A0A5K4F885_SCHMA Loading...

Protein Wnt

Ligand for members of the frizzled family of seven transmembrane receptors.

AlphaFold DB , UniProt , Accession A0A5K4F885, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 544 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.2	Low	61.2	Low	221 Å²	221	127.7 Å²	127.7	100%	1.089	65%	0.649	S	S	*	*				0	-16.6	0	-63.4	-126.9	-171	0	0	114.3
2	S	59.5	Low	60.9	Low	93 Å²	93	122.7 Å²	122.7	65%	0.65	63%	0.632	S	S	*	*	H	α-helix	trans	-83.5	-12.8	-178.2	-160.1	0	0	0	0	116.1	N6	S2-N6 PolarHBondContact O-ND2 3.03Å
3	V	62	Low	60.4	Low	105 Å²	105	121.6 Å²	121.6	64%	0.636	63%	0.627	S	S	*	*	H	α-helix	trans	-88.1	-25.9	-175.3	-175.5	0	0	0	0	112
4	W	58.3	Low	59.8	Low	199 Å²	199	123.4 Å²	123.4	75%	0.754	63%	0.628	S	S	*	*	H	α-helix	trans	-80.6	-26.3	178.5	-78.9	69.8	0	0	0	113.1	L8	W4-L8 PolarHBondContact O-N 3Å
5	L	63.2	Low	59.1	Low	127 Å²	127	121.3 Å²	121.3	67%	0.665	62%	0.624	S	S	*	*	H	α-helix	trans	-69	-34.1	175.8	-117	83	0	0	0	112.7	L9	L5-L9 PolarHBondContact O-N 3.15Å; L5-L9 VanDerWaalsContact O-N 3.15Å
6	N	59	Low	58.3	Low	97 Å²	97	120.4 Å²	120.4	52%	0.519	62%	0.62	S	S	.	*	H	α-helix	trans	-76.4	-28	179.9	-74.7	-38.1	0	0	0	112.9	S2 F10	S2-N6 PolarHBondContact O-ND2 3.03Å; N6-F10 PolarHBondContact O-N 3.15Å; N6-F10 VanDerWaalsContact O-N 3.09Å
7	I	68	Low	57.8	Low	94 Å²	94	117.9 Å²	117.9	48%	0.482	62%	0.616	S	S	.	*	H	α-helix	trans	-74.6	-36.4	176.2	-63.1	170	0	0	0	110.5	L11	I7-L11 HydrophobicContact CG2-CD1 3.98Å; I7-L11 WeakPolarHBondContact O-CB 3.21Å; I7-L11 VanDerWaalsContact O-CG 3.32Å; I7-L11 WeakPolarHBondContact O-CG 3.2Å; I7-L11 PolarHBondContact O-N 3.48Å
8	L	63.5	Low	57.2	Low	112 Å²	112	116.7 Å²	116.7	59%	0.586	62%	0.619	S	S	*	*	H	α-helix	trans	-69.7	-33.2	172.4	-98.1	107.5	0	0	0	113.2	W4 C12	W4-L8 PolarHBondContact O-N 3Å; L8-C12 WeakPolarHBondContact O-CB 3.44Å; L8-C12 PolarHBondContact O-N 2.99Å; L8-C12 PolarHBondContact O-SG 3.27Å; L8-C12 VanDerWaalsContact O-SG 3.42Å
9	L	64.5	Low	56.5	Low	109 Å²	109	119.2 Å²	119.2	57%	0.571	63%	0.627	S	S	*	*	H	α-helix	trans	-70	-38.5	175.4	-133.1	87.3	0	0	0	112	L5 L13	L5-L9 PolarHBondContact O-N 3.15Å; L5-L9 VanDerWaalsContact O-N 3.15Å; L9-L13 WeakPolarHBondContact O-CG 3.41Å; L9-L13 PolarHBondContact O-N 3.18Å; L9-L13 VanDerWaalsContact O-N 3.13Å
10	F	60.1	Low	55.7	Low	137 Å²	137	120 Å²	120	60%	0.601	63%	0.631	S	S	*	*	H	α-helix	trans	-69.8	-38.9	175.3	-101.7	-89.7	0	0	0	112.4	N6 L13 F14	N6-F10 PolarHBondContact O-N 3.15Å; N6-F10 VanDerWaalsContact O-N 3.09Å; F10-L13 PolarHBondContact O-N 2.93Å; F10-F14 HydrophobicContact CD1-CD2 4.35Å; F10-F14 HydrophobicContact CD1-CE2 4.06Å; F10-F14 HydrophobicContact CE1-CE2 4.48Å; F10-F14 WeakPolarHBondContact O-CD2 3.32Å; F10-F14 PolarHBondContact O-N 3.39Å; F10-F14 VanDerWaalsContact O-N 3.11Å
11	L	63.2	Low	54.9	Low	111 Å²	111	125 Å²	125	58%	0.581	64%	0.641	S	S	*	*	H	α-helix	trans	-71.3	-28.8	176.7	-70.3	169.4	0	0	0	112.8	I7 T15	I7-L11 HydrophobicContact CG2-CD1 3.98Å; I7-L11 WeakPolarHBondContact O-CB 3.21Å; I7-L11 VanDerWaalsContact O-CG 3.32Å; I7-L11 WeakPolarHBondContact O-CG 3.2Å; I7-L11 PolarHBondContact O-N 3.48Å; L11-T15 WeakPolarHBondContact O-CG2 3.46Å; L11-T15 PolarHBondContact O-N 3.18Å; L11-T15 PolarHBondContact O-OG1 3.2Å; L11-T15 VanDerWaalsContact O-OG1 3.08Å
12	C	57.3	Low	54.4	Low	67 Å²	67	122.9 Å²	122.9	45%	0.453	63%	0.628	S	S	.	*	H	α-helix	trans	-72.2	-36.7	171.2	-77	0	0	0	0	113	L8 T15 L16	L8-C12 WeakPolarHBondContact O-CB 3.44Å; L8-C12 PolarHBondContact O-N 2.99Å; L8-C12 PolarHBondContact O-SG 3.27Å; L8-C12 VanDerWaalsContact O-SG 3.42Å; C12-T15 PolarHBondContact O-N 3.03Å; C12-T15 PolarHBondContact O-OG1 3.1Å; C12-L16 WeakPolarHBondContact O-CB 3.49Å; C12-L16 WeakPolarHBondContact O-CD1 3.35Å; C12-L16 PolarHBondContact O-N 3.34Å; C12-L16 VanDerWaalsContact O-N 3.09Å
13	L	55.1	Low	53.3	Low	109 Å²	109	125.4 Å²	125.4	57%	0.571	63%	0.634	S	S	*	*	H	α-helix	trans	-71.8	-29.7	177.7	-75	163.8	0	0	0	112.6	L9 F10 S17	L9-L13 WeakPolarHBondContact O-CG 3.41Å; L9-L13 PolarHBondContact O-N 3.18Å; L9-L13 VanDerWaalsContact O-N 3.13Å; F10-L13 PolarHBondContact O-N 2.93Å; L13-S17 PolarHBondContact O-N 3.22Å
14	F	51.9	Low	52	Low	146 Å²	146	128.7 Å²	128.7	64%	0.64	65%	0.647	S	S	*	*	H	α-helix	trans	-78.1	-27.2	174.5	-91.2	-86.3	0	0	0	113.7	F10	F10-F14 HydrophobicContact CD1-CD2 4.35Å; F10-F14 HydrophobicContact CD1-CE2 4.06Å; F10-F14 HydrophobicContact CE1-CE2 4.48Å; F10-F14 WeakPolarHBondContact O-CD2 3.32Å; F10-F14 PolarHBondContact O-N 3.39Å; F10-F14 VanDerWaalsContact O-N 3.11Å
15	T	49	Very low	50.7	Low	92 Å²	92	127.1 Å²	127.1	56%	0.564	65%	0.652	S	S	*	*	H	α-helix	trans	-82.8	-29.6	174.7	53.5	0	0	0	0	112.9	L11 C12 S18	L11-T15 WeakPolarHBondContact O-CG2 3.46Å; L11-T15 PolarHBondContact O-N 3.18Å; L11-T15 PolarHBondContact O-OG1 3.2Å; L11-T15 VanDerWaalsContact O-OG1 3.08Å; C12-T15 PolarHBondContact O-N 3.03Å; C12-T15 PolarHBondContact O-OG1 3.1Å; T15-S18 PolarHBondContact O-N 3.1Å
16	L	46.7	Very low	49.2	Very low	108 Å²	108	126.9 Å²	126.9	57%	0.565	66%	0.656	S	S	*	*	H	α-helix	trans	-72.3	-25.6	171.7	-85.1	149.7	0	0	0	113.2	C12	C12-L16 WeakPolarHBondContact O-CB 3.49Å; C12-L16 WeakPolarHBondContact O-CD1 3.35Å; C12-L16 PolarHBondContact O-N 3.34Å; C12-L16 VanDerWaalsContact O-N 3.09Å
17	S	49.8	Very low	47.9	Very low	77 Å²	77	129.3 Å²	129.3	54%	0.538	67%	0.669	S	S	.	*	H	α-helix	trans	-76.3	-20.4	173.7	178.3	0	0	0	0	114.1	L13	L13-S17 PolarHBondContact O-N 3.22Å
18	S	46.4	Very low	46.3	Very low	96 Å²	96	132.8 Å²	132.8	67%	0.671	69%	0.687	S	S	*	*	H	α-helix	trans	-91.4	-17.8	179.5	-100.9	0	0	0	0	113.7	T15	T15-S18 PolarHBondContact O-N 3.1Å
19	Q	43.3	Very low	45	Very low	164 Å²	164	133.1 Å²	133.1	77%	0.766	70%	0.695	S	S	*	*	H	α-helix	trans	-99.2	-7.5	175.2	-68	-154.8	-20.3	0	0	114.5
20	L	40.6	Very low	43.4	Very low	135 Å²	135	134.2 Å²	134.2	71%	0.707	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	7.3	172.4	-100.5	137	0	0	0	114
21	R	40.3	Very low	42.3	Very low	226 Å²	226	134.6 Å²	134.6	85%	0.853	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	6.7	175	-89.8	-173.8	172.7	-156.4	-0.8	114.9
22	E	41.2	Very low	40.6	Very low	176 Å²	176	135.8 Å²	135.8	82%	0.822	72%	0.717	S	S	*	*	S	Bend	trans	-118.9	15	178.3	-71.8	-155.7	160.5	0	0	115.1
23	L	35.7	Very low	39.5	Very low	147 Å²	147	141.2 Å²	141.2	77%	0.77	74%	0.74	S	S	*	*	S	Bend	trans	-125.4	52.5	-178.1	-76.3	167.3	0	0	0	113.2
24	L	35	Very low	38.3	Very low	174 Å²	174	144.4 Å²	144.4	91%	0.911	75%	0.752	S	S	*	*	S	Bend	trans	-155.6	51.4	162.8	-82.6	-177	0	0	0	110.5
25	I	30.4	Very low	37.2	Very low	165 Å²	165	143.2 Å²	143.2	85%	0.846	76%	0.76	S	S	*	*			trans	-146.4	83.9	168	-51.6	178	0	0	0	108.3
26	T	31.9	Very low	36.3	Very low	122 Å²	122	146.3 Å²	146.3	75%	0.748	77%	0.773	S	S	*	*			trans	-146.9	123.1	162.8	50.2	0	0	0	0	110.1
27	D	31.1	Very low	35.5	Very low	148 Å²	148	146 Å²	146	79%	0.791	78%	0.78	S	S	*	*			trans	78.5	91.8	147.7	-51.5	-28.6	0	0	0	120.8
28	I	36.3	Very low	34.3	Very low	168 Å²	168	150.4 Å²	150.4	86%	0.862	80%	0.796	S	S	*	*			trans	-144.3	129.9	133.6	-56.5	-174.1	0	0	0	108.8
29	P	35	Very low	33.5	Very low	118 Å²	118	151 Å²	151	77%	0.766	80%	0.8	S	S	*	*			trans	-83.5	162.7	-170.5	34.1	-34.8	0	0	0	114.8
30	D	31.5	Very low	32.9	Very low	132 Å²	132	152.2 Å²	152.2	71%	0.706	81%	0.806	S	S	*	*			trans	-47	136.6	-179.9	-69.5	-60.7	0	0	0	115.8
31	D	35.9	Very low	32	Very low	145 Å²	145	151.1 Å²	151.1	78%	0.775	81%	0.81	S	S	*	*			trans	-153.6	109.7	137.5	-110.7	-33.7	0	0	0	112.3
32	N	29.3	Very low	31.6	Very low	137 Å²	137	146.3 Å²	146.3	73%	0.733	81%	0.808	S	S	*	*			trans	32	108.5	143.1	-66.5	-57.8	0	0	0	119.7
33	L	32.3	Very low	30.8	Very low	180 Å²	180	146.4 Å²	146.4	94%	0.942	81%	0.808	S	S	*	*			trans	-147.3	110	142	-132.7	79.4	0	0	0	110.8
34	Q	31.6	Very low	30.7	Very low	176 Å²	176	146 Å²	146	82%	0.822	81%	0.807	S	S	*	*			trans	-64	152.6	172.7	-111.7	167.1	-90.3	0	0	111.7
35	P	27.4	Very low	30.4	Very low	122 Å²	122	143.9 Å²	143.9	79%	0.792	80%	0.796	S	S	*	*			trans	-92.8	112.6	178.7	34.1	-25.1	0	0	0	110.3
36	D	31.2	Very low	30.2	Very low	156 Å²	156	143 Å²	143	83%	0.834	79%	0.793	S	S	*	*			trans	-86.8	127.8	170.5	-84.7	-21.6	0	0	0	112.2
37	S	30.3	Very low	30.2	Very low	102 Å²	102	145.6 Å²	145.6	71%	0.713	80%	0.801	S	S	*	*			trans	-69.3	158.2	-177.6	44.9	0	0	0	0	114.7
38	L	24.7	Very low	30.1	Very low	170 Å²	170	148.1 Å²	148.1	89%	0.89	81%	0.805	S	S	*	*			trans	-39.3	133.6	161.3	-76	80.3	0	0	0	113.3
39	S	29.4	Very low	29.5	Very low	108 Å²	108	148.9 Å²	148.9	76%	0.755	81%	0.805	S	S	*	*			trans	-168.4	121.2	131.2	50.1	0	0	0	0	112.6
40	Q	29.5	Very low	29.2	Very low	189 Å²	189	152 Å²	152	88%	0.883	81%	0.806	S	S	*	*			trans	35.1	122	134.8	-67.5	168	-16.3	0	0	120.7
41	S	22.6	Very low	28.9	Very low	113 Å²	113	153.8 Å²	153.8	79%	0.79	81%	0.81	S	S	*	*			trans	-51.6	156.4	157.5	54.2	0	0	0	0	113.7
42	P	30.9	Very low	28.5	Very low	124 Å²	124	153.3 Å²	153.3	81%	0.805	81%	0.808	S	S	*	*				-145.7	170.7	99.2	35.4	-17.6	0	0	0	116.2
43	E	25.7	Very low	28.3	Very low	179 Å²	179	151.3 Å²	151.3	84%	0.836	81%	0.81	S	S	*	*			trans	-54.7	145.1	-180	-58.2	163.1	138.3	0	0	115.6
44	N	31.8	Very low	28.1	Very low	139 Å²	139	150.8 Å²	150.8	74%	0.743	81%	0.806	S	S	*	*				179.6	119.4	123.7	-101.7	-31.4	0	0	0	114.3
45	N	29.3	Very low	27.8	Very low	129 Å²	129	149 Å²	149	69%	0.69	81%	0.807	S	S	*	*				54.2	124	126.8	-64	-20.1	0	0	0	123.6
46	N	25.9	Very low	27.8	Very low	146 Å²	146	147 Å²	147	78%	0.781	81%	0.808	S	S	*	*			trans	73.4	99.4	136.9	-66	-26.2	0	0	0	120
47	I	32.2	Very low	27.4	Very low	177 Å²	177	146.7 Å²	146.7	91%	0.908	81%	0.806	S	S	*	*			trans	-140.1	136	134.3	-59.6	-173.3	0	0	0	110.9
48	K	29.5	Very low	27.3	Very low	200 Å²	200	147.3 Å²	147.3	87%	0.87	81%	0.811	S	S	*	*			trans	-57.7	154	-169.6	-72.5	161	170	175.5	0	117.7
49	Q	24.4	Very low	27.2	Very low	184 Å²	184	144.8 Å²	144.8	86%	0.86	80%	0.802	S	S	*	*			trans	-47.4	146.5	160.8	-65.3	168.4	-21.1	0	0	114.2
50	K	27.5	Very low	27	Very low	183 Å²	183	148.8 Å²	148.8	80%	0.796	81%	0.807	S	S	*	*			trans	-150.7	111.6	139.3	-155.5	176.7	179.3	-166.2	0	110.5	D52	K50-D52 WeakPolarHBondContact CE-OD2 3.47Å; K50-D52 IonicContact NZ-OD2 3.75Å
51	H	25.8	Very low	27	Very low	170 Å²	170	146 Å²	146	79%	0.787	80%	0.802	S	S	*	*			trans	-75.6	140.2	161.3	-84.7	-91.7	0	0	0	108.6
52	D	27.4	Very low	27.1	Very low	136 Å²	136	148.3 Å²	148.3	73%	0.727	81%	0.806	S	S	*	*			trans	-145.2	125.1	152.6	-81.9	-45	0	0	0	108.4	K50	K50-D52 WeakPolarHBondContact CE-OD2 3.47Å; K50-D52 IonicContact NZ-OD2 3.75Å
53	A	23.9	Very low	27	Very low	94 Å²	94	145.4 Å²	145.4	78%	0.777	80%	0.799	S	S	*	*			trans	-89.6	142.2	176.3	0	0	0	0	0	109.8
54	I	28.1	Very low	27.1	Very low	169 Å²	169	144.7 Å²	144.7	87%	0.867	80%	0.8	S	S	*	*			trans	-130.1	115.1	164.8	-61.5	-179.7	0	0	0	108.6
55	V	25.2	Very low	27.1	Very low	140 Å²	140	145 Å²	145	85%	0.848	80%	0.802	S	S	*	*			trans	-83.8	135.4	165.9	171.2	0	0	0	0	107.7
56	G	29.2	Very low	27.1	Very low	78 Å²	78	147.4 Å²	147.4	80%	0.804	81%	0.806	S	S	*	*			trans	-153.5	105	173.6	0	0	0	0	0	110.7
57	D	21.2	Very low	27.5	Very low	150 Å²	150	147.9 Å²	147.9	80%	0.802	81%	0.808	S	S	*	*			trans	-89	133.4	179.5	-166.8	11.2	0	0	0	109.6
58	S	28.3	Very low	27.4	Very low	116 Å²	116	145.2 Å²	145.2	81%	0.811	80%	0.796	S	S	*	*			trans	-164.7	118.5	155.2	65.9	0	0	0	0	112.6
59	T	23.7	Very low	27.5	Very low	116 Å²	116	144.8 Å²	144.8	71%	0.712	80%	0.797	S	S	*	*			trans	-74	172.1	175.5	46.2	0	0	0	0	115.8
60	F	25.1	Very low	27.6	Very low	192 Å²	192	142.5 Å²	142.5	84%	0.842	79%	0.79	S	S	*	*			trans	83.8	132	161.4	-103.5	-106.5	0	0	0	115.7
61	V	30	Very low	27.6	Very low	130 Å²	130	140 Å²	140	79%	0.788	79%	0.791	S	S	*	*			cis	-156	143.4	49.4	179.6	0	0	0	0	110.8
62	N	24.5	Very low	27.6	Very low	162 Å²	162	140.5 Å²	140.5	87%	0.866	79%	0.793	S	S	*	*			trans	-83.5	150.2	170.4	-81.2	-39.3	0	0	0	112.4
63	G	27.3	Very low	27.5	Very low	64 Å²	64	140.6 Å²	140.6	66%	0.66	80%	0.798	S	S	*	*			trans	165.8	112.7	152.8	0	0	0	0	0	117.6
64	L	29.8	Very low	27.6	Very low	163 Å²	163	146.2 Å²	146.2	85%	0.853	80%	0.801	S	S	*	*			trans	81.6	136.2	145.5	-52.7	159.8	0	0	0	117.2
65	D	31.5	Very low	27.6	Very low	147 Å²	147	146 Å²	146	79%	0.786	80%	0.796	S	S	*	*			cis	-158.7	161.4	3	-137	-26.4	0	0	0	110.6
66	K	28.6	Very low	27.6	Very low	178 Å²	178	150.7 Å²	150.7	77%	0.774	80%	0.799	S	S	*	*			trans	-81.2	150.5	-175	-67.6	168.7	177.3	169	0	113
67	N	34.2	Very low	27.5	Very low	157 Å²	157	154.8 Å²	154.8	84%	0.84	80%	0.797	S	S	*	*			trans	170.7	94.1	134	-82	-23.7	0	0	0	109.8
68	N	29.6	Very low	27.9	Very low	121 Å²	121	152.3 Å²	152.3	65%	0.647	79%	0.787	S	S	*	*				77.5	98.7	86.3	-158.7	19.1	0	0	0	114.8
69	H	32.6	Very low	28.1	Very low	190 Å²	190	152.3 Å²	152.3	88%	0.88	78%	0.778	S	S	*	*			trans	-155.6	128.8	138.5	-109.1	27.1	0	0	0	112.6
70	N	25.3	Very low	28.5	Very low	137 Å²	137	150 Å²	150	73%	0.733	77%	0.766	S	S	*	*			trans	-66.4	136.8	-168	-67.3	-43.2	0	0	0	114.5
71	T	28	Very low	29	Very low	130 Å²	130	143 Å²	143	80%	0.798	74%	0.738	S	S	*	*			trans	-158.6	103.7	136.2	-9.3	0	0	0	0	111.7
72	E	26.9	Very low	29.5	Very low	180 Å²	180	139.2 Å²	139.2	84%	0.841	71%	0.713	S	S	*	*			trans	59.9	94.6	140.6	-64.2	-178.3	163.8	0	0	121	Y74	E72-Y74 PolarHBondContact O-N 3.32Å
73	V	24.9	Very low	30.2	Very low	138 Å²	138	141 Å²	141	84%	0.836	71%	0.707	S	S	*	*			trans	-21.8	115.1	139.5	-179.2	0	0	0	0	114.9
74	Y	24.9	Very low	30.7	Very low	213 Å²	213	143.1 Å²	143.1	84%	0.835	70%	0.699	S	S	*	*			trans	-155	111.4	143.8	-110.6	-81.7	0	0	0	110.3	E72	E72-Y74 PolarHBondContact O-N 3.32Å
75	H	28.7	Very low	31.1	Very low	165 Å²	165	136.9 Å²	136.9	76%	0.764	67%	0.666	S	S	*	*			trans	63.1	91.8	169.5	-71.5	-62	0	0	0	120.5
76	R	26.2	Very low	31.2	Very low	238 Å²	238	134.3 Å²	134.3	90%	0.898	65%	0.649	S	S	*	*			trans	-58.4	151.5	143.6	-82.3	177.8	175.2	173.6	-1.9	110.6
77	Q	25.9	Very low	31.5	Very low	164 Å²	164	129 Å²	129	77%	0.766	64%	0.639	S	S	*	*			trans	98	62.5	174.5	-61.5	174.8	-16.8	0	0	116.5
78	T	30.4	Very low	31.5	Very low	98 Å²	98	124.7 Å²	124.7	60%	0.601	62%	0.618	S	S	*	*			trans	-119.3	95.8	152	50.9	0	0	0	0	107.9	L82	T78-L82 VanDerWaalsContact CB-CD1 3.44Å; T78-L82 HydrophobicContact CG2-CD1 4.25Å; T78-L82 WeakPolarHBondContact OG1-CD1 3.41Å
79	N	31.1	Very low	31.7	Very low	116 Å²	116	125.4 Å²	125.4	62%	0.62	62%	0.616	S	S	*	*			trans	-63.9	145.2	-172.6	-86.6	-36.1	0	0	0	113.2	D81	N79-D81 VanDerWaalsContact C-N 3.27Å; N79-D81 PolarHBondContact O-N 3.2Å
80	S	32.4	Very low	31.5	Very low	66 Å²	66	121.4 Å²	121.4	46%	0.462	61%	0.609	S	S	.	*	S	Bend	trans	45.8	-48.3	164.1	56.9	0	0	0	0	120.5	L82 R83	S80-L82 VanDerWaalsContact C-N 3.32Å; S80-L82 PolarHBondContact O-N 3.49Å; S80-R83 WeakPolarHBondContact O-CB 3.49Å; S80-R83 PolarHBondContact O-N 3.42Å
81	D	35.6	Very low	31.7	Very low	45 Å²	45	120.6 Å²	120.6	24%	0.241	60%	0.601	C	S	.	*	T	Hydrogen-bonded Turn	trans	-78.3	-18.6	-169.6	-61.6	-13.8	0	0	0	112.6	N79 R83 R398	N79-D81 VanDerWaalsContact C-N 3.27Å; N79-D81 PolarHBondContact O-N 3.2Å; D81-R83 VanDerWaalsContact C-N 3.33Å; D81-R398 WeakPolarHBondContact OD2-CB 3.43Å
82	L	41	Very low	31.7	Very low	51 Å²	51	120 Å²	120	27%	0.267	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.7	-12	171.4	-92.1	145.8	0	0	0	113.7	T78 S80 F84 I85 E86	T78-L82 VanDerWaalsContact CB-CD1 3.44Å; T78-L82 HydrophobicContact CG2-CD1 4.25Å; T78-L82 WeakPolarHBondContact OG1-CD1 3.41Å; S80-L82 VanDerWaalsContact C-N 3.32Å; S80-L82 PolarHBondContact O-N 3.49Å; L82-F84 PolarHBondContact O-N 3.32Å; L82-I85 HydrophobicContact CD2-CB 4.06Å; L82-I85 HydrophobicContact CD2-CD1 3.88Å; L82-I85 HydrophobicContact CD2-CG2 4.15Å; L82-I85 HydrophobicContact CG-CD1 4.34Å; L82-I85 CarbonylContact O-C 3.54Å; L82-I85 WeakPolarHBondContact O-CA 3.5Å; L82-I85 PolarHBondContact O-N 3.32Å; L82-E86 WeakPolarHBondContact O-CG 3.3Å; L82-E86 PolarHBondContact O-N 3.01Å
83	R	38.8	Very low	31.9	Very low	200 Å²	200	115.4 Å²	115.4	76%	0.755	58%	0.582	S	S	*	*	H	α-helix	trans	-64	-30.5	175.6	-71.8	-169.4	179.3	-179.4	1.2	111.7	S80 D81 I85 E86 A87	S80-R83 WeakPolarHBondContact O-CB 3.49Å; S80-R83 PolarHBondContact O-N 3.42Å; D81-R83 VanDerWaalsContact C-N 3.33Å; R83-I85 VanDerWaalsContact C-N 3.29Å; R83-I85 PolarHBondContact O-N 3.28Å; R83-E86 PolarHBondContact O-N 3.47Å; R83-A87 PolarHBondContact O-N 2.94Å
84	F	38.3	Very low	32.2	Very low	108 Å²	108	116.5 Å²	116.5	47%	0.474	58%	0.583	S	S	.	*	H	α-helix	trans	-67.7	-29.2	172.3	-63.4	-78.7	0	0	0	112.9	L82	L82-F84 PolarHBondContact O-N 3.32Å
85	I	37.8	Very low	32.4	Very low	32 Å²	32	112.9 Å²	112.9	16%	0.164	57%	0.569	C	S	.	*	H	α-helix	trans	-83.6	-20.5	176.7	-61.2	174.1	0	0	0	111.5	L82 R83	L82-I85 HydrophobicContact CD2-CB 4.06Å; L82-I85 HydrophobicContact CD2-CD1 3.88Å; L82-I85 HydrophobicContact CD2-CG2 4.15Å; L82-I85 HydrophobicContact CG-CD1 4.34Å; L82-I85 CarbonylContact O-C 3.54Å; L82-I85 WeakPolarHBondContact O-CA 3.5Å; L82-I85 PolarHBondContact O-N 3.32Å; R83-I85 VanDerWaalsContact C-N 3.29Å; R83-I85 PolarHBondContact O-N 3.28Å
86	E	35.1	Very low	32.4	Very low	93 Å²	93	110 Å²	110	44%	0.435	57%	0.565	S	S	.	*	H	α-helix	trans	-99.2	-11.9	179.6	-66.6	-164.6	130.6	0	0	114.1	L82 R83 T88 K89	L82-E86 WeakPolarHBondContact O-CG 3.3Å; L82-E86 PolarHBondContact O-N 3.01Å; R83-E86 PolarHBondContact O-N 3.47Å; E86-T88 PolarHBondContact O-N 3.35Å; E86-T88 VanDerWaalsContact O-N 3.13Å; E86-K89 HydrophobicContact CB-CD 4.42Å; E86-K89 HydrophobicContact CG-CD 4.44Å; E86-K89 VanDerWaalsContact O-CB 3.27Å; E86-K89 WeakPolarHBondContact O-CB 3.35Å; E86-K89 PolarHBondContact O-N 3.47Å; E86-K89 IonicContact OE1-NZ 3.01Å; E86-K89 PolarHBondContact OE1-NZ 2.95Å
87	A	34.2	Very low	32.7	Very low	68 Å²	68	108.1 Å²	108.1	56%	0.562	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-62.9	-16.4	175.4	0	0	0	0	0	113.7	R83 K89 S90	R83-A87 PolarHBondContact O-N 2.94Å; A87-K89 VanDerWaalsContact C-N 3.3Å; A87-S90 PolarHBondContact O-OG 2.75Å
88	T	33.5	Very low	32.9	Very low	66 Å²	66	104.3 Å²	104.3	41%	0.405	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-82.4	0.9	169.6	59	0	0	0	0	114.2	E86 S90	E86-T88 PolarHBondContact O-N 3.35Å; E86-T88 VanDerWaalsContact O-N 3.13Å; T88-S90 VanDerWaalsContact C-N 3.34Å
89	K	33.7	Very low	32.9	Very low	136 Å²	136	107.1 Å²	107.1	59%	0.591	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-82.9	-0.4	175.4	-76	179.3	174.1	170.9	0	114.5	E86 A87 Q91	E86-K89 HydrophobicContact CB-CD 4.42Å; E86-K89 HydrophobicContact CG-CD 4.44Å; E86-K89 VanDerWaalsContact O-CB 3.27Å; E86-K89 WeakPolarHBondContact O-CB 3.35Å; E86-K89 PolarHBondContact O-N 3.47Å; E86-K89 IonicContact OE1-NZ 3.01Å; E86-K89 PolarHBondContact OE1-NZ 2.95Å; A87-K89 VanDerWaalsContact C-N 3.3Å; K89-Q91 VanDerWaalsContact C-N 3.34Å; K89-Q91 PolarHBondContact O-N 2.93Å
90	S	29.8	Very low	32.7	Very low	105 Å²	105	112.2 Å²	112.2	73%	0.734	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-85.7	5.5	-178.4	50.6	0	0	0	0	115.4	A87 T88	A87-S90 PolarHBondContact O-OG 2.75Å; T88-S90 VanDerWaalsContact C-N 3.34Å
91	Q	30	Very low	32.5	Very low	121 Å²	121	116.1 Å²	116.1	57%	0.565	59%	0.592	S	S	*	*			trans	-129.8	77.3	162.1	-73	-177.5	-0.7	0	0	109.8	K89 L93	K89-Q91 VanDerWaalsContact C-N 3.34Å; K89-Q91 PolarHBondContact O-N 2.93Å; Q91-L93 HydrophobicContact CB-CD1 4.01Å; Q91-L93 HydrophobicContact CB-CG 4.07Å; Q91-L93 HydrophobicContact CG-CD1 4.17Å; Q91-L93 HydrophobicContact CG-CG 4.46Å; Q91-L93 PolarHBondContact O-N 2.91Å
92	S	27.7	Very low	32.1	Very low	117 Å²	117	125.2 Å²	125.2	82%	0.818	63%	0.625	S	S	*	*			trans	-66.8	69.5	150.3	58	0	0	0	0	108.4	N94	S92-N94 PolarHBondContact O-N 2.94Å
93	L	30.7	Very low	31.4	Very low	83 Å²	83	131.8 Å²	131.8	44%	0.435	66%	0.656	S	S	.	*			trans	-79.5	99.2	168	-76.9	165.3	0	0	0	106.2	Q91 Y95	Q91-L93 HydrophobicContact CB-CD1 4.01Å; Q91-L93 HydrophobicContact CB-CG 4.07Å; Q91-L93 HydrophobicContact CG-CD1 4.17Å; Q91-L93 HydrophobicContact CG-CG 4.46Å; Q91-L93 PolarHBondContact O-N 2.91Å; L93-Y95 HydrophobicContact CB-CD2 4.25Å; L93-Y95 HydrophobicContact CB-CE2 4.04Å; L93-Y95 VanDerWaalsContact O-CD2 3.32Å; L93-Y95 WeakPolarHBondContact O-CD2 3.33Å; L93-Y95 PolarHBondContact O-N 3.26Å
94	N	29.9	Very low	31	Very low	161 Å²	161	128.2 Å²	128.2	86%	0.861	65%	0.652	S	S	*	*			trans	-53.6	95.9	151.6	-92.2	-25.3	0	0	0	106	S92 P96	S92-N94 PolarHBondContact O-N 2.94Å; N94-P96 WeakPolarHBondContact O-CD 3.5Å; N94-P96 VanDerWaalsContact O-N 3.17Å
95	Y	30.1	Very low	30.5	Very low	138 Å²	138	128.6 Å²	128.6	54%	0.541	67%	0.666	S	S	.	*			trans	-65.6	115.1	174.1	-81.8	-88.7	0	0	0	107.3	L93 Q97 N305	L93-Y95 HydrophobicContact CB-CD2 4.25Å; L93-Y95 HydrophobicContact CB-CE2 4.04Å; L93-Y95 VanDerWaalsContact O-CD2 3.32Å; L93-Y95 WeakPolarHBondContact O-CD2 3.33Å; L93-Y95 PolarHBondContact O-N 3.26Å; Y95-Q97 PolarHBondContact O-N 2.96Å; Y95-N305 PolarHBondContact OH-ND2 3.2Å; Y95-N305 VanDerWaalsContact OH-ND2 3.12Å
96	P	29.3	Very low	29.9	Very low	103 Å²	103	133.7 Å²	133.7	67%	0.669	69%	0.693	S	S	*	*			trans	-63.1	140	169.8	19.6	-16.5	0	0	0	107.6	N94 T98	N94-P96 WeakPolarHBondContact O-CD 3.5Å; N94-P96 VanDerWaalsContact O-N 3.17Å; P96-T98 VanDerWaalsContact C-N 3.34Å; P96-T98 PolarHBondContact O-N 3.41Å
97	Q	31	Very low	29.6	Very low	199 Å²	199	134.8 Å²	134.8	93%	0.93	70%	0.702	S	S	*	*			trans	-56.1	100.3	169.7	-68.9	-172.2	-23	0	0	107.8	Y95 N99	Y95-Q97 PolarHBondContact O-N 2.96Å; Q97-N99 PolarHBondContact O-N 2.78Å
98	T	31.4	Very low	29.3	Very low	84 Å²	84	138.1 Å²	138.1	52%	0.515	71%	0.71	S	S	.	*			trans	-73.6	122.9	177.4	51.3	0	0	0	0	108.2	P96 R286	P96-T98 VanDerWaalsContact C-N 3.34Å; P96-T98 PolarHBondContact O-N 3.41Å; T98-R286 VanDerWaalsContact CG2-NH1 3.34Å
99	N	29.1	Very low	28.9	Very low	158 Å²	158	140.9 Å²	140.9	85%	0.845	73%	0.727	S	S	*	*			trans	-43.8	137.1	-175.6	-117	-25.7	0	0	0	113.8	Q97	Q97-N99 PolarHBondContact O-N 2.78Å
100	R	27	Very low	28.6	Very low	223 Å²	223	140.8 Å²	140.8	84%	0.842	73%	0.733	S	S	*	*	S	Bend	trans	-48.5	149.4	160.6	-76	173.6	170.8	171.5	-4	109.5
101	N	28.6	Very low	28.4	Very low	148 Å²	148	142.5 Å²	142.5	79%	0.791	73%	0.734	S	S	*	*			trans	102.2	74.1	177.7	-49.5	-17.5	0	0	0	112.4
102	Y	27.3	Very low	28.3	Very low	236 Å²	236	146.1 Å²	146.1	93%	0.925	74%	0.743	S	S	*	*			trans	-164.6	90.9	137.2	-99.4	-73.2	0	0	0	107.7
103	M	25.7	Very low	28.3	Very low	188 Å²	188	148 Å²	148	93%	0.926	74%	0.744	S	S	*	*			trans	-73.1	119	162.7	-75.4	-80.1	-177.1	0	0	106.9
104	N	31.2	Very low	28.2	Very low	126 Å²	126	152 Å²	152	67%	0.674	76%	0.761	S	S	*	*			trans	-103.6	116.1	166.5	-168.3	-16	0	0	0	108.3	D106	N104-D106 VanDerWaalsContact C-N 3.3Å; N104-D106 PolarHBondContact O-N 3.13Å; N104-D106 PolarHBondContact OD1-N 2.97Å
105	P	27	Very low	28.2	Very low	116 Å²	116	152.8 Å²	152.8	75%	0.753	76%	0.759	S	S	*	*			trans	-74.5	-5	-176.8	-15.2	30.6	0	0	0	116.1	L107	P105-L107 PolarHBondContact O-N 3.4Å
106	D	26	Very low	28.2	Very low	138 Å²	138	157.9 Å²	157.9	74%	0.738	78%	0.777	S	S	*	*			trans	-104.2	48.6	-166.1	-64.5	-28.9	0	0	0	115.3	N104 N108	N104-D106 VanDerWaalsContact C-N 3.3Å; N104-D106 PolarHBondContact O-N 3.13Å; N104-D106 PolarHBondContact OD1-N 2.97Å; D106-N108 VanDerWaalsContact C-N 3.28Å; D106-N108 PolarHBondContact O-N 3.34Å
107	L	28.6	Very low	28.4	Very low	117 Å²	117	156.7 Å²	156.7	61%	0.613	77%	0.765	S	S	*	*			trans	-81.2	76.7	167.8	-84.3	162.8	0	0	0	110.5	P105 T109	P105-L107 PolarHBondContact O-N 3.4Å; L107-T109 PolarHBondContact O-N 3.31Å; L107-T109 VanDerWaalsContact O-N 3.11Å
108	N	27.1	Very low	28.7	Very low	138 Å²	138	148.6 Å²	148.6	74%	0.738	73%	0.728	S	S	*	*			trans	-76.1	92	171.3	-150.3	-3.3	0	0	0	109.4	D106 D110	D106-N108 VanDerWaalsContact C-N 3.28Å; D106-N108 PolarHBondContact O-N 3.34Å; N108-D110 VanDerWaalsContact C-N 3.29Å; N108-D110 PolarHBondContact O-N 2.8Å
109	T	26.6	Very low	29.2	Very low	123 Å²	123	151.6 Å²	151.6	76%	0.755	74%	0.736	S	S	*	*			trans	-86.7	55.9	177.7	46.3	0	0	0	0	112.4	L107	L107-T109 PolarHBondContact O-N 3.31Å; L107-T109 VanDerWaalsContact O-N 3.11Å
110	D	25.6	Very low	30	Very low	134 Å²	134	148.1 Å²	148.1	72%	0.717	72%	0.721	S	S	*	*			trans	-119.8	74.8	178	-74.8	-19.3	0	0	0	110.8	N108	N108-D110 VanDerWaalsContact C-N 3.29Å; N108-D110 PolarHBondContact O-N 2.8Å
111	N	27.1	Very low	30.9	Very low	141 Å²	141	141.4 Å²	141.4	75%	0.754	70%	0.699	S	S	*	*			trans	-160.3	46.5	160.8	-132	-20.3	0	0	0	115.2
112	Y	26.5	Very low	31.5	Very low	197 Å²	197	138.4 Å²	138.4	77%	0.773	68%	0.683	S	S	*	*			trans	-110.4	107.1	150	-91.2	-89.4	0	0	0	107	H114	Y112-H114 PolarHBondContact O-N 3.38Å
113	N	27.7	Very low	32.3	Very low	157 Å²	157	132.1 Å²	132.1	84%	0.84	66%	0.662	S	S	*	*			trans	-60.1	83.3	168.7	-84.9	-26.5	0	0	0	109.6	Q115	N113-Q115 PolarHBondContact O-N 2.83Å
114	H	29.7	Very low	33.6	Very low	168 Å²	168	129 Å²	129	78%	0.778	65%	0.645	S	S	*	*			trans	-67.1	108.1	157.2	-105.5	-68.7	0	0	0	106	Y112 R116	Y112-H114 PolarHBondContact O-N 3.38Å; H114-R116 PolarHBondContact O-N 3.05Å
115	Q	30.5	Very low	33.9	Very low	177 Å²	177	125.4 Å²	125.4	83%	0.827	63%	0.628	S	S	*	*			trans	-50.5	114.3	158.2	-76.8	176.5	-29.3	0	0	106.7	N113 L117	N113-Q115 PolarHBondContact O-N 2.83Å; Q115-L117 PolarHBondContact O-N 2.95Å
116	R	30.2	Very low	34.8	Very low	244 Å²	244	123.1 Å²	123.1	92%	0.921	61%	0.608	S	S	*	*			trans	-56.6	106.9	173.2	-82.9	-171.9	-167.6	-170.1	4.3	107.2	H114 N118	H114-R116 PolarHBondContact O-N 3.05Å; R116-N118 PolarHBondContact O-N 2.71Å
117	L	32.6	Very low	36	Very low	79 Å²	79	122.2 Å²	122.2	41%	0.414	60%	0.6	S	S	.	*			trans	-57.5	137	162	-80.8	94.1	0	0	0	107.7	Q115 Q121 L122 T125	Q115-L117 PolarHBondContact O-N 2.95Å; L117-Q121 HydrophobicContact CB-CB 4.1Å; L117-Q121 HydrophobicContact CD2-CB 4.02Å; L117-Q121 HydrophobicContact CG-CB 4.43Å; L117-L122 HydrophobicContact CB-CB 4.4Å; L117-T125 HydrophobicContact CD2-CG2 4.47Å; L117-T125 WeakPolarHBondContact CD2-OG1 3.35Å
118	N	37.8	Very low	36.5	Very low	29 Å²	29	121.3 Å²	121.3	16%	0.155	60%	0.596	C	S	.	*			trans	-54.1	152	170.6	-82.5	-5.4	0	0	0	110.8	R116 T120 Q121 L122 R518	R116-N118 PolarHBondContact O-N 2.71Å; N118-T120 PolarHBondContact O-N 3.48Å; N118-T120 VanDerWaalsContact O-N 3.11Å; N118-Q121 HydrophobicContact CB-CB 4.09Å; N118-Q121 HydrophobicContact CB-CG 4.06Å; N118-Q121 CarbonylContact O-C 3.42Å; N118-Q121 WeakPolarHBondContact O-CA 3.47Å; N118-Q121 WeakPolarHBondContact O-CB 3.16Å; N118-Q121 PolarHBondContact O-N 2.8Å; N118-L122 WeakPolarHBondContact O-CB 3.47Å; N118-L122 PolarHBondContact O-N 2.96Å; N118-R518 WeakPolarHBondContact ND2-CD 3.31Å; N118-R518 PolarHBondContact ND2-NE 3.36Å; N118-R518 PolarHBondContact OD1-NE 2.97Å; N118-R518 VanDerWaalsContact OD1-NE 3.1Å; N118-R518 PolarHBondContact OD1-NH1 3Å; N118-R518 PolarHBondContact OD1-NH2 3.15Å
119	Q	42	Very low	37	Very low	147 Å²	147	119.2 Å²	119.2	69%	0.687	58%	0.582	S	S	*	*	H	α-helix	trans	-53.2	-36.4	176.2	-162.5	163.4	1.3	0	0	112.7	L122 E123	Q119-L122 PolarHBondContact O-N 2.88Å; Q119-E123 VanDerWaalsContact O-CB 3.32Å; Q119-E123 WeakPolarHBondContact O-CB 3.44Å; Q119-E123 WeakPolarHBondContact O-CG 3.31Å; Q119-E123 PolarHBondContact O-N 3.41Å
120	T	45.7	Very low	37.7	Very low	85 Å²	85	117.8 Å²	117.8	52%	0.521	57%	0.57	S	S	.	*	H	α-helix	trans	-72.4	-32.8	172.3	46.6	0	0	0	0	114.2	N118 Q124	N118-T120 PolarHBondContact O-N 3.48Å; N118-T120 VanDerWaalsContact O-N 3.11Å; T120-Q124 VanDerWaalsContact O-CB 3.31Å; T120-Q124 WeakPolarHBondContact O-CB 2.97Å; T120-Q124 VanDerWaalsContact O-CG 3.25Å; T120-Q124 WeakPolarHBondContact O-CG 3.24Å; T120-Q124 PolarHBondContact O-N 3.19Å
121	Q	45.5	Very low	38.3	Very low	81 Å²	81	117.3 Å²	117.3	38%	0.379	57%	0.567	S	S	.	*	H	α-helix	trans	-76.9	-30.3	173.6	-72.2	175.3	-25.2	0	0	111.4	L117 N118 T125	L117-Q121 HydrophobicContact CB-CB 4.1Å; L117-Q121 HydrophobicContact CD2-CB 4.02Å; L117-Q121 HydrophobicContact CG-CB 4.43Å; N118-Q121 HydrophobicContact CB-CB 4.09Å; N118-Q121 HydrophobicContact CB-CG 4.06Å; N118-Q121 CarbonylContact O-C 3.42Å; N118-Q121 WeakPolarHBondContact O-CA 3.47Å; N118-Q121 WeakPolarHBondContact O-CB 3.16Å; N118-Q121 PolarHBondContact O-N 2.8Å; Q121-T125 WeakPolarHBondContact O-CB 3.39Å; Q121-T125 PolarHBondContact O-N 3.43Å; Q121-T125 PolarHBondContact O-OG1 3.4Å
122	L	40.4	Very low	38.9	Very low	86 Å²	86	116.8 Å²	116.8	45%	0.45	57%	0.565	S	S	.	*	H	α-helix	trans	-71.1	-42.8	172.7	-179	65.6	0	0	0	109.5	L117 N118 Q119 T125 I126	L117-L122 HydrophobicContact CB-CB 4.4Å; N118-L122 WeakPolarHBondContact O-CB 3.47Å; N118-L122 PolarHBondContact O-N 2.96Å; Q119-L122 PolarHBondContact O-N 2.88Å; L122-T125 PolarHBondContact O-N 2.87Å; L122-I126 HydrophobicContact CD1-CD1 4.13Å; L122-I126 HydrophobicContact CD1-CG1 4.44Å; L122-I126 HydrophobicContact CG-CD1 3.83Å; L122-I126 VanDerWaalsContact O-CB 3.23Å; L122-I126 WeakPolarHBondContact O-CB 3.46Å; L122-I126 WeakPolarHBondContact O-CD1 3.42Å; L122-I126 WeakPolarHBondContact O-CG1 3.42Å; L122-I126 PolarHBondContact O-N 3.13Å
123	E	45.4	Very low	39.3	Very low	103 Å²	103	110.1 Å²	110.1	48%	0.481	54%	0.543	S	S	.	.	H	α-helix	trans	-63	-44.4	171.3	-77.1	164.8	-173.6	0	0	111.2	Q119 I126 Q127	Q119-E123 VanDerWaalsContact O-CB 3.32Å; Q119-E123 WeakPolarHBondContact O-CB 3.44Å; Q119-E123 WeakPolarHBondContact O-CG 3.31Å; Q119-E123 PolarHBondContact O-N 3.41Å; E123-I126 PolarHBondContact O-N 3.44Å; E123-Q127 WeakPolarHBondContact O-CB 3.46Å; E123-Q127 PolarHBondContact O-N 3.43Å
124	Q	52.5	Low	39.6	Very low	122 Å²	122	110 Å²	110	57%	0.57	54%	0.542	S	S	*	.	H	α-helix	trans	-64.8	-38.3	173	-78.4	173.7	-20.2	0	0	112.7	T120 Q127 D128	T120-Q124 VanDerWaalsContact O-CB 3.31Å; T120-Q124 WeakPolarHBondContact O-CB 2.97Å; T120-Q124 VanDerWaalsContact O-CG 3.25Å; T120-Q124 WeakPolarHBondContact O-CG 3.24Å; T120-Q124 PolarHBondContact O-N 3.19Å; Q124-Q127 PolarHBondContact O-N 2.9Å; Q124-D128 VanDerWaalsContact O-CB 3.23Å; Q124-D128 WeakPolarHBondContact O-CB 3.34Å; Q124-D128 PolarHBondContact O-N 2.56Å
125	T	36.9	Very low	40.1	Very low	52 Å²	52	108.8 Å²	108.8	32%	0.319	54%	0.541	S	S	.	.	H	α-helix	trans	-70.6	-34.7	175.8	-54.4	0	0	0	0	110.8	L117 Q121 L122 M129	L117-T125 HydrophobicContact CD2-CG2 4.47Å; L117-T125 WeakPolarHBondContact CD2-OG1 3.35Å; Q121-T125 WeakPolarHBondContact O-CB 3.39Å; Q121-T125 PolarHBondContact O-N 3.43Å; Q121-T125 PolarHBondContact O-OG1 3.4Å; L122-T125 PolarHBondContact O-N 2.87Å; T125-M129 HydrophobicContact CG2-CE 4.39Å; T125-M129 HydrophobicContact CG2-CG 4.42Å; T125-M129 HydrophobicContact CG2-SD 4.42Å; T125-M129 WeakPolarHBondContact O-CB 3.32Å; T125-M129 WeakPolarHBondContact O-CG 3.24Å; T125-M129 PolarHBondContact O-N 3.37Å
126	I	46.8	Very low	40.2	Very low	68 Å²	68	106.4 Å²	106.4	35%	0.349	53%	0.531	S	S	.	.	H	α-helix	trans	-68.7	-39	173	-72	164.8	0	0	0	110.1	L122 E123 M129 N130	L122-I126 HydrophobicContact CD1-CD1 4.13Å; L122-I126 HydrophobicContact CD1-CG1 4.44Å; L122-I126 HydrophobicContact CG-CD1 3.83Å; L122-I126 VanDerWaalsContact O-CB 3.23Å; L122-I126 WeakPolarHBondContact O-CB 3.46Å; L122-I126 WeakPolarHBondContact O-CD1 3.42Å; L122-I126 WeakPolarHBondContact O-CG1 3.42Å; L122-I126 PolarHBondContact O-N 3.13Å; E123-I126 PolarHBondContact O-N 3.44Å; I126-M129 HydrophobicContact CB-CE 4.47Å; I126-M129 HydrophobicContact CG1-CE 3.95Å; I126-M129 PolarHBondContact O-N 3.07Å; I126-N130 VanDerWaalsContact O-CB 3.27Å; I126-N130 WeakPolarHBondContact O-CB 3.38Å; I126-N130 PolarHBondContact O-N 3.38Å; I126-N130 PolarHBondContact O-ND2 3.04Å; I126-N130 VanDerWaalsContact O-ND2 3.16Å
127	Q	50.1	Low	40.5	Very low	118 Å²	118	100 Å²	100	55%	0.551	51%	0.514	S	S	*	.	H	α-helix	trans	-66.7	-47	174.3	-143.3	91.4	4.1	0	0	111.1	E123 Q124 M129 N130 D131	E123-Q127 WeakPolarHBondContact O-CB 3.46Å; E123-Q127 PolarHBondContact O-N 3.43Å; Q124-Q127 PolarHBondContact O-N 2.9Å; Q127-M129 VanDerWaalsContact C-N 3.29Å; Q127-M129 PolarHBondContact O-N 3.21Å; Q127-N130 CarbonylContact O-C 3.53Å; Q127-N130 WeakPolarHBondContact O-CA 3.49Å; Q127-N130 PolarHBondContact O-N 2.94Å; Q127-D131 PolarHBondContact O-N 2.86Å
128	D	40.4	Very low	40.6	Very low	99 Å²	99	99.1 Å²	99.1	53%	0.529	51%	0.511	S	S	.	.	H	α-helix	trans	-67.2	-28.9	177.3	-70.2	-19.3	0	0	0	112	Q124 N132	Q124-D128 VanDerWaalsContact O-CB 3.23Å; Q124-D128 WeakPolarHBondContact O-CB 3.34Å; Q124-D128 PolarHBondContact O-N 2.56Å; D128-N132 PolarHBondContact O-N 3.11Å; D128-N132 PolarHBondContact O-ND2 3.29Å
129	M	36.6	Very low	40.7	Very low	94 Å²	94	103.7 Å²	103.7	46%	0.463	54%	0.54	S	S	.	.	H	α-helix	trans	-73.8	-34.8	169	-77.4	-172.8	-49	0	0	111.6	T125 I126 Q127 N133	T125-M129 HydrophobicContact CG2-CE 4.39Å; T125-M129 HydrophobicContact CG2-CG 4.42Å; T125-M129 HydrophobicContact CG2-SD 4.42Å; T125-M129 WeakPolarHBondContact O-CB 3.32Å; T125-M129 WeakPolarHBondContact O-CG 3.24Å; T125-M129 PolarHBondContact O-N 3.37Å; I126-M129 HydrophobicContact CB-CE 4.47Å; I126-M129 HydrophobicContact CG1-CE 3.95Å; I126-M129 PolarHBondContact O-N 3.07Å; Q127-M129 VanDerWaalsContact C-N 3.29Å; Q127-M129 PolarHBondContact O-N 3.21Å; M129-N133 WeakPolarHBondContact O-CB 3.27Å; M129-N133 PolarHBondContact O-N 3.32Å; M129-N133 PolarHBondContact O-ND2 3.4Å; M129-N133 VanDerWaalsContact O-ND2 3.16Å; M129-N133 PolarHBondContact O-OD1 3.29Å
