0	0	0	0	115.4
223	K	28.5	Very low	27.8	Very low	211 Å²	211	152.1 Å²	152.1	92%	0.917	82%	0.819	S	S	*	*			trans	56.4	119.7	140.4	-72.4	179.5	177.1	179.4	0	119.2
224	G	27.3	Very low	28.1	Very low	68 Å²	68	147.3 Å²	147.3	70%	0.701	81%	0.812	S	S	*	*			trans	-176.5	85.6	157.6	0	0	0	0	0	112.8
225	S	27.5	Very low	28.6	Very low	110 Å²	110	150.1 Å²	150.1	77%	0.769	82%	0.819	S	S	*	*			trans	24.7	107.4	151.3	53.2	0	0	0	0	119.5
226	S	27.4	Very low	29	Very low	115 Å²	115	151.9 Å²	151.9	80%	0.804	82%	0.824	S	S	*	*				74.8	108.5	80.4	69.9	0	0	0	0	116.4
227	A	27.8	Very low	29.2	Very low	103 Å²	103	146.7 Å²	146.7	85%	0.851	82%	0.815	S	S	*	*			trans	-171.3	137.7	138.6	0	0	0	0	0	111.6
228	A	29.6	Very low	30.3	Very low	88 Å²	88	150.2 Å²	150.2	73%	0.727	82%	0.824	S	S	*	*			trans	76.8	63.2	162.5	0	0	0	0	0	119.8
229	L	30.6	Very low	30.9	Very low	171 Å²	171	147.2 Å²	147.2	90%	0.895	82%	0.823	S	S	*	*			trans	-84.6	105.3	151.1	-80.8	163.5	0	0	0	109.2	K231	L229-K231 PolarHBondContact O-N 2.9Å
230	F	30.6	Very low	31.2	Very low	199 Å²	199	141.3 Å²	141.3	87%	0.873	81%	0.814	S	S	*	*			trans	-71.1	120.1	161.3	-77	-84.2	0	0	0	108.8	T232	F230-T232 PolarHBondContact O-N 3.46Å
231	K	31.2	Very low	31.8	Very low	202 Å²	202	140.8 Å²	140.8	88%	0.878	81%	0.813	S	S	*	*			trans	-74.9	115.3	-177.1	-68.8	175.1	177.4	176.6	0	110.5	L229	L229-K231 PolarHBondContact O-N 2.9Å
232	T	33.7	Very low	32	Very low	122 Å²	122	143 Å²	143	75%	0.748	81%	0.812	S	S	*	*			trans	-65.9	141.4	151.6	49.3	0	0	0	0	109.3	F230 A234	F230-T232 PolarHBondContact O-N 3.46Å; T232-A234 PolarHBondContact O-N 3.11Å; T232-A234 VanDerWaalsContact O-N 3.1Å
233	P	30.7	Very low	32.8	Very low	132 Å²	132	143.3 Å²	143.3	86%	0.857	81%	0.812	S	S	*	*			trans	-65.6	115.8	176.7	25.7	-30.5	0	0	0	109.7
234	A	31	Very low	33.8	Very low	89 Å²	89	140.1 Å²	140.1	74%	0.736	81%	0.81	S	S	*	*			trans	-69.5	141.7	177.9	0	0	0	0	0	111.2	T232 K236	T232-A234 PolarHBondContact O-N 3.11Å; T232-A234 VanDerWaalsContact O-N 3.1Å; A234-K236 PolarHBondContact O-N 2.92Å
235	K	38.2	Very low	34.9	Very low	209 Å²	209	143.4 Å²	143.4	91%	0.909	81%	0.811	S	S	*	*			trans	-37.2	119.7	161.4	-83.5	176.2	168.3	178.1	0	110.2	S237	K235-S237 PolarHBondContact O-N 3.15Å
236	K	35.3	Very low	35.9	Very low	205 Å²	205	146.8 Å²	146.8	89%	0.891	82%	0.815	S	S	*	*			trans	-61	126.8	169.3	-78.6	-176.9	177.4	176.8	0	108.9	A234	A234-K236 PolarHBondContact O-N 2.92Å
237	S	30.5	Very low	37	Very low	104 Å²	104	144 Å²	144	73%	0.727	79%	0.794	S	S	*	*			trans	-61.9	130.9	172.5	54.4	0	0	0	0	110.4	K235 N239	K235-S237 PolarHBondContact O-N 3.15Å; S237-N239 PolarHBondContact O-N 3.17Å
238	K	46.9	Very low	38.8	Very low	198 Å²	198	141.5 Å²	141.5	86%	0.861	77%	0.773	S	S	*	*	S	Bend	trans	-51.6	99.9	163.1	-166.4	176	-172.8	177.6	0	108.9
239	N	37.5	Very low	40.8	Very low	153 Å²	153	144.7 Å²	144.7	82%	0.818	78%	0.775	S	S	*	*			trans	171.8	72.5	157.9	-85.2	-10.6	0	0	0	109.4	S237	S237-N239 PolarHBondContact O-N 3.17Å
240	T	31.1	Very low	43.1	Very low	120 Å²	120	140.6 Å²	140.6	74%	0.736	76%	0.757	S	S	*	*	S	Bend	trans	-138.8	133.8	161.3	42.2	0	0	0	0	106.4	E242	T240-E242 PolarHBondContact O-N 3.28Å
241	P	37	Very low	45.6	Very low	125 Å²	125	136.3 Å²	136.3	81%	0.812	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-56.7	134.6	177.4	24.6	-32	0	0	0	109.1
242	E	34	Very low	48	Very low	176 Å²	176	131.2 Å²	131.2	82%	0.822	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-48.5	124.1	180	-69.9	177.4	156.5	0	0	109.9	T240 V244	T240-E242 PolarHBondContact O-N 3.28Å; E242-V244 PolarHBondContact O-N 3.37Å
243	P	41.3	Very low	50.4	Low	110 Å²	110	132 Å²	132	71%	0.714	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-64.7	120.2	166.8	26.7	-29.3	0	0	0	107.5	N245	P243-N245 PolarHBondContact O-N 3.35Å
244	V	50.8	Low	53	Low	144 Å²	144	132.4 Å²	132.4	87%	0.873	70%	0.698	S	S	*	*	S	Bend	trans	-62.3	2.6	-178.5	174	0	0	0	0	113.7	E242	E242-V244 PolarHBondContact O-N 3.37Å
245	N	49.2	Very low	55.5	Low	136 Å²	136	134.6 Å²	134.6	73%	0.727	69%	0.693	S	S	*	*			trans	-114.2	101.8	170	-76.7	-17.2	0	0	0	108.4	P243	P243-N245 PolarHBondContact O-N 3.35Å
246	Q	49.8	Very low	57.4	Low	182 Å²	182	127.6 Å²	127.6	85%	0.85	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-53.9	124.8	153.1	-70.2	174.6	0.4	0	0	106	A248	Q246-A248 PolarHBondContact O-N 3.13Å; Q246-A248 VanDerWaalsContact O-N 3.15Å
247	P	50.5	Low	59.2	Low	57 Å²	57	124.2 Å²	124.2	37%	0.37	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-53.4	128.6	167.4	25.6	-32.1	0	0	0	105.8	M249 E251 E252	P247-M249 PolarHBondContact O-N 2.76Å; P247-E251 HydrophobicContact CB-CB 4.43Å; P247-E252 HydrophobicContact CB-CG 4.23Å; P247-E252 HydrophobicContact CG-CG 3.97Å; P247-E252 WeakPolarHBondContact CG-OE1 3.3Å
248	A	66.1	Low	61.4	Low	49 Å²	49	122.2 Å²	122.2	41%	0.405	66%	0.657	S	S	.	*	P	Polyproline II helix	trans	-54.9	138.4	177.1	0	0	0	0	0	107.3	Q246 T250 E251 E252	Q246-A248 PolarHBondContact O-N 3.13Å; Q246-A248 VanDerWaalsContact O-N 3.15Å; A248-T250 WeakPolarHBondContact CB-OG1 2.89Å; A248-T250 CarbonylContact O-C 3.55Å; A248-T250 PolarHBondContact O-N 3.43Å; A248-E251 WeakPolarHBondContact O-CA 3.19Å; A248-E251 WeakPolarHBondContact O-CB 3.47Å; A248-E251 PolarHBondContact O-N 2.55Å; A248-E252 PolarHBondContact O-N 3.2Å
249	M	70.8	Confident	62.2	Low	155 Å²	155	115.6 Å²	115.6	76%	0.764	64%	0.635	S	S	*	*	H	α-helix	trans	-45.6	-26.9	178	-69.9	-69.1	-64.7	0	0	113.1	P247 Y253	P247-M249 PolarHBondContact O-N 2.76Å; M249-Y253 PolarHBondContact O-N 3.48Å; M249-Y253 VanDerWaalsContact O-N 3.15Å
250	T	78.7	Confident	63.3	Low	85 Å²	85	114.4 Å²	114.4	52%	0.521	64%	0.639	S	S	.	*	H	α-helix	trans	-66.9	-41.1	173.3	53.6	0	0	0	0	114.2	A248 Y253 F254	A248-T250 WeakPolarHBondContact CB-OG1 2.89Å; A248-T250 CarbonylContact O-C 3.55Å; A248-T250 PolarHBondContact O-N 3.43Å; T250-Y253 WeakPolarHBondContact O-CB 3.49Å; T250-Y253 PolarHBondContact O-N 3.03Å; T250-F254 WeakPolarHBondContact O-CD2 3.47Å; T250-F254 PolarHBondContact O-N 3.44Å
251	E	82.5	Confident	64.5	Low	110 Å²	110	116.8 Å²	116.8	51%	0.514	64%	0.639	S	S	.	*	H	α-helix	trans	-66.4	-42.3	176.9	-68.7	-178.3	165.4	0	0	110.6	P247 A248 Y253 F254 E255	P247-E251 HydrophobicContact CB-CB 4.43Å; A248-E251 WeakPolarHBondContact O-CA 3.19Å; A248-E251 WeakPolarHBondContact O-CB 3.47Å; A248-E251 PolarHBondContact O-N 2.55Å; E251-Y253 VanDerWaalsContact C-N 3.32Å; E251-Y253 PolarHBondContact O-N 3.4Å; E251-F254 PolarHBondContact O-N 3.46Å; E251-E255 WeakPolarHBondContact O-CB 3.17Å; E251-E255 VanDerWaalsContact O-CG 3.29Å; E251-E255 WeakPolarHBondContact O-CG 3.35Å; E251-E255 PolarHBondContact O-N 3.2Å
252	E	81.4	Confident	65.5	Low	95 Å²	95	117.2 Å²	117.2	44%	0.444	63%	0.633	S	S	.	*	H	α-helix	trans	-60.6	-40.4	173.3	-67	-171.9	170.2	0	0	112.2	P247 A248 E255 A256	P247-E252 HydrophobicContact CB-CG 4.23Å; P247-E252 HydrophobicContact CG-CG 3.97Å; P247-E252 WeakPolarHBondContact CG-OE1 3.3Å; A248-E252 PolarHBondContact O-N 3.2Å; E252-E255 PolarHBondContact O-N 3.33Å; E252-A256 VanDerWaalsContact O-CB 3.26Å; E252-A256 WeakPolarHBondContact O-CB 3.45Å; E252-A256 PolarHBondContact O-N 2.93Å
253	Y	85.4	Confident	66.3	Low	137 Å²	137	116.7 Å²	116.7	54%	0.537	64%	0.635	S	S	.	*	H	α-helix	trans	-60.4	-48	173.9	177.4	-92.2	0	0	0	111.7	M249 T250 E251 A256 H257	M249-Y253 PolarHBondContact O-N 3.48Å; M249-Y253 VanDerWaalsContact O-N 3.15Å; T250-Y253 WeakPolarHBondContact O-CB 3.49Å; T250-Y253 PolarHBondContact O-N 3.03Å; E251-Y253 VanDerWaalsContact C-N 3.32Å; E251-Y253 PolarHBondContact O-N 3.4Å; Y253-A256 PolarHBondContact O-N 3.18Å; Y253-H257 AromaticContact CD2-CD2 3.46Å; Y253-H257 VanDerWaalsContact CD2-CD2 3.46Å; Y253-H257 WeakPolarHBondContact CD2-CD2 3.41Å; Y253-H257 AromaticContact CD2-NE2 3.84Å; Y253-H257 AromaticContact CE2-CD2 3.32Å; Y253-H257 WeakPolarHBondContact CE2-CD2 3.49Å; Y253-H257 AromaticContact CE2-NE2 3.53Å; Y253-H257 AromaticContact CG-CD2 3.97Å; Y253-H257 AromaticContact CZ-CD2 3.71Å; Y253-H257 WeakPolarHBondContact O-CB 3.5Å; Y253-H257 PolarHBondContact O-CD2 3.24Å; Y253-H257 VanDerWaalsContact O-CD2 3.24Å; Y253-H257 PolarHBondContact O-N 3.5Å
254	F	85.5	Confident	67.3	Low	141 Å²	141	116.5 Å²	116.5	62%	0.618	63%	0.632	S	S	*	*	H	α-helix	trans	-72.8	-26.6	179.2	-71.4	-63.4	0	0	0	113.4	T250 E251 G258	T250-F254 WeakPolarHBondContact O-CD2 3.47Å; T250-F254 PolarHBondContact O-N 3.44Å; E251-F254 PolarHBondContact O-N 3.46Å; F254-G258 WeakPolarHBondContact O-CA 3.32Å; F254-G258 PolarHBondContact O-N 3.07Å
255	E	83	Confident	68	Low	136 Å²	136	113.6 Å²	113.6	64%	0.636	62%	0.618	S	S	*	*	H	α-helix	trans	-72.1	-42.6	172.4	-75.4	-178.4	178.4	0	0	111.2	E251 E252	E251-E255 WeakPolarHBondContact O-CB 3.17Å; E251-E255 VanDerWaalsContact O-CG 3.29Å; E251-E255 WeakPolarHBondContact O-CG 3.35Å; E251-E255 PolarHBondContact O-N 3.2Å; E252-E255 PolarHBondContact O-N 3.33Å
256	A	78	Confident	68.4	Low	61 Å²	61	112.5 Å²	112.5	50%	0.504	61%	0.612	S	S	.	*	H	α-helix	trans	-66.5	-42.6	176.8	0	0	0	0	0	112.4	E252 Y253	E252-A256 VanDerWaalsContact O-CB 3.26Å; E252-A256 WeakPolarHBondContact O-CB 3.45Å; E252-A256 PolarHBondContact O-N 2.93Å; Y253-A256 PolarHBondContact O-N 3.18Å
257	H	74.2	Confident	68.9	Low	135 Å²	135	114.4 Å²	114.4	63%	0.625	61%	0.612	S	S	*	*	H	α-helix	trans	-95.8	-13	-177.5	-67.8	-72.1	0	0	0	114.6	Y253	Y253-H257 AromaticContact CD2-CD2 3.46Å; Y253-H257 VanDerWaalsContact CD2-CD2 3.46Å; Y253-H257 WeakPolarHBondContact CD2-CD2 3.41Å; Y253-H257 AromaticContact CD2-NE2 3.84Å; Y253-H257 AromaticContact CE2-CD2 3.32Å; Y253-H257 WeakPolarHBondContact CE2-CD2 3.49Å; Y253-H257 AromaticContact CE2-NE2 3.53Å; Y253-H257 AromaticContact CG-CD2 3.97Å; Y253-H257 AromaticContact CZ-CD2 3.71Å; Y253-H257 WeakPolarHBondContact O-CB 3.5Å; Y253-H257 PolarHBondContact O-CD2 3.24Å; Y253-H257 VanDerWaalsContact O-CD2 3.24Å; Y253-H257 PolarHBondContact O-N 3.5Å
258	G	74.7	Confident	69.4	Low	62 Å²	62	114.8 Å²	114.8	64%	0.639	61%	0.613	S	S	*	*	H	α-helix	trans	-89.1	-16.4	-179.8	0	0	0	0	0	114	F254 S260	F254-G258 WeakPolarHBondContact O-CA 3.32Å; F254-G258 PolarHBondContact O-N 3.07Å; G258-S260 PolarHBondContact O-N 2.89Å
259	S	65	Low	69.1	Low	59 Å²	59	117.4 Å²	117.4	41%	0.413	62%	0.62	S	S	.	*			trans	-81.9	111.7	171.5	79.8	0	0	0	0	110.1	K261	S259-K261 PolarHBondContact O-N 3.24Å
260	S	59.7	Low	68.8	Low	127 Å²	127	118.6 Å²	118.6	89%	0.888	62%	0.623	S	S	*	*	S	Bend	trans	-65.4	-5.3	175.7	58.7	0	0	0	0	113.9	G258	G258-S260 PolarHBondContact O-N 2.89Å
261	K	56.8	Low	68	Low	171 Å²	171	121.9 Å²	121.9	74%	0.743	63%	0.626	S	S	*	*			trans	-111.7	85	174.3	-69.5	-176.2	179.4	-177.9	0	108.7	S259 L263	S259-K261 PolarHBondContact O-N 3.24Å; K261-L263 PolarHBondContact O-N 2.95Å
262	I	58.7	Low	67.3	Low	134 Å²	134	121.1 Å²	121.1	69%	0.687	63%	0.625	S	S	*	*			trans	-69.1	89.4	165.3	-51.9	172	0	0	0	106.3	T264	I262-T264 HydrophobicContact CG2-CG2 3.73Å; I262-T264 PolarHBondContact O-N 3.03Å
263	L	49.7	Very low	66.2	Low	165 Å²	165	125.8 Å²	125.8	86%	0.864	65%	0.647	S	S	*	*			trans	-75.7	77.1	174.8	-157.9	94.1	0	0	0	107.8	K261	K261-L263 PolarHBondContact O-N 2.95Å
264	T	63.8	Low	65.2	Low	106 Å²	106	123.6 Å²	123.6	65%	0.65	65%	0.647	S	S	*	*			trans	-65.1	137.3	169.1	53.3	0	0	0	0	108.1	I262 D266	I262-T264 HydrophobicContact CG2-CG2 3.73Å; I262-T264 PolarHBondContact O-N 3.03Å; T264-D266 PolarHBondContact O-N 3.03Å
265	S	65.4	Low	64.1	Low	83 Å²	83	122.1 Å²	122.1	58%	0.58	65%	0.652	S	S	*	*			trans	-65.4	138.9	173	60	0	0	0	0	109.2	R267	S265-R267 PolarHBondContact O-N 2.92Å
266	D	57.2	Low	63.4	Low	113 Å²	113	121.7 Å²	121.7	60%	0.604	65%	0.648	S	S	*	*	S	Bend	trans	-52.8	7.6	170	-104.6	41.3	0	0	0	116.3	T264 T268 R271	T264-D266 PolarHBondContact O-N 3.03Å; D266-T268 VanDerWaalsContact C-N 3.26Å; D266-T268 PolarHBondContact O-N 3.48Å; D266-R271 VanDerWaalsContact CB-NH1 3.34Å; D266-R271 WeakPolarHBondContact O-CD 3.33Å; D266-R271 PolarHBondContact O-NH1 2.76Å; D266-R271 IonicContact OD2-CZ 3.76Å; D266-R271 IonicContact OD2-NH1 2.94Å; D266-R271 PolarHBondContact OD2-NH1 2.94Å; D266-R271 IonicContact OD2-NH2 3.45Å; D266-R271 PolarHBondContact OD2-NH2 3.23Å
267	R	60.1	Low	63	Low	221 Å²	221	122.4 Å²	122.4	83%	0.834	64%	0.643	S	S	*	*			trans	-88.7	61.4	172.9	-64.1	179.2	176.8	164.8	-1.2	109.5	S265	S265-R267 PolarHBondContact O-N 2.92Å
268	T	60.3	Low	62.9	Low	65 Å²	65	119.6 Å²	119.6	40%	0.399	63%	0.632	S	S	.	*			trans	-69.6	140	171.5	48.9	0	0	0	0	109.5	D266 E270 R271	D266-T268 VanDerWaalsContact C-N 3.26Å; D266-T268 PolarHBondContact O-N 3.48Å; T268-E270 PolarHBondContact O-N 2.98Å; T268-E270 VanDerWaalsContact O-N 3.12Å; T268-R271 WeakPolarHBondContact O-CB 3.47Å; T268-R271 PolarHBondContact O-N 3.27Å
269	L	60.9	Low	62.6	Low	105 Å²	105	122.4 Å²	122.4	55%	0.55	62%	0.624	S	S	.	*	G	3₁₀ helix	trans	-59.7	-21.6	177.6	-67	174.1	0	0	0	112.2	R271 L272	L269-R271 VanDerWaalsContact C-N 3.28Å; L269-R271 PolarHBondContact O-N 3.42Å; L269-L272 HydrophobicContact CD2-CD1 3.72Å; L269-L272 WeakPolarHBondContact O-CB 3.43Å; L269-L272 PolarHBondContact O-N 3.05Å; L269-L272 VanDerWaalsContact O-N 3.16Å
270	E	63.5	Low	63	Low	179 Å²	179	126.8 Å²	126.8	84%	0.836	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-64	-27.8	172.6	-65.7	179.2	168.7	0	0	113.7	T268 L272	T268-E270 PolarHBondContact O-N 2.98Å; T268-E270 VanDerWaalsContact O-N 3.12Å; E270-L272 PolarHBondContact O-N 3.43Å
271	R	63.2	Low	63.8	Low	155 Å²	155	123.6 Å²	123.6	59%	0.585	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-76.9	-11.2	175.4	-75.9	-179.8	172.3	171.9	-1.7	112.8	D266 T268 L269 H273	D266-R271 VanDerWaalsContact CB-NH1 3.34Å; D266-R271 WeakPolarHBondContact O-CD 3.33Å; D266-R271 PolarHBondContact O-NH1 2.76Å; D266-R271 IonicContact OD2-CZ 3.76Å; D266-R271 IonicContact OD2-NH1 2.94Å; D266-R271 PolarHBondContact OD2-NH1 2.94Å; D266-R271 IonicContact OD2-NH2 3.45Å; D266-R271 PolarHBondContact OD2-NH2 3.23Å; T268-R271 WeakPolarHBondContact O-CB 3.47Å; T268-R271 PolarHBondContact O-N 3.27Å; L269-R271 VanDerWaalsContact C-N 3.28Å; L269-R271 PolarHBondContact O-N 3.42Å; R271-H273 PolarHBondContact O-N 3.4Å
272	L	66.5	Low	64.7	Low	93 Å²	93	118.2 Å²	118.2	49%	0.487	59%	0.592	S	S	.	*			trans	-76.2	104.6	170.7	-63.3	170.7	0	0	0	107.5	L269 E270 T274	L269-L272 HydrophobicContact CD2-CD1 3.72Å; L269-L272 WeakPolarHBondContact O-CB 3.43Å; L269-L272 PolarHBondContact O-N 3.05Å; L269-L272 VanDerWaalsContact O-N 3.16Å; E270-L272 PolarHBondContact O-N 3.43Å; L272-T274 PolarHBondContact O-N 3.2Å
273	H	57.8	Low	65.4	Low	194 Å²	194	114.3 Å²	114.3	90%	0.898	58%	0.58	S	S	*	*			trans	-65.6	21.4	168.5	-76.8	-78.3	0	0	0	113.2	R271	R271-H273 PolarHBondContact O-N 3.4Å
274	T	64.8	Low	66.7	Low	90 Å²	90	112.8 Å²	112.8	55%	0.552	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-76.1	121.7	170.5	49.3	0	0	0	0	108	L272	L272-T274 PolarHBondContact O-N 3.2Å
275	P	63.8	Low	67.3	Low	110 Å²	110	113.1 Å²	113.1	71%	0.714	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-57.8	144.3	173.4	25.6	-33.2	0	0	0	109.3	L277	P275-L277 PolarHBondContact O-N 2.85Å
276	K	67.7	Low	67.8	Low	128 Å²	128	114 Å²	114	56%	0.557	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-57.7	126.3	168.9	-66.4	-179.5	178.3	-180	0	107.1	Q477	K276-Q477 HydrophobicContact CB-CB 3.88Å; K276-Q477 HydrophobicContact CD-CB 4.42Å
277	L	69	Low	68.7	Low	75 Å²	75	116.3 Å²	116.3	39%	0.393	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75	139	-178.6	-80.7	143.6	0	0	0	109	P275 L285 L475 V476 Q477	P275-L277 PolarHBondContact O-N 2.85Å; L277-L285 HydrophobicContact CD2-CD1 3.97Å; L277-L475 PolarHBondContact N-O 2.8Å; L277-L475 VanDerWaalsContact N-O 3.07Å; L277-V476 WeakPolarHBondContact O-CA 3.47Å; L277-Q477 PolarHBondContact O-N 2.82Å; L277-Q477 VanDerWaalsContact O-N 3.12Å
278	D	71.8	Confident	69	Low	76 Å²	76	108.9 Å²	108.9	41%	0.406	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.3	144.1	168.7	-70.9	-26.8	0	0	0	109.1	E280 T281 L282	D278-E280 PolarHBondContact O-N 3.31Å; D278-T281 HydrophobicContact CB-CG2 4.16Å; D278-T281 PolarHBondContact N-OG1 3.41Å; D278-T281 PolarHBondContact O-N 3.11Å; D278-T281 PolarHBondContact O-OG1 3.38Å; D278-L282 PolarHBondContact O-N 3.2Å
279	R	69.4	Low	69.6	Low	122 Å²	122	113.4 Å²	113.4	46%	0.46	58%	0.576	S	S	.	*	H	α-helix	trans	-52.8	-41.6	-176.7	178.5	-179.8	171.5	140.4	-1.8	112.6	L282 A283 S469 V476	R279-L282 PolarHBondContact O-N 3.5Å; R279-A283 PolarHBondContact O-N 3.25Å; R279-S469 PolarHBondContact NH1-O 2.89Å; R279-V476 HydrophobicContact CB-CG1 4.17Å
280	E	74	Confident	70	Confident	150 Å²	150	114 Å²	114	70%	0.701	59%	0.586	S	S	*	*	H	α-helix	trans	-66.5	-42.1	-179.8	-62.7	178.9	179	0	0	111.4	D278 L282 A283 H284	D278-E280 PolarHBondContact O-N 3.31Å; E280-L282 VanDerWaalsContact C-N 3.32Å; E280-L282 PolarHBondContact O-N 3.05Å; E280-A283 PolarHBondContact O-N 2.94Å; E280-H284 PolarHBondContact O-CD2 2.87Å; E280-H284 PolarHBondContact O-N 3.33Å
281	T	74.8	Confident	70.3	Confident	61 Å²	61	107.8 Å²	107.8	37%	0.374	56%	0.562	S	S	.	*	H	α-helix	trans	-64.6	-37.6	176.1	66.6	0	0	0	0	112	D278 L285	D278-T281 HydrophobicContact CB-CG2 4.16Å; D278-T281 PolarHBondContact N-OG1 3.41Å; D278-T281 PolarHBondContact O-N 3.11Å; D278-T281 PolarHBondContact O-OG1 3.38Å; T281-L285 WeakPolarHBondContact O-CB 3.32Å; T281-L285 WeakPolarHBondContact O-CG 3.4Å; T281-L285 PolarHBondContact O-N 3.38Å
282	L	75.9	Confident	71.1	Confident	58 Å²	58	106 Å²	106	30%	0.304	57%	0.572	S	S	.	*	H	α-helix	trans	-65.2	-46	175.5	-178	159.1	0	0	0	111.1	D278 R279 E280 H284 L285 L286 V476	D278-L282 PolarHBondContact O-N 3.2Å; R279-L282 PolarHBondContact O-N 3.5Å; E280-L282 VanDerWaalsContact C-N 3.32Å; E280-L282 PolarHBondContact O-N 3.05Å; L282-H284 VanDerWaalsContact C-N 3.34Å; L282-H284 PolarHBondContact O-N 2.98Å; L282-L285 PolarHBondContact O-N 3.07Å; L282-L285 VanDerWaalsContact O-N 3.17Å; L282-L286 HydrophobicContact CD2-CD1 3.35Å; L282-L286 HydrophobicContact CD2-CG 3.96Å; L282-L286 HydrophobicContact CG-CD1 4.39Å; L282-L286 WeakPolarHBondContact O-CG 3.4Å; L282-L286 PolarHBondContact O-N 3.05Å; L282-V476 HydrophobicContact CD1-CG2 3.5Å; L282-V476 VanDerWaalsContact CD1-CG2 3.5Å
283	A	73.9	Confident	72	Confident	51 Å²	51	109.3 Å²	109.3	42%	0.421	58%	0.579	S	S	.	*	H	α-helix	trans	-57.9	-48.2	178.4	0	0	0	0	0	110.9	R279 E280 L285 L286 E287	R279-A283 PolarHBondContact O-N 3.25Å; E280-A283 PolarHBondContact O-N 2.94Å; A283-L285 VanDerWaalsContact C-N 3.31Å; A283-L285 PolarHBondContact O-N 3.27Å; A283-L286 PolarHBondContact O-N 2.87Å; A283-L286 VanDerWaalsContact O-N 3.13Å; A283-E287 WeakPolarHBondContact O-CB 3.5Å; A283-E287 PolarHBondContact O-N 2.88Å
284	H	76.8	Confident	73.3	Confident	134 Å²	134	102.6 Å²	102.6	62%	0.62	55%	0.554	S	S	*	*	H	α-helix	trans	-60.8	-36.4	176.1	-73.1	-49.6	0	0	0	113.6	E280 L282 E287	E280-H284 PolarHBondContact O-CD2 2.87Å; E280-H284 PolarHBondContact O-N 3.33Å; L282-H284 VanDerWaalsContact C-N 3.34Å; L282-H284 PolarHBondContact O-N 2.98Å; H284-E287 IonicContact ND1-OE2 2.7Å
285	L	77.2	Confident	74.5	Confident	112 Å²	112	105.4 Å²	105.4	59%	0.586	56%	0.559	S	S	*	*	H	α-helix	trans	-72.6	-27.7	176.8	-71.8	170.7	0	0	0	113.2	L277 T281 L282 A283	L277-L285 HydrophobicContact CD2-CD1 3.97Å; T281-L285 WeakPolarHBondContact O-CB 3.32Å; T281-L285 WeakPolarHBondContact O-CG 3.4Å; T281-L285 PolarHBondContact O-N 3.38Å; L282-L285 PolarHBondContact O-N 3.07Å; L282-L285 VanDerWaalsContact O-N 3.17Å; A283-L285 VanDerWaalsContact C-N 3.31Å; A283-L285 PolarHBondContact O-N 3.27Å
286	L	75.1	Confident	75.8	Confident	103 Å²	103	105.1 Å²	105.1	54%	0.539	55%	0.548	S	S	.	.	H	α-helix	trans	-81.9	-34.2	177.1	-74.8	-176.9	0	0	0	112.6	L282 A283 G288 K289	L282-L286 HydrophobicContact CD2-CD1 3.35Å; L282-L286 HydrophobicContact CD2-CG 3.96Å; L282-L286 HydrophobicContact CG-CD1 4.39Å; L282-L286 WeakPolarHBondContact O-CG 3.4Å; L282-L286 PolarHBondContact O-N 3.05Å; A283-L286 PolarHBondContact O-N 2.87Å; A283-L286 VanDerWaalsContact O-N 3.13Å; L286-G288 PolarHBondContact O-N 3.2Å; L286-G288 VanDerWaalsContact O-N 3.08Å; L286-K289 PolarHBondContact O-N 3.4Å; L286-K289 VanDerWaalsContact O-N 3.12Å
287	E	76.6	Confident	76.8	Confident	161 Å²	161	100.6 Å²	100.6	75%	0.752	53%	0.529	S	S	*	.	H	α-helix	trans	-59	-24.5	-177	-145.4	166.7	-163	0	0	113	A283 H284	A283-E287 WeakPolarHBondContact O-CB 3.5Å; A283-E287 PolarHBondContact O-N 2.88Å; H284-E287 IonicContact ND1-OE2 2.7Å
288	G	66.2	Low	77.8	Confident	64 Å²	64	102.9 Å²	102.9	66%	0.66	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	0.3	179.3	0	0	0	0	0	116.5	L286 P290	L286-G288 PolarHBondContact O-N 3.2Å; L286-G288 VanDerWaalsContact O-N 3.08Å; G288-P290 WeakPolarHBondContact O-CD 3.41Å
289	K	73.9	Confident	78.8	Confident	161 Å²	161	105 Å²	105	70%	0.7	55%	0.545	S	S	*	.			trans	-111.9	100	-175.1	-69.1	-177.5	-176	172.7	0	112	L286	L286-K289 PolarHBondContact O-N 3.4Å; L286-K289 VanDerWaalsContact O-N 3.12Å
290	P	67.5	Low	79.9	Confident	116 Å²	116	101.2 Å²	101.2	75%	0.753	53%	0.534	S	S	*	.			trans	-66.7	140.9	170.4	27.3	-32.5	0	0	0	110.4	G288 C292	G288-P290 WeakPolarHBondContact O-CD 3.41Å; P290-C292 PolarHBondContact O-N 2.83Å
291	S	71.5	Confident	80.7	Confident	49 Å²	49	94.6 Å²	94.6	34%	0.343	50%	0.503	S	S	.	.			trans	-68.5	131	172.7	56.8	0	0	0	0	109.9	Y293 S294	S291-Y293 PolarHBondContact O-N 3.33Å; S291-Y293 VanDerWaalsContact O-N 3.12Å; S291-S294 PolarHBondContact O-N 3.17Å
292	C	78.5	Confident	81.6	Confident	117 Å²	117	95.3 Å²	95.3	79%	0.791	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-22.1	-178.1	-61.8	0	0	0	0	113.5	P290	P290-C292 PolarHBondContact O-N 2.83Å
293	Y	85.6	Confident	82.4	Confident	163 Å²	163	98 Å²	98	64%	0.639	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	33.6	-172.2	-58.1	-71.6	0	0	0	113.1	S291 K295 E296 I297	S291-Y293 PolarHBondContact O-N 3.33Å; S291-Y293 VanDerWaalsContact O-N 3.12Å; Y293-K295 VanDerWaalsContact C-N 3.28Å; Y293-K295 PolarHBondContact O-N 2.99Å; Y293-E296 VanDerWaalsContact CA-OE2 3.27Å; Y293-E296 WeakPolarHBondContact CA-OE2 3.46Å; Y293-E296 PolarHBondContact O-N 2.85Å; Y293-I297 WeakPolarHBondContact O-CD1 3.47Å; Y293-I297 VanDerWaalsContact O-CG1 3.25Å; Y293-I297 WeakPolarHBondContact O-CG1 3.49Å; Y293-I297 PolarHBondContact O-N 3.41Å; Y293-I297 VanDerWaalsContact O-N 3.15Å
294	S	86.4	Confident	83.3	Confident	53 Å²	53	96.4 Å²	96.4	37%	0.371	50%	0.498	S	S	.	.	H	α-helix	trans	-60.5	-34.2	-177.5	50.1	0	0	0	0	113.6	S291 Q298	S291-S294 PolarHBondContact O-N 3.17Å; S294-Q298 VanDerWaalsContact O-CG 3.32Å; S294-Q298 WeakPolarHBondContact O-CG 3.38Å; S294-Q298 PolarHBondContact O-N 3.17Å; S294-Q298 VanDerWaalsContact O-N 3.09Å
295	K	88.5	Confident	83.9	Confident	149 Å²	149	95.2 Å²	95.2	65%	0.648	49%	0.488	S	S	*	.	H	α-helix	trans	-69.5	-46.7	-179.4	-65.4	-177.7	-179.5	179.8	0	111.7	Y293 I297 Q298 E299	Y293-K295 VanDerWaalsContact C-N 3.28Å; Y293-K295 PolarHBondContact O-N 2.99Å; K295-I297 VanDerWaalsContact C-N 3.28Å; K295-I297 PolarHBondContact O-N 3.42Å; K295-Q298 WeakPolarHBondContact O-CB 3.45Å; K295-Q298 PolarHBondContact O-N 3.17Å; K295-Q298 VanDerWaalsContact O-N 3.14Å; K295-E299 PolarHBondContact O-N 3.2Å
296	E	91.2	Very high	84.6	Confident	104 Å²	104	96.6 Å²	96.6	49%	0.486	49%	0.491	S	S	.	.	H	α-helix	trans	-64.9	-35.9	179.2	-63.4	81.4	176.6	0	0	111.3	Y293 E299 L300	Y293-E296 VanDerWaalsContact CA-OE2 3.27Å; Y293-E296 WeakPolarHBondContact CA-OE2 3.46Å; Y293-E296 PolarHBondContact O-N 2.85Å; E296-E299 PolarHBondContact O-N 3.32Å; E296-L300 WeakPolarHBondContact O-CB 3.43Å; E296-L300 PolarHBondContact O-N 3.22Å
297	I	90	Very high	85.3	Confident	33 Å²	33	95.2 Å²	95.2	17%	0.169	48%	0.482	C	S	.	.	H	α-helix	trans	-64.3	-41.4	173.4	-69.4	167.1	0	0	0	111	Y293 K295 L300 H301 T460 F461 Q462	Y293-I297 WeakPolarHBondContact O-CD1 3.47Å; Y293-I297 VanDerWaalsContact O-CG1 3.25Å; Y293-I297 WeakPolarHBondContact O-CG1 3.49Å; Y293-I297 PolarHBondContact O-N 3.41Å; Y293-I297 VanDerWaalsContact O-N 3.15Å; K295-I297 VanDerWaalsContact C-N 3.28Å; K295-I297 PolarHBondContact O-N 3.42Å; I297-L300 PolarHBondContact O-N 2.89Å; I297-H301 WeakPolarHBondContact O-CB 3.43Å; I297-H301 PolarHBondContact O-N 3Å; I297-T460 WeakPolarHBondContact CG2-O 3.4Å; I297-F461 HydrophobicContact CD1-CB 4.41Å; I297-F461 HydrophobicContact CG1-CB 4.35Å; I297-Q462 HydrophobicContact CG2-CG 4.14Å
298	Q	90	Very high	86.1	Confident	123 Å²	123	87.8 Å²	87.8	58%	0.575	45%	0.447	S	S	*	.	H	α-helix	trans	-65.6	-43.6	176.1	-74.5	173	-1.5	0	0	111.8	S294 K295 L300 H301 D302	S294-Q298 VanDerWaalsContact O-CG 3.32Å; S294-Q298 WeakPolarHBondContact O-CG 3.38Å; S294-Q298 PolarHBondContact O-N 3.17Å; S294-Q298 VanDerWaalsContact O-N 3.09Å; K295-Q298 WeakPolarHBondContact O-CB 3.45Å; K295-Q298 PolarHBondContact O-N 3.17Å; K295-Q298 VanDerWaalsContact O-N 3.14Å; Q298-L300 VanDerWaalsContact C-N 3.27Å; Q298-L300 PolarHBondContact O-N 2.92Å; Q298-H301 WeakPolarHBondContact O-CB 3.29Å; Q298-H301 PolarHBondContact O-N 3.36Å; Q298-H301 VanDerWaalsContact O-N 3.11Å; Q298-D302 PolarHBondContact O-N 3.18Å
299	E	92.6	Very high	87.3	Confident	120 Å²	120	89.4 Å²	89.4	56%	0.561	44%	0.444	S	S	*	.	H	α-helix	trans	-59.4	-39.3	174.7	-71.4	178.5	-169.9	0	0	112.2	K295 E296 D302 K303	K295-E299 PolarHBondContact O-N 3.2Å; E296-E299 PolarHBondContact O-N 3.32Å; E299-D302 PolarHBondContact O-N 3.4Å; E299-K303 WeakPolarHBondContact O-CG 3.49Å; E299-K303 PolarHBondContact O-N 2.85Å; E299-K303 VanDerWaalsContact O-N 3.13Å
300	L	91.5	Very high	88.3	Confident	43 Å²	43	86.8 Å²	86.8	23%	0.225	43%	0.433	C	S	.	.	H	α-helix	trans	-66.7	-40.5	175.3	-174.1	59	0	0	0	111.6	E296 I297 Q298 D302 K303 H304 V459 F461	E296-L300 WeakPolarHBondContact O-CB 3.43Å; E296-L300 PolarHBondContact O-N 3.22Å; I297-L300 PolarHBondContact O-N 2.89Å; Q298-L300 VanDerWaalsContact C-N 3.27Å; Q298-L300 PolarHBondContact O-N 2.92Å; L300-D302 VanDerWaalsContact C-N 3.34Å; L300-D302 PolarHBondContact O-N 3.48Å; L300-K303 WeakPolarHBondContact O-CB 3.27Å; L300-K303 PolarHBondContact O-N 3.45Å; L300-H304 PolarHBondContact O-CD2 2.91Å; L300-H304 PolarHBondContact O-N 3.25Å; L300-H304 VanDerWaalsContact O-N 3.17Å; L300-V459 WeakPolarHBondContact CD2-O 3.49Å; L300-V459 WeakPolarHBondContact CG-O 3.45Å; L300-F461 HydrophobicContact CD2-CD2 4.06Å; L300-F461 HydrophobicContact CD2-CE2 4.28Å
