A0A087XTW8_POEFO Loading...

A kinase (PRKA) anchor protein 8-like

AlphaFold DB , UniProt , Accession A0A087XTW8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 699 aa.

Structure Viewer

Loading PAE data...

(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	33.2	Very low	31.5	Very low	238 Å²	238	157.8 Å²	157.8	100%	1.172	86%	0.857	S	S	*	*				0	132.8	0	-80.1	163.7	163.2	0	0	108
2	D	33.3	Very low	31	Very low	141 Å²	141	153.8 Å²	153.8	75%	0.754	85%	0.849	S	S	*	*			trans	-34.8	136.4	-176.5	-49.4	-90.5	0	0	0	116.7
3	N	32.8	Very low	31	Very low	159 Å²	159	160.7 Å²	160.7	85%	0.85	86%	0.855	S	S	*	*				-168.7	141.2	93.4	-99.5	-67.2	0	0	0	113.8
4	R	37.9	Very low	30.6	Very low	249 Å²	249	154.6 Å²	154.6	94%	0.94	85%	0.849	S	S	*	*			trans	-94.2	142.3	165	-69	174.3	175.9	160.6	-2	108.6
5	G	28.5	Very low	30.4	Very low	81 Å²	81	149.8 Å²	149.8	84%	0.835	85%	0.849	S	S	*	*			trans	-148.5	66.5	178.2	0	0	0	0	0	113.2
6	Y	33.8	Very low	30.2	Very low	243 Å²	243	145.7 Å²	145.7	95%	0.953	85%	0.85	S	S	*	*			trans	-96.4	125.3	171.7	-112.1	-86.4	0	0	0	110.7
7	S	28.5	Very low	30	Very low	113 Å²	113	144.4 Å²	144.4	79%	0.79	85%	0.851	S	S	*	*			trans	-146.5	99.5	168.9	-163.9	0	0	0	0	106.9
8	S	32.3	Very low	30.3	Very low	115 Å²	115	142.9 Å²	142.9	80%	0.804	85%	0.849	S	S	*	*				75.7	110.4	94.5	175.2	0	0	0	0	114.2
9	G	28.3	Very low	30.2	Very low	71 Å²	71	139.2 Å²	139.2	73%	0.732	84%	0.844	S	S	*	*			trans	166.4	105.3	159	0	0	0	0	0	119
10	Y	27.4	Very low	30.3	Very low	224 Å²	224	140.6 Å²	140.6	88%	0.878	85%	0.846	S	S	*	*			trans	75.8	90.3	135.6	-110.6	-94.7	0	0	0	123.5
11	S	30.4	Very low	30.7	Very low	102 Å²	102	145.8 Å²	145.8	71%	0.713	85%	0.851	S	S	*	*				27.4	146.3	117.6	-52.3	0	0	0	0	124.5
12	S	25.1	Very low	30.4	Very low	109 Å²	109	138 Å²	138	76%	0.762	83%	0.832	S	S	*	*			trans	85	143.6	163.2	-152.6	0	0	0	0	113.2
13	W	30.9	Very low	30.4	Very low	244 Å²	244	137.9 Å²	137.9	92%	0.924	84%	0.842	S	S	*	*			cis	-119.3	174.3	21.2	-60.9	12.7	0	0	0	110.4
14	G	26.1	Very low	30.4	Very low	75 Å²	75	134.1 Å²	134.1	77%	0.773	84%	0.841	S	S	*	*			cis	112.1	81.5	12.1	0	0	0	0	0	111.6
15	G	27.1	Very low	30.1	Very low	83 Å²	83	126.1 Å²	126.1	86%	0.856	84%	0.836	S	S	*	*			trans	178.2	122.6	176.3	0	0	0	0	0	112.3
16	G	27.8	Very low	30.1	Very low	84 Å²	84	131 Å²	131	87%	0.866	84%	0.835	S	S	*	*			trans	-104.5	156.7	177.2	0	0	0	0	0	112
17	S	27.2	Very low	30.1	Very low	123 Å²	123	127.5 Å²	127.5	86%	0.86	83%	0.832	S	S	*	*			trans	-147	141.1	160.6	-164.9	0	0	0	0	111.7
18	S	33.9	Very low	30.2	Very low	118 Å²	118	129.3 Å²	129.3	83%	0.825	83%	0.83	S	S	*	*			trans	-85.6	131.6	178.2	51.7	0	0	0	0	111.2
19	G	30	Very low	30.2	Very low	73 Å²	73	135.4 Å²	135.4	75%	0.753	84%	0.837	S	S	*	*			trans	-146.8	105.3	175.3	0	0	0	0	0	113.1	R21	G19-R21 PolarHBondContact O-N 3.39Å
20	N	32.5	Very low	30.3	Very low	166 Å²	166	134.9 Å²	134.9	89%	0.888	83%	0.832	S	S	*	*			trans	-68.8	122.9	166.1	-87.5	7.3	0	0	0	110.4
21	R	36.8	Very low	30.5	Very low	251 Å²	251	128.4 Å²	128.4	95%	0.947	83%	0.833	S	S	*	*			trans	-162.7	146.2	149.7	-86.3	128.6	-166.8	-118.8	9.4	104.8	G19	G19-R21 PolarHBondContact O-N 3.39Å
22	G	28.5	Very low	30.4	Very low	74 Å²	74	127.3 Å²	127.3	76%	0.763	84%	0.838	S	S	*	*			cis	145.1	121.3	14.9	0	0	0	0	0	105.3
23	S	33.8	Very low	30.8	Very low	138 Å²	138	127.6 Å²	127.6	97%	0.965	85%	0.847	S	S	*	*			trans	-73	137.6	-160	-47.8	0	0	0	0	114.9
24	G	32.7	Very low	30.8	Very low	81 Å²	81	119.7 Å²	119.7	84%	0.835	84%	0.841	S	S	*	*			trans	177.8	134.7	163.8	0	0	0	0	0	108.1
25	G	31.6	Very low	31	Very low	81 Å²	81	120 Å²	120	84%	0.835	85%	0.845	S	S	*	*			cis	117.4	57.4	12	0	0	0	0	0	110.1
26	F	28	Very low	31.1	Very low	184 Å²	184	121.7 Å²	121.7	81%	0.807	84%	0.843	S	S	*	*			trans	-130.2	99.1	-177.7	-162.3	-92	0	0	0	110.2	M28	F26-M28 HydrophobicContact CE1-CB 4.12Å; F26-M28 HydrophobicContact CZ-CB 4.3Å
27	D	32.7	Very low	31.3	Very low	168 Å²	168	127.5 Å²	127.5	90%	0.898	84%	0.84	S	S	*	*			trans	-104.7	115	160.2	-73.9	-64.2	0	0	0	106.9
28	M	30.8	Very low	31.6	Very low	151 Å²	151	130.4 Å²	130.4	74%	0.744	84%	0.837	S	S	*	*			trans	-146.6	113.8	152.9	-156.1	179.4	174.3	0	0	111.8	F26	F26-M28 HydrophobicContact CE1-CB 4.12Å; F26-M28 HydrophobicContact CZ-CB 4.3Å
29	Y	32.9	Very low	31.4	Very low	244 Å²	244	131.7 Å²	131.7	96%	0.957	84%	0.835	S	S	*	*			trans	-129.3	129.2	167.1	-145.3	-88	0	0	0	105.4
30	G	30.3	Very low	31.6	Very low	60 Å²	60	133.7 Å²	133.7	62%	0.619	84%	0.838	S	S	*	*			trans	156.9	73.7	-179.9	0	0	0	0	0	115.1
31	G	31	Very low	31.4	Very low	87 Å²	87	129.4 Å²	129.4	90%	0.897	83%	0.832	S	S	*	*			trans	-70.5	153.7	160.5	0	0	0	0	0	111.4
32	G	29.4	Very low	31.2	Very low	79 Å²	79	122.5 Å²	122.5	81%	0.814	83%	0.829	S	S	*	*			trans	-173	96.9	-179.6	0	0	0	0	0	112.2
33	A	32.5	Very low	31.2	Very low	116 Å²	116	122.8 Å²	122.8	96%	0.959	83%	0.832	S	S	*	*			trans	-53.9	149.7	-174.5	0	0	0	0	0	115.6
34	G	30.9	Very low	31.1	Very low	77 Å²	77	119.1 Å²	119.1	79%	0.794	82%	0.816	S	S	*	*			trans	-157.3	102.3	168.9	0	0	0	0	0	110.6
35	G	30.8	Very low	31.1	Very low	83 Å²	83	126.3 Å²	126.3	86%	0.856	82%	0.82	S	S	*	*			trans	-67.1	148.3	-170.9	0	0	0	0	0	114.7
36	S	28.6	Very low	31.1	Very low	117 Å²	117	125.9 Å²	125.9	82%	0.818	82%	0.815	S	S	*	*			trans	-77.9	127	177.4	-167.5	0	0	0	0	111.1
37	Y	33.6	Very low	31.3	Very low	206 Å²	206	121.3 Å²	121.3	81%	0.808	82%	0.82	S	S	*	*			trans	-124.2	116.9	160	-156.8	-89.7	0	0	0	108.5
38	K	31.7	Very low	31.2	Very low	185 Å²	185	117.1 Å²	117.1	80%	0.804	82%	0.816	S	S	*	*			trans	-74.1	130.6	174.5	-68.1	176.8	177.8	175.2	0	108.4
39	D	31.2	Very low	31.1	Very low	144 Å²	144	114.1 Å²	114.1	77%	0.77	82%	0.824	S	S	*	*			trans	-143.5	154.4	149.3	-127.3	-43.2	0	0	0	112.3
40	S	32.9	Very low	31.1	Very low	116 Å²	116	106.3 Å²	106.3	81%	0.811	82%	0.818	S	S	*	*			trans	-101.9	156.1	-161.4	-56.6	0	0	0	0	112.6
41	G	29.2	Very low	31.1	Very low	75 Å²	75	107.7 Å²	107.7	77%	0.773	83%	0.832	S	S	*	*			trans	128	104.4	152.3	0	0	0	0	0	117.5
42	A	31.9	Very low	31.2	Very low	106 Å²	106	107.6 Å²	107.6	88%	0.876	83%	0.831	S	S	*	*			trans	12.2	111.2	140.9	0	0	0	0	0	120.1
43	G	29.9	Very low	31.4	Very low	81 Å²	81	108 Å²	108	84%	0.835	84%	0.835	S	S	*	*				78	117.3	103	0	0	0	0	0	120.9
44	G	29.9	Very low	31.6	Very low	61 Å²	61	110.7 Å²	110.7	63%	0.629	83%	0.827	S	S	*	*			trans	114	130.2	134.6	0	0	0	0	0	117.9
45	Y	33.9	Very low	32	Very low	232 Å²	232	114.4 Å²	114.4	91%	0.91	83%	0.826	S	S	*	*			trans	41.8	148	152.4	78.8	-84.6	0	0	0	120.2
46	G	31.1	Very low	32.2	Very low	71 Å²	71	120.3 Å²	120.3	73%	0.732	83%	0.828	S	S	*	*			cis	141.8	122.6	6.9	0	0	0	0	0	110.2
47	G	32.2	Very low	32.6	Very low	88 Å²	88	127 Å²	127	91%	0.907	84%	0.836	S	S	*	*			trans	91.6	154.2	-179.6	0	0	0	0	0	114.6
48	G	31	Very low	32.7	Very low	80 Å²	80	120.3 Å²	120.3	83%	0.825	83%	0.83	S	S	*	*			cis	166.7	150.3	-5.5	0	0	0	0	0	112.7
49	G	29.3	Very low	33.5	Very low	89 Å²	89	117.5 Å²	117.5	92%	0.918	83%	0.83	S	S	*	*			trans	87.3	152.4	174.3	0	0	0	0	0	115.7
50	G	32	Very low	33.9	Very low	79 Å²	79	116.8 Å²	116.8	81%	0.814	84%	0.836	S	S	*	*			cis	168.8	149.4	-7.1	0	0	0	0	0	113.3
51	G	31.3	Very low	33.9	Very low	89 Å²	89	115.5 Å²	115.5	92%	0.918	84%	0.841	S	S	*	*			trans	79.7	148.4	172.1	0	0	0	0	0	116
52	G	32.9	Very low	34.1	Very low	86 Å²	86	115.3 Å²	115.3	89%	0.887	84%	0.84	S	S	*	*			cis	147	109.8	-3.7	0	0	0	0	0	112.1
53	G	32.3	Very low	34.2	Very low	87 Å²	87	115.5 Å²	115.5	90%	0.897	83%	0.834	S	S	*	*			trans	-170.5	134.3	177.8	0	0	0	0	0	112.2
54	H	36.6	Very low	34.8	Very low	172 Å²	172	120.6 Å²	120.6	80%	0.796	84%	0.839	S	S	*	*			trans	-133.9	153.9	-159.5	-164.1	-38.6	0	0	0	112.7
55	M	39.1	Very low	35.5	Very low	156 Å²	156	124.7 Å²	124.7	77%	0.768	85%	0.845	S	S	*	*			trans	90.3	140.4	164.6	-48.9	-174.5	179.3	0	0	115.1
56	K	36.4	Very low	35.6	Very low	207 Å²	207	118.9 Å²	118.9	90%	0.9	84%	0.839	S	S	*	*			cis	-134.9	166.8	21.3	-68.5	177.1	177.5	-177.5	0	113.1
57	R	36.4	Very low	36.5	Very low	257 Å²	257	122 Å²	122	97%	0.97	85%	0.849	S	S	*	*			trans	-131.2	140.3	179.5	-176.7	-170.6	-77.3	-129.2	2.8	110.6
58	G	35.5	Very low	37.4	Very low	66 Å²	66	122.3 Å²	122.3	68%	0.68	84%	0.838	S	S	*	*			trans	177.8	152	174.8	0	0	0	0	0	111.7
59	P	47.6	Very low	38.4	Very low	125 Å²	125	121.3 Å²	121.3	81%	0.812	83%	0.828	S	S	*	*				-121.7	178.6	-103.1	40.2	-34.2	0	0	0	116.8
60	S	40.1	Very low	40	Very low	129 Å²	129	121.4 Å²	121.4	90%	0.902	81%	0.81	S	S	*	*			trans	76	129.6	-175.4	75.5	0	0	0	0	115.2
61	G	33.8	Very low	41.3	Very low	89 Å²	89	125.1 Å²	125.1	92%	0.918	81%	0.806	S	S	*	*			cis	176.1	66.7	-3.2	0	0	0	0	0	113.1
62	G	33.6	Very low	42.9	Very low	72 Å²	72	123.2 Å²	123.2	74%	0.742	78%	0.781	S	S	*	*			trans	-146.6	141.5	177.4	0	0	0	0	0	110.9	M64	G62-M64 PolarHBondContact O-N 3.12Å
63	S	33.4	Very low	45.3	Very low	109 Å²	109	123.6 Å²	123.6	76%	0.762	76%	0.763	S	S	*	*			trans	-65.6	129.3	-165.4	-164.8	0	0	0	0	113.7
64	M	43.1	Very low	47.5	Very low	188 Å²	188	122.5 Å²	122.5	93%	0.926	75%	0.745	S	S	*	*			trans	-101.2	101.2	162.9	-74.8	-168.2	-176.1	0	0	109.6	G62	G62-M64 PolarHBondContact O-N 3.12Å
65	L	43.8	Very low	49.6	Very low	147 Å²	147	117.2 Å²	117.2	77%	0.77	73%	0.725	S	S	*	*			trans	-134.7	145.2	163.1	-67.1	172.4	0	0	0	107.5
66	S	36.5	Very low	51.7	Low	111 Å²	111	113.9 Å²	113.9	78%	0.776	71%	0.71	S	S	*	*			trans	72.7	62.3	178.7	-51.1	0	0	0	0	117.2	S68	S66-S68 VanDerWaalsContact C-N 3.26Å; S66-S68 PolarHBondContact O-N 2.66Å
67	S	49	Very low	54	Low	136 Å²	136	106.8 Å²	106.8	95%	0.951	69%	0.69	S	S	*	*			trans	-82.5	72.5	156.3	-179.4	0	0	0	0	110.7
68	S	51.4	Low	56.4	Low	95 Å²	95	101.7 Å²	101.7	66%	0.664	68%	0.675	S	S	*	*			trans	-134.3	53.3	165	64.2	0	0	0	0	109.3	S66 T70	S66-S68 VanDerWaalsContact C-N 3.26Å; S66-S68 PolarHBondContact O-N 2.66Å; S68-T70 PolarHBondContact O-N 3.17Å
69	G	52.4	Low	58.6	Low	59 Å²	59	102.7 Å²	102.7	61%	0.608	66%	0.664	S	S	*	*			trans	-61.6	108.5	173.2	0	0	0	0	0	108.8	D73	G69-D73 VanDerWaalsContact CA-OD2 3.31Å; G69-D73 WeakPolarHBondContact CA-OD2 3.28Å
70	T	62.9	Low	60.4	Low	90 Å²	90	100.7 Å²	100.7	55%	0.552	65%	0.646	S	S	*	*			trans	-76.3	167.7	-174.3	65	0	0	0	0	110.2	S68 A72 D73	S68-T70 PolarHBondContact O-N 3.17Å; T70-A72 PolarHBondContact O-N 3.03Å; T70-A72 WeakPolarHBondContact OG1-CB 3.25Å; T70-D73 PolarHBondContact N-OD2 2.82Å; T70-D73 PolarHBondContact O-N 2.98Å
71	H	59.3	Low	62.7	Low	158 Å²	158	100.7 Å²	100.7	73%	0.731	63%	0.632	S	S	*	*	H	α-helix	trans	-46.9	-27.8	172.8	178.7	-102.3	0	0	0	113.4	D73 A74 V75	H71-D73 PolarHBondContact O-N 3.09Å; H71-A74 PolarHBondContact O-N 3.46Å; H71-V75 WeakPolarHBondContact O-CG2 3.39Å; H71-V75 PolarHBondContact O-N 3Å; H71-V75 VanDerWaalsContact O-N 3.08Å
72	A	65.6	Low	64.8	Low	48 Å²	48	105.6 Å²	105.6	40%	0.397	62%	0.622	S	S	.	*	H	α-helix	trans	-59.2	-41.9	174.3	0	0	0	0	0	113.8	T70 A74 V75 I76	T70-A72 PolarHBondContact O-N 3.03Å; T70-A72 WeakPolarHBondContact OG1-CB 3.25Å; A72-A74 VanDerWaalsContact C-N 3.32Å; A72-A74 PolarHBondContact O-N 3.4Å; A72-V75 PolarHBondContact O-N 3.46Å; A72-I76 WeakPolarHBondContact O-CB 3.43Å; A72-I76 WeakPolarHBondContact O-CD1 3.35Å; A72-I76 VanDerWaalsContact O-CG1 3.25Å; A72-I76 WeakPolarHBondContact O-CG1 3.28Å; A72-I76 PolarHBondContact O-N 3.19Å
73	D	81.7	Confident	66.8	Low	95 Å²	95	106.7 Å²	106.7	51%	0.508	61%	0.611	S	S	.	*	H	α-helix	trans	-66.5	-36.4	-179	-68	-43.8	0	0	0	111.5	G69 T70 H71 I76 A77	G69-D73 VanDerWaalsContact CA-OD2 3.31Å; G69-D73 WeakPolarHBondContact CA-OD2 3.28Å; T70-D73 PolarHBondContact N-OD2 2.82Å; T70-D73 PolarHBondContact O-N 2.98Å; H71-D73 PolarHBondContact O-N 3.09Å; D73-I76 PolarHBondContact O-N 3.45Å; D73-A77 WeakPolarHBondContact O-CB 3.39Å; D73-A77 PolarHBondContact O-N 3.43Å
74	A	78.8	Confident	69	Low	63 Å²	63	106.3 Å²	106.3	52%	0.521	60%	0.6	S	S	.	*	H	α-helix	trans	-68	-37.9	174	0	0	0	0	0	112	H71 A72 K78	H71-A74 PolarHBondContact O-N 3.46Å; A72-A74 VanDerWaalsContact C-N 3.32Å; A72-A74 PolarHBondContact O-N 3.4Å; A74-K78 WeakPolarHBondContact O-CB 3.48Å; A74-K78 PolarHBondContact O-N 3.32Å
75	V	82	Confident	70.5	Confident	61 Å²	61	102.8 Å²	102.8	37%	0.37	58%	0.583	S	S	.	*	H	α-helix	trans	-67.1	-44.3	174.1	170.5	0	0	0	0	111	H71 A72 A77 K78 I79	H71-V75 WeakPolarHBondContact O-CG2 3.39Å; H71-V75 PolarHBondContact O-N 3Å; H71-V75 VanDerWaalsContact O-N 3.08Å; A72-V75 PolarHBondContact O-N 3.46Å; V75-A77 PolarHBondContact O-N 2.98Å; V75-K78 PolarHBondContact O-N 2.91Å; V75-K78 VanDerWaalsContact O-N 3.16Å; V75-I79 HydrophobicContact CG1-CD1 3.74Å; V75-I79 HydrophobicContact CG1-CG1 4.38Å; V75-I79 VanDerWaalsContact O-CG1 3.31Å; V75-I79 WeakPolarHBondContact O-CG1 3.29Å; V75-I79 PolarHBondContact O-N 2.99Å
76	I	83.4	Confident	71.6	Confident	87 Å²	87	100.5 Å²	100.5	45%	0.446	57%	0.571	S	S	.	*	H	α-helix	trans	-61.9	-44.5	176.8	-68.5	162.1	0	0	0	110.6	A72 D73 K78 I79 N80	A72-I76 WeakPolarHBondContact O-CB 3.43Å; A72-I76 WeakPolarHBondContact O-CD1 3.35Å; A72-I76 VanDerWaalsContact O-CG1 3.25Å; A72-I76 WeakPolarHBondContact O-CG1 3.28Å; A72-I76 PolarHBondContact O-N 3.19Å; D73-I76 PolarHBondContact O-N 3.45Å; I76-K78 VanDerWaalsContact C-N 3.3Å; I76-K78 PolarHBondContact O-N 2.99Å; I76-I79 PolarHBondContact O-N 3.07Å; I76-N80 WeakPolarHBondContact O-CB 3.4Å; I76-N80 VanDerWaalsContact O-CG 3.25Å; I76-N80 PolarHBondContact O-N 3.42Å; I76-N80 PolarHBondContact O-ND2 3.49Å
77	A	84.5	Confident	73	Confident	58 Å²	58	99.6 Å²	99.6	48%	0.479	56%	0.561	S	S	.	*	H	α-helix	trans	-59.7	-39.8	174.3	0	0	0	0	0	112.3	D73 V75 N80 Q81	D73-A77 WeakPolarHBondContact O-CB 3.39Å; D73-A77 PolarHBondContact O-N 3.43Å; V75-A77 PolarHBondContact O-N 2.98Å; A77-N80 PolarHBondContact O-N 2.95Å; A77-Q81 WeakPolarHBondContact O-CB 3.49Å; A77-Q81 PolarHBondContact O-N 3.2Å
78	K	85.1	Confident	73.5	Confident	150 Å²	150	100.1 Å²	100.1	65%	0.652	55%	0.548	S	S	*	.	H	α-helix	trans	-74	-30.1	179.5	-155.6	170.7	-170.7	176.6	0	113.1	A74 V75 I76 R82	A74-K78 WeakPolarHBondContact O-CB 3.48Å; A74-K78 PolarHBondContact O-N 3.32Å; V75-K78 PolarHBondContact O-N 2.91Å; V75-K78 VanDerWaalsContact O-N 3.16Å; I76-K78 VanDerWaalsContact C-N 3.3Å; I76-K78 PolarHBondContact O-N 2.99Å; K78-R82 PolarHBondContact O-N 3.46Å; K78-R82 VanDerWaalsContact O-N 3.14Å
79	I	83.5	Confident	73.6	Confident	87 Å²	87	102.5 Å²	102.5	45%	0.446	55%	0.553	S	S	.	*	H	α-helix	trans	-68.8	-49	169.9	-71	166.4	0	0	0	109.8	V75 I76 Q81 R82 L83	V75-I79 HydrophobicContact CG1-CD1 3.74Å; V75-I79 HydrophobicContact CG1-CG1 4.38Å; V75-I79 VanDerWaalsContact O-CG1 3.31Å; V75-I79 WeakPolarHBondContact O-CG1 3.29Å; V75-I79 PolarHBondContact O-N 2.99Å; I76-I79 PolarHBondContact O-N 3.07Å; I79-Q81 VanDerWaalsContact C-N 3.32Å; I79-Q81 PolarHBondContact O-N 2.87Å; I79-R82 WeakPolarHBondContact O-CB 3.38Å; I79-R82 PolarHBondContact O-N 3.37Å; I79-R82 VanDerWaalsContact O-N 3.08Å; I79-L83 HydrophobicContact CG2-CD1 3.92Å; I79-L83 HydrophobicContact CG2-CG 4.41Å; I79-L83 WeakPolarHBondContact O-CG 3.34Å; I79-L83 PolarHBondContact O-N 3.23Å
80	N	84.3	Confident	73.7	Confident	82 Å²	82	108 Å²	108	44%	0.439	56%	0.562	S	S	.	*	H	α-helix	trans	-61.2	-40.7	177.6	-68.3	-13.6	0	0	0	111.4	I76 A77 R82 L83 D84	I76-N80 WeakPolarHBondContact O-CB 3.4Å; I76-N80 VanDerWaalsContact O-CG 3.25Å; I76-N80 PolarHBondContact O-N 3.42Å; I76-N80 PolarHBondContact O-ND2 3.49Å; A77-N80 PolarHBondContact O-N 2.95Å; N80-R82 VanDerWaalsContact C-N 3.34Å; N80-R82 PolarHBondContact O-N 2.88Å; N80-L83 PolarHBondContact O-N 2.84Å; N80-L83 VanDerWaalsContact O-N 3.16Å; N80-D84 PolarHBondContact O-N 3.33Å
81	Q	88.8	Confident	73.1	Confident	130 Å²	130	105.9 Å²	105.9	61%	0.607	56%	0.559	S	S	*	*	H	α-helix	trans	-62	-38.1	173.7	-170.2	-179.3	22.7	0	0	112.6	A77 I79 M85	A77-Q81 WeakPolarHBondContact O-CB 3.49Å; A77-Q81 PolarHBondContact O-N 3.2Å; I79-Q81 VanDerWaalsContact C-N 3.32Å; I79-Q81 PolarHBondContact O-N 2.87Å; Q81-M85 WeakPolarHBondContact O-CB 3.48Å; Q81-M85 WeakPolarHBondContact O-CG 3.42Å; Q81-M85 PolarHBondContact O-N 2.94Å; Q81-M85 VanDerWaalsContact O-N 3.13Å
82	R	78.6	Confident	72.4	Confident	191 Å²	191	101.1 Å²	101.1	72%	0.721	55%	0.553	S	S	*	*	H	α-helix	trans	-67.1	-41.6	172	-87.6	-174.5	168.2	-173.3	-3.8	111.8	K78 I79 N80 M85 L86	K78-R82 PolarHBondContact O-N 3.46Å; K78-R82 VanDerWaalsContact O-N 3.14Å; I79-R82 WeakPolarHBondContact O-CB 3.38Å; I79-R82 PolarHBondContact O-N 3.37Å; I79-R82 VanDerWaalsContact O-N 3.08Å; N80-R82 VanDerWaalsContact C-N 3.34Å; N80-R82 PolarHBondContact O-N 2.88Å; R82-M85 PolarHBondContact O-N 3.47Å; R82-L86 WeakPolarHBondContact O-CD1 3.19Å; R82-L86 PolarHBondContact O-N 3.27Å
83	L	75.1	Confident	71.3	Confident	95 Å²	95	108.3 Å²	108.3	50%	0.497	58%	0.575	S	S	.	*	H	α-helix	trans	-66.3	-39.9	178.4	-70.2	171.7	0	0	0	112.2	I79 N80 L86 T87	I79-L83 HydrophobicContact CG2-CD1 3.92Å; I79-L83 HydrophobicContact CG2-CG 4.41Å; I79-L83 WeakPolarHBondContact O-CG 3.34Å; I79-L83 PolarHBondContact O-N 3.23Å; N80-L83 PolarHBondContact O-N 2.84Å; N80-L83 VanDerWaalsContact O-N 3.16Å; L83-L86 PolarHBondContact O-N 3.49Å; L83-T87 VanDerWaalsContact O-CB 3.28Å; L83-T87 WeakPolarHBondContact O-CB 3.36Å; L83-T87 PolarHBondContact O-N 2.94Å; L83-T87 PolarHBondContact O-OG1 2.89Å
84	D	78.8	Confident	69.4	Low	102 Å²	102	114.7 Å²	114.7	55%	0.545	59%	0.592	S	S	.	*	H	α-helix	trans	-63.6	-40.9	173.3	-79.5	-19.9	0	0	0	111.6	N80 T87 Q88	N80-D84 PolarHBondContact O-N 3.33Å; D84-T87 PolarHBondContact O-N 3.41Å; D84-Q88 WeakPolarHBondContact O-CG 3.29Å; D84-Q88 PolarHBondContact O-N 3.4Å
85	M	75.3	Confident	67.3	Low	113 Å²	113	115.1 Å²	115.1	56%	0.557	60%	0.603	S	S	*	*	H	α-helix	trans	-65.5	-43.5	174.9	-70.2	-89	-69.1	0	0	112.1	Q81 R82 Q88 L89	Q81-M85 WeakPolarHBondContact O-CB 3.48Å; Q81-M85 WeakPolarHBondContact O-CG 3.42Å; Q81-M85 PolarHBondContact O-N 2.94Å; Q81-M85 VanDerWaalsContact O-N 3.13Å; R82-M85 PolarHBondContact O-N 3.47Å; M85-Q88 PolarHBondContact O-N 3.33Å; M85-L89 PolarHBondContact O-N 3.49Å; M85-L89 VanDerWaalsContact O-N 3.14Å
86	L	67.2	Low	65.6	Low	100 Å²	100	118.4 Å²	118.4	52%	0.524	63%	0.625	S	S	.	*	H	α-helix	trans	-65.4	-38.7	174.3	-92.2	92.5	0	0	0	111.6	R82 L83 Q88 L89 E90	R82-L86 WeakPolarHBondContact O-CD1 3.19Å; R82-L86 PolarHBondContact O-N 3.27Å; L83-L86 PolarHBondContact O-N 3.49Å; L86-Q88 VanDerWaalsContact C-N 3.27Å; L86-Q88 PolarHBondContact O-N 3.47Å; L86-L89 PolarHBondContact O-N 2.94Å; L86-L89 VanDerWaalsContact O-N 3.09Å; L86-E90 WeakPolarHBondContact O-CB 3.23Å; L86-E90 PolarHBondContact O-N 3.15Å
87	T	65.9	Low	63.4	Low	91 Å²	91	125.6 Å²	125.6	56%	0.558	65%	0.647	S	S	*	*	H	α-helix	trans	-65.6	-31.9	177.7	-56.3	0	0	0	0	111.6	L83 D84 G91	L83-T87 VanDerWaalsContact O-CB 3.28Å; L83-T87 WeakPolarHBondContact O-CB 3.36Å; L83-T87 PolarHBondContact O-N 2.94Å; L83-T87 PolarHBondContact O-OG1 2.89Å; D84-T87 PolarHBondContact O-N 3.41Å; T87-G91 WeakPolarHBondContact O-CA 3.2Å; T87-G91 PolarHBondContact O-N 3.26Å
88	Q	58.4	Low	61.4	Low	148 Å²	148	126.6 Å²	126.6	69%	0.692	66%	0.662	S	S	*	*	H	α-helix	trans	-73	-29.7	172.2	-72.6	173.3	35.4	0	0	113.1	D84 M85 L86	D84-Q88 WeakPolarHBondContact O-CG 3.29Å; D84-Q88 PolarHBondContact O-N 3.4Å; M85-Q88 PolarHBondContact O-N 3.33Å; L86-Q88 VanDerWaalsContact C-N 3.27Å; L86-Q88 PolarHBondContact O-N 3.47Å
89	L	54.3	Low	58.9	Low	145 Å²	145	126 Å²	126	76%	0.759	67%	0.667	S	S	*	*	H	α-helix	trans	-81.6	-35.5	176.2	-81.7	156.2	0	0	0	113.2	M85 L86	M85-L89 PolarHBondContact O-N 3.49Å; M85-L89 VanDerWaalsContact O-N 3.14Å; L86-L89 PolarHBondContact O-N 2.94Å; L86-L89 VanDerWaalsContact O-N 3.09Å
90	E	54.9	Low	56.8	Low	173 Å²	173	132 Å²	132	81%	0.808	68%	0.684	S	S	*	*	H	α-helix	trans	-83.9	-23.4	177	-164.3	171.1	-175.4	0	0	112.1	L86 G92	L86-E90 WeakPolarHBondContact O-CB 3.23Å; L86-E90 PolarHBondContact O-N 3.15Å; E90-G92 VanDerWaalsContact C-N 3.27Å; E90-G92 PolarHBondContact O-N 2.95Å
91	G	49.1	Very low	54.4	Low	46 Å²	46	136.5 Å²	136.5	47%	0.474	70%	0.7	S	S	.	*			trans	-79.2	12.4	-179.2	0	0	0	0	0	116.6	T87 F93	T87-G91 WeakPolarHBondContact O-CA 3.2Å; T87-G91 PolarHBondContact O-N 3.26Å; G91-F93 PolarHBondContact O-N 3.33Å
92	G	45.7	Very low	51.9	Low	59 Å²	59	138.4 Å²	138.4	61%	0.608	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	12.7	-167.2	0	0	0	0	0	118.8	E90	E90-G92 VanDerWaalsContact C-N 3.27Å; E90-G92 PolarHBondContact O-N 2.95Å
93	F	41.5	Very low	49.7	Very low	198 Å²	198	136.6 Å²	136.6	87%	0.868	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144	41.2	179	-105.8	-75.9	0	0	0	114.9	G91	G91-F93 PolarHBondContact O-N 3.33Å
94	R	42	Very low	47.6	Very low	230 Å²	230	141.4 Å²	141.4	87%	0.868	73%	0.727	S	S	*	*			trans	-134.6	86.5	166.1	-74.9	-61.3	-161	-80.2	-2.6	112.2
95	G	35.2	Very low	45.4	Very low	72 Å²	72	145 Å²	145	74%	0.742	74%	0.74	S	S	*	*			trans	-67.5	144.2	168.9	0	0	0	0	0	112.2	R97	G95-R97 PolarHBondContact O-N 2.92Å
96	P	46.5	Very low	43.5	Very low	129 Å²	129	143.2 Å²	143.2	84%	0.838	74%	0.739	S	S	*	*			trans	-92.9	102.8	-173.5	34.3	-33	0	0	0	112.5
97	R	36.8	Very low	41.7	Very low	239 Å²	239	147.3 Å²	147.3	90%	0.902	75%	0.752	S	S	*	*			trans	-142.5	119.9	154.3	-66.9	-166.5	-171.8	-166.4	4.5	110	G95	G95-R97 PolarHBondContact O-N 2.92Å
98	G	42.2	Very low	40	Very low	78 Å²	78	149.8 Å²	149.8	80%	0.804	76%	0.762	S	S	*	*			trans	-96.8	110.9	169.6	0	0	0	0	0	110.1
99	D	33.3	Very low	38.7	Very low	139 Å²	139	147 Å²	147	74%	0.743	76%	0.76	S	S	*	*			trans	-129.2	108.1	153.6	-81.7	-56.3	0	0	0	105.3
100	R	39.4	Very low	38	Very low	212 Å²	212	151.7 Å²	151.7	80%	0.8	77%	0.767	S	S	*	*				92.8	88.1	61.9	-171.9	176.1	-144.6	147.7	3.6	110.5
101	F	34.3	Very low	37.4	Very low	177 Å²	177	148.9 Å²	148.9	78%	0.776	76%	0.764	S	S	*	*			trans	64	118.2	172.8	-68.3	-102.2	0	0	0	116.6
102	D	34.6	Very low	36.6	Very low	170 Å²	170	152.3 Å²	152.3	91%	0.909	78%	0.781	S	S	*	*				-143.1	157.4	119.3	-136.2	-36.6	0	0	0	110.5
103	E	32.8	Very low	35.8	Very low	152 Å²	152	152.9 Å²	152.9	71%	0.71	79%	0.787	S	S	*	*			trans	-90.9	163.4	-150.1	-149.5	113.5	139.7	0	0	115	E105	E103-E105 PolarHBondContact O-N 3.22Å
104	Y	32.1	Very low	35.5	Very low	197 Å²	197	152.1 Å²	152.1	77%	0.773	79%	0.791	S	S	*	*			trans	-77.3	109.7	174.4	174.8	-92.5	0	0	0	110.8	S106	Y104-S106 WeakPolarHBondContact CE1-OG 3.18Å
105	E	32.6	Very low	35	Very low	178 Å²	178	146.8 Å²	146.8	83%	0.832	79%	0.789	S	S	*	*			trans	-116.8	106.5	160.7	-78.8	-150.9	133.1	0	0	112	E103	E103-E105 PolarHBondContact O-N 3.22Å
106	S	34.5	Very low	34.8	Very low	75 Å²	75	148.8 Å²	148.8	52%	0.524	79%	0.791	S	S	.	*			trans	-92.9	121.4	166.2	53.9	0	0	0	0	110	Y104	Y104-S106 WeakPolarHBondContact CE1-OG 3.18Å
107	F	30.6	Very low	34.2	Very low	185 Å²	185	147.8 Å²	147.8	81%	0.811	79%	0.787	S	S	*	*			trans	-133.1	89.7	171	-115	-77.6	0	0	0	112.7
108	D	29.6	Very low	34	Very low	143 Å²	143	147 Å²	147	77%	0.765	78%	0.784	S	S	*	*			trans	-88.2	148.5	157.5	-167.3	-17.7	0	0	0	108.9
109	S	31.9	Very low	33.7	Very low	91 Å²	91	151.3 Å²	151.3	64%	0.636	79%	0.789	S	S	*	*			trans	71.8	78.9	163	-65.1	0	0	0	0	119.8
110	R	38	Very low	34	Very low	243 Å²	243	152 Å²	152	92%	0.917	79%	0.792	S	S	*	*				26	157.9	114.5	-63.2	-177	162.4	-156.2	-5.2	119.8
111	P	43.3	Very low	33.8	Very low	113 Å²	113	152.9 Å²	152.9	73%	0.734	80%	0.796	S	S	*	*			cis	-149.8	-179.3	24.1	42.6	-21.5	0	0	0	119.4
112	S	31.7	Very low	33.6	Very low	119 Å²	119	156.2 Å²	156.2	83%	0.832	80%	0.804	S	S	*	*			trans	92.4	106.8	145.3	-58.2	0	0	0	0	122
113	G	29.7	Very low	33.7	Very low	71 Å²	71	154 Å²	154	73%	0.732	80%	0.802	S	S	*	*				112	96.4	123.7	0	0	0	0	0	119
114	L	35.3	Very low	33.4	Very low	182 Å²	182	150.6 Å²	150.6	95%	0.953	81%	0.808	S	S	*	*				-176.1	159.2	111.6	-92.9	166.9	0	0	0	110.4
115	S	29.9	Very low	33.3	Very low	118 Å²	118	145.4 Å²	145.4	83%	0.825	81%	0.813	S	S	*	*			trans	-90.8	169.3	-157.6	-52.3	0	0	0	0	116.3
116	S	31.2	Very low	33.1	Very low	114 Å²	114	140.5 Å²	140.5	80%	0.797	81%	0.811	S	S	*	*			trans	101.5	119.3	169.4	-160.6	0	0	0	0	113.8
117	S	34	Very low	33.1	Very low	108 Å²	108	142 Å²	142	76%	0.755	82%	0.821	S	S	*	*			cis	-161.4	152.4	2.7	-99.9	0	0	0	0	113.2
118	R	33.7	Very low	33	Very low	223 Å²	223	144.3 Å²	144.3	84%	0.842	83%	0.826	S	S	*	*			trans	85.7	60.6	145.7	-151.8	166.9	-178.3	88.1	-6.3	120
119	D	34.9	Very low	33.1	Very low	167 Å²	167	140.7 Å²	140.7	89%	0.893	82%	0.823	S	S	*	*			trans	-66	138.7	152.7	-83.2	-50	0	0	0	111.9
120	L	40.1	Very low	32.9	Very low	155 Å²	155	146.1 Å²	146.1	81%	0.812	84%	0.836	S	S	*	*			trans	-104	12.7	-177.5	-98.3	167.2	0	0	0	114.3
121	Y	34.3	Very low	32.5	Very low	229 Å²	229	137.3 Å²	137.3	90%	0.898	82%	0.82	S	S	*	*			trans	-149.5	90.5	-175.7	-126.6	-91.8	0	0	0	114
122	R	30.8	Very low	31.8	Very low	248 Å²	248	139.4 Å²	139.4	94%	0.936	83%	0.825	S	S	*	*			trans	176.4	145.2	135.6	-177.4	164.3	-103.6	-124.6	-0.7	111.8
123	S	36	Very low	31.7	Very low	124 Å²	124	138.1 Å²	138.1	87%	0.867	82%	0.816	S	S	*	*			trans	-93.8	155.6	-160.9	-43.2	0	0	0	0	116.9
124	G	27.8	Very low	31.8	Very low	80 Å²	80	142.7 Å²	142.7	83%	0.825	82%	0.82	S	S	*	*			trans	176.3	139.4	155.8	0	0	0	0	0	108.7
125	G	28.5	Very low	31.8	Very low	87 Å²	87	141.1 Å²	141.1	90%	0.897	81%	0.812	S	S	*	*			cis	138.9	88.6	2.9	0	0	0	0	0	110.8
126	G	29.6	Very low	32.1	Very low	75 Å²	75	143.3 Å²	143.3	77%	0.773	81%	0.811	S	S	*	*			trans	128.3	102.9	160.9	0	0	0	0	0	119.2
127	S	33.3	Very low	32.1	Very low	106 Å²	106	143 Å²	143	74%	0.741	81%	0.809	S	S	*	*				62.8	116.1	125	-176.8	0	0	0	0	122.9
128	Y	29.7	Very low	32	Very low	234 Å²	234	145.4 Å²	145.4	92%	0.918	81%	0.808	S	S	*	*				-125.4	121.9	125	-22.5	-78.2	0	0	0	104.6
129	G	31.9	Very low	31.9	Very low	68 Å²	68	145.4 Å²	145.4	70%	0.701	81%	0.808	S	S	*	*				88.3	121.3	56.8	0	0	0	0	0	107.5
130	F	26.5	Very low	31.6	Very low	205 Å²	205	141 Å²	141	90%	0.899	80%	0.802	S	S	*	*			cis	-159.6	168	22	-179.4	-95.4	0	0	0	108.4
131	G	30.4	Very low	31.1	Very low	57 Å²	57	136.8 Å²	136.8	59%	0.588	80%	0.797	S	S	*	*			trans	-154	163.9	171.8	0	0	0	0	0	112.6
132	D	29.2	Very low	31.2	Very low	157 Å²	157	132.4 Å²	132.4	84%	0.84	80%	0.8	S	S	*	*			trans	-165.8	161.4	152.5	-141.2	-22.8	0	0	0	113.9
133	S	28.1	Very low	31.2	Very low	92 Å²	92	123.6 Å²	123.6	64%	0.643	79%	0.786	S	S	*	*			trans	64.9	103.5	147.5	-154.5	0	0	0	0	123.5
134	M	33.6	Very low	30.9	Very low	168 Å²	168	128.4 Å²	128.4	83%	0.828	79%	0.792	S	S	*	*				49.8	143.7	127.4	-59.6	-157.4	-174.6	0	0	125.2
135	L	34	Very low	30.9	Very low	148 Å²	148	127.8 Å²	127.8	78%	0.775	79%	0.785	S	S	*	*			trans	87.7	148.2	147.5	-76.9	154.5	0	0	0	121.8
136	M	37.4	Very low	30.9	Very low	164 Å²	164	127.5 Å²	127.5	81%	0.808	78%	0.783	S	S	*	*			trans	80.4	97.4	161.4	-93.8	43.7	152.9	0	0	122.9
137	S	29.5	Very low	30.9	Very low	107 Å²	107	127.5 Å²	127.5	75%	0.748	78%	0.782	S	S	*	*				17.6	131.1	125.7	-105	0	0	0	0	122.7
