A0A5K4FCR6_SCHMA Loading...

Neur_chan_LBD domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FCR6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 666 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	31.8	Very low	32	Very low	233 Å²	233	162 Å²	162	100%	1.148	84%	0.838	S	S	*	*				0	149.2	0	-76.3	160.3	165.2	0	0	108.2
2	D	32.6	Very low	31.9	Very low	150 Å²	150	163.8 Å²	163.8	80%	0.802	84%	0.839	S	S	*	*			trans	51.2	81.2	156	-51.8	-22.8	0	0	0	120
3	R	31.9	Very low	31.8	Very low	218 Å²	218	164.1 Å²	164.1	82%	0.823	83%	0.834	S	S	*	*			trans	17.7	127.6	130.2	-57.8	176.3	-178.5	178	0.6	117.9
4	N	37.3	Very low	31.5	Very low	173 Å²	173	163.1 Å²	163.1	93%	0.925	83%	0.831	S	S	*	*				-137.9	130.2	121.9	-102.2	-44.6	0	0	0	109.2
5	I	33.3	Very low	31.4	Very low	125 Å²	125	161.3 Å²	161.3	64%	0.641	82%	0.822	S	S	*	*			trans	-120.1	122.8	-177.1	-62.2	173.2	0	0	0	107.6	L7	I5-L7 HydrophobicContact CG2-CD1 4.12Å; I5-L7 HydrophobicContact CG2-CG 4.2Å
6	H	33.9	Very low	31.3	Very low	192 Å²	192	161 Å²	161	89%	0.889	82%	0.822	S	S	*	*			trans	-131.4	95.8	167.4	-127.4	-82.1	0	0	0	108.9
7	L	27.4	Very low	31.2	Very low	151 Å²	151	160.1 Å²	160.1	79%	0.791	82%	0.82	S	S	*	*			trans	-83	118.3	174.8	-83.1	156	0	0	0	109.1	I5	I5-L7 HydrophobicContact CG2-CD1 4.12Å; I5-L7 HydrophobicContact CG2-CG 4.2Å
8	S	30.8	Very low	31.3	Very low	109 Å²	109	161 Å²	161	76%	0.762	82%	0.817	S	S	*	*			trans	-112	121.5	160.2	58.4	0	0	0	0	107.8
9	I	28.6	Very low	31.3	Very low	170 Å²	170	163.1 Å²	163.1	87%	0.872	82%	0.815	S	S	*	*			trans	-79.4	130.8	-171.5	-63.9	164.3	0	0	0	109.3
10	S	32.5	Very low	31.3	Very low	101 Å²	101	162.2 Å²	162.2	71%	0.706	81%	0.813	S	S	*	*			trans	-137.3	110.3	168.5	61.8	0	0	0	0	110.4
11	D	32.2	Very low	31.1	Very low	160 Å²	160	161.2 Å²	161.2	86%	0.856	81%	0.81	S	S	*	*			trans	31.3	92.2	153.2	-54.8	-9.3	0	0	0	118.5
12	H	30.5	Very low	31.2	Very low	184 Å²	184	158.5 Å²	158.5	85%	0.852	79%	0.794	S	S	*	*			trans	-80.4	109.9	154.5	-85	-67	0	0	0	110.5
13	E	31.1	Very low	31.1	Very low	167 Å²	167	161.3 Å²	161.3	78%	0.78	80%	0.799	S	S	*	*			trans	-113.7	114.8	148.3	-94.5	-165.5	153.7	0	0	108.1	I15	E13-I15 PolarHBondContact O-N 3.36Å
14	L	27.5	Very low	30.9	Very low	150 Å²	150	161.5 Å²	161.5	79%	0.785	80%	0.8	S	S	*	*			trans	-73.8	124.9	168	-81.5	83.9	0	0	0	109.1
15	I	30.1	Very low	30.7	Very low	136 Å²	136	159.4 Å²	159.4	70%	0.697	79%	0.788	S	S	*	*			trans	-96.9	114.9	159	-62.2	-180	0	0	0	106.9	E13 D17	E13-I15 PolarHBondContact O-N 3.36Å; I15-D17 PolarHBondContact O-N 3.2Å
16	L	30.4	Very low	30.6	Very low	157 Å²	157	161.3 Å²	161.3	82%	0.822	80%	0.795	S	S	*	*			trans	-77.7	103.4	170.2	-86.6	157.2	0	0	0	108.6	K18	L16-K18 PolarHBondContact O-N 3.31Å
17	D	29.6	Very low	30.6	Very low	146 Å²	146	158.2 Å²	158.2	78%	0.781	79%	0.789	S	S	*	*			trans	-63.3	121.8	170.1	-93.9	-32.2	0	0	0	110.2	I15	I15-D17 PolarHBondContact O-N 3.2Å
18	K	32.7	Very low	30.7	Very low	176 Å²	176	157.9 Å²	157.9	77%	0.765	79%	0.788	S	S	*	*			trans	-100.8	97.7	-179.2	-165	-173.1	178.7	-157.5	0	109.2	L16 D20	L16-K18 PolarHBondContact O-N 3.31Å; K18-D20 PolarHBondContact O-N 3.13Å
19	Y	30.5	Very low	30.7	Very low	200 Å²	200	160.5 Å²	160.5	78%	0.784	79%	0.792	S	S	*	*			trans	-56.8	118.3	172.7	-87.1	-102.3	0	0	0	111.4	L21	Y19-L21 HydrophobicContact CD1-CD1 3.72Å; Y19-L21 HydrophobicContact CG-CD1 4.38Å
20	D	31.5	Very low	30.7	Very low	146 Å²	146	158.9 Å²	158.9	78%	0.781	79%	0.785	S	S	*	*			trans	-103.4	92.5	160.7	-88.7	-42	0	0	0	109.3	K18 H22	K18-D20 PolarHBondContact O-N 3.13Å; D20-H22 PolarHBondContact O-N 3.03Å
21	L	27.6	Very low	30.7	Very low	141 Å²	141	164.1 Å²	164.1	74%	0.738	80%	0.795	S	S	*	*			trans	-75.9	104.6	170.4	-95	85.8	0	0	0	109.9	Y19	Y19-L21 HydrophobicContact CD1-CD1 3.72Å; Y19-L21 HydrophobicContact CG-CD1 4.38Å
22	H	32.9	Very low	30.5	Very low	177 Å²	177	164 Å²	164	82%	0.819	79%	0.788	S	S	*	*			trans	-154	61.5	162.6	-129.5	-76.5	0	0	0	118.2	D20	D20-H22 PolarHBondContact O-N 3.03Å
23	K	31.9	Very low	30.7	Very low	209 Å²	209	160.9 Å²	160.9	91%	0.909	78%	0.783	S	S	*	*			trans	-154	133.6	141.3	-116.2	168.4	-175.5	-179.4	0	111.9
24	R	28.2	Very low	30.6	Very low	221 Å²	221	159.8 Å²	159.8	83%	0.834	78%	0.782	S	S	*	*			trans	-99.8	144.7	168	-60.8	174.7	-178.4	132.7	1.8	107.1
25	D	31.7	Very low	30.8	Very low	129 Å²	129	157.7 Å²	157.7	69%	0.69	78%	0.78	S	S	*	*				-171.3	149.6	100.5	-100.7	-48.3	0	0	0	111.8
26	Q	32.5	Very low	30.8	Very low	165 Å²	165	159.3 Å²	159.3	77%	0.771	79%	0.789	S	S	*	*			trans	36.4	123	146.3	-59.3	158.3	55.1	0	0	118.5
27	T	32.9	Very low	30.9	Very low	127 Å²	127	156.8 Å²	156.8	78%	0.779	78%	0.783	S	S	*	*			cis	-143.5	136.9	20.9	49.8	0	0	0	0	110.9
28	L	29.6	Very low	30.9	Very low	145 Å²	145	157.7 Å²	157.7	76%	0.759	79%	0.786	S	S	*	*				71.1	81.5	64.7	-136.8	-174.9	0	0	0	115.2
29	L	30.8	Very low	30.5	Very low	164 Å²	164	158.1 Å²	158.1	86%	0.859	79%	0.79	S	S	*	*				-168	144.4	127.2	-105.6	165.2	0	0	0	112.1
30	L	28.2	Very low	30.4	Very low	136 Å²	136	157.6 Å²	157.6	71%	0.712	80%	0.795	S	S	*	*			trans	-106.1	151.3	-178.1	-71.4	77.1	0	0	0	111.6
31	K	31.8	Very low	30.2	Very low	210 Å²	210	160.3 Å²	160.3	91%	0.913	80%	0.796	S	S	*	*				-159	128.7	127.4	-114.4	170.5	-177.2	179.7	0	113.6
32	H	29.8	Very low	30.3	Very low	157 Å²	157	164 Å²	164	73%	0.727	80%	0.802	S	S	*	*			trans	-65.2	155.6	157.6	-73.9	-116.9	0	0	0	108.8
33	T	33.6	Very low	30	Very low	120 Å²	120	162.2 Å²	162.2	74%	0.736	80%	0.798	S	S	*	*				-172.2	138.5	59.3	41.9	0	0	0	0	113
34	N	28.5	Very low	29.9	Very low	143 Å²	143	159.7 Å²	159.7	77%	0.765	79%	0.794	S	S	*	*			trans	40.6	136.2	136.8	-57.9	2.4	0	0	0	124.1
35	S	32.9	Very low	30.1	Very low	106 Å²	106	156.1 Å²	156.1	74%	0.741	79%	0.791	S	S	*	*			trans	94.8	106.7	131.2	60.2	0	0	0	0	122.9
36	L	30.4	Very low	30.1	Very low	170 Å²	170	155.6 Å²	155.6	89%	0.89	79%	0.794	S	S	*	*			trans	78.3	154.1	141.1	-65.3	169.6	0	0	0	118.7
37	P	31.2	Very low	30.1	Very low	105 Å²	105	155 Å²	155	68%	0.682	80%	0.797	S	S	*	*			trans	-117.8	146.9	-144.8	39.7	-28.9	0	0	0	115.6
38	I	29.2	Very low	30	Very low	165 Å²	165	154.2 Å²	154.2	85%	0.846	79%	0.794	S	S	*	*			trans	-138	160.9	157.8	-79.1	102.3	0	0	0	107.7
39	E	24.6	Very low	30.1	Very low	184 Å²	184	157.1 Å²	157.1	86%	0.86	80%	0.796	S	S	*	*			trans	-58	136.1	176.4	-55.5	161.3	122.9	0	0	112.4
40	E	29.3	Very low	30.1	Very low	190 Å²	190	158.2 Å²	158.2	89%	0.888	80%	0.797	S	S	*	*			trans	-154.2	159.8	154.4	-135.2	163.6	-145	0	0	112.4
41	Y	27.5	Very low	30.1	Very low	202 Å²	202	159.2 Å²	159.2	79%	0.792	80%	0.802	S	S	*	*			trans	-75.2	145.6	-169.9	-85.2	-122.8	0	0	0	113
42	Y	29.5	Very low	29.9	Very low	220 Å²	220	160.7 Å²	160.7	86%	0.863	80%	0.803	S	S	*	*			trans	-129.5	111.8	149.5	-92.6	-85.9	0	0	0	110.4
43	N	25.8	Very low	29.8	Very low	139 Å²	139	161.3 Å²	161.3	74%	0.743	81%	0.806	S	S	*	*			trans	-72.3	136.1	153.4	-64.9	-29.6	0	0	0	107.6
44	L	31	Very low	29.4	Very low	156 Å²	156	162.1 Å²	162.1	82%	0.817	81%	0.806	S	S	*	*			trans	-169.5	140.1	144.8	-103	153.6	0	0	0	109.3
45	D	31.1	Very low	29.4	Very low	146 Å²	146	164 Å²	164	78%	0.781	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-56.7	158.4	-155.7	-56.9	-74.9	0	0	0	118.9
46	P	32.6	Very low	29.1	Very low	117 Å²	117	170.5 Å²	170.5	76%	0.76	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-92.1	132.6	179.9	35.2	-33.2	0	0	0	114.5
47	D	32.3	Very low	28.9	Very low	153 Å²	153	167 Å²	167	82%	0.818	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-62.9	127	171.5	-81.3	-47.7	0	0	0	112.9	Y49	D47-Y49 VanDerWaalsContact C-N 3.3Å; D47-Y49 PolarHBondContact O-N 3.42Å
48	P	30.4	Very low	28.6	Very low	111 Å²	111	169.4 Å²	169.4	72%	0.721	82%	0.817	S	S	*	*	S	Bend	trans	-85.7	42.3	-171.2	35.6	-38.2	0	0	0	115
49	Y	32.8	Very low	28.5	Very low	205 Å²	205	167.4 Å²	167.4	80%	0.804	82%	0.818	S	S	*	*			trans	-124.5	32.8	-176.2	-73.5	-68.9	0	0	0	115.7	D47	D47-Y49 VanDerWaalsContact C-N 3.3Å; D47-Y49 PolarHBondContact O-N 3.42Å
50	H	29.6	Very low	28.6	Very low	188 Å²	188	164.1 Å²	164.1	87%	0.87	81%	0.814	S	S	*	*			trans	-146	51.3	-178.6	-113.7	-73.4	0	0	0	115.8
51	L	27.6	Very low	28.6	Very low	157 Å²	157	166.4 Å²	166.4	82%	0.822	82%	0.816	S	S	*	*			trans	-142.3	43.3	-174.8	-128.3	165.4	0	0	0	117.9
52	Y	28.9	Very low	28.7	Very low	241 Å²	241	160.9 Å²	160.9	95%	0.945	81%	0.812	S	S	*	*			trans	-135.2	71.3	160	-83.3	-68	0	0	0	113.1
53	H	27.1	Very low	28.6	Very low	170 Å²	170	156.2 Å²	156.2	79%	0.787	81%	0.809	S	S	*	*	S	Bend	trans	-139.5	135.5	161.3	-138.7	-67.7	0	0	0	109.7
54	N	26.3	Very low	28.8	Very low	136 Å²	136	157.1 Å²	157.1	73%	0.727	81%	0.812	S	S	*	*	S	Bend	trans	62.1	84.1	173.8	-54.8	-13.6	0	0	0	117.7
55	Q	26.9	Very low	28.5	Very low	183 Å²	183	157.8 Å²	157.8	86%	0.855	81%	0.811	S	S	*	*			trans	-173.2	76.8	132.3	-105.7	174.9	41.3	0	0	113.2
56	Y	27.8	Very low	28.6	Very low	242 Å²	242	159.3 Å²	159.3	95%	0.949	81%	0.813	S	S	*	*			trans	-141.3	76.6	158.9	-87.3	-66.8	0	0	0	110.8
57	S	25.1	Very low	28.3	Very low	98 Å²	98	160.4 Å²	160.4	69%	0.685	81%	0.812	S	S	*	*			trans	-87.2	138.4	165.9	53.5	0	0	0	0	110.7
58	N	25	Very low	28.1	Very low	154 Å²	154	164.4 Å²	164.4	82%	0.824	82%	0.816	S	S	*	*			trans	63.9	90.2	163.8	-55.2	-21.1	0	0	0	117.5
59	S	28.3	Very low	27.9	Very low	124 Å²	124	164.7 Å²	164.7	87%	0.867	82%	0.821	S	S	*	*				-161.7	157.9	123.1	34.8	0	0	0	0	112.3
60	C	25.1	Very low	27.7	Very low	115 Å²	115	162.6 Å²	162.6	78%	0.777	82%	0.816	S	S	*	*			trans	-46.6	135.9	-170.7	-53.8	0	0	0	0	116.4
61	Y	30.1	Very low	27.4	Very low	238 Å²	238	159.3 Å²	159.3	93%	0.933	81%	0.814	S	S	*	*				-154.5	140.7	117.3	-99.4	-68.8	0	0	0	110.3
62	A	29.1	Very low	27.5	Very low	85 Å²	85	161.3 Å²	161.3	70%	0.702	81%	0.812	S	S	*	*			trans	-93.9	144.8	-171.5	0	0	0	0	0	112.7	I64	A62-I64 PolarHBondContact O-N 3.21Å
63	P	27.2	Very low	27.3	Very low	123 Å²	123	158.2 Å²	158.2	80%	0.799	81%	0.806	S	S	*	*			trans	-76.5	111.9	178	30.4	-33.3	0	0	0	111.1	Q65	P63-Q65 PolarHBondContact O-N 3.49Å
64	I	30.3	Very low	27.4	Very low	158 Å²	158	156.5 Å²	156.5	81%	0.81	81%	0.81	S	S	*	*			trans	-71.1	110.5	168.8	-64.4	178.3	0	0	0	108.4	A62 H66	A62-I64 PolarHBondContact O-N 3.21Å; I64-H66 PolarHBondContact O-N 3.23Å
65	Q	25.1	Very low	27.3	Very low	169 Å²	169	161 Å²	161	79%	0.79	82%	0.817	S	S	*	*			trans	-64.9	128.8	170.7	-66	-179.7	-21.5	0	0	109.9	P63	P63-Q65 PolarHBondContact O-N 3.49Å
66	H	33.1	Very low	27.2	Very low	179 Å²	179	161.3 Å²	161.3	83%	0.829	82%	0.821	S	S	*	*			trans	-130.1	99	157.9	-121.5	-66.7	0	0	0	111.5	I64 R68	I64-H66 PolarHBondContact O-N 3.23Å; H66-R68 PolarHBondContact O-N 2.91Å
67	N	26.4	Very low	27.2	Very low	139 Å²	139	155.6 Å²	155.6	74%	0.743	81%	0.811	S	S	*	*			trans	-60.8	129.6	170.1	-77.7	-44.9	0	0	0	110.7
68	R	28.6	Very low	27.4	Very low	237 Å²	237	156.3 Å²	156.3	89%	0.894	81%	0.811	S	S	*	*				-168.2	110.7	128.1	-109	165.7	-179.1	173.9	1.4	112.2	H66	H66-R68 PolarHBondContact O-N 2.91Å
69	S	24.3	Very low	27.5	Very low	118 Å²	118	158.3 Å²	158.3	83%	0.825	81%	0.807	S	S	*	*			trans	-70.9	130.2	160.5	42.4	0	0	0	0	110.1
70	K	29.8	Very low	27.6	Very low	161 Å²	161	156.5 Å²	156.5	70%	0.7	79%	0.794	S	S	*	*			trans	-140.9	117.4	155.8	-81	-159.4	172.7	-170.2	0	109	Y72	K70-Y72 HydrophobicContact CB-CD2 4.33Å; K70-Y72 HydrophobicContact CB-CE2 4.08Å; K70-Y72 HydrophobicContact CD-CE2 4.2Å
71	S	23.8	Very low	27.9	Very low	119 Å²	119	155.1 Å²	155.1	83%	0.832	79%	0.786	S	S	*	*			trans	-67.8	133.8	169.5	39	0	0	0	0	110.2
72	Y	29.5	Very low	28.2	Very low	198 Å²	198	150.6 Å²	150.6	78%	0.776	78%	0.777	S	S	*	*			trans	-136.5	137.4	165.5	-84.8	-76.9	0	0	0	109.8	K70	K70-Y72 HydrophobicContact CB-CD2 4.33Å; K70-Y72 HydrophobicContact CB-CE2 4.08Å; K70-Y72 HydrophobicContact CD-CE2 4.2Å
73	Q	25.3	Very low	28.4	Very low	176 Å²	176	151.8 Å²	151.8	82%	0.822	77%	0.771	S	S	*	*			trans	-76.7	155.5	-179.6	-70.6	-177.3	-15.9	0	0	111.3	R75	Q73-R75 PolarHBondContact O-N 3.45Å
74	P	27.1	Very low	28.7	Very low	135 Å²	135	154.2 Å²	154.2	88%	0.877	77%	0.766	S	S	*	*			trans	-65.8	104	175.8	27.8	-34.8	0	0	0	110.4
75	R	25	Very low	28.8	Very low	230 Å²	230	154.8 Å²	154.8	87%	0.868	76%	0.758	S	S	*	*			trans	-90.5	122.6	169.9	-151.2	178.9	-159.1	-172.4	5.4	107.8	Q73 V77	Q73-R75 PolarHBondContact O-N 3.45Å; R75-V77 PolarHBondContact O-N 3.02Å; R75-V77 VanDerWaalsContact O-N 3.09Å
76	M	25.3	Very low	29.2	Very low	190 Å²	190	151.1 Å²	151.1	94%	0.936	74%	0.743	S	S	*	*			trans	-57.3	116	175.3	-71.1	178.1	174	0	0	109.9
77	V	27.3	Very low	29.4	Very low	121 Å²	121	148.8 Å²	148.8	73%	0.733	73%	0.733	S	S	*	*			trans	-96.2	111.5	169.6	178.2	0	0	0	0	107.3	R75	R75-V77 PolarHBondContact O-N 3.02Å; R75-V77 VanDerWaalsContact O-N 3.09Å
78	T	28.9	Very low	29.8	Very low	113 Å²	113	146.9 Å²	146.9	69%	0.693	72%	0.722	S	S	*	*			trans	-66.6	150.1	173.6	43.7	0	0	0	0	110.7	S80	T78-S80 PolarHBondContact O-N 3.21Å; T78-S80 PolarHBondContact O-OG 3.13Å
79	R	28.4	Very low	30.2	Very low	196 Å²	196	141.7 Å²	141.7	74%	0.74	71%	0.706	S	S	*	*	S	Bend	trans	-68.4	78.9	-167.1	-161.9	176.5	-172.5	-175.9	0.5	112.6	D362	R79-D362 IonicContact NH2-OD1 2.88Å
80	S	30.7	Very low	30.7	Very low	86 Å²	86	142.5 Å²	142.5	60%	0.601	70%	0.696	S	S	*	*			trans	-143.5	-1.7	-175.9	65.8	0	0	0	0	116.3	T78 I82	T78-S80 PolarHBondContact O-N 3.21Å; T78-S80 PolarHBondContact O-OG 3.13Å; S80-I82 VanDerWaalsContact C-N 3.32Å; S80-I82 PolarHBondContact O-N 3.05Å
81	S	31.5	Very low	31.1	Very low	86 Å²	86	137.8 Å²	137.8	60%	0.601	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-67.2	-20.9	-170	48.8	0	0	0	0	116.1	N83 Y84	S81-N83 VanDerWaalsContact C-N 3.27Å; S81-N83 PolarHBondContact O-N 3.38Å; S81-Y84 PolarHBondContact O-N 3.41Å
82	I	35.3	Very low	31.7	Very low	143 Å²	143	136.7 Å²	136.7	73%	0.733	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-62	-29.1	-171.7	-69.3	171.1	0	0	0	113.2	S80 Y84	S80-I82 VanDerWaalsContact C-N 3.32Å; S80-I82 PolarHBondContact O-N 3.05Å; I82-Y84 PolarHBondContact O-N 3.28Å
83	N	33.6	Very low	32.1	Very low	111 Å²	111	129.4 Å²	129.4	59%	0.594	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-77	-11.3	-174.1	-89.9	-33.4	0	0	0	115.9	S81 R85 N86 Q87	S81-N83 VanDerWaalsContact C-N 3.27Å; S81-N83 PolarHBondContact O-N 3.38Å; N83-R85 PolarHBondContact O-N 3.34Å; N83-N86 PolarHBondContact O-N 3.18Å; N83-Q87 PolarHBondContact O-N 3.46Å
84	Y	33.2	Very low	32.7	Very low	173 Å²	173	126.5 Å²	126.5	68%	0.678	64%	0.637	S	S	*	*	H	α-helix	trans	-69.9	-29.6	-178.7	-107.9	-83.6	0	0	0	113.8	S81 I82 N86 L88	S81-Y84 PolarHBondContact O-N 3.41Å; I82-Y84 PolarHBondContact O-N 3.28Å; Y84-N86 VanDerWaalsContact C-N 3.35Å; Y84-N86 PolarHBondContact O-N 3.45Å; Y84-L88 PolarHBondContact O-N 2.99Å
85	R	32.4	Very low	33.2	Very low	171 Å²	171	127.2 Å²	127.2	65%	0.645	63%	0.626	S	S	*	*	H	α-helix	trans	-65.3	-35.6	176	-91.5	-175.9	178.3	146.1	12.3	112.6	N83 K89 E367	N83-R85 PolarHBondContact O-N 3.34Å; R85-K89 PolarHBondContact O-N 3.15Å; R85-K89 VanDerWaalsContact O-N 3.11Å; R85-E367 IonicContact CZ-OE1 3.61Å; R85-E367 VanDerWaalsContact CZ-OE1 3.3Å; R85-E367 IonicContact NH1-OE1 2.79Å; R85-E367 PolarHBondContact NH1-OE1 3.25Å; R85-E367 IonicContact NH2-OE1 3.59Å; R85-E367 PolarHBondContact NH2-OE1 3.19Å; R85-E367 IonicContact NH2-OE2 3.21Å
86	N	34	Very low	33.7	Very low	91 Å²	91	122.9 Å²	122.9	49%	0.487	61%	0.614	S	S	.	*	H	α-helix	trans	-79.4	-35.4	-175.7	-71.1	-14.6	0	0	0	112.9	N83 Y84 L88 K89 H90	N83-N86 PolarHBondContact O-N 3.18Å; Y84-N86 VanDerWaalsContact C-N 3.35Å; Y84-N86 PolarHBondContact O-N 3.45Å; N86-L88 VanDerWaalsContact C-N 3.35Å; N86-K89 PolarHBondContact O-N 3.5Å; N86-H90 PolarHBondContact O-N 2.95Å; N86-H90 VanDerWaalsContact O-N 3.13Å
87	Q	36.4	Very low	34.2	Very low	130 Å²	130	122.1 Å²	122.1	61%	0.607	60%	0.602	S	S	*	*	H	α-helix	trans	-65.3	-38	171.3	-69.9	-172.4	-11.8	0	0	112.1	N83 H90 S91	N83-Q87 PolarHBondContact O-N 3.46Å; Q87-H90 PolarHBondContact O-N 2.82Å; Q87-S91 PolarHBondContact O-N 3.38Å; Q87-S91 PolarHBondContact O-OG 3.5Å
88	L	34.9	Very low	34.7	Very low	100 Å²	100	119.2 Å²	119.2	52%	0.524	59%	0.586	S	S	.	*	H	α-helix	trans	-64.2	-44.5	174.1	-86	163	0	0	0	112.2	Y84 N86 H90 S91 L92	Y84-L88 PolarHBondContact O-N 2.99Å; N86-L88 VanDerWaalsContact C-N 3.35Å; L88-H90 PolarHBondContact O-N 2.86Å; L88-S91 PolarHBondContact O-N 2.9Å; L88-S91 PolarHBondContact O-OG 3.47Å; L88-S91 VanDerWaalsContact O-OG 3.09Å; L88-L92 WeakPolarHBondContact O-CB 3.13Å; L88-L92 WeakPolarHBondContact O-CG 3.24Å; L88-L92 PolarHBondContact O-N 3.27Å
89	K	36.5	Very low	35	Very low	127 Å²	127	118.3 Å²	118.3	55%	0.552	58%	0.577	S	S	*	*	H	α-helix	trans	-55.9	-48	173.7	-80.5	-170.1	171.6	-170.1	0	112.3	R85 N86 L92 S93	R85-K89 PolarHBondContact O-N 3.15Å; R85-K89 VanDerWaalsContact O-N 3.11Å; N86-K89 PolarHBondContact O-N 3.5Å; K89-L92 PolarHBondContact O-N 2.96Å; K89-S93 PolarHBondContact O-N 3.45Å