301	H	91.7	Very high	89.5	Confident	12 Å²	12	81.3 Å²	81.3	6%	0.056	40%	0.397	C	S	.	.	H	α-helix	trans	-60.5	-43.7	175.2	-165.2	-78.2	0	0	0	111.8	I297 Q298 K303 H304 R305 D335	I297-H301 WeakPolarHBondContact O-CB 3.43Å; I297-H301 PolarHBondContact O-N 3Å; Q298-H301 WeakPolarHBondContact O-CB 3.29Å; Q298-H301 PolarHBondContact O-N 3.36Å; Q298-H301 VanDerWaalsContact O-N 3.11Å; H301-K303 VanDerWaalsContact C-N 3.32Å; H301-K303 PolarHBondContact O-N 3.17Å; H301-H304 PolarHBondContact O-N 3.32Å; H301-R305 PolarHBondContact CE1-NE 3.04Å; H301-R305 PolarHBondContact ND1-NE 3.17Å; H301-R305 WeakPolarHBondContact O-CG 3.24Å; H301-R305 PolarHBondContact O-N 3.48Å; H301-D335 IonicContact CE1-OD2 2.76Å; H301-D335 PolarHBondContact CE1-OD2 2.92Å; H301-D335 IonicContact ND1-OD2 3.96Å; H301-D335 IonicContact NE2-OD2 2.55Å
302	D	92.8	Very high	90.5	Very high	75 Å²	75	80 Å²	80	40%	0.401	39%	0.386	S	S	.	.	H	α-helix	trans	-67.5	-30.8	178.3	-71.5	-28.5	0	0	0	112.9	Q298 E299 L300 R305 Q306	Q298-D302 PolarHBondContact O-N 3.18Å; E299-D302 PolarHBondContact O-N 3.4Å; L300-D302 VanDerWaalsContact C-N 3.34Å; L300-D302 PolarHBondContact O-N 3.48Å; D302-R305 PolarHBondContact O-N 3.27Å; D302-R305 IonicContact OD1-CZ 3.98Å; D302-R305 IonicContact OD1-NE 3.19Å; D302-R305 IonicContact OD1-NH1 2.85Å; D302-R305 PolarHBondContact OD1-NH1 3.34Å; D302-Q306 PolarHBondContact O-N 2.96Å
303	K	92.9	Very high	91.2	Very high	116 Å²	116	79.1 Å²	79.1	50%	0.504	37%	0.373	S	S	.	.	H	α-helix	trans	-62.9	-46.1	170.2	-71.9	170.8	-173.5	169.9	0	111.3	E299 L300 H301 R305 Q306	E299-K303 WeakPolarHBondContact O-CG 3.49Å; E299-K303 PolarHBondContact O-N 2.85Å; E299-K303 VanDerWaalsContact O-N 3.13Å; L300-K303 WeakPolarHBondContact O-CB 3.27Å; L300-K303 PolarHBondContact O-N 3.45Å; H301-K303 VanDerWaalsContact C-N 3.32Å; H301-K303 PolarHBondContact O-N 3.17Å; K303-R305 VanDerWaalsContact C-N 3.3Å; K303-R305 PolarHBondContact O-N 2.99Å; K303-Q306 WeakPolarHBondContact O-CB 3.44Å; K303-Q306 PolarHBondContact O-N 3.43Å
304	H	92.3	Very high	91.5	Very high	17 Å²	17	72.7 Å²	72.7	8%	0.079	35%	0.349	C	S	.	.	H	α-helix	trans	-64.1	-34.7	178.3	-65.6	-48.8	0	0	0	112.4	L300 H301 Q306 H307 L332 V459	L300-H304 PolarHBondContact O-CD2 2.91Å; L300-H304 PolarHBondContact O-N 3.25Å; L300-H304 VanDerWaalsContact O-N 3.17Å; H301-H304 PolarHBondContact O-N 3.32Å; H304-Q306 PolarHBondContact O-N 3.36Å; H304-H307 WeakPolarHBondContact O-CB 3.32Å; H304-H307 PolarHBondContact O-N 3.09Å; H304-L332 HydrophobicContact CB-CD1 3.64Å; H304-L332 HydrophobicContact CB-CD2 4.15Å; H304-V459 PolarHBondContact NE2-O 3.47Å
305	R	90.7	Very high	91.8	Very high	108 Å²	108	70.2 Å²	70.2	41%	0.408	33%	0.331	S	S	.	.	H	α-helix	trans	-58.8	-30.9	174.8	-73	179.8	172.4	168.3	-12.3	113.5	H301 D302 K303 H307 F308 D335	H301-R305 PolarHBondContact CE1-NE 3.04Å; H301-R305 PolarHBondContact ND1-NE 3.17Å; H301-R305 WeakPolarHBondContact O-CG 3.24Å; H301-R305 PolarHBondContact O-N 3.48Å; D302-R305 PolarHBondContact O-N 3.27Å; D302-R305 IonicContact OD1-CZ 3.98Å; D302-R305 IonicContact OD1-NE 3.19Å; D302-R305 IonicContact OD1-NH1 2.85Å; D302-R305 PolarHBondContact OD1-NH1 3.34Å; K303-R305 VanDerWaalsContact C-N 3.3Å; K303-R305 PolarHBondContact O-N 2.99Å; R305-H307 PolarHBondContact O-N 2.67Å; R305-F308 HydrophobicContact CB-CD2 4.23Å; R305-F308 HydrophobicContact CB-CE2 3.95Å; R305-F308 HydrophobicContact CB-CZ 4.34Å; R305-F308 HydrophobicContact CG-CD2 4.38Å; R305-F308 HydrophobicContact CG-CE2 3.63Å; R305-F308 HydrophobicContact CG-CZ 3.87Å; R305-F308 WeakPolarHBondContact O-CB 3.35Å; R305-F308 WeakPolarHBondContact O-CD2 3.38Å; R305-F308 VanDerWaalsContact O-CG 3.26Å; R305-F308 WeakPolarHBondContact O-CG 3.39Å; R305-F308 PolarHBondContact O-N 3.27Å; R305-D335 IonicContact CZ-OD2 2.58Å; R305-D335 VanDerWaalsContact CZ-OD2 3.28Å; R305-D335 IonicContact NE-OD2 3.09Å; R305-D335 PolarHBondContact NE-OD2 2.82Å; R305-D335 VanDerWaalsContact NE-OD2 3.09Å; R305-D335 IonicContact NH2-OD2 3.78Å; R305-D335 PolarHBondContact NH2-OD2 3.32Å
306	Q	91.1	Very high	91.8	Very high	141 Å²	141	68.7 Å²	68.7	66%	0.659	33%	0.326	S	S	*	.	H	α-helix	trans	-64.1	-26.3	177.6	-62.8	174	16.8	0	0	112.1	D302 K303 H304 F308 T309	D302-Q306 PolarHBondContact O-N 2.96Å; K303-Q306 WeakPolarHBondContact O-CB 3.44Å; K303-Q306 PolarHBondContact O-N 3.43Å; H304-Q306 PolarHBondContact O-N 3.36Å; Q306-F308 VanDerWaalsContact C-N 3.31Å; Q306-F308 PolarHBondContact O-N 3.04Å; Q306-T309 PolarHBondContact O-OG1 3Å
307	H	90.8	Very high	91.7	Very high	74 Å²	74	69.3 Å²	69.3	34%	0.343	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-10.3	-179.2	-61.3	-41.9	0	0	0	114	H304 R305 T309 K310 W311	H304-H307 WeakPolarHBondContact O-CB 3.32Å; H304-H307 PolarHBondContact O-N 3.09Å; R305-H307 PolarHBondContact O-N 2.67Å; H307-T309 VanDerWaalsContact C-N 3.29Å; H307-T309 PolarHBondContact O-N 3.13Å; H307-K310 WeakPolarHBondContact O-CA 3.4Å; H307-K310 WeakPolarHBondContact O-CB 3.48Å; H307-K310 PolarHBondContact O-N 3.49Å; H307-W311 PolarHBondContact O-N 3.15Å
308	F	92.4	Very high	91.6	Very high	6 Å²	6	69.2 Å²	69.2	3%	0.026	34%	0.34	C	S	.	.	H	α-helix	trans	-59.4	-38	-177.9	-66	-15.5	0	0	0	113.7	R305 Q306 K310 W311 M312 L332 D335 F336 H340	R305-F308 HydrophobicContact CB-CD2 4.23Å; R305-F308 HydrophobicContact CB-CE2 3.95Å; R305-F308 HydrophobicContact CB-CZ 4.34Å; R305-F308 HydrophobicContact CG-CD2 4.38Å; R305-F308 HydrophobicContact CG-CE2 3.63Å; R305-F308 HydrophobicContact CG-CZ 3.87Å; R305-F308 WeakPolarHBondContact O-CB 3.35Å; R305-F308 WeakPolarHBondContact O-CD2 3.38Å; R305-F308 VanDerWaalsContact O-CG 3.26Å; R305-F308 WeakPolarHBondContact O-CG 3.39Å; R305-F308 PolarHBondContact O-N 3.27Å; Q306-F308 VanDerWaalsContact C-N 3.31Å; Q306-F308 PolarHBondContact O-N 3.04Å; F308-K310 VanDerWaalsContact C-N 3.28Å; F308-K310 PolarHBondContact O-N 3.3Å; F308-W311 HydrophobicContact CD1-CD2 4.46Å; F308-W311 AromaticContact CD1-CE3 3.96Å; F308-W311 HydrophobicContact CD1-CE3 3.96Å; F308-W311 HydrophobicContact CD1-CZ3 4.08Å; F308-W311 HydrophobicContact CE1-CE3 4.31Å; F308-W311 HydrophobicContact CE1-CH2 4.46Å; F308-W311 AromaticContact CE1-CZ3 3.97Å; F308-W311 HydrophobicContact CE1-CZ3 3.97Å; F308-W311 PolarHBondContact O-N 2.91Å; F308-M312 PolarHBondContact O-N 2.97Å; F308-L332 HydrophobicContact CE1-CD1 3.76Å; F308-L332 HydrophobicContact CE1-CG 4.16Å; F308-L332 HydrophobicContact CZ-CD1 3.67Å; F308-L332 HydrophobicContact CZ-CG 4.28Å; F308-L332 WeakPolarHBondContact CZ-O 3.24Å; F308-D335 HydrophobicContact CE2-CB 4.26Å; F308-D335 HydrophobicContact CZ-CB 4.31Å; F308-F336 HydrophobicContact CB-CD2 3.82Å; F308-F336 HydrophobicContact CB-CE2 4.16Å; F308-F336 HydrophobicContact CD1-CB 4.26Å; F308-F336 AromaticContact CD1-CD2 3.75Å; F308-F336 HydrophobicContact CD1-CD2 3.75Å; F308-F336 HydrophobicContact CD1-CG 4.42Å; F308-F336 HydrophobicContact CD2-CD2 4.26Å; F308-F336 HydrophobicContact CE1-CB 3.97Å; F308-F336 HydrophobicContact CE1-CD2 4.31Å; F308-F336 HydrophobicContact CE2-CB 4.25Å; F308-F336 AromaticContact CG-CD2 3.71Å; F308-F336 HydrophobicContact CG-CD2 3.71Å; F308-F336 HydrophobicContact CZ-CB 3.95Å; F308-H340 VanDerWaalsContact CB-CD2 3.5Å; F308-H340 WeakPolarHBondContact CB-CD2 3.38Å; F308-H340 WeakPolarHBondContact CB-NE2 3.31Å
309	T	91.9	Very high	91.8	Very high	97 Å²	97	67.5 Å²	67.5	60%	0.595	33%	0.331	S	S	*	.	H	α-helix	trans	-62.1	-38.4	174.8	54.9	0	0	0	0	112	Q306 H307 L313	Q306-T309 PolarHBondContact O-OG1 3Å; H307-T309 VanDerWaalsContact C-N 3.29Å; H307-T309 PolarHBondContact O-N 3.13Å; T309-L313 PolarHBondContact O-N 3.18Å
310	K	93.8	Very high	91.9	Very high	107 Å²	107	62 Å²	62	47%	0.465	31%	0.305	S	S	.	.	H	α-helix	trans	-71.4	-37.4	176.4	-177.8	168.3	167.8	-168.4	0	111.6	H307 F308 L313 Q314 W456	H307-K310 WeakPolarHBondContact O-CA 3.4Å; H307-K310 WeakPolarHBondContact O-CB 3.48Å; H307-K310 PolarHBondContact O-N 3.49Å; F308-K310 VanDerWaalsContact C-N 3.28Å; F308-K310 PolarHBondContact O-N 3.3Å; K310-L313 PolarHBondContact O-N 2.99Å; K310-Q314 VanDerWaalsContact O-CG 3.27Å; K310-Q314 WeakPolarHBondContact O-CG 3.45Å; K310-Q314 PolarHBondContact O-N 3.01Å; K310-W456 HydrophobicContact CD-CH2 3.61Å; K310-W456 HydrophobicContact CD-CZ2 3.89Å; K310-W456 VanDerWaalsContact CE-CH2 3.45Å; K310-W456 HydrophobicContact CG-CH2 4.18Å; K310-W456 HydrophobicContact CG-CZ2 4.01Å
311	W	93.6	Very high	92	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.6	-44.6	174.3	-66.9	0.5	0	0	0	111.2	H307 F308 L313 Q314 L315 V321 V323 L332 L333 F336 W456 C458	H307-W311 PolarHBondContact O-N 3.15Å; F308-W311 HydrophobicContact CD1-CD2 4.46Å; F308-W311 AromaticContact CD1-CE3 3.96Å; F308-W311 HydrophobicContact CD1-CE3 3.96Å; F308-W311 HydrophobicContact CD1-CZ3 4.08Å; F308-W311 HydrophobicContact CE1-CE3 4.31Å; F308-W311 HydrophobicContact CE1-CH2 4.46Å; F308-W311 AromaticContact CE1-CZ3 3.97Å; F308-W311 HydrophobicContact CE1-CZ3 3.97Å; F308-W311 PolarHBondContact O-N 2.91Å; W311-L313 VanDerWaalsContact C-N 3.34Å; W311-L313 PolarHBondContact O-N 2.96Å; W311-Q314 WeakPolarHBondContact O-CB 3.2Å; W311-Q314 PolarHBondContact O-N 2.69Å; W311-Q314 VanDerWaalsContact O-N 3.11Å; W311-L315 VanDerWaalsContact O-CG 3.29Å; W311-L315 WeakPolarHBondContact O-CG 3.25Å; W311-L315 PolarHBondContact O-N 3.32Å; W311-V321 HydrophobicContact CB-CG2 4.49Å; W311-V321 HydrophobicContact CD2-CG1 4.17Å; W311-V321 HydrophobicContact CE3-CG1 4.45Å; W311-V321 HydrophobicContact CG-CG1 4.4Å; W311-V323 HydrophobicContact CH2-CG1 4.38Å; W311-V323 HydrophobicContact CH2-CG2 3.58Å; W311-V323 HydrophobicContact CZ2-CG2 4.07Å; W311-V323 HydrophobicContact CZ3-CG2 4.09Å; W311-L332 HydrophobicContact CH2-CD2 4.09Å; W311-L333 HydrophobicContact CZ3-CD2 4.29Å; W311-F336 HydrophobicContact CB-CE2 4.2Å; W311-F336 HydrophobicContact CB-CZ 4.46Å; W311-F336 HydrophobicContact CE3-CD2 4.15Å; W311-F336 HydrophobicContact CE3-CE2 4.35Å; W311-F336 HydrophobicContact CE3-CG 4.39Å; W311-W456 AromaticContact CD1-CD2 3.97Å; W311-W456 AromaticContact CD1-CE2 3.5Å; W311-W456 VanDerWaalsContact CD1-CE2 3.5Å; W311-W456 AromaticContact CD1-CZ2 3.73Å; W311-W456 AromaticContact CD1-NE1 3.56Å; W311-W456 HydrophobicContact CZ2-CB 4.06Å; W311-W456 HydrophobicContact CZ2-CG 4.23Å; W311-W456 AromaticContact NE1-CD1 3.66Å; W311-W456 AromaticContact NE1-CD2 3.22Å; W311-W456 AromaticContact NE1-CE2 3.27Å; W311-W456 VanDerWaalsContact NE1-CE2 3.27Å; W311-W456 AromaticContact NE1-CE3 3.74Å; W311-W456 AromaticContact NE1-CG 3.43Å; W311-W456 AromaticContact NE1-CZ2 3.76Å; W311-W456 AromaticContact NE1-NE1 3.5Å; W311-C458 VanDerWaalsContact CZ2-SG 3.58Å
312	M	91.8	Very high	92.2	Very high	21 Å²	21	59.3 Å²	59.3	10%	0.103	29%	0.292	C	S	.	.	H	α-helix	trans	-58.1	-46.4	177	-177.6	55.5	79.8	0	0	111.9	F308 Q314 L315 Q316 H340 L341 Y399	F308-M312 PolarHBondContact O-N 2.97Å; M312-Q314 VanDerWaalsContact C-N 3.31Å; M312-Q314 PolarHBondContact O-N 3.15Å; M312-L315 PolarHBondContact O-N 2.9Å; M312-Q316 WeakPolarHBondContact O-CG 3.47Å; M312-Q316 PolarHBondContact O-N 2.99Å; M312-Q316 HydrophobicContact SD-CG 4.44Å; M312-H340 HydrophobicContact CE-CB 3.79Å; M312-L341 HydrophobicContact CE-CD2 3.74Å; M312-Y399 HydrophobicContact CE-CE1 4.48Å; M312-Y399 HydrophobicContact SD-CE1 4.2Å
313	L	93.5	Very high	92.3	Very high	99 Å²	99	55.8 Å²	55.8	52%	0.518	27%	0.272	S	S	.	.	H	α-helix	trans	-59.9	-41	175.5	178.7	64.6	0	0	0	112.4	T309 K310 W311 Q316 L317	T309-L313 PolarHBondContact O-N 3.18Å; K310-L313 PolarHBondContact O-N 2.99Å; W311-L313 VanDerWaalsContact C-N 3.34Å; W311-L313 PolarHBondContact O-N 2.96Å; L313-Q316 PolarHBondContact O-N 2.72Å; L313-L317 HydrophobicContact CG-CD1 4.3Å; L313-L317 WeakPolarHBondContact O-CG 3.48Å; L313-L317 PolarHBondContact O-N 2.73Å
314	Q	92.9	Very high	92.4	Very high	29 Å²	29	54.5 Å²	54.5	14%	0.136	27%	0.265	C	S	.	.	H	α-helix	trans	-67.4	-39.7	179.3	-73.9	171.9	-20.4	0	0	112.5	K310 W311 M312 L317 F319 L454	K310-Q314 VanDerWaalsContact O-CG 3.27Å; K310-Q314 WeakPolarHBondContact O-CG 3.45Å; K310-Q314 PolarHBondContact O-N 3.01Å; W311-Q314 WeakPolarHBondContact O-CB 3.2Å; W311-Q314 PolarHBondContact O-N 2.69Å; W311-Q314 VanDerWaalsContact O-N 3.11Å; M312-Q314 VanDerWaalsContact C-N 3.31Å; M312-Q314 PolarHBondContact O-N 3.15Å; Q314-L317 PolarHBondContact O-N 2.57Å; Q314-F319 WeakPolarHBondContact O-CB 3.27Å; Q314-F319 PolarHBondContact O-N 3.38Å; Q314-F319 VanDerWaalsContact O-N 3.17Å; Q314-L454 HydrophobicContact CB-CD1 3.88Å; Q314-L454 HydrophobicContact CG-CD1 3.75Å
315	L	91.4	Very high	92.4	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62	-47	176	-69	164.9	0	0	0	110.4	W311 M312 L317 G318 V321 F336 Y399 H429 V431	W311-L315 VanDerWaalsContact O-CG 3.29Å; W311-L315 WeakPolarHBondContact O-CG 3.25Å; W311-L315 PolarHBondContact O-N 3.32Å; M312-L315 PolarHBondContact O-N 2.9Å; L315-L317 PolarHBondContact O-N 3.28Å; L315-G318 WeakPolarHBondContact O-CA 3.43Å; L315-G318 PolarHBondContact O-N 2.77Å; L315-V321 HydrophobicContact CD2-CB 4.39Å; L315-V321 HydrophobicContact CD2-CG2 4.1Å; L315-V321 HydrophobicContact CG-CG2 4.21Å; L315-F336 HydrophobicContact CD1-CE1 4.24Å; L315-F336 HydrophobicContact CD1-CZ 3.9Å; L315-Y399 HydrophobicContact CB-CE1 4.27Å; L315-Y399 HydrophobicContact CD1-CD1 4.34Å; L315-Y399 HydrophobicContact CD1-CE1 4.19Å; L315-H429 HydrophobicContact CB-CB 4.2Å; L315-H429 HydrophobicContact CD2-CB 4.06Å; L315-H429 PolarHBondContact O-CE1 3.02Å; L315-H429 PolarHBondContact O-ND1 3.37Å; L315-V431 HydrophobicContact CD1-CG2 3.7Å; L315-V431 HydrophobicContact CD2-CG2 3.75Å; L315-V431 HydrophobicContact CG-CG2 4.36Å
316	Q	88.1	Confident	92.5	Very high	117 Å²	117	54.3 Å²	54.3	55%	0.547	28%	0.276	S	S	.	.	H	α-helix	trans	-60.9	-28	177.1	-71.4	178	-15.5	0	0	113.7	M312 L313 G318	M312-Q316 WeakPolarHBondContact O-CG 3.47Å; M312-Q316 PolarHBondContact O-N 2.99Å; M312-Q316 HydrophobicContact SD-CG 4.44Å; L313-Q316 PolarHBondContact O-N 2.72Å; Q316-G318 PolarHBondContact O-N 2.86Å
317	L	90.1	Very high	92.5	Very high	117 Å²	117	47.7 Å²	47.7	61%	0.613	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-0.3	174.4	-69.6	169.2	0	0	0	113.4	L313 Q314 L315 F319	L313-L317 HydrophobicContact CG-CD1 4.3Å; L313-L317 WeakPolarHBondContact O-CG 3.48Å; L313-L317 PolarHBondContact O-N 2.73Å; Q314-L317 PolarHBondContact O-N 2.57Å; L315-L317 PolarHBondContact O-N 3.28Å; L317-F319 HydrophobicContact CB-CD2 3.88Å; L317-F319 HydrophobicContact CB-CE2 4.04Å
318	G	88.1	Confident	92.6	Very high	31 Å²	31	44.5 Å²	44.5	32%	0.32	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.6	15.6	178.1	0	0	0	0	0	114.6	L315 Q316	L315-G318 WeakPolarHBondContact O-CA 3.43Å; L315-G318 PolarHBondContact O-N 2.77Å; Q316-G318 PolarHBondContact O-N 2.86Å
319	F	93.5	Very high	92.6	Very high	88 Å²	88	44.2 Å²	44.2	39%	0.386	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-91	141.8	172.4	-64.7	-79.9	0	0	0	111	Q314 L317 N452 L454	Q314-F319 WeakPolarHBondContact O-CB 3.27Å; Q314-F319 PolarHBondContact O-N 3.38Å; Q314-F319 VanDerWaalsContact O-N 3.17Å; L317-F319 HydrophobicContact CB-CD2 3.88Å; L317-F319 HydrophobicContact CB-CE2 4.04Å; F319-N452 HydrophobicContact CD1-CB 4.49Å; F319-L454 HydrophobicContact CB-CD1 3.46Å; F319-L454 VanDerWaalsContact CB-CD1 3.46Å; F319-L454 HydrophobicContact CB-CG 3.83Å; F319-L454 HydrophobicContact CD1-CD1 4.06Å; F319-L454 HydrophobicContact CD1-CD2 4.31Å; F319-L454 HydrophobicContact CD1-CG 3.98Å; F319-L454 HydrophobicContact CD2-CD1 4.06Å; F319-L454 HydrophobicContact CG-CD1 3.59Å; F319-L454 HydrophobicContact CG-CG 3.99Å
320	S	94.3	Very high	92.6	Very high	3 Å²	3	42 Å²	42	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	137.2	170.2	-54	0	0	0	0	110	L430 F451 N452 W453 L454	S320-L430 CarbonylContact C-O 3.6Å; S320-L430 WeakPolarHBondContact CA-O 3.09Å; S320-L430 WeakPolarHBondContact CB-O 3.37Å; S320-F451 WeakPolarHBondContact CB-O 3.42Å; S320-F451 PolarHBondContact OG-O 3.01Å; S320-N452 PolarHBondContact N-O 2.8Å; S320-W453 VanDerWaalsContact CB-CE3 3.49Å; S320-W453 VanDerWaalsContact CB-CZ3 3.5Å; S320-W453 CarbonylContact O-C 3.57Å; S320-W453 WeakPolarHBondContact O-CA 3.38Å; S320-L454 PolarHBondContact O-N 3.47Å
321	V	95	Very high	92.5	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	127.6	180	167.4	0	0	0	0	109.4	W311 L315 V323 L430 V431 A432 W456	W311-V321 HydrophobicContact CB-CG2 4.49Å; W311-V321 HydrophobicContact CD2-CG1 4.17Å; W311-V321 HydrophobicContact CE3-CG1 4.45Å; W311-V321 HydrophobicContact CG-CG1 4.4Å; L315-V321 HydrophobicContact CD2-CB 4.39Å; L315-V321 HydrophobicContact CD2-CG2 4.1Å; L315-V321 HydrophobicContact CG-CG2 4.21Å; V321-V323 HydrophobicContact CG1-CG2 4.12Å; V321-L430 PolarHBondContact N-O 3.19Å; V321-V431 HydrophobicContact CB-CG2 4.42Å; V321-V431 HydrophobicContact CG1-CG1 4.38Å; V321-V431 CarbonylContact O-C 3.59Å; V321-V431 WeakPolarHBondContact O-CA 3.44Å; V321-A432 PolarHBondContact O-N 3.25Å; V321-W456 HydrophobicContact CG1-CG 4.5Å
322	V	94.6	Very high	92.5	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	126.9	171.7	69.1	0	0	0	0	111.5	A432 I434 W453 L454 W455 W456	V322-A432 WeakPolarHBondContact CA-O 3.14Å; V322-A432 HydrophobicContact CG2-CB 4.38Å; V322-I434 HydrophobicContact CG2-CD1 3.44Å; V322-I434 VanDerWaalsContact CG2-CD1 3.44Å; V322-I434 HydrophobicContact CG2-CG1 3.54Å; V322-W453 HydrophobicContact CB-CD2 4.04Å; V322-W453 HydrophobicContact CB-CE3 3.54Å; V322-W453 HydrophobicContact CB-CZ3 3.81Å; V322-W453 HydrophobicContact CG1-CB 4.13Å; V322-W453 HydrophobicContact CG1-CD2 4.14Å; V322-W453 HydrophobicContact CG1-CE3 4Å; V322-W453 HydrophobicContact CG1-CG 4.25Å; V322-W453 HydrophobicContact CG2-CE3 4.45Å; V322-W453 HydrophobicContact CG2-CZ3 4.44Å; V322-L454 PolarHBondContact N-O 2.95Å; V322-W455 HydrophobicContact CG1-CB 4.38Å; V322-W455 HydrophobicContact CG1-CD2 3.56Å; V322-W455 HydrophobicContact CG1-CE3 3.82Å; V322-W455 HydrophobicContact CG1-CG 3.84Å; V322-W455 HydrophobicContact CG1-CZ2 4.38Å; V322-W455 HydrophobicContact CG1-CZ3 4.32Å; V322-W456 PolarHBondContact O-N 3.23Å
323	V	95.1	Very high	92.5	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	120.4	-176.5	-169.1	0	0	0	0	109.2	W311 V321 K329 L333 A432 S433 I434 W456 C458	W311-V323 HydrophobicContact CH2-CG1 4.38Å; W311-V323 HydrophobicContact CH2-CG2 3.58Å; W311-V323 HydrophobicContact CZ2-CG2 4.07Å; W311-V323 HydrophobicContact CZ3-CG2 4.09Å; V321-V323 HydrophobicContact CG1-CG2 4.12Å; V323-K329 HydrophobicContact CB-CD 4.14Å; V323-K329 HydrophobicContact CG1-CD 3.67Å; V323-K329 HydrophobicContact CG1-CG 4.27Å; V323-L333 HydrophobicContact CG2-CD2 4.28Å; V323-A432 PolarHBondContact N-O 3.34Å; V323-S433 WeakPolarHBondContact O-CA 3.46Å; V323-I434 PolarHBondContact O-N 3.01Å; V323-W456 WeakPolarHBondContact CA-O 3.43Å; V323-C458 HydrophobicContact CG1-CB 3.36Å; V323-C458 VanDerWaalsContact CG1-SG 3.59Å
324	Y	94.9	Very high	92.4	Very high	90 Å²	90	37.3 Å²	37.3	35%	0.353	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	151.1	176.3	71.3	-78	0	0	0	109.8	W455 W456 E457 C458	Y324-W455 HydrophobicContact CD1-CB 4.32Å; Y324-W455 AromaticContact CD1-CE3 3.58Å; Y324-W455 HydrophobicContact CD1-CE3 3.58Å; Y324-W455 HydrophobicContact CD1-CZ3 4.33Å; Y324-W455 HydrophobicContact CE1-CB 3.81Å; Y324-W455 AromaticContact CE1-CE3 3.96Å; Y324-W455 HydrophobicContact CE1-CE3 3.96Å; Y324-W455 HydrophobicContact CG-CE3 4.12Å; Y324-W455 HydrophobicContact CG-CZ3 4.46Å; Y324-W456 WeakPolarHBondContact CD1-O 3.1Å; Y324-W456 VanDerWaalsContact CE1-C 3.43Å; Y324-W456 WeakPolarHBondContact CE1-O 3.5Å; Y324-W456 PolarHBondContact N-O 2.89Å; Y324-E457 HydrophobicContact CE1-CB 4.33Å; Y324-E457 HydrophobicContact CE2-CB 4.37Å; Y324-E457 HydrophobicContact CE2-CG 4.45Å; Y324-E457 WeakPolarHBondContact O-CA 3.39Å; Y324-C458 PolarHBondContact O-N 3.45Å
325	G	93	Very high	92.4	Very high	18 Å²	18	37.8 Å²	37.8	19%	0.186	20%	0.198	C	C	.	.			trans	153.2	162.9	-177.9	0	0	0	0	0	111.7	K329	G325-K329 PolarHBondContact O-NZ 3.05Å
326	L	92.3	Very high	92.5	Very high	102 Å²	102	37.8 Å²	37.8	53%	0.534	20%	0.198	S	C	.	.	S	Bend	trans	-78.7	131.5	178.9	179.3	67.3	0	0	0	111	V459 T460 F461	L326-V459 HydrophobicContact CB-CG1 4.17Å; L326-T460 PolarHBondContact O-N 2.88Å; L326-F461 HydrophobicContact CD2-CD1 3.92Å; L326-F461 HydrophobicContact CD2-CE1 3.77Å; L326-F461 HydrophobicContact CG-CD1 4.45Å; L326-F461 PolarHBondContact O-N 3.35Å
327	G	91.3	Very high	92.7	Very high	2 Å²	2	35.8 Å²	35.8	2%	0.021	19%	0.186	C	C	.	.	S	Bend	trans	106.7	161.9	-179.8	0	0	0	0	0	112.7	K329 Q462 Y464	G327-K329 PolarHBondContact O-N 2.95Å; G327-K329 PolarHBondContact O-NZ 3.25Å; G327-Q462 WeakPolarHBondContact CA-O 3.37Å; G327-Y464 WeakPolarHBondContact CA-OH 3.06Å; G327-Y464 PolarHBondContact N-OH 2.87Å; G327-Y464 WeakPolarHBondContact O-CE1 3.4Å; G327-Y464 PolarHBondContact O-OH 3.49Å
328	S	92.6	Very high	92.7	Very high	7 Å²	7	34.8 Å²	34.8	5%	0.049	18%	0.184	C	C	.	.			trans	-62.9	128.2	175.1	-178.6	0	0	0	0	109.9	K330 T460 Q462 E467	S328-K330 PolarHBondContact OG-N 3.36Å; S328-T460 PolarHBondContact O-OG1 3.42Å; S328-Q462 PolarHBondContact N-O 3.46Å; S328-Q462 PolarHBondContact O-OE1 3.03Å; S328-E467 VanDerWaalsContact CB-OE1 3.32Å; S328-E467 WeakPolarHBondContact CB-OE1 3.47Å; S328-E467 PolarHBondContact OG-OE1 2.87Å
329	K	92.8	Very high	92.8	Very high	1 Å²	1	36.3 Å²	36.3	0%	0.004	19%	0.19	C	C	.	.			trans	-98.7	0.2	177	-67.4	163	-68.7	-64.9	0	111.8	V323 G325 G327 T331 L332 L333 I434 D435	V323-K329 HydrophobicContact CB-CD 4.14Å; V323-K329 HydrophobicContact CG1-CD 3.67Å; V323-K329 HydrophobicContact CG1-CG 4.27Å; G325-K329 PolarHBondContact O-NZ 3.05Å; G327-K329 PolarHBondContact O-N 2.95Å; G327-K329 PolarHBondContact O-NZ 3.25Å; K329-T331 PolarHBondContact O-N 2.87Å; K329-L332 WeakPolarHBondContact O-CB 3.46Å; K329-L332 PolarHBondContact O-N 3.47Å; K329-L333 PolarHBondContact O-N 3.28Å; K329-I434 WeakPolarHBondContact CE-O 3.23Å; K329-I434 PolarHBondContact NZ-O 3.17Å; K329-I434 VanDerWaalsContact NZ-O 3.13Å; K329-D435 IonicContact NZ-OD1 3.65Å; K329-D435 PolarHBondContact NZ-OD1 2.78Å; K329-D435 IonicContact NZ-OD2 3.72Å; K329-D435 PolarHBondContact NZ-OD2 3.21Å; K329-D435 VanDerWaalsContact NZ-OD2 3.09Å
330	K	92.1	Very high	92.4	Very high	49 Å²	49	35.2 Å²	35.2	21%	0.213	19%	0.186	C	C	.	.	H	α-helix	trans	-59.5	-49.5	-174.7	-172.4	-171.6	171.9	-169.2	0	111.3	S328 L332 L333 E334 E466	S328-K330 PolarHBondContact OG-N 3.36Å; K330-L332 VanDerWaalsContact C-N 3.27Å; K330-L332 PolarHBondContact O-N 3.13Å; K330-L333 PolarHBondContact O-N 3.5Å; K330-E334 WeakPolarHBondContact O-CB 2.93Å; K330-E334 PolarHBondContact O-N 3.2Å; K330-E466 VanDerWaalsContact CD-OE2 3.32Å; K330-E466 WeakPolarHBondContact CD-OE2 3.39Å; K330-E466 WeakPolarHBondContact CE-OE2 3.48Å; K330-E466 IonicContact NZ-OE1 3.61Å; K330-E466 PolarHBondContact NZ-OE1 3.12Å; K330-E466 IonicContact NZ-OE2 2.7Å; K330-E466 PolarHBondContact NZ-OE2 3.06Å
331	T	91.9	Very high	92	Very high	67 Å²	67	35.1 Å²	35.1	41%	0.411	19%	0.185	S	C	.	.	H	α-helix	trans	-59.3	-39.2	178.5	-53.8	0	0	0	0	112	K329 E334 D335 Q462	K329-T331 PolarHBondContact O-N 2.87Å; T331-E334 PolarHBondContact O-N 3.45Å; T331-D335 WeakPolarHBondContact O-CB 3.22Å; T331-D335 VanDerWaalsContact O-CG 3.32Å; T331-D335 PolarHBondContact O-N 2.95Å; T331-Q462 PolarHBondContact OG1-OE1 3.38Å
332	L	92.9	Very high	91.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.8	-43.8	178.7	-176.2	70.3	0	0	0	112.1	H304 F308 W311 K329 K330 D335 F336 C458	H304-L332 HydrophobicContact CB-CD1 3.64Å; H304-L332 HydrophobicContact CB-CD2 4.15Å; F308-L332 HydrophobicContact CE1-CD1 3.76Å; F308-L332 HydrophobicContact CE1-CG 4.16Å; F308-L332 HydrophobicContact CZ-CD1 3.67Å; F308-L332 HydrophobicContact CZ-CG 4.28Å; F308-L332 WeakPolarHBondContact CZ-O 3.24Å; W311-L332 HydrophobicContact CH2-CD2 4.09Å; K329-L332 WeakPolarHBondContact O-CB 3.46Å; K329-L332 PolarHBondContact O-N 3.47Å; K330-L332 VanDerWaalsContact C-N 3.27Å; K330-L332 PolarHBondContact O-N 3.13Å; L332-D335 PolarHBondContact O-N 3.45Å; L332-F336 PolarHBondContact O-N 3.02Å; L332-C458 HydrophobicContact CD2-CB 3.62Å
333	L	92.4	Very high	90.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-71.5	-34.5	178.5	-70.7	-179.3	0	0	0	112.4	W311 V323 K329 K330 F336 R337 V431	W311-L333 HydrophobicContact CZ3-CD2 4.29Å; V323-L333 HydrophobicContact CG2-CD2 4.28Å; K329-L333 PolarHBondContact O-N 3.28Å; K330-L333 PolarHBondContact O-N 3.5Å; L333-F336 WeakPolarHBondContact O-CB 3.43Å; L333-F336 PolarHBondContact O-N 3.33Å; L333-R337 WeakPolarHBondContact O-CB 3.32Å; L333-R337 PolarHBondContact O-N 2.96Å; L333-V431 HydrophobicContact CD2-CG1 3.61Å
334	E	92.1	Very high	90.3	Very high	62 Å²	62	50.9 Å²	50.9	29%	0.29	27%	0.268	S	S	.	.	H	α-helix	trans	-67.7	-40	173.4	-170.9	61.8	-155.6	0	0	111.1	K330 T331 F336 R337 V338	K330-E334 WeakPolarHBondContact O-CB 2.93Å; K330-E334 PolarHBondContact O-N 3.2Å; T331-E334 PolarHBondContact O-N 3.45Å; E334-F336 VanDerWaalsContact C-N 3.32Å; E334-F336 PolarHBondContact O-N 3.37Å; E334-R337 WeakPolarHBondContact O-CB 3.29Å; E334-R337 PolarHBondContact O-N 3.33Å; E334-R337 VanDerWaalsContact O-N 3.17Å; E334-R337 IonicContact OE1-CZ 3.03Å; E334-R337 IonicContact OE1-NH1 3.99Å; E334-R337 PolarHBondContact OE1-NH1 3.27Å; E334-R337 IonicContact OE2-NH1 2.75Å; E334-R337 PolarHBondContact OE2-NH1 2.91Å; E334-V338 WeakPolarHBondContact O-CG2 3.34Å; E334-V338 PolarHBondContact O-N 3.29Å
335	D	92.4	Very high	89.9	Confident	40 Å²	40	50.4 Å²	50.4	21%	0.214	27%	0.271	C	S	.	.	H	α-helix	trans	-62.9	-39.1	173.3	-80.8	-0.3	0	0	0	112.1	H301 R305 F308 T331 L332 R337 S339	H301-D335 IonicContact CE1-OD2 2.76Å; H301-D335 PolarHBondContact CE1-OD2 2.92Å; H301-D335 IonicContact ND1-OD2 3.96Å; H301-D335 IonicContact NE2-OD2 2.55Å; R305-D335 IonicContact CZ-OD2 2.58Å; R305-D335 VanDerWaalsContact CZ-OD2 3.28Å; R305-D335 IonicContact NE-OD2 3.09Å; R305-D335 PolarHBondContact NE-OD2 2.82Å; R305-D335 VanDerWaalsContact NE-OD2 3.09Å; R305-D335 IonicContact NH2-OD2 3.78Å; R305-D335 PolarHBondContact NH2-OD2 3.32Å; F308-D335 HydrophobicContact CE2-CB 4.26Å; F308-D335 HydrophobicContact CZ-CB 4.31Å; T331-D335 WeakPolarHBondContact O-CB 3.22Å; T331-D335 VanDerWaalsContact O-CG 3.32Å; T331-D335 PolarHBondContact O-N 2.95Å; L332-D335 PolarHBondContact O-N 3.45Å; D335-R337 VanDerWaalsContact C-N 3.34Å; D335-S339 VanDerWaalsContact O-CB 3.29Å; D335-S339 WeakPolarHBondContact O-CB 3.33Å; D335-S339 PolarHBondContact O-N 3.12Å; D335-S339 PolarHBondContact O-OG 3.32Å