138	Q	33.9	Very low	30.9	Very low	160 Å²	160	131.2 Å²	131.2	75%	0.748	79%	0.792	S	S	*	*				83.2	144.8	124.8	-156	-170.6	113	0	0	120.8
139	R	30.5	Very low	31	Very low	222 Å²	222	123 Å²	123	84%	0.838	78%	0.779	S	S	*	*			trans	78.6	136	163.7	-163.7	176	-72.8	-130.5	-1.8	113.7
140	G	28.8	Very low	31.2	Very low	74 Å²	74	128.8 Å²	128.8	76%	0.763	79%	0.792	S	S	*	*			cis	131	120.7	12.8	0	0	0	0	0	106.7
141	G	30	Very low	31.4	Very low	68 Å²	68	122.6 Å²	122.6	70%	0.701	79%	0.787	S	S	*	*				126.6	171.1	70.4	0	0	0	0	0	109
142	S	35.7	Very low	31.4	Very low	137 Å²	137	124 Å²	124	96%	0.958	80%	0.802	S	S	*	*			trans	66.8	150.9	-178.6	76.2	0	0	0	0	116.9
143	G	30.5	Very low	31.4	Very low	63 Å²	63	120.4 Å²	120.4	65%	0.649	80%	0.801	S	S	*	*			cis	163.9	166.2	-7.7	0	0	0	0	0	112.9
144	F	29.7	Very low	31.5	Very low	224 Å²	224	120.1 Å²	120.1	98%	0.982	81%	0.812	S	S	*	*			trans	60.6	156.7	171.5	-76.4	-105.1	0	0	0	116.9
145	G	28.6	Very low	31.3	Very low	67 Å²	67	115.8 Å²	115.8	69%	0.691	81%	0.811	S	S	*	*			cis	158.6	146.7	-4.3	0	0	0	0	0	111.4
146	G	29.2	Very low	31.1	Very low	82 Å²	82	118.4 Å²	118.4	85%	0.845	82%	0.817	S	S	*	*			trans	85.2	137	-175.5	0	0	0	0	0	112.7
147	G	29.6	Very low	30.9	Very low	74 Å²	74	117.6 Å²	117.6	76%	0.763	82%	0.816	S	S	*	*			cis	83.1	126.1	39.8	0	0	0	0	0	107.6
148	I	31.8	Very low	30.9	Very low	185 Å²	185	117.5 Å²	117.5	95%	0.949	82%	0.815	S	S	*	*			cis	-167.2	157.2	31.7	8	171.4	0	0	0	105.3
149	G	32.1	Very low	31.4	Very low	62 Å²	62	115.3 Å²	115.3	64%	0.639	82%	0.815	S	S	*	*			cis	174.4	-173.9	1.5	0	0	0	0	0	109.5
150	L	35.6	Very low	31.3	Very low	188 Å²	188	110.5 Å²	110.5	98%	0.984	82%	0.815	S	S	*	*			trans	71.8	127.2	178.9	-44.3	172.6	0	0	0	115.6
151	G	30.8	Very low	31.4	Very low	76 Å²	76	113.2 Å²	113.2	78%	0.784	82%	0.822	S	S	*	*			cis	171.2	136.3	-10.4	0	0	0	0	0	112.4
152	G	30.8	Very low	31.8	Very low	87 Å²	87	115.4 Å²	115.4	90%	0.897	83%	0.827	S	S	*	*			trans	74.6	150.1	175.1	0	0	0	0	0	116.1
153	G	30.4	Very low	31.4	Very low	80 Å²	80	113.8 Å²	113.8	83%	0.825	82%	0.816	S	S	*	*			cis	156.7	102.3	-6.8	0	0	0	0	0	112.6
154	G	30.1	Very low	31.5	Very low	86 Å²	86	122.1 Å²	122.1	89%	0.887	83%	0.829	S	S	*	*			trans	79.8	146.5	176.6	0	0	0	0	0	115
155	G	28.9	Very low	31.5	Very low	78 Å²	78	115.2 Å²	115.2	80%	0.804	82%	0.821	S	S	*	*			cis	126.3	84.7	-3.2	0	0	0	0	0	113.4
156	F	30.5	Very low	31.6	Very low	202 Å²	202	119.5 Å²	119.5	89%	0.886	83%	0.833	S	S	*	*			trans	-150.9	149.4	156.7	65.1	-93.1	0	0	0	110.7
157	D	32.4	Very low	31.5	Very low	147 Å²	147	119.7 Å²	119.7	79%	0.786	83%	0.827	S	S	*	*			trans	-98.1	126.3	-162.3	-74	-91.7	0	0	0	114.7
158	S	29.2	Very low	31.7	Very low	105 Å²	105	125.5 Å²	125.5	73%	0.734	83%	0.831	S	S	*	*			trans	62.3	164.2	133.1	-54.7	0	0	0	0	120.5
159	P	43.5	Very low	31.7	Very low	115 Å²	115	125.5 Å²	125.5	75%	0.747	83%	0.83	S	S	*	*				-135.9	140.7	-63.3	37.1	-21.4	0	0	0	113.6
160	S	30.1	Very low	32	Very low	121 Å²	121	133.5 Å²	133.5	85%	0.846	84%	0.841	S	S	*	*			trans	-167.2	121.7	157	-89.2	0	0	0	0	113.3
161	S	30.3	Very low	32.6	Very low	130 Å²	130	129.7 Å²	129.7	91%	0.909	83%	0.827	S	S	*	*			trans	154.7	155.1	139	55.3	0	0	0	0	112.3
162	S	37.1	Very low	32.6	Very low	114 Å²	114	133 Å²	133	80%	0.797	83%	0.827	S	S	*	*			trans	-93.1	150.2	-167	176.7	0	0	0	0	113.3
163	S	28.3	Very low	32.7	Very low	104 Å²	104	138.1 Å²	138.1	73%	0.727	83%	0.83	S	S	*	*			trans	-165.1	123.7	141.1	40	0	0	0	0	114.7
164	Y	33	Very low	32.9	Very low	238 Å²	238	144.7 Å²	144.7	93%	0.933	83%	0.83	S	S	*	*			trans	45.7	142.4	144.6	-72.7	-87.9	0	0	0	123.6
165	G	28.9	Very low	33	Very low	79 Å²	79	147.8 Å²	147.8	81%	0.814	83%	0.826	S	S	*	*			trans	134.6	99.6	138.9	0	0	0	0	0	116.5
166	V	30.1	Very low	33.2	Very low	156 Å²	156	148 Å²	148	95%	0.945	82%	0.815	S	S	*	*			trans	-87	120.5	171.3	170.2	0	0	0	0	111
167	A	27.3	Very low	33.4	Very low	87 Å²	87	147.8 Å²	147.8	72%	0.719	81%	0.814	S	S	*	*			trans	-156.5	110.8	151.6	0	0	0	0	0	113.5
168	K	35.2	Very low	33.4	Very low	195 Å²	195	145.3 Å²	145.3	85%	0.848	82%	0.815	S	S	*	*			trans	55.1	107.3	152.2	-60	179.6	179.3	175.4	0	119.3
169	M	30.8	Very low	33.3	Very low	185 Å²	185	144 Å²	144	91%	0.911	82%	0.818	S	S	*	*				-164	139	118.6	-128.5	67.2	171.8	0	0	111.7
170	R	38.9	Very low	32.6	Very low	230 Å²	230	142 Å²	142	87%	0.868	82%	0.817	S	S	*	*			trans	-97.1	150.8	155.1	-112.8	176.9	150.2	176.2	-6.4	106.1
171	P	48.4	Very low	32.6	Very low	109 Å²	109	145.7 Å²	145.7	71%	0.708	82%	0.821	S	S	*	*				-157.3	160.7	77.3	39.7	-18.9	0	0	0	119.2
172	N	30.5	Very low	32.5	Very low	146 Å²	146	143.3 Å²	143.3	78%	0.781	82%	0.817	S	S	*	*			trans	42.4	109.8	142	-56.4	-0.7	0	0	0	122.9
173	M	33.6	Very low	32.1	Very low	193 Å²	193	141.9 Å²	141.9	95%	0.951	82%	0.821	S	S	*	*				-153.8	115.3	114.3	-70.1	-154	-171.6	0	0	106.5
174	R	32.8	Very low	32.1	Very low	218 Å²	218	140.4 Å²	140.4	82%	0.823	82%	0.822	S	S	*	*				83.8	93.5	63.1	-173.2	56	162.9	-156	-4.3	112.9
175	D	33.5	Very low	32	Very low	152 Å²	152	135.4 Å²	135.4	81%	0.813	82%	0.822	S	S	*	*			trans	-59.9	145.4	170.9	-49.3	-99.5	0	0	0	113
176	S	33.3	Very low	32	Very low	82 Å²	82	135.8 Å²	135.8	57%	0.573	83%	0.826	S	S	*	*			trans	177.6	126.9	178.5	-80.8	0	0	0	0	107.5
177	F	34.6	Very low	31.9	Very low	197 Å²	197	132.3 Å²	132.3	86%	0.864	82%	0.822	S	S	*	*			cis	-149.4	174.5	3.2	-88.7	-76.4	0	0	0	107.3
178	A	31	Very low	32	Very low	96 Å²	96	132.5 Å²	132.5	79%	0.793	83%	0.832	S	S	*	*			cis	-155.1	147.1	26.9	0	0	0	0	0	113.9
179	G	27.7	Very low	31.7	Very low	78 Å²	78	126.3 Å²	126.3	80%	0.804	82%	0.823	S	S	*	*			trans	-128.8	132.2	146.1	0	0	0	0	0	107
180	G	29.1	Very low	31.7	Very low	71 Å²	71	129.8 Å²	129.8	73%	0.732	83%	0.826	S	S	*	*			trans	-115.4	147.1	-180	0	0	0	0	0	111.8
181	Q	30.6	Very low	31.3	Very low	199 Å²	199	125.3 Å²	125.3	93%	0.93	83%	0.825	S	S	*	*				173.2	130.1	121.3	-156.4	78.9	52.2	0	0	110.1
182	G	26.9	Very low	30.4	Very low	80 Å²	80	123.6 Å²	123.6	83%	0.825	83%	0.826	S	S	*	*			trans	84	131.9	166.6	0	0	0	0	0	116.3
183	G	29.8	Very low	30.3	Very low	85 Å²	85	121.3 Å²	121.3	88%	0.876	83%	0.828	S	S	*	*			cis	150.1	122.3	-6	0	0	0	0	0	110.9
184	G	27.4	Very low	30	Very low	73 Å²	73	115.5 Å²	115.5	75%	0.753	82%	0.817	S	S	*	*			trans	166.1	81.3	178.4	0	0	0	0	0	119.2
185	S	31.3	Very low	30	Very low	132 Å²	132	115.3 Å²	115.3	92%	0.923	82%	0.817	S	S	*	*			trans	49.6	124.6	143.1	64.2	0	0	0	0	124.1
186	G	28.8	Very low	29.8	Very low	88 Å²	88	118.4 Å²	118.4	91%	0.907	82%	0.817	S	S	*	*			trans	134.5	123.8	144.2	0	0	0	0	0	115.1
187	G	28.2	Very low	29.6	Very low	83 Å²	83	119.6 Å²	119.6	86%	0.856	83%	0.825	S	S	*	*			cis	170.8	135.3	-9.9	0	0	0	0	0	113
188	G	30.4	Very low	30.5	Very low	90 Å²	90	115.4 Å²	115.4	93%	0.928	82%	0.817	S	S	*	*			trans	82.1	140.3	173.7	0	0	0	0	0	115.5
189	G	27.7	Very low	30.5	Very low	65 Å²	65	122 Å²	122	67%	0.67	82%	0.822	S	S	*	*			cis	-157.8	158.8	-8.3	0	0	0	0	0	107.9
190	W	31.9	Very low	30.7	Very low	258 Å²	258	129.6 Å²	129.6	98%	0.977	83%	0.826	S	S	*	*				-166.1	153.5	94.8	-89.9	91.1	0	0	0	111.3
191	V	31.1	Very low	30.7	Very low	137 Å²	137	130 Å²	130	83%	0.83	83%	0.831	S	S	*	*			trans	-49.8	151.7	172.1	-173.6	0	0	0	0	112.8
192	G	28	Very low	30.7	Very low	72 Å²	72	124.7 Å²	124.7	74%	0.742	83%	0.829	S	S	*	*			cis	-177	-164.9	6.1	0	0	0	0	0	108.5
193	A	29.1	Very low	30.8	Very low	99 Å²	99	124.5 Å²	124.5	82%	0.818	83%	0.827	S	S	*	*			cis	-164.1	146.5	3.3	0	0	0	0	0	111.8
194	G	26.8	Very low	30.8	Very low	70 Å²	70	125.8 Å²	125.8	72%	0.722	83%	0.829	S	S	*	*			trans	74.2	144.2	159.8	0	0	0	0	0	118
195	R	32.3	Very low	30.8	Very low	215 Å²	215	125.8 Å²	125.8	81%	0.811	83%	0.829	S	S	*	*			cis	-153.1	150.5	16.4	-70.1	-154.9	-173	-70.4	3.1	114.3
196	R	30.2	Very low	30.8	Very low	217 Å²	217	123.9 Å²	123.9	82%	0.819	82%	0.822	S	S	*	*			trans	62.6	102.6	145	-68.3	176.6	-158.4	-74	4.7	120.8
197	S	28.3	Very low	30.9	Very low	107 Å²	107	131.7 Å²	131.7	75%	0.748	82%	0.824	S	S	*	*			trans	-73.4	-166	130.5	62.1	0	0	0	0	110
198	P	53.5	Low	30.8	Very low	108 Å²	108	131.7 Å²	131.7	70%	0.701	82%	0.823	S	S	*	*			cis	-142.8	173.8	-1.1	43	-25.5	0	0	0	116.9
199	R	30.8	Very low	30.7	Very low	235 Å²	235	132.1 Å²	132.1	89%	0.887	82%	0.819	S	S	*	*				-166.5	152.3	124.2	-69.1	-149.1	-170.5	-99.2	1.9	106.4
200	R	33.7	Very low	30.7	Very low	237 Å²	237	133.9 Å²	133.9	89%	0.894	83%	0.827	S	S	*	*			cis	-143.4	150.9	11	-177.5	179.9	-76.3	-137.8	0.3	108.2
201	G	29.1	Very low	30.6	Very low	81 Å²	81	125 Å²	125	84%	0.835	82%	0.815	S	S	*	*			trans	-80.4	-167.5	-175.6	0	0	0	0	0	114.9
202	G	30	Very low	30.6	Very low	86 Å²	86	122 Å²	122	89%	0.887	81%	0.811	S	S	*	*			cis	157.6	151.9	-0.2	0	0	0	0	0	111.9
203	G	28.7	Very low	30.6	Very low	76 Å²	76	128.3 Å²	128.3	78%	0.784	82%	0.819	S	S	*	*			trans	108.2	111.6	-179.7	0	0	0	0	0	112.7
204	A	30.3	Very low	30.7	Very low	112 Å²	112	127.5 Å²	127.5	93%	0.926	82%	0.82	S	S	*	*				75.4	129.4	72.6	0	0	0	0	0	113
205	G	27.6	Very low	30.8	Very low	73 Å²	73	127.6 Å²	127.6	75%	0.753	82%	0.822	S	S	*	*			cis	170	-178	-4.3	0	0	0	0	0	111.7
206	A	30	Very low	30.8	Very low	92 Å²	92	128.3 Å²	128.3	76%	0.76	82%	0.824	S	S	*	*			trans	68.1	118.3	162.7	0	0	0	0	0	121.5
207	R	30.6	Very low	30.7	Very low	253 Å²	253	129.1 Å²	129.1	96%	0.955	83%	0.827	S	S	*	*				43.1	116.6	125.4	-57.7	173.4	179.6	162.2	-1.1	118.9
208	G	26	Very low	30.7	Very low	82 Å²	82	129 Å²	129	85%	0.845	83%	0.826	S	S	*	*			trans	-167.8	132.2	162.2	0	0	0	0	0	113.1
209	A	28.5	Very low	29.7	Very low	100 Å²	100	131.2 Å²	131.2	83%	0.826	83%	0.833	S	S	*	*			trans	-80.8	173.4	-169.3	0	0	0	0	0	116.2
210	A	29.3	Very low	30.3	Very low	102 Å²	102	126 Å²	126	84%	0.843	83%	0.829	S	S	*	*			trans	77	147.5	147.4	0	0	0	0	0	120.1
211	G	29.1	Very low	30.8	Very low	70 Å²	70	121 Å²	121	72%	0.722	83%	0.825	S	S	*	*			trans	74.6	112.4	167	0	0	0	0	0	114.5
212	G	30.3	Very low	31.9	Very low	74 Å²	74	122.3 Å²	122.3	76%	0.763	82%	0.819	S	S	*	*			cis	83.5	81	20.3	0	0	0	0	0	110.9
213	F	29.2	Very low	32.3	Very low	205 Å²	205	126 Å²	126	90%	0.899	82%	0.818	S	S	*	*			trans	-137.9	97.2	167.8	-88.4	-78.1	0	0	0	110.8
214	G	30.3	Very low	32.3	Very low	82 Å²	82	128 Å²	128	85%	0.845	82%	0.819	S	S	*	*			trans	-83.6	134.6	141.4	0	0	0	0	0	107.6
215	G	28.3	Very low	32.3	Very low	73 Å²	73	126.6 Å²	126.6	75%	0.753	82%	0.815	S	S	*	*			trans	179.8	99.2	-173.7	0	0	0	0	0	114.1
216	R	32.7	Very low	32.6	Very low	229 Å²	229	126.6 Å²	126.6	86%	0.864	82%	0.816	S	S	*	*			trans	-46.4	150.5	175.3	-42	-176.6	-170.9	-72	1.2	114.9
217	R	27.6	Very low	32.7	Very low	234 Å²	234	129.7 Å²	129.7	88%	0.883	82%	0.819	S	S	*	*			trans	-158.7	133.3	132.6	-92.6	136	-164.4	-75	2.2	106.9
218	S	30	Very low	33.2	Very low	104 Å²	104	128.9 Å²	128.9	73%	0.727	82%	0.815	S	S	*	*			cis	78.3	115.5	48.6	-57.8	0	0	0	0	112.3
219	D	32.3	Very low	33.5	Very low	156 Å²	156	128.9 Å²	128.9	83%	0.834	82%	0.815	S	S	*	*			trans	-59.9	164.6	171.7	-52	-72.4	0	0	0	112.9
220	P	43.2	Very low	34	Very low	124 Å²	124	130.5 Å²	130.5	81%	0.805	82%	0.821	S	S	*	*			trans	-119.8	121.3	145.9	33.8	-21.6	0	0	0	111.6
221	T	43.7	Very low	34.1	Very low	133 Å²	133	129.3 Å²	129.3	82%	0.816	82%	0.819	S	S	*	*			trans	-91.3	161.9	151.2	50.2	0	0	0	0	109.7
222	P	53.1	Low	34.2	Very low	108 Å²	108	130.3 Å²	130.3	70%	0.701	83%	0.829	S	S	*	*			trans	-140.3	131.5	141	20.7	0.2	0	0	0	115.8
223	L	38.1	Very low	34.2	Very low	165 Å²	165	130.9 Å²	130.9	86%	0.864	83%	0.834	S	S	*	*			trans	62.3	141	147.7	-75.2	83.2	0	0	0	119.9
224	S	28.9	Very low	34.3	Very low	117 Å²	117	124.6 Å²	124.6	82%	0.818	83%	0.827	S	S	*	*			cis	-164.7	172.3	-3.6	59.6	0	0	0	0	110.5
225	G	30.2	Very low	34.8	Very low	82 Å²	82	128.7 Å²	128.7	85%	0.845	83%	0.825	S	S	*	*			cis	175.6	2.9	-7.8	0	0	0	0	0	120.8
226	G	34.1	Very low	35	Very low	74 Å²	74	130 Å²	130	76%	0.763	82%	0.823	S	S	*	*			trans	-171.8	166.7	-178.3	0	0	0	0	0	115.1
227	L	31.6	Very low	35.2	Very low	156 Å²	156	126.1 Å²	126.1	82%	0.817	81%	0.814	S	S	*	*			cis	-161.9	133.7	4.9	-164.5	71.6	0	0	0	113.3
228	R	39.5	Very low	35.6	Very low	236 Å²	236	126.2 Å²	126.2	89%	0.891	81%	0.814	S	S	*	*			trans	22.4	138.4	153.9	-55.8	174.7	-172.6	-100.4	0.6	123.5
229	G	33.7	Very low	35.6	Very low	82 Å²	82	124.2 Å²	124.2	85%	0.845	81%	0.81	S	S	*	*			trans	177.1	123	150.9	0	0	0	0	0	116.7
230	S	39.5	Very low	35.8	Very low	135 Å²	135	125.7 Å²	125.7	94%	0.944	81%	0.812	S	S	*	*			trans	-68.3	166	179.8	-51.1	0	0	0	0	115.1
231	G	30.2	Very low	35.4	Very low	77 Å²	77	125.2 Å²	125.2	79%	0.794	81%	0.811	S	S	*	*			cis	162.5	178	-3.1	0	0	0	0	0	113.4
232	G	31.3	Very low	35.6	Very low	90 Å²	90	125 Å²	125	93%	0.928	81%	0.812	S	S	*	*			trans	81.7	142.3	173.6	0	0	0	0	0	115.9
233	G	30.6	Very low	34.6	Very low	86 Å²	86	123.8 Å²	123.8	89%	0.887	82%	0.819	S	S	*	*			cis	170.9	139	-7	0	0	0	0	0	110.5
234	G	30.4	Very low	34.3	Very low	73 Å²	73	119.9 Å²	119.9	75%	0.753	82%	0.819	S	S	*	*			trans	165	102.1	179.5	0	0	0	0	0	115.7
235	Q	42.2	Very low	34.8	Very low	169 Å²	169	117.7 Å²	117.7	79%	0.79	82%	0.815	S	S	*	*			trans	-58.1	159.8	171.2	-87.6	75.1	-5.7	0	0	112.8
236	S	33	Very low	35.2	Very low	101 Å²	101	125.6 Å²	125.6	71%	0.706	82%	0.819	S	S	*	*			cis	-160.4	143	40.4	37.9	0	0	0	0	116.7
237	H	36.2	Very low	35.6	Very low	146 Å²	146	125.9 Å²	125.9	68%	0.676	82%	0.822	S	S	*	*			trans	35.4	117	142.4	-51.7	-61.9	0	0	0	122.6
238	R	36	Very low	36.3	Very low	236 Å²	236	128.3 Å²	128.3	89%	0.891	83%	0.826	S	S	*	*				54	133.8	94.9	-62.1	-172.5	-168.6	-121.4	9.3	115.4
239	G	30.4	Very low	36.4	Very low	63 Å²	63	125.1 Å²	125.1	65%	0.649	83%	0.825	S	S	*	*			cis	150.8	157.6	-4	0	0	0	0	0	113
240	H	34.9	Very low	36.9	Very low	186 Å²	186	126.7 Å²	126.7	86%	0.861	82%	0.821	S	S	*	*			trans	95.2	143.2	170.8	-53.8	90.4	0	0	0	120.6
241	S	36.4	Very low	37.5	Very low	114 Å²	114	124.6 Å²	124.6	80%	0.797	81%	0.806	S	S	*	*			trans	-77.3	-167.6	-174.9	-36.3	0	0	0	0	113.5
242	P	47.8	Very low	38.5	Very low	128 Å²	128	128.9 Å²	128.9	83%	0.831	81%	0.81	S	S	*	*			cis	-143.8	169	3.9	41.9	-22.4	0	0	0	119
243	G	30.7	Very low	39.2	Very low	83 Å²	83	132.3 Å²	132.3	86%	0.856	81%	0.806	S	S	*	*			trans	94.1	153.4	144.8	0	0	0	0	0	118.9
244	G	32	Very low	39.6	Very low	84 Å²	84	132.4 Å²	132.4	87%	0.866	79%	0.794	S	S	*	*			trans	108	92.8	170	0	0	0	0	0	114.9
245	G	39.4	Very low	40	Very low	70 Å²	70	136.9 Å²	136.9	72%	0.722	80%	0.8	S	S	*	*			trans	-86.1	166	173.5	0	0	0	0	0	113.5
246	R	39.7	Very low	39.8	Very low	249 Å²	249	137.9 Å²	137.9	94%	0.94	80%	0.797	S	S	*	*			trans	-163.1	152.6	148.5	-103.5	156	-146.8	-77.3	1.3	110
247	G	42	Very low	40.1	Very low	79 Å²	79	141.7 Å²	141.7	81%	0.814	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-68.4	148.1	-158.5	0	0	0	0	0	115.9
248	K	46.2	Very low	40.3	Very low	207 Å²	207	143 Å²	143	90%	0.9	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-103.2	130.2	152.1	-72.4	170.1	179.1	176	0	106.6
249	L	41.1	Very low	41	Very low	169 Å²	169	136.8 Å²	136.8	89%	0.885	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-66.1	146.5	-178.3	-62.4	170.1	0	0	0	110.3
250	P	44.3	Very low	41.3	Very low	116 Å²	116	143.7 Å²	143.7	75%	0.753	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-68.7	140.9	171.2	29.9	-33.3	0	0	0	110.4
251	S	52	Low	41.5	Very low	90 Å²	90	139.9 Å²	139.9	63%	0.629	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-65.5	135.9	178.9	179.2	0	0	0	0	111.8	L253	S251-L253 VanDerWaalsContact C-N 3.3Å; S251-L253 PolarHBondContact O-N 2.95Å; S251-L253 PolarHBondContact OG-N 2.82Å
252	L	51.5	Low	41.8	Very low	167 Å²	167	138.8 Å²	138.8	87%	0.874	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	5.7	179.3	-67.9	174.2	0	0	0	114.1
253	L	46.5	Very low	41.3	Very low	162 Å²	162	136.1 Å²	136.1	85%	0.848	81%	0.808	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	10.5	-174.8	-91.8	77.9	0	0	0	115.4	S251	S251-L253 VanDerWaalsContact C-N 3.3Å; S251-L253 PolarHBondContact O-N 2.95Å; S251-L253 PolarHBondContact OG-N 2.82Å
254	S	38	Very low	41.4	Very low	89 Å²	89	141.8 Å²	141.8	62%	0.622	81%	0.809	S	S	*	*			trans	-111.5	90.9	174.4	63.1	0	0	0	0	112.1	R256	S254-R256 PolarHBondContact O-N 3.09Å
255	N	40	Very low	41.6	Very low	166 Å²	166	147.2 Å²	147.2	89%	0.888	81%	0.812	S	S	*	*			trans	-67.4	80.2	167.3	-88.4	-8.7	0	0	0	110.6
256	R	38.1	Very low	41.3	Very low	191 Å²	191	146.4 Å²	146.4	72%	0.721	80%	0.804	S	S	*	*			trans	-102.3	74.8	167.2	-167.4	174.7	-170.9	170.4	4.1	109.1	S254 Y258	S254-R256 PolarHBondContact O-N 3.09Å; R256-Y258 HydrophobicContact CG-CD2 4.01Å; R256-Y258 HydrophobicContact CG-CE2 4.28Å; R256-Y258 PolarHBondContact O-N 3.22Å
257	M	38.8	Very low	41.2	Very low	181 Å²	181	140.6 Å²	140.6	89%	0.892	80%	0.801	S	S	*	*			trans	-59.3	128.8	164.7	-77.2	-65.8	-162.9	0	0	108.8
258	Y	40.2	Very low	40.8	Very low	174 Å²	174	141.3 Å²	141.3	68%	0.682	80%	0.8	S	S	*	*			trans	-124.1	144.7	168.9	-114.2	-108.7	0	0	0	108.5	R256	R256-Y258 HydrophobicContact CG-CD2 4.01Å; R256-Y258 HydrophobicContact CG-CE2 4.28Å; R256-Y258 PolarHBondContact O-N 3.22Å
259	P	50.1	Low	40.8	Very low	105 Å²	105	137.8 Å²	137.8	68%	0.682	80%	0.798	S	S	*	*			trans	-70.9	144.8	-174.2	29.2	-35.7	0	0	0	112	S261	P259-S261 PolarHBondContact O-N 3.31Å
260	E	37.2	Very low	40.3	Very low	208 Å²	208	133.2 Å²	133.2	97%	0.972	79%	0.792	S	S	*	*			trans	-73.4	96	179.5	-169.9	170.8	169.2	0	0	111.5
261	S	39.7	Very low	40.5	Very low	105 Å²	105	133.3 Å²	133.3	73%	0.734	79%	0.792	S	S	*	*			trans	-148.7	129.4	157.5	54.7	0	0	0	0	109.7	P259	P259-S261 PolarHBondContact O-N 3.31Å
262	G	43.1	Very low	39.7	Very low	92 Å²	92	138 Å²	138	95%	0.948	80%	0.804	S	S	*	*			trans	-68	132.3	-163.5	0	0	0	0	0	114.6
263	G	36.4	Very low	38.7	Very low	71 Å²	71	136.3 Å²	136.3	73%	0.732	80%	0.796	S	S	*	*			trans	-140.7	106.6	176.8	0	0	0	0	0	112.2	Q265	G263-Q265 PolarHBondContact O-N 2.66Å
264	F	32.6	Very low	38	Very low	202 Å²	202	137.7 Å²	137.7	89%	0.886	80%	0.795	S	S	*	*			trans	-61	120.1	174.8	177	-92.3	0	0	0	111.2
265	Q	36.8	Very low	38.4	Very low	199 Å²	199	138.8 Å²	138.8	93%	0.93	80%	0.8	S	S	*	*			trans	-95.8	125.1	168	-81.1	-165.8	-21.9	0	0	110.8	G263	G263-Q265 PolarHBondContact O-N 2.66Å
266	G	33.4	Very low	38	Very low	53 Å²	53	134.1 Å²	134.1	55%	0.546	79%	0.792	S	S	.	*			trans	-163.9	65.9	-177.8	0	0	0	0	0	113.6
267	S	36.7	Very low	37.9	Very low	127 Å²	127	135.4 Å²	135.4	89%	0.888	80%	0.797	S	S	*	*			trans	56.2	132.5	149.3	-52.6	0	0	0	0	121.3
268	A	34.6	Very low	38.3	Very low	94 Å²	94	135.1 Å²	135.1	78%	0.777	79%	0.793	S	S	*	*			trans	-87.3	-157.8	179	0	0	0	0	0	113
269	P	46.3	Very low	37.9	Very low	132 Å²	132	135.5 Å²	135.5	86%	0.857	80%	0.799	S	S	*	*				-118.6	161.6	-74.6	34.2	-21	0	0	0	113
270	G	29.8	Very low	37	Very low	74 Å²	74	134.2 Å²	134.2	76%	0.763	80%	0.804	S	S	*	*			trans	-170	137.3	173.9	0	0	0	0	0	114.8
271	P	48.7	Very low	36.7	Very low	118 Å²	118	128.2 Å²	128.2	77%	0.766	80%	0.798	S	S	*	*			trans	-107.5	136.4	-175.9	37.2	-29.8	0	0	0	114.2
272	Q	34.3	Very low	36.5	Very low	189 Å²	189	126.9 Å²	126.9	88%	0.883	80%	0.801	S	S	*	*			trans	-164.8	148.9	155.7	-140.2	75.4	71.8	0	0	113.4
273	D	30.9	Very low	36.7	Very low	131 Å²	131	127.8 Å²	127.8	70%	0.701	79%	0.79	S	S	*	*			trans	-93	140.2	-168.2	-66.3	-89.5	0	0	0	117.1
274	F	33.1	Very low	36.9	Very low	190 Å²	190	136.3 Å²	136.3	83%	0.833	80%	0.8	S	S	*	*			trans	56.8	-179.9	144.7	-79.8	-89.5	0	0	0	118
275	P	46.2	Very low	36.8	Very low	112 Å²	112	130.6 Å²	130.6	73%	0.727	80%	0.798	S	S	*	*				-138.1	156.9	-81.8	40.2	-21.5	0	0	0	117.4
276	G	30.2	Very low	36.6	Very low	69 Å²	69	124.3 Å²	124.3	71%	0.711	79%	0.787	S	S	*	*			trans	65.8	130	138.2	0	0	0	0	0	121.2
277	R	36.7	Very low	36.8	Very low	217 Å²	217	133.1 Å²	133.1	82%	0.819	80%	0.804	S	S	*	*			trans	-156.7	135.3	138.5	-114.2	176	-160.6	-77.4	-3.4	112.2
278	H	46.9	Very low	36.9	Very low	176 Å²	176	133.9 Å²	133.9	82%	0.815	79%	0.793	S	S	*	*			trans	-115.8	119	170.1	27.7	-97.3	0	0	0	108.3
279	F	32.2	Very low	37	Very low	182 Å²	182	140 Å²	140	80%	0.798	80%	0.796	S	S	*	*			trans	-148.7	131.2	169.1	-101.7	-100.3	0	0	0	105.1
280	G	32.2	Very low	36.3	Very low	78 Å²	78	137.1 Å²	137.1	80%	0.804	79%	0.79	S	S	*	*			cis	132.2	115.5	4.1	0	0	0	0	0	109.8
281	G	29.6	Very low	36.9	Very low	82 Å²	82	145 Å²	145	85%	0.845	80%	0.797	S	S	*	*			trans	140.7	119.7	172.3	0	0	0	0	0	115.3
282	G	36.8	Very low	36.2	Very low	76 Å²	76	148.4 Å²	148.4	78%	0.784	80%	0.8	S	S	*	*			trans	-84.1	-139.8	156.1	0	0	0	0	0	110.3
283	P	45.8	Very low	36.3	Very low	111 Å²	111	150.4 Å²	150.4	72%	0.721	80%	0.799	S	S	*	*			cis	-148.3	173.2	11	44.7	-26.1	0	0	0	117.7
284	R	40.7	Very low	37.2	Very low	250 Å²	250	148.9 Å²	148.9	94%	0.943	80%	0.796	S	S	*	*			trans	64	149.2	157	-64.9	160.3	-173.5	-164.8	2.7	117.8
285	G	31.4	Very low	37.3	Very low	82 Å²	82	146.6 Å²	146.6	85%	0.845	79%	0.792	S	S	*	*			cis	170	163.5	-6.7	0	0	0	0	0	113
286	G	32.6	Very low	36.7	Very low	68 Å²	68	147.9 Å²	147.9	70%	0.701	79%	0.791	S	S	*	*			trans	141.4	102.9	176.9	0	0	0	0	0	111.1
287	R	36.4	Very low	36.9	Very low	238 Å²	238	152.4 Å²	152.4	90%	0.898	79%	0.792	S	S	*	*				55.3	119.1	74.4	-61.1	-166	-170.4	-84.7	7.4	110.6
288	Q	39.7	Very low	36.7	Very low	143 Å²	143	148.6 Å²	148.6	67%	0.668	78%	0.783	S	S	*	*			cis	-154	160.1	29.6	-71.4	-159.8	31.1	0	0	115.3
289	R	37.2	Very low	35.9	Very low	223 Å²	223	146.9 Å²	146.9	84%	0.842	78%	0.775	S	S	*	*			trans	26	133.2	139.2	-49.7	174.3	-152.5	-128.8	5.1	118.5
290	G	30.4	Very low	35.8	Very low	70 Å²	70	145.9 Å²	145.9	72%	0.722	78%	0.775	S	S	*	*			cis	110.4	118.5	8.8	0	0	0	0	0	113.8
291	R	44.2	Very low	36	Very low	241 Å²	241	151.1 Å²	151.1	91%	0.909	78%	0.776	S	S	*	*			trans	178.3	106.1	160.6	-93.6	157.9	-156.3	-96.2	8	106.3
292	K	33.3	Very low	36.2	Very low	189 Å²	189	153.6 Å²	153.6	82%	0.822	78%	0.777	S	S	*	*				55.9	101	75.3	-67.2	-171.8	178.3	-178.3	0	112.3
293	R	35.7	Very low	35.7	Very low	230 Å²	230	158 Å²	158	87%	0.868	78%	0.777	S	S	*	*				89.3	165.8	92.4	-94.6	-172.4	149.7	173.1	-5.3	112.4
294	P	50.6	Low	35	Very low	100 Å²	100	161.8 Å²	161.8	65%	0.649	78%	0.777	S	S	*	*			cis	-142.9	-139.7	-43.1	41.5	-20.1	0	0	0	111.8
295	L	34.1	Very low	34.3	Very low	141 Å²	141	156.3 Å²	156.3	74%	0.738	77%	0.766	S	S	*	*			trans	87.9	119.3	174	-95.9	57.3	0	0	0	115.6
296	I	34.7	Very low	34.3	Very low	140 Å²	140	155.6 Å²	155.6	72%	0.718	76%	0.759	S	S	*	*			cis	68.2	116.5	45.8	-56.4	168.4	0	0	0	110
297	K	33.5	Very low	34.3	Very low	164 Å²	164	161.4 Å²	161.4	71%	0.713	77%	0.768	S	S	*	*				-179.3	161.1	80.6	-140.9	167.8	-178.7	-161.6	0	112.6
298	Q	32.1	Very low	34.5	Very low	136 Å²	136	159.7 Å²	159.7	64%	0.636	77%	0.767	S	S	*	*			trans	38.2	141.8	142.5	-78.1	165	-31.9	0	0	119.5
299	Q	31.2	Very low	34.3	Very low	140 Å²	140	163 Å²	163	65%	0.654	78%	0.78	S	S	*	*			cis	-167.8	177.1	19.8	-130.1	156.3	-113.4	0	0	106.8
300	M	30.4	Very low	34.3	Very low	161 Å²	161	163.2 Å²	163.2	79%	0.793	78%	0.78	S	S	*	*			cis	-156.5	-165.4	5	-154.9	151	-172.9	0	0	108.9
301	K	35.5	Very low	34.4	Very low	188 Å²	188	169.2 Å²	169.2	82%	0.817	79%	0.786	S	S	*	*			trans	-103.1	162.3	150.6	-72.5	-178.1	176.1	-178.4	0	109
302	P	33.1	Very low	33.6	Very low	134 Å²	134	163.7 Å²	163.7	87%	0.87	78%	0.78	S	S	*	*				-128.9	-171.9	119.2	37.6	-30.5	0	0	0	113.3
303	Q	27.8	Very low	33.3	Very low	168 Å²	168	158.6 Å²	158.6	79%	0.785	78%	0.781	S	S	*	*			trans	-136.4	163.1	-156.8	-178.3	-165.7	-94.1	0	0	109.3
304	R	29.9	Very low	32.9	Very low	191 Å²	191	151 Å²	151	72%	0.721	78%	0.775	S	S	*	*			trans	104.3	136	138.6	-131.7	-168.2	152.1	148.4	0.5	119.2
305	D	27.2	Very low	31.7	Very low	135 Å²	135	154.2 Å²	154.2	72%	0.722	79%	0.786	S	S	*	*			trans	55.2	152.8	158.4	-54.9	-27.3	0	0	0	119.6
306	G	30.1	Very low	31.6	Very low	68 Å²	68	156 Å²	156	70%	0.701	79%	0.791	S	S	*	*			cis	156.7	155.4	-6.1	0	0	0	0	0	112.9
307	Q	34.1	Very low	32.6	Very low	190 Å²	190	154.1 Å²	154.1	89%	0.888	79%	0.787	S	S	*	*			trans	83.5	109.3	161.9	-54.4	-170.8	-12	0	0	123
308	K	39.3	Very low	32.4	Very low	202 Å²	202	154.3 Å²	154.3	88%	0.878	79%	0.791	S	S	*	*				39.1	130.7	119.9	-61.3	178.7	177.4	179.2	0	122.1
309	K	36.9	Very low	32.6	Very low	213 Å²	213	152.6 Å²	152.6	93%	0.926	79%	0.794	S	S	*	*				-155.9	151	128.6	-127.2	173.9	-177.5	178.3	0	113.8
310	R	36.3	Very low	32.9	Very low	226 Å²	226	154.2 Å²	154.2	85%	0.853	80%	0.799	S	S	*	*			trans	-110.7	157.9	177.8	-69.4	165	69.8	-175	5.2	110.7
311	K	32	Very low	33.1	Very low	196 Å²	196	153.4 Å²	153.4	85%	0.852	80%	0.795	S	S	*	*			trans	154.5	112.8	137.4	-88	-172.2	173.4	-165.5	0	109.1
312	T	28.2	Very low	32.6	Very low	126 Å²	126	151.9 Å²	151.9	77%	0.773	80%	0.796	S	S	*	*				71.6	119.7	72.5	58.7	0	0	0	0	116.4
313	G	26.8	Very low	32.5	Very low	82 Å²	82	152.9 Å²	152.9	85%	0.845	79%	0.786	S	S	*	*			trans	131.5	118.4	139.1	0	0	0	0	0	118.4
314	G	26.5	Very low	32.8	Very low	71 Å²	71	151 Å²	151	73%	0.732	79%	0.787	S	S	*	*				99.8	130	128.8	0	0	0	0	0	120.9
315	D	25.9	Very low	32.7	Very low	167 Å²	167	148.5 Å²	148.5	89%	0.893	78%	0.783	S	S	*	*			trans	71.5	117.8	140.4	-77	-126.5	0	0	0	123.9
316	E	32.8	Very low	32.6	Very low	178 Å²	178	149 Å²	149	83%	0.832	79%	0.786	S	S	*	*			trans	-59.9	-179.8	140.3	-83.4	-167.8	113.7	0	0	111.5
317	P	55.2	Low	32.6	Very low	100 Å²	100	154.2 Å²	154.2	65%	0.649	79%	0.792	S	S	*	*			cis	-149.1	-162.8	23.1	45.3	-22.9	0	0	0	117.4
318	E	28.7	Very low	32.2	Very low	168 Å²	168	153.2 Å²	153.2	79%	0.785	79%	0.787	S	S	*	*			trans	79.9	98.7	148	-80.3	175.9	-164.1	0	0	122.5
319	S	37.5	Very low	31.6	Very low	100 Å²	100	147.8 Å²	147.8	70%	0.699	78%	0.78	S	S	*	*				43.9	138	110.6	75.2	0	0	0	0	122
320	K	37.3	Very low	31	Very low	175 Å²	175	146.7 Å²	146.7	76%	0.761	78%	0.778	S	S	*	*			trans	-172.3	119.8	152	-114.8	162.7	177.1	163.5	0	116
321	M	33.7	Very low	30.6	Very low	143 Å²	143	139 Å²	139	70%	0.704	77%	0.769	S	S	*	*			trans	52.3	149.1	133.7	78.3	-162.9	167.9	0	0	121.9
322	N	25.8	Very low	30.2	Very low	157 Å²	157	135.3 Å²	135.3	84%	0.84	76%	0.763	S	S	*	*			cis	-172.8	166.1	-11.6	-104.9	-4.5	0	0	0	110.3
323	K	31.1	Very low	30.1	Very low	154 Å²	154	137 Å²	137	67%	0.67	76%	0.762	S	S	*	*			trans	101.5	120.5	141.2	-153.5	176.8	-177.8	-152.7	0	121	E325	K323-E325 HydrophobicContact CD-CG 4.43Å; K323-E325 VanDerWaalsContact CE-CD 3.43Å; K323-E325 VanDerWaalsContact CE-OE2 3.31Å; K323-E325 WeakPolarHBondContact CE-OE2 3.2Å; K323-E325 HydrophobicContact CG-CG 4.46Å; K323-E325 IonicContact NZ-OE1 2.64Å; K323-E325 PolarHBondContact NZ-OE1 2.86Å; K323-E325 IonicContact NZ-OE2 2.75Å; K323-E325 PolarHBondContact NZ-OE2 3.1Å
324	T	32.7	Very low	30.1	Very low	130 Å²	130	141.2 Å²	141.2	80%	0.798	76%	0.76	S	S	*	*			trans	-97.1	145.2	167.4	47.1	0	0	0	0	112.4
325	E	28.3	Very low	30.4	Very low	137 Å²	137	145 Å²	145	64%	0.64	76%	0.759	S	S	*	*			trans	-157.6	127.9	167.1	-61.8	-173.5	105.5	0	0	105.8	K323	K323-E325 HydrophobicContact CD-CG 4.43Å; K323-E325 VanDerWaalsContact CE-CD 3.43Å; K323-E325 VanDerWaalsContact CE-OE2 3.31Å; K323-E325 WeakPolarHBondContact CE-OE2 3.2Å; K323-E325 HydrophobicContact CG-CG 4.46Å; K323-E325 IonicContact NZ-OE1 2.64Å; K323-E325 PolarHBondContact NZ-OE1 2.86Å; K323-E325 IonicContact NZ-OE2 2.75Å; K323-E325 PolarHBondContact NZ-OE2 3.1Å