130	N	41.2	Very low	40.7	Very low	92 Å²	92	104.6 Å²	104.6	49%	0.492	54%	0.544	S	S	.	.	H	α-helix	trans	-75.6	-30.6	177.6	-73.9	-22.3	0	0	0	113.1	I126 Q127 N132 N133	I126-N130 VanDerWaalsContact O-CB 3.27Å; I126-N130 WeakPolarHBondContact O-CB 3.38Å; I126-N130 PolarHBondContact O-N 3.38Å; I126-N130 PolarHBondContact O-ND2 3.04Å; I126-N130 VanDerWaalsContact O-ND2 3.16Å; Q127-N130 CarbonylContact O-C 3.53Å; Q127-N130 WeakPolarHBondContact O-CA 3.49Å; Q127-N130 PolarHBondContact O-N 2.94Å; N130-N132 VanDerWaalsContact C-N 3.35Å; N130-N133 PolarHBondContact OD1-ND2 3.18Å
131	D	39.1	Very low	40.8	Very low	124 Å²	124	104.1 Å²	104.1	66%	0.663	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-10.4	178	-70.6	-24	0	0	0	113.1	Q127	Q127-D131 PolarHBondContact O-N 2.86Å
132	N	39.7	Very low	40.7	Very low	131 Å²	131	102.4 Å²	102.4	70%	0.701	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	10.4	172.7	-72.6	-63.1	0	0	0	113.5	D128 N130 D134	D128-N132 PolarHBondContact O-N 3.11Å; D128-N132 PolarHBondContact O-ND2 3.29Å; N130-N132 VanDerWaalsContact C-N 3.35Å; N132-D134 VanDerWaalsContact C-N 3.29Å; N132-D134 PolarHBondContact O-N 3.46Å
133	N	35	Very low	41	Very low	57 Å²	57	102.4 Å²	102.4	31%	0.305	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-80.3	5.3	-172.7	-100.6	-19.8	0	0	0	115.6	M129 N130 N135	M129-N133 WeakPolarHBondContact O-CB 3.27Å; M129-N133 PolarHBondContact O-N 3.32Å; M129-N133 PolarHBondContact O-ND2 3.4Å; M129-N133 VanDerWaalsContact O-ND2 3.16Å; M129-N133 PolarHBondContact O-OD1 3.29Å; N130-N133 PolarHBondContact OD1-ND2 3.18Å; N133-N135 PolarHBondContact O-N 3.04Å
134	D	34.7	Very low	41.6	Very low	154 Å²	154	97.7 Å²	97.7	82%	0.824	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-73.1	2.4	179.1	-78.4	-17.7	0	0	0	114.6	N132	N132-D134 VanDerWaalsContact C-N 3.29Å; N132-D134 PolarHBondContact O-N 3.46Å
135	N	38.8	Very low	41.8	Very low	142 Å²	142	98.5 Å²	98.5	76%	0.759	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-145.7	15	178.6	-76.2	-65.7	0	0	0	116.5	N133	N133-N135 PolarHBondContact O-N 3.04Å
136	M	32.4	Very low	43	Very low	127 Å²	127	100.8 Å²	100.8	63%	0.626	54%	0.542	S	S	*	.			trans	-100.3	114.9	173	-164.9	150	73.6	0	0	109.6	T138	M136-T138 PolarHBondContact O-N 3.06Å
137	M	36.2	Very low	43.2	Very low	111 Å²	111	100.5 Å²	100.5	55%	0.547	56%	0.556	S	S	.	*			trans	-63.4	94.5	174.6	-94.8	-172.8	-163.4	0	0	109.7	F142 H156	M137-F142 HydrophobicContact SD-CZ 4.37Å; M137-H156 WeakPolarHBondContact CE-NE2 3.49Å
138	T	35.6	Very low	43.1	Very low	60 Å²	60	101.8 Å²	101.8	37%	0.368	56%	0.56	S	S	.	*			trans	-72	149.3	166.8	58.1	0	0	0	0	109.4	M136 E140 T141	M136-T138 PolarHBondContact O-N 3.06Å; T138-E140 PolarHBondContact O-N 2.83Å; T138-T141 PolarHBondContact O-N 3.38Å; T138-T141 PolarHBondContact O-OG1 2.82Å
139	T	39.7	Very low	43.3	Very low	124 Å²	124	102.5 Å²	102.5	76%	0.761	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-56	-13.1	177.9	36	0	0	0	0	114.2	T141	T139-T141 VanDerWaalsContact C-N 3.31Å; T139-T141 PolarHBondContact O-N 2.94Å
140	E	43.1	Very low	44	Very low	166 Å²	166	104 Å²	104	78%	0.776	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-76.7	-14	179.9	-59.5	-174.3	164.6	0	0	113.6	T138 F142	T138-E140 PolarHBondContact O-N 2.83Å; E140-F142 PolarHBondContact O-N 3.5Å
141	T	45.9	Very low	44.8	Very low	76 Å²	76	103.6 Å²	103.6	47%	0.466	57%	0.565	S	S	.	*	G	3₁₀ helix	trans	-80.1	0.8	178.2	52.5	0	0	0	0	114.5	T138 T139	T138-T141 PolarHBondContact O-N 3.38Å; T138-T141 PolarHBondContact O-OG1 2.82Å; T139-T141 VanDerWaalsContact C-N 3.31Å; T139-T141 PolarHBondContact O-N 2.94Å
142	F	43.8	Very low	46.2	Very low	44 Å²	44	99 Å²	99	19%	0.193	54%	0.543	C	S	.	.	G	3₁₀ helix	trans	-103.3	-8.2	-170.4	-71.6	-76.8	0	0	0	114.8	M137 E140 L149 Q150 M151	M137-F142 HydrophobicContact SD-CZ 4.37Å; E140-F142 PolarHBondContact O-N 3.5Å; F142-L149 HydrophobicContact CB-CD1 4.37Å; F142-L149 HydrophobicContact CB-CG 4.43Å; F142-L149 CarbonylContact O-C 3.28Å; F142-L149 VanDerWaalsContact O-C 3.28Å; F142-L149 WeakPolarHBondContact O-CA 3.1Å; F142-L149 WeakPolarHBondContact O-CG 3.45Å; F142-Q150 PolarHBondContact O-N 2.72Å; F142-M151 HydrophobicContact CD1-CB 4.47Å; F142-M151 WeakPolarHBondContact CD1-O 3.41Å
143	V	47.7	Very low	48.1	Very low	86 Å²	86	95.1 Å²	95.1	52%	0.521	52%	0.521	S	S	.	.	B	Isolated β-bridge	trans	-118.4	115.7	-177.5	-174.4	0	0	0	0	109.5	L149	V143-L149 HydrophobicContact CG2-CD1 4.34Å
144	G	57.1	Low	50.5	Low	5 Å²	5	92.4 Å²	92.4	5%	0.052	51%	0.507	C	S	.	.			trans	-70.9	164.8	175.9	0	0	0	0	0	112.6	D146 G147 K148	G144-D146 PolarHBondContact O-N 3.04Å; G144-G147 PolarHBondContact O-N 2.8Å; G144-K148 PolarHBondContact N-O 2.99Å
145	P	56.3	Low	52.6	Low	139 Å²	139	87.5 Å²	87.5	90%	0.903	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-10.2	176.3	23.7	-31.8	0	0	0	113.8
146	D	64	Low	54	Low	100 Å²	100	83.3 Å²	83.3	54%	0.535	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	3.8	173.1	64.9	-19	0	0	0	113.6	G144 K148	G144-D146 PolarHBondContact O-N 3.04Å; D146-K148 PolarHBondContact O-N 2.72Å; D146-K148 PolarHBondContact OD1-N 2.82Å; D146-K148 VanDerWaalsContact OD1-N 3.13Å; D146-K148 WeakPolarHBondContact OD2-CB 3.43Å; D146-K148 VanDerWaalsContact OD2-CD 3.31Å; D146-K148 WeakPolarHBondContact OD2-CD 3.43Å; D146-K148 WeakPolarHBondContact OD2-CG 3.28Å
147	G	50.2	Low	55.1	Low	62 Å²	62	80.6 Å²	80.6	64%	0.639	45%	0.448	S	S	*	.	S	Bend	trans	72	6.5	-175.3	0	0	0	0	0	114	G144	G144-G147 PolarHBondContact O-N 2.8Å
148	K	47.1	Very low	56.3	Low	145 Å²	145	78.3 Å²	78.3	63%	0.63	44%	0.438	S	S	*	.	S	Bend	trans	-92.2	146.6	176.6	-63.2	-174.4	-172.3	162.5	0	110.5	G144 D146 Q150	G144-K148 PolarHBondContact N-O 2.99Å; D146-K148 PolarHBondContact O-N 2.72Å; D146-K148 PolarHBondContact OD1-N 2.82Å; D146-K148 VanDerWaalsContact OD1-N 3.13Å; D146-K148 WeakPolarHBondContact OD2-CB 3.43Å; D146-K148 VanDerWaalsContact OD2-CD 3.31Å; D146-K148 WeakPolarHBondContact OD2-CD 3.43Å; D146-K148 WeakPolarHBondContact OD2-CG 3.28Å; K148-Q150 PolarHBondContact O-N 2.85Å
149	L	44.7	Very low	57.6	Low	114 Å²	114	77.2 Å²	77.2	60%	0.597	44%	0.439	S	S	*	.	B	Isolated β-bridge	trans	-64.8	109.7	175.7	-144.1	84.4	0	0	0	109.2	F142 V143 M151	F142-L149 HydrophobicContact CB-CD1 4.37Å; F142-L149 HydrophobicContact CB-CG 4.43Å; F142-L149 CarbonylContact O-C 3.28Å; F142-L149 VanDerWaalsContact O-C 3.28Å; F142-L149 WeakPolarHBondContact O-CA 3.1Å; F142-L149 WeakPolarHBondContact O-CG 3.45Å; V143-L149 HydrophobicContact CG2-CD1 4.34Å; L149-M151 WeakPolarHBondContact CD2-O 3.41Å; L149-M151 PolarHBondContact O-N 3.08Å
150	Q	52.4	Low	59.7	Low	125 Å²	125	73.9 Å²	73.9	58%	0.584	41%	0.414	S	S	*	.	S	Bend	trans	-66	-20.7	-174.3	-109.3	-176.6	1.8	0	0	113.3	F142 K148	F142-Q150 PolarHBondContact O-N 2.72Å; K148-Q150 PolarHBondContact O-N 2.85Å
151	M	57.9	Low	61.7	Low	83 Å²	83	68.7 Å²	68.7	41%	0.409	39%	0.391	S	S	.	.	S	Bend	trans	-157.9	142.1	168.8	-159.9	74.6	66.8	0	0	107.4	F142 L149 D155	F142-M151 HydrophobicContact CD1-CB 4.47Å; F142-M151 WeakPolarHBondContact CD1-O 3.41Å; L149-M151 WeakPolarHBondContact CD2-O 3.41Å; L149-M151 PolarHBondContact O-N 3.08Å; M151-D155 HydrophobicContact CG-CB 4.13Å; M151-D155 HydrophobicContact SD-CB 3.95Å; M151-D155 VanDerWaalsContact SD-O 3.39Å
152	S	69	Low	63.7	Low	29 Å²	29	76.1 Å²	76.1	20%	0.203	41%	0.411	C	S	.	.			trans	-77.5	150.7	163.9	78.5	0	0	0	0	109	C154 D155	S152-C154 PolarHBondContact O-N 2.73Å; S152-C154 WeakPolarHBondContact OG-CB 3.48Å; S152-C154 PolarHBondContact OG-N 2.9Å; S152-D155 PolarHBondContact O-N 3.02Å; S152-D155 PolarHBondContact OG-N 3.29Å; S152-D155 PolarHBondContact OG-OD2 3.41Å
153	I	78.3	Confident	65.8	Low	48 Å²	48	80.6 Å²	80.6	25%	0.246	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-48.1	-28.9	166.9	-173.7	165.6	0	0	0	111.8	F160 L172 M175 I179	I153-F160 WeakPolarHBondContact O-CE2 3.17Å; I153-L172 HydrophobicContact CG2-CD1 3.51Å; I153-M175 HydrophobicContact CD1-CB 3.79Å; I153-M175 HydrophobicContact CG2-CB 4.45Å; I153-I179 HydrophobicContact CD1-CD1 3.37Å; I153-I179 HydrophobicContact CD1-CG1 4.45Å; I153-I179 HydrophobicContact CG1-CD1 4.09Å
154	C	84.9	Confident	67.9	Low	1 Å²	1	77.6 Å²	77.6	1%	0.007	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-78.1	-17.6	177.9	-53.7	0	0	0	0	114.8	S152 K165 C168 R169	S152-C154 PolarHBondContact O-N 2.73Å; S152-C154 WeakPolarHBondContact OG-CB 3.48Å; S152-C154 PolarHBondContact OG-N 2.9Å; C154-K165 WeakPolarHBondContact O-CE 3.34Å; C154-K165 WeakPolarHBondContact O-CG 3.32Å; C154-C168 WeakPolarHBondContact CA-SG 3.38Å; C154-C168 HydrophobicContact CB-CB 3.77Å; C154-C168 WeakPolarHBondContact CB-SG 3.4Å; C154-C168 WeakPolarHBondContact SG-CB 3.25Å; C154-C168 CovalentContact SG-SG 2.03Å; C154-C168 PolarHBondContact SG-SG 3.41Å; C154-R169 HydrophobicContact CB-CG 4.29Å
155	D	79.2	Confident	69.5	Low	51 Å²	51	80 Å²	80	27%	0.273	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-106.8	11.4	-176.7	-68.2	-52.3	0	0	0	113.9	M151 S152 K165 R169	M151-D155 HydrophobicContact CG-CB 4.13Å; M151-D155 HydrophobicContact SD-CB 3.95Å; M151-D155 VanDerWaalsContact SD-O 3.39Å; S152-D155 PolarHBondContact O-N 3.02Å; S152-D155 PolarHBondContact OG-N 3.29Å; S152-D155 PolarHBondContact OG-OD2 3.41Å; D155-K165 IonicContact OD1-NZ 3.35Å; D155-K165 PolarHBondContact OD1-NZ 2.92Å; D155-R169 IonicContact OD1-NH2 2.78Å; D155-R169 PolarHBondContact OD1-NH2 3.13Å; D155-R169 IonicContact OD2-NH2 3.85Å
156	H	69.3	Low	71.1	Confident	53 Å²	53	80.6 Å²	80.6	25%	0.245	40%	0.404	C	S	.	.			trans	-40.7	138.9	177.8	-172.2	-70.1	0	0	0	113.8	M137 N158 G159	M137-H156 WeakPolarHBondContact CE-NE2 3.49Å; H156-N158 PolarHBondContact ND1-N 3.4Å; H156-N158 VanDerWaalsContact ND1-N 3.2Å; H156-N158 PolarHBondContact O-N 3.35Å; H156-G159 WeakPolarHBondContact O-CA 3.16Å; H156-G159 PolarHBondContact O-N 2.86Å
157	P	55.4	Low	72.4	Confident	70 Å²	70	76.4 Å²	76.4	46%	0.455	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-34.2	-171.2	19.4	-32.8	0	0	0	115.6	G159	P157-G159 PolarHBondContact O-N 3.15Å
158	N	61.7	Low	74.3	Confident	64 Å²	64	73.4 Å²	73.4	34%	0.342	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-3.5	171	-68.4	-20.9	0	0	0	114	H156 I240	H156-N158 PolarHBondContact ND1-N 3.4Å; H156-N158 VanDerWaalsContact ND1-N 3.2Å; H156-N158 PolarHBondContact O-N 3.35Å; N158-I240 WeakPolarHBondContact OD1-CB 3.38Å
159	G	62.8	Low	76.4	Confident	37 Å²	37	74 Å²	74	38%	0.381	35%	0.349	S	S	.	.			trans	69.1	95.9	157.2	0	0	0	0	0	114.8	H156 P157 L161	H156-G159 WeakPolarHBondContact O-CA 3.16Å; H156-G159 PolarHBondContact O-N 2.86Å; P157-G159 PolarHBondContact O-N 3.15Å; G159-L161 PolarHBondContact O-N 3.18Å
160	F	82.2	Confident	78.5	Confident	54 Å²	54	73.6 Å²	73.6	24%	0.237	34%	0.344	C	S	.	.			trans	-53	137	157	-72.3	-25.7	0	0	0	110	I153 Q164 K165 C168 F316	I153-F160 WeakPolarHBondContact O-CE2 3.17Å; F160-Q164 HydrophobicContact CB-CB 3.81Å; F160-Q164 HydrophobicContact CD1-CB 4.48Å; F160-Q164 HydrophobicContact CG-CB 4.18Å; F160-K165 HydrophobicContact CB-CG 3.68Å; F160-K165 VanDerWaalsContact O-CE 3.29Å; F160-K165 WeakPolarHBondContact O-CE 3.43Å; F160-K165 WeakPolarHBondContact O-CG 3.46Å; F160-C168 HydrophobicContact CD2-CB 4.2Å; F160-C168 HydrophobicContact CE2-CB 4.3Å; F160-F316 HydrophobicContact CD1-CZ 4.15Å; F160-F316 HydrophobicContact CD2-CZ 4.44Å; F160-F316 HydrophobicContact CE1-CE1 4.18Å; F160-F316 AromaticContact CE1-CZ 3.71Å; F160-F316 HydrophobicContact CE1-CZ 3.71Å; F160-F316 HydrophobicContact CE2-CZ 4.04Å; F160-F316 HydrophobicContact CZ-CE1 4.39Å; F160-F316 AromaticContact CZ-CZ 3.67Å; F160-F316 HydrophobicContact CZ-CZ 3.67Å
161	L	86.8	Confident	80.3	Confident	57 Å²	57	69.8 Å²	69.8	30%	0.298	33%	0.325	S	S	.	.			trans	-66	158.4	175.2	-63.4	170.2	0	0	0	110.1	G159 R163 Q164 K165 V319 R320	G159-L161 PolarHBondContact O-N 3.18Å; L161-R163 PolarHBondContact O-N 2.89Å; L161-Q164 HydrophobicContact CB-CG 4.45Å; L161-Q164 CarbonylContact O-C 3.57Å; L161-Q164 WeakPolarHBondContact O-CA 3.49Å; L161-Q164 WeakPolarHBondContact O-CB 3.37Å; L161-Q164 PolarHBondContact O-N 3.48Å; L161-K165 PolarHBondContact O-N 3.38Å; L161-V319 HydrophobicContact CB-CG1 4.01Å; L161-V319 HydrophobicContact CD1-CB 4.4Å; L161-V319 HydrophobicContact CD1-CG1 3.74Å; L161-R320 HydrophobicContact CD1-CB 4.18Å
162	R	87.3	Confident	81.7	Confident	232 Å²	232	69.9 Å²	69.9	88%	0.875	33%	0.326	S	S	*	.	H	α-helix	trans	-46.4	-42.9	-177.3	-174.3	179	177.8	-172.9	-0.3	113.6	K166	R162-K166 PolarHBondContact O-N 3.34Å
163	R	88	Confident	82.4	Confident	138 Å²	138	75.2 Å²	75.2	52%	0.521	35%	0.348	S	S	.	.	H	α-helix	trans	-70.7	-38.7	177.9	-172	172.9	-177.6	153.1	4.2	113	L161 K166 L167 V319	L161-R163 PolarHBondContact O-N 2.89Å; R163-K166 PolarHBondContact O-N 2.88Å; R163-L167 PolarHBondContact O-N 3.32Å; R163-V319 HydrophobicContact CB-CG1 3.94Å; R163-V319 HydrophobicContact CB-CG2 4.32Å; R163-V319 HydrophobicContact CG-CG2 4.21Å
164	Q	91.1	Very high	82.9	Confident	22 Å²	22	73 Å²	73	10%	0.103	34%	0.337	C	S	.	.	H	α-helix	trans	-66.5	-40.8	174.7	-67.7	174.3	-53.4	0	0	111.1	F160 L161 K166 L167 C168 F316 V319	F160-Q164 HydrophobicContact CB-CB 3.81Å; F160-Q164 HydrophobicContact CD1-CB 4.48Å; F160-Q164 HydrophobicContact CG-CB 4.18Å; L161-Q164 HydrophobicContact CB-CG 4.45Å; L161-Q164 CarbonylContact O-C 3.57Å; L161-Q164 WeakPolarHBondContact O-CA 3.49Å; L161-Q164 WeakPolarHBondContact O-CB 3.37Å; L161-Q164 PolarHBondContact O-N 3.48Å; Q164-K166 VanDerWaalsContact C-N 3.32Å; Q164-K166 PolarHBondContact O-N 3.47Å; Q164-L167 PolarHBondContact O-N 3.15Å; Q164-C168 VanDerWaalsContact O-CB 3.3Å; Q164-C168 WeakPolarHBondContact O-CB 3.44Å; Q164-C168 PolarHBondContact O-N 3.49Å; Q164-F316 HydrophobicContact CB-CD2 4.48Å; Q164-F316 HydrophobicContact CB-CE2 4.12Å; Q164-F316 WeakPolarHBondContact CG-O 3Å; Q164-F316 PolarHBondContact NE2-O 3.36Å; Q164-V319 HydrophobicContact CG-CB 3.8Å; Q164-V319 HydrophobicContact CG-CG1 4.12Å; Q164-V319 HydrophobicContact CG-CG2 3.72Å
165	K	90.6	Very high	83.1	Confident	57 Å²	57	73.1 Å²	73.1	25%	0.248	34%	0.337	C	S	.	.	H	α-helix	trans	-58.9	-41.7	173.9	-69.1	-163.6	171.5	-155.9	0	112.4	C154 D155 F160 L161 C168 R169	C154-K165 WeakPolarHBondContact O-CE 3.34Å; C154-K165 WeakPolarHBondContact O-CG 3.32Å; D155-K165 IonicContact OD1-NZ 3.35Å; D155-K165 PolarHBondContact OD1-NZ 2.92Å; F160-K165 HydrophobicContact CB-CG 3.68Å; F160-K165 VanDerWaalsContact O-CE 3.29Å; F160-K165 WeakPolarHBondContact O-CE 3.43Å; F160-K165 WeakPolarHBondContact O-CG 3.46Å; L161-K165 PolarHBondContact O-N 3.38Å; K165-C168 PolarHBondContact O-N 3.28Å; K165-R169 VanDerWaalsContact O-CG 3.32Å; K165-R169 WeakPolarHBondContact O-CG 3.48Å; K165-R169 PolarHBondContact O-N 3.42Å
166	K	90.9	Very high	83.6	Confident	151 Å²	151	77.6 Å²	77.6	66%	0.657	36%	0.356	S	S	*	.	H	α-helix	trans	-60.3	-48.4	175.9	-173.2	179.5	177.9	-178.4	0	111.2	R162 R163 Q164 R169 Q170	R162-K166 PolarHBondContact O-N 3.34Å; R163-K166 PolarHBondContact O-N 2.88Å; Q164-K166 VanDerWaalsContact C-N 3.32Å; Q164-K166 PolarHBondContact O-N 3.47Å; K166-R169 PolarHBondContact O-N 2.83Å; K166-Q170 WeakPolarHBondContact O-CB 3.29Å; K166-Q170 PolarHBondContact O-N 3.41Å
167	L	90.5	Very high	84.6	Confident	11 Å²	11	75.5 Å²	75.5	6%	0.058	35%	0.348	C	S	.	.	H	α-helix	trans	-63.5	-43.2	177.3	-70.2	170.3	0	0	0	112.2	R163 Q164 R169 Q170 Y171 Q315 F316	R163-L167 PolarHBondContact O-N 3.32Å; Q164-L167 PolarHBondContact O-N 3.15Å; L167-R169 VanDerWaalsContact C-N 3.34Å; L167-R169 PolarHBondContact O-N 3.17Å; L167-Q170 PolarHBondContact O-N 3.2Å; L167-Y171 PolarHBondContact O-N 2.93Å; L167-Q315 HydrophobicContact CD1-CB 3.84Å; L167-Q315 VanDerWaalsContact CD1-O 3.28Å; L167-Q315 WeakPolarHBondContact CD1-O 3.23Å; L167-F316 HydrophobicContact CB-CD2 4.2Å; L167-F316 HydrophobicContact CD1-CD2 4.37Å
168	C	91.4	Very high	86.4	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-59.5	-43.6	177.7	-178.7	0	0	0	0	111.9	C154 F160 Q164 K165 Y171 L172 M175 F316	C154-C168 WeakPolarHBondContact CA-SG 3.38Å; C154-C168 HydrophobicContact CB-CB 3.77Å; C154-C168 WeakPolarHBondContact CB-SG 3.4Å; C154-C168 WeakPolarHBondContact SG-CB 3.25Å; C154-C168 CovalentContact SG-SG 2.03Å; C154-C168 PolarHBondContact SG-SG 3.41Å; F160-C168 HydrophobicContact CD2-CB 4.2Å; F160-C168 HydrophobicContact CE2-CB 4.3Å; Q164-C168 VanDerWaalsContact O-CB 3.3Å; Q164-C168 WeakPolarHBondContact O-CB 3.44Å; Q164-C168 PolarHBondContact O-N 3.49Å; K165-C168 PolarHBondContact O-N 3.28Å; C168-Y171 CarbonylContact O-C 3.27Å; C168-L172 WeakPolarHBondContact O-CA 3.29Å; C168-L172 PolarHBondContact O-N 3.22Å; C168-M175 HydrophobicContact CB-CG 4.35Å; C168-M175 HydrophobicContact CB-SD 3.78Å; C168-M175 VanDerWaalsContact SG-CG 3.57Å; C168-F316 HydrophobicContact CB-CE2 4.46Å
169	R	90.4	Very high	87.8	Confident	158 Å²	158	73.1 Å²	73.1	60%	0.596	33%	0.331	S	S	*	.	H	α-helix	trans	-68.9	-33.4	176.6	-69.4	174.1	-175.1	-177.1	-0.9	112.7	C154 D155 K165 K166 L167	C154-R169 HydrophobicContact CB-CG 4.29Å; D155-R169 IonicContact OD1-NH2 2.78Å; D155-R169 PolarHBondContact OD1-NH2 3.13Å; D155-R169 IonicContact OD2-NH2 3.85Å; K165-R169 VanDerWaalsContact O-CG 3.32Å; K165-R169 WeakPolarHBondContact O-CG 3.48Å; K165-R169 PolarHBondContact O-N 3.42Å; K166-R169 PolarHBondContact O-N 2.83Å; L167-R169 VanDerWaalsContact C-N 3.34Å; L167-R169 PolarHBondContact O-N 3.17Å
170	Q	89.3	Confident	89.2	Confident	105 Å²	105	80 Å²	80	49%	0.491	35%	0.345	S	S	.	.	H	α-helix	trans	-73.1	-35.9	178.4	-176.8	179.1	-12.1	0	0	112.6	K166 L167	K166-Q170 WeakPolarHBondContact O-CB 3.29Å; K166-Q170 PolarHBondContact O-N 3.41Å; L167-Q170 PolarHBondContact O-N 3.2Å
171	Y	88.7	Confident	89.9	Confident	44 Å²	44	77.4 Å²	77.4	17%	0.173	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.5	48.3	-177.3	-64.2	-85.8	0	0	0	110.8	L167 C168 H173 L174 M175 N281 F308 F312	L167-Y171 PolarHBondContact O-N 2.93Å; C168-Y171 CarbonylContact O-C 3.27Å; Y171-H173 VanDerWaalsContact C-N 3.31Å; Y171-H173 PolarHBondContact O-N 3.26Å; Y171-L174 HydrophobicContact CD1-CD2 4.32Å; Y171-L174 WeakPolarHBondContact O-CB 3.31Å; Y171-L174 PolarHBondContact O-N 3.39Å; Y171-M175 PolarHBondContact O-N 2.67Å; Y171-N281 HydrophobicContact CD1-CB 4.47Å; Y171-N281 HydrophobicContact CE1-CB 4.17Å; Y171-F308 HydrophobicContact CE1-CZ 4.25Å; Y171-F312 HydrophobicContact CD1-CE2 4.44Å; Y171-F312 HydrophobicContact CD2-CD2 4.45Å; Y171-F312 AromaticContact CD2-CE2 3.69Å; Y171-F312 HydrophobicContact CD2-CE2 3.69Å; Y171-F312 HydrophobicContact CE2-CE2 4.33Å; Y171-F312 AromaticContact CG-CE2 3.75Å; Y171-F312 HydrophobicContact CG-CE2 3.75Å
172	L	88	Confident	90.3	Very high	85 Å²	85	77.6 Å²	77.6	45%	0.445	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-56.6	-44.5	-172.6	-176.1	65.1	0	0	0	112	I153 C168 L174 M175	I153-L172 HydrophobicContact CG2-CD1 3.51Å; C168-L172 WeakPolarHBondContact O-CA 3.29Å; C168-L172 PolarHBondContact O-N 3.22Å; L172-L174 PolarHBondContact O-N 2.94Å; L172-M175 WeakPolarHBondContact O-CB 3.13Å; L172-M175 WeakPolarHBondContact O-CG 2.88Å; L172-M175 PolarHBondContact O-N 3.14Å; L172-M175 VanDerWaalsContact O-N 3.15Å
173	H	84.3	Confident	90.8	Very high	141 Å²	141	71.3 Å²	71.3	65%	0.653	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-66.7	-22.7	179	-59.2	-68.9	0	0	0	113.4	Y171 M175	Y171-H173 VanDerWaalsContact C-N 3.31Å; Y171-H173 PolarHBondContact O-N 3.26Å; H173-M175 VanDerWaalsContact C-N 3.33Å
174	L	88.1	Confident	91.2	Very high	2 Å²	2	66.9 Å²	66.9	1%	0.01	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-80.9	-15.2	177.2	-160.2	59.6	0	0	0	112.7	Y171 L172 E176 S177 V178 V270 A273 F308 F312	Y171-L174 HydrophobicContact CD1-CD2 4.32Å; Y171-L174 WeakPolarHBondContact O-CB 3.31Å; Y171-L174 PolarHBondContact O-N 3.39Å; L172-L174 PolarHBondContact O-N 2.94Å; L174-E176 VanDerWaalsContact C-N 3.26Å; L174-E176 PolarHBondContact O-N 3.01Å; L174-S177 WeakPolarHBondContact O-CB 3.47Å; L174-S177 PolarHBondContact O-N 3.24Å; L174-S177 VanDerWaalsContact O-N 3.09Å; L174-V178 WeakPolarHBondContact O-CG2 3.26Å; L174-V178 PolarHBondContact O-N 3.42Å; L174-V270 HydrophobicContact CD1-CG1 4.09Å; L174-V270 HydrophobicContact CD1-CG2 4.47Å; L174-V270 HydrophobicContact CD2-CG1 3.79Å; L174-V270 HydrophobicContact CD2-CG2 4.45Å; L174-V270 HydrophobicContact CG-CG1 4.18Å; L174-V270 HydrophobicContact CG-CG2 4.21Å; L174-A273 HydrophobicContact CD1-CB 4.37Å; L174-F308 HydrophobicContact CD2-CE1 4.1Å; L174-F308 HydrophobicContact CD2-CZ 4.46Å; L174-F312 HydrophobicContact CD2-CD2 3.78Å; L174-F312 HydrophobicContact CD2-CE2 3.81Å; L174-F312 HydrophobicContact CD2-CG 4.17Å; L174-F312 HydrophobicContact CD2-CZ 4.24Å
175	M	90	Very high	91.5	Very high	4 Å²	4	65.8 Å²	65.8	2%	0.02	29%	0.291	C	S	.	.	H	α-helix	trans	-64.7	-30.3	-174.1	-67	-64	97	0	0	113.1	I153 C168 Y171 L172 H173 V178 I179 F312 F316	I153-M175 HydrophobicContact CD1-CB 3.79Å; I153-M175 HydrophobicContact CG2-CB 4.45Å; C168-M175 HydrophobicContact CB-CG 4.35Å; C168-M175 HydrophobicContact CB-SD 3.78Å; C168-M175 VanDerWaalsContact SG-CG 3.57Å; Y171-M175 PolarHBondContact O-N 2.67Å; L172-M175 WeakPolarHBondContact O-CB 3.13Å; L172-M175 WeakPolarHBondContact O-CG 2.88Å; L172-M175 PolarHBondContact O-N 3.14Å; L172-M175 VanDerWaalsContact O-N 3.15Å; H173-M175 VanDerWaalsContact C-N 3.33Å; M175-V178 HydrophobicContact CE-CB 4.43Å; M175-V178 HydrophobicContact CE-CG2 3.75Å; M175-V178 WeakPolarHBondContact O-CB 3.26Å; M175-V178 PolarHBondContact O-N 2.76Å; M175-I179 WeakPolarHBondContact O-CG1 3.48Å; M175-I179 PolarHBondContact O-N 2.96Å; M175-F312 HydrophobicContact CE-CE1 3.91Å; M175-F312 HydrophobicContact CE-CE2 4.42Å; M175-F312 HydrophobicContact CE-CZ 3.39Å; M175-F316 HydrophobicContact CE-CE2 4.48Å; M175-F316 HydrophobicContact SD-CE2 4.06Å; M175-F316 HydrophobicContact SD-CZ 4.24Å
176	E	88.1	Confident	91.8	Very high	145 Å²	145	63.2 Å²	63.2	68%	0.678	28%	0.279	S	S	*	.	H	α-helix	trans	-61.8	-45.6	172.6	-172.1	-178	164	0	0	111	L174 V178 I179 R180	L174-E176 VanDerWaalsContact C-N 3.26Å; L174-E176 PolarHBondContact O-N 3.01Å; E176-V178 VanDerWaalsContact C-N 3.29Å; E176-V178 PolarHBondContact O-N 3.32Å; E176-I179 PolarHBondContact O-N 3.48Å; E176-R180 VanDerWaalsContact O-CB 3.31Å; E176-R180 WeakPolarHBondContact O-CB 3.48Å; E176-R180 PolarHBondContact O-N 3.35Å
177	S	91.7	Very high	92.1	Very high	9 Å²	9	63.1 Å²	63.1	6%	0.063	28%	0.279	C	S	.	.	H	α-helix	trans	-64	-34.5	176	-43	0	0	0	0	112.1	L174 G181 A269 A273	L174-S177 WeakPolarHBondContact O-CB 3.47Å; L174-S177 PolarHBondContact O-N 3.24Å; L174-S177 VanDerWaalsContact O-N 3.09Å; S177-G181 PolarHBondContact O-N 3.42Å; S177-A269 WeakPolarHBondContact O-CB 3.05Å; S177-A273 WeakPolarHBondContact OG-CB 3.41Å
178	V	92.4	Very high	92.5	Very high	8 Å²	8	63.2 Å²	63.2	5%	0.048	28%	0.279	C	S	.	.	H	α-helix	trans	-65.2	-48	174.2	174.9	0	0	0	0	111.1	L174 M175 E176 G181 Y182 V266 V270 F312 F316	L174-V178 WeakPolarHBondContact O-CG2 3.26Å; L174-V178 PolarHBondContact O-N 3.42Å; M175-V178 HydrophobicContact CE-CB 4.43Å; M175-V178 HydrophobicContact CE-CG2 3.75Å; M175-V178 WeakPolarHBondContact O-CB 3.26Å; M175-V178 PolarHBondContact O-N 2.76Å; E176-V178 VanDerWaalsContact C-N 3.29Å; E176-V178 PolarHBondContact O-N 3.32Å; V178-G181 PolarHBondContact O-N 3.38Å; V178-Y182 WeakPolarHBondContact O-CB 3.42Å; V178-Y182 PolarHBondContact O-N 2.8Å; V178-V266 HydrophobicContact CG1-CG1 4.14Å; V178-V266 HydrophobicContact CG1-CG2 4.39Å; V178-V266 HydrophobicContact CG2-CG1 4.39Å; V178-V270 HydrophobicContact CG2-CG2 3.7Å; V178-F312 HydrophobicContact CG2-CD1 4.05Å; V178-F312 HydrophobicContact CG2-CE1 3.44Å; V178-F312 VanDerWaalsContact CG2-CE1 3.44Å; V178-F312 HydrophobicContact CG2-CZ 4.23Å; V178-F316 HydrophobicContact CG1-CD1 4.11Å; V178-F316 HydrophobicContact CG1-CE1 3.98Å
179	I	91.5	Very high	92.9	Very high	76 Å²	76	63.2 Å²	63.2	39%	0.39	28%	0.279	S	S	.	.	H	α-helix	trans	-62.3	-48.8	177.1	-70.7	-179.6	0	0	0	110.2	I153 M175 E176 G181 Y182 F183	I153-I179 HydrophobicContact CD1-CD1 3.37Å; I153-I179 HydrophobicContact CD1-CG1 4.45Å; I153-I179 HydrophobicContact CG1-CD1 4.09Å; M175-I179 WeakPolarHBondContact O-CG1 3.48Å; M175-I179 PolarHBondContact O-N 2.96Å; E176-I179 PolarHBondContact O-N 3.48Å; I179-G181 VanDerWaalsContact C-N 3.33Å; I179-G181 PolarHBondContact O-N 3.36Å; I179-Y182 PolarHBondContact O-N 2.68Å; I179-F183 HydrophobicContact CG2-CD2 3.67Å; I179-F183 HydrophobicContact CG2-CE2 3.74Å; I179-F183 VanDerWaalsContact O-CD2 3.31Å; I179-F183 WeakPolarHBondContact O-CD2 3.46Å; I179-F183 PolarHBondContact O-N 2.62Å
180	R	92.7	Very high	93.2	Very high	181 Å²	181	58.3 Å²	58.3	68%	0.683	26%	0.263	S	S	*	.	H	α-helix	trans	-56.6	-46.7	177.1	-179.8	-179.6	169	119.2	-0.3	111.3	E176 F183 M184	E176-R180 VanDerWaalsContact O-CB 3.31Å; E176-R180 WeakPolarHBondContact O-CB 3.48Å; E176-R180 PolarHBondContact O-N 3.35Å; R180-F183 PolarHBondContact O-N 3.14Å; R180-M184 VanDerWaalsContact O-CB 3.25Å; R180-M184 WeakPolarHBondContact O-CB 3.46Å; R180-M184 PolarHBondContact O-N 3.13Å
181	G	95.9	Very high	93.6	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64	-40.1	178.7	0	0	0	0	0	113.2	S177 V178 I179 M184 G185 G265	S177-G181 PolarHBondContact O-N 3.42Å; V178-G181 PolarHBondContact O-N 3.38Å; I179-G181 VanDerWaalsContact C-N 3.33Å; I179-G181 PolarHBondContact O-N 3.36Å; G181-M184 PolarHBondContact O-N 3.48Å; G181-G185 PolarHBondContact O-N 2.99Å; G181-G265 VanDerWaalsContact C-C 3.47Å; G181-G265 WeakPolarHBondContact CA-O 3.18Å; G181-G265 CarbonylContact O-C 3.57Å; G181-G265 VanDerWaalsContact O-C 3.24Å; G181-G265 VanDerWaalsContact O-CA 3.27Å; G181-G265 WeakPolarHBondContact O-CA 3.1Å
182	Y	96.1	Very high	94.1	Very high	61 Å²	61	58.1 Å²	58.1	24%	0.239	26%	0.259	C	S	.	.	H	α-helix	trans	-61.8	-48.6	175.7	-171.7	-93.7	0	0	0	111.8	V178 I179 G185 L186 L244 T262 V266	V178-Y182 WeakPolarHBondContact O-CB 3.42Å; V178-Y182 PolarHBondContact O-N 2.8Å; I179-Y182 PolarHBondContact O-N 2.68Å; Y182-G185 PolarHBondContact O-N 3.33Å; Y182-L186 HydrophobicContact CD1-CD1 3.98Å; Y182-L186 HydrophobicContact CE1-CD1 3.58Å; Y182-L186 HydrophobicContact CE1-CG 4.28Å; Y182-L186 PolarHBondContact O-N 3.41Å; Y182-L186 VanDerWaalsContact O-N 3.15Å; Y182-L244 HydrophobicContact CE1-CD2 4.44Å; Y182-L244 WeakPolarHBondContact OH-CD2 3.11Å; Y182-T262 HydrophobicContact CD2-CG2 4.18Å; Y182-T262 HydrophobicContact CE2-CG2 3.96Å; Y182-V266 HydrophobicContact CD2-CG2 4.42Å
183	F	96.2	Very high	94.5	Very high	99 Å²	99	54.1 Å²	54.1	43%	0.434	24%	0.238	S	C	.	.	H	α-helix	trans	-71.1	-29.7	177.4	-77.7	-68.4	0	0	0	113.4	I179 R180 G185 L186 K187 H203	I179-F183 HydrophobicContact CG2-CD2 3.67Å; I179-F183 HydrophobicContact CG2-CE2 3.74Å; I179-F183 VanDerWaalsContact O-CD2 3.31Å; I179-F183 WeakPolarHBondContact O-CD2 3.46Å; I179-F183 PolarHBondContact O-N 2.62Å; R180-F183 PolarHBondContact O-N 3.14Å; F183-G185 VanDerWaalsContact C-N 3.28Å; F183-G185 PolarHBondContact O-N 3.15Å; F183-L186 HydrophobicContact CD1-CD1 4.13Å; F183-L186 HydrophobicContact CE1-CD1 4.37Å; F183-L186 PolarHBondContact O-N 3.45Å; F183-K187 WeakPolarHBondContact O-CB 3.03Å; F183-K187 WeakPolarHBondContact O-CG 3.16Å; F183-K187 PolarHBondContact O-N 3.14Å; F183-H203 AromaticContact CE1-CE1 3.96Å
184	M	97.3	Very high	95	Very high	45 Å²	45	50.9 Å²	50.9	22%	0.222	23%	0.232	C	C	.	.	H	α-helix	trans	-59.5	-42.6	170	-174.7	179.9	69.6	0	0	110.7	R180 G181 E188 H268 A269 F375	R180-M184 VanDerWaalsContact O-CB 3.25Å; R180-M184 WeakPolarHBondContact O-CB 3.46Å; R180-M184 PolarHBondContact O-N 3.13Å; G181-M184 PolarHBondContact O-N 3.48Å; M184-E188 WeakPolarHBondContact O-CB 3.21Å; M184-E188 PolarHBondContact O-N 2.99Å; M184-H268 HydrophobicContact CE-CB 3.92Å; M184-A269 HydrophobicContact CE-CB 4.48Å; M184-F375 HydrophobicContact CE-CD1 4.14Å; M184-F375 HydrophobicContact CE-CD2 3.47Å; M184-F375 VanDerWaalsContact CE-CD2 3.47Å; M184-F375 HydrophobicContact CE-CE1 4.2Å; M184-F375 HydrophobicContact CE-CE2 3.59Å; M184-F375 HydrophobicContact CE-CG 3.78Å; M184-F375 HydrophobicContact CE-CZ 3.96Å; M184-F375 HydrophobicContact CG-CD1 3.84Å; M184-F375 HydrophobicContact CG-CE1 3.98Å; M184-F375 HydrophobicContact CG-CG 4.28Å; M184-F375 HydrophobicContact SD-CB 4.4Å; M184-F375 HydrophobicContact SD-CD1 4.26Å; M184-F375 HydrophobicContact SD-CD2 4.37Å; M184-F375 HydrophobicContact SD-CG 4.08Å
185	G	98	Very high	95.3	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.6	-43.2	173.4	0	0	0	0	0	113.5	G181 Y182 F183 E188 C189 V261	G181-G185 PolarHBondContact O-N 2.99Å; Y182-G185 PolarHBondContact O-N 3.33Å; F183-G185 VanDerWaalsContact C-N 3.28Å; F183-G185 PolarHBondContact O-N 3.15Å; G185-E188 PolarHBondContact O-N 3.28Å; G185-C189 WeakPolarHBondContact O-CB 3.48Å; G185-C189 PolarHBondContact O-N 2.91Å; G185-V261 WeakPolarHBondContact O-CG1 3.28Å
186	L	97.1	Very high	95.6	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	25%	0.25	C	C	.	.	H	α-helix	trans	-68	-41.6	177.8	-68.2	177.9	0	0	0	112.8	Y182 F183 E188 C189 E190 V258 T262	Y182-L186 HydrophobicContact CD1-CD1 3.98Å; Y182-L186 HydrophobicContact CE1-CD1 3.58Å; Y182-L186 HydrophobicContact CE1-CG 4.28Å; Y182-L186 PolarHBondContact O-N 3.41Å; Y182-L186 VanDerWaalsContact O-N 3.15Å; F183-L186 HydrophobicContact CD1-CD1 4.13Å; F183-L186 HydrophobicContact CE1-CD1 4.37Å; F183-L186 PolarHBondContact O-N 3.45Å; L186-E188 VanDerWaalsContact C-N 3.31Å; L186-E188 PolarHBondContact O-N 3.03Å; L186-C189 WeakPolarHBondContact O-CA 3.26Å; L186-C189 VanDerWaalsContact O-CB 3.23Å; L186-C189 WeakPolarHBondContact O-CB 3.42Å; L186-C189 PolarHBondContact O-N 2.84Å; L186-C189 VanDerWaalsContact O-N 3.1Å; L186-E190 WeakPolarHBondContact O-CG 2.98Å; L186-E190 PolarHBondContact O-N 3.12Å; L186-V258 HydrophobicContact CD2-CG1 4.07Å; L186-T262 HydrophobicContact CD2-CG2 3.78Å; L186-T262 HydrophobicContact CG-CG2 3.97Å
187	K	97.4	Very high	96	Very high	150 Å²	150	49.7 Å²	49.7	65%	0.652	23%	0.229	S	C	*	.	H	α-helix	trans	-62.2	-39.7	175.2	-74.9	-175.8	177	-173.2	0	112	F183 C189 E190 Y191	F183-K187 WeakPolarHBondContact O-CB 3.03Å; F183-K187 WeakPolarHBondContact O-CG 3.16Å; F183-K187 PolarHBondContact O-N 3.14Å; K187-C189 VanDerWaalsContact C-N 3.31Å; K187-E190 PolarHBondContact O-N 3.28Å; K187-Y191 PolarHBondContact O-N 3.49Å
188	E	98.4	Very high	96.2	Very high	12 Å²	12	50.2 Å²	50.2	6%	0.056	23%	0.229	C	C	.	.	H	α-helix	trans	-67.7	-34.6	174.2	-174	58.3	-154.9	0	0	111.5	M184 G185 L186 Y191 Q192 V261 F375 R376	M184-E188 WeakPolarHBondContact O-CB 3.21Å; M184-E188 PolarHBondContact O-N 2.99Å; G185-E188 PolarHBondContact O-N 3.28Å; L186-E188 VanDerWaalsContact C-N 3.31Å; L186-E188 PolarHBondContact O-N 3.03Å; E188-Y191 WeakPolarHBondContact O-CB 3.37Å; E188-Y191 PolarHBondContact O-N 2.03Å; E188-Q192 HydrophobicContact CG-CG 4.43Å; E188-Q192 VanDerWaalsContact O-CG 3.28Å; E188-Q192 WeakPolarHBondContact O-CG 3.48Å; E188-Q192 PolarHBondContact O-N 3.4Å; E188-Q192 PolarHBondContact OE1-NE2 3.05Å; E188-V261 HydrophobicContact CB-CG2 4.35Å; E188-V261 HydrophobicContact CG-CG2 4.41Å; E188-F375 HydrophobicContact CB-CD1 3.89Å; E188-F375 HydrophobicContact CB-CE1 3.57Å; E188-F375 HydrophobicContact CG-CD1 3.99Å; E188-F375 HydrophobicContact CG-CE1 3.91Å; E188-R376 VanDerWaalsContact OE1-CD 3.29Å; E188-R376 WeakPolarHBondContact OE1-CD 3.46Å; E188-R376 IonicContact OE1-NE 2.84Å; E188-R376 PolarHBondContact OE1-NE 3.24Å; E188-R376 IonicContact OE2-CZ 3.33Å; E188-R376 IonicContact OE2-NE 3.79Å; E188-R376 PolarHBondContact OE2-NE 3.18Å; E188-R376 IonicContact OE2-NH2 3.51Å
189	C	98.5	Very high	96.4	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.8	-46.1	171.6	-173.6	0	0	0	0	112.5	G185 L186 K187 Y191 Q192 F193 W198 C200 Y257 V261	G185-C189 WeakPolarHBondContact O-CB 3.48Å; G185-C189 PolarHBondContact O-N 2.91Å; L186-C189 WeakPolarHBondContact O-CA 3.26Å; L186-C189 VanDerWaalsContact O-CB 3.23Å; L186-C189 WeakPolarHBondContact O-CB 3.42Å; L186-C189 PolarHBondContact O-N 2.84Å; L186-C189 VanDerWaalsContact O-N 3.1Å; K187-C189 VanDerWaalsContact C-N 3.31Å; C189-Y191 VanDerWaalsContact C-N 3.28Å; C189-Y191 PolarHBondContact O-N 2.69Å; C189-Q192 PolarHBondContact O-N 3.33Å; C189-F193 WeakPolarHBondContact O-CB 3.21Å; C189-F193 WeakPolarHBondContact O-CD2 3.37Å; C189-F193 PolarHBondContact O-N 2.79Å; C189-W198 WeakPolarHBondContact SG-CH2 3.43Å; C189-C200 HydrophobicContact CB-CB 3.83Å; C189-C200 WeakPolarHBondContact CB-SG 3Å; C189-C200 WeakPolarHBondContact SG-CB 3.46Å; C189-C200 CovalentContact SG-SG 2.03Å; C189-C200 PolarHBondContact SG-SG 2.77Å; C189-Y257 HydrophobicContact CB-CD1 4.42Å; C189-Y257 HydrophobicContact CB-CE1 3.84Å; C189-V261 HydrophobicContact CB-CG1 4.16Å