90	H	36.5	Very low	35.5	Very low	135 Å²	135	113.4 Å²	113.4	63%	0.625	57%	0.565	S	S	*	*	H	α-helix	trans	-66.5	-37.8	179	-93.9	-69.1	0	0	0	114.4	N86 Q87 L88 L92 S93 N94	N86-H90 PolarHBondContact O-N 2.95Å; N86-H90 VanDerWaalsContact O-N 3.13Å; Q87-H90 PolarHBondContact O-N 2.82Å; L88-H90 PolarHBondContact O-N 2.86Å; H90-L92 VanDerWaalsContact C-N 3.31Å; H90-L92 PolarHBondContact O-N 3.29Å; H90-S93 PolarHBondContact O-OG 2.92Å; H90-N94 PolarHBondContact O-N 3.35Å
91	S	36.9	Very low	35.8	Very low	63 Å²	63	115.9 Å²	115.9	44%	0.441	57%	0.567	S	S	.	*	H	α-helix	trans	-71.4	-26.8	177.2	65.8	0	0	0	0	113.1	Q87 L88	Q87-S91 PolarHBondContact O-N 3.38Å; Q87-S91 PolarHBondContact O-OG 3.5Å; L88-S91 PolarHBondContact O-N 2.9Å; L88-S91 PolarHBondContact O-OG 3.47Å; L88-S91 VanDerWaalsContact O-OG 3.09Å
92	L	37.5	Very low	36.1	Very low	95 Å²	95	118.3 Å²	118.3	50%	0.497	57%	0.569	S	S	.	*	H	α-helix	trans	-78.4	-43.9	174.3	-73.2	167.5	0	0	0	112.1	L88 K89 H90 N94 K95 F96	L88-L92 WeakPolarHBondContact O-CB 3.13Å; L88-L92 WeakPolarHBondContact O-CG 3.24Å; L88-L92 PolarHBondContact O-N 3.27Å; K89-L92 PolarHBondContact O-N 2.96Å; H90-L92 VanDerWaalsContact C-N 3.31Å; H90-L92 PolarHBondContact O-N 3.29Å; L92-N94 VanDerWaalsContact C-N 3.3Å; L92-N94 PolarHBondContact O-N 3.26Å; L92-K95 PolarHBondContact O-N 3.14Å; L92-F96 PolarHBondContact O-N 3.04Å; L92-F96 VanDerWaalsContact O-N 3.14Å
93	S	37.3	Very low	36	Very low	46 Å²	46	119 Å²	119	32%	0.322	57%	0.566	S	S	.	*	H	α-helix	trans	-55.9	-45.5	178.2	62	0	0	0	0	111.8	K89 H90 K95 F96 Y97	K89-S93 PolarHBondContact O-N 3.45Å; H90-S93 PolarHBondContact O-OG 2.92Å; S93-K95 PolarHBondContact O-N 3.12Å; S93-F96 PolarHBondContact O-N 2.57Å; S93-F96 VanDerWaalsContact O-N 3.09Å; S93-Y97 PolarHBondContact O-N 3.19Å
94	N	37	Very low	36.1	Very low	115 Å²	115	119 Å²	119	62%	0.615	57%	0.566	S	S	*	*	H	α-helix	trans	-69	-19.3	-178.4	-67.5	9.6	0	0	0	113.3	H90 L92	H90-N94 PolarHBondContact O-N 3.35Å; L92-N94 VanDerWaalsContact C-N 3.3Å; L92-N94 PolarHBondContact O-N 3.26Å
95	K	38.1	Very low	36.2	Very low	149 Å²	149	117.8 Å²	117.8	65%	0.648	57%	0.571	S	S	*	*	H	α-helix	trans	-87.9	-19.3	172.3	-81.8	-176.5	172.5	-179.5	0	113.9	L92 S93 S98 N99	L92-K95 PolarHBondContact O-N 3.14Å; S93-K95 PolarHBondContact O-N 3.12Å; K95-S98 PolarHBondContact O-OG 3.47Å; K95-N99 PolarHBondContact O-ND2 3.5Å
96	F	36.2	Very low	36.4	Very low	140 Å²	140	116.4 Å²	116.4	61%	0.614	58%	0.575	S	S	*	*	H	α-helix	trans	-83.6	-40.8	174.5	-91.2	-89	0	0	0	112.4	L92 S93 S98 N99 I100	L92-F96 PolarHBondContact O-N 3.04Å; L92-F96 VanDerWaalsContact O-N 3.14Å; S93-F96 PolarHBondContact O-N 2.57Å; S93-F96 VanDerWaalsContact O-N 3.09Å; F96-S98 PolarHBondContact O-N 3.3Å; F96-N99 PolarHBondContact O-N 3.47Å; F96-I100 PolarHBondContact O-N 3.3Å
97	Y	36.2	Very low	36.4	Very low	174 Å²	174	120.7 Å²	120.7	68%	0.682	59%	0.589	S	S	*	*	H	α-helix	trans	-59	-45.2	179.4	-91.8	-91	0	0	0	113.2	S93 N99 I100	S93-Y97 PolarHBondContact O-N 3.19Å; Y97-N99 PolarHBondContact O-N 3.31Å; Y97-N99 VanDerWaalsContact O-N 3.15Å; Y97-I100 PolarHBondContact O-N 2.85Å; Y97-I100 VanDerWaalsContact O-N 3.13Å
98	S	36.5	Very low	36.2	Very low	59 Å²	59	122.2 Å²	122.2	41%	0.413	60%	0.601	S	S	.	*	H	α-helix	trans	-64.2	-19.6	179.6	60.1	0	0	0	0	114.7	K95 F96	K95-S98 PolarHBondContact O-OG 3.47Å; F96-S98 PolarHBondContact O-N 3.3Å
99	N	36.6	Very low	36	Very low	95 Å²	95	124.8 Å²	124.8	51%	0.508	62%	0.615	S	S	.	*	H	α-helix	trans	-92.1	-10.2	178.6	-81	-74.8	0	0	0	113.7	K95 F96 Y97	K95-N99 PolarHBondContact O-ND2 3.5Å; F96-N99 PolarHBondContact O-N 3.47Å; Y97-N99 PolarHBondContact O-N 3.31Å; Y97-N99 VanDerWaalsContact O-N 3.15Å
100	I	38	Very low	35.7	Very low	92 Å²	92	126.5 Å²	126.5	47%	0.472	63%	0.63	S	S	.	*	H	α-helix	trans	-91.6	-42	-179.3	-68.8	168.7	0	0	0	110.5	F96 Y97 Q102 K103 N104	F96-I100 PolarHBondContact O-N 3.3Å; Y97-I100 PolarHBondContact O-N 2.85Å; Y97-I100 VanDerWaalsContact O-N 3.13Å; I100-Q102 VanDerWaalsContact C-N 3.35Å; I100-Q102 PolarHBondContact O-N 3.1Å; I100-K103 PolarHBondContact O-N 2.76Å; I100-K103 VanDerWaalsContact O-N 3.15Å; I100-N104 PolarHBondContact O-N 2.65Å
101	E	38	Very low	35.4	Very low	138 Å²	138	129.6 Å²	129.6	65%	0.645	64%	0.642	S	S	*	*	H	α-helix	trans	-60	-43.6	175.7	-64.3	-173.8	130.5	0	0	111.9	K103 N104 L105	E101-K103 VanDerWaalsContact C-N 3.27Å; E101-K103 PolarHBondContact O-N 3.45Å; E101-N104 PolarHBondContact O-N 2.99Å; E101-L105 WeakPolarHBondContact O-CD1 3.37Å; E101-L105 PolarHBondContact O-N 2.83Å
102	Q	36.1	Very low	34.9	Very low	138 Å²	138	132.4 Å²	132.4	65%	0.645	66%	0.658	S	S	*	*	H	α-helix	trans	-63.9	-27.2	177.2	-68.5	-169.1	-8.6	0	0	113.7	I100 I106	I100-Q102 VanDerWaalsContact C-N 3.35Å; I100-Q102 PolarHBondContact O-N 3.1Å; Q102-I106 VanDerWaalsContact O-CD1 3.25Å; Q102-I106 WeakPolarHBondContact O-CD1 3.3Å; Q102-I106 WeakPolarHBondContact O-CG1 3.3Å
103	K	34.9	Very low	34.5	Very low	157 Å²	157	135.3 Å²	135.3	68%	0.683	67%	0.674	S	S	*	*	H	α-helix	trans	-82.7	-25.8	177.4	-85.3	-180	173.9	175.2	0	113.6	I100 E101	I100-K103 PolarHBondContact O-N 2.76Å; I100-K103 VanDerWaalsContact O-N 3.15Å; E101-K103 VanDerWaalsContact C-N 3.27Å; E101-K103 PolarHBondContact O-N 3.45Å
104	N	35	Very low	34.2	Very low	111 Å²	111	142.5 Å²	142.5	59%	0.594	70%	0.695	S	S	*	*	H	α-helix	trans	-86	-28.6	-178	-72.1	-15	0	0	0	113.2	I100 E101 I106	I100-N104 PolarHBondContact O-N 2.65Å; E101-N104 PolarHBondContact O-N 2.99Å; N104-I106 VanDerWaalsContact C-N 3.27Å; N104-I106 PolarHBondContact O-N 2.9Å
105	L	35.4	Very low	33.8	Very low	147 Å²	147	142.6 Å²	142.6	77%	0.77	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-68	-21.5	172.9	-92.4	89.1	0	0	0	114.3	E101	E101-L105 WeakPolarHBondContact O-CD1 3.37Å; E101-L105 PolarHBondContact O-N 2.83Å
106	I	36.2	Very low	33.4	Very low	143 Å²	143	140.7 Å²	140.7	73%	0.733	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-83.4	-13.2	-172.7	-66.2	174.7	0	0	0	112.9	Q102 N104	Q102-I106 VanDerWaalsContact O-CD1 3.25Å; Q102-I106 WeakPolarHBondContact O-CD1 3.3Å; Q102-I106 WeakPolarHBondContact O-CG1 3.3Å; N104-I106 VanDerWaalsContact C-N 3.27Å; N104-I106 PolarHBondContact O-N 2.9Å
107	K	33.3	Very low	33	Very low	180 Å²	180	140.4 Å²	140.4	78%	0.783	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-91.3	-4.9	-174.2	-84.9	-172.9	171.1	-175.3	0	116.4
108	L	33.5	Very low	32.7	Very low	162 Å²	162	138.9 Å²	138.9	85%	0.848	71%	0.71	S	S	*	*	S	Bend	trans	-104.5	6.4	-165.4	-139.8	85.9	0	0	0	116.6
109	N	31.1	Very low	32.5	Very low	154 Å²	154	141.6 Å²	141.6	82%	0.824	72%	0.724	S	S	*	*			trans	-134	69.4	-170.2	-147	3.6	0	0	0	114.1
110	N	29	Very low	32.3	Very low	163 Å²	163	142 Å²	142	87%	0.872	73%	0.73	S	S	*	*			trans	-119.5	91.5	176.4	-96.5	-16.2	0	0	0	111.8
111	K	30	Very low	32.1	Very low	201 Å²	201	145.3 Å²	145.3	87%	0.874	74%	0.743	S	S	*	*			trans	-143.7	120.8	157.1	-81.6	-167.8	176.6	178.9	0	109.6
112	P	27.4	Very low	31.8	Very low	121 Å²	121	145.9 Å²	145.9	79%	0.786	75%	0.749	S	S	*	*			trans	-99.4	133.3	-174.2	35.2	-31.7	0	0	0	113.2
113	L	29.9	Very low	31.7	Very low	157 Å²	157	144 Å²	144	82%	0.822	75%	0.749	S	S	*	*			trans	-148.9	110	160	-96.4	111.8	0	0	0	112.4
114	Y	31	Very low	31.4	Very low	197 Å²	197	142 Å²	142	77%	0.773	75%	0.75	S	S	*	*			trans	55.5	115.1	140.9	-67.1	-88.1	0	0	0	122.8
115	T	27.1	Very low	31.2	Very low	116 Å²	116	144.8 Å²	144.8	71%	0.712	76%	0.764	S	S	*	*				49.9	138.2	125.9	60.4	0	0	0	0	121.1
116	T	29.7	Very low	30.9	Very low	110 Å²	110	144.7 Å²	144.7	68%	0.675	76%	0.759	S	S	*	*			cis	-166.1	152.3	14.9	1.7	0	0	0	0	113.6
117	N	27.4	Very low	30.5	Very low	134 Å²	134	143.9 Å²	143.9	72%	0.717	76%	0.756	S	S	*	*			trans	70.3	142.8	142.7	-67.9	-7.8	0	0	0	124
118	N	30.8	Very low	30.2	Very low	142 Å²	142	139.7 Å²	139.7	76%	0.759	75%	0.746	S	S	*	*			trans	70.4	144.5	155.9	-60.7	-5.7	0	0	0	117.7
119	T	32.9	Very low	29.9	Very low	115 Å²	115	141.1 Å²	141.1	71%	0.706	74%	0.742	S	S	*	*			cis	-175.4	152.9	-15	31.5	0	0	0	0	106.6
120	T	32	Very low	29.7	Very low	104 Å²	104	140.3 Å²	140.3	64%	0.638	74%	0.737	S	S	*	*			cis	-164.1	176.8	-4	19.8	0	0	0	0	109.4
121	H	34	Very low	29.6	Very low	162 Å²	162	138.3 Å²	138.3	75%	0.75	73%	0.731	S	S	*	*			trans	76.6	125.1	170.7	-56.7	-79.5	0	0	0	117.7
122	I	31	Very low	29.5	Very low	149 Å²	149	134.6 Å²	134.6	76%	0.764	73%	0.725	S	S	*	*			cis	113.7	133.1	12.1	-66.3	171	0	0	0	112.3
123	P	34.1	Very low	29.4	Very low	100 Å²	100	138.7 Å²	138.7	65%	0.649	73%	0.726	S	S	*	*			trans	-143.4	-152.2	-132.4	41.1	-18.1	0	0	0	115.2
124	T	28.4	Very low	29.4	Very low	114 Å²	114	139 Å²	139	70%	0.699	73%	0.729	S	S	*	*			trans	61.9	129	149.2	48.8	0	0	0	0	122.3
125	L	31.7	Very low	29.2	Very low	170 Å²	170	135.1 Å²	135.1	89%	0.89	73%	0.726	S	S	*	*			trans	176.7	121.4	131.1	-93.8	150.6	0	0	0	107
126	H	28.7	Very low	29.2	Very low	144 Å²	144	135 Å²	135	67%	0.667	73%	0.725	S	S	*	*			cis	91.5	120.3	24	-146.1	-13.3	0	0	0	113.9
127	N	27.9	Very low	29.2	Very low	126 Å²	126	135.7 Å²	135.7	67%	0.674	73%	0.729	S	S	*	*			trans	72.7	153.7	159.6	-74.4	1.3	0	0	0	119.7
128	T	27.2	Very low	29.4	Very low	93 Å²	93	135.5 Å²	135.5	57%	0.571	73%	0.729	S	S	*	*			cis	-167.1	161.3	-15.2	21.8	0	0	0	0	113.2
129	Y	26.8	Very low	29.4	Very low	192 Å²	192	134.4 Å²	134.4	75%	0.753	72%	0.723	S	S	*	*			trans	50.5	130.1	143.1	-66.4	-52	0	0	0	124.1
130	N	26.2	Very low	29.4	Very low	137 Å²	137	134.9 Å²	134.9	73%	0.733	72%	0.721	S	S	*	*			trans	69.2	162	138.2	-58.7	-6.7	0	0	0	117.8
131	T	28	Very low	29.5	Very low	121 Å²	121	136.7 Å²	136.7	74%	0.742	72%	0.722	S	S	*	*			cis	-158.2	160.8	4.7	-11.7	0	0	0	0	112.3
132	T	27.2	Very low	29.5	Very low	123 Å²	123	135.2 Å²	135.2	76%	0.755	72%	0.72	S	S	*	*			trans	73.1	146	145.1	-53.7	0	0	0	0	121.6
133	Y	25.3	Very low	29.6	Very low	206 Å²	206	132.7 Å²	132.7	81%	0.808	72%	0.715	S	S	*	*			trans	-61.7	157.6	176.1	-53.6	-100.5	0	0	0	115.9
134	N	30.5	Very low	29.6	Very low	163 Å²	163	134.7 Å²	134.7	87%	0.872	72%	0.72	S	S	*	*				-166.3	-178.6	119	-98.3	-16.3	0	0	0	112.5
135	T	26.8	Very low	29.9	Very low	116 Å²	116	136 Å²	136	71%	0.712	72%	0.72	S	S	*	*			trans	-115.5	178.6	-155.1	55.3	0	0	0	0	115.9
136	T	27.3	Very low	29.9	Very low	114 Å²	114	134.5 Å²	134.5	70%	0.699	71%	0.713	S	S	*	*			trans	79.7	117.4	146.6	30.1	0	0	0	0	120.6
137	T	28.7	Very low	30.3	Very low	124 Å²	124	132 Å²	132	76%	0.761	71%	0.712	S	S	*	*			trans	59.9	133.2	141.2	51.2	0	0	0	0	119.1
138	D	31.5	Very low	30.6	Very low	131 Å²	131	134 Å²	134	70%	0.701	72%	0.717	S	S	*	*				-165.3	151.1	64.8	-120.7	-7.2	0	0	0	116.9
139	N	31.9	Very low	31	Very low	118 Å²	118	135.7 Å²	135.7	63%	0.631	72%	0.722	S	S	*	*			trans	60.5	133	141.1	-65	-35.7	0	0	0	126.9
140	N	32	Very low	31.2	Very low	125 Å²	125	133.8 Å²	133.8	67%	0.668	72%	0.724	S	S	*	*			trans	74.5	146.3	144.2	-66.2	-14.6	0	0	0	120.6
141	H	35.2	Very low	31.5	Very low	143 Å²	143	131.4 Å²	131.4	66%	0.662	72%	0.718	S	S	*	*			cis	-151.8	145.4	6.8	-116.3	-40.7	0	0	0	114.1
142	N	33.2	Very low	31.6	Very low	131 Å²	131	130.7 Å²	130.7	70%	0.701	72%	0.718	S	S	*	*			trans	78.2	132.5	138.3	-65.2	-10	0	0	0	126.6
143	S	33.8	Very low	31.9	Very low	96 Å²	96	129.5 Å²	129.5	67%	0.671	72%	0.715	S	S	*	*			trans	85.1	109.5	133.7	58.8	0	0	0	0	123.7
144	N	32.5	Very low	32.3	Very low	141 Å²	141	127.8 Å²	127.8	75%	0.754	72%	0.719	S	S	*	*				71.1	148.4	123	-63.6	16.4	0	0	0	120.2
145	M	35.3	Very low	32.4	Very low	143 Å²	143	124.9 Å²	124.9	70%	0.704	71%	0.711	S	S	*	*			cis	-158.2	150.9	-0.1	-125.5	167.1	155.9	0	0	111.1
146	D	32.8	Very low	33.3	Very low	137 Å²	137	124.8 Å²	124.8	73%	0.733	71%	0.712	S	S	*	*			trans	42.9	158	149.4	-45.9	-19.8	0	0	0	121.2
147	S	35.6	Very low	33.7	Very low	92 Å²	92	126.6 Å²	126.6	64%	0.643	71%	0.713	S	S	*	*			cis	-163.2	151.5	23.7	61.7	0	0	0	0	113.4
148	Q	35.2	Very low	34	Very low	168 Å²	168	128.2 Å²	128.2	79%	0.785	71%	0.71	S	S	*	*			trans	64.3	147.7	131.9	-74.5	-179.5	40.7	0	0	121.7
149	L	34.7	Very low	34.2	Very low	128 Å²	128	129.9 Å²	129.9	67%	0.67	72%	0.716	S	S	*	*			cis	-151.8	149.9	5.8	-95.7	137.6	0	0	0	112
150	L	31.2	Very low	34.3	Very low	152 Å²	152	127.3 Å²	127.3	80%	0.796	72%	0.716	S	S	*	*			trans	34.5	152.1	137.8	-64.5	-179.3	0	0	0	123.3
151	S	33.4	Very low	34.1	Very low	88 Å²	88	129.2 Å²	129.2	62%	0.615	73%	0.727	S	S	*	*			cis	-173.5	157.5	-5.8	47.7	0	0	0	0	113.7
152	S	30.7	Very low	33.8	Very low	106 Å²	106	126.9 Å²	126.9	74%	0.741	73%	0.726	S	S	*	*			trans	52.8	149.2	139.9	63.9	0	0	0	0	122.1
153	S	32.4	Very low	33.5	Very low	98 Å²	98	125.2 Å²	125.2	69%	0.685	73%	0.725	S	S	*	*			cis	176.8	149	-14.2	52.1	0	0	0	0	109.1
154	L	34.4	Very low	33.2	Very low	169 Å²	169	129 Å²	129	89%	0.885	73%	0.73	S	S	*	*			trans	169.9	165.1	134.1	-92.2	159.3	0	0	0	112.6
155	S	32.1	Very low	33	Very low	103 Å²	103	129.7 Å²	129.7	72%	0.72	73%	0.728	S	S	*	*			trans	-156	-167.3	-151.1	-44.4	0	0	0	0	110.7
156	P	45.8	Very low	32.5	Very low	113 Å²	113	126.9 Å²	126.9	73%	0.734	72%	0.723	S	S	*	*				-132.4	-139.3	-60.9	34.5	-13.1	0	0	0	112.1
157	E	35.2	Very low	32.2	Very low	152 Å²	152	127.1 Å²	127.1	71%	0.71	72%	0.724	S	S	*	*			trans	85.5	149.4	164.5	-56.8	-173.5	158.4	0	0	118.4
158	F	36.3	Very low	31.8	Very low	158 Å²	158	128.7 Å²	128.7	69%	0.693	73%	0.73	S	S	*	*			cis	-140.4	168.7	4.7	-123.9	-63.9	0	0	0	112.7
159	M	34.2	Very low	31.5	Very low	167 Å²	167	126.1 Å²	126.1	82%	0.823	73%	0.726	S	S	*	*			trans	-28.3	162.3	173.6	-75.5	150.7	36.4	0	0	120.8
160	G	33.4	Very low	31.2	Very low	63 Å²	63	125.6 Å²	125.6	65%	0.649	73%	0.728	S	S	*	*			cis	150.8	163.1	-4.6	0	0	0	0	0	115
161	N	29.7	Very low	31.1	Very low	165 Å²	165	124.5 Å²	124.5	88%	0.882	72%	0.723	S	S	*	*			trans	63	154.3	166	-68.4	-4.2	0	0	0	119.7
162	S	28.9	Very low	31.1	Very low	94 Å²	94	126.4 Å²	126.4	66%	0.657	73%	0.726	S	S	*	*			cis	-168.3	134.8	-21.2	51.5	0	0	0	0	112.9
163	S	26.4	Very low	31.3	Very low	97 Å²	97	127.1 Å²	127.1	68%	0.678	72%	0.721	S	S	*	*			trans	45.4	138.1	145.1	66.1	0	0	0	0	124
164	K	27.9	Very low	31.4	Very low	175 Å²	175	129.3 Å²	129.3	76%	0.761	72%	0.724	S	S	*	*			trans	71	158.2	153.9	-69	162.7	158.7	-112.4	0	116
165	E	28.3	Very low	31.3	Very low	155 Å²	155	127.3 Å²	127.3	72%	0.724	71%	0.714	S	S	*	*			cis	-140.9	-167.6	-0.1	-143	137.5	-126.3	0	0	112.7
166	S	24.8	Very low	31.3	Very low	85 Å²	85	127.8 Å²	127.8	59%	0.594	71%	0.709	S	S	*	*			trans	-98	159.2	-160.1	59	0	0	0	0	117.7
167	N	25.8	Very low	30.6	Very low	142 Å²	142	130.4 Å²	130.4	76%	0.759	71%	0.708	S	S	*	*			trans	87.2	151.7	143.4	-68.6	-19	0	0	0	122.6
168	T	27.1	Very low	30.4	Very low	124 Å²	124	133.7 Å²	133.7	76%	0.761	71%	0.714	S	S	*	*			trans	77.8	128.6	151	28.8	0	0	0	0	121.2
169	T	27.9	Very low	30	Very low	114 Å²	114	132.3 Å²	132.3	70%	0.699	72%	0.719	S	S	*	*			trans	10.3	142.4	135.3	52.8	0	0	0	0	118.3
170	T	29.5	Very low	29.9	Very low	117 Å²	117	129.3 Å²	129.3	72%	0.718	71%	0.714	S	S	*	*			cis	-164.1	-172	12.1	7.2	0	0	0	0	108.1
171	D	28.5	Very low	29.5	Very low	129 Å²	129	132.7 Å²	132.7	69%	0.69	72%	0.718	S	S	*	*			cis	-155	-157.6	5.7	-136.1	-50.4	0	0	0	110.6
172	D	34.2	Very low	29.5	Very low	128 Å²	128	134.5 Å²	134.5	68%	0.684	71%	0.714	S	S	*	*			trans	74.5	148.7	148.9	-70.9	-6.2	0	0	0	119.6
173	L	34.3	Very low	29.6	Very low	122 Å²	122	136 Å²	136	64%	0.639	72%	0.719	S	S	*	*			cis	-160.1	137.5	-15.8	-110.3	168.5	0	0	0	110.5
174	L	33.9	Very low	29.5	Very low	143 Å²	143	137.2 Å²	137.2	75%	0.749	72%	0.722	S	S	*	*			trans	67.3	161.5	154	-49.4	170.6	0	0	0	117.5
175	L	33.6	Very low	29.6	Very low	128 Å²	128	135.3 Å²	135.3	67%	0.67	72%	0.72	S	S	*	*			cis	-152.1	142.4	2.8	-160.1	72.4	0	0	0	112.1
176	N	30.8	Very low	29.6	Very low	113 Å²	113	134.5 Å²	134.5	60%	0.604	72%	0.721	S	S	*	*			trans	57.9	149.6	148.2	-82.7	-19.9	0	0	0	121.5
177	K	31.2	Very low	29.8	Very low	168 Å²	168	136.1 Å²	136.1	73%	0.73	73%	0.728	S	S	*	*			cis	-167.1	162.3	-18.8	-138.9	172.8	-159.6	163.9	0	110.7
178	R	30.9	Very low	30	Very low	221 Å²	221	134.8 Å²	134.8	83%	0.834	73%	0.725	S	S	*	*			trans	70.2	119	168.1	-63.8	173.9	169.9	158.3	-4.8	115.6
179	T	28.8	Very low	30	Very low	128 Å²	128	135.8 Å²	135.8	79%	0.785	73%	0.725	S	S	*	*			cis	92.4	94.9	18.2	79.9	0	0	0	0	118.2
180	S	31.5	Very low	30.1	Very low	105 Å²	105	140.3 Å²	140.3	73%	0.734	74%	0.735	S	S	*	*			trans	-173.8	102.4	137.2	51.9	0	0	0	0	108.2
181	N	25.5	Very low	30	Very low	134 Å²	134	142.7 Å²	142.7	72%	0.717	74%	0.736	S	S	*	*				67.6	116.3	94.4	-60.1	3.6	0	0	0	112
182	Y	29.9	Very low	30	Very low	203 Å²	203	147.8 Å²	147.8	80%	0.796	75%	0.747	S	S	*	*				-162.4	149.6	70	-106.7	-85	0	0	0	115.6
183	T	30.3	Very low	29.7	Very low	126 Å²	126	147.5 Å²	147.5	77%	0.773	74%	0.744	S	S	*	*			trans	46.8	105.6	156.4	38.9	0	0	0	0	121.8
184	T	25.5	Very low	29.3	Very low	121 Å²	121	150.2 Å²	150.2	74%	0.742	75%	0.751	S	S	*	*			trans	-59.7	161.4	158.9	50.7	0	0	0	0	115.7
185	N	28.5	Very low	28.9	Very low	135 Å²	135	149.6 Å²	149.6	72%	0.722	75%	0.748	S	S	*	*			trans	142.5	134.3	140.4	-70.3	-4.5	0	0	0	109.9
186	N	29.3	Very low	28.6	Very low	139 Å²	139	153 Å²	153	74%	0.743	76%	0.761	S	S	*	*			cis	-145.6	169.7	2.4	-106.5	-23	0	0	0	112.9