336	F	92.6	Very high	89.8	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-44.1	172.4	177.1	-108.6	0	0	0	111.3	F308 W311 L315 L332 L333 E334 S339 H340 L341 L401 V431	F308-F336 HydrophobicContact CB-CD2 3.82Å; F308-F336 HydrophobicContact CB-CE2 4.16Å; F308-F336 HydrophobicContact CD1-CB 4.26Å; F308-F336 AromaticContact CD1-CD2 3.75Å; F308-F336 HydrophobicContact CD1-CD2 3.75Å; F308-F336 HydrophobicContact CD1-CG 4.42Å; F308-F336 HydrophobicContact CD2-CD2 4.26Å; F308-F336 HydrophobicContact CE1-CB 3.97Å; F308-F336 HydrophobicContact CE1-CD2 4.31Å; F308-F336 HydrophobicContact CE2-CB 4.25Å; F308-F336 AromaticContact CG-CD2 3.71Å; F308-F336 HydrophobicContact CG-CD2 3.71Å; F308-F336 HydrophobicContact CZ-CB 3.95Å; W311-F336 HydrophobicContact CB-CE2 4.2Å; W311-F336 HydrophobicContact CB-CZ 4.46Å; W311-F336 HydrophobicContact CE3-CD2 4.15Å; W311-F336 HydrophobicContact CE3-CE2 4.35Å; W311-F336 HydrophobicContact CE3-CG 4.39Å; L315-F336 HydrophobicContact CD1-CE1 4.24Å; L315-F336 HydrophobicContact CD1-CZ 3.9Å; L332-F336 PolarHBondContact O-N 3.02Å; L333-F336 WeakPolarHBondContact O-CB 3.43Å; L333-F336 PolarHBondContact O-N 3.33Å; E334-F336 VanDerWaalsContact C-N 3.32Å; E334-F336 PolarHBondContact O-N 3.37Å; F336-S339 PolarHBondContact O-OG 3.23Å; F336-H340 HydrophobicContact CD2-CB 4.43Å; F336-H340 HydrophobicContact CE2-CB 4.15Å; F336-H340 PolarHBondContact O-N 3.31Å; F336-L341 HydrophobicContact CD1-CD1 4.01Å; F336-L341 HydrophobicContact CD1-CG 4.44Å; F336-L341 HydrophobicContact CE1-CD1 3.78Å; F336-L341 HydrophobicContact CE1-CD2 4.35Å; F336-L341 HydrophobicContact CE1-CG 4.08Å; F336-L401 HydrophobicContact CD1-CD2 4.37Å; F336-V431 HydrophobicContact CE1-CG2 4.2Å
337	R	91.9	Very high	89.8	Confident	75 Å²	75	48.1 Å²	48.1	28%	0.283	25%	0.253	S	S	.	.	H	α-helix	trans	-60.4	-50.2	176.8	-179.7	-165.3	175.7	-168.2	4.4	112.2	L333 E334 D335 S339 L341 S342 H346 L401	L333-R337 WeakPolarHBondContact O-CB 3.32Å; L333-R337 PolarHBondContact O-N 2.96Å; E334-R337 WeakPolarHBondContact O-CB 3.29Å; E334-R337 PolarHBondContact O-N 3.33Å; E334-R337 VanDerWaalsContact O-N 3.17Å; E334-R337 IonicContact OE1-CZ 3.03Å; E334-R337 IonicContact OE1-NH1 3.99Å; E334-R337 PolarHBondContact OE1-NH1 3.27Å; E334-R337 IonicContact OE2-NH1 2.75Å; E334-R337 PolarHBondContact OE2-NH1 2.91Å; D335-R337 VanDerWaalsContact C-N 3.34Å; R337-S339 PolarHBondContact O-N 3.24Å; R337-L341 HydrophobicContact CB-CD1 4.49Å; R337-L341 HydrophobicContact CG-CB 4.47Å; R337-L341 CarbonylContact O-C 3.55Å; R337-L341 WeakPolarHBondContact O-CA 3.21Å; R337-L341 WeakPolarHBondContact O-CB 3.48Å; R337-L341 PolarHBondContact O-N 2.6Å; R337-S342 PolarHBondContact O-N 3.05Å; R337-H346 PolarHBondContact NE-CD2 3.32Å; R337-H346 PolarHBondContact NE-NE2 3.41Å; R337-H346 PolarHBondContact NH2-NE2 2.92Å; R337-H346 VanDerWaalsContact NH2-NE2 3.14Å; R337-L401 HydrophobicContact CB-CD2 4.2Å
338	V	91.7	Very high	89.9	Confident	95 Å²	95	49.8 Å²	49.8	58%	0.576	26%	0.262	S	S	*	.	H	α-helix	trans	-65.2	-41.2	-178.1	173.2	0	0	0	0	111.4	E334	E334-V338 WeakPolarHBondContact O-CG2 3.34Å; E334-V338 PolarHBondContact O-N 3.29Å
339	S	89.5	Confident	89.9	Confident	64 Å²	64	49.8 Å²	49.8	45%	0.448	26%	0.262	S	S	.	.	H	α-helix	trans	-76.9	-40.8	-175.2	56.9	0	0	0	0	114.3	D335 F336 R337	D335-S339 VanDerWaalsContact O-CB 3.29Å; D335-S339 WeakPolarHBondContact O-CB 3.33Å; D335-S339 PolarHBondContact O-N 3.12Å; D335-S339 PolarHBondContact O-OG 3.32Å; F336-S339 PolarHBondContact O-OG 3.23Å; R337-S339 PolarHBondContact O-N 3.24Å
340	H	85.8	Confident	89.9	Confident	65 Å²	65	51.9 Å²	51.9	30%	0.301	27%	0.274	S	S	.	.	H	α-helix	trans	-114.8	-29.6	-170.7	-76.8	-77.5	0	0	0	114.7	F308 M312 F336	F308-H340 VanDerWaalsContact CB-CD2 3.5Å; F308-H340 WeakPolarHBondContact CB-CD2 3.38Å; F308-H340 WeakPolarHBondContact CB-NE2 3.31Å; M312-H340 HydrophobicContact CE-CB 3.79Å; F336-H340 HydrophobicContact CD2-CB 4.43Å; F336-H340 HydrophobicContact CE2-CB 4.15Å; F336-H340 PolarHBondContact O-N 3.31Å
341	L	85.2	Confident	89.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.263	C	S	.	.	S	Bend	trans	-100.9	8.3	-171.7	-56.6	178.4	0	0	0	114.1	M312 F336 R337 Q343 E344 H346 Y399 L401	M312-L341 HydrophobicContact CE-CD2 3.74Å; F336-L341 HydrophobicContact CD1-CD1 4.01Å; F336-L341 HydrophobicContact CD1-CG 4.44Å; F336-L341 HydrophobicContact CE1-CD1 3.78Å; F336-L341 HydrophobicContact CE1-CD2 4.35Å; F336-L341 HydrophobicContact CE1-CG 4.08Å; R337-L341 HydrophobicContact CB-CD1 4.49Å; R337-L341 HydrophobicContact CG-CB 4.47Å; R337-L341 CarbonylContact O-C 3.55Å; R337-L341 WeakPolarHBondContact O-CA 3.21Å; R337-L341 WeakPolarHBondContact O-CB 3.48Å; R337-L341 PolarHBondContact O-N 2.6Å; L341-Q343 PolarHBondContact O-N 2.88Å; L341-E344 VanDerWaalsContact CD2-OE2 3.31Å; L341-E344 WeakPolarHBondContact CD2-OE2 3.41Å; L341-E344 PolarHBondContact O-N 2.97Å; L341-H346 HydrophobicContact CB-CB 4.46Å; L341-H346 HydrophobicContact CD1-CB 4.5Å; L341-H346 PolarHBondContact O-CE1 3.04Å; L341-H346 PolarHBondContact O-ND1 3.31Å; L341-Y399 HydrophobicContact CD2-CD1 3.64Å; L341-Y399 HydrophobicContact CD2-CD2 4.06Å; L341-Y399 HydrophobicContact CD2-CE1 3.96Å; L341-Y399 HydrophobicContact CD2-CE2 4.38Å; L341-Y399 HydrophobicContact CD2-CG 3.67Å; L341-L401 HydrophobicContact CD1-CD1 3.64Å; L341-L401 HydrophobicContact CD1-CD2 3.95Å; L341-L401 HydrophobicContact CD1-CG 4.18Å
342	S	80.6	Confident	89.3	Confident	84 Å²	84	47.1 Å²	47.1	59%	0.587	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-24.3	-177.1	56.6	0	0	0	0	114.2	R337	R337-S342 PolarHBondContact O-N 3.05Å
343	Q	82.4	Confident	89	Confident	190 Å²	190	50.2 Å²	50.2	89%	0.888	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-8.9	-179.2	-62.9	-176.2	-6.6	0	0	113.4	L341	L341-Q343 PolarHBondContact O-N 2.88Å
344	E	85.3	Confident	88.3	Confident	57 Å²	57	51.2 Å²	51.2	27%	0.266	27%	0.267	S	S	.	.	S	Bend	trans	-109.7	155.8	-175	-65.4	175.6	138.7	0	0	110.9	L341 H346 Y399	L341-E344 VanDerWaalsContact CD2-OE2 3.31Å; L341-E344 WeakPolarHBondContact CD2-OE2 3.41Å; L341-E344 PolarHBondContact O-N 2.97Å; E344-H346 PolarHBondContact O-N 2.89Å; E344-H346 PolarHBondContact O-ND1 3.16Å; E344-Y399 HydrophobicContact CB-CD2 3.84Å; E344-Y399 HydrophobicContact CB-CE2 3.78Å; E344-Y399 VanDerWaalsContact CD-CZ 3.44Å; E344-Y399 VanDerWaalsContact CD-OH 3.27Å; E344-Y399 HydrophobicContact CG-CD2 4.48Å; E344-Y399 HydrophobicContact CG-CE2 3.92Å; E344-Y399 VanDerWaalsContact OE1-CE2 3.32Å; E344-Y399 WeakPolarHBondContact OE1-CE2 3.25Å; E344-Y399 PolarHBondContact OE1-OH 2.9Å; E344-Y399 WeakPolarHBondContact OE2-CE2 3.49Å; E344-Y399 PolarHBondContact OE2-OH 3.16Å
345	I	87.9	Confident	87.6	Confident	81 Å²	81	52.2 Å²	52.2	42%	0.415	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	116.6	177.3	-57.6	173.4	0	0	0	108	V369 L396 I398 Y399	I345-V369 HydrophobicContact CG2-CG1 3.75Å; I345-V369 HydrophobicContact CG2-CG2 4.34Å; I345-L396 HydrophobicContact CD1-CD2 4.37Å; I345-I398 WeakPolarHBondContact O-CA 3.46Å; I345-Y399 PolarHBondContact O-N 3.28Å
346	H	90.6	Very high	87.3	Confident	52 Å²	52	51.5 Å²	51.5	24%	0.241	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	139.7	-177.9	61	-88.6	0	0	0	112.1	R337 L341 E344 Y399 L401	R337-H346 PolarHBondContact NE-CD2 3.32Å; R337-H346 PolarHBondContact NE-NE2 3.41Å; R337-H346 PolarHBondContact NH2-NE2 2.92Å; R337-H346 VanDerWaalsContact NH2-NE2 3.14Å; L341-H346 HydrophobicContact CB-CB 4.46Å; L341-H346 HydrophobicContact CD1-CB 4.5Å; L341-H346 PolarHBondContact O-CE1 3.04Å; L341-H346 PolarHBondContact O-ND1 3.31Å; E344-H346 PolarHBondContact O-N 2.89Å; E344-H346 PolarHBondContact O-ND1 3.16Å; H346-Y399 CarbonylContact C-O 3.59Å; H346-Y399 WeakPolarHBondContact CA-O 3.34Å; H346-L401 HydrophobicContact CB-CD1 4.02Å
347	L	92.1	Very high	87	Confident	19 Å²	19	53.7 Å²	53.7	10%	0.099	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	126.6	174.1	-179	66.5	0	0	0	109.3	V349 A364 L365 Y399 L400 L401	L347-V349 HydrophobicContact CD2-CG2 4.19Å; L347-V349 HydrophobicContact CG-CG2 4.21Å; L347-A364 HydrophobicContact CD1-CB 4.26Å; L347-A364 HydrophobicContact CD2-CB 4.32Å; L347-L365 HydrophobicContact CB-CD2 4.35Å; L347-L365 HydrophobicContact CD2-CD2 3.44Å; L347-L365 VanDerWaalsContact CD2-CD2 3.44Å; L347-L365 HydrophobicContact CD2-CG 3.62Å; L347-Y399 PolarHBondContact N-O 3.25Å; L347-L400 HydrophobicContact CB-CD1 3.95Å; L347-L400 HydrophobicContact CD2-CD1 3.8Å; L347-L400 HydrophobicContact CG-CD1 4.01Å; L347-L401 PolarHBondContact O-N 3.11Å
348	V	93.3	Very high	86.8	Confident	37 Å²	37	51.1 Å²	51.1	22%	0.224	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	120.1	175.5	-177.4	0	0	0	0	109.4	L401	V348-L401 CarbonylContact C-O 3.58Å; V348-L401 HydrophobicContact CG2-CB 4.42Å; V348-L401 HydrophobicContact CG2-CD1 4.29Å
349	V	92.4	Very high	86.5	Confident	8 Å²	8	51.1 Å²	51.1	5%	0.048	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	121.3	176.6	179.5	0	0	0	0	108.8	L347 I356 I361 L400 L401 I402 H403	L347-V349 HydrophobicContact CD2-CG2 4.19Å; L347-V349 HydrophobicContact CG-CG2 4.21Å; V349-I356 HydrophobicContact CG1-CG1 4.32Å; V349-I361 HydrophobicContact CG1-CD1 3.66Å; V349-I361 HydrophobicContact CG1-CG1 3.91Å; V349-I361 HydrophobicContact CG2-CG1 4.23Å; V349-I361 HydrophobicContact CG2-CG2 4.07Å; V349-L400 HydrophobicContact CG2-CD1 3.73Å; V349-L401 PolarHBondContact N-O 2.62Å; V349-I402 HydrophobicContact CB-CG1 4.25Å; V349-I402 WeakPolarHBondContact O-CA 3.49Å; V349-H403 PolarHBondContact O-N 3.21Å
350	N	91.9	Very high	86.5	Confident	45 Å²	45	50.9 Å²	50.9	24%	0.241	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	96.4	175.9	-67.5	-42.7	0	0	0	109.7	F352 F353 H403	N350-F352 VanDerWaalsContact C-N 3.29Å; N350-F352 HydrophobicContact CB-CD1 4.47Å; N350-F352 HydrophobicContact CB-CE1 3.92Å; N350-F352 HydrophobicContact CB-CE2 4.44Å; N350-F352 HydrophobicContact CB-CZ 3.91Å; N350-F352 PolarHBondContact O-N 3.27Å; N350-F353 HydrophobicContact CB-CD2 3.28Å; N350-F353 HydrophobicContact CB-CE2 3.42Å; N350-F353 VanDerWaalsContact CB-CE2 3.42Å; N350-F353 PolarHBondContact O-N 3.09Å; N350-H403 PolarHBondContact OD1-CD2 2.58Å
351	G	87.8	Confident	86.7	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-16.3	-176.5	0	0	0	0	0	115	F353 H403 G407	G351-F353 VanDerWaalsContact C-N 3.28Å; G351-F353 PolarHBondContact O-N 3.13Å; G351-H403 VanDerWaalsContact CA-O 3.22Å; G351-H403 WeakPolarHBondContact CA-O 3.39Å; G351-H403 PolarHBondContact N-O 3.04Å; G351-G407 WeakPolarHBondContact O-CA 3.41Å
352	F	85.6	Confident	86.9	Confident	16 Å²	16	48 Å²	48	7%	0.07	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-13	175.4	59	-100.9	0	0	0	113.6	N350 H403 N404 E467 Y470	N350-F352 VanDerWaalsContact C-N 3.29Å; N350-F352 HydrophobicContact CB-CD1 4.47Å; N350-F352 HydrophobicContact CB-CE1 3.92Å; N350-F352 HydrophobicContact CB-CE2 4.44Å; N350-F352 HydrophobicContact CB-CZ 3.91Å; N350-F352 PolarHBondContact O-N 3.27Å; F352-H403 HydrophobicContact CD1-CB 4.3Å; F352-H403 HydrophobicContact CE1-CB 4.14Å; F352-N404 HydrophobicContact CB-CB 4.41Å; F352-E467 HydrophobicContact CB-CB 4.4Å; F352-E467 HydrophobicContact CB-CG 4.44Å; F352-E467 HydrophobicContact CD1-CG 4.14Å; F352-E467 HydrophobicContact CG-CG 4.33Å; F352-Y470 AromaticContact CD2-CD2 3.89Å; F352-Y470 HydrophobicContact CD2-CD2 3.89Å; F352-Y470 AromaticContact CD2-CE2 3.75Å; F352-Y470 HydrophobicContact CD2-CE2 3.75Å; F352-Y470 HydrophobicContact CE2-CD2 4.43Å; F352-Y470 AromaticContact CE2-CE2 3.82Å; F352-Y470 HydrophobicContact CE2-CE2 3.82Å
353	F	84.8	Confident	87.3	Confident	64 Å²	64	47.2 Å²	47.2	28%	0.281	25%	0.249	S	C	.	.			trans	-71.4	130.4	174.7	-78.3	-83.4	0	0	0	110.8	N350 G351 S355 I356 Y470	N350-F353 HydrophobicContact CB-CD2 3.28Å; N350-F353 HydrophobicContact CB-CE2 3.42Å; N350-F353 VanDerWaalsContact CB-CE2 3.42Å; N350-F353 PolarHBondContact O-N 3.09Å; G351-F353 VanDerWaalsContact C-N 3.28Å; G351-F353 PolarHBondContact O-N 3.13Å; F353-S355 PolarHBondContact O-N 3.3Å; F353-I356 WeakPolarHBondContact O-CG2 3.23Å; F353-I356 PolarHBondContact O-N 3.34Å; F353-Y470 HydrophobicContact CD1-CE1 4.05Å; F353-Y470 AromaticContact CD1-CE2 3.87Å; F353-Y470 HydrophobicContact CD1-CE2 3.87Å; F353-Y470 AromaticContact CD1-CZ 3.59Å; F353-Y470 HydrophobicContact CE1-CE1 4.1Å; F353-Y470 AromaticContact CE1-CE2 3.83Å; F353-Y470 HydrophobicContact CE1-CE2 3.83Å; F353-Y470 AromaticContact CE1-CZ 3.35Å; F353-Y470 WeakPolarHBondContact CE1-OH 3.22Å; F353-Y470 HydrophobicContact CG-CE2 4.49Å; F353-Y470 HydrophobicContact CZ-CE2 4.36Å
354	P	77.5	Confident	87.6	Confident	21 Å²	21	39.1 Å²	39.1	14%	0.136	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-13.9	-178.5	29.1	-35.3	0	0	0	113.8	M409 Y470	P354-M409 VanDerWaalsContact O-CG 3.25Å; P354-M409 WeakPolarHBondContact O-CG 3.5Å; P354-Y470 HydrophobicContact CG-CD1 4.26Å; P354-Y470 HydrophobicContact CG-CG 4.38Å
355	S	79.2	Confident	87.7	Confident	84 Å²	84	36.6 Å²	36.6	59%	0.587	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-1.9	179.3	60.5	0	0	0	0	113.7	F353 T357	F353-S355 PolarHBondContact O-N 3.3Å; S355-T357 PolarHBondContact O-N 2.86Å
356	I	85.2	Confident	87.7	Confident	25 Å²	25	32.7 Å²	32.7	13%	0.128	18%	0.183	C	C	.	.			trans	-73.1	128.7	-178.4	-165.9	61.9	0	0	0	110.2	V349 F353 I361 M409 L410	V349-I356 HydrophobicContact CG1-CG1 4.32Å; F353-I356 WeakPolarHBondContact O-CG2 3.23Å; F353-I356 PolarHBondContact O-N 3.34Å; I356-I361 HydrophobicContact CD1-CD1 4.49Å; I356-I361 HydrophobicContact CD1-CG1 3.97Å; I356-I361 HydrophobicContact CG1-CD1 4.11Å; I356-I361 HydrophobicContact CG1-CG1 4.15Å; I356-M409 HydrophobicContact CG2-CB 4.2Å; I356-M409 WeakPolarHBondContact O-CB 3.03Å; I356-L410 HydrophobicContact CG2-CG 4.42Å
357	T	85.8	Confident	87.4	Confident	46 Å²	46	33.3 Å²	33.3	28%	0.282	19%	0.192	S	C	.	.			trans	-121.2	154.3	175.9	62.3	0	0	0	0	110.2	S355 K359 S360 I361	S355-T357 PolarHBondContact O-N 2.86Å; T357-K359 PolarHBondContact O-N 3.17Å; T357-S360 WeakPolarHBondContact O-CB 3.5Å; T357-S360 PolarHBondContact O-N 3.45Å; T357-S360 VanDerWaalsContact O-N 3.1Å; T357-S360 WeakPolarHBondContact OG1-CB 3.38Å; T357-S360 PolarHBondContact OG1-N 3.24Å; T357-I361 PolarHBondContact O-N 3.4Å
358	L	87.3	Confident	87	Confident	20 Å²	20	39 Å²	39	11%	0.105	22%	0.218	C	C	.	.	H	α-helix	trans	-56	-42	173.6	176.7	67.8	0	0	0	111.1	S360 I361 L362 P379 T415 A418	L358-S360 VanDerWaalsContact C-N 3.29Å; L358-S360 PolarHBondContact O-N 2.75Å; L358-I361 PolarHBondContact O-N 2.96Å; L358-I361 VanDerWaalsContact O-N 3.13Å; L358-L362 HydrophobicContact CD1-CD1 4.22Å; L358-L362 HydrophobicContact CD1-CG 4.14Å; L358-L362 HydrophobicContact CD2-CD1 4.36Å; L358-L362 HydrophobicContact CG-CD1 3.94Å; L358-L362 HydrophobicContact CG-CG 4.25Å; L358-L362 WeakPolarHBondContact O-CG 3.44Å; L358-L362 PolarHBondContact O-N 2.86Å; L358-P379 HydrophobicContact CD2-CB 4.1Å; L358-T415 HydrophobicContact CB-CG2 4.07Å; L358-T415 HydrophobicContact CD1-CG2 4.09Å; L358-A418 HydrophobicContact CD1-CB 3.79Å; L358-A418 HydrophobicContact CD2-CB 3.7Å; L358-A418 HydrophobicContact CG-CB 4.38Å
359	K	87.3	Confident	86.4	Confident	96 Å²	96	39 Å²	39	42%	0.417	22%	0.218	S	C	.	.	H	α-helix	trans	-56	-43.9	176.7	-64.1	178.1	-175.2	171.5	0	111.1	T357 I361 L362 N363 E581	T357-K359 PolarHBondContact O-N 3.17Å; K359-I361 PolarHBondContact O-N 2.99Å; K359-L362 PolarHBondContact O-N 3.44Å; K359-N363 VanDerWaalsContact O-CB 3.24Å; K359-N363 WeakPolarHBondContact O-CB 3.45Å; K359-N363 PolarHBondContact O-N 3.09Å; K359-N363 PolarHBondContact O-ND2 3.39Å; K359-E581 IonicContact NZ-OE2 3Å; K359-E581 PolarHBondContact NZ-OE2 2.93Å
360	S	88.4	Confident	85.8	Confident	58 Å²	58	40.5 Å²	40.5	41%	0.406	23%	0.226	S	C	.	.	H	α-helix	trans	-62.6	-40.6	177.1	-172.2	0	0	0	0	112.7	T357 L358 A364	T357-S360 WeakPolarHBondContact O-CB 3.5Å; T357-S360 PolarHBondContact O-N 3.45Å; T357-S360 VanDerWaalsContact O-N 3.1Å; T357-S360 WeakPolarHBondContact OG1-CB 3.38Å; T357-S360 PolarHBondContact OG1-N 3.24Å; L358-S360 VanDerWaalsContact C-N 3.29Å; L358-S360 PolarHBondContact O-N 2.75Å; S360-A364 WeakPolarHBondContact O-CB 3.49Å; S360-A364 PolarHBondContact O-N 3.39Å
361	I	90.2	Very high	85.2	Confident	4 Å²	4	46 Å²	46	2%	0.021	25%	0.25	C	C	.	.	H	α-helix	trans	-67	-46.9	179.1	-62.2	166.3	0	0	0	110.3	V349 I356 T357 L358 K359 N363 A364 L365 L410	V349-I361 HydrophobicContact CG1-CD1 3.66Å; V349-I361 HydrophobicContact CG1-CG1 3.91Å; V349-I361 HydrophobicContact CG2-CG1 4.23Å; V349-I361 HydrophobicContact CG2-CG2 4.07Å; I356-I361 HydrophobicContact CD1-CD1 4.49Å; I356-I361 HydrophobicContact CD1-CG1 3.97Å; I356-I361 HydrophobicContact CG1-CD1 4.11Å; I356-I361 HydrophobicContact CG1-CG1 4.15Å; T357-I361 PolarHBondContact O-N 3.4Å; L358-I361 PolarHBondContact O-N 2.96Å; L358-I361 VanDerWaalsContact O-N 3.13Å; K359-I361 PolarHBondContact O-N 2.99Å; I361-N363 VanDerWaalsContact C-N 3.35Å; I361-N363 PolarHBondContact O-N 3.4Å; I361-A364 PolarHBondContact O-N 3.28Å; I361-L365 HydrophobicContact CG2-CD1 4.49Å; I361-L365 PolarHBondContact O-N 3.1Å; I361-L410 HydrophobicContact CD1-CD2 3.85Å
362	L	89.2	Confident	84.8	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65	-40	179	-64.6	176.5	0	0	0	111.6	L358 K359 L365 T366 P379 Q382 I383 I386 L422	L358-L362 HydrophobicContact CD1-CD1 4.22Å; L358-L362 HydrophobicContact CD1-CG 4.14Å; L358-L362 HydrophobicContact CD2-CD1 4.36Å; L358-L362 HydrophobicContact CG-CD1 3.94Å; L358-L362 HydrophobicContact CG-CG 4.25Å; L358-L362 WeakPolarHBondContact O-CG 3.44Å; L358-L362 PolarHBondContact O-N 2.86Å; K359-L362 PolarHBondContact O-N 3.44Å; L362-L365 PolarHBondContact O-N 2.99Å; L362-T366 PolarHBondContact O-N 2.84Å; L362-T366 PolarHBondContact O-OG1 3.12Å; L362-P379 HydrophobicContact CD1-CB 3.81Å; L362-Q382 VanDerWaalsContact C-NE2 3.26Å; L362-Q382 VanDerWaalsContact CB-CD 3.42Å; L362-Q382 HydrophobicContact CB-CG 4.15Å; L362-Q382 VanDerWaalsContact CB-OE1 3.28Å; L362-Q382 PolarHBondContact O-NE2 2.72Å; L362-I383 HydrophobicContact CD1-CD1 4.43Å; L362-I383 HydrophobicContact CD1-CG1 4.2Å; L362-I383 HydrophobicContact CD2-CG1 3.91Å; L362-I386 HydrophobicContact CD2-CD1 4.06Å; L362-L422 HydrophobicContact CD2-CD1 3.8Å
363	N	89.1	Confident	84	Confident	68 Å²	68	57.3 Å²	57.3	36%	0.364	30%	0.303	S	S	.	.	H	α-helix	trans	-65.6	-38.3	176.2	-72.2	-16.2	0	0	0	112.3	K359 I361 L365 T366 C367 Q382	K359-N363 VanDerWaalsContact O-CB 3.24Å; K359-N363 WeakPolarHBondContact O-CB 3.45Å; K359-N363 PolarHBondContact O-N 3.09Å; K359-N363 PolarHBondContact O-ND2 3.39Å; I361-N363 VanDerWaalsContact C-N 3.35Å; I361-N363 PolarHBondContact O-N 3.4Å; N363-L365 VanDerWaalsContact C-N 3.34Å; N363-T366 PolarHBondContact O-N 2.91Å; N363-T366 PolarHBondContact O-OG1 3.21Å; N363-C367 WeakPolarHBondContact O-CB 3.48Å; N363-C367 PolarHBondContact O-N 3.44Å; N363-C367 PolarHBondContact O-SG 2.71Å; N363-Q382 PolarHBondContact OD1-NE2 3.35Å
364	A	88.6	Confident	83.3	Confident	20 Å²	20	55.5 Å²	55.5	17%	0.165	30%	0.302	C	S	.	.	H	α-helix	trans	-61.2	-45	172.6	0	0	0	0	0	110.8	L347 S360 I361 E368	L347-A364 HydrophobicContact CD1-CB 4.26Å; L347-A364 HydrophobicContact CD2-CB 4.32Å; S360-A364 WeakPolarHBondContact O-CB 3.49Å; S360-A364 PolarHBondContact O-N 3.39Å; I361-A364 PolarHBondContact O-N 3.28Å; A364-E368 WeakPolarHBondContact O-CA 3.37Å; A364-E368 WeakPolarHBondContact O-CB 3.48Å; A364-E368 PolarHBondContact O-N 3.01Å
365	L	87.9	Confident	83.1	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.021	34%	0.338	C	S	.	.	I	π-helix	trans	-62	-46.2	175.3	-71.1	172.4	0	0	0	112.6	L347 I361 L362 N363 V369 L370 I386 I398 L422	L347-L365 HydrophobicContact CB-CD2 4.35Å; L347-L365 HydrophobicContact CD2-CD2 3.44Å; L347-L365 VanDerWaalsContact CD2-CD2 3.44Å; L347-L365 HydrophobicContact CD2-CG 3.62Å; I361-L365 HydrophobicContact CG2-CD1 4.49Å; I361-L365 PolarHBondContact O-N 3.1Å; L362-L365 PolarHBondContact O-N 2.99Å; N363-L365 VanDerWaalsContact C-N 3.34Å; L365-V369 HydrophobicContact CD2-CG2 4.31Å; L365-V369 VanDerWaalsContact O-CB 3.3Å; L365-V369 WeakPolarHBondContact O-CB 3.21Å; L365-V369 PolarHBondContact O-N 2.96Å; L365-L370 PolarHBondContact O-N 3.23Å; L365-L370 VanDerWaalsContact O-N 3.07Å; L365-I386 HydrophobicContact CB-CD1 4.47Å; L365-I398 HydrophobicContact CD2-CG2 4.39Å; L365-L422 HydrophobicContact CD1-CD1 4.2Å
366	T	86.7	Confident	83.1	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.322	C	S	.	.	I	π-helix	trans	-75.1	-40.3	-176.8	54.9	0	0	0	0	113.6	L362 N363 L370 E371 H372 F376 Q382 I386	L362-T366 PolarHBondContact O-N 2.84Å; L362-T366 PolarHBondContact O-OG1 3.12Å; N363-T366 PolarHBondContact O-N 2.91Å; N363-T366 PolarHBondContact O-OG1 3.21Å; T366-L370 HydrophobicContact CG2-CD1 4.45Å; T366-L370 CarbonylContact O-C 3.47Å; T366-E371 PolarHBondContact O-N 3.03Å; T366-H372 PolarHBondContact O-N 3.06Å; T366-F376 HydrophobicContact CG2-CE2 4.13Å; T366-Q382 HydrophobicContact CG2-CG 3.64Å; T366-Q382 PolarHBondContact OG1-NE2 3.25Å; T366-I386 HydrophobicContact CG2-CD1 3.87Å; T366-I386 HydrophobicContact CG2-CG1 3.79Å
367	C	84.7	Confident	82.5	Confident	65 Å²	65	64.8 Å²	64.8	44%	0.439	36%	0.357	S	S	.	.	I	π-helix	trans	-84.1	-42.6	-174.8	-55.7	0	0	0	0	112	N363 E371	N363-C367 WeakPolarHBondContact O-CB 3.48Å; N363-C367 PolarHBondContact O-N 3.44Å; N363-C367 PolarHBondContact O-SG 2.71Å; C367-E371 WeakPolarHBondContact O-CA 3.46Å
368	E	83.4	Confident	82.4	Confident	139 Å²	139	65.4 Å²	65.4	65%	0.65	36%	0.361	S	S	*	.	I	π-helix	trans	-89.9	-39.7	-174.3	-53.6	-178.4	166	0	0	112.2	A364	A364-E368 WeakPolarHBondContact O-CA 3.37Å; A364-E368 WeakPolarHBondContact O-CB 3.48Å; A364-E368 PolarHBondContact O-N 3.01Å
369	V	81.6	Confident	82.1	Confident	35 Å²	35	66.3 Å²	66.3	21%	0.212	37%	0.367	C	S	.	.	I	π-helix	trans	-91.9	-43.5	-175.6	-177.2	0	0	0	0	112.3	I345 L365 I398	I345-V369 HydrophobicContact CG2-CG1 3.75Å; I345-V369 HydrophobicContact CG2-CG2 4.34Å; L365-V369 HydrophobicContact CD2-CG2 4.31Å; L365-V369 VanDerWaalsContact O-CB 3.3Å; L365-V369 WeakPolarHBondContact O-CB 3.21Å; L365-V369 PolarHBondContact O-N 2.96Å; V369-I398 HydrophobicContact CG1-CD1 3.53Å; V369-I398 HydrophobicContact CG1-CG1 3.97Å
370	L	80.5	Confident	82.1	Confident	41 Å²	41	65.2 Å²	65.2	22%	0.215	37%	0.372	C	S	.	.	S	Bend	trans	-95.6	-1.2	-177.5	-68.6	157.3	0	0	0	113.5	L365 T366 H372 I386	L365-L370 PolarHBondContact O-N 3.23Å; L365-L370 VanDerWaalsContact O-N 3.07Å; T366-L370 HydrophobicContact CG2-CD1 4.45Å; T366-L370 CarbonylContact O-C 3.47Å; L370-H372 PolarHBondContact O-N 3.29Å; L370-I386 HydrophobicContact CD1-CB 4.44Å; L370-I386 HydrophobicContact CD1-CG1 3.85Å; L370-I386 HydrophobicContact CD1-CG2 4.39Å
371	E	79.6	Confident	82	Confident	160 Å²	160	66.8 Å²	66.8	75%	0.748	38%	0.376	S	S	*	.			trans	50.4	25	-179.3	-59.7	-174.7	168	0	0	114.6	T366 C367 Q373	T366-E371 PolarHBondContact O-N 3.03Å; C367-E371 WeakPolarHBondContact O-CA 3.46Å; E371-Q373 PolarHBondContact O-N 3.46Å
372	H	79.4	Confident	81.9	Confident	67 Å²	67	66.9 Å²	66.9	31%	0.31	38%	0.376	S	S	.	.			trans	-84.9	118.9	-179.5	-170.2	68.3	0	0	0	110.6	T366 L370 G374 F376 F385	T366-H372 PolarHBondContact O-N 3.06Å; L370-H372 PolarHBondContact O-N 3.29Å; H372-G374 PolarHBondContact CD2-N 3.33Å; H372-G374 VanDerWaalsContact CD2-N 3.32Å; H372-G374 PolarHBondContact O-N 3.34Å; H372-F376 AromaticContact CD2-CE2 3.79Å; H372-F376 AromaticContact CD2-CZ 3.62Å; H372-F376 AromaticContact NE2-CZ 3.84Å; H372-F385 HydrophobicContact CB-CE1 3.96Å; H372-F385 HydrophobicContact CB-CZ 4.16Å; H372-F385 AromaticContact CD2-CE1 3.96Å; H372-F385 AromaticContact CD2-CZ 3.98Å; H372-F385 AromaticContact CE1-CZ 3.99Å; H372-F385 AromaticContact CG-CE1 3.79Å; H372-F385 AromaticContact CG-CZ 3.67Å; H372-F385 AromaticContact ND1-CZ 3.68Å
373	Q	67.4	Low	81.8	Confident	187 Å²	187	67.2 Å²	67.2	87%	0.874	38%	0.378	S	S	*	.			trans	-82.2	7.8	-177.8	-65.4	-79.2	-24	0	0	113.9	E371	E371-Q373 PolarHBondContact O-N 3.46Å
374	G	70.1	Confident	81.8	Confident	26 Å²	26	70 Å²	70	27%	0.268	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-87.5	139.9	-177.9	0	0	0	0	0	113.4	H372	H372-G374 PolarHBondContact CD2-N 3.33Å; H372-G374 VanDerWaalsContact CD2-N 3.32Å; H372-G374 PolarHBondContact O-N 3.34Å
375	T	73.4	Confident	81.9	Confident	143 Å²	143	71.5 Å²	71.5	88%	0.877	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-91.1	129.6	169	55	0	0	0	0	110.3
376	F	78.9	Confident	81.9	Confident	59 Å²	59	71.4 Å²	71.4	26%	0.259	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-98.3	141.1	174.7	-59.4	-83.8	0	0	0	110.5	T366 H372 Q382 F385	T366-F376 HydrophobicContact CG2-CE2 4.13Å; H372-F376 AromaticContact CD2-CE2 3.79Å; H372-F376 AromaticContact CD2-CZ 3.62Å; H372-F376 AromaticContact NE2-CZ 3.84Å; F376-Q382 HydrophobicContact CB-CB 3.96Å; F376-Q382 HydrophobicContact CB-CG 4.38Å; F376-Q382 HydrophobicContact CD1-CB 4.48Å; F376-Q382 HydrophobicContact CD2-CB 3.94Å; F376-Q382 HydrophobicContact CD2-CG 3.54Å; F376-Q382 HydrophobicContact CE2-CG 4Å; F376-Q382 HydrophobicContact CG-CB 3.86Å; F376-Q382 HydrophobicContact CG-CG 4.01Å; F376-F385 HydrophobicContact CE1-CB 4.08Å; F376-F385 HydrophobicContact CE1-CD1 4.39Å; F376-F385 HydrophobicContact CE1-CG 4.09Å; F376-F385 HydrophobicContact CE2-CD1 4.2Å; F376-F385 HydrophobicContact CZ-CB 4.08Å; F376-F385 AromaticContact CZ-CD1 3.57Å; F376-F385 HydrophobicContact CZ-CD1 3.57Å; F376-F385 HydrophobicContact CZ-CD2 4.29Å; F376-F385 HydrophobicContact CZ-CE1 4.05Å; F376-F385 AromaticContact CZ-CG 3.7Å; F376-F385 HydrophobicContact CZ-CG 3.7Å
377	S	73	Confident	82	Confident	123 Å²	123	72.2 Å²	72.2	86%	0.86	40%	0.397	S	S	*	.	S	Bend	trans	-82.6	-32.5	176.2	-168.6	0	0	0	0	112.3
378	T	83.9	Confident	82.2	Confident	59 Å²	59	73.9 Å²	73.9	36%	0.362	40%	0.399	S	S	.	.			trans	-117.5	132.6	-176.7	-37	0	0	0	0	110.3	S380 D381 Q382	T378-S380 PolarHBondContact O-N 3.1Å; T378-D381 VanDerWaalsContact CB-OD2 3.23Å; T378-D381 WeakPolarHBondContact CB-OD2 3.34Å; T378-D381 PolarHBondContact O-N 2.79Å; T378-D381 PolarHBondContact OG1-OD2 3.2Å; T378-Q382 PolarHBondContact O-N 2.86Å
379	P	81.5	Confident	82.4	Confident	38 Å²	38	68.6 Å²	68.6	25%	0.247	38%	0.376	C	S	.	.	H	α-helix	trans	-57.7	-35.4	174	-26.3	35	0	0	0	113.5	L358 L362 D381 Q382 I383	L358-P379 HydrophobicContact CD2-CB 4.1Å; L362-P379 HydrophobicContact CD1-CB 3.81Å; P379-D381 PolarHBondContact O-N 3.34Å; P379-Q382 WeakPolarHBondContact O-CB 3.28Å; P379-Q382 PolarHBondContact O-N 3.4Å; P379-I383 WeakPolarHBondContact O-CD1 3.22Å; P379-I383 VanDerWaalsContact O-CG1 3.28Å; P379-I383 WeakPolarHBondContact O-CG1 3.18Å; P379-I383 PolarHBondContact O-N 3.43Å