190	E	97.6	Very high	96.6	Very high	55 Å²	55	47 Å²	47	26%	0.257	21%	0.213	S	C	.	.	H	α-helix	trans	-60.4	-39.3	174.8	-68.9	176.5	171.7	0	0	111.8	L186 K187 S194 C200 Q201 H203	L186-E190 WeakPolarHBondContact O-CG 2.98Å; L186-E190 PolarHBondContact O-N 3.12Å; K187-E190 PolarHBondContact O-N 3.28Å; E190-S194 WeakPolarHBondContact O-CA 3.27Å; E190-S194 WeakPolarHBondContact O-CB 3.49Å; E190-S194 PolarHBondContact O-N 2.97Å; E190-C200 HydrophobicContact CG-CB 4.12Å; E190-Q201 HydrophobicContact CG-CG 4.06Å; E190-H203 IonicContact OE1-CD2 3.29Å; E190-H203 IonicContact OE1-NE2 3.8Å
191	Y	97.9	Very high	96.7	Very high	124 Å²	124	43.1 Å²	43.1	49%	0.486	20%	0.203	S	C	.	.	H	α-helix	trans	-61.8	-55.2	175.9	-179.3	-95.7	0	0	0	111.8	K187 E188 C189 F193 S194 R376	K187-Y191 PolarHBondContact O-N 3.49Å; E188-Y191 WeakPolarHBondContact O-CB 3.37Å; E188-Y191 PolarHBondContact O-N 2.03Å; C189-Y191 VanDerWaalsContact C-N 3.28Å; C189-Y191 PolarHBondContact O-N 2.69Å; Y191-F193 VanDerWaalsContact C-N 3.26Å; Y191-F193 PolarHBondContact O-N 3.35Å; Y191-S194 WeakPolarHBondContact O-CB 3.23Å; Y191-S194 PolarHBondContact O-N 2.89Å; Y191-S194 PolarHBondContact O-OG 2.97Å; Y191-R376 VanDerWaalsContact CZ-CZ 3.48Å; Y191-R376 PolarHBondContact OH-NH1 2.85Å
192	Q	98	Very high	96.3	Very high	21 Å²	21	43.9 Å²	43.9	10%	0.098	21%	0.21	C	C	.	.	H	α-helix	trans	-62.6	-32.9	-176.9	-66.7	-63.7	-14.2	0	0	112.6	E188 C189 Y257 Q383	E188-Q192 HydrophobicContact CG-CG 4.43Å; E188-Q192 VanDerWaalsContact O-CG 3.28Å; E188-Q192 WeakPolarHBondContact O-CG 3.48Å; E188-Q192 PolarHBondContact O-N 3.4Å; E188-Q192 PolarHBondContact OE1-NE2 3.05Å; C189-Q192 PolarHBondContact O-N 3.33Å; Q192-Y257 WeakPolarHBondContact CG-OH 3.41Å; Q192-Q383 PolarHBondContact O-NE2 3.2Å; Q192-Q383 VanDerWaalsContact OE1-CD 3.23Å
193	F	97.3	Very high	95.9	Very high	1 Å²	1	42.5 Å²	42.5	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-104.3	7.8	-176.1	-70	-86.7	0	0	0	114.4	C189 Y191 A195 H196 W198 N199 Y257 F386	C189-F193 WeakPolarHBondContact O-CB 3.21Å; C189-F193 WeakPolarHBondContact O-CD2 3.37Å; C189-F193 PolarHBondContact O-N 2.79Å; Y191-F193 VanDerWaalsContact C-N 3.26Å; Y191-F193 PolarHBondContact O-N 3.35Å; F193-A195 PolarHBondContact O-N 3.18Å; F193-H196 HydrophobicContact CB-CB 4.4Å; F193-H196 HydrophobicContact CD1-CB 4.1Å; F193-H196 AromaticContact CD1-CG 3.77Å; F193-H196 AromaticContact CD1-ND1 3.87Å; F193-H196 WeakPolarHBondContact O-CB 3.32Å; F193-H196 PolarHBondContact O-N 3.44Å; F193-W198 HydrophobicContact CB-CE3 4.22Å; F193-W198 HydrophobicContact CB-CZ3 4.21Å; F193-W198 AromaticContact CD1-CE3 3.71Å; F193-W198 HydrophobicContact CD1-CE3 3.71Å; F193-W198 AromaticContact CD1-CZ3 3.68Å; F193-W198 HydrophobicContact CD1-CZ3 3.68Å; F193-W198 HydrophobicContact CD2-CE3 4.45Å; F193-W198 HydrophobicContact CD2-CH2 4.44Å; F193-W198 AromaticContact CD2-CZ3 3.7Å; F193-W198 HydrophobicContact CD2-CZ3 3.7Å; F193-W198 HydrophobicContact CE1-CE3 4.19Å; F193-W198 AromaticContact CE1-CZ3 3.92Å; F193-W198 HydrophobicContact CE1-CZ3 3.92Å; F193-W198 AromaticContact CE2-CZ3 3.95Å; F193-W198 HydrophobicContact CE2-CZ3 3.95Å; F193-W198 AromaticContact CG-CE3 3.85Å; F193-W198 HydrophobicContact CG-CE3 3.85Å; F193-W198 AromaticContact CG-CZ3 3.56Å; F193-W198 HydrophobicContact CG-CZ3 3.56Å; F193-W198 HydrophobicContact CZ-CZ3 4.05Å; F193-N199 VanDerWaalsContact O-CA 3.28Å; F193-N199 WeakPolarHBondContact O-CA 3.37Å; F193-N199 WeakPolarHBondContact O-CB 3.26Å; F193-Y257 HydrophobicContact CD2-CD1 4.28Å; F193-Y257 HydrophobicContact CD2-CE1 4.12Å; F193-Y257 AromaticContact CE2-CD1 3.52Å; F193-Y257 HydrophobicContact CE2-CD1 3.52Å; F193-Y257 AromaticContact CE2-CD2 3.94Å; F193-Y257 HydrophobicContact CE2-CD2 3.94Å; F193-Y257 AromaticContact CE2-CE1 3.56Å; F193-Y257 HydrophobicContact CE2-CE1 3.56Å; F193-Y257 AromaticContact CE2-CE2 3.94Å; F193-Y257 HydrophobicContact CE2-CE2 3.94Å; F193-Y257 AromaticContact CE2-CG 3.73Å; F193-Y257 HydrophobicContact CE2-CG 3.73Å; F193-Y257 AromaticContact CE2-CZ 3.77Å; F193-Y257 HydrophobicContact CZ-CD1 4.32Å; F193-Y257 HydrophobicContact CZ-CD2 4.22Å; F193-Y257 HydrophobicContact CZ-CG 4.11Å; F193-F386 AromaticContact CE1-CD1 3.87Å; F193-F386 HydrophobicContact CE1-CD1 3.87Å; F193-F386 HydrophobicContact CE1-CD2 4.42Å; F193-F386 AromaticContact CE1-CE1 3.52Å; F193-F386 HydrophobicContact CE1-CE1 3.52Å; F193-F386 HydrophobicContact CE1-CE2 4.07Å; F193-F386 HydrophobicContact CE1-CG 4.33Å; F193-F386 AromaticContact CE1-CZ 3.62Å; F193-F386 HydrophobicContact CE1-CZ 3.62Å; F193-F386 AromaticContact CZ-CD1 3.75Å; F193-F386 HydrophobicContact CZ-CD1 3.75Å; F193-F386 AromaticContact CZ-CD2 3.94Å; F193-F386 HydrophobicContact CZ-CD2 3.94Å; F193-F386 AromaticContact CZ-CE1 3.87Å; F193-F386 HydrophobicContact CZ-CE1 3.87Å; F193-F386 HydrophobicContact CZ-CE2 4.01Å; F193-F386 AromaticContact CZ-CG 3.81Å; F193-F386 HydrophobicContact CZ-CG 3.81Å; F193-F386 AromaticContact CZ-CZ 3.99Å; F193-F386 HydrophobicContact CZ-CZ 3.99Å
194	S	95.5	Very high	95.5	Very high	74 Å²	74	42.1 Å²	42.1	52%	0.517	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-38.8	-176.6	55	0	0	0	0	114.7	E190 Y191 R487	E190-S194 WeakPolarHBondContact O-CA 3.27Å; E190-S194 WeakPolarHBondContact O-CB 3.49Å; E190-S194 PolarHBondContact O-N 2.97Å; Y191-S194 WeakPolarHBondContact O-CB 3.23Å; Y191-S194 PolarHBondContact O-N 2.89Å; Y191-S194 PolarHBondContact O-OG 2.97Å; S194-R487 PolarHBondContact O-NH2 2.75Å
195	A	94.3	Very high	95	Very high	32 Å²	32	43.7 Å²	43.7	26%	0.264	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-11.8	178.3	0	0	0	0	0	114.9	F193 L496 N497	F193-A195 PolarHBondContact O-N 3.18Å; A195-L496 HydrophobicContact CB-CB 4.43Å; A195-L496 CarbonylContact O-C 3.57Å; A195-L496 VanDerWaalsContact O-C 3.27Å; A195-N497 HydrophobicContact CB-CB 4Å
196	H	96	Very high	94.4	Very high	30 Å²	30	47.3 Å²	47.3	14%	0.139	24%	0.239	C	C	.	.	S	Bend	trans	-82.4	155.7	-177.4	-72.3	73.7	0	0	0	111.3	F193 W198 H387 R487 L496	F193-H196 HydrophobicContact CB-CB 4.4Å; F193-H196 HydrophobicContact CD1-CB 4.1Å; F193-H196 AromaticContact CD1-CG 3.77Å; F193-H196 AromaticContact CD1-ND1 3.87Å; F193-H196 WeakPolarHBondContact O-CB 3.32Å; F193-H196 PolarHBondContact O-N 3.44Å; H196-W198 VanDerWaalsContact C-N 3.27Å; H196-W198 WeakPolarHBondContact CB-O 3.38Å; H196-W198 CarbonylContact O-C 3.53Å; H196-W198 PolarHBondContact O-N 2.96Å; H196-H387 AromaticContact NE2-CE1 3.93Å; H196-R487 PolarHBondContact O-NH1 3.38Å; H196-R487 PolarHBondContact O-NH2 2.85Å; H196-L496 VanDerWaalsContact NE2-CD1 3.35Å; H196-L496 WeakPolarHBondContact NE2-CD1 3.39Å
197	R	96.7	Very high	93.7	Very high	63 Å²	63	48.4 Å²	48.4	24%	0.238	25%	0.246	C	C	.	.	S	Bend	trans	-56.5	-39.3	174.9	-69.7	180	-178.9	161.5	0	112.9	T471 F472 T484 R487 Y501 L502 C504	R197-T471 WeakPolarHBondContact CD-O 3Å; R197-F472 HydrophobicContact CB-CB 3.96Å; R197-T484 HydrophobicContact CB-CG2 3.97Å; R197-T484 HydrophobicContact CG-CG2 4.12Å; R197-R487 VanDerWaalsContact C-NH1 3.27Å; R197-R487 PolarHBondContact O-NH1 3.28Å; R197-Y501 HydrophobicContact CG-CD1 4.44Å; R197-Y501 HydrophobicContact CG-CE1 3.86Å; R197-Y501 PolarHBondContact NE-O 3.13Å; R197-Y501 PolarHBondContact NH2-O 3.25Å; R197-L502 HydrophobicContact CG-CD1 4.38Å; R197-C504 PolarHBondContact NE-SG 3.04Å
198	W	96.4	Very high	92.4	Very high	21 Å²	21	49.6 Å²	49.6	8%	0.08	25%	0.254	C	S	.	.	S	Bend	trans	-93	117.2	162	175.3	77.7	0	0	0	108.8	C189 F193 H196 C200 L247 E254 V258 F472	C189-W198 WeakPolarHBondContact SG-CH2 3.43Å; F193-W198 HydrophobicContact CB-CE3 4.22Å; F193-W198 HydrophobicContact CB-CZ3 4.21Å; F193-W198 AromaticContact CD1-CE3 3.71Å; F193-W198 HydrophobicContact CD1-CE3 3.71Å; F193-W198 AromaticContact CD1-CZ3 3.68Å; F193-W198 HydrophobicContact CD1-CZ3 3.68Å; F193-W198 HydrophobicContact CD2-CE3 4.45Å; F193-W198 HydrophobicContact CD2-CH2 4.44Å; F193-W198 AromaticContact CD2-CZ3 3.7Å; F193-W198 HydrophobicContact CD2-CZ3 3.7Å; F193-W198 HydrophobicContact CE1-CE3 4.19Å; F193-W198 AromaticContact CE1-CZ3 3.92Å; F193-W198 HydrophobicContact CE1-CZ3 3.92Å; F193-W198 AromaticContact CE2-CZ3 3.95Å; F193-W198 HydrophobicContact CE2-CZ3 3.95Å; F193-W198 AromaticContact CG-CE3 3.85Å; F193-W198 HydrophobicContact CG-CE3 3.85Å; F193-W198 AromaticContact CG-CZ3 3.56Å; F193-W198 HydrophobicContact CG-CZ3 3.56Å; F193-W198 HydrophobicContact CZ-CZ3 4.05Å; H196-W198 VanDerWaalsContact C-N 3.27Å; H196-W198 WeakPolarHBondContact CB-O 3.38Å; H196-W198 CarbonylContact O-C 3.53Å; H196-W198 PolarHBondContact O-N 2.96Å; W198-C200 HydrophobicContact CH2-CB 3.9Å; W198-C200 HydrophobicContact CZ2-CB 3.83Å; W198-C200 VanDerWaalsContact CZ2-SG 3.58Å; W198-C200 HydrophobicContact CZ3-CB 4.43Å; W198-L247 HydrophobicContact CZ2-CD2 3.78Å; W198-E254 HydrophobicContact CB-CG 4.41Å; W198-E254 HydrophobicContact CD2-CB 3.78Å; W198-E254 HydrophobicContact CD2-CG 3.47Å; W198-E254 VanDerWaalsContact CD2-CG 3.47Å; W198-E254 HydrophobicContact CE3-CB 3.74Å; W198-E254 HydrophobicContact CE3-CG 3.34Å; W198-E254 HydrophobicContact CG-CG 3.96Å; W198-E254 HydrophobicContact CH2-CB 3.71Å; W198-E254 HydrophobicContact CH2-CG 4.28Å; W198-E254 HydrophobicContact CZ2-CB 3.77Å; W198-E254 HydrophobicContact CZ2-CG 4.41Å; W198-E254 HydrophobicContact CZ3-CB 3.69Å; W198-E254 HydrophobicContact CZ3-CG 3.77Å; W198-V258 HydrophobicContact CH2-CG2 3.62Å; W198-V258 HydrophobicContact CZ2-CG2 3.69Å; W198-F472 HydrophobicContact CB-CB 4.29Å; W198-F472 HydrophobicContact CB-CD1 3.81Å; W198-F472 HydrophobicContact CB-CD2 3.77Å; W198-F472 HydrophobicContact CB-CE1 3.97Å; W198-F472 HydrophobicContact CB-CE2 3.89Å; W198-F472 HydrophobicContact CB-CG 3.71Å; W198-F472 HydrophobicContact CB-CZ 4Å; W198-F472 AromaticContact CD1-CD1 4Å; W198-F472 AromaticContact CD1-CE1 3.69Å; W198-F472 HydrophobicContact CG-CD1 4.23Å; W198-F472 AromaticContact CG-CE1 4Å; W198-F472 HydrophobicContact CG-CE1 4Å; W198-F472 HydrophobicContact CG-CE2 4.45Å; W198-F472 HydrophobicContact CG-CZ 4.11Å
199	N	95.6	Very high	90.4	Very high	11 Å²	11	53.5 Å²	53.5	6%	0.059	28%	0.279	C	S	.	.			trans	-112.9	19	-174	67.9	-14.6	0	0	0	113.7	F193 Q201	F193-N199 VanDerWaalsContact O-CA 3.28Å; F193-N199 WeakPolarHBondContact O-CA 3.37Å; F193-N199 WeakPolarHBondContact O-CB 3.26Å; N199-Q201 VanDerWaalsContact ND2-CD 3.32Å; N199-Q201 PolarHBondContact ND2-OE1 2.77Å; N199-Q201 PolarHBondContact O-N 2.99Å; N199-Q201 WeakPolarHBondContact OD1-CB 3.35Å; N199-Q201 PolarHBondContact OD1-N 3.3Å
200	C	95.9	Very high	88	Confident	6 Å²	6	58.5 Å²	58.5	4%	0.041	31%	0.311	C	S	.	.	S	Bend	trans	60.6	6.1	-178.4	-148.1	0	0	0	0	116.6	C189 E190 W198	C189-C200 HydrophobicContact CB-CB 3.83Å; C189-C200 WeakPolarHBondContact CB-SG 3Å; C189-C200 WeakPolarHBondContact SG-CB 3.46Å; C189-C200 CovalentContact SG-SG 2.03Å; C189-C200 PolarHBondContact SG-SG 2.77Å; E190-C200 HydrophobicContact CG-CB 4.12Å; W198-C200 HydrophobicContact CH2-CB 3.9Å; W198-C200 HydrophobicContact CZ2-CB 3.83Å; W198-C200 VanDerWaalsContact CZ2-SG 3.58Å; W198-C200 HydrophobicContact CZ3-CB 4.43Å
201	Q	94.3	Very high	85	Confident	99 Å²	99	60.8 Å²	60.8	46%	0.463	33%	0.331	S	S	.	.			trans	-82.2	166.9	176.6	-67.8	-175.8	-28.3	0	0	112.6	E190 N199 H203 I482	E190-Q201 HydrophobicContact CG-CG 4.06Å; N199-Q201 VanDerWaalsContact ND2-CD 3.32Å; N199-Q201 PolarHBondContact ND2-OE1 2.77Å; N199-Q201 PolarHBondContact O-N 2.99Å; N199-Q201 WeakPolarHBondContact OD1-CB 3.35Å; N199-Q201 PolarHBondContact OD1-N 3.3Å; Q201-H203 PolarHBondContact O-N 3.18Å; Q201-I482 HydrophobicContact CB-CD1 4.19Å
202	G	89	Confident	82.4	Confident	15 Å²	15	62 Å²	62	16%	0.155	35%	0.346	C	S	.	.			trans	74.2	12.3	176.5	0	0	0	0	0	114	N204 L205 Y243	G202-N204 PolarHBondContact O-N 2.89Å; G202-N204 VanDerWaalsContact O-N 3.11Å; G202-L205 VanDerWaalsContact O-CB 3.3Å; G202-L205 WeakPolarHBondContact O-CB 3.39Å; G202-L205 WeakPolarHBondContact O-CG 3.23Å; G202-L205 PolarHBondContact O-N 2.96Å; G202-Y243 WeakPolarHBondContact O-CB 3.45Å
203	H	87.1	Confident	79.8	Confident	33 Å²	33	65.8 Å²	65.8	15%	0.153	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-26.7	-178.5	65.9	68.2	0	0	0	113.3	F183 E190 Q201 T242 L244	F183-H203 AromaticContact CE1-CE1 3.96Å; E190-H203 IonicContact OE1-CD2 3.29Å; E190-H203 IonicContact OE1-NE2 3.8Å; Q201-H203 PolarHBondContact O-N 3.18Å; H203-T242 WeakPolarHBondContact O-CB 3.29Å; H203-L244 HydrophobicContact CB-CB 4.03Å; H203-L244 HydrophobicContact CB-CD2 4.35Å; H203-L244 VanDerWaalsContact O-CB 3.24Å; H203-L244 WeakPolarHBondContact O-CB 3.48Å; H203-L244 PolarHBondContact O-N 2.86Å
204	N	86.4	Confident	77.6	Confident	91 Å²	91	77.7 Å²	77.7	49%	0.487	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-9.8	178.8	63	-18	0	0	0	113.8	G202 T206	G202-N204 PolarHBondContact O-N 2.89Å; G202-N204 VanDerWaalsContact O-N 3.11Å; N204-T206 PolarHBondContact O-N 3.13Å
205	L	87.7	Confident	75.2	Confident	78 Å²	78	82.3 Å²	82.3	41%	0.408	43%	0.43	S	S	.	.			trans	-62.1	132.3	-179.8	-64.3	174.4	0	0	0	110.3	G202 T242 Y243 I482	G202-L205 VanDerWaalsContact O-CB 3.3Å; G202-L205 WeakPolarHBondContact O-CB 3.39Å; G202-L205 WeakPolarHBondContact O-CG 3.23Å; G202-L205 PolarHBondContact O-N 2.96Å; L205-T242 CarbonylContact O-C 3.52Å; L205-T242 WeakPolarHBondContact O-CA 3.49Å; L205-Y243 HydrophobicContact CB-CD2 3.73Å; L205-Y243 HydrophobicContact CB-CE2 4.12Å; L205-Y243 HydrophobicContact CB-CG 4.05Å; L205-Y243 WeakPolarHBondContact O-CD2 3.46Å; L205-Y243 PolarHBondContact O-N 3.44Å; L205-I482 HydrophobicContact CD1-CG2 3.54Å
206	T	86.2	Confident	72.9	Confident	75 Å²	75	84.5 Å²	84.5	46%	0.46	44%	0.435	S	S	.	.	B	Isolated β-bridge	trans	-79.9	137.2	176.6	59.3	0	0	0	0	109.9	N204 Q208 I240	N204-T206 PolarHBondContact O-N 3.13Å; T206-Q208 PolarHBondContact O-N 3.26Å; T206-Q208 VanDerWaalsContact O-N 3.09Å; T206-I240 HydrophobicContact CG2-CG2 3.53Å
207	V	81.8	Confident	70.1	Confident	25 Å²	25	92.1 Å²	92.1	15%	0.152	47%	0.468	C	S	.	.			trans	-76.8	101.4	176.4	-178.5	0	0	0	0	107.9	T209 Q241 Y243 K246 P477	V207-T209 PolarHBondContact O-N 2.97Å; V207-Q241 PolarHBondContact N-O 3.05Å; V207-Y243 HydrophobicContact CG2-CD2 3.82Å; V207-Y243 HydrophobicContact CG2-CE2 4.03Å; V207-K246 HydrophobicContact CG2-CG 3.72Å; V207-P477 HydrophobicContact CG1-CB 4.32Å
208	Q	70.9	Confident	67.4	Low	175 Å²	175	99.5 Å²	99.5	82%	0.818	50%	0.495	S	S	*	.			trans	-67.5	98.2	171.1	-62.8	-174.8	10.6	0	0	108.6	T206	T206-Q208 PolarHBondContact O-N 3.26Å; T206-Q208 VanDerWaalsContact O-N 3.09Å
209	T	56.3	Low	64.9	Low	95 Å²	95	103 Å²	103	58%	0.583	52%	0.515	S	S	*	.			trans	-68.2	127.3	168.8	38.9	0	0	0	0	108.8	V207	V207-T209 PolarHBondContact O-N 2.97Å
210	P	47	Very low	62	Low	104 Å²	104	112.4 Å²	112.4	68%	0.675	55%	0.55	S	S	*	.			trans	-56.2	141	176.8	20.3	-29.8	0	0	0	109.9	N212	P210-N212 PolarHBondContact O-N 3.45Å
211	P	35.8	Very low	59	Low	104 Å²	104	121.4 Å²	121.4	68%	0.675	58%	0.584	S	S	*	*	S	Bend	trans	-74.1	78.3	-175.3	31	-34.1	0	0	0	109.6
212	N	41.4	Very low	56.3	Low	150 Å²	150	126.4 Å²	126.4	80%	0.802	60%	0.599	S	S	*	*			trans	-138.3	131.8	173.9	-115.9	-16.5	0	0	0	111.8	P210	P210-N212 PolarHBondContact O-N 3.45Å
213	S	45.2	Very low	54.1	Low	99 Å²	99	134.3 Å²	134.3	69%	0.692	63%	0.632	S	S	*	*	S	Bend	trans	93.3	73.1	-178.7	78.1	0	0	0	0	118.2	K215	S213-K215 PolarHBondContact O-N 3Å
214	R	49.9	Very low	51.6	Low	251 Å²	251	136.8 Å²	136.8	95%	0.947	65%	0.653	S	S	*	*	S	Bend	trans	52.9	-18.9	153.7	-73	179.9	174.6	172.9	-2.3	120.9
215	K	45.5	Very low	49.4	Very low	172 Å²	172	139 Å²	139	75%	0.748	66%	0.66	S	S	*	*	S	Bend	trans	-87.2	-26.3	-172	-77.5	178.2	176.8	171	0	113.4	S213	S213-K215 PolarHBondContact O-N 3Å
216	Q	46.4	Very low	46.9	Very low	78 Å²	78	141.5 Å²	141.5	36%	0.364	68%	0.681	S	S	.	*	G	3₁₀ helix	trans	-79.7	-25.9	-179	-124.3	174.2	12.1	0	0	113.7	R218 L219 R220	Q216-R218 PolarHBondContact O-N 3.32Å; Q216-L219 PolarHBondContact O-N 3.32Å; Q216-R220 PolarHBondContact O-N 3.38Å
217	K	36.4	Very low	44.8	Very low	189 Å²	189	145 Å²	145	82%	0.822	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-60.4	-24.7	171.9	-91.4	-171.7	175.4	-175.6	0	112.7
218	R	40.7	Very low	42.7	Very low	218 Å²	218	151.6 Å²	151.6	82%	0.823	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-78.1	-16.6	172	-84.4	-171.9	174.4	-169.1	-1.4	114.1	Q216	Q216-R218 PolarHBondContact O-N 3.32Å
219	L	42.4	Very low	41.3	Very low	94 Å²	94	150 Å²	150	49%	0.492	72%	0.721	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.5	-33.3	-173.6	-82.9	157.9	0	0	0	113.5	Q216 V238	Q216-L219 PolarHBondContact O-N 3.32Å; L219-V238 HydrophobicContact CD1-CG2 4.04Å; L219-V238 HydrophobicContact CD2-CG2 3.49Å; L219-V238 VanDerWaalsContact CD2-CG2 3.49Å; L219-V238 HydrophobicContact CG-CG2 4.4Å
220	R	34.8	Very low	40.6	Very low	209 Å²	209	152.9 Å²	152.9	79%	0.789	74%	0.739	S	S	*	*	S	Bend	trans	-88.5	-10.9	179	-73.5	-168.1	-170.3	-176.1	2.6	115.3	Q216	Q216-R220 PolarHBondContact O-N 3.38Å
221	Y	34.1	Very low	40.2	Very low	195 Å²	195	153.5 Å²	153.5	77%	0.765	74%	0.737	S	S	*	*	S	Bend	trans	-98.4	10.5	-178.2	-156.5	-98.8	0	0	0	113.4
222	R	36.6	Very low	40.4	Very low	204 Å²	204	155.6 Å²	155.6	77%	0.77	74%	0.742	S	S	*	*	S	Bend	trans	-111.3	6.9	-176	-148.4	177.1	176	159.6	1.4	114.1	S224	R222-S224 VanDerWaalsContact C-N 3.35Å
223	E	42.8	Very low	40.3	Very low	182 Å²	182	152.5 Å²	152.5	85%	0.85	73%	0.732	S	S	*	*	S	Bend	trans	-90.2	6.1	177.1	-81.2	176.2	158.8	0	0	113.8
224	S	35.4	Very low	40.2	Very low	84 Å²	84	155.4 Å²	155.4	59%	0.587	74%	0.735	S	S	*	*	S	Bend	trans	-140.1	91.1	176.6	58.3	0	0	0	0	109.9	R222	R222-S224 VanDerWaalsContact C-N 3.35Å
225	E	40.6	Very low	39.7	Very low	138 Å²	138	153.3 Å²	153.3	65%	0.645	73%	0.727	S	S	*	*			trans	166.7	126.4	142.7	-94.5	-173.7	-179.9	0	0	110.7	K227	E225-K227 PolarHBondContact O-N 3.08Å; E225-K227 WeakPolarHBondContact OE2-CE 3.44Å; E225-K227 IonicContact OE2-NZ 2.61Å; E225-K227 PolarHBondContact OE2-NZ 3.12Å
226	P	35.3	Very low	39.7	Very low	131 Å²	131	154.5 Å²	154.5	85%	0.851	73%	0.732	S	S	*	*			trans	-81	95.6	169.7	32.4	-26.9	0	0	0	108.1
227	K	41.1	Very low	39.9	Very low	147 Å²	147	155.1 Å²	155.1	64%	0.639	75%	0.745	S	S	*	*			trans	-110.5	116.8	169.4	-81.3	177.2	172.2	153.8	0	110.3	E225 D229	E225-K227 PolarHBondContact O-N 3.08Å; E225-K227 WeakPolarHBondContact OE2-CE 3.44Å; E225-K227 IonicContact OE2-NZ 2.61Å; E225-K227 PolarHBondContact OE2-NZ 3.12Å; K227-D229 PolarHBondContact O-N 2.95Å
228	N	38.1	Very low	40.8	Very low	165 Å²	165	150.3 Å²	150.3	88%	0.882	73%	0.731	S	S	*	*			trans	-57.8	94.7	167	-69.6	-32.1	0	0	0	108.6
229	D	40.8	Very low	42	Very low	140 Å²	140	146.1 Å²	146.1	75%	0.749	72%	0.715	S	S	*	*			trans	-139.9	120.1	170.3	-81.9	-47.3	0	0	0	111.1	K227 D231	K227-D229 PolarHBondContact O-N 2.95Å; D229-D231 VanDerWaalsContact C-N 3.29Å; D229-D231 PolarHBondContact O-N 3.11Å
230	V	41.7	Very low	43.4	Very low	157 Å²	157	145.4 Å²	145.4	95%	0.952	71%	0.711	S	S	*	*			trans	-70.8	77.2	177.5	-177.9	0	0	0	0	108.6
231	D	39.2	Very low	45.6	Very low	117 Å²	117	139.6 Å²	139.6	63%	0.626	69%	0.693	S	S	*	*			trans	-157.9	84.5	159.4	-166.6	3.5	0	0	0	111.2	D229 S233	D229-D231 VanDerWaalsContact C-N 3.29Å; D229-D231 PolarHBondContact O-N 3.11Å; D231-S233 PolarHBondContact O-N 3.31Å; D231-S233 WeakPolarHBondContact OD1-CB 3.3Å; D231-S233 PolarHBondContact OD1-N 3.32Å; D231-S233 PolarHBondContact OD1-OG 2.95Å
232	N	39	Very low	48.3	Very low	147 Å²	147	131.4 Å²	131.4	79%	0.786	66%	0.663	S	S	*	*			trans	-86.1	15.6	-175	-127.2	-8.6	0	0	0	113.3
233	S	40.1	Very low	51	Low	86 Å²	86	122.3 Å²	122.3	60%	0.601	63%	0.629	S	S	*	*	S	Bend	trans	-93.5	-5.7	-165.5	68.9	0	0	0	0	115.9	D231	D231-S233 PolarHBondContact O-N 3.31Å; D231-S233 WeakPolarHBondContact OD1-CB 3.3Å; D231-S233 PolarHBondContact OD1-N 3.32Å; D231-S233 PolarHBondContact OD1-OG 2.95Å
234	Q	43.5	Very low	53.4	Low	159 Å²	159	114.2 Å²	114.2	74%	0.743	59%	0.592	S	S	*	*			trans	-136	25.2	-172.2	-65.5	-167.9	11.2	0	0	117.5	K236	Q234-K236 VanDerWaalsContact C-N 3.28Å; Q234-K236 PolarHBondContact O-N 3.44Å
235	R	40.1	Very low	56	Low	208 Å²	208	111.8 Å²	111.8	79%	0.785	57%	0.572	S	S	*	*			trans	-69.7	85.2	167	-76.8	-173.6	-178.3	-170.4	0.7	110.3	S237	R235-S237 PolarHBondContact O-N 3.03Å
236	K	44.8	Very low	58.6	Low	197 Å²	197	107.6 Å²	107.6	86%	0.857	55%	0.552	S	S	*	*			trans	-64.3	100.2	167.5	-79.2	-177.8	179.7	174	0	108.4	Q234 V238	Q234-K236 VanDerWaalsContact C-N 3.28Å; Q234-K236 PolarHBondContact O-N 3.44Å; K236-V238 PolarHBondContact O-N 2.87Å; K236-V238 VanDerWaalsContact O-N 3.15Å
237	S	50.2	Low	61.4	Low	90 Å²	90	101.8 Å²	101.8	63%	0.629	51%	0.513	S	S	*	.			trans	-50.1	118.2	169.2	165.6	0	0	0	0	109.2	R235 R239	R235-S237 PolarHBondContact O-N 3.03Å; S237-R239 PolarHBondContact O-N 3.34Å
238	V	56.1	Low	64	Low	88 Å²	88	95 Å²	95	53%	0.533	48%	0.484	S	S	.	.			trans	-74.1	107.9	173.4	176.8	0	0	0	0	107	L219 K236 I240	L219-V238 HydrophobicContact CD1-CG2 4.04Å; L219-V238 HydrophobicContact CD2-CG2 3.49Å; L219-V238 VanDerWaalsContact CD2-CG2 3.49Å; L219-V238 HydrophobicContact CG-CG2 4.4Å; K236-V238 PolarHBondContact O-N 2.87Å; K236-V238 VanDerWaalsContact O-N 3.15Å; V238-I240 PolarHBondContact O-N 3.05Å
239	R	64.8	Low	66.7	Low	130 Å²	130	89.2 Å²	89.2	49%	0.491	46%	0.457	S	S	.	.			trans	-73.8	111.8	176.7	-173.3	174.8	176.2	-178.7	-4.9	109.6	S237 Q241	S237-R239 PolarHBondContact O-N 3.34Å; R239-Q241 PolarHBondContact O-N 3.44Å
240	I	72.9	Confident	69.3	Low	80 Å²	80	85.8 Å²	85.8	41%	0.41	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-67.8	125.4	171.1	-55.7	173.4	0	0	0	107.3	N158 T206 V238	N158-I240 WeakPolarHBondContact OD1-CB 3.38Å; T206-I240 HydrophobicContact CG2-CG2 3.53Å; V238-I240 PolarHBondContact O-N 3.05Å
241	Q	81.5	Confident	71.9	Confident	87 Å²	87	78.3 Å²	78.3	41%	0.407	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-96.8	132	174.6	-67.8	-175.2	5	0	0	109	V207 R239	V207-Q241 PolarHBondContact N-O 3.05Å; R239-Q241 PolarHBondContact O-N 3.44Å
242	T	90.3	Very high	74.7	Confident	22 Å²	22	72.8 Å²	72.8	14%	0.135	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-98.9	168.4	174.7	65.3	0	0	0	0	111.7	H203 L205 L244 D245 K246	H203-T242 WeakPolarHBondContact O-CB 3.29Å; L205-T242 CarbonylContact O-C 3.52Å; L205-T242 WeakPolarHBondContact O-CA 3.49Å; T242-L244 PolarHBondContact O-N 3.33Å; T242-L244 PolarHBondContact OG1-N 3.32Å; T242-D245 WeakPolarHBondContact O-CB 3.48Å; T242-D245 PolarHBondContact O-N 2.74Å; T242-D245 VanDerWaalsContact O-N 3.15Å; T242-D245 PolarHBondContact OG1-N 3.07Å; T242-D245 VanDerWaalsContact OG1-N 3.16Å; T242-K246 PolarHBondContact O-N 3.45Å; T242-K246 VanDerWaalsContact O-N 3.08Å
243	Y	92.3	Very high	77.5	Confident	13 Å²	13	68.6 Å²	68.6	5%	0.051	33%	0.334	C	S	.	.	H	α-helix	trans	-58.2	-37.9	171.3	-86.9	-129.8	0	0	0	111.1	G202 L205 V207 K246 L247 H475 P477 G480 I482	G202-Y243 WeakPolarHBondContact O-CB 3.45Å; L205-Y243 HydrophobicContact CB-CD2 3.73Å; L205-Y243 HydrophobicContact CB-CE2 4.12Å; L205-Y243 HydrophobicContact CB-CG 4.05Å; L205-Y243 WeakPolarHBondContact O-CD2 3.46Å; L205-Y243 PolarHBondContact O-N 3.44Å; V207-Y243 HydrophobicContact CG2-CD2 3.82Å; V207-Y243 HydrophobicContact CG2-CE2 4.03Å; Y243-K246 WeakPolarHBondContact O-CB 3.46Å; Y243-K246 PolarHBondContact O-N 2.81Å; Y243-L247 PolarHBondContact O-N 3.38Å; Y243-H475 AromaticContact CZ-NE2 3.9Å; Y243-H475 PolarHBondContact OH-CE1 2.84Å; Y243-H475 PolarHBondContact OH-NE2 3.49Å; Y243-P477 HydrophobicContact CE2-CB 4.47Å; Y243-P477 WeakPolarHBondContact OH-CG 3.42Å; Y243-G480 VanDerWaalsContact CD1-O 3.3Å; Y243-G480 WeakPolarHBondContact CD1-O 3.3Å; Y243-I482 HydrophobicContact CD1-CG2 3.96Å; Y243-I482 HydrophobicContact CE1-CG2 3.97Å
244	L	92.8	Very high	80.3	Confident	13 Å²	13	65.1 Å²	65.1	7%	0.068	31%	0.308	C	S	.	.	H	α-helix	trans	-61.7	-45.1	173.3	-177.1	57.5	0	0	0	112.5	Y182 H203 T242 K246 L247 L248 V258	Y182-L244 HydrophobicContact CE1-CD2 4.44Å; Y182-L244 WeakPolarHBondContact OH-CD2 3.11Å; H203-L244 HydrophobicContact CB-CB 4.03Å; H203-L244 HydrophobicContact CB-CD2 4.35Å; H203-L244 VanDerWaalsContact O-CB 3.24Å; H203-L244 WeakPolarHBondContact O-CB 3.48Å; H203-L244 PolarHBondContact O-N 2.86Å; T242-L244 PolarHBondContact O-N 3.33Å; T242-L244 PolarHBondContact OG1-N 3.32Å; L244-K246 PolarHBondContact O-N 3.21Å; L244-L247 PolarHBondContact O-N 3.44Å; L244-L248 HydrophobicContact CD1-CD1 3.93Å; L244-L248 HydrophobicContact CD1-CD2 4.33Å; L244-L248 HydrophobicContact CD1-CG 3.88Å; L244-L248 HydrophobicContact CG-CD1 3.97Å; L244-L248 HydrophobicContact CG-CG 4.28Å; L244-L248 WeakPolarHBondContact O-CB 3.45Å; L244-L248 VanDerWaalsContact O-CG 3.25Å; L244-L248 WeakPolarHBondContact O-CG 3.37Å; L244-L248 PolarHBondContact O-N 3.45Å; L244-V258 HydrophobicContact CD1-CG1 3.68Å
245	D	92	Very high	82.9	Confident	33 Å²	33	57.6 Å²	57.6	18%	0.176	27%	0.273	C	S	.	.	H	α-helix	trans	-60.1	-36	175.9	-81.7	-31.6	0	0	0	112.1	T242 S249 R320	T242-D245 WeakPolarHBondContact O-CB 3.48Å; T242-D245 PolarHBondContact O-N 2.74Å; T242-D245 VanDerWaalsContact O-N 3.15Å; T242-D245 PolarHBondContact OG1-N 3.07Å; T242-D245 VanDerWaalsContact OG1-N 3.16Å; D245-S249 VanDerWaalsContact O-CB 3.3Å; D245-S249 WeakPolarHBondContact O-CB 3.29Å; D245-S249 PolarHBondContact O-N 3.3Å; D245-S249 VanDerWaalsContact O-N 3.13Å; D245-S249 PolarHBondContact O-OG 3.13Å; D245-R320 IonicContact OD1-CZ 2.74Å; D245-R320 IonicContact OD1-NH1 3.86Å; D245-R320 PolarHBondContact OD1-NH1 2.83Å
246	K	93.8	Very high	85.7	Confident	49 Å²	49	47.7 Å²	47.7	21%	0.213	24%	0.235	C	C	.	.	H	α-helix	trans	-66.9	-51.1	174.5	-68.1	-60.4	-164.7	-173.3	0	111.4	V207 T242 Y243 L244 L248 S249 K250	V207-K246 HydrophobicContact CG2-CG 3.72Å; T242-K246 PolarHBondContact O-N 3.45Å; T242-K246 VanDerWaalsContact O-N 3.08Å; Y243-K246 WeakPolarHBondContact O-CB 3.46Å; Y243-K246 PolarHBondContact O-N 2.81Å; L244-K246 PolarHBondContact O-N 3.21Å; K246-L248 PolarHBondContact O-N 3.15Å; K246-S249 WeakPolarHBondContact O-CA 3.19Å; K246-S249 WeakPolarHBondContact O-CB 3.32Å; K246-S249 PolarHBondContact O-N 3.04Å; K246-S249 PolarHBondContact O-OG 2.88Å; K246-K250 WeakPolarHBondContact O-CG 3.29Å; K246-K250 PolarHBondContact O-N 3.16Å
247	L	95.2	Very high	88.2	Confident	9 Å²	9	38.3 Å²	38.3	5%	0.047	20%	0.195	C	C	.	.	H	α-helix	trans	-53.8	-52	177.8	-175	67.9	0	0	0	111.2	W198 Y243 L244 S249 K250 E254 S255 V258	W198-L247 HydrophobicContact CZ2-CD2 3.78Å; Y243-L247 PolarHBondContact O-N 3.38Å; L244-L247 PolarHBondContact O-N 3.44Å; L247-S249 PolarHBondContact O-N 3Å; L247-S249 VanDerWaalsContact O-N 3.16Å; L247-K250 PolarHBondContact O-N 3.4Å; L247-E254 HydrophobicContact CD1-CB 4.22Å; L247-E254 HydrophobicContact CD2-CB 4.48Å; L247-S255 WeakPolarHBondContact O-CB 3.45Å; L247-V258 HydrophobicContact CD2-CG2 4.23Å
248	L	95.6	Very high	90.5	Very high	4 Å²	4	34 Å²	34	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-66.2	-16.5	178.9	-62.2	-176.4	0	0	0	113.9	L244 K246 V258 L259 R320 N335	L244-L248 HydrophobicContact CD1-CD1 3.93Å; L244-L248 HydrophobicContact CD1-CD2 4.33Å; L244-L248 HydrophobicContact CD1-CG 3.88Å; L244-L248 HydrophobicContact CG-CD1 3.97Å; L244-L248 HydrophobicContact CG-CG 4.28Å; L244-L248 WeakPolarHBondContact O-CB 3.45Å; L244-L248 VanDerWaalsContact O-CG 3.25Å; L244-L248 WeakPolarHBondContact O-CG 3.37Å; L244-L248 PolarHBondContact O-N 3.45Å; K246-L248 PolarHBondContact O-N 3.15Å; L248-V258 HydrophobicContact CD2-CB 4.32Å; L248-V258 HydrophobicContact CD2-CG1 4.23Å; L248-L259 HydrophobicContact CD1-CD2 4.18Å; L248-L259 HydrophobicContact CD2-CD1 4.22Å; L248-L259 HydrophobicContact CD2-CD2 3.87Å; L248-L259 HydrophobicContact CD2-CG 3.67Å; L248-R320 VanDerWaalsContact CD1-NH2 3.29Å; L248-N335 PolarHBondContact O-ND2 3.41Å
249	S	94.9	Very high	92.5	Very high	45 Å²	45	30.2 Å²	30.2	32%	0.315	14%	0.141	S	C	.	.	H	α-helix	trans	-85.8	-15.9	174.2	78.1	0	0	0	0	114	D245 K246 L247 L331	D245-S249 VanDerWaalsContact O-CB 3.3Å; D245-S249 WeakPolarHBondContact O-CB 3.29Å; D245-S249 PolarHBondContact O-N 3.3Å; D245-S249 VanDerWaalsContact O-N 3.13Å; D245-S249 PolarHBondContact O-OG 3.13Å; K246-S249 WeakPolarHBondContact O-CA 3.19Å; K246-S249 WeakPolarHBondContact O-CB 3.32Å; K246-S249 PolarHBondContact O-N 3.04Å; K246-S249 PolarHBondContact O-OG 2.88Å; L247-S249 PolarHBondContact O-N 3Å; L247-S249 VanDerWaalsContact O-N 3.16Å; S249-L331 WeakPolarHBondContact O-CD2 3.26Å
250	K	95.6	Very high	94.1	Very high	68 Å²	68	24 Å²	24	30%	0.296	12%	0.118	S	C	.	.	H	α-helix	trans	-88.1	-28.4	-179	-64.1	-60.4	-177.3	176.5	0	113.1	K246 L247 T252 S467 R478 Y479	K246-K250 WeakPolarHBondContact O-CG 3.29Å; K246-K250 PolarHBondContact O-N 3.16Å; L247-K250 PolarHBondContact O-N 3.4Å; K250-T252 HydrophobicContact CB-CG2 3.89Å; K250-S467 VanDerWaalsContact O-CB 3.29Å; K250-S467 WeakPolarHBondContact O-CB 3.3Å; K250-S467 PolarHBondContact O-OG 3.36Å; K250-R478 WeakPolarHBondContact CE-O 3.5Å; K250-Y479 HydrophobicContact CB-CD1 4.29Å; K250-Y479 HydrophobicContact CB-CE1 4.48Å; K250-Y479 HydrophobicContact CD-CD1 4.13Å; K250-Y479 HydrophobicContact CD-CE1 4.05Å; K250-Y479 HydrophobicContact CG-CD1 3.74Å; K250-Y479 HydrophobicContact CG-CE1 4.09Å
251	G	96.4	Very high	95.4	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	40	-178.1	0	0	0	0	0	112.2	S255 I466 S467	G251-S255 VanDerWaalsContact C-OG 3.31Å; G251-S255 VanDerWaalsContact CA-OG 3.25Å; G251-S255 WeakPolarHBondContact CA-OG 3.49Å; G251-I466 WeakPolarHBondContact O-CG1 3.33Å; G251-I466 PolarHBondContact O-N 3.18Å; G251-S467 PolarHBondContact O-N 3.43Å; G251-S467 VanDerWaalsContact O-N 3.08Å
252	T	98	Very high	96.2	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.08	C	C	.	.			trans	-80.2	171.8	172.1	68.9	0	0	0	0	110.9	K250 E254 S255 A256 S467	K250-T252 HydrophobicContact CB-CG2 3.89Å; T252-E254 VanDerWaalsContact C-N 3.27Å; T252-E254 WeakPolarHBondContact CB-OE2 3.47Å; T252-E254 PolarHBondContact O-N 3.47Å; T252-E254 PolarHBondContact OG1-OE2 3.34Å; T252-S255 PolarHBondContact N-OG 2.92Å; T252-S255 WeakPolarHBondContact O-CB 3.35Å; T252-S255 PolarHBondContact O-N 2.65Å; T252-S255 VanDerWaalsContact O-N 3.14Å; T252-S255 PolarHBondContact O-OG 3.5Å; T252-S255 PolarHBondContact OG1-N 3.44Å; T252-A256 PolarHBondContact O-N 3.18Å; T252-A256 VanDerWaalsContact O-N 3.13Å; T252-S467 WeakPolarHBondContact CA-O 3.41Å
253	R	97.7	Very high	96.6	Very high	60 Å²	60	15.3 Å²	15.3	23%	0.226	7%	0.074	C	C	.	.	H	α-helix	trans	-59.7	-38	177.4	-162.9	-171.4	-78.5	-139.5	1.7	112.6	S255 A256 Y257 F386 H387 A389 Y465	R253-S255 VanDerWaalsContact C-N 3.32Å; R253-S255 PolarHBondContact O-N 3.15Å; R253-A256 VanDerWaalsContact O-CB 3.31Å; R253-A256 WeakPolarHBondContact O-CB 3.48Å; R253-A256 PolarHBondContact O-N 3.26Å; R253-A256 VanDerWaalsContact O-N 3.15Å; R253-Y257 PolarHBondContact O-N 3.21Å; R253-F386 HydrophobicContact CB-CD2 4.4Å; R253-F386 HydrophobicContact CB-CE2 3.85Å; R253-F386 HydrophobicContact CB-CZ 4.44Å; R253-F386 VanDerWaalsContact CD-O 3.26Å; R253-F386 WeakPolarHBondContact CD-O 3.45Å; R253-F386 HydrophobicContact CG-CD2 3.56Å; R253-F386 HydrophobicContact CG-CE2 3.4Å; R253-F386 VanDerWaalsContact CG-CE2 3.4Å; R253-F386 HydrophobicContact CG-CG 4.31Å; R253-F386 HydrophobicContact CG-CZ 4Å; R253-F386 PolarHBondContact NH1-O 3.38Å; R253-F386 VanDerWaalsContact NH1-O 3.15Å; R253-F386 WeakPolarHBondContact O-CD2 3.19Å; R253-H387 PolarHBondContact NH1-O 3.2Å; R253-A389 HydrophobicContact CG-CB 3.83Å; R253-Y465 HydrophobicContact CB-CD1 4.27Å; R253-Y465 HydrophobicContact CB-CG 4.29Å; R253-Y465 HydrophobicContact CG-CD1 4.25Å; R253-Y465 PolarHBondContact NH2-OH 2.02Å
254	E	98	Very high	96.9	Very high	13 Å²	13	14.7 Å²	14.7	6%	0.061	7%	0.072	C	C	.	.	H	α-helix	trans	-64.7	-40.2	177.2	-58.3	73.7	-153.4	0	0	110.4	W198 L247 T252 A256 Y257 V258 F386 S469 F472	W198-E254 HydrophobicContact CB-CG 4.41Å; W198-E254 HydrophobicContact CD2-CB 3.78Å; W198-E254 HydrophobicContact CD2-CG 3.47Å; W198-E254 VanDerWaalsContact CD2-CG 3.47Å; W198-E254 HydrophobicContact CE3-CB 3.74Å; W198-E254 HydrophobicContact CE3-CG 3.34Å; W198-E254 HydrophobicContact CG-CG 3.96Å; W198-E254 HydrophobicContact CH2-CB 3.71Å; W198-E254 HydrophobicContact CH2-CG 4.28Å; W198-E254 HydrophobicContact CZ2-CB 3.77Å; W198-E254 HydrophobicContact CZ2-CG 4.41Å; W198-E254 HydrophobicContact CZ3-CB 3.69Å; W198-E254 HydrophobicContact CZ3-CG 3.77Å; L247-E254 HydrophobicContact CD1-CB 4.22Å; L247-E254 HydrophobicContact CD2-CB 4.48Å; T252-E254 VanDerWaalsContact C-N 3.27Å; T252-E254 WeakPolarHBondContact CB-OE2 3.47Å; T252-E254 PolarHBondContact O-N 3.47Å; T252-E254 PolarHBondContact OG1-OE2 3.34Å; E254-A256 VanDerWaalsContact C-N 3.27Å; E254-A256 PolarHBondContact O-N 2.89Å; E254-Y257 PolarHBondContact O-N 3.18Å; E254-V258 VanDerWaalsContact O-CG2 3.29Å; E254-V258 WeakPolarHBondContact O-CG2 3.44Å; E254-V258 PolarHBondContact O-N 3.06Å; E254-F386 HydrophobicContact CG-CE2 4.3Å; E254-S469 VanDerWaalsContact OE1-CB 3.26Å; E254-S469 WeakPolarHBondContact OE1-CB 3.42Å; E254-S469 PolarHBondContact OE1-OG 3.3Å; E254-S469 PolarHBondContact OE2-OG 3.38Å; E254-F472 HydrophobicContact CG-CE2 4.06Å; E254-F472 HydrophobicContact CG-CZ 3.85Å; E254-F472 WeakPolarHBondContact OE1-CE2 3.38Å