187	T	27.9	Very low	28.5	Very low	119 Å²	119	152.5 Å²	152.5	73%	0.73	77%	0.766	S	S	*	*			trans	-48	152.2	177.5	50.8	0	0	0	0	115.1
188	T	30.8	Very low	28.3	Very low	113 Å²	113	153.9 Å²	153.9	69%	0.693	77%	0.772	S	S	*	*				-166.5	150	60.3	38.4	0	0	0	0	114.6
189	N	27.1	Very low	28.2	Very low	146 Å²	146	150.8 Å²	150.8	78%	0.781	77%	0.771	S	S	*	*			trans	38.8	117.2	141.8	-57.2	-29.4	0	0	0	119.7
190	K	30.8	Very low	28.1	Very low	208 Å²	208	154.9 Å²	154.9	90%	0.904	77%	0.774	S	S	*	*				-162.5	160.9	51.4	-116.3	166.8	-177.5	176.8	0	113.1
191	K	26.6	Very low	28.1	Very low	167 Å²	167	154.9 Å²	154.9	73%	0.726	77%	0.774	S	S	*	*			trans	-88.3	138.4	179.7	-66.4	169.6	172.8	176.9	0	113.5	I193	K191-I193 HydrophobicContact CB-CD1 3.99Å; K191-I193 HydrophobicContact CB-CG1 4.27Å; K191-I193 HydrophobicContact CD-CD1 3.95Å; K191-I193 HydrophobicContact CG-CD1 4.2Å
192	Y	29.3	Very low	28.2	Very low	236 Å²	236	154.3 Å²	154.3	93%	0.925	78%	0.775	S	S	*	*			trans	-164.6	109.3	139.2	-79.8	-71.3	0	0	0	105.2
193	I	27	Very low	28.3	Very low	122 Å²	122	151.9 Å²	151.9	63%	0.626	77%	0.774	S	S	*	*			cis	79.5	91.7	35.6	-55.3	-174.2	0	0	0	114.6	K191	K191-I193 HydrophobicContact CB-CD1 3.99Å; K191-I193 HydrophobicContact CB-CG1 4.27Å; K191-I193 HydrophobicContact CD-CD1 3.95Å; K191-I193 HydrophobicContact CG-CD1 4.2Å
194	K	26.4	Very low	28.3	Very low	179 Å²	179	153.1 Å²	153.1	78%	0.778	78%	0.775	S	S	*	*			trans	67.3	133.4	142.1	-81.1	-167.4	168	-177.7	0	122.4
195	N	25.4	Very low	28.7	Very low	130 Å²	130	153.1 Å²	153.1	70%	0.695	78%	0.775	S	S	*	*			trans	64.1	102.9	135.6	-62.3	18.3	0	0	0	119.7
196	E	27.8	Very low	29	Very low	201 Å²	201	152.5 Å²	152.5	94%	0.939	78%	0.778	S	S	*	*			trans	-122.7	112.4	133.9	-72.9	-163.4	151.2	0	0	110
197	S	28.4	Very low	29.1	Very low	101 Å²	101	153.5 Å²	153.5	71%	0.706	78%	0.782	S	S	*	*			trans	-90.1	124.6	171.1	50.7	0	0	0	0	109.5	L199	S197-L199 PolarHBondContact O-N 3.1Å
198	K	27.2	Very low	29.2	Very low	197 Å²	197	153.2 Å²	153.2	86%	0.857	78%	0.782	S	S	*	*			trans	-53.9	124.9	179	-66.7	175.7	178.2	176.4	0	111.4
199	L	27.9	Very low	29.1	Very low	157 Å²	157	155.8 Å²	155.8	82%	0.822	79%	0.791	S	S	*	*			trans	-134.1	103	170.6	-118	168.1	0	0	0	108.6	S197	S197-L199 PolarHBondContact O-N 3.1Å
200	Y	27.9	Very low	29.2	Very low	214 Å²	214	155.9 Å²	155.9	84%	0.839	79%	0.79	S	S	*	*			trans	-84.7	107.9	173.4	-88.9	-85.7	0	0	0	109.5
201	S	31.1	Very low	29.2	Very low	105 Å²	105	151.1 Å²	151.1	73%	0.734	78%	0.783	S	S	*	*			trans	-97	103.5	168	43.5	0	0	0	0	110.1	I203	S201-I203 PolarHBondContact O-N 3.26Å
202	T	28.1	Very low	29.2	Very low	122 Å²	122	153.2 Å²	153.2	75%	0.748	79%	0.787	S	S	*	*			trans	-77.4	114.2	174.5	-60.1	0	0	0	0	109.6	I204	T202-I204 HydrophobicContact CG2-CG1 4.27Å
203	I	31.1	Very low	29.2	Very low	151 Å²	151	150.9 Å²	150.9	77%	0.774	79%	0.785	S	S	*	*			trans	-117.3	125.9	164.6	-64.3	-179.6	0	0	0	107.9	S201	S201-I203 PolarHBondContact O-N 3.26Å
204	I	31.2	Very low	29.2	Very low	152 Å²	152	152.9 Å²	152.9	78%	0.779	79%	0.791	S	S	*	*			trans	-89.1	132.7	-174	-61.7	166.9	0	0	0	109.3	T202	T202-I204 HydrophobicContact CG2-CG1 4.27Å
205	T	33.8	Very low	29.4	Very low	121 Å²	121	151 Å²	151	74%	0.742	79%	0.79	S	S	*	*			trans	-127.5	145.9	165	51.6	0	0	0	0	110.4
206	P	33.2	Very low	29.4	Very low	123 Å²	123	151.2 Å²	151.2	80%	0.799	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-85.1	163	-168.3	33.5	-36.5	0	0	0	114.5
207	I	31.7	Very low	29.5	Very low	160 Å²	160	149.8 Å²	149.8	82%	0.821	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-79.9	130.3	-177.2	-60.9	158.6	0	0	0	111.1
208	P	30.7	Very low	29.5	Very low	113 Å²	113	149.1 Å²	149.1	73%	0.734	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-83.6	147.1	162.4	33.7	-32	0	0	0	111.5
209	L	29.1	Very low	29.6	Very low	167 Å²	167	146.4 Å²	146.4	87%	0.874	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-71.5	147.5	-174.2	-73.8	73.3	0	0	0	112.9
210	I	29.4	Very low	29.8	Very low	148 Å²	148	145.1 Å²	145.1	76%	0.759	77%	0.769	S	S	*	*			trans	-85.4	114.9	162	-62.2	175.6	0	0	0	108.4	Y212	I210-Y212 HydrophobicContact CG2-CD2 4.37Å; I210-Y212 HydrophobicContact CG2-CE2 4.42Å
211	S	29.4	Very low	29.9	Very low	108 Å²	108	141.7 Å²	141.7	76%	0.755	76%	0.763	S	S	*	*			trans	-83.3	117.2	165.4	42.3	0	0	0	0	110.2
212	Y	26.9	Very low	29.7	Very low	210 Å²	210	143 Å²	143	82%	0.824	76%	0.762	S	S	*	*			trans	-76.4	122.3	166.3	-85.8	-97.4	0	0	0	109.6	I210	I210-Y212 HydrophobicContact CG2-CD2 4.37Å; I210-Y212 HydrophobicContact CG2-CE2 4.42Å
213	Q	30	Very low	29.8	Very low	188 Å²	188	144.2 Å²	144.2	88%	0.879	76%	0.762	S	S	*	*			trans	-113	103.5	159.9	-82.3	-172.9	-52.9	0	0	109.9
214	H	27.5	Very low	29.5	Very low	164 Å²	164	147.8 Å²	147.8	76%	0.759	77%	0.768	S	S	*	*			trans	-69.2	143.4	146.4	-91.5	38	0	0	0	108.7
215	N	28.9	Very low	29.5	Very low	140 Å²	140	146 Å²	146	75%	0.749	77%	0.766	S	S	*	*				-168.6	115.5	126.9	-92.5	-13.7	0	0	0	109.5
216	I	27.1	Very low	29	Very low	134 Å²	134	147.3 Å²	147.3	69%	0.687	77%	0.769	S	S	*	*				69.5	102	102.5	-61.2	170.7	0	0	0	113.7
217	I	29.1	Very low	28.6	Very low	171 Å²	171	150.3 Å²	150.3	88%	0.877	77%	0.769	S	S	*	*			trans	-135.4	121.6	131.2	-57.5	-177	0	0	0	106.6
218	P	29	Very low	28.5	Very low	87 Å²	87	150.3 Å²	150.3	57%	0.565	77%	0.77	S	S	*	*			trans	-101.5	161.1	178.9	37.7	-31.7	0	0	0	112.6
219	N	29.2	Very low	28.1	Very low	139 Å²	139	151.3 Å²	151.3	74%	0.743	77%	0.769	S	S	*	*				170.1	150.9	116.9	-87.1	-18.6	0	0	0	114.3
220	N	32.5	Very low	28.1	Very low	131 Å²	131	150.9 Å²	150.9	70%	0.701	77%	0.767	S	S	*	*			trans	70.7	115.1	162.6	-59.6	1.5	0	0	0	117.5
221	I	30	Very low	27.9	Very low	142 Å²	142	148.5 Å²	148.5	73%	0.728	76%	0.764	S	S	*	*				76.9	123.2	60	-66.1	165.8	0	0	0	110.7
222	D	26	Very low	27.7	Very low	132 Å²	132	148.4 Å²	148.4	71%	0.706	76%	0.763	S	S	*	*			cis	-172.4	176.9	-13.8	-118.7	-37.4	0	0	0	111.1
223	I	29.7	Very low	27.8	Very low	147 Å²	147	146.1 Å²	146.1	75%	0.754	76%	0.764	S	S	*	*			trans	67.3	120.1	152.5	-68.1	154.9	0	0	0	119.5
224	Y	25.4	Very low	27.5	Very low	226 Å²	226	141.9 Å²	141.9	89%	0.886	76%	0.755	S	S	*	*			trans	-77.8	154.1	155.8	-77.5	-93.2	0	0	0	110.9
225	P	31	Very low	27.8	Very low	114 Å²	114	141.8 Å²	141.8	74%	0.74	76%	0.758	S	S	*	*				-148.5	154.3	111.8	35.6	-19	0	0	0	118.2
226	N	24.3	Very low	27.6	Very low	150 Å²	150	141.5 Å²	141.5	80%	0.802	76%	0.757	S	S	*	*			trans	-7.2	146.5	155.6	-67.9	-37.8	0	0	0	122.6
227	K	24.7	Very low	28	Very low	185 Å²	185	142.9 Å²	142.9	80%	0.804	77%	0.766	S	S	*	*			trans	24.9	125.9	138.8	-70.2	-174	169.4	-169	0	119.3
228	L	28.2	Very low	28.1	Very low	161 Å²	161	143.2 Å²	143.2	84%	0.843	76%	0.761	S	S	*	*				-143.3	135.6	125	-150.1	77.4	0	0	0	110.4
229	D	22.9	Very low	28.2	Very low	134 Å²	134	150.6 Å²	150.6	72%	0.717	78%	0.777	S	S	*	*			trans	-73.7	153.1	163.3	-59.4	-78.8	0	0	0	109.7
230	N	29.2	Very low	28.4	Very low	157 Å²	157	151.6 Å²	151.6	84%	0.84	78%	0.782	S	S	*	*			trans	-165.4	143.3	134.5	-102.5	-37.8	0	0	0	112.2
231	S	24.2	Very low	28.5	Very low	98 Å²	98	149.8 Å²	149.8	69%	0.685	78%	0.779	S	S	*	*			trans	-103.8	152	178.7	59.5	0	0	0	0	110.8
232	S	25.5	Very low	28.4	Very low	106 Å²	106	150.7 Å²	150.7	74%	0.741	79%	0.786	S	S	*	*			trans	61.1	131.9	166.8	71.3	0	0	0	0	118.4
233	I	29.1	Very low	28.9	Very low	163 Å²	163	152 Å²	152	84%	0.836	79%	0.791	S	S	*	*				-172.7	149	106.6	-94	158.5	0	0	0	107.9
234	S	24.6	Very low	29	Very low	99 Å²	99	151 Å²	151	69%	0.692	79%	0.787	S	S	*	*			trans	-105.1	160.5	173.6	59.6	0	0	0	0	110.2
235	I	32.4	Very low	29.4	Very low	161 Å²	161	146.8 Å²	146.8	83%	0.826	78%	0.78	S	S	*	*			trans	-172.2	154.6	137.1	-99.4	151.8	0	0	0	109.5
236	N	25.5	Very low	29.5	Very low	135 Å²	135	147.6 Å²	147.6	72%	0.722	78%	0.778	S	S	*	*			trans	-72.8	163.2	179.4	-51.2	-89.9	0	0	0	111.6
237	D	36.3	Very low	29.9	Very low	163 Å²	163	146 Å²	146	87%	0.872	77%	0.769	S	S	*	*			trans	-133.1	149.2	138.5	-132.8	-34	0	0	0	112.5
238	K	31.1	Very low	30.3	Very low	178 Å²	178	144.2 Å²	144.2	77%	0.774	77%	0.769	S	S	*	*			trans	-140.7	127.2	-179.2	-77.7	-177.7	178.5	177.7	0	108.8
239	R	30.6	Very low	30.5	Very low	242 Å²	242	141.7 Å²	141.7	91%	0.913	77%	0.765	S	S	*	*			trans	166.1	124.4	141	-95.3	152	175.5	-168.9	-1.9	111.8
240	L	33.9	Very low	30.9	Very low	160 Å²	160	142.2 Å²	142.2	84%	0.838	77%	0.768	S	S	*	*				-168.1	136	112	-124.4	67	0	0	0	111.5
241	S	34.4	Very low	31.2	Very low	93 Å²	93	143.3 Å²	143.3	65%	0.65	77%	0.768	S	S	*	*			trans	11.6	120.5	145.8	53	0	0	0	0	118.5
242	N	28.1	Very low	31.8	Very low	161 Å²	161	144.5 Å²	144.5	86%	0.861	77%	0.766	S	S	*	*			cis	64.7	107.4	41	-136	52.4	0	0	0	114.1
243	I	35.3	Very low	32.4	Very low	158 Å²	158	145.4 Å²	145.4	81%	0.81	76%	0.762	S	S	*	*			trans	-161.6	124.6	151.4	-100	153.2	0	0	0	108.8
244	N	32.9	Very low	32.7	Very low	127 Å²	127	145.4 Å²	145.4	68%	0.679	76%	0.762	S	S	*	*			trans	22.9	128.5	154.4	-61.4	1.7	0	0	0	120.7
245	N	32.6	Very low	33.4	Very low	137 Å²	137	146.4 Å²	146.4	73%	0.733	76%	0.759	S	S	*	*				58.2	133.4	77.8	-50.5	1.8	0	0	0	113.1
246	N	33.3	Very low	33.6	Very low	131 Å²	131	145.3 Å²	145.3	70%	0.701	75%	0.75	S	S	*	*			cis	-157.3	178.7	-3.6	-113	37.1	0	0	0	106.3
247	D	33.3	Very low	34	Very low	116 Å²	116	149.3 Å²	149.3	62%	0.62	76%	0.755	S	S	*	*			cis	-157.6	177.7	11.6	-141.4	-45.6	0	0	0	110.6
248	N	32.7	Very low	33.8	Very low	148 Å²	148	148 Å²	148	79%	0.791	75%	0.748	S	S	*	*			trans	67.2	150.4	172.4	-58.4	-62.6	0	0	0	116.5
249	S	33.6	Very low	33.9	Very low	109 Å²	109	149.4 Å²	149.4	76%	0.762	75%	0.748	S	S	*	*			cis	-145.6	165.8	-8.1	42.9	0	0	0	0	110.9	E251	S249-E251 PolarHBondContact O-N 2.78Å
250	N	30.8	Very low	34	Very low	145 Å²	145	146.9 Å²	146.9	78%	0.775	74%	0.744	S	S	*	*			trans	-72.8	113.9	-170.5	-60	-67.1	0	0	0	114.2
251	E	36.1	Very low	33.8	Very low	179 Å²	179	143.9 Å²	143.9	84%	0.836	74%	0.736	S	S	*	*			trans	-149.6	-28.6	161.3	-137.6	166.5	-152.3	0	0	115	S249 I253	S249-E251 PolarHBondContact O-N 2.78Å; E251-I253 PolarHBondContact O-N 3.25Å
252	N	35.9	Very low	33.6	Very low	124 Å²	124	148.9 Å²	148.9	66%	0.663	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-81.9	-0.5	-170.6	-72.9	-53.8	0	0	0	117.2	L254 I255	N252-L254 PolarHBondContact O-N 3.35Å; N252-L254 VanDerWaalsContact O-N 3.13Å; N252-I255 PolarHBondContact O-N 3.06Å
253	I	37.1	Very low	33.8	Very low	125 Å²	125	147 Å²	147	64%	0.641	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-69.3	-14.6	-167.7	-69.1	174.3	0	0	0	113.9	E251	E251-I253 PolarHBondContact O-N 3.25Å
254	L	36.6	Very low	33.3	Very low	162 Å²	162	146.9 Å²	146.9	85%	0.848	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-84.2	-14.6	176.2	-99.5	161.8	0	0	0	114.9	N252	N252-L254 PolarHBondContact O-N 3.35Å; N252-L254 VanDerWaalsContact O-N 3.13Å
255	I	38.2	Very low	33.2	Very low	121 Å²	121	148.6 Å²	148.6	62%	0.621	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-31.1	-170.2	-64	177.3	0	0	0	112.9	N252 R257	N252-I255 PolarHBondContact O-N 3.06Å; I255-R257 PolarHBondContact O-N 2.72Å
256	E	36.7	Very low	33	Very low	137 Å²	137	144.8 Å²	144.8	64%	0.64	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-80.9	-14.2	-172.7	-71.8	-147.1	114.4	0	0	116.1	N258 R259	E256-N258 PolarHBondContact O-N 3.33Å; E256-R259 PolarHBondContact O-N 3.1Å
257	R	34	Very low	32.7	Very low	219 Å²	219	147.8 Å²	147.8	83%	0.826	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-63.9	-24	177.7	-85.5	-175.7	168.5	139.3	-1.5	113.4	I255 R259	I255-R257 PolarHBondContact O-N 2.72Å; R257-R259 VanDerWaalsContact C-N 3.32Å; R257-R259 PolarHBondContact O-N 3.3Å
258	N	32.8	Very low	32.5	Very low	136 Å²	136	147.5 Å²	147.5	73%	0.727	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-83.4	3.3	179.2	-72.6	-10.7	0	0	0	114.8	E256	E256-N258 PolarHBondContact O-N 3.33Å
259	R	33.7	Very low	32.2	Very low	207 Å²	207	149 Å²	149	78%	0.781	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-97.8	11.5	178.6	-83.8	-177.4	168.5	165	-2.5	115.3	E256 R257	E256-R259 PolarHBondContact O-N 3.1Å; R257-R259 VanDerWaalsContact C-N 3.32Å; R257-R259 PolarHBondContact O-N 3.3Å
260	K	31.8	Very low	32.3	Very low	190 Å²	190	151 Å²	151	83%	0.826	76%	0.76	S	S	*	*			trans	-117.7	1.4	-179.2	-71.5	-175.5	178.9	174.9	0	115.8	K262	K260-K262 PolarHBondContact O-N 3.18Å
261	S	29.8	Very low	33.3	Very low	96 Å²	96	152.6 Å²	152.6	67%	0.671	77%	0.765	S	S	*	*	S	Bend	trans	-68	94	157.7	35.3	0	0	0	0	109	V263	S261-V263 PolarHBondContact O-N 3.16Å
262	K	31.2	Very low	35	Very low	199 Å²	199	149.4 Å²	149.4	87%	0.865	76%	0.763	S	S	*	*			trans	-56.6	114.5	171.9	-79	-177	174.3	-179.4	0	108.9	K260 N264	K260-K262 PolarHBondContact O-N 3.18Å; K262-N264 PolarHBondContact O-N 3.32Å
263	V	31.1	Very low	37.2	Very low	120 Å²	120	147.5 Å²	147.5	73%	0.727	75%	0.749	S	S	*	*			trans	-61.4	120.1	170	178.2	0	0	0	0	107.8	S261 I265	S261-V263 PolarHBondContact O-N 3.16Å; V263-I265 VanDerWaalsContact C-N 3.29Å; V263-I265 HydrophobicContact CB-CG1 4.38Å; V263-I265 HydrophobicContact CG1-CG1 3.94Å; V263-I265 PolarHBondContact O-N 3.32Å
264	N	26.3	Very low	39.5	Very low	156 Å²	156	143.1 Å²	143.1	83%	0.834	73%	0.731	S	S	*	*			trans	-67.7	94.3	162.4	-86.2	-19.2	0	0	0	107.4	K262 G266	K262-N264 PolarHBondContact O-N 3.32Å; N264-G266 PolarHBondContact O-N 3.15Å
265	I	30.2	Very low	42.1	Very low	163 Å²	163	140.9 Å²	140.9	84%	0.836	71%	0.711	S	S	*	*			trans	-73.7	69.9	167.4	-55.2	177.4	0	0	0	106.8	V263	V263-I265 VanDerWaalsContact C-N 3.29Å; V263-I265 HydrophobicContact CB-CG1 4.38Å; V263-I265 HydrophobicContact CG1-CG1 3.94Å; V263-I265 PolarHBondContact O-N 3.32Å
266	G	28.5	Very low	44.6	Very low	58 Å²	58	135.1 Å²	135.1	60%	0.598	68%	0.681	S	S	*	*			trans	-110.9	91.2	-165.6	0	0	0	0	0	112	N264	N264-G266 PolarHBondContact O-N 3.15Å
267	K	25.7	Very low	47.2	Very low	194 Å²	194	129 Å²	129	84%	0.843	65%	0.653	S	S	*	*	S	Bend	trans	65.7	152.7	-175.4	-61.9	179.3	173.8	-180	0	114.6	M269	K267-M269 PolarHBondContact O-N 2.82Å
268	P	28.9	Very low	50	Low	110 Å²	110	118.6 Å²	118.6	71%	0.714	61%	0.614	S	S	*	*			trans	-59.9	135.2	154.3	29.2	-33.5	0	0	0	108.2	N270	P268-N270 PolarHBondContact O-N 2.99Å
269	M	28	Very low	52.8	Low	180 Å²	180	112.3 Å²	112.3	89%	0.887	58%	0.58	S	S	*	*			trans	-64.4	121.9	170.2	179.8	168.1	156.9	0	0	107.7	K267 M271	K267-M269 PolarHBondContact O-N 2.82Å; M269-M271 PolarHBondContact O-N 3.44Å
270	N	34.9	Very low	55.6	Low	151 Å²	151	102.5 Å²	102.5	81%	0.807	54%	0.543	S	S	*	.			trans	-63.5	96.9	177.3	-83.4	9.4	0	0	0	108.9	P268 S272	P268-N270 PolarHBondContact O-N 2.99Å; N270-S272 PolarHBondContact O-N 3.15Å; N270-S272 VanDerWaalsContact O-N 3.1Å
271	M	51.3	Low	58.4	Low	178 Å²	178	95 Å²	95	88%	0.877	51%	0.512	S	S	*	.			trans	-62.4	109.1	156.2	-81.7	174.7	57.3	0	0	106.7	M269 K273	M269-M271 PolarHBondContact O-N 3.44Å; M271-K273 PolarHBondContact O-N 2.99Å
272	S	72.2	Confident	61.2	Low	112 Å²	112	90.5 Å²	90.5	78%	0.783	48%	0.48	S	S	*	.			trans	-58.1	131.7	168.6	47.6	0	0	0	0	108.9	N270	N270-S272 PolarHBondContact O-N 3.15Å; N270-S272 VanDerWaalsContact O-N 3.1Å
273	K	83.1	Confident	64	Low	84 Å²	84	82.8 Å²	82.8	37%	0.365	45%	0.45	S	S	.	.			trans	-54.9	142.4	174.9	-58.1	-172.8	178.5	-171.4	0	109.8	M271 R275 T423 E427	M271-K273 PolarHBondContact O-N 2.99Å; K273-R275 PolarHBondContact O-N 2.86Å; K273-T423 WeakPolarHBondContact CD-O 3.37Å; K273-T423 WeakPolarHBondContact CE-O 3.22Å; K273-T423 PolarHBondContact NZ-O 3.23Å; K273-E427 HydrophobicContact CB-CB 4.2Å; K273-E427 HydrophobicContact CD-CB 4.28Å
274	A	85.6	Confident	66.6	Low	32 Å²	32	81.3 Å²	81.3	26%	0.264	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	102.3	173.2	0	0	0	0	0	108.8	V276 W355 E425 V426 E427	A274-V276 PolarHBondContact O-N 2.72Å; A274-W355 HydrophobicContact CB-CH2 3.39Å; A274-W355 HydrophobicContact CB-CZ2 3.31Å; A274-W355 HydrophobicContact CB-CZ3 4.22Å; A274-E425 PolarHBondContact N-O 3.07Å; A274-V426 WeakPolarHBondContact O-CA 3.43Å; A274-E427 PolarHBondContact O-N 2.86Å
275	R	89.6	Confident	69.6	Low	115 Å²	115	74.1 Å²	74.1	43%	0.434	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	120.7	177.1	-174.1	174.3	176.9	-119.8	-13	109.2	K273 E277 E427 V429	K273-R275 PolarHBondContact O-N 2.86Å; R275-E277 IonicContact CZ-OE1 3.36Å; R275-E277 IonicContact NE-OE1 3.69Å; R275-E277 IonicContact NH1-OE1 3.3Å; R275-E277 PolarHBondContact NH1-OE1 2.84Å; R275-E277 IonicContact NH2-OE1 3.61Å; R275-E277 PolarHBondContact NH2-OE1 3Å; R275-E427 WeakPolarHBondContact CA-O 3.22Å; R275-V429 HydrophobicContact CG-CG2 3.89Å
276	V	90.9	Very high	72.2	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	117.2	174.9	-174.6	0	0	0	0	107.7	A274 L278 A303 W305 W355 P357 V426 E427 L428 V429	A274-V276 PolarHBondContact O-N 2.72Å; V276-L278 HydrophobicContact CG1-CD2 3.87Å; V276-A303 HydrophobicContact CG1-CB 4.29Å; V276-W305 HydrophobicContact CG1-CE3 4.38Å; V276-W305 HydrophobicContact CG2-CB 4.29Å; V276-W355 HydrophobicContact CG2-CH2 3.97Å; V276-W355 HydrophobicContact CG2-CZ3 4.01Å; V276-P357 HydrophobicContact CG1-CG 4.46Å; V276-P357 HydrophobicContact CG2-CB 3.94Å; V276-V426 HydrophobicContact CG2-CG1 3.98Å; V276-E427 PolarHBondContact N-O 2.79Å; V276-L428 HydrophobicContact CB-CD2 3.87Å; V276-L428 HydrophobicContact CG1-CD2 4.32Å; V276-L428 HydrophobicContact CG2-CD2 4.37Å; V276-V429 PolarHBondContact O-N 2.84Å