326	D	25.8	Very low	30.9	Very low	147 Å²	147	142.5 Å²	142.5	79%	0.786	75%	0.752	S	S	*	*			cis	-143.9	-101.6	1.6	-64.9	-50.2	0	0	0	114.8
327	E	30.3	Very low	30.7	Very low	176 Å²	176	142.2 Å²	142.2	82%	0.822	75%	0.747	S	S	*	*			trans	-140.7	-177.3	-156.5	-60.4	176.1	146.5	0	0	113.7
328	E	24.7	Very low	29.4	Very low	170 Å²	170	147 Å²	147	79%	0.794	76%	0.761	S	S	*	*			cis	-165	159.7	13.2	-147.6	-172.6	162.8	0	0	113
329	A	27.1	Very low	29.3	Very low	87 Å²	87	148.4 Å²	148.4	72%	0.719	77%	0.768	S	S	*	*			trans	51.7	153.5	144.4	0	0	0	0	0	124.2
330	E	25.2	Very low	28.8	Very low	190 Å²	190	147.6 Å²	147.6	89%	0.888	78%	0.775	S	S	*	*			cis	-169.8	137.8	-28.3	-172.3	-171.9	-146	0	0	108.7
331	G	26.4	Very low	28.2	Very low	64 Å²	64	146.4 Å²	146.4	66%	0.66	78%	0.777	S	S	*	*			trans	68.1	169	152.5	0	0	0	0	0	119.6
332	T	24.2	Very low	27.8	Very low	120 Å²	120	145.4 Å²	145.4	74%	0.736	78%	0.775	S	S	*	*			cis	-163.2	154.3	-25.4	-20.2	0	0	0	0	108.1
333	Q	25.9	Very low	27.8	Very low	161 Å²	161	144.8 Å²	144.8	75%	0.752	77%	0.771	S	S	*	*			trans	66.2	151.3	161.1	-63	164.5	-0.1	0	0	116.8
334	E	26.5	Very low	27.7	Very low	171 Å²	171	144.1 Å²	144.1	80%	0.799	78%	0.775	S	S	*	*			cis	-157	149.9	-14.8	-116	166.2	-163.3	0	0	107.9
335	E	33	Very low	27.9	Very low	150 Å²	150	143 Å²	143	70%	0.701	77%	0.77	S	S	*	*			trans	-77.1	157.2	166.1	-118.5	-152.3	-153.5	0	0	109.9
336	P	37.4	Very low	27.9	Very low	115 Å²	115	145 Å²	145	75%	0.747	78%	0.779	S	S	*	*				-154.7	162.9	61.1	40.1	-18.4	0	0	0	119.9
337	K	28.7	Very low	27.9	Very low	171 Å²	171	142.3 Å²	142.3	74%	0.743	78%	0.778	S	S	*	*			trans	-3.9	139.3	149.2	-53.8	173.4	-175.5	-179.8	0	120
338	Q	27.6	Very low	27.7	Very low	200 Å²	200	137.9 Å²	137.9	94%	0.935	77%	0.771	S	S	*	*				-161.9	158.8	115.5	-114.3	175.3	3.5	0	0	114.2
339	E	26.6	Very low	27.8	Very low	199 Å²	199	136 Å²	136	93%	0.93	77%	0.771	S	S	*	*			trans	-81.8	162.6	-177.4	-56.6	166.6	155.5	0	0	112.4
340	G	25.7	Very low	28	Very low	82 Å²	82	140.6 Å²	140.6	85%	0.845	78%	0.778	S	S	*	*			trans	176.1	128.9	169.9	0	0	0	0	0	113.8
341	D	24.4	Very low	28	Very low	151 Å²	151	140.4 Å²	140.4	81%	0.807	78%	0.777	S	S	*	*			trans	-96.8	171.5	-168.5	-152.2	-10.5	0	0	0	114
342	D	26.1	Very low	28.1	Very low	122 Å²	122	142.3 Å²	142.3	65%	0.652	79%	0.787	S	S	*	*			trans	83.6	126.5	144	-95.6	-38.6	0	0	0	124.1
343	N	26.4	Very low	28.3	Very low	143 Å²	143	142.4 Å²	142.4	77%	0.765	79%	0.787	S	S	*	*			trans	76.1	130.6	145.5	-70.9	-66	0	0	0	124.5
344	N	28.3	Very low	28.9	Very low	141 Å²	141	140.5 Å²	140.5	75%	0.754	79%	0.789	S	S	*	*			trans	-88.8	150.3	165.9	-177.5	24.5	0	0	0	109.6	E346	N344-E346 PolarHBondContact OD1-N 3.11Å
345	P	38.1	Very low	28.8	Very low	107 Å²	107	138.1 Å²	138.1	70%	0.695	79%	0.791	S	S	*	*				-151.4	146.6	101.8	37.1	-18.8	0	0	0	117.9
346	E	27.2	Very low	28.5	Very low	177 Å²	177	139.4 Å²	139.4	83%	0.827	80%	0.797	S	S	*	*			trans	61.9	123.9	138.4	-77.2	-163.2	120.7	0	0	125.1	N344	N344-E346 PolarHBondContact OD1-N 3.11Å
347	A	25.7	Very low	28.1	Very low	92 Å²	92	142.8 Å²	142.8	76%	0.76	80%	0.803	S	S	*	*				97.9	160.2	120.9	0	0	0	0	0	122.6
348	A	26.8	Very low	27.9	Very low	82 Å²	82	137.7 Å²	137.7	68%	0.678	80%	0.798	S	S	*	*			trans	76.5	100.4	179.7	0	0	0	0	0	116
349	T	26.7	Very low	27.8	Very low	130 Å²	130	137.5 Å²	137.5	80%	0.798	80%	0.795	S	S	*	*				64.9	140.3	81.4	64.9	0	0	0	0	113.3
350	E	30.1	Very low	27.7	Very low	184 Å²	184	134.3 Å²	134.3	86%	0.86	79%	0.789	S	S	*	*			cis	-149.2	163.9	37.2	-67.3	175.9	146.8	0	0	113.2
351	E	26.7	Very low	27.8	Very low	186 Å²	186	134.4 Å²	134.4	87%	0.869	78%	0.782	S	S	*	*			trans	-88.3	150.6	166.9	-63.7	-168.1	157.4	0	0	112.4
352	A	27.3	Very low	27.9	Very low	105 Å²	105	134 Å²	134	87%	0.868	79%	0.785	S	S	*	*			trans	-151	134.1	151.5	0	0	0	0	0	111.5
353	T	28.5	Very low	28.1	Very low	122 Å²	122	133.2 Å²	133.2	75%	0.748	80%	0.796	S	S	*	*			trans	-102.7	-152.6	-173.4	47.4	0	0	0	0	111.6
354	P	38	Very low	28.4	Very low	120 Å²	120	136 Å²	136	78%	0.779	80%	0.801	S	S	*	*				-113.1	-175.1	-94.8	37.7	-22.4	0	0	0	112.9
355	S	25.1	Very low	28.6	Very low	121 Å²	121	138.1 Å²	138.1	85%	0.846	81%	0.806	S	S	*	*			trans	-139.3	132.2	164.2	38.5	0	0	0	0	112.7
356	E	26.9	Very low	28.6	Very low	178 Å²	178	142.1 Å²	142.1	83%	0.832	82%	0.816	S	S	*	*			trans	-100.6	173.8	174.1	-77.9	-155.1	118.9	0	0	112.1
357	E	28.1	Very low	28.8	Very low	186 Å²	186	142.7 Å²	142.7	87%	0.869	82%	0.818	S	S	*	*			trans	70.8	138.8	167.8	-49.2	-162.4	-160.5	0	0	117.2
358	G	24.8	Very low	29.3	Very low	63 Å²	63	148 Å²	148	65%	0.649	82%	0.824	S	S	*	*			cis	160.9	138.9	-9	0	0	0	0	0	112.9
359	K	26.2	Very low	29.6	Very low	196 Å²	196	154 Å²	154	85%	0.852	84%	0.835	S	S	*	*			trans	66	129.3	167.9	-50.4	160.6	-177.6	157.7	0	115
360	T	24.7	Very low	30.2	Very low	133 Å²	133	156.9 Å²	156.9	82%	0.816	84%	0.837	S	S	*	*				-170.6	143.9	60.1	40.2	0	0	0	0	114.2
361	A	26.8	Very low	30.5	Very low	84 Å²	84	153.1 Å²	153.1	69%	0.694	83%	0.828	S	S	*	*			trans	46.7	107.2	140.6	0	0	0	0	0	123.5
362	T	26.6	Very low	31.1	Very low	141 Å²	141	149.9 Å²	149.9	87%	0.865	82%	0.823	S	S	*	*				65.4	110.5	129.6	60	0	0	0	0	122.5
363	A	31	Very low	32	Very low	107 Å²	107	148.8 Å²	148.8	88%	0.884	81%	0.806	S	S	*	*			trans	-148	151.8	132	0	0	0	0	0	110.4
364	K	32.8	Very low	33	Very low	202 Å²	202	150.4 Å²	150.4	88%	0.878	81%	0.805	S	S	*	*			trans	-88.5	142.1	-178.4	-68.9	173.9	175.1	177.2	0	112.2
365	Q	32	Very low	33.2	Very low	184 Å²	184	147 Å²	147	86%	0.86	79%	0.791	S	S	*	*			trans	-166.9	107.3	134.7	-102.6	159	13.8	0	0	106.6
366	E	37.7	Very low	34.3	Very low	192 Å²	192	147.1 Å²	147.1	90%	0.897	78%	0.778	S	S	*	*				48.7	75	97.3	-73.9	-144.9	126	0	0	115.3
367	E	32.4	Very low	35.3	Very low	189 Å²	189	143.9 Å²	143.9	88%	0.883	76%	0.763	S	S	*	*			trans	-117.9	136.5	147.8	-86.7	-142.6	111.3	0	0	111.5	K369	E367-K369 PolarHBondContact O-N 3.33Å
368	K	35.3	Very low	36.4	Very low	203 Å²	203	142.8 Å²	142.8	88%	0.883	76%	0.756	S	S	*	*			trans	-77.8	101.7	-175.6	-69.7	170.1	-179.6	167.2	0	110	K370	K368-K370 PolarHBondContact O-N 3.4Å
369	K	33.6	Very low	37.5	Very low	207 Å²	207	146.7 Å²	146.7	90%	0.9	76%	0.757	S	S	*	*			trans	-57.2	101.8	165.8	-71.8	-172.5	176.2	-175.5	0	110.4	E367	E367-K369 PolarHBondContact O-N 3.33Å
370	K	38.8	Very low	38.8	Very low	192 Å²	192	143.3 Å²	143.3	84%	0.835	74%	0.744	S	S	*	*			trans	-63.3	138	158.3	-67.1	177.3	-179.1	173.5	0	107.9	K368	K368-K370 PolarHBondContact O-N 3.4Å
371	P	37.8	Very low	40.2	Very low	104 Å²	104	143.5 Å²	143.5	68%	0.675	73%	0.734	S	S	*	*			trans	-69.8	154.4	172.1	30.8	-34.5	0	0	0	110.5	T373	P371-T373 PolarHBondContact O-N 2.82Å; P371-T373 VanDerWaalsContact O-N 3.13Å
372	P	39.7	Very low	41.5	Very low	118 Å²	118	142.1 Å²	142.1	77%	0.766	72%	0.722	S	S	*	*			trans	-71.9	108.1	-174.6	28.4	-34.5	0	0	0	112	Q374	P372-Q374 VanDerWaalsContact C-N 3.27Å; P372-Q374 PolarHBondContact O-N 2.99Å
373	T	45.6	Very low	42.8	Very low	83 Å²	83	145.5 Å²	145.5	51%	0.509	72%	0.719	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.1	1.6	175.4	43.3	0	0	0	0	114.3	P371 G375 Q376 E377	P371-T373 PolarHBondContact O-N 2.82Å; P371-T373 VanDerWaalsContact O-N 3.13Å; T373-G375 PolarHBondContact O-N 2.81Å; T373-G375 VanDerWaalsContact O-N 3.12Å; T373-Q376 PolarHBondContact O-N 2.84Å; T373-E377 PolarHBondContact O-N 3.04Å
374	Q	49.1	Very low	44	Very low	156 Å²	156	148.4 Å²	148.4	73%	0.729	71%	0.711	S	S	*	*	H	α-helix	trans	-56	-31.5	-177.7	-70.5	-178.9	-12.7	0	0	113.7	P372 Q376 K378	P372-Q374 VanDerWaalsContact C-N 3.27Å; P372-Q374 PolarHBondContact O-N 2.99Å; Q374-Q376 PolarHBondContact O-N 3.21Å; Q374-K378 WeakPolarHBondContact O-CB 3.41Å; Q374-K378 PolarHBondContact O-N 3.16Å; Q374-K378 VanDerWaalsContact O-N 3.15Å
375	G	43	Very low	45.2	Very low	47 Å²	47	143.4 Å²	143.4	49%	0.485	69%	0.687	S	S	.	*	H	α-helix	trans	-66.8	-32.8	175.7	0	0	0	0	0	114	T373 Q379	T373-G375 PolarHBondContact O-N 2.81Å; T373-G375 VanDerWaalsContact O-N 3.12Å; G375-Q379 VanDerWaalsContact O-CG 3.32Å; G375-Q379 WeakPolarHBondContact O-CG 3.49Å; G375-Q379 PolarHBondContact O-N 3.03Å
376	Q	47.9	Very low	46.2	Very low	124 Å²	124	142 Å²	142	58%	0.579	67%	0.674	S	S	*	*	H	α-helix	trans	-81.2	-38.4	-178.5	-69.3	-176	-15.1	0	0	111.8	T373 Q374 Q379 Q380	T373-Q376 PolarHBondContact O-N 2.84Å; Q374-Q376 PolarHBondContact O-N 3.21Å; Q376-Q379 PolarHBondContact O-N 3.22Å; Q376-Q380 WeakPolarHBondContact O-CB 3.43Å; Q376-Q380 VanDerWaalsContact O-CG 3.31Å; Q376-Q380 WeakPolarHBondContact O-CG 3.32Å; Q376-Q380 PolarHBondContact O-N 3.32Å
377	E	48	Very low	47.3	Very low	111 Å²	111	134.3 Å²	134.3	52%	0.519	65%	0.646	S	S	.	*	H	α-helix	trans	-65.5	-42.3	173.5	-69.9	-171.2	154.2	0	0	112	T373 Q379 Q380 K381	T373-E377 PolarHBondContact O-N 3.04Å; E377-Q379 VanDerWaalsContact C-N 3.3Å; E377-Q379 PolarHBondContact O-N 3.4Å; E377-Q380 PolarHBondContact O-N 2.81Å; E377-K381 WeakPolarHBondContact O-CB 3.41Å; E377-K381 WeakPolarHBondContact O-CG 3.34Å; E377-K381 PolarHBondContact O-N 2.75Å
378	K	50.2	Low	49	Very low	163 Å²	163	128.8 Å²	128.8	71%	0.709	62%	0.619	S	S	*	*	H	α-helix	trans	-62.1	-39	177	-153.4	173	-174.4	-177.4	0	111.1	Q374 A382	Q374-K378 WeakPolarHBondContact O-CB 3.41Å; Q374-K378 PolarHBondContact O-N 3.16Å; Q374-K378 VanDerWaalsContact O-N 3.15Å; K378-A382 VanDerWaalsContact O-CB 3.23Å; K378-A382 WeakPolarHBondContact O-CB 3.28Å; K378-A382 PolarHBondContact O-N 2.99Å
379	Q	48.6	Very low	50.5	Low	145 Å²	145	120.6 Å²	120.6	68%	0.678	58%	0.584	S	S	*	*	H	α-helix	trans	-69.4	-38.8	173.3	-75	179.9	0.5	0	0	113.7	G375 Q376 E377 R383	G375-Q379 VanDerWaalsContact O-CG 3.32Å; G375-Q379 WeakPolarHBondContact O-CG 3.49Å; G375-Q379 PolarHBondContact O-N 3.03Å; Q376-Q379 PolarHBondContact O-N 3.22Å; E377-Q379 VanDerWaalsContact C-N 3.3Å; E377-Q379 PolarHBondContact O-N 3.4Å; Q379-R383 VanDerWaalsContact O-CB 3.28Å; Q379-R383 WeakPolarHBondContact O-CB 3.47Å; Q379-R383 PolarHBondContact O-N 3.27Å
380	Q	54.2	Low	52.1	Low	124 Å²	124	113.9 Å²	113.9	58%	0.579	56%	0.558	S	S	*	*	H	α-helix	trans	-70.8	-41.1	177.2	-73	-179	27	0	0	111.9	Q376 E377 R383 K384	Q376-Q380 WeakPolarHBondContact O-CB 3.43Å; Q376-Q380 VanDerWaalsContact O-CG 3.31Å; Q376-Q380 WeakPolarHBondContact O-CG 3.32Å; Q376-Q380 PolarHBondContact O-N 3.32Å; E377-Q380 PolarHBondContact O-N 2.81Å; Q380-R383 PolarHBondContact O-N 2.87Å; Q380-K384 WeakPolarHBondContact O-CB 3.48Å; Q380-K384 PolarHBondContact O-N 3.22Å
381	K	53.1	Low	53.6	Low	138 Å²	138	108.4 Å²	108.4	60%	0.6	53%	0.532	S	S	*	.	H	α-helix	trans	-62.6	-44.2	172.3	-72.2	-178.8	177.7	-176	0	111	E377 R383 K384 R385	E377-K381 WeakPolarHBondContact O-CB 3.41Å; E377-K381 WeakPolarHBondContact O-CG 3.34Å; E377-K381 PolarHBondContact O-N 2.75Å; K381-R383 PolarHBondContact O-N 3.09Å; K381-K384 PolarHBondContact O-N 3.05Å; K381-R385 WeakPolarHBondContact O-CB 3.31Å; K381-R385 WeakPolarHBondContact O-CG 3.44Å; K381-R385 PolarHBondContact O-N 3.28Å
382	A	54.7	Low	55.4	Low	54 Å²	54	104.2 Å²	104.2	45%	0.446	50%	0.504	S	S	.	.	H	α-helix	trans	-61.1	-41.4	173.3	0	0	0	0	0	112.6	K378 R386	K378-A382 VanDerWaalsContact O-CB 3.23Å; K378-A382 WeakPolarHBondContact O-CB 3.28Å; K378-A382 PolarHBondContact O-N 2.99Å; A382-R386 WeakPolarHBondContact O-CB 3.44Å; A382-R386 PolarHBondContact O-N 3.18Å
383	R	54.3	Low	57.4	Low	212 Å²	212	100 Å²	100	80%	0.8	48%	0.475	S	S	*	.	H	α-helix	trans	-71.1	-37.8	179.6	-166.3	173.6	-178.1	-176.5	-0.7	113	Q379 Q380 K381 G387	Q379-R383 VanDerWaalsContact O-CB 3.28Å; Q379-R383 WeakPolarHBondContact O-CB 3.47Å; Q379-R383 PolarHBondContact O-N 3.27Å; Q380-R383 PolarHBondContact O-N 2.87Å; K381-R383 PolarHBondContact O-N 3.09Å; R383-G387 PolarHBondContact O-N 3.26Å
384	K	54.4	Low	59.1	Low	168 Å²	168	96.2 Å²	96.2	73%	0.73	45%	0.451	S	S	*	.	H	α-helix	trans	-66.4	-47.1	171.6	-77	-172	174	-169.9	0	111.3	Q380 K381 R386 G387 F388	Q380-K384 WeakPolarHBondContact O-CB 3.48Å; Q380-K384 PolarHBondContact O-N 3.22Å; K381-K384 PolarHBondContact O-N 3.05Å; K384-R386 VanDerWaalsContact C-N 3.34Å; K384-R386 PolarHBondContact O-N 2.81Å; K384-G387 PolarHBondContact O-N 3.22Å; K384-F388 PolarHBondContact O-N 3.45Å; K384-F388 VanDerWaalsContact O-N 3.13Å
385	R	58.6	Low	60.8	Low	97 Å²	97	90.2 Å²	90.2	37%	0.366	43%	0.428	S	S	.	.	H	α-helix	trans	-62.8	-36.6	176	-72.5	-160	-68.2	175.8	4.1	112.4	K381 G387 F388 M389 E468	K381-R385 WeakPolarHBondContact O-CB 3.31Å; K381-R385 WeakPolarHBondContact O-CG 3.44Å; K381-R385 PolarHBondContact O-N 3.28Å; R385-G387 VanDerWaalsContact C-N 3.32Å; R385-G387 PolarHBondContact O-N 3.15Å; R385-F388 CarbonylContact O-C 3.57Å; R385-F388 WeakPolarHBondContact O-CA 3.38Å; R385-F388 WeakPolarHBondContact O-CB 3.39Å; R385-F388 PolarHBondContact O-N 2.89Å; R385-M389 HydrophobicContact CB-CE 3.99Å; R385-M389 VanDerWaalsContact O-CG 3.27Å; R385-M389 WeakPolarHBondContact O-CG 3.27Å; R385-M389 PolarHBondContact O-N 3.4Å; R385-E468 IonicContact CZ-OE1 2.78Å; R385-E468 IonicContact CZ-OE2 3.61Å; R385-E468 VanDerWaalsContact CZ-OE2 3.23Å; R385-E468 IonicContact NE-OE2 3.12Å; R385-E468 IonicContact NH1-OE1 2.75Å; R385-E468 PolarHBondContact NH1-OE1 3.25Å; R385-E468 IonicContact NH1-OE2 3.95Å; R385-E468 IonicContact NH2-OE1 2.82Å; R385-E468 PolarHBondContact NH2-OE1 3.15Å; R385-E468 IonicContact NH2-OE2 3.82Å; R385-E468 PolarHBondContact NH2-OE2 3.17Å
386	R	54.3	Low	63	Low	156 Å²	156	88.2 Å²	88.2	59%	0.589	41%	0.406	S	S	*	.	H	α-helix	trans	-60.7	-38.3	174.2	-164.4	-178.5	-173.7	-69.9	3.2	112.9	A382 K384 F388 M389 D390	A382-R386 WeakPolarHBondContact O-CB 3.44Å; A382-R386 PolarHBondContact O-N 3.18Å; K384-R386 VanDerWaalsContact C-N 3.34Å; K384-R386 PolarHBondContact O-N 2.81Å; R386-F388 VanDerWaalsContact C-N 3.34Å; R386-M389 PolarHBondContact O-N 3.44Å; R386-D390 IonicContact NH1-OD2 2.74Å; R386-D390 PolarHBondContact NH1-OD2 3.45Å; R386-D390 PolarHBondContact O-N 2.93Å
387	G	60.5	Low	64.5	Low	29 Å²	29	84 Å²	84	30%	0.299	39%	0.39	S	S	.	.	H	α-helix	trans	-71.6	-24.3	173.4	0	0	0	0	0	114.1	R383 K384 R385 R391	R383-G387 PolarHBondContact O-N 3.26Å; K384-G387 PolarHBondContact O-N 3.22Å; R385-G387 VanDerWaalsContact C-N 3.32Å; R385-G387 PolarHBondContact O-N 3.15Å; G387-R391 WeakPolarHBondContact O-CG 3.29Å; G387-R391 PolarHBondContact O-NE 2.92Å
388	F	67.4	Low	66.1	Low	74 Å²	74	78.8 Å²	78.8	33%	0.325	37%	0.367	S	S	.	.	H	α-helix	trans	-72	-47.8	167.3	178.7	-108	0	0	0	110.9	K384 R385 R386 D390 R391 L392 L455 T461	K384-F388 PolarHBondContact O-N 3.45Å; K384-F388 VanDerWaalsContact O-N 3.13Å; R385-F388 CarbonylContact O-C 3.57Å; R385-F388 WeakPolarHBondContact O-CA 3.38Å; R385-F388 WeakPolarHBondContact O-CB 3.39Å; R385-F388 PolarHBondContact O-N 2.89Å; R386-F388 VanDerWaalsContact C-N 3.34Å; F388-D390 VanDerWaalsContact C-N 3.33Å; F388-D390 PolarHBondContact O-N 3.13Å; F388-R391 WeakPolarHBondContact O-CA 3.32Å; F388-R391 WeakPolarHBondContact O-CB 3.15Å; F388-R391 PolarHBondContact O-N 2.95Å; F388-L392 HydrophobicContact CD1-CD1 4.13Å; F388-L392 HydrophobicContact CD1-CG 4.5Å; F388-L392 HydrophobicContact CE1-CD1 3.61Å; F388-L392 HydrophobicContact CE1-CG 4.3Å; F388-L392 HydrophobicContact CE2-CD2 4.27Å; F388-L392 HydrophobicContact CZ-CD1 3.87Å; F388-L392 HydrophobicContact CZ-CD2 4.26Å; F388-L392 HydrophobicContact CZ-CG 4.34Å; F388-L392 PolarHBondContact O-N 3.05Å; F388-L392 VanDerWaalsContact O-N 3.1Å; F388-L455 HydrophobicContact CE2-CD1 4.01Å; F388-L455 HydrophobicContact CZ-CD1 3.69Å; F388-L455 HydrophobicContact CZ-CD2 4.02Å; F388-T461 HydrophobicContact CE1-CG2 4.14Å
389	M	66.8	Low	67.7	Low	30 Å²	30	71.7 Å²	71.7	15%	0.148	34%	0.337	C	S	.	.	H	α-helix	trans	-56	-43.7	174.5	-61.5	170.5	-161	0	0	112.6	R385 R386 R391 L392 M393 I465	R385-M389 HydrophobicContact CB-CE 3.99Å; R385-M389 VanDerWaalsContact O-CG 3.27Å; R385-M389 WeakPolarHBondContact O-CG 3.27Å; R385-M389 PolarHBondContact O-N 3.4Å; R386-M389 PolarHBondContact O-N 3.44Å; M389-R391 PolarHBondContact O-N 3.39Å; M389-L392 PolarHBondContact O-N 2.9Å; M389-M393 PolarHBondContact O-N 3.42Å; M389-M393 VanDerWaalsContact O-N 3.16Å; M389-I465 HydrophobicContact CE-CG1 3.79Å; M389-I465 HydrophobicContact CE-CG2 4.4Å; M389-I465 HydrophobicContact CG-CD1 3.67Å; M389-I465 HydrophobicContact CG-CG1 3.95Å; M389-I465 HydrophobicContact SD-CD1 4.27Å; M389-I465 HydrophobicContact SD-CG1 3.95Å; M389-I465 HydrophobicContact SD-CG2 3.91Å
390	D	67.1	Low	69.3	Low	66 Å²	66	72.1 Å²	72.1	35%	0.353	34%	0.337	S	S	.	.	H	α-helix	trans	-64	-19.6	176.3	-80.6	-46.5	0	0	0	113.1	R386 F388 M393 R402	R386-D390 IonicContact NH1-OD2 2.74Å; R386-D390 PolarHBondContact NH1-OD2 3.45Å; R386-D390 PolarHBondContact O-N 2.93Å; F388-D390 VanDerWaalsContact C-N 3.33Å; F388-D390 PolarHBondContact O-N 3.13Å; D390-M393 HydrophobicContact CB-CE 4.36Å; D390-M393 WeakPolarHBondContact OD1-CE 3.43Å; D390-R402 IonicContact OD1-NH1 3.97Å
391	R	70.9	Confident	70.7	Confident	78 Å²	78	69.1 Å²	69.1	29%	0.294	32%	0.322	S	S	.	.	H	α-helix	trans	-91.4	-25.3	175.2	-75.3	177.8	-72.5	176	6.4	113.9	G387 F388 M389 E564	G387-R391 WeakPolarHBondContact O-CG 3.29Å; G387-R391 PolarHBondContact O-NE 2.92Å; F388-R391 WeakPolarHBondContact O-CA 3.32Å; F388-R391 WeakPolarHBondContact O-CB 3.15Å; F388-R391 PolarHBondContact O-N 2.95Å; M389-R391 PolarHBondContact O-N 3.39Å; R391-E564 PolarHBondContact NH1-O 3.45Å
392	L	75	Confident	72.2	Confident	15 Å²	15	70.2 Å²	70.2	8%	0.079	32%	0.322	C	S	.	.	H	α-helix	trans	-81	-20.5	172.8	-56.2	-168.5	0	0	0	113.3	F388 M389 F394 V452 L455 T461	F388-L392 HydrophobicContact CD1-CD1 4.13Å; F388-L392 HydrophobicContact CD1-CG 4.5Å; F388-L392 HydrophobicContact CE1-CD1 3.61Å; F388-L392 HydrophobicContact CE1-CG 4.3Å; F388-L392 HydrophobicContact CE2-CD2 4.27Å; F388-L392 HydrophobicContact CZ-CD1 3.87Å; F388-L392 HydrophobicContact CZ-CD2 4.26Å; F388-L392 HydrophobicContact CZ-CG 4.34Å; F388-L392 PolarHBondContact O-N 3.05Å; F388-L392 VanDerWaalsContact O-N 3.1Å; M389-L392 PolarHBondContact O-N 2.9Å; L392-F394 PolarHBondContact O-N 3.2Å; L392-V452 HydrophobicContact CB-CG2 4.37Å; L392-V452 HydrophobicContact CD2-CG2 4.28Å; L392-L455 HydrophobicContact CD1-CD1 4.07Å; L392-L455 HydrophobicContact CD2-CD1 3.25Å; L392-L455 HydrophobicContact CG-CD1 4.29Å; L392-T461 HydrophobicContact CD1-CG2 4.17Å
393	M	81.6	Confident	73.5	Confident	31 Å²	31	67.9 Å²	67.9	15%	0.153	30%	0.303	C	S	.	.	S	Bend	trans	-71	116	175.1	-78.8	-172.7	-75.2	0	0	111.5	M389 D390 A395 S403 F404	M389-M393 PolarHBondContact O-N 3.42Å; M389-M393 VanDerWaalsContact O-N 3.16Å; D390-M393 HydrophobicContact CB-CE 4.36Å; D390-M393 WeakPolarHBondContact OD1-CE 3.43Å; M393-A395 PolarHBondContact O-N 2.91Å; M393-S403 CarbonylContact C-O 3.55Å; M393-S403 VanDerWaalsContact CA-O 3.28Å; M393-S403 WeakPolarHBondContact CA-O 3.36Å; M393-F404 HydrophobicContact CE-CZ 4.34Å; M393-F404 HydrophobicContact CG-CD1 3.64Å; M393-F404 HydrophobicContact CG-CD2 4.18Å; M393-F404 HydrophobicContact CG-CE1 3.31Å; M393-F404 HydrophobicContact CG-CE2 3.87Å; M393-F404 HydrophobicContact CG-CG 4.07Å; M393-F404 HydrophobicContact CG-CZ 3.43Å; M393-F404 VanDerWaalsContact CG-CZ 3.43Å; M393-F404 HydrophobicContact SD-CE1 4.12Å; M393-F404 HydrophobicContact SD-CE2 3.86Å; M393-F404 HydrophobicContact SD-CZ 3.59Å; M393-F404 VanDerWaalsContact SD-CZ 3.59Å
394	F	81.8	Confident	74.5	Confident	3 Å²	3	59.4 Å²	59.4	1%	0.013	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	124.1	159.3	-61.6	-78.1	0	0	0	109.2	L392 R402 S403 K406 M409 F445 T448 A449 V452	L392-F394 PolarHBondContact O-N 3.2Å; F394-R402 CarbonylContact O-C 3.56Å; F394-R402 VanDerWaalsContact O-CA 3.28Å; F394-R402 WeakPolarHBondContact O-CA 3.27Å; F394-S403 PolarHBondContact N-O 2.84Å; F394-S403 PolarHBondContact O-N 2.74Å; F394-K406 HydrophobicContact CE2-CB 4.11Å; F394-K406 HydrophobicContact CZ-CB 4Å; F394-K406 HydrophobicContact CZ-CG 4.29Å; F394-M409 HydrophobicContact CB-CB 3.91Å; F394-M409 HydrophobicContact CB-CE 3.5Å; F394-M409 VanDerWaalsContact CB-CE 3.5Å; F394-M409 HydrophobicContact CB-CG 3.99Å; F394-M409 HydrophobicContact CG-CB 4.21Å; F394-M409 VanDerWaalsContact O-CE 3.26Å; F394-M409 WeakPolarHBondContact O-CE 3.48Å; F394-F445 AromaticContact CD1-CD2 3.56Å; F394-F445 HydrophobicContact CD1-CD2 3.56Å; F394-F445 AromaticContact CD1-CE2 3.64Å; F394-F445 HydrophobicContact CD1-CE2 3.64Å; F394-F445 AromaticContact CE1-CD2 3.83Å; F394-F445 HydrophobicContact CE1-CD2 3.83Å; F394-F445 AromaticContact CE1-CE2 3.59Å; F394-F445 HydrophobicContact CE1-CE2 3.59Å; F394-F445 HydrophobicContact CG-CE2 4.47Å; F394-F445 HydrophobicContact CZ-CE2 4.41Å; F394-T448 HydrophobicContact CD1-CG2 3.66Å; F394-T448 HydrophobicContact CE1-CG2 3.91Å; F394-T448 HydrophobicContact CG-CG2 4.23Å; F394-A449 HydrophobicContact CE1-CB 3.87Å; F394-A449 HydrophobicContact CZ-CB 4.23Å; F394-V452 HydrophobicContact CE2-CG1 4.46Å; F394-V452 HydrophobicContact CE2-CG2 4.32Å; F394-V452 HydrophobicContact CZ-CB 4.22Å; F394-V452 HydrophobicContact CZ-CG1 4.4Å; F394-V452 HydrophobicContact CZ-CG2 4.17Å
395	A	85.4	Confident	75.7	Confident	29 Å²	29	55.8 Å²	55.8	24%	0.24	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	111.4	-176.9	0	0	0	0	0	113.3	M393 S397 F401 R402 K444	M393-A395 PolarHBondContact O-N 2.91Å; A395-S397 PolarHBondContact O-N 3.36Å; A395-F401 CarbonylContact C-O 3.54Å; A395-F401 WeakPolarHBondContact CA-O 3.46Å; A395-R402 HydrophobicContact CB-CG 4.12Å; A395-K444 PolarHBondContact O-NZ 2.62Å
396	C	87.7	Confident	76.9	Confident	5 Å²	5	56.7 Å²	56.7	3%	0.034	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	111.4	172.1	179.5	0	0	0	0	109.7	V398 C399 K400 F401 M409	C396-V398 PolarHBondContact O-N 2.81Å; C396-C399 HydrophobicContact CB-CB 4.26Å; C396-K400 VanDerWaalsContact O-CA 3.31Å; C396-K400 WeakPolarHBondContact O-CA 3.42Å; C396-K400 PolarHBondContact O-N 2.82Å; C396-F401 HydrophobicContact CB-CB 4.33Å; C396-F401 PolarHBondContact N-O 2.63Å; C396-F401 PolarHBondContact O-N 2.97Å; C396-M409 HydrophobicContact CB-CE 4.41Å; C396-M409 HydrophobicContact CB-SD 4.18Å
397	S	79.2	Confident	78.4	Confident	35 Å²	35	56.7 Å²	56.7	25%	0.245	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-34.4	-175.7	53.9	0	0	0	0	113	A395 M441 V530 I534	A395-S397 PolarHBondContact O-N 3.36Å; S397-M441 VanDerWaalsContact OG-CE 3.26Å; S397-M441 WeakPolarHBondContact OG-CE 3.14Å; S397-M441 PolarHBondContact OG-SD 3.28Å; S397-M441 VanDerWaalsContact OG-SD 3.37Å; S397-V530 WeakPolarHBondContact O-CG1 3.34Å; S397-I534 VanDerWaalsContact OG-CD1 3.31Å; S397-I534 WeakPolarHBondContact OG-CD1 3.27Å
398	V	82.6	Confident	79.6	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.018	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-45.6	-180	177.3	0	0	0	0	111	C396 F422 L425 M441 S527	C396-V398 PolarHBondContact O-N 2.81Å; V398-F422 HydrophobicContact CB-CE2 4.13Å; V398-F422 HydrophobicContact CG1-CD2 4.45Å; V398-F422 HydrophobicContact CG1-CE2 3.83Å; V398-F422 HydrophobicContact CG1-CZ 4.39Å; V398-F422 HydrophobicContact CG2-CE2 4.25Å; V398-F422 HydrophobicContact CG2-CZ 4.12Å; V398-L425 HydrophobicContact CG1-CD1 3.72Å; V398-M441 HydrophobicContact CG2-CG 4.3Å; V398-M441 HydrophobicContact CG2-SD 4.19Å; V398-S527 WeakPolarHBondContact O-CB 3.4Å
399	C	82.8	Confident	80.3	Confident	13 Å²	13	56.5 Å²	56.5	9%	0.088	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-9.5	-176.7	-68.2	0	0	0	0	114.1	C396 F401 H412 F417 H418	C396-C399 HydrophobicContact CB-CB 4.26Å; C399-F401 HydrophobicContact CB-CB 4.32Å; C399-F401 PolarHBondContact O-N 3.38Å; C399-H412 VanDerWaalsContact CB-CE1 3.41Å; C399-H412 WeakPolarHBondContact CB-CE1 3.07Å; C399-H412 WeakPolarHBondContact CB-NE2 3.5Å; C399-H412 PolarHBondContact SG-NE2 3.43Å; C399-F417 HydrophobicContact CB-CD1 4.36Å; C399-F417 HydrophobicContact CB-CE1 3.85Å; C399-H418 PolarHBondContact SG-ND1 2.92Å
400	K	83.2	Confident	81.2	Confident	155 Å²	155	57.6 Å²	57.6	67%	0.674	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	20	-168.6	-58.4	-179.2	-179.8	176.6	0	114.5	C396	C396-K400 VanDerWaalsContact O-CA 3.31Å; C396-K400 WeakPolarHBondContact O-CA 3.42Å; C396-K400 PolarHBondContact O-N 2.82Å
401	F	82.5	Confident	82.3	Confident	61 Å²	61	57.3 Å²	57.3	27%	0.268	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	143.1	176.1	-178.4	-107.8	0	0	0	110.6	A395 C396 C399 E408 M409 H412	A395-F401 CarbonylContact C-O 3.54Å; A395-F401 WeakPolarHBondContact CA-O 3.46Å; C396-F401 HydrophobicContact CB-CB 4.33Å; C396-F401 PolarHBondContact N-O 2.63Å; C396-F401 PolarHBondContact O-N 2.97Å; C399-F401 HydrophobicContact CB-CB 4.32Å; C399-F401 PolarHBondContact O-N 3.38Å; F401-E408 WeakPolarHBondContact CE1-O 3.43Å; F401-E408 HydrophobicContact CZ-CB 4.3Å; F401-M409 HydrophobicContact CD1-CE 3.52Å; F401-M409 HydrophobicContact CD1-SD 3.87Å; F401-M409 HydrophobicContact CE1-CE 3.88Å; F401-M409 HydrophobicContact CE1-SD 4.22Å; F401-H412 VanDerWaalsContact CB-CE1 3.4Å; F401-H412 WeakPolarHBondContact CB-CE1 3.33Å; F401-H412 HydrophobicContact CD1-CB 3.56Å; F401-H412 AromaticContact CD1-CD2 3.65Å; F401-H412 AromaticContact CD1-CG 3.3Å; F401-H412 AromaticContact CD1-ND1 3.67Å; F401-H412 AromaticContact CD2-ND1 3.95Å; F401-H412 HydrophobicContact CE1-CB 3.53Å; F401-H412 AromaticContact CE1-CG 3.83Å; F401-H412 HydrophobicContact CG-CB 4.27Å; F401-H412 AromaticContact CG-CE1 3.75Å; F401-H412 AromaticContact CG-CG 3.65Å; F401-H412 AromaticContact CG-ND1 3.48Å; F401-H412 WeakPolarHBondContact CG-ND1 3.06Å; F401-H412 HydrophobicContact CZ-CB 4.19Å
402	R	86.5	Confident	83.1	Confident	160 Å²	160	54.3 Å²	54.3	60%	0.604	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.6	134	178	-64.8	-176.5	177.9	-154.9	-5.3	109.1	D390 F394 A395	D390-R402 IonicContact OD1-NH1 3.97Å; F394-R402 CarbonylContact O-C 3.56Å; F394-R402 VanDerWaalsContact O-CA 3.28Å; F394-R402 WeakPolarHBondContact O-CA 3.27Å; A395-R402 HydrophobicContact CB-CG 4.12Å
403	S	80.1	Confident	83.6	Confident	5 Å²	5	54.5 Å²	54.5	4%	0.035	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	160.3	172.7	-178.1	0	0	0	0	110.6	M393 F394 Y405 E408	M393-S403 CarbonylContact C-O 3.55Å; M393-S403 VanDerWaalsContact CA-O 3.28Å; M393-S403 WeakPolarHBondContact CA-O 3.36Å; F394-S403 PolarHBondContact N-O 2.84Å; F394-S403 PolarHBondContact O-N 2.74Å; S403-Y405 PolarHBondContact OG-N 3.35Å; S403-E408 VanDerWaalsContact CB-OE2 3.23Å; S403-E408 WeakPolarHBondContact CB-OE2 3.33Å; S403-E408 WeakPolarHBondContact OG-CB 3.46Å; S403-E408 PolarHBondContact OG-OE2 2.94Å