380	S	85.6	Confident	82.5	Confident	73 Å²	73	67.1 Å²	67.1	51%	0.51	37%	0.367	S	S	.	.	H	α-helix	trans	-63.9	-40.4	179	-51.6	0	0	0	0	112.9	T378 Q382 I383 H384	T378-S380 PolarHBondContact O-N 3.1Å; S380-Q382 VanDerWaalsContact C-N 3.31Å; S380-I383 PolarHBondContact O-N 3.31Å; S380-H384 PolarHBondContact O-N 3.48Å
381	D	87.1	Confident	82.9	Confident	92 Å²	92	72.8 Å²	72.8	49%	0.492	39%	0.39	S	S	.	.	H	α-helix	trans	-68.2	-37.4	178.7	-60.3	-28.3	0	0	0	110.5	T378 P379 H384 F385	T378-D381 VanDerWaalsContact CB-OD2 3.23Å; T378-D381 WeakPolarHBondContact CB-OD2 3.34Å; T378-D381 PolarHBondContact O-N 2.79Å; T378-D381 PolarHBondContact OG1-OD2 3.2Å; P379-D381 PolarHBondContact O-N 3.34Å; D381-H384 PolarHBondContact O-N 3.33Å; D381-F385 WeakPolarHBondContact O-CB 3.13Å; D381-F385 PolarHBondContact O-N 3.34Å
382	Q	87.9	Confident	83.3	Confident	6 Å²	6	70.9 Å²	70.9	3%	0.028	39%	0.385	C	S	.	.	H	α-helix	trans	-63.1	-42.2	174.5	-168.1	168.9	17.5	0	0	111.5	L362 N363 T366 F376 T378 P379 S380 F385 I386	L362-Q382 VanDerWaalsContact C-NE2 3.26Å; L362-Q382 VanDerWaalsContact CB-CD 3.42Å; L362-Q382 HydrophobicContact CB-CG 4.15Å; L362-Q382 VanDerWaalsContact CB-OE1 3.28Å; L362-Q382 PolarHBondContact O-NE2 2.72Å; N363-Q382 PolarHBondContact OD1-NE2 3.35Å; T366-Q382 HydrophobicContact CG2-CG 3.64Å; T366-Q382 PolarHBondContact OG1-NE2 3.25Å; F376-Q382 HydrophobicContact CB-CB 3.96Å; F376-Q382 HydrophobicContact CB-CG 4.38Å; F376-Q382 HydrophobicContact CD1-CB 4.48Å; F376-Q382 HydrophobicContact CD2-CB 3.94Å; F376-Q382 HydrophobicContact CD2-CG 3.54Å; F376-Q382 HydrophobicContact CE2-CG 4Å; F376-Q382 HydrophobicContact CG-CB 3.86Å; F376-Q382 HydrophobicContact CG-CG 4.01Å; T378-Q382 PolarHBondContact O-N 2.86Å; P379-Q382 WeakPolarHBondContact O-CB 3.28Å; P379-Q382 PolarHBondContact O-N 3.4Å; S380-Q382 VanDerWaalsContact C-N 3.31Å; Q382-F385 WeakPolarHBondContact O-CB 3.39Å; Q382-F385 PolarHBondContact O-N 3.22Å; Q382-I386 HydrophobicContact CG-CD1 4.26Å; Q382-I386 WeakPolarHBondContact O-CD1 3.22Å; Q382-I386 VanDerWaalsContact O-CG1 3.23Å; Q382-I386 WeakPolarHBondContact O-CG1 3.32Å; Q382-I386 PolarHBondContact O-N 3.07Å
383	I	88.2	Confident	83.6	Confident	7 Å²	7	69.1 Å²	69.1	4%	0.036	38%	0.38	C	S	.	.	H	α-helix	trans	-65.6	-41.4	175.8	-64.4	158.9	0	0	0	110.9	L362 P379 S380 F385 I386 A387 A418 Q421 L422	L362-I383 HydrophobicContact CD1-CD1 4.43Å; L362-I383 HydrophobicContact CD1-CG1 4.2Å; L362-I383 HydrophobicContact CD2-CG1 3.91Å; P379-I383 WeakPolarHBondContact O-CD1 3.22Å; P379-I383 VanDerWaalsContact O-CG1 3.28Å; P379-I383 WeakPolarHBondContact O-CG1 3.18Å; P379-I383 PolarHBondContact O-N 3.43Å; S380-I383 PolarHBondContact O-N 3.31Å; I383-F385 VanDerWaalsContact C-N 3.31Å; I383-F385 PolarHBondContact O-N 2.72Å; I383-I386 PolarHBondContact O-N 3.36Å; I383-A387 WeakPolarHBondContact O-CB 3.35Å; I383-A387 PolarHBondContact O-N 2.89Å; I383-A418 HydrophobicContact CD1-CB 3.42Å; I383-A418 VanDerWaalsContact CD1-CB 3.42Å; I383-Q421 HydrophobicContact CG2-CB 4.01Å; I383-L422 HydrophobicContact CG2-CD2 4.16Å; I383-L422 HydrophobicContact CG2-CG 4.49Å
384	H	89.3	Confident	84.2	Confident	126 Å²	126	64 Å²	64	58%	0.583	36%	0.363	S	S	*	.	H	α-helix	trans	-61.3	-42.1	175.5	-177.6	-81.5	0	0	0	111.5	S380 D381 A387 Q388	S380-H384 PolarHBondContact O-N 3.48Å; D381-H384 PolarHBondContact O-N 3.33Å; H384-A387 PolarHBondContact O-N 3.01Å; H384-Q388 WeakPolarHBondContact O-CB 3.47Å; H384-Q388 PolarHBondContact O-N 2.96Å
385	F	89.3	Confident	84.8	Confident	51 Å²	51	69.9 Å²	69.9	22%	0.224	39%	0.388	C	S	.	.	H	α-helix	trans	-61.7	-45.3	174.2	176.4	-99.7	0	0	0	112.2	H372 F376 D381 Q382 I383 A387 Q388 T389	H372-F385 HydrophobicContact CB-CE1 3.96Å; H372-F385 HydrophobicContact CB-CZ 4.16Å; H372-F385 AromaticContact CD2-CE1 3.96Å; H372-F385 AromaticContact CD2-CZ 3.98Å; H372-F385 AromaticContact CE1-CZ 3.99Å; H372-F385 AromaticContact CG-CE1 3.79Å; H372-F385 AromaticContact CG-CZ 3.67Å; H372-F385 AromaticContact ND1-CZ 3.68Å; F376-F385 HydrophobicContact CE1-CB 4.08Å; F376-F385 HydrophobicContact CE1-CD1 4.39Å; F376-F385 HydrophobicContact CE1-CG 4.09Å; F376-F385 HydrophobicContact CE2-CD1 4.2Å; F376-F385 HydrophobicContact CZ-CB 4.08Å; F376-F385 AromaticContact CZ-CD1 3.57Å; F376-F385 HydrophobicContact CZ-CD1 3.57Å; F376-F385 HydrophobicContact CZ-CD2 4.29Å; F376-F385 HydrophobicContact CZ-CE1 4.05Å; F376-F385 AromaticContact CZ-CG 3.7Å; F376-F385 HydrophobicContact CZ-CG 3.7Å; D381-F385 WeakPolarHBondContact O-CB 3.13Å; D381-F385 PolarHBondContact O-N 3.34Å; Q382-F385 WeakPolarHBondContact O-CB 3.39Å; Q382-F385 PolarHBondContact O-N 3.22Å; I383-F385 VanDerWaalsContact C-N 3.31Å; I383-F385 PolarHBondContact O-N 2.72Å; F385-A387 VanDerWaalsContact C-N 3.33Å; F385-A387 PolarHBondContact O-N 2.98Å; F385-Q388 PolarHBondContact O-N 3.12Å; F385-T389 HydrophobicContact CD1-CG2 4.29Å; F385-T389 HydrophobicContact CD2-CG2 4.27Å; F385-T389 HydrophobicContact CE1-CG2 3.83Å; F385-T389 HydrophobicContact CE2-CG2 3.82Å; F385-T389 HydrophobicContact CG-CG2 4.5Å; F385-T389 HydrophobicContact CZ-CG2 3.58Å; F385-T389 WeakPolarHBondContact O-CG2 3.47Å; F385-T389 PolarHBondContact O-N 3.45Å; F385-T389 PolarHBondContact O-OG1 3.29Å
386	I	88.8	Confident	85.3	Confident	3 Å²	3	66.8 Å²	66.8	2%	0.015	37%	0.366	C	S	.	.	H	α-helix	trans	-59.7	-44.7	174.8	-67.7	162.8	0	0	0	110.5	L362 L365 T366 L370 Q382 I383 Q388 T389 L390 L422 L425	L362-I386 HydrophobicContact CD2-CD1 4.06Å; L365-I386 HydrophobicContact CB-CD1 4.47Å; T366-I386 HydrophobicContact CG2-CD1 3.87Å; T366-I386 HydrophobicContact CG2-CG1 3.79Å; L370-I386 HydrophobicContact CD1-CB 4.44Å; L370-I386 HydrophobicContact CD1-CG1 3.85Å; L370-I386 HydrophobicContact CD1-CG2 4.39Å; Q382-I386 HydrophobicContact CG-CD1 4.26Å; Q382-I386 WeakPolarHBondContact O-CD1 3.22Å; Q382-I386 VanDerWaalsContact O-CG1 3.23Å; Q382-I386 WeakPolarHBondContact O-CG1 3.32Å; Q382-I386 PolarHBondContact O-N 3.07Å; I383-I386 PolarHBondContact O-N 3.36Å; I386-Q388 VanDerWaalsContact C-N 3.32Å; I386-Q388 PolarHBondContact O-N 3.29Å; I386-T389 WeakPolarHBondContact CA-OG1 3.46Å; I386-T389 PolarHBondContact O-N 3.02Å; I386-T389 PolarHBondContact O-OG1 2.98Å; I386-L390 HydrophobicContact CG2-CD1 3.65Å; I386-L390 HydrophobicContact CG2-CG 4.43Å; I386-L390 WeakPolarHBondContact O-CB 3.45Å; I386-L390 VanDerWaalsContact O-CG 3.31Å; I386-L390 WeakPolarHBondContact O-CG 3.15Å; I386-L390 PolarHBondContact O-N 3.31Å; I386-L422 HydrophobicContact CB-CD2 4.42Å; I386-L422 HydrophobicContact CD1-CD2 4.29Å; I386-L422 HydrophobicContact CG2-CD2 3.88Å; I386-L425 HydrophobicContact CG2-CD1 4.43Å
387	A	88.8	Confident	85.7	Confident	16 Å²	16	68 Å²	68	13%	0.132	37%	0.372	C	S	.	.	H	α-helix	trans	-64.2	-36.5	178.6	0	0	0	0	0	112.5	I383 H384 F385 K391 L425	I383-A387 WeakPolarHBondContact O-CB 3.35Å; I383-A387 PolarHBondContact O-N 2.89Å; H384-A387 PolarHBondContact O-N 3.01Å; F385-A387 VanDerWaalsContact C-N 3.33Å; F385-A387 PolarHBondContact O-N 2.98Å; A387-K391 WeakPolarHBondContact O-CD 3.35Å; A387-K391 WeakPolarHBondContact O-CG 3.37Å; A387-K391 PolarHBondContact O-N 3.15Å; A387-K391 VanDerWaalsContact O-N 3.17Å; A387-L425 HydrophobicContact CB-CD1 4.19Å; A387-L425 HydrophobicContact CB-CD2 3.86Å
388	Q	88.4	Confident	86.6	Confident	100 Å²	100	62.4 Å²	62.4	47%	0.467	33%	0.333	S	S	.	.	H	α-helix	trans	-71.9	-47.8	177.6	-173.7	171.8	-6.4	0	0	111.6	H384 F385 I386 L390 K391 D392	H384-Q388 WeakPolarHBondContact O-CB 3.47Å; H384-Q388 PolarHBondContact O-N 2.96Å; F385-Q388 PolarHBondContact O-N 3.12Å; I386-Q388 VanDerWaalsContact C-N 3.32Å; I386-Q388 PolarHBondContact O-N 3.29Å; Q388-L390 VanDerWaalsContact C-N 3.31Å; Q388-L390 PolarHBondContact O-N 3.23Å; Q388-K391 WeakPolarHBondContact O-CB 3.21Å; Q388-K391 PolarHBondContact O-N 3.09Å; Q388-K391 VanDerWaalsContact O-N 3.09Å; Q388-D392 VanDerWaalsContact O-CG 3.27Å; Q388-D392 PolarHBondContact O-N 3Å
389	T	87.1	Confident	87	Confident	29 Å²	29	59.8 Å²	59.8	18%	0.178	32%	0.316	C	S	.	.	H	α-helix	trans	-60.2	-39.9	178.3	48.1	0	0	0	0	112.3	F385 I386 D392 S393	F385-T389 HydrophobicContact CD1-CG2 4.29Å; F385-T389 HydrophobicContact CD2-CG2 4.27Å; F385-T389 HydrophobicContact CE1-CG2 3.83Å; F385-T389 HydrophobicContact CE2-CG2 3.82Å; F385-T389 HydrophobicContact CG-CG2 4.5Å; F385-T389 HydrophobicContact CZ-CG2 3.58Å; F385-T389 WeakPolarHBondContact O-CG2 3.47Å; F385-T389 PolarHBondContact O-N 3.45Å; F385-T389 PolarHBondContact O-OG1 3.29Å; I386-T389 WeakPolarHBondContact CA-OG1 3.46Å; I386-T389 PolarHBondContact O-N 3.02Å; I386-T389 PolarHBondContact O-OG1 2.98Å; T389-D392 PolarHBondContact O-N 3.5Å; T389-S393 PolarHBondContact O-N 3.25Å; T389-S393 PolarHBondContact O-OG 3.05Å
390	L	85.4	Confident	87.5	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-68.6	-35	174.9	-71.8	168.3	0	0	0	112.6	I386 Q388 D392 S393 I398 L425 N427	I386-L390 HydrophobicContact CG2-CD1 3.65Å; I386-L390 HydrophobicContact CG2-CG 4.43Å; I386-L390 WeakPolarHBondContact O-CB 3.45Å; I386-L390 VanDerWaalsContact O-CG 3.31Å; I386-L390 WeakPolarHBondContact O-CG 3.15Å; I386-L390 PolarHBondContact O-N 3.31Å; Q388-L390 VanDerWaalsContact C-N 3.31Å; Q388-L390 PolarHBondContact O-N 3.23Å; L390-D392 VanDerWaalsContact C-N 3.31Å; L390-D392 PolarHBondContact O-N 3.07Å; L390-S393 CarbonylContact O-C 3.58Å; L390-S393 VanDerWaalsContact O-C 3.28Å; L390-S393 PolarHBondContact O-N 3.2Å; L390-S393 VanDerWaalsContact O-O 3.12Å; L390-I398 HydrophobicContact CD2-CD1 3.85Å; L390-L425 HydrophobicContact CD1-CD1 3.6Å; L390-N427 HydrophobicContact CB-CB 4.43Å; L390-N427 HydrophobicContact CD2-CB 4.07Å; L390-N427 PolarHBondContact O-ND2 3.07Å
391	K	87.1	Confident	87.9	Confident	159 Å²	159	54.7 Å²	54.7	69%	0.691	28%	0.281	S	S	*	.	H	α-helix	trans	-65.3	-36	172.9	-77.1	171	-176.8	178.6	0	112.5	A387 Q388 S393	A387-K391 WeakPolarHBondContact O-CD 3.35Å; A387-K391 WeakPolarHBondContact O-CG 3.37Å; A387-K391 PolarHBondContact O-N 3.15Å; A387-K391 VanDerWaalsContact O-N 3.17Å; Q388-K391 WeakPolarHBondContact O-CB 3.21Å; Q388-K391 PolarHBondContact O-N 3.09Å; Q388-K391 VanDerWaalsContact O-N 3.09Å; K391-S393 PolarHBondContact O-N 3.06Å
392	D	88.4	Confident	88.3	Confident	121 Å²	121	50.3 Å²	50.3	65%	0.647	26%	0.258	S	S	*	.	H	α-helix	trans	-71.6	-21.9	178.3	-63.7	-25.8	0	0	0	112	Q388 T389 L390	Q388-D392 VanDerWaalsContact O-CG 3.27Å; Q388-D392 PolarHBondContact O-N 3Å; T389-D392 PolarHBondContact O-N 3.5Å; L390-D392 VanDerWaalsContact C-N 3.31Å; L390-D392 PolarHBondContact O-N 3.07Å
393	S	85.6	Confident	88.6	Confident	30 Å²	30	50.1 Å²	50.1	21%	0.21	26%	0.257	C	S	.	.			trans	-126.9	80.6	-177.1	54.3	0	0	0	0	112.4	T389 L390 K391 D395 L396 N427	T389-S393 PolarHBondContact O-N 3.25Å; T389-S393 PolarHBondContact O-OG 3.05Å; L390-S393 CarbonylContact O-C 3.58Å; L390-S393 VanDerWaalsContact O-C 3.28Å; L390-S393 PolarHBondContact O-N 3.2Å; L390-S393 VanDerWaalsContact O-O 3.12Å; K391-S393 PolarHBondContact O-N 3.06Å; S393-D395 VanDerWaalsContact C-N 3.26Å; S393-D395 PolarHBondContact O-N 3.34Å; S393-L396 PolarHBondContact O-N 3.11Å; S393-L396 WeakPolarHBondContact OG-CD1 3.12Å; S393-N427 PolarHBondContact O-ND2 3.25Å; S393-N427 VanDerWaalsContact O-ND2 3.14Å
394	P	79.9	Confident	88.7	Confident	80 Å²	80	50.4 Å²	50.4	52%	0.519	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-20.5	-175.7	27.7	-35.3	0	0	0	114.3	L396	P394-L396 VanDerWaalsContact C-N 3.33Å
395	D	82.6	Confident	88.8	Confident	148 Å²	148	44.5 Å²	44.5	79%	0.791	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-10.8	-178.3	-60.7	-30	0	0	0	113.2	S393 H397	S393-D395 VanDerWaalsContact C-N 3.26Å; S393-D395 PolarHBondContact O-N 3.34Å; D395-H397 PolarHBondContact O-N 2.98Å
396	L	84.8	Confident	88.8	Confident	78 Å²	78	42.8 Å²	42.8	41%	0.408	22%	0.224	S	C	.	.			trans	-88.6	95.9	-177.6	-71.7	178	0	0	0	110.8	I345 S393 P394 N427	I345-L396 HydrophobicContact CD1-CD2 4.37Å; S393-L396 PolarHBondContact O-N 3.11Å; S393-L396 WeakPolarHBondContact OG-CD1 3.12Å; P394-L396 VanDerWaalsContact C-N 3.33Å; L396-N427 WeakPolarHBondContact O-CB 3.49Å
397	H	88.3	Confident	88.7	Confident	84 Å²	84	42.9 Å²	42.9	39%	0.389	23%	0.226	S	C	.	.			trans	-89	126.2	171.3	-63	-73.2	0	0	0	111.3	D395 Y399 N427 H429	D395-H397 PolarHBondContact O-N 2.98Å; H397-Y399 HydrophobicContact CB-CE2 4.25Å; H397-N427 WeakPolarHBondContact CA-O 3.4Å; H397-H429 AromaticContact ND1-NE2 3.38Å; H397-H429 PolarHBondContact ND1-NE2 2.84Å
398	I	90.6	Very high	88.5	Confident	6 Å²	6	44.2 Å²	44.2	3%	0.031	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.2	178.9	-57.6	170.7	0	0	0	109.1	I345 L365 V369 L390 N427 L428 H429	I345-I398 WeakPolarHBondContact O-CA 3.46Å; L365-I398 HydrophobicContact CD2-CG2 4.39Å; V369-I398 HydrophobicContact CG1-CD1 3.53Å; V369-I398 HydrophobicContact CG1-CG1 3.97Å; L390-I398 HydrophobicContact CD2-CD1 3.85Å; I398-N427 PolarHBondContact N-O 2.65Å; I398-L428 WeakPolarHBondContact O-CA 3.11Å; I398-H429 PolarHBondContact O-N 3.47Å
399	Y	92.2	Very high	88.2	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.016	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	117.8	176.1	-67.2	-96.5	0	0	0	110.8	M312 L315 L341 E344 I345 H346 L347 H397 H429	M312-Y399 HydrophobicContact CE-CE1 4.48Å; M312-Y399 HydrophobicContact SD-CE1 4.2Å; L315-Y399 HydrophobicContact CB-CE1 4.27Å; L315-Y399 HydrophobicContact CD1-CD1 4.34Å; L315-Y399 HydrophobicContact CD1-CE1 4.19Å; L341-Y399 HydrophobicContact CD2-CD1 3.64Å; L341-Y399 HydrophobicContact CD2-CD2 4.06Å; L341-Y399 HydrophobicContact CD2-CE1 3.96Å; L341-Y399 HydrophobicContact CD2-CE2 4.38Å; L341-Y399 HydrophobicContact CD2-CG 3.67Å; E344-Y399 HydrophobicContact CB-CD2 3.84Å; E344-Y399 HydrophobicContact CB-CE2 3.78Å; E344-Y399 VanDerWaalsContact CD-CZ 3.44Å; E344-Y399 VanDerWaalsContact CD-OH 3.27Å; E344-Y399 HydrophobicContact CG-CD2 4.48Å; E344-Y399 HydrophobicContact CG-CE2 3.92Å; E344-Y399 VanDerWaalsContact OE1-CE2 3.32Å; E344-Y399 WeakPolarHBondContact OE1-CE2 3.25Å; E344-Y399 PolarHBondContact OE1-OH 2.9Å; E344-Y399 WeakPolarHBondContact OE2-CE2 3.49Å; E344-Y399 PolarHBondContact OE2-OH 3.16Å; I345-Y399 PolarHBondContact O-N 3.28Å; H346-Y399 CarbonylContact C-O 3.59Å; H346-Y399 WeakPolarHBondContact CA-O 3.34Å; L347-Y399 PolarHBondContact N-O 3.25Å; H397-Y399 HydrophobicContact CB-CE2 4.25Å; Y399-H429 CarbonylContact C-O 3.53Å; Y399-H429 WeakPolarHBondContact CA-O 3.49Å; Y399-H429 HydrophobicContact CD1-CB 3.59Å; Y399-H429 HydrophobicContact CE1-CB 3.75Å; Y399-H429 AromaticContact CE1-CD2 3.67Å; Y399-H429 AromaticContact CE1-CG 3.95Å; Y399-H429 HydrophobicContact CG-CB 4.31Å; Y399-H429 AromaticContact CZ-CD2 3.66Å
400	L	92.9	Very high	88.2	Confident	3 Å²	3	40.2 Å²	40.2	2%	0.016	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	115	177	-174.4	59.1	0	0	0	109.4	L347 V349 I402 L419 L428 H429 L430 V431	L347-L400 HydrophobicContact CB-CD1 3.95Å; L347-L400 HydrophobicContact CD2-CD1 3.8Å; L347-L400 HydrophobicContact CG-CD1 4.01Å; V349-L400 HydrophobicContact CG2-CD1 3.73Å; L400-I402 HydrophobicContact CD2-CD1 4.05Å; L400-I402 HydrophobicContact CD2-CG1 4.36Å; L400-I402 HydrophobicContact CG-CD1 4.21Å; L400-I402 HydrophobicContact CG-CG1 3.96Å; L400-L419 HydrophobicContact CD2-CD2 4.48Å; L400-L428 HydrophobicContact CB-CD2 4.13Å; L400-L428 HydrophobicContact CD2-CD2 4.37Å; L400-H429 PolarHBondContact N-O 3Å; L400-L430 HydrophobicContact CB-CD1 4.08Å; L400-L430 HydrophobicContact CD2-CD1 3.98Å; L400-L430 HydrophobicContact CG-CD1 3.93Å; L400-L430 WeakPolarHBondContact O-CA 3.15Å; L400-V431 PolarHBondContact O-N 3.18Å
401	L	94.5	Very high	88.3	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	116.6	174.7	-62.5	94.5	0	0	0	109.1	F336 R337 L341 H346 L347 V348 V349 V431	F336-L401 HydrophobicContact CD1-CD2 4.37Å; R337-L401 HydrophobicContact CB-CD2 4.2Å; L341-L401 HydrophobicContact CD1-CD1 3.64Å; L341-L401 HydrophobicContact CD1-CD2 3.95Å; L341-L401 HydrophobicContact CD1-CG 4.18Å; H346-L401 HydrophobicContact CB-CD1 4.02Å; L347-L401 PolarHBondContact O-N 3.11Å; V348-L401 CarbonylContact C-O 3.58Å; V348-L401 HydrophobicContact CG2-CB 4.42Å; V348-L401 HydrophobicContact CG2-CD1 4.29Å; V349-L401 PolarHBondContact N-O 2.62Å; L401-V431 CarbonylContact C-O 3.48Å; L401-V431 WeakPolarHBondContact CA-O 3.34Å
402	I	94.7	Very high	88.3	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	107.8	178.1	-52.2	-174.2	0	0	0	109.4	V349 L400 I405 L410 L419 L430 V431 A432 S433	V349-I402 HydrophobicContact CB-CG1 4.25Å; V349-I402 WeakPolarHBondContact O-CA 3.49Å; L400-I402 HydrophobicContact CD2-CD1 4.05Å; L400-I402 HydrophobicContact CD2-CG1 4.36Å; L400-I402 HydrophobicContact CG-CD1 4.21Å; L400-I402 HydrophobicContact CG-CG1 3.96Å; I402-I405 HydrophobicContact CG2-CB 4.11Å; I402-I405 HydrophobicContact CG2-CG1 4.45Å; I402-L410 HydrophobicContact CG2-CD1 4.27Å; I402-L419 HydrophobicContact CD1-CD1 4.15Å; I402-L419 HydrophobicContact CD1-CD2 4.05Å; I402-L430 HydrophobicContact CD1-CD1 3.55Å; I402-L430 HydrophobicContact CG1-CD1 3.69Å; I402-V431 PolarHBondContact N-O 2.91Å; I402-A432 HydrophobicContact CB-CB 4.39Å; I402-A432 CarbonylContact O-C 3.28Å; I402-A432 WeakPolarHBondContact O-CA 3.49Å; I402-S433 PolarHBondContact O-N 2.68Å; I402-S433 PolarHBondContact O-OG 3.17Å
403	H	93.5	Very high	88.3	Confident	3 Å²	3	39.6 Å²	39.6	1%	0.014	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	128.3	165.3	-59.3	-79.6	0	0	0	108.8	V349 N350 G351 F352 S433	V349-H403 PolarHBondContact O-N 3.21Å; N350-H403 PolarHBondContact OD1-CD2 2.58Å; G351-H403 VanDerWaalsContact CA-O 3.22Å; G351-H403 WeakPolarHBondContact CA-O 3.39Å; G351-H403 PolarHBondContact N-O 3.04Å; F352-H403 HydrophobicContact CD1-CB 4.3Å; F352-H403 HydrophobicContact CE1-CB 4.14Å; H403-S433 VanDerWaalsContact CA-OG 3.29Å; H403-S433 WeakPolarHBondContact CA-OG 3.45Å
404	N	91.6	Very high	88.4	Confident	13 Å²	13	44 Å²	44	7%	0.07	23%	0.23	C	C	.	.			trans	51	73.9	179.9	-68.4	97.7	0	0	0	114	F352 D406 G407 S433 D435	F352-N404 HydrophobicContact CB-CB 4.41Å; N404-D406 VanDerWaalsContact C-OD1 3.28Å; N404-D406 VanDerWaalsContact CA-OD1 3.22Å; N404-D406 WeakPolarHBondContact CA-OD1 3.31Å; N404-D406 VanDerWaalsContact CB-OD1 3.32Å; N404-D406 WeakPolarHBondContact CB-OD1 3.41Å; N404-D406 PolarHBondContact ND2-OD1 2.96Å; N404-D406 PolarHBondContact O-N 3.29Å; N404-D406 VanDerWaalsContact O-N 3.1Å; N404-G407 PolarHBondContact O-N 2.96Å; N404-S433 WeakPolarHBondContact CA-O 3.08Å; N404-S433 PolarHBondContact N-OG 3.26Å; N404-D435 PolarHBondContact ND2-OD2 3.12Å
405	I	91.4	Very high	88.9	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-18.1	173.8	-166.8	164	0	0	0	112.8	I402 G407 L410 Q416 A432 S433 I434 W443 W453	I402-I405 HydrophobicContact CG2-CB 4.11Å; I402-I405 HydrophobicContact CG2-CG1 4.45Å; I405-G407 VanDerWaalsContact C-N 3.31Å; I405-L410 WeakPolarHBondContact O-CB 3.5Å; I405-Q416 PolarHBondContact O-NE2 3.21Å; I405-A432 HydrophobicContact CB-CB 4.19Å; I405-A432 HydrophobicContact CD1-CB 4.09Å; I405-A432 HydrophobicContact CG2-CB 4.33Å; I405-S433 WeakPolarHBondContact CG2-O 3.5Å; I405-S433 PolarHBondContact N-O 3.43Å; I405-I434 HydrophobicContact CG2-CG1 3.95Å; I405-W443 HydrophobicContact CD1-CZ2 4.21Å; I405-W443 HydrophobicContact CG2-CH2 4.44Å; I405-W443 HydrophobicContact CG2-CZ2 4.01Å; I405-W453 HydrophobicContact CD1-CH2 4.11Å; I405-W453 HydrophobicContact CD1-CZ2 3.98Å
406	D	89.1	Confident	89.4	Confident	15 Å²	15	34.2 Å²	34.2	8%	0.08	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	9.3	176.2	61.6	-19.7	0	0	0	114.2	N404 R411 D435 H436 A439	N404-D406 VanDerWaalsContact C-OD1 3.28Å; N404-D406 VanDerWaalsContact CA-OD1 3.22Å; N404-D406 WeakPolarHBondContact CA-OD1 3.31Å; N404-D406 VanDerWaalsContact CB-OD1 3.32Å; N404-D406 WeakPolarHBondContact CB-OD1 3.41Å; N404-D406 PolarHBondContact ND2-OD1 2.96Å; N404-D406 PolarHBondContact O-N 3.29Å; N404-D406 VanDerWaalsContact O-N 3.1Å; D406-R411 PolarHBondContact O-NE 2.92Å; D406-R411 PolarHBondContact O-NH2 3.27Å; D406-R411 VanDerWaalsContact O-NH2 3.11Å; D406-D435 PolarHBondContact OD2-N 3.21Å; D406-H436 HydrophobicContact CB-CB 4.09Å; D406-H436 WeakPolarHBondContact OD2-CA 3.39Å; D406-H436 WeakPolarHBondContact OD2-CB 3.39Å; D406-H436 PolarHBondContact OD2-N 2.89Å; D406-A439 HydrophobicContact CB-CB 4.04Å
407	G	87.1	Confident	89.7	Confident	4 Å²	4	32 Å²	32	4%	0.041	16%	0.164	C	C	.	.			trans	-52	145.7	173.5	0	0	0	0	0	112.5	G351 N404 I405 M409 L410 R411	G351-G407 WeakPolarHBondContact O-CA 3.41Å; N404-G407 PolarHBondContact O-N 2.96Å; I405-G407 VanDerWaalsContact C-N 3.31Å; G407-M409 PolarHBondContact O-N 3.24Å; G407-M409 VanDerWaalsContact O-N 3.12Å; G407-L410 PolarHBondContact O-N 2.81Å; G407-R411 WeakPolarHBondContact O-CG 3.46Å; G407-R411 PolarHBondContact O-N 3.2Å
408	P	82.8	Confident	89.8	Confident	44 Å²	44	28.2 Å²	28.2	29%	0.286	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-34.6	-170.6	23	-33.7	0	0	0	113.6
409	M	83.4	Confident	89.9	Confident	45 Å²	45	28 Å²	28	22%	0.222	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-20.2	178	-60	-61.5	94.2	0	0	113.5	P354 I356 G407	P354-M409 VanDerWaalsContact O-CG 3.25Å; P354-M409 WeakPolarHBondContact O-CG 3.5Å; I356-M409 HydrophobicContact CG2-CB 4.2Å; I356-M409 WeakPolarHBondContact O-CB 3.03Å; G407-M409 PolarHBondContact O-N 3.24Å; G407-M409 VanDerWaalsContact O-N 3.12Å
410	L	86.5	Confident	89.8	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-9.4	-179.7	-61.7	-179.3	0	0	0	113.2	I356 I361 I402 I405 G407 G412 T415 Q416	I356-L410 HydrophobicContact CG2-CG 4.42Å; I361-L410 HydrophobicContact CD1-CD2 3.85Å; I402-L410 HydrophobicContact CG2-CD1 4.27Å; I405-L410 WeakPolarHBondContact O-CB 3.5Å; G407-L410 PolarHBondContact O-N 2.81Å; L410-G412 PolarHBondContact O-N 3.48Å; L410-T415 HydrophobicContact CB-CG2 4.43Å; L410-T415 HydrophobicContact CD2-CG2 3.67Å; L410-Q416 WeakPolarHBondContact O-CG 3.44Å; L410-Q416 PolarHBondContact O-NE2 3.28Å
411	R	87.6	Confident	89.7	Confident	103 Å²	103	31.5 Å²	31.5	39%	0.389	16%	0.163	S	C	.	.			trans	-67.6	-16.2	179	-71.6	172.9	-161.6	160.5	5.2	114.5	D406 G407 E413 V442	D406-R411 PolarHBondContact O-NE 2.92Å; D406-R411 PolarHBondContact O-NH2 3.27Å; D406-R411 VanDerWaalsContact O-NH2 3.11Å; G407-R411 WeakPolarHBondContact O-CG 3.46Å; G407-R411 PolarHBondContact O-N 3.2Å; R411-E413 PolarHBondContact O-N 2.86Å; R411-V442 VanDerWaalsContact O-CG1 3.25Å; R411-V442 WeakPolarHBondContact O-CG1 3.43Å
412	G	87.4	Confident	89.5	Confident	37 Å²	37	31.5 Å²	31.5	38%	0.381	16%	0.163	S	C	.	.	S	Bend	trans	-58.6	137.1	180	0	0	0	0	0	111.9	L410 K414 T415 Q416	L410-G412 PolarHBondContact O-N 3.48Å; G412-K414 VanDerWaalsContact C-N 3.29Å; G412-K414 PolarHBondContact O-N 3.18Å; G412-T415 WeakPolarHBondContact O-CB 3.44Å; G412-T415 PolarHBondContact O-N 3.26Å; G412-T415 VanDerWaalsContact O-N 3.11Å; G412-Q416 PolarHBondContact O-N 3.26Å
413	E	88.6	Confident	89.4	Confident	132 Å²	132	31.8 Å²	31.8	62%	0.617	17%	0.166	S	C	*	.	H	α-helix	trans	-60.7	-39.6	-178.9	179.8	166.1	-160.2	0	0	112.1	R411 T415 Q416 S417 K447	R411-E413 PolarHBondContact O-N 2.86Å; E413-T415 VanDerWaalsContact C-N 3.34Å; E413-T415 PolarHBondContact O-N 3.03Å; E413-Q416 PolarHBondContact O-N 2.85Å; E413-S417 VanDerWaalsContact O-CB 3.3Å; E413-S417 WeakPolarHBondContact O-CB 3.42Å; E413-S417 PolarHBondContact O-N 3.24Å; E413-K447 IonicContact OE1-NZ 2.65Å; E413-K447 PolarHBondContact OE1-NZ 3.47Å
414	K	88.1	Confident	89.3	Confident	123 Å²	123	34.2 Å²	34.2	54%	0.535	19%	0.186	S	C	.	.	H	α-helix	trans	-56.5	-46.9	174	-67.3	171.7	177.7	163	0	111	G412 S417 A418 D585	G412-K414 VanDerWaalsContact C-N 3.29Å; G412-K414 PolarHBondContact O-N 3.18Å; K414-S417 PolarHBondContact O-N 3.03Å; K414-A418 WeakPolarHBondContact O-CB 3.39Å; K414-A418 PolarHBondContact O-N 2.93Å; K414-D585 PolarHBondContact NZ-O 3.24Å; K414-D585 VanDerWaalsContact NZ-O 3.17Å; K414-D585 IonicContact NZ-OD1 3.56Å; K414-D585 PolarHBondContact NZ-OD1 3.09Å
415	T	90.1	Very high	89.2	Confident	18 Å²	18	34.7 Å²	34.7	11%	0.11	19%	0.189	C	C	.	.	H	α-helix	trans	-64.9	-47.2	179.3	-54.9	0	0	0	0	112.3	L358 L410 G412 E413 S417 A418 L419	L358-T415 HydrophobicContact CB-CG2 4.07Å; L358-T415 HydrophobicContact CD1-CG2 4.09Å; L410-T415 HydrophobicContact CB-CG2 4.43Å; L410-T415 HydrophobicContact CD2-CG2 3.67Å; G412-T415 WeakPolarHBondContact O-CB 3.44Å; G412-T415 PolarHBondContact O-N 3.26Å; G412-T415 VanDerWaalsContact O-N 3.11Å; E413-T415 VanDerWaalsContact C-N 3.34Å; E413-T415 PolarHBondContact O-N 3.03Å; T415-S417 PolarHBondContact O-N 2.89Å; T415-A418 WeakPolarHBondContact O-CB 3.28Å; T415-A418 PolarHBondContact O-N 2.8Å; T415-L419 HydrophobicContact CG2-CD1 4.39Å; T415-L419 WeakPolarHBondContact O-CG 3.03Å; T415-L419 PolarHBondContact O-N 3.49Å
416	Q	91.8	Very high	88.9	Confident	3 Å²	3	39.1 Å²	39.1	1%	0.014	22%	0.217	C	C	.	.	H	α-helix	trans	-68.4	-34.8	178.3	-68.3	-66	-36.5	0	0	112.3	I405 L410 G412 E413 A418 L419 G420 V442 K447 F451	I405-Q416 PolarHBondContact O-NE2 3.21Å; L410-Q416 WeakPolarHBondContact O-CG 3.44Å; L410-Q416 PolarHBondContact O-NE2 3.28Å; G412-Q416 PolarHBondContact O-N 3.26Å; E413-Q416 PolarHBondContact O-N 2.85Å; Q416-A418 VanDerWaalsContact C-N 3.35Å; Q416-L419 PolarHBondContact O-N 2.91Å; Q416-G420 PolarHBondContact O-N 2.75Å; Q416-V442 HydrophobicContact CB-CG1 4.33Å; Q416-V442 HydrophobicContact CG-CG1 3.64Å; Q416-K447 HydrophobicContact CB-CD 4.28Å; Q416-F451 WeakPolarHBondContact O-CZ 3.42Å
417	S	91.4	Very high	88.9	Confident	31 Å²	31	39.2 Å²	39.2	22%	0.217	22%	0.218	C	C	.	.	H	α-helix	trans	-65.7	-38.9	173.4	-171.6	0	0	0	0	111.8	E413 K414 T415 G420 Q421	E413-S417 VanDerWaalsContact O-CB 3.3Å; E413-S417 WeakPolarHBondContact O-CB 3.42Å; E413-S417 PolarHBondContact O-N 3.24Å; K414-S417 PolarHBondContact O-N 3.03Å; T415-S417 PolarHBondContact O-N 2.89Å; S417-G420 PolarHBondContact O-N 3Å; S417-Q421 WeakPolarHBondContact O-CG 3.43Å; S417-Q421 PolarHBondContact O-N 3.28Å
418	A	91.1	Very high	89.1	Confident	6 Å²	6	39.3 Å²	39.3	5%	0.05	22%	0.217	C	C	.	.	H	α-helix	trans	-64.2	-46.5	175.1	0	0	0	0	0	111.8	L358 I383 K414 T415 Q416 G420 Q421 L422	L358-A418 HydrophobicContact CD1-CB 3.79Å; L358-A418 HydrophobicContact CD2-CB 3.7Å; L358-A418 HydrophobicContact CG-CB 4.38Å; I383-A418 HydrophobicContact CD1-CB 3.42Å; I383-A418 VanDerWaalsContact CD1-CB 3.42Å; K414-A418 WeakPolarHBondContact O-CB 3.39Å; K414-A418 PolarHBondContact O-N 2.93Å; T415-A418 WeakPolarHBondContact O-CB 3.28Å; T415-A418 PolarHBondContact O-N 2.8Å; Q416-A418 VanDerWaalsContact C-N 3.35Å; A418-G420 VanDerWaalsContact C-N 3.3Å; A418-G420 PolarHBondContact O-N 3.42Å; A418-Q421 PolarHBondContact O-N 3.5Å; A418-L422 WeakPolarHBondContact O-CG 3.46Å; A418-L422 PolarHBondContact O-N 3.11Å; A418-L422 VanDerWaalsContact O-N 3.07Å