277	E	91.7	Very high	75	Confident	10 Å²	10	70.4 Å²	70.4	5%	0.047	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	125.6	179.2	-64.9	-176.4	149.1	0	0	109.4	R275 A303 R304 V429 P432	R275-E277 IonicContact CZ-OE1 3.36Å; R275-E277 IonicContact NE-OE1 3.69Å; R275-E277 IonicContact NH1-OE1 3.3Å; R275-E277 PolarHBondContact NH1-OE1 2.84Å; R275-E277 IonicContact NH2-OE1 3.61Å; R275-E277 PolarHBondContact NH2-OE1 3Å; E277-A303 CarbonylContact O-C 3.57Å; E277-A303 WeakPolarHBondContact O-CA 3.38Å; E277-R304 HydrophobicContact CB-CB 4.4Å; E277-R304 PolarHBondContact N-O 3.36Å; E277-R304 PolarHBondContact O-N 2.94Å; E277-R304 IonicContact OE2-CZ 2.99Å; E277-R304 IonicContact OE2-NE 2.86Å; E277-R304 PolarHBondContact OE2-NE 3.06Å; E277-R304 IonicContact OE2-NH2 3.99Å; E277-R304 PolarHBondContact OE2-NH2 2.89Å; E277-V429 CarbonylContact C-O 3.57Å; E277-V429 WeakPolarHBondContact CA-O 3.48Å; E277-P432 VanDerWaalsContact CD-CD 3.4Å; E277-P432 WeakPolarHBondContact OE1-CD 3.4Å; E277-P432 VanDerWaalsContact OE1-CG 3.27Å; E277-P432 WeakPolarHBondContact OE1-CG 3.33Å
278	L	92.7	Very high	78.1	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	135.3	-175.1	-60.3	-177.7	0	0	0	111.7	V276 L301 Q302 A303 L359 I417 L428 V429 S431 L478 F480	V276-L278 HydrophobicContact CG1-CD2 3.87Å; L278-L301 HydrophobicContact CD2-CD1 4.39Å; L278-Q302 WeakPolarHBondContact CA-O 3.25Å; L278-A303 HydrophobicContact CD2-CB 3.49Å; L278-A303 VanDerWaalsContact CD2-CB 3.49Å; L278-L359 HydrophobicContact CD1-CD2 4.46Å; L278-L359 HydrophobicContact CD2-CD1 3.71Å; L278-L359 HydrophobicContact CD2-CD2 4.28Å; L278-I417 HydrophobicContact CD1-CB 4.49Å; L278-I417 HydrophobicContact CD1-CG2 3.86Å; L278-L428 HydrophobicContact CD1-CB 4.24Å; L278-L428 HydrophobicContact CD1-CD1 4.25Å; L278-L428 HydrophobicContact CD1-CD2 4.26Å; L278-L428 HydrophobicContact CD1-CG 4.47Å; L278-V429 PolarHBondContact N-O 2.84Å; L278-S431 PolarHBondContact O-N 2.91Å; L278-L478 HydrophobicContact CB-CD2 3.93Å; L278-L478 HydrophobicContact CD1-CB 4.22Å; L278-L478 HydrophobicContact CD1-CD2 3.94Å; L278-L478 HydrophobicContact CG-CD2 4.36Å; L278-F480 HydrophobicContact CB-CE2 4.45Å; L278-F480 HydrophobicContact CB-CZ 3.82Å
279	V	91.7	Very high	81	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.024	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	130.5	170.7	-169.3	0	0	0	0	108.1	I281 L301 Q302 S431 E434	V279-I281 HydrophobicContact CG1-CG1 4.34Å; V279-L301 WeakPolarHBondContact O-CA 3.29Å; V279-L301 WeakPolarHBondContact O-CD1 3.32Å; V279-Q302 HydrophobicContact CB-CB 4.26Å; V279-Q302 PolarHBondContact N-O 3.24Å; V279-Q302 PolarHBondContact O-N 3.17Å; V279-S431 VanDerWaalsContact CG2-CB 3.41Å; V279-E434 HydrophobicContact CG1-CB 4.07Å; V279-E434 HydrophobicContact CG2-CB 3.64Å
280	L	91.9	Very high	83.9	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.7	173.2	-171.2	146.7	0	0	0	110.8	F282 I299 V415 I417 S436 Q437 F480	L280-F282 HydrophobicContact CD2-CD1 4.45Å; L280-F282 HydrophobicContact CD2-CD2 3.37Å; L280-F282 HydrophobicContact CD2-CE1 4.35Å; L280-F282 HydrophobicContact CD2-CE2 3.23Å; L280-F282 HydrophobicContact CD2-CG 4.02Å; L280-F282 HydrophobicContact CD2-CZ 3.78Å; L280-I299 HydrophobicContact CD1-CG2 3.81Å; L280-I299 HydrophobicContact CD2-CG2 3.98Å; L280-I299 HydrophobicContact CG-CG2 3.65Å; L280-V415 HydrophobicContact CD1-CB 3.81Å; L280-V415 HydrophobicContact CD1-CG1 3.79Å; L280-V415 HydrophobicContact CD1-CG2 4.26Å; L280-I417 HydrophobicContact CD1-CD1 3.72Å; L280-S436 PolarHBondContact N-OG 3.2Å; L280-S436 CarbonylContact O-C 3.6Å; L280-S436 WeakPolarHBondContact O-CA 3.31Å; L280-S436 WeakPolarHBondContact O-CB 3.41Å; L280-Q437 PolarHBondContact O-N 3.42Å; L280-F480 HydrophobicContact CB-CB 4.25Å; L280-F480 HydrophobicContact CB-CD1 3.6Å; L280-F480 HydrophobicContact CB-CD2 4.04Å; L280-F480 HydrophobicContact CB-CE1 3.82Å; L280-F480 HydrophobicContact CB-CE2 4.24Å; L280-F480 HydrophobicContact CB-CG 3.7Å; L280-F480 HydrophobicContact CB-CZ 4.11Å; L280-F480 HydrophobicContact CD1-CB 4.1Å; L280-F480 HydrophobicContact CD1-CD2 3.89Å; L280-F480 HydrophobicContact CD1-CG 4.02Å; L280-F480 HydrophobicContact CD2-CB 4.2Å; L280-F480 HydrophobicContact CG-CB 4.42Å; L280-F480 HydrophobicContact CG-CG 4.3Å
281	I	90.9	Very high	86.6	Confident	33 Å²	33	46.3 Å²	46.3	17%	0.169	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	117.5	174.8	-58.1	-179.5	0	0	0	108.9	V279 V283 I299 F300 Q437	V279-I281 HydrophobicContact CG1-CG1 4.34Å; I281-V283 HydrophobicContact CG2-CG2 4.34Å; I281-V283 PolarHBondContact O-N 3.3Å; I281-I299 WeakPolarHBondContact O-CA 3.49Å; I281-F300 HydrophobicContact CB-CB 4.31Å; I281-F300 HydrophobicContact CB-CD1 4.42Å; I281-F300 HydrophobicContact CD1-CD1 4.18Å; I281-F300 HydrophobicContact CG1-CD1 4.45Å; I281-F300 PolarHBondContact N-O 2.88Å; I281-F300 PolarHBondContact O-N 2.76Å; I281-Q437 VanDerWaalsContact CA-O 3.29Å; I281-Q437 WeakPolarHBondContact CA-O 3.4Å; I281-Q437 HydrophobicContact CD1-CG 4.3Å; I281-Q437 HydrophobicContact CG1-CG 4.02Å; I281-Q437 HydrophobicContact CG2-CG 4.29Å
282	F	89.8	Confident	88.5	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	94.2	169.7	-71.6	-93.7	0	0	0	108.5	L280 V285 I299 V415 Q437 V438 D439 V455 S482	L280-F282 HydrophobicContact CD2-CD1 4.45Å; L280-F282 HydrophobicContact CD2-CD2 3.37Å; L280-F282 HydrophobicContact CD2-CE1 4.35Å; L280-F282 HydrophobicContact CD2-CE2 3.23Å; L280-F282 HydrophobicContact CD2-CG 4.02Å; L280-F282 HydrophobicContact CD2-CZ 3.78Å; F282-V285 HydrophobicContact CD1-CG2 4.29Å; F282-I299 HydrophobicContact CD1-CG1 4.19Å; F282-V415 HydrophobicContact CE1-CG2 3.71Å; F282-V415 HydrophobicContact CZ-CG2 3.71Å; F282-Q437 PolarHBondContact N-O 2.99Å; F282-V438 HydrophobicContact CB-CB 4.37Å; F282-V438 HydrophobicContact CB-CG1 4.03Å; F282-V438 HydrophobicContact CB-CG2 4.21Å; F282-V438 HydrophobicContact CD2-CG2 4.06Å; F282-V438 HydrophobicContact CG-CG2 4.44Å; F282-D439 PolarHBondContact O-N 3.17Å; F282-V455 HydrophobicContact CD2-CG2 4.11Å; F282-V455 HydrophobicContact CE2-CG1 4.33Å; F282-V455 HydrophobicContact CE2-CG2 4.22Å; F282-S482 VanDerWaalsContact CE2-CB 3.43Å
283	V	88.3	Confident	89.5	Confident	37 Å²	37	39.5 Å²	39.5	22%	0.224	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	-39.9	-179.8	-179.2	0	0	0	0	110.7	I281 D298 F300 C442	I281-V283 HydrophobicContact CG2-CG2 4.34Å; I281-V283 PolarHBondContact O-N 3.3Å; V283-D298 WeakPolarHBondContact CB-O 3.24Å; V283-D298 PolarHBondContact N-O 3.44Å; V283-D298 VanDerWaalsContact N-O 3.08Å; V283-F300 HydrophobicContact CG2-CB 3.68Å; V283-C442 WeakPolarHBondContact O-CB 3.39Å
284	K	87.6	Confident	90	Very high	90 Å²	90	38.6 Å²	38.6	39%	0.391	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	118.5	175.9	176	159.6	-170.2	164	0	111.9	A297 D298 C442 A444	K284-A297 CarbonylContact O-C 3.53Å; K284-A297 VanDerWaalsContact O-CA 3.28Å; K284-A297 WeakPolarHBondContact O-CA 3.47Å; K284-D298 HydrophobicContact CB-CB 4.09Å; K284-D298 PolarHBondContact N-O 3Å; K284-D298 PolarHBondContact O-N 2.85Å; K284-C442 HydrophobicContact CB-CB 4.36Å; K284-C442 VanDerWaalsContact CD-O 3.27Å; K284-C442 WeakPolarHBondContact CD-O 3.41Å; K284-C442 VanDerWaalsContact CE-O 3.3Å; K284-C442 WeakPolarHBondContact CE-O 3.47Å; K284-C442 VanDerWaalsContact CG-O 3.25Å; K284-C442 WeakPolarHBondContact CG-O 3.34Å; K284-A444 VanDerWaalsContact CE-CB 3.44Å
285	V	88	Confident	90.3	Very high	5 Å²	5	37.1 Å²	37.1	3%	0.03	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	130.9	161.3	-173.7	0	0	0	0	108.6	F282 V288 Y295 L413 A444 I451	F282-V285 HydrophobicContact CD1-CG2 4.29Å; V285-V288 HydrophobicContact CG1-CG2 4.5Å; V285-Y295 HydrophobicContact CG1-CD2 4.46Å; V285-L413 HydrophobicContact CG1-CD1 3.98Å; V285-A444 WeakPolarHBondContact O-CB 3.07Å; V285-A444 PolarHBondContact O-N 2.98Å; V285-I451 HydrophobicContact CB-CD1 3.68Å; V285-I451 HydrophobicContact CG1-CD1 4.31Å; V285-I451 HydrophobicContact CG2-CD1 3.83Å
286	G	85.2	Confident	90.5	Very high	5 Å²	5	36.1 Å²	36.1	5%	0.052	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-147.7	175.4	0	0	0	0	0	112	Q296	G286-Q296 WeakPolarHBondContact CA-O 3.33Å; G286-Q296 PolarHBondContact N-O 2.92Å
287	Q	87.3	Confident	90.5	Very high	138 Å²	138	36.2 Å²	36.2	65%	0.645	18%	0.181	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	139.5	175.7	-171.4	176.4	8.7	0	0	111.2	Q296	Q287-Q296 PolarHBondContact O-N 3.02Å; Q287-Q296 VanDerWaalsContact O-N 3.15Å
288	V	89.9	Confident	90.5	Very high	8 Å²	8	36.7 Å²	36.7	5%	0.048	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	101.6	172.5	-176.1	0	0	0	0	109.4	V285 T290 L413 W449	V285-V288 HydrophobicContact CG1-CG2 4.5Å; V288-T290 PolarHBondContact O-N 3.18Å; V288-L413 HydrophobicContact CG2-CD1 4.33Å; V288-W449 HydrophobicContact CB-CZ2 3.79Å; V288-W449 HydrophobicContact CG1-CH2 4.31Å; V288-W449 HydrophobicContact CG1-CZ2 3.72Å; V288-W449 HydrophobicContact CG2-CD2 4.5Å; V288-W449 HydrophobicContact CG2-CZ2 4.29Å
289	D	90.4	Very high	90.6	Very high	40 Å²	40	36.8 Å²	36.8	21%	0.214	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	89.4	-179.9	-179.3	-8.4	0	0	0	109.4	V291 N292 E293 R294	D289-V291 PolarHBondContact O-N 3.47Å; D289-V291 PolarHBondContact OD1-N 3.37Å; D289-N292 VanDerWaalsContact CG-ND2 3.3Å; D289-N292 PolarHBondContact O-N 2.9Å; D289-N292 PolarHBondContact OD1-N 3.29Å; D289-N292 PolarHBondContact OD1-ND2 2.89Å; D289-N292 VanDerWaalsContact OD1-ND2 3.08Å; D289-N292 WeakPolarHBondContact OD2-CB 3.27Å; D289-N292 PolarHBondContact OD2-ND2 2.84Å; D289-E293 PolarHBondContact O-N 3.46Å; D289-E293 VanDerWaalsContact O-N 3.11Å; D289-R294 HydrophobicContact CB-CG 3.8Å; D289-R294 PolarHBondContact N-O 2.95Å; D289-R294 PolarHBondContact O-N 2.93Å; D289-R294 IonicContact OD2-CZ 2.96Å; D289-R294 IonicContact OD2-NE 2.67Å; D289-R294 PolarHBondContact OD2-NE 3Å; D289-R294 IonicContact OD2-NH2 3.61Å; D289-R294 PolarHBondContact OD2-NH2 3.28Å; D289-R294 VanDerWaalsContact OD2-NH2 3.14Å
290	T	90.1	Very high	90.6	Very high	14 Å²	14	39.2 Å²	39.2	9%	0.086	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-22.5	-176.9	-60.1	0	0	0	0	112.4	V288 L401 L403 R486 P541	V288-T290 PolarHBondContact O-N 3.18Å; T290-L401 HydrophobicContact CG2-CD1 4.15Å; T290-L403 HydrophobicContact CG2-CD1 4.04Å; T290-L403 HydrophobicContact CG2-CD2 3.87Å; T290-R486 PolarHBondContact OG1-NH1 3Å; T290-R486 PolarHBondContact OG1-NH2 3.47Å; T290-P541 VanDerWaalsContact O-CD 3.26Å; T290-P541 WeakPolarHBondContact O-CD 3.43Å; T290-P541 WeakPolarHBondContact O-CG 3.43Å
291	V	90.8	Very high	90.7	Very high	66 Å²	66	39.2 Å²	39.2	40%	0.4	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-31.9	-176.8	178.6	0	0	0	0	112.3	D289	D289-V291 PolarHBondContact O-N 3.47Å; D289-V291 PolarHBondContact OD1-N 3.37Å
292	N	91.4	Very high	90.7	Very high	93 Å²	93	38.5 Å²	38.5	50%	0.497	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	12.5	176.3	-57.2	-77.2	0	0	0	113.6	D289 R294	D289-N292 VanDerWaalsContact CG-ND2 3.3Å; D289-N292 PolarHBondContact O-N 2.9Å; D289-N292 PolarHBondContact OD1-N 3.29Å; D289-N292 PolarHBondContact OD1-ND2 2.89Å; D289-N292 VanDerWaalsContact OD1-ND2 3.08Å; D289-N292 WeakPolarHBondContact OD2-CB 3.27Å; D289-N292 PolarHBondContact OD2-ND2 2.84Å; N292-R294 HydrophobicContact CB-CG 4.16Å; N292-R294 PolarHBondContact O-N 3.17Å
293	E	92.3	Very high	90.8	Very high	54 Å²	54	38.5 Å²	38.5	25%	0.252	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	54.7	174.1	-64.7	-169.1	129.6	0	0	112.9	D289 H398 E399 P541	D289-E293 PolarHBondContact O-N 3.46Å; D289-E293 VanDerWaalsContact O-N 3.11Å; E293-H398 PolarHBondContact O-ND1 3.26Å; E293-E399 CarbonylContact C-O 3.59Å; E293-E399 VanDerWaalsContact C-O 3.3Å; E293-E399 WeakPolarHBondContact CB-O 3.46Å; E293-E399 PolarHBondContact O-N 2.89Å; E293-P541 HydrophobicContact CG-CB 4.4Å; E293-P541 HydrophobicContact CG-CG 4.34Å
294	R	93.7	Very high	90.9	Very high	65 Å²	65	37.5 Å²	37.5	25%	0.245	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	161.7	-175.7	64.9	-175.7	179.7	-179.6	-7.2	112.9	D289 N292 E365 I396 F397	D289-R294 HydrophobicContact CB-CG 3.8Å; D289-R294 PolarHBondContact N-O 2.95Å; D289-R294 PolarHBondContact O-N 2.93Å; D289-R294 IonicContact OD2-CZ 2.96Å; D289-R294 IonicContact OD2-NE 2.67Å; D289-R294 PolarHBondContact OD2-NE 3Å; D289-R294 IonicContact OD2-NH2 3.61Å; D289-R294 PolarHBondContact OD2-NH2 3.28Å; D289-R294 VanDerWaalsContact OD2-NH2 3.14Å; N292-R294 HydrophobicContact CB-CG 4.16Å; N292-R294 PolarHBondContact O-N 3.17Å; R294-E365 WeakPolarHBondContact CD-OE2 3.2Å; R294-E365 IonicContact CZ-OE2 3.83Å; R294-E365 IonicContact NE-OE2 3.52Å; R294-E365 IonicContact NH1-OE1 3.14Å; R294-E365 PolarHBondContact NH1-OE1 2.94Å; R294-E365 VanDerWaalsContact NH1-OE1 3.15Å; R294-E365 IonicContact NH1-OE2 3.15Å; R294-E365 PolarHBondContact NH1-OE2 3.31Å; R294-I396 HydrophobicContact CB-CG2 4.16Å; R294-I396 HydrophobicContact CG-CG2 4.29Å; R294-F397 CarbonylContact C-O 3.55Å; R294-F397 WeakPolarHBondContact CA-O 3.12Å; R294-F397 VanDerWaalsContact CB-O 3.31Å; R294-F397 WeakPolarHBondContact CB-O 3.44Å
295	Y	92.9	Very high	91	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.008	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	153.3	175.6	70.7	-83.3	0	0	0	112	V285 A297 I396 F397 E399 L413 S414 V415	V285-Y295 HydrophobicContact CG1-CD2 4.46Å; Y295-A297 HydrophobicContact CD2-CB 4.13Å; Y295-A297 HydrophobicContact CE2-CB 3.81Å; Y295-I396 CarbonylContact O-C 3.6Å; Y295-I396 WeakPolarHBondContact O-CA 3.22Å; Y295-F397 HydrophobicContact CD1-CB 4.14Å; Y295-F397 HydrophobicContact CE1-CB 3.63Å; Y295-F397 HydrophobicContact CE2-CB 4.22Å; Y295-F397 HydrophobicContact CE2-CD2 4.02Å; Y295-F397 HydrophobicContact CE2-CG 4.41Å; Y295-F397 PolarHBondContact N-O 3.31Å; Y295-F397 PolarHBondContact O-N 3.35Å; Y295-E399 HydrophobicContact CD1-CB 4.08Å; Y295-E399 HydrophobicContact CE1-CB 4.11Å; Y295-L413 HydrophobicContact CD1-CB 4.35Å; Y295-L413 HydrophobicContact CD1-CD2 3.89Å; Y295-L413 HydrophobicContact CD2-CD1 4.34Å; Y295-L413 HydrophobicContact CE1-CB 3.95Å; Y295-L413 HydrophobicContact CE1-CD2 4.29Å; Y295-L413 HydrophobicContact CE2-CB 4.35Å; Y295-L413 HydrophobicContact CG-CD1 4.39Å; Y295-L413 HydrophobicContact CG-CD2 4.2Å; Y295-S414 PolarHBondContact OH-O 2.67Å; Y295-V415 VanDerWaalsContact OH-CG2 3.3Å; Y295-V415 WeakPolarHBondContact OH-CG2 3.24Å
296	Q	92.8	Very high	90.8	Very high	94 Å²	94	38 Å²	38	44%	0.439	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	141.2	170.8	-177.5	174.7	58.7	0	0	110.5	G286 Q287	G286-Q296 WeakPolarHBondContact CA-O 3.33Å; G286-Q296 PolarHBondContact N-O 2.92Å; Q287-Q296 PolarHBondContact O-N 3.02Å; Q287-Q296 VanDerWaalsContact O-N 3.15Å
297	A	91.9	Very high	90.7	Very high	2 Å²	2	38.4 Å²	38.4	2%	0.017	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	155.6	169	0	0	0	0	0	114.2	K284 Y295 I299 K394 G395 F397	K284-A297 CarbonylContact O-C 3.53Å; K284-A297 VanDerWaalsContact O-CA 3.28Å; K284-A297 WeakPolarHBondContact O-CA 3.47Å; Y295-A297 HydrophobicContact CD2-CB 4.13Å; Y295-A297 HydrophobicContact CE2-CB 3.81Å; A297-I299 HydrophobicContact CB-CD1 3.93Å; A297-I299 HydrophobicContact CB-CG1 3.95Å; A297-K394 WeakPolarHBondContact O-CA 3.47Å; A297-G395 PolarHBondContact N-O 2.89Å; A297-G395 PolarHBondContact O-N 2.88Å; A297-F397 HydrophobicContact CB-CD2 4.1Å; A297-F397 HydrophobicContact CB-CE2 3.91Å
298	D	92	Very high	90.2	Very high	20 Å²	20	35.4 Å²	35.4	11%	0.107	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	119	162.1	-167.8	-4.5	0	0	0	106.2	V283 K284 R392	V283-D298 WeakPolarHBondContact CB-O 3.24Å; V283-D298 PolarHBondContact N-O 3.44Å; V283-D298 VanDerWaalsContact N-O 3.08Å; K284-D298 HydrophobicContact CB-CB 4.09Å; K284-D298 PolarHBondContact N-O 3Å; K284-D298 PolarHBondContact O-N 2.85Å; D298-R392 WeakPolarHBondContact OD1-CG 3.42Å; D298-R392 IonicContact OD1-CZ 2.96Å; D298-R392 IonicContact OD1-NE 2.96Å; D298-R392 PolarHBondContact OD1-NE 3.24Å; D298-R392 IonicContact OD1-NH2 2.79Å; D298-R392 IonicContact OD2-CZ 2.72Å; D298-R392 IonicContact OD2-NE 3.13Å; D298-R392 PolarHBondContact OD2-NE 3.42Å; D298-R392 IonicContact OD2-NH2 2.67Å; D298-R392 PolarHBondContact OD2-NH2 3.2Å