404	F	76.1	Confident	83.8	Confident	35 Å²	35	59.4 Å²	59.4	15%	0.154	29%	0.286	C	S	.	.	S	Bend	trans	-93.2	-16.7	166.7	-68.1	-84.2	0	0	0	112.7	M393 I462 I465	M393-F404 HydrophobicContact CE-CZ 4.34Å; M393-F404 HydrophobicContact CG-CD1 3.64Å; M393-F404 HydrophobicContact CG-CD2 4.18Å; M393-F404 HydrophobicContact CG-CE1 3.31Å; M393-F404 HydrophobicContact CG-CE2 3.87Å; M393-F404 HydrophobicContact CG-CG 4.07Å; M393-F404 HydrophobicContact CG-CZ 3.43Å; M393-F404 VanDerWaalsContact CG-CZ 3.43Å; M393-F404 HydrophobicContact SD-CE1 4.12Å; M393-F404 HydrophobicContact SD-CE2 3.86Å; M393-F404 HydrophobicContact SD-CZ 3.59Å; M393-F404 VanDerWaalsContact SD-CZ 3.59Å; F404-I462 HydrophobicContact CB-CD1 3.81Å; F404-I462 HydrophobicContact CB-CG1 4.08Å; F404-I462 HydrophobicContact CD1-CG1 4.34Å; F404-I462 HydrophobicContact CG-CG1 4.39Å; F404-I465 HydrophobicContact CE1-CD1 4.34Å
405	Y	80.2	Confident	84.1	Confident	91 Å²	91	60.7 Å²	60.7	36%	0.357	30%	0.295	S	S	.	.			trans	-97.5	138.8	-175.8	-61	-74.1	0	0	0	110.9	S403 M409 I462	S403-Y405 PolarHBondContact OG-N 3.35Å; Y405-M409 PolarHBondContact O-N 3.45Å; Y405-I462 HydrophobicContact CE1-CD1 4.26Å
406	K	83.4	Confident	84.1	Confident	116 Å²	116	69.7 Å²	69.7	50%	0.504	32%	0.323	S	S	.	.	H	α-helix	trans	-64.8	-49.2	178	-173.2	-168.1	167.5	-166.2	0	110.5	F394 E408 M409 D410 F445	F394-K406 HydrophobicContact CE2-CB 4.11Å; F394-K406 HydrophobicContact CZ-CB 4Å; F394-K406 HydrophobicContact CZ-CG 4.29Å; K406-E408 VanDerWaalsContact C-N 3.34Å; K406-E408 PolarHBondContact O-N 3.5Å; K406-M409 WeakPolarHBondContact O-CA 3.49Å; K406-M409 WeakPolarHBondContact O-CB 3.4Å; K406-M409 PolarHBondContact O-N 3.5Å; K406-D410 WeakPolarHBondContact CE-OD2 3.46Å; K406-D410 PolarHBondContact O-N 3.46Å; K406-F445 HydrophobicContact CD-CZ 4.43Å; K406-F445 HydrophobicContact CG-CE2 4Å; K406-F445 HydrophobicContact CG-CZ 3.64Å
407	E	85.6	Confident	83.9	Confident	157 Å²	157	73 Å²	73	73%	0.734	34%	0.337	S	S	*	.	H	α-helix	trans	-52.7	-45.5	178.6	-66.5	149.4	-138.6	0	0	112.9	M409 D410 A411	E407-M409 VanDerWaalsContact C-N 3.27Å; E407-M409 PolarHBondContact O-N 2.99Å; E407-D410 PolarHBondContact O-N 3.04Å; E407-A411 VanDerWaalsContact O-CB 3.25Å; E407-A411 WeakPolarHBondContact O-CB 3.42Å; E407-A411 PolarHBondContact O-N 3.24Å
408	E	85.3	Confident	84.2	Confident	95 Å²	95	71.5 Å²	71.5	44%	0.444	33%	0.326	S	S	.	.	H	α-helix	trans	-64.6	-30.1	177.3	-72.5	-172.7	-176.4	0	0	112.8	F401 S403 K406 H412	F401-E408 WeakPolarHBondContact CE1-O 3.43Å; F401-E408 HydrophobicContact CZ-CB 4.3Å; S403-E408 VanDerWaalsContact CB-OE2 3.23Å; S403-E408 WeakPolarHBondContact CB-OE2 3.33Å; S403-E408 WeakPolarHBondContact OG-CB 3.46Å; S403-E408 PolarHBondContact OG-OE2 2.94Å; K406-E408 VanDerWaalsContact C-N 3.34Å; K406-E408 PolarHBondContact O-N 3.5Å; E408-H412 WeakPolarHBondContact O-CB 3.31Å; E408-H412 PolarHBondContact O-N 3.37Å
409	M	82.9	Confident	84.5	Confident	4 Å²	4	76.4 Å²	76.4	2%	0.02	35%	0.347	C	S	.	.	H	α-helix	trans	-79.7	-39.4	176	-174.2	58.8	69.5	0	0	112.1	F394 C396 F401 Y405 K406 E407 H412 L413 F445	F394-M409 HydrophobicContact CB-CB 3.91Å; F394-M409 HydrophobicContact CB-CE 3.5Å; F394-M409 VanDerWaalsContact CB-CE 3.5Å; F394-M409 HydrophobicContact CB-CG 3.99Å; F394-M409 HydrophobicContact CG-CB 4.21Å; F394-M409 VanDerWaalsContact O-CE 3.26Å; F394-M409 WeakPolarHBondContact O-CE 3.48Å; C396-M409 HydrophobicContact CB-CE 4.41Å; C396-M409 HydrophobicContact CB-SD 4.18Å; F401-M409 HydrophobicContact CD1-CE 3.52Å; F401-M409 HydrophobicContact CD1-SD 3.87Å; F401-M409 HydrophobicContact CE1-CE 3.88Å; F401-M409 HydrophobicContact CE1-SD 4.22Å; Y405-M409 PolarHBondContact O-N 3.45Å; K406-M409 WeakPolarHBondContact O-CA 3.49Å; K406-M409 WeakPolarHBondContact O-CB 3.4Å; K406-M409 PolarHBondContact O-N 3.5Å; E407-M409 VanDerWaalsContact C-N 3.27Å; E407-M409 PolarHBondContact O-N 2.99Å; M409-H412 WeakPolarHBondContact O-CB 3.26Å; M409-H412 PolarHBondContact O-N 2.89Å; M409-H412 VanDerWaalsContact O-N 3.16Å; M409-H412 HydrophobicContact SD-CB 4.29Å; M409-L413 WeakPolarHBondContact O-CG 3.27Å; M409-L413 PolarHBondContact O-N 3.49Å; M409-F445 HydrophobicContact CB-CD2 4.12Å; M409-F445 HydrophobicContact CB-CE2 3.86Å; M409-F445 HydrophobicContact CG-CD2 3.5Å; M409-F445 HydrophobicContact CG-CE2 3.78Å; M409-F445 HydrophobicContact CG-CG 4.41Å
410	D	86.1	Confident	84.7	Confident	52 Å²	52	78.3 Å²	78.3	28%	0.278	36%	0.357	S	S	.	.	H	α-helix	trans	-61	-51.2	172.9	-74.3	-41.5	0	0	0	110.1	K406 E407 H412 L413 E414 F445	K406-D410 WeakPolarHBondContact CE-OD2 3.46Å; K406-D410 PolarHBondContact O-N 3.46Å; E407-D410 PolarHBondContact O-N 3.04Å; D410-H412 PolarHBondContact O-N 2.83Å; D410-L413 PolarHBondContact O-N 3.26Å; D410-L413 VanDerWaalsContact O-N 3.11Å; D410-E414 PolarHBondContact O-N 3.33Å; D410-F445 VanDerWaalsContact CG-CZ 3.49Å; D410-F445 WeakPolarHBondContact OD1-CE1 3.22Å; D410-F445 WeakPolarHBondContact OD1-CZ 3.09Å; D410-F445 WeakPolarHBondContact OD2-CZ 3.27Å
411	A	89.5	Confident	84.8	Confident	60 Å²	60	71 Å²	71	50%	0.496	33%	0.325	S	S	.	.	H	α-helix	trans	-57.7	-33.5	172.3	0	0	0	0	0	112.7	E407 S415	E407-A411 VanDerWaalsContact O-CB 3.25Å; E407-A411 WeakPolarHBondContact O-CB 3.42Å; E407-A411 PolarHBondContact O-N 3.24Å; A411-S415 WeakPolarHBondContact O-CA 3.47Å; A411-S415 VanDerWaalsContact O-CB 3.27Å; A411-S415 WeakPolarHBondContact O-CB 3.32Å; A411-S415 PolarHBondContact O-N 3.44Å
412	H	88.8	Confident	84.9	Confident	15 Å²	15	69.1 Å²	69.1	7%	0.069	32%	0.316	C	S	.	.	H	α-helix	trans	-66.8	-48	173.6	175.6	73.6	0	0	0	112.7	C399 F401 E408 M409 D410 E414 S415 F417 H418	C399-H412 VanDerWaalsContact CB-CE1 3.41Å; C399-H412 WeakPolarHBondContact CB-CE1 3.07Å; C399-H412 WeakPolarHBondContact CB-NE2 3.5Å; C399-H412 PolarHBondContact SG-NE2 3.43Å; F401-H412 VanDerWaalsContact CB-CE1 3.4Å; F401-H412 WeakPolarHBondContact CB-CE1 3.33Å; F401-H412 HydrophobicContact CD1-CB 3.56Å; F401-H412 AromaticContact CD1-CD2 3.65Å; F401-H412 AromaticContact CD1-CG 3.3Å; F401-H412 AromaticContact CD1-ND1 3.67Å; F401-H412 AromaticContact CD2-ND1 3.95Å; F401-H412 HydrophobicContact CE1-CB 3.53Å; F401-H412 AromaticContact CE1-CG 3.83Å; F401-H412 HydrophobicContact CG-CB 4.27Å; F401-H412 AromaticContact CG-CE1 3.75Å; F401-H412 AromaticContact CG-CG 3.65Å; F401-H412 AromaticContact CG-ND1 3.48Å; F401-H412 WeakPolarHBondContact CG-ND1 3.06Å; F401-H412 HydrophobicContact CZ-CB 4.19Å; E408-H412 WeakPolarHBondContact O-CB 3.31Å; E408-H412 PolarHBondContact O-N 3.37Å; M409-H412 WeakPolarHBondContact O-CB 3.26Å; M409-H412 PolarHBondContact O-N 2.89Å; M409-H412 VanDerWaalsContact O-N 3.16Å; M409-H412 HydrophobicContact SD-CB 4.29Å; D410-H412 PolarHBondContact O-N 2.83Å; H412-E414 PolarHBondContact O-N 3.45Å; H412-S415 VanDerWaalsContact O-CB 3.27Å; H412-S415 WeakPolarHBondContact O-CB 3.13Å; H412-S415 PolarHBondContact O-N 2.96Å; H412-S415 VanDerWaalsContact O-N 3.11Å; H412-S415 PolarHBondContact O-OG 3.36Å; H412-F417 AromaticContact CE1-CD1 3.93Å; H412-H418 AromaticContact NE2-ND1 3.82Å; H412-H418 WeakPolarHBondContact O-CB 3.33Å
413	L	85.4	Confident	85	Confident	19 Å²	19	67.2 Å²	67.2	10%	0.099	31%	0.313	C	S	.	.	H	α-helix	trans	-62.1	-35.4	179.2	-68.5	173.9	0	0	0	111.4	M409 D410 H418 F445	M409-L413 WeakPolarHBondContact O-CG 3.27Å; M409-L413 PolarHBondContact O-N 3.49Å; D410-L413 PolarHBondContact O-N 3.26Å; D410-L413 VanDerWaalsContact O-N 3.11Å; L413-H418 VanDerWaalsContact CD2-CE1 3.48Å; L413-H418 WeakPolarHBondContact CD2-CE1 3.03Å; L413-H418 PolarHBondContact O-CD2 3.1Å; L413-F445 HydrophobicContact CD1-CB 4.39Å; L413-F445 HydrophobicContact CD1-CD1 4.35Å; L413-F445 HydrophobicContact CD1-CG 4.25Å
414	E	84.9	Confident	85.2	Confident	134 Å²	134	69.7 Å²	69.7	63%	0.626	32%	0.323	S	S	*	.	H	α-helix	trans	-82.6	-16	176	-65.8	-174.3	-176.2	0	0	114.1	D410 H412 K419	D410-E414 PolarHBondContact O-N 3.33Å; H412-E414 PolarHBondContact O-N 3.45Å; E414-K419 VanDerWaalsContact O-CD 3.3Å; E414-K419 WeakPolarHBondContact O-CD 3.18Å; E414-K419 WeakPolarHBondContact O-CE 3.41Å; E414-K419 PolarHBondContact O-NZ 3.2Å
415	S	88.9	Confident	85.6	Confident	31 Å²	31	68 Å²	68	22%	0.217	32%	0.316	C	S	.	.	S	Bend	trans	-58.8	150.5	-176.9	74.3	0	0	0	0	112.8	A411 H412 F417 H418 K419	A411-S415 WeakPolarHBondContact O-CA 3.47Å; A411-S415 VanDerWaalsContact O-CB 3.27Å; A411-S415 WeakPolarHBondContact O-CB 3.32Å; A411-S415 PolarHBondContact O-N 3.44Å; H412-S415 VanDerWaalsContact O-CB 3.27Å; H412-S415 WeakPolarHBondContact O-CB 3.13Å; H412-S415 PolarHBondContact O-N 2.96Å; H412-S415 VanDerWaalsContact O-N 3.11Å; H412-S415 PolarHBondContact O-OG 3.36Å; S415-F417 PolarHBondContact O-N 3.39Å; S415-F417 VanDerWaalsContact O-N 3.13Å; S415-F417 PolarHBondContact OG-N 3.44Å; S415-H418 PolarHBondContact O-N 2.78Å; S415-H418 PolarHBondContact OG-N 3.04Å; S415-H418 VanDerWaalsContact OG-N 3.1Å; S415-K419 WeakPolarHBondContact O-CB 3.49Å; S415-K419 WeakPolarHBondContact O-CG 3.32Å; S415-K419 PolarHBondContact O-N 3.38Å
416	R	83.9	Confident	85.7	Confident	217 Å²	217	65.9 Å²	65.9	82%	0.819	31%	0.314	S	S	*	.	H	α-helix	trans	-55.5	-28.8	168.6	-59.8	-176.1	-174.2	-168.1	2.3	111.6	D420	R416-D420 WeakPolarHBondContact O-CB 3.49Å; R416-D420 VanDerWaalsContact O-CG 3.25Å; R416-D420 PolarHBondContact O-N 2.9Å
417	F	83	Confident	85.9	Confident	76 Å²	76	66.6 Å²	66.6	33%	0.333	32%	0.323	S	S	.	.	H	α-helix	trans	-65.2	-53.6	177.5	-176.1	-85.5	0	0	0	112	C399 H412 S415 D420 H421 M520 A523	C399-F417 HydrophobicContact CB-CD1 4.36Å; C399-F417 HydrophobicContact CB-CE1 3.85Å; H412-F417 AromaticContact CE1-CD1 3.93Å; S415-F417 PolarHBondContact O-N 3.39Å; S415-F417 VanDerWaalsContact O-N 3.13Å; S415-F417 PolarHBondContact OG-N 3.44Å; F417-D420 PolarHBondContact O-N 2.77Å; F417-H421 AromaticContact CD1-CE1 3.82Å; F417-H421 AromaticContact CD1-ND1 3.69Å; F417-H421 AromaticContact CD2-CE1 3.87Å; F417-H421 AromaticContact CE1-CE1 3.37Å; F417-H421 WeakPolarHBondContact CE1-CE1 3.19Å; F417-H421 AromaticContact CE1-ND1 3.62Å; F417-H421 AromaticContact CE2-CE1 3.45Å; F417-H421 VanDerWaalsContact CE2-CE1 3.45Å; F417-H421 WeakPolarHBondContact CE2-CE1 3.45Å; F417-H421 AromaticContact CZ-CE1 3.19Å; F417-H421 WeakPolarHBondContact CZ-CE1 3.37Å; F417-H421 AromaticContact CZ-ND1 3.91Å; F417-H421 AromaticContact CZ-NE2 3.78Å; F417-H421 PolarHBondContact O-N 3.29Å; F417-H421 PolarHBondContact O-ND1 2.59Å; F417-M520 HydrophobicContact CD2-CE 3.88Å; F417-M520 HydrophobicContact CD2-SD 3.49Å; F417-M520 WeakPolarHBondContact CD2-SD 3.46Å; F417-M520 HydrophobicContact CE2-CE 4.31Å; F417-M520 HydrophobicContact CE2-SD 3.49Å; F417-M520 WeakPolarHBondContact CE2-SD 3.17Å; F417-M520 HydrophobicContact CG-CE 4.4Å; F417-A523 HydrophobicContact CZ-CB 4.37Å
418	H	87.3	Confident	85.6	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.009	31%	0.309	C	S	.	.	H	α-helix	trans	-63.4	-47.7	178.2	-176.9	90.6	0	0	0	110.8	C399 H412 L413 S415 D420 H421 F422 Q438	C399-H418 PolarHBondContact SG-ND1 2.92Å; H412-H418 AromaticContact NE2-ND1 3.82Å; H412-H418 WeakPolarHBondContact O-CB 3.33Å; L413-H418 VanDerWaalsContact CD2-CE1 3.48Å; L413-H418 WeakPolarHBondContact CD2-CE1 3.03Å; L413-H418 PolarHBondContact O-CD2 3.1Å; S415-H418 PolarHBondContact O-N 2.78Å; S415-H418 PolarHBondContact OG-N 3.04Å; S415-H418 VanDerWaalsContact OG-N 3.1Å; H418-D420 VanDerWaalsContact C-N 3.31Å; H418-D420 PolarHBondContact O-N 3.09Å; H418-H421 PolarHBondContact O-N 3.09Å; H418-H421 VanDerWaalsContact O-N 3.09Å; H418-F422 AromaticContact CD2-CD2 3.76Å; H418-F422 AromaticContact CE1-CD2 3.59Å; H418-F422 AromaticContact CE1-CE2 3.12Å; H418-F422 WeakPolarHBondContact CE1-CE2 3.12Å; H418-F422 AromaticContact CE1-CZ 3.95Å; H418-F422 AromaticContact ND1-CE2 3.79Å; H418-F422 AromaticContact NE2-CD2 3.39Å; H418-F422 WeakPolarHBondContact NE2-CD2 3.29Å; H418-F422 AromaticContact NE2-CE2 3.29Å; H418-F422 VanDerWaalsContact NE2-CE2 3.29Å; H418-F422 WeakPolarHBondContact NE2-CE2 3.39Å; H418-F422 AromaticContact NE2-CZ 4Å; H418-F422 PolarHBondContact O-N 2.83Å; H418-Q438 PolarHBondContact NE2-OE1 3.25Å
419	K	87.4	Confident	85.3	Confident	106 Å²	106	60.7 Å²	60.7	46%	0.461	30%	0.297	S	S	.	.	H	α-helix	trans	-55.5	-41.8	176.3	-70.9	170.3	177	160.3	0	112.3	E414 S415 F422 K423	E414-K419 VanDerWaalsContact O-CD 3.3Å; E414-K419 WeakPolarHBondContact O-CD 3.18Å; E414-K419 WeakPolarHBondContact O-CE 3.41Å; E414-K419 PolarHBondContact O-NZ 3.2Å; S415-K419 WeakPolarHBondContact O-CB 3.49Å; S415-K419 WeakPolarHBondContact O-CG 3.32Å; S415-K419 PolarHBondContact O-N 3.38Å; K419-F422 PolarHBondContact O-N 3.22Å; K419-K423 VanDerWaalsContact O-CG 3.27Å; K419-K423 WeakPolarHBondContact O-CG 3.48Å; K419-K423 PolarHBondContact O-N 3.19Å
420	D	87.1	Confident	85.3	Confident	54 Å²	54	63.7 Å²	63.7	29%	0.289	32%	0.318	S	S	.	.	H	α-helix	trans	-77.6	-22.7	178.3	-76.6	-2.5	0	0	0	114.6	R416 F417 H418 K423 F424 M520	R416-D420 WeakPolarHBondContact O-CB 3.49Å; R416-D420 VanDerWaalsContact O-CG 3.25Å; R416-D420 PolarHBondContact O-N 2.9Å; F417-D420 PolarHBondContact O-N 2.77Å; H418-D420 VanDerWaalsContact C-N 3.31Å; H418-D420 PolarHBondContact O-N 3.09Å; D420-K423 IonicContact OD1-NZ 3.79Å; D420-K423 PolarHBondContact OD1-NZ 3.19Å; D420-F424 PolarHBondContact O-N 3.4Å; D420-M520 HydrophobicContact CB-CE 3.97Å
421	H	86	Confident	85	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-71.9	-43.6	167.5	-77.9	74.3	0	0	0	110.4	F417 H418 F424 L425 A523 K524	F417-H421 AromaticContact CD1-CE1 3.82Å; F417-H421 AromaticContact CD1-ND1 3.69Å; F417-H421 AromaticContact CD2-CE1 3.87Å; F417-H421 AromaticContact CE1-CE1 3.37Å; F417-H421 WeakPolarHBondContact CE1-CE1 3.19Å; F417-H421 AromaticContact CE1-ND1 3.62Å; F417-H421 AromaticContact CE2-CE1 3.45Å; F417-H421 VanDerWaalsContact CE2-CE1 3.45Å; F417-H421 WeakPolarHBondContact CE2-CE1 3.45Å; F417-H421 AromaticContact CZ-CE1 3.19Å; F417-H421 WeakPolarHBondContact CZ-CE1 3.37Å; F417-H421 AromaticContact CZ-ND1 3.91Å; F417-H421 AromaticContact CZ-NE2 3.78Å; F417-H421 PolarHBondContact O-N 3.29Å; F417-H421 PolarHBondContact O-ND1 2.59Å; H418-H421 PolarHBondContact O-N 3.09Å; H418-H421 VanDerWaalsContact O-N 3.09Å; H421-F424 WeakPolarHBondContact O-CB 3.49Å; H421-F424 PolarHBondContact O-N 2.95Å; H421-F424 VanDerWaalsContact O-N 3.13Å; H421-L425 WeakPolarHBondContact O-CG 3.28Å; H421-L425 PolarHBondContact O-N 2.82Å; H421-A523 VanDerWaalsContact NE2-CB 3.32Å; H421-A523 WeakPolarHBondContact NE2-CB 3.23Å; H421-K524 PolarHBondContact NE2-N 3.23Å
422	F	84.4	Confident	84.5	Confident	22 Å²	22	68.3 Å²	68.3	10%	0.096	33%	0.33	C	S	.	.	H	α-helix	trans	-66.6	-40.1	177.5	-89.9	-98.6	0	0	0	113.1	V398 H418 K419 F424 L425 S426 L437 Q438 M441	V398-F422 HydrophobicContact CB-CE2 4.13Å; V398-F422 HydrophobicContact CG1-CD2 4.45Å; V398-F422 HydrophobicContact CG1-CE2 3.83Å; V398-F422 HydrophobicContact CG1-CZ 4.39Å; V398-F422 HydrophobicContact CG2-CE2 4.25Å; V398-F422 HydrophobicContact CG2-CZ 4.12Å; H418-F422 AromaticContact CD2-CD2 3.76Å; H418-F422 AromaticContact CE1-CD2 3.59Å; H418-F422 AromaticContact CE1-CE2 3.12Å; H418-F422 WeakPolarHBondContact CE1-CE2 3.12Å; H418-F422 AromaticContact CE1-CZ 3.95Å; H418-F422 AromaticContact ND1-CE2 3.79Å; H418-F422 AromaticContact NE2-CD2 3.39Å; H418-F422 WeakPolarHBondContact NE2-CD2 3.29Å; H418-F422 AromaticContact NE2-CE2 3.29Å; H418-F422 VanDerWaalsContact NE2-CE2 3.29Å; H418-F422 WeakPolarHBondContact NE2-CE2 3.39Å; H418-F422 AromaticContact NE2-CZ 4Å; H418-F422 PolarHBondContact O-N 2.83Å; K419-F422 PolarHBondContact O-N 3.22Å; F422-F424 PolarHBondContact O-N 2.91Å; F422-L425 HydrophobicContact CE1-CD1 4.48Å; F422-L425 CarbonylContact O-C 3.57Å; F422-L425 WeakPolarHBondContact O-CB 3.43Å; F422-L425 PolarHBondContact O-N 2.92Å; F422-L425 VanDerWaalsContact O-N 3.09Å; F422-S426 PolarHBondContact O-N 3.23Å; F422-S426 PolarHBondContact O-OG 3.05Å; F422-L437 HydrophobicContact CE1-CB 4.18Å; F422-Q438 HydrophobicContact CD1-CB 4.26Å; F422-Q438 HydrophobicContact CE1-CB 3.85Å; F422-M441 HydrophobicContact CZ-CG 4.27Å
423	K	87.9	Confident	84.1	Confident	121 Å²	121	68.5 Å²	68.5	53%	0.526	33%	0.332	S	S	.	.	H	α-helix	trans	-57.7	-34.2	169.3	-71.4	169.8	-162.2	162.5	0	113	K419 D420 S426 N427	K419-K423 VanDerWaalsContact O-CG 3.27Å; K419-K423 WeakPolarHBondContact O-CG 3.48Å; K419-K423 PolarHBondContact O-N 3.19Å; D420-K423 IonicContact OD1-NZ 3.79Å; D420-K423 PolarHBondContact OD1-NZ 3.19Å; K423-S426 WeakPolarHBondContact CA-OG 3.2Å; K423-S426 PolarHBondContact O-OG 3.12Å; K423-N427 VanDerWaalsContact O-CG 3.25Å; K423-N427 PolarHBondContact O-N 3.46Å; K423-N427 PolarHBondContact O-ND2 3.44Å
424	F	85.5	Confident	84	Confident	57 Å²	57	67.9 Å²	67.9	25%	0.25	33%	0.329	C	S	.	.	H	α-helix	trans	-74.2	-36.5	175.9	-175.7	-110.4	0	0	0	111.8	D420 H421 F422 Q428 K524 L528	D420-F424 PolarHBondContact O-N 3.4Å; H421-F424 WeakPolarHBondContact O-CB 3.49Å; H421-F424 PolarHBondContact O-N 2.95Å; H421-F424 VanDerWaalsContact O-N 3.13Å; F422-F424 PolarHBondContact O-N 2.91Å; F424-Q428 VanDerWaalsContact O-CG 3.28Å; F424-Q428 WeakPolarHBondContact O-CG 3.49Å; F424-K524 HydrophobicContact CB-CD 4.23Å; F424-K524 HydrophobicContact CB-CG 4.32Å; F424-K524 HydrophobicContact CD1-CB 3.61Å; F424-K524 HydrophobicContact CD1-CG 4.14Å; F424-K524 HydrophobicContact CE1-CB 3.78Å; F424-K524 VanDerWaalsContact CE1-O 3.29Å; F424-K524 WeakPolarHBondContact CE1-O 3.48Å; F424-K524 HydrophobicContact CG-CB 4.13Å; F424-K524 HydrophobicContact CG-CD 4.2Å; F424-K524 HydrophobicContact CG-CG 4.25Å; F424-K524 HydrophobicContact CZ-CB 4.47Å; F424-L528 HydrophobicContact CD1-CD1 4.17Å; F424-L528 HydrophobicContact CD1-CG 4.05Å; F424-L528 HydrophobicContact CE1-CD1 3.29Å; F424-L528 HydrophobicContact CE1-CD2 4.42Å; F424-L528 HydrophobicContact CE1-CG 3.62Å; F424-L528 HydrophobicContact CZ-CD1 3.77Å
425	L	84	Confident	84	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64.4	-43.3	171	-64.8	-173.9	0	0	0	111.9	V398 H421 F422 N427 Q428 L429 T434 L528 A531	V398-L425 HydrophobicContact CG1-CD1 3.72Å; H421-L425 WeakPolarHBondContact O-CG 3.28Å; H421-L425 PolarHBondContact O-N 2.82Å; F422-L425 HydrophobicContact CE1-CD1 4.48Å; F422-L425 CarbonylContact O-C 3.57Å; F422-L425 WeakPolarHBondContact O-CB 3.43Å; F422-L425 PolarHBondContact O-N 2.92Å; F422-L425 VanDerWaalsContact O-N 3.09Å; L425-N427 PolarHBondContact O-N 3.06Å; L425-Q428 CarbonylContact O-C 3.44Å; L425-Q428 PolarHBondContact O-N 2.96Å; L425-L429 HydrophobicContact CB-CD1 4.36Å; L425-L429 HydrophobicContact CD2-CD1 4.38Å; L425-L429 WeakPolarHBondContact O-CB 3.19Å; L425-L429 PolarHBondContact O-N 2.94Å; L425-T434 HydrophobicContact CB-CG2 4.03Å; L425-L528 HydrophobicContact CD2-CD2 3.55Å; L425-L528 HydrophobicContact CD2-CG 4.1Å; L425-A531 HydrophobicContact CD1-CB 4.18Å; L425-A531 HydrophobicContact CD2-CB 4.02Å
426	S	82.7	Confident	83.8	Confident	46 Å²	46	63.9 Å²	63.9	32%	0.322	31%	0.309	S	S	.	.	H	α-helix	trans	-67.7	-18.9	-177.9	65.4	0	0	0	0	113.8	F422 K423	F422-S426 PolarHBondContact O-N 3.23Å; F422-S426 PolarHBondContact O-OG 3.05Å; K423-S426 WeakPolarHBondContact CA-OG 3.2Å; K423-S426 PolarHBondContact O-OG 3.12Å
427	N	86.7	Confident	83.9	Confident	131 Å²	131	53.5 Å²	53.5	70%	0.701	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-6.9	172.3	-67.5	-11.6	0	0	0	112.9	K423 L425	K423-N427 VanDerWaalsContact O-CG 3.25Å; K423-N427 PolarHBondContact O-N 3.46Å; K423-N427 PolarHBondContact O-ND2 3.44Å; L425-N427 PolarHBondContact O-N 3.06Å
428	Q	80.3	Confident	84	Confident	95 Å²	95	52.1 Å²	52.1	44%	0.444	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	-13.2	-170.9	-70.4	-76.8	-25.4	0	0	113.7	F424 L425 L528	F424-Q428 VanDerWaalsContact O-CG 3.28Å; F424-Q428 WeakPolarHBondContact O-CG 3.49Å; L425-Q428 CarbonylContact O-C 3.44Å; L425-Q428 PolarHBondContact O-N 2.96Å; Q428-L528 HydrophobicContact CB-CD1 4.46Å; Q428-L528 HydrophobicContact CB-CD2 3.42Å; Q428-L528 VanDerWaalsContact CB-CD2 3.42Å; Q428-L528 HydrophobicContact CG-CD1 4.06Å; Q428-L528 HydrophobicContact CG-CD2 3.85Å
429	L	79.1	Confident	83.8	Confident	33 Å²	33	55.1 Å²	55.1	17%	0.173	28%	0.279	C	S	.	.	S	Bend	trans	-132.8	158	178.5	-60.2	175.2	0	0	0	107.3	L425 T434 L437 A531 L535	L425-L429 HydrophobicContact CB-CD1 4.36Å; L425-L429 HydrophobicContact CD2-CD1 4.38Å; L425-L429 WeakPolarHBondContact O-CB 3.19Å; L425-L429 PolarHBondContact O-N 2.94Å; L429-T434 HydrophobicContact CB-CG2 3.83Å; L429-T434 HydrophobicContact CD1-CG2 4.39Å; L429-L437 HydrophobicContact CD1-CD1 4.01Å; L429-A531 HydrophobicContact CD1-CB 4.17Å; L429-L535 HydrophobicContact CD1-CD1 4.08Å; L429-L535 HydrophobicContact CD2-CD1 4.31Å
430	S	82.2	Confident	83.6	Confident	66 Å²	66	52.8 Å²	52.8	46%	0.462	27%	0.267	S	S	.	.			trans	-74.4	146.4	-179.8	61.3	0	0	0	0	111	T433 T434	S430-T433 PolarHBondContact N-OG1 3.15Å; S430-T433 WeakPolarHBondContact O-CA 3.28Å; S430-T433 WeakPolarHBondContact O-CB 3.34Å; S430-T433 PolarHBondContact O-N 2.86Å; S430-T433 PolarHBondContact O-OG1 2.96Å; S430-T433 VanDerWaalsContact OG-CG2 3.28Å; S430-T433 WeakPolarHBondContact OG-CG2 3.46Å; S430-T433 PolarHBondContact OG-OG1 3.18Å; S430-T434 PolarHBondContact O-N 2.72Å; S430-T434 VanDerWaalsContact O-N 3.11Å
431	K	80.8	Confident	83.5	Confident	158 Å²	158	50.6 Å²	50.6	69%	0.687	26%	0.255	S	S	*	.	H	α-helix	trans	-41.5	-55.8	-180	-62	-175	179.1	-174.6	0	114.1	T433 T434 D435	K431-T433 PolarHBondContact O-N 3.31Å; K431-T433 VanDerWaalsContact O-N 3.1Å; K431-T434 PolarHBondContact O-N 2.8Å; K431-T434 PolarHBondContact O-OG1 2.78Å; K431-D435 VanDerWaalsContact C-OD2 3.28Å; K431-D435 PolarHBondContact O-N 3.28Å
432	P	78.5	Confident	83.3	Confident	52 Å²	52	54.6 Å²	54.6	34%	0.338	27%	0.274	S	S	.	.	H	α-helix	trans	-66.1	-21.1	-178.6	29	-38.2	0	0	0	114	F436 Y547 L548	P432-F436 WeakPolarHBondContact O-CB 3.3Å; P432-F436 PolarHBondContact O-N 3.29Å; P432-Y547 WeakPolarHBondContact O-CE1 3.1Å; P432-L548 HydrophobicContact CB-CD2 3.64Å; P432-L548 HydrophobicContact CG-CD2 3.76Å
433	T	81	Confident	83.2	Confident	18 Å²	18	54.9 Å²	54.9	11%	0.11	28%	0.276	C	S	.	.	H	α-helix	trans	-79.8	-26.9	172.1	66.2	0	0	0	0	112.7	S430 K431 L437 L544	S430-T433 PolarHBondContact N-OG1 3.15Å; S430-T433 WeakPolarHBondContact O-CA 3.28Å; S430-T433 WeakPolarHBondContact O-CB 3.34Å; S430-T433 PolarHBondContact O-N 2.86Å; S430-T433 PolarHBondContact O-OG1 2.96Å; S430-T433 VanDerWaalsContact OG-CG2 3.28Å; S430-T433 WeakPolarHBondContact OG-CG2 3.46Å; S430-T433 PolarHBondContact OG-OG1 3.18Å; K431-T433 PolarHBondContact O-N 3.31Å; K431-T433 VanDerWaalsContact O-N 3.1Å; T433-L437 VanDerWaalsContact O-CG 3.29Å; T433-L437 WeakPolarHBondContact O-CG 3.17Å; T433-L437 PolarHBondContact O-N 2.72Å; T433-L544 HydrophobicContact CG2-CD1 4Å; T433-L544 HydrophobicContact CG2-CD2 4.22Å
434	T	82.5	Confident	82.8	Confident	7 Å²	7	52.7 Å²	52.7	4%	0.043	27%	0.267	C	S	.	.	H	α-helix	trans	-79.8	-34.3	172.2	51.1	0	0	0	0	112.7	L425 L429 S430 K431 L437 Q438	L425-T434 HydrophobicContact CB-CG2 4.03Å; L429-T434 HydrophobicContact CB-CG2 3.83Å; L429-T434 HydrophobicContact CD1-CG2 4.39Å; S430-T434 PolarHBondContact O-N 2.72Å; S430-T434 VanDerWaalsContact O-N 3.11Å; K431-T434 PolarHBondContact O-N 2.8Å; K431-T434 PolarHBondContact O-OG1 2.78Å; T434-L437 PolarHBondContact O-N 3.13Å; T434-Q438 PolarHBondContact O-N 2.89Å
435	D	84.8	Confident	82.6	Confident	80 Å²	80	51.2 Å²	51.2	43%	0.428	26%	0.26	S	S	.	.	H	α-helix	trans	-66.6	-46.5	177.2	-53.3	-24.6	0	0	0	109.3	K431 L437 Q438 E439 Y547	K431-D435 VanDerWaalsContact C-OD2 3.28Å; K431-D435 PolarHBondContact O-N 3.28Å; D435-L437 VanDerWaalsContact C-N 3.3Å; D435-L437 PolarHBondContact O-N 3.41Å; D435-Q438 PolarHBondContact O-N 2.99Å; D435-Q438 VanDerWaalsContact O-N 3.09Å; D435-E439 PolarHBondContact O-N 2.94Å; D435-Y547 HydrophobicContact CB-CE1 4.49Å
436	F	85.8	Confident	82.5	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-54.7	-40.1	168.4	175.2	-98.4	0	0	0	113.6	P432 Y440 L535 I540 K543 L544 Y547 P553 F554	P432-F436 WeakPolarHBondContact O-CB 3.3Å; P432-F436 PolarHBondContact O-N 3.29Å; F436-Y440 WeakPolarHBondContact O-CB 3.27Å; F436-Y440 PolarHBondContact O-N 3.23Å; F436-L535 HydrophobicContact CD1-CD2 4.37Å; F436-I540 HydrophobicContact CE1-CG2 3.69Å; F436-I540 HydrophobicContact CZ-CG2 3.96Å; F436-K543 HydrophobicContact CE2-CB 3.9Å; F436-K543 HydrophobicContact CZ-CB 3.81Å; F436-L544 HydrophobicContact CB-CD1 3.68Å; F436-L544 HydrophobicContact CD1-CB 4.05Å; F436-L544 HydrophobicContact CD1-CD1 3.53Å; F436-L544 HydrophobicContact CD1-CG 4.36Å; F436-L544 HydrophobicContact CD2-CD1 4.29Å; F436-L544 HydrophobicContact CE1-CB 3.89Å; F436-L544 HydrophobicContact CE1-CD1 4.25Å; F436-L544 HydrophobicContact CE2-CB 4.4Å; F436-L544 HydrophobicContact CG-CB 4.38Å; F436-L544 HydrophobicContact CG-CD1 3.55Å; F436-L544 HydrophobicContact CZ-CB 4.07Å; F436-Y547 HydrophobicContact CB-CD1 3.69Å; F436-Y547 HydrophobicContact CB-CE1 3.88Å; F436-Y547 HydrophobicContact CB-CG 4.19Å; F436-Y547 HydrophobicContact CD2-CD1 4.17Å; F436-Y547 HydrophobicContact CD2-CD2 4.23Å; F436-Y547 AromaticContact CD2-CG 3.79Å; F436-Y547 HydrophobicContact CD2-CG 3.79Å; F436-Y547 HydrophobicContact CG-CD1 4.38Å; F436-Y547 HydrophobicContact CG-CG 4.44Å; F436-P553 HydrophobicContact CE2-CG 4.2Å; F436-F554 HydrophobicContact CD2-CE2 4.04Å; F436-F554 AromaticContact CD2-CZ 3.99Å; F436-F554 HydrophobicContact CD2-CZ 3.99Å; F436-F554 HydrophobicContact CE2-CE1 4.33Å; F436-F554 AromaticContact CE2-CE2 3.91Å; F436-F554 HydrophobicContact CE2-CE2 3.91Å; F436-F554 AromaticContact CE2-CZ 3.43Å; F436-F554 HydrophobicContact CE2-CZ 3.43Å; F436-F554 VanDerWaalsContact CE2-CZ 3.43Å; F436-F554 AromaticContact CZ-CZ 3.99Å; F436-F554 HydrophobicContact CZ-CZ 3.99Å
437	L	85.4	Confident	82.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-69.4	-34.3	178.1	-79.5	171.8	0	0	0	112.4	F422 L429 T433 T434 D435 M441 A531 I534 L535	F422-L437 HydrophobicContact CE1-CB 4.18Å; L429-L437 HydrophobicContact CD1-CD1 4.01Å; T433-L437 VanDerWaalsContact O-CG 3.29Å; T433-L437 WeakPolarHBondContact O-CG 3.17Å; T433-L437 PolarHBondContact O-N 2.72Å; T434-L437 PolarHBondContact O-N 3.13Å; D435-L437 VanDerWaalsContact C-N 3.3Å; D435-L437 PolarHBondContact O-N 3.41Å; L437-M441 VanDerWaalsContact O-CG 3.32Å; L437-M441 WeakPolarHBondContact O-CG 3.47Å; L437-M441 PolarHBondContact O-N 3.22Å; L437-A531 HydrophobicContact CD1-CB 4.02Å; L437-I534 HydrophobicContact CD2-CG2 3.91Å; L437-L535 HydrophobicContact CD1-CD1 4.15Å; L437-L535 HydrophobicContact CD1-CD2 4.32Å; L437-L535 HydrophobicContact CD1-CG 4.34Å; L437-L535 HydrophobicContact CD2-CD2 4.13Å; L437-L535 HydrophobicContact CD2-CG 4.4Å; L437-L535 HydrophobicContact CG-CD2 4.13Å