419	L	91.4	Very high	89.5	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-62.8	-36.6	174.8	-70.1	175.2	0	0	0	112.1	L400 I402 T415 Q416 L422 A423 F451	L400-L419 HydrophobicContact CD2-CD2 4.48Å; I402-L419 HydrophobicContact CD1-CD1 4.15Å; I402-L419 HydrophobicContact CD1-CD2 4.05Å; T415-L419 HydrophobicContact CG2-CD1 4.39Å; T415-L419 WeakPolarHBondContact O-CG 3.03Å; T415-L419 PolarHBondContact O-N 3.49Å; Q416-L419 PolarHBondContact O-N 2.91Å; L419-L422 HydrophobicContact CD2-CD1 4.46Å; L419-L422 PolarHBondContact O-N 2.97Å; L419-A423 WeakPolarHBondContact O-CB 3.23Å; L419-A423 PolarHBondContact O-N 3.48Å; L419-F451 VanDerWaalsContact C-CE1 3.47Å; L419-F451 HydrophobicContact CB-CE1 3.88Å; L419-F451 HydrophobicContact CB-CZ 3.78Å
420	G	91.6	Very high	90	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62	-46.4	174.5	0	0	0	0	0	111.8	Q416 S417 A418 L422 A423 A424 Q450	Q416-G420 PolarHBondContact O-N 2.75Å; S417-G420 PolarHBondContact O-N 3Å; A418-G420 VanDerWaalsContact C-N 3.3Å; A418-G420 PolarHBondContact O-N 3.42Å; G420-L422 VanDerWaalsContact C-N 3.28Å; G420-L422 PolarHBondContact O-N 3.46Å; G420-A423 PolarHBondContact O-N 3.46Å; G420-A424 PolarHBondContact O-N 2.86Å; G420-Q450 WeakPolarHBondContact O-CB 3.44Å
421	Q	90.8	Very high	90.4	Very high	79 Å²	79	35.6 Å²	35.6	37%	0.369	20%	0.196	S	C	.	.	H	α-helix	trans	-60.9	-37	175.5	-71.3	176.1	16.5	0	0	112.7	I383 S417 A418	I383-Q421 HydrophobicContact CG2-CB 4.01Å; S417-Q421 WeakPolarHBondContact O-CG 3.43Å; S417-Q421 PolarHBondContact O-N 3.28Å; A418-Q421 PolarHBondContact O-N 3.5Å
422	L	90.3	Very high	90.8	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-68.2	-42.8	174.8	-70.3	174.7	0	0	0	112.1	L362 L365 I383 I386 A418 L419 G420 A424 L425 L428	L362-L422 HydrophobicContact CD2-CD1 3.8Å; L365-L422 HydrophobicContact CD1-CD1 4.2Å; I383-L422 HydrophobicContact CG2-CD2 4.16Å; I383-L422 HydrophobicContact CG2-CG 4.49Å; I386-L422 HydrophobicContact CB-CD2 4.42Å; I386-L422 HydrophobicContact CD1-CD2 4.29Å; I386-L422 HydrophobicContact CG2-CD2 3.88Å; A418-L422 WeakPolarHBondContact O-CG 3.46Å; A418-L422 PolarHBondContact O-N 3.11Å; A418-L422 VanDerWaalsContact O-N 3.07Å; L419-L422 HydrophobicContact CD2-CD1 4.46Å; L419-L422 PolarHBondContact O-N 2.97Å; G420-L422 VanDerWaalsContact C-N 3.28Å; G420-L422 PolarHBondContact O-N 3.46Å; L422-A424 PolarHBondContact O-N 2.98Å; L422-L425 HydrophobicContact CD2-CD1 4.46Å; L422-L425 WeakPolarHBondContact O-CB 3.41Å; L422-L425 WeakPolarHBondContact O-CG 3.48Å; L422-L425 PolarHBondContact O-N 2.97Å; L422-L428 HydrophobicContact CB-CD1 4.08Å; L422-L428 HydrophobicContact CD2-CD1 4.39Å
423	A	91.5	Very high	91.1	Very high	7 Å²	7	29 Å²	29	6%	0.058	16%	0.16	C	C	.	.	H	α-helix	trans	-68.4	-22.7	178.9	0	0	0	0	0	113.5	L419 G420 L425 L430 F451	L419-A423 WeakPolarHBondContact O-CB 3.23Å; L419-A423 PolarHBondContact O-N 3.48Å; G420-A423 PolarHBondContact O-N 3.46Å; A423-L425 PolarHBondContact O-N 3.35Å; A423-L430 HydrophobicContact CB-CB 4.43Å; A423-L430 HydrophobicContact CB-CD2 3.92Å; A423-F451 HydrophobicContact CB-CD1 3.54Å; A423-F451 HydrophobicContact CB-CE1 4.05Å; A423-F451 HydrophobicContact CB-CG 4.47Å
424	A	91.4	Very high	91.4	Very high	54 Å²	54	23.2 Å²	23.2	45%	0.446	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-12.2	175.3	0	0	0	0	0	113.2	G420 L422 Q450	G420-A424 PolarHBondContact O-N 2.86Å; L422-A424 PolarHBondContact O-N 2.98Å; A424-Q450 HydrophobicContact CB-CB 4.39Å
425	L	89.2	Confident	91.6	Very high	23 Å²	23	19.5 Å²	19.5	12%	0.12	12%	0.119	C	C	.	.	S	Bend	trans	-78.2	131.7	178.9	-59.4	175.8	0	0	0	110.1	I386 A387 L390 L422 A423 N427 L428	I386-L425 HydrophobicContact CG2-CD1 4.43Å; A387-L425 HydrophobicContact CB-CD1 4.19Å; A387-L425 HydrophobicContact CB-CD2 3.86Å; L390-L425 HydrophobicContact CD1-CD1 3.6Å; L422-L425 HydrophobicContact CD2-CD1 4.46Å; L422-L425 WeakPolarHBondContact O-CB 3.41Å; L422-L425 WeakPolarHBondContact O-CG 3.48Å; L422-L425 PolarHBondContact O-N 2.97Å; A423-L425 PolarHBondContact O-N 3.35Å; L425-N427 PolarHBondContact O-N 3.48Å; L425-L428 HydrophobicContact CB-CB 4.22Å; L425-L428 PolarHBondContact O-N 3.09Å
426	P	86.3	Confident	91.6	Very high	94 Å²	94	22.7 Å²	22.7	61%	0.61	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-23.6	-177.1	26.9	-34.6	0	0	0	113.3	H429	P426-H429 PolarHBondContact O-CE1 3.25Å; P426-H429 VanDerWaalsContact O-CE1 3.27Å
427	N	88.9	Confident	91.5	Very high	18 Å²	18	30.1 Å²	30.1	10%	0.096	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-10.3	-178.2	-62.7	10.8	0	0	0	112.7	L390 S393 L396 H397 I398 L425	L390-N427 HydrophobicContact CB-CB 4.43Å; L390-N427 HydrophobicContact CD2-CB 4.07Å; L390-N427 PolarHBondContact O-ND2 3.07Å; S393-N427 PolarHBondContact O-ND2 3.25Å; S393-N427 VanDerWaalsContact O-ND2 3.14Å; L396-N427 WeakPolarHBondContact O-CB 3.49Å; H397-N427 WeakPolarHBondContact CA-O 3.4Å; I398-N427 PolarHBondContact N-O 2.65Å; L425-N427 PolarHBondContact O-N 3.48Å
428	L	90.6	Very high	91.5	Very high	6 Å²	6	32.9 Å²	32.9	3%	0.031	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	115.6	-178.8	-168.6	155.2	0	0	0	109.4	I398 L400 L422 L425	I398-L428 WeakPolarHBondContact O-CA 3.11Å; L400-L428 HydrophobicContact CB-CD2 4.13Å; L400-L428 HydrophobicContact CD2-CD2 4.37Å; L422-L428 HydrophobicContact CB-CD1 4.08Å; L422-L428 HydrophobicContact CD2-CD1 4.39Å; L425-L428 HydrophobicContact CB-CB 4.22Å; L425-L428 PolarHBondContact O-N 3.09Å
429	H	92.3	Very high	91.3	Very high	7 Å²	7	32.9 Å²	32.9	3%	0.032	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	122.6	-179.2	-59.5	-54.2	0	0	0	109.9	L315 H397 I398 Y399 L400 P426	L315-H429 HydrophobicContact CB-CB 4.2Å; L315-H429 HydrophobicContact CD2-CB 4.06Å; L315-H429 PolarHBondContact O-CE1 3.02Å; L315-H429 PolarHBondContact O-ND1 3.37Å; H397-H429 AromaticContact ND1-NE2 3.38Å; H397-H429 PolarHBondContact ND1-NE2 2.84Å; I398-H429 PolarHBondContact O-N 3.47Å; Y399-H429 CarbonylContact C-O 3.53Å; Y399-H429 WeakPolarHBondContact CA-O 3.49Å; Y399-H429 HydrophobicContact CD1-CB 3.59Å; Y399-H429 HydrophobicContact CE1-CB 3.75Å; Y399-H429 AromaticContact CE1-CD2 3.67Å; Y399-H429 AromaticContact CE1-CG 3.95Å; Y399-H429 HydrophobicContact CG-CB 4.31Å; Y399-H429 AromaticContact CZ-CD2 3.66Å; L400-H429 PolarHBondContact N-O 3Å; P426-H429 PolarHBondContact O-CE1 3.25Å; P426-H429 VanDerWaalsContact O-CE1 3.27Å
430	L	94	Very high	91.3	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	128.9	-176.5	177.4	64.2	0	0	0	111.4	S320 V321 L400 I402 A423 F451 W453	S320-L430 CarbonylContact C-O 3.6Å; S320-L430 WeakPolarHBondContact CA-O 3.09Å; S320-L430 WeakPolarHBondContact CB-O 3.37Å; V321-L430 PolarHBondContact N-O 3.19Å; L400-L430 HydrophobicContact CB-CD1 4.08Å; L400-L430 HydrophobicContact CD2-CD1 3.98Å; L400-L430 HydrophobicContact CG-CD1 3.93Å; L400-L430 WeakPolarHBondContact O-CA 3.15Å; I402-L430 HydrophobicContact CD1-CD1 3.55Å; I402-L430 HydrophobicContact CG1-CD1 3.69Å; A423-L430 HydrophobicContact CB-CB 4.43Å; A423-L430 HydrophobicContact CB-CD2 3.92Å; L430-F451 HydrophobicContact CD2-CD1 3.66Å; L430-F451 HydrophobicContact CD2-CE1 3.72Å; L430-W453 HydrophobicContact CD2-CH2 3.4Å; L430-W453 VanDerWaalsContact CD2-CH2 3.4Å; L430-W453 HydrophobicContact CD2-CZ2 4.14Å; L430-W453 HydrophobicContact CD2-CZ3 4.02Å; L430-W453 HydrophobicContact CG-CH2 3.95Å; L430-W453 HydrophobicContact CG-CZ3 4.2Å
431	V	95.1	Very high	91.2	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	120.6	167.4	-176.6	0	0	0	0	108.3	L315 V321 L333 F336 L400 L401 I402	L315-V431 HydrophobicContact CD1-CG2 3.7Å; L315-V431 HydrophobicContact CD2-CG2 3.75Å; L315-V431 HydrophobicContact CG-CG2 4.36Å; V321-V431 HydrophobicContact CB-CG2 4.42Å; V321-V431 HydrophobicContact CG1-CG1 4.38Å; V321-V431 CarbonylContact O-C 3.59Å; V321-V431 WeakPolarHBondContact O-CA 3.44Å; L333-V431 HydrophobicContact CD2-CG1 3.61Å; F336-V431 HydrophobicContact CE1-CG2 4.2Å; L400-V431 PolarHBondContact O-N 3.18Å; L401-V431 CarbonylContact C-O 3.48Å; L401-V431 WeakPolarHBondContact CA-O 3.34Å; I402-V431 PolarHBondContact N-O 2.91Å
432	A	94.8	Very high	91.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	155.8	-178	0	0	0	0	0	112.1	V321 V322 V323 I402 I405 W453	V321-A432 PolarHBondContact O-N 3.25Å; V322-A432 WeakPolarHBondContact CA-O 3.14Å; V322-A432 HydrophobicContact CG2-CB 4.38Å; V323-A432 PolarHBondContact N-O 3.34Å; I402-A432 HydrophobicContact CB-CB 4.39Å; I402-A432 CarbonylContact O-C 3.28Å; I402-A432 WeakPolarHBondContact O-CA 3.49Å; I405-A432 HydrophobicContact CB-CB 4.19Å; I405-A432 HydrophobicContact CD1-CB 4.09Å; I405-A432 HydrophobicContact CG2-CB 4.33Å; A432-W453 HydrophobicContact CB-CH2 3.62Å; A432-W453 HydrophobicContact CB-CZ3 3.98Å
433	S	94.8	Very high	91.1	Very high	2 Å²	2	41 Å²	41	1%	0.014	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	145.5	170.5	47.3	0	0	0	0	112.1	V323 I402 H403 N404 I405	V323-S433 WeakPolarHBondContact O-CA 3.46Å; I402-S433 PolarHBondContact O-N 2.68Å; I402-S433 PolarHBondContact O-OG 3.17Å; H403-S433 VanDerWaalsContact CA-OG 3.29Å; H403-S433 WeakPolarHBondContact CA-OG 3.45Å; N404-S433 WeakPolarHBondContact CA-O 3.08Å; N404-S433 PolarHBondContact N-OG 3.26Å; I405-S433 WeakPolarHBondContact CG2-O 3.5Å; I405-S433 PolarHBondContact N-O 3.43Å
434	I	94.1	Very high	91.1	Very high	10 Å²	10	45.5 Å²	45.5	5%	0.051	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	139.9	177.9	-56.9	174.4	0	0	0	110.1	V322 V323 K329 I405 A439 W443 W455	V322-I434 HydrophobicContact CG2-CD1 3.44Å; V322-I434 VanDerWaalsContact CG2-CD1 3.44Å; V322-I434 HydrophobicContact CG2-CG1 3.54Å; V323-I434 PolarHBondContact O-N 3.01Å; K329-I434 WeakPolarHBondContact CE-O 3.23Å; K329-I434 PolarHBondContact NZ-O 3.17Å; K329-I434 VanDerWaalsContact NZ-O 3.13Å; I405-I434 HydrophobicContact CG2-CG1 3.95Å; I434-A439 HydrophobicContact CG2-CB 3.31Å; I434-W443 HydrophobicContact CD1-CH2 3.49Å; I434-W443 VanDerWaalsContact CD1-CH2 3.49Å; I434-W443 HydrophobicContact CD1-CZ3 3.88Å; I434-W443 HydrophobicContact CG1-CH2 4.16Å; I434-W455 HydrophobicContact CD1-CH2 3.59Å; I434-W455 HydrophobicContact CD1-CZ3 3.53Å
435	D	91.6	Very high	91.1	Very high	45 Å²	45	49.4 Å²	49.4	24%	0.241	26%	0.264	C	S	.	.			trans	-125.3	-34.1	172	-80	-62	0	0	0	114	K329 N404 D406 Y464	K329-D435 IonicContact NZ-OD1 3.65Å; K329-D435 PolarHBondContact NZ-OD1 2.78Å; K329-D435 IonicContact NZ-OD2 3.72Å; K329-D435 PolarHBondContact NZ-OD2 3.21Å; K329-D435 VanDerWaalsContact NZ-OD2 3.09Å; N404-D435 PolarHBondContact ND2-OD2 3.12Å; D406-D435 PolarHBondContact OD2-N 3.21Å; D435-Y464 WeakPolarHBondContact OD1-CE1 3.46Å; D435-Y464 VanDerWaalsContact OD1-CZ 3.26Å; D435-Y464 PolarHBondContact OD1-OH 3.48Å
436	H	90.5	Very high	91.2	Very high	85 Å²	85	54.3 Å²	54.3	39%	0.394	28%	0.284	S	S	.	.			trans	-74.4	131.1	-174.9	-166.8	-91.6	0	0	0	111	D406 N438 A439	D406-H436 HydrophobicContact CB-CB 4.09Å; D406-H436 WeakPolarHBondContact OD2-CA 3.39Å; D406-H436 WeakPolarHBondContact OD2-CB 3.39Å; D406-H436 PolarHBondContact OD2-N 2.89Å; H436-N438 PolarHBondContact ND1-N 2.8Å; H436-N438 VanDerWaalsContact ND1-N 3.18Å; H436-N438 PolarHBondContact O-N 2.86Å; H436-A439 HydrophobicContact CB-CB 4.34Å; H436-A439 WeakPolarHBondContact O-CB 3.39Å; H436-A439 PolarHBondContact O-N 3.02Å
437	I	90.8	Very high	91.5	Very high	159 Å²	159	50.4 Å²	50.4	82%	0.815	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-41	-177.6	-56.6	168.6	0	0	0	111.2
438	N	90.4	Very high	91.5	Very high	90 Å²	90	53.2 Å²	53.2	48%	0.481	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	14.3	-177.2	-56.2	-25.1	0	0	0	113.5	H436 P440 L441	H436-N438 PolarHBondContact ND1-N 2.8Å; H436-N438 VanDerWaalsContact ND1-N 3.18Å; H436-N438 PolarHBondContact O-N 2.86Å; N438-P440 VanDerWaalsContact C-N 3.33Å; N438-L441 HydrophobicContact CB-CD1 3.71Å; N438-L441 HydrophobicContact CB-CG 4.13Å; N438-L441 VanDerWaalsContact O-CB 3.31Å; N438-L441 WeakPolarHBondContact O-CB 3.11Å; N438-L441 WeakPolarHBondContact O-CG 3.17Å; N438-L441 PolarHBondContact O-N 3.42Å; N438-L441 VanDerWaalsContact O-N 3.1Å
439	A	88	Confident	91.6	Very high	6 Å²	6	56.5 Å²	56.5	5%	0.05	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-54.7	-39.3	-179.4	0	0	0	0	0	114.4	D406 I434 H436 L441 V442	D406-A439 HydrophobicContact CB-CB 4.04Å; I434-A439 HydrophobicContact CG2-CB 3.31Å; H436-A439 HydrophobicContact CB-CB 4.34Å; H436-A439 WeakPolarHBondContact O-CB 3.39Å; H436-A439 PolarHBondContact O-N 3.02Å; A439-L441 PolarHBondContact O-N 3.44Å; A439-L441 VanDerWaalsContact O-N 3.08Å; A439-V442 PolarHBondContact O-N 2.86Å
440	P	89.6	Confident	91.6	Very high	54 Å²	54	57.4 Å²	57.4	35%	0.351	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-64	-16.1	179.1	-21	33	0	0	0	114.3	N438 V442 W443 W455	N438-P440 VanDerWaalsContact C-N 3.33Å; P440-V442 PolarHBondContact O-N 3.02Å; P440-W443 HydrophobicContact CB-CE3 4.47Å; P440-W443 PolarHBondContact O-N 3.36Å; P440-W443 VanDerWaalsContact O-N 3.15Å; P440-W455 HydrophobicContact CG-CH2 4.08Å
441	L	90.1	Very high	91.5	Very high	145 Å²	145	57.3 Å²	57.3	76%	0.759	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-65.1	-21.6	178.7	-64.9	-175.5	0	0	0	113.1	N438 A439 W443	N438-L441 HydrophobicContact CB-CD1 3.71Å; N438-L441 HydrophobicContact CB-CG 4.13Å; N438-L441 VanDerWaalsContact O-CB 3.31Å; N438-L441 WeakPolarHBondContact O-CB 3.11Å; N438-L441 WeakPolarHBondContact O-CG 3.17Å; N438-L441 PolarHBondContact O-N 3.42Å; N438-L441 VanDerWaalsContact O-N 3.1Å; A439-L441 PolarHBondContact O-N 3.44Å; A439-L441 VanDerWaalsContact O-N 3.08Å; L441-W443 PolarHBondContact O-N 3.44Å
442	V	88.4	Confident	91.4	Very high	42 Å²	42	60.8 Å²	60.8	26%	0.255	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-76.4	-17.9	179.3	-164.4	0	0	0	0	111.4	R411 Q416 A439 P440	R411-V442 VanDerWaalsContact O-CG1 3.25Å; R411-V442 WeakPolarHBondContact O-CG1 3.43Å; Q416-V442 HydrophobicContact CB-CG1 4.33Å; Q416-V442 HydrophobicContact CG-CG1 3.64Å; A439-V442 PolarHBondContact O-N 2.86Å; P440-V442 PolarHBondContact O-N 3.02Å
443	W	91.4	Very high	91.4	Very high	12 Å²	12	62.1 Å²	62.1	5%	0.045	32%	0.321	C	S	.	.			trans	-102.2	106.5	-175.2	-56.6	-36.5	0	0	0	112.1	I405 I434 P440 L441 Q448 F451 W453 W455	I405-W443 HydrophobicContact CD1-CZ2 4.21Å; I405-W443 HydrophobicContact CG2-CH2 4.44Å; I405-W443 HydrophobicContact CG2-CZ2 4.01Å; I434-W443 HydrophobicContact CD1-CH2 3.49Å; I434-W443 VanDerWaalsContact CD1-CH2 3.49Å; I434-W443 HydrophobicContact CD1-CZ3 3.88Å; I434-W443 HydrophobicContact CG1-CH2 4.16Å; P440-W443 HydrophobicContact CB-CE3 4.47Å; P440-W443 PolarHBondContact O-N 3.36Å; P440-W443 VanDerWaalsContact O-N 3.15Å; L441-W443 PolarHBondContact O-N 3.44Å; W443-Q448 HydrophobicContact CB-CG 3.71Å; W443-Q448 PolarHBondContact O-NE2 3.19Å; W443-Q448 VanDerWaalsContact O-NE2 3.12Å; W443-F451 AromaticContact NE1-CE2 3.91Å; W443-W453 AromaticContact CE3-NE1 3.96Å; W443-W453 HydrophobicContact CH2-CZ2 4.23Å; W443-W453 AromaticContact CH2-NE1 3.79Å; W443-W453 AromaticContact CZ2-CZ2 4Å; W443-W453 HydrophobicContact CZ2-CZ2 4Å; W443-W453 AromaticContact CZ2-NE1 3.91Å; W443-W453 AromaticContact CZ3-NE1 3.82Å; W443-W455 HydrophobicContact CE3-CZ2 4.36Å; W443-W455 HydrophobicContact CH2-CH2 4.49Å; W443-W455 AromaticContact CZ3-CH2 3.66Å; W443-W455 HydrophobicContact CZ3-CH2 3.66Å; W443-W455 AromaticContact CZ3-CZ2 3.68Å; W443-W455 HydrophobicContact CZ3-CZ2 3.68Å
444	D	91.2	Very high	91.4	Very high	100 Å²	100	64.3 Å²	64.3	54%	0.535	33%	0.332	S	S	.	.			trans	-69.7	162.9	163.9	-173	24.7	0	0	0	111.2	F446 K447 Q448	D444-F446 PolarHBondContact O-N 3Å; D444-F446 VanDerWaalsContact O-N 3.15Å; D444-K447 PolarHBondContact O-N 2.91Å; D444-Q448 WeakPolarHBondContact O-CG 3.32Å; D444-Q448 PolarHBondContact O-N 3Å
445	Q	91.9	Very high	91.5	Very high	136 Å²	136	69.3 Å²	69.3	64%	0.636	35%	0.351	S	S	*	.	H	α-helix	trans	-52.4	-39.2	-179	-173.9	62.1	45	0	0	112.4	Q448 S449	Q445-Q448 PolarHBondContact O-N 3.18Å; Q445-S449 PolarHBondContact O-N 3.32Å
446	F	91.5	Very high	91.6	Very high	127 Å²	127	68.8 Å²	68.8	56%	0.557	35%	0.345	S	S	*	.	H	α-helix	trans	-63.8	-45.6	176.9	-177.7	-105.3	0	0	0	112	D444 S449 Q450	D444-F446 PolarHBondContact O-N 3Å; D444-F446 VanDerWaalsContact O-N 3.15Å; F446-S449 WeakPolarHBondContact O-CB 3.29Å; F446-S449 PolarHBondContact O-N 3.29Å; F446-Q450 VanDerWaalsContact CE1-CD 3.49Å; F446-Q450 HydrophobicContact CE1-CG 4.27Å; F446-Q450 HydrophobicContact CZ-CG 4.4Å; F446-Q450 WeakPolarHBondContact O-CG 3.47Å; F446-Q450 PolarHBondContact O-N 3.13Å; F446-Q450 VanDerWaalsContact O-N 3.09Å
447	K	90.9	Very high	91.8	Very high	11 Å²	11	70.8 Å²	70.8	5%	0.048	36%	0.355	C	S	.	.	H	α-helix	trans	-65.3	-42	178.7	-58.3	-172.7	-174.9	79.8	0	110.7	E413 Q416 D444 S449 Q450 F451	E413-K447 IonicContact OE1-NZ 2.65Å; E413-K447 PolarHBondContact OE1-NZ 3.47Å; Q416-K447 HydrophobicContact CB-CD 4.28Å; D444-K447 PolarHBondContact O-N 2.91Å; K447-S449 VanDerWaalsContact C-N 3.28Å; K447-S449 PolarHBondContact O-N 2.84Å; K447-Q450 WeakPolarHBondContact O-CB 3.41Å; K447-Q450 PolarHBondContact O-N 2.87Å; K447-Q450 VanDerWaalsContact O-N 3.07Å; K447-F451 HydrophobicContact CB-CD2 4.39Å; K447-F451 HydrophobicContact CB-CE2 4.31Å; K447-F451 WeakPolarHBondContact O-CD2 3.46Å; K447-F451 PolarHBondContact O-N 3.42Å
448	Q	90.5	Very high	91.9	Very high	78 Å²	78	63.3 Å²	63.3	36%	0.364	32%	0.316	S	S	.	.	H	α-helix	trans	-59.6	-39.8	175.7	-65.8	-177.3	11.6	0	0	112.2	W443 D444 Q445 Q450 F451 N452	W443-Q448 HydrophobicContact CB-CG 3.71Å; W443-Q448 PolarHBondContact O-NE2 3.19Å; W443-Q448 VanDerWaalsContact O-NE2 3.12Å; D444-Q448 WeakPolarHBondContact O-CG 3.32Å; D444-Q448 PolarHBondContact O-N 3Å; Q445-Q448 PolarHBondContact O-N 3.18Å; Q448-Q450 VanDerWaalsContact C-N 3.3Å; Q448-Q450 PolarHBondContact O-N 2.95Å; Q448-F451 PolarHBondContact O-N 3.08Å; Q448-N452 PolarHBondContact O-N 3.1Å; Q448-N452 VanDerWaalsContact O-N 3.12Å
449	S	92.3	Very high	92	Very high	75 Å²	75	60.3 Å²	60.3	52%	0.524	30%	0.302	S	S	.	.	H	α-helix	trans	-67.8	-27.8	175.3	-173.4	0	0	0	0	113.4	Q445 F446 K447 N452	Q445-S449 PolarHBondContact O-N 3.32Å; F446-S449 WeakPolarHBondContact O-CB 3.29Å; F446-S449 PolarHBondContact O-N 3.29Å; K447-S449 VanDerWaalsContact C-N 3.28Å; K447-S449 PolarHBondContact O-N 2.84Å; S449-N452 PolarHBondContact O-OD1 3.24Å
450	Q	92.4	Very high	92	Very high	25 Å²	25	60.2 Å²	60.2	12%	0.117	30%	0.3	C	S	.	.	H	α-helix	trans	-77.8	-41.1	175.9	-71.5	-177.1	-31.5	0	0	111.8	G420 A424 F446 K447 Q448	G420-Q450 WeakPolarHBondContact O-CB 3.44Å; A424-Q450 HydrophobicContact CB-CB 4.39Å; F446-Q450 VanDerWaalsContact CE1-CD 3.49Å; F446-Q450 HydrophobicContact CE1-CG 4.27Å; F446-Q450 HydrophobicContact CZ-CG 4.4Å; F446-Q450 WeakPolarHBondContact O-CG 3.47Å; F446-Q450 PolarHBondContact O-N 3.13Å; F446-Q450 VanDerWaalsContact O-N 3.09Å; K447-Q450 WeakPolarHBondContact O-CB 3.41Å; K447-Q450 PolarHBondContact O-N 2.87Å; K447-Q450 VanDerWaalsContact O-N 3.07Å; Q448-Q450 VanDerWaalsContact C-N 3.3Å; Q448-Q450 PolarHBondContact O-N 2.95Å
451	F	91	Very high	92.1	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-72.3	-26	-179.5	-75.9	-65.5	0	0	0	113.6	S320 Q416 L419 A423 L430 W443 K447 Q448 W453	S320-F451 WeakPolarHBondContact CB-O 3.42Å; S320-F451 PolarHBondContact OG-O 3.01Å; Q416-F451 WeakPolarHBondContact O-CZ 3.42Å; L419-F451 VanDerWaalsContact C-CE1 3.47Å; L419-F451 HydrophobicContact CB-CE1 3.88Å; L419-F451 HydrophobicContact CB-CZ 3.78Å; A423-F451 HydrophobicContact CB-CD1 3.54Å; A423-F451 HydrophobicContact CB-CE1 4.05Å; A423-F451 HydrophobicContact CB-CG 4.47Å; L430-F451 HydrophobicContact CD2-CD1 3.66Å; L430-F451 HydrophobicContact CD2-CE1 3.72Å; W443-F451 AromaticContact NE1-CE2 3.91Å; K447-F451 HydrophobicContact CB-CD2 4.39Å; K447-F451 HydrophobicContact CB-CE2 4.31Å; K447-F451 WeakPolarHBondContact O-CD2 3.46Å; K447-F451 PolarHBondContact O-N 3.42Å; Q448-F451 PolarHBondContact O-N 3.08Å; F451-W453 VanDerWaalsContact C-N 3.35Å; F451-W453 HydrophobicContact CB-CD2 3.79Å; F451-W453 HydrophobicContact CB-CG 3.96Å; F451-W453 HydrophobicContact CB-CZ2 3.83Å; F451-W453 AromaticContact CD1-CE2 3.92Å; F451-W453 HydrophobicContact CD1-CH2 4.01Å; F451-W453 AromaticContact CD1-CZ2 3.44Å; F451-W453 HydrophobicContact CD1-CZ2 3.44Å; F451-W453 VanDerWaalsContact CD1-CZ2 3.44Å; F451-W453 HydrophobicContact CD2-CZ2 4.13Å; F451-W453 AromaticContact CD2-NE1 3.65Å; F451-W453 HydrophobicContact CE1-CH2 4.49Å; F451-W453 AromaticContact CE1-CZ2 3.94Å; F451-W453 HydrophobicContact CE1-CZ2 3.94Å; F451-W453 HydrophobicContact CG-CD2 4.44Å; F451-W453 AromaticContact CG-CE2 3.54Å; F451-W453 HydrophobicContact CG-CH2 4.47Å; F451-W453 AromaticContact CG-CZ2 3.55Å; F451-W453 HydrophobicContact CG-CZ2 3.55Å; F451-W453 AromaticContact CG-NE1 3.49Å; F451-W453 HydrophobicContact CZ-CZ2 4.49Å; F451-W453 PolarHBondContact O-N 3.46Å
452	N	93.9	Very high	92	Very high	75 Å²	75	58.3 Å²	58.3	40%	0.401	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	54.3	-177.9	-71.7	-30	0	0	0	112.6	F319 S320 Q448 S449	F319-N452 HydrophobicContact CD1-CB 4.49Å; S320-N452 PolarHBondContact N-O 2.8Å; Q448-N452 PolarHBondContact O-N 3.1Å; Q448-N452 VanDerWaalsContact O-N 3.12Å; S449-N452 PolarHBondContact O-OD1 3.24Å
453	W	93.9	Very high	92	Very high	27 Å²	27	62.7 Å²	62.7	10%	0.102	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	133.8	-172.8	-69.9	126.1	0	0	0	114	S320 V322 I405 L430 A432 W443 F451	S320-W453 VanDerWaalsContact CB-CE3 3.49Å; S320-W453 VanDerWaalsContact CB-CZ3 3.5Å; S320-W453 CarbonylContact O-C 3.57Å; S320-W453 WeakPolarHBondContact O-CA 3.38Å; V322-W453 HydrophobicContact CB-CD2 4.04Å; V322-W453 HydrophobicContact CB-CE3 3.54Å; V322-W453 HydrophobicContact CB-CZ3 3.81Å; V322-W453 HydrophobicContact CG1-CB 4.13Å; V322-W453 HydrophobicContact CG1-CD2 4.14Å; V322-W453 HydrophobicContact CG1-CE3 4Å; V322-W453 HydrophobicContact CG1-CG 4.25Å; V322-W453 HydrophobicContact CG2-CE3 4.45Å; V322-W453 HydrophobicContact CG2-CZ3 4.44Å; I405-W453 HydrophobicContact CD1-CH2 4.11Å; I405-W453 HydrophobicContact CD1-CZ2 3.98Å; L430-W453 HydrophobicContact CD2-CH2 3.4Å; L430-W453 VanDerWaalsContact CD2-CH2 3.4Å; L430-W453 HydrophobicContact CD2-CZ2 4.14Å; L430-W453 HydrophobicContact CD2-CZ3 4.02Å; L430-W453 HydrophobicContact CG-CH2 3.95Å; L430-W453 HydrophobicContact CG-CZ3 4.2Å; A432-W453 HydrophobicContact CB-CH2 3.62Å; A432-W453 HydrophobicContact CB-CZ3 3.98Å; W443-W453 AromaticContact CE3-NE1 3.96Å; W443-W453 HydrophobicContact CH2-CZ2 4.23Å; W443-W453 AromaticContact CH2-NE1 3.79Å; W443-W453 AromaticContact CZ2-CZ2 4Å; W443-W453 HydrophobicContact CZ2-CZ2 4Å; W443-W453 AromaticContact CZ2-NE1 3.91Å; W443-W453 AromaticContact CZ3-NE1 3.82Å; F451-W453 VanDerWaalsContact C-N 3.35Å; F451-W453 HydrophobicContact CB-CD2 3.79Å; F451-W453 HydrophobicContact CB-CG 3.96Å; F451-W453 HydrophobicContact CB-CZ2 3.83Å; F451-W453 AromaticContact CD1-CE2 3.92Å; F451-W453 HydrophobicContact CD1-CH2 4.01Å; F451-W453 AromaticContact CD1-CZ2 3.44Å; F451-W453 HydrophobicContact CD1-CZ2 3.44Å; F451-W453 VanDerWaalsContact CD1-CZ2 3.44Å; F451-W453 HydrophobicContact CD2-CZ2 4.13Å; F451-W453 AromaticContact CD2-NE1 3.65Å; F451-W453 HydrophobicContact CE1-CH2 4.49Å; F451-W453 AromaticContact CE1-CZ2 3.94Å; F451-W453 HydrophobicContact CE1-CZ2 3.94Å; F451-W453 HydrophobicContact CG-CD2 4.44Å; F451-W453 AromaticContact CG-CE2 3.54Å; F451-W453 HydrophobicContact CG-CH2 4.47Å; F451-W453 AromaticContact CG-CZ2 3.55Å; F451-W453 HydrophobicContact CG-CZ2 3.55Å; F451-W453 AromaticContact CG-NE1 3.49Å; F451-W453 HydrophobicContact CZ-CZ2 4.49Å; F451-W453 PolarHBondContact O-N 3.46Å
454	L	95.4	Very high	91.9	Very high	49 Å²	49	65 Å²	65	26%	0.257	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	117.6	159.9	-69.6	178.8	0	0	0	109.8	Q314 F319 S320 V322	Q314-L454 HydrophobicContact CB-CD1 3.88Å; Q314-L454 HydrophobicContact CG-CD1 3.75Å; F319-L454 HydrophobicContact CB-CD1 3.46Å; F319-L454 VanDerWaalsContact CB-CD1 3.46Å; F319-L454 HydrophobicContact CB-CG 3.83Å; F319-L454 HydrophobicContact CD1-CD1 4.06Å; F319-L454 HydrophobicContact CD1-CD2 4.31Å; F319-L454 HydrophobicContact CD1-CG 3.98Å; F319-L454 HydrophobicContact CD2-CD1 4.06Å; F319-L454 HydrophobicContact CG-CD1 3.59Å; F319-L454 HydrophobicContact CG-CG 3.99Å; S320-L454 PolarHBondContact O-N 3.47Å; V322-L454 PolarHBondContact N-O 2.95Å
455	W	94.9	Very high	91.6	Very high	115 Å²	115	64.7 Å²	64.7	44%	0.436	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	123.4	-175.1	-68.6	79.1	0	0	0	110.9	V322 Y324 I434 P440 W443	V322-W455 HydrophobicContact CG1-CB 4.38Å; V322-W455 HydrophobicContact CG1-CD2 3.56Å; V322-W455 HydrophobicContact CG1-CE3 3.82Å; V322-W455 HydrophobicContact CG1-CG 3.84Å; V322-W455 HydrophobicContact CG1-CZ2 4.38Å; V322-W455 HydrophobicContact CG1-CZ3 4.32Å; Y324-W455 HydrophobicContact CD1-CB 4.32Å; Y324-W455 AromaticContact CD1-CE3 3.58Å; Y324-W455 HydrophobicContact CD1-CE3 3.58Å; Y324-W455 HydrophobicContact CD1-CZ3 4.33Å; Y324-W455 HydrophobicContact CE1-CB 3.81Å; Y324-W455 AromaticContact CE1-CE3 3.96Å; Y324-W455 HydrophobicContact CE1-CE3 3.96Å; Y324-W455 HydrophobicContact CG-CE3 4.12Å; Y324-W455 HydrophobicContact CG-CZ3 4.46Å; I434-W455 HydrophobicContact CD1-CH2 3.59Å; I434-W455 HydrophobicContact CD1-CZ3 3.53Å; P440-W455 HydrophobicContact CG-CH2 4.08Å; W443-W455 HydrophobicContact CE3-CZ2 4.36Å; W443-W455 HydrophobicContact CH2-CH2 4.49Å; W443-W455 AromaticContact CZ3-CH2 3.66Å; W443-W455 HydrophobicContact CZ3-CH2 3.66Å; W443-W455 AromaticContact CZ3-CZ2 3.68Å; W443-W455 HydrophobicContact CZ3-CZ2 3.68Å