299	I	92.9	Very high	89.3	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	140.1	-169.8	-67.1	155.7	0	0	0	108.1	L280 I281 F282 A297 R392 I393 F397 V415	L280-I299 HydrophobicContact CD1-CG2 3.81Å; L280-I299 HydrophobicContact CD2-CG2 3.98Å; L280-I299 HydrophobicContact CG-CG2 3.65Å; I281-I299 WeakPolarHBondContact O-CA 3.49Å; F282-I299 HydrophobicContact CD1-CG1 4.19Å; A297-I299 HydrophobicContact CB-CD1 3.93Å; A297-I299 HydrophobicContact CB-CG1 3.95Å; I299-R392 WeakPolarHBondContact O-CA 3.45Å; I299-I393 PolarHBondContact N-O 2.86Å; I299-I393 PolarHBondContact O-N 2.8Å; I299-F397 HydrophobicContact CD1-CD2 4.35Å; I299-F397 HydrophobicContact CD1-CE1 4.22Å; I299-F397 HydrophobicContact CD1-CE2 3.63Å; I299-F397 HydrophobicContact CD1-CZ 3.56Å; I299-V415 HydrophobicContact CD1-CG1 4.39Å; I299-V415 HydrophobicContact CD1-CG2 3.62Å
300	F	93.2	Very high	88.4	Confident	54 Å²	54	38.7 Å²	38.7	24%	0.237	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	117.3	167.3	176.7	-94.6	0	0	0	108.3	I281 V283 Q302 K390 R391	I281-F300 HydrophobicContact CB-CB 4.31Å; I281-F300 HydrophobicContact CB-CD1 4.42Å; I281-F300 HydrophobicContact CD1-CD1 4.18Å; I281-F300 HydrophobicContact CG1-CD1 4.45Å; I281-F300 PolarHBondContact N-O 2.88Å; I281-F300 PolarHBondContact O-N 2.76Å; V283-F300 HydrophobicContact CG2-CB 3.68Å; F300-Q302 HydrophobicContact CE1-CB 3.9Å; F300-Q302 HydrophobicContact CZ-CB 4.37Å; F300-K390 HydrophobicContact CE2-CB 3.92Å; F300-K390 HydrophobicContact CE2-CD 4.43Å; F300-K390 HydrophobicContact CE2-CG 4.27Å; F300-K390 HydrophobicContact CZ-CB 3.95Å; F300-K390 HydrophobicContact CZ-CD 3.91Å; F300-K390 HydrophobicContact CZ-CG 3.78Å; F300-R391 WeakPolarHBondContact CA-O 3.46Å
301	L	92.9	Very high	87.4	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	121.9	176.4	167.2	59.8	0	0	0	108	L278 V279 R391 I393 I417	L278-L301 HydrophobicContact CD2-CD1 4.39Å; V279-L301 WeakPolarHBondContact O-CA 3.29Å; V279-L301 WeakPolarHBondContact O-CD1 3.32Å; L301-R391 HydrophobicContact CB-CB 4.36Å; L301-R391 PolarHBondContact N-O 2.89Å; L301-R391 PolarHBondContact O-N 2.68Å; L301-I393 HydrophobicContact CB-CD1 4.28Å; L301-I393 HydrophobicContact CD2-CD1 4.14Å; L301-I417 HydrophobicContact CD1-CD1 3.56Å; L301-I417 HydrophobicContact CD2-CD1 3.63Å; L301-I417 HydrophobicContact CD2-CG1 4.12Å; L301-I417 HydrophobicContact CD2-CG2 4.47Å; L301-I417 HydrophobicContact CG-CD1 4.17Å
302	Q	91.9	Very high	86.1	Confident	18 Å²	18	38.4 Å²	38.4	8%	0.084	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130.2	170.9	179	167.2	-40.9	0	0	108.9	L278 V279 F300 V388 E389 K390	L278-Q302 WeakPolarHBondContact CA-O 3.25Å; V279-Q302 HydrophobicContact CB-CB 4.26Å; V279-Q302 PolarHBondContact N-O 3.24Å; V279-Q302 PolarHBondContact O-N 3.17Å; F300-Q302 HydrophobicContact CE1-CB 3.9Å; F300-Q302 HydrophobicContact CZ-CB 4.37Å; Q302-V388 HydrophobicContact CG-CG1 3.59Å; Q302-E389 WeakPolarHBondContact CA-O 3.39Å; Q302-K390 HydrophobicContact CB-CG 4.4Å; Q302-K390 HydrophobicContact CG-CG 4.05Å; Q302-K390 VanDerWaalsContact OE1-CE 3.24Å
303	A	91.9	Very high	84.5	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	128.1	176.8	0	0	0	0	0	109.4	V276 E277 L278 W305 L359 V388 E389	V276-A303 HydrophobicContact CG1-CB 4.29Å; E277-A303 CarbonylContact O-C 3.57Å; E277-A303 WeakPolarHBondContact O-CA 3.38Å; L278-A303 HydrophobicContact CD2-CB 3.49Å; L278-A303 VanDerWaalsContact CD2-CB 3.49Å; A303-W305 HydrophobicContact CB-CZ3 4.21Å; A303-L359 HydrophobicContact CB-CD1 3.38Å; A303-V388 CarbonylContact O-C 3.56Å; A303-V388 WeakPolarHBondContact O-CA 3.36Å; A303-E389 HydrophobicContact CB-CB 4.47Å; A303-E389 PolarHBondContact N-O 3.12Å; A303-E389 PolarHBondContact O-N 3.37Å
304	R	89.3	Confident	82.6	Confident	17 Å²	17	38.5 Å²	38.5	6%	0.064	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	133.3	-179.6	-178	171.5	75.3	177.7	4.3	110.3	E277 E377 Y386 L387 V388 T433	E277-R304 HydrophobicContact CB-CB 4.4Å; E277-R304 PolarHBondContact N-O 3.36Å; E277-R304 PolarHBondContact O-N 2.94Å; E277-R304 IonicContact OE2-CZ 2.99Å; E277-R304 IonicContact OE2-NE 2.86Å; E277-R304 PolarHBondContact OE2-NE 3.06Å; E277-R304 IonicContact OE2-NH2 3.99Å; E277-R304 PolarHBondContact OE2-NH2 2.89Å; R304-E377 VanDerWaalsContact CD-OE2 3.24Å; R304-E377 WeakPolarHBondContact CD-OE2 3.49Å; R304-E377 IonicContact CZ-OE2 3.64Å; R304-E377 IonicContact NH1-OE2 3Å; R304-E377 PolarHBondContact NH1-OE2 3.32Å; R304-Y386 HydrophobicContact CG-CD1 3.75Å; R304-Y386 HydrophobicContact CG-CG 4.16Å; R304-L387 WeakPolarHBondContact CA-O 3.23Å; R304-V388 HydrophobicContact CB-CG2 4.32Å; R304-V388 HydrophobicContact CG-CG2 3.99Å; R304-T433 PolarHBondContact NH2-OG1 3.08Å
305	W	89.4	Confident	80.7	Confident	5 Å²	5	39.6 Å²	39.6	2%	0.019	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	154.8	171.7	63.1	94.4	0	0	0	110.6	V276 A303 L349 W355 P357 Y386 L387 E389	V276-W305 HydrophobicContact CG1-CE3 4.38Å; V276-W305 HydrophobicContact CG2-CB 4.29Å; A303-W305 HydrophobicContact CB-CZ3 4.21Å; W305-L349 HydrophobicContact CZ2-CD1 4.47Å; W305-W355 AromaticContact CD1-CE3 3.71Å; W305-W355 HydrophobicContact CD2-CZ3 4.45Å; W305-W355 HydrophobicContact CG-CE3 4.23Å; W305-W355 HydrophobicContact CG-CZ3 4.1Å; W305-W355 WeakPolarHBondContact CZ2-O 3.39Å; W305-W355 AromaticContact NE1-CE3 3.7Å; W305-W355 PolarHBondContact NE1-O 3.38Å; W305-P357 HydrophobicContact CD2-CG 4.3Å; W305-P357 HydrophobicContact CE3-CG 3.85Å; W305-P357 HydrophobicContact CH2-CG 3.88Å; W305-P357 VanDerWaalsContact CZ2-CD 3.42Å; W305-P357 HydrophobicContact CZ2-CG 4.33Å; W305-P357 HydrophobicContact CZ3-CG 3.63Å; W305-Y386 CarbonylContact O-C 3.53Å; W305-Y386 WeakPolarHBondContact O-CA 2.95Å; W305-L387 HydrophobicContact CD2-CB 4.5Å; W305-L387 HydrophobicContact CH2-CG 4.38Å; W305-L387 HydrophobicContact CZ2-CB 4.28Å; W305-L387 HydrophobicContact CZ2-CD2 3.58Å; W305-L387 HydrophobicContact CZ2-CG 3.76Å; W305-L387 PolarHBondContact N-O 3.25Å; W305-L387 PolarHBondContact O-N 2.71Å; W305-E389 HydrophobicContact CH2-CB 3.78Å; W305-E389 HydrophobicContact CZ3-CB 3.71Å
306	R	85.1	Confident	78.7	Confident	101 Å²	101	46.2 Å²	46.2	38%	0.381	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	137.6	176.5	-175.2	179.4	175.7	160.4	8.7	110.3	P308 D311 E384 Y386	R306-P308 HydrophobicContact CG-CG 4.35Å; R306-D311 IonicContact CZ-OD2 3.03Å; R306-D311 IonicContact NE-OD2 3.69Å; R306-D311 IonicContact NH2-OD2 2.65Å; R306-D311 PolarHBondContact NH2-OD2 2.9Å; R306-E384 IonicContact CZ-OE1 3.17Å; R306-E384 IonicContact CZ-OE2 2.86Å; R306-E384 IonicContact NE-OE2 3.46Å; R306-E384 IonicContact NH1-OE1 2.76Å; R306-E384 PolarHBondContact NH1-OE1 3Å; R306-E384 IonicContact NH1-OE2 3.76Å; R306-E384 PolarHBondContact NH1-OE2 3.01Å; R306-E384 IonicContact NH2-OE1 3.8Å; R306-E384 PolarHBondContact NH2-OE1 3.42Å; R306-E384 IonicContact NH2-OE2 2.97Å; R306-Y386 HydrophobicContact CB-CD1 4.14Å; R306-Y386 HydrophobicContact CB-CE1 3.87Å
307	E	82.4	Confident	76.5	Confident	12 Å²	12	43.5 Å²	43.5	6%	0.056	22%	0.22	C	C	.	.			trans	-126.6	88	176.1	178.7	48.1	-84.4	0	0	110.7	L309 L310 F354 W355 A385 L387	E307-L309 HydrophobicContact CG-CB 4.46Å; E307-L309 PolarHBondContact O-N 3.45Å; E307-L309 WeakPolarHBondContact OE1-CB 3.48Å; E307-L309 WeakPolarHBondContact OE1-CG 3.29Å; E307-L309 PolarHBondContact OE1-N 2.97Å; E307-L309 VanDerWaalsContact OE1-N 3.15Å; E307-L310 HydrophobicContact CB-CD1 4.16Å; E307-L310 HydrophobicContact CG-CD1 3.99Å; E307-L310 HydrophobicContact CG-CG 4.06Å; E307-L310 PolarHBondContact O-N 2.94Å; E307-F354 HydrophobicContact CG-CD1 4.04Å; E307-W355 PolarHBondContact OE2-N 2.69Å; E307-A385 PolarHBondContact N-O 3.27Å; E307-L387 HydrophobicContact CB-CB 4.3Å
308	P	76.6	Confident	74.3	Confident	76 Å²	76	45.8 Å²	45.8	49%	0.494	24%	0.235	S	C	.	.	H	α-helix	trans	-60.8	-13.4	-174.3	-24.2	34.9	0	0	0	115.5	R306 L310	R306-P308 HydrophobicContact CG-CG 4.35Å; P308-L310 PolarHBondContact O-N 2.9Å
309	L	72.4	Confident	71.9	Confident	116 Å²	116	50.4 Å²	50.4	61%	0.607	26%	0.26	S	S	*	.	H	α-helix	trans	-66.4	-27.7	172.8	-64.5	175.2	0	0	0	112.3	E307	E307-L309 HydrophobicContact CG-CB 4.46Å; E307-L309 PolarHBondContact O-N 3.45Å; E307-L309 WeakPolarHBondContact OE1-CB 3.48Å; E307-L309 WeakPolarHBondContact OE1-CG 3.29Å; E307-L309 PolarHBondContact OE1-N 2.97Å; E307-L309 VanDerWaalsContact OE1-N 3.15Å
310	L	70.6	Confident	69.5	Low	1 Å²	1	56.9 Å²	56.9	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-82	-32	179.6	-65.8	171.8	0	0	0	112.5	E307 P308 A312 M313 F354 V376 A385 W648	E307-L310 HydrophobicContact CB-CD1 4.16Å; E307-L310 HydrophobicContact CG-CD1 3.99Å; E307-L310 HydrophobicContact CG-CG 4.06Å; E307-L310 PolarHBondContact O-N 2.94Å; P308-L310 PolarHBondContact O-N 2.9Å; L310-A312 PolarHBondContact O-N 2.85Å; L310-A312 VanDerWaalsContact O-N 3.1Å; L310-M313 HydrophobicContact CD2-SD 4.27Å; L310-M313 PolarHBondContact O-N 2.81Å; L310-F354 HydrophobicContact CD2-CE1 3.89Å; L310-F354 HydrophobicContact CD2-CZ 4.27Å; L310-F354 HydrophobicContact CG-CE1 4.19Å; L310-V376 HydrophobicContact CD1-CG1 4.19Å; L310-V376 HydrophobicContact CD1-CG2 4.28Å; L310-A385 HydrophobicContact CB-CB 3.43Å; L310-A385 VanDerWaalsContact CB-CB 3.43Å; L310-A385 HydrophobicContact CD1-CB 4.42Å; L310-W648 HydrophobicContact CD2-CH2 3.57Å; L310-W648 HydrophobicContact CD2-CZ3 3.66Å
311	D	70	Confident	67.1	Low	28 Å²	28	57.7 Å²	57.7	15%	0.15	30%	0.3	C	S	.	.	H	α-helix	trans	-49.2	-38.1	172.2	-61.5	2	0	0	0	111.2	R306 M313 N315 A385	R306-D311 IonicContact CZ-OD2 3.03Å; R306-D311 IonicContact NE-OD2 3.69Å; R306-D311 IonicContact NH2-OD2 2.65Å; R306-D311 PolarHBondContact NH2-OD2 2.9Å; D311-M313 VanDerWaalsContact C-N 3.35Å; D311-M313 PolarHBondContact O-N 3.4Å; D311-N315 PolarHBondContact O-ND2 2.88Å; D311-A385 VanDerWaalsContact OD1-CB 3.32Å; D311-A385 WeakPolarHBondContact OD1-CB 2.78Å; D311-A385 PolarHBondContact OD1-N 3.17Å
312	A	61.8	Low	64.7	Low	46 Å²	46	66.8 Å²	66.8	38%	0.38	34%	0.339	S	S	.	.	H	α-helix	trans	-77.4	-12.3	-178.8	0	0	0	0	0	114.8	L310 K316	L310-A312 PolarHBondContact O-N 2.85Å; L310-A312 VanDerWaalsContact O-N 3.1Å; A312-K316 VanDerWaalsContact O-CD 3.3Å; A312-K316 WeakPolarHBondContact O-CD 3.46Å; A312-K316 VanDerWaalsContact O-CG 3.3Å; A312-K316 WeakPolarHBondContact O-CG 3.31Å
313	M	57.8	Low	62.3	Low	79 Å²	79	69.8 Å²	69.8	39%	0.389	36%	0.362	S	S	.	.	H	α-helix	trans	-88.1	-41.9	177.8	-69.4	-175.1	61.3	0	0	111.6	L310 D311 N315 K316 S317 W648	L310-M313 HydrophobicContact CD2-SD 4.27Å; L310-M313 PolarHBondContact O-N 2.81Å; D311-M313 VanDerWaalsContact C-N 3.35Å; D311-M313 PolarHBondContact O-N 3.4Å; M313-N315 VanDerWaalsContact C-N 3.34Å; M313-N315 PolarHBondContact O-N 3.26Å; M313-K316 PolarHBondContact O-N 2.8Å; M313-S317 PolarHBondContact O-N 2.81Å; M313-S317 VanDerWaalsContact O-N 3.14Å; M313-W648 HydrophobicContact CB-CH2 3.74Å; M313-W648 HydrophobicContact CB-CZ2 4.07Å; M313-W648 HydrophobicContact CE-CH2 3.5Å; M313-W648 HydrophobicContact CE-CZ2 4.48Å; M313-W648 HydrophobicContact CE-CZ3 3.71Å; M313-W648 HydrophobicContact CG-CH2 4.25Å; M313-W648 HydrophobicContact SD-CH2 3.63Å; M313-W648 HydrophobicContact SD-CZ3 4.04Å
314	W	54.1	Low	59.5	Low	69 Å²	69	74.3 Å²	74.3	26%	0.261	39%	0.394	S	S	.	.	H	α-helix	trans	-60	-42.6	174.1	-173.8	-115.3	0	0	0	112.3	K316 S317 S318 F378 F383	W314-K316 PolarHBondContact O-N 2.83Å; W314-S317 PolarHBondContact O-N 3.07Å; W314-S317 PolarHBondContact O-OG 2.88Å; W314-S318 PolarHBondContact O-N 2.74Å; W314-S318 VanDerWaalsContact O-N 3.12Å; W314-S318 PolarHBondContact O-OG 2.72Å; W314-F378 HydrophobicContact CB-CE1 4.45Å; W314-F383 HydrophobicContact CZ2-CD1 4.42Å; W314-F383 HydrophobicContact CZ2-CE1 4.29Å; W314-F383 AromaticContact NE1-CD1 3.4Å; W314-F383 AromaticContact NE1-CE1 3.91Å; W314-F383 AromaticContact NE1-CG 3.73Å
315	N	52.3	Low	56.7	Low	89 Å²	89	84.5 Å²	84.5	48%	0.476	43%	0.433	S	S	.	.	H	α-helix	trans	-65.6	-22.4	175	-76.9	-70	0	0	0	113.6	D311 M313 S318 L319	D311-N315 PolarHBondContact O-ND2 2.88Å; M313-N315 VanDerWaalsContact C-N 3.34Å; M313-N315 PolarHBondContact O-N 3.26Å; N315-S318 PolarHBondContact O-OG 3.1Å; N315-L319 WeakPolarHBondContact O-CD1 3.17Å; N315-L319 PolarHBondContact O-N 2.99Å
316	K	51.4	Low	54.2	Low	140 Å²	140	92.7 Å²	92.7	61%	0.609	47%	0.471	S	S	*	.	H	α-helix	trans	-85.3	-30.8	176.8	-76	171.7	-172.9	165.5	0	113.2	A312 M313 W314 K320	A312-K316 VanDerWaalsContact O-CD 3.3Å; A312-K316 WeakPolarHBondContact O-CD 3.46Å; A312-K316 VanDerWaalsContact O-CG 3.3Å; A312-K316 WeakPolarHBondContact O-CG 3.31Å; M313-K316 PolarHBondContact O-N 2.8Å; W314-K316 PolarHBondContact O-N 2.83Å; K316-K320 WeakPolarHBondContact O-CB 3.4Å; K316-K320 WeakPolarHBondContact O-CG 3.39Å; K316-K320 PolarHBondContact O-N 2.65Å
317	S	47.6	Very low	51.8	Low	37 Å²	37	94.2 Å²	94.2	26%	0.259	49%	0.492	S	S	.	.	H	α-helix	trans	-70.5	-44.1	171.2	49.6	0	0	0	0	111	M313 W314 L319 K320 S321	M313-S317 PolarHBondContact O-N 2.81Å; M313-S317 VanDerWaalsContact O-N 3.14Å; W314-S317 PolarHBondContact O-N 3.07Å; W314-S317 PolarHBondContact O-OG 2.88Å; S317-L319 PolarHBondContact O-N 2.85Å; S317-K320 PolarHBondContact O-N 2.82Å; S317-S321 PolarHBondContact O-N 2.99Å
318	S	45.5	Very low	49.6	Very low	50 Å²	50	99.5 Å²	99.5	35%	0.35	52%	0.521	S	S	.	.	H	α-helix	trans	-63.9	-39.3	179.7	70.7	0	0	0	0	113.3	W314 N315 K322	W314-S318 PolarHBondContact O-N 2.74Å; W314-S318 VanDerWaalsContact O-N 3.12Å; W314-S318 PolarHBondContact O-OG 2.72Å; N315-S318 PolarHBondContact O-OG 3.1Å; S318-K322 PolarHBondContact O-N 3.09Å
319	L	40.7	Very low	47.7	Very low	118 Å²	118	102.3 Å²	102.3	62%	0.618	54%	0.539	S	S	*	.	H	α-helix	trans	-69.6	-39.7	172.5	-93.2	96	0	0	0	113.1	N315 S317 S321 K322 S323	N315-L319 WeakPolarHBondContact O-CD1 3.17Å; N315-L319 PolarHBondContact O-N 2.99Å; S317-L319 PolarHBondContact O-N 2.85Å; L319-S321 VanDerWaalsContact C-N 3.32Å; L319-S321 PolarHBondContact O-N 3.27Å; L319-K322 PolarHBondContact O-N 3.43Å; L319-S323 PolarHBondContact O-N 3.41Å; L319-S323 PolarHBondContact O-OG 2.69Å
320	K	42.3	Very low	46.1	Very low	137 Å²	137	101.3 Å²	101.3	60%	0.596	54%	0.541	S	S	*	.	H	α-helix	trans	-64.2	-35.9	177.6	-82.1	-177	173.6	-174	0	112.6	K316 S317 S323	K316-K320 WeakPolarHBondContact O-CB 3.4Å; K316-K320 WeakPolarHBondContact O-CG 3.39Å; K316-K320 PolarHBondContact O-N 2.65Å; S317-K320 PolarHBondContact O-N 2.82Å; K320-S323 PolarHBondContact O-N 3.07Å; K320-S323 PolarHBondContact O-OG 3.24Å
321	S	43.3	Very low	44.8	Very low	71 Å²	71	108.1 Å²	108.1	50%	0.497	58%	0.576	S	S	.	*	H	α-helix	trans	-59.4	-44.5	172	174.4	0	0	0	0	111.6	S317 L319	S317-S321 PolarHBondContact O-N 2.99Å; L319-S321 VanDerWaalsContact C-N 3.32Å; L319-S321 PolarHBondContact O-N 3.27Å
322	K	41.9	Very low	43.3	Very low	192 Å²	192	115.4 Å²	115.4	84%	0.835	61%	0.609	S	S	*	*	H	α-helix	trans	-78.8	-15.8	-179.1	-74.6	-179.9	175.5	174	0	115.1	S318 L319	S318-K322 PolarHBondContact O-N 3.09Å; L319-K322 PolarHBondContact O-N 3.43Å
323	S	41.9	Very low	42.2	Very low	81 Å²	81	117.3 Å²	117.3	57%	0.566	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	23.6	179.3	77.2	0	0	0	0	114.3	L319 K320 W325	L319-S323 PolarHBondContact O-N 3.41Å; L319-S323 PolarHBondContact O-OG 2.69Å; K320-S323 PolarHBondContact O-N 3.07Å; K320-S323 PolarHBondContact O-OG 3.24Å; S323-W325 PolarHBondContact O-N 3.42Å
324	S	32.6	Very low	41.3	Very low	95 Å²	95	119.2 Å²	119.2	66%	0.664	63%	0.631	S	S	*	*			trans	-77	34.1	-172.4	-153.9	0	0	0	0	115.2
325	W	31	Very low	40.7	Very low	232 Å²	232	122.9 Å²	122.9	88%	0.879	65%	0.65	S	S	*	*	S	Bend	trans	-142.9	128.2	166.9	-70.8	98.1	0	0	0	110.4	S323	S323-W325 PolarHBondContact O-N 3.42Å
326	Q	36.2	Very low	40.1	Very low	176 Å²	176	123.4 Å²	123.4	82%	0.822	66%	0.656	S	S	*	*	S	Bend	trans	75.8	111.5	171.2	-52.6	-180	-0.2	0	0	118.5
327	T	34.8	Very low	39.4	Very low	133 Å²	133	123.7 Å²	123.7	82%	0.816	66%	0.664	S	S	*	*			trans	59.1	132.8	153.2	61.2	0	0	0	0	118.5
328	N	37.8	Very low	39.1	Very low	124 Å²	124	126.4 Å²	126.4	66%	0.663	68%	0.675	S	S	*	*			cis	-160	141.5	24.1	-133	-5.6	0	0	0	110.3	S330	N328-S330 PolarHBondContact O-N 2.82Å; N328-S330 VanDerWaalsContact O-N 3.13Å
329	P	36.1	Very low	38.7	Very low	135 Å²	135	129 Å²	129	88%	0.877	69%	0.689	S	S	*	*			trans	-89.4	67.6	-174.8	36.4	-35.7	0	0	0	113
330	S	37.8	Very low	38.4	Very low	94 Å²	94	127.6 Å²	127.6	66%	0.657	69%	0.689	S	S	*	*			trans	-151.6	20.2	-178.1	58.9	0	0	0	0	116.2	N328	N328-S330 PolarHBondContact O-N 2.82Å; N328-S330 VanDerWaalsContact O-N 3.13Å
331	I	44.6	Very low	38	Very low	144 Å²	144	129.8 Å²	129.8	74%	0.738	70%	0.699	S	S	*	*			trans	-102.5	111.6	170	-62.1	172.6	0	0	0	108.5	N333	I331-N333 PolarHBondContact O-N 3.16Å
332	E	36.8	Very low	37.5	Very low	181 Å²	181	131.1 Å²	131.1	85%	0.846	69%	0.693	S	S	*	*			trans	-62.3	118.3	172	-63.4	179.4	145.5	0	0	109.2	P334	E332-P334 VanDerWaalsContact O-CD 3.29Å; E332-P334 WeakPolarHBondContact O-CD 3.45Å
333	N	39.2	Very low	36.8	Very low	87 Å²	87	131.1 Å²	131.1	47%	0.465	70%	0.696	S	S	.	*			trans	-78.6	117.5	177	-67.2	-81.3	0	0	0	108.5	I331 F335 T336	I331-N333 PolarHBondContact O-N 3.16Å; N333-F335 PolarHBondContact O-N 2.99Å; N333-T336 PolarHBondContact O-OG1 3.26Å