438	Q	85.3	Confident	81.9	Confident	47 Å²	47	52.5 Å²	52.5	22%	0.22	26%	0.255	C	S	.	.	H	α-helix	trans	-68.9	-48.1	176.1	179.9	66.3	9.8	0	0	110.2	H418 F422 T434 D435 Y440 M441 Q442	H418-Q438 PolarHBondContact NE2-OE1 3.25Å; F422-Q438 HydrophobicContact CD1-CB 4.26Å; F422-Q438 HydrophobicContact CE1-CB 3.85Å; T434-Q438 PolarHBondContact O-N 2.89Å; D435-Q438 PolarHBondContact O-N 2.99Å; D435-Q438 VanDerWaalsContact O-N 3.09Å; Q438-Y440 VanDerWaalsContact C-N 3.34Å; Q438-Y440 PolarHBondContact O-N 3.43Å; Q438-M441 PolarHBondContact O-N 2.94Å; Q438-Q442 WeakPolarHBondContact O-CG 3.41Å; Q438-Q442 PolarHBondContact O-N 2.78Å
439	E	83.5	Confident	81.9	Confident	65 Å²	65	49 Å²	49	30%	0.304	24%	0.242	S	C	.	.	H	α-helix	trans	-61.1	-40.2	173.4	-73.7	-176.7	-150.5	0	0	112.4	D435 M441 Q442 N443 Y547 F554	D435-E439 PolarHBondContact O-N 2.94Å; E439-M441 VanDerWaalsContact C-N 3.34Å; E439-M441 PolarHBondContact O-N 3.24Å; E439-Q442 PolarHBondContact O-N 2.87Å; E439-N443 WeakPolarHBondContact O-CB 3.43Å; E439-N443 PolarHBondContact O-N 2.88Å; E439-Y547 VanDerWaalsContact CD-CE2 3.5Å; E439-Y547 VanDerWaalsContact OE1-CE2 3.28Å; E439-Y547 WeakPolarHBondContact OE1-CE2 3.35Å; E439-Y547 VanDerWaalsContact OE1-CZ 3.31Å; E439-Y547 PolarHBondContact OE1-OH 3.45Å; E439-Y547 WeakPolarHBondContact OE2-CE2 3.4Å; E439-F554 HydrophobicContact CB-CD2 4.25Å; E439-F554 HydrophobicContact CB-CE2 3.83Å
440	Y	82.6	Confident	81.9	Confident	56 Å²	56	52.7 Å²	52.7	22%	0.22	26%	0.259	C	S	.	.	H	α-helix	trans	-62.6	-39.5	176.3	176.9	-120.7	0	0	0	112.1	F436 Q438 K444 I534 I540 F554	F436-Y440 WeakPolarHBondContact O-CB 3.27Å; F436-Y440 PolarHBondContact O-N 3.23Å; Q438-Y440 VanDerWaalsContact C-N 3.34Å; Q438-Y440 PolarHBondContact O-N 3.43Å; Y440-K444 VanDerWaalsContact O-CB 3.3Å; Y440-K444 WeakPolarHBondContact O-CB 3.22Å; Y440-K444 PolarHBondContact O-N 3.4Å; Y440-I534 HydrophobicContact CD1-CG2 4.16Å; Y440-I534 HydrophobicContact CE1-CG2 3.84Å; Y440-I540 HydrophobicContact CE1-CD1 4.1Å; Y440-I540 HydrophobicContact CE2-CD1 4.48Å; Y440-I540 WeakPolarHBondContact OH-CD1 3.49Å; Y440-F554 HydrophobicContact CD2-CE1 4.1Å; Y440-F554 HydrophobicContact CD2-CZ 4.2Å
441	M	83.8	Confident	81.5	Confident	8 Å²	8	52.6 Å²	52.6	4%	0.039	25%	0.248	C	C	.	.	H	α-helix	trans	-67.6	-42	173.2	-70.2	-61	96.5	0	0	111.9	S397 V398 F422 L437 Q438 E439 K444 F445	S397-M441 VanDerWaalsContact OG-CE 3.26Å; S397-M441 WeakPolarHBondContact OG-CE 3.14Å; S397-M441 PolarHBondContact OG-SD 3.28Å; S397-M441 VanDerWaalsContact OG-SD 3.37Å; V398-M441 HydrophobicContact CG2-CG 4.3Å; V398-M441 HydrophobicContact CG2-SD 4.19Å; F422-M441 HydrophobicContact CZ-CG 4.27Å; L437-M441 VanDerWaalsContact O-CG 3.32Å; L437-M441 WeakPolarHBondContact O-CG 3.47Å; L437-M441 PolarHBondContact O-N 3.22Å; Q438-M441 PolarHBondContact O-N 2.94Å; E439-M441 VanDerWaalsContact C-N 3.34Å; E439-M441 PolarHBondContact O-N 3.24Å; M441-K444 PolarHBondContact O-N 2.99Å; M441-F445 WeakPolarHBondContact O-CB 3.3Å; M441-F445 PolarHBondContact O-N 3.37Å
442	Q	82.3	Confident	81.3	Confident	85 Å²	85	46 Å²	46	40%	0.397	22%	0.221	S	C	.	.	H	α-helix	trans	-66	-40	177.4	-73.8	175.1	-18.6	0	0	112.5	Q438 E439 F445 K446	Q438-Q442 WeakPolarHBondContact O-CG 3.41Å; Q438-Q442 PolarHBondContact O-N 2.78Å; E439-Q442 PolarHBondContact O-N 2.87Å; Q442-F445 WeakPolarHBondContact O-CB 3.4Å; Q442-F445 PolarHBondContact O-N 3.11Å; Q442-K446 WeakPolarHBondContact O-CG 3.48Å; Q442-K446 PolarHBondContact O-N 2.64Å
443	N	83.1	Confident	80.9	Confident	27 Å²	27	46.2 Å²	46.2	14%	0.144	23%	0.233	C	C	.	.	H	α-helix	trans	-67.8	-43	174.8	-170.1	-4.6	0	0	0	111.1	E439 F445 K446 K447 F554	E439-N443 WeakPolarHBondContact O-CB 3.43Å; E439-N443 PolarHBondContact O-N 2.88Å; N443-F445 PolarHBondContact O-N 3.38Å; N443-K446 PolarHBondContact O-N 3.42Å; N443-K447 WeakPolarHBondContact O-CG 3.35Å; N443-K447 PolarHBondContact O-N 2.93Å; N443-K447 WeakPolarHBondContact OD1-CE 3.3Å; N443-F554 HydrophobicContact CB-CD1 4.43Å; N443-F554 VanDerWaalsContact ND2-CB 3.27Å; N443-F554 WeakPolarHBondContact ND2-CB 3.45Å; N443-F554 WeakPolarHBondContact ND2-CD1 3.43Å; N443-F554 VanDerWaalsContact ND2-CG 3.3Å; N443-F554 WeakPolarHBondContact ND2-CG 3.41Å
444	K	79.8	Confident	80.5	Confident	75 Å²	75	52.5 Å²	52.5	33%	0.326	26%	0.261	S	S	.	.	H	α-helix	trans	-57.9	-38.5	172.3	-168.7	-164.9	173.1	-162.2	0	111.6	A395 Y440 M441 T448	A395-K444 PolarHBondContact O-NZ 2.62Å; Y440-K444 VanDerWaalsContact O-CB 3.3Å; Y440-K444 WeakPolarHBondContact O-CB 3.22Å; Y440-K444 PolarHBondContact O-N 3.4Å; M441-K444 PolarHBondContact O-N 2.99Å; K444-T448 WeakPolarHBondContact O-CB 3.16Å; K444-T448 PolarHBondContact O-N 3.36Å; K444-T448 VanDerWaalsContact O-N 3.13Å; K444-T448 PolarHBondContact O-OG1 3.4Å
445	F	80.2	Confident	79.8	Confident	26 Å²	26	54.6 Å²	54.6	11%	0.114	27%	0.272	C	S	.	.	H	α-helix	trans	-63.9	-54.2	173.7	169.3	-108.2	0	0	0	111.7	F394 K406 M409 D410 L413 M441 Q442 N443 K447 T448 A449	F394-F445 AromaticContact CD1-CD2 3.56Å; F394-F445 HydrophobicContact CD1-CD2 3.56Å; F394-F445 AromaticContact CD1-CE2 3.64Å; F394-F445 HydrophobicContact CD1-CE2 3.64Å; F394-F445 AromaticContact CE1-CD2 3.83Å; F394-F445 HydrophobicContact CE1-CD2 3.83Å; F394-F445 AromaticContact CE1-CE2 3.59Å; F394-F445 HydrophobicContact CE1-CE2 3.59Å; F394-F445 HydrophobicContact CG-CE2 4.47Å; F394-F445 HydrophobicContact CZ-CE2 4.41Å; K406-F445 HydrophobicContact CD-CZ 4.43Å; K406-F445 HydrophobicContact CG-CE2 4Å; K406-F445 HydrophobicContact CG-CZ 3.64Å; M409-F445 HydrophobicContact CB-CD2 4.12Å; M409-F445 HydrophobicContact CB-CE2 3.86Å; M409-F445 HydrophobicContact CG-CD2 3.5Å; M409-F445 HydrophobicContact CG-CE2 3.78Å; M409-F445 HydrophobicContact CG-CG 4.41Å; D410-F445 VanDerWaalsContact CG-CZ 3.49Å; D410-F445 WeakPolarHBondContact OD1-CE1 3.22Å; D410-F445 WeakPolarHBondContact OD1-CZ 3.09Å; D410-F445 WeakPolarHBondContact OD2-CZ 3.27Å; L413-F445 HydrophobicContact CD1-CB 4.39Å; L413-F445 HydrophobicContact CD1-CD1 4.35Å; L413-F445 HydrophobicContact CD1-CG 4.25Å; M441-F445 WeakPolarHBondContact O-CB 3.3Å; M441-F445 PolarHBondContact O-N 3.37Å; Q442-F445 WeakPolarHBondContact O-CB 3.4Å; Q442-F445 PolarHBondContact O-N 3.11Å; N443-F445 PolarHBondContact O-N 3.38Å; F445-K447 PolarHBondContact O-N 3Å; F445-T448 CarbonylContact O-C 3.59Å; F445-T448 WeakPolarHBondContact O-CA 3.32Å; F445-T448 PolarHBondContact O-N 3.13Å; F445-A449 HydrophobicContact CZ-CB 4.5Å; F445-A449 PolarHBondContact O-N 3.11Å
446	K	83.3	Confident	78.4	Confident	128 Å²	128	58.9 Å²	58.9	56%	0.557	29%	0.289	S	S	*	.	H	α-helix	trans	-52.5	-49.6	177.8	-73.3	-175.9	177.4	-170.2	0	112.3	Q442 N443 T448 A449 E450	Q442-K446 WeakPolarHBondContact O-CG 3.48Å; Q442-K446 PolarHBondContact O-N 2.64Å; N443-K446 PolarHBondContact O-N 3.42Å; K446-T448 VanDerWaalsContact C-N 3.27Å; K446-T448 PolarHBondContact O-N 2.73Å; K446-A449 CarbonylContact O-C 3.56Å; K446-A449 WeakPolarHBondContact O-CA 3.27Å; K446-A449 WeakPolarHBondContact O-CB 3.32Å; K446-A449 PolarHBondContact O-N 3.28Å; K446-E450 WeakPolarHBondContact O-CG 3.47Å; K446-E450 PolarHBondContact O-N 3.42Å
447	K	81.2	Confident	77.6	Confident	70 Å²	70	64.1 Å²	64.1	30%	0.304	32%	0.317	S	S	.	.	H	α-helix	trans	-61.9	-29.1	175.3	-68.6	-177.4	176.1	-159.7	0	114.8	N443 F445 R451 D559	N443-K447 WeakPolarHBondContact O-CG 3.35Å; N443-K447 PolarHBondContact O-N 2.93Å; N443-K447 WeakPolarHBondContact OD1-CE 3.3Å; F445-K447 PolarHBondContact O-N 3Å; K447-R451 WeakPolarHBondContact O-CG 3.09Å; K447-R451 PolarHBondContact O-N 2.97Å; K447-R451 PolarHBondContact O-NE 3.46Å; K447-D559 VanDerWaalsContact NZ-CG 3.29Å; K447-D559 IonicContact NZ-OD2 2.67Å; K447-D559 PolarHBondContact NZ-OD2 3.01Å
448	T	74.4	Confident	76.5	Confident	6 Å²	6	68.4 Å²	68.4	4%	0.037	34%	0.337	C	S	.	.	H	α-helix	trans	-78.9	-36.3	174	-50.6	0	0	0	0	110.3	F394 K444 F445 K446 R451 V452	F394-T448 HydrophobicContact CD1-CG2 3.66Å; F394-T448 HydrophobicContact CE1-CG2 3.91Å; F394-T448 HydrophobicContact CG-CG2 4.23Å; K444-T448 WeakPolarHBondContact O-CB 3.16Å; K444-T448 PolarHBondContact O-N 3.36Å; K444-T448 VanDerWaalsContact O-N 3.13Å; K444-T448 PolarHBondContact O-OG1 3.4Å; F445-T448 CarbonylContact O-C 3.59Å; F445-T448 WeakPolarHBondContact O-CA 3.32Å; F445-T448 PolarHBondContact O-N 3.13Å; K446-T448 VanDerWaalsContact C-N 3.27Å; K446-T448 PolarHBondContact O-N 2.73Å; T448-R451 PolarHBondContact O-N 2.86Å; T448-V452 HydrophobicContact CG2-CG2 4.49Å; T448-V452 WeakPolarHBondContact O-CB 3.44Å; T448-V452 VanDerWaalsContact O-CG2 3.25Å; T448-V452 WeakPolarHBondContact O-CG2 3.28Å; T448-V452 PolarHBondContact O-N 3.29Å
449	A	79.8	Confident	75.5	Confident	22 Å²	22	69.2 Å²	69.2	18%	0.182	35%	0.348	C	S	.	.	H	α-helix	trans	-67.6	-40	176.2	0	0	0	0	0	111.9	F394 F445 K446 V452 G453	F394-A449 HydrophobicContact CE1-CB 3.87Å; F394-A449 HydrophobicContact CZ-CB 4.23Å; F445-A449 HydrophobicContact CZ-CB 4.5Å; F445-A449 PolarHBondContact O-N 3.11Å; K446-A449 CarbonylContact O-C 3.56Å; K446-A449 WeakPolarHBondContact O-CA 3.27Å; K446-A449 WeakPolarHBondContact O-CB 3.32Å; K446-A449 PolarHBondContact O-N 3.28Å; A449-V452 PolarHBondContact O-N 2.91Å; A449-G453 PolarHBondContact O-N 2.86Å
450	E	80.3	Confident	75	Confident	111 Å²	111	68.4 Å²	68.4	52%	0.519	35%	0.352	S	S	.	.	H	α-helix	trans	-61	-49.3	173.8	-73.2	153.4	-160.8	0	0	110.8	K446 V452 G453 Q454	K446-E450 WeakPolarHBondContact O-CG 3.47Å; K446-E450 PolarHBondContact O-N 3.42Å; E450-V452 PolarHBondContact O-N 3.46Å; E450-G453 PolarHBondContact O-N 3.22Å; E450-Q454 VanDerWaalsContact O-CG 3.3Å; E450-Q454 WeakPolarHBondContact O-CG 3.31Å; E450-Q454 PolarHBondContact O-N 3.4Å
451	R	72.5	Confident	74.4	Confident	64 Å²	64	67.4 Å²	67.4	24%	0.242	35%	0.352	C	S	.	.	H	α-helix	trans	-66.9	-30.6	176.8	-69.4	-176	-55.3	167.1	7	114.1	K447 T448 D565	K447-R451 WeakPolarHBondContact O-CG 3.09Å; K447-R451 PolarHBondContact O-N 2.97Å; K447-R451 PolarHBondContact O-NE 3.46Å; T448-R451 PolarHBondContact O-N 2.86Å; R451-D565 VanDerWaalsContact CD-OD1 3.31Å; R451-D565 WeakPolarHBondContact CD-OD1 3.39Å; R451-D565 IonicContact CZ-OD1 2.71Å; R451-D565 IonicContact NE-OD1 3.23Å; R451-D565 IonicContact NH1-OD1 3.95Å; R451-D565 PolarHBondContact NH1-OD1 3.35Å
452	V	77.4	Confident	73.8	Confident	18 Å²	18	67.4 Å²	67.4	11%	0.109	35%	0.352	C	S	.	.	H	α-helix	trans	-76.4	-33.2	172.9	170.6	0	0	0	0	111.2	L392 F394 T448 A449 E450 L455 H458	L392-V452 HydrophobicContact CB-CG2 4.37Å; L392-V452 HydrophobicContact CD2-CG2 4.28Å; F394-V452 HydrophobicContact CE2-CG1 4.46Å; F394-V452 HydrophobicContact CE2-CG2 4.32Å; F394-V452 HydrophobicContact CZ-CB 4.22Å; F394-V452 HydrophobicContact CZ-CG1 4.4Å; F394-V452 HydrophobicContact CZ-CG2 4.17Å; T448-V452 HydrophobicContact CG2-CG2 4.49Å; T448-V452 WeakPolarHBondContact O-CB 3.44Å; T448-V452 VanDerWaalsContact O-CG2 3.25Å; T448-V452 WeakPolarHBondContact O-CG2 3.28Å; T448-V452 PolarHBondContact O-N 3.29Å; A449-V452 PolarHBondContact O-N 2.91Å; E450-V452 PolarHBondContact O-N 3.46Å; V452-L455 PolarHBondContact O-N 2.87Å; V452-H458 HydrophobicContact CG1-CB 4.1Å
453	G	70.7	Confident	73.1	Confident	58 Å²	58	66.2 Å²	66.2	60%	0.598	35%	0.352	S	S	*	.	H	α-helix	trans	-71.7	-33	175.4	0	0	0	0	0	113.4	A449 E450 L455	A449-G453 PolarHBondContact O-N 2.86Å; E450-G453 PolarHBondContact O-N 3.22Å; G453-L455 PolarHBondContact O-N 3.36Å
454	Q	72.3	Confident	72.7	Confident	150 Å²	150	69.6 Å²	69.6	70%	0.701	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-12.4	168.9	-73.3	168.2	1.4	0	0	113.2	E450	E450-Q454 VanDerWaalsContact O-CG 3.3Å; E450-Q454 WeakPolarHBondContact O-CG 3.31Å; E450-Q454 PolarHBondContact O-N 3.4Å
455	L	68.1	Low	72.3	Confident	51 Å²	51	66.4 Å²	66.4	27%	0.267	35%	0.354	S	S	.	.	S	Bend	trans	-99.5	87.1	175	-74.7	162.6	0	0	0	110.4	F388 L392 V452 G453 N457 H458	F388-L455 HydrophobicContact CE2-CD1 4.01Å; F388-L455 HydrophobicContact CZ-CD1 3.69Å; F388-L455 HydrophobicContact CZ-CD2 4.02Å; L392-L455 HydrophobicContact CD1-CD1 4.07Å; L392-L455 HydrophobicContact CD2-CD1 3.25Å; L392-L455 HydrophobicContact CG-CD1 4.29Å; V452-L455 PolarHBondContact O-N 2.87Å; G453-L455 PolarHBondContact O-N 3.36Å; L455-N457 PolarHBondContact O-N 3.18Å; L455-H458 PolarHBondContact O-N 2.94Å
456	E	55.5	Low	71.8	Confident	170 Å²	170	70.9 Å²	70.9	79%	0.794	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	129.3	161.5	-62.3	-179.9	-177.4	0	0	109
457	N	67.2	Low	71.2	Confident	110 Å²	110	72.6 Å²	72.6	59%	0.588	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	32.4	-172.5	-43.8	-76.5	0	0	0	116.3	L455 S459 A460 T461	L455-N457 PolarHBondContact O-N 3.18Å; N457-S459 PolarHBondContact O-N 3.4Å; N457-A460 HydrophobicContact CB-CB 3.95Å; N457-A460 PolarHBondContact O-N 3.41Å; N457-A460 VanDerWaalsContact O-N 3.14Å; N457-T461 PolarHBondContact O-N 3.05Å; N457-T461 PolarHBondContact O-OG1 3.01Å; N457-T461 VanDerWaalsContact O-OG1 3.11Å
458	H	63.6	Low	70.7	Confident	90 Å²	90	73.2 Å²	73.2	42%	0.417	38%	0.378	S	S	.	.	H	α-helix	trans	-47.7	-41.9	167.3	64.4	-89.3	0	0	0	113	V452 L455 T461 I462	V452-H458 HydrophobicContact CG1-CB 4.1Å; L455-H458 PolarHBondContact O-N 2.94Å; H458-T461 WeakPolarHBondContact O-CB 3.47Å; H458-T461 PolarHBondContact O-N 3.02Å; H458-I462 WeakPolarHBondContact O-CD1 3.31Å; H458-I462 VanDerWaalsContact O-CG1 3.27Å; H458-I462 WeakPolarHBondContact O-CG1 3.46Å; H458-I462 PolarHBondContact O-N 2.93Å
459	S	64.9	Low	70.3	Confident	63 Å²	63	78.8 Å²	78.8	44%	0.441	40%	0.403	S	S	.	.	H	α-helix	trans	-64.9	-42.8	178.2	57.8	0	0	0	0	113.2	N457 T461 I462 C463	N457-S459 PolarHBondContact O-N 3.4Å; S459-T461 VanDerWaalsContact C-N 3.34Å; S459-I462 PolarHBondContact O-N 3.13Å; S459-C463 PolarHBondContact O-N 3.34Å; S459-C463 PolarHBondContact O-SG 3.16Å
460	A	71.6	Confident	69.9	Low	49 Å²	49	79.6 Å²	79.6	41%	0.405	41%	0.405	S	S	.	.	H	α-helix	trans	-65.8	-38.7	175.2	0	0	0	0	0	111.4	N457 C463 Q464	N457-A460 HydrophobicContact CB-CB 3.95Å; N457-A460 PolarHBondContact O-N 3.41Å; N457-A460 VanDerWaalsContact O-N 3.14Å; A460-C463 WeakPolarHBondContact O-CB 3.32Å; A460-C463 PolarHBondContact O-N 3.13Å; A460-Q464 WeakPolarHBondContact O-CB 3.46Å; A460-Q464 PolarHBondContact O-N 3.26Å
461	T	70.3	Confident	69.4	Low	35 Å²	35	82.1 Å²	82.1	22%	0.215	42%	0.421	C	S	.	.	H	α-helix	trans	-60.7	-47.3	174.5	-59.1	0	0	0	0	111	F388 L392 N457 H458 S459 C463 Q464 I465	F388-T461 HydrophobicContact CE1-CG2 4.14Å; L392-T461 HydrophobicContact CD1-CG2 4.17Å; N457-T461 PolarHBondContact O-N 3.05Å; N457-T461 PolarHBondContact O-OG1 3.01Å; N457-T461 VanDerWaalsContact O-OG1 3.11Å; H458-T461 WeakPolarHBondContact O-CB 3.47Å; H458-T461 PolarHBondContact O-N 3.02Å; S459-T461 VanDerWaalsContact C-N 3.34Å; T461-C463 PolarHBondContact O-N 2.9Å; T461-Q464 PolarHBondContact O-N 3.24Å; T461-I465 HydrophobicContact CG2-CD1 4.11Å; T461-I465 WeakPolarHBondContact O-CD1 3.37Å; T461-I465 VanDerWaalsContact O-CG1 3.23Å; T461-I465 WeakPolarHBondContact O-CG1 3.28Å; T461-I465 PolarHBondContact O-N 3.1Å
462	I	72.1	Confident	69.1	Low	8 Å²	8	81.6 Å²	81.6	4%	0.041	43%	0.425	C	S	.	.	H	α-helix	trans	-59.8	-44.6	174.7	-67.5	161.8	0	0	0	111	F404 Y405 H458 S459 Q464 I465 Y466	F404-I462 HydrophobicContact CB-CD1 3.81Å; F404-I462 HydrophobicContact CB-CG1 4.08Å; F404-I462 HydrophobicContact CD1-CG1 4.34Å; F404-I462 HydrophobicContact CG-CG1 4.39Å; Y405-I462 HydrophobicContact CE1-CD1 4.26Å; H458-I462 WeakPolarHBondContact O-CD1 3.31Å; H458-I462 VanDerWaalsContact O-CG1 3.27Å; H458-I462 WeakPolarHBondContact O-CG1 3.46Å; H458-I462 PolarHBondContact O-N 2.93Å; S459-I462 PolarHBondContact O-N 3.13Å; I462-Q464 VanDerWaalsContact C-N 3.34Å; I462-Q464 PolarHBondContact O-N 2.93Å; I462-I465 WeakPolarHBondContact O-CB 3.31Å; I462-I465 PolarHBondContact O-N 2.81Å; I462-Y466 HydrophobicContact CG2-CD2 3.79Å; I462-Y466 HydrophobicContact CG2-CE2 3.5Å; I462-Y466 VanDerWaalsContact O-CD2 3.23Å; I462-Y466 WeakPolarHBondContact O-CD2 3.47Å; I462-Y466 PolarHBondContact O-N 3.28Å
463	C	67.9	Low	68.7	Low	59 Å²	59	89.4 Å²	89.4	40%	0.399	45%	0.452	S	S	.	.	H	α-helix	trans	-61.6	-39.5	175.6	-69.9	0	0	0	0	112.6	S459 A460 T461 Y466 R467	S459-C463 PolarHBondContact O-N 3.34Å; S459-C463 PolarHBondContact O-SG 3.16Å; A460-C463 WeakPolarHBondContact O-CB 3.32Å; A460-C463 PolarHBondContact O-N 3.13Å; T461-C463 PolarHBondContact O-N 2.9Å; C463-Y466 PolarHBondContact O-N 3.32Å; C463-R467 WeakPolarHBondContact O-CB 3.46Å; C463-R467 WeakPolarHBondContact O-CG 3.46Å; C463-R467 PolarHBondContact O-N 3.36Å
464	Q	73.8	Confident	68.4	Low	98 Å²	98	95.1 Å²	95.1	46%	0.458	46%	0.463	S	S	.	.	H	α-helix	trans	-66.4	-38.8	175.6	-170.7	171.9	10.3	0	0	111.7	A460 T461 I462 R467 E468	A460-Q464 WeakPolarHBondContact O-CB 3.46Å; A460-Q464 PolarHBondContact O-N 3.26Å; T461-Q464 PolarHBondContact O-N 3.24Å; I462-Q464 VanDerWaalsContact C-N 3.34Å; I462-Q464 PolarHBondContact O-N 2.93Å; Q464-R467 PolarHBondContact O-N 2.75Å; Q464-E468 WeakPolarHBondContact O-CB 3.21Å; Q464-E468 WeakPolarHBondContact O-CG 3.23Å; Q464-E468 PolarHBondContact O-N 2.83Å
465	I	71.8	Confident	68.6	Low	8 Å²	8	91 Å²	91	4%	0.041	45%	0.446	C	S	.	.	H	α-helix	trans	-59.2	-48.8	174.5	-67.3	160.4	0	0	0	110.6	M389 F404 T461 I462 R467 E468 Q469	M389-I465 HydrophobicContact CE-CG1 3.79Å; M389-I465 HydrophobicContact CE-CG2 4.4Å; M389-I465 HydrophobicContact CG-CD1 3.67Å; M389-I465 HydrophobicContact CG-CG1 3.95Å; M389-I465 HydrophobicContact SD-CD1 4.27Å; M389-I465 HydrophobicContact SD-CG1 3.95Å; M389-I465 HydrophobicContact SD-CG2 3.91Å; F404-I465 HydrophobicContact CE1-CD1 4.34Å; T461-I465 HydrophobicContact CG2-CD1 4.11Å; T461-I465 WeakPolarHBondContact O-CD1 3.37Å; T461-I465 VanDerWaalsContact O-CG1 3.23Å; T461-I465 WeakPolarHBondContact O-CG1 3.28Å; T461-I465 PolarHBondContact O-N 3.1Å; I462-I465 WeakPolarHBondContact O-CB 3.31Å; I462-I465 PolarHBondContact O-N 2.81Å; I465-R467 PolarHBondContact O-N 2.83Å; I465-E468 PolarHBondContact O-N 2.92Å; I465-Q469 VanDerWaalsContact CG2-NE2 3.26Å; I465-Q469 WeakPolarHBondContact O-CG 3.26Å; I465-Q469 PolarHBondContact O-N 2.81Å
466	Y	68.7	Low	68.5	Low	120 Å²	120	90 Å²	90	47%	0.471	45%	0.447	S	S	.	.	H	α-helix	trans	-64.6	-39.1	177.3	-74.6	-65.4	0	0	0	112.6	I462 C463 E468 Q469 D470	I462-Y466 HydrophobicContact CG2-CD2 3.79Å; I462-Y466 HydrophobicContact CG2-CE2 3.5Å; I462-Y466 VanDerWaalsContact O-CD2 3.23Å; I462-Y466 WeakPolarHBondContact O-CD2 3.47Å; I462-Y466 PolarHBondContact O-N 3.28Å; C463-Y466 PolarHBondContact O-N 3.32Å; Y466-E468 VanDerWaalsContact C-N 3.26Å; Y466-E468 PolarHBondContact O-N 2.95Å; Y466-Q469 PolarHBondContact O-N 3.35Å; Y466-D470 PolarHBondContact O-N 2.8Å; Y466-D470 VanDerWaalsContact O-N 3.14Å
467	R	70.6	Confident	69	Low	164 Å²	164	90.4 Å²	90.4	62%	0.619	45%	0.451	S	S	*	.	H	α-helix	trans	-66.4	-21	174.1	-71.2	169.9	-174.9	177.9	3	114.3	C463 Q464 I465	C463-R467 WeakPolarHBondContact O-CB 3.46Å; C463-R467 WeakPolarHBondContact O-CG 3.46Å; C463-R467 PolarHBondContact O-N 3.36Å; Q464-R467 PolarHBondContact O-N 2.75Å; I465-R467 PolarHBondContact O-N 2.83Å
468	E	70.8	Confident	69.4	Low	84 Å²	84	91.2 Å²	91.2	39%	0.393	45%	0.452	S	S	.	.	H	α-helix	trans	-91.5	-22.5	174.9	-75	-174.3	-171.3	0	0	113.1	R385 Q464 I465 Y466	R385-E468 IonicContact CZ-OE1 2.78Å; R385-E468 IonicContact CZ-OE2 3.61Å; R385-E468 VanDerWaalsContact CZ-OE2 3.23Å; R385-E468 IonicContact NE-OE2 3.12Å; R385-E468 IonicContact NH1-OE1 2.75Å; R385-E468 PolarHBondContact NH1-OE1 3.25Å; R385-E468 IonicContact NH1-OE2 3.95Å; R385-E468 IonicContact NH2-OE1 2.82Å; R385-E468 PolarHBondContact NH2-OE1 3.15Å; R385-E468 IonicContact NH2-OE2 3.82Å; R385-E468 PolarHBondContact NH2-OE2 3.17Å; Q464-E468 WeakPolarHBondContact O-CB 3.21Å; Q464-E468 WeakPolarHBondContact O-CG 3.23Å; Q464-E468 PolarHBondContact O-N 2.83Å; I465-E468 PolarHBondContact O-N 2.92Å; Y466-E468 VanDerWaalsContact C-N 3.26Å; Y466-E468 PolarHBondContact O-N 2.95Å
469	Q	65.9	Low	70	Confident	123 Å²	123	91.5 Å²	91.5	58%	0.575	45%	0.453	S	S	*	.	H	α-helix	trans	-84	-13.9	171.8	-68.4	-178.3	35.7	0	0	112.9	I465 Y466 L471	I465-Q469 VanDerWaalsContact CG2-NE2 3.26Å; I465-Q469 WeakPolarHBondContact O-CG 3.26Å; I465-Q469 PolarHBondContact O-N 2.81Å; Y466-Q469 PolarHBondContact O-N 3.35Å; Q469-L471 PolarHBondContact O-N 3.5Å
470	D	71.2	Confident	70.1	Confident	39 Å²	39	97.9 Å²	97.9	21%	0.209	47%	0.473	C	S	.	.			trans	-76.2	90	-179.2	-156.9	-29.6	0	0	0	112.6	Y466 T472 R473 K483	Y466-D470 PolarHBondContact O-N 2.8Å; Y466-D470 VanDerWaalsContact O-N 3.14Å; D470-T472 PolarHBondContact O-N 3.34Å; D470-T472 VanDerWaalsContact O-N 3.14Å; D470-T472 WeakPolarHBondContact OD1-CA 3.47Å; D470-T472 WeakPolarHBondContact OD1-CB 3.35Å; D470-T472 PolarHBondContact OD1-N 2.95Å; D470-T472 PolarHBondContact OD1-OG1 2.94Å; D470-R473 VanDerWaalsContact O-CB 3.25Å; D470-R473 WeakPolarHBondContact O-CB 3.45Å; D470-R473 PolarHBondContact O-N 3.35Å; D470-R473 VanDerWaalsContact O-N 3.13Å; D470-K483 WeakPolarHBondContact OD2-CD 3.34Å; D470-K483 VanDerWaalsContact OD2-CE 3.26Å; D470-K483 WeakPolarHBondContact OD2-CE 3.43Å; D470-K483 IonicContact OD2-NZ 3.15Å; D470-K483 PolarHBondContact OD2-NZ 3.02Å
471	L	70.9	Confident	70.2	Confident	163 Å²	163	101.4 Å²	101.4	85%	0.853	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-13.7	174.2	-60.8	177.2	0	0	0	113.5	Q469 R473	Q469-L471 PolarHBondContact O-N 3.5Å; L471-R473 VanDerWaalsContact C-N 3.33Å
472	T	66.6	Low	70.3	Confident	53 Å²	53	110.4 Å²	110.4	33%	0.325	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-6.8	177	70.1	0	0	0	0	113.1	D470 E474 L475	D470-T472 PolarHBondContact O-N 3.34Å; D470-T472 VanDerWaalsContact O-N 3.14Å; D470-T472 WeakPolarHBondContact OD1-CA 3.47Å; D470-T472 WeakPolarHBondContact OD1-CB 3.35Å; D470-T472 PolarHBondContact OD1-N 2.95Å; D470-T472 PolarHBondContact OD1-OG1 2.94Å; T472-E474 VanDerWaalsContact C-N 3.25Å; T472-E474 PolarHBondContact O-N 3Å; T472-L475 HydrophobicContact CG2-CD1 4.04Å; T472-L475 WeakPolarHBondContact O-CB 3.21Å; T472-L475 PolarHBondContact O-N 3.16Å
473	R	67.9	Low	70.2	Confident	182 Å²	182	114.8 Å²	114.8	69%	0.687	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.4	-179.7	-174.6	175.7	176.7	-170.9	-2.8	114.6	D470 L471	D470-R473 VanDerWaalsContact O-CB 3.25Å; D470-R473 WeakPolarHBondContact O-CB 3.45Å; D470-R473 PolarHBondContact O-N 3.35Å; D470-R473 VanDerWaalsContact O-N 3.13Å; L471-R473 VanDerWaalsContact C-N 3.33Å
474	E	65.4	Low	70.5	Confident	179 Å²	179	117.1 Å²	117.1	84%	0.836	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	0	176.4	-64.5	-178.5	-178.2	0	0	112.7	T472 G476	T472-E474 VanDerWaalsContact C-N 3.25Å; T472-E474 PolarHBondContact O-N 3Å; E474-G476 PolarHBondContact O-N 2.89Å
475	L	75.9	Confident	70.7	Confident	64 Å²	64	117.9 Å²	117.9	34%	0.335	55%	0.547	S	S	.	.			trans	-89.6	103.6	175.6	-56.3	176.2	0	0	0	109.1	T472 M481	T472-L475 HydrophobicContact CG2-CD1 4.04Å; T472-L475 WeakPolarHBondContact O-CB 3.21Å; T472-L475 PolarHBondContact O-N 3.16Å; L475-M481 HydrophobicContact CD1-CB 4.36Å; L475-M481 HydrophobicContact CD1-CE 3.73Å; L475-M481 HydrophobicContact CD1-SD 4.07Å; L475-M481 HydrophobicContact CD2-CE 3.76Å; L475-M481 HydrophobicContact CG-CE 4.25Å
476	G	66.3	Low	71.4	Confident	28 Å²	28	119.9 Å²	119.9	29%	0.289	57%	0.565	S	S	.	*			trans	-70.3	170.6	175.4	0	0	0	0	0	113.1	E474 E478 H479	E474-G476 PolarHBondContact O-N 2.89Å; G476-E478 VanDerWaalsContact C-CD 3.45Å; G476-E478 VanDerWaalsContact CA-CD 3.46Å; G476-E478 VanDerWaalsContact CA-OE1 3.23Å; G476-E478 WeakPolarHBondContact CA-OE1 3.47Å; G476-E478 VanDerWaalsContact CA-OE2 3.23Å; G476-E478 WeakPolarHBondContact CA-OE2 3.37Å; G476-E478 PolarHBondContact N-OE1 3.46Å; G476-E478 PolarHBondContact O-N 3.21Å; G476-E478 VanDerWaalsContact O-N 3.13Å; G476-H479 PolarHBondContact O-N 2.82Å; G476-H479 VanDerWaalsContact O-N 3.09Å
477	M	65.2	Low	72.1	Confident	179 Å²	179	115.7 Å²	115.7	88%	0.882	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-60.5	-24.4	-175.8	-65.3	175.9	65.4	0	0	112.8	H479 F480	M477-H479 PolarHBondContact O-N 3.46Å; M477-H479 VanDerWaalsContact O-N 3.13Å; M477-F480 PolarHBondContact O-N 2.98Å
478	E	75.5	Confident	72.8	Confident	127 Å²	127	112.4 Å²	112.4	59%	0.593	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-57.6	-20	174.2	65.5	-79.2	179.1	0	0	114.5	G476 F480	G476-E478 VanDerWaalsContact C-CD 3.45Å; G476-E478 VanDerWaalsContact CA-CD 3.46Å; G476-E478 VanDerWaalsContact CA-OE1 3.23Å; G476-E478 WeakPolarHBondContact CA-OE1 3.47Å; G476-E478 VanDerWaalsContact CA-OE2 3.23Å; G476-E478 WeakPolarHBondContact CA-OE2 3.37Å; G476-E478 PolarHBondContact N-OE1 3.46Å; G476-E478 PolarHBondContact O-N 3.21Å; G476-E478 VanDerWaalsContact O-N 3.13Å; E478-F480 WeakPolarHBondContact O-CD2 3.35Å
479	H	77	Confident	73.6	Confident	97 Å²	97	109.3 Å²	109.3	45%	0.449	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-91.2	-8.3	-178.1	-69.2	-39.5	0	0	0	114.7	G476 M477 M481	G476-H479 PolarHBondContact O-N 2.82Å; G476-H479 VanDerWaalsContact O-N 3.09Å; M477-H479 PolarHBondContact O-N 3.46Å; M477-H479 VanDerWaalsContact O-N 3.13Å; H479-M481 HydrophobicContact CB-CE 3.67Å; H479-M481 HydrophobicContact CB-CG 4.49Å; H479-M481 PolarHBondContact O-N 3.21Å
480	F	67.6	Low	74.5	Confident	196 Å²	196	105.3 Å²	105.3	86%	0.86	53%	0.526	S	S	*	.			trans	51.1	19	-177.9	-58.4	-84.4	0	0	0	114.9	M477 E478	M477-F480 PolarHBondContact O-N 2.98Å; E478-F480 WeakPolarHBondContact O-CD2 3.35Å
481	M	72.8	Confident	75.2	Confident	123 Å²	123	104.6 Å²	104.6	61%	0.606	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-88.9	123.1	178.8	-75	-169.9	-86.3	0	0	109.6	L475 H479	L475-M481 HydrophobicContact CD1-CB 4.36Å; L475-M481 HydrophobicContact CD1-CE 3.73Å; L475-M481 HydrophobicContact CD1-SD 4.07Å; L475-M481 HydrophobicContact CD2-CE 3.76Å; L475-M481 HydrophobicContact CG-CE 4.25Å; H479-M481 HydrophobicContact CB-CE 3.67Å; H479-M481 HydrophobicContact CB-CG 4.49Å; H479-M481 PolarHBondContact O-N 3.21Å
482	R	71.4	Confident	76	Confident	225 Å²	225	98.1 Å²	98.1	85%	0.849	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-100.2	132.3	173.8	-175.5	174	178.1	170.3	1.3	109.8	V484	R482-V484 PolarHBondContact O-N 2.9Å
483	K	71.9	Confident	77	Confident	99 Å²	99	101.3 Å²	101.3	43%	0.43	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-59.1	120.5	167.8	-175.7	-178.7	179.4	-175.8	0	109.5	D470 E485	D470-K483 WeakPolarHBondContact OD2-CD 3.34Å; D470-K483 VanDerWaalsContact OD2-CE 3.26Å; D470-K483 WeakPolarHBondContact OD2-CE 3.43Å; D470-K483 IonicContact OD2-NZ 3.15Å; D470-K483 PolarHBondContact OD2-NZ 3.02Å; K483-E485 WeakPolarHBondContact CE-OE1 3.03Å; K483-E485 HydrophobicContact CG-CG 4.46Å; K483-E485 IonicContact NZ-OE1 3.81Å; K483-E485 PolarHBondContact NZ-OE1 3.13Å; K483-E485 VanDerWaalsContact NZ-OE1 3.15Å