456	W	94.7	Very high	91.2	Very high	34 Å²	34	61.9 Å²	61.9	13%	0.129	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	123.6	178.1	-77.1	97.3	0	0	0	111.3	K310 W311 V321 V322 V323 Y324 C458	K310-W456 HydrophobicContact CD-CH2 3.61Å; K310-W456 HydrophobicContact CD-CZ2 3.89Å; K310-W456 VanDerWaalsContact CE-CH2 3.45Å; K310-W456 HydrophobicContact CG-CH2 4.18Å; K310-W456 HydrophobicContact CG-CZ2 4.01Å; W311-W456 AromaticContact CD1-CD2 3.97Å; W311-W456 AromaticContact CD1-CE2 3.5Å; W311-W456 VanDerWaalsContact CD1-CE2 3.5Å; W311-W456 AromaticContact CD1-CZ2 3.73Å; W311-W456 AromaticContact CD1-NE1 3.56Å; W311-W456 HydrophobicContact CZ2-CB 4.06Å; W311-W456 HydrophobicContact CZ2-CG 4.23Å; W311-W456 AromaticContact NE1-CD1 3.66Å; W311-W456 AromaticContact NE1-CD2 3.22Å; W311-W456 AromaticContact NE1-CE2 3.27Å; W311-W456 VanDerWaalsContact NE1-CE2 3.27Å; W311-W456 AromaticContact NE1-CE3 3.74Å; W311-W456 AromaticContact NE1-CG 3.43Å; W311-W456 AromaticContact NE1-CZ2 3.76Å; W311-W456 AromaticContact NE1-NE1 3.5Å; V321-W456 HydrophobicContact CG1-CG 4.5Å; V322-W456 PolarHBondContact O-N 3.23Å; V323-W456 WeakPolarHBondContact CA-O 3.43Å; Y324-W456 WeakPolarHBondContact CD1-O 3.1Å; Y324-W456 VanDerWaalsContact CE1-C 3.43Å; Y324-W456 WeakPolarHBondContact CE1-O 3.5Å; Y324-W456 PolarHBondContact N-O 2.89Å; W456-C458 PolarHBondContact O-N 3.05Å
457	E	94.4	Very high	90.9	Very high	127 Å²	127	57 Å²	57	59%	0.593	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	107.6	174.5	-174	-178.7	179.1	0	0	109.4	Y324 V459	Y324-E457 HydrophobicContact CE1-CB 4.33Å; Y324-E457 HydrophobicContact CE2-CB 4.37Å; Y324-E457 HydrophobicContact CE2-CG 4.45Å; Y324-E457 WeakPolarHBondContact O-CA 3.39Å; E457-V459 HydrophobicContact CG-CG2 4.16Å
458	C	92.7	Very high	90.5	Very high	1 Å²	1	60 Å²	60	1%	0.007	30%	0.295	C	S	.	.			trans	-126.1	87.7	171	-58.3	0	0	0	0	110.2	W311 V323 Y324 L332 W456	W311-C458 VanDerWaalsContact CZ2-SG 3.58Å; V323-C458 HydrophobicContact CG1-CB 3.36Å; V323-C458 VanDerWaalsContact CG1-SG 3.59Å; Y324-C458 PolarHBondContact O-N 3.45Å; L332-C458 HydrophobicContact CD2-CB 3.62Å; W456-C458 PolarHBondContact O-N 3.05Å
459	V	93.4	Very high	89.7	Confident	28 Å²	28	57.3 Å²	57.3	17%	0.17	29%	0.285	C	S	.	.			trans	-80.3	124.3	168.7	-177.4	0	0	0	0	108.2	L300 H304 L326 E457 F461	L300-V459 WeakPolarHBondContact CD2-O 3.49Å; L300-V459 WeakPolarHBondContact CG-O 3.45Å; H304-V459 PolarHBondContact NE2-O 3.47Å; L326-V459 HydrophobicContact CB-CG1 4.17Å; E457-V459 HydrophobicContact CG-CG2 4.16Å; V459-F461 HydrophobicContact CG1-CD1 4.33Å; V459-F461 HydrophobicContact CG1-CD2 3.85Å; V459-F461 HydrophobicContact CG1-CE1 4.06Å; V459-F461 HydrophobicContact CG1-CE2 3.53Å; V459-F461 HydrophobicContact CG1-CG 4.24Å; V459-F461 HydrophobicContact CG1-CZ 3.64Å
460	T	88.4	Confident	88.7	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.018	27%	0.274	C	S	.	.			trans	-116.3	-18.5	-178.5	62.9	0	0	0	0	112.8	I297 L326 S328 Q462	I297-T460 WeakPolarHBondContact CG2-O 3.4Å; L326-T460 PolarHBondContact O-N 2.88Å; S328-T460 PolarHBondContact O-OG1 3.42Å; T460-Q462 PolarHBondContact O-N 2.88Å
461	F	90.3	Very high	87.6	Confident	116 Å²	116	62.8 Å²	62.8	51%	0.509	30%	0.299	S	S	.	.			trans	52.7	13.8	-172.9	-62.5	-73.3	0	0	0	114.9	I297 L300 L326 V459	I297-F461 HydrophobicContact CD1-CB 4.41Å; I297-F461 HydrophobicContact CG1-CB 4.35Å; L300-F461 HydrophobicContact CD2-CD2 4.06Å; L300-F461 HydrophobicContact CD2-CE2 4.28Å; L326-F461 HydrophobicContact CD2-CD1 3.92Å; L326-F461 HydrophobicContact CD2-CE1 3.77Å; L326-F461 HydrophobicContact CG-CD1 4.45Å; L326-F461 PolarHBondContact O-N 3.35Å; V459-F461 HydrophobicContact CG1-CD1 4.33Å; V459-F461 HydrophobicContact CG1-CD2 3.85Å; V459-F461 HydrophobicContact CG1-CE1 4.06Å; V459-F461 HydrophobicContact CG1-CE2 3.53Å; V459-F461 HydrophobicContact CG1-CG 4.24Å; V459-F461 HydrophobicContact CG1-CZ 3.64Å
462	Q	88.6	Confident	86.4	Confident	43 Å²	43	66.2 Å²	66.2	20%	0.201	32%	0.317	C	S	.	.			trans	-73.2	149.2	176.7	-68.4	179.4	3.9	0	0	110.6	I297 G327 S328 T331 T460	I297-Q462 HydrophobicContact CG2-CG 4.14Å; G327-Q462 WeakPolarHBondContact CA-O 3.37Å; S328-Q462 PolarHBondContact N-O 3.46Å; S328-Q462 PolarHBondContact O-OE1 3.03Å; T331-Q462 PolarHBondContact OG1-OE1 3.38Å; T460-Q462 PolarHBondContact O-N 2.88Å
463	H	88.8	Confident	85.1	Confident	134 Å²	134	65.6 Å²	65.6	62%	0.62	32%	0.319	S	S	*	.			trans	-71.5	137.3	-179.9	-57.7	-53.2	0	0	0	111.5	T465	H463-T465 HydrophobicContact CB-CG2 3.97Å; H463-T465 PolarHBondContact O-N 3.15Å
464	Y	89	Confident	83.7	Confident	60 Å²	60	70.9 Å²	70.9	24%	0.235	35%	0.349	C	S	.	.			trans	-77.4	60.5	175.6	-64.9	-78.5	0	0	0	112.1	G327 D435 E467 T468	G327-Y464 WeakPolarHBondContact CA-OH 3.06Å; G327-Y464 PolarHBondContact N-OH 2.87Å; G327-Y464 WeakPolarHBondContact O-CE1 3.4Å; G327-Y464 PolarHBondContact O-OH 3.49Å; D435-Y464 WeakPolarHBondContact OD1-CE1 3.46Å; D435-Y464 VanDerWaalsContact OD1-CZ 3.26Å; D435-Y464 PolarHBondContact OD1-OH 3.48Å; Y464-E467 VanDerWaalsContact C-OE2 3.23Å; Y464-E467 WeakPolarHBondContact CA-OE2 3.35Å; Y464-E467 HydrophobicContact CD1-CB 4.44Å; Y464-E467 HydrophobicContact CD1-CG 4.32Å; Y464-T468 WeakPolarHBondContact O-CB 3.46Å; Y464-T468 VanDerWaalsContact O-CG2 3.28Å; Y464-T468 WeakPolarHBondContact O-CG2 3.31Å; Y464-T468 PolarHBondContact O-N 3.03Å; Y464-T468 PolarHBondContact O-OG1 3.48Å
465	T	85	Confident	82.3	Confident	95 Å²	95	73.1 Å²	73.1	58%	0.583	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-41.7	-172.2	52.2	0	0	0	0	112.7	H463 S469	H463-T465 HydrophobicContact CB-CG2 3.97Å; H463-T465 PolarHBondContact O-N 3.15Å; T465-S469 WeakPolarHBondContact O-CB 3.49Å
466	E	83.1	Confident	80.9	Confident	76 Å²	76	68.9 Å²	68.9	36%	0.355	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-39.4	-176.7	-64.2	-171.9	-162.8	0	0	112	K330 S469	K330-E466 VanDerWaalsContact CD-OE2 3.32Å; K330-E466 WeakPolarHBondContact CD-OE2 3.39Å; K330-E466 WeakPolarHBondContact CE-OE2 3.48Å; K330-E466 IonicContact NZ-OE1 3.61Å; K330-E466 PolarHBondContact NZ-OE1 3.12Å; K330-E466 IonicContact NZ-OE2 2.7Å; K330-E466 PolarHBondContact NZ-OE2 3.06Å; E466-S469 VanDerWaalsContact O-CB 3.24Å; E466-S469 WeakPolarHBondContact O-CB 3.43Å; E466-S469 PolarHBondContact O-N 3.24Å; E466-S469 VanDerWaalsContact O-N 3.15Å; E466-S469 PolarHBondContact O-OG 3.43Å
467	E	85.4	Confident	79.3	Confident	26 Å²	26	71.5 Å²	71.5	12%	0.121	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-66.5	-41	-177.2	-56	88.7	159.1	0	0	110.9	S328 F352 Y464 S469	S328-E467 VanDerWaalsContact CB-OE1 3.32Å; S328-E467 WeakPolarHBondContact CB-OE1 3.47Å; S328-E467 PolarHBondContact OG-OE1 2.87Å; F352-E467 HydrophobicContact CB-CB 4.4Å; F352-E467 HydrophobicContact CB-CG 4.44Å; F352-E467 HydrophobicContact CD1-CG 4.14Å; F352-E467 HydrophobicContact CG-CG 4.33Å; Y464-E467 VanDerWaalsContact C-OE2 3.23Å; Y464-E467 WeakPolarHBondContact CA-OE2 3.35Å; Y464-E467 HydrophobicContact CD1-CB 4.44Å; Y464-E467 HydrophobicContact CD1-CG 4.32Å; E467-S469 PolarHBondContact O-N 3.14Å
468	T	82.2	Confident	77.7	Confident	73 Å²	73	68.8 Å²	68.8	45%	0.448	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-78.4	-9.5	176.7	63.5	0	0	0	0	113.2	Y464 Y470 E471	Y464-T468 WeakPolarHBondContact O-CB 3.46Å; Y464-T468 VanDerWaalsContact O-CG2 3.28Å; Y464-T468 WeakPolarHBondContact O-CG2 3.31Å; Y464-T468 PolarHBondContact O-N 3.03Å; Y464-T468 PolarHBondContact O-OG1 3.48Å; T468-Y470 PolarHBondContact O-N 3.46Å; T468-E471 PolarHBondContact O-N 3.17Å; T468-E471 VanDerWaalsContact O-N 3.16Å
469	S	74.7	Confident	75.6	Confident	22 Å²	22	74.2 Å²	74.2	15%	0.154	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-68.7	-24.8	-174.3	84.8	0	0	0	0	113.3	R279 T465 E466 E467	R279-S469 PolarHBondContact NH1-O 2.89Å; T465-S469 WeakPolarHBondContact O-CB 3.49Å; E466-S469 VanDerWaalsContact O-CB 3.24Å; E466-S469 WeakPolarHBondContact O-CB 3.43Å; E466-S469 PolarHBondContact O-N 3.24Å; E466-S469 VanDerWaalsContact O-N 3.15Å; E466-S469 PolarHBondContact O-OG 3.43Å; E467-S469 PolarHBondContact O-N 3.14Å
470	Y	70.7	Confident	73.9	Confident	77 Å²	77	75.8 Å²	75.8	30%	0.302	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-95.6	-5.8	177.3	-57.5	-73.7	0	0	0	112.9	F352 F353 P354 T468	F352-Y470 AromaticContact CD2-CD2 3.89Å; F352-Y470 HydrophobicContact CD2-CD2 3.89Å; F352-Y470 AromaticContact CD2-CE2 3.75Å; F352-Y470 HydrophobicContact CD2-CE2 3.75Å; F352-Y470 HydrophobicContact CE2-CD2 4.43Å; F352-Y470 AromaticContact CE2-CE2 3.82Å; F352-Y470 HydrophobicContact CE2-CE2 3.82Å; F353-Y470 HydrophobicContact CD1-CE1 4.05Å; F353-Y470 AromaticContact CD1-CE2 3.87Å; F353-Y470 HydrophobicContact CD1-CE2 3.87Å; F353-Y470 AromaticContact CD1-CZ 3.59Å; F353-Y470 HydrophobicContact CE1-CE1 4.1Å; F353-Y470 AromaticContact CE1-CE2 3.83Å; F353-Y470 HydrophobicContact CE1-CE2 3.83Å; F353-Y470 AromaticContact CE1-CZ 3.35Å; F353-Y470 WeakPolarHBondContact CE1-OH 3.22Å; F353-Y470 HydrophobicContact CG-CE2 4.49Å; F353-Y470 HydrophobicContact CZ-CE2 4.36Å; P354-Y470 HydrophobicContact CG-CD1 4.26Å; P354-Y470 HydrophobicContact CG-CG 4.38Å; T468-Y470 PolarHBondContact O-N 3.46Å
471	E	69.5	Low	72.3	Confident	137 Å²	137	78.2 Å²	78.2	64%	0.64	42%	0.423	S	S	*	.	S	Bend	trans	-82	141.7	179	-166	178.9	178.2	0	0	110.9	T468 S473 Q478	T468-E471 PolarHBondContact O-N 3.17Å; T468-E471 VanDerWaalsContact O-N 3.16Å; E471-S473 PolarHBondContact O-N 3.48Å; E471-S473 VanDerWaalsContact O-N 3.09Å; E471-Q478 PolarHBondContact O-NE2 3.15Å; E471-Q478 VanDerWaalsContact O-NE2 3.16Å
472	N	64.9	Low	70.9	Confident	72 Å²	72	74.6 Å²	74.6	39%	0.385	41%	0.409	S	S	.	.			trans	-78.8	94.9	175.7	-73	13.2	0	0	0	109.8	Q478 S486	N472-Q478 PolarHBondContact OD1-NE2 2.7Å; N472-Q478 PolarHBondContact OD1-OE1 3.46Å; N472-S486 WeakPolarHBondContact ND2-CB 3.47Å
473	S	67.3	Low	69.7	Low	62 Å²	62	73.7 Å²	73.7	43%	0.434	41%	0.409	S	S	.	.			trans	-77.4	134.1	170.3	-172.5	0	0	0	0	111.1	E471 L475 V476	E471-S473 PolarHBondContact O-N 3.48Å; E471-S473 VanDerWaalsContact O-N 3.09Å; S473-L475 PolarHBondContact O-N 2.7Å; S473-L475 VanDerWaalsContact O-N 3.15Å; S473-V476 PolarHBondContact O-N 2.95Å; S473-V476 VanDerWaalsContact O-O 3.08Å
474	L	64.2	Low	68.9	Low	138 Å²	138	68.1 Å²	68.1	72%	0.723	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-25.6	177.4	-67.7	175.8	0	0	0	113.4
475	L	65.8	Low	68.1	Low	97 Å²	97	66.2 Å²	66.2	51%	0.508	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-12.3	-175.7	-61	176.4	0	0	0	113.3	L277 S473	L277-L475 PolarHBondContact N-O 2.8Å; L277-L475 VanDerWaalsContact N-O 3.07Å; S473-L475 PolarHBondContact O-N 2.7Å; S473-L475 VanDerWaalsContact O-N 3.15Å
476	V	66	Low	67.7	Low	26 Å²	26	62.2 Å²	62.2	16%	0.158	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	124.1	-176.5	-179.6	0	0	0	0	109.1	L277 R279 L282 S473 Q478	L277-V476 WeakPolarHBondContact O-CA 3.47Å; R279-V476 HydrophobicContact CB-CG1 4.17Å; L282-V476 HydrophobicContact CD1-CG2 3.5Å; L282-V476 VanDerWaalsContact CD1-CG2 3.5Å; S473-V476 PolarHBondContact O-N 2.95Å; S473-V476 VanDerWaalsContact O-O 3.08Å; V476-Q478 PolarHBondContact O-N 3.48Å
477	Q	61.1	Low	67.5	Low	88 Å²	88	58.6 Å²	58.6	41%	0.411	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	109.2	172.7	-174.2	160.1	-28.4	0	0	108.3	K276 L277 T479	K276-Q477 HydrophobicContact CB-CB 3.88Å; K276-Q477 HydrophobicContact CD-CB 4.42Å; L277-Q477 PolarHBondContact O-N 2.82Å; L277-Q477 VanDerWaalsContact O-N 3.12Å; Q477-T479 PolarHBondContact O-N 3.16Å
478	Q	61.1	Low	67.3	Low	71 Å²	71	58.2 Å²	58.2	33%	0.332	34%	0.338	S	S	.	.			trans	-73.8	112.6	170.3	-70.4	-176	0	0	0	109	E471 N472 V476 G480	E471-Q478 PolarHBondContact O-NE2 3.15Å; E471-Q478 VanDerWaalsContact O-NE2 3.16Å; N472-Q478 PolarHBondContact OD1-NE2 2.7Å; N472-Q478 PolarHBondContact OD1-OE1 3.46Å; V476-Q478 PolarHBondContact O-N 3.48Å; Q478-G480 VanDerWaalsContact C-N 3.34Å; Q478-G480 PolarHBondContact O-N 2.97Å
479	T	48.3	Very low	67.2	Low	115 Å²	115	60 Å²	60	71%	0.706	34%	0.34	S	S	*	.			trans	-81.4	80.7	166.8	44.1	0	0	0	0	108.5	Q477	Q477-T479 PolarHBondContact O-N 3.16Å
480	G	56.6	Low	67.6	Low	60 Å²	60	60.5 Å²	60.5	62%	0.619	34%	0.343	S	S	*	.	S	Bend	trans	-170.9	167.5	-179.9	0	0	0	0	0	113.1	Q478	Q478-G480 VanDerWaalsContact C-N 3.34Å; Q478-G480 PolarHBondContact O-N 2.97Å
481	A	55.7	Low	68.2	Low	54 Å²	54	56.9 Å²	56.9	45%	0.446	33%	0.329	S	S	.	.	S	Bend	trans	-58.1	145.2	167.5	0	0	0	0	0	109.6	A483 E572	A481-A483 PolarHBondContact O-N 3.41Å; A481-E572 HydrophobicContact CB-CG 4.35Å
482	L	60.3	Low	68.9	Low	41 Å²	41	57.7 Å²	57.7	22%	0.215	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-56.6	122.1	179.3	-73.1	155	0	0	0	109.7	K553 L554 V571	L482-K553 WeakPolarHBondContact CD1-O 3.5Å; L482-L554 HydrophobicContact CD1-CD2 3.77Å; L482-V571 HydrophobicContact CB-CG2 4.23Å; L482-V571 HydrophobicContact CD1-CG2 4.06Å
483	A	64.5	Low	69.9	Low	24 Å²	24	58.5 Å²	58.5	20%	0.198	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-60.5	144.5	174.5	0	0	0	0	0	110.4	A481 S485 S486 L487	A481-A483 PolarHBondContact O-N 3.41Å; A483-S485 PolarHBondContact O-N 2.97Å; A483-S486 PolarHBondContact N-OG 3.07Å; A483-S486 WeakPolarHBondContact O-CA 3.25Å; A483-S486 WeakPolarHBondContact O-CB 3.37Å; A483-S486 PolarHBondContact O-N 2.96Å; A483-S486 PolarHBondContact O-OG 3.45Å; A483-L487 PolarHBondContact O-N 3.12Å
484	L	71.6	Confident	70.9	Confident	17 Å²	17	55.9 Å²	55.9	9%	0.089	32%	0.318	C	S	.	.	H	α-helix	trans	-49.1	-42.1	176.5	-79.2	173.3	0	0	0	113.4	L487 T488 T575 D578 F579	L484-L487 PolarHBondContact O-N 3.48Å; L484-T488 WeakPolarHBondContact O-CG2 3.31Å; L484-T488 PolarHBondContact O-N 3.24Å; L484-T488 PolarHBondContact O-OG1 2.88Å; L484-T575 HydrophobicContact CD1-CG2 4.03Å; L484-T575 VanDerWaalsContact CD2-CB 3.48Å; L484-T575 HydrophobicContact CD2-CG2 4.05Å; L484-T575 WeakPolarHBondContact CD2-O 3.43Å; L484-T575 HydrophobicContact CG-CG2 3.76Å; L484-D578 HydrophobicContact CD1-CB 4.17Å; L484-D578 HydrophobicContact CD2-CB 4.46Å; L484-F579 HydrophobicContact CD2-CB 4.3Å
485	S	72.3	Confident	72.1	Confident	19 Å²	19	52.8 Å²	52.8	13%	0.133	31%	0.305	C	S	.	.	H	α-helix	trans	-60.6	-45.1	175.1	54.8	0	0	0	0	111.5	A483 L487 T488 H489	A483-S485 PolarHBondContact O-N 2.97Å; S485-L487 PolarHBondContact O-N 2.94Å; S485-T488 WeakPolarHBondContact CA-OG1 3.15Å; S485-T488 PolarHBondContact O-N 3.32Å; S485-T488 PolarHBondContact O-OG1 3.11Å; S485-H489 WeakPolarHBondContact O-CB 3.06Å; S485-H489 PolarHBondContact O-CD2 3.03Å; S485-H489 PolarHBondContact O-N 2.63Å
486	S	76.9	Confident	73.2	Confident	12 Å²	12	52.3 Å²	52.3	8%	0.084	31%	0.308	C	S	.	.	H	α-helix	trans	-65.1	-39.7	178	74.2	0	0	0	0	112.8	N472 A483 H489 V490	N472-S486 WeakPolarHBondContact ND2-CB 3.47Å; A483-S486 PolarHBondContact N-OG 3.07Å; A483-S486 WeakPolarHBondContact O-CA 3.25Å; A483-S486 WeakPolarHBondContact O-CB 3.37Å; A483-S486 PolarHBondContact O-N 2.96Å; A483-S486 PolarHBondContact O-OG 3.45Å; S486-H489 PolarHBondContact O-N 3.47Å; S486-V490 VanDerWaalsContact O-CG2 3.31Å; S486-V490 WeakPolarHBondContact O-CG2 3.35Å; S486-V490 PolarHBondContact O-N 3.08Å
487	L	79	Confident	74.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-63.2	-49.1	177.7	-179	63.9	0	0	0	111.1	A483 L484 S485 H489 V490 L491 F502 L554 V571 L576 F579	A483-L487 PolarHBondContact O-N 3.12Å; L484-L487 PolarHBondContact O-N 3.48Å; S485-L487 PolarHBondContact O-N 2.94Å; L487-H489 VanDerWaalsContact C-N 3.34Å; L487-H489 PolarHBondContact O-N 2.87Å; L487-V490 PolarHBondContact O-N 3.38Å; L487-L491 HydrophobicContact CD1-CD1 3.62Å; L487-L491 HydrophobicContact CD1-CG 4.25Å; L487-L491 HydrophobicContact CD2-CD1 4.43Å; L487-L491 HydrophobicContact CG-CD1 3.65Å; L487-L491 WeakPolarHBondContact O-CB 3.34Å; L487-L491 WeakPolarHBondContact O-CG 3.46Å; L487-L491 PolarHBondContact O-N 3.02Å; L487-F502 HydrophobicContact CD1-CE1 4.14Å; L487-F502 HydrophobicContact CD1-CZ 3.97Å; L487-L554 HydrophobicContact CD1-CD2 3.46Å; L487-L554 VanDerWaalsContact CD1-CD2 3.46Å; L487-V571 HydrophobicContact CD2-CG1 4.35Å; L487-L576 HydrophobicContact CD2-CD2 4.39Å; L487-F579 HydrophobicContact CD2-CB 4.37Å; L487-F579 HydrophobicContact CD2-CD2 4.18Å; L487-F579 HydrophobicContact CD2-CG 4.11Å; L487-F579 HydrophobicContact CG-CD2 4.42Å
488	T	80.6	Confident	75.8	Confident	18 Å²	18	51.1 Å²	51.1	11%	0.11	30%	0.304	C	S	.	.	H	α-helix	trans	-61.6	-40.7	177.8	49.2	0	0	0	0	112	L484 S485 L491 R492 F579	L484-T488 WeakPolarHBondContact O-CG2 3.31Å; L484-T488 PolarHBondContact O-N 3.24Å; L484-T488 PolarHBondContact O-OG1 2.88Å; S485-T488 WeakPolarHBondContact CA-OG1 3.15Å; S485-T488 PolarHBondContact O-N 3.32Å; S485-T488 PolarHBondContact O-OG1 3.11Å; T488-L491 PolarHBondContact O-N 3.44Å; T488-R492 WeakPolarHBondContact O-CB 3.31Å; T488-R492 VanDerWaalsContact O-CG 3.24Å; T488-R492 WeakPolarHBondContact O-CG 3.4Å; T488-R492 PolarHBondContact O-N 2.91Å; T488-F579 HydrophobicContact CG2-CD2 3.78Å; T488-F579 HydrophobicContact CG2-CE2 3.98Å
489	H	80.4	Confident	77.1	Confident	109 Å²	109	52 Å²	52	51%	0.505	30%	0.304	S	S	.	.	H	α-helix	trans	-65.1	-44.2	177.2	-80.3	-118.3	0	0	0	112.5	S485 S486 L487 S493	S485-H489 WeakPolarHBondContact O-CB 3.06Å; S485-H489 PolarHBondContact O-CD2 3.03Å; S485-H489 PolarHBondContact O-N 2.63Å; S486-H489 PolarHBondContact O-N 3.47Å; L487-H489 VanDerWaalsContact C-N 3.34Å; L487-H489 PolarHBondContact O-N 2.87Å; H489-S493 PolarHBondContact O-N 3.32Å
490	V	83.4	Confident	79.1	Confident	33 Å²	33	47.4 Å²	47.4	20%	0.2	28%	0.279	C	S	.	.	H	α-helix	trans	-64.4	-46.5	175.9	173.3	0	0	0	0	110.3	S486 L487 R492 S493 L494 H552 L554	S486-V490 VanDerWaalsContact O-CG2 3.31Å; S486-V490 WeakPolarHBondContact O-CG2 3.35Å; S486-V490 PolarHBondContact O-N 3.08Å; L487-V490 PolarHBondContact O-N 3.38Å; V490-R492 VanDerWaalsContact C-N 3.33Å; V490-R492 PolarHBondContact O-N 3.34Å; V490-S493 WeakPolarHBondContact O-CB 3.12Å; V490-S493 PolarHBondContact O-N 3.36Å; V490-S493 PolarHBondContact O-OG 3.47Å; V490-L494 HydrophobicContact CG1-CD1 4.28Å; V490-L494 WeakPolarHBondContact O-CG 3.17Å; V490-L494 PolarHBondContact O-N 3.34Å; V490-H552 HydrophobicContact CG1-CB 3.93Å; V490-L554 HydrophobicContact CG1-CD1 4.05Å; V490-L554 HydrophobicContact CG1-CD2 4.5Å
491	L	83.1	Confident	80.8	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-64.7	-35.4	-179.4	-72.7	165.3	0	0	0	112.9	L487 T488 S493 L494 R499 F502 F579	L487-L491 HydrophobicContact CD1-CD1 3.62Å; L487-L491 HydrophobicContact CD1-CG 4.25Å; L487-L491 HydrophobicContact CD2-CD1 4.43Å; L487-L491 HydrophobicContact CG-CD1 3.65Å; L487-L491 WeakPolarHBondContact O-CB 3.34Å; L487-L491 WeakPolarHBondContact O-CG 3.46Å; L487-L491 PolarHBondContact O-N 3.02Å; T488-L491 PolarHBondContact O-N 3.44Å; L491-S493 PolarHBondContact O-N 3.13Å; L491-L494 HydrophobicContact CD2-CD1 3.69Å; L491-L494 HydrophobicContact CG-CD1 4.46Å; L491-L494 WeakPolarHBondContact O-CB 3.34Å; L491-L494 PolarHBondContact O-N 3.38Å; L491-L494 VanDerWaalsContact O-N 3.08Å; L491-R499 VanDerWaalsContact O-CD 3.24Å; L491-R499 WeakPolarHBondContact O-CD 3.38Å; L491-R499 WeakPolarHBondContact O-CG 3.43Å; L491-F502 HydrophobicContact CD1-CD1 3.68Å; L491-F502 HydrophobicContact CD1-CE1 3.54Å; L491-F502 HydrophobicContact CD1-CZ 4.45Å; L491-F502 HydrophobicContact CD2-CB 4.07Å; L491-F502 HydrophobicContact CD2-CD1 3.5Å; L491-F502 HydrophobicContact CD2-CE1 4.06Å; L491-F502 HydrophobicContact CD2-CG 3.78Å; L491-F502 HydrophobicContact CG-CD1 4.28Å; L491-F502 HydrophobicContact CG-CE1 4.42Å; L491-F579 HydrophobicContact CB-CZ 4.4Å; L491-F579 HydrophobicContact CD1-CD2 4.29Å; L491-F579 HydrophobicContact CD1-CE1 3.8Å; L491-F579 HydrophobicContact CD1-CE2 3.42Å; L491-F579 VanDerWaalsContact CD1-CE2 3.42Å; L491-F579 HydrophobicContact CD1-CZ 3.13Å; L491-F579 HydrophobicContact CG-CZ 4.31Å
492	R	83.8	Confident	82.4	Confident	154 Å²	154	42.1 Å²	42.1	58%	0.581	23%	0.229	S	C	*	.	H	α-helix	trans	-63.2	-26.3	172.6	-77.6	174.8	174.7	170	-2.6	113.5	T488 V490 D586	T488-R492 WeakPolarHBondContact O-CB 3.31Å; T488-R492 VanDerWaalsContact O-CG 3.24Å; T488-R492 WeakPolarHBondContact O-CG 3.4Å; T488-R492 PolarHBondContact O-N 2.91Å; V490-R492 VanDerWaalsContact C-N 3.33Å; V490-R492 PolarHBondContact O-N 3.34Å; R492-D586 IonicContact NH2-OD2 3.96Å; R492-D586 PolarHBondContact NH2-OD2 2.65Å
493	S	86.2	Confident	83.8	Confident	89 Å²	89	42.7 Å²	42.7	62%	0.622	23%	0.23	S	C	*	.	H	α-helix	trans	-81.4	-17.2	175	73.1	0	0	0	0	113.6	H489 V490 L491	H489-S493 PolarHBondContact O-N 3.32Å; V490-S493 WeakPolarHBondContact O-CB 3.12Å; V490-S493 PolarHBondContact O-N 3.36Å; V490-S493 PolarHBondContact O-OG 3.47Å; L491-S493 PolarHBondContact O-N 3.13Å
494	L	88.1	Confident	85	Confident	8 Å²	8	44.3 Å²	44.3	4%	0.042	23%	0.234	C	C	.	.	S	Bend	trans	-81.2	152.4	-177.7	-70.9	169.6	0	0	0	112.1	V490 L491 A498 R499 E548 F549 L554	V490-L494 HydrophobicContact CG1-CD1 4.28Å; V490-L494 WeakPolarHBondContact O-CG 3.17Å; V490-L494 PolarHBondContact O-N 3.34Å; L491-L494 HydrophobicContact CD2-CD1 3.69Å; L491-L494 HydrophobicContact CG-CD1 4.46Å; L491-L494 WeakPolarHBondContact O-CB 3.34Å; L491-L494 PolarHBondContact O-N 3.38Å; L491-L494 VanDerWaalsContact O-N 3.08Å; L494-A498 HydrophobicContact CB-CB 4.03Å; L494-A498 HydrophobicContact CD2-CB 4.43Å; L494-R499 HydrophobicContact CB-CG 4.23Å; L494-E548 HydrophobicContact CD2-CG 4.01Å; L494-E548 WeakPolarHBondContact CD2-OE1 3.46Å; L494-F549 HydrophobicContact CD1-CD1 4.08Å; L494-F549 HydrophobicContact CD1-CE1 3.67Å; L494-F549 HydrophobicContact CD2-CE1 4.35Å; L494-L554 HydrophobicContact CD1-CD1 4.26Å
495	T	90.1	Very high	85.8	Confident	72 Å²	72	43.5 Å²	43.5	44%	0.442	23%	0.23	S	C	.	.			trans	-61.2	153.2	177	68.7	0	0	0	0	111.3	N497 A498 R499	T495-N497 PolarHBondContact O-N 3.1Å; T495-A498 WeakPolarHBondContact O-CB 3.33Å; T495-A498 PolarHBondContact O-N 3.14Å; T495-A498 VanDerWaalsContact O-N 3.08Å; T495-A498 VanDerWaalsContact OG1-CB 3.26Å; T495-A498 WeakPolarHBondContact OG1-CB 3.45Å; T495-A498 PolarHBondContact OG1-N 3.4Å; T495-R499 PolarHBondContact O-N 2.82Å
496	P	88.8	Confident	86.5	Confident	88 Å²	88	42.7 Å²	42.7	57%	0.571	22%	0.224	S	C	*	.	H	α-helix	trans	-56.9	-35.4	178	20.9	-32.2	0	0	0	113	R499 G500	P496-R499 PolarHBondContact O-N 3.3Å; P496-G500 PolarHBondContact O-N 3Å
497	N	90.8	Very high	87.1	Confident	89 Å²	89	46.4 Å²	46.4	48%	0.476	24%	0.239	S	C	.	.	H	α-helix	trans	-67.6	-44.3	175.3	-68.4	7.5	0	0	0	111.3	T495 R499 G500 I501	T495-N497 PolarHBondContact O-N 3.1Å; N497-R499 VanDerWaalsContact C-N 3.33Å; N497-R499 PolarHBondContact O-N 3.47Å; N497-G500 PolarHBondContact O-N 3.15Å; N497-G500 VanDerWaalsContact O-N 3.14Å; N497-I501 VanDerWaalsContact O-CG1 3.27Å; N497-I501 WeakPolarHBondContact O-CG1 3.2Å; N497-I501 PolarHBondContact O-N 2.74Å
498	A	90.3	Very high	87.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.2	-45.2	174.6	0	0	0	0	0	111.7	L494 T495 G500 I501 F502 F549	L494-A498 HydrophobicContact CB-CB 4.03Å; L494-A498 HydrophobicContact CD2-CB 4.43Å; T495-A498 WeakPolarHBondContact O-CB 3.33Å; T495-A498 PolarHBondContact O-N 3.14Å; T495-A498 VanDerWaalsContact O-N 3.08Å; T495-A498 VanDerWaalsContact OG1-CB 3.26Å; T495-A498 WeakPolarHBondContact OG1-CB 3.45Å; T495-A498 PolarHBondContact OG1-N 3.4Å; A498-G500 VanDerWaalsContact C-N 3.34Å; A498-G500 PolarHBondContact O-N 3.38Å; A498-I501 PolarHBondContact O-N 3Å; A498-F502 PolarHBondContact O-N 3.36Å; A498-F549 HydrophobicContact CB-CE1 4.2Å; A498-F549 HydrophobicContact CB-CZ 4.06Å; A498-F549 WeakPolarHBondContact O-CZ 3.35Å
499	R	89.4	Confident	87.6	Confident	90 Å²	90	48.2 Å²	48.2	34%	0.34	25%	0.246	S	C	.	.	H	α-helix	trans	-58.6	-44.4	173.2	-71.7	-172.6	-74.9	164.3	0.6	111.7	L491 L494 T495 P496 N497 I501 F502 K503	L491-R499 VanDerWaalsContact O-CD 3.24Å; L491-R499 WeakPolarHBondContact O-CD 3.38Å; L491-R499 WeakPolarHBondContact O-CG 3.43Å; L494-R499 HydrophobicContact CB-CG 4.23Å; T495-R499 PolarHBondContact O-N 2.82Å; P496-R499 PolarHBondContact O-N 3.3Å; N497-R499 VanDerWaalsContact C-N 3.33Å; N497-R499 PolarHBondContact O-N 3.47Å; R499-I501 PolarHBondContact O-N 3.29Å; R499-F502 PolarHBondContact O-N 2.73Å; R499-K503 WeakPolarHBondContact O-CB 3.42Å; R499-K503 WeakPolarHBondContact O-CG 3.3Å; R499-K503 PolarHBondContact O-N 3.23Å
500	G	89.8	Confident	87.9	Confident	17 Å²	17	44.9 Å²	44.9	18%	0.175	23%	0.232	C	C	.	.	H	α-helix	trans	-60.1	-42.4	175.3	0	0	0	0	0	113.3	P496 N497 A498 K503 L504	P496-G500 PolarHBondContact O-N 3Å; N497-G500 PolarHBondContact O-N 3.15Å; N497-G500 VanDerWaalsContact O-N 3.14Å; A498-G500 VanDerWaalsContact C-N 3.34Å; A498-G500 PolarHBondContact O-N 3.38Å; G500-K503 PolarHBondContact O-N 3.46Å; G500-L504 PolarHBondContact O-N 2.72Å
501	I	91.6	Very high	88	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.015	25%	0.251	C	S	.	.	H	α-helix	trans	-62.8	-46	176.7	-65.8	164.5	0	0	0	109.8	N497 A498 R499 L504 L505 F526 L535 V536 L542 Q545 F549	N497-I501 VanDerWaalsContact O-CG1 3.27Å; N497-I501 WeakPolarHBondContact O-CG1 3.2Å; N497-I501 PolarHBondContact O-N 2.74Å; A498-I501 PolarHBondContact O-N 3Å; R499-I501 PolarHBondContact O-N 3.29Å; I501-L504 PolarHBondContact O-N 3.28Å; I501-L505 PolarHBondContact O-N 2.89Å; I501-L505 VanDerWaalsContact O-N 3.14Å; I501-F526 HydrophobicContact CG2-CE1 3.74Å; I501-F526 HydrophobicContact CG2-CZ 3.47Å; I501-F526 VanDerWaalsContact CG2-CZ 3.47Å; I501-L535 HydrophobicContact CG1-CB 3.86Å; I501-L535 HydrophobicContact CG1-CD1 3.96Å; I501-L535 HydrophobicContact CG1-CG 4.48Å; I501-V536 HydrophobicContact CD1-CG2 3.39Å; I501-V536 HydrophobicContact CG1-CG2 4Å; I501-L542 HydrophobicContact CD1-CD1 4.44Å; I501-L542 HydrophobicContact CG2-CD1 4Å; I501-Q545 HydrophobicContact CD1-CB 4.38Å; I501-Q545 HydrophobicContact CD1-CG 4.25Å; I501-F549 HydrophobicContact CB-CE2 4.4Å; I501-F549 HydrophobicContact CG2-CE2 3.9Å; I501-F549 HydrophobicContact CG2-CZ 4.49Å
502	F	90.1	Very high	87.9	Confident	1 Å²	1	50.8 Å²	50.8	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-63.3	-44	176.9	-170.9	-101.6	0	0	0	111.8	L487 L491 A498 R499 L504 L505 V506 F549 L554 V569 F579	L487-F502 HydrophobicContact CD1-CE1 4.14Å; L487-F502 HydrophobicContact CD1-CZ 3.97Å; L491-F502 HydrophobicContact CD1-CD1 3.68Å; L491-F502 HydrophobicContact CD1-CE1 3.54Å; L491-F502 HydrophobicContact CD1-CZ 4.45Å; L491-F502 HydrophobicContact CD2-CB 4.07Å; L491-F502 HydrophobicContact CD2-CD1 3.5Å; L491-F502 HydrophobicContact CD2-CE1 4.06Å; L491-F502 HydrophobicContact CD2-CG 3.78Å; L491-F502 HydrophobicContact CG-CD1 4.28Å; L491-F502 HydrophobicContact CG-CE1 4.42Å; A498-F502 PolarHBondContact O-N 3.36Å; R499-F502 PolarHBondContact O-N 2.73Å; F502-L504 PolarHBondContact O-N 3.13Å; F502-L505 WeakPolarHBondContact O-CB 3.25Å; F502-L505 PolarHBondContact O-N 3.49Å; F502-L505 VanDerWaalsContact O-N 3.15Å; F502-V506 HydrophobicContact CD1-CG2 3.85Å; F502-V506 HydrophobicContact CE1-CG2 3.49Å; F502-V506 VanDerWaalsContact CE1-CG2 3.49Å; F502-V506 HydrophobicContact CE2-CG2 4.4Å; F502-V506 HydrophobicContact CG-CG2 4.45Å; F502-V506 HydrophobicContact CZ-CG2 3.8Å; F502-V506 WeakPolarHBondContact O-CG2 3.38Å; F502-V506 PolarHBondContact O-N 2.87Å; F502-F549 HydrophobicContact CB-CZ 4.25Å; F502-L554 HydrophobicContact CD2-CD1 4.49Å; F502-L554 HydrophobicContact CE2-CB 3.98Å; F502-L554 HydrophobicContact CE2-CD1 4.28Å; F502-V569 HydrophobicContact CE2-CG1 4.29Å; F502-V569 HydrophobicContact CE2-CG2 4.43Å; F502-V569 HydrophobicContact CZ-CG1 4.07Å; F502-F579 HydrophobicContact CE1-CE1 4.41Å