334	P	40.1	Very low	36.3	Very low	118 Å²	118	133.6 Å²	133.6	77%	0.766	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	14.7	-172.6	-22.3	35.6	0	0	0	116.4	E332	E332-P334 VanDerWaalsContact O-CD 3.29Å; E332-P334 WeakPolarHBondContact O-CD 3.45Å
335	F	40.3	Very low	36.1	Very low	147 Å²	147	136.1 Å²	136.1	65%	0.645	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128	-5.4	-170.1	-79.9	-94.2	0	0	0	114.5	N333 D337 L338	N333-F335 PolarHBondContact O-N 2.99Å; F335-D337 PolarHBondContact O-N 3.5Å; F335-L338 HydrophobicContact CD1-CD1 3.47Å; F335-L338 VanDerWaalsContact CD1-CD1 3.47Å; F335-L338 HydrophobicContact CE1-CD1 3.8Å; F335-L338 HydrophobicContact CG-CD1 4.33Å; F335-L338 PolarHBondContact O-N 2.96Å; F335-L338 VanDerWaalsContact O-N 3.17Å
336	T	40.5	Very low	36.3	Very low	99 Å²	99	130.2 Å²	130.2	61%	0.607	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-13.7	178.9	36.1	0	0	0	0	114.7	N333 T339	N333-T336 PolarHBondContact O-OG1 3.26Å; T336-T339 PolarHBondContact O-OG1 3.02Å
337	D	35.7	Very low	36.5	Very low	146 Å²	146	125.4 Å²	125.4	78%	0.781	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-25.9	172	-85.3	-17.5	0	0	0	113.1	F335 S340	F335-D337 PolarHBondContact O-N 3.5Å; D337-S340 PolarHBondContact O-OG 3.28Å
338	L	41.6	Very low	37	Very low	95 Å²	95	126.7 Å²	126.7	50%	0.497	67%	0.672	S	S	.	*	G	3₁₀ helix	trans	-76.3	-25.8	-177.2	-77.8	155.5	0	0	0	112.8	F335 S340	F335-L338 HydrophobicContact CD1-CD1 3.47Å; F335-L338 VanDerWaalsContact CD1-CD1 3.47Å; F335-L338 HydrophobicContact CE1-CD1 3.8Å; F335-L338 HydrophobicContact CG-CD1 4.33Å; F335-L338 PolarHBondContact O-N 2.96Å; F335-L338 VanDerWaalsContact O-N 3.17Å; L338-S340 PolarHBondContact O-N 3.32Å; L338-S340 VanDerWaalsContact O-N 3.09Å
339	T	38.4	Very low	37.8	Very low	104 Å²	104	121.8 Å²	121.8	64%	0.638	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-72.1	2	-179.2	43.5	0	0	0	0	114.8	T336	T336-T339 PolarHBondContact O-OG1 3.02Å
340	S	34.6	Very low	38.4	Very low	89 Å²	89	121.5 Å²	121.5	62%	0.622	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-96	-1.9	-174.2	65.3	0	0	0	0	115.7	D337 L338	D337-S340 PolarHBondContact O-OG 3.28Å; L338-S340 PolarHBondContact O-N 3.32Å; L338-S340 VanDerWaalsContact O-N 3.09Å
341	K	33.1	Very low	39.1	Very low	182 Å²	182	120.6 Å²	120.6	79%	0.791	62%	0.62	S	S	*	*			trans	-138.2	62.6	-171	-67.7	180	-176.7	165.6	0	114.9
342	R	33.1	Very low	39.7	Very low	100 Å²	100	120.6 Å²	120.6	38%	0.377	62%	0.621	S	S	.	*			trans	-129.2	90.1	170.4	-74.4	-174.3	-177.5	141.2	3.1	113.8	L649 N650	R342-L649 PolarHBondContact NH1-O 3.02Å; R342-N650 WeakPolarHBondContact CD-OD1 3.48Å; R342-N650 PolarHBondContact NH1-OD1 2.78Å
343	Q	27.4	Very low	41.1	Very low	191 Å²	191	117.1 Å²	117.1	89%	0.893	61%	0.605	S	S	*	*			trans	-138.7	83.7	148.5	-83.2	-162.1	-23.2	0	0	107.8
344	L	30.7	Very low	42.6	Very low	134 Å²	134	114.8 Å²	114.8	70%	0.702	59%	0.591	S	S	*	*			trans	-154.1	104.9	170.5	-150.3	82.8	0	0	0	110.3
345	N	28.2	Very low	44.5	Very low	147 Å²	147	112.8 Å²	112.8	79%	0.786	57%	0.568	S	S	*	*	S	Bend	trans	-59	141.5	166.8	-57.6	6.5	0	0	0	108.3
346	T	36.4	Very low	46.5	Very low	109 Å²	109	106.8 Å²	106.8	67%	0.669	54%	0.543	S	S	*	.			trans	71.2	64.2	-172.3	69.3	0	0	0	0	115.3	K348	T346-K348 VanDerWaalsContact C-N 3.28Å; T346-K348 PolarHBondContact O-N 3.17Å
347	L	39.2	Very low	48.5	Very low	74 Å²	74	102 Å²	102	39%	0.387	51%	0.514	S	S	.	.			trans	-63.3	91.5	153.3	-87.3	166.9	0	0	0	110	L349 H374	L347-L349 PolarHBondContact O-N 3.07Å; L347-H374 PolarHBondContact O-ND1 2.96Å
348	K	46.2	Very low	50.8	Low	161 Å²	161	99.2 Å²	99.2	70%	0.7	49%	0.492	S	S	*	.			trans	-60.5	129.7	151.5	-70.1	-178.9	176.5	-178.9	0	107	T346 Q350	T346-K348 VanDerWaalsContact C-N 3.28Å; T346-K348 PolarHBondContact O-N 3.17Å; K348-Q350 PolarHBondContact O-N 2.88Å
349	L	53.1	Low	53	Low	20 Å²	20	95 Å²	95	11%	0.105	47%	0.47	C	S	.	.			trans	-54.5	108.4	161.5	-68.4	171.1	0	0	0	107.2	W305 L347 F354 H374 L387 L645	W305-L349 HydrophobicContact CZ2-CD1 4.47Å; L347-L349 PolarHBondContact O-N 3.07Å; L349-F354 HydrophobicContact CD2-CB 4.36Å; L349-F354 HydrophobicContact CD2-CD2 3.92Å; L349-F354 HydrophobicContact CD2-CG 4.5Å; L349-H374 VanDerWaalsContact CD1-CD2 3.47Å; L349-H374 WeakPolarHBondContact CD1-CD2 3.36Å; L349-L387 HydrophobicContact CD1-CD2 3.95Å; L349-L645 HydrophobicContact CD2-CD2 4.2Å
350	Q	48.8	Very low	55.5	Low	130 Å²	130	94.3 Å²	94.3	61%	0.607	46%	0.462	S	S	*	.			trans	-69.1	138.6	166.5	-69.4	-171.1	-123.9	0	0	106.8	K348 D352 E353	K348-Q350 PolarHBondContact O-N 2.88Å; Q350-D352 PolarHBondContact O-N 3.36Å; Q350-E353 PolarHBondContact O-N 3.05Å; Q350-E353 VanDerWaalsContact O-N 3.14Å
351	D	54.2	Low	58.2	Low	75 Å²	75	91.5 Å²	91.5	40%	0.401	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-11	-177.4	-62.5	-78.3	0	0	0	113.2	R358	D351-R358 IonicContact OD1-CZ 3.02Å; D351-R358 VanDerWaalsContact OD1-CZ 3.3Å; D351-R358 IonicContact OD1-NE 2.69Å; D351-R358 PolarHBondContact OD1-NE 3.14Å; D351-R358 IonicContact OD1-NH2 3.18Å; D351-R358 PolarHBondContact OD1-NH2 2.92Å; D351-R358 IonicContact OD2-CZ 2.74Å; D351-R358 IonicContact OD2-NE 2.65Å; D351-R358 IonicContact OD2-NH2 2.72Å; D351-R358 PolarHBondContact OD2-NH2 2.97Å
352	D	56.4	Low	60.8	Low	143 Å²	143	86.8 Å²	86.8	77%	0.765	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-18.4	-176.5	-47.2	-58.8	0	0	0	114.3	Q350	Q350-D352 PolarHBondContact O-N 3.36Å
353	E	66.2	Low	63.7	Low	109 Å²	109	83 Å²	83	51%	0.509	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-40.4	-177	-69.3	-168.7	167.1	0	0	114.3	Q350	Q350-E353 PolarHBondContact O-N 3.05Å; Q350-E353 VanDerWaalsContact O-N 3.14Å
354	F	71.1	Confident	66.8	Low	38 Å²	38	75.1 Å²	75.1	17%	0.167	38%	0.378	C	S	.	.	S	Bend	trans	-144.5	158	-176.4	-66.5	-81.7	0	0	0	112	E307 L310 L349 N356 L387	E307-F354 HydrophobicContact CG-CD1 4.04Å; L310-F354 HydrophobicContact CD2-CE1 3.89Å; L310-F354 HydrophobicContact CD2-CZ 4.27Å; L310-F354 HydrophobicContact CG-CE1 4.19Å; L349-F354 HydrophobicContact CD2-CB 4.36Å; L349-F354 HydrophobicContact CD2-CD2 3.92Å; L349-F354 HydrophobicContact CD2-CG 4.5Å; F354-N356 PolarHBondContact O-N 3.31Å; F354-N356 VanDerWaalsContact O-N 3.17Å; F354-L387 HydrophobicContact CB-CD2 4.35Å
355	W	78.6	Confident	69.5	Low	75 Å²	75	73.7 Å²	73.7	28%	0.284	37%	0.368	S	S	.	.			trans	-70	112.1	176.8	-171	99.1	0	0	0	110.6	A274 V276 W305 E307 P357 V426	A274-W355 HydrophobicContact CB-CH2 3.39Å; A274-W355 HydrophobicContact CB-CZ2 3.31Å; A274-W355 HydrophobicContact CB-CZ3 4.22Å; V276-W355 HydrophobicContact CG2-CH2 3.97Å; V276-W355 HydrophobicContact CG2-CZ3 4.01Å; W305-W355 AromaticContact CD1-CE3 3.71Å; W305-W355 HydrophobicContact CD2-CZ3 4.45Å; W305-W355 HydrophobicContact CG-CE3 4.23Å; W305-W355 HydrophobicContact CG-CZ3 4.1Å; W305-W355 WeakPolarHBondContact CZ2-O 3.39Å; W305-W355 AromaticContact NE1-CE3 3.7Å; W305-W355 PolarHBondContact NE1-O 3.38Å; E307-W355 PolarHBondContact OE2-N 2.69Å; W355-P357 HydrophobicContact CH2-CB 3.93Å; W355-P357 HydrophobicContact CZ3-CB 3.67Å; W355-P357 HydrophobicContact CZ3-CG 4.24Å; W355-V426 HydrophobicContact CH2-CG2 3.77Å; W355-V426 HydrophobicContact CZ2-CG2 3.71Å
356	N	82.7	Confident	72.4	Confident	21 Å²	21	69.6 Å²	69.6	11%	0.112	36%	0.36	C	S	.	.			trans	-104.4	127.7	174.6	-177.6	-53.1	0	0	0	110.1	F354 R358 R421	F354-N356 PolarHBondContact O-N 3.31Å; F354-N356 VanDerWaalsContact O-N 3.17Å; N356-R358 VanDerWaalsContact C-N 3.27Å; N356-R358 PolarHBondContact O-N 3.17Å; N356-R358 WeakPolarHBondContact OD1-CA 3.44Å; N356-R358 PolarHBondContact OD1-N 2.83Å; N356-R421 PolarHBondContact O-NH1 3.19Å; N356-R421 PolarHBondContact O-NH2 3.44Å
357	P	82.6	Confident	74.8	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.362	C	S	.	.			trans	-68.6	-15.8	-178.2	26.2	-34.2	0	0	0	115.3	V276 W305 W355 L359 C419	V276-P357 HydrophobicContact CG1-CG 4.46Å; V276-P357 HydrophobicContact CG2-CB 3.94Å; W305-P357 HydrophobicContact CD2-CG 4.3Å; W305-P357 HydrophobicContact CE3-CG 3.85Å; W305-P357 HydrophobicContact CH2-CG 3.88Å; W305-P357 VanDerWaalsContact CZ2-CD 3.42Å; W305-P357 HydrophobicContact CZ2-CG 4.33Å; W305-P357 HydrophobicContact CZ3-CG 3.63Å; W355-P357 HydrophobicContact CH2-CB 3.93Å; W355-P357 HydrophobicContact CZ3-CB 3.67Å; W355-P357 HydrophobicContact CZ3-CG 4.24Å; P357-L359 HydrophobicContact CB-CG 4.35Å; P357-L359 HydrophobicContact CG-CD1 4.34Å; P357-L359 HydrophobicContact CG-CG 4.15Å; P357-C419 WeakPolarHBondContact O-CB 3.38Å
358	R	84.4	Confident	77.1	Confident	87 Å²	87	69.7 Å²	69.7	33%	0.328	35%	0.354	S	S	.	.			trans	53.3	63.2	-176.8	-64.3	-178.5	175.6	173.8	1.9	113	D351 N356 C419 D420	D351-R358 IonicContact OD1-CZ 3.02Å; D351-R358 VanDerWaalsContact OD1-CZ 3.3Å; D351-R358 IonicContact OD1-NE 2.69Å; D351-R358 PolarHBondContact OD1-NE 3.14Å; D351-R358 IonicContact OD1-NH2 3.18Å; D351-R358 PolarHBondContact OD1-NH2 2.92Å; D351-R358 IonicContact OD2-CZ 2.74Å; D351-R358 IonicContact OD2-NE 2.65Å; D351-R358 IonicContact OD2-NH2 2.72Å; D351-R358 PolarHBondContact OD2-NH2 2.97Å; N356-R358 VanDerWaalsContact C-N 3.27Å; N356-R358 PolarHBondContact O-N 3.17Å; N356-R358 WeakPolarHBondContact OD1-CA 3.44Å; N356-R358 PolarHBondContact OD1-N 2.83Å; R358-C419 WeakPolarHBondContact O-CA 3.41Å; R358-D420 HydrophobicContact CB-CB 3.84Å; R358-D420 WeakPolarHBondContact CD-OD2 3.45Å; R358-D420 IonicContact CZ-OD2 2.86Å; R358-D420 IonicContact NH1-OD2 2.95Å; R358-D420 PolarHBondContact NH1-OD2 2.91Å; R358-D420 PolarHBondContact O-N 2.78Å
359	L	88.6	Confident	79.1	Confident	5 Å²	5	67.6 Å²	67.6	3%	0.026	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	134.3	177.9	-64.7	168.2	0	0	0	111.4	L278 A303 P357 R391 I417 T418 C419 L428	L278-L359 HydrophobicContact CD1-CD2 4.46Å; L278-L359 HydrophobicContact CD2-CD1 3.71Å; L278-L359 HydrophobicContact CD2-CD2 4.28Å; A303-L359 HydrophobicContact CB-CD1 3.38Å; P357-L359 HydrophobicContact CB-CG 4.35Å; P357-L359 HydrophobicContact CG-CD1 4.34Å; P357-L359 HydrophobicContact CG-CG 4.15Å; L359-R391 PolarHBondContact O-NH1 3.48Å; L359-R391 PolarHBondContact O-NH2 2.9Å; L359-I417 HydrophobicContact CB-CG2 4.43Å; L359-I417 HydrophobicContact CD2-CG2 4.02Å; L359-T418 CarbonylContact C-O 3.55Å; L359-T418 VanDerWaalsContact CA-O 3.31Å; L359-T418 WeakPolarHBondContact CA-O 3.33Å; L359-C419 HydrophobicContact CD2-CB 4.39Å; L359-L428 HydrophobicContact CD2-CD1 4.37Å; L359-L428 HydrophobicContact CD2-CD2 3.82Å
360	L	89.9	Confident	80.8	Confident	90 Å²	90	70.1 Å²	70.1	47%	0.471	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	162.9	-179.4	-60.8	172.5	0	0	0	109.7	I417 T418	L360-I417 CarbonylContact O-C 3.55Å; L360-I417 WeakPolarHBondContact O-CA 3.36Å; L360-T418 PolarHBondContact N-O 3.1Å; L360-T418 PolarHBondContact O-N 3.32Å
361	I	91.9	Very high	82.7	Confident	30 Å²	30	69.4 Å²	69.4	15%	0.154	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	123.5	170.7	-59	172.2	0	0	0	108.1	A364 I393 F397 V415 T416 I417	I361-A364 HydrophobicContact CB-CB 4.4Å; I361-A364 HydrophobicContact CG2-CB 4.01Å; I361-I393 HydrophobicContact CD1-CD1 3.72Å; I361-I393 HydrophobicContact CD1-CG2 3.88Å; I361-F397 HydrophobicContact CD1-CE1 4.4Å; I361-F397 HydrophobicContact CG2-CD1 4.41Å; I361-F397 HydrophobicContact CG2-CE1 4.17Å; I361-V415 HydrophobicContact CG2-CG1 4.38Å; I361-T416 WeakPolarHBondContact CA-O 3.45Å; I361-I417 HydrophobicContact CG1-CG1 4.27Å
362	D	88.3	Confident	84.3	Confident	83 Å²	83	68.4 Å²	68.4	44%	0.444	35%	0.354	S	S	.	.	S	Bend	trans	-86.1	-29	-175.7	-171.3	48.4	0	0	0	113.1	R79 T416 T418	R79-D362 IonicContact NH2-OD1 2.88Å; D362-T416 HydrophobicContact CB-CG2 4.21Å; D362-T416 PolarHBondContact N-O 2.86Å; D362-T418 HydrophobicContact CB-CG2 4.12Å
363	N	92.6	Very high	85.6	Confident	22 Å²	22	64.5 Å²	64.5	12%	0.118	34%	0.338	C	S	.	.	S	Bend	trans	-98.5	15.9	-176.5	79.3	-50.9	0	0	0	115.4	F397 H398 S414 T416	N363-F397 CarbonylContact O-C 3.57Å; N363-F397 WeakPolarHBondContact O-CA 3.34Å; N363-H398 PolarHBondContact ND2-O 2.81Å; N363-H398 VanDerWaalsContact ND2-O 3.12Å; N363-H398 PolarHBondContact O-N 2.86Å; N363-S414 PolarHBondContact ND2-O 2.86Å; N363-T416 PolarHBondContact OD1-N 2.88Å
364	A	92	Very high	86.4	Confident	24 Å²	24	60.3 Å²	60.3	20%	0.198	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-77.8	129.4	173.9	0	0	0	0	0	111.9	I361 G366 P368 F397	I361-A364 HydrophobicContact CB-CB 4.4Å; I361-A364 HydrophobicContact CG2-CB 4.01Å; A364-G366 PolarHBondContact O-N 3.14Å; A364-P368 HydrophobicContact CB-CG 4.42Å; A364-F397 HydrophobicContact CB-CD1 4.3Å; A364-F397 HydrophobicContact CB-CE1 4.21Å
365	E	89.1	Confident	86.9	Confident	104 Å²	104	60.7 Å²	60.7	49%	0.486	32%	0.32	S	S	.	.	S	Bend	trans	-83	90.5	173.5	-165.4	-167.1	169.8	0	0	110	R294 I396	R294-E365 WeakPolarHBondContact CD-OE2 3.2Å; R294-E365 IonicContact CZ-OE2 3.83Å; R294-E365 IonicContact NE-OE2 3.52Å; R294-E365 IonicContact NH1-OE1 3.14Å; R294-E365 PolarHBondContact NH1-OE1 2.94Å; R294-E365 VanDerWaalsContact NH1-OE1 3.15Å; R294-E365 IonicContact NH1-OE2 3.15Å; R294-E365 PolarHBondContact NH1-OE2 3.31Å; E365-I396 HydrophobicContact CB-CB 4.22Å; E365-I396 HydrophobicContact CB-CG2 4.01Å; E365-I396 PolarHBondContact N-O 2.83Å; E365-I396 WeakPolarHBondContact OE2-CG2 3.24Å
366	G	88.3	Confident	86.9	Confident	61 Å²	61	57.1 Å²	57.1	63%	0.629	31%	0.307	S	S	*	.	S	Bend	trans	104.2	-163	179.1	0	0	0	0	0	113.5	A364 P368	A364-G366 PolarHBondContact O-N 3.14Å; G366-P368 WeakPolarHBondContact O-CD 3.47Å
367	E	85.9	Confident	86.5	Confident	150 Å²	150	56.9 Å²	56.9	70%	0.701	31%	0.305	S	S	*	.			trans	-87.2	113.2	168.6	-65.6	-161.4	124.6	0	0	108.9	R85	R85-E367 IonicContact CZ-OE1 3.61Å; R85-E367 VanDerWaalsContact CZ-OE1 3.3Å; R85-E367 IonicContact NH1-OE1 2.79Å; R85-E367 PolarHBondContact NH1-OE1 3.25Å; R85-E367 IonicContact NH2-OE1 3.59Å; R85-E367 PolarHBondContact NH2-OE1 3.19Å; R85-E367 IonicContact NH2-OE2 3.21Å
368	P	88.4	Confident	86	Confident	35 Å²	35	57.1 Å²	57.1	23%	0.227	31%	0.306	C	S	.	.			trans	-69.8	157.9	177.1	29.8	-34.8	0	0	0	111.4	A364 G366 E370 I393	A364-P368 HydrophobicContact CB-CG 4.42Å; G366-P368 WeakPolarHBondContact O-CD 3.47Å; P368-E370 HydrophobicContact CG-CG 4.13Å; P368-E370 PolarHBondContact O-N 3.14Å; P368-I393 HydrophobicContact CB-CG2 3.99Å; P368-I393 HydrophobicContact CG-CG2 4.35Å
369	I	88.8	Confident	85.3	Confident	118 Å²	118	54.6 Å²	54.6	61%	0.605	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	114.4	173.2	-58.4	174	0	0	0	107.7	I393 K394	I369-I393 WeakPolarHBondContact O-CA 3.5Å; I369-K394 HydrophobicContact CB-CB 4.46Å; I369-K394 PolarHBondContact N-O 3.05Å; I369-K394 PolarHBondContact O-N 2.98Å
370	E	88	Confident	83.9	Confident	72 Å²	72	58 Å²	58	34%	0.336	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.5	-177.1	-58.4	-173.4	168	0	0	111.6	P368 R391 R392 I393	P368-E370 HydrophobicContact CG-CG 4.13Å; P368-E370 PolarHBondContact O-N 3.14Å; E370-R391 IonicContact OE1-NH2 2.91Å; E370-R391 PolarHBondContact OE1-NH2 2.86Å; E370-R391 IonicContact OE2-CZ 3.82Å; E370-R391 IonicContact OE2-NE 3.4Å; E370-R391 IonicContact OE2-NH2 2.89Å; E370-R391 PolarHBondContact OE2-NH2 3.31Å; E370-R392 WeakPolarHBondContact CA-O 3.4Å; E370-I393 HydrophobicContact CG-CG1 4.23Å; E370-I393 HydrophobicContact CG-CG2 4.25Å
371	I	88.7	Confident	82.4	Confident	115 Å²	115	58.4 Å²	58.4	59%	0.59	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	124	170.6	-55.8	174.7	0	0	0	106.5	R391 R392	I371-R391 CarbonylContact O-C 3.43Å; I371-R391 VanDerWaalsContact O-CA 3.31Å; I371-R391 WeakPolarHBondContact O-CA 3.49Å; I371-R392 HydrophobicContact CB-CB 4.46Å; I371-R392 PolarHBondContact N-O 3.15Å; I371-R392 PolarHBondContact O-N 3.27Å
372	I	87.4	Confident	81.1	Confident	54 Å²	54	63 Å²	63	28%	0.277	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	132.4	-172.2	-47.6	-173.6	0	0	0	109.6	E389 K390 R391	I372-E389 HydrophobicContact CG2-CG 3.67Å; I372-K390 WeakPolarHBondContact CA-O 3.18Å; I372-R391 HydrophobicContact CD1-CG 4.36Å; I372-R391 HydrophobicContact CG1-CG 4.05Å; I372-R391 HydrophobicContact CG2-CG 4.09Å
373	S	84	Confident	79.9	Confident	61 Å²	61	62.4 Å²	62.4	43%	0.427	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	155.9	171.6	56.2	0	0	0	0	110.7	K390	S373-K390 PolarHBondContact N-O 3.29Å; S373-K390 PolarHBondContact O-N 3.28Å
374	H	83.8	Confident	79.1	Confident	22 Å²	22	63.6 Å²	63.6	10%	0.102	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.1	-176.5	-51.5	97.6	0	0	0	110.7	L347 L349 V388 L645	L347-H374 PolarHBondContact O-ND1 2.96Å; L349-H374 VanDerWaalsContact CD1-CD2 3.47Å; L349-H374 WeakPolarHBondContact CD1-CD2 3.36Å; H374-V388 WeakPolarHBondContact CA-O 3.16Å; H374-L645 HydrophobicContact CB-CD2 3.83Å; H374-L645 WeakPolarHBondContact O-CB 3.43Å