484	V	72.4	Confident	78	Confident	109 Å²	109	97 Å²	97	66%	0.661	50%	0.499	S	S	*	.			trans	-113	114	171.4	179.5	0	0	0	0	107.4	R482	R482-V484 PolarHBondContact O-N 2.9Å
485	E	78.9	Confident	79.1	Confident	114 Å²	114	95.9 Å²	95.9	53%	0.533	49%	0.491	S	S	.	.			trans	-78.9	137.3	171.9	-61.2	-174.3	166.7	0	0	108.9	K483 M498	K483-E485 WeakPolarHBondContact CE-OE1 3.03Å; K483-E485 HydrophobicContact CG-CG 4.46Å; K483-E485 IonicContact NZ-OE1 3.81Å; K483-E485 PolarHBondContact NZ-OE1 3.13Å; K483-E485 VanDerWaalsContact NZ-OE1 3.15Å; E485-M498 VanDerWaalsContact C-CG 3.47Å; E485-M498 HydrophobicContact CB-CB 4.27Å; E485-M498 HydrophobicContact CB-CG 3.8Å; E485-M498 VanDerWaalsContact O-CB 3.31Å; E485-M498 WeakPolarHBondContact O-CB 3.47Å; E485-M498 VanDerWaalsContact O-CG 3.29Å; E485-M498 WeakPolarHBondContact O-CG 3.46Å; E485-M498 PolarHBondContact O-N 2.87Å
486	A	85.6	Confident	79.7	Confident	50 Å²	50	93.6 Å²	93.6	41%	0.413	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	127.7	-176.8	0	0	0	0	0	110.4	I496	A486-I496 CarbonylContact C-O 3.43Å; A486-I496 WeakPolarHBondContact CA-O 3.35Å; A486-I496 WeakPolarHBondContact CB-O 3.45Å
487	A	83.6	Confident	80.8	Confident	31 Å²	31	94.8 Å²	94.8	26%	0.256	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	129	171.8	0	0	0	0	0	110.2	I496 M498 I503	A487-I496 PolarHBondContact N-O 2.86Å; A487-I496 PolarHBondContact O-N 2.8Å; A487-M498 HydrophobicContact CB-SD 3.84Å; A487-I503 HydrophobicContact CB-CD1 4.09Å; A487-I503 HydrophobicContact CB-CG1 4.44Å
488	H	85.4	Confident	81.8	Confident	95 Å²	95	91.6 Å²	91.6	44%	0.44	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	114.4	171.2	177.9	-102.7	0	0	0	110.5	G490 D493 F495	H488-G490 PolarHBondContact O-N 3.43Å; H488-G490 VanDerWaalsContact O-N 3.15Å; H488-D493 IonicContact CE1-OD1 2.81Å; H488-D493 IonicContact NE2-OD1 2.72Å; H488-F495 HydrophobicContact CB-CD1 3.95Å; H488-F495 HydrophobicContact CB-CE1 3.79Å; H488-F495 AromaticContact CD2-CD1 3.94Å; H488-F495 AromaticContact CD2-CE1 3.58Å; H488-F495 AromaticContact CD2-CE2 3.96Å; H488-F495 AromaticContact CD2-CZ 3.58Å; H488-F495 AromaticContact CG-CE1 3.96Å
489	C	88.4	Confident	82.4	Confident	19 Å²	19	90.7 Å²	90.7	13%	0.128	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	93.5	171.1	-175	0	0	0	0	110.6	A491 C492 D493 L494 I496 H506 H512	C489-A491 PolarHBondContact O-N 3.12Å; C489-C492 PolarHBondContact O-N 3.15Å; C489-D493 WeakPolarHBondContact O-CA 3.49Å; C489-D493 PolarHBondContact O-N 3.27Å; C489-L494 PolarHBondContact N-O 2.95Å; C489-I496 HydrophobicContact CB-CD1 4.06Å; C489-H506 WeakPolarHBondContact CB-NE2 3.44Å; C489-H506 PolarHBondContact SG-NE2 3.49Å; C489-H512 VanDerWaalsContact SG-CE1 3.5Å; C489-H512 PolarHBondContact SG-ND1 2.96Å; C489-H512 VanDerWaalsContact SG-ND1 3.43Å
490	G	84.3	Confident	82.8	Confident	40 Å²	40	90.5 Å²	90.5	41%	0.412	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	11.2	176.1	0	0	0	0	0	116.2	H488 M519	H488-G490 PolarHBondContact O-N 3.43Å; H488-G490 VanDerWaalsContact O-N 3.15Å; G490-M519 WeakPolarHBondContact O-CE 3.42Å
491	A	86.2	Confident	83.9	Confident	23 Å²	23	87.3 Å²	87.3	19%	0.19	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-24	166.4	0	0	0	0	0	113.2	C489 N515 M519	C489-A491 PolarHBondContact O-N 3.12Å; A491-N515 WeakPolarHBondContact O-CB 3.04Å; A491-M519 HydrophobicContact CB-CB 4.39Å; A491-M519 HydrophobicContact CB-CG 4.03Å
492	C	87.4	Confident	84.7	Confident	27 Å²	27	84.5 Å²	84.5	18%	0.182	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-4.9	178.4	-60.4	0	0	0	0	112.8	C489 L494 N515	C489-C492 PolarHBondContact O-N 3.15Å; C492-L494 HydrophobicContact CB-CB 4.39Å; C492-L494 HydrophobicContact CB-CD1 4.02Å; C492-L494 HydrophobicContact CB-CG 3.97Å; C492-L494 PolarHBondContact O-N 3.39Å; C492-N515 PolarHBondContact SG-ND2 3.31Å
493	D	87.3	Confident	85.6	Confident	120 Å²	120	75.8 Å²	75.8	64%	0.642	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	40.6	-170.9	-59.5	-33.5	0	0	0	112.9	H488 C489	H488-D493 IonicContact CE1-OD1 2.81Å; H488-D493 IonicContact NE2-OD1 2.72Å; C489-D493 WeakPolarHBondContact O-CA 3.49Å; C489-D493 PolarHBondContact O-N 3.27Å
494	L	89.3	Confident	86.5	Confident	92 Å²	92	75.8 Å²	75.8	48%	0.482	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	133.7	179.2	-65.8	179.2	0	0	0	111.2	C489 C492	C489-L494 PolarHBondContact N-O 2.95Å; C492-L494 HydrophobicContact CB-CB 4.39Å; C492-L494 HydrophobicContact CB-CD1 4.02Å; C492-L494 HydrophobicContact CB-CG 3.97Å; C492-L494 PolarHBondContact O-N 3.39Å
495	F	88.9	Confident	87.4	Confident	155 Å²	155	77.8 Å²	77.8	68%	0.68	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	126.7	167.3	-65.4	-82.9	0	0	0	110	H488	H488-F495 HydrophobicContact CB-CD1 3.95Å; H488-F495 HydrophobicContact CB-CE1 3.79Å; H488-F495 AromaticContact CD2-CD1 3.94Å; H488-F495 AromaticContact CD2-CE1 3.58Å; H488-F495 AromaticContact CD2-CE2 3.96Å; H488-F495 AromaticContact CD2-CZ 3.58Å; H488-F495 AromaticContact CG-CE1 3.96Å
496	I	89.1	Confident	88.1	Confident	17 Å²	17	73.5 Å²	73.5	9%	0.087	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128.7	-178	-52.9	155.3	0	0	0	106.4	A486 A487 C489 L502 I503 H506	A486-I496 CarbonylContact C-O 3.43Å; A486-I496 WeakPolarHBondContact CA-O 3.35Å; A486-I496 WeakPolarHBondContact CB-O 3.45Å; A487-I496 PolarHBondContact N-O 2.86Å; A487-I496 PolarHBondContact O-N 2.8Å; C489-I496 HydrophobicContact CB-CD1 4.06Å; I496-L502 HydrophobicContact CG2-CB 3.89Å; I496-I503 HydrophobicContact CB-CG1 4.45Å; I496-I503 HydrophobicContact CG2-CG1 3.82Å; I496-H506 HydrophobicContact CD1-CB 3.72Å; I496-H506 WeakPolarHBondContact CD1-CD2 3.25Å; I496-H506 HydrophobicContact CG1-CB 4.43Å
497	P	89.2	Confident	88.4	Confident	52 Å²	52	74.8 Å²	74.8	34%	0.338	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	148.8	174.8	-23.5	33.3	0	0	0	111.4	Q499 L502	P497-Q499 HydrophobicContact CB-CG 4.5Å; P497-Q499 PolarHBondContact O-N 3.4Å; P497-L502 HydrophobicContact CB-CD1 4.12Å; P497-L502 HydrophobicContact CG-CD1 3.89Å
498	M	85.7	Confident	88.8	Confident	113 Å²	113	80.1 Å²	80.1	56%	0.557	41%	0.412	S	S	*	.	S	Bend	trans	-70.1	60.8	175.5	-74.2	-66.8	-71.6	0	0	112.2	E485 A487 I503	E485-M498 VanDerWaalsContact C-CG 3.47Å; E485-M498 HydrophobicContact CB-CB 4.27Å; E485-M498 HydrophobicContact CB-CG 3.8Å; E485-M498 VanDerWaalsContact O-CB 3.31Å; E485-M498 WeakPolarHBondContact O-CB 3.47Å; E485-M498 VanDerWaalsContact O-CG 3.29Å; E485-M498 WeakPolarHBondContact O-CG 3.46Å; E485-M498 PolarHBondContact O-N 2.87Å; A487-M498 HydrophobicContact CB-SD 3.84Å; M498-I503 HydrophobicContact SD-CD1 4.05Å
499	Q	87.6	Confident	89.1	Confident	107 Å²	107	76.9 Å²	76.9	50%	0.5	40%	0.399	S	S	.	.			trans	-120.2	123.2	172.6	-67.7	-177.3	-8.3	0	0	107.8	P497 H501 L502 I503	P497-Q499 HydrophobicContact CB-CG 4.5Å; P497-Q499 PolarHBondContact O-N 3.4Å; Q499-H501 VanDerWaalsContact C-N 3.26Å; Q499-H501 PolarHBondContact O-N 2.85Å; Q499-L502 HydrophobicContact CB-CB 4.34Å; Q499-L502 HydrophobicContact CB-CD1 4.19Å; Q499-L502 HydrophobicContact CB-CG 4.13Å; Q499-L502 PolarHBondContact O-N 3.04Å; Q499-L502 VanDerWaalsContact OE1-CD1 3.25Å; Q499-I503 PolarHBondContact O-N 2.94Å; Q499-I503 VanDerWaalsContact O-N 3.13Å
500	P	86.9	Confident	89.1	Confident	94 Å²	94	80.8 Å²	80.8	61%	0.61	42%	0.424	S	S	*	.	H	α-helix	trans	-58.5	-39.2	-171.3	21.7	-32.9	0	0	0	111.9	L502 I503 Q504	P500-L502 PolarHBondContact O-N 3.26Å; P500-I503 PolarHBondContact O-N 3.42Å; P500-Q504 VanDerWaalsContact O-CB 3.23Å; P500-Q504 WeakPolarHBondContact O-CB 3.32Å; P500-Q504 PolarHBondContact O-N 3.48Å
501	H	90.3	Very high	89.3	Confident	129 Å²	129	84.3 Å²	84.3	60%	0.597	43%	0.434	S	S	*	.	H	α-helix	trans	-65.9	-33.7	179.2	-46.3	-58	0	0	0	113.7	Q499 K505	Q499-H501 VanDerWaalsContact C-N 3.26Å; Q499-H501 PolarHBondContact O-N 2.85Å; H501-K505 VanDerWaalsContact O-CB 3.31Å; H501-K505 WeakPolarHBondContact O-CB 3.42Å; H501-K505 WeakPolarHBondContact O-CD 3.37Å; H501-K505 WeakPolarHBondContact O-CG 3.23Å; H501-K505 PolarHBondContact O-N 3.28Å
502	L	89.2	Confident	89.6	Confident	64 Å²	64	84.1 Å²	84.1	34%	0.335	43%	0.429	S	S	.	.	H	α-helix	trans	-74.3	-42.2	177.1	-65.4	-176.1	0	0	0	111	I496 P497 Q499 P500 K505 H506	I496-L502 HydrophobicContact CG2-CB 3.89Å; P497-L502 HydrophobicContact CB-CD1 4.12Å; P497-L502 HydrophobicContact CG-CD1 3.89Å; Q499-L502 HydrophobicContact CB-CB 4.34Å; Q499-L502 HydrophobicContact CB-CD1 4.19Å; Q499-L502 HydrophobicContact CB-CG 4.13Å; Q499-L502 PolarHBondContact O-N 3.04Å; Q499-L502 VanDerWaalsContact OE1-CD1 3.25Å; P500-L502 PolarHBondContact O-N 3.26Å; L502-K505 PolarHBondContact O-N 3.39Å; L502-H506 WeakPolarHBondContact O-CB 3.43Å; L502-H506 PolarHBondContact O-N 2.88Å
503	I	89.8	Confident	89.7	Confident	41 Å²	41	86.3 Å²	86.3	21%	0.21	44%	0.439	C	S	.	.	H	α-helix	trans	-61.9	-46.5	174.9	-65.6	170	0	0	0	110.2	A487 I496 M498 Q499 P500 H506 I507	A487-I503 HydrophobicContact CB-CD1 4.09Å; A487-I503 HydrophobicContact CB-CG1 4.44Å; I496-I503 HydrophobicContact CB-CG1 4.45Å; I496-I503 HydrophobicContact CG2-CG1 3.82Å; M498-I503 HydrophobicContact SD-CD1 4.05Å; Q499-I503 PolarHBondContact O-N 2.94Å; Q499-I503 VanDerWaalsContact O-N 3.13Å; P500-I503 PolarHBondContact O-N 3.42Å; I503-H506 PolarHBondContact O-N 3.2Å; I503-I507 HydrophobicContact CG2-CD1 3.64Å; I503-I507 HydrophobicContact CG2-CG1 4.36Å; I503-I507 WeakPolarHBondContact O-CG1 3.34Å; I503-I507 PolarHBondContact O-N 3.33Å
504	Q	91.3	Very high	89.8	Confident	100 Å²	100	89.1 Å²	89.1	47%	0.467	44%	0.442	S	S	.	.	H	α-helix	trans	-65.6	-41.2	179.7	-160.6	-167.1	39.7	0	0	112	P500 H506 I507 K508	P500-Q504 VanDerWaalsContact O-CB 3.23Å; P500-Q504 WeakPolarHBondContact O-CB 3.32Å; P500-Q504 PolarHBondContact O-N 3.48Å; Q504-H506 VanDerWaalsContact C-N 3.32Å; Q504-H506 PolarHBondContact O-N 2.92Å; Q504-I507 PolarHBondContact O-N 3.39Å; Q504-K508 HydrophobicContact CG-CD 4.11Å; Q504-K508 VanDerWaalsContact O-CB 3.32Å; Q504-K508 WeakPolarHBondContact O-CB 3.27Å; Q504-K508 VanDerWaalsContact O-CG 3.32Å; Q504-K508 WeakPolarHBondContact O-CG 3.35Å; Q504-K508 PolarHBondContact O-N 3.13Å
505	K	92.1	Very high	89.7	Confident	150 Å²	150	87.5 Å²	87.5	65%	0.652	43%	0.433	S	S	*	.	H	α-helix	trans	-60	-40.6	172.3	-78.2	171.4	-177.7	179.5	0	111.9	H501 L502 S509	H501-K505 VanDerWaalsContact O-CB 3.31Å; H501-K505 WeakPolarHBondContact O-CB 3.42Å; H501-K505 WeakPolarHBondContact O-CD 3.37Å; H501-K505 WeakPolarHBondContact O-CG 3.23Å; H501-K505 PolarHBondContact O-N 3.28Å; L502-K505 PolarHBondContact O-N 3.39Å; K505-S509 PolarHBondContact O-N 3.41Å
506	H	92.4	Very high	89.7	Confident	25 Å²	25	87 Å²	87	12%	0.116	43%	0.427	C	S	.	.	H	α-helix	trans	-66.4	-49.9	175.4	175.9	77.1	0	0	0	112.4	C489 I496 L502 I503 Q504 K508 S509 H512	C489-H506 WeakPolarHBondContact CB-NE2 3.44Å; C489-H506 PolarHBondContact SG-NE2 3.49Å; I496-H506 HydrophobicContact CD1-CB 3.72Å; I496-H506 WeakPolarHBondContact CD1-CD2 3.25Å; I496-H506 HydrophobicContact CG1-CB 4.43Å; L502-H506 WeakPolarHBondContact O-CB 3.43Å; L502-H506 PolarHBondContact O-N 2.88Å; I503-H506 PolarHBondContact O-N 3.2Å; Q504-H506 VanDerWaalsContact C-N 3.32Å; Q504-H506 PolarHBondContact O-N 2.92Å; H506-K508 VanDerWaalsContact C-N 3.29Å; H506-K508 PolarHBondContact O-N 2.99Å; H506-S509 VanDerWaalsContact O-CB 3.22Å; H506-S509 WeakPolarHBondContact O-CB 3.38Å; H506-S509 PolarHBondContact O-N 2.5Å; H506-S509 PolarHBondContact O-OG 3.03Å; H506-H512 AromaticContact CD2-ND1 3.4Å; H506-H512 PolarHBondContact CD2-ND1 2.77Å; H506-H512 AromaticContact CE1-ND1 3.9Å; H506-H512 AromaticContact NE2-CE1 3.89Å; H506-H512 AromaticContact NE2-CG 3.75Å; H506-H512 AromaticContact NE2-ND1 2.93Å; H506-H512 PolarHBondContact NE2-ND1 2.72Å; H506-H512 WeakPolarHBondContact O-CB 3.43Å
507	I	91.6	Very high	89.5	Confident	76 Å²	76	94.1 Å²	94.1	39%	0.39	46%	0.457	S	S	.	.	H	α-helix	trans	-63.4	-36	-178.2	-66.4	169.7	0	0	0	111.5	I503 Q504 S509 H512 N513	I503-I507 HydrophobicContact CG2-CD1 3.64Å; I503-I507 HydrophobicContact CG2-CG1 4.36Å; I503-I507 WeakPolarHBondContact O-CG1 3.34Å; I503-I507 PolarHBondContact O-N 3.33Å; Q504-I507 PolarHBondContact O-N 3.39Å; I507-S509 VanDerWaalsContact C-N 3.26Å; I507-S509 PolarHBondContact O-N 3.05Å; I507-H512 PolarHBondContact O-CD2 2.71Å; I507-N513 PolarHBondContact O-ND2 3.13Å
508	K	92.3	Very high	89.3	Confident	144 Å²	144	93.1 Å²	93.1	63%	0.626	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-11.6	174.6	-70.6	177.6	175.5	178	0	113.5	Q504 H506	Q504-K508 HydrophobicContact CG-CD 4.11Å; Q504-K508 VanDerWaalsContact O-CB 3.32Å; Q504-K508 WeakPolarHBondContact O-CB 3.27Å; Q504-K508 VanDerWaalsContact O-CG 3.32Å; Q504-K508 WeakPolarHBondContact O-CG 3.35Å; Q504-K508 PolarHBondContact O-N 3.13Å; H506-K508 VanDerWaalsContact C-N 3.29Å; H506-K508 PolarHBondContact O-N 2.99Å
509	S	92.2	Very high	89.3	Confident	26 Å²	26	91.5 Å²	91.5	18%	0.182	45%	0.449	C	S	.	.	S	Bend	trans	-66.5	145.7	-178.6	73.7	0	0	0	0	112.6	K505 H506 I507 D511 H512 N513	K505-S509 PolarHBondContact O-N 3.41Å; H506-S509 VanDerWaalsContact O-CB 3.22Å; H506-S509 WeakPolarHBondContact O-CB 3.38Å; H506-S509 PolarHBondContact O-N 2.5Å; H506-S509 PolarHBondContact O-OG 3.03Å; I507-S509 VanDerWaalsContact C-N 3.26Å; I507-S509 PolarHBondContact O-N 3.05Å; S509-D511 VanDerWaalsContact C-N 3.29Å; S509-D511 PolarHBondContact O-N 3.44Å; S509-H512 PolarHBondContact O-N 2.9Å; S509-H512 WeakPolarHBondContact OG-CB 3.46Å; S509-H512 PolarHBondContact OG-N 2.67Å; S509-N513 PolarHBondContact O-N 3.43Å; S509-N513 VanDerWaalsContact O-N 3.12Å; S509-N513 PolarHBondContact O-ND2 3.14Å
510	P	89.3	Confident	89	Confident	101 Å²	101	88.5 Å²	88.5	66%	0.656	44%	0.435	S	S	*	.	H	α-helix	trans	-63.8	-35.7	178.6	25.6	-33.9	0	0	0	112	N513 Y514	P510-N513 PolarHBondContact O-N 3.07Å; P510-Y514 PolarHBondContact O-N 3.19Å
511	D	88	Confident	89	Confident	115 Å²	115	88.7 Å²	88.7	62%	0.615	43%	0.428	S	S	*	.	H	α-helix	trans	-63.3	-44.8	177.6	-59.2	-37.1	0	0	0	111.5	S509 N513 Y514 N515	S509-D511 VanDerWaalsContact C-N 3.29Å; S509-D511 PolarHBondContact O-N 3.44Å; D511-N513 VanDerWaalsContact C-N 3.32Å; D511-N513 PolarHBondContact O-N 3.46Å; D511-Y514 PolarHBondContact O-N 3.19Å; D511-N515 WeakPolarHBondContact O-CB 3.43Å; D511-N515 VanDerWaalsContact O-CG 3.29Å; D511-N515 PolarHBondContact O-N 3.01Å; D511-N515 PolarHBondContact O-ND2 2.75Å
512	H	92.5	Very high	88.7	Confident	18 Å²	18	88.5 Å²	88.5	8%	0.083	43%	0.427	C	S	.	.	H	α-helix	trans	-59.9	-43.4	173	179.9	92.1	0	0	0	111.2	C489 H506 I507 S509 N515 R516	C489-H512 VanDerWaalsContact SG-CE1 3.5Å; C489-H512 PolarHBondContact SG-ND1 2.96Å; C489-H512 VanDerWaalsContact SG-ND1 3.43Å; H506-H512 AromaticContact CD2-ND1 3.4Å; H506-H512 PolarHBondContact CD2-ND1 2.77Å; H506-H512 AromaticContact CE1-ND1 3.9Å; H506-H512 AromaticContact NE2-CE1 3.89Å; H506-H512 AromaticContact NE2-CG 3.75Å; H506-H512 AromaticContact NE2-ND1 2.93Å; H506-H512 PolarHBondContact NE2-ND1 2.72Å; H506-H512 WeakPolarHBondContact O-CB 3.43Å; I507-H512 PolarHBondContact O-CD2 2.71Å; S509-H512 PolarHBondContact O-N 2.9Å; S509-H512 WeakPolarHBondContact OG-CB 3.46Å; S509-H512 PolarHBondContact OG-N 2.67Å; H512-N515 PolarHBondContact O-N 2.78Å; H512-R516 WeakPolarHBondContact O-CA 3.25Å; H512-R516 WeakPolarHBondContact O-CB 3.4Å; H512-R516 PolarHBondContact O-N 3.14Å
513	N	89.1	Confident	88.4	Confident	73 Å²	73	87.1 Å²	87.1	39%	0.39	43%	0.425	S	S	.	.	H	α-helix	trans	-66.5	-38.3	-179.4	-76.5	-67.3	0	0	0	113	I507 S509 P510 D511 K517	I507-N513 PolarHBondContact O-ND2 3.13Å; S509-N513 PolarHBondContact O-N 3.43Å; S509-N513 VanDerWaalsContact O-N 3.12Å; S509-N513 PolarHBondContact O-ND2 3.14Å; P510-N513 PolarHBondContact O-N 3.07Å; D511-N513 VanDerWaalsContact C-N 3.32Å; D511-N513 PolarHBondContact O-N 3.46Å; N513-K517 PolarHBondContact O-N 3.34Å; N513-K517 VanDerWaalsContact O-N 3.17Å
514	Y	88.3	Confident	88.2	Confident	180 Å²	180	87.4 Å²	87.4	71%	0.706	43%	0.425	S	S	*	.	H	α-helix	trans	-64	-51.8	172.8	-179.3	-96.8	0	0	0	111.5	P510 D511 R516 K517 G518	P510-Y514 PolarHBondContact O-N 3.19Å; D511-Y514 PolarHBondContact O-N 3.19Å; Y514-R516 PolarHBondContact O-N 2.95Å; Y514-K517 WeakPolarHBondContact O-CB 3.23Å; Y514-K517 PolarHBondContact O-N 3.2Å; Y514-K517 VanDerWaalsContact O-N 3.15Å; Y514-G518 PolarHBondContact O-N 3.5Å
515	N	88.9	Confident	87.8	Confident	57 Å²	57	90.2 Å²	90.2	31%	0.305	43%	0.431	S	S	.	.	H	α-helix	trans	-65.1	-39.1	-178.8	-70.7	-21.2	0	0	0	112.2	A491 C492 D511 H512 K517 G518 M519	A491-N515 WeakPolarHBondContact O-CB 3.04Å; C492-N515 PolarHBondContact SG-ND2 3.31Å; D511-N515 WeakPolarHBondContact O-CB 3.43Å; D511-N515 VanDerWaalsContact O-CG 3.29Å; D511-N515 PolarHBondContact O-N 3.01Å; D511-N515 PolarHBondContact O-ND2 2.75Å; H512-N515 PolarHBondContact O-N 2.78Å; N515-K517 VanDerWaalsContact C-N 3.31Å; N515-K517 PolarHBondContact O-N 2.96Å; N515-G518 PolarHBondContact O-N 3.31Å; N515-M519 WeakPolarHBondContact O-CB 3.3Å; N515-M519 WeakPolarHBondContact O-CG 3.29Å; N515-M519 PolarHBondContact O-N 2.58Å
516	R	88.1	Confident	87.4	Confident	145 Å²	145	83.9 Å²	83.9	55%	0.547	41%	0.408	S	S	.	.	H	α-helix	trans	-57.1	-42.4	172.5	178.6	-178.5	178.5	-168.9	3.1	111.4	H512 Y514 M520	H512-R516 WeakPolarHBondContact O-CA 3.25Å; H512-R516 WeakPolarHBondContact O-CB 3.4Å; H512-R516 PolarHBondContact O-N 3.14Å; Y514-R516 PolarHBondContact O-N 2.95Å; R516-M520 VanDerWaalsContact O-CB 3.27Å; R516-M520 WeakPolarHBondContact O-CB 3.49Å; R516-M520 PolarHBondContact O-N 3.2Å
517	K	85.3	Confident	86.9	Confident	166 Å²	166	82.7 Å²	82.7	72%	0.722	40%	0.403	S	S	*	.	H	α-helix	trans	-65.6	-44.8	176.4	-171.3	176.6	-179.4	178.2	0	111.5	N513 Y514 N515 M520 E521	N513-K517 PolarHBondContact O-N 3.34Å; N513-K517 VanDerWaalsContact O-N 3.17Å; Y514-K517 WeakPolarHBondContact O-CB 3.23Å; Y514-K517 PolarHBondContact O-N 3.2Å; Y514-K517 VanDerWaalsContact O-N 3.15Å; N515-K517 VanDerWaalsContact C-N 3.31Å; N515-K517 PolarHBondContact O-N 2.96Å; K517-M520 PolarHBondContact O-N 2.94Å; K517-E521 PolarHBondContact O-N 3.41Å; K517-E521 VanDerWaalsContact O-N 3.15Å
518	G	85.4	Confident	86.6	Confident	31 Å²	31	79.9 Å²	79.9	32%	0.32	39%	0.389	S	S	.	.	H	α-helix	trans	-60.6	-46.6	175.3	0	0	0	0	0	112.8	Y514 N515 E521 Q522	Y514-G518 PolarHBondContact O-N 3.5Å; N515-G518 PolarHBondContact O-N 3.31Å; G518-E521 PolarHBondContact O-N 2.84Å; G518-Q522 WeakPolarHBondContact O-CG 3.31Å; G518-Q522 PolarHBondContact O-N 3.48Å
519	M	83.9	Confident	86.3	Confident	79 Å²	79	76.5 Å²	76.5	39%	0.389	38%	0.383	S	S	.	.	H	α-helix	trans	-67.4	-37.3	178.4	-74.4	-62.2	-70.4	0	0	113	G490 A491 N515 E521 Q522 A523	G490-M519 WeakPolarHBondContact O-CE 3.42Å; A491-M519 HydrophobicContact CB-CB 4.39Å; A491-M519 HydrophobicContact CB-CG 4.03Å; N515-M519 WeakPolarHBondContact O-CB 3.3Å; N515-M519 WeakPolarHBondContact O-CG 3.29Å; N515-M519 PolarHBondContact O-N 2.58Å; M519-E521 VanDerWaalsContact C-N 3.27Å; M519-E521 PolarHBondContact O-N 2.99Å; M519-Q522 PolarHBondContact O-N 3.46Å; M519-A523 VanDerWaalsContact O-CB 3.27Å; M519-A523 WeakPolarHBondContact O-CB 3.31Å; M519-A523 PolarHBondContact O-N 3.05Å
520	M	83	Confident	86	Confident	44 Å²	44	77 Å²	77	22%	0.217	39%	0.385	C	S	.	.	H	α-helix	trans	-59.6	-39.4	171.9	-172.9	71	-179.8	0	0	111.4	F417 D420 R516 K517 K524	F417-M520 HydrophobicContact CD2-CE 3.88Å; F417-M520 HydrophobicContact CD2-SD 3.49Å; F417-M520 WeakPolarHBondContact CD2-SD 3.46Å; F417-M520 HydrophobicContact CE2-CE 4.31Å; F417-M520 HydrophobicContact CE2-SD 3.49Å; F417-M520 WeakPolarHBondContact CE2-SD 3.17Å; F417-M520 HydrophobicContact CG-CE 4.4Å; D420-M520 HydrophobicContact CB-CE 3.97Å; R516-M520 VanDerWaalsContact O-CB 3.27Å; R516-M520 WeakPolarHBondContact O-CB 3.49Å; R516-M520 PolarHBondContact O-N 3.2Å; K517-M520 PolarHBondContact O-N 2.94Å; M520-K524 WeakPolarHBondContact O-CG 3.25Å; M520-K524 PolarHBondContact O-N 3.15Å
521	E	85.5	Confident	85.8	Confident	99 Å²	99	72.2 Å²	72.2	46%	0.463	35%	0.354	S	S	.	.	H	α-helix	trans	-73	-39.5	177.4	-158.8	-171.3	153	0	0	112.4	K517 G518 M519 A523 K524 R525	K517-E521 PolarHBondContact O-N 3.41Å; K517-E521 VanDerWaalsContact O-N 3.15Å; G518-E521 PolarHBondContact O-N 2.84Å; M519-E521 VanDerWaalsContact C-N 3.27Å; M519-E521 PolarHBondContact O-N 2.99Å; E521-A523 VanDerWaalsContact C-N 3.33Å; E521-K524 PolarHBondContact O-N 3.21Å; E521-R525 WeakPolarHBondContact O-CG 3.39Å; E521-R525 PolarHBondContact O-N 3.37Å; E521-R525 IonicContact OE1-CZ 3.26Å; E521-R525 VanDerWaalsContact OE1-CZ 3.26Å; E521-R525 IonicContact OE1-NE 3.17Å; E521-R525 PolarHBondContact OE1-NE 3.23Å; E521-R525 IonicContact OE1-NH2 2.66Å; E521-R525 PolarHBondContact OE1-NH2 3.2Å
522	Q	84.3	Confident	85.7	Confident	124 Å²	124	72.4 Å²	72.4	58%	0.579	35%	0.346	S	S	*	.	H	α-helix	trans	-63.3	-39.5	173	-69.4	-176.8	24.2	0	0	111.9	G518 M519 R525 G526	G518-Q522 WeakPolarHBondContact O-CG 3.31Å; G518-Q522 PolarHBondContact O-N 3.48Å; M519-Q522 PolarHBondContact O-N 3.46Å; Q522-R525 PolarHBondContact O-N 3.06Å; Q522-G526 PolarHBondContact O-N 2.84Å
523	A	83.8	Confident	85.3	Confident	35 Å²	35	75.4 Å²	75.4	29%	0.289	37%	0.369	S	S	.	.	H	α-helix	trans	-62	-44.5	174.2	0	0	0	0	0	111.3	F417 H421 M519 E521 R525 G526 S527	F417-A523 HydrophobicContact CZ-CB 4.37Å; H421-A523 VanDerWaalsContact NE2-CB 3.32Å; H421-A523 WeakPolarHBondContact NE2-CB 3.23Å; M519-A523 VanDerWaalsContact O-CB 3.27Å; M519-A523 WeakPolarHBondContact O-CB 3.31Å; M519-A523 PolarHBondContact O-N 3.05Å; E521-A523 VanDerWaalsContact C-N 3.33Å; A523-R525 PolarHBondContact O-N 3.31Å; A523-G526 CarbonylContact O-C 3.5Å; A523-G526 PolarHBondContact O-N 3.44Å; A523-S527 WeakPolarHBondContact O-CB 3.36Å; A523-S527 PolarHBondContact O-N 3.11Å
524	K	85.2	Confident	85	Confident	47 Å²	47	73 Å²	73	20%	0.204	36%	0.356	C	S	.	.	H	α-helix	trans	-59.9	-43.2	172.5	-76.6	177.1	-176.6	-173.6	0	113.3	H421 F424 M520 E521 G526 S527 L528	H421-K524 PolarHBondContact NE2-N 3.23Å; F424-K524 HydrophobicContact CB-CD 4.23Å; F424-K524 HydrophobicContact CB-CG 4.32Å; F424-K524 HydrophobicContact CD1-CB 3.61Å; F424-K524 HydrophobicContact CD1-CG 4.14Å; F424-K524 HydrophobicContact CE1-CB 3.78Å; F424-K524 VanDerWaalsContact CE1-O 3.29Å; F424-K524 WeakPolarHBondContact CE1-O 3.48Å; F424-K524 HydrophobicContact CG-CB 4.13Å; F424-K524 HydrophobicContact CG-CD 4.2Å; F424-K524 HydrophobicContact CG-CG 4.25Å; F424-K524 HydrophobicContact CZ-CB 4.47Å; M520-K524 WeakPolarHBondContact O-CG 3.25Å; M520-K524 PolarHBondContact O-N 3.15Å; E521-K524 PolarHBondContact O-N 3.21Å; K524-G526 VanDerWaalsContact C-N 3.35Å; K524-S527 PolarHBondContact O-N 2.93Å; K524-S527 PolarHBondContact O-OG 2.97Å; K524-L528 PolarHBondContact O-N 3.37Å
525	R	83.5	Confident	84.5	Confident	159 Å²	159	65.7 Å²	65.7	60%	0.6	33%	0.329	S	S	*	.	H	α-helix	trans	-67.2	-36.8	175.7	-67.4	171.4	-174.9	-150.4	-5.3	111.8	E521 Q522 A523 S529	E521-R525 WeakPolarHBondContact O-CG 3.39Å; E521-R525 PolarHBondContact O-N 3.37Å; E521-R525 IonicContact OE1-CZ 3.26Å; E521-R525 VanDerWaalsContact OE1-CZ 3.26Å; E521-R525 IonicContact OE1-NE 3.17Å; E521-R525 PolarHBondContact OE1-NE 3.23Å; E521-R525 IonicContact OE1-NH2 2.66Å; E521-R525 PolarHBondContact OE1-NH2 3.2Å; Q522-R525 PolarHBondContact O-N 3.06Å; A523-R525 PolarHBondContact O-N 3.31Å; R525-S529 PolarHBondContact O-N 3.44Å
526	G	82.9	Confident	84.2	Confident	17 Å²	17	69.4 Å²	69.4	18%	0.175	35%	0.349	C	S	.	.	H	α-helix	trans	-68.9	-37.4	173.8	0	0	0	0	0	113.2	Q522 A523 K524 L528 S529 V530	Q522-G526 PolarHBondContact O-N 2.84Å; A523-G526 CarbonylContact O-C 3.5Å; A523-G526 PolarHBondContact O-N 3.44Å; K524-G526 VanDerWaalsContact C-N 3.35Å; G526-L528 VanDerWaalsContact C-N 3.32Å; G526-L528 PolarHBondContact O-N 3.39Å; G526-S529 PolarHBondContact O-N 3.37Å; G526-S529 PolarHBondContact O-OG 3.4Å; G526-V530 WeakPolarHBondContact O-CG2 3.49Å; G526-V530 PolarHBondContact O-N 3.48Å
527	S	82.3	Confident	83.9	Confident	1 Å²	1	67 Å²	67	1%	0.007	34%	0.344	C	S	.	.	H	α-helix	trans	-66.6	-35.8	179.3	75.6	0	0	0	0	111.4	V398 A523 K524 V530 A531	V398-S527 WeakPolarHBondContact O-CB 3.4Å; A523-S527 WeakPolarHBondContact O-CB 3.36Å; A523-S527 PolarHBondContact O-N 3.11Å; K524-S527 PolarHBondContact O-N 2.93Å; K524-S527 PolarHBondContact O-OG 2.97Å; S527-V530 PolarHBondContact O-N 2.92Å; S527-A531 WeakPolarHBondContact O-CB 3.44Å; S527-A531 PolarHBondContact O-N 3.09Å
528	L	84.5	Confident	83.7	Confident	16 Å²	16	67.7 Å²	67.7	8%	0.084	35%	0.346	C	S	.	.	H	α-helix	trans	-60.1	-44	170	-76.7	176.2	0	0	0	113.1	F424 L425 Q428 K524 G526 R532	F424-L528 HydrophobicContact CD1-CD1 4.17Å; F424-L528 HydrophobicContact CD1-CG 4.05Å; F424-L528 HydrophobicContact CE1-CD1 3.29Å; F424-L528 HydrophobicContact CE1-CD2 4.42Å; F424-L528 HydrophobicContact CE1-CG 3.62Å; F424-L528 HydrophobicContact CZ-CD1 3.77Å; L425-L528 HydrophobicContact CD2-CD2 3.55Å; L425-L528 HydrophobicContact CD2-CG 4.1Å; Q428-L528 HydrophobicContact CB-CD1 4.46Å; Q428-L528 HydrophobicContact CB-CD2 3.42Å; Q428-L528 VanDerWaalsContact CB-CD2 3.42Å; Q428-L528 HydrophobicContact CG-CD1 4.06Å; Q428-L528 HydrophobicContact CG-CD2 3.85Å; K524-L528 PolarHBondContact O-N 3.37Å; G526-L528 VanDerWaalsContact C-N 3.32Å; G526-L528 PolarHBondContact O-N 3.39Å; L528-R532 WeakPolarHBondContact O-CB 3.47Å; L528-R532 VanDerWaalsContact O-CG 3.25Å; L528-R532 WeakPolarHBondContact O-CG 3.44Å; L528-R532 PolarHBondContact O-N 3.13Å
529	S	86.6	Confident	83.2	Confident	73 Å²	73	71.5 Å²	71.5	51%	0.51	36%	0.359	S	S	.	.	H	α-helix	trans	-69.3	-38.2	-178.9	69.1	0	0	0	0	111.5	R525 G526 S533	R525-S529 PolarHBondContact O-N 3.44Å; G526-S529 PolarHBondContact O-N 3.37Å; G526-S529 PolarHBondContact O-OG 3.4Å; S529-S533 WeakPolarHBondContact O-CB 3.23Å; S529-S533 PolarHBondContact O-N 3Å
530	V	86.6	Confident	83	Confident	37 Å²	37	68.7 Å²	68.7	22%	0.224	35%	0.346	C	S	.	.	H	α-helix	trans	-67.1	-47.1	174	176	0	0	0	0	111.4	S397 G526 S527 R532 S533 I534	S397-V530 WeakPolarHBondContact O-CG1 3.34Å; G526-V530 WeakPolarHBondContact O-CG2 3.49Å; G526-V530 PolarHBondContact O-N 3.48Å; S527-V530 PolarHBondContact O-N 2.92Å; V530-R532 PolarHBondContact O-N 3.13Å; V530-S533 CarbonylContact O-C 3.35Å; V530-S533 WeakPolarHBondContact O-CA 3.18Å; V530-S533 WeakPolarHBondContact O-CB 3.46Å; V530-S533 PolarHBondContact O-N 3.24Å; V530-I534 HydrophobicContact CG1-CD1 3.72Å; V530-I534 HydrophobicContact CG1-CG1 4.33Å; V530-I534 WeakPolarHBondContact O-CG1 3.26Å; V530-I534 PolarHBondContact O-N 2.98Å