255	S	97.7	Very high	97.2	Very high	1 Å²	1	14 Å²	14	1%	0.007	7%	0.068	C	C	.	.	H	α-helix	trans	-63.4	-34.3	174.9	77.8	0	0	0	0	112.7	L247 G251 T252 R253 V258 L259	L247-S255 WeakPolarHBondContact O-CB 3.45Å; G251-S255 VanDerWaalsContact C-OG 3.31Å; G251-S255 VanDerWaalsContact CA-OG 3.25Å; G251-S255 WeakPolarHBondContact CA-OG 3.49Å; T252-S255 PolarHBondContact N-OG 2.92Å; T252-S255 WeakPolarHBondContact O-CB 3.35Å; T252-S255 PolarHBondContact O-N 2.65Å; T252-S255 VanDerWaalsContact O-N 3.14Å; T252-S255 PolarHBondContact O-OG 3.5Å; T252-S255 PolarHBondContact OG1-N 3.44Å; R253-S255 VanDerWaalsContact C-N 3.32Å; R253-S255 PolarHBondContact O-N 3.15Å; S255-V258 PolarHBondContact O-N 3.48Å; S255-L259 WeakPolarHBondContact O-CB 3.29Å; S255-L259 WeakPolarHBondContact O-CD1 3.28Å; S255-L259 VanDerWaalsContact O-CG 3.24Å; S255-L259 WeakPolarHBondContact O-CG 3.26Å; S255-L259 PolarHBondContact O-N 3Å
256	A	98.5	Very high	97.5	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-63.4	-47.9	176.4	0	0	0	0	0	111.4	T252 R253 E254 L259 A260 N338 L463 I464	T252-A256 PolarHBondContact O-N 3.18Å; T252-A256 VanDerWaalsContact O-N 3.13Å; R253-A256 VanDerWaalsContact O-CB 3.31Å; R253-A256 WeakPolarHBondContact O-CB 3.48Å; R253-A256 PolarHBondContact O-N 3.26Å; R253-A256 VanDerWaalsContact O-N 3.15Å; E254-A256 VanDerWaalsContact C-N 3.27Å; E254-A256 PolarHBondContact O-N 2.89Å; A256-L259 PolarHBondContact O-N 3.44Å; A256-A260 PolarHBondContact O-N 3.38Å; A256-A260 VanDerWaalsContact O-N 3.1Å; A256-N338 WeakPolarHBondContact CA-ND2 3.38Å; A256-N338 WeakPolarHBondContact CB-ND2 3.06Å; A256-L463 HydrophobicContact CB-CB 4.42Å; A256-I464 VanDerWaalsContact CB-O 3.32Å; A256-I464 WeakPolarHBondContact CB-O 2.99Å
257	Y	98.5	Very high	97.7	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-61.4	-46.9	176.1	-179	-85.7	0	0	0	111.9	C189 Q192 F193 R253 E254 L259 A260 V261 G379 L382 Q383 F386	C189-Y257 HydrophobicContact CB-CD1 4.42Å; C189-Y257 HydrophobicContact CB-CE1 3.84Å; Q192-Y257 WeakPolarHBondContact CG-OH 3.41Å; F193-Y257 HydrophobicContact CD2-CD1 4.28Å; F193-Y257 HydrophobicContact CD2-CE1 4.12Å; F193-Y257 AromaticContact CE2-CD1 3.52Å; F193-Y257 HydrophobicContact CE2-CD1 3.52Å; F193-Y257 AromaticContact CE2-CD2 3.94Å; F193-Y257 HydrophobicContact CE2-CD2 3.94Å; F193-Y257 AromaticContact CE2-CE1 3.56Å; F193-Y257 HydrophobicContact CE2-CE1 3.56Å; F193-Y257 AromaticContact CE2-CE2 3.94Å; F193-Y257 HydrophobicContact CE2-CE2 3.94Å; F193-Y257 AromaticContact CE2-CG 3.73Å; F193-Y257 HydrophobicContact CE2-CG 3.73Å; F193-Y257 AromaticContact CE2-CZ 3.77Å; F193-Y257 HydrophobicContact CZ-CD1 4.32Å; F193-Y257 HydrophobicContact CZ-CD2 4.22Å; F193-Y257 HydrophobicContact CZ-CG 4.11Å; R253-Y257 PolarHBondContact O-N 3.21Å; E254-Y257 PolarHBondContact O-N 3.18Å; Y257-L259 VanDerWaalsContact C-N 3.32Å; Y257-L259 PolarHBondContact O-N 3.06Å; Y257-A260 PolarHBondContact O-N 3.38Å; Y257-V261 HydrophobicContact CD1-CB 4.4Å; Y257-V261 HydrophobicContact CD1-CG1 4.04Å; Y257-V261 HydrophobicContact CE1-CB 3.9Å; Y257-V261 HydrophobicContact CE1-CG1 3.72Å; Y257-V261 HydrophobicContact CE1-CG2 4.26Å; Y257-V261 WeakPolarHBondContact O-CG1 3.02Å; Y257-V261 PolarHBondContact O-N 3.01Å; Y257-G379 PolarHBondContact OH-O 3.33Å; Y257-L382 HydrophobicContact CD2-CB 4.08Å; Y257-L382 HydrophobicContact CE2-CB 3.58Å; Y257-Q383 HydrophobicContact CE2-CB 4.2Å; Y257-F386 HydrophobicContact CD2-CB 3.96Å
258	V	98.4	Very high	97.8	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-59.7	-42.4	-179.3	175.1	0	0	0	0	111.7	L186 W198 L244 L247 L248 E254 S255 T262	L186-V258 HydrophobicContact CD2-CG1 4.07Å; W198-V258 HydrophobicContact CH2-CG2 3.62Å; W198-V258 HydrophobicContact CZ2-CG2 3.69Å; L244-V258 HydrophobicContact CD1-CG1 3.68Å; L247-V258 HydrophobicContact CD2-CG2 4.23Å; L248-V258 HydrophobicContact CD2-CB 4.32Å; L248-V258 HydrophobicContact CD2-CG1 4.23Å; E254-V258 VanDerWaalsContact O-CG2 3.29Å; E254-V258 WeakPolarHBondContact O-CG2 3.44Å; E254-V258 PolarHBondContact O-N 3.06Å; S255-V258 PolarHBondContact O-N 3.48Å; V258-T262 HydrophobicContact CG1-CG2 4.2Å; V258-T262 WeakPolarHBondContact O-CB 3.33Å; V258-T262 VanDerWaalsContact O-CG2 3.25Å; V258-T262 WeakPolarHBondContact O-CG2 3.21Å; V258-T262 PolarHBondContact O-N 2.93Å; V258-T262 PolarHBondContact O-OG1 3.12Å
259	L	98.5	Very high	97.9	Very high	8 Å²	8	10.9 Å²	10.9	4%	0.042	5%	0.054	C	C	.	.	H	α-helix	trans	-62.6	-45.5	176.2	-73	167.7	0	0	0	111.8	L248 S255 A256 Y257 T262 S263 N335 N338 N339	L248-L259 HydrophobicContact CD1-CD2 4.18Å; L248-L259 HydrophobicContact CD2-CD1 4.22Å; L248-L259 HydrophobicContact CD2-CD2 3.87Å; L248-L259 HydrophobicContact CD2-CG 3.67Å; S255-L259 WeakPolarHBondContact O-CB 3.29Å; S255-L259 WeakPolarHBondContact O-CD1 3.28Å; S255-L259 VanDerWaalsContact O-CG 3.24Å; S255-L259 WeakPolarHBondContact O-CG 3.26Å; S255-L259 PolarHBondContact O-N 3Å; A256-L259 PolarHBondContact O-N 3.44Å; Y257-L259 VanDerWaalsContact C-N 3.32Å; Y257-L259 PolarHBondContact O-N 3.06Å; L259-T262 PolarHBondContact O-OG1 2.92Å; L259-S263 VanDerWaalsContact O-CB 3.24Å; L259-S263 WeakPolarHBondContact O-CB 3.45Å; L259-S263 PolarHBondContact O-N 3.32Å; L259-N335 HydrophobicContact CD1-CB 3.65Å; L259-N335 VanDerWaalsContact CD1-CG 3.46Å; L259-N335 VanDerWaalsContact CD1-OD1 3.29Å; L259-N335 WeakPolarHBondContact CD1-OD1 3.4Å; L259-N338 HydrophobicContact CB-CB 3.97Å; L259-N338 HydrophobicContact CD1-CB 4.36Å; L259-N339 WeakPolarHBondContact CB-OD1 3.28Å; L259-N339 WeakPolarHBondContact CD2-OD1 3.49Å; L259-N339 PolarHBondContact O-OD1 3.25Å
260	A	98.7	Very high	98	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-63.9	-52.2	178.9	0	0	0	0	0	112	A256 Y257 T262 S263 A264 N338 G342 L382 L463	A256-A260 PolarHBondContact O-N 3.38Å; A256-A260 VanDerWaalsContact O-N 3.1Å; Y257-A260 PolarHBondContact O-N 3.38Å; A260-T262 PolarHBondContact O-N 3.36Å; A260-S263 PolarHBondContact O-N 3.17Å; A260-A264 VanDerWaalsContact O-CB 3.31Å; A260-A264 WeakPolarHBondContact O-CB 3.06Å; A260-A264 PolarHBondContact O-N 3.46Å; A260-N338 VanDerWaalsContact CA-O 3.26Å; A260-N338 WeakPolarHBondContact CA-O 3.31Å; A260-N338 WeakPolarHBondContact CB-O 3.46Å; A260-G342 VanDerWaalsContact O-CA 3.27Å; A260-G342 WeakPolarHBondContact O-CA 3.38Å; A260-L382 HydrophobicContact CB-CD1 4.31Å; A260-L382 HydrophobicContact CB-CD2 3.96Å; A260-L463 HydrophobicContact CB-CD2 3.62Å
261	V	98.6	Very high	98.1	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-68	-34.8	-175.7	76	0	0	0	0	112.4	G185 E188 C189 Y257 G265 F375 L382	G185-V261 WeakPolarHBondContact O-CG1 3.28Å; E188-V261 HydrophobicContact CB-CG2 4.35Å; E188-V261 HydrophobicContact CG-CG2 4.41Å; C189-V261 HydrophobicContact CB-CG1 4.16Å; Y257-V261 HydrophobicContact CD1-CB 4.4Å; Y257-V261 HydrophobicContact CD1-CG1 4.04Å; Y257-V261 HydrophobicContact CE1-CB 3.9Å; Y257-V261 HydrophobicContact CE1-CG1 3.72Å; Y257-V261 HydrophobicContact CE1-CG2 4.26Å; Y257-V261 WeakPolarHBondContact O-CG1 3.02Å; Y257-V261 PolarHBondContact O-N 3.01Å; V261-G265 PolarHBondContact O-N 2.85Å; V261-F375 HydrophobicContact CG2-CE1 4.22Å; V261-F375 HydrophobicContact CG2-CZ 4.09Å; V261-L382 HydrophobicContact CB-CD1 4.02Å; V261-L382 HydrophobicContact CG2-CD1 4.26Å
262	T	98.5	Very high	98	Very high	5 Å²	5	10.6 Å²	10.6	3%	0.031	5%	0.047	C	C	.	.	H	α-helix	trans	-72.8	-37.6	175.5	56.2	0	0	0	0	111.8	Y182 L186 V258 L259 A260 G265 V266	Y182-T262 HydrophobicContact CD2-CG2 4.18Å; Y182-T262 HydrophobicContact CE2-CG2 3.96Å; L186-T262 HydrophobicContact CD2-CG2 3.78Å; L186-T262 HydrophobicContact CG-CG2 3.97Å; V258-T262 HydrophobicContact CG1-CG2 4.2Å; V258-T262 WeakPolarHBondContact O-CB 3.33Å; V258-T262 VanDerWaalsContact O-CG2 3.25Å; V258-T262 WeakPolarHBondContact O-CG2 3.21Å; V258-T262 PolarHBondContact O-N 2.93Å; V258-T262 PolarHBondContact O-OG1 3.12Å; L259-T262 PolarHBondContact O-OG1 2.92Å; A260-T262 PolarHBondContact O-N 3.36Å; T262-G265 PolarHBondContact O-N 3.11Å; T262-V266 WeakPolarHBondContact O-CG2 3.13Å; T262-V266 PolarHBondContact O-N 2.99Å
263	S	98.6	Very high	97.9	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-69	-37.2	174.8	-165	0	0	0	0	112.4	L259 A260 S267 S313 N339 R343	L259-S263 VanDerWaalsContact O-CB 3.24Å; L259-S263 WeakPolarHBondContact O-CB 3.45Å; L259-S263 PolarHBondContact O-N 3.32Å; A260-S263 PolarHBondContact O-N 3.17Å; S263-S267 PolarHBondContact O-N 2.91Å; S263-S267 VanDerWaalsContact O-N 3.15Å; S263-S267 PolarHBondContact O-OG 2.82Å; S263-S313 PolarHBondContact O-OG 3.03Å; S263-S313 VanDerWaalsContact O-OG 3.08Å; S263-S313 PolarHBondContact OG-OG 3.48Å; S263-S313 VanDerWaalsContact OG-OG 3.07Å; S263-N339 WeakPolarHBondContact CB-O 3.45Å; S263-N339 PolarHBondContact OG-O 3.26Å; S263-N339 VanDerWaalsContact OG-O 3.11Å; S263-R343 WeakPolarHBondContact OG-CD 3.34Å; S263-R343 VanDerWaalsContact OG-CG 3.28Å; S263-R343 WeakPolarHBondContact OG-CG 3.32Å; S263-R343 PolarHBondContact OG-NE 2.7Å
264	A	98.7	Very high	97.8	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-61.1	-47.6	169.6	0	0	0	0	0	111.1	A260 V266 S267 H268 G342 V346 F375 L382	A260-A264 VanDerWaalsContact O-CB 3.31Å; A260-A264 WeakPolarHBondContact O-CB 3.06Å; A260-A264 PolarHBondContact O-N 3.46Å; A264-V266 PolarHBondContact O-N 3.25Å; A264-S267 PolarHBondContact O-N 3.32Å; A264-H268 VanDerWaalsContact O-CB 3.3Å; A264-H268 WeakPolarHBondContact O-CB 3.4Å; A264-H268 PolarHBondContact O-N 2.92Å; A264-G342 WeakPolarHBondContact CB-O 3.3Å; A264-V346 HydrophobicContact CB-CG2 3.68Å; A264-F375 HydrophobicContact CB-CE2 4.27Å; A264-L382 HydrophobicContact CB-CD1 4.46Å
265	G	98.6	Very high	97.6	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-60.4	-45	-179.8	0	0	0	0	0	113.4	G181 V261 T262 H268 A269 F375	G181-G265 VanDerWaalsContact C-C 3.47Å; G181-G265 WeakPolarHBondContact CA-O 3.18Å; G181-G265 CarbonylContact O-C 3.57Å; G181-G265 VanDerWaalsContact O-C 3.24Å; G181-G265 VanDerWaalsContact O-CA 3.27Å; G181-G265 WeakPolarHBondContact O-CA 3.1Å; V261-G265 PolarHBondContact O-N 2.85Å; T262-G265 PolarHBondContact O-N 3.11Å; G265-H268 PolarHBondContact O-N 3.41Å; G265-A269 WeakPolarHBondContact O-CB 3.03Å; G265-A269 PolarHBondContact O-N 2.65Å; G265-F375 VanDerWaalsContact CA-CE2 3.5Å
266	V	98.3	Very high	97.4	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-61.8	-44.5	174.2	173.2	0	0	0	0	111.1	V178 Y182 T262 A264 H268 V270 L317	V178-V266 HydrophobicContact CG1-CG1 4.14Å; V178-V266 HydrophobicContact CG1-CG2 4.39Å; V178-V266 HydrophobicContact CG2-CG1 4.39Å; Y182-V266 HydrophobicContact CD2-CG2 4.42Å; T262-V266 WeakPolarHBondContact O-CG2 3.13Å; T262-V266 PolarHBondContact O-N 2.99Å; A264-V266 PolarHBondContact O-N 3.25Å; V266-H268 PolarHBondContact O-N 3.16Å; V266-V270 HydrophobicContact CG1-CG2 4.19Å; V266-V270 VanDerWaalsContact O-CB 3.24Å; V266-V270 WeakPolarHBondContact O-CB 3.45Å; V266-V270 WeakPolarHBondContact O-CG2 3.33Å; V266-V270 PolarHBondContact O-N 3.34Å; V266-L317 HydrophobicContact CB-CD1 4.23Å; V266-L317 HydrophobicContact CG2-CD1 4.06Å
267	S	98.5	Very high	97	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63.8	-43	-179.5	-50.2	0	0	0	0	112	S263 A264 T271 S313 R343	S263-S267 PolarHBondContact O-N 2.91Å; S263-S267 VanDerWaalsContact O-N 3.15Å; S263-S267 PolarHBondContact O-OG 2.82Å; A264-S267 PolarHBondContact O-N 3.32Å; S267-T271 VanDerWaalsContact O-CB 3.26Å; S267-T271 WeakPolarHBondContact O-CB 3.18Å; S267-T271 PolarHBondContact O-N 2.96Å; S267-T271 PolarHBondContact O-OG1 2.04Å; S267-S313 WeakPolarHBondContact OG-CB 3.42Å; S267-S313 PolarHBondContact OG-OG 3.34Å; S267-R343 WeakPolarHBondContact OG-CG 3.09Å
268	H	98.4	Very high	96.1	Very high	19 Å²	19	18.5 Å²	18.5	9%	0.088	11%	0.114	C	C	.	.	H	α-helix	trans	-64.7	-52.4	179	-172.1	-70.9	0	0	0	111.4	M184 A264 G265 V266 V270 T271 K272 L372 P373 F375	M184-H268 HydrophobicContact CE-CB 3.92Å; A264-H268 VanDerWaalsContact O-CB 3.3Å; A264-H268 WeakPolarHBondContact O-CB 3.4Å; A264-H268 PolarHBondContact O-N 2.92Å; G265-H268 PolarHBondContact O-N 3.41Å; V266-H268 PolarHBondContact O-N 3.16Å; H268-V270 PolarHBondContact O-N 3.35Å; H268-T271 PolarHBondContact O-N 2.59Å; H268-K272 WeakPolarHBondContact O-CB 3.34Å; H268-K272 PolarHBondContact O-N 2.83Å; H268-L372 WeakPolarHBondContact O-CD1 3.18Å; H268-P373 PolarHBondContact NE2-O 3.2Å; H268-F375 HydrophobicContact CB-CD2 4.2Å; H268-F375 HydrophobicContact CB-CE2 4.31Å; H268-F375 AromaticContact CD2-CD2 3.95Å; H268-F375 AromaticContact CG-CD2 3.99Å
269	A	97.6	Very high	95.2	Very high	9 Å²	9	19.3 Å²	19.3	7%	0.074	12%	0.118	C	C	.	.	H	α-helix	trans	-67.5	-39.2	-177.8	0	0	0	0	0	113.2	S177 M184 G265 K272 A273	S177-A269 WeakPolarHBondContact O-CB 3.05Å; M184-A269 HydrophobicContact CE-CB 4.48Å; G265-A269 WeakPolarHBondContact O-CB 3.03Å; G265-A269 PolarHBondContact O-N 2.65Å; A269-K272 PolarHBondContact O-N 3.46Å; A269-A273 WeakPolarHBondContact O-CB 3.29Å; A269-A273 PolarHBondContact O-N 3.1Å
270	V	96.3	Very high	94.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.8	-47	174.3	164.8	0	0	0	0	110.6	L174 V178 V266 H268 K272 A273 C274 F308 F312	L174-V270 HydrophobicContact CD1-CG1 4.09Å; L174-V270 HydrophobicContact CD1-CG2 4.47Å; L174-V270 HydrophobicContact CD2-CG1 3.79Å; L174-V270 HydrophobicContact CD2-CG2 4.45Å; L174-V270 HydrophobicContact CG-CG1 4.18Å; L174-V270 HydrophobicContact CG-CG2 4.21Å; V178-V270 HydrophobicContact CG2-CG2 3.7Å; V266-V270 HydrophobicContact CG1-CG2 4.19Å; V266-V270 VanDerWaalsContact O-CB 3.24Å; V266-V270 WeakPolarHBondContact O-CB 3.45Å; V266-V270 WeakPolarHBondContact O-CG2 3.33Å; V266-V270 PolarHBondContact O-N 3.34Å; H268-V270 PolarHBondContact O-N 3.35Å; V270-K272 VanDerWaalsContact C-N 3.3Å; V270-K272 PolarHBondContact O-N 3.37Å; V270-A273 PolarHBondContact O-N 2.91Å; V270-C274 PolarHBondContact O-N 2.96Å; V270-C274 VanDerWaalsContact O-N 3.1Å; V270-C274 PolarHBondContact O-SG 3.48Å; V270-F308 HydrophobicContact CG1-CD1 4.12Å; V270-F308 HydrophobicContact CG1-CE1 3.96Å; V270-F312 HydrophobicContact CG1-CB 4.22Å; V270-F312 HydrophobicContact CG1-CG 4.37Å; V270-F312 HydrophobicContact CG2-CD1 4.2Å
271	T	97.1	Very high	93.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.8	-45.1	177.2	-59	0	0	0	0	110.9	S267 H268 A273 C274 S275 D304 N305 I306 G309 L372	S267-T271 VanDerWaalsContact O-CB 3.26Å; S267-T271 WeakPolarHBondContact O-CB 3.18Å; S267-T271 PolarHBondContact O-N 2.96Å; S267-T271 PolarHBondContact O-OG1 2.04Å; H268-T271 PolarHBondContact O-N 2.59Å; T271-A273 VanDerWaalsContact C-N 3.34Å; T271-A273 PolarHBondContact O-N 3.22Å; T271-C274 WeakPolarHBondContact O-CB 3.26Å; T271-C274 PolarHBondContact O-N 2.88Å; T271-S275 PolarHBondContact O-N 3.19Å; T271-S275 PolarHBondContact O-OG 3.45Å; T271-D304 HydrophobicContact CG2-CB 3.77Å; T271-N305 VanDerWaalsContact CG2-C 3.46Å; T271-I306 HydrophobicContact CG2-CB 4.42Å; T271-G309 WeakPolarHBondContact OG1-CA 3.39Å; T271-L372 HydrophobicContact CG2-CD1 3.91Å; T271-L372 HydrophobicContact CG2-CD2 3.98Å; T271-L372 HydrophobicContact CG2-CG 4.1Å
272	K	96.1	Very high	93.3	Very high	107 Å²	107	32.2 Å²	32.2	47%	0.465	19%	0.188	S	C	.	.	H	α-helix	trans	-65.2	-37.1	-178.9	-170.9	56.9	178.1	175	0	113	H268 A269 V270 C274 S275 S276 L372	H268-K272 WeakPolarHBondContact O-CB 3.34Å; H268-K272 PolarHBondContact O-N 2.83Å; A269-K272 PolarHBondContact O-N 3.46Å; V270-K272 VanDerWaalsContact C-N 3.3Å; V270-K272 PolarHBondContact O-N 3.37Å; K272-C274 VanDerWaalsContact C-N 3.34Å; K272-S275 PolarHBondContact O-OG 2.98Å; K272-S275 VanDerWaalsContact O-OG 3.13Å; K272-S276 WeakPolarHBondContact O-CB 3.36Å; K272-S276 PolarHBondContact O-N 3.46Å; K272-S276 PolarHBondContact O-OG 3.21Å; K272-L372 HydrophobicContact CB-CD1 3.86Å; K272-L372 HydrophobicContact CD-CD1 4.41Å
273	A	94.4	Very high	93	Very high	7 Å²	7	33.2 Å²	33.2	6%	0.058	20%	0.2	C	C	.	.	H	α-helix	trans	-66	-37.4	175.5	0	0	0	0	0	112.2	L174 S177 A269 V270 T271 S276 L278	L174-A273 HydrophobicContact CD1-CB 4.37Å; S177-A273 WeakPolarHBondContact OG-CB 3.41Å; A269-A273 WeakPolarHBondContact O-CB 3.29Å; A269-A273 PolarHBondContact O-N 3.1Å; V270-A273 PolarHBondContact O-N 2.91Å; T271-A273 VanDerWaalsContact C-N 3.34Å; T271-A273 PolarHBondContact O-N 3.22Å; A273-S276 PolarHBondContact O-OG 3.46Å; A273-S276 VanDerWaalsContact O-OG 3.06Å; A273-L278 HydrophobicContact CB-CB 4.44Å; A273-L278 HydrophobicContact CB-CD2 4.12Å; A273-L278 VanDerWaalsContact O-CB 3.29Å; A273-L278 WeakPolarHBondContact O-CB 3.31Å; A273-L278 PolarHBondContact O-N 2.91Å; A273-L278 VanDerWaalsContact O-N 3.09Å
274	C	95.5	Very high	92.9	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.014	22%	0.215	C	C	.	.	H	α-helix	trans	-66.4	-47.3	175.3	-66.1	0	0	0	0	111.8	V270 T271 K272 S276 G277 C282 F308	V270-C274 PolarHBondContact O-N 2.96Å; V270-C274 VanDerWaalsContact O-N 3.1Å; V270-C274 PolarHBondContact O-SG 3.48Å; T271-C274 WeakPolarHBondContact O-CB 3.26Å; T271-C274 PolarHBondContact O-N 2.88Å; K272-C274 VanDerWaalsContact C-N 3.34Å; C274-S276 VanDerWaalsContact C-N 3.31Å; C274-S276 PolarHBondContact O-N 3.25Å; C274-G277 PolarHBondContact O-N 3.35Å; C274-C282 WeakPolarHBondContact CA-SG 3.38Å; C274-C282 HydrophobicContact CB-CB 3.68Å; C274-C282 WeakPolarHBondContact CB-SG 3.16Å; C274-C282 WeakPolarHBondContact SG-CB 3.21Å; C274-C282 CovalentContact SG-SG 2.03Å; C274-C282 PolarHBondContact SG-SG 3.32Å; C274-F308 VanDerWaalsContact SG-CD1 3.59Å; C274-F308 WeakPolarHBondContact SG-CE1 3.39Å
275	S	94.8	Very high	92.6	Very high	17 Å²	17	35.9 Å²	35.9	12%	0.119	22%	0.217	C	C	.	.	H	α-helix	trans	-71.5	-23.8	-179.9	60.6	0	0	0	0	113.7	T271 K272 G277 C302 D304	T271-S275 PolarHBondContact O-N 3.19Å; T271-S275 PolarHBondContact O-OG 3.45Å; K272-S275 PolarHBondContact O-OG 2.98Å; K272-S275 VanDerWaalsContact O-OG 3.13Å; S275-G277 PolarHBondContact O-N 3.26Å; S275-C302 PolarHBondContact O-SG 3.33Å; S275-D304 WeakPolarHBondContact CB-OD1 3.41Å; S275-D304 PolarHBondContact OG-OD1 3.14Å
276	S	92.4	Very high	92.3	Very high	43 Å²	43	43.3 Å²	43.3	30%	0.301	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	0.1	172.3	71.5	0	0	0	0	113.9	K272 A273 C274 L278	K272-S276 WeakPolarHBondContact O-CB 3.36Å; K272-S276 PolarHBondContact O-N 3.46Å; K272-S276 PolarHBondContact O-OG 3.21Å; A273-S276 PolarHBondContact O-OG 3.46Å; A273-S276 VanDerWaalsContact O-OG 3.06Å; C274-S276 VanDerWaalsContact C-N 3.31Å; C274-S276 PolarHBondContact O-N 3.25Å; S276-L278 VanDerWaalsContact C-N 3.32Å; S276-L278 PolarHBondContact O-N 2.04Å
277	G	90.5	Very high	91.8	Very high	61 Å²	61	45.6 Å²	45.6	63%	0.629	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	20.8	-179	0	0	0	0	0	114.4	C274 S275 H279	C274-G277 PolarHBondContact O-N 3.35Å; S275-G277 PolarHBondContact O-N 3.26Å; G277-H279 PolarHBondContact O-N 3.29Å
278	L	80.7	Confident	91.1	Very high	111 Å²	111	45.6 Å²	45.6	58%	0.581	26%	0.259	S	S	*	.			trans	-71.5	-19	-178.7	-171.2	62.6	0	0	0	112.8	A273 S276	A273-L278 HydrophobicContact CB-CB 4.44Å; A273-L278 HydrophobicContact CB-CD2 4.12Å; A273-L278 VanDerWaalsContact O-CB 3.29Å; A273-L278 WeakPolarHBondContact O-CB 3.31Å; A273-L278 PolarHBondContact O-N 2.91Å; A273-L278 VanDerWaalsContact O-N 3.09Å; S276-L278 VanDerWaalsContact C-N 3.32Å; S276-L278 PolarHBondContact O-N 2.04Å
279	H	79.1	Confident	90.4	Very high	17 Å²	17	50.3 Å²	50.3	8%	0.079	28%	0.277	C	S	.	.			trans	-141.9	130.6	-172.7	-167	-27.3	0	0	0	112.5	G277 N281	G277-H279 PolarHBondContact O-N 3.29Å; H279-N281 VanDerWaalsContact C-N 3.32Å; H279-N281 VanDerWaalsContact CE1-CB 3.43Å; H279-N281 WeakPolarHBondContact CE1-CB 3.48Å; H279-N281 PolarHBondContact CE1-ND2 3.25Å; H279-N281 PolarHBondContact ND1-N 3.46Å; H279-N281 PolarHBondContact O-N 3.5Å
280	D	82.5	Confident	89.8	Confident	161 Å²	161	56.2 Å²	56.2	86%	0.861	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-21.7	179.8	-59.9	-17.3	0	0	0	116	C282	D280-C282 VanDerWaalsContact C-N 3.32Å
281	N	82.3	Confident	89	Confident	95 Å²	95	60.2 Å²	60.2	51%	0.508	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-4.6	-173.9	-67.8	-11.3	0	0	0	113.1	Y171 H279	Y171-N281 HydrophobicContact CD1-CB 4.47Å; Y171-N281 HydrophobicContact CE1-CB 4.17Å; H279-N281 VanDerWaalsContact C-N 3.32Å; H279-N281 VanDerWaalsContact CE1-CB 3.43Å; H279-N281 WeakPolarHBondContact CE1-CB 3.48Å; H279-N281 PolarHBondContact CE1-ND2 3.25Å; H279-N281 PolarHBondContact ND1-N 3.46Å; H279-N281 PolarHBondContact O-N 3.5Å
282	C	91.1	Very high	88.2	Confident	22 Å²	22	65.1 Å²	65.1	15%	0.149	36%	0.358	C	S	.	.			trans	-148	167.7	178.4	61.3	0	0	0	0	110	C274 D280 F308	C274-C282 WeakPolarHBondContact CA-SG 3.38Å; C274-C282 HydrophobicContact CB-CB 3.68Å; C274-C282 WeakPolarHBondContact CB-SG 3.16Å; C274-C282 WeakPolarHBondContact SG-CB 3.21Å; C274-C282 CovalentContact SG-SG 2.03Å; C274-C282 PolarHBondContact SG-SG 3.32Å; D280-C282 VanDerWaalsContact C-N 3.32Å; C282-F308 HydrophobicContact CB-CD1 3.95Å; C282-F308 HydrophobicContact CB-CD2 4.27Å; C282-F308 HydrophobicContact CB-CE1 3.57Å; C282-F308 HydrophobicContact CB-CE2 3.89Å; C282-F308 HydrophobicContact CB-CG 4.3Å; C282-F308 HydrophobicContact CB-CZ 3.53Å
283	G	92.4	Very high	87.3	Confident	27 Å²	27	71.5 Å²	71.5	28%	0.278	38%	0.379	S	S	.	.			trans	-168	-159.6	-177.5	0	0	0	0	0	112
284	C	94.7	Very high	86.8	Confident	47 Å²	47	75.5 Å²	75.5	32%	0.318	40%	0.397	S	S	.	.			trans	-63.4	153.6	176.2	-42.1	0	0	0	0	112	R286 C302 S303	C284-R286 PolarHBondContact O-N 3.4Å; C284-C302 HydrophobicContact CB-CB 3.96Å; C284-C302 WeakPolarHBondContact CB-SG 3.47Å; C284-C302 VanDerWaalsContact SG-CA 3.56Å; C284-C302 WeakPolarHBondContact SG-CB 3.28Å; C284-C302 CovalentContact SG-SG 2.02Å; C284-C302 PolarHBondContact SG-SG 3.22Å; C284-S303 CarbonylContact C-O 3.6Å; C284-S303 VanDerWaalsContact CA-O 3.25Å; C284-S303 WeakPolarHBondContact CA-O 3.25Å
285	D	94.3	Very high	86.1	Confident	8 Å²	8	80.8 Å²	80.8	4%	0.043	43%	0.431	C	S	.	.	B	Isolated β-bridge	trans	-72.2	115.5	167.1	-173.7	2	0	0	0	109.7	T287 I288 S303 N305	D285-T287 VanDerWaalsContact CG-OG1 3.31Å; D285-T287 WeakPolarHBondContact OD1-CB 3.25Å; D285-T287 PolarHBondContact OD1-N 3.21Å; D285-T287 PolarHBondContact OD1-OG1 3.16Å; D285-T287 PolarHBondContact OD2-OG1 3.21Å; D285-I288 HydrophobicContact CB-CG2 4.49Å; D285-S303 PolarHBondContact N-O 3.4Å; D285-N305 HydrophobicContact CB-CB 3.95Å
286	R	90.8	Very high	85.6	Confident	156 Å²	156	85 Å²	85	59%	0.589	45%	0.452	S	S	*	.			trans	-93.3	-10.2	178.4	-63.3	-172.9	178.2	-165.8	-0.7	112.9	T98 C284 I288 Y289	T98-R286 VanDerWaalsContact CG2-NH1 3.34Å; C284-R286 PolarHBondContact O-N 3.4Å; R286-I288 PolarHBondContact O-N 2.84Å; R286-Y289 WeakPolarHBondContact O-CD2 3.48Å; R286-Y289 PolarHBondContact O-N 2.76Å
287	T	88.4	Confident	85.4	Confident	48 Å²	48	84.6 Å²	84.6	29%	0.294	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-68.6	-14.4	179.7	67.2	0	0	0	0	112.4	D285 Y289 D290	D285-T287 VanDerWaalsContact CG-OG1 3.31Å; D285-T287 WeakPolarHBondContact OD1-CB 3.25Å; D285-T287 PolarHBondContact OD1-N 3.21Å; D285-T287 PolarHBondContact OD1-OG1 3.16Å; D285-T287 PolarHBondContact OD2-OG1 3.21Å; T287-Y289 PolarHBondContact O-N 2.86Å; T287-D290 WeakPolarHBondContact O-CB 3.42Å; T287-D290 PolarHBondContact O-N 3.05Å
288	I	84.1	Confident	85.4	Confident	0 Å²	0	88.4 Å²	88.4	0%	0	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-59.3	-29.6	174.8	70.2	179.2	0	0	0	113.1	D285 R286 D290 H291 W299 S303 R370	D285-I288 HydrophobicContact CB-CG2 4.49Å; R286-I288 PolarHBondContact O-N 2.84Å; I288-D290 PolarHBondContact O-N 3.27Å; I288-H291 WeakPolarHBondContact O-CB 3.24Å; I288-H291 PolarHBondContact O-N 3.24Å; I288-W299 HydrophobicContact CB-CD2 4.43Å; I288-W299 HydrophobicContact CB-CE3 4.29Å; I288-S303 WeakPolarHBondContact CD1-OG 3.33Å; I288-S303 WeakPolarHBondContact CG2-OG 3.47Å; I288-R370 HydrophobicContact CG2-CG 4.4Å
289	Y	82.5	Confident	85.9	Confident	118 Å²	118	85 Å²	85	46%	0.463	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-77.5	-12.1	-179	-62.1	-71.7	0	0	0	112.1	R286 T287 W299 G301	R286-Y289 WeakPolarHBondContact O-CD2 3.48Å; R286-Y289 PolarHBondContact O-N 2.76Å; T287-Y289 PolarHBondContact O-N 2.86Å; Y289-W299 WeakPolarHBondContact CE1-O 3.27Å; Y289-G301 PolarHBondContact OH-N 3.27Å; Y289-G301 PolarHBondContact OH-O 2.83Å
290	D	84.9	Confident	86.4	Confident	134 Å²	134	86.5 Å²	86.5	72%	0.717	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-87.8	-8	175.2	-53.9	-37.6	0	0	0	111.9	T287 I288	T287-D290 WeakPolarHBondContact O-CB 3.42Å; T287-D290 PolarHBondContact O-N 3.05Å; I288-D290 PolarHBondContact O-N 3.27Å
291	H	79.4	Confident	86.8	Confident	84 Å²	84	81 Å²	81	39%	0.389	42%	0.419	S	S	.	.	S	Bend	trans	-70.5	148	175.5	-72.1	-47.1	0	0	0	111.7	I288	I288-H291 WeakPolarHBondContact O-CB 3.24Å; I288-H291 PolarHBondContact O-N 3.24Å
292	P	81.4	Confident	87.4	Confident	102 Å²	102	78.4 Å²	78.4	66%	0.662	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-52.3	145.4	172.5	-24.6	33.9	0	0	0	111.5	E294	P292-E294 PolarHBondContact O-N 3.08Å
293	R	77.5	Confident	87.6	Confident	242 Å²	242	77.3 Å²	77.3	91%	0.913	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-60	124.8	174.5	-72.5	-174.3	175.8	-172.6	-3.1	109.4
294	E	82.8	Confident	87.8	Confident	91 Å²	91	76.3 Å²	76.3	43%	0.425	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-82	143.2	173.8	-66.7	-72.1	176.2	0	0	109.1	P292 N296 F297	P292-E294 PolarHBondContact O-N 3.08Å; E294-N296 VanDerWaalsContact C-N 3.26Å; E294-N296 PolarHBondContact O-N 3.31Å; E294-F297 HydrophobicContact CB-CD1 3.92Å; E294-F297 HydrophobicContact CB-CE1 3.68Å; E294-F297 HydrophobicContact CB-CE2 4.35Å; E294-F297 HydrophobicContact CB-CG 4.37Å; E294-F297 HydrophobicContact CB-CZ 3.93Å; E294-F297 HydrophobicContact CG-CD1 4.46Å; E294-F297 HydrophobicContact CG-CE1 3.73Å; E294-F297 HydrophobicContact CG-CE2 4.2Å; E294-F297 HydrophobicContact CG-CZ 3.59Å
295	P	81.4	Confident	87.8	Confident	112 Å²	112	74.4 Å²	74.4	73%	0.727	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-26.2	-174.2	24.5	-33.1	0	0	0	113.5
296	N	84.5	Confident	87.9	Confident	107 Å²	107	74.1 Å²	74.1	57%	0.572	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	2.4	-165.4	-60.8	-23.2	0	0	0	114	E294 R366	E294-N296 VanDerWaalsContact C-N 3.26Å; E294-N296 PolarHBondContact O-N 3.31Å; N296-R366 PolarHBondContact O-NE 2.88Å
297	F	88.8	Confident	88.1	Confident	34 Å²	34	72 Å²	72	15%	0.149	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-166	160.8	176.8	70.9	-92.3	0	0	0	111.7	E294 W299 V352 R366 C368	E294-F297 HydrophobicContact CB-CD1 3.92Å; E294-F297 HydrophobicContact CB-CE1 3.68Å; E294-F297 HydrophobicContact CB-CE2 4.35Å; E294-F297 HydrophobicContact CB-CG 4.37Å; E294-F297 HydrophobicContact CB-CZ 3.93Å; E294-F297 HydrophobicContact CG-CD1 4.46Å; E294-F297 HydrophobicContact CG-CE1 3.73Å; E294-F297 HydrophobicContact CG-CE2 4.2Å; E294-F297 HydrophobicContact CG-CZ 3.59Å; F297-W299 AromaticContact CE2-CD2 3.79Å; F297-W299 HydrophobicContact CE2-CD2 3.79Å; F297-W299 AromaticContact CE2-CE2 3.66Å; F297-W299 HydrophobicContact CE2-CE3 4.11Å; F297-W299 HydrophobicContact CE2-CG 4.27Å; F297-W299 HydrophobicContact CE2-CH2 4.21Å; F297-W299 AromaticContact CE2-CZ2 3.9Å; F297-W299 HydrophobicContact CE2-CZ2 3.9Å; F297-W299 HydrophobicContact CE2-CZ3 4.31Å; F297-W299 AromaticContact CZ-CE2 4Å; F297-W299 HydrophobicContact CZ-CH2 4.23Å; F297-W299 AromaticContact CZ-CZ2 3.83Å; F297-W299 HydrophobicContact CZ-CZ2 3.83Å; F297-V352 HydrophobicContact CZ-CG1 4.43Å; F297-R366 WeakPolarHBondContact CA-O 3.31Å; F297-R366 HydrophobicContact CB-CG 3.65Å; F297-R366 WeakPolarHBondContact CB-O 3.4Å; F297-C368 VanDerWaalsContact CB-SG 3.54Å; F297-C368 HydrophobicContact CD2-CB 3.45Å; F297-C368 VanDerWaalsContact CD2-CB 3.45Å; F297-C368 WeakPolarHBondContact CD2-SG 3.24Å; F297-C368 HydrophobicContact CE2-CB 3.61Å; F297-C368 HydrophobicContact CG-CB 4.11Å; F297-C368 WeakPolarHBondContact CG-SG 3.44Å; F297-C368 HydrophobicContact CZ-CB 4.36Å
298	E	90.1	Very high	88.4	Confident	140 Å²	140	71.3 Å²	71.3	65%	0.654	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	138.7	171.5	-62.7	-174.4	160.3	0	0	111.2	S300 R366 T367 C368	E298-S300 PolarHBondContact O-N 2.89Å; E298-R366 PolarHBondContact N-O 2.78Å; E298-T367 CarbonylContact O-C 3.47Å; E298-T367 VanDerWaalsContact O-CA 3.28Å; E298-T367 WeakPolarHBondContact O-CA 3.49Å; E298-C368 PolarHBondContact O-N 2.62Å
299	W	91.6	Very high	89	Confident	40 Å²	40	71.3 Å²	71.3	15%	0.152	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	126.7	169.9	-71.4	109.1	0	0	0	109.7	I288 Y289 F297 V352 R370	I288-W299 HydrophobicContact CB-CD2 4.43Å; I288-W299 HydrophobicContact CB-CE3 4.29Å; Y289-W299 WeakPolarHBondContact CE1-O 3.27Å; F297-W299 AromaticContact CE2-CD2 3.79Å; F297-W299 HydrophobicContact CE2-CD2 3.79Å; F297-W299 AromaticContact CE2-CE2 3.66Å; F297-W299 HydrophobicContact CE2-CE3 4.11Å; F297-W299 HydrophobicContact CE2-CG 4.27Å; F297-W299 HydrophobicContact CE2-CH2 4.21Å; F297-W299 AromaticContact CE2-CZ2 3.9Å; F297-W299 HydrophobicContact CE2-CZ2 3.9Å; F297-W299 HydrophobicContact CE2-CZ3 4.31Å; F297-W299 AromaticContact CZ-CE2 4Å; F297-W299 HydrophobicContact CZ-CH2 4.23Å; F297-W299 AromaticContact CZ-CZ2 3.83Å; F297-W299 HydrophobicContact CZ-CZ2 3.83Å; W299-V352 HydrophobicContact CH2-CG1 4.2Å; W299-V352 HydrophobicContact CH2-CG2 3.88Å; W299-V352 HydrophobicContact CZ3-CG1 4.29Å; W299-V352 HydrophobicContact CZ3-CG2 4.5Å; W299-R370 HydrophobicContact CH2-CG 3.96Å; W299-R370 HydrophobicContact CZ3-CG 3.77Å
300	S	89.8	Confident	89.7	Confident	49 Å²	49	66 Å²	66	34%	0.343	34%	0.341	S	S	.	.			trans	-154.6	-177.8	178.6	-162	0	0	0	0	111.3	E298 C368 W369	E298-S300 PolarHBondContact O-N 2.89Å; S300-C368 PolarHBondContact N-O 3.32Å; S300-W369 WeakPolarHBondContact O-CB 3.48Å
301	G	90.2	Very high	90.1	Very high	44 Å²	44	61.9 Å²	61.9	45%	0.454	32%	0.317	S	S	.	.	S	Bend	trans	70.6	-154	174.9	0	0	0	0	0	114	Y289	Y289-G301 PolarHBondContact OH-N 3.27Å; Y289-G301 PolarHBondContact OH-O 2.83Å
302	C	94.2	Very high	90.9	Very high	41 Å²	41	58.3 Å²	58.3	28%	0.277	30%	0.3	S	S	.	.			trans	-110.1	100.3	-178.4	-177	0	0	0	0	109.9	S275 C284	S275-C302 PolarHBondContact O-SG 3.33Å; C284-C302 HydrophobicContact CB-CB 3.96Å; C284-C302 WeakPolarHBondContact CB-SG 3.47Å; C284-C302 VanDerWaalsContact SG-CA 3.56Å; C284-C302 WeakPolarHBondContact SG-CB 3.28Å; C284-C302 CovalentContact SG-SG 2.02Å; C284-C302 PolarHBondContact SG-SG 3.22Å
303	S	95.3	Very high	91.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-74.9	138.3	170.9	-71	0	0	0	0	111	C284 D285 I288 N305 R370	C284-S303 CarbonylContact C-O 3.6Å; C284-S303 VanDerWaalsContact CA-O 3.25Å; C284-S303 WeakPolarHBondContact CA-O 3.25Å; D285-S303 PolarHBondContact N-O 3.4Å; I288-S303 WeakPolarHBondContact CD1-OG 3.33Å; I288-S303 WeakPolarHBondContact CG2-OG 3.47Å; S303-N305 PolarHBondContact O-N 3.24Å; S303-R370 CarbonylContact C-O 3.52Å; S303-R370 VanDerWaalsContact CA-O 3.28Å; S303-R370 WeakPolarHBondContact CA-O 3.3Å; S303-R370 PolarHBondContact OG-N 2.88Å
304	D	96.4	Very high	92.6	Very high	6 Å²	6	43.1 Å²	43.1	3%	0.032	23%	0.23	C	C	.	.			trans	-68.7	116.2	178.4	-79.4	-37.4	0	0	0	110.6	T271 S275 I306 M350 R370 S371 L372	T271-D304 HydrophobicContact CG2-CB 3.77Å; S275-D304 WeakPolarHBondContact CB-OD1 3.41Å; S275-D304 PolarHBondContact OG-OD1 3.14Å; D304-I306 VanDerWaalsContact C-N 3.3Å; D304-I306 PolarHBondContact O-N 3.5Å; D304-M350 HydrophobicContact CB-CE 3.86Å; D304-M350 WeakPolarHBondContact O-CE 3.34Å; D304-R370 PolarHBondContact N-O 2.86Å; D304-S371 WeakPolarHBondContact OD2-CA 3.29Å; D304-L372 HydrophobicContact CB-CD1 4.42Å; D304-L372 HydrophobicContact CB-CG 3.87Å; D304-L372 WeakPolarHBondContact OD2-CG 3.45Å; D304-L372 PolarHBondContact OD2-N 2.96Å
305	N	95.8	Very high	93.1	Very high	6 Å²	6	41.8 Å²	41.8	3%	0.032	22%	0.224	C	C	.	.			trans	-78.9	74.8	177.9	-170.5	-15.9	0	0	0	111.9	Y95 T271 D285 S303 Y307 F308 G309	Y95-N305 PolarHBondContact OH-ND2 3.2Å; Y95-N305 VanDerWaalsContact OH-ND2 3.12Å; T271-N305 VanDerWaalsContact CG2-C 3.46Å; D285-N305 HydrophobicContact CB-CB 3.95Å; S303-N305 PolarHBondContact O-N 3.24Å; N305-Y307 PolarHBondContact O-N 2.84Å; N305-Y307 PolarHBondContact OD1-N 3.29Å; N305-F308 HydrophobicContact CB-CB 4.34Å; N305-F308 WeakPolarHBondContact O-CB 3.25Å; N305-F308 PolarHBondContact O-N 3.43Å; N305-F308 PolarHBondContact OD1-N 3.4Å; N305-F308 VanDerWaalsContact OD1-N 3.1Å; N305-G309 PolarHBondContact O-N 3.33Å