375	E	80.5	Confident	78.4	Confident	45 Å²	45	62.5 Å²	62.5	21%	0.21	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	161.7	179.4	-69.5	170.8	-135.4	0	0	109.9	V388 K390	E375-V388 HydrophobicContact CB-CB 4.47Å; E375-V388 PolarHBondContact N-O 3.09Å; E375-V388 PolarHBondContact O-N 2.95Å; E375-K390 VanDerWaalsContact OE1-CD 3.24Å; E375-K390 WeakPolarHBondContact OE1-CD 3.22Å; E375-K390 WeakPolarHBondContact OE1-CE 3.47Å; E375-K390 IonicContact OE1-NZ 3.91Å; E375-K390 PolarHBondContact OE1-NZ 3.25Å; E375-K390 IonicContact OE2-NZ 3.34Å; E375-K390 PolarHBondContact OE2-NZ 2.88Å
376	V	78.6	Confident	78.1	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	124.9	174.1	-173.2	0	0	0	0	109.3	L310 F378 Y386 L387 V643 L645	L310-V376 HydrophobicContact CD1-CG1 4.19Å; L310-V376 HydrophobicContact CD1-CG2 4.28Å; V376-F378 HydrophobicContact CB-CE2 4.33Å; V376-F378 HydrophobicContact CG1-CD2 4.2Å; V376-F378 HydrophobicContact CG1-CE1 4.43Å; V376-F378 HydrophobicContact CG1-CE2 3.61Å; V376-F378 HydrophobicContact CG1-CZ 3.74Å; V376-Y386 WeakPolarHBondContact CA-O 3.31Å; V376-L387 HydrophobicContact CG2-CD1 4.37Å; V376-V643 PolarHBondContact N-O 2.76Å; V376-V643 PolarHBondContact O-N 3.36Å; V376-L645 HydrophobicContact CG2-CB 4.38Å; V376-L645 HydrophobicContact CG2-CD1 3.61Å
377	E	75.5	Confident	78	Confident	17 Å²	17	56.8 Å²	56.8	8%	0.079	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	132.1	170.2	-74.5	174.6	-170.6	0	0	109	R304 Y386 V388 I640	R304-E377 VanDerWaalsContact CD-OE2 3.24Å; R304-E377 WeakPolarHBondContact CD-OE2 3.49Å; R304-E377 IonicContact CZ-OE2 3.64Å; R304-E377 IonicContact NH1-OE2 3Å; R304-E377 PolarHBondContact NH1-OE2 3.32Å; E377-Y386 PolarHBondContact N-O 3.49Å; E377-Y386 PolarHBondContact O-N 3.11Å; E377-V388 HydrophobicContact CB-CG2 4.27Å; E377-V388 HydrophobicContact CG-CG2 3.82Å; E377-I640 HydrophobicContact CB-CG2 4.09Å; E377-I640 HydrophobicContact CG-CG2 3.93Å
378	F	70.9	Confident	78	Confident	5 Å²	5	49.7 Å²	49.7	2%	0.022	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	128.9	165.2	-63.1	-88.9	0	0	0	108.5	W314 V376 A385 L641 W648	W314-F378 HydrophobicContact CB-CE1 4.45Å; V376-F378 HydrophobicContact CB-CE2 4.33Å; V376-F378 HydrophobicContact CG1-CD2 4.2Å; V376-F378 HydrophobicContact CG1-CE1 4.43Å; V376-F378 HydrophobicContact CG1-CE2 3.61Å; V376-F378 HydrophobicContact CG1-CZ 3.74Å; F378-A385 HydrophobicContact CD1-CB 4.05Å; F378-A385 HydrophobicContact CE1-CB 3.71Å; F378-A385 HydrophobicContact CZ-CB 4.49Å; F378-L641 PolarHBondContact N-O 3.46Å; F378-L641 PolarHBondContact O-N 2.96Å; F378-L641 VanDerWaalsContact O-N 3.1Å; F378-W648 AromaticContact CE2-NE1 3.84Å; F378-W648 HydrophobicContact CZ-CZ2 4.09Å; F378-W648 AromaticContact CZ-NE1 3.82Å
379	I	69.1	Low	78	Confident	33 Å²	33	48.3 Å²	48.3	17%	0.169	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	124	-176.7	-55.4	-175	0	0	0	109.9	F383 E384 Y386	I379-F383 WeakPolarHBondContact O-CA 3.47Å; I379-F383 PolarHBondContact O-N 3.42Å; I379-E384 PolarHBondContact N-O 2.98Å; I379-Y386 HydrophobicContact CD1-CD2 3.59Å; I379-Y386 HydrophobicContact CD1-CE2 3.58Å; I379-Y386 HydrophobicContact CD1-CG 4.32Å; I379-Y386 HydrophobicContact CG1-CD2 3.88Å; I379-Y386 HydrophobicContact CG1-CE2 4.12Å
380	E	60.2	Low	78	Confident	76 Å²	76	44.4 Å²	44.4	36%	0.355	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	144.3	173.4	-63	-173.4	148.3	0	0	110.7	F383 S639	E380-F383 HydrophobicContact CG-CE1 3.89Å; E380-F383 HydrophobicContact CG-CZ 3.87Å; E380-F383 WeakPolarHBondContact OE1-CZ 3.35Å; E380-S639 VanDerWaalsContact OE2-CB 3.25Å; E380-S639 WeakPolarHBondContact OE2-CB 3.25Å; E380-S639 PolarHBondContact OE2-OG 2.78Å
381	P	57.5	Low	78.2	Confident	99 Å²	99	41.7 Å²	41.7	64%	0.643	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	cis	-94.1	-13.9	12.8	36.8	-37	0	0	0	115.8	F383	P381-F383 VanDerWaalsContact C-N 3.32Å; P381-F383 VanDerWaalsContact O-CD2 3.24Å; P381-F383 WeakPolarHBondContact O-CD2 3.34Å; P381-F383 PolarHBondContact O-N 2.91Å
382	D	64.3	Low	78.4	Confident	128 Å²	128	42.1 Å²	42.1	68%	0.684	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-9.2	-169	-68.4	-42.7	0	0	0	113.9	E384	D382-E384 HydrophobicContact CB-CG 3.76Å; D382-E384 PolarHBondContact O-N 3.44Å
383	F	65	Low	78.6	Confident	70 Å²	70	39.5 Å²	39.5	31%	0.307	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	32.4	-177.4	-68.5	-83.4	0	0	0	114.1	W314 I379 E380 P381	W314-F383 HydrophobicContact CZ2-CD1 4.42Å; W314-F383 HydrophobicContact CZ2-CE1 4.29Å; W314-F383 AromaticContact NE1-CD1 3.4Å; W314-F383 AromaticContact NE1-CE1 3.91Å; W314-F383 AromaticContact NE1-CG 3.73Å; I379-F383 WeakPolarHBondContact O-CA 3.47Å; I379-F383 PolarHBondContact O-N 3.42Å; E380-F383 HydrophobicContact CG-CE1 3.89Å; E380-F383 HydrophobicContact CG-CZ 3.87Å; E380-F383 WeakPolarHBondContact OE1-CZ 3.35Å; P381-F383 VanDerWaalsContact C-N 3.32Å; P381-F383 VanDerWaalsContact O-CD2 3.24Å; P381-F383 WeakPolarHBondContact O-CD2 3.34Å; P381-F383 PolarHBondContact O-N 2.91Å
384	E	74.8	Confident	79.1	Confident	47 Å²	47	41.7 Å²	41.7	22%	0.22	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	132.3	174.6	-47.8	-158.8	141.7	0	0	110.2	R306 I379 D382 Y386	R306-E384 IonicContact CZ-OE1 3.17Å; R306-E384 IonicContact CZ-OE2 2.86Å; R306-E384 IonicContact NE-OE2 3.46Å; R306-E384 IonicContact NH1-OE1 2.76Å; R306-E384 PolarHBondContact NH1-OE1 3Å; R306-E384 IonicContact NH1-OE2 3.76Å; R306-E384 PolarHBondContact NH1-OE2 3.01Å; R306-E384 IonicContact NH2-OE1 3.8Å; R306-E384 PolarHBondContact NH2-OE1 3.42Å; R306-E384 IonicContact NH2-OE2 2.97Å; I379-E384 PolarHBondContact N-O 2.98Å; D382-E384 HydrophobicContact CB-CG 3.76Å; D382-E384 PolarHBondContact O-N 3.44Å; E384-Y386 HydrophobicContact CB-CD2 4.46Å; E384-Y386 HydrophobicContact CB-CE2 3.9Å
385	A	78.5	Confident	79.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	123.4	-178.2	0	0	0	0	0	111.4	E307 L310 D311 F378	E307-A385 PolarHBondContact N-O 3.27Å; L310-A385 HydrophobicContact CB-CB 3.43Å; L310-A385 VanDerWaalsContact CB-CB 3.43Å; L310-A385 HydrophobicContact CD1-CB 4.42Å; D311-A385 VanDerWaalsContact OD1-CB 3.32Å; D311-A385 WeakPolarHBondContact OD1-CB 2.78Å; D311-A385 PolarHBondContact OD1-N 3.17Å; F378-A385 HydrophobicContact CD1-CB 4.05Å; F378-A385 HydrophobicContact CE1-CB 3.71Å; F378-A385 HydrophobicContact CZ-CB 4.49Å
386	Y	82.4	Confident	80.1	Confident	44 Å²	44	42 Å²	42	17%	0.173	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.8	176	-74.4	-92.7	0	0	0	110.4	R304 W305 R306 V376 E377 I379 E384	R304-Y386 HydrophobicContact CG-CD1 3.75Å; R304-Y386 HydrophobicContact CG-CG 4.16Å; W305-Y386 CarbonylContact O-C 3.53Å; W305-Y386 WeakPolarHBondContact O-CA 2.95Å; R306-Y386 HydrophobicContact CB-CD1 4.14Å; R306-Y386 HydrophobicContact CB-CE1 3.87Å; V376-Y386 WeakPolarHBondContact CA-O 3.31Å; E377-Y386 PolarHBondContact N-O 3.49Å; E377-Y386 PolarHBondContact O-N 3.11Å; I379-Y386 HydrophobicContact CD1-CD2 3.59Å; I379-Y386 HydrophobicContact CD1-CE2 3.58Å; I379-Y386 HydrophobicContact CD1-CG 4.32Å; I379-Y386 HydrophobicContact CG1-CD2 3.88Å; I379-Y386 HydrophobicContact CG1-CE2 4.12Å; E384-Y386 HydrophobicContact CB-CD2 4.46Å; E384-Y386 HydrophobicContact CB-CE2 3.9Å
387	L	85.9	Confident	80.9	Confident	2 Å²	2	42 Å²	42	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	128.5	173.9	-175.9	54	0	0	0	108.7	R304 W305 E307 L349 F354 V376 L645	R304-L387 WeakPolarHBondContact CA-O 3.23Å; W305-L387 HydrophobicContact CD2-CB 4.5Å; W305-L387 HydrophobicContact CH2-CG 4.38Å; W305-L387 HydrophobicContact CZ2-CB 4.28Å; W305-L387 HydrophobicContact CZ2-CD2 3.58Å; W305-L387 HydrophobicContact CZ2-CG 3.76Å; W305-L387 PolarHBondContact N-O 3.25Å; W305-L387 PolarHBondContact O-N 2.71Å; E307-L387 HydrophobicContact CB-CB 4.3Å; L349-L387 HydrophobicContact CD1-CD2 3.95Å; F354-L387 HydrophobicContact CB-CD2 4.35Å; V376-L387 HydrophobicContact CG2-CD1 4.37Å; L387-L645 HydrophobicContact CD1-CD2 4.47Å
388	V	85.8	Confident	81.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	110.4	-173.5	-174.4	0	0	0	0	110	Q302 A303 R304 H374 E375 E377 K390	Q302-V388 HydrophobicContact CG-CG1 3.59Å; A303-V388 CarbonylContact O-C 3.56Å; A303-V388 WeakPolarHBondContact O-CA 3.36Å; R304-V388 HydrophobicContact CB-CG2 4.32Å; R304-V388 HydrophobicContact CG-CG2 3.99Å; H374-V388 WeakPolarHBondContact CA-O 3.16Å; E375-V388 HydrophobicContact CB-CB 4.47Å; E375-V388 PolarHBondContact N-O 3.09Å; E375-V388 PolarHBondContact O-N 2.95Å; E377-V388 HydrophobicContact CB-CG2 4.27Å; E377-V388 HydrophobicContact CG-CG2 3.82Å; V388-K390 HydrophobicContact CG1-CG 4.1Å
389	E	88.3	Confident	82.8	Confident	6 Å²	6	46.8 Å²	46.8	3%	0.028	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	117.4	171.5	-175.2	-175.3	164.2	0	0	109.5	Q302 A303 W305 I372 R391	Q302-E389 WeakPolarHBondContact CA-O 3.39Å; A303-E389 HydrophobicContact CB-CB 4.47Å; A303-E389 PolarHBondContact N-O 3.12Å; A303-E389 PolarHBondContact O-N 3.37Å; W305-E389 HydrophobicContact CH2-CB 3.78Å; W305-E389 HydrophobicContact CZ3-CB 3.71Å; I372-E389 HydrophobicContact CG2-CG 3.67Å; E389-R391 HydrophobicContact CG-CG 4.02Å; E389-R391 WeakPolarHBondContact OE1-CD 3.14Å; E389-R391 IonicContact OE1-NE 3.55Å; E389-R391 IonicContact OE1-NH1 2.82Å
390	K	89.6	Confident	83.9	Confident	37 Å²	37	49.7 Å²	49.7	16%	0.161	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	120.5	175.9	-68.6	173.9	-175.2	175.9	0	109.1	F300 Q302 I372 S373 E375 V388	F300-K390 HydrophobicContact CE2-CB 3.92Å; F300-K390 HydrophobicContact CE2-CD 4.43Å; F300-K390 HydrophobicContact CE2-CG 4.27Å; F300-K390 HydrophobicContact CZ-CB 3.95Å; F300-K390 HydrophobicContact CZ-CD 3.91Å; F300-K390 HydrophobicContact CZ-CG 3.78Å; Q302-K390 HydrophobicContact CB-CG 4.4Å; Q302-K390 HydrophobicContact CG-CG 4.05Å; Q302-K390 VanDerWaalsContact OE1-CE 3.24Å; I372-K390 WeakPolarHBondContact CA-O 3.18Å; S373-K390 PolarHBondContact N-O 3.29Å; S373-K390 PolarHBondContact O-N 3.28Å; E375-K390 VanDerWaalsContact OE1-CD 3.24Å; E375-K390 WeakPolarHBondContact OE1-CD 3.22Å; E375-K390 WeakPolarHBondContact OE1-CE 3.47Å; E375-K390 IonicContact OE1-NZ 3.91Å; E375-K390 PolarHBondContact OE1-NZ 3.25Å; E375-K390 IonicContact OE2-NZ 3.34Å; E375-K390 PolarHBondContact OE2-NZ 2.88Å; V388-K390 HydrophobicContact CG1-CG 4.1Å
391	R	91.7	Very high	85.4	Confident	14 Å²	14	46.4 Å²	46.4	5%	0.053	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	120.4	-178.3	-57.1	174	74.8	166	-6.9	110	F300 L301 L359 E370 I371 I372 E389 I393	F300-R391 WeakPolarHBondContact CA-O 3.46Å; L301-R391 HydrophobicContact CB-CB 4.36Å; L301-R391 PolarHBondContact N-O 2.89Å; L301-R391 PolarHBondContact O-N 2.68Å; L359-R391 PolarHBondContact O-NH1 3.48Å; L359-R391 PolarHBondContact O-NH2 2.9Å; E370-R391 IonicContact OE1-NH2 2.91Å; E370-R391 PolarHBondContact OE1-NH2 2.86Å; E370-R391 IonicContact OE2-CZ 3.82Å; E370-R391 IonicContact OE2-NE 3.4Å; E370-R391 IonicContact OE2-NH2 2.89Å; E370-R391 PolarHBondContact OE2-NH2 3.31Å; I371-R391 CarbonylContact O-C 3.43Å; I371-R391 VanDerWaalsContact O-CA 3.31Å; I371-R391 WeakPolarHBondContact O-CA 3.49Å; I372-R391 HydrophobicContact CD1-CG 4.36Å; I372-R391 HydrophobicContact CG1-CG 4.05Å; I372-R391 HydrophobicContact CG2-CG 4.09Å; E389-R391 HydrophobicContact CG-CG 4.02Å; E389-R391 WeakPolarHBondContact OE1-CD 3.14Å; E389-R391 IonicContact OE1-NE 3.55Å; E389-R391 IonicContact OE1-NH1 2.82Å; R391-I393 HydrophobicContact CB-CD1 3.87Å; R391-I393 HydrophobicContact CB-CG1 3.85Å
392	R	92.3	Very high	87	Confident	124 Å²	124	48.1 Å²	48.1	47%	0.468	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	120.9	163.3	-171.4	175.9	-175.7	159.1	2.3	109	D298 I299 E370 I371	D298-R392 WeakPolarHBondContact OD1-CG 3.42Å; D298-R392 IonicContact OD1-CZ 2.96Å; D298-R392 IonicContact OD1-NE 2.96Å; D298-R392 PolarHBondContact OD1-NE 3.24Å; D298-R392 IonicContact OD1-NH2 2.79Å; D298-R392 IonicContact OD2-CZ 2.72Å; D298-R392 IonicContact OD2-NE 3.13Å; D298-R392 PolarHBondContact OD2-NE 3.42Å; D298-R392 IonicContact OD2-NH2 2.67Å; D298-R392 PolarHBondContact OD2-NH2 3.2Å; I299-R392 WeakPolarHBondContact O-CA 3.45Å; E370-R392 WeakPolarHBondContact CA-O 3.4Å; I371-R392 HydrophobicContact CB-CB 4.46Å; I371-R392 PolarHBondContact N-O 3.15Å; I371-R392 PolarHBondContact O-N 3.27Å
393	I	93.1	Very high	88.3	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	116.5	-167.3	-54.6	-175.2	0	0	0	108.6	I299 L301 I361 P368 I369 E370 R391 F397	I299-I393 PolarHBondContact N-O 2.86Å; I299-I393 PolarHBondContact O-N 2.8Å; L301-I393 HydrophobicContact CB-CD1 4.28Å; L301-I393 HydrophobicContact CD2-CD1 4.14Å; I361-I393 HydrophobicContact CD1-CD1 3.72Å; I361-I393 HydrophobicContact CD1-CG2 3.88Å; P368-I393 HydrophobicContact CB-CG2 3.99Å; P368-I393 HydrophobicContact CG-CG2 4.35Å; I369-I393 WeakPolarHBondContact O-CA 3.5Å; E370-I393 HydrophobicContact CG-CG1 4.23Å; E370-I393 HydrophobicContact CG-CG2 4.25Å; R391-I393 HydrophobicContact CB-CD1 3.87Å; R391-I393 HydrophobicContact CB-CG1 3.85Å; I393-F397 HydrophobicContact CG2-CZ 4.44Å
394	K	93.1	Very high	89.5	Confident	106 Å²	106	46.1 Å²	46.1	46%	0.461	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	115.5	179.4	-176.5	176.4	178.7	178.1	0	109.9	A297 I369	A297-K394 WeakPolarHBondContact O-CA 3.47Å; I369-K394 HydrophobicContact CB-CB 4.46Å; I369-K394 PolarHBondContact N-O 3.05Å; I369-K394 PolarHBondContact O-N 2.98Å
395	G	92.2	Very high	90.3	Very high	11 Å²	11	44.9 Å²	44.9	11%	0.113	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	-177.8	-170.9	0	0	0	0	0	114.1	A297	A297-G395 PolarHBondContact N-O 2.89Å; A297-G395 PolarHBondContact O-N 2.88Å
396	I	94.1	Very high	90.9	Very high	63 Å²	63	45 Å²	45	32%	0.323	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	139.6	165.8	-61.1	172.4	0	0	0	106.1	R294 Y295 E365	R294-I396 HydrophobicContact CB-CG2 4.16Å; R294-I396 HydrophobicContact CG-CG2 4.29Å; Y295-I396 CarbonylContact O-C 3.6Å; Y295-I396 WeakPolarHBondContact O-CA 3.22Å; E365-I396 HydrophobicContact CB-CB 4.22Å; E365-I396 HydrophobicContact CB-CG2 4.01Å; E365-I396 PolarHBondContact N-O 2.83Å; E365-I396 WeakPolarHBondContact OE2-CG2 3.24Å
397	F	94.6	Very high	91.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	134.3	-176.4	-57	-85.6	0	0	0	109.1	R294 Y295 A297 I299 I361 N363 A364 I393	R294-F397 CarbonylContact C-O 3.55Å; R294-F397 WeakPolarHBondContact CA-O 3.12Å; R294-F397 VanDerWaalsContact CB-O 3.31Å; R294-F397 WeakPolarHBondContact CB-O 3.44Å; Y295-F397 HydrophobicContact CD1-CB 4.14Å; Y295-F397 HydrophobicContact CE1-CB 3.63Å; Y295-F397 HydrophobicContact CE2-CB 4.22Å; Y295-F397 HydrophobicContact CE2-CD2 4.02Å; Y295-F397 HydrophobicContact CE2-CG 4.41Å; Y295-F397 PolarHBondContact N-O 3.31Å; Y295-F397 PolarHBondContact O-N 3.35Å; A297-F397 HydrophobicContact CB-CD2 4.1Å; A297-F397 HydrophobicContact CB-CE2 3.91Å; I299-F397 HydrophobicContact CD1-CD2 4.35Å; I299-F397 HydrophobicContact CD1-CE1 4.22Å; I299-F397 HydrophobicContact CD1-CE2 3.63Å; I299-F397 HydrophobicContact CD1-CZ 3.56Å; I361-F397 HydrophobicContact CD1-CE1 4.4Å; I361-F397 HydrophobicContact CG2-CD1 4.41Å; I361-F397 HydrophobicContact CG2-CE1 4.17Å; N363-F397 CarbonylContact O-C 3.57Å; N363-F397 WeakPolarHBondContact O-CA 3.34Å; A364-F397 HydrophobicContact CB-CD1 4.3Å; A364-F397 HydrophobicContact CB-CE1 4.21Å; I393-F397 HydrophobicContact CG2-CZ 4.44Å
398	H	93.6	Very high	91.4	Very high	98 Å²	98	44.7 Å²	44.7	45%	0.454	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	135.8	176	178.7	45.1	0	0	0	109.7	E293 N363	E293-H398 PolarHBondContact O-ND1 3.26Å; N363-H398 PolarHBondContact ND2-O 2.81Å; N363-H398 VanDerWaalsContact ND2-O 3.12Å; N363-H398 PolarHBondContact O-N 2.86Å
399	E	92.8	Very high	91.6	Very high	25 Å²	25	44.8 Å²	44.8	12%	0.117	21%	0.205	C	C	.	.			trans	-148.8	130.8	-179.9	-174.5	56	-95.9	0	0	111.2	E293 Y295 L401 L413 S414	E293-E399 CarbonylContact C-O 3.59Å; E293-E399 VanDerWaalsContact C-O 3.3Å; E293-E399 WeakPolarHBondContact CB-O 3.46Å; E293-E399 PolarHBondContact O-N 2.89Å; Y295-E399 HydrophobicContact CD1-CB 4.08Å; Y295-E399 HydrophobicContact CE1-CB 4.11Å; E399-L401 HydrophobicContact CB-CD2 4.48Å; E399-L401 HydrophobicContact CG-CD2 4.17Å; E399-L413 HydrophobicContact CG-CD2 4.5Å; E399-S414 WeakPolarHBondContact OE2-CA 3.45Å; E399-S414 WeakPolarHBondContact OE2-CB 3.39Å; E399-S414 PolarHBondContact OE2-N 2.91Å; E399-S414 PolarHBondContact OE2-OG 2.72Å
400	T	91.7	Very high	91.6	Very high	94 Å²	94	46 Å²	46	58%	0.577	21%	0.213	S	C	*	.			trans	-85.3	114.7	-177.7	52.2	0	0	0	0	110.9
401	L	91.4	Very high	91.7	Very high	6 Å²	6	44.5 Å²	44.5	3%	0.031	21%	0.207	C	C	.	.			trans	-90.9	128.5	-166.2	-57.7	179.9	0	0	0	113.2	T290 E399 L403 Q411 Y545	T290-L401 HydrophobicContact CG2-CD1 4.15Å; E399-L401 HydrophobicContact CB-CD2 4.48Å; E399-L401 HydrophobicContact CG-CD2 4.17Å; L401-L403 HydrophobicContact CB-CD1 4.41Å; L401-L403 HydrophobicContact CB-CD2 4.3Å; L401-L403 HydrophobicContact CB-CG 4.06Å; L401-L403 PolarHBondContact O-N 2.86Å; L401-Q411 HydrophobicContact CD2-CB 4.19Å; L401-Q411 HydrophobicContact CD2-CG 4.06Å; L401-Y545 PolarHBondContact O-OH 3.04Å