531	A	85	Confident	82.7	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-58.5	-45.9	177.1	0	0	0	0	0	111.7	L425 L429 L437 S527 S533 I534 L535	L425-A531 HydrophobicContact CD1-CB 4.18Å; L425-A531 HydrophobicContact CD2-CB 4.02Å; L429-A531 HydrophobicContact CD1-CB 4.17Å; L437-A531 HydrophobicContact CD1-CB 4.02Å; S527-A531 WeakPolarHBondContact O-CB 3.44Å; S527-A531 PolarHBondContact O-N 3.09Å; A531-S533 VanDerWaalsContact C-N 3.32Å; A531-S533 PolarHBondContact O-N 3.34Å; A531-I534 PolarHBondContact O-N 3.28Å; A531-L535 VanDerWaalsContact O-CG 3.29Å; A531-L535 WeakPolarHBondContact O-CG 3.21Å; A531-L535 PolarHBondContact O-N 3.14Å
532	R	84.5	Confident	82.5	Confident	120 Å²	120	69.2 Å²	69.2	45%	0.453	35%	0.349	S	S	.	.	H	α-helix	trans	-60.4	-40.5	173.3	-72	171.9	-177.2	172.7	3.3	112	L528 V530 I534 N536	L528-R532 WeakPolarHBondContact O-CB 3.47Å; L528-R532 VanDerWaalsContact O-CG 3.25Å; L528-R532 WeakPolarHBondContact O-CG 3.44Å; L528-R532 PolarHBondContact O-N 3.13Å; V530-R532 PolarHBondContact O-N 3.13Å; R532-I534 VanDerWaalsContact C-N 3.34Å; R532-I534 PolarHBondContact O-N 3.21Å; R532-N536 VanDerWaalsContact O-CB 3.28Å; R532-N536 WeakPolarHBondContact O-CB 3.49Å; R532-N536 PolarHBondContact O-N 3.21Å; R532-N536 PolarHBondContact O-ND2 3.19Å; R532-N536 VanDerWaalsContact O-ND2 3.12Å
533	S	84.3	Confident	82.2	Confident	81 Å²	81	65.4 Å²	65.4	57%	0.566	33%	0.331	S	S	*	.	H	α-helix	trans	-65.2	-35.5	176	-167.1	0	0	0	0	113.2	S529 V530 A531 H537	S529-S533 WeakPolarHBondContact O-CB 3.23Å; S529-S533 PolarHBondContact O-N 3Å; V530-S533 CarbonylContact O-C 3.35Å; V530-S533 WeakPolarHBondContact O-CA 3.18Å; V530-S533 WeakPolarHBondContact O-CB 3.46Å; V530-S533 PolarHBondContact O-N 3.24Å; A531-S533 VanDerWaalsContact C-N 3.32Å; A531-S533 PolarHBondContact O-N 3.34Å; S533-H537 PolarHBondContact O-N 3.03Å
534	I	83.5	Confident	81.9	Confident	21 Å²	21	64.7 Å²	64.7	11%	0.108	32%	0.322	C	S	.	.	H	α-helix	trans	-68.8	-49.2	176.8	-72	167.1	0	0	0	110.2	S397 L437 Y440 V530 A531 R532 N536 H537 I540	S397-I534 VanDerWaalsContact OG-CD1 3.31Å; S397-I534 WeakPolarHBondContact OG-CD1 3.27Å; L437-I534 HydrophobicContact CD2-CG2 3.91Å; Y440-I534 HydrophobicContact CD1-CG2 4.16Å; Y440-I534 HydrophobicContact CE1-CG2 3.84Å; V530-I534 HydrophobicContact CG1-CD1 3.72Å; V530-I534 HydrophobicContact CG1-CG1 4.33Å; V530-I534 WeakPolarHBondContact O-CG1 3.26Å; V530-I534 PolarHBondContact O-N 2.98Å; A531-I534 PolarHBondContact O-N 3.28Å; R532-I534 VanDerWaalsContact C-N 3.34Å; R532-I534 PolarHBondContact O-N 3.21Å; I534-N536 PolarHBondContact O-N 2.78Å; I534-H537 WeakPolarHBondContact O-CB 3.35Å; I534-H537 PolarHBondContact O-N 3.49Å; I534-I540 HydrophobicContact CG2-CD1 3.94Å; I534-I540 HydrophobicContact CG2-CG2 3.94Å
535	L	78.4	Confident	81.6	Confident	27 Å²	27	67.7 Å²	67.7	14%	0.141	34%	0.336	C	S	.	.	H	α-helix	trans	-62.7	-31.4	177.6	-63.9	168.1	0	0	0	112.2	L429 F436 L437 A531 H537 L544	L429-L535 HydrophobicContact CD1-CD1 4.08Å; L429-L535 HydrophobicContact CD2-CD1 4.31Å; F436-L535 HydrophobicContact CD1-CD2 4.37Å; L437-L535 HydrophobicContact CD1-CD1 4.15Å; L437-L535 HydrophobicContact CD1-CD2 4.32Å; L437-L535 HydrophobicContact CD1-CG 4.34Å; L437-L535 HydrophobicContact CD2-CD2 4.13Å; L437-L535 HydrophobicContact CD2-CG 4.4Å; L437-L535 HydrophobicContact CG-CD2 4.13Å; A531-L535 VanDerWaalsContact O-CG 3.29Å; A531-L535 WeakPolarHBondContact O-CG 3.21Å; A531-L535 PolarHBondContact O-N 3.14Å; L535-H537 VanDerWaalsContact C-N 3.26Å; L535-H537 PolarHBondContact O-N 2.94Å; L535-L544 HydrophobicContact CD2-CD1 4.45Å; L535-L544 HydrophobicContact CD2-CD2 3.79Å
536	N	81.6	Confident	81.2	Confident	136 Å²	136	61.7 Å²	61.7	73%	0.727	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-7.6	174.8	-72.3	-21.7	0	0	0	114.1	R532 I534	R532-N536 VanDerWaalsContact O-CB 3.28Å; R532-N536 WeakPolarHBondContact O-CB 3.49Å; R532-N536 PolarHBondContact O-N 3.21Å; R532-N536 PolarHBondContact O-ND2 3.19Å; R532-N536 VanDerWaalsContact O-ND2 3.12Å; I534-N536 PolarHBondContact O-N 2.78Å
537	H	82.6	Confident	80.9	Confident	95 Å²	95	63.1 Å²	63.1	44%	0.44	32%	0.319	S	S	.	.	S	Bend	trans	-76.9	129.8	179.2	-174.3	-111.8	0	0	0	111.4	S533 I534 L535 L539 I540 G541	S533-H537 PolarHBondContact O-N 3.03Å; I534-H537 WeakPolarHBondContact O-CB 3.35Å; I534-H537 PolarHBondContact O-N 3.49Å; L535-H537 VanDerWaalsContact C-N 3.26Å; L535-H537 PolarHBondContact O-N 2.94Å; H537-L539 VanDerWaalsContact C-N 3.29Å; H537-L539 PolarHBondContact O-N 3.33Å; H537-L539 VanDerWaalsContact O-N 3.09Å; H537-I540 HydrophobicContact CB-CB 4.29Å; H537-I540 HydrophobicContact CB-CD1 4.13Å; H537-I540 HydrophobicContact CB-CG1 4.29Å; H537-I540 PolarHBondContact O-N 2.98Å; H537-G541 PolarHBondContact O-N 3.26Å
538	K	79.4	Confident	80.7	Confident	179 Å²	179	67.5 Å²	67.5	78%	0.778	34%	0.342	S	S	*	.	H	α-helix	trans	-56.1	-33.9	-169.2	-66.4	-178.5	-179.3	177	0	115.4	K542	K538-K542 WeakPolarHBondContact O-CG 3.5Å
539	L	76.6	Confident	80.4	Confident	112 Å²	112	73.3 Å²	73.3	59%	0.586	37%	0.367	S	S	*	.	H	α-helix	trans	-79.9	-35.7	178	-61	-179.8	0	0	0	111.9	H537 K543	H537-L539 VanDerWaalsContact C-N 3.29Å; H537-L539 PolarHBondContact O-N 3.33Å; H537-L539 VanDerWaalsContact O-N 3.09Å; L539-K543 PolarHBondContact O-N 3.27Å; L539-K543 VanDerWaalsContact O-N 3.16Å
540	I	78.1	Confident	79.6	Confident	20 Å²	20	73 Å²	73	10%	0.103	38%	0.375	C	S	.	.	H	α-helix	trans	-79.1	-37.6	-176.7	-57.9	175.9	0	0	0	110.1	F436 Y440 I534 H537 K542 K543 L544	F436-I540 HydrophobicContact CE1-CG2 3.69Å; F436-I540 HydrophobicContact CZ-CG2 3.96Å; Y440-I540 HydrophobicContact CE1-CD1 4.1Å; Y440-I540 HydrophobicContact CE2-CD1 4.48Å; Y440-I540 WeakPolarHBondContact OH-CD1 3.49Å; I534-I540 HydrophobicContact CG2-CD1 3.94Å; I534-I540 HydrophobicContact CG2-CG2 3.94Å; H537-I540 HydrophobicContact CB-CB 4.29Å; H537-I540 HydrophobicContact CB-CD1 4.13Å; H537-I540 HydrophobicContact CB-CG1 4.29Å; H537-I540 PolarHBondContact O-N 2.98Å; I540-K542 VanDerWaalsContact C-N 3.33Å; I540-K542 PolarHBondContact O-N 3.18Å; I540-K543 PolarHBondContact O-N 2.9Å; I540-L544 WeakPolarHBondContact O-CB 3.23Å; I540-L544 PolarHBondContact O-N 3.41Å
541	G	77.6	Confident	78.7	Confident	14 Å²	14	76.9 Å²	76.9	14%	0.144	39%	0.391	C	S	.	.	H	α-helix	trans	-59.8	-39.7	170.1	0	0	0	0	0	112.8	H537 L544 E545	H537-G541 PolarHBondContact O-N 3.26Å; G541-L544 WeakPolarHBondContact O-CB 3.23Å; G541-L544 PolarHBondContact O-N 2.93Å; G541-E545 WeakPolarHBondContact O-CG 3.44Å; G541-E545 PolarHBondContact O-N 3.13Å
542	K	80.8	Confident	77.4	Confident	139 Å²	139	81.7 Å²	81.7	60%	0.604	42%	0.417	S	S	*	.	H	α-helix	trans	-63.3	-43.3	172.1	-77.2	178.5	176.1	-169.4	0	112.6	K538 I540 L544 E545 S546	K538-K542 WeakPolarHBondContact O-CG 3.5Å; I540-K542 VanDerWaalsContact C-N 3.33Å; I540-K542 PolarHBondContact O-N 3.18Å; K542-L544 VanDerWaalsContact C-N 3.35Å; K542-E545 WeakPolarHBondContact O-CB 3.48Å; K542-E545 PolarHBondContact O-N 3.48Å; K542-S546 PolarHBondContact O-N 3.09Å
543	K	78.1	Confident	76.4	Confident	45 Å²	45	77 Å²	77	20%	0.196	40%	0.401	C	S	.	.	H	α-helix	trans	-63.8	-40.1	175.5	-73.4	-173.2	-179.3	-172.5	0	112.1	F436 L539 I540 E545 S546 Y547 P553 F554 D559	F436-K543 HydrophobicContact CE2-CB 3.9Å; F436-K543 HydrophobicContact CZ-CB 3.81Å; L539-K543 PolarHBondContact O-N 3.27Å; L539-K543 VanDerWaalsContact O-N 3.16Å; I540-K543 PolarHBondContact O-N 2.9Å; K543-E545 VanDerWaalsContact C-N 3.35Å; K543-S546 PolarHBondContact O-N 3.39Å; K543-Y547 WeakPolarHBondContact O-CB 3.47Å; K543-Y547 PolarHBondContact O-N 2.98Å; K543-P553 HydrophobicContact CB-CB 3.73Å; K543-P553 HydrophobicContact CB-CG 4.43Å; K543-P553 HydrophobicContact CD-CB 4.35Å; K543-P553 HydrophobicContact CG-CB 3.95Å; K543-P553 WeakPolarHBondContact O-CG 3.47Å; K543-F554 HydrophobicContact CD-CE1 4.26Å; K543-D559 IonicContact NZ-OD1 3.84Å; K543-D559 PolarHBondContact NZ-OD1 2.78Å; K543-D559 IonicContact NZ-OD2 2.63Å; K543-D559 PolarHBondContact NZ-OD2 3.34Å
544	L	78.4	Confident	75.1	Confident	20 Å²	20	75.1 Å²	75.1	11%	0.105	38%	0.383	C	S	.	.	H	α-helix	trans	-61.3	-42.3	171.9	177.1	72.1	0	0	0	111.5	T433 F436 L535 I540 G541 K542 S546 Y547 L548	T433-L544 HydrophobicContact CG2-CD1 4Å; T433-L544 HydrophobicContact CG2-CD2 4.22Å; F436-L544 HydrophobicContact CB-CD1 3.68Å; F436-L544 HydrophobicContact CD1-CB 4.05Å; F436-L544 HydrophobicContact CD1-CD1 3.53Å; F436-L544 HydrophobicContact CD1-CG 4.36Å; F436-L544 HydrophobicContact CD2-CD1 4.29Å; F436-L544 HydrophobicContact CE1-CB 3.89Å; F436-L544 HydrophobicContact CE1-CD1 4.25Å; F436-L544 HydrophobicContact CE2-CB 4.4Å; F436-L544 HydrophobicContact CG-CB 4.38Å; F436-L544 HydrophobicContact CG-CD1 3.55Å; F436-L544 HydrophobicContact CZ-CB 4.07Å; L535-L544 HydrophobicContact CD2-CD1 4.45Å; L535-L544 HydrophobicContact CD2-CD2 3.79Å; I540-L544 WeakPolarHBondContact O-CB 3.23Å; I540-L544 PolarHBondContact O-N 3.41Å; G541-L544 WeakPolarHBondContact O-CB 3.23Å; G541-L544 PolarHBondContact O-N 2.93Å; K542-L544 VanDerWaalsContact C-N 3.35Å; L544-S546 VanDerWaalsContact C-N 3.33Å; L544-S546 PolarHBondContact O-N 2.84Å; L544-Y547 PolarHBondContact O-N 2.87Å; L544-L548 HydrophobicContact CD1-CD1 4.31Å; L544-L548 HydrophobicContact CD1-CG 4.43Å; L544-L548 HydrophobicContact CG-CD1 3.98Å; L544-L548 HydrophobicContact CG-CG 4.49Å; L544-L548 WeakPolarHBondContact O-CB 3.32Å; L544-L548 VanDerWaalsContact O-CG 3.23Å; L544-L548 WeakPolarHBondContact O-CG 3.49Å; L544-L548 PolarHBondContact O-N 3.43Å
545	E	78.9	Confident	73.7	Confident	110 Å²	110	79.2 Å²	79.2	51%	0.514	41%	0.41	S	S	.	.	H	α-helix	trans	-65.2	-31.4	175.6	-77.2	176.9	-151.3	0	0	113.4	G541 K542 K543 K549	G541-E545 WeakPolarHBondContact O-CG 3.44Å; G541-E545 PolarHBondContact O-N 3.13Å; K542-E545 WeakPolarHBondContact O-CB 3.48Å; K542-E545 PolarHBondContact O-N 3.48Å; K543-E545 VanDerWaalsContact C-N 3.35Å; E545-K549 WeakPolarHBondContact O-CD 3.38Å; E545-K549 WeakPolarHBondContact O-CE 3.21Å; E545-K549 WeakPolarHBondContact O-CG 3.44Å; E545-K549 PolarHBondContact O-N 3.34Å
546	S	75.3	Confident	72	Confident	32 Å²	32	80.3 Å²	80.3	22%	0.224	43%	0.427	C	S	.	.	H	α-helix	trans	-74.5	-40.8	170.8	-83.6	0	0	0	0	112.2	K542 K543 L544 L548 K549 G550 E551	K542-S546 PolarHBondContact O-N 3.09Å; K543-S546 PolarHBondContact O-N 3.39Å; L544-S546 VanDerWaalsContact C-N 3.33Å; L544-S546 PolarHBondContact O-N 2.84Å; S546-L548 VanDerWaalsContact C-N 3.32Å; S546-L548 PolarHBondContact O-N 2.9Å; S546-K549 CarbonylContact O-C 3.57Å; S546-K549 WeakPolarHBondContact O-CA 3.49Å; S546-K549 WeakPolarHBondContact O-CB 3.36Å; S546-K549 PolarHBondContact O-N 3.1Å; S546-G550 PolarHBondContact O-N 2.92Å; S546-E551 CarbonylContact C-O 3.59Å; S546-E551 PolarHBondContact O-N 3.08Å; S546-E551 VanDerWaalsContact O-N 3.09Å; S546-E551 PolarHBondContact OG-OE2 3.18Å
547	Y	75.9	Confident	70.1	Confident	47 Å²	47	80.5 Å²	80.5	18%	0.184	43%	0.428	C	S	.	.	H	α-helix	trans	-58	-45.7	174.3	-171.4	-104.4	0	0	0	111.5	P432 D435 F436 E439 K543 L544 K549 G550 P553	P432-Y547 WeakPolarHBondContact O-CE1 3.1Å; D435-Y547 HydrophobicContact CB-CE1 4.49Å; F436-Y547 HydrophobicContact CB-CD1 3.69Å; F436-Y547 HydrophobicContact CB-CE1 3.88Å; F436-Y547 HydrophobicContact CB-CG 4.19Å; F436-Y547 HydrophobicContact CD2-CD1 4.17Å; F436-Y547 HydrophobicContact CD2-CD2 4.23Å; F436-Y547 AromaticContact CD2-CG 3.79Å; F436-Y547 HydrophobicContact CD2-CG 3.79Å; F436-Y547 HydrophobicContact CG-CD1 4.38Å; F436-Y547 HydrophobicContact CG-CG 4.44Å; E439-Y547 VanDerWaalsContact CD-CE2 3.5Å; E439-Y547 VanDerWaalsContact OE1-CE2 3.28Å; E439-Y547 WeakPolarHBondContact OE1-CE2 3.35Å; E439-Y547 VanDerWaalsContact OE1-CZ 3.31Å; E439-Y547 PolarHBondContact OE1-OH 3.45Å; E439-Y547 WeakPolarHBondContact OE2-CE2 3.4Å; K543-Y547 WeakPolarHBondContact O-CB 3.47Å; K543-Y547 PolarHBondContact O-N 2.98Å; L544-Y547 PolarHBondContact O-N 2.87Å; Y547-K549 PolarHBondContact O-N 3.23Å; Y547-K549 VanDerWaalsContact O-N 3.15Å; Y547-G550 PolarHBondContact O-N 3.38Å; Y547-P553 HydrophobicContact CD2-CG 4.15Å; Y547-P553 HydrophobicContact CG-CG 4.39Å
548	L	77.1	Confident	68.4	Low	93 Å²	93	84.5 Å²	84.5	49%	0.487	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-13.3	175.2	-71.8	169.7	0	0	0	114	P432 L544 S546	P432-L548 HydrophobicContact CB-CD2 3.64Å; P432-L548 HydrophobicContact CG-CD2 3.76Å; L544-L548 HydrophobicContact CD1-CD1 4.31Å; L544-L548 HydrophobicContact CD1-CG 4.43Å; L544-L548 HydrophobicContact CG-CD1 3.98Å; L544-L548 HydrophobicContact CG-CG 4.49Å; L544-L548 WeakPolarHBondContact O-CB 3.32Å; L544-L548 VanDerWaalsContact O-CG 3.23Å; L544-L548 WeakPolarHBondContact O-CG 3.49Å; L544-L548 PolarHBondContact O-N 3.43Å; S546-L548 VanDerWaalsContact C-N 3.32Å; S546-L548 PolarHBondContact O-N 2.9Å
549	K	79.3	Confident	67	Low	139 Å²	139	78.9 Å²	78.9	60%	0.604	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-3	172.6	-68.5	162.7	-164	155.1	0	113	E545 S546 Y547	E545-K549 WeakPolarHBondContact O-CD 3.38Å; E545-K549 WeakPolarHBondContact O-CE 3.21Å; E545-K549 WeakPolarHBondContact O-CG 3.44Å; E545-K549 PolarHBondContact O-N 3.34Å; S546-K549 CarbonylContact O-C 3.57Å; S546-K549 WeakPolarHBondContact O-CA 3.49Å; S546-K549 WeakPolarHBondContact O-CB 3.36Å; S546-K549 PolarHBondContact O-N 3.1Å; Y547-K549 PolarHBondContact O-N 3.23Å; Y547-K549 VanDerWaalsContact O-N 3.15Å
550	G	68.6	Low	65.7	Low	67 Å²	67	80.1 Å²	80.1	69%	0.691	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.9	11.4	-177.2	0	0	0	0	0	114.7	S546 Y547	S546-G550 PolarHBondContact O-N 2.92Å; Y547-G550 PolarHBondContact O-N 3.38Å
551	E	69.4	Low	64	Low	117 Å²	117	87.5 Å²	87.5	55%	0.547	46%	0.462	S	S	.	.			trans	-91.6	121.3	170.5	-67.3	172.5	169.6	0	0	109.2	S546 P553	S546-E551 CarbonylContact C-O 3.59Å; S546-E551 PolarHBondContact O-N 3.08Å; S546-E551 VanDerWaalsContact O-N 3.09Å; S546-E551 PolarHBondContact OG-OE2 3.18Å; E551-P553 WeakPolarHBondContact O-CD 3.4Å; E551-P553 WeakPolarHBondContact O-CG 3.34Å; E551-P553 VanDerWaalsContact O-N 3.08Å
552	N	58	Low	62.4	Low	102 Å²	102	90.6 Å²	90.6	55%	0.545	48%	0.475	S	S	.	.			trans	-62.8	106.9	175.7	-79.7	-15.4	0	0	0	110.5	F554 T555	N552-F554 PolarHBondContact O-N 2.96Å; N552-T555 HydrophobicContact CB-CG2 3.88Å; N552-T555 WeakPolarHBondContact CB-OG1 3.23Å; N552-T555 PolarHBondContact O-OG1 2.86Å
553	P	61.5	Low	60.9	Low	21 Å²	21	88.4 Å²	88.4	14%	0.136	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	8.2	-173	-4.1	21.4	0	0	0	113.4	F436 K543 Y547 E551	F436-P553 HydrophobicContact CE2-CG 4.2Å; K543-P553 HydrophobicContact CB-CB 3.73Å; K543-P553 HydrophobicContact CB-CG 4.43Å; K543-P553 HydrophobicContact CD-CB 4.35Å; K543-P553 HydrophobicContact CG-CB 3.95Å; K543-P553 WeakPolarHBondContact O-CG 3.47Å; Y547-P553 HydrophobicContact CD2-CG 4.15Å; Y547-P553 HydrophobicContact CG-CG 4.39Å; E551-P553 WeakPolarHBondContact O-CD 3.4Å; E551-P553 WeakPolarHBondContact O-CG 3.34Å; E551-P553 VanDerWaalsContact O-N 3.08Å
554	F	58.9	Low	59.4	Low	41 Å²	41	91.9 Å²	91.9	18%	0.18	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.9	-7.8	-163.8	-63.5	-43.2	0	0	0	112.5	F436 E439 Y440 N443 K543 N552	F436-F554 HydrophobicContact CD2-CE2 4.04Å; F436-F554 AromaticContact CD2-CZ 3.99Å; F436-F554 HydrophobicContact CD2-CZ 3.99Å; F436-F554 HydrophobicContact CE2-CE1 4.33Å; F436-F554 AromaticContact CE2-CE2 3.91Å; F436-F554 HydrophobicContact CE2-CE2 3.91Å; F436-F554 AromaticContact CE2-CZ 3.43Å; F436-F554 HydrophobicContact CE2-CZ 3.43Å; F436-F554 VanDerWaalsContact CE2-CZ 3.43Å; F436-F554 AromaticContact CZ-CZ 3.99Å; F436-F554 HydrophobicContact CZ-CZ 3.99Å; E439-F554 HydrophobicContact CB-CD2 4.25Å; E439-F554 HydrophobicContact CB-CE2 3.83Å; Y440-F554 HydrophobicContact CD2-CE1 4.1Å; Y440-F554 HydrophobicContact CD2-CZ 4.2Å; N443-F554 HydrophobicContact CB-CD1 4.43Å; N443-F554 VanDerWaalsContact ND2-CB 3.27Å; N443-F554 WeakPolarHBondContact ND2-CB 3.45Å; N443-F554 WeakPolarHBondContact ND2-CD1 3.43Å; N443-F554 VanDerWaalsContact ND2-CG 3.3Å; N443-F554 WeakPolarHBondContact ND2-CG 3.41Å; K543-F554 HydrophobicContact CD-CE1 4.26Å; N552-F554 PolarHBondContact O-N 2.96Å
555	T	52.3	Low	58.1	Low	108 Å²	108	94 Å²	94	66%	0.663	50%	0.504	S	S	*	.	S	Bend	trans	-101.3	-5.6	177.7	54.1	0	0	0	0	113.6	N552	N552-T555 HydrophobicContact CB-CG2 3.88Å; N552-T555 WeakPolarHBondContact CB-OG1 3.23Å; N552-T555 PolarHBondContact O-OG1 2.86Å
556	G	43.5	Very low	56.3	Low	50 Å²	50	93.4 Å²	93.4	52%	0.515	51%	0.511	S	S	.	.	S	Bend	trans	-99.6	122.8	175.6	0	0	0	0	0	111.6	Q558	G556-Q558 VanDerWaalsContact C-N 3.26Å; G556-Q558 PolarHBondContact O-N 3.16Å
557	N	41.3	Very low	55	Low	139 Å²	139	98.8 Å²	98.8	74%	0.743	54%	0.535	S	S	*	.	S	Bend	trans	-64.1	81	175.3	-67.9	-2.9	0	0	0	111.3
558	Q	47.6	Very low	53.9	Low	179 Å²	179	99.1 Å²	99.1	84%	0.836	55%	0.547	S	S	*	.			trans	-136.6	11.8	176	-151.1	171.3	96.8	0	0	112.1	G556	G556-Q558 VanDerWaalsContact C-N 3.26Å; G556-Q558 PolarHBondContact O-N 3.16Å
559	D	48.8	Very low	52.6	Low	61 Å²	61	102.3 Å²	102.3	33%	0.326	56%	0.562	S	S	.	*			trans	-103.2	-1.4	172.7	-81.1	-26.1	0	0	0	113.1	K447 K543 H561 D562	K447-D559 VanDerWaalsContact NZ-CG 3.29Å; K447-D559 IonicContact NZ-OD2 2.67Å; K447-D559 PolarHBondContact NZ-OD2 3.01Å; K543-D559 IonicContact NZ-OD1 3.84Å; K543-D559 PolarHBondContact NZ-OD1 2.78Å; K543-D559 IonicContact NZ-OD2 2.63Å; K543-D559 PolarHBondContact NZ-OD2 3.34Å; D559-H561 PolarHBondContact O-N 2.8Å; D559-D562 PolarHBondContact O-N 2.85Å
560	E	49.7	Very low	50.8	Low	139 Å²	139	102.3 Å²	102.3	65%	0.65	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	2.3	171.5	-62.6	177.5	128.7	0	0	112.7
561	H	42.7	Very low	49.6	Very low	174 Å²	174	104 Å²	104	81%	0.806	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.9	40.2	172.1	-75.9	1.7	0	0	0	111.9	D559 P563	D559-H561 PolarHBondContact O-N 2.8Å; H561-P563 WeakPolarHBondContact O-CD 3.46Å
562	D	44.8	Very low	48.5	Very low	80 Å²	80	103 Å²	103	43%	0.428	57%	0.571	S	S	.	*			trans	-73	115.9	148	-165.7	9.5	0	0	0	108.2	D559 E564 D565	D559-D562 PolarHBondContact O-N 2.85Å; D562-E564 PolarHBondContact O-N 3.25Å; D562-D565 PolarHBondContact O-N 3.34Å; D562-D565 VanDerWaalsContact O-N 3.13Å
563	P	47.9	Very low	47.5	Very low	92 Å²	92	105.2 Å²	105.2	60%	0.597	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-3.6	-176.7	26.1	-36.5	0	0	0	114.4	H561	H561-P563 WeakPolarHBondContact O-CD 3.46Å
564	E	47.8	Very low	46.5	Very low	118 Å²	118	110.8 Å²	110.8	55%	0.551	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-18.9	174.9	-58.5	-163.9	177.2	0	0	114.4	R391 D562	R391-E564 PolarHBondContact NH1-O 3.45Å; D562-E564 PolarHBondContact O-N 3.25Å
565	D	50	Low	45.4	Very low	65 Å²	65	117.8 Å²	117.8	35%	0.348	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.2	-35.4	179.8	-109.9	22.4	0	0	0	112.2	R451 D562 M567 A568	R451-D565 VanDerWaalsContact CD-OD1 3.31Å; R451-D565 WeakPolarHBondContact CD-OD1 3.39Å; R451-D565 IonicContact CZ-OD1 2.71Å; R451-D565 IonicContact NE-OD1 3.23Å; R451-D565 IonicContact NH1-OD1 3.95Å; R451-D565 PolarHBondContact NH1-OD1 3.35Å; D562-D565 PolarHBondContact O-N 3.34Å; D562-D565 VanDerWaalsContact O-N 3.13Å; D565-M567 PolarHBondContact O-N 2.95Å; D565-A568 VanDerWaalsContact O-CB 3.31Å; D565-A568 WeakPolarHBondContact O-CB 3.26Å; D565-A568 PolarHBondContact O-N 3.34Å
566	S	42.3	Very low	44.8	Very low	97 Å²	97	120.7 Å²	120.7	68%	0.678	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-6.1	179.7	-174.9	0	0	0	0	114.9
567	M	46.9	Very low	44.3	Very low	145 Å²	145	124 Å²	124	71%	0.714	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	9.3	176	-57.2	-173.4	-171.6	0	0	113.2	D565	D565-M567 PolarHBondContact O-N 2.95Å
568	A	53.7	Low	43.7	Very low	54 Å²	54	120.6 Å²	120.6	45%	0.446	65%	0.653	S	S	.	*	S	Bend	trans	-93.6	-25.8	-175.8	0	0	0	0	0	114.5	D565 D570	D565-A568 VanDerWaalsContact O-CB 3.31Å; D565-A568 WeakPolarHBondContact O-CB 3.26Å; D565-A568 PolarHBondContact O-N 3.34Å; A568-D570 VanDerWaalsContact C-N 3.29Å; A568-D570 PolarHBondContact O-N 3.01Å
569	M	49.3	Very low	42.7	Very low	161 Å²	161	121.7 Å²	121.7	79%	0.793	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-26.2	-179.2	-67	-67	-179.8	0	0	113.3	V571	M569-V571 PolarHBondContact O-N 3.4Å
570	D	41.6	Very low	41.8	Very low	138 Å²	138	123.6 Å²	123.6	74%	0.738	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	19.3	-167.7	-142.6	-2	0	0	0	114.4	A568	A568-D570 VanDerWaalsContact C-N 3.29Å; A568-D570 PolarHBondContact O-N 3.01Å
571	V	43.3	Very low	41	Very low	104 Å²	104	121.2 Å²	121.2	63%	0.63	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.5	-35.1	-177.8	-175.3	0	0	0	0	112.5	M569 E573	M569-V571 PolarHBondContact O-N 3.4Å; V571-E573 VanDerWaalsContact C-N 3.27Å; V571-E573 PolarHBondContact O-N 2.86Å
572	S	46.5	Very low	40.3	Very low	95 Å²	95	122.1 Å²	122.1	66%	0.664	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-68.5	-26.7	176.6	-53.8	0	0	0	0	112.8
573	E	37.1	Very low	39.5	Very low	148 Å²	148	121.8 Å²	121.8	69%	0.692	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-76.7	-20.6	-178	-153.4	176.2	170.1	0	0	113.1	V571	V571-E573 VanDerWaalsContact C-N 3.27Å; V571-E573 PolarHBondContact O-N 2.86Å
574	L	39.5	Very low	38.7	Very low	138 Å²	138	126.6 Å²	126.6	72%	0.723	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-87.3	-7.3	-173.3	-164.1	60.1	0	0	0	114.5
575	E	36.9	Very low	38.1	Very low	189 Å²	189	126 Å²	126	88%	0.883	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-99.9	7.8	171.8	-70.8	-165.7	132.3	0	0	113.3
576	Q	40.2	Very low	37	Very low	169 Å²	169	132.5 Å²	132.5	79%	0.79	76%	0.756	S	S	*	*	S	Bend	trans	-116.4	11.4	179.5	-73	-175.1	-8.2	0	0	115.3
577	T	31.3	Very low	36.3	Very low	119 Å²	119	135.5 Å²	135.5	73%	0.73	76%	0.764	S	S	*	*			trans	-109.7	80.3	173.7	63.9	0	0	0	0	111.9
578	G	29.2	Very low	36	Very low	67 Å²	67	133.8 Å²	133.8	69%	0.691	76%	0.764	S	S	*	*	S	Bend	trans	-156.7	99.7	172.7	0	0	0	0	0	110.6
579	E	28.2	Very low	34.7	Very low	203 Å²	203	140.7 Å²	140.7	95%	0.949	79%	0.787	S	S	*	*			trans	73	93.3	174.2	-57.9	-175.4	121.5	0	0	117.1
580	A	29.3	Very low	33.8	Very low	101 Å²	101	140.8 Å²	140.8	84%	0.835	79%	0.79	S	S	*	*			trans	-78.7	177.9	149.1	0	0	0	0	0	109.1
581	A	32.3	Very low	33	Very low	89 Å²	89	142.6 Å²	142.6	74%	0.736	80%	0.799	S	S	*	*			cis	-154	-168.9	15.2	0	0	0	0	0	107.8
582	E	27.7	Very low	32	Very low	193 Å²	193	144 Å²	144	90%	0.902	80%	0.803	S	S	*	*			cis	-144.1	158.4	18.1	-61.1	179	137.9	0	0	107.5
583	G	27.7	Very low	31.1	Very low	73 Å²	73	146.8 Å²	146.8	75%	0.753	81%	0.806	S	S	*	*			cis	124.1	152.4	47.8	0	0	0	0	0	107
584	Q	32.3	Very low	30.5	Very low	193 Å²	193	145.2 Å²	145.2	90%	0.902	81%	0.812	S	S	*	*			cis	-154.6	177.7	-2.7	-117.4	-156.5	-83.3	0	0	108.9
585	P	35.3	Very low	29.8	Very low	106 Å²	106	144.8 Å²	144.8	69%	0.688	81%	0.814	S	S	*	*			trans	-108.3	176.9	-166.3	42.5	-37.3	0	0	0	115.1
586	E	25.9	Very low	29.2	Very low	200 Å²	200	139.4 Å²	139.4	94%	0.935	80%	0.802	S	S	*	*			trans	-143.1	161.1	153.6	46.5	-161.5	147.3	0	0	113.3
587	N	28.1	Very low	28.4	Very low	160 Å²	160	140.9 Å²	140.9	86%	0.856	81%	0.809	S	S	*	*			trans	-105.3	163.9	-152.6	-146.9	27.6	0	0	0	112
588	P	40.7	Very low	28	Very low	109 Å²	109	138.4 Å²	138.4	71%	0.708	81%	0.807	S	S	*	*			trans	-91.8	157.5	-178.9	36.6	-31.5	0	0	0	112.9
589	E	25.4	Very low	27.8	Very low	199 Å²	199	144.5 Å²	144.5	93%	0.93	82%	0.817	S	S	*	*			trans	-122.8	146.2	160.9	-78.8	-161.4	122	0	0	111.9
590	L	31.3	Very low	27.5	Very low	164 Å²	164	139.3 Å²	139.3	86%	0.859	81%	0.809	S	S	*	*			trans	-89.5	156.1	176.2	-59.1	162.9	0	0	0	109.4
591	N	24.4	Very low	27.4	Very low	175 Å²	175	139.2 Å²	139.2	94%	0.936	81%	0.808	S	S	*	*			trans	-156.3	157.1	136.3	-111.8	-41.4	0	0	0	113.3
592	D	22.6	Very low	27.1	Very low	133 Å²	133	142.2 Å²	142.2	71%	0.711	81%	0.807	S	S	*	*			trans	-125.5	168	-158	-171	-147.6	0	0	0	111.9
593	E	26.9	Very low	27	Very low	155 Å²	155	141.9 Å²	141.9	72%	0.724	80%	0.803	S	S	*	*			trans	38.5	124.3	162.8	-77	-169.1	145.3	0	0	122.4
594	S	25.6	Very low	26.8	Very low	115 Å²	115	141.9 Å²	141.9	80%	0.804	80%	0.803	S	S	*	*				179.3	119.5	117.2	31.9	0	0	0	0	110.1
595	V	24.4	Very low	26.4	Very low	129 Å²	129	142.4 Å²	142.4	78%	0.782	81%	0.806	S	S	*	*				95	143.5	63	161.9	0	0	0	0	112.8
596	A	24	Very low	25.9	Very low	75 Å²	75	141.1 Å²	141.1	62%	0.62	81%	0.811	S	S	*	*			trans	77.6	109.4	172.1	0	0	0	0	0	115.7
597	E	23.7	Very low	25.8	Very low	201 Å²	201	140.3 Å²	140.3	94%	0.939	81%	0.807	S	S	*	*				72.8	137.5	88.1	-71.5	178.7	176.9	0	0	112.7
598	G	22.7	Very low	25.8	Very low	66 Å²	66	141.5 Å²	141.5	68%	0.68	81%	0.808	S	S	*	*			cis	165.9	160.5	2.2	0	0	0	0	0	109.6
599	E	24.5	Very low	25.7	Very low	195 Å²	195	141.7 Å²	141.7	91%	0.911	81%	0.809	S	S	*	*			trans	59.2	110.8	168.2	-53.4	-166.1	114.8	0	0	117.4
600	A	23	Very low	26.3	Very low	94 Å²	94	137.5 Å²	137.5	78%	0.777	80%	0.799	S	S	*	*				90.4	137.6	55.1	0	0	0	0	0	115
601	A	26.3	Very low	26.5	Very low	100 Å²	100	135 Å²	135	83%	0.826	80%	0.802	S	S	*	*			trans	72	144.1	166.5	0	0	0	0	0	118.5
602	Q	26.9	Very low	26.8	Very low	152 Å²	152	131.2 Å²	131.2	71%	0.71	80%	0.795	S	S	*	*			cis	-173.4	138.6	-12.8	165.8	175.7	98.4	0	0	110.7
603	K	24.4	Very low	27.3	Very low	185 Å²	185	129.7 Å²	129.7	80%	0.804	80%	0.801	S	S	*	*			trans	60.3	132.2	165.5	-68.7	165.5	-174.6	177.7	0	116
604	G	23.6	Very low	27.6	Very low	74 Å²	74	127.3 Å²	127.3	76%	0.763	81%	0.808	S	S	*	*				111	140.2	56.5	0	0	0	0	0	106.8
605	E	25.2	Very low	28.1	Very low	204 Å²	204	126.8 Å²	126.8	95%	0.953	81%	0.81	S	S	*	*			cis	-147.5	164.7	15.3	-58	171.4	139.6	0	0	108.5
606	G	23.6	Very low	28.4	Very low	78 Å²	78	123.8 Å²	123.8	80%	0.804	80%	0.799	S	S	*	*			trans	154.8	95.6	171.2	0	0	0	0	0	117
607	E	24.7	Very low	28.9	Very low	183 Å²	183	123 Å²	123	86%	0.855	80%	0.798	S	S	*	*			trans	-3.2	128.2	168.3	-70.4	167.6	105.1	0	0	123.9
608	Q	27.9	Very low	29.4	Very low	185 Å²	185	121.8 Å²	121.8	86%	0.864	79%	0.792	S	S	*	*			trans	76.1	145.8	145.3	-70.9	-166.6	-8.5	0	0	123.1
609	P	38.5	Very low	30.1	Very low	114 Å²	114	125.4 Å²	125.4	74%	0.74	79%	0.792	S	S	*	*			trans	-131	-157.5	-159.3	37.4	-12.5	0	0	0	112.2
610	P	38.6	Very low	30.8	Very low	111 Å²	111	123.1 Å²	123.1	72%	0.721	78%	0.781	S	S	*	*				-122.8	159.9	-65.9	35.3	-22.2	0	0	0	112.4	A612	P610-A612 PolarHBondContact O-N 3.31Å
611	A	34.2	Very low	31.8	Very low	111 Å²	111	124.4 Å²	124.4	92%	0.917	78%	0.775	S	S	*	*			trans	-81.1	113.2	164.9	0	0	0	0	0	110.5
612	A	31.6	Very low	32.7	Very low	95 Å²	95	128.5 Å²	128.5	79%	0.785	77%	0.769	S	S	*	*			trans	-142.2	65.2	170.2	0	0	0	0	0	109.6	P610	P610-A612 PolarHBondContact O-N 3.31Å