306	I	96.1	Very high	93.8	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-62.2	-29.3	-178.3	-175.9	53.4	0	0	0	113	T271 D304 F308 G309 A310 V346 I347 M350 L372	T271-I306 HydrophobicContact CG2-CB 4.42Å; D304-I306 VanDerWaalsContact C-N 3.3Å; D304-I306 PolarHBondContact O-N 3.5Å; I306-F308 VanDerWaalsContact C-N 3.31Å; I306-F308 PolarHBondContact O-N 3.47Å; I306-G309 PolarHBondContact O-N 3.27Å; I306-A310 VanDerWaalsContact O-CB 3.29Å; I306-A310 WeakPolarHBondContact O-CB 3.49Å; I306-A310 PolarHBondContact O-N 3.11Å; I306-V346 HydrophobicContact CD1-CB 3.91Å; I306-V346 HydrophobicContact CD1-CG1 3.36Å; I306-V346 HydrophobicContact CG1-CB 4.32Å; I306-V346 HydrophobicContact CG1-CG1 3.93Å; I306-I347 HydrophobicContact CG1-CG1 3.68Å; I306-I347 HydrophobicContact CG2-CG1 4.19Å; I306-M350 HydrophobicContact CB-CE 4.27Å; I306-M350 HydrophobicContact CB-CG 4.36Å; I306-M350 HydrophobicContact CB-SD 3.78Å; I306-M350 HydrophobicContact CG1-SD 4.28Å; I306-M350 HydrophobicContact CG2-CE 4.07Å; I306-M350 HydrophobicContact CG2-CG 3.78Å; I306-M350 HydrophobicContact CG2-SD 3.8Å; I306-L372 HydrophobicContact CB-CD2 4.42Å; I306-L372 HydrophobicContact CD1-CD2 3.84Å; I306-L372 HydrophobicContact CG1-CD2 4.4Å
307	Y	95.2	Very high	94.3	Very high	111 Å²	111	33.1 Å²	33.1	44%	0.435	17%	0.171	S	C	.	.	H	α-helix	trans	-63.2	-39.4	177.9	-66.8	-72.9	0	0	0	111.6	N305 E311 I347	N305-Y307 PolarHBondContact O-N 2.84Å; N305-Y307 PolarHBondContact OD1-N 3.29Å; Y307-E311 WeakPolarHBondContact O-CB 3.44Å; Y307-E311 PolarHBondContact O-N 3.29Å; Y307-I347 HydrophobicContact CD1-CD1 4.41Å; Y307-I347 HydrophobicContact CE1-CD1 4.42Å; Y307-I347 HydrophobicContact CE1-CG2 4Å
308	F	94.8	Very high	94.6	Very high	34 Å²	34	31.6 Å²	31.6	15%	0.149	16%	0.164	C	C	.	.	H	α-helix	trans	-60.5	-50.2	172.9	179.5	-89.5	0	0	0	111.7	Y171 L174 V270 C274 C282 N305 I306 E311 F312	Y171-F308 HydrophobicContact CE1-CZ 4.25Å; L174-F308 HydrophobicContact CD2-CE1 4.1Å; L174-F308 HydrophobicContact CD2-CZ 4.46Å; V270-F308 HydrophobicContact CG1-CD1 4.12Å; V270-F308 HydrophobicContact CG1-CE1 3.96Å; C274-F308 VanDerWaalsContact SG-CD1 3.59Å; C274-F308 WeakPolarHBondContact SG-CE1 3.39Å; C282-F308 HydrophobicContact CB-CD1 3.95Å; C282-F308 HydrophobicContact CB-CD2 4.27Å; C282-F308 HydrophobicContact CB-CE1 3.57Å; C282-F308 HydrophobicContact CB-CE2 3.89Å; C282-F308 HydrophobicContact CB-CG 4.3Å; C282-F308 HydrophobicContact CB-CZ 3.53Å; N305-F308 HydrophobicContact CB-CB 4.34Å; N305-F308 WeakPolarHBondContact O-CB 3.25Å; N305-F308 PolarHBondContact O-N 3.43Å; N305-F308 PolarHBondContact OD1-N 3.4Å; N305-F308 VanDerWaalsContact OD1-N 3.1Å; I306-F308 VanDerWaalsContact C-N 3.31Å; I306-F308 PolarHBondContact O-N 3.47Å; F308-E311 PolarHBondContact O-N 3.02Å; F308-F312 WeakPolarHBondContact O-CB 3.29Å; F308-F312 PolarHBondContact O-N 3.2Å
309	G	96	Very high	94.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-66.5	-41.2	-178	0	0	0	0	0	113.7	T271 N305 I306 F312 S313	T271-G309 WeakPolarHBondContact OG1-CA 3.39Å; N305-G309 PolarHBondContact O-N 3.33Å; I306-G309 PolarHBondContact O-N 3.27Å; G309-F312 PolarHBondContact O-N 2.79Å; G309-S313 WeakPolarHBondContact O-CB 3.39Å; G309-S313 PolarHBondContact O-N 3.18Å
310	A	96.9	Very high	94.7	Very high	8 Å²	8	26.3 Å²	26.3	7%	0.066	14%	0.139	C	C	.	.	H	α-helix	trans	-64	-39.9	175.6	0	0	0	0	0	112.1	I306 R314 R343 I347	I306-A310 VanDerWaalsContact O-CB 3.29Å; I306-A310 WeakPolarHBondContact O-CB 3.49Å; I306-A310 PolarHBondContact O-N 3.11Å; A310-R314 WeakPolarHBondContact O-CB 3.37Å; A310-R314 PolarHBondContact O-N 3.1Å; A310-R343 HydrophobicContact CB-CB 4.24Å; A310-R343 WeakPolarHBondContact O-CD 3.24Å; A310-I347 HydrophobicContact CB-CD1 3.88Å; A310-I347 HydrophobicContact CB-CG1 4.35Å
311	E	94.9	Very high	94.8	Very high	46 Å²	46	24.1 Å²	24.1	22%	0.215	12%	0.123	C	C	.	.	H	α-helix	trans	-69	-41.3	176.6	-179.7	54.7	-153	0	0	111.6	Y307 F308 R314 Q315	Y307-E311 WeakPolarHBondContact O-CB 3.44Å; Y307-E311 PolarHBondContact O-N 3.29Å; F308-E311 PolarHBondContact O-N 3.02Å; E311-R314 VanDerWaalsContact O-CB 3.31Å; E311-R314 WeakPolarHBondContact O-CB 2.98Å; E311-R314 PolarHBondContact O-N 3.16Å; E311-R314 IonicContact OE1-CZ 3.81Å; E311-R314 IonicContact OE1-NE 2.67Å; E311-R314 PolarHBondContact OE1-NE 3.15Å; E311-R314 IonicContact OE1-NH2 2.85Å; E311-R314 PolarHBondContact OE1-NH2 3.08Å; E311-R314 IonicContact OE2-CZ 2.77Å; E311-R314 IonicContact OE2-NE 3.34Å; E311-R314 PolarHBondContact OE2-NE 3.38Å; E311-R314 IonicContact OE2-NH2 3.07Å; E311-R314 PolarHBondContact OE2-NH2 2.91Å; E311-Q315 WeakPolarHBondContact O-CG 3.46Å; E311-Q315 PolarHBondContact O-N 2.96Å; E311-Q315 WeakPolarHBondContact OE1-CG 3.25Å; E311-Q315 PolarHBondContact OE1-NE2 3.3Å
312	F	95.3	Very high	94.9	Very high	9 Å²	9	25.8 Å²	25.8	4%	0.039	12%	0.116	C	C	.	.	H	α-helix	trans	-59	-50.6	172.9	-171.3	-81.3	0	0	0	111.3	Y171 L174 M175 V178 V270 F308 G309 R314 Q315 F316	Y171-F312 HydrophobicContact CD1-CE2 4.44Å; Y171-F312 HydrophobicContact CD2-CD2 4.45Å; Y171-F312 AromaticContact CD2-CE2 3.69Å; Y171-F312 HydrophobicContact CD2-CE2 3.69Å; Y171-F312 HydrophobicContact CE2-CE2 4.33Å; Y171-F312 AromaticContact CG-CE2 3.75Å; Y171-F312 HydrophobicContact CG-CE2 3.75Å; L174-F312 HydrophobicContact CD2-CD2 3.78Å; L174-F312 HydrophobicContact CD2-CE2 3.81Å; L174-F312 HydrophobicContact CD2-CG 4.17Å; L174-F312 HydrophobicContact CD2-CZ 4.24Å; M175-F312 HydrophobicContact CE-CE1 3.91Å; M175-F312 HydrophobicContact CE-CE2 4.42Å; M175-F312 HydrophobicContact CE-CZ 3.39Å; V178-F312 HydrophobicContact CG2-CD1 4.05Å; V178-F312 HydrophobicContact CG2-CE1 3.44Å; V178-F312 VanDerWaalsContact CG2-CE1 3.44Å; V178-F312 HydrophobicContact CG2-CZ 4.23Å; V270-F312 HydrophobicContact CG1-CB 4.22Å; V270-F312 HydrophobicContact CG1-CG 4.37Å; V270-F312 HydrophobicContact CG2-CD1 4.2Å; F308-F312 WeakPolarHBondContact O-CB 3.29Å; F308-F312 PolarHBondContact O-N 3.2Å; G309-F312 PolarHBondContact O-N 2.79Å; F312-R314 VanDerWaalsContact C-N 3.29Å; F312-R314 PolarHBondContact O-N 3.16Å; F312-Q315 PolarHBondContact O-N 2.94Å; F312-Q315 VanDerWaalsContact O-N 3.13Å; F312-F316 HydrophobicContact CD1-CB 4.39Å; F312-F316 HydrophobicContact CE1-CB 3.95Å; F312-F316 HydrophobicContact CE1-CD2 4.31Å; F312-F316 HydrophobicContact CE1-CG 4.17Å; F312-F316 HydrophobicContact CZ-CD2 4.39Å; F312-F316 WeakPolarHBondContact O-CB 3.39Å; F312-F316 PolarHBondContact O-N 2.86Å
313	S	97	Very high	94.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-55.1	-44.4	177.1	179.4	0	0	0	0	111.3	S263 S267 G309 F316 L317	S263-S313 PolarHBondContact O-OG 3.03Å; S263-S313 VanDerWaalsContact O-OG 3.08Å; S263-S313 PolarHBondContact OG-OG 3.48Å; S263-S313 VanDerWaalsContact OG-OG 3.07Å; S267-S313 WeakPolarHBondContact OG-CB 3.42Å; S267-S313 PolarHBondContact OG-OG 3.34Å; G309-S313 WeakPolarHBondContact O-CB 3.39Å; G309-S313 PolarHBondContact O-N 3.18Å; S313-F316 PolarHBondContact O-N 3.03Å; S313-L317 WeakPolarHBondContact O-CB 3.43Å; S313-L317 PolarHBondContact O-N 3.36Å
314	R	97.2	Very high	94.5	Very high	26 Å²	26	29.3 Å²	29.3	10%	0.098	13%	0.129	C	C	.	.	H	α-helix	trans	-55.9	-54.4	173	-167.9	178.7	72.4	74.6	-5.1	112.2	A310 E311 F312 F316 D318	A310-R314 WeakPolarHBondContact O-CB 3.37Å; A310-R314 PolarHBondContact O-N 3.1Å; E311-R314 VanDerWaalsContact O-CB 3.31Å; E311-R314 WeakPolarHBondContact O-CB 2.98Å; E311-R314 PolarHBondContact O-N 3.16Å; E311-R314 IonicContact OE1-CZ 3.81Å; E311-R314 IonicContact OE1-NE 2.67Å; E311-R314 PolarHBondContact OE1-NE 3.15Å; E311-R314 IonicContact OE1-NH2 2.85Å; E311-R314 PolarHBondContact OE1-NH2 3.08Å; E311-R314 IonicContact OE2-CZ 2.77Å; E311-R314 IonicContact OE2-NE 3.34Å; E311-R314 PolarHBondContact OE2-NE 3.38Å; E311-R314 IonicContact OE2-NH2 3.07Å; E311-R314 PolarHBondContact OE2-NH2 2.91Å; F312-R314 VanDerWaalsContact C-N 3.29Å; F312-R314 PolarHBondContact O-N 3.16Å; R314-F316 PolarHBondContact O-N 2.96Å; R314-D318 VanDerWaalsContact CG-OD2 3.29Å; R314-D318 WeakPolarHBondContact CG-OD2 3.3Å; R314-D318 WeakPolarHBondContact O-CB 3.46Å; R314-D318 PolarHBondContact O-N 3.13Å
315	Q	94.8	Very high	94.1	Very high	62 Å²	62	31.9 Å²	31.9	29%	0.29	14%	0.142	S	C	.	.	H	α-helix	trans	-66	-29.1	-174.1	-69.9	-174	33.8	0	0	112.2	L167 E311 F312 V319	L167-Q315 HydrophobicContact CD1-CB 3.84Å; L167-Q315 VanDerWaalsContact CD1-O 3.28Å; L167-Q315 WeakPolarHBondContact CD1-O 3.23Å; E311-Q315 WeakPolarHBondContact O-CG 3.46Å; E311-Q315 PolarHBondContact O-N 2.96Å; E311-Q315 WeakPolarHBondContact OE1-CG 3.25Å; E311-Q315 PolarHBondContact OE1-NE2 3.3Å; F312-Q315 PolarHBondContact O-N 2.94Å; F312-Q315 VanDerWaalsContact O-N 3.13Å; Q315-V319 WeakPolarHBondContact O-CG2 3.41Å
316	F	94.7	Very high	93.8	Very high	9 Å²	9	40.3 Å²	40.3	4%	0.039	18%	0.179	C	C	.	.	H	α-helix	trans	-89.8	-51.9	-176.6	-165.8	-97.2	0	0	0	113.6	F160 Q164 L167 C168 M175 V178 F312 S313 R314	F160-F316 HydrophobicContact CD1-CZ 4.15Å; F160-F316 HydrophobicContact CD2-CZ 4.44Å; F160-F316 HydrophobicContact CE1-CE1 4.18Å; F160-F316 AromaticContact CE1-CZ 3.71Å; F160-F316 HydrophobicContact CE1-CZ 3.71Å; F160-F316 HydrophobicContact CE2-CZ 4.04Å; F160-F316 HydrophobicContact CZ-CE1 4.39Å; F160-F316 AromaticContact CZ-CZ 3.67Å; F160-F316 HydrophobicContact CZ-CZ 3.67Å; Q164-F316 HydrophobicContact CB-CD2 4.48Å; Q164-F316 HydrophobicContact CB-CE2 4.12Å; Q164-F316 WeakPolarHBondContact CG-O 3Å; Q164-F316 PolarHBondContact NE2-O 3.36Å; L167-F316 HydrophobicContact CB-CD2 4.2Å; L167-F316 HydrophobicContact CD1-CD2 4.37Å; C168-F316 HydrophobicContact CB-CE2 4.46Å; M175-F316 HydrophobicContact CE-CE2 4.48Å; M175-F316 HydrophobicContact SD-CE2 4.06Å; M175-F316 HydrophobicContact SD-CZ 4.24Å; V178-F316 HydrophobicContact CG1-CD1 4.11Å; V178-F316 HydrophobicContact CG1-CE1 3.98Å; F312-F316 HydrophobicContact CD1-CB 4.39Å; F312-F316 HydrophobicContact CE1-CB 3.95Å; F312-F316 HydrophobicContact CE1-CD2 4.31Å; F312-F316 HydrophobicContact CE1-CG 4.17Å; F312-F316 HydrophobicContact CZ-CD2 4.39Å; F312-F316 WeakPolarHBondContact O-CB 3.39Å; F312-F316 PolarHBondContact O-N 2.86Å; S313-F316 PolarHBondContact O-N 3.03Å; R314-F316 PolarHBondContact O-N 2.96Å
317	L	95.2	Very high	93.6	Very high	29 Å²	29	50.5 Å²	50.5	15%	0.152	22%	0.217	C	C	.	.	H	α-helix	trans	-78.6	-35.8	-173.7	-61.7	179.2	0	0	0	112.7	V266 S313 V319	V266-L317 HydrophobicContact CB-CD1 4.23Å; V266-L317 HydrophobicContact CG2-CD1 4.06Å; S313-L317 WeakPolarHBondContact O-CB 3.43Å; S313-L317 PolarHBondContact O-N 3.36Å; L317-V319 PolarHBondContact O-N 3.33Å
318	D	95.5	Very high	93.5	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.011	21%	0.213	C	C	.	.	H	α-helix	trans	-73.2	-12.9	-174.4	-67.3	-8.6	0	0	0	113.4	R314 R320 E321 R322 L336 N339 R343	R314-D318 VanDerWaalsContact CG-OD2 3.29Å; R314-D318 WeakPolarHBondContact CG-OD2 3.3Å; R314-D318 WeakPolarHBondContact O-CB 3.46Å; R314-D318 PolarHBondContact O-N 3.13Å; D318-R320 PolarHBondContact O-N 3.42Å; D318-E321 PolarHBondContact O-N 3.4Å; D318-E321 VanDerWaalsContact O-N 3.16Å; D318-R322 HydrophobicContact CB-CG 4.49Å; D318-R322 WeakPolarHBondContact O-CB 3.47Å; D318-R322 VanDerWaalsContact O-CG 3.26Å; D318-R322 WeakPolarHBondContact O-CG 3.5Å; D318-R322 PolarHBondContact O-N 2.03Å; D318-L336 HydrophobicContact CB-CD2 3.44Å; D318-L336 VanDerWaalsContact CB-CD2 3.44Å; D318-L336 VanDerWaalsContact CG-CD2 3.45Å; D318-N339 PolarHBondContact OD1-ND2 3.42Å; D318-R343 IonicContact OD1-NH2 3.32Å; D318-R343 PolarHBondContact OD1-NH2 3.15Å; D318-R343 IonicContact OD2-CZ 3.37Å; D318-R343 IonicContact OD2-NH2 2.83Å; D318-R343 PolarHBondContact OD2-NH2 3.34Å
319	V	92.8	Very high	93.4	Very high	9 Å²	9	47.9 Å²	47.9	6%	0.055	22%	0.215	C	C	.	.	H	α-helix	trans	-55.1	-41.8	-177.3	-177.7	0	0	0	0	111.4	L161 R163 Q164 Q315 L317 N323	L161-V319 HydrophobicContact CB-CG1 4.01Å; L161-V319 HydrophobicContact CD1-CB 4.4Å; L161-V319 HydrophobicContact CD1-CG1 3.74Å; R163-V319 HydrophobicContact CB-CG1 3.94Å; R163-V319 HydrophobicContact CB-CG2 4.32Å; R163-V319 HydrophobicContact CG-CG2 4.21Å; Q164-V319 HydrophobicContact CG-CB 3.8Å; Q164-V319 HydrophobicContact CG-CG1 4.12Å; Q164-V319 HydrophobicContact CG-CG2 3.72Å; Q315-V319 WeakPolarHBondContact O-CG2 3.41Å; L317-V319 PolarHBondContact O-N 3.33Å; V319-N323 PolarHBondContact O-N 2.97Å
320	R	91.3	Very high	93.3	Very high	59 Å²	59	50.7 Å²	50.7	22%	0.223	23%	0.228	C	C	.	.	H	α-helix	trans	-67	-44.7	-179.1	-174.3	171.4	77.1	170.4	4	111.7	L161 D245 L248 D318 N323 R324	L161-R320 HydrophobicContact CD1-CB 4.18Å; D245-R320 IonicContact OD1-CZ 2.74Å; D245-R320 IonicContact OD1-NH1 3.86Å; D245-R320 PolarHBondContact OD1-NH1 2.83Å; L248-R320 VanDerWaalsContact CD1-NH2 3.29Å; D318-R320 PolarHBondContact O-N 3.42Å; R320-N323 PolarHBondContact O-N 3.36Å; R320-R324 PolarHBondContact O-N 3.4Å; R320-R324 VanDerWaalsContact O-N 3.11Å
321	E	92.3	Very high	93.2	Very high	3 Å²	3	50.6 Å²	50.6	1%	0.014	23%	0.226	C	C	.	.	H	α-helix	trans	-75.9	-33.2	-175.3	-54	-50.3	131.2	0	0	111.5	D318 N323 R324 L325 N335 L336	D318-E321 PolarHBondContact O-N 3.4Å; D318-E321 VanDerWaalsContact O-N 3.16Å; E321-N323 VanDerWaalsContact C-N 3.33Å; E321-N323 PolarHBondContact O-N 2.97Å; E321-R324 WeakPolarHBondContact O-CA 3.28Å; E321-R324 WeakPolarHBondContact O-CB 3.36Å; E321-R324 PolarHBondContact O-N 2.76Å; E321-R324 IonicContact OE1-CZ 3.48Å; E321-R324 IonicContact OE1-NE 2.77Å; E321-R324 IonicContact OE1-NH2 3.85Å; E321-R324 PolarHBondContact OE1-NH2 3Å; E321-R324 VanDerWaalsContact OE1-NH2 3.07Å; E321-R324 IonicContact OE2-CZ 3.26Å; E321-R324 IonicContact OE2-NE 3.96Å; E321-R324 PolarHBondContact OE2-NE 3.29Å; E321-R324 IonicContact OE2-NH2 3.53Å; E321-R324 PolarHBondContact OE2-NH2 3.04Å; E321-L325 PolarHBondContact O-N 3.32Å; E321-L325 VanDerWaalsContact O-N 3.12Å; E321-N335 HydrophobicContact CB-CB 4.3Å; E321-N335 HydrophobicContact CG-CB 3.82Å; E321-N335 PolarHBondContact OE2-ND2 3.31Å; E321-L336 HydrophobicContact CB-CD2 3.82Å; E321-L336 HydrophobicContact CB-CG 3.82Å
322	R	91.3	Very high	93.2	Very high	80 Å²	80	48.4 Å²	48.4	30%	0.302	22%	0.215	S	C	.	.	H	α-helix	trans	-57.8	-43	167.4	-72.8	172.5	-176.8	-125.4	-12.7	112.4	D318 R324 L325 L336	D318-R322 HydrophobicContact CB-CG 4.49Å; D318-R322 WeakPolarHBondContact O-CB 3.47Å; D318-R322 VanDerWaalsContact O-CG 3.26Å; D318-R322 WeakPolarHBondContact O-CG 3.5Å; D318-R322 PolarHBondContact O-N 2.03Å; R322-R324 PolarHBondContact O-N 3.41Å; R322-L325 WeakPolarHBondContact O-CB 3.41Å; R322-L325 PolarHBondContact O-N 2.96Å; R322-L336 HydrophobicContact CG-CD1 4.37Å; R322-L336 HydrophobicContact CG-CD2 4.26Å
323	N	89.8	Confident	93.1	Very high	72 Å²	72	49.6 Å²	49.6	39%	0.385	22%	0.222	S	C	.	.	H	α-helix	trans	-68.5	-23.7	174.4	-74.4	-16.7	0	0	0	112.6	V319 R320 E321	V319-N323 PolarHBondContact O-N 2.97Å; R320-N323 PolarHBondContact O-N 3.36Å; E321-N323 VanDerWaalsContact C-N 3.33Å; E321-N323 PolarHBondContact O-N 2.97Å
324	R	90.9	Very high	93.1	Very high	43 Å²	43	49.6 Å²	49.6	16%	0.162	22%	0.222	C	C	.	.	H	α-helix	trans	-73.5	-29.2	175.9	-162.5	-176.4	-58	-123.1	4.5	112.1	R320 E321 R322 K326 R327 N328 L331	R320-R324 PolarHBondContact O-N 3.4Å; R320-R324 VanDerWaalsContact O-N 3.11Å; E321-R324 WeakPolarHBondContact O-CA 3.28Å; E321-R324 WeakPolarHBondContact O-CB 3.36Å; E321-R324 PolarHBondContact O-N 2.76Å; E321-R324 IonicContact OE1-CZ 3.48Å; E321-R324 IonicContact OE1-NE 2.77Å; E321-R324 IonicContact OE1-NH2 3.85Å; E321-R324 PolarHBondContact OE1-NH2 3Å; E321-R324 VanDerWaalsContact OE1-NH2 3.07Å; E321-R324 IonicContact OE2-CZ 3.26Å; E321-R324 IonicContact OE2-NE 3.96Å; E321-R324 PolarHBondContact OE2-NE 3.29Å; E321-R324 IonicContact OE2-NH2 3.53Å; E321-R324 PolarHBondContact OE2-NH2 3.04Å; R322-R324 PolarHBondContact O-N 3.41Å; R324-K326 PolarHBondContact O-N 3.07Å; R324-K326 VanDerWaalsContact O-N 3.08Å; R324-R327 PolarHBondContact O-N 2.81Å; R324-N328 HydrophobicContact CG-CB 4.42Å; R324-N328 CarbonylContact O-C 3.58Å; R324-N328 PolarHBondContact O-N 3.29Å; R324-L331 VanDerWaalsContact NH1-CD2 3.27Å
325	L	89.5	Confident	93.1	Very high	59 Å²	59	48.4 Å²	48.4	31%	0.309	22%	0.218	S	C	.	.	H	α-helix	trans	-51.2	-35.7	177.4	-64	176.4	0	0	0	113.2	E321 R322 R327 L333 L336	E321-L325 PolarHBondContact O-N 3.32Å; E321-L325 VanDerWaalsContact O-N 3.12Å; R322-L325 WeakPolarHBondContact O-CB 3.41Å; R322-L325 PolarHBondContact O-N 2.96Å; L325-R327 VanDerWaalsContact C-N 3.28Å; L325-R327 PolarHBondContact O-N 2.88Å; L325-L333 HydrophobicContact CD2-CB 4.42Å; L325-L333 HydrophobicContact CD2-CD2 3.72Å; L325-L333 HydrophobicContact CD2-CG 3.61Å; L325-L336 HydrophobicContact CD1-CD1 3.96Å; L325-L336 HydrophobicContact CD2-CD1 4.17Å; L325-L336 HydrophobicContact CG-CD1 4.24Å
326	K	89	Confident	93.2	Very high	184 Å²	184	45.8 Å²	45.8	80%	0.8	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-24.2	178.3	-60.6	-173.4	179	-171.8	0	114.4	R324	R324-K326 PolarHBondContact O-N 3.07Å; R324-K326 VanDerWaalsContact O-N 3.08Å
327	R	90.8	Very high	93.3	Very high	216 Å²	216	47 Å²	47	82%	0.815	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.5	-34.9	-173.2	-72.6	-178.3	-84.6	170.4	-8.2	112.9	R324 L325	R324-R327 PolarHBondContact O-N 2.81Å; L325-R327 VanDerWaalsContact C-N 3.28Å; L325-R327 PolarHBondContact O-N 2.88Å
328	N	93.7	Very high	93.5	Very high	67 Å²	67	45.6 Å²	45.6	36%	0.358	20%	0.204	S	C	.	.			trans	-150.8	85.2	-179.9	-175.1	-17	0	0	0	108.2	R324 K330 L331 G332	R324-N328 HydrophobicContact CG-CB 4.42Å; R324-N328 CarbonylContact O-C 3.58Å; R324-N328 PolarHBondContact O-N 3.29Å; N328-K330 VanDerWaalsContact C-N 3.33Å; N328-K330 PolarHBondContact O-N 2.95Å; N328-K330 PolarHBondContact OD1-N 2.87Å; N328-L331 HydrophobicContact CB-CB 4.37Å; N328-L331 PolarHBondContact O-N 3.45Å; N328-L331 WeakPolarHBondContact OD1-CB 3.45Å; N328-L331 PolarHBondContact OD1-N 2.8Å; N328-G332 PolarHBondContact O-N 3.45Å
329	A	92.3	Very high	93.6	Very high	23 Å²	23	45.7 Å²	45.7	19%	0.19	21%	0.205	C	C	.	.	H	α-helix	trans	-59.6	-42.8	-179.7	0	0	0	0	0	111.8	L331 G332 L333 Y394	A329-L331 PolarHBondContact O-N 3.32Å; A329-G332 PolarHBondContact O-N 2.83Å; A329-L333 WeakPolarHBondContact O-CB 3.45Å; A329-L333 WeakPolarHBondContact O-CG 3.29Å; A329-L333 PolarHBondContact O-N 2.52Å; A329-Y394 HydrophobicContact CB-CE1 3.93Å; A329-Y394 HydrophobicContact CB-CE2 4.24Å
330	K	94	Very high	93.8	Very high	59 Å²	59	46.8 Å²	46.8	26%	0.257	21%	0.208	S	C	.	.	H	α-helix	trans	-51.2	-56.7	177.1	-178.2	176.6	-171.5	-169.4	0	111.4	N328 T334 V392 Y394 I466	N328-K330 VanDerWaalsContact C-N 3.33Å; N328-K330 PolarHBondContact O-N 2.95Å; N328-K330 PolarHBondContact OD1-N 2.87Å; K330-T334 WeakPolarHBondContact O-CB 3.4Å; K330-T334 PolarHBondContact O-N 2.61Å; K330-T334 PolarHBondContact O-OG1 2.97Å; K330-V392 WeakPolarHBondContact CE-O 3.37Å; K330-Y394 HydrophobicContact CB-CG 4.2Å; K330-I466 HydrophobicContact CD-CB 4.4Å; K330-I466 HydrophobicContact CD-CD1 4.48Å; K330-I466 HydrophobicContact CD-CG2 4.24Å; K330-I466 HydrophobicContact CG-CB 4.43Å; K330-I466 HydrophobicContact CG-CD1 4.3Å; K330-I466 HydrophobicContact CG-CG2 3.83Å
331	L	96.1	Very high	94.1	Very high	5 Å²	5	44 Å²	44	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-70.4	-40.3	-179.9	179	58.8	0	0	0	112.6	S249 R324 N328 A329 T334 N335 I466	S249-L331 WeakPolarHBondContact O-CD2 3.26Å; R324-L331 VanDerWaalsContact NH1-CD2 3.27Å; N328-L331 HydrophobicContact CB-CB 4.37Å; N328-L331 PolarHBondContact O-N 3.45Å; N328-L331 WeakPolarHBondContact OD1-CB 3.45Å; N328-L331 PolarHBondContact OD1-N 2.8Å; A329-L331 PolarHBondContact O-N 3.32Å; L331-T334 PolarHBondContact O-N 3.45Å; L331-N335 WeakPolarHBondContact CD1-OD1 3.46Å; L331-N335 WeakPolarHBondContact O-CB 3.28Å; L331-N335 VanDerWaalsContact O-CG 3.29Å; L331-N335 PolarHBondContact O-N 2.83Å; L331-I466 HydrophobicContact CB-CD1 3.9Å; L331-I466 HydrophobicContact CD1-CD1 3.83Å; L331-I466 HydrophobicContact CD1-CG1 4.46Å; L331-I466 HydrophobicContact CG-CD1 4.39Å
332	G	94.3	Very high	94.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.1	-45.5	-179.3	0	0	0	0	0	112.7	N328 A329 N335 L336	N328-G332 PolarHBondContact O-N 3.45Å; A329-G332 PolarHBondContact O-N 2.83Å; G332-N335 PolarHBondContact O-N 3.34Å; G332-L336 WeakPolarHBondContact O-CB 2.93Å; G332-L336 VanDerWaalsContact O-CG 3.23Å; G332-L336 WeakPolarHBondContact O-CG 3.33Å; G332-L336 PolarHBondContact O-N 2.88Å
333	L	93.8	Very high	94.8	Very high	34 Å²	34	40.8 Å²	40.8	18%	0.178	19%	0.185	C	C	.	.	H	α-helix	trans	-66.4	-43.5	176.4	-70.1	171.3	0	0	0	111.5	L325 A329 N335 L336 H337 Y394 L399	L325-L333 HydrophobicContact CD2-CB 4.42Å; L325-L333 HydrophobicContact CD2-CD2 3.72Å; L325-L333 HydrophobicContact CD2-CG 3.61Å; A329-L333 WeakPolarHBondContact O-CB 3.45Å; A329-L333 WeakPolarHBondContact O-CG 3.29Å; A329-L333 PolarHBondContact O-N 2.52Å; L333-N335 VanDerWaalsContact C-N 3.32Å; L333-N335 PolarHBondContact O-N 2.85Å; L333-L336 PolarHBondContact O-N 3.35Å; L333-H337 WeakPolarHBondContact O-CB 3.45Å; L333-H337 PolarHBondContact O-N 2.77Å; L333-Y394 HydrophobicContact CD1-CD2 3.94Å; L333-Y394 HydrophobicContact CD1-CE2 3.4Å; L333-Y394 VanDerWaalsContact CD1-CE2 3.4Å; L333-L399 HydrophobicContact CB-CD1 3.78Å; L333-L399 HydrophobicContact CB-CD2 4.34Å; L333-L399 HydrophobicContact CB-CG 4.14Å
334	T	96	Very high	95.1	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-56	-47.7	176.5	-58.4	0	0	0	0	110.9	K330 L331 H337 N338 I464 I466	K330-T334 WeakPolarHBondContact O-CB 3.4Å; K330-T334 PolarHBondContact O-N 2.61Å; K330-T334 PolarHBondContact O-OG1 2.97Å; L331-T334 PolarHBondContact O-N 3.45Å; T334-H337 PolarHBondContact O-N 3Å; T334-N338 PolarHBondContact O-N 3.37Å; T334-N338 VanDerWaalsContact O-N 3.13Å; T334-N338 PolarHBondContact O-ND2 3.13Å; T334-N338 VanDerWaalsContact O-ND2 3.17Å; T334-I464 HydrophobicContact CG2-CD1 4.4Å; T334-I464 HydrophobicContact CG2-CG1 3.96Å; T334-I464 WeakPolarHBondContact CG2-O 3.49Å; T334-I466 HydrophobicContact CG2-CG2 3.89Å; T334-I466 WeakPolarHBondContact OG1-CG2 3.27Å
335	N	97.6	Very high	95.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-68.2	-38.8	-179.5	-71.5	-4.7	0	0	0	112.7	L248 L259 E321 L331 G332 L333 N338 N339	L248-N335 PolarHBondContact O-ND2 3.41Å; L259-N335 HydrophobicContact CD1-CB 3.65Å; L259-N335 VanDerWaalsContact CD1-CG 3.46Å; L259-N335 VanDerWaalsContact CD1-OD1 3.29Å; L259-N335 WeakPolarHBondContact CD1-OD1 3.4Å; E321-N335 HydrophobicContact CB-CB 4.3Å; E321-N335 HydrophobicContact CG-CB 3.82Å; E321-N335 PolarHBondContact OE2-ND2 3.31Å; L331-N335 WeakPolarHBondContact CD1-OD1 3.46Å; L331-N335 WeakPolarHBondContact O-CB 3.28Å; L331-N335 VanDerWaalsContact O-CG 3.29Å; L331-N335 PolarHBondContact O-N 2.83Å; G332-N335 PolarHBondContact O-N 3.34Å; L333-N335 VanDerWaalsContact C-N 3.32Å; L333-N335 PolarHBondContact O-N 2.85Å; N335-N338 PolarHBondContact O-N 2.97Å; N335-N339 PolarHBondContact O-N 2.89Å
336	L	96.5	Very high	95.8	Very high	8 Å²	8	33.8 Å²	33.8	4%	0.042	15%	0.151	C	C	.	.	H	α-helix	trans	-63.2	-41.2	175.9	-74.3	170	0	0	0	112	D318 E321 R322 L325 G332 L333 N339 Y340	D318-L336 HydrophobicContact CB-CD2 3.44Å; D318-L336 VanDerWaalsContact CB-CD2 3.44Å; D318-L336 VanDerWaalsContact CG-CD2 3.45Å; E321-L336 HydrophobicContact CB-CD2 3.82Å; E321-L336 HydrophobicContact CB-CG 3.82Å; R322-L336 HydrophobicContact CG-CD1 4.37Å; R322-L336 HydrophobicContact CG-CD2 4.26Å; L325-L336 HydrophobicContact CD1-CD1 3.96Å; L325-L336 HydrophobicContact CD2-CD1 4.17Å; L325-L336 HydrophobicContact CG-CD1 4.24Å; G332-L336 WeakPolarHBondContact O-CB 2.93Å; G332-L336 VanDerWaalsContact O-CG 3.23Å; G332-L336 WeakPolarHBondContact O-CG 3.33Å; G332-L336 PolarHBondContact O-N 2.88Å; L333-L336 PolarHBondContact O-N 3.35Å; L336-N339 PolarHBondContact O-N 3.31Å; L336-Y340 PolarHBondContact O-N 2.86Å
337	H	97	Very high	96.1	Very high	34 Å²	34	26.3 Å²	26.3	16%	0.157	12%	0.119	C	C	.	.	H	α-helix	trans	-59.2	-51.2	174.8	-177.6	93	0	0	0	111.1	L333 T334 N339 Y340 V341 T459 D462 I464	L333-H337 WeakPolarHBondContact O-CB 3.45Å; L333-H337 PolarHBondContact O-N 2.77Å; T334-H337 PolarHBondContact O-N 3Å; H337-N339 VanDerWaalsContact C-N 3.33Å; H337-N339 PolarHBondContact O-N 3.4Å; H337-Y340 CarbonylContact O-C 3.58Å; H337-Y340 WeakPolarHBondContact O-CA 3.29Å; H337-Y340 VanDerWaalsContact O-CB 3.32Å; H337-Y340 WeakPolarHBondContact O-CB 3.33Å; H337-Y340 PolarHBondContact O-N 2.95Å; H337-V341 WeakPolarHBondContact NE2-CG2 3.38Å; H337-V341 WeakPolarHBondContact O-CG2 3.14Å; H337-V341 PolarHBondContact O-N 3.21Å; H337-T459 PolarHBondContact CE1-O 3.22Å; H337-T459 VanDerWaalsContact CE1-O 3.22Å; H337-T459 PolarHBondContact NE2-O 3.22Å; H337-D462 PolarHBondContact CD2-O 3.03Å; H337-D462 PolarHBondContact NE2-O 2.83Å; H337-I464 HydrophobicContact CB-CD1 3.63Å; H337-I464 HydrophobicContact CB-CG1 4.17Å; H337-I464 VanDerWaalsContact CG-CD1 3.49Å
338	N	98.5	Very high	96.3	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-63	-37.4	-179.4	-66.2	-34.7	0	0	0	112.7	A256 L259 A260 T334 N335 Y340 V341 G342 L463 I464	A256-N338 WeakPolarHBondContact CA-ND2 3.38Å; A256-N338 WeakPolarHBondContact CB-ND2 3.06Å; L259-N338 HydrophobicContact CB-CB 3.97Å; L259-N338 HydrophobicContact CD1-CB 4.36Å; A260-N338 VanDerWaalsContact CA-O 3.26Å; A260-N338 WeakPolarHBondContact CA-O 3.31Å; A260-N338 WeakPolarHBondContact CB-O 3.46Å; T334-N338 PolarHBondContact O-N 3.37Å; T334-N338 VanDerWaalsContact O-N 3.13Å; T334-N338 PolarHBondContact O-ND2 3.13Å; T334-N338 VanDerWaalsContact O-ND2 3.17Å; N335-N338 PolarHBondContact O-N 2.97Å; N338-Y340 VanDerWaalsContact C-N 3.29Å; N338-Y340 PolarHBondContact O-N 2.92Å; N338-V341 PolarHBondContact O-N 2.87Å; N338-G342 PolarHBondContact O-N 3.5Å; N338-G342 VanDerWaalsContact O-N 3.15Å; N338-L463 HydrophobicContact CB-CD2 4.42Å; N338-I464 PolarHBondContact ND2-O 3.28Å; N338-I464 PolarHBondContact OD1-N 3.03Å; N338-I464 PolarHBondContact OD1-O 3.19Å
339	N	98.3	Very high	96.4	Very high	4 Å²	4	20.7 Å²	20.7	2%	0.021	10%	0.101	C	C	.	.	H	α-helix	trans	-60.2	-40.3	170.5	-76.4	-9.3	0	0	0	111.9	L259 S263 D318 N335 L336 H337 R343	L259-N339 WeakPolarHBondContact CB-OD1 3.28Å; L259-N339 WeakPolarHBondContact CD2-OD1 3.49Å; L259-N339 PolarHBondContact O-OD1 3.25Å; S263-N339 WeakPolarHBondContact CB-O 3.45Å; S263-N339 PolarHBondContact OG-O 3.26Å; S263-N339 VanDerWaalsContact OG-O 3.11Å; D318-N339 PolarHBondContact OD1-ND2 3.42Å; N335-N339 PolarHBondContact O-N 2.89Å; L336-N339 PolarHBondContact O-N 3.31Å; H337-N339 VanDerWaalsContact C-N 3.33Å; H337-N339 PolarHBondContact O-N 3.4Å; N339-R343 WeakPolarHBondContact O-CG 3.47Å; N339-R343 PolarHBondContact O-N 3.37Å; N339-R343 PolarHBondContact O-NE 3.2Å; N339-R343 VanDerWaalsContact O-NE 3.08Å
340	Y	97.6	Very high	96.5	Very high	32 Å²	32	20.8 Å²	20.8	13%	0.125	10%	0.098	C	C	.	.	H	α-helix	trans	-67	-46.3	178.6	167.7	-97.8	0	0	0	111.6	L336 H337 N338 G342 R343 H344 E460	L336-Y340 PolarHBondContact O-N 2.86Å; H337-Y340 CarbonylContact O-C 3.58Å; H337-Y340 WeakPolarHBondContact O-CA 3.29Å; H337-Y340 VanDerWaalsContact O-CB 3.32Å; H337-Y340 WeakPolarHBondContact O-CB 3.33Å; H337-Y340 PolarHBondContact O-N 2.95Å; N338-Y340 VanDerWaalsContact C-N 3.29Å; N338-Y340 PolarHBondContact O-N 2.92Å; Y340-G342 VanDerWaalsContact C-N 3.25Å; Y340-G342 PolarHBondContact O-N 3.3Å; Y340-R343 PolarHBondContact O-N 3.08Å; Y340-H344 HydrophobicContact CE1-CB 4.38Å; Y340-H344 VanDerWaalsContact O-CB 3.31Å; Y340-H344 WeakPolarHBondContact O-CB 3.36Å; Y340-H344 PolarHBondContact O-N 3.07Å; Y340-E460 HydrophobicContact CE1-CB 3.63Å; Y340-E460 PolarHBondContact OH-OE2 2.81Å
341	V	98	Very high	96.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-52.3	-46.3	175.1	174.7	0	0	0	0	110.6	H337 N338 R343 H344 M345 L382 E460 D462 L463	H337-V341 WeakPolarHBondContact NE2-CG2 3.38Å; H337-V341 WeakPolarHBondContact O-CG2 3.14Å; H337-V341 PolarHBondContact O-N 3.21Å; N338-V341 PolarHBondContact O-N 2.87Å; V341-R343 PolarHBondContact O-N 3.24Å; V341-H344 PolarHBondContact O-N 3.41Å; V341-M345 WeakPolarHBondContact O-CB 3.14Å; V341-M345 PolarHBondContact O-N 3.41Å; V341-L382 HydrophobicContact CG1-CD2 4.37Å; V341-E460 WeakPolarHBondContact CG2-O 3.5Å; V341-D462 WeakPolarHBondContact CG2-O 3.05Å; V341-L463 HydrophobicContact CB-CD2 4.08Å; V341-L463 HydrophobicContact CG1-CD2 3.75Å; V341-L463 HydrophobicContact CG1-CG 4.36Å; V341-L463 HydrophobicContact CG2-CD2 4.49Å
342	G	98.3	Very high	96.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-57.2	-47.2	176.5	0	0	0	0	0	113.6	A260 A264 N338 Y340 V346	A260-G342 VanDerWaalsContact O-CA 3.27Å; A260-G342 WeakPolarHBondContact O-CA 3.38Å; A264-G342 WeakPolarHBondContact CB-O 3.3Å; N338-G342 PolarHBondContact O-N 3.5Å; N338-G342 VanDerWaalsContact O-N 3.15Å; Y340-G342 VanDerWaalsContact C-N 3.25Å; Y340-G342 PolarHBondContact O-N 3.3Å; G342-V346 WeakPolarHBondContact O-CG2 3.41Å; G342-V346 PolarHBondContact O-N 3.35Å
343	R	98.4	Very high	96.3	Very high	15 Å²	15	28.4 Å²	28.4	6%	0.057	14%	0.139	C	C	.	.	H	α-helix	trans	-66	-45	178.1	-71.5	177.9	-87	145	-16.7	112.3	S263 S267 A310 D318 N339 Y340 V341 M345 V346 I347	S263-R343 WeakPolarHBondContact OG-CD 3.34Å; S263-R343 VanDerWaalsContact OG-CG 3.28Å; S263-R343 WeakPolarHBondContact OG-CG 3.32Å; S263-R343 PolarHBondContact OG-NE 2.7Å; S267-R343 WeakPolarHBondContact OG-CG 3.09Å; A310-R343 HydrophobicContact CB-CB 4.24Å; A310-R343 WeakPolarHBondContact O-CD 3.24Å; D318-R343 IonicContact OD1-NH2 3.32Å; D318-R343 PolarHBondContact OD1-NH2 3.15Å; D318-R343 IonicContact OD2-CZ 3.37Å; D318-R343 IonicContact OD2-NH2 2.83Å; D318-R343 PolarHBondContact OD2-NH2 3.34Å; N339-R343 WeakPolarHBondContact O-CG 3.47Å; N339-R343 PolarHBondContact O-N 3.37Å; N339-R343 PolarHBondContact O-NE 3.2Å; N339-R343 VanDerWaalsContact O-NE 3.08Å; Y340-R343 PolarHBondContact O-N 3.08Å; V341-R343 PolarHBondContact O-N 3.24Å; R343-M345 VanDerWaalsContact C-N 3.31Å; R343-M345 PolarHBondContact O-N 2.67Å; R343-V346 PolarHBondContact O-N 2.88Å; R343-I347 PolarHBondContact O-N 2.95Å
344	H	96.8	Very high	96.3	Very high	21 Å²	21	29 Å²	29	10%	0.097	15%	0.146	C	C	.	.	H	α-helix	trans	-63.4	-38.8	-179.2	-172.8	62.1	0	0	0	111.4	Y340 V341 V346 I347 N348 E460 N461	Y340-H344 HydrophobicContact CE1-CB 4.38Å; Y340-H344 VanDerWaalsContact O-CB 3.31Å; Y340-H344 WeakPolarHBondContact O-CB 3.36Å; Y340-H344 PolarHBondContact O-N 3.07Å; V341-H344 PolarHBondContact O-N 3.41Å; H344-V346 VanDerWaalsContact C-N 3.3Å; H344-V346 PolarHBondContact O-N 3.48Å; H344-I347 PolarHBondContact O-N 2.86Å; H344-I347 VanDerWaalsContact O-N 3.14Å; H344-N348 PolarHBondContact CD2-ND2 3.26Å; H344-N348 PolarHBondContact CE1-ND2 2.98Å; H344-N348 VanDerWaalsContact CE1-ND2 3.32Å; H344-N348 PolarHBondContact CE1-OD1 2.86Å; H344-N348 VanDerWaalsContact CE1-OD1 3.31Å; H344-N348 PolarHBondContact NE2-ND2 3.24Å; H344-N348 WeakPolarHBondContact O-CB 3.24Å; H344-N348 PolarHBondContact O-N 3.15Å; H344-E460 IonicContact CE1-OE1 3.82Å; H344-E460 IonicContact CE1-OE2 3.93Å; H344-E460 WeakPolarHBondContact NE2-CG 3.39Å; H344-E460 IonicContact NE2-OE1 3.72Å; H344-E460 PolarHBondContact NE2-OE1 2.98Å; H344-E460 VanDerWaalsContact NE2-OE1 3.15Å; H344-E460 IonicContact NE2-OE2 3.78Å; H344-N461 PolarHBondContact CD2-OD1 3.3Å
345	M	97	Very high	96.2	Very high	7 Å²	7	34.8 Å²	34.8	3%	0.034	17%	0.171	C	C	.	.	H	α-helix	trans	-57.8	-40.5	174.3	-169.8	65.6	70.9	0	0	112.4	V341 R343 K349 L378 Q381 L382 R385	V341-M345 WeakPolarHBondContact O-CB 3.14Å; V341-M345 PolarHBondContact O-N 3.41Å; R343-M345 VanDerWaalsContact C-N 3.31Å; R343-M345 PolarHBondContact O-N 2.67Å; M345-K349 VanDerWaalsContact O-CB 3.29Å; M345-K349 WeakPolarHBondContact O-CB 3.46Å; M345-K349 VanDerWaalsContact O-CG 3.25Å; M345-K349 WeakPolarHBondContact O-CG 3.48Å; M345-K349 PolarHBondContact O-N 3.47Å; M345-K349 VanDerWaalsContact O-N 3.16Å; M345-K349 HydrophobicContact SD-CG 4.12Å; M345-L378 HydrophobicContact CG-CD2 3.78Å; M345-Q381 HydrophobicContact CE-CB 4.48Å; M345-Q381 HydrophobicContact SD-CB 4.22Å; M345-L382 HydrophobicContact CB-CD2 4.39Å; M345-L382 HydrophobicContact CE-CD2 4.18Å; M345-L382 HydrophobicContact CG-CD2 4.36Å; M345-L382 HydrophobicContact CG-CG 4.45Å; M345-R385 HydrophobicContact CE-CG 4.22Å
346	V	97.5	Very high	96.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66.4	-43	176.9	-168.6	0	0	0	0	111.2	A264 I306 G342 R343 H344 K349 M350 L372 L378	A264-V346 HydrophobicContact CB-CG2 3.68Å; I306-V346 HydrophobicContact CD1-CB 3.91Å; I306-V346 HydrophobicContact CD1-CG1 3.36Å; I306-V346 HydrophobicContact CG1-CB 4.32Å; I306-V346 HydrophobicContact CG1-CG1 3.93Å; G342-V346 WeakPolarHBondContact O-CG2 3.41Å; G342-V346 PolarHBondContact O-N 3.35Å; R343-V346 PolarHBondContact O-N 2.88Å; H344-V346 VanDerWaalsContact C-N 3.3Å; H344-V346 PolarHBondContact O-N 3.48Å; V346-K349 PolarHBondContact O-N 2.78Å; V346-M350 PolarHBondContact O-N 3.47Å; V346-L372 HydrophobicContact CG1-CD2 3.76Å; V346-L378 HydrophobicContact CB-CD1 4.45Å; V346-L378 HydrophobicContact CG1-CD1 4.27Å; V346-L378 HydrophobicContact CG2-CD1 3.88Å
347	I	95.8	Very high	95.8	Very high	26 Å²	26	40.4 Å²	40.4	13%	0.133	20%	0.2	C	C	.	.	H	α-helix	trans	-61.6	-48.2	178.7	-65.8	165.4	0	0	0	110.7	I306 Y307 A310 R343 H344 K349 M350	I306-I347 HydrophobicContact CG1-CG1 3.68Å; I306-I347 HydrophobicContact CG2-CG1 4.19Å; Y307-I347 HydrophobicContact CD1-CD1 4.41Å; Y307-I347 HydrophobicContact CE1-CD1 4.42Å; Y307-I347 HydrophobicContact CE1-CG2 4Å; A310-I347 HydrophobicContact CB-CD1 3.88Å; A310-I347 HydrophobicContact CB-CG1 4.35Å; R343-I347 PolarHBondContact O-N 2.95Å; H344-I347 PolarHBondContact O-N 2.86Å; H344-I347 VanDerWaalsContact O-N 3.14Å; I347-K349 PolarHBondContact O-N 3.31Å; I347-M350 VanDerWaalsContact O-CG 3.25Å; I347-M350 WeakPolarHBondContact O-CG 3.27Å; I347-M350 PolarHBondContact O-N 2.86Å