503	K	89.3	Confident	87.4	Confident	53 Å²	53	46.3 Å²	46.3	23%	0.23	24%	0.243	C	C	.	.	H	α-helix	trans	-56.5	-45.3	175	-78.7	-172.2	177.8	-160.9	0	112.2	R499 G500 L505 V506 K507 E583 D584	R499-K503 WeakPolarHBondContact O-CB 3.42Å; R499-K503 WeakPolarHBondContact O-CG 3.3Å; R499-K503 PolarHBondContact O-N 3.23Å; G500-K503 PolarHBondContact O-N 3.46Å; K503-L505 VanDerWaalsContact C-N 3.31Å; K503-L505 PolarHBondContact O-N 3.24Å; K503-V506 PolarHBondContact O-N 3.39Å; K503-K507 WeakPolarHBondContact O-CB 3.25Å; K503-K507 WeakPolarHBondContact O-CG 3.48Å; K503-K507 PolarHBondContact O-N 3.23Å; K503-E583 WeakPolarHBondContact CE-OE2 3.5Å; K503-E583 IonicContact NZ-OE2 3.36Å; K503-E583 PolarHBondContact NZ-OE2 2.81Å; K503-D584 IonicContact NZ-OD1 3.37Å
504	L	89.7	Confident	86.8	Confident	57 Å²	57	49 Å²	49	30%	0.298	25%	0.25	S	S	.	.	H	α-helix	trans	-61	-42.6	177.1	-76.8	-177.6	0	0	0	111.9	G500 I501 F502 K507 F508 F526 A533 L535	G500-L504 PolarHBondContact O-N 2.72Å; I501-L504 PolarHBondContact O-N 3.28Å; F502-L504 PolarHBondContact O-N 3.13Å; L504-K507 PolarHBondContact O-N 3.37Å; L504-F508 PolarHBondContact O-N 2.85Å; L504-F526 HydrophobicContact CB-CE2 4.46Å; L504-A533 HydrophobicContact CD1-CB 3.81Å; L504-L535 HydrophobicContact CD1-CD1 3.35Å; L504-L535 HydrophobicContact CG-CD1 4.07Å
505	L	88.3	Confident	86.3	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-65.2	-42.6	179.1	-164.5	151	0	0	0	111	I501 F502 K503 F508 Q509 L521 F526 I555 L567 V569	I501-L505 PolarHBondContact O-N 2.89Å; I501-L505 VanDerWaalsContact O-N 3.14Å; F502-L505 WeakPolarHBondContact O-CB 3.25Å; F502-L505 PolarHBondContact O-N 3.49Å; F502-L505 VanDerWaalsContact O-N 3.15Å; K503-L505 VanDerWaalsContact C-N 3.31Å; K503-L505 PolarHBondContact O-N 3.24Å; L505-F508 PolarHBondContact O-N 3.25Å; L505-Q509 WeakPolarHBondContact O-CB 3.48Å; L505-Q509 PolarHBondContact O-N 3.25Å; L505-L521 HydrophobicContact CG-CD1 4.19Å; L505-F526 HydrophobicContact CB-CE2 3.69Å; L505-F526 HydrophobicContact CB-CZ 3.81Å; L505-F526 HydrophobicContact CD1-CE1 3.97Å; L505-F526 HydrophobicContact CD1-CE2 3.99Å; L505-F526 HydrophobicContact CD1-CZ 3.66Å; L505-F526 HydrophobicContact CG-CE2 4.11Å; L505-F526 HydrophobicContact CG-CZ 4.21Å; L505-I555 HydrophobicContact CD1-CD1 3.75Å; L505-L567 HydrophobicContact CD1-CB 4.17Å; L505-L567 HydrophobicContact CD1-CD1 4.44Å; L505-V569 HydrophobicContact CD2-CB 4.42Å; L505-V569 HydrophobicContact CD2-CG2 3.06Å
506	V	88.1	Confident	85.2	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.006	29%	0.292	C	S	.	.	H	α-helix	trans	-63.6	-46.4	176	170.8	0	0	0	0	111.8	F502 K503 F508 Q509 L510 V569 L576	F502-V506 HydrophobicContact CD1-CG2 3.85Å; F502-V506 HydrophobicContact CE1-CG2 3.49Å; F502-V506 VanDerWaalsContact CE1-CG2 3.49Å; F502-V506 HydrophobicContact CE2-CG2 4.4Å; F502-V506 HydrophobicContact CG-CG2 4.45Å; F502-V506 HydrophobicContact CZ-CG2 3.8Å; F502-V506 WeakPolarHBondContact O-CG2 3.38Å; F502-V506 PolarHBondContact O-N 2.87Å; K503-V506 PolarHBondContact O-N 3.39Å; V506-F508 VanDerWaalsContact C-N 3.32Å; V506-F508 PolarHBondContact O-N 3.12Å; V506-Q509 PolarHBondContact O-N 2.98Å; V506-L510 HydrophobicContact CG1-CD1 3.73Å; V506-L510 WeakPolarHBondContact O-CB 3.37Å; V506-L510 WeakPolarHBondContact O-CG 3.41Å; V506-L510 PolarHBondContact O-N 3.38Å; V506-V569 HydrophobicContact CG2-CG2 4.22Å; V506-L576 HydrophobicContact CG1-CB 4.08Å; V506-L576 HydrophobicContact CG1-CD1 4.46Å; V506-L576 HydrophobicContact CG1-CD2 4.04Å; V506-L576 HydrophobicContact CG1-CG 4.42Å; V506-L576 HydrophobicContact CG2-CD2 3.89Å
507	K	88.4	Confident	84.1	Confident	90 Å²	90	57 Å²	57	39%	0.391	30%	0.301	S	S	.	.	H	α-helix	trans	-58.7	-43.4	176.9	-75.8	-179.8	-179.3	-172	0	111.9	K503 L504 L510 E511	K503-K507 WeakPolarHBondContact O-CB 3.25Å; K503-K507 WeakPolarHBondContact O-CG 3.48Å; K503-K507 PolarHBondContact O-N 3.23Å; L504-K507 PolarHBondContact O-N 3.37Å; K507-L510 VanDerWaalsContact O-CB 3.29Å; K507-L510 WeakPolarHBondContact O-CB 3.47Å; K507-L510 PolarHBondContact O-N 2.96Å; K507-E511 WeakPolarHBondContact O-CG 3.38Å; K507-E511 PolarHBondContact O-N 3.3Å
508	F	85.7	Confident	83.2	Confident	30 Å²	30	56 Å²	56	13%	0.132	29%	0.291	C	S	.	.	H	α-helix	trans	-71.3	-35.4	178.1	-169.5	-103.5	0	0	0	113.1	L504 L505 V506 L510 E511 N512 Y518 L521 R529	L504-F508 PolarHBondContact O-N 2.85Å; L505-F508 PolarHBondContact O-N 3.25Å; V506-F508 VanDerWaalsContact C-N 3.32Å; V506-F508 PolarHBondContact O-N 3.12Å; F508-L510 VanDerWaalsContact C-N 3.26Å; F508-L510 PolarHBondContact O-N 3.08Å; F508-E511 PolarHBondContact O-N 2.94Å; F508-N512 WeakPolarHBondContact CD1-ND2 3.25Å; F508-N512 WeakPolarHBondContact CD2-ND2 3.35Å; F508-N512 WeakPolarHBondContact CE1-ND2 3.25Å; F508-N512 WeakPolarHBondContact CE2-ND2 3.24Å; F508-N512 WeakPolarHBondContact CZ-ND2 3.36Å; F508-N512 PolarHBondContact O-N 3.46Å; F508-N512 PolarHBondContact O-ND2 2.9Å; F508-Y518 HydrophobicContact CD1-CE2 4.41Å; F508-Y518 AromaticContact CD1-CZ 3.9Å; F508-Y518 WeakPolarHBondContact CD1-OH 3.36Å; F508-Y518 AromaticContact CE1-CE2 3.62Å; F508-Y518 HydrophobicContact CE1-CE2 3.62Å; F508-Y518 AromaticContact CE1-CZ 3.57Å; F508-Y518 WeakPolarHBondContact CE1-OH 3.49Å; F508-Y518 HydrophobicContact CZ-CE2 4.36Å; F508-L521 HydrophobicContact CB-CD1 3.76Å; F508-L521 HydrophobicContact CD1-CD1 3.2Å; F508-L521 HydrophobicContact CD1-CD2 3.59Å; F508-L521 HydrophobicContact CD1-CG 3.17Å; F508-L521 HydrophobicContact CE1-CD1 3.99Å; F508-L521 HydrophobicContact CE1-CD2 3.55Å; F508-L521 HydrophobicContact CE1-CG 3.39Å; F508-L521 HydrophobicContact CG-CD1 3.77Å; F508-L521 HydrophobicContact CG-CD2 4.23Å; F508-L521 HydrophobicContact CG-CG 4.09Å; F508-L521 HydrophobicContact CZ-CD2 4.25Å; F508-R529 VanDerWaalsContact CE2-CZ 3.41Å
509	Q	85.1	Confident	82	Confident	27 Å²	27	59.7 Å²	59.7	13%	0.126	32%	0.317	C	S	.	.	H	α-helix	trans	-63.9	-37.2	172.3	-177.7	163.9	-23.8	0	0	110.9	L505 V506 K513	L505-Q509 WeakPolarHBondContact O-CB 3.48Å; L505-Q509 PolarHBondContact O-N 3.25Å; V506-Q509 PolarHBondContact O-N 2.98Å; Q509-K513 WeakPolarHBondContact O-CG 3.44Å; Q509-K513 PolarHBondContact O-N 3.41Å
510	L	85.3	Confident	81.4	Confident	38 Å²	38	55.8 Å²	55.8	20%	0.199	31%	0.305	C	S	.	.	H	α-helix	trans	-61.9	-49.2	173.4	-85.5	158.2	0	0	0	113.4	V506 K507 F508 N512 K513 I577 L580	V506-L510 HydrophobicContact CG1-CD1 3.73Å; V506-L510 WeakPolarHBondContact O-CB 3.37Å; V506-L510 WeakPolarHBondContact O-CG 3.41Å; V506-L510 PolarHBondContact O-N 3.38Å; K507-L510 VanDerWaalsContact O-CB 3.29Å; K507-L510 WeakPolarHBondContact O-CB 3.47Å; K507-L510 PolarHBondContact O-N 2.96Å; F508-L510 VanDerWaalsContact C-N 3.26Å; F508-L510 PolarHBondContact O-N 3.08Å; L510-N512 PolarHBondContact O-N 3.23Å; L510-K513 HydrophobicContact CD2-CD 3.96Å; L510-K513 VanDerWaalsContact CD2-CE 3.48Å; L510-K513 HydrophobicContact CG-CD 4.48Å; L510-K513 WeakPolarHBondContact O-CG 3.24Å; L510-K513 PolarHBondContact O-N 3.46Å; L510-I577 HydrophobicContact CD2-CD1 4.21Å; L510-I577 HydrophobicContact CD2-CG1 3.47Å; L510-I577 VanDerWaalsContact CD2-CG1 3.47Å; L510-L580 HydrophobicContact CD1-CD2 4.08Å
511	E	85.5	Confident	81	Confident	129 Å²	129	55.2 Å²	55.2	60%	0.603	30%	0.297	S	S	*	.	H	α-helix	trans	-62.2	-29	179.4	-72.8	165.9	-171.5	0	0	112.9	K507 F508	K507-E511 WeakPolarHBondContact O-CG 3.38Å; K507-E511 PolarHBondContact O-N 3.3Å; F508-E511 PolarHBondContact O-N 2.94Å
512	N	82.4	Confident	80.7	Confident	30 Å²	30	55.9 Å²	55.9	16%	0.16	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	10.3	-177.5	-64	-67.5	0	0	0	114.2	F508 L510 D514 N515 Y518	F508-N512 WeakPolarHBondContact CD1-ND2 3.25Å; F508-N512 WeakPolarHBondContact CD2-ND2 3.35Å; F508-N512 WeakPolarHBondContact CE1-ND2 3.25Å; F508-N512 WeakPolarHBondContact CE2-ND2 3.24Å; F508-N512 WeakPolarHBondContact CZ-ND2 3.36Å; F508-N512 PolarHBondContact O-N 3.46Å; F508-N512 PolarHBondContact O-ND2 2.9Å; L510-N512 PolarHBondContact O-N 3.23Å; N512-D514 PolarHBondContact O-N 2.93Å; N512-N515 PolarHBondContact O-N 3.44Å; N512-Y518 HydrophobicContact CB-CD1 3.68Å; N512-Y518 HydrophobicContact CB-CD2 4.11Å; N512-Y518 HydrophobicContact CB-CE1 3.91Å; N512-Y518 HydrophobicContact CB-CE2 4.34Å; N512-Y518 HydrophobicContact CB-CG 3.78Å
513	K	73.5	Confident	80.6	Confident	59 Å²	59	56.7 Å²	56.7	26%	0.257	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-30.9	179.3	-69.3	-178.7	174.6	174.6	0	112.9	Q509 L510 N515 T573	Q509-K513 WeakPolarHBondContact O-CG 3.44Å; Q509-K513 PolarHBondContact O-N 3.41Å; L510-K513 HydrophobicContact CD2-CD 3.96Å; L510-K513 VanDerWaalsContact CD2-CE 3.48Å; L510-K513 HydrophobicContact CG-CD 4.48Å; L510-K513 WeakPolarHBondContact O-CG 3.24Å; L510-K513 PolarHBondContact O-N 3.46Å; K513-N515 VanDerWaalsContact C-N 3.28Å; K513-N515 PolarHBondContact O-N 3.46Å; K513-T573 HydrophobicContact CD-CG2 3.57Å; K513-T573 VanDerWaalsContact CE-CB 3.4Å; K513-T573 HydrophobicContact CG-CG2 4.05Å; K513-T573 VanDerWaalsContact NZ-C 3.32Å; K513-T573 VanDerWaalsContact NZ-CB 3.26Å; K513-T573 PolarHBondContact NZ-O 3.08Å
514	D	72.1	Confident	80.6	Confident	146 Å²	146	61.6 Å²	61.6	78%	0.781	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-10.3	-175.8	-57.6	-31.7	0	0	0	113	N512 P516	N512-D514 PolarHBondContact O-N 2.93Å; D514-P516 WeakPolarHBondContact O-CD 3.33Å
515	N	78.1	Confident	80.5	Confident	95 Å²	95	62.9 Å²	62.9	51%	0.508	34%	0.337	S	S	.	.			trans	-98.5	102.2	-179.5	-79.7	-35.3	0	0	0	111.2	N512 K513 S517 Y518	N512-N515 PolarHBondContact O-N 3.44Å; K513-N515 VanDerWaalsContact C-N 3.28Å; K513-N515 PolarHBondContact O-N 3.46Å; N515-S517 PolarHBondContact O-N 3.21Å; N515-S517 VanDerWaalsContact O-N 3.12Å; N515-Y518 VanDerWaalsContact O-CB 3.31Å; N515-Y518 WeakPolarHBondContact O-CB 3.35Å; N515-Y518 PolarHBondContact O-N 3.22Å
516	P	67	Low	80.6	Confident	130 Å²	130	62.9 Å²	62.9	84%	0.844	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-16.5	-179.9	27.1	-35.4	0	0	0	113.6	D514 Y518	D514-P516 WeakPolarHBondContact O-CD 3.33Å; P516-Y518 VanDerWaalsContact C-N 3.32Å
517	S	66.1	Low	80.8	Confident	111 Å²	111	65.1 Å²	65.1	78%	0.776	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-5.3	176.2	-52.9	0	0	0	0	113.7	N515 S519	N515-S517 PolarHBondContact O-N 3.21Å; N515-S517 VanDerWaalsContact O-N 3.12Å; S517-S519 PolarHBondContact O-N 3.03Å
518	Y	71.6	Confident	81	Confident	68 Å²	68	66.2 Å²	66.2	27%	0.267	35%	0.352	S	S	.	.			trans	-79.6	110.3	-176.7	177.6	-109.1	0	0	0	111	F508 N512 N515 P516 G520 L521	F508-Y518 HydrophobicContact CD1-CE2 4.41Å; F508-Y518 AromaticContact CD1-CZ 3.9Å; F508-Y518 WeakPolarHBondContact CD1-OH 3.36Å; F508-Y518 AromaticContact CE1-CE2 3.62Å; F508-Y518 HydrophobicContact CE1-CE2 3.62Å; F508-Y518 AromaticContact CE1-CZ 3.57Å; F508-Y518 WeakPolarHBondContact CE1-OH 3.49Å; F508-Y518 HydrophobicContact CZ-CE2 4.36Å; N512-Y518 HydrophobicContact CB-CD1 3.68Å; N512-Y518 HydrophobicContact CB-CD2 4.11Å; N512-Y518 HydrophobicContact CB-CE1 3.91Å; N512-Y518 HydrophobicContact CB-CE2 4.34Å; N512-Y518 HydrophobicContact CB-CG 3.78Å; N515-Y518 VanDerWaalsContact O-CB 3.31Å; N515-Y518 WeakPolarHBondContact O-CB 3.35Å; N515-Y518 PolarHBondContact O-N 3.22Å; P516-Y518 VanDerWaalsContact C-N 3.32Å; Y518-G520 WeakPolarHBondContact CE2-O 3.37Å; Y518-G520 VanDerWaalsContact CZ-CA 3.45Å; Y518-G520 PolarHBondContact OH-O 3.34Å; Y518-L521 WeakPolarHBondContact OH-CA 3.46Å; Y518-L521 WeakPolarHBondContact OH-CG 3.41Å; Y518-L521 PolarHBondContact OH-N 3.45Å
519	S	65.6	Low	81.2	Confident	78 Å²	78	69.5 Å²	69.5	55%	0.545	36%	0.363	S	S	.	.			trans	-88.8	0.5	-177.1	-64.7	0	0	0	0	114.2	S517 Y566 I568	S517-S519 PolarHBondContact O-N 3.03Å; S519-Y566 WeakPolarHBondContact O-CB 2.67Å; S519-I568 WeakPolarHBondContact O-CD1 3.42Å
520	G	75.3	Confident	81.5	Confident	7 Å²	7	68.2 Å²	68.2	7%	0.072	36%	0.357	C	S	.	.			trans	120.4	178.6	-178.3	0	0	0	0	0	113.7	Y518 Y566	Y518-G520 WeakPolarHBondContact CE2-O 3.37Å; Y518-G520 VanDerWaalsContact CZ-CA 3.45Å; Y518-G520 PolarHBondContact OH-O 3.34Å; G520-Y566 VanDerWaalsContact O-CD1 3.25Å; G520-Y566 WeakPolarHBondContact O-CD1 3.46Å
521	L	81.4	Confident	81.9	Confident	5 Å²	5	74.2 Å²	74.2	3%	0.026	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	128.1	-178.8	-105.8	150.8	0	0	0	110.1	L505 F508 Y518 F526 Y566 L567	L505-L521 HydrophobicContact CG-CD1 4.19Å; F508-L521 HydrophobicContact CB-CD1 3.76Å; F508-L521 HydrophobicContact CD1-CD1 3.2Å; F508-L521 HydrophobicContact CD1-CD2 3.59Å; F508-L521 HydrophobicContact CD1-CG 3.17Å; F508-L521 HydrophobicContact CE1-CD1 3.99Å; F508-L521 HydrophobicContact CE1-CD2 3.55Å; F508-L521 HydrophobicContact CE1-CG 3.39Å; F508-L521 HydrophobicContact CG-CD1 3.77Å; F508-L521 HydrophobicContact CG-CD2 4.23Å; F508-L521 HydrophobicContact CG-CG 4.09Å; F508-L521 HydrophobicContact CZ-CD2 4.25Å; Y518-L521 WeakPolarHBondContact OH-CA 3.46Å; Y518-L521 WeakPolarHBondContact OH-CG 3.41Å; Y518-L521 PolarHBondContact OH-N 3.45Å; L521-F526 HydrophobicContact CD1-CD2 4.14Å; L521-F526 HydrophobicContact CD2-CB 4.18Å; L521-F526 HydrophobicContact CD2-CD2 4.4Å; L521-Y566 CarbonylContact O-C 3.53Å; L521-Y566 VanDerWaalsContact O-CA 3.31Å; L521-Y566 WeakPolarHBondContact O-CA 3.38Å; L521-L567 HydrophobicContact CB-CB 4.34Å; L521-L567 PolarHBondContact N-O 3.43Å; L521-L567 VanDerWaalsContact N-O 3.13Å; L521-L567 PolarHBondContact O-N 3.04Å
522	S	86.9	Confident	82.2	Confident	17 Å²	17	73.9 Å²	73.9	12%	0.119	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	142.9	169	88.9	0	0	0	0	109.7	Q524 D525 F526	S522-Q524 VanDerWaalsContact C-N 3.26Å; S522-Q524 PolarHBondContact O-N 3.33Å; S522-D525 PolarHBondContact O-N 3.43Å; S522-D525 WeakPolarHBondContact OG-CB 3.44Å; S522-D525 PolarHBondContact OG-N 3.14Å; S522-D525 VanDerWaalsContact OG-N 3.13Å; S522-D525 PolarHBondContact OG-OD2 2.89Å; S522-F526 WeakPolarHBondContact O-CB 3.3Å; S522-F526 PolarHBondContact O-N 2.97Å
523	F	87.8	Confident	82.7	Confident	19 Å²	19	74.8 Å²	74.8	8%	0.083	39%	0.388	C	S	.	.	H	α-helix	trans	-59	-37.7	177.9	177.3	-99.1	0	0	0	112.7	F526 Y527 D539 L542 R543 L546 E565	F523-F526 PolarHBondContact O-N 3.37Å; F523-Y527 WeakPolarHBondContact O-CB 3.46Å; F523-Y527 PolarHBondContact O-N 3.26Å; F523-D539 WeakPolarHBondContact CE1-OD1 3.46Å; F523-D539 WeakPolarHBondContact CZ-OD1 3.49Å; F523-L542 HydrophobicContact CE2-CD2 3.86Å; F523-L542 HydrophobicContact CE2-CG 4.18Å; F523-L542 HydrophobicContact CZ-CD2 4.21Å; F523-R543 HydrophobicContact CE2-CG 4.03Å; F523-R543 HydrophobicContact CZ-CG 3.7Å; F523-L546 HydrophobicContact CD2-CD1 3.7Å; F523-L546 HydrophobicContact CE2-CD1 3.52Å; F523-E565 PolarHBondContact N-O 3.26Å
524	Q	87.9	Confident	83.5	Confident	156 Å²	156	80.6 Å²	80.6	73%	0.729	41%	0.413	S	S	*	.	H	α-helix	trans	-67	-46.5	-178.8	-66.5	-180	-1.5	0	0	111.8	S522 F526 Y527 Q528	S522-Q524 VanDerWaalsContact C-N 3.26Å; S522-Q524 PolarHBondContact O-N 3.33Å; Q524-F526 VanDerWaalsContact C-N 3.31Å; Q524-F526 PolarHBondContact O-N 2.95Å; Q524-Y527 PolarHBondContact O-N 2.91Å; Q524-Q528 PolarHBondContact O-N 2.89Å
525	D	88.7	Confident	84.4	Confident	83 Å²	83	75.1 Å²	75.1	44%	0.444	38%	0.384	S	S	.	.	H	α-helix	trans	-65.9	-38.4	177.8	-61.7	-35.3	0	0	0	111	S522 Q528 R529	S522-D525 PolarHBondContact O-N 3.43Å; S522-D525 WeakPolarHBondContact OG-CB 3.44Å; S522-D525 PolarHBondContact OG-N 3.14Å; S522-D525 VanDerWaalsContact OG-N 3.13Å; S522-D525 PolarHBondContact OG-OD2 2.89Å; D525-Q528 PolarHBondContact O-N 2.94Å; D525-R529 WeakPolarHBondContact O-CG 3.32Å; D525-R529 PolarHBondContact O-N 2.91Å; D525-R529 VanDerWaalsContact O-N 3.1Å
526	F	90.6	Very high	85	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.009	36%	0.363	C	S	.	.	H	α-helix	trans	-63.6	-44.9	176.9	-171.4	-123.6	0	0	0	111.6	I501 L504 L505 L521 S522 F523 Q524 Q528 R529 C530 L542 L546 L567	I501-F526 HydrophobicContact CG2-CE1 3.74Å; I501-F526 HydrophobicContact CG2-CZ 3.47Å; I501-F526 VanDerWaalsContact CG2-CZ 3.47Å; L504-F526 HydrophobicContact CB-CE2 4.46Å; L505-F526 HydrophobicContact CB-CE2 3.69Å; L505-F526 HydrophobicContact CB-CZ 3.81Å; L505-F526 HydrophobicContact CD1-CE1 3.97Å; L505-F526 HydrophobicContact CD1-CE2 3.99Å; L505-F526 HydrophobicContact CD1-CZ 3.66Å; L505-F526 HydrophobicContact CG-CE2 4.11Å; L505-F526 HydrophobicContact CG-CZ 4.21Å; L521-F526 HydrophobicContact CD1-CD2 4.14Å; L521-F526 HydrophobicContact CD2-CB 4.18Å; L521-F526 HydrophobicContact CD2-CD2 4.4Å; S522-F526 WeakPolarHBondContact O-CB 3.3Å; S522-F526 PolarHBondContact O-N 2.97Å; F523-F526 PolarHBondContact O-N 3.37Å; Q524-F526 VanDerWaalsContact C-N 3.31Å; Q524-F526 PolarHBondContact O-N 2.95Å; F526-Q528 VanDerWaalsContact C-N 3.35Å; F526-Q528 PolarHBondContact O-N 3Å; F526-R529 PolarHBondContact O-N 3.45Å; F526-C530 PolarHBondContact O-N 3.3Å; F526-C530 PolarHBondContact O-SG 3.08Å; F526-C530 VanDerWaalsContact O-SG 3.33Å; F526-L542 HydrophobicContact CD1-CD1 4.2Å; F526-L542 HydrophobicContact CD1-CD2 3.99Å; F526-L542 HydrophobicContact CE1-CD1 3.83Å; F526-L542 HydrophobicContact CE1-CD2 4.46Å; F526-L546 HydrophobicContact CE1-CD2 4.1Å; F526-L567 HydrophobicContact CB-CD1 4.25Å; F526-L567 HydrophobicContact CD1-CD1 3.67Å; F526-L567 HydrophobicContact CE1-CD1 4.31Å; F526-L567 HydrophobicContact CG-CD1 4.13Å
527	Y	91.1	Very high	86	Confident	48 Å²	48	72.2 Å²	72.2	19%	0.188	36%	0.362	C	S	.	.	H	α-helix	trans	-60.2	-43.3	175.8	178.1	-111.3	0	0	0	112.5	F523 Q524 R529 C530 R531 D539 L542	F523-Y527 WeakPolarHBondContact O-CB 3.46Å; F523-Y527 PolarHBondContact O-N 3.26Å; Q524-Y527 PolarHBondContact O-N 2.91Å; Y527-R529 VanDerWaalsContact C-N 3.34Å; Y527-R529 PolarHBondContact O-N 2.9Å; Y527-C530 PolarHBondContact O-N 3.22Å; Y527-R531 WeakPolarHBondContact O-CB 3.06Å; Y527-R531 PolarHBondContact O-N 3.3Å; Y527-D539 HydrophobicContact CE2-CB 4.31Å; Y527-D539 PolarHBondContact OH-N 2.8Å; Y527-L542 HydrophobicContact CD2-CB 4.28Å; Y527-L542 HydrophobicContact CD2-CD2 3.75Å; Y527-L542 HydrophobicContact CG-CD2 4.25Å
528	Q	92.4	Very high	87.2	Confident	112 Å²	112	69.7 Å²	69.7	52%	0.523	34%	0.344	S	S	.	.	H	α-helix	trans	-57.5	-47.4	176.2	-179.8	175.7	-14.7	0	0	111.2	Q524 D525 F526 R531 E532	Q524-Q528 PolarHBondContact O-N 2.89Å; D525-Q528 PolarHBondContact O-N 2.94Å; F526-Q528 VanDerWaalsContact C-N 3.35Å; F526-Q528 PolarHBondContact O-N 3Å; Q528-R531 WeakPolarHBondContact O-CB 2.94Å; Q528-R531 PolarHBondContact O-N 2.92Å; Q528-E532 WeakPolarHBondContact CG-OE1 2.91Å; Q528-E532 PolarHBondContact NE2-OE1 3.37Å; Q528-E532 WeakPolarHBondContact O-CG 3.42Å; Q528-E532 PolarHBondContact O-N 3.36Å
529	R	90.8	Very high	88.1	Confident	99 Å²	99	68.9 Å²	68.9	37%	0.374	34%	0.344	S	S	.	.	H	α-helix	trans	-66.8	-40.7	179.5	-67.6	174.8	-172.9	-139.5	4.7	113.1	F508 D525 F526 Y527 R531 E532 A533	F508-R529 VanDerWaalsContact CE2-CZ 3.41Å; D525-R529 WeakPolarHBondContact O-CG 3.32Å; D525-R529 PolarHBondContact O-N 2.91Å; D525-R529 VanDerWaalsContact O-N 3.1Å; F526-R529 PolarHBondContact O-N 3.45Å; Y527-R529 VanDerWaalsContact C-N 3.34Å; Y527-R529 PolarHBondContact O-N 2.9Å; R529-R531 PolarHBondContact O-N 3.41Å; R529-E532 PolarHBondContact O-N 3.49Å; R529-A533 WeakPolarHBondContact O-CB 3.38Å; R529-A533 PolarHBondContact O-N 3.37Å
530	C	92.4	Very high	89.3	Confident	0 Å²	0	71 Å²	71	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-62	-34.9	175	-71.3	0	0	0	0	111.8	F526 Y527 F534 L535 V536	F526-C530 PolarHBondContact O-N 3.3Å; F526-C530 PolarHBondContact O-SG 3.08Å; F526-C530 VanDerWaalsContact O-SG 3.33Å; Y527-C530 PolarHBondContact O-N 3.22Å; C530-F534 PolarHBondContact O-N 3.18Å; C530-L535 PolarHBondContact O-N 2.89Å; C530-V536 HydrophobicContact CB-CB 4.46Å; C530-V536 HydrophobicContact CB-CG2 4.16Å
531	R	92.3	Very high	90	Very high	164 Å²	164	73.5 Å²	73.5	62%	0.619	36%	0.363	S	S	*	.	H	α-helix	trans	-73.5	-40.4	175.8	-174.6	178.7	169.2	-170.7	-3.1	112.1	Y527 Q528 R529 A533 F534	Y527-R531 WeakPolarHBondContact O-CB 3.06Å; Y527-R531 PolarHBondContact O-N 3.3Å; Q528-R531 WeakPolarHBondContact O-CB 2.94Å; Q528-R531 PolarHBondContact O-N 2.92Å; R529-R531 PolarHBondContact O-N 3.41Å; R531-A533 VanDerWaalsContact C-N 3.28Å; R531-A533 PolarHBondContact O-N 3.15Å; R531-F534 PolarHBondContact O-N 2.91Å; R531-F534 VanDerWaalsContact O-N 3.09Å
532	E	93.3	Very high	90.5	Very high	122 Å²	122	73.3 Å²	73.3	57%	0.57	36%	0.362	S	S	*	.	H	α-helix	trans	-61.8	-36.2	174	-75.1	172.1	-172.2	0	0	112	Q528 R529 F534	Q528-E532 WeakPolarHBondContact CG-OE1 2.91Å; Q528-E532 PolarHBondContact NE2-OE1 3.37Å; Q528-E532 WeakPolarHBondContact O-CG 3.42Å; Q528-E532 PolarHBondContact O-N 3.36Å; R529-E532 PolarHBondContact O-N 3.49Å; E532-F534 VanDerWaalsContact C-N 3.26Å; E532-F534 WeakPolarHBondContact O-CD2 3.26Å; E532-F534 PolarHBondContact O-N 3.42Å
533	A	91.4	Very high	90.7	Very high	49 Å²	49	77.5 Å²	77.5	41%	0.405	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	4.4	174.9	0	0	0	0	0	114.2	L504 R529 R531 L535	L504-A533 HydrophobicContact CD1-CB 3.81Å; R529-A533 WeakPolarHBondContact O-CB 3.38Å; R529-A533 PolarHBondContact O-N 3.37Å; R531-A533 VanDerWaalsContact C-N 3.28Å; R531-A533 PolarHBondContact O-N 3.15Å; A533-L535 HydrophobicContact CB-CD1 3.99Å; A533-L535 HydrophobicContact CB-CG 3.99Å; A533-L535 PolarHBondContact O-N 3.43Å
534	F	90.6	Very high	90.8	Very high	182 Å²	182	79.9 Å²	79.9	80%	0.798	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	28.7	-178	-56.8	-80.5	0	0	0	115	C530 R531 E532	C530-F534 PolarHBondContact O-N 3.18Å; R531-F534 PolarHBondContact O-N 2.91Å; R531-F534 VanDerWaalsContact O-N 3.09Å; E532-F534 VanDerWaalsContact C-N 3.26Å; E532-F534 WeakPolarHBondContact O-CD2 3.26Å; E532-F534 PolarHBondContact O-N 3.42Å
535	L	91.1	Very high	91	Very high	31 Å²	31	74.2 Å²	74.2	16%	0.162	37%	0.365	C	S	.	.			trans	-83.6	-27.3	-179.6	-65.2	170.3	0	0	0	112.7	I501 L504 C530 A533	I501-L535 HydrophobicContact CG1-CB 3.86Å; I501-L535 HydrophobicContact CG1-CD1 3.96Å; I501-L535 HydrophobicContact CG1-CG 4.48Å; L504-L535 HydrophobicContact CD1-CD1 3.35Å; L504-L535 HydrophobicContact CG-CD1 4.07Å; C530-L535 PolarHBondContact O-N 2.89Å; A533-L535 HydrophobicContact CB-CD1 3.99Å; A533-L535 HydrophobicContact CB-CG 3.99Å; A533-L535 PolarHBondContact O-N 3.43Å
536	V	91	Very high	91	Very high	10 Å²	10	71.3 Å²	71.3	6%	0.061	35%	0.349	C	S	.	.			trans	-138.4	141.8	-172	-174.3	0	0	0	0	111.3	I501 C530 S538 T541 L542	I501-V536 HydrophobicContact CD1-CG2 3.39Å; I501-V536 HydrophobicContact CG1-CG2 4Å; C530-V536 HydrophobicContact CB-CB 4.46Å; C530-V536 HydrophobicContact CB-CG2 4.16Å; V536-S538 WeakPolarHBondContact CG1-O 3.37Å; V536-T541 WeakPolarHBondContact CG1-OG1 3.27Å; V536-L542 HydrophobicContact CG1-CB 4.09Å; V536-L542 HydrophobicContact CG2-CD1 4.24Å
537	N	88.9	Confident	91	Very high	154 Å²	154	74.8 Å²	74.8	82%	0.824	37%	0.37	S	S	*	.	S	Bend	trans	-95.8	-29.1	-178.2	-64	-19.1	0	0	0	113.8
538	S	91.3	Very high	91	Very high	58 Å²	58	75.3 Å²	75.3	41%	0.406	38%	0.375	S	S	.	.	S	Bend	trans	-147	157.8	-175.3	-178.8	0	0	0	0	112.5	V536 L540 T541 L542	V536-S538 WeakPolarHBondContact CG1-O 3.37Å; S538-L540 VanDerWaalsContact C-N 3.27Å; S538-L540 PolarHBondContact O-N 3.34Å; S538-T541 PolarHBondContact N-OG1 2.77Å; S538-T541 VanDerWaalsContact N-OG1 3.14Å; S538-T541 PolarHBondContact O-N 3.33Å; S538-T541 PolarHBondContact O-OG1 3.31Å; S538-L542 PolarHBondContact O-N 2.72Å
539	D	90.3	Very high	90.8	Very high	50 Å²	50	70 Å²	70	27%	0.267	35%	0.35	S	S	.	.	H	α-helix	trans	-57.3	-41.7	176.8	-169	48.7	0	0	0	112.1	F523 Y527 T541 L542 R543	F523-D539 WeakPolarHBondContact CE1-OD1 3.46Å; F523-D539 WeakPolarHBondContact CZ-OD1 3.49Å; Y527-D539 HydrophobicContact CE2-CB 4.31Å; Y527-D539 PolarHBondContact OH-N 2.8Å; D539-T541 VanDerWaalsContact C-N 3.3Å; D539-T541 PolarHBondContact O-N 3.15Å; D539-L542 PolarHBondContact O-N 3.24Å; D539-L542 VanDerWaalsContact O-N 3.13Å; D539-R543 WeakPolarHBondContact O-CG 3.37Å; D539-R543 PolarHBondContact O-N 2.97Å; D539-R543 IonicContact OD2-CZ 3.28Å; D539-R543 IonicContact OD2-NE 3.09Å; D539-R543 PolarHBondContact OD2-NE 3.48Å; D539-R543 IonicContact OD2-NH2 3.8Å; D539-R543 PolarHBondContact OD2-NH2 3.35Å
540	L	90.4	Very high	90.6	Very high	122 Å²	122	73.2 Å²	73.2	64%	0.639	36%	0.362	S	S	*	.	H	α-helix	trans	-61	-40.4	-179.8	-173.3	65.7	0	0	0	111.7	S538 L542 R543 T544	S538-L540 VanDerWaalsContact C-N 3.27Å; S538-L540 PolarHBondContact O-N 3.34Å; L540-L542 VanDerWaalsContact C-N 3.33Å; L540-L542 PolarHBondContact O-N 3.13Å; L540-R543 PolarHBondContact O-N 3.21Å; L540-T544 WeakPolarHBondContact O-CG2 3.43Å; L540-T544 PolarHBondContact O-N 3.28Å; L540-T544 PolarHBondContact O-OG1 2.63Å
541	T	90.4	Very high	90.3	Very high	61 Å²	61	79.2 Å²	79.2	37%	0.374	39%	0.394	S	S	.	.	H	α-helix	trans	-67.2	-34.3	178	43	0	0	0	0	112.3	V536 S538 D539 T544 Q545	V536-T541 WeakPolarHBondContact CG1-OG1 3.27Å; S538-T541 PolarHBondContact N-OG1 2.77Å; S538-T541 VanDerWaalsContact N-OG1 3.14Å; S538-T541 PolarHBondContact O-N 3.33Å; S538-T541 PolarHBondContact O-OG1 3.31Å; D539-T541 VanDerWaalsContact C-N 3.3Å; D539-T541 PolarHBondContact O-N 3.15Å; T541-T544 WeakPolarHBondContact CA-OG1 3.47Å; T541-T544 PolarHBondContact O-OG1 3.14Å; T541-Q545 WeakPolarHBondContact O-CG 3.26Å; T541-Q545 PolarHBondContact O-N 3.37Å