613	A	33.5	Very low	33.6	Very low	102 Å²	102	126.3 Å²	126.3	84%	0.843	76%	0.76	S	S	*	*			trans	-142.8	68.8	-176	0	0	0	0	0	110.7
614	A	33.3	Very low	34.6	Very low	105 Å²	105	118.8 Å²	118.8	87%	0.868	74%	0.735	S	S	*	*	S	Bend	trans	-157	-12.9	173.9	0	0	0	0	0	114.8
615	A	34.6	Very low	35.7	Very low	103 Å²	103	121.6 Å²	121.6	85%	0.851	73%	0.728	S	S	*	*	S	Bend	trans	-118.5	9.9	-174.4	0	0	0	0	0	114.4
616	A	31.5	Very low	36.8	Very low	66 Å²	66	118.4 Å²	118.4	55%	0.545	71%	0.713	S	S	.	*	S	Bend	trans	-98.7	-20.7	-179.3	0	0	0	0	0	113.9	E618 E619	A616-E618 VanDerWaalsContact C-N 3.34Å; A616-E618 PolarHBondContact O-N 3.48Å; A616-E619 PolarHBondContact O-N 2.99Å
617	G	33.8	Very low	38	Very low	58 Å²	58	121.3 Å²	121.3	60%	0.598	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-13.6	-170	0	0	0	0	0	116.2
618	E	36	Very low	39.2	Very low	176 Å²	176	118 Å²	118	82%	0.822	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-15.3	178.8	-67	-171.3	154.7	0	0	113.4	A616	A616-E618 VanDerWaalsContact C-N 3.34Å; A616-E618 PolarHBondContact O-N 3.48Å
619	E	36.9	Very low	40.6	Very low	143 Å²	143	117.7 Å²	117.7	67%	0.668	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-39.5	178.2	-148	176.9	-142.3	0	0	111.7	A616 N621 R622 M623	A616-E619 PolarHBondContact O-N 2.99Å; E619-N621 VanDerWaalsContact C-N 3.27Å; E619-N621 PolarHBondContact O-N 3.07Å; E619-R622 PolarHBondContact O-N 3.03Å; E619-R622 VanDerWaalsContact O-N 3.15Å; E619-M623 PolarHBondContact O-N 2.92Å
620	E	39.6	Very low	41.1	Very low	146 Å²	146	117.9 Å²	117.9	68%	0.682	68%	0.678	S	S	*	*	H	α-helix	trans	-59	-38.1	175.7	-127.1	177.5	-179.2	0	0	112	R622 G624	E620-R622 VanDerWaalsContact C-N 3.31Å; E620-R622 PolarHBondContact O-N 3.05Å; E620-G624 PolarHBondContact O-N 3.38Å; E620-G624 VanDerWaalsContact O-N 3.12Å
621	N	43.9	Very low	42	Very low	121 Å²	121	114.1 Å²	114.1	65%	0.647	66%	0.659	S	S	*	*	H	α-helix	trans	-74.4	-19.6	-178.8	-139.8	41.9	0	0	0	113.2	E619	E619-N621 VanDerWaalsContact C-N 3.27Å; E619-N621 PolarHBondContact O-N 3.07Å
622	R	45.3	Very low	43.1	Very low	187 Å²	187	115.2 Å²	115.2	71%	0.706	65%	0.645	S	S	*	*	H	α-helix	trans	-83.8	-41.3	172.8	-81.5	-175	176.3	162.7	3.1	112.4	E619 E620 G624 E625 E626	E619-R622 PolarHBondContact O-N 3.03Å; E619-R622 VanDerWaalsContact O-N 3.15Å; E620-R622 VanDerWaalsContact C-N 3.31Å; E620-R622 PolarHBondContact O-N 3.05Å; R622-G624 VanDerWaalsContact C-N 3.29Å; R622-G624 PolarHBondContact O-N 2.93Å; R622-E625 PolarHBondContact O-N 3.07Å; R622-E626 PolarHBondContact O-N 2.94Å; R622-E626 VanDerWaalsContact O-N 3.13Å
623	M	44.2	Very low	44.3	Very low	105 Å²	105	116.8 Å²	116.8	52%	0.517	64%	0.636	S	S	.	*	H	α-helix	trans	-63	-37.9	174.9	-70.7	-168	-64.5	0	0	111.4	E619 E625 E626 E627	E619-M623 PolarHBondContact O-N 2.92Å; M623-E625 VanDerWaalsContact C-N 3.31Å; M623-E625 PolarHBondContact O-N 3.31Å; M623-E626 PolarHBondContact O-N 3.35Å; M623-E627 WeakPolarHBondContact O-CB 3.44Å; M623-E627 WeakPolarHBondContact O-CG 3.49Å; M623-E627 PolarHBondContact O-N 3.38Å
624	G	45.4	Very low	45.7	Very low	27 Å²	27	118.3 Å²	118.3	28%	0.278	63%	0.626	S	S	.	*	H	α-helix	trans	-65.1	-27.3	174.8	0	0	0	0	0	115	E620 R622 N628	E620-G624 PolarHBondContact O-N 3.38Å; E620-G624 VanDerWaalsContact O-N 3.12Å; R622-G624 VanDerWaalsContact C-N 3.29Å; R622-G624 PolarHBondContact O-N 2.93Å; G624-N628 WeakPolarHBondContact O-CB 3.46Å; G624-N628 PolarHBondContact O-N 3.44Å; G624-N628 PolarHBondContact O-ND2 3.01Å
625	E	48.1	Very low	47.1	Very low	134 Å²	134	120.1 Å²	120.1	63%	0.626	62%	0.616	S	S	*	*	H	α-helix	trans	-80	-31.1	173.4	-74.4	-175.3	159.1	0	0	112.4	R622 M623 R629	R622-E625 PolarHBondContact O-N 3.07Å; M623-E625 VanDerWaalsContact C-N 3.31Å; M623-E625 PolarHBondContact O-N 3.31Å; E625-R629 PolarHBondContact O-N 3Å
626	E	47.9	Very low	48.7	Very low	137 Å²	137	123 Å²	123	64%	0.64	61%	0.605	S	S	*	*	H	α-helix	trans	-77.3	-38.5	174.9	-69.8	-172.4	158.7	0	0	112.7	R622 M623 R629 M630	R622-E626 PolarHBondContact O-N 2.94Å; R622-E626 VanDerWaalsContact O-N 3.13Å; M623-E626 PolarHBondContact O-N 3.35Å; E626-R629 PolarHBondContact O-N 2.86Å; E626-M630 PolarHBondContact O-N 2.91Å
627	E	48	Very low	50.3	Low	138 Å²	138	125.8 Å²	125.8	65%	0.645	61%	0.608	S	S	*	*	H	α-helix	trans	-66.2	-40.8	174.4	-74.1	-173.1	155.4	0	0	112.1	M623 R629 M630 G631	M623-E627 WeakPolarHBondContact O-CB 3.44Å; M623-E627 WeakPolarHBondContact O-CG 3.49Å; M623-E627 PolarHBondContact O-N 3.38Å; E627-R629 VanDerWaalsContact C-N 3.33Å; E627-R629 PolarHBondContact O-N 2.93Å; E627-M630 PolarHBondContact O-N 2.63Å; E627-G631 PolarHBondContact O-N 2.75Å
628	N	50	Low	52	Low	115 Å²	115	128.8 Å²	128.8	62%	0.615	61%	0.607	S	S	*	*	H	α-helix	trans	-64.2	-36.6	173.6	-80.3	-49.4	0	0	0	112.1	G624 G631 E632	G624-N628 WeakPolarHBondContact O-CB 3.46Å; G624-N628 PolarHBondContact O-N 3.44Å; G624-N628 PolarHBondContact O-ND2 3.01Å; N628-G631 PolarHBondContact O-N 2.64Å; N628-E632 WeakPolarHBondContact O-CG 3.49Å; N628-E632 PolarHBondContact O-N 3.43Å
629	R	57.4	Low	53.5	Low	177 Å²	177	124.9 Å²	124.9	67%	0.668	59%	0.591	S	S	*	*	H	α-helix	trans	-65.7	-41.4	174.1	-88.1	-172.4	-178.9	163.1	6.1	113.2	E625 E626 E627 G631 E632 E633	E625-R629 PolarHBondContact O-N 3Å; E626-R629 PolarHBondContact O-N 2.86Å; E627-R629 VanDerWaalsContact C-N 3.33Å; E627-R629 PolarHBondContact O-N 2.93Å; R629-G631 VanDerWaalsContact C-N 3.31Å; R629-E632 PolarHBondContact O-N 3.25Å; R629-E633 WeakPolarHBondContact O-CB 3.29Å; R629-E633 WeakPolarHBondContact O-CG 3.36Å; R629-E633 PolarHBondContact O-N 3.23Å
630	M	49.5	Very low	55.2	Low	119 Å²	119	122.9 Å²	122.9	59%	0.586	58%	0.582	S	S	*	*	H	α-helix	trans	-65.7	-36.8	175.5	-71.8	-163.8	-59.8	0	0	111.6	E626 E627 E633 E634	E626-M630 PolarHBondContact O-N 2.91Å; E627-M630 PolarHBondContact O-N 2.63Å; M630-E633 PolarHBondContact O-N 3.46Å; M630-E634 WeakPolarHBondContact O-CB 3.49Å; M630-E634 WeakPolarHBondContact O-CG 3.26Å; M630-E634 PolarHBondContact O-N 3.25Å
631	G	58.3	Low	56.6	Low	31 Å²	31	121.8 Å²	121.8	32%	0.32	58%	0.577	S	S	.	*	H	α-helix	trans	-62.9	-44.6	172.9	0	0	0	0	0	113.4	E627 N628 R629 E633 E634 E635	E627-G631 PolarHBondContact O-N 2.75Å; N628-G631 PolarHBondContact O-N 2.64Å; R629-G631 VanDerWaalsContact C-N 3.31Å; G631-E633 VanDerWaalsContact C-N 3.31Å; G631-E633 PolarHBondContact O-N 3.26Å; G631-E634 PolarHBondContact O-N 3.13Å; G631-E635 PolarHBondContact O-N 3.38Å
632	E	57.4	Low	57.9	Low	135 Å²	135	120.6 Å²	120.6	63%	0.631	57%	0.568	S	S	*	*	H	α-helix	trans	-66.4	-30.2	175.3	-72.8	-178.9	172.4	0	0	112.8	N628 R629 R636	N628-E632 WeakPolarHBondContact O-CG 3.49Å; N628-E632 PolarHBondContact O-N 3.43Å; R629-E632 PolarHBondContact O-N 3.25Å; E632-R636 VanDerWaalsContact O-CB 3.23Å; E632-R636 WeakPolarHBondContact O-CB 3.31Å; E632-R636 PolarHBondContact O-N 3.5Å
633	E	56.6	Low	59	Low	128 Å²	128	117.1 Å²	117.1	60%	0.598	56%	0.559	S	S	*	*	H	α-helix	trans	-77.1	-34.5	173.6	-74.8	-176.6	178.1	0	0	112.7	R629 M630 G631 M637	R629-E633 WeakPolarHBondContact O-CB 3.29Å; R629-E633 WeakPolarHBondContact O-CG 3.36Å; R629-E633 PolarHBondContact O-N 3.23Å; M630-E633 PolarHBondContact O-N 3.46Å; G631-E633 VanDerWaalsContact C-N 3.31Å; G631-E633 PolarHBondContact O-N 3.26Å; E633-M637 WeakPolarHBondContact O-CB 3.45Å; E633-M637 PolarHBondContact O-N 2.81Å; E633-M637 VanDerWaalsContact O-N 3.07Å
634	E	61.3	Low	60.1	Low	134 Å²	134	118.3 Å²	118.3	63%	0.626	56%	0.563	S	S	*	*	H	α-helix	trans	-69.1	-48.6	172.7	-77.1	-172.8	153.8	0	0	111.8	M630 G631 R636 M637 E638	M630-E634 WeakPolarHBondContact O-CB 3.49Å; M630-E634 WeakPolarHBondContact O-CG 3.26Å; M630-E634 PolarHBondContact O-N 3.25Å; G631-E634 PolarHBondContact O-N 3.13Å; E634-R636 VanDerWaalsContact C-N 3.28Å; E634-R636 PolarHBondContact O-N 3.2Å; E634-M637 WeakPolarHBondContact O-CB 3.46Å; E634-M637 PolarHBondContact O-N 3.34Å; E634-E638 PolarHBondContact O-N 3.19Å
635	E	64.1	Low	61.4	Low	142 Å²	142	122.4 Å²	122.4	66%	0.664	58%	0.575	S	S	*	*	H	α-helix	trans	-58.4	-40	175.3	-77.5	-167.3	153.5	0	0	111.6	G631 M637 E638 D639	G631-E635 PolarHBondContact O-N 3.38Å; E635-M637 VanDerWaalsContact C-N 3.32Å; E635-M637 PolarHBondContact O-N 3.44Å; E635-E638 PolarHBondContact O-N 3.42Å; E635-D639 WeakPolarHBondContact O-CB 3.35Å; E635-D639 PolarHBondContact O-N 3.15Å
636	R	67.9	Low	62.7	Low	164 Å²	164	121.8 Å²	121.8	62%	0.619	57%	0.572	S	S	*	*	H	α-helix	trans	-64.3	-34.7	174.8	174	177.2	-84.4	-84.2	-0.5	112.6	E632 E634 E640	E632-R636 VanDerWaalsContact O-CB 3.23Å; E632-R636 WeakPolarHBondContact O-CB 3.31Å; E632-R636 PolarHBondContact O-N 3.5Å; E634-R636 VanDerWaalsContact C-N 3.28Å; E634-R636 PolarHBondContact O-N 3.2Å; R636-E640 IonicContact NH1-OE1 2.63Å; R636-E640 WeakPolarHBondContact O-CB 3.5Å; R636-E640 WeakPolarHBondContact O-CG 3.49Å; R636-E640 PolarHBondContact O-N 3.46Å; R636-E640 VanDerWaalsContact O-N 3.07Å
637	M	65.9	Low	63.7	Low	124 Å²	124	119.9 Å²	119.9	61%	0.611	57%	0.566	S	S	*	*	H	α-helix	trans	-73.3	-38.6	177.6	-157.9	178.9	-47.8	0	0	111.4	E633 E634 E635 E640 E641	E633-M637 WeakPolarHBondContact O-CB 3.45Å; E633-M637 PolarHBondContact O-N 2.81Å; E633-M637 VanDerWaalsContact O-N 3.07Å; E634-M637 WeakPolarHBondContact O-CB 3.46Å; E634-M637 PolarHBondContact O-N 3.34Å; E635-M637 VanDerWaalsContact C-N 3.32Å; E635-M637 PolarHBondContact O-N 3.44Å; M637-E640 PolarHBondContact O-N 3.12Å; M637-E641 PolarHBondContact O-N 3.33Å
638	E	68.3	Low	64.8	Low	122 Å²	122	119.4 Å²	119.4	57%	0.57	56%	0.564	S	S	*	*	H	α-helix	trans	-65.8	-38.3	172.9	-68.5	-168.9	168.4	0	0	112.2	E634 E635 E641 Q642	E634-E638 PolarHBondContact O-N 3.19Å; E635-E638 PolarHBondContact O-N 3.42Å; E638-E641 PolarHBondContact O-N 3.48Å; E638-Q642 WeakPolarHBondContact O-CB 3.4Å; E638-Q642 VanDerWaalsContact O-CG 3.26Å; E638-Q642 WeakPolarHBondContact O-CG 3.44Å; E638-Q642 PolarHBondContact O-N 2.83Å; E638-Q642 PolarHBondContact O-NE2 3.23Å
639	D	68.6	Low	65.9	Low	94 Å²	94	120.5 Å²	120.5	50%	0.503	57%	0.565	S	S	.	*	H	α-helix	trans	-66.6	-34.5	173.3	-96.7	-3.3	0	0	0	112.6	E635 Q643	E635-D639 WeakPolarHBondContact O-CB 3.35Å; E635-D639 PolarHBondContact O-N 3.15Å; D639-Q643 WeakPolarHBondContact O-CB 3.36Å; D639-Q643 WeakPolarHBondContact O-CG 3.28Å; D639-Q643 PolarHBondContact O-N 3.32Å; D639-Q643 PolarHBondContact O-NE2 2.96Å
640	E	70.8	Confident	66.3	Low	101 Å²	101	118 Å²	118	47%	0.472	56%	0.561	S	S	.	*	H	α-helix	trans	-73.6	-38.3	175.3	-77.7	-178.5	-166.6	0	0	111.9	R636 M637 Q644	R636-E640 IonicContact NH1-OE1 2.63Å; R636-E640 WeakPolarHBondContact O-CB 3.5Å; R636-E640 WeakPolarHBondContact O-CG 3.49Å; R636-E640 PolarHBondContact O-N 3.46Å; R636-E640 VanDerWaalsContact O-N 3.07Å; M637-E640 PolarHBondContact O-N 3.12Å; E640-Q644 WeakPolarHBondContact O-CB 3.33Å; E640-Q644 PolarHBondContact O-N 3.09Å
641	E	70.7	Confident	66.9	Low	122 Å²	122	117.1 Å²	117.1	57%	0.57	56%	0.559	S	S	*	*	H	α-helix	trans	-66.5	-40.7	171	-80.8	-159.9	132.8	0	0	112.3	M637 E638 Q644 Q645	M637-E641 PolarHBondContact O-N 3.33Å; E638-E641 PolarHBondContact O-N 3.48Å; E641-Q644 PolarHBondContact O-N 3.14Å; E641-Q645 WeakPolarHBondContact O-CG 3.12Å; E641-Q645 PolarHBondContact O-N 3.38Å
642	Q	70.1	Confident	67.1	Low	97 Å²	97	121.3 Å²	121.3	45%	0.453	57%	0.57	S	S	.	*	H	α-helix	trans	-65.1	-39.4	176.6	-77.7	175.1	74.7	0	0	112.3	E638 Q644 Q645 Q646	E638-Q642 WeakPolarHBondContact O-CB 3.4Å; E638-Q642 VanDerWaalsContact O-CG 3.26Å; E638-Q642 WeakPolarHBondContact O-CG 3.44Å; E638-Q642 PolarHBondContact O-N 2.83Å; E638-Q642 PolarHBondContact O-NE2 3.23Å; Q642-Q644 VanDerWaalsContact C-N 3.33Å; Q642-Q645 PolarHBondContact O-N 3.36Å; Q642-Q646 WeakPolarHBondContact O-CB 3.45Å; Q642-Q646 WeakPolarHBondContact O-CG 3.48Å; Q642-Q646 PolarHBondContact O-N 3.39Å
643	Q	68.4	Low	67.2	Low	113 Å²	113	120 Å²	120	53%	0.528	56%	0.564	S	S	.	*	H	α-helix	trans	-64.7	-37.2	171.5	-81	169.7	79.4	0	0	112.1	D639 Q646 L647	D639-Q643 WeakPolarHBondContact O-CB 3.36Å; D639-Q643 WeakPolarHBondContact O-CG 3.28Å; D639-Q643 PolarHBondContact O-N 3.32Å; D639-Q643 PolarHBondContact O-NE2 2.96Å; Q643-Q646 PolarHBondContact O-N 2.93Å; Q643-L647 WeakPolarHBondContact O-CB 3.49Å; Q643-L647 VanDerWaalsContact O-CG 3.26Å; Q643-L647 WeakPolarHBondContact O-CG 3.25Å; Q643-L647 PolarHBondContact O-N 2.81Å
644	Q	68.3	Low	67.1	Low	130 Å²	130	120.1 Å²	120.1	61%	0.607	57%	0.565	S	S	*	*	H	α-helix	trans	-66.3	-42.1	176.3	-129.8	157.2	102.7	0	0	111.7	E640 E641 Q642 L647 E648	E640-Q644 WeakPolarHBondContact O-CB 3.33Å; E640-Q644 PolarHBondContact O-N 3.09Å; E641-Q644 PolarHBondContact O-N 3.14Å; Q642-Q644 VanDerWaalsContact C-N 3.33Å; Q644-L647 PolarHBondContact O-N 3Å; Q644-E648 WeakPolarHBondContact O-CG 3.31Å; Q644-E648 PolarHBondContact O-N 2.81Å
645	Q	72.1	Confident	66.7	Low	113 Å²	113	120.2 Å²	120.2	53%	0.528	57%	0.565	S	S	.	*	H	α-helix	trans	-65.4	-41.7	175.1	-70.6	173.5	40.8	0	0	112	E641 Q642 L647 E648 E649	E641-Q645 WeakPolarHBondContact O-CG 3.12Å; E641-Q645 PolarHBondContact O-N 3.38Å; Q642-Q645 PolarHBondContact O-N 3.36Å; Q645-L647 VanDerWaalsContact C-N 3.34Å; Q645-L647 PolarHBondContact O-N 2.68Å; Q645-E648 PolarHBondContact O-N 3.13Å; Q645-E649 PolarHBondContact O-N 3.39Å
646	Q	74.3	Confident	65.9	Low	121 Å²	121	117 Å²	117	57%	0.565	56%	0.555	S	S	*	*	H	α-helix	trans	-62.1	-39.8	174.1	-75.5	174.8	23.5	0	0	112.1	Q642 Q643 E648 E649 E650	Q642-Q646 WeakPolarHBondContact O-CB 3.45Å; Q642-Q646 WeakPolarHBondContact O-CG 3.48Å; Q642-Q646 PolarHBondContact O-N 3.39Å; Q643-Q646 PolarHBondContact O-N 2.93Å; Q646-E648 VanDerWaalsContact C-N 3.35Å; Q646-E649 PolarHBondContact O-N 2.86Å; Q646-E650 VanDerWaalsContact O-CB 3.29Å; Q646-E650 WeakPolarHBondContact O-CB 3.5Å; Q646-E650 PolarHBondContact O-N 2.82Å
647	L	70.1	Confident	65.1	Low	98 Å²	98	115.2 Å²	115.2	51%	0.513	55%	0.552	S	S	.	*	H	α-helix	trans	-67.3	-33.4	174.6	-72	166.7	0	0	0	112.5	Q643 Q644 Q645 N651	Q643-L647 WeakPolarHBondContact O-CB 3.49Å; Q643-L647 VanDerWaalsContact O-CG 3.26Å; Q643-L647 WeakPolarHBondContact O-CG 3.25Å; Q643-L647 PolarHBondContact O-N 2.81Å; Q644-L647 PolarHBondContact O-N 3Å; Q645-L647 VanDerWaalsContact C-N 3.34Å; Q645-L647 PolarHBondContact O-N 2.68Å; L647-N651 WeakPolarHBondContact O-CB 3.39Å; L647-N651 PolarHBondContact O-N 2.86Å; L647-N651 VanDerWaalsContact O-N 3.09Å; L647-N651 PolarHBondContact O-ND2 3.08Å
648	E	71.6	Confident	64.2	Low	127 Å²	127	117.1 Å²	117.1	59%	0.593	56%	0.56	S	S	*	*	H	α-helix	trans	-73.4	-34.6	173.9	-73.7	-169.8	166.3	0	0	112.8	Q644 Q645 Q646 Q652	Q644-E648 WeakPolarHBondContact O-CG 3.31Å; Q644-E648 PolarHBondContact O-N 2.81Å; Q645-E648 PolarHBondContact O-N 3.13Å; Q646-E648 VanDerWaalsContact C-N 3.35Å; E648-Q652 WeakPolarHBondContact O-CG 3.48Å; E648-Q652 PolarHBondContact O-N 3.14Å; E648-Q652 PolarHBondContact O-NE2 3.34Å
649	E	72.4	Confident	63.1	Low	138 Å²	138	117.1 Å²	117.1	65%	0.645	56%	0.563	S	S	*	*	H	α-helix	trans	-69.5	-41.9	171.1	-74.1	-169.4	145.5	0	0	111.7	Q645 Q646 N651 Q652 E653	Q645-E649 PolarHBondContact O-N 3.39Å; Q646-E649 PolarHBondContact O-N 2.86Å; E649-N651 PolarHBondContact O-N 3.42Å; E649-Q652 CarbonylContact O-C 3.57Å; E649-Q652 PolarHBondContact O-N 3.5Å; E649-Q652 VanDerWaalsContact O-N 3.13Å; E649-E653 PolarHBondContact O-N 3.38Å
650	E	66.3	Low	61.7	Low	125 Å²	125	119.8 Å²	119.8	58%	0.584	57%	0.572	S	S	*	*	H	α-helix	trans	-65.8	-38.4	179	-161.9	170.1	-140.7	0	0	111.5	Q646 E653 E654	Q646-E650 VanDerWaalsContact O-CB 3.29Å; Q646-E650 WeakPolarHBondContact O-CB 3.5Å; Q646-E650 PolarHBondContact O-N 2.82Å; E650-E653 PolarHBondContact O-N 3.16Å; E650-E654 PolarHBondContact O-N 2.88Å
651	N	61.8	Low	60.1	Low	101 Å²	101	118.5 Å²	118.5	54%	0.54	59%	0.586	S	S	.	*	H	α-helix	trans	-64.8	-36.6	170.7	-85.3	-88	0	0	0	112.9	L647 E649 E654 E655	L647-N651 WeakPolarHBondContact O-CB 3.39Å; L647-N651 PolarHBondContact O-N 2.86Å; L647-N651 VanDerWaalsContact O-N 3.09Å; L647-N651 PolarHBondContact O-ND2 3.08Å; E649-N651 PolarHBondContact O-N 3.42Å; N651-E654 PolarHBondContact O-N 3.3Å; N651-E655 PolarHBondContact O-N 2.84Å
652	Q	62.4	Low	58.7	Low	119 Å²	119	117 Å²	117	56%	0.556	60%	0.595	S	S	*	*	H	α-helix	trans	-72.3	-32.9	175.2	-77.1	170.5	82.9	0	0	112.1	E648 E649 T656	E648-Q652 WeakPolarHBondContact O-CG 3.48Å; E648-Q652 PolarHBondContact O-N 3.14Å; E648-Q652 PolarHBondContact O-NE2 3.34Å; E649-Q652 CarbonylContact O-C 3.57Å; E649-Q652 PolarHBondContact O-N 3.5Å; E649-Q652 VanDerWaalsContact O-N 3.13Å; Q652-T656 WeakPolarHBondContact O-CB 3.34Å; Q652-T656 WeakPolarHBondContact O-CG2 3.35Å; Q652-T656 PolarHBondContact O-N 2.92Å; Q652-T656 PolarHBondContact O-OG1 3.49Å
653	E	60.3	Low	57.2	Low	108 Å²	108	120.5 Å²	120.5	51%	0.505	61%	0.611	S	S	.	*	H	α-helix	trans	-67.3	-36.2	169.8	-81.3	-149.2	178.4	0	0	112.4	E649 E650 T656 K657	E649-E653 PolarHBondContact O-N 3.38Å; E650-E653 PolarHBondContact O-N 3.16Å; E653-T656 WeakPolarHBondContact CA-OG1 3.33Å; E653-T656 PolarHBondContact O-OG1 2.83Å; E653-K657 VanDerWaalsContact O-CB 3.32Å; E653-K657 WeakPolarHBondContact O-CB 3.31Å; E653-K657 WeakPolarHBondContact O-CD 3.44Å; E653-K657 WeakPolarHBondContact O-CG 3.1Å; E653-K657 PolarHBondContact O-N 3.16Å; E653-K657 IonicContact OE2-NZ 2.96Å; E653-K657 PolarHBondContact OE2-NZ 3.08Å
654	E	54	Low	55.7	Low	130 Å²	130	124.8 Å²	124.8	61%	0.607	63%	0.631	S	S	*	*	H	α-helix	trans	-67.9	-46.7	172.3	-71.4	-157.6	145.1	0	0	111.8	E650 N651 T656 K657 E658	E650-E654 PolarHBondContact O-N 2.88Å; N651-E654 PolarHBondContact O-N 3.3Å; E654-T656 VanDerWaalsContact C-N 3.26Å; E654-T656 PolarHBondContact O-N 3.4Å; E654-K657 PolarHBondContact O-N 2.88Å; E654-E658 PolarHBondContact O-N 3.47Å
655	E	51.5	Low	54.2	Low	135 Å²	135	121.8 Å²	121.8	63%	0.631	64%	0.635	S	S	*	*	H	α-helix	trans	-59.8	-33.8	175.2	-87.2	-162	140.7	0	0	112.9	N651 N659	N651-E655 PolarHBondContact O-N 2.84Å; E655-N659 PolarHBondContact O-N 3.19Å; E655-N659 PolarHBondContact O-ND2 2.92Å
656	T	49.1	Very low	52	Low	75 Å²	75	125 Å²	125	46%	0.46	65%	0.648	S	S	.	*	H	α-helix	trans	-80.1	-34	178	50.2	0	0	0	0	113.1	Q652 E653 E654 N659 H660	Q652-T656 WeakPolarHBondContact O-CB 3.34Å; Q652-T656 WeakPolarHBondContact O-CG2 3.35Å; Q652-T656 PolarHBondContact O-N 2.92Å; Q652-T656 PolarHBondContact O-OG1 3.49Å; E653-T656 WeakPolarHBondContact CA-OG1 3.33Å; E653-T656 PolarHBondContact O-OG1 2.83Å; E654-T656 VanDerWaalsContact C-N 3.26Å; E654-T656 PolarHBondContact O-N 3.4Å; T656-N659 PolarHBondContact O-N 2.93Å; T656-H660 PolarHBondContact O-N 3.4Å; T656-H660 VanDerWaalsContact O-N 3.08Å; T656-H660 PolarHBondContact O-ND1 3.5Å
657	K	49.8	Very low	50.1	Low	126 Å²	126	128.8 Å²	128.8	55%	0.548	67%	0.666	S	S	.	*	H	α-helix	trans	-68	-38.4	171.5	-75.1	164.5	-168.9	150.8	0	112.2	E653 E654 N659 H660 G661	E653-K657 VanDerWaalsContact O-CB 3.32Å; E653-K657 WeakPolarHBondContact O-CB 3.31Å; E653-K657 WeakPolarHBondContact O-CD 3.44Å; E653-K657 WeakPolarHBondContact O-CG 3.1Å; E653-K657 PolarHBondContact O-N 3.16Å; E653-K657 IonicContact OE2-NZ 2.96Å; E653-K657 PolarHBondContact OE2-NZ 3.08Å; E654-K657 PolarHBondContact O-N 2.88Å; K657-N659 VanDerWaalsContact C-N 3.27Å; K657-N659 PolarHBondContact O-N 3.5Å; K657-H660 PolarHBondContact O-N 3.06Å; K657-G661 PolarHBondContact O-N 3.5Å
658	E	46.6	Very low	48.3	Very low	165 Å²	165	130.2 Å²	130.2	77%	0.771	67%	0.673	S	S	*	*	H	α-helix	trans	-63.7	-30.9	173.6	-74.8	-158.4	150.1	0	0	112.6	E654	E654-E658 PolarHBondContact O-N 3.47Å
659	N	45.1	Very low	46.2	Very low	122 Å²	122	127.4 Å²	127.4	65%	0.652	68%	0.677	S	S	*	*	H	α-helix	trans	-77.6	-37.8	174.6	-84.2	-81.1	0	0	0	113.6	E655 T656 K657 G661	E655-N659 PolarHBondContact O-N 3.19Å; E655-N659 PolarHBondContact O-ND2 2.92Å; T656-N659 PolarHBondContact O-N 2.93Å; K657-N659 VanDerWaalsContact C-N 3.27Å; K657-N659 PolarHBondContact O-N 3.5Å; N659-G661 VanDerWaalsContact C-N 3.31Å; N659-G661 PolarHBondContact O-N 3.42Å
660	H	39.1	Very low	44.4	Very low	149 Å²	149	130.6 Å²	130.6	69%	0.69	69%	0.692	S	S	*	*	H	α-helix	trans	-74.1	-19.3	-179.4	-76.2	74.4	0	0	0	113.6	T656 K657 A662	T656-H660 PolarHBondContact O-N 3.4Å; T656-H660 VanDerWaalsContact O-N 3.08Å; T656-H660 PolarHBondContact O-ND1 3.5Å; K657-H660 PolarHBondContact O-N 3.06Å; H660-A662 PolarHBondContact O-N 3.17Å; H660-A662 VanDerWaalsContact O-N 3.1Å
661	G	37.2	Very low	42.7	Very low	74 Å²	74	133.1 Å²	133.1	76%	0.763	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	2.4	176.7	0	0	0	0	0	116	K657 N659	K657-G661 PolarHBondContact O-N 3.5Å; N659-G661 VanDerWaalsContact C-N 3.31Å; N659-G661 PolarHBondContact O-N 3.42Å
662	A	41.8	Very low	41.4	Very low	90 Å²	90	135.7 Å²	135.7	74%	0.744	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	-5.8	-170.8	0	0	0	0	0	115.8	H660	H660-A662 PolarHBondContact O-N 3.17Å; H660-A662 VanDerWaalsContact O-N 3.1Å
663	E	39.6	Very low	40.1	Very low	171 Å²	171	137.8 Å²	137.8	80%	0.799	72%	0.723	S	S	*	*	S	Bend	trans	-106.1	-24.9	-171.4	-164.5	172.4	162.4	0	0	115.4	G665	E663-G665 PolarHBondContact O-N 3.07Å
664	E	36	Very low	38.6	Very low	203 Å²	203	140.2 Å²	140.2	95%	0.949	74%	0.739	S	S	*	*	S	Bend	trans	-75.7	82.4	-179.4	-70	-163.6	169.3	0	0	112.6
665	G	36.2	Very low	37.5	Very low	68 Å²	68	143.2 Å²	143.2	70%	0.701	75%	0.753	S	S	*	*			trans	178.1	28.2	178.2	0	0	0	0	0	119.3	E663	E663-G665 PolarHBondContact O-N 3.07Å
666	F	27.1	Very low	36.3	Very low	179 Å²	179	140 Å²	140	79%	0.785	76%	0.756	S	S	*	*			trans	-147.9	75	170.1	-140.6	-107.5	0	0	0	114.7	I668	F666-I668 HydrophobicContact CD1-CD1 4.16Å; F666-I668 HydrophobicContact CD1-CG1 4.03Å; F666-I668 HydrophobicContact CE1-CD1 3.32Å; F666-I668 HydrophobicContact CE1-CG1 3.71Å; F666-I668 HydrophobicContact CZ-CD1 3.53Å; F666-I668 HydrophobicContact CZ-CG1 4.18Å; F666-I668 PolarHBondContact O-N 3.34Å
667	E	34.2	Very low	35.1	Very low	201 Å²	201	147.3 Å²	147.3	94%	0.939	78%	0.777	S	S	*	*			trans	-81.3	105.1	166.8	-168.3	175.9	-137.4	0	0	109
668	I	32.1	Very low	34.1	Very low	129 Å²	129	145.8 Å²	145.8	66%	0.662	78%	0.778	S	S	*	*			trans	-126.8	130.1	165.4	-68	-163	0	0	0	107.8	F666	F666-I668 HydrophobicContact CD1-CD1 4.16Å; F666-I668 HydrophobicContact CD1-CG1 4.03Å; F666-I668 HydrophobicContact CE1-CD1 3.32Å; F666-I668 HydrophobicContact CE1-CG1 3.71Å; F666-I668 HydrophobicContact CZ-CD1 3.53Å; F666-I668 HydrophobicContact CZ-CG1 4.18Å; F666-I668 PolarHBondContact O-N 3.34Å
669	G	28.4	Very low	33.2	Very low	67 Å²	67	143 Å²	143	69%	0.691	77%	0.772	S	S	*	*			trans	-74.4	158.1	-161.9	0	0	0	0	0	116	E671	G669-E671 PolarHBondContact O-N 3.5Å
670	E	33.9	Very low	32.4	Very low	205 Å²	205	145.1 Å²	145.1	96%	0.958	78%	0.778	S	S	*	*			trans	-85.3	100.9	171.8	-62.6	-180	155	0	0	110.2
671	E	31.3	Very low	32.1	Very low	179 Å²	179	144.3 Å²	144.3	84%	0.836	78%	0.778	S	S	*	*			trans	-126.5	131.6	158.9	-77.9	178.8	176.3	0	0	103.4	G669	G669-E671 PolarHBondContact O-N 3.5Å
672	E	33.7	Very low	31.7	Very low	154 Å²	154	149.6 Å²	149.6	72%	0.72	78%	0.783	S	S	*	*			cis	-152	160.9	23.7	-102.6	162	163.6	0	0	110.4
673	E	34.1	Very low	31	Very low	164 Å²	164	149 Å²	149	77%	0.766	79%	0.786	S	S	*	*			trans	50.7	112.7	139.8	-58.9	173	172	0	0	118.8
674	D	29.1	Very low	30.8	Very low	158 Å²	158	150.3 Å²	150.3	85%	0.845	79%	0.792	S	S	*	*				65.8	148.1	57.4	-128.6	-13.1	0	0	0	114.4
675	E	32.5	Very low	30.7	Very low	194 Å²	194	149.9 Å²	149.9	91%	0.907	79%	0.79	S	S	*	*			trans	70.3	136.9	-174.9	-45.4	-168.7	-170	0	0	117.2
676	G	24.9	Very low	30.5	Very low	68 Å²	68	150 Å²	150	70%	0.701	79%	0.791	S	S	*	*			cis	150.3	142.5	-5.1	0	0	0	0	0	112.2
677	Y	24.2	Very low	30.5	Very low	228 Å²	228	149.4 Å²	149.4	89%	0.894	79%	0.788	S	S	*	*			trans	66.6	158.7	164.8	-109	-130.6	0	0	0	116.8
678	V	28.8	Very low	30.4	Very low	94 Å²	94	147.8 Å²	147.8	57%	0.57	78%	0.781	S	S	*	*			cis	-168	137.4	-26.9	111.5	0	0	0	0	110.7
679	V	28.3	Very low	30.3	Very low	106 Å²	106	144.3 Å²	144.3	64%	0.642	78%	0.777	S	S	*	*			trans	52.1	135.5	135.6	174.3	0	0	0	0	123
680	H	28.1	Very low	30.6	Very low	167 Å²	167	147 Å²	147	77%	0.773	78%	0.775	S	S	*	*			trans	63.5	151.5	158.9	-76.6	-43.4	0	0	0	117.6
681	D	33	Very low	30.8	Very low	131 Å²	131	145.4 Å²	145.4	70%	0.701	77%	0.768	S	S	*	*			cis	175.7	-172	-21.5	-143.2	-56.5	0	0	0	104.4
682	E	29.2	Very low	31.2	Very low	185 Å²	185	145.5 Å²	145.5	86%	0.864	77%	0.768	S	S	*	*			trans	70.8	107.2	166.4	-51.8	-169	-176	0	0	117.8
683	G	27.2	Very low	31.4	Very low	77 Å²	77	141.3 Å²	141.3	79%	0.794	77%	0.766	S	S	*	*				114.9	94.8	124.3	0	0	0	0	0	118.1
684	E	33.8	Very low	31.8	Very low	200 Å²	200	137.7 Å²	137.7	94%	0.935	76%	0.764	S	S	*	*				-147.8	120.1	128	-126.2	176.9	-177.9	0	0	112.5
685	E	35.3	Very low	32.5	Very low	193 Å²	193	137.9 Å²	137.9	90%	0.902	76%	0.76	S	S	*	*			trans	-64.6	154.8	155.8	-50.2	171.7	160.3	0	0	107.9
686	G	30.5	Very low	33	Very low	70 Å²	70	135.1 Å²	135.1	72%	0.722	75%	0.747	S	S	*	*			cis	155.7	144.2	2.6	0	0	0	0	0	110.2
687	F	27.3	Very low	33.8	Very low	167 Å²	167	139.9 Å²	139.9	73%	0.732	75%	0.745	S	S	*	*			trans	78.4	104.2	151.5	-147.4	-113.1	0	0	0	122.1
688	H	32.1	Very low	34.7	Very low	168 Å²	168	136.2 Å²	136.2	78%	0.778	74%	0.736	S	S	*	*				157.7	128.8	126.8	-92.1	-64.8	0	0	0	110
689	G	30.8	Very low	35.5	Very low	56 Å²	56	144.3 Å²	144.3	58%	0.577	77%	0.768	S	S	*	*			cis	-178.1	151.9	-7.8	0	0	0	0	0	111
690	D	35	Very low	35.8	Very low	124 Å²	124	146.2 Å²	146.2	66%	0.663	77%	0.774	S	S	*	*			trans	54.4	112.7	148.3	-44.4	-34	0	0	0	119.1
691	E	38.2	Very low	36.2	Very low	171 Å²	171	145.1 Å²	145.1	80%	0.799	77%	0.774	S	S	*	*				97.1	137.3	97.7	-85.3	-177.8	165	0	0	110.7
692	E	39.9	Very low	36.4	Very low	181 Å²	181	145.9 Å²	145.9	85%	0.846	78%	0.778	S	S	*	*			cis	-139.6	157.7	-6.6	-86.7	163.8	153.6	0	0	104.3
693	G	37.9	Very low	36.8	Very low	66 Å²	66	143.6 Å²	143.6	68%	0.68	77%	0.773	S	S	*	*			cis	126	156.9	37.6	0	0	0	0	0	108
694	A	41.9	Very low	37.4	Very low	87 Å²	87	147.8 Å²	147.8	72%	0.719	77%	0.771	S	S	*	*			trans	63.7	136.3	178.4	0	0	0	0	0	117.2
695	E	44.7	Very low	37.7	Very low	163 Å²	163	144.3 Å²	144.3	76%	0.762	76%	0.761	S	S	*	*			cis	171.6	139.5	-13	-111.9	151.8	-153.7	0	0	103.3
696	E	42.3	Very low	37.9	Very low	136 Å²	136	140.8 Å²	140.8	64%	0.636	75%	0.751	S	S	*	*				73.8	129.3	99.5	-150.1	177	-153.2	0	0	112.2
697	Y	41.1	Very low	38.4	Very low	168 Å²	168	146.2 Å²	146.2	66%	0.659	75%	0.753	S	S	*	*			cis	-161.4	174.7	4.8	-123.1	173.3	0	0	0	110.3
698	Q	42.9	Very low	39.3	Very low	151 Å²	151	144.5 Å²	144.5	71%	0.706	75%	0.754	S	S	*	*			trans	44.5	142	139.2	-63	163.9	-4.7	0	0	119.7
699	E	45.3	Very low	40	Very low	263 Å²	263	142.4 Å²	142.4	100%	1.229	75%	0.752	S	S	*	*			cis	-147.6	0	29.5	-158.1	170.2	-162.4	0	0	111.6

Retrieved 699 of 699 residues in 118.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).