348	N	95	Very high	95.4	Very high	79 Å²	79	39.3 Å²	39.3	42%	0.422	20%	0.198	S	C	.	.	H	α-helix	trans	-70.8	-20.5	-176.2	-70.6	-3.1	0	0	0	113.5	H344	H344-N348 PolarHBondContact CD2-ND2 3.26Å; H344-N348 PolarHBondContact CE1-ND2 2.98Å; H344-N348 VanDerWaalsContact CE1-ND2 3.32Å; H344-N348 PolarHBondContact CE1-OD1 2.86Å; H344-N348 VanDerWaalsContact CE1-OD1 3.31Å; H344-N348 PolarHBondContact NE2-ND2 3.24Å; H344-N348 WeakPolarHBondContact O-CB 3.24Å; H344-N348 PolarHBondContact O-N 3.15Å
349	K	96	Very high	95.2	Very high	86 Å²	86	45.6 Å²	45.6	37%	0.374	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	13.9	-178.3	-63.2	-71.1	158.6	158.4	0	113	M345 V346 I347 E351 P373 L378	M345-K349 VanDerWaalsContact O-CB 3.29Å; M345-K349 WeakPolarHBondContact O-CB 3.46Å; M345-K349 VanDerWaalsContact O-CG 3.25Å; M345-K349 WeakPolarHBondContact O-CG 3.48Å; M345-K349 PolarHBondContact O-N 3.47Å; M345-K349 VanDerWaalsContact O-N 3.16Å; M345-K349 HydrophobicContact SD-CG 4.12Å; V346-K349 PolarHBondContact O-N 2.78Å; I347-K349 PolarHBondContact O-N 3.31Å; K349-E351 PolarHBondContact O-N 3.06Å; K349-P373 HydrophobicContact CB-CB 4.22Å; K349-P373 HydrophobicContact CB-CG 3.92Å; K349-P373 VanDerWaalsContact O-CB 3.24Å; K349-P373 WeakPolarHBondContact O-CB 3.18Å; K349-P373 WeakPolarHBondContact O-CD 3.49Å; K349-P373 WeakPolarHBondContact O-CG 3.34Å; K349-L378 HydrophobicContact CB-CD2 3.92Å; K349-L378 HydrophobicContact CG-CD2 4.2Å
350	M	94.9	Very high	94.9	Very high	26 Å²	26	51.6 Å²	51.6	13%	0.128	28%	0.279	C	S	.	.			trans	-57.3	136	168.4	-68.9	-69.4	-68.8	0	0	110.5	D304 I306 V346 I347 R370 L372	D304-M350 HydrophobicContact CB-CE 3.86Å; D304-M350 WeakPolarHBondContact O-CE 3.34Å; I306-M350 HydrophobicContact CB-CE 4.27Å; I306-M350 HydrophobicContact CB-CG 4.36Å; I306-M350 HydrophobicContact CB-SD 3.78Å; I306-M350 HydrophobicContact CG1-SD 4.28Å; I306-M350 HydrophobicContact CG2-CE 4.07Å; I306-M350 HydrophobicContact CG2-CG 3.78Å; I306-M350 HydrophobicContact CG2-SD 3.8Å; V346-M350 PolarHBondContact O-N 3.47Å; I347-M350 VanDerWaalsContact O-CG 3.25Å; I347-M350 WeakPolarHBondContact O-CG 3.27Å; I347-M350 PolarHBondContact O-N 2.86Å; M350-R370 HydrophobicContact CE-CB 4.06Å; M350-L372 HydrophobicContact SD-CD2 3.85Å; M350-L372 HydrophobicContact SD-CG 4.37Å
351	E	93.4	Very high	94.5	Very high	68 Å²	68	52.7 Å²	52.7	32%	0.318	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	149.5	-177.2	-66.5	172.5	-171.2	0	0	110.1	K349 Q353 R370 S371	K349-E351 PolarHBondContact O-N 3.06Å; E351-Q353 PolarHBondContact OE2-NE2 3.03Å; E351-R370 CarbonylContact O-C 3.5Å; E351-R370 WeakPolarHBondContact O-CA 3.44Å; E351-S371 PolarHBondContact N-O 3.37Å; E351-S371 PolarHBondContact O-N 3.09Å
352	V	92.4	Very high	94.2	Very high	76 Å²	76	55.3 Å²	55.3	46%	0.461	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	118.4	166.2	-179.7	0	0	0	0	107.5	F297 W299 C368	F297-V352 HydrophobicContact CZ-CG1 4.43Å; W299-V352 HydrophobicContact CH2-CG1 4.2Å; W299-V352 HydrophobicContact CH2-CG2 3.88Å; W299-V352 HydrophobicContact CZ3-CG1 4.29Å; W299-V352 HydrophobicContact CZ3-CG2 4.5Å; V352-C368 HydrophobicContact CG1-CB 3.62Å
353	Q	93.6	Very high	93.9	Very high	79 Å²	79	58.6 Å²	58.6	37%	0.369	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	140.3	176.7	-68.5	-71.4	-22.1	0	0	108.5	E351 C368 W369	E351-Q353 PolarHBondContact OE2-NE2 3.03Å; Q353-C368 CarbonylContact O-C 3.56Å; Q353-C368 WeakPolarHBondContact O-CA 3.42Å; Q353-C368 WeakPolarHBondContact O-CB 3.37Å; Q353-W369 HydrophobicContact CB-CZ2 4.19Å; Q353-W369 PolarHBondContact N-O 2.85Å; Q353-W369 PolarHBondContact O-N 3.37Å
354	C	93.8	Very high	93.5	Very high	46 Å²	46	66 Å²	66	31%	0.311	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	146.6	-173.7	-56.9	0	0	0	0	111.4	T367 C368	C354-T367 CarbonylContact C-O 3.48Å; C354-T367 VanDerWaalsContact CA-O 3.3Å; C354-T367 WeakPolarHBondContact CA-O 3.42Å; C354-C368 HydrophobicContact CB-CB 4.03Å; C354-C368 WeakPolarHBondContact CB-SG 3.35Å; C354-C368 WeakPolarHBondContact SG-CB 3.39Å; C354-C368 CovalentContact SG-SG 2.03Å; C354-C368 PolarHBondContact SG-SG 3Å
355	K	94	Very high	93.2	Very high	124 Å²	124	70.5 Å²	70.5	54%	0.539	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	128.6	167.2	-175	170.7	175	-179.8	0	109.4	H357 R366 T367 W369	K355-H357 PolarHBondContact O-CD2 2.98Å; K355-H357 PolarHBondContact O-NE2 3.2Å; K355-R366 WeakPolarHBondContact O-CA 3.44Å; K355-R366 VanDerWaalsContact O-CB 3.3Å; K355-R366 WeakPolarHBondContact O-CB 3.32Å; K355-T367 PolarHBondContact N-O 3.01Å; K355-T367 PolarHBondContact O-N 3.22Å; K355-W369 HydrophobicContact CB-CH2 3.87Å; K355-W369 HydrophobicContact CB-CZ3 3.82Å
356	C	94.6	Very high	93	Very high	39 Å²	39	74.2 Å²	74.2	26%	0.264	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	135.9	177.3	-58.3	0	0	0	0	110.1	C363	C356-C363 HydrophobicContact CB-CB 3.85Å; C356-C363 WeakPolarHBondContact CB-SG 3.3Å; C356-C363 VanDerWaalsContact SG-CA 3.56Å; C356-C363 WeakPolarHBondContact SG-CB 3.29Å; C356-C363 CovalentContact SG-SG 2.03Å; C356-C363 PolarHBondContact SG-SG 3.37Å
357	H	91.2	Very high	92.7	Very high	86 Å²	86	75.6 Å²	75.6	40%	0.398	42%	0.42	S	S	.	.			trans	-127.2	7.9	-174.7	-55.7	-75.3	0	0	0	113.2	K355 M365 T367	K355-H357 PolarHBondContact O-CD2 2.98Å; K355-H357 PolarHBondContact O-NE2 3.2Å; H357-M365 HydrophobicContact CB-CE 4.24Å; H357-M365 HydrophobicContact CB-CG 4.4Å; H357-M365 PolarHBondContact N-O 3Å; H357-T367 PolarHBondContact NE2-OG1 3.26Å
358	G	88.7	Confident	92.7	Very high	11 Å²	11	74.3 Å²	74.3	11%	0.113	41%	0.414	C	S	.	.	S	Bend	trans	-71.6	166.2	176.6	0	0	0	0	0	112.5	S360 G361 S362	G358-S360 PolarHBondContact O-N 2.97Å; G358-G361 PolarHBondContact O-N 3.43Å; G358-S362 WeakPolarHBondContact CA-O 3.49Å; G358-S362 PolarHBondContact N-O 3.06Å; G358-S362 PolarHBondContact O-N 3.47Å
359	V	93.7	Very high	92.6	Very high	132 Å²	132	74 Å²	74	80%	0.8	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-52.9	132.3	180	-176.4	0	0	0	0	110.4	G361 S362	V359-G361 PolarHBondContact O-N 3.1Å; V359-S362 VanDerWaalsContact O-CB 3.26Å; V359-S362 WeakPolarHBondContact O-CB 3.49Å; V359-S362 PolarHBondContact O-N 2.87Å; V359-S362 VanDerWaalsContact O-N 3.09Å
360	S	92.3	Very high	92.6	Very high	131 Å²	131	72.4 Å²	72.4	92%	0.916	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	55.3	30.3	-177.4	-54	0	0	0	0	114.9	G358	G358-S360 PolarHBondContact O-N 2.97Å
361	G	89.5	Confident	92.6	Very high	55 Å²	55	72.2 Å²	72.2	57%	0.567	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	85	11.2	-179.4	0	0	0	0	0	114.4	G358 V359	G358-G361 PolarHBondContact O-N 3.43Å; V359-G361 PolarHBondContact O-N 3.1Å
362	S	91.9	Very high	92.8	Very high	54 Å²	54	69.6 Å²	69.6	38%	0.378	39%	0.388	S	S	.	.			trans	-56.3	141.3	174.4	174.1	0	0	0	0	112.1	G358 V359 E364	G358-S362 WeakPolarHBondContact CA-O 3.49Å; G358-S362 PolarHBondContact N-O 3.06Å; G358-S362 PolarHBondContact O-N 3.47Å; V359-S362 VanDerWaalsContact O-CB 3.26Å; V359-S362 WeakPolarHBondContact O-CB 3.49Å; V359-S362 PolarHBondContact O-N 2.87Å; V359-S362 VanDerWaalsContact O-N 3.09Å; S362-E364 PolarHBondContact OG-N 3.11Å
363	C	92.6	Very high	93.1	Very high	70 Å²	70	66.1 Å²	66.1	47%	0.473	37%	0.367	S	S	.	.	S	Bend	trans	-96.2	10.5	179.5	-66.3	0	0	0	0	114.2	C356 M365	C356-C363 HydrophobicContact CB-CB 3.85Å; C356-C363 WeakPolarHBondContact CB-SG 3.3Å; C356-C363 VanDerWaalsContact SG-CA 3.56Å; C356-C363 WeakPolarHBondContact SG-CB 3.29Å; C356-C363 CovalentContact SG-SG 2.03Å; C356-C363 PolarHBondContact SG-SG 3.37Å; C363-M365 PolarHBondContact O-N 2.9Å
364	E	89.7	Confident	93.2	Very high	170 Å²	170	69.4 Å²	69.4	79%	0.794	38%	0.38	S	S	*	.	S	Bend	trans	-55.5	-38.8	175.3	-172.3	61.8	-160.7	0	0	111.4	S362	S362-E364 PolarHBondContact OG-N 3.11Å
365	M	89.5	Confident	93.4	Very high	115 Å²	115	67.8 Å²	67.8	57%	0.567	37%	0.367	S	S	*	.	S	Bend	trans	-115.5	126.9	168.4	57.1	-173.4	-69.1	0	0	109.5	H357 C363	H357-M365 HydrophobicContact CB-CE 4.24Å; H357-M365 HydrophobicContact CB-CG 4.4Å; H357-M365 PolarHBondContact N-O 3Å; C363-M365 PolarHBondContact O-N 2.9Å
366	R	92.6	Very high	93.6	Very high	86 Å²	86	67.1 Å²	67.1	33%	0.325	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	150.9	-179.2	65	-173.9	178.3	165	1.8	111.1	N296 F297 E298 K355	N296-R366 PolarHBondContact O-NE 2.88Å; F297-R366 WeakPolarHBondContact CA-O 3.31Å; F297-R366 HydrophobicContact CB-CG 3.65Å; F297-R366 WeakPolarHBondContact CB-O 3.4Å; E298-R366 PolarHBondContact N-O 2.78Å; K355-R366 WeakPolarHBondContact O-CA 3.44Å; K355-R366 VanDerWaalsContact O-CB 3.3Å; K355-R366 WeakPolarHBondContact O-CB 3.32Å
367	T	92.4	Very high	93.8	Very high	28 Å²	28	68.7 Å²	68.7	17%	0.172	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.8	173.7	57.9	0	0	0	0	109.4	E298 C354 K355 H357	E298-T367 CarbonylContact O-C 3.47Å; E298-T367 VanDerWaalsContact O-CA 3.28Å; E298-T367 WeakPolarHBondContact O-CA 3.49Å; C354-T367 CarbonylContact C-O 3.48Å; C354-T367 VanDerWaalsContact CA-O 3.3Å; C354-T367 WeakPolarHBondContact CA-O 3.42Å; K355-T367 PolarHBondContact N-O 3.01Å; K355-T367 PolarHBondContact O-N 3.22Å; H357-T367 PolarHBondContact NE2-OG1 3.26Å
368	C	94.4	Very high	94.1	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	156.6	-178.7	-48.9	0	0	0	0	112.9	F297 E298 S300 V352 Q353 C354	F297-C368 VanDerWaalsContact CB-SG 3.54Å; F297-C368 HydrophobicContact CD2-CB 3.45Å; F297-C368 VanDerWaalsContact CD2-CB 3.45Å; F297-C368 WeakPolarHBondContact CD2-SG 3.24Å; F297-C368 HydrophobicContact CE2-CB 3.61Å; F297-C368 HydrophobicContact CG-CB 4.11Å; F297-C368 WeakPolarHBondContact CG-SG 3.44Å; F297-C368 HydrophobicContact CZ-CB 4.36Å; E298-C368 PolarHBondContact O-N 2.62Å; S300-C368 PolarHBondContact N-O 3.32Å; V352-C368 HydrophobicContact CG1-CB 3.62Å; Q353-C368 CarbonylContact O-C 3.56Å; Q353-C368 WeakPolarHBondContact O-CA 3.42Å; Q353-C368 WeakPolarHBondContact O-CB 3.37Å; C354-C368 HydrophobicContact CB-CB 4.03Å; C354-C368 WeakPolarHBondContact CB-SG 3.35Å; C354-C368 WeakPolarHBondContact SG-CB 3.39Å; C354-C368 CovalentContact SG-SG 2.03Å; C354-C368 PolarHBondContact SG-SG 3Å
369	W	94.6	Very high	94.5	Very high	73 Å²	73	64.1 Å²	64.1	28%	0.277	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	158.7	175.5	58.2	94.8	0	0	0	110	S300 Q353 K355	S300-W369 WeakPolarHBondContact O-CB 3.48Å; Q353-W369 HydrophobicContact CB-CZ2 4.19Å; Q353-W369 PolarHBondContact N-O 2.85Å; Q353-W369 PolarHBondContact O-N 3.37Å; K355-W369 HydrophobicContact CB-CH2 3.87Å; K355-W369 HydrophobicContact CB-CZ3 3.82Å
370	R	94.6	Very high	94.7	Very high	51 Å²	51	59.4 Å²	59.4	19%	0.192	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	125.7	172.2	-60.1	-176.3	68	-170.9	1.9	109.2	I288 W299 S303 D304 M350 E351	I288-R370 HydrophobicContact CG2-CG 4.4Å; W299-R370 HydrophobicContact CH2-CG 3.96Å; W299-R370 HydrophobicContact CZ3-CG 3.77Å; S303-R370 CarbonylContact C-O 3.52Å; S303-R370 VanDerWaalsContact CA-O 3.28Å; S303-R370 WeakPolarHBondContact CA-O 3.3Å; S303-R370 PolarHBondContact OG-N 2.88Å; D304-R370 PolarHBondContact N-O 2.86Å; M350-R370 HydrophobicContact CE-CB 4.06Å; E351-R370 CarbonylContact O-C 3.5Å; E351-R370 WeakPolarHBondContact O-CA 3.44Å
371	S	96.1	Very high	94.9	Very high	23 Å²	23	54.9 Å²	54.9	16%	0.161	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	147.4	-178.4	-177.1	0	0	0	0	110.6	D304 E351	D304-S371 WeakPolarHBondContact OD2-CA 3.29Å; E351-S371 PolarHBondContact N-O 3.37Å; E351-S371 PolarHBondContact O-N 3.09Å
372	L	97.5	Very high	95.4	Very high	13 Å²	13	52.3 Å²	52.3	7%	0.068	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-58.2	141.7	168.2	-70.3	163.6	0	0	0	110.4	H268 T271 K272 D304 I306 V346 M350	H268-L372 WeakPolarHBondContact O-CD1 3.18Å; T271-L372 HydrophobicContact CG2-CD1 3.91Å; T271-L372 HydrophobicContact CG2-CD2 3.98Å; T271-L372 HydrophobicContact CG2-CG 4.1Å; K272-L372 HydrophobicContact CB-CD1 3.86Å; K272-L372 HydrophobicContact CD-CD1 4.41Å; D304-L372 HydrophobicContact CB-CD1 4.42Å; D304-L372 HydrophobicContact CB-CG 3.87Å; D304-L372 WeakPolarHBondContact OD2-CG 3.45Å; D304-L372 PolarHBondContact OD2-N 2.96Å; I306-L372 HydrophobicContact CB-CD2 4.42Å; I306-L372 HydrophobicContact CD1-CD2 3.84Å; I306-L372 HydrophobicContact CG1-CD2 4.4Å; V346-L372 HydrophobicContact CG1-CD2 3.76Å; M350-L372 HydrophobicContact SD-CD2 3.85Å; M350-L372 HydrophobicContact SD-CG 4.37Å
373	P	97.1	Very high	95.6	Very high	3 Å²	3	51.6 Å²	51.6	2%	0.019	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-66	160.4	173.1	26.2	-32.9	0	0	0	111.5	H268 K349 F375 L378	H268-P373 PolarHBondContact NE2-O 3.2Å; K349-P373 HydrophobicContact CB-CB 4.22Å; K349-P373 HydrophobicContact CB-CG 3.92Å; K349-P373 VanDerWaalsContact O-CB 3.24Å; K349-P373 WeakPolarHBondContact O-CB 3.18Å; K349-P373 WeakPolarHBondContact O-CD 3.49Å; K349-P373 WeakPolarHBondContact O-CG 3.34Å; P373-F375 PolarHBondContact O-N 2.63Å; P373-L378 HydrophobicContact CB-CG 4.37Å; P373-L378 HydrophobicContact CG-CD1 3.76Å; P373-L378 HydrophobicContact CG-CD2 3.81Å; P373-L378 HydrophobicContact CG-CG 3.79Å
374	K	97.3	Very high	95.8	Very high	147 Å²	147	53.6 Å²	53.6	64%	0.639	25%	0.249	S	C	*	.	P	Polyproline II helix	trans	-60.1	127.6	167.3	-66.6	-179	-177.7	175.8	0	109.6	R376 N377 L378	K374-R376 PolarHBondContact O-N 2.88Å; K374-N377 WeakPolarHBondContact O-CB 3.42Å; K374-N377 PolarHBondContact O-N 3.38Å; K374-L378 PolarHBondContact O-N 3.18Å
375	F	98	Very high	96.2	Very high	12 Å²	12	49.5 Å²	49.5	5%	0.053	23%	0.226	C	C	.	.	H	α-helix	trans	-62.8	-30.1	-174.2	-162	-104	0	0	0	113.4	M184 E188 V261 A264 G265 H268 P373 N377 L378 G379	M184-F375 HydrophobicContact CE-CD1 4.14Å; M184-F375 HydrophobicContact CE-CD2 3.47Å; M184-F375 VanDerWaalsContact CE-CD2 3.47Å; M184-F375 HydrophobicContact CE-CE1 4.2Å; M184-F375 HydrophobicContact CE-CE2 3.59Å; M184-F375 HydrophobicContact CE-CG 3.78Å; M184-F375 HydrophobicContact CE-CZ 3.96Å; M184-F375 HydrophobicContact CG-CD1 3.84Å; M184-F375 HydrophobicContact CG-CE1 3.98Å; M184-F375 HydrophobicContact CG-CG 4.28Å; M184-F375 HydrophobicContact SD-CB 4.4Å; M184-F375 HydrophobicContact SD-CD1 4.26Å; M184-F375 HydrophobicContact SD-CD2 4.37Å; M184-F375 HydrophobicContact SD-CG 4.08Å; E188-F375 HydrophobicContact CB-CD1 3.89Å; E188-F375 HydrophobicContact CB-CE1 3.57Å; E188-F375 HydrophobicContact CG-CD1 3.99Å; E188-F375 HydrophobicContact CG-CE1 3.91Å; V261-F375 HydrophobicContact CG2-CE1 4.22Å; V261-F375 HydrophobicContact CG2-CZ 4.09Å; A264-F375 HydrophobicContact CB-CE2 4.27Å; G265-F375 VanDerWaalsContact CA-CE2 3.5Å; H268-F375 HydrophobicContact CB-CD2 4.2Å; H268-F375 HydrophobicContact CB-CE2 4.31Å; H268-F375 AromaticContact CD2-CD2 3.95Å; H268-F375 AromaticContact CG-CD2 3.99Å; P373-F375 PolarHBondContact O-N 2.63Å; F375-N377 VanDerWaalsContact C-N 3.29Å; F375-N377 PolarHBondContact O-N 3.02Å; F375-L378 HydrophobicContact CD2-CD1 3.79Å; F375-L378 HydrophobicContact CE2-CD1 4.19Å; F375-L378 WeakPolarHBondContact O-CB 3.21Å; F375-L378 PolarHBondContact O-N 2.85Å; F375-L378 VanDerWaalsContact O-N 3.13Å; F375-G379 PolarHBondContact O-N 2.97Å
376	R	98	Very high	96.6	Very high	110 Å²	110	44.7 Å²	44.7	42%	0.415	20%	0.202	S	C	.	.	H	α-helix	trans	-56.8	-40.4	171.9	-179.3	56.1	55.2	74.6	1.3	112.8	E188 Y191 K374 L378 G379 A380	E188-R376 VanDerWaalsContact OE1-CD 3.29Å; E188-R376 WeakPolarHBondContact OE1-CD 3.46Å; E188-R376 IonicContact OE1-NE 2.84Å; E188-R376 PolarHBondContact OE1-NE 3.24Å; E188-R376 IonicContact OE2-CZ 3.33Å; E188-R376 IonicContact OE2-NE 3.79Å; E188-R376 PolarHBondContact OE2-NE 3.18Å; E188-R376 IonicContact OE2-NH2 3.51Å; Y191-R376 VanDerWaalsContact CZ-CZ 3.48Å; Y191-R376 PolarHBondContact OH-NH1 2.85Å; K374-R376 PolarHBondContact O-N 2.88Å; R376-L378 VanDerWaalsContact C-N 3.32Å; R376-G379 PolarHBondContact O-N 2.82Å; R376-A380 PolarHBondContact O-N 3.42Å
377	N	97.5	Very high	96.8	Very high	72 Å²	72	45.3 Å²	45.3	39%	0.385	21%	0.209	S	C	.	.	H	α-helix	trans	-70.3	-32.8	179.1	-63.7	-3.3	0	0	0	111.1	K374 F375 Q381	K374-N377 WeakPolarHBondContact O-CB 3.42Å; K374-N377 PolarHBondContact O-N 3.38Å; F375-N377 VanDerWaalsContact C-N 3.29Å; F375-N377 PolarHBondContact O-N 3.02Å; N377-Q381 VanDerWaalsContact O-CG 3.29Å; N377-Q381 WeakPolarHBondContact O-CG 3.49Å; N377-Q381 PolarHBondContact O-N 2.65Å; N377-Q381 PolarHBondContact O-NE2 3.12Å
378	L	97.4	Very high	96.9	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-67.4	-44.1	172.9	-68.7	171.6	0	0	0	111.3	M345 V346 K349 P373 K374 F375 R376 Q381 L382	M345-L378 HydrophobicContact CG-CD2 3.78Å; V346-L378 HydrophobicContact CB-CD1 4.45Å; V346-L378 HydrophobicContact CG1-CD1 4.27Å; V346-L378 HydrophobicContact CG2-CD1 3.88Å; K349-L378 HydrophobicContact CB-CD2 3.92Å; K349-L378 HydrophobicContact CG-CD2 4.2Å; P373-L378 HydrophobicContact CB-CG 4.37Å; P373-L378 HydrophobicContact CG-CD1 3.76Å; P373-L378 HydrophobicContact CG-CD2 3.81Å; P373-L378 HydrophobicContact CG-CG 3.79Å; K374-L378 PolarHBondContact O-N 3.18Å; F375-L378 HydrophobicContact CD2-CD1 3.79Å; F375-L378 HydrophobicContact CE2-CD1 4.19Å; F375-L378 WeakPolarHBondContact O-CB 3.21Å; F375-L378 PolarHBondContact O-N 2.85Å; F375-L378 VanDerWaalsContact O-N 3.13Å; R376-L378 VanDerWaalsContact C-N 3.32Å; L378-Q381 PolarHBondContact O-N 3.22Å; L378-L382 WeakPolarHBondContact O-CB 3.36Å; L378-L382 WeakPolarHBondContact O-CG 3.28Å; L378-L382 PolarHBondContact O-N 2.81Å
379	G	97.8	Very high	97.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58	-47.6	175.9	0	0	0	0	0	112.4	Y257 F375 R376 Q381 L382 Q383	Y257-G379 PolarHBondContact OH-O 3.33Å; F375-G379 PolarHBondContact O-N 2.97Å; R376-G379 PolarHBondContact O-N 2.82Å; G379-Q381 PolarHBondContact O-N 2.92Å; G379-L382 PolarHBondContact O-N 3.41Å; G379-Q383 WeakPolarHBondContact O-CB 3.24Å; G379-Q383 PolarHBondContact O-N 3.15Å
380	A	98	Very high	97.2	Very high	34 Å²	34	49.3 Å²	49.3	28%	0.281	23%	0.231	S	C	.	.	H	α-helix	trans	-59.9	-45.2	177.3	0	0	0	0	0	112.1	R376 Q383 E384	R376-A380 PolarHBondContact O-N 3.42Å; A380-Q383 WeakPolarHBondContact O-CB 3.44Å; A380-Q383 PolarHBondContact O-N 3.05Å; A380-Q383 VanDerWaalsContact O-N 3.11Å; A380-E384 PolarHBondContact O-N 3.29Å
381	Q	97.4	Very high	97.3	Very high	36 Å²	36	48.9 Å²	48.9	17%	0.168	23%	0.231	C	C	.	.	H	α-helix	trans	-67.1	-39.7	178.3	-72.8	174.4	84.7	0	0	112.8	M345 N377 L378 G379 Q383 E384 R385	M345-Q381 HydrophobicContact CE-CB 4.48Å; M345-Q381 HydrophobicContact SD-CB 4.22Å; N377-Q381 VanDerWaalsContact O-CG 3.29Å; N377-Q381 WeakPolarHBondContact O-CG 3.49Å; N377-Q381 PolarHBondContact O-N 2.65Å; N377-Q381 PolarHBondContact O-NE2 3.12Å; L378-Q381 PolarHBondContact O-N 3.22Å; G379-Q381 PolarHBondContact O-N 2.92Å; Q381-Q383 PolarHBondContact O-N 3.18Å; Q381-E384 PolarHBondContact O-N 3.3Å; Q381-R385 WeakPolarHBondContact O-CG 3.4Å; Q381-R385 PolarHBondContact O-N 2.93Å; Q381-R385 VanDerWaalsContact O-N 3.15Å
382	L	98.3	Very high	97.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.2	-30.3	172.9	-73.3	174.3	0	0	0	111.7	Y257 A260 V261 A264 V341 M345 L378 G379 R385 F386	Y257-L382 HydrophobicContact CD2-CB 4.08Å; Y257-L382 HydrophobicContact CE2-CB 3.58Å; A260-L382 HydrophobicContact CB-CD1 4.31Å; A260-L382 HydrophobicContact CB-CD2 3.96Å; V261-L382 HydrophobicContact CB-CD1 4.02Å; V261-L382 HydrophobicContact CG2-CD1 4.26Å; A264-L382 HydrophobicContact CB-CD1 4.46Å; V341-L382 HydrophobicContact CG1-CD2 4.37Å; M345-L382 HydrophobicContact CB-CD2 4.39Å; M345-L382 HydrophobicContact CE-CD2 4.18Å; M345-L382 HydrophobicContact CG-CD2 4.36Å; M345-L382 HydrophobicContact CG-CG 4.45Å; L378-L382 WeakPolarHBondContact O-CB 3.36Å; L378-L382 WeakPolarHBondContact O-CG 3.28Å; L378-L382 PolarHBondContact O-N 2.81Å; G379-L382 PolarHBondContact O-N 3.41Å; L382-R385 PolarHBondContact O-N 3.47Å; L382-F386 WeakPolarHBondContact O-CB 3.39Å; L382-F386 PolarHBondContact O-N 2.76Å
383	Q	97.2	Very high	97.1	Very high	39 Å²	39	48.7 Å²	48.7	18%	0.182	23%	0.229	C	C	.	.	H	α-helix	trans	-70.6	-42.3	177.6	-172.1	-167.7	41.5	0	0	111	Q192 Y257 G379 A380 Q381 R385 F386 H387	Q192-Q383 PolarHBondContact O-NE2 3.2Å; Q192-Q383 VanDerWaalsContact OE1-CD 3.23Å; Y257-Q383 HydrophobicContact CE2-CB 4.2Å; G379-Q383 WeakPolarHBondContact O-CB 3.24Å; G379-Q383 PolarHBondContact O-N 3.15Å; A380-Q383 WeakPolarHBondContact O-CB 3.44Å; A380-Q383 PolarHBondContact O-N 3.05Å; A380-Q383 VanDerWaalsContact O-N 3.11Å; Q381-Q383 PolarHBondContact O-N 3.18Å; Q383-R385 VanDerWaalsContact C-N 3.31Å; Q383-R385 PolarHBondContact O-N 3.32Å; Q383-F386 WeakPolarHBondContact O-CA 3.37Å; Q383-F386 VanDerWaalsContact O-CB 3.3Å; Q383-F386 WeakPolarHBondContact O-CB 3.26Å; Q383-F386 PolarHBondContact O-N 3.27Å; Q383-H387 PolarHBondContact O-CD2 3.1Å; Q383-H387 PolarHBondContact O-N 3.41Å; Q383-H387 VanDerWaalsContact O-N 3.14Å
384	E	97.5	Very high	96.8	Very high	113 Å²	113	51.9 Å²	51.9	53%	0.528	24%	0.242	S	C	.	.	H	α-helix	trans	-55	-48.4	171	-69.1	170.3	-173.5	0	0	110.6	A380 Q381 F386 H387 E388	A380-E384 PolarHBondContact O-N 3.29Å; Q381-E384 PolarHBondContact O-N 3.3Å; E384-F386 VanDerWaalsContact C-N 3.25Å; E384-F386 PolarHBondContact O-N 3.2Å; E384-H387 PolarHBondContact O-N 2.9Å; E384-H387 VanDerWaalsContact O-N 3.12Å; E384-E388 PolarHBondContact O-N 3.23Å
385	R	97.2	Very high	96.3	Very high	84 Å²	84	48.3 Å²	48.3	32%	0.317	23%	0.228	S	C	.	.	H	α-helix	trans	-63.5	-28.5	175.4	-58.4	-52.3	174.3	-175.1	0.6	113.5	M345 Q381 L382 Q383 E388 A389 L463	M345-R385 HydrophobicContact CE-CG 4.22Å; Q381-R385 WeakPolarHBondContact O-CG 3.4Å; Q381-R385 PolarHBondContact O-N 2.93Å; Q381-R385 VanDerWaalsContact O-N 3.15Å; L382-R385 PolarHBondContact O-N 3.47Å; Q383-R385 VanDerWaalsContact C-N 3.31Å; Q383-R385 PolarHBondContact O-N 3.32Å; R385-E388 IonicContact NH1-OE2 3.64Å; R385-E388 PolarHBondContact O-N 3.18Å; R385-A389 WeakPolarHBondContact O-CA 3.38Å; R385-A389 PolarHBondContact O-N 2.87Å; R385-L463 HydrophobicContact CB-CD1 4.15Å; R385-L463 HydrophobicContact CB-CG 4.12Å
386	F	98	Very high	95.6	Very high	13 Å²	13	53.9 Å²	53.9	6%	0.057	25%	0.254	C	S	.	.	H	α-helix	trans	-66.3	-40.7	174.3	163.4	-84.9	0	0	0	111.3	F193 R253 E254 Y257 L382 Q383 E384 E388 A389 L463	F193-F386 AromaticContact CE1-CD1 3.87Å; F193-F386 HydrophobicContact CE1-CD1 3.87Å; F193-F386 HydrophobicContact CE1-CD2 4.42Å; F193-F386 AromaticContact CE1-CE1 3.52Å; F193-F386 HydrophobicContact CE1-CE1 3.52Å; F193-F386 HydrophobicContact CE1-CE2 4.07Å; F193-F386 HydrophobicContact CE1-CG 4.33Å; F193-F386 AromaticContact CE1-CZ 3.62Å; F193-F386 HydrophobicContact CE1-CZ 3.62Å; F193-F386 AromaticContact CZ-CD1 3.75Å; F193-F386 HydrophobicContact CZ-CD1 3.75Å; F193-F386 AromaticContact CZ-CD2 3.94Å; F193-F386 HydrophobicContact CZ-CD2 3.94Å; F193-F386 AromaticContact CZ-CE1 3.87Å; F193-F386 HydrophobicContact CZ-CE1 3.87Å; F193-F386 HydrophobicContact CZ-CE2 4.01Å; F193-F386 AromaticContact CZ-CG 3.81Å; F193-F386 HydrophobicContact CZ-CG 3.81Å; F193-F386 AromaticContact CZ-CZ 3.99Å; F193-F386 HydrophobicContact CZ-CZ 3.99Å; R253-F386 HydrophobicContact CB-CD2 4.4Å; R253-F386 HydrophobicContact CB-CE2 3.85Å; R253-F386 HydrophobicContact CB-CZ 4.44Å; R253-F386 VanDerWaalsContact CD-O 3.26Å; R253-F386 WeakPolarHBondContact CD-O 3.45Å; R253-F386 HydrophobicContact CG-CD2 3.56Å; R253-F386 HydrophobicContact CG-CE2 3.4Å; R253-F386 VanDerWaalsContact CG-CE2 3.4Å; R253-F386 HydrophobicContact CG-CG 4.31Å; R253-F386 HydrophobicContact CG-CZ 4Å; R253-F386 PolarHBondContact NH1-O 3.38Å; R253-F386 VanDerWaalsContact NH1-O 3.15Å; R253-F386 WeakPolarHBondContact O-CD2 3.19Å; E254-F386 HydrophobicContact CG-CE2 4.3Å; Y257-F386 HydrophobicContact CD2-CB 3.96Å; L382-F386 WeakPolarHBondContact O-CB 3.39Å; L382-F386 PolarHBondContact O-N 2.76Å; Q383-F386 WeakPolarHBondContact O-CA 3.37Å; Q383-F386 VanDerWaalsContact O-CB 3.3Å; Q383-F386 WeakPolarHBondContact O-CB 3.26Å; Q383-F386 PolarHBondContact O-N 3.27Å; E384-F386 VanDerWaalsContact C-N 3.25Å; E384-F386 PolarHBondContact O-N 3.2Å; F386-E388 VanDerWaalsContact C-N 3.28Å; F386-E388 PolarHBondContact O-N 3.29Å; F386-A389 VanDerWaalsContact O-CB 3.29Å; F386-A389 WeakPolarHBondContact O-CB 3.18Å; F386-A389 PolarHBondContact O-N 2.84Å; F386-L463 HydrophobicContact CB-CD1 4.2Å
387	H	96.2	Very high	94.8	Very high	100 Å²	100	53 Å²	53	46%	0.463	26%	0.258	S	S	.	.	H	α-helix	trans	-65.2	-34.2	178.2	-66.5	-60.5	0	0	0	112.3	H196 R253 Q383 E384	H196-H387 AromaticContact NE2-CE1 3.93Å; R253-H387 PolarHBondContact NH1-O 3.2Å; Q383-H387 PolarHBondContact O-CD2 3.1Å; Q383-H387 PolarHBondContact O-N 3.41Å; Q383-H387 VanDerWaalsContact O-N 3.14Å; E384-H387 PolarHBondContact O-N 2.9Å; E384-H387 VanDerWaalsContact O-N 3.12Å
388	E	96	Very high	94.3	Very high	130 Å²	130	50.8 Å²	50.8	61%	0.607	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.4	0.9	178.8	-61.1	179.8	163.8	0	0	114.4	E384 R385 F386	E384-E388 PolarHBondContact O-N 3.23Å; R385-E388 IonicContact NH1-OE2 3.64Å; R385-E388 PolarHBondContact O-N 3.18Å; F386-E388 VanDerWaalsContact C-N 3.28Å; F386-E388 PolarHBondContact O-N 3.29Å
389	A	97.7	Very high	93.9	Very high	9 Å²	9	51.2 Å²	51.2	7%	0.074	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-53.8	143.3	-171.6	0	0	0	0	0	113.4	R253 R385 F386 L463 Y465	R253-A389 HydrophobicContact CG-CB 3.83Å; R385-A389 WeakPolarHBondContact O-CA 3.38Å; R385-A389 PolarHBondContact O-N 2.87Å; F386-A389 VanDerWaalsContact O-CB 3.29Å; F386-A389 WeakPolarHBondContact O-CB 3.18Å; F386-A389 PolarHBondContact O-N 2.84Å; A389-L463 CarbonylContact C-O 3.52Å; A389-L463 VanDerWaalsContact CA-O 3.24Å; A389-L463 WeakPolarHBondContact CA-O 3.34Å; A389-L463 HydrophobicContact CB-CB 4.05Å; A389-L463 WeakPolarHBondContact CB-O 3.46Å; A389-Y465 HydrophobicContact CB-CD1 4.09Å; A389-Y465 HydrophobicContact CB-CE1 4.34Å; A389-Y465 WeakPolarHBondContact O-CE1 3.45Å
390	I	96.8	Very high	93.5	Very high	45 Å²	45	51.3 Å²	51.3	23%	0.231	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	128	-170.6	-57.5	172.6	0	0	0	110.3	V392 P401 D462 L463 I464 Y465	I390-V392 HydrophobicContact CG2-CG1 4.2Å; I390-P401 HydrophobicContact CG2-CB 3.72Å; I390-P401 HydrophobicContact CG2-CG 4.17Å; I390-D462 HydrophobicContact CD1-CB 4.03Å; I390-L463 PolarHBondContact N-O 2.65Å; I390-I464 HydrophobicContact CB-CG2 4.33Å; I390-I464 VanDerWaalsContact O-CA 3.27Å; I390-I464 WeakPolarHBondContact O-CA 3.4Å; I390-Y465 PolarHBondContact O-N 3.33Å
391	Q	97.3	Very high	93.3	Very high	43 Å²	43	50.3 Å²	50.3	20%	0.201	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	128.2	170.1	-161.4	171.2	-10.1	0	0	110.2	M402 Y465	Q391-M402 HydrophobicContact CB-CB 4.48Å; Q391-M402 HydrophobicContact CB-SD 4.38Å; Q391-M402 HydrophobicContact CG-CG 4.28Å; Q391-M402 HydrophobicContact CG-SD 3.58Å; Q391-M402 VanDerWaalsContact CG-SD 3.58Å; Q391-M402 PolarHBondContact O-N 2.03Å; Q391-Y465 CarbonylContact C-O 3.53Å; Q391-Y465 WeakPolarHBondContact CA-O 3.42Å; Q391-Y465 HydrophobicContact CB-CD2 4.32Å; Q391-Y465 HydrophobicContact CB-CE1 3.95Å; Q391-Y465 HydrophobicContact CB-CE2 3.71Å; Q391-Y465 HydrophobicContact CG-CD2 3.96Å; Q391-Y465 HydrophobicContact CG-CE2 3.5Å; Q391-Y465 VanDerWaalsContact CG-CE2 3.5Å; Q391-Y465 PolarHBondContact OE1-OH 3.04Å
392	V	95.3	Very high	93.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	150.5	-177.4	-60.3	0	0	0	0	112.8	K330 I390 L399 V400 P458 I464 Y465 I466	K330-V392 WeakPolarHBondContact CE-O 3.37Å; I390-V392 HydrophobicContact CG2-CG1 4.2Å; V392-L399 HydrophobicContact CB-CB 4.49Å; V392-L399 HydrophobicContact CG2-CD2 4.13Å; V392-V400 CarbonylContact C-O 3.53Å; V392-V400 VanDerWaalsContact CA-O 3.24Å; V392-V400 WeakPolarHBondContact CA-O 3.1Å; V392-P458 HydrophobicContact CG1-CG 3.9Å; V392-I464 HydrophobicContact CG1-CB 3.99Å; V392-I464 HydrophobicContact CG1-CG2 3.97Å; V392-I464 HydrophobicContact CG2-CB 4.21Å; V392-I464 HydrophobicContact CG2-CD1 4.24Å; V392-Y465 PolarHBondContact N-O 2.75Å; V392-I466 HydrophobicContact CG2-CG2 3.84Å
393	T	93.7	Very high	92.6	Very high	31 Å²	31	58.7 Å²	58.7	19%	0.19	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	167.3	166.7	-165.5	0	0	0	0	110.7	M395 L399 V400 L405	T393-M395 HydrophobicContact CG2-CG 3.95Å; T393-M395 HydrophobicContact CG2-SD 3.88Å; T393-L399 WeakPolarHBondContact O-CA 3.45Å; T393-V400 HydrophobicContact CG2-CB 4.29Å; T393-V400 PolarHBondContact N-O 3.41Å; T393-V400 PolarHBondContact O-N 2.95Å; T393-L405 HydrophobicContact CG2-CD2 4.13Å
394	Y	90	Very high	92.2	Very high	71 Å²	71	57.3 Å²	57.3	28%	0.278	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	112.8	177.3	-178.8	-105.8	0	0	0	109.4	A329 K330 L333 N397 R398 L399	A329-Y394 HydrophobicContact CB-CE1 3.93Å; A329-Y394 HydrophobicContact CB-CE2 4.24Å; K330-Y394 HydrophobicContact CB-CG 4.2Å; L333-Y394 HydrophobicContact CD1-CD2 3.94Å; L333-Y394 HydrophobicContact CD1-CE2 3.4Å; L333-Y394 VanDerWaalsContact CD1-CE2 3.4Å; Y394-N397 WeakPolarHBondContact OH-CA 3.35Å; Y394-N397 PolarHBondContact OH-OD1 2.91Å; Y394-N397 VanDerWaalsContact OH-OD1 3.04Å; Y394-R398 WeakPolarHBondContact CA-O 3.4Å; Y394-L399 HydrophobicContact CD2-CD2 4.17Å
395	M	86.9	Confident	91.6	Very high	72 Å²	72	53.9 Å²	53.9	36%	0.355	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	138	-177.2	-68.1	-178.3	71.4	0	0	109.4	T393 N397 R398 L405	T393-M395 HydrophobicContact CG2-CG 3.95Å; T393-M395 HydrophobicContact CG2-SD 3.88Å; M395-N397 PolarHBondContact O-N 2.96Å; M395-R398 PolarHBondContact N-O 3.48Å; M395-R398 WeakPolarHBondContact O-CG 3.05Å; M395-R398 PolarHBondContact O-N 3.49Å; M395-R398 VanDerWaalsContact O-O 3.14Å; M395-L405 HydrophobicContact SD-CD1 4.26Å; M395-L405 HydrophobicContact SD-CD2 3.69Å
396	Q	82.7	Confident	91.1	Very high	128 Å²	128	54.4 Å²	54.4	60%	0.598	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	43.7	177.8	-60.7	178.6	-23	0	0	113.5	R398	Q396-R398 VanDerWaalsContact C-N 3.27Å; Q396-R398 PolarHBondContact O-N 2.98Å
397	N	83.1	Confident	90.5	Very high	93 Å²	93	59.4 Å²	59.4	50%	0.497	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.9	21	-179.8	-65.1	-13.9	0	0	0	116.9	Y394 M395	Y394-N397 WeakPolarHBondContact OH-CA 3.35Å; Y394-N397 PolarHBondContact OH-OD1 2.91Å; Y394-N397 VanDerWaalsContact OH-OD1 3.04Å; M395-N397 PolarHBondContact O-N 2.96Å
398	R	85.3	Confident	89.8	Confident	24 Å²	24	56.3 Å²	56.3	9%	0.091	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	160.9	176.1	58	177.5	-175.3	128.1	29.5	112.3	D81 Y394 M395 Q396 V400 P452 L455	D81-R398 WeakPolarHBondContact OD2-CB 3.43Å; Y394-R398 WeakPolarHBondContact CA-O 3.4Å; M395-R398 PolarHBondContact N-O 3.48Å; M395-R398 WeakPolarHBondContact O-CG 3.05Å; M395-R398 PolarHBondContact O-N 3.49Å; M395-R398 VanDerWaalsContact O-O 3.14Å; Q396-R398 VanDerWaalsContact C-N 3.27Å; Q396-R398 PolarHBondContact O-N 2.98Å; R398-V400 HydrophobicContact CG-CG2 4.1Å; R398-P452 PolarHBondContact NH1-O 2.03Å; R398-P452 VanDerWaalsContact NH1-O 3.07Å; R398-P452 PolarHBondContact NH2-O 3.07Å; R398-L455 PolarHBondContact NH1-O 3.46Å
399	L	89.3	Confident	89.1	Confident	11 Å²	11	54.4 Å²	54.4	6%	0.058	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	129.7	173.9	-65	175.1	0	0	0	109.4	L333 V392 T393 Y394 I464	L333-L399 HydrophobicContact CB-CD1 3.78Å; L333-L399 HydrophobicContact CB-CD2 4.34Å; L333-L399 HydrophobicContact CB-CG 4.14Å; V392-L399 HydrophobicContact CB-CB 4.49Å; V392-L399 HydrophobicContact CG2-CD2 4.13Å; T393-L399 WeakPolarHBondContact O-CA 3.45Å; Y394-L399 HydrophobicContact CD2-CD2 4.17Å; L399-I464 HydrophobicContact CD1-CD1 3.58Å
400	V	90.1	Very high	88.3	Confident	1 Å²	1	61 Å²	61	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	131.9	-176.8	-179.8	0	0	0	0	109.4	V392 T393 R398 M402 L455	V392-V400 CarbonylContact C-O 3.53Å; V392-V400 VanDerWaalsContact CA-O 3.24Å; V392-V400 WeakPolarHBondContact CA-O 3.1Å; T393-V400 HydrophobicContact CG2-CB 4.29Å; T393-V400 PolarHBondContact N-O 3.41Å; T393-V400 PolarHBondContact O-N 2.95Å; R398-V400 HydrophobicContact CG-CG2 4.1Å; V400-M402 PolarHBondContact O-N 3.07Å; V400-L455 HydrophobicContact CG1-CB 3.98Å; V400-L455 HydrophobicContact CG1-CD1 3.95Å; V400-L455 HydrophobicContact CG1-CD2 3.91Å; V400-L455 HydrophobicContact CG1-CG 4.18Å
401	P	93.8	Very high	87.3	Confident	13 Å²	13	63.9 Å²	63.9	8%	0.084	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	127.6	171.9	-24.8	35.9	0	0	0	111.9	I390 K403 A404 L405 P456 P458	I390-P401 HydrophobicContact CG2-CB 3.72Å; I390-P401 HydrophobicContact CG2-CG 4.17Å; P401-K403 VanDerWaalsContact C-N 3.33Å; P401-K403 PolarHBondContact O-N 2.9Å; P401-A404 HydrophobicContact CB-CB 4.13Å; P401-A404 PolarHBondContact O-N 2.78Å; P401-L405 PolarHBondContact O-N 3.4Å; P401-P456 WeakPolarHBondContact CD-O 3.4Å; P401-P458 HydrophobicContact CG-CG 4.3Å