542	L	91.3	Very high	89.8	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-67.2	-43.8	172.8	-176.3	60.8	0	0	0	110.6	I501 F523 F526 Y527 V536 S538 D539 L540 T544 Q545 L546	I501-L542 HydrophobicContact CD1-CD1 4.44Å; I501-L542 HydrophobicContact CG2-CD1 4Å; F523-L542 HydrophobicContact CE2-CD2 3.86Å; F523-L542 HydrophobicContact CE2-CG 4.18Å; F523-L542 HydrophobicContact CZ-CD2 4.21Å; F526-L542 HydrophobicContact CD1-CD1 4.2Å; F526-L542 HydrophobicContact CD1-CD2 3.99Å; F526-L542 HydrophobicContact CE1-CD1 3.83Å; F526-L542 HydrophobicContact CE1-CD2 4.46Å; Y527-L542 HydrophobicContact CD2-CB 4.28Å; Y527-L542 HydrophobicContact CD2-CD2 3.75Å; Y527-L542 HydrophobicContact CG-CD2 4.25Å; V536-L542 HydrophobicContact CG1-CB 4.09Å; V536-L542 HydrophobicContact CG2-CD1 4.24Å; S538-L542 PolarHBondContact O-N 2.72Å; D539-L542 PolarHBondContact O-N 3.24Å; D539-L542 VanDerWaalsContact O-N 3.13Å; L540-L542 VanDerWaalsContact C-N 3.33Å; L540-L542 PolarHBondContact O-N 3.13Å; L542-T544 VanDerWaalsContact C-N 3.34Å; L542-T544 PolarHBondContact O-N 3.32Å; L542-Q545 WeakPolarHBondContact O-CB 3.39Å; L542-Q545 PolarHBondContact O-N 3.24Å; L542-Q545 VanDerWaalsContact O-N 3.12Å; L542-L546 HydrophobicContact CD1-CG 4.46Å; L542-L546 HydrophobicContact CG-CD1 4.22Å; L542-L546 HydrophobicContact CG-CG 4.36Å; L542-L546 WeakPolarHBondContact O-CG 3.48Å; L542-L546 PolarHBondContact O-N 3.18Å
543	R	90.8	Very high	89.2	Confident	105 Å²	105	75.7 Å²	75.7	40%	0.396	38%	0.382	S	S	.	.	H	α-helix	trans	-60.1	-42	177.9	-69.2	178.5	-176.7	-82.4	-1.1	112.2	F523 D539 L540 Q545 L546 T547	F523-R543 HydrophobicContact CE2-CG 4.03Å; F523-R543 HydrophobicContact CZ-CG 3.7Å; D539-R543 WeakPolarHBondContact O-CG 3.37Å; D539-R543 PolarHBondContact O-N 2.97Å; D539-R543 IonicContact OD2-CZ 3.28Å; D539-R543 IonicContact OD2-NE 3.09Å; D539-R543 PolarHBondContact OD2-NE 3.48Å; D539-R543 IonicContact OD2-NH2 3.8Å; D539-R543 PolarHBondContact OD2-NH2 3.35Å; L540-R543 PolarHBondContact O-N 3.21Å; R543-Q545 VanDerWaalsContact C-N 3.28Å; R543-Q545 PolarHBondContact O-N 3.34Å; R543-L546 PolarHBondContact O-N 3.43Å; R543-T547 WeakPolarHBondContact O-CG2 3.49Å; R543-T547 PolarHBondContact O-N 3.32Å; R543-T547 PolarHBondContact O-OG1 3.33Å
544	T	91	Very high	88.9	Confident	70 Å²	70	73.3 Å²	73.3	43%	0.429	36%	0.363	S	S	.	.	H	α-helix	trans	-62.7	-35	175.5	50.8	0	0	0	0	112.8	L540 T541 L542 T547 E548	L540-T544 WeakPolarHBondContact O-CG2 3.43Å; L540-T544 PolarHBondContact O-N 3.28Å; L540-T544 PolarHBondContact O-OG1 2.63Å; T541-T544 WeakPolarHBondContact CA-OG1 3.47Å; T541-T544 PolarHBondContact O-OG1 3.14Å; L542-T544 VanDerWaalsContact C-N 3.34Å; L542-T544 PolarHBondContact O-N 3.32Å; T544-T547 VanDerWaalsContact C-OG1 3.27Å; T544-T547 VanDerWaalsContact CA-OG1 3.3Å; T544-T547 WeakPolarHBondContact CA-OG1 3.47Å; T544-T547 PolarHBondContact O-OG1 3.48Å; T544-E548 PolarHBondContact O-N 3.46Å; T544-E548 VanDerWaalsContact O-N 3.13Å
545	Q	90.7	Very high	88.7	Confident	37 Å²	37	65 Å²	65	17%	0.173	33%	0.327	C	S	.	.	H	α-helix	trans	-73.5	-38.3	176	-71.6	-64.5	-52.3	0	0	111.6	I501 T541 L542 R543 T547 E548 F549	I501-Q545 HydrophobicContact CD1-CB 4.38Å; I501-Q545 HydrophobicContact CD1-CG 4.25Å; T541-Q545 WeakPolarHBondContact O-CG 3.26Å; T541-Q545 PolarHBondContact O-N 3.37Å; L542-Q545 WeakPolarHBondContact O-CB 3.39Å; L542-Q545 PolarHBondContact O-N 3.24Å; L542-Q545 VanDerWaalsContact O-N 3.12Å; R543-Q545 VanDerWaalsContact C-N 3.28Å; R543-Q545 PolarHBondContact O-N 3.34Å; Q545-T547 VanDerWaalsContact C-N 3.34Å; Q545-T547 PolarHBondContact O-N 3.47Å; Q545-E548 PolarHBondContact NE2-OE2 3.45Å; Q545-E548 WeakPolarHBondContact O-CB 3.32Å; Q545-E548 PolarHBondContact O-N 3.41Å; Q545-E548 PolarHBondContact OE1-OE2 2.94Å; Q545-F549 HydrophobicContact CB-CE2 4.42Å; Q545-F549 VanDerWaalsContact O-CD2 3.25Å; Q545-F549 WeakPolarHBondContact O-CD2 3.4Å; Q545-F549 VanDerWaalsContact O-CG 3.25Å; Q545-F549 WeakPolarHBondContact O-CG 3.48Å; Q545-F549 PolarHBondContact O-N 3.42Å
546	L	90.1	Very high	88.4	Confident	21 Å²	21	71.2 Å²	71.2	11%	0.11	35%	0.348	C	S	.	.	H	α-helix	trans	-66.2	-34.7	173.7	-68.7	177.7	0	0	0	112.5	F523 F526 L542 R543 F549 R550 I555 L567	F523-L546 HydrophobicContact CD2-CD1 3.7Å; F523-L546 HydrophobicContact CE2-CD1 3.52Å; F526-L546 HydrophobicContact CE1-CD2 4.1Å; L542-L546 HydrophobicContact CD1-CG 4.46Å; L542-L546 HydrophobicContact CG-CD1 4.22Å; L542-L546 HydrophobicContact CG-CG 4.36Å; L542-L546 WeakPolarHBondContact O-CG 3.48Å; L542-L546 PolarHBondContact O-N 3.18Å; R543-L546 PolarHBondContact O-N 3.43Å; L546-F549 HydrophobicContact CD2-CD2 4.21Å; L546-F549 PolarHBondContact O-N 3.09Å; L546-R550 WeakPolarHBondContact O-CB 3.15Å; L546-R550 PolarHBondContact O-N 3.1Å; L546-I555 HydrophobicContact CD2-CD1 3.94Å; L546-L567 HydrophobicContact CD1-CD1 4.03Å; L546-L567 HydrophobicContact CD1-CD2 4.09Å; L546-L567 HydrophobicContact CD2-CD1 4.13Å; L546-L567 HydrophobicContact CD2-CD2 4.07Å
547	T	89.7	Confident	88.1	Confident	75 Å²	75	73.5 Å²	73.5	46%	0.46	36%	0.362	S	S	.	.	H	α-helix	trans	-65.4	-42.5	172.3	48.9	0	0	0	0	111.1	R543 T544 Q545 F549 R550 D551	R543-T547 WeakPolarHBondContact O-CG2 3.49Å; R543-T547 PolarHBondContact O-N 3.32Å; R543-T547 PolarHBondContact O-OG1 3.33Å; T544-T547 VanDerWaalsContact C-OG1 3.27Å; T544-T547 VanDerWaalsContact CA-OG1 3.3Å; T544-T547 WeakPolarHBondContact CA-OG1 3.47Å; T544-T547 PolarHBondContact O-OG1 3.48Å; Q545-T547 VanDerWaalsContact C-N 3.34Å; Q545-T547 PolarHBondContact O-N 3.47Å; T547-F549 PolarHBondContact O-N 3.24Å; T547-R550 WeakPolarHBondContact O-CB 3.05Å; T547-R550 PolarHBondContact O-N 2.88Å; T547-R550 VanDerWaalsContact O-N 3.11Å; T547-D551 VanDerWaalsContact O-CG 3.24Å; T547-D551 PolarHBondContact O-N 3.46Å
548	E	90.2	Very high	87.8	Confident	59 Å²	59	73.7 Å²	73.7	28%	0.276	35%	0.351	S	S	.	.	H	α-helix	trans	-59.3	-46.3	174.5	-177	174.9	-170.5	0	0	111.4	L494 T544 Q545 R550 D551 H552	L494-E548 HydrophobicContact CD2-CG 4.01Å; L494-E548 WeakPolarHBondContact CD2-OE1 3.46Å; T544-E548 PolarHBondContact O-N 3.46Å; T544-E548 VanDerWaalsContact O-N 3.13Å; Q545-E548 PolarHBondContact NE2-OE2 3.45Å; Q545-E548 WeakPolarHBondContact O-CB 3.32Å; Q545-E548 PolarHBondContact O-N 3.41Å; Q545-E548 PolarHBondContact OE1-OE2 2.94Å; E548-R550 VanDerWaalsContact C-N 3.27Å; E548-R550 PolarHBondContact O-N 2.75Å; E548-D551 PolarHBondContact O-N 2.78Å; E548-H552 PolarHBondContact O-CD2 3.12Å; E548-H552 PolarHBondContact O-N 3.26Å; E548-H552 VanDerWaalsContact O-N 3.07Å
549	F	89.4	Confident	87.3	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-63.7	-31.5	175.2	-61	-30.3	0	0	0	113.6	L494 A498 I501 F502 Q545 L546 T547 K553 L554 I555	L494-F549 HydrophobicContact CD1-CD1 4.08Å; L494-F549 HydrophobicContact CD1-CE1 3.67Å; L494-F549 HydrophobicContact CD2-CE1 4.35Å; A498-F549 HydrophobicContact CB-CE1 4.2Å; A498-F549 HydrophobicContact CB-CZ 4.06Å; A498-F549 WeakPolarHBondContact O-CZ 3.35Å; I501-F549 HydrophobicContact CB-CE2 4.4Å; I501-F549 HydrophobicContact CG2-CE2 3.9Å; I501-F549 HydrophobicContact CG2-CZ 4.49Å; F502-F549 HydrophobicContact CB-CZ 4.25Å; Q545-F549 HydrophobicContact CB-CE2 4.42Å; Q545-F549 VanDerWaalsContact O-CD2 3.25Å; Q545-F549 WeakPolarHBondContact O-CD2 3.4Å; Q545-F549 VanDerWaalsContact O-CG 3.25Å; Q545-F549 WeakPolarHBondContact O-CG 3.48Å; Q545-F549 PolarHBondContact O-N 3.42Å; L546-F549 HydrophobicContact CD2-CD2 4.21Å; L546-F549 PolarHBondContact O-N 3.09Å; T547-F549 PolarHBondContact O-N 3.24Å; F549-K553 PolarHBondContact O-N 3.02Å; F549-L554 HydrophobicContact CB-CB 4.34Å; F549-L554 HydrophobicContact CD1-CD1 4.02Å; F549-L554 WeakPolarHBondContact O-CB 3.43Å; F549-L554 PolarHBondContact O-N 3.11Å; F549-I555 HydrophobicContact CB-CB 4.39Å; F549-I555 HydrophobicContact CB-CD1 3.65Å; F549-I555 HydrophobicContact CB-CG1 3.98Å; F549-I555 HydrophobicContact CD2-CD1 3.5Å; F549-I555 HydrophobicContact CE2-CD1 4.49Å; F549-I555 HydrophobicContact CG-CD1 3.93Å
550	R	86.4	Confident	86.6	Confident	167 Å²	167	77 Å²	77	63%	0.63	36%	0.362	S	S	*	.	H	α-helix	trans	-71.6	-40.7	175.4	-177.7	-179.5	174.5	-177	-2.4	111.5	L546 T547 E548 H552 K553	L546-R550 WeakPolarHBondContact O-CB 3.15Å; L546-R550 PolarHBondContact O-N 3.1Å; T547-R550 WeakPolarHBondContact O-CB 3.05Å; T547-R550 PolarHBondContact O-N 2.88Å; T547-R550 VanDerWaalsContact O-N 3.11Å; E548-R550 VanDerWaalsContact C-N 3.27Å; E548-R550 PolarHBondContact O-N 2.75Å; R550-H552 VanDerWaalsContact C-N 3.26Å; R550-H552 PolarHBondContact O-N 2.93Å; R550-K553 WeakPolarHBondContact O-CA 3.5Å; R550-K553 PolarHBondContact O-N 3.21Å
551	D	84.8	Confident	85.8	Confident	126 Å²	126	76.5 Å²	76.5	67%	0.674	38%	0.376	S	S	*	.	H	α-helix	trans	-63.2	-37.8	177.5	-67.6	-18.1	0	0	0	110.9	T547 E548 K553	T547-D551 VanDerWaalsContact O-CG 3.24Å; T547-D551 PolarHBondContact O-N 3.46Å; E548-D551 PolarHBondContact O-N 2.78Å; D551-K553 PolarHBondContact O-N 3.44Å
552	H	82.7	Confident	85	Confident	73 Å²	73	80 Å²	80	34%	0.338	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	2.8	171.3	-65.2	-56.5	0	0	0	114.6	V490 E548 R550 L554	V490-H552 HydrophobicContact CG1-CB 3.93Å; E548-H552 PolarHBondContact O-CD2 3.12Å; E548-H552 PolarHBondContact O-N 3.26Å; E548-H552 VanDerWaalsContact O-N 3.07Å; R550-H552 VanDerWaalsContact C-N 3.26Å; R550-H552 PolarHBondContact O-N 2.93Å; H552-L554 HydrophobicContact CB-CD1 4.26Å; H552-L554 HydrophobicContact CB-CG 3.9Å; H552-L554 PolarHBondContact O-N 3.21Å
553	K	81.6	Confident	84.2	Confident	139 Å²	139	82.7 Å²	82.7	60%	0.604	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	22.3	-178.7	-55.7	-179.3	179.2	-179	0	114.8	L482 F549 R550 D551	L482-K553 WeakPolarHBondContact CD1-O 3.5Å; F549-K553 PolarHBondContact O-N 3.02Å; R550-K553 WeakPolarHBondContact O-CA 3.5Å; R550-K553 PolarHBondContact O-N 3.21Å; D551-K553 PolarHBondContact O-N 3.44Å
554	L	83.7	Confident	83.7	Confident	0 Å²	0	80.6 Å²	80.6	0%	0	42%	0.419	C	S	.	.			trans	-73.3	-38.7	179	-59.5	-178	0	0	0	111.7	L482 L487 V490 L494 F502 F549 H552 V569 A570	L482-L554 HydrophobicContact CD1-CD2 3.77Å; L487-L554 HydrophobicContact CD1-CD2 3.46Å; L487-L554 VanDerWaalsContact CD1-CD2 3.46Å; V490-L554 HydrophobicContact CG1-CD1 4.05Å; V490-L554 HydrophobicContact CG1-CD2 4.5Å; L494-L554 HydrophobicContact CD1-CD1 4.26Å; F502-L554 HydrophobicContact CD2-CD1 4.49Å; F502-L554 HydrophobicContact CE2-CB 3.98Å; F502-L554 HydrophobicContact CE2-CD1 4.28Å; F549-L554 HydrophobicContact CB-CB 4.34Å; F549-L554 HydrophobicContact CD1-CD1 4.02Å; F549-L554 WeakPolarHBondContact O-CB 3.43Å; F549-L554 PolarHBondContact O-N 3.11Å; H552-L554 HydrophobicContact CB-CD1 4.26Å; H552-L554 HydrophobicContact CB-CG 3.9Å; H552-L554 PolarHBondContact O-N 3.21Å; L554-V569 WeakPolarHBondContact O-CG1 3.3Å; L554-A570 PolarHBondContact O-N 2.79Å
555	I	87.7	Confident	83.2	Confident	7 Å²	7	80.3 Å²	80.3	4%	0.036	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	141.8	-176.7	-60.8	175.1	0	0	0	109.9	L505 L546 F549 L567 I568	L505-I555 HydrophobicContact CD1-CD1 3.75Å; L546-I555 HydrophobicContact CD2-CD1 3.94Å; F549-I555 HydrophobicContact CB-CB 4.39Å; F549-I555 HydrophobicContact CB-CD1 3.65Å; F549-I555 HydrophobicContact CB-CG1 3.98Å; F549-I555 HydrophobicContact CD2-CD1 3.5Å; F549-I555 HydrophobicContact CE2-CD1 4.49Å; F549-I555 HydrophobicContact CG-CD1 3.93Å; I555-L567 HydrophobicContact CG2-CB 4.39Å; I555-L567 HydrophobicContact CG2-CD2 3.98Å; I555-I568 WeakPolarHBondContact CA-O 3.47Å
556	R	84.7	Confident	82.9	Confident	161 Å²	161	81.1 Å²	81.1	61%	0.608	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.8	165.3	-73.7	175	-171.6	-168.6	5.8	109.2	I568 A570	R556-I568 PolarHBondContact N-O 3.17Å; R556-I568 PolarHBondContact O-N 3.14Å; R556-A570 HydrophobicContact CG-CB 3.97Å
557	T	84.5	Confident	82.8	Confident	59 Å²	59	80.4 Å²	80.4	36%	0.362	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	123	170.4	-46.1	0	0	0	0	108.5	E565 Y566	T557-E565 HydrophobicContact CG2-CB 3.98Å; T557-E565 HydrophobicContact CG2-CG 4.35Å; T557-Y566 CarbonylContact C-O 3.58Å; T557-Y566 WeakPolarHBondContact CA-O 3Å
558	R	82.5	Confident	82.5	Confident	158 Å²	158	78.8 Å²	78.8	60%	0.596	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	128.5	168.9	-69.4	-165.5	-177.2	-144.6	3.1	108.8	Y566 I568	R558-Y566 PolarHBondContact N-O 3.37Å; R558-Y566 WeakPolarHBondContact O-CA 3.38Å; R558-Y566 WeakPolarHBondContact O-CB 3.07Å; R558-Y566 PolarHBondContact O-N 3.46Å; R558-I568 HydrophobicContact CB-CD1 4.46Å; R558-I568 HydrophobicContact CG-CD1 4.03Å
559	K	81	Confident	82.3	Confident	153 Å²	153	76.2 Å²	76.2	67%	0.665	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	123.7	171	-63.5	-169.1	174	-169.4	0	108.1	E565	K559-E565 VanDerWaalsContact CE-OE1 3.25Å; K559-E565 WeakPolarHBondContact CE-OE1 3.29Å; K559-E565 HydrophobicContact CG-CG 4.3Å; K559-E565 IonicContact NZ-OE1 2.85Å
560	G	75.8	Confident	81.6	Confident	23 Å²	23	77.3 Å²	77.3	24%	0.237	40%	0.396	C	S	.	.			trans	-71.2	168.4	174	0	0	0	0	0	111.9	D562 G563 V564	G560-D562 PolarHBondContact O-N 3.15Å; G560-G563 PolarHBondContact O-N 3.25Å; G560-V564 PolarHBondContact N-O 3.41Å
561	A	72.5	Confident	81.2	Confident	112 Å²	112	69.7 Å²	69.7	93%	0.926	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.4	173.7	0	0	0	0	0	112.3	G563	A561-G563 PolarHBondContact O-N 2.79Å
562	D	74.4	Confident	80.9	Confident	135 Å²	135	69.3 Å²	69.3	72%	0.722	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	2.9	177.8	-53.6	-31.7	0	0	0	113.3	G560 V564	G560-D562 PolarHBondContact O-N 3.15Å; D562-V564 HydrophobicContact CB-CG2 4.37Å; D562-V564 PolarHBondContact O-N 3.39Å
563	G	74.9	Confident	80.8	Confident	56 Å²	56	68.7 Å²	68.7	58%	0.577	36%	0.364	S	S	*	.	S	Bend	trans	77.4	-3.2	-177.3	0	0	0	0	0	114.9	G560 A561	G560-G563 PolarHBondContact O-N 3.25Å; A561-G563 PolarHBondContact O-N 2.79Å
564	V	79.9	Confident	80.7	Confident	62 Å²	62	67 Å²	67	38%	0.376	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-73.1	136	177	-178	0	0	0	0	110.7	G560 D562 Y566	G560-V564 PolarHBondContact N-O 3.41Å; D562-V564 HydrophobicContact CB-CG2 4.37Å; D562-V564 PolarHBondContact O-N 3.39Å; V564-Y566 HydrophobicContact CB-CE2 4.32Å
565	E	80.8	Confident	80.4	Confident	64 Å²	64	68.2 Å²	68.2	30%	0.299	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	117.9	176.1	-61.7	-170.9	155.8	0	0	110.7	F523 T557 K559	F523-E565 PolarHBondContact N-O 3.26Å; T557-E565 HydrophobicContact CG2-CB 3.98Å; T557-E565 HydrophobicContact CG2-CG 4.35Å; K559-E565 VanDerWaalsContact CE-OE1 3.25Å; K559-E565 WeakPolarHBondContact CE-OE1 3.29Å; K559-E565 HydrophobicContact CG-CG 4.3Å; K559-E565 IonicContact NZ-OE1 2.85Å
566	Y	84.6	Confident	80.1	Confident	54 Å²	54	67.9 Å²	67.9	21%	0.212	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	130.6	174.1	-66.7	-74.8	0	0	0	111.1	S519 G520 L521 T557 R558 V564	S519-Y566 WeakPolarHBondContact O-CB 2.67Å; G520-Y566 VanDerWaalsContact O-CD1 3.25Å; G520-Y566 WeakPolarHBondContact O-CD1 3.46Å; L521-Y566 CarbonylContact O-C 3.53Å; L521-Y566 VanDerWaalsContact O-CA 3.31Å; L521-Y566 WeakPolarHBondContact O-CA 3.38Å; T557-Y566 CarbonylContact C-O 3.58Å; T557-Y566 WeakPolarHBondContact CA-O 3Å; R558-Y566 PolarHBondContact N-O 3.37Å; R558-Y566 WeakPolarHBondContact O-CA 3.38Å; R558-Y566 WeakPolarHBondContact O-CB 3.07Å; R558-Y566 PolarHBondContact O-N 3.46Å; V564-Y566 HydrophobicContact CB-CE2 4.32Å
567	L	85.9	Confident	79.9	Confident	5 Å²	5	63.3 Å²	63.3	3%	0.026	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	127	177.7	-61.5	164.1	0	0	0	109.7	L505 L521 F526 L546 I555	L505-L567 HydrophobicContact CD1-CB 4.17Å; L505-L567 HydrophobicContact CD1-CD1 4.44Å; L521-L567 HydrophobicContact CB-CB 4.34Å; L521-L567 PolarHBondContact N-O 3.43Å; L521-L567 VanDerWaalsContact N-O 3.13Å; L521-L567 PolarHBondContact O-N 3.04Å; F526-L567 HydrophobicContact CB-CD1 4.25Å; F526-L567 HydrophobicContact CD1-CD1 3.67Å; F526-L567 HydrophobicContact CE1-CD1 4.31Å; F526-L567 HydrophobicContact CG-CD1 4.13Å; L546-L567 HydrophobicContact CD1-CD1 4.03Å; L546-L567 HydrophobicContact CD1-CD2 4.09Å; L546-L567 HydrophobicContact CD2-CD1 4.13Å; L546-L567 HydrophobicContact CD2-CD2 4.07Å; I555-L567 HydrophobicContact CG2-CB 4.39Å; I555-L567 HydrophobicContact CG2-CD2 3.98Å
568	I	85	Confident	79.6	Confident	41 Å²	41	63.2 Å²	63.2	21%	0.21	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	133.3	179	-53.4	174.1	0	0	0	108.8	S519 I555 R556 R558	S519-I568 WeakPolarHBondContact O-CD1 3.42Å; I555-I568 WeakPolarHBondContact CA-O 3.47Å; R556-I568 PolarHBondContact N-O 3.17Å; R556-I568 PolarHBondContact O-N 3.14Å; R558-I568 HydrophobicContact CB-CD1 4.46Å; R558-I568 HydrophobicContact CG-CD1 4.03Å
569	V	85.1	Confident	79.5	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.03	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	131.8	170.8	-171.1	0	0	0	0	109.4	F502 L505 V506 L554 V571 L576	F502-V569 HydrophobicContact CE2-CG1 4.29Å; F502-V569 HydrophobicContact CE2-CG2 4.43Å; F502-V569 HydrophobicContact CZ-CG1 4.07Å; L505-V569 HydrophobicContact CD2-CB 4.42Å; L505-V569 HydrophobicContact CD2-CG2 3.06Å; V506-V569 HydrophobicContact CG2-CG2 4.22Å; L554-V569 WeakPolarHBondContact O-CG1 3.3Å; V569-V571 HydrophobicContact CG1-CB 3.75Å; V569-V571 HydrophobicContact CG1-CG2 3.76Å; V569-V571 PolarHBondContact O-N 3.06Å; V569-V571 VanDerWaalsContact O-N 3.11Å; V569-L576 HydrophobicContact CB-CD1 4.27Å; V569-L576 HydrophobicContact CG1-CD1 4.24Å; V569-L576 HydrophobicContact CG1-CD2 4.16Å
570	A	75.6	Confident	79.5	Confident	23 Å²	23	50.1 Å²	50.1	19%	0.19	30%	0.3	C	S	.	.	S	Bend	trans	-79.6	19.1	-178.7	0	0	0	0	0	114.1	L554 R556	L554-A570 PolarHBondContact O-N 2.79Å; R556-A570 HydrophobicContact CG-CB 3.97Å
571	V	77.9	Confident	79.5	Confident	8 Å²	8	53.1 Å²	53.1	5%	0.048	31%	0.308	C	S	.	.	S	Bend	trans	-118	146.3	-169.6	-178.9	0	0	0	0	109.5	L482 L487 V569 T575 L576	L482-V571 HydrophobicContact CB-CG2 4.23Å; L482-V571 HydrophobicContact CD1-CG2 4.06Å; L487-V571 HydrophobicContact CD2-CG1 4.35Å; V569-V571 HydrophobicContact CG1-CB 3.75Å; V569-V571 HydrophobicContact CG1-CG2 3.76Å; V569-V571 PolarHBondContact O-N 3.06Å; V569-V571 VanDerWaalsContact O-N 3.11Å; V571-T575 WeakPolarHBondContact CG1-OG1 3.34Å; V571-L576 HydrophobicContact CB-CD2 4.07Å; V571-L576 HydrophobicContact CB-CG 4.21Å; V571-L576 HydrophobicContact CG1-CD2 3.98Å; V571-L576 HydrophobicContact CG1-CG 4.05Å
572	E	78.3	Confident	79.6	Confident	118 Å²	118	51 Å²	51	55%	0.551	28%	0.281	S	S	*	.			trans	-63.5	149.4	-179.6	-69.8	-178	-177.1	0	0	112.3	A481 N574 T575 L576	A481-E572 HydrophobicContact CB-CG 4.35Å; E572-N574 VanDerWaalsContact C-N 3.33Å; E572-N574 PolarHBondContact O-N 2.8Å; E572-T575 WeakPolarHBondContact CB-OG1 3.4Å; E572-T575 PolarHBondContact N-OG1 2.77Å; E572-T575 PolarHBondContact O-N 3.02Å; E572-T575 PolarHBondContact O-OG1 3.07Å; E572-L576 WeakPolarHBondContact O-CG 3.36Å; E572-L576 PolarHBondContact O-N 3.48Å; E572-L576 VanDerWaalsContact O-N 3.09Å
573	T	79.8	Confident	79.3	Confident	60 Å²	60	45.6 Å²	45.6	37%	0.368	25%	0.252	S	S	.	.	H	α-helix	trans	-62.5	-39.2	-175.1	51.8	0	0	0	0	112.8	K513 L576 I577	K513-T573 HydrophobicContact CD-CG2 3.57Å; K513-T573 VanDerWaalsContact CE-CB 3.4Å; K513-T573 HydrophobicContact CG-CG2 4.05Å; K513-T573 VanDerWaalsContact NZ-C 3.32Å; K513-T573 VanDerWaalsContact NZ-CB 3.26Å; K513-T573 PolarHBondContact NZ-O 3.08Å; T573-L576 PolarHBondContact O-N 3.39Å; T573-I577 WeakPolarHBondContact O-CG1 3.39Å; T573-I577 PolarHBondContact O-N 2.94Å
574	N	79.3	Confident	78.6	Confident	103 Å²	103	48 Å²	48	55%	0.551	25%	0.251	S	S	*	.	H	α-helix	trans	-69.4	-45	-178.1	-62.8	-10.6	0	0	0	110.8	E572 L576 I577 D578	E572-N574 VanDerWaalsContact C-N 3.33Å; E572-N574 PolarHBondContact O-N 2.8Å; N574-L576 PolarHBondContact O-N 3.36Å; N574-I577 WeakPolarHBondContact O-CA 3.38Å; N574-I577 WeakPolarHBondContact O-CB 3.43Å; N574-I577 PolarHBondContact O-N 2.97Å; N574-D578 PolarHBondContact O-N 3.01Å
575	T	77.7	Confident	77.2	Confident	26 Å²	26	49.7 Å²	49.7	16%	0.16	26%	0.258	C	S	.	.	H	α-helix	trans	-60.6	-31.9	174.7	52.2	0	0	0	0	112.7	L484 V571 E572 I577 F579	L484-T575 HydrophobicContact CD1-CG2 4.03Å; L484-T575 VanDerWaalsContact CD2-CB 3.48Å; L484-T575 HydrophobicContact CD2-CG2 4.05Å; L484-T575 WeakPolarHBondContact CD2-O 3.43Å; L484-T575 HydrophobicContact CG-CG2 3.76Å; V571-T575 WeakPolarHBondContact CG1-OG1 3.34Å; E572-T575 WeakPolarHBondContact CB-OG1 3.4Å; E572-T575 PolarHBondContact N-OG1 2.77Å; E572-T575 PolarHBondContact O-N 3.02Å; E572-T575 PolarHBondContact O-OG1 3.07Å; T575-I577 VanDerWaalsContact C-N 3.34Å; T575-F579 VanDerWaalsContact O-CB 3.23Å; T575-F579 WeakPolarHBondContact O-CB 3.25Å; T575-F579 PolarHBondContact O-N 3.22Å
576	L	80.9	Confident	75.3	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-69.9	-29.9	173.8	-71	176.8	0	0	0	113.5	L487 V506 V569 V571 E572 T573 N574 L580	L487-L576 HydrophobicContact CD2-CD2 4.39Å; V506-L576 HydrophobicContact CG1-CB 4.08Å; V506-L576 HydrophobicContact CG1-CD1 4.46Å; V506-L576 HydrophobicContact CG1-CD2 4.04Å; V506-L576 HydrophobicContact CG1-CG 4.42Å; V506-L576 HydrophobicContact CG2-CD2 3.89Å; V569-L576 HydrophobicContact CB-CD1 4.27Å; V569-L576 HydrophobicContact CG1-CD1 4.24Å; V569-L576 HydrophobicContact CG1-CD2 4.16Å; V571-L576 HydrophobicContact CB-CD2 4.07Å; V571-L576 HydrophobicContact CB-CG 4.21Å; V571-L576 HydrophobicContact CG1-CD2 3.98Å; V571-L576 HydrophobicContact CG1-CG 4.05Å; E572-L576 WeakPolarHBondContact O-CG 3.36Å; E572-L576 PolarHBondContact O-N 3.48Å; E572-L576 VanDerWaalsContact O-N 3.09Å; T573-L576 PolarHBondContact O-N 3.39Å; N574-L576 PolarHBondContact O-N 3.36Å; L576-L580 PolarHBondContact O-N 3.48Å
577	I	81.3	Confident	74.9	Confident	65 Å²	65	54.6 Å²	54.6	33%	0.333	29%	0.29	S	S	.	.	H	α-helix	trans	-70	-51.8	174.6	-63.4	166.7	0	0	0	108.8	L510 T573 N574 T575 F579 L580 E581	L510-I577 HydrophobicContact CD2-CD1 4.21Å; L510-I577 HydrophobicContact CD2-CG1 3.47Å; L510-I577 VanDerWaalsContact CD2-CG1 3.47Å; T573-I577 WeakPolarHBondContact O-CG1 3.39Å; T573-I577 PolarHBondContact O-N 2.94Å; N574-I577 WeakPolarHBondContact O-CA 3.38Å; N574-I577 WeakPolarHBondContact O-CB 3.43Å; N574-I577 PolarHBondContact O-N 2.97Å; T575-I577 VanDerWaalsContact C-N 3.34Å; I577-F579 PolarHBondContact O-N 3.32Å; I577-L580 PolarHBondContact O-N 3.07Å; I577-E581 PolarHBondContact O-N 3.46Å
578	D	77.7	Confident	74.3	Confident	57 Å²	57	57.2 Å²	57.2	31%	0.305	30%	0.304	S	S	.	.	H	α-helix	trans	-57.9	-39.5	178.8	-61.8	-24.4	0	0	0	111.5	L484 N574 N582	L484-D578 HydrophobicContact CD1-CB 4.17Å; L484-D578 HydrophobicContact CD2-CB 4.46Å; N574-D578 PolarHBondContact O-N 3.01Å; D578-N582 WeakPolarHBondContact O-CB 3.3Å; D578-N582 PolarHBondContact O-N 3.42Å; D578-N582 PolarHBondContact O-ND2 3.3Å
579	F	80.3	Confident	73.7	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.009	31%	0.309	C	S	.	.	H	α-helix	trans	-61.9	-45.1	175.3	172.4	-100	0	0	0	112.5	L484 L487 T488 L491 F502 T575 I577 N582 E583	L484-F579 HydrophobicContact CD2-CB 4.3Å; L487-F579 HydrophobicContact CD2-CB 4.37Å; L487-F579 HydrophobicContact CD2-CD2 4.18Å; L487-F579 HydrophobicContact CD2-CG 4.11Å; L487-F579 HydrophobicContact CG-CD2 4.42Å; T488-F579 HydrophobicContact CG2-CD2 3.78Å; T488-F579 HydrophobicContact CG2-CE2 3.98Å; L491-F579 HydrophobicContact CB-CZ 4.4Å; L491-F579 HydrophobicContact CD1-CD2 4.29Å; L491-F579 HydrophobicContact CD1-CE1 3.8Å; L491-F579 HydrophobicContact CD1-CE2 3.42Å; L491-F579 VanDerWaalsContact CD1-CE2 3.42Å; L491-F579 HydrophobicContact CD1-CZ 3.13Å; L491-F579 HydrophobicContact CG-CZ 4.31Å; F502-F579 HydrophobicContact CE1-CE1 4.41Å; T575-F579 VanDerWaalsContact O-CB 3.23Å; T575-F579 WeakPolarHBondContact O-CB 3.25Å; T575-F579 PolarHBondContact O-N 3.22Å; I577-F579 PolarHBondContact O-N 3.32Å; F579-N582 PolarHBondContact O-N 3.28Å; F579-E583 HydrophobicContact CD2-CG 4.49Å; F579-E583 HydrophobicContact CE1-CG 4.34Å; F579-E583 HydrophobicContact CE2-CG 3.7Å; F579-E583 HydrophobicContact CZ-CB 4.43Å; F579-E583 HydrophobicContact CZ-CG 3.6Å; F579-E583 WeakPolarHBondContact CZ-OE1 3.28Å; F579-E583 WeakPolarHBondContact CZ-OE2 3.21Å; F579-E583 PolarHBondContact O-N 2.9Å
580	L	81.3	Confident	73	Confident	33 Å²	33	61.2 Å²	61.2	17%	0.173	33%	0.325	C	S	.	.	H	α-helix	trans	-65.8	-42.4	-179.7	-170.8	70.6	0	0	0	111.1	L510 L576 I577 N582 E583 D584	L510-L580 HydrophobicContact CD1-CD2 4.08Å; L576-L580 PolarHBondContact O-N 3.48Å; I577-L580 PolarHBondContact O-N 3.07Å; L580-N582 PolarHBondContact O-N 3.12Å; L580-E583 PolarHBondContact O-N 2.75Å; L580-D584 PolarHBondContact O-N 3.4Å; L580-D584 VanDerWaalsContact O-N 3.14Å
581	E	76.7	Confident	72.9	Confident	87 Å²	87	63.6 Å²	63.6	41%	0.407	33%	0.334	S	S	.	.	H	α-helix	trans	-60	-44.6	175.3	-69.9	-169.4	-176.5	0	0	111.7	K359 I577 D584 D585	K359-E581 IonicContact NZ-OE2 3Å; K359-E581 PolarHBondContact NZ-OE2 2.93Å; I577-E581 PolarHBondContact O-N 3.46Å; E581-D584 PolarHBondContact O-N 3.24Å; E581-D585 PolarHBondContact O-N 2.97Å
582	N	73.3	Confident	72.5	Confident	66 Å²	66	67.3 Å²	67.3	35%	0.353	35%	0.353	S	S	.	.	H	α-helix	trans	-70.1	-32.9	-178.5	-70.6	-37.9	0	0	0	113.4	D578 F579 L580 D585	D578-N582 WeakPolarHBondContact O-CB 3.3Å; D578-N582 PolarHBondContact O-N 3.42Å; D578-N582 PolarHBondContact O-ND2 3.3Å; F579-N582 PolarHBondContact O-N 3.28Å; L580-N582 PolarHBondContact O-N 3.12Å; N582-D585 PolarHBondContact O-N 3.26Å
583	E	69.9	Low	72.1	Confident	23 Å²	23	63.6 Å²	63.6	11%	0.107	34%	0.338	C	S	.	.	H	α-helix	trans	-82.3	-17.3	178.1	-92.7	-152	159.3	0	0	114.3	K503 F579 L580	K503-E583 WeakPolarHBondContact CE-OE2 3.5Å; K503-E583 IonicContact NZ-OE2 3.36Å; K503-E583 PolarHBondContact NZ-OE2 2.81Å; F579-E583 HydrophobicContact CD2-CG 4.49Å; F579-E583 HydrophobicContact CE1-CG 4.34Å; F579-E583 HydrophobicContact CE2-CG 3.7Å; F579-E583 HydrophobicContact CZ-CB 4.43Å; F579-E583 HydrophobicContact CZ-CG 3.6Å; F579-E583 WeakPolarHBondContact CZ-OE1 3.28Å; F579-E583 WeakPolarHBondContact CZ-OE2 3.21Å; F579-E583 PolarHBondContact O-N 2.9Å; L580-E583 PolarHBondContact O-N 2.75Å
584	D	60.4	Low	71.5	Confident	107 Å²	107	63.9 Å²	63.9	57%	0.572	34%	0.336	S	S	*	.	H	α-helix	trans	-81.7	-12.3	170.6	-69.4	-21.7	0	0	0	111.1	K503 L580 E581	K503-D584 IonicContact NZ-OD1 3.37Å; L580-D584 PolarHBondContact O-N 3.4Å; L580-D584 VanDerWaalsContact O-N 3.14Å; E581-D584 PolarHBondContact O-N 3.24Å
585	D	50.4	Low	70.9	Confident	96 Å²	96	60.7 Å²	60.7	51%	0.513	32%	0.318	S	S	.	.			trans	-91.6	-17.8	178.2	-96	-33.9	0	0	0	114.8	K414 E581 N582	K414-D585 PolarHBondContact NZ-O 3.24Å; K414-D585 VanDerWaalsContact NZ-O 3.17Å; K414-D585 IonicContact NZ-OD1 3.56Å; K414-D585 PolarHBondContact NZ-OD1 3.09Å; E581-D585 PolarHBondContact O-N 2.97Å; N582-D585 PolarHBondContact O-N 3.26Å
586	D	40.7	Very low	70.3	Confident	166 Å²	166	63.8 Å²	63.8	89%	0.888	33%	0.333	S	S	*	.			trans	-94	0	173.6	-88.5	-10.8	0	0	0	110.5	R492	R492-D586 IonicContact NH2-OD2 3.96Å; R492-D586 PolarHBondContact NH2-OD2 2.65Å

Retrieved 586 of 586 residues in 460.6 ms (Link to these results)

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