402	M	92	Very high	85.8	Confident	53 Å²	53	65.6 Å²	65.6	26%	0.261	32%	0.321	S	S	.	.	H	α-helix	trans	-62.7	-38.9	-179.1	-74.7	-170.6	56.2	0	0	112.4	Q391 V400 A404 L405 E406	Q391-M402 HydrophobicContact CB-CB 4.48Å; Q391-M402 HydrophobicContact CB-SD 4.38Å; Q391-M402 HydrophobicContact CG-CG 4.28Å; Q391-M402 HydrophobicContact CG-SD 3.58Å; Q391-M402 VanDerWaalsContact CG-SD 3.58Å; Q391-M402 PolarHBondContact O-N 2.03Å; V400-M402 PolarHBondContact O-N 3.07Å; M402-A404 VanDerWaalsContact C-N 3.28Å; M402-A404 PolarHBondContact O-N 3.4Å; M402-L405 WeakPolarHBondContact O-CB 3.17Å; M402-L405 PolarHBondContact O-N 2.8Å; M402-L405 VanDerWaalsContact O-N 3.11Å; M402-E406 WeakPolarHBondContact O-CG 3.25Å; M402-E406 PolarHBondContact O-N 3.01Å
403	K	89.7	Confident	84.4	Confident	160 Å²	160	70.6 Å²	70.6	70%	0.696	35%	0.348	S	S	*	.	H	α-helix	trans	-58.4	-39.2	176.3	-68.9	-177.1	178.1	177.7	0	112.6	P401 L405 E406 Q407	P401-K403 VanDerWaalsContact C-N 3.33Å; P401-K403 PolarHBondContact O-N 2.9Å; K403-L405 VanDerWaalsContact C-N 3.35Å; K403-E406 PolarHBondContact O-N 2.88Å; K403-Q407 VanDerWaalsContact O-CG 3.31Å; K403-Q407 WeakPolarHBondContact O-CG 3.38Å; K403-Q407 PolarHBondContact O-N 3.23Å
404	A	87.1	Confident	82.9	Confident	9 Å²	9	70.5 Å²	70.5	7%	0.074	35%	0.353	C	S	.	.	H	α-helix	trans	-68.2	-37	178.3	0	0	0	0	0	111.3	P401 M402 Q407 L408 L455 P456	P401-A404 HydrophobicContact CB-CB 4.13Å; P401-A404 PolarHBondContact O-N 2.78Å; M402-A404 VanDerWaalsContact C-N 3.28Å; M402-A404 PolarHBondContact O-N 3.4Å; A404-Q407 PolarHBondContact O-N 3.29Å; A404-L408 PolarHBondContact O-N 2.84Å; A404-L455 HydrophobicContact CB-CD2 3.56Å; A404-P456 HydrophobicContact CB-CG 3.79Å
405	L	85.7	Confident	81.4	Confident	41 Å²	41	70.8 Å²	70.8	22%	0.215	36%	0.36	C	S	.	.	H	α-helix	trans	-67.2	-39.5	174.3	-174.8	64.6	0	0	0	112.4	T393 M395 P401 M402 K403 Q407 L408 N409	T393-L405 HydrophobicContact CG2-CD2 4.13Å; M395-L405 HydrophobicContact SD-CD1 4.26Å; M395-L405 HydrophobicContact SD-CD2 3.69Å; P401-L405 PolarHBondContact O-N 3.4Å; M402-L405 WeakPolarHBondContact O-CB 3.17Å; M402-L405 PolarHBondContact O-N 2.8Å; M402-L405 VanDerWaalsContact O-N 3.11Å; K403-L405 VanDerWaalsContact C-N 3.35Å; L405-Q407 VanDerWaalsContact C-N 3.34Å; L405-L408 PolarHBondContact O-N 3.5Å; L405-N409 PolarHBondContact O-N 3.06Å; L405-N409 VanDerWaalsContact O-N 3.13Å; L405-N409 PolarHBondContact O-ND2 3.41Å
406	E	87.1	Confident	80.1	Confident	95 Å²	95	69.9 Å²	69.9	44%	0.444	36%	0.364	S	S	.	.	H	α-helix	trans	-64.1	-38.5	175.6	-72.4	170.1	-164.5	0	0	112.3	M402 K403 N409 K410	M402-E406 WeakPolarHBondContact O-CG 3.25Å; M402-E406 PolarHBondContact O-N 3.01Å; K403-E406 PolarHBondContact O-N 2.88Å; E406-N409 PolarHBondContact O-N 3.18Å; E406-K410 WeakPolarHBondContact O-CG 3.38Å; E406-K410 PolarHBondContact O-N 3.4Å
407	Q	84.8	Confident	78.9	Confident	118 Å²	118	68.9 Å²	68.9	55%	0.551	36%	0.362	S	S	*	.	H	α-helix	trans	-62.8	-46.2	175.8	-74.7	168.6	-19	0	0	111.4	K403 A404 L405 N409 K410 E411	K403-Q407 VanDerWaalsContact O-CG 3.31Å; K403-Q407 WeakPolarHBondContact O-CG 3.38Å; K403-Q407 PolarHBondContact O-N 3.23Å; A404-Q407 PolarHBondContact O-N 3.29Å; L405-Q407 VanDerWaalsContact C-N 3.34Å; Q407-N409 VanDerWaalsContact C-N 3.32Å; Q407-N409 PolarHBondContact O-N 3.42Å; Q407-K410 WeakPolarHBondContact O-CB 3.31Å; Q407-K410 PolarHBondContact O-N 2.97Å; Q407-K410 VanDerWaalsContact O-N 3.15Å; Q407-E411 WeakPolarHBondContact O-CG 3.4Å; Q407-E411 PolarHBondContact O-N 3.43Å
408	L	80.5	Confident	77.5	Confident	36 Å²	36	69.9 Å²	69.9	19%	0.188	37%	0.366	C	S	.	.	H	α-helix	trans	-59.2	-42.1	175.4	-70.8	-175.9	0	0	0	112.9	A404 L405 K410 E411 S412 L450 L455	A404-L408 PolarHBondContact O-N 2.84Å; L405-L408 PolarHBondContact O-N 3.5Å; L408-K410 VanDerWaalsContact C-N 3.32Å; L408-K410 PolarHBondContact O-N 3.48Å; L408-E411 PolarHBondContact O-N 3.31Å; L408-S412 WeakPolarHBondContact O-CB 3.48Å; L408-S412 PolarHBondContact O-N 2.97Å; L408-L450 HydrophobicContact CD2-CB 3.76Å; L408-L450 HydrophobicContact CD2-CD1 3.47Å; L408-L450 VanDerWaalsContact CD2-CD1 3.47Å; L408-L450 HydrophobicContact CD2-CG 4.14Å; L408-L455 HydrophobicContact CD1-CD1 3.64Å; L408-L455 HydrophobicContact CD1-CD2 3.52Å; L408-L455 HydrophobicContact CD1-CG 3.57Å; L408-L455 HydrophobicContact CG-CD2 4.13Å
409	N	81.9	Confident	76	Confident	89 Å²	89	75.5 Å²	75.5	48%	0.476	40%	0.398	S	S	.	.	H	α-helix	trans	-67.4	-35	178.7	-70.4	-20.8	0	0	0	111.9	L405 E406 Q407 N413	L405-N409 PolarHBondContact O-N 3.06Å; L405-N409 VanDerWaalsContact O-N 3.13Å; L405-N409 PolarHBondContact O-ND2 3.41Å; E406-N409 PolarHBondContact O-N 3.18Å; Q407-N409 VanDerWaalsContact C-N 3.32Å; Q407-N409 PolarHBondContact O-N 3.42Å; N409-N413 WeakPolarHBondContact O-CB 3.34Å; N409-N413 VanDerWaalsContact O-CG 3.3Å; N409-N413 PolarHBondContact O-N 3.43Å; N409-N413 PolarHBondContact O-ND2 3.42Å
410	K	81.8	Confident	74.4	Confident	147 Å²	147	78.5 Å²	78.5	64%	0.639	42%	0.419	S	S	*	.	H	α-helix	trans	-66.8	-41.4	174.4	-75.2	173.9	-178.1	177.4	0	111.8	E406 Q407 L408 N413 G414	E406-K410 WeakPolarHBondContact O-CG 3.38Å; E406-K410 PolarHBondContact O-N 3.4Å; Q407-K410 WeakPolarHBondContact O-CB 3.31Å; Q407-K410 PolarHBondContact O-N 2.97Å; Q407-K410 VanDerWaalsContact O-N 3.15Å; L408-K410 VanDerWaalsContact C-N 3.32Å; L408-K410 PolarHBondContact O-N 3.48Å; K410-N413 PolarHBondContact O-N 3Å; K410-G414 PolarHBondContact O-N 2.89Å
411	E	74.3	Confident	72.6	Confident	107 Å²	107	83.5 Å²	83.5	50%	0.5	44%	0.442	S	S	.	.	H	α-helix	trans	-65.8	-42.8	176.4	-71.7	174.3	-179	0	0	111.7	Q407 L408 N413 G414 N415	Q407-E411 WeakPolarHBondContact O-CG 3.4Å; Q407-E411 PolarHBondContact O-N 3.43Å; L408-E411 PolarHBondContact O-N 3.31Å; E411-N413 VanDerWaalsContact C-N 3.32Å; E411-N413 PolarHBondContact O-N 3.37Å; E411-G414 PolarHBondContact O-N 3.36Å; E411-N415 WeakPolarHBondContact O-CB 3.31Å; E411-N415 VanDerWaalsContact O-CG 3.25Å; E411-N415 PolarHBondContact O-N 3.43Å; E411-N415 PolarHBondContact O-ND2 3.29Å
412	S	67.3	Low	70.8	Confident	78 Å²	78	87.7 Å²	87.7	55%	0.545	47%	0.47	S	S	.	.	H	α-helix	trans	-61	-40.7	175.1	-171	0	0	0	0	112.1	L408 A416	L408-S412 WeakPolarHBondContact O-CB 3.48Å; L408-S412 PolarHBondContact O-N 2.97Å; S412-A416 PolarHBondContact O-N 3.31Å; S412-A416 VanDerWaalsContact O-N 3.13Å
413	N	65.7	Low	69.1	Low	105 Å²	105	88.8 Å²	88.8	56%	0.561	49%	0.487	S	S	*	.	H	α-helix	trans	-76.4	-33.4	178.4	-72.5	-17.1	0	0	0	112.8	N409 K410 E411 N415 A416 L417	N409-N413 WeakPolarHBondContact O-CB 3.34Å; N409-N413 VanDerWaalsContact O-CG 3.3Å; N409-N413 PolarHBondContact O-N 3.43Å; N409-N413 PolarHBondContact O-ND2 3.42Å; K410-N413 PolarHBondContact O-N 3Å; E411-N413 VanDerWaalsContact C-N 3.32Å; E411-N413 PolarHBondContact O-N 3.37Å; N413-N415 VanDerWaalsContact C-N 3.34Å; N413-A416 PolarHBondContact O-N 2.98Å; N413-L417 PolarHBondContact O-N 2.83Å
414	G	62.6	Low	67.3	Low	29 Å²	29	88.3 Å²	88.3	30%	0.299	49%	0.491	S	S	.	.	H	α-helix	trans	-63.3	-41.1	173.5	0	0	0	0	0	111.7	K410 E411 L417 L418	K410-G414 PolarHBondContact O-N 2.89Å; E411-G414 PolarHBondContact O-N 3.36Å; G414-L417 PolarHBondContact O-N 3.18Å; G414-L418 WeakPolarHBondContact O-CG 3.48Å; G414-L418 PolarHBondContact O-N 3.01Å
415	N	58.9	Low	65.5	Low	77 Å²	77	95.4 Å²	95.4	41%	0.412	53%	0.528	S	S	.	.	H	α-helix	trans	-67.8	-37.6	174.5	-67.6	-15.2	0	0	0	111.8	E411 N413 L417 L418 L419	E411-N415 WeakPolarHBondContact O-CB 3.31Å; E411-N415 VanDerWaalsContact O-CG 3.25Å; E411-N415 PolarHBondContact O-N 3.43Å; E411-N415 PolarHBondContact O-ND2 3.29Å; N413-N415 VanDerWaalsContact C-N 3.34Å; N415-L417 VanDerWaalsContact C-N 3.32Å; N415-L417 PolarHBondContact O-N 3.05Å; N415-L418 PolarHBondContact O-N 2.03Å; N415-L419 WeakPolarHBondContact O-CB 3.18Å; N415-L419 WeakPolarHBondContact O-CD1 3.32Å; N415-L419 WeakPolarHBondContact O-CG 3.44Å; N415-L419 PolarHBondContact O-N 2.79Å
416	A	58	Low	63.7	Low	53 Å²	53	98.2 Å²	98.2	44%	0.438	55%	0.55	S	S	.	*	H	α-helix	trans	-64.1	-35.8	172.6	0	0	0	0	0	112.6	S412 N413 S420	S412-A416 PolarHBondContact O-N 3.31Å; S412-A416 VanDerWaalsContact O-N 3.13Å; N413-A416 PolarHBondContact O-N 2.98Å; A416-S420 PolarHBondContact O-N 3.27Å; A416-S420 PolarHBondContact O-OG 3.3Å
417	L	58.1	Low	61.9	Low	108 Å²	108	98.4 Å²	98.4	57%	0.565	56%	0.562	S	S	*	*	H	α-helix	trans	-69.7	-40.1	174	-80.9	162.3	0	0	0	112.2	N413 G414 N415 L419 S420 H421	N413-L417 PolarHBondContact O-N 2.83Å; G414-L417 PolarHBondContact O-N 3.18Å; N415-L417 VanDerWaalsContact C-N 3.32Å; N415-L417 PolarHBondContact O-N 3.05Å; L417-L419 VanDerWaalsContact C-N 3.33Å; L417-L419 PolarHBondContact O-N 2.03Å; L417-S420 WeakPolarHBondContact CA-OG 3.43Å; L417-S420 PolarHBondContact O-N 3.1Å; L417-S420 PolarHBondContact O-OG 3.41Å; L417-H421 PolarHBondContact O-N 3.04Å; L417-H421 PolarHBondContact O-ND1 2.83Å
418	L	54.6	Low	60	Low	113 Å²	113	99.2 Å²	99.2	59%	0.592	58%	0.575	S	S	*	*	H	α-helix	trans	-65.3	-36.1	175.2	-73.3	171.1	0	0	0	112.4	G414 N415 S420	G414-L418 WeakPolarHBondContact O-CG 3.48Å; G414-L418 PolarHBondContact O-N 3.01Å; N415-L418 PolarHBondContact O-N 2.03Å; L418-S420 PolarHBondContact O-N 3.46Å
419	L	52.6	Low	58.4	Low	143 Å²	143	102 Å²	102	75%	0.749	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-12.7	175.9	-73.8	161.7	0	0	0	113.9	N415 L417	N415-L419 WeakPolarHBondContact O-CB 3.18Å; N415-L419 WeakPolarHBondContact O-CD1 3.32Å; N415-L419 WeakPolarHBondContact O-CG 3.44Å; N415-L419 PolarHBondContact O-N 2.79Å; L417-L419 VanDerWaalsContact C-N 3.33Å; L417-L419 PolarHBondContact O-N 2.03Å
420	S	55.1	Low	56.7	Low	73 Å²	73	101.5 Å²	101.5	51%	0.51	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105	2.2	-179.9	50.2	0	0	0	0	114.2	A416 L417 L418 P422	A416-S420 PolarHBondContact O-N 3.27Å; A416-S420 PolarHBondContact O-OG 3.3Å; L417-S420 WeakPolarHBondContact CA-OG 3.43Å; L417-S420 PolarHBondContact O-N 3.1Å; L417-S420 PolarHBondContact O-OG 3.41Å; L418-S420 PolarHBondContact O-N 3.46Å; S420-P422 WeakPolarHBondContact O-CD 2.99Å
421	H	53.4	Low	55	Low	106 Å²	106	101.1 Å²	101.1	49%	0.491	63%	0.631	S	S	.	*			trans	-77	113.4	174.9	-82.5	67.9	0	0	0	111.2	L417 A423	L417-H421 PolarHBondContact O-N 3.04Å; L417-H421 PolarHBondContact O-ND1 2.83Å; H421-A423 PolarHBondContact O-N 3.09Å
422	P	56.3	Low	53.5	Low	102 Å²	102	104 Å²	104	66%	0.662	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-67.7	-16.4	179.1	-15.4	30.5	0	0	0	113.2	S420 L424 L425	S420-P422 WeakPolarHBondContact O-CD 2.99Å; P422-L424 VanDerWaalsContact C-N 3.25Å; P422-L424 PolarHBondContact O-N 3.31Å; P422-L425 PolarHBondContact O-N 3.15Å; P422-L425 VanDerWaalsContact O-N 3.1Å
423	A	56.4	Low	52.5	Low	76 Å²	76	106.7 Å²	106.7	63%	0.628	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-70.7	-14.3	-173.4	0	0	0	0	0	114.4	H421 L425	H421-A423 PolarHBondContact O-N 3.09Å; A423-L425 VanDerWaalsContact C-N 3.3Å
424	L	50.6	Low	51.7	Low	149 Å²	149	106 Å²	106	78%	0.78	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-81.7	-10	172.1	-75	166.2	0	0	0	113	P422	P422-L424 VanDerWaalsContact C-N 3.25Å; P422-L424 PolarHBondContact O-N 3.31Å
425	L	49.7	Very low	50.9	Low	159 Å²	159	116.7 Å²	116.7	83%	0.832	70%	0.7	S	S	*	*	S	Bend	trans	-101.1	-0.4	-176	-79	149.2	0	0	0	114.1	P422 A423	P422-L425 PolarHBondContact O-N 3.15Å; P422-L425 VanDerWaalsContact O-N 3.1Å; A423-L425 VanDerWaalsContact C-N 3.3Å
426	S	48.7	Very low	50.4	Low	99 Å²	99	118.5 Å²	118.5	69%	0.692	71%	0.714	S	S	*	*			trans	-109.5	7	-167.9	62.3	0	0	0	0	117.2
427	S	49	Very low	49.7	Very low	99 Å²	99	119.5 Å²	119.5	69%	0.692	72%	0.718	S	S	*	*	S	Bend	trans	-117.2	88.8	173.3	73.8	0	0	0	0	112
428	T	45	Very low	49.3	Very low	135 Å²	135	124.9 Å²	124.9	83%	0.828	73%	0.731	S	S	*	*			trans	171.2	92.2	136.5	33.6	0	0	0	0	107.9	A430	T428-A430 VanDerWaalsContact C-N 3.29Å; T428-A430 PolarHBondContact O-N 2.99Å
429	G	46.6	Very low	49.1	Very low	94 Å²	94	125.3 Å²	125.3	97%	0.969	73%	0.734	S	S	*	*			trans	-67.4	94.3	156.2	0	0	0	0	0	108
430	A	46.9	Very low	49	Very low	80 Å²	80	122.2 Å²	122.2	66%	0.661	72%	0.721	S	S	*	*			trans	-156.2	108.9	163.5	0	0	0	0	0	108.8	T428 M432	T428-A430 VanDerWaalsContact C-N 3.29Å; T428-A430 PolarHBondContact O-N 2.99Å; A430-M432 PolarHBondContact O-N 3.44Å; A430-M432 VanDerWaalsContact O-N 3.15Å
431	T	44.6	Very low	48.6	Very low	138 Å²	138	124.5 Å²	124.5	85%	0.847	73%	0.726	S	S	*	*			trans	-52.2	108	167.1	43.1	0	0	0	0	111.1
432	M	44	Very low	48.2	Very low	169 Å²	169	124.3 Å²	124.3	83%	0.833	73%	0.729	S	S	*	*			trans	-148.2	117.1	156.1	-88.9	-74.5	101.4	0	0	108.2	A430 S434	A430-M432 PolarHBondContact O-N 3.44Å; A430-M432 VanDerWaalsContact O-N 3.15Å; M432-S434 PolarHBondContact O-N 2.93Å; M432-S434 VanDerWaalsContact O-N 3.15Å
433	S	45.5	Very low	47.7	Very low	134 Å²	134	123.8 Å²	123.8	94%	0.937	73%	0.728	S	S	*	*			trans	-65.4	104.1	169.4	-173.5	0	0	0	0	108.7
434	S	48.5	Very low	47.2	Very low	91 Å²	91	126.8 Å²	126.8	64%	0.636	73%	0.733	S	S	*	*			trans	-148	123.9	164.5	63.7	0	0	0	0	109.8	M432 V436	M432-S434 PolarHBondContact O-N 2.93Å; M432-S434 VanDerWaalsContact O-N 3.15Å; S434-V436 PolarHBondContact O-N 3.2Å
435	R	46.8	Very low	47.2	Very low	252 Å²	252	123.5 Å²	123.5	95%	0.951	72%	0.719	S	S	*	*			trans	-52.6	105.4	174.5	-67.2	173.1	-174.1	177.2	0.9	109.8	S437	R435-S437 PolarHBondContact O-N 2.49Å
436	V	48.2	Very low	46.8	Very low	115 Å²	115	120.6 Å²	120.6	70%	0.697	71%	0.712	S	S	*	*			trans	-83.6	110.7	159.6	179.3	0	0	0	0	106.3	S434 T440	S434-V436 PolarHBondContact O-N 3.2Å; V436-T440 WeakPolarHBondContact CG1-OG1 3.38Å
437	S	42.2	Very low	46.6	Very low	75 Å²	75	119.2 Å²	119.2	52%	0.524	70%	0.702	S	S	.	*			trans	-53	135.4	176.4	-82.8	0	0	0	0	110.8	R435 N439 T440	R435-S437 PolarHBondContact O-N 2.49Å; S437-N439 PolarHBondContact O-N 3.13Å; S437-T440 PolarHBondContact O-N 3.3Å; S437-T440 PolarHBondContact O-OG1 3.43Å
438	R	50	Low	46.4	Very low	221 Å²	221	120.2 Å²	120.2	83%	0.834	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.4	-26	170.3	-76.5	-179.1	-171.8	173.6	2.4	112.8	T440 L441 D442	R438-T440 PolarHBondContact O-N 3.21Å; R438-L441 PolarHBondContact O-N 2.99Å; R438-D442 PolarHBondContact O-N 3.4Å
439	N	51.1	Low	46.6	Very low	122 Å²	122	119 Å²	119	65%	0.652	70%	0.702	S	S	*	*	H	α-helix	trans	-65	-17.8	179.6	-60	8.9	0	0	0	114.7	S437 S443	S437-N439 PolarHBondContact O-N 3.13Å; N439-S443 PolarHBondContact O-N 3.01Å
440	T	50.5	Low	46.9	Very low	77 Å²	77	118.5 Å²	118.5	47%	0.472	68%	0.676	S	S	.	*	H	α-helix	trans	-84.5	-20.2	175.4	49	0	0	0	0	113.3	V436 S437 R438	V436-T440 WeakPolarHBondContact CG1-OG1 3.38Å; S437-T440 PolarHBondContact O-N 3.3Å; S437-T440 PolarHBondContact O-OG1 3.43Å; R438-T440 PolarHBondContact O-N 3.21Å
441	L	46.5	Very low	47.4	Very low	121 Å²	121	117.4 Å²	117.4	63%	0.634	66%	0.664	S	S	*	*	H	α-helix	trans	-79.7	-34.3	170.5	-166.3	67.3	0	0	0	110.9	R438 S443 L444 T445	R438-L441 PolarHBondContact O-N 2.99Å; L441-S443 PolarHBondContact O-N 3.28Å; L441-L444 PolarHBondContact O-N 3.22Å; L441-L444 VanDerWaalsContact O-N 3.1Å; L441-T445 PolarHBondContact O-N 2.99Å; L441-T445 PolarHBondContact O-OG1 2.84Å
442	D	44.9	Very low	48	Very low	103 Å²	103	113 Å²	113	55%	0.551	64%	0.638	S	S	*	*	H	α-helix	trans	-66.7	-21.9	172.4	-68	-30.3	0	0	0	112.9	R438 T445	R438-D442 PolarHBondContact O-N 3.4Å; D442-T445 WeakPolarHBondContact CA-OG1 3.13Å; D442-T445 PolarHBondContact O-OG1 3.39Å
443	S	46.6	Very low	49	Very low	91 Å²	91	109.1 Å²	109.1	64%	0.636	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-19.5	172.8	-179.2	0	0	0	0	113.6	N439 L441	N439-S443 PolarHBondContact O-N 3.01Å; L441-S443 PolarHBondContact O-N 3.28Å
444	L	46.4	Very low	50.2	Low	138 Å²	138	105.8 Å²	105.8	72%	0.723	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	-17.1	179.9	-75.6	154.7	0	0	0	112.2	L441	L441-L444 PolarHBondContact O-N 3.22Å; L441-L444 VanDerWaalsContact O-N 3.1Å
445	T	49.2	Very low	51.4	Low	80 Å²	80	102.1 Å²	102.1	49%	0.491	58%	0.576	S	S	.	*	S	Bend	trans	-93.5	1.7	172.6	55	0	0	0	0	113.5	L441 D442 S447	L441-T445 PolarHBondContact O-N 2.99Å; L441-T445 PolarHBondContact O-OG1 2.84Å; D442-T445 WeakPolarHBondContact CA-OG1 3.13Å; D442-T445 PolarHBondContact O-OG1 3.39Å; T445-S447 PolarHBondContact O-N 3.27Å
446	S	41.2	Very low	53	Low	98 Å²	98	93.9 Å²	93.9	69%	0.685	56%	0.556	S	S	*	*			trans	-75.2	30.7	164.8	-163.7	0	0	0	0	112.4	T448	S446-T448 VanDerWaalsContact C-N 3.34Å; S446-T448 PolarHBondContact O-N 2.84Å
447	S	45.5	Very low	54.4	Low	71 Å²	71	91 Å²	91	50%	0.497	54%	0.54	S	S	.	.			trans	-59.7	103.9	160.7	55.6	0	0	0	0	106.4	T445 S449	T445-S447 PolarHBondContact O-N 3.27Å; S447-S449 PolarHBondContact O-N 2.93Å
448	T	44.8	Very low	56.6	Low	120 Å²	120	88.4 Å²	88.4	74%	0.736	52%	0.522	S	S	*	.			trans	-28	96.7	166.4	33	0	0	0	0	110.3	S446 L450	S446-T448 VanDerWaalsContact C-N 3.34Å; S446-T448 PolarHBondContact O-N 2.84Å; T448-L450 PolarHBondContact O-N 2.85Å
449	S	47.8	Very low	58.6	Low	110 Å²	110	81.3 Å²	81.3	77%	0.769	50%	0.504	S	S	*	.			trans	-62.4	98.7	159.4	62.2	0	0	0	0	103.6	S447 S451	S447-S449 PolarHBondContact O-N 2.93Å; S449-S451 PolarHBondContact O-N 2.84Å
450	L	53.3	Low	60.4	Low	83 Å²	83	78.8 Å²	78.8	44%	0.435	49%	0.488	S	S	.	.			trans	-55.8	96.6	175.6	-84	147.4	0	0	0	106	L408 T448 S454	L408-L450 HydrophobicContact CD2-CB 3.76Å; L408-L450 HydrophobicContact CD2-CD1 3.47Å; L408-L450 VanDerWaalsContact CD2-CD1 3.47Å; L408-L450 HydrophobicContact CD2-CG 4.14Å; T448-L450 PolarHBondContact O-N 2.85Å; L450-S454 VanDerWaalsContact CD2-OG 3.3Å; L450-S454 WeakPolarHBondContact CD2-OG 3.42Å
451	S	57.1	Low	62.4	Low	57 Å²	57	77.2 Å²	77.2	40%	0.399	48%	0.477	S	S	.	.			trans	-53.7	134.4	177.5	63.2	0	0	0	0	105.7	S449 S453 S454	S449-S451 PolarHBondContact O-N 2.84Å; S451-S453 WeakPolarHBondContact CB-OG 3Å; S451-S453 PolarHBondContact O-N 2.98Å; S451-S453 PolarHBondContact OG-OG 2.94Å; S451-S454 PolarHBondContact O-N 3.38Å; S451-S454 PolarHBondContact O-OG 3.09Å
452	P	58.2	Low	64.7	Low	46 Å²	46	73.1 Å²	73.1	30%	0.299	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-52.8	-31.7	-172.9	-26.9	31.8	0	0	0	111.8	R398 S454 L455	R398-P452 PolarHBondContact NH1-O 2.03Å; R398-P452 VanDerWaalsContact NH1-O 3.07Å; R398-P452 PolarHBondContact NH2-O 3.07Å; P452-S454 PolarHBondContact O-N 3.35Å; P452-L455 HydrophobicContact CB-CD1 4.01Å; P452-L455 VanDerWaalsContact O-CB 3.31Å; P452-L455 WeakPolarHBondContact O-CB 3.28Å; P452-L455 WeakPolarHBondContact O-CD1 3.06Å; P452-L455 PolarHBondContact O-N 3.47Å
453	S	64.1	Low	67.2	Low	86 Å²	86	68.2 Å²	68.2	60%	0.601	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-43.6	-24.1	170.2	27.8	0	0	0	0	117.3	S451	S451-S453 WeakPolarHBondContact CB-OG 3Å; S451-S453 PolarHBondContact O-N 2.98Å; S451-S453 PolarHBondContact OG-OG 2.94Å
454	S	71.7	Confident	69.6	Low	64 Å²	64	63.9 Å²	63.9	45%	0.448	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-88	-5.7	176.7	64.4	0	0	0	0	114.8	L450 S451 P452	L450-S454 VanDerWaalsContact CD2-OG 3.3Å; L450-S454 WeakPolarHBondContact CD2-OG 3.42Å; S451-S454 PolarHBondContact O-N 3.38Å; S451-S454 PolarHBondContact O-OG 3.09Å; P452-S454 PolarHBondContact O-N 3.35Å
455	L	73.4	Confident	72.1	Confident	14 Å²	14	58.6 Å²	58.6	7%	0.073	37%	0.369	C	S	.	.	S	Bend	trans	-62.9	139.8	175.9	-82.2	142	0	0	0	110.9	R398 V400 A404 L408 P452	R398-L455 PolarHBondContact NH1-O 3.46Å; V400-L455 HydrophobicContact CG1-CB 3.98Å; V400-L455 HydrophobicContact CG1-CD1 3.95Å; V400-L455 HydrophobicContact CG1-CD2 3.91Å; V400-L455 HydrophobicContact CG1-CG 4.18Å; A404-L455 HydrophobicContact CB-CD2 3.56Å; L408-L455 HydrophobicContact CD1-CD1 3.64Å; L408-L455 HydrophobicContact CD1-CD2 3.52Å; L408-L455 HydrophobicContact CD1-CG 3.57Å; L408-L455 HydrophobicContact CG-CD2 4.13Å; P452-L455 HydrophobicContact CB-CD1 4.01Å; P452-L455 VanDerWaalsContact O-CB 3.31Å; P452-L455 WeakPolarHBondContact O-CB 3.28Å; P452-L455 WeakPolarHBondContact O-CD1 3.06Å; P452-L455 PolarHBondContact O-N 3.47Å
456	P	80.7	Confident	74.4	Confident	79 Å²	79	55.5 Å²	55.5	51%	0.513	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-61.1	142.6	176.5	27.2	-34.5	0	0	0	110.5	P401 A404	P401-P456 WeakPolarHBondContact CD-O 3.4Å; A404-P456 HydrophobicContact CB-CG 3.79Å
457	S	77.9	Confident	77	Confident	54 Å²	54	53 Å²	53	38%	0.378	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-97.9	149.4	169.2	-68.3	0	0	0	0	109.7
458	P	87.9	Confident	79.4	Confident	22 Å²	22	56.4 Å²	56.4	14%	0.143	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-56.5	144.6	170.5	-19.5	31.6	0	0	0	111.2	V392 P401 D462 I464	V392-P458 HydrophobicContact CG1-CG 3.9Å; P401-P458 HydrophobicContact CG-CG 4.3Å; P458-D462 HydrophobicContact CB-CB 4.35Å; P458-I464 HydrophobicContact CB-CG2 3.69Å; P458-I464 HydrophobicContact CG-CG2 3.85Å
459	T	91.5	Very high	81.9	Confident	72 Å²	72	52.9 Å²	52.9	44%	0.442	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-79.8	169.5	178.3	73.1	0	0	0	0	111.8	H337 N461 D462	H337-T459 PolarHBondContact CE1-O 3.22Å; H337-T459 VanDerWaalsContact CE1-O 3.22Å; H337-T459 PolarHBondContact NE2-O 3.22Å; T459-N461 PolarHBondContact O-N 1.99Å; T459-N461 VanDerWaalsContact O-N 3.14Å; T459-N461 PolarHBondContact OG1-N 3.46Å; T459-D462 WeakPolarHBondContact CB-OD2 3.25Å; T459-D462 WeakPolarHBondContact CG2-OD2 3.04Å; T459-D462 PolarHBondContact N-OD2 3.29Å; T459-D462 PolarHBondContact O-N 2.83Å; T459-D462 PolarHBondContact OG1-OD1 2.86Å; T459-D462 PolarHBondContact OG1-OD2 2.67Å
460	E	89	Confident	84.2	Confident	69 Å²	69	49.1 Å²	49.1	32%	0.322	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-13.1	175.5	56.9	-176	-170.1	0	0	114.9	Y340 V341 H344	Y340-E460 HydrophobicContact CE1-CB 3.63Å; Y340-E460 PolarHBondContact OH-OE2 2.81Å; V341-E460 WeakPolarHBondContact CG2-O 3.5Å; H344-E460 IonicContact CE1-OE1 3.82Å; H344-E460 IonicContact CE1-OE2 3.93Å; H344-E460 WeakPolarHBondContact NE2-CG 3.39Å; H344-E460 IonicContact NE2-OE1 3.72Å; H344-E460 PolarHBondContact NE2-OE1 2.98Å; H344-E460 VanDerWaalsContact NE2-OE1 3.15Å; H344-E460 IonicContact NE2-OE2 3.78Å
461	N	91.9	Very high	86.2	Confident	44 Å²	44	49.9 Å²	49.9	24%	0.235	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-9.9	-179.7	-64.6	-53.3	0	0	0	113.4	H344 T459	H344-N461 PolarHBondContact CD2-OD1 3.3Å; T459-N461 PolarHBondContact O-N 1.99Å; T459-N461 VanDerWaalsContact O-N 3.14Å; T459-N461 PolarHBondContact OG1-N 3.46Å
462	D	94.7	Very high	88	Confident	34 Å²	34	47.7 Å²	47.7	18%	0.182	29%	0.285	C	S	.	.			trans	-85.7	127.4	-174.7	-63	-35.9	0	0	0	111.2	H337 V341 I390 P458 T459	H337-D462 PolarHBondContact CD2-O 3.03Å; H337-D462 PolarHBondContact NE2-O 2.83Å; V341-D462 WeakPolarHBondContact CG2-O 3.05Å; I390-D462 HydrophobicContact CD1-CB 4.03Å; P458-D462 HydrophobicContact CB-CB 4.35Å; T459-D462 WeakPolarHBondContact CB-OD2 3.25Å; T459-D462 WeakPolarHBondContact CG2-OD2 3.04Å; T459-D462 PolarHBondContact N-OD2 3.29Å; T459-D462 PolarHBondContact O-N 2.83Å; T459-D462 PolarHBondContact OG1-OD1 2.86Å; T459-D462 PolarHBondContact OG1-OD2 2.67Å
463	L	98	Very high	89.9	Confident	0 Å²	0	46 Å²	46	0%	0	27%	0.274	C	S	.	.			trans	-75.7	139.5	165.1	-68.6	179.7	0	0	0	110.1	A256 A260 N338 V341 R385 F386 A389 I390	A256-L463 HydrophobicContact CB-CB 4.42Å; A260-L463 HydrophobicContact CB-CD2 3.62Å; N338-L463 HydrophobicContact CB-CD2 4.42Å; V341-L463 HydrophobicContact CB-CD2 4.08Å; V341-L463 HydrophobicContact CG1-CD2 3.75Å; V341-L463 HydrophobicContact CG1-CG 4.36Å; V341-L463 HydrophobicContact CG2-CD2 4.49Å; R385-L463 HydrophobicContact CB-CD1 4.15Å; R385-L463 HydrophobicContact CB-CG 4.12Å; F386-L463 HydrophobicContact CB-CD1 4.2Å; A389-L463 CarbonylContact C-O 3.52Å; A389-L463 VanDerWaalsContact CA-O 3.24Å; A389-L463 WeakPolarHBondContact CA-O 3.34Å; A389-L463 HydrophobicContact CB-CB 4.05Å; A389-L463 WeakPolarHBondContact CB-O 3.46Å; I390-L463 PolarHBondContact N-O 2.65Å
464	I	97.8	Very high	91.4	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	147	-176.6	62.8	176.9	0	0	0	112.5	A256 T334 H337 N338 I390 V392 L399 P458	A256-I464 VanDerWaalsContact CB-O 3.32Å; A256-I464 WeakPolarHBondContact CB-O 2.99Å; T334-I464 HydrophobicContact CG2-CD1 4.4Å; T334-I464 HydrophobicContact CG2-CG1 3.96Å; T334-I464 WeakPolarHBondContact CG2-O 3.49Å; H337-I464 HydrophobicContact CB-CD1 3.63Å; H337-I464 HydrophobicContact CB-CG1 4.17Å; H337-I464 VanDerWaalsContact CG-CD1 3.49Å; N338-I464 PolarHBondContact ND2-O 3.28Å; N338-I464 PolarHBondContact OD1-N 3.03Å; N338-I464 PolarHBondContact OD1-O 3.19Å; I390-I464 HydrophobicContact CB-CG2 4.33Å; I390-I464 VanDerWaalsContact O-CA 3.27Å; I390-I464 WeakPolarHBondContact O-CA 3.4Å; V392-I464 HydrophobicContact CG1-CB 3.99Å; V392-I464 HydrophobicContact CG1-CG2 3.97Å; V392-I464 HydrophobicContact CG2-CB 4.21Å; V392-I464 HydrophobicContact CG2-CD1 4.24Å; L399-I464 HydrophobicContact CD1-CD1 3.58Å; P458-I464 HydrophobicContact CB-CG2 3.69Å; P458-I464 HydrophobicContact CG-CG2 3.85Å
465	Y	98.3	Very high	92.4	Very high	26 Å²	26	48.8 Å²	48.8	10%	0.102	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	161.5	179.2	71.5	-85.8	0	0	0	111.7	R253 A389 I390 Q391 V392 S467	R253-Y465 HydrophobicContact CB-CD1 4.27Å; R253-Y465 HydrophobicContact CB-CG 4.29Å; R253-Y465 HydrophobicContact CG-CD1 4.25Å; R253-Y465 PolarHBondContact NH2-OH 2.02Å; A389-Y465 HydrophobicContact CB-CD1 4.09Å; A389-Y465 HydrophobicContact CB-CE1 4.34Å; A389-Y465 WeakPolarHBondContact O-CE1 3.45Å; I390-Y465 PolarHBondContact O-N 3.33Å; Q391-Y465 CarbonylContact C-O 3.53Å; Q391-Y465 WeakPolarHBondContact CA-O 3.42Å; Q391-Y465 HydrophobicContact CB-CD2 4.32Å; Q391-Y465 HydrophobicContact CB-CE1 3.95Å; Q391-Y465 HydrophobicContact CB-CE2 3.71Å; Q391-Y465 HydrophobicContact CG-CD2 3.96Å; Q391-Y465 HydrophobicContact CG-CE2 3.5Å; Q391-Y465 VanDerWaalsContact CG-CE2 3.5Å; Q391-Y465 PolarHBondContact OE1-OH 3.04Å; V392-Y465 PolarHBondContact N-O 2.75Å; Y465-S467 VanDerWaalsContact CD2-O 3.28Å; Y465-S467 WeakPolarHBondContact CD2-O 3.28Å
466	I	97.1	Very high	93.4	Very high	16 Å²	16	49.5 Å²	49.5	8%	0.082	27%	0.274	C	S	.	.	S	Bend	trans	-119.3	-19.3	-173.7	56.8	160.6	0	0	0	114.4	G251 K330 L331 T334 V392	G251-I466 WeakPolarHBondContact O-CG1 3.33Å; G251-I466 PolarHBondContact O-N 3.18Å; K330-I466 HydrophobicContact CD-CB 4.4Å; K330-I466 HydrophobicContact CD-CD1 4.48Å; K330-I466 HydrophobicContact CD-CG2 4.24Å; K330-I466 HydrophobicContact CG-CB 4.43Å; K330-I466 HydrophobicContact CG-CD1 4.3Å; K330-I466 HydrophobicContact CG-CG2 3.83Å; L331-I466 HydrophobicContact CB-CD1 3.9Å; L331-I466 HydrophobicContact CD1-CD1 3.83Å; L331-I466 HydrophobicContact CD1-CG1 4.46Å; L331-I466 HydrophobicContact CG-CD1 4.39Å; T334-I466 HydrophobicContact CG2-CG2 3.89Å; T334-I466 WeakPolarHBondContact OG1-CG2 3.27Å; V392-I466 HydrophobicContact CG2-CG2 3.84Å
467	S	96.5	Very high	93.9	Very high	44 Å²	44	47.8 Å²	47.8	31%	0.308	26%	0.263	S	S	.	.	S	Bend	trans	-131	142.2	-176.2	-53	0	0	0	0	109.8	K250 G251 T252 Y465	K250-S467 VanDerWaalsContact O-CB 3.29Å; K250-S467 WeakPolarHBondContact O-CB 3.3Å; K250-S467 PolarHBondContact O-OG 3.36Å; G251-S467 PolarHBondContact O-N 3.43Å; G251-S467 VanDerWaalsContact O-N 3.08Å; T252-S467 WeakPolarHBondContact CA-O 3.41Å; Y465-S467 VanDerWaalsContact CD2-O 3.28Å; Y465-S467 WeakPolarHBondContact CD2-O 3.28Å
468	E	96.2	Very high	94.6	Very high	143 Å²	143	52.9 Å²	52.9	67%	0.668	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-64	147.2	173.3	-66.3	-179.4	177.2	0	0	111.6
469	S	96.5	Very high	94.7	Very high	46 Å²	46	55.1 Å²	55.1	32%	0.322	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-73.5	141.6	177.9	-57.6	0	0	0	0	110.8	E254	E254-S469 VanDerWaalsContact OE1-CB 3.26Å; E254-S469 WeakPolarHBondContact OE1-CB 3.42Å; E254-S469 PolarHBondContact OE1-OG 3.3Å; E254-S469 PolarHBondContact OE2-OG 3.38Å
470	P	95.9	Very high	94.6	Very high	32 Å²	32	52 Å²	52	21%	0.208	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-68.4	173.7	170.6	33.9	-38.4	0	0	0	110.8	F472 Y479	P470-F472 HydrophobicContact CG-CD1 3.95Å; P470-F472 HydrophobicContact CG-CD2 4.32Å; P470-F472 HydrophobicContact CG-CE1 3.6Å; P470-F472 HydrophobicContact CG-CE2 4.03Å; P470-F472 HydrophobicContact CG-CG 4.29Å; P470-F472 HydrophobicContact CG-CZ 3.65Å; P470-F472 WeakPolarHBondContact O-CD2 3.14Å; P470-F472 WeakPolarHBondContact O-CE2 3.35Å; P470-F472 PolarHBondContact O-N 3.09Å; P470-Y479 HydrophobicContact CB-CD1 4.32Å; P470-Y479 HydrophobicContact CB-CD2 4.22Å; P470-Y479 HydrophobicContact CB-CE2 4.46Å; P470-Y479 HydrophobicContact CB-CG 4.15Å; P470-Y479 HydrophobicContact CG-CD1 3.85Å; P470-Y479 HydrophobicContact CG-CD2 4.35Å; P470-Y479 HydrophobicContact CG-CE1 4.47Å; P470-Y479 HydrophobicContact CG-CG 3.79Å
471	T	95.1	Very high	94.8	Very high	98 Å²	98	48.9 Å²	48.9	60%	0.601	25%	0.248	S	C	*	.			trans	-69.5	-19.7	-178.9	61.6	0	0	0	0	114.4	R197 C473	R197-T471 WeakPolarHBondContact CD-O 3Å; T471-C473 PolarHBondContact O-N 3.46Å
472	F	96.4	Very high	94.9	Very high	12 Å²	12	49.2 Å²	49.2	5%	0.053	25%	0.249	C	C	.	.			trans	56.1	5.3	-174.5	-59.7	-74.4	0	0	0	116.4	R197 W198 E254 P470 G483	R197-F472 HydrophobicContact CB-CB 3.96Å; W198-F472 HydrophobicContact CB-CB 4.29Å; W198-F472 HydrophobicContact CB-CD1 3.81Å; W198-F472 HydrophobicContact CB-CD2 3.77Å; W198-F472 HydrophobicContact CB-CE1 3.97Å; W198-F472 HydrophobicContact CB-CE2 3.89Å; W198-F472 HydrophobicContact CB-CG 3.71Å; W198-F472 HydrophobicContact CB-CZ 4Å; W198-F472 AromaticContact CD1-CD1 4Å; W198-F472 AromaticContact CD1-CE1 3.69Å; W198-F472 HydrophobicContact CG-CD1 4.23Å; W198-F472 AromaticContact CG-CE1 4Å; W198-F472 HydrophobicContact CG-CE1 4Å; W198-F472 HydrophobicContact CG-CE2 4.45Å; W198-F472 HydrophobicContact CG-CZ 4.11Å; E254-F472 HydrophobicContact CG-CE2 4.06Å; E254-F472 HydrophobicContact CG-CZ 3.85Å; E254-F472 WeakPolarHBondContact OE1-CE2 3.38Å; P470-F472 HydrophobicContact CG-CD1 3.95Å; P470-F472 HydrophobicContact CG-CD2 4.32Å; P470-F472 HydrophobicContact CG-CE1 3.6Å; P470-F472 HydrophobicContact CG-CE2 4.03Å; P470-F472 HydrophobicContact CG-CG 4.29Å; P470-F472 HydrophobicContact CG-CZ 3.65Å; P470-F472 WeakPolarHBondContact O-CD2 3.14Å; P470-F472 WeakPolarHBondContact O-CE2 3.35Å; P470-F472 PolarHBondContact O-N 3.09Å; F472-G483 WeakPolarHBondContact O-CA 3.45Å
473	C	96.7	Very high	95	Very high	10 Å²	10	47.8 Å²	47.8	7%	0.068	24%	0.243	C	C	.	.	S	Bend	trans	-67.1	-45	177.3	-69.9	0	0	0	0	112.1	T471 G483 T484 C504 R506	T471-C473 PolarHBondContact O-N 3.46Å; C473-G483 WeakPolarHBondContact O-CA 3.05Å; C473-T484 PolarHBondContact O-N 3.02Å; C473-T484 PolarHBondContact O-OG1 2.74Å; C473-C504 VanDerWaalsContact CA-SG 3.54Å; C473-C504 HydrophobicContact CB-CB 3.7Å; C473-C504 WeakPolarHBondContact CB-SG 3.35Å; C473-C504 WeakPolarHBondContact SG-CB 3.37Å; C473-C504 CovalentContact SG-SG 2.03Å; C473-C504 PolarHBondContact SG-SG 2.98Å; C473-R506 PolarHBondContact O-NH1 2.73Å
474	H	95.5	Very high	94.9	Very high	104 Å²	104	47.8 Å²	47.8	48%	0.481	24%	0.243	S	C	.	.	S	Bend	trans	-104.3	152.9	-177.7	-55.6	-73.1	0	0	0	111	D476 S481 Y485	H474-D476 PolarHBondContact O-N 3.46Å; H474-S481 PolarHBondContact O-OG 3.16Å; H474-Y485 AromaticContact ND1-CE2 3.87Å; H474-Y485 PolarHBondContact ND1-OH 3.06Å
475	H	94.3	Very high	94.9	Very high	105 Å²	105	53.4 Å²	53.4	49%	0.486	26%	0.264	S	S	.	.			trans	-61.8	118.2	171.1	176	-98.2	0	0	0	109.7	Y243 S481 I482	Y243-H475 AromaticContact CZ-NE2 3.9Å; Y243-H475 PolarHBondContact OH-CE1 2.84Å; Y243-H475 PolarHBondContact OH-NE2 3.49Å; H475-S481 CarbonylContact C-O 3.53Å; H475-S481 WeakPolarHBondContact CA-O 3.03Å; H475-I482 WeakPolarHBondContact CB-O 3.31Å
476	D	93.7	Very high	94.7	Very high	29 Å²	29	54.7 Å²	54.7	16%	0.155	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-136.1	96.6	177	-169.9	-16.9	0	0	0	110.2	H474 R478 Y479 G480 S481	H474-D476 PolarHBondContact O-N 3.46Å; D476-R478 PolarHBondContact O-N 3.35Å; D476-R478 WeakPolarHBondContact OD1-CB 3.05Å; D476-R478 WeakPolarHBondContact OD1-CG 3.21Å; D476-R478 IonicContact OD1-CZ 3.54Å; D476-R478 PolarHBondContact OD1-N 2.86Å; D476-R478 IonicContact OD1-NE 3.55Å; D476-R478 PolarHBondContact OD1-NE 2.8Å; D476-R478 IonicContact OD1-NH2 3.33Å; D476-R478 IonicContact OD2-CZ 3.15Å; D476-R478 IonicContact OD2-NE 3.65Å; D476-R478 PolarHBondContact OD2-NE 3.24Å; D476-R478 IonicContact OD2-NH2 2.99Å; D476-R478 PolarHBondContact OD2-NH2 3.29Å; D476-Y479 PolarHBondContact O-N 3.29Å; D476-Y479 WeakPolarHBondContact OD2-CD2 3.3Å; D476-G480 PolarHBondContact O-N 3.22Å; D476-S481 CarbonylContact C-O 3.58Å; D476-S481 PolarHBondContact N-O 2.73Å; D476-S481 PolarHBondContact O-N 3.37Å
477	P	91.7	Very high	94.7	Very high	43 Å²	43	55.3 Å²	55.3	28%	0.279	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-19.3	178.7	-21.6	29.7	0	0	0	114.1	V207 Y243 Y479 G480	V207-P477 HydrophobicContact CG1-CB 4.32Å; Y243-P477 HydrophobicContact CE2-CB 4.47Å; Y243-P477 WeakPolarHBondContact OH-CG 3.42Å; P477-Y479 VanDerWaalsContact C-N 3.33Å; P477-G480 PolarHBondContact O-N 3.04Å
478	R	91.1	Very high	94.7	Very high	160 Å²	160	59.2 Å²	59.2	60%	0.604	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-32.1	-179.2	-57.3	173.2	-63.6	176.3	2.7	111.7	K250 D476	K250-R478 WeakPolarHBondContact CE-O 3.5Å; D476-R478 PolarHBondContact O-N 3.35Å; D476-R478 WeakPolarHBondContact OD1-CB 3.05Å; D476-R478 WeakPolarHBondContact OD1-CG 3.21Å; D476-R478 IonicContact OD1-CZ 3.54Å; D476-R478 PolarHBondContact OD1-N 2.86Å; D476-R478 IonicContact OD1-NE 3.55Å; D476-R478 PolarHBondContact OD1-NE 2.8Å; D476-R478 IonicContact OD1-NH2 3.33Å; D476-R478 IonicContact OD2-CZ 3.15Å; D476-R478 IonicContact OD2-NE 3.65Å; D476-R478 PolarHBondContact OD2-NE 3.24Å; D476-R478 IonicContact OD2-NH2 2.99Å; D476-R478 PolarHBondContact OD2-NH2 3.29Å
479	Y	91.5	Very high	94.7	Very high	69 Å²	69	52.9 Å²	52.9	27%	0.271	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-6.6	176	-74	-87.7	0	0	0	112.9	K250 P470 D476 P477	K250-Y479 HydrophobicContact CB-CD1 4.29Å; K250-Y479 HydrophobicContact CB-CE1 4.48Å; K250-Y479 HydrophobicContact CD-CD1 4.13Å; K250-Y479 HydrophobicContact CD-CE1 4.05Å; K250-Y479 HydrophobicContact CG-CD1 3.74Å; K250-Y479 HydrophobicContact CG-CE1 4.09Å; P470-Y479 HydrophobicContact CB-CD1 4.32Å; P470-Y479 HydrophobicContact CB-CD2 4.22Å; P470-Y479 HydrophobicContact CB-CE2 4.46Å; P470-Y479 HydrophobicContact CB-CG 4.15Å; P470-Y479 HydrophobicContact CG-CD1 3.85Å; P470-Y479 HydrophobicContact CG-CD2 4.35Å; P470-Y479 HydrophobicContact CG-CE1 4.47Å; P470-Y479 HydrophobicContact CG-CG 3.79Å; D476-Y479 PolarHBondContact O-N 3.29Å; D476-Y479 WeakPolarHBondContact OD2-CD2 3.3Å; P477-Y479 VanDerWaalsContact C-N 3.33Å
480	G	89.4	Confident	94.6	Very high	7 Å²	7	53.8 Å²	53.8	7%	0.072	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	32.5	-170.5	0	0	0	0	0	112.1	Y243 D476 P477	Y243-G480 VanDerWaalsContact CD1-O 3.3Å; Y243-G480 WeakPolarHBondContact CD1-O 3.3Å; D476-G480 PolarHBondContact O-N 3.22Å; P477-G480 PolarHBondContact O-N 3.04Å
481	S	93.6	Very high	94.5	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.021	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-94.8	125.1	178.1	176	0	0	0	0	110.6	H474 H475 D476 G483	H474-S481 PolarHBondContact O-OG 3.16Å; H475-S481 CarbonylContact C-O 3.53Å; H475-S481 WeakPolarHBondContact CA-O 3.03Å; D476-S481 CarbonylContact C-O 3.58Å; D476-S481 PolarHBondContact N-O 2.73Å; D476-S481 PolarHBondContact O-N 3.37Å; S481-G483 PolarHBondContact OG-N 3.39Å
482	I	93.9	Very high	94.4	Very high	52 Å²	52	58 Å²	58	27%	0.267	29%	0.288	S	S	.	.			trans	-82.1	-16.2	173.7	60.2	173.4	0	0	0	113.3	Q201 L205 Y243 H475	Q201-I482 HydrophobicContact CB-CD1 4.19Å; L205-I482 HydrophobicContact CD1-CG2 3.54Å; Y243-I482 HydrophobicContact CD1-CG2 3.96Å; Y243-I482 HydrophobicContact CE1-CG2 3.97Å; H475-I482 WeakPolarHBondContact CB-O 3.31Å
483	G	95.4	Very high	94.3	Very high	4 Å²	4	58.8 Å²	58.8	4%	0.041	30%	0.295	C	S	.	.			trans	82.2	179.3	-174.1	0	0	0	0	0	113.5	F472 C473 S481	F472-G483 WeakPolarHBondContact O-CA 3.45Å; C473-G483 WeakPolarHBondContact O-CA 3.05Å; S481-G483 PolarHBondContact OG-N 3.39Å
484	T	97	Very high	94.1	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.336	C	S	.	.	S	Bend	trans	-107.2	6.9	179.9	59.8	0	0	0	0	114.5	R197 C473 G486 R487 L502 R506 C543	R197-T484 HydrophobicContact CB-CG2 3.97Å; R197-T484 HydrophobicContact CG-CG2 4.12Å; C473-T484 PolarHBondContact O-N 3.02Å; C473-T484 PolarHBondContact O-OG1 2.74Å; T484-G486 PolarHBondContact O-N 2.86Å; T484-R487 WeakPolarHBondContact O-CB 3.23Å; T484-R487 PolarHBondContact O-N 3.41Å; T484-L502 WeakPolarHBondContact CB-O 3.26Å; T484-L502 HydrophobicContact CG2-CD1 4.46Å; T484-L502 WeakPolarHBondContact CG2-O 3Å; T484-L502 PolarHBondContact OG1-O 3.31Å; T484-R506 VanDerWaalsContact C-NH2 3.31Å; T484-R506 PolarHBondContact O-NH2 2.97Å; T484-R506 PolarHBondContact OG1-NH2 2.82Å; T484-C543 VanDerWaalsContact O-CB 3.26Å; T484-C543 WeakPolarHBondContact O-CB 3.33Å
485	Y	96.3	Very high	93.9	Very high	118 Å²	118	64.5 Å²	64.5	46%	0.463	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	133.5	174	-72.7	-80.1	0	0	0	110.4	H474 R487 R506 N544	H474-Y485 AromaticContact ND1-CE2 3.87Å; H474-Y485 PolarHBondContact ND1-OH 3.06Å; Y485-R487 PolarHBondContact O-N 3.39Å; Y485-R506 PolarHBondContact OH-NH1 3.06Å; Y485-N544 VanDerWaalsContact CD1-C 3.47Å; Y485-N544 WeakPolarHBondContact CD1-O 3.32Å; Y485-N544 WeakPolarHBondContact CD1-OXT 3.37Å; Y485-N544 WeakPolarHBondContact CE1-O 3.45Å
486	G	95.9	Very high	93.9	Very high	54 Å²	54	62.7 Å²	62.7	56%	0.557	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.7	5.6	177.2	0	0	0	0	0	115.5	T484 T542 C543	T484-G486 PolarHBondContact O-N 2.86Å; G486-T542 VanDerWaalsContact O-CG2 3.27Å; G486-T542 WeakPolarHBondContact O-CG2 3.37Å; G486-C543 PolarHBondContact N-O 3.42Å
487	R	96.1	Very high	93.9	Very high	28 Å²	28	64 Å²	64	11%	0.106	33%	0.331	C	S	.	.			trans	-80.4	137.6	178.4	-68.8	-169.8	63.2	-169.1	-5.7	112.3	S194 H196 R197 T484 Y485 L502 T542 C543	S194-R487 PolarHBondContact O-NH2 2.75Å; H196-R487 PolarHBondContact O-NH1 3.38Å; H196-R487 PolarHBondContact O-NH2 2.85Å; R197-R487 VanDerWaalsContact C-NH1 3.27Å; R197-R487 PolarHBondContact O-NH1 3.28Å; T484-R487 WeakPolarHBondContact O-CB 3.23Å; T484-R487 PolarHBondContact O-N 3.41Å; Y485-R487 PolarHBondContact O-N 3.39Å; R487-L502 HydrophobicContact CB-CD2 4.28Å; R487-T542 CarbonylContact O-C 3.59Å; R487-T542 WeakPolarHBondContact O-CA 2.93Å; R487-C543 PolarHBondContact O-N 3.49Å; R487-C543 PolarHBondContact O-SG 3.16Å
488	Q	96.1	Very high	94.2	Very high	127 Å²	127	62.5 Å²	62.5	59%	0.593	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	134.8	171.8	-173.3	173.5	2.3	0	0	110.4	L502 I540 S541	Q488-L502 VanDerWaalsContact O-CD2 3.26Å; Q488-L502 WeakPolarHBondContact O-CD2 3.27Å; Q488-I540 HydrophobicContact CG-CG2 4.04Å; Q488-S541 CarbonylContact C-O 3.41Å; Q488-S541 VanDerWaalsContact CA-O 3.29Å; Q488-S541 WeakPolarHBondContact CA-O 3.14Å
489	C	96.4	Very high	94.4	Very high	10 Å²	10	55.1 Å²	55.1	7%	0.068	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	163.6	177.8	65.1	0	0	0	0	110.6	C499 L502 C503 S541	C489-C499 VanDerWaalsContact C-SG 3.54Å; C489-C499 HydrophobicContact CB-CB 3.8Å; C489-C499 WeakPolarHBondContact CB-SG 3.47Å; C489-C499 WeakPolarHBondContact SG-CA 3.06Å; C489-C499 WeakPolarHBondContact SG-CB 3.46Å; C489-C499 CovalentContact SG-SG 2.04Å; C489-C499 PolarHBondContact SG-SG 2.9Å; C489-L502 HydrophobicContact CB-CB 4.4Å; C489-L502 HydrophobicContact CB-CD2 3.98Å; C489-C503 VanDerWaalsContact SG-SG 3.62Å; C489-S541 PolarHBondContact N-O 3.13Å
490	D	95.4	Very high	94.6	Very high	65 Å²	65	59.4 Å²	59.4	35%	0.348	32%	0.317	S	S	.	.	B	Isolated β-bridge	trans	-105.1	125.8	175.3	-173.3	-11.3	0	0	0	109.8	N492 S493 N497 S498 C499	D490-N492 PolarHBondContact OD1-N 2.83Å; D490-S493 PolarHBondContact OD1-N 2.78Å; D490-N497 PolarHBondContact N-O 2.68Å; D490-S498 CarbonylContact O-C 3.55Å; D490-S498 WeakPolarHBondContact O-CA 3.29Å; D490-C499 VanDerWaalsContact C-SG 3.51Å; D490-C499 PolarHBondContact O-N 2.76Å
491	E	93.5	Very high	94.9	Very high	67 Å²	67	62.8 Å²	62.8	31%	0.313	33%	0.328	S	S	.	.	S	Bend	trans	-70.9	-31.8	178.8	-71.6	179	-126.3	0	0	112.4	F508 R510 S541	E491-F508 HydrophobicContact CG-CD2 4.31Å; E491-F508 HydrophobicContact CG-CE2 3.49Å; E491-F508 VanDerWaalsContact CG-CE2 3.49Å; E491-F508 HydrophobicContact CG-CZ 3.63Å; E491-R510 WeakPolarHBondContact OE1-CD 3.08Å; E491-R510 WeakPolarHBondContact OE1-CG 3.38Å; E491-R510 WeakPolarHBondContact OE2-CD 3.43Å; E491-R510 IonicContact OE2-NH1 3.68Å; E491-R510 PolarHBondContact OE2-NH1 3.34Å; E491-S541 PolarHBondContact OE1-OG 3.39Å
492	N	92.9	Very high	95	Very high	150 Å²	150	62.7 Å²	62.7	80%	0.802	33%	0.328	S	S	*	.	S	Bend	trans	-97.2	-12.6	-171.8	-63.4	-34.8	0	0	0	112.8	D490	D490-N492 PolarHBondContact OD1-N 2.83Å
493	S	93.9	Very high	95.2	Very high	30 Å²	30	60.2 Å²	60.2	21%	0.21	32%	0.315	C	S	.	.			trans	-74.7	143.5	177.6	-177.7	0	0	0	0	111.8	D490 G495 N497 S498	D490-S493 PolarHBondContact OD1-N 2.78Å; S493-G495 PolarHBondContact OG-N 3.16Å; S493-N497 VanDerWaalsContact CB-OD1 3.29Å; S493-N497 WeakPolarHBondContact CB-OD1 3.39Å; S493-N497 PolarHBondContact OG-OD1 2.83Å; S493-S498 WeakPolarHBondContact O-CB 3Å
494	Q	91.9	Very high	95.2	Very high	198 Å²	198	61.7 Å²	61.7	93%	0.925	32%	0.324	S	S	*	.			trans	-97.6	-2.9	167.6	-63.4	-175.2	-11.9	0	0	112.6
495	G	92	Very high	95.1	Very high	36 Å²	36	64.6 Å²	64.6	37%	0.371	35%	0.354	S	S	.	.	S	Bend	trans	-83.5	-163.7	-177.3	0	0	0	0	0	114.3	S493 N497 S498	S493-G495 PolarHBondContact OG-N 3.16Å; G495-N497 PolarHBondContact O-N 2.92Å; G495-S498 WeakPolarHBondContact O-CB 3.17Å; G495-S498 PolarHBondContact O-N 3.47Å; G495-S498 PolarHBondContact O-OG 3.47Å
496	L	94.2	Very high	95.1	Very high	66 Å²	66	61.6 Å²	61.6	35%	0.346	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-22.1	-179.9	-59.8	175.9	0	0	0	113.3	A195 H196 S498 Y501	A195-L496 HydrophobicContact CB-CB 4.43Å; A195-L496 CarbonylContact O-C 3.57Å; A195-L496 VanDerWaalsContact O-C 3.27Å; H196-L496 VanDerWaalsContact NE2-CD1 3.35Å; H196-L496 WeakPolarHBondContact NE2-CD1 3.39Å; L496-S498 VanDerWaalsContact C-N 3.27Å; L496-Y501 HydrophobicContact CB-CD1 4.31Å; L496-Y501 HydrophobicContact CB-CE1 4.11Å; L496-Y501 HydrophobicContact CD2-CD1 4.12Å; L496-Y501 HydrophobicContact CD2-CE1 3.54Å; L496-Y501 HydrophobicContact CD2-CE2 4.24Å; L496-Y501 HydrophobicContact CG-CE1 4.42Å; L496-Y501 WeakPolarHBondContact O-CD1 3.19Å
497	N	94.4	Very high	95.1	Very high	56 Å²	56	60.5 Å²	60.5	30%	0.299	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-2.3	172.5	64.1	-32.5	0	0	0	113.4	A195 D490 S493 G495	A195-N497 HydrophobicContact CB-CB 4Å; D490-N497 PolarHBondContact N-O 2.68Å; S493-N497 VanDerWaalsContact CB-OD1 3.29Å; S493-N497 WeakPolarHBondContact CB-OD1 3.39Å; S493-N497 PolarHBondContact OG-OD1 2.83Å; G495-N497 PolarHBondContact O-N 2.92Å
498	S	96.4	Very high	95.1	Very high	12 Å²	12	62.7 Å²	62.7	8%	0.084	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-60.7	138.5	178.8	66.4	0	0	0	0	111.5	D490 S493 G495 L496 H500 Y501 L502	D490-S498 CarbonylContact O-C 3.55Å; D490-S498 WeakPolarHBondContact O-CA 3.29Å; S493-S498 WeakPolarHBondContact O-CB 3Å; G495-S498 WeakPolarHBondContact O-CB 3.17Å; G495-S498 PolarHBondContact O-N 3.47Å; G495-S498 PolarHBondContact O-OG 3.47Å; L496-S498 VanDerWaalsContact C-N 3.27Å; S498-H500 PolarHBondContact O-N 2.57Å; S498-Y501 PolarHBondContact O-N 3.06Å; S498-Y501 VanDerWaalsContact OG-CB 3.26Å; S498-Y501 WeakPolarHBondContact OG-CB 3.14Å; S498-Y501 PolarHBondContact OG-N 2.81Å; S498-L502 VanDerWaalsContact O-CB 3.28Å; S498-L502 WeakPolarHBondContact O-CB 3.12Å; S498-L502 PolarHBondContact O-N 3.1Å
499	C	96.6	Very high	95.1	Very high	6 Å²	6	61.7 Å²	61.7	4%	0.041	34%	0.335	C	S	.	.	H	α-helix	trans	-58.4	-34.4	178.6	-67.3	0	0	0	0	112.8	C489 D490 C503 F508	C489-C499 VanDerWaalsContact C-SG 3.54Å; C489-C499 HydrophobicContact CB-CB 3.8Å; C489-C499 WeakPolarHBondContact CB-SG 3.47Å; C489-C499 WeakPolarHBondContact SG-CA 3.06Å; C489-C499 WeakPolarHBondContact SG-CB 3.46Å; C489-C499 CovalentContact SG-SG 2.04Å; C489-C499 PolarHBondContact SG-SG 2.9Å; D490-C499 VanDerWaalsContact C-SG 3.51Å; D490-C499 PolarHBondContact O-N 2.76Å; C499-C503 WeakPolarHBondContact O-CB 3.47Å; C499-C503 PolarHBondContact O-N 2.98Å; C499-C503 VanDerWaalsContact O-N 3.1Å; C499-C503 PolarHBondContact O-SG 2.9Å; C499-F508 HydrophobicContact CB-CD1 3.43Å; C499-F508 VanDerWaalsContact CB-CD1 3.43Å; C499-F508 HydrophobicContact CB-CE1 3.66Å; C499-F508 HydrophobicContact CB-CG 4.02Å; C499-F508 HydrophobicContact CB-CZ 4.43Å
500	H	95.2	Very high	95.1	Very high	159 Å²	159	69.1 Å²	69.1	74%	0.736	36%	0.362	S	S	*	.	H	α-helix	trans	-61.7	-49	176.2	179.5	-103	0	0	0	112.3	S498	S498-H500 PolarHBondContact O-N 2.57Å
501	Y	95.3	Very high	95	Very high	77 Å²	77	70 Å²	70	30%	0.302	36%	0.364	S	S	.	.	H	α-helix	trans	-74.5	-47	-179.4	175.8	-95.4	0	0	0	112.5	R197 L496 S498 C504	R197-Y501 HydrophobicContact CG-CD1 4.44Å; R197-Y501 HydrophobicContact CG-CE1 3.86Å; R197-Y501 PolarHBondContact NE-O 3.13Å; R197-Y501 PolarHBondContact NH2-O 3.25Å; L496-Y501 HydrophobicContact CB-CD1 4.31Å; L496-Y501 HydrophobicContact CB-CE1 4.11Å; L496-Y501 HydrophobicContact CD2-CD1 4.12Å; L496-Y501 HydrophobicContact CD2-CE1 3.54Å; L496-Y501 HydrophobicContact CD2-CE2 4.24Å; L496-Y501 HydrophobicContact CG-CE1 4.42Å; L496-Y501 WeakPolarHBondContact O-CD1 3.19Å; S498-Y501 PolarHBondContact O-N 3.06Å; S498-Y501 VanDerWaalsContact OG-CB 3.26Å; S498-Y501 WeakPolarHBondContact OG-CB 3.14Å; S498-Y501 PolarHBondContact OG-N 2.81Å; Y501-C504 PolarHBondContact O-N 3.23Å
502	L	96.8	Very high	95	Very high	2 Å²	2	71 Å²	71	1%	0.01	38%	0.375	C	S	.	.	H	α-helix	trans	-70.8	-39.6	-171.4	-166.4	63.4	0	0	0	112.1	R197 T484 R487 Q488 C489 S498 C504	R197-L502 HydrophobicContact CG-CD1 4.38Å; T484-L502 WeakPolarHBondContact CB-O 3.26Å; T484-L502 HydrophobicContact CG2-CD1 4.46Å; T484-L502 WeakPolarHBondContact CG2-O 3Å; T484-L502 PolarHBondContact OG1-O 3.31Å; R487-L502 HydrophobicContact CB-CD2 4.28Å; Q488-L502 VanDerWaalsContact O-CD2 3.26Å; Q488-L502 WeakPolarHBondContact O-CD2 3.27Å; C489-L502 HydrophobicContact CB-CB 4.4Å; C489-L502 HydrophobicContact CB-CD2 3.98Å; S498-L502 VanDerWaalsContact O-CB 3.28Å; S498-L502 WeakPolarHBondContact O-CB 3.12Å; S498-L502 PolarHBondContact O-N 3.1Å; L502-C504 VanDerWaalsContact C-N 3.25Å; L502-C504 PolarHBondContact O-N 2.85Å
503	C	97.3	Very high	95	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	1.6	-178	-49.1	0	0	0	0	113.5	C489 C499 G505 R506 G507 C543	C489-C503 VanDerWaalsContact SG-SG 3.62Å; C499-C503 WeakPolarHBondContact O-CB 3.47Å; C499-C503 PolarHBondContact O-N 2.98Å; C499-C503 VanDerWaalsContact O-N 3.1Å; C499-C503 PolarHBondContact O-SG 2.9Å; C503-G505 VanDerWaalsContact C-N 3.26Å; C503-G505 PolarHBondContact O-N 2.9Å; C503-R506 WeakPolarHBondContact O-CB 3.43Å; C503-R506 WeakPolarHBondContact O-CG 3.03Å; C503-R506 PolarHBondContact O-N 2.85Å; C503-R506 VanDerWaalsContact O-N 3.13Å; C503-R506 PolarHBondContact O-NE 2.03Å; C503-G507 WeakPolarHBondContact CB-O 3.08Å; C503-C543 WeakPolarHBondContact CA-SG 3.39Å; C503-C543 HydrophobicContact CB-CB 3.58Å; C503-C543 WeakPolarHBondContact CB-SG 3.49Å; C503-C543 PolarHBondContact N-SG 3.48Å; C503-C543 WeakPolarHBondContact SG-CA 3.25Å; C503-C543 WeakPolarHBondContact SG-CB 3.31Å; C503-C543 CovalentContact SG-SG 2.04Å; C503-C543 PolarHBondContact SG-SG 3.06Å
504	C	96.6	Very high	95	Very high	34 Å²	34	71.6 Å²	71.6	23%	0.23	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	40.5	177.7	-54.5	0	0	0	0	113.4	R197 C473 Y501 L502 R506	R197-C504 PolarHBondContact NE-SG 3.04Å; C473-C504 VanDerWaalsContact CA-SG 3.54Å; C473-C504 HydrophobicContact CB-CB 3.7Å; C473-C504 WeakPolarHBondContact CB-SG 3.35Å; C473-C504 WeakPolarHBondContact SG-CB 3.37Å; C473-C504 CovalentContact SG-SG 2.03Å; C473-C504 PolarHBondContact SG-SG 2.98Å; Y501-C504 PolarHBondContact O-N 3.23Å; L502-C504 VanDerWaalsContact C-N 3.25Å; L502-C504 PolarHBondContact O-N 2.85Å; C504-R506 VanDerWaalsContact C-N 3.27Å; C504-R506 PolarHBondContact O-N 3.2Å
505	G	94.7	Very high	95	Very high	62 Å²	62	67.3 Å²	67.3	64%	0.639	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	3.4	178.8	0	0	0	0	0	116.2	C503 G507	C503-G505 VanDerWaalsContact C-N 3.26Å; C503-G505 PolarHBondContact O-N 2.9Å; G505-G507 PolarHBondContact O-N 3.36Å
506	R	95.6	Very high	95.2	Very high	54 Å²	54	71.4 Å²	71.4	20%	0.204	36%	0.363	C	S	.	.	S	Bend	trans	-78.5	-0.9	-179.6	-60.1	173.8	-60.3	-178.9	16.9	114.4	C473 T484 Y485 C503 C504 N544	C473-R506 PolarHBondContact O-NH1 2.73Å; T484-R506 VanDerWaalsContact C-NH2 3.31Å; T484-R506 PolarHBondContact O-NH2 2.97Å; T484-R506 PolarHBondContact OG1-NH2 2.82Å; Y485-R506 PolarHBondContact OH-NH1 3.06Å; C503-R506 WeakPolarHBondContact O-CB 3.43Å; C503-R506 WeakPolarHBondContact O-CG 3.03Å; C503-R506 PolarHBondContact O-N 2.85Å; C503-R506 VanDerWaalsContact O-N 3.13Å; C503-R506 PolarHBondContact O-NE 2.03Å; C504-R506 VanDerWaalsContact C-N 3.27Å; C504-R506 PolarHBondContact O-N 3.2Å; R506-N544 HydrophobicContact CB-CB 4.5Å; R506-N544 VanDerWaalsContact CZ-O 3.26Å; R506-N544 PolarHBondContact NE-O 3.08Å; R506-N544 PolarHBondContact NH2-O 3.15Å; R506-N544 PolarHBondContact O-ND2 3.24Å
507	G	95.7	Very high	95.2	Very high	32 Å²	32	71.9 Å²	71.9	33%	0.33	36%	0.364	S	S	.	.			trans	74.3	-177.1	-169.3	0	0	0	0	0	113	C503 G505 N544	C503-G507 WeakPolarHBondContact CB-O 3.08Å; G505-G507 PolarHBondContact O-N 3.36Å; G507-N544 PolarHBondContact O-N 3.02Å
508	F	96.9	Very high	95.2	Very high	73 Å²	73	76.3 Å²	76.3	32%	0.32	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	150.7	-179	55.7	-87.3	0	0	0	110.1	E491 C499 R510 T542 N544	E491-F508 HydrophobicContact CG-CD2 4.31Å; E491-F508 HydrophobicContact CG-CE2 3.49Å; E491-F508 VanDerWaalsContact CG-CE2 3.49Å; E491-F508 HydrophobicContact CG-CZ 3.63Å; C499-F508 HydrophobicContact CB-CD1 3.43Å; C499-F508 VanDerWaalsContact CB-CD1 3.43Å; C499-F508 HydrophobicContact CB-CE1 3.66Å; C499-F508 HydrophobicContact CB-CG 4.02Å; C499-F508 HydrophobicContact CB-CZ 4.43Å; F508-R510 HydrophobicContact CD2-CG 3.9Å; F508-R510 HydrophobicContact CE2-CG 3.72Å; F508-T542 CarbonylContact C-O 3.24Å; F508-T542 WeakPolarHBondContact CA-O 3.04Å; F508-T542 WeakPolarHBondContact CB-O 3.49Å; F508-N544 PolarHBondContact N-ND2 3.32Å
509	K	96.6	Very high	95.1	Very high	106 Å²	106	76.6 Å²	76.6	46%	0.461	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	137.6	170.4	65.2	-176.5	-179.1	-179	0	109.5	S541 T542 N544	K509-S541 WeakPolarHBondContact O-CA 3.42Å; K509-T542 PolarHBondContact N-O 3.44Å; K509-T542 PolarHBondContact O-N 3.26Å; K509-N544 PolarHBondContact N-OD1 3.33Å
510	R	95.5	Very high	95.1	Very high	167 Å²	167	80.8 Å²	80.8	63%	0.63	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	134.4	173.9	-62.3	-170.4	-66.1	-168.1	-0.4	109.8	E491 F508 V539	E491-R510 WeakPolarHBondContact OE1-CD 3.08Å; E491-R510 WeakPolarHBondContact OE1-CG 3.38Å; E491-R510 WeakPolarHBondContact OE2-CD 3.43Å; E491-R510 IonicContact OE2-NH1 3.68Å; E491-R510 PolarHBondContact OE2-NH1 3.34Å; F508-R510 HydrophobicContact CD2-CG 3.9Å; F508-R510 HydrophobicContact CE2-CG 3.72Å; R510-V539 HydrophobicContact CB-CG1 4.48Å
511	Q	93.8	Very high	95.1	Very high	83 Å²	83	76.5 Å²	76.5	39%	0.388	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	129.2	172.8	-59.7	-176.4	-60.4	0	0	109.1	F513 I540	Q511-F513 HydrophobicContact CB-CD2 4.2Å; Q511-F513 HydrophobicContact CB-CE1 4.49Å; Q511-F513 HydrophobicContact CB-CE2 3.25Å; Q511-F513 HydrophobicContact CB-CZ 3.44Å; Q511-F513 VanDerWaalsContact CB-CZ 3.44Å; Q511-F513 HydrophobicContact CG-CE2 4.35Å; Q511-F513 HydrophobicContact CG-CZ 4.19Å; Q511-I540 PolarHBondContact N-O 3.11Å; Q511-I540 PolarHBondContact O-N 3.09Å
512	T	93.3	Very high	95.1	Very high	88 Å²	88	80 Å²	80	54%	0.54	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.8	-178.2	-55.5	0	0	0	0	108.8	T537 V538 V539	T512-T537 HydrophobicContact CG2-CG2 3.27Å; T512-V538 WeakPolarHBondContact CA-O 3.41Å; T512-V539 HydrophobicContact CG2-CG2 4.28Å
513	F	93	Very high	95	Very high	101 Å²	101	85.8 Å²	85.8	44%	0.443	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	152.7	179.4	-51.3	-82.6	0	0	0	110.5	Q511 T537 V538 I540	Q511-F513 HydrophobicContact CB-CD2 4.2Å; Q511-F513 HydrophobicContact CB-CE1 4.49Å; Q511-F513 HydrophobicContact CB-CE2 3.25Å; Q511-F513 HydrophobicContact CB-CZ 3.44Å; Q511-F513 VanDerWaalsContact CB-CZ 3.44Å; Q511-F513 HydrophobicContact CG-CE2 4.35Å; Q511-F513 HydrophobicContact CG-CZ 4.19Å; F513-T537 WeakPolarHBondContact O-CA 3.47Å; F513-V538 PolarHBondContact N-O 3.3Å; F513-V538 PolarHBondContact O-N 3.29Å; F513-I540 HydrophobicContact CD2-CD1 4.4Å
514	V	93.7	Very high	94.7	Very high	92 Å²	92	91 Å²	91	56%	0.558	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	105.5	172.5	-179	0	0	0	0	108	R535	V514-R535 HydrophobicContact CG1-CB 3.65Å; V514-R535 HydrophobicContact CG1-CG 3.94Å
515	Q	92.2	Very high	94.3	Very high	108 Å²	108	99.1 Å²	99.1	51%	0.505	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	137.9	175.5	-170.1	172.4	13.5	0	0	109.8	K536 V538	Q515-K536 PolarHBondContact N-O 3.47Å; Q515-K536 PolarHBondContact O-N 3.27Å; Q515-V538 HydrophobicContact CB-CG2 3.99Å
516	Q	95.2	Very high	93.9	Very high	121 Å²	121	101.1 Å²	101.1	57%	0.565	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	128.1	171.3	-67.1	-175.9	10.3	0	0	109.7	T533 C534 R535	Q516-T533 HydrophobicContact CB-CG2 3.97Å; Q516-T533 HydrophobicContact CG-CG2 4.24Å; Q516-C534 WeakPolarHBondContact CA-O 3.38Å; Q516-R535 HydrophobicContact CG-CG 4.36Å
517	E	93.7	Very high	93.3	Very high	77 Å²	77	103.6 Å²	103.6	36%	0.36	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	156.3	174.7	67.2	-178.8	-169.5	0	0	110.9	C534 K536	E517-C534 PolarHBondContact N-O 3.19Å; E517-C534 PolarHBondContact O-N 3.43Å; E517-K536 HydrophobicContact CG-CB 4.39Å; E517-K536 VanDerWaalsContact OE1-CD 3.31Å; E517-K536 WeakPolarHBondContact OE1-CD 3.08Å; E517-K536 IonicContact OE1-NZ 3.24Å; E517-K536 WeakPolarHBondContact OE2-CD 3.23Å; E517-K536 IonicContact OE2-NZ 2.76Å
518	R	94.9	Very high	93.2	Very high	148 Å²	148	108.5 Å²	108.5	56%	0.558	52%	0.52	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	125.2	170.1	-73.1	-171.7	172.7	172.3	6.8	108.5	N118 C531 K532	N118-R518 WeakPolarHBondContact ND2-CD 3.31Å; N118-R518 PolarHBondContact ND2-NE 3.36Å; N118-R518 PolarHBondContact OD1-NE 2.97Å; N118-R518 VanDerWaalsContact OD1-NE 3.1Å; N118-R518 PolarHBondContact OD1-NH1 3Å; N118-R518 PolarHBondContact OD1-NH2 3.15Å; R518-C531 HydrophobicContact CB-CB 3.95Å; R518-C531 HydrophobicContact CG-CB 4.23Å; R518-K532 WeakPolarHBondContact CA-O 3.39Å
519	C	95.4	Very high	93	Very high	19 Å²	19	109.1 Å²	109.1	13%	0.128	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	171.2	-178.4	64	0	0	0	0	109.7	C521 K532 C534	C519-C521 PolarHBondContact O-N 2.97Å; C519-K532 PolarHBondContact N-O 3.02Å; C519-K532 PolarHBondContact O-N 2.92Å; C519-K532 PolarHBondContact SG-O 3.04Å; C519-C534 HydrophobicContact CB-CB 3.57Å; C519-C534 WeakPolarHBondContact CB-SG 3.42Å; C519-C534 WeakPolarHBondContact SG-CB 3.22Å; C519-C534 PolarHBondContact SG-N 3.11Å; C519-C534 CovalentContact SG-SG 1.99Å; C519-C534 PolarHBondContact SG-SG 3.18Å
520	D	95.3	Very high	92.9	Very high	93 Å²	93	106.7 Å²	106.7	50%	0.497	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48	38.6	177.2	-67	-8.8	0	0	0	112.7	K522 K532	D520-K522 PolarHBondContact O-N 3.34Å; D520-K532 HydrophobicContact CB-CB 4.41Å; D520-K532 HydrophobicContact CB-CD 4.04Å; D520-K532 HydrophobicContact CB-CG 4.2Å; D520-K532 IonicContact OD2-NZ 3.45Å; D520-K532 PolarHBondContact OD2-NZ 3.37Å
521	C	96.2	Very high	93	Very high	70 Å²	70	100.3 Å²	100.3	47%	0.473	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	117.8	-179	-66.7	0	0	0	0	110	C519 V529 C531	C519-C521 PolarHBondContact O-N 2.97Å; C521-V529 HydrophobicContact CB-CG1 3.9Å; C521-C531 VanDerWaalsContact CA-SG 3.6Å; C521-C531 HydrophobicContact CB-CB 4.04Å; C521-C531 WeakPolarHBondContact CB-SG 3.31Å; C521-C531 WeakPolarHBondContact SG-CB 3.32Å; C521-C531 CovalentContact SG-SG 2.03Å; C521-C531 PolarHBondContact SG-SG 3.13Å
522	K	94	Very high	93.1	Very high	151 Å²	151	102.3 Å²	102.3	66%	0.657	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	131.4	175.4	-64.7	-172.8	179.9	-172.1	0	109.7	D520 V530	D520-K522 PolarHBondContact O-N 3.34Å; K522-V530 PolarHBondContact N-O 2.83Å; K522-V530 PolarHBondContact O-N 3.11Å
523	F	95.4	Very high	93.3	Very high	123 Å²	123	102.8 Å²	102.8	54%	0.539	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	124.6	168.4	-174.3	-106.1	0	0	0	109	W525 V529	F523-W525 AromaticContact CE1-CE3 3.78Å; F523-W525 HydrophobicContact CE1-CE3 3.78Å; F523-W525 HydrophobicContact CE1-CZ3 4.26Å; F523-V529 HydrophobicContact CD2-CG2 3.93Å
524	Q	91.4	Very high	93.5	Very high	108 Å²	108	100 Å²	100	51%	0.505	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	120.2	168.5	-66.7	-177	-24.7	0	0	107.5	C526 K528 V530	Q524-C526 PolarHBondContact O-N 2.8Å; Q524-K528 WeakPolarHBondContact CB-O 3.46Å; Q524-K528 PolarHBondContact N-O 2.83Å; Q524-K528 PolarHBondContact O-N 2.87Å; Q524-V530 VanDerWaalsContact CD-CG2 3.49Å; Q524-V530 HydrophobicContact CG-CG2 4.12Å
525	W	88.2	Confident	93.5	Very high	206 Å²	206	105 Å²	105	78%	0.78	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	122.9	179	-171.7	-107.3	0	0	0	110.1	F523	F523-W525 AromaticContact CE1-CE3 3.78Å; F523-W525 HydrophobicContact CE1-CE3 3.78Å; F523-W525 HydrophobicContact CE1-CZ3 4.26Å
526	C	86.6	Confident	93.6	Very high	104 Å²	104	104.7 Å²	104.7	70%	0.703	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	85.3	-173.7	-165.2	0	0	0	0	117.3	Q524	Q524-C526 PolarHBondContact O-N 2.8Å
527	C	82.3	Confident	93.5	Very high	106 Å²	106	103.4 Å²	103.4	72%	0.716	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	cis	-149.8	49.5	-2.8	-76.7	0	0	0	0	110.5
528	K	93.1	Very high	93.4	Very high	135 Å²	135	101.4 Å²	101.4	59%	0.587	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	133.4	-169.3	-172.5	177.3	178.1	-179.3	0	112.4	Q524 V530	Q524-K528 WeakPolarHBondContact CB-O 3.46Å; Q524-K528 PolarHBondContact N-O 2.83Å; Q524-K528 PolarHBondContact O-N 2.87Å; K528-V530 HydrophobicContact CD-CG2 3.97Å; K528-V530 HydrophobicContact CG-CG2 3.99Å
529	V	94.1	Very high	93.3	Very high	85 Å²	85	97.9 Å²	97.9	52%	0.515	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	118.5	163.2	-178	0	0	0	0	108.6	C521 F523	C521-V529 HydrophobicContact CB-CG1 3.9Å; F523-V529 HydrophobicContact CD2-CG2 3.93Å
530	V	94.6	Very high	93.3	Very high	55 Å²	55	99.3 Å²	99.3	33%	0.333	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	118.2	174.4	-179.5	0	0	0	0	108.3	K522 Q524 K528	K522-V530 PolarHBondContact N-O 2.83Å; K522-V530 PolarHBondContact O-N 3.11Å; Q524-V530 VanDerWaalsContact CD-CG2 3.49Å; Q524-V530 HydrophobicContact CG-CG2 4.12Å; K528-V530 HydrophobicContact CD-CG2 3.97Å; K528-V530 HydrophobicContact CG-CG2 3.99Å
531	C	97.1	Very high	93.4	Very high	34 Å²	34	95.1 Å²	95.1	23%	0.23	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	152.6	176.8	-52.2	0	0	0	0	110.3	R518 C521	R518-C531 HydrophobicContact CB-CB 3.95Å; R518-C531 HydrophobicContact CG-CB 4.23Å; C521-C531 VanDerWaalsContact CA-SG 3.6Å; C521-C531 HydrophobicContact CB-CB 4.04Å; C521-C531 WeakPolarHBondContact CB-SG 3.31Å; C521-C531 WeakPolarHBondContact SG-CB 3.32Å; C521-C531 CovalentContact SG-SG 2.03Å; C521-C531 PolarHBondContact SG-SG 3.13Å
532	K	96.2	Very high	93.4	Very high	124 Å²	124	92.6 Å²	92.6	54%	0.539	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	160.6	163.5	-60.4	-178.9	-164.1	155.6	0	109.8	R518 C519 D520	R518-K532 WeakPolarHBondContact CA-O 3.39Å; C519-K532 PolarHBondContact N-O 3.02Å; C519-K532 PolarHBondContact O-N 2.92Å; C519-K532 PolarHBondContact SG-O 3.04Å; D520-K532 HydrophobicContact CB-CB 4.41Å; D520-K532 HydrophobicContact CB-CD 4.04Å; D520-K532 HydrophobicContact CB-CG 4.2Å; D520-K532 IonicContact OD2-NZ 3.45Å; D520-K532 PolarHBondContact OD2-NZ 3.37Å
533	T	96.5	Very high	93.6	Very high	98 Å²	98	85.5 Å²	85.5	60%	0.601	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	110.3	168.3	-55.8	0	0	0	0	108.5	Q516	Q516-T533 HydrophobicContact CB-CG2 3.97Å; Q516-T533 HydrophobicContact CG-CG2 4.24Å
534	C	96.6	Very high	93.6	Very high	43 Å²	43	84.3 Å²	84.3	29%	0.291	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	152.9	173.7	-73.4	0	0	0	0	110.8	Q516 E517 C519	Q516-C534 WeakPolarHBondContact CA-O 3.38Å; E517-C534 PolarHBondContact N-O 3.19Å; E517-C534 PolarHBondContact O-N 3.43Å; C519-C534 HydrophobicContact CB-CB 3.57Å; C519-C534 WeakPolarHBondContact CB-SG 3.42Å; C519-C534 WeakPolarHBondContact SG-CB 3.22Å; C519-C534 PolarHBondContact SG-N 3.11Å; C519-C534 CovalentContact SG-SG 1.99Å; C519-C534 PolarHBondContact SG-SG 3.18Å
535	R	95.4	Very high	93.7	Very high	198 Å²	198	83.1 Å²	83.1	75%	0.747	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	121.3	169.2	-72.4	-178.4	179.7	-173.4	0.5	108.4	V514 Q516	V514-R535 HydrophobicContact CG1-CB 3.65Å; V514-R535 HydrophobicContact CG1-CG 3.94Å; Q516-R535 HydrophobicContact CG-CG 4.36Å
536	K	93.5	Very high	94	Very high	100 Å²	100	76.6 Å²	76.6	44%	0.435	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128.7	176.2	-179.8	173.2	177.2	178.7	0	109.6	Q515 E517 V538	Q515-K536 PolarHBondContact N-O 3.47Å; Q515-K536 PolarHBondContact O-N 3.27Å; E517-K536 HydrophobicContact CG-CB 4.39Å; E517-K536 VanDerWaalsContact OE1-CD 3.31Å; E517-K536 WeakPolarHBondContact OE1-CD 3.08Å; E517-K536 IonicContact OE1-NZ 3.24Å; E517-K536 WeakPolarHBondContact OE2-CD 3.23Å; E517-K536 IonicContact OE2-NZ 2.76Å; K536-V538 HydrophobicContact CD-CG2 4.41Å; K536-V538 HydrophobicContact CG-CG2 4.12Å; K536-V538 PolarHBondContact O-N 3.44Å
537	T	92.7	Very high	94.4	Very high	95 Å²	95	75.1 Å²	75.1	58%	0.583	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	116.3	172.1	-56	0	0	0	0	108.6	T512 F513	T512-T537 HydrophobicContact CG2-CG2 3.27Å; F513-T537 WeakPolarHBondContact O-CA 3.47Å
538	V	92.6	Very high	95.1	Very high	34 Å²	34	73.3 Å²	73.3	21%	0.206	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	131.2	178.2	-179	0	0	0	0	108.6	T512 F513 Q515 K536 I540	T512-V538 WeakPolarHBondContact CA-O 3.41Å; F513-V538 PolarHBondContact N-O 3.3Å; F513-V538 PolarHBondContact O-N 3.29Å; Q515-V538 HydrophobicContact CB-CG2 3.99Å; K536-V538 HydrophobicContact CD-CG2 4.41Å; K536-V538 HydrophobicContact CG-CG2 4.12Å; K536-V538 PolarHBondContact O-N 3.44Å; V538-I540 HydrophobicContact CG1-CG1 4.12Å
539	V	92.7	Very high	95.2	Very high	75 Å²	75	69.4 Å²	69.4	46%	0.455	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	120.8	173.3	-176.2	0	0	0	0	107.7	R510 T512	R510-V539 HydrophobicContact CB-CG1 4.48Å; T512-V539 HydrophobicContact CG2-CG2 4.28Å
540	I	94.7	Very high	95.3	Very high	49 Å²	49	68.4 Å²	68.4	25%	0.251	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	125.6	176	-61.7	179	0	0	0	107.9	Q488 Q511 F513 V538	Q488-I540 HydrophobicContact CG-CG2 4.04Å; Q511-I540 PolarHBondContact N-O 3.11Å; Q511-I540 PolarHBondContact O-N 3.09Å; F513-I540 HydrophobicContact CD2-CD1 4.4Å; V538-I540 HydrophobicContact CG1-CG1 4.12Å
541	S	96.7	Very high	95.4	Very high	5 Å²	5	69.4 Å²	69.4	4%	0.035	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	122.1	-177.8	-56.1	0	0	0	0	108.8	Q488 C489 E491 K509	Q488-S541 CarbonylContact C-O 3.41Å; Q488-S541 VanDerWaalsContact CA-O 3.29Å; Q488-S541 WeakPolarHBondContact CA-O 3.14Å; C489-S541 PolarHBondContact N-O 3.13Å; E491-S541 PolarHBondContact OE1-OG 3.39Å; K509-S541 WeakPolarHBondContact O-CA 3.42Å
542	T	97.1	Very high	95.2	Very high	17 Å²	17	72.1 Å²	72.1	10%	0.104	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	128.9	-167.9	-58	0	0	0	0	110.1	G486 R487 F508 K509 N544	G486-T542 VanDerWaalsContact O-CG2 3.27Å; G486-T542 WeakPolarHBondContact O-CG2 3.37Å; R487-T542 CarbonylContact O-C 3.59Å; R487-T542 WeakPolarHBondContact O-CA 2.93Å; F508-T542 CarbonylContact C-O 3.24Å; F508-T542 WeakPolarHBondContact CA-O 3.04Å; F508-T542 WeakPolarHBondContact CB-O 3.49Å; K509-T542 PolarHBondContact N-O 3.44Å; K509-T542 PolarHBondContact O-N 3.26Å; T542-N544 PolarHBondContact O-N 3.09Å
543	C	97.4	Very high	95.2	Very high	2 Å²	2	67.8 Å²	67.8	1%	0.014	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	135.4	179.1	-64	0	0	0	0	112.4	T484 G486 R487 C503	T484-C543 VanDerWaalsContact O-CB 3.26Å; T484-C543 WeakPolarHBondContact O-CB 3.33Å; G486-C543 PolarHBondContact N-O 3.42Å; R487-C543 PolarHBondContact O-N 3.49Å; R487-C543 PolarHBondContact O-SG 3.16Å; C503-C543 WeakPolarHBondContact CA-SG 3.39Å; C503-C543 HydrophobicContact CB-CB 3.58Å; C503-C543 WeakPolarHBondContact CB-SG 3.49Å; C503-C543 PolarHBondContact N-SG 3.48Å; C503-C543 WeakPolarHBondContact SG-CA 3.25Å; C503-C543 WeakPolarHBondContact SG-CB 3.31Å; C503-C543 CovalentContact SG-SG 2.04Å; C503-C543 PolarHBondContact SG-SG 3.06Å
544	N	95.9	Very high	95	Very high	97 Å²	97	65 Å²	65	52%	0.519	33%	0.331	S	S	.	.			trans	-71	0	177.1	-68.3	-21.8	0	0	0	113.5	Y485 R506 G507 F508 K509 T542	Y485-N544 VanDerWaalsContact CD1-C 3.47Å; Y485-N544 WeakPolarHBondContact CD1-O 3.32Å; Y485-N544 WeakPolarHBondContact CD1-OXT 3.37Å; Y485-N544 WeakPolarHBondContact CE1-O 3.45Å; R506-N544 HydrophobicContact CB-CB 4.5Å; R506-N544 VanDerWaalsContact CZ-O 3.26Å; R506-N544 PolarHBondContact NE-O 3.08Å; R506-N544 PolarHBondContact NH2-O 3.15Å; R506-N544 PolarHBondContact O-ND2 3.24Å; G507-N544 PolarHBondContact O-N 3.02Å; F508-N544 PolarHBondContact N-ND2 3.32Å; K509-N544 PolarHBondContact N-OD1 3.33Å; T542-N544 PolarHBondContact O-N 3.09Å

Retrieved 544 of 544 residues in 195.5 ms (Link to these results)

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