402	E	91	Very high	91.7	Very high	135 Å²	135	46.4 Å²	46.4	63%	0.631	22%	0.218	S	C	*	.			trans	-83.3	80.5	177.3	-75.2	-154.5	-177.1	0	0	111.9	R404 Q411	E402-R404 VanDerWaalsContact C-N 3.29Å; E402-R404 PolarHBondContact O-N 2.85Å; E402-Q411 PolarHBondContact O-NE2 2.88Å
403	L	92	Very high	91.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-83.7	3.7	-173.9	-61.9	169.8	0	0	0	114.3	T290 L401 H405 F406 L540 P541 I543 Y545 T547	T290-L403 HydrophobicContact CG2-CD1 4.04Å; T290-L403 HydrophobicContact CG2-CD2 3.87Å; L401-L403 HydrophobicContact CB-CD1 4.41Å; L401-L403 HydrophobicContact CB-CD2 4.3Å; L401-L403 HydrophobicContact CB-CG 4.06Å; L401-L403 PolarHBondContact O-N 2.86Å; L403-H405 PolarHBondContact O-N 2.83Å; L403-F406 HydrophobicContact CB-CB 4.38Å; L403-F406 HydrophobicContact CD2-CD2 3.93Å; L403-F406 WeakPolarHBondContact O-CB 3.35Å; L403-F406 PolarHBondContact O-N 2.87Å; L403-L540 HydrophobicContact CD1-CD2 4.06Å; L403-L540 HydrophobicContact CD2-CD2 4.49Å; L403-P541 HydrophobicContact CD1-CG 3.4Å; L403-I543 HydrophobicContact CB-CD1 4.22Å; L403-Y545 HydrophobicContact CB-CE2 4.45Å; L403-Y545 PolarHBondContact N-OH 3.44Å; L403-T547 HydrophobicContact CB-CG2 4.43Å; L403-T547 VanDerWaalsContact O-CG2 3.25Å; L403-T547 WeakPolarHBondContact O-CG2 3.34Å
404	R	91.3	Very high	91.7	Very high	157 Å²	157	41.3 Å²	41.3	59%	0.592	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-53.8	-30.8	-177.6	176.1	174.6	171.5	146.5	-0.9	113.5	E402 Y545 Y548	E402-R404 VanDerWaalsContact C-N 3.29Å; E402-R404 PolarHBondContact O-N 2.85Å; R404-Y545 HydrophobicContact CB-CD2 4.23Å; R404-Y545 HydrophobicContact CB-CE2 3.99Å; R404-Y548 PolarHBondContact O-N 2.82Å
405	H	91	Very high	91.7	Very high	21 Å²	21	36.3 Å²	36.3	10%	0.097	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-105.1	6.2	-176.8	-47.2	92.6	0	0	0	113.1	L403 F408 Y548 D609 R613	L403-H405 PolarHBondContact O-N 2.83Å; H405-F408 CarbonylContact O-C 3.52Å; H405-F408 WeakPolarHBondContact O-CA 3.47Å; H405-F408 PolarHBondContact O-N 2.78Å; H405-Y548 HydrophobicContact CB-CD2 4.13Å; H405-Y548 HydrophobicContact CB-CE2 3.93Å; H405-Y548 AromaticContact CD2-CE2 3.7Å; H405-Y548 AromaticContact CD2-CZ 4Å; H405-D609 IonicContact CD2-OD2 3.74Å; H405-R613 PolarHBondContact CD2-NH2 2.9Å; H405-R613 PolarHBondContact CE1-NH2 3.27Å; H405-R613 PolarHBondContact NE2-NH2 2.98Å
406	F	90.4	Very high	91.7	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.009	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	133.3	179.2	-176.8	-86.9	0	0	0	111.6	L403 D409 F491 L540 T547 L549	L403-F406 HydrophobicContact CB-CB 4.38Å; L403-F406 HydrophobicContact CD2-CD2 3.93Å; L403-F406 WeakPolarHBondContact O-CB 3.35Å; L403-F406 PolarHBondContact O-N 2.87Å; F406-D409 WeakPolarHBondContact CD2-OD1 3.25Å; F406-F491 HydrophobicContact CE1-CD1 4.01Å; F406-F491 HydrophobicContact CE1-CE1 4.21Å; F406-F491 HydrophobicContact CE1-CG 4.43Å; F406-F491 HydrophobicContact CE2-CZ 4.43Å; F406-F491 AromaticContact CZ-CD1 3.81Å; F406-F491 HydrophobicContact CZ-CD1 3.81Å; F406-F491 HydrophobicContact CZ-CD2 4.47Å; F406-F491 AromaticContact CZ-CE1 3.59Å; F406-F491 HydrophobicContact CZ-CE1 3.59Å; F406-F491 HydrophobicContact CZ-CE2 4.28Å; F406-F491 HydrophobicContact CZ-CG 4.26Å; F406-F491 AromaticContact CZ-CZ 3.85Å; F406-F491 HydrophobicContact CZ-CZ 3.85Å; F406-L540 HydrophobicContact CD1-CD1 4.26Å; F406-L540 HydrophobicContact CD1-CD2 3.92Å; F406-L540 HydrophobicContact CD2-CD2 3.95Å; F406-L540 HydrophobicContact CE1-CD1 4.22Å; F406-L540 HydrophobicContact CE1-CD2 3.88Å; F406-L540 HydrophobicContact CE1-CG 4.28Å; F406-L540 HydrophobicContact CE2-CD2 3.9Å; F406-L540 HydrophobicContact CG-CD2 3.96Å; F406-L540 HydrophobicContact CZ-CD2 3.86Å; F406-L540 HydrophobicContact CZ-CG 4.45Å; F406-T547 HydrophobicContact CB-CG2 4.39Å; F406-L549 HydrophobicContact CD1-CB 4.18Å; F406-L549 HydrophobicContact CD1-CD1 4.32Å; F406-L549 HydrophobicContact CE1-CD1 3.98Å; F406-L549 PolarHBondContact O-N 3.23Å
407	P	89.5	Confident	91.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	cis	-96.1	17	11.7	39.5	-38.2	0	0	0	114.9	D409 S488 F491 I496	P407-D409 VanDerWaalsContact C-N 3.31Å; P407-S488 WeakPolarHBondContact O-CB 3.15Å; P407-F491 HydrophobicContact CB-CB 3.49Å; P407-F491 VanDerWaalsContact CB-CB 3.49Å; P407-F491 HydrophobicContact CB-CD2 3.88Å; P407-F491 HydrophobicContact CB-CG 3.77Å; P407-F491 HydrophobicContact CG-CB 3.71Å; P407-I496 HydrophobicContact CG-CD1 4.29Å
408	F	89.5	Confident	91.5	Very high	39 Å²	39	34.4 Å²	34.4	17%	0.171	17%	0.169	C	C	.	.	S	Bend	trans	-98.2	25.1	176.4	-62.1	-82	0	0	0	112.1	H405 S488 L492 V606 A610	H405-F408 CarbonylContact O-C 3.52Å; H405-F408 WeakPolarHBondContact O-CA 3.47Å; H405-F408 PolarHBondContact O-N 2.78Å; F408-S488 WeakPolarHBondContact CE1-OG 3.27Å; F408-L492 HydrophobicContact CE1-CD1 4.08Å; F408-L492 HydrophobicContact CE2-CD2 4.15Å; F408-L492 HydrophobicContact CZ-CD1 3.82Å; F408-L492 HydrophobicContact CZ-CD2 3.76Å; F408-L492 HydrophobicContact CZ-CG 4.18Å; F408-V606 HydrophobicContact CD2-CG1 3.52Å; F408-V606 HydrophobicContact CE2-CG1 3.47Å; F408-V606 VanDerWaalsContact CE2-CG1 3.47Å; F408-V606 HydrophobicContact CG-CG1 4.45Å; F408-V606 HydrophobicContact CZ-CG1 4.35Å; F408-A610 HydrophobicContact CB-CB 4.11Å; F408-A610 HydrophobicContact CD1-CB 4Å; F408-A610 HydrophobicContact CG-CB 4.13Å
409	D	90.5	Very high	91.2	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.016	15%	0.148	C	C	.	.			trans	-71.4	148.4	-178	53.4	-55	0	0	0	113	F406 P407 Q411 R486	F406-D409 WeakPolarHBondContact CD2-OD1 3.25Å; P407-D409 VanDerWaalsContact C-N 3.31Å; D409-Q411 PolarHBondContact OD2-NE2 3.46Å; D409-R486 PolarHBondContact O-N 2.89Å; D409-R486 WeakPolarHBondContact OD1-CD 3.35Å; D409-R486 IonicContact OD1-NE 2.83Å; D409-R486 PolarHBondContact OD1-NE 2.98Å; D409-R486 IonicContact OD2-CZ 3.25Å; D409-R486 IonicContact OD2-NE 2.71Å; D409-R486 PolarHBondContact OD2-NE 3.26Å; D409-R486 IonicContact OD2-NH2 2.63Å; D409-R486 PolarHBondContact OD2-NH2 3.41Å
410	C	89.2	Confident	90.8	Very high	31 Å²	31	32.2 Å²	32.2	21%	0.209	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	123.9	165.2	-60.3	0	0	0	0	105.8	S484 M617	C410-S484 CarbonylContact C-O 3.3Å; C410-S484 WeakPolarHBondContact CA-O 3.37Å; C410-M617 HydrophobicContact CB-CE 3.84Å
411	Q	91.8	Very high	90.4	Very high	5 Å²	5	30.1 Å²	30.1	2%	0.023	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	136.8	-178.7	-56.4	-58.9	-20.1	0	0	109.3	L401 E402 D409 L413 W449 S484	L401-Q411 HydrophobicContact CD2-CB 4.19Å; L401-Q411 HydrophobicContact CD2-CG 4.06Å; E402-Q411 PolarHBondContact O-NE2 2.88Å; D409-Q411 PolarHBondContact OD2-NE2 3.46Å; Q411-L413 HydrophobicContact CB-CD2 4.42Å; Q411-W449 HydrophobicContact CB-CZ3 4.33Å; Q411-W449 HydrophobicContact CG-CH2 3.78Å; Q411-W449 HydrophobicContact CG-CZ3 3.87Å; Q411-S484 PolarHBondContact N-O 2.97Å; Q411-S484 PolarHBondContact O-N 2.79Å
412	D	90.9	Very high	90	Very high	54 Å²	54	30.8 Å²	30.8	29%	0.289	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	100.7	175.9	-67.6	-6.8	0	0	0	107.5	S414 R483	D412-S414 PolarHBondContact O-N 2.79Å; D412-R483 VanDerWaalsContact CG-CZ 3.48Å; D412-R483 WeakPolarHBondContact OD1-CD 3.4Å; D412-R483 WeakPolarHBondContact OD1-CG 3.48Å; D412-R483 IonicContact OD1-CZ 3.89Å; D412-R483 VanDerWaalsContact OD1-CZ 3.25Å; D412-R483 IonicContact OD1-NE 3.74Å; D412-R483 IonicContact OD1-NH1 3.77Å; D412-R483 PolarHBondContact OD1-NH1 3.43Å; D412-R483 IonicContact OD2-CZ 2.86Å; D412-R483 IonicContact OD2-NH1 3.88Å; D412-R483 PolarHBondContact OD2-NH1 3.39Å; D412-R483 IonicContact OD2-NH2 3.68Å; D412-R483 PolarHBondContact OD2-NH2 3.46Å; D412-R483 VanDerWaalsContact OD2-NH2 3.13Å
413	L	91.7	Very high	89.6	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	107.9	-177.7	-56.8	179.2	0	0	0	109.6	V285 V288 Y295 E399 Q411 T481 S482	V285-L413 HydrophobicContact CG1-CD1 3.98Å; V288-L413 HydrophobicContact CG2-CD1 4.33Å; Y295-L413 HydrophobicContact CD1-CB 4.35Å; Y295-L413 HydrophobicContact CD1-CD2 3.89Å; Y295-L413 HydrophobicContact CD2-CD1 4.34Å; Y295-L413 HydrophobicContact CE1-CB 3.95Å; Y295-L413 HydrophobicContact CE1-CD2 4.29Å; Y295-L413 HydrophobicContact CE2-CB 4.35Å; Y295-L413 HydrophobicContact CG-CD1 4.39Å; Y295-L413 HydrophobicContact CG-CD2 4.2Å; E399-L413 HydrophobicContact CG-CD2 4.5Å; Q411-L413 HydrophobicContact CB-CD2 4.42Å; L413-T481 WeakPolarHBondContact O-CA 3.36Å; L413-S482 WeakPolarHBondContact CB-O 3.18Å; L413-S482 PolarHBondContact N-O 3.47Å; L413-S482 PolarHBondContact O-N 3.17Å
414	S	93.2	Very high	89	Confident	16 Å²	16	31.6 Å²	31.6	11%	0.112	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	145.3	-173.7	82.4	0	0	0	0	114.3	Y295 N363 E399 D412 F480	Y295-S414 PolarHBondContact OH-O 2.67Å; N363-S414 PolarHBondContact ND2-O 2.86Å; E399-S414 WeakPolarHBondContact OE2-CA 3.45Å; E399-S414 WeakPolarHBondContact OE2-CB 3.39Å; E399-S414 PolarHBondContact OE2-N 2.91Å; E399-S414 PolarHBondContact OE2-OG 2.72Å; D412-S414 PolarHBondContact O-N 2.79Å; S414-F480 CarbonylContact C-O 3.53Å; S414-F480 WeakPolarHBondContact CA-O 3.43Å
415	V	92.9	Very high	88.7	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	119.4	164.6	-175.1	0	0	0	0	107.7	L280 F282 Y295 I299 I361 I417 V479 F480	L280-V415 HydrophobicContact CD1-CB 3.81Å; L280-V415 HydrophobicContact CD1-CG1 3.79Å; L280-V415 HydrophobicContact CD1-CG2 4.26Å; F282-V415 HydrophobicContact CE1-CG2 3.71Å; F282-V415 HydrophobicContact CZ-CG2 3.71Å; Y295-V415 VanDerWaalsContact OH-CG2 3.3Å; Y295-V415 WeakPolarHBondContact OH-CG2 3.24Å; I299-V415 HydrophobicContact CD1-CG1 4.39Å; I299-V415 HydrophobicContact CD1-CG2 3.62Å; I361-V415 HydrophobicContact CG2-CG1 4.38Å; V415-I417 HydrophobicContact CG1-CG1 4.34Å; V415-V479 WeakPolarHBondContact O-CA 3.36Å; V415-F480 PolarHBondContact N-O 3.13Å; V415-F480 PolarHBondContact O-N 3.36Å
416	T	92.9	Very high	88.4	Confident	19 Å²	19	28.1 Å²	28.1	12%	0.117	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	104.8	-177.5	-63	0	0	0	0	110.2	I361 D362 N363 T418 I462 V479	I361-T416 WeakPolarHBondContact CA-O 3.45Å; D362-T416 HydrophobicContact CB-CG2 4.21Å; D362-T416 PolarHBondContact N-O 2.86Å; N363-T416 PolarHBondContact OD1-N 2.88Å; T416-T418 HydrophobicContact CG2-CG2 3.98Å; T416-I462 HydrophobicContact CG2-CD1 3.98Å; T416-V479 HydrophobicContact CG2-CG2 4.05Å
417	I	92.3	Very high	88.3	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	136.9	177	-67.4	155.7	0	0	0	109.5	L278 L280 L301 L359 L360 I361 V415 G477 L478 F480	L278-I417 HydrophobicContact CD1-CB 4.49Å; L278-I417 HydrophobicContact CD1-CG2 3.86Å; L280-I417 HydrophobicContact CD1-CD1 3.72Å; L301-I417 HydrophobicContact CD1-CD1 3.56Å; L301-I417 HydrophobicContact CD2-CD1 3.63Å; L301-I417 HydrophobicContact CD2-CG1 4.12Å; L301-I417 HydrophobicContact CD2-CG2 4.47Å; L301-I417 HydrophobicContact CG-CD1 4.17Å; L359-I417 HydrophobicContact CB-CG2 4.43Å; L359-I417 HydrophobicContact CD2-CG2 4.02Å; L360-I417 CarbonylContact O-C 3.55Å; L360-I417 WeakPolarHBondContact O-CA 3.36Å; I361-I417 HydrophobicContact CG1-CG1 4.27Å; V415-I417 HydrophobicContact CG1-CG1 4.34Å; I417-G477 CarbonylContact O-C 3.56Å; I417-G477 WeakPolarHBondContact O-CA 3.19Å; I417-L478 PolarHBondContact N-O 2.97Å; I417-L478 PolarHBondContact O-N 2.72Å; I417-F480 HydrophobicContact CD1-CD2 3.95Å; I417-F480 HydrophobicContact CD1-CE2 3.68Å
418	T	91.1	Very high	88.3	Confident	14 Å²	14	33.1 Å²	33.1	9%	0.086	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	178.7	-174.6	74.7	0	0	0	0	110.1	L359 L360 D362 T416 I462	L359-T418 CarbonylContact C-O 3.55Å; L359-T418 VanDerWaalsContact CA-O 3.31Å; L359-T418 WeakPolarHBondContact CA-O 3.33Å; L360-T418 PolarHBondContact N-O 3.1Å; L360-T418 PolarHBondContact O-N 3.32Å; D362-T418 HydrophobicContact CB-CG2 4.12Å; T416-T418 HydrophobicContact CG2-CG2 3.98Å; T418-I462 HydrophobicContact CG2-CD1 3.4Å; T418-I462 VanDerWaalsContact CG2-CD1 3.4Å
419	C	88	Confident	88.2	Confident	2 Å²	2	33 Å²	33	1%	0.014	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	157.5	170.5	68.5	0	0	0	0	114.3	P357 R358 L359 R421 H475 P476	P357-C419 WeakPolarHBondContact O-CB 3.38Å; R358-C419 WeakPolarHBondContact O-CA 3.41Å; L359-C419 HydrophobicContact CD2-CB 4.39Å; C419-R421 PolarHBondContact O-N 2.87Å; C419-R421 PolarHBondContact SG-O 2.99Å; C419-R421 VanDerWaalsContact SG-O 3.35Å; C419-H475 PolarHBondContact O-ND1 3.08Å; C419-P476 WeakPolarHBondContact SG-CG 3.36Å
420	D	84.2	Confident	88	Confident	75 Å²	75	34.3 Å²	34.3	40%	0.401	18%	0.184	S	C	.	.	S	Bend	trans	-63.9	-22.9	175.5	-169.3	38.4	0	0	0	113	R358 H475	R358-D420 HydrophobicContact CB-CB 3.84Å; R358-D420 WeakPolarHBondContact CD-OD2 3.45Å; R358-D420 IonicContact CZ-OD2 2.86Å; R358-D420 IonicContact NH1-OD2 2.95Å; R358-D420 PolarHBondContact NH1-OD2 2.91Å; R358-D420 PolarHBondContact O-N 2.78Å; D420-H475 PolarHBondContact O-CE1 2.8Å; D420-H475 VanDerWaalsContact O-CE1 3.31Å
421	R	82.8	Confident	87.6	Confident	51 Å²	51	33.2 Å²	33.2	19%	0.192	18%	0.177	C	C	.	.	S	Bend	trans	-83.4	161.3	176.7	-70.1	-166.2	175	98.8	14.6	113.4	N356 C419 E425 V426 H475	N356-R421 PolarHBondContact O-NH1 3.19Å; N356-R421 PolarHBondContact O-NH2 3.44Å; C419-R421 PolarHBondContact O-N 2.87Å; C419-R421 PolarHBondContact SG-O 2.99Å; C419-R421 VanDerWaalsContact SG-O 3.35Å; R421-E425 HydrophobicContact CB-CB 4.29Å; R421-E425 WeakPolarHBondContact CB-OE2 3.41Å; R421-E425 WeakPolarHBondContact CD-OE2 3.41Å; R421-E425 WeakPolarHBondContact CG-OE2 3.31Å; R421-E425 IonicContact NE-OE2 2.95Å; R421-V426 HydrophobicContact CB-CB 4.33Å; R421-V426 HydrophobicContact CB-CG2 3.59Å; R421-V426 HydrophobicContact CG-CG2 4.14Å; R421-H475 PolarHBondContact O-ND1 2.85Å
422	T	83.5	Confident	86.8	Confident	20 Å²	20	35.6 Å²	35.6	12%	0.123	19%	0.193	C	C	.	.			trans	-85.3	162.3	179.4	60.7	0	0	0	0	112.8	D424 E425 V426 R473 H474	T422-D424 PolarHBondContact O-N 2.79Å; T422-E425 PolarHBondContact O-N 3.01Å; T422-V426 PolarHBondContact O-N 3.01Å; T422-R473 HydrophobicContact CG2-CB 4.15Å; T422-R473 HydrophobicContact CG2-CG 4.09Å; T422-H474 CarbonylContact C-O 3.54Å; T422-H474 WeakPolarHBondContact CA-O 3.37Å; T422-H474 WeakPolarHBondContact CB-O 3.43Å
423	T	82.1	Confident	85.6	Confident	20 Å²	20	34.6 Å²	34.6	12%	0.123	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-12.8	175.7	-45.3	0	0	0	0	113.2	K273 E461 H474	K273-T423 WeakPolarHBondContact CD-O 3.37Å; K273-T423 WeakPolarHBondContact CE-O 3.22Å; K273-T423 PolarHBondContact NZ-O 3.23Å; T423-E461 HydrophobicContact CG2-CG 4.47Å; T423-H474 PolarHBondContact N-O 3.26Å; T423-H474 VanDerWaalsContact OG1-C 3.27Å; T423-H474 PolarHBondContact OG1-O 2.99Å
424	D	80.6	Confident	84.9	Confident	131 Å²	131	37.1 Å²	37.1	70%	0.701	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-28.2	173.8	-57.8	-51.1	0	0	0	112.7	T422	T422-D424 PolarHBondContact O-N 2.79Å
425	E	84	Confident	84.1	Confident	105 Å²	105	37.2 Å²	37.2	49%	0.491	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-37.2	-179.3	-66.1	177.7	-178.3	0	0	112.2	A274 R421 T422	A274-E425 PolarHBondContact N-O 3.07Å; R421-E425 HydrophobicContact CB-CB 4.29Å; R421-E425 WeakPolarHBondContact CB-OE2 3.41Å; R421-E425 WeakPolarHBondContact CD-OE2 3.41Å; R421-E425 WeakPolarHBondContact CG-OE2 3.31Å; R421-E425 IonicContact NE-OE2 2.95Å; T422-E425 PolarHBondContact O-N 3.01Å
426	V	86.3	Confident	83.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	143.1	-170.7	177.1	0	0	0	0	111.4	A274 V276 W355 R421 T422 L428 P476	A274-V426 WeakPolarHBondContact O-CA 3.43Å; V276-V426 HydrophobicContact CG2-CG1 3.98Å; W355-V426 HydrophobicContact CH2-CG2 3.77Å; W355-V426 HydrophobicContact CZ2-CG2 3.71Å; R421-V426 HydrophobicContact CB-CB 4.33Å; R421-V426 HydrophobicContact CB-CG2 3.59Å; R421-V426 HydrophobicContact CG-CG2 4.14Å; T422-V426 PolarHBondContact O-N 3.01Å; V426-L428 HydrophobicContact CG1-CD2 3.77Å; V426-L428 HydrophobicContact CG1-CG 4.36Å; V426-P476 HydrophobicContact CB-CG 4.29Å; V426-P476 HydrophobicContact CG1-CG 4.21Å
427	E	87.9	Confident	82.8	Confident	97 Å²	97	39.4 Å²	39.4	45%	0.453	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	113.4	169.6	-166.7	172.7	156.6	0	0	109.6	K273 A274 R275 V276 V429	K273-E427 HydrophobicContact CB-CB 4.2Å; K273-E427 HydrophobicContact CD-CB 4.28Å; A274-E427 PolarHBondContact O-N 2.86Å; R275-E427 WeakPolarHBondContact CA-O 3.22Å; V276-E427 PolarHBondContact N-O 2.79Å; E427-V429 HydrophobicContact CG-CG2 3.94Å
428	L	88	Confident	82.1	Confident	11 Å²	11	39.7 Å²	39.7	6%	0.058	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	119.6	175.7	-58.5	-175.2	0	0	0	109.3	V276 L278 L359 V426 P476 L478	V276-L428 HydrophobicContact CB-CD2 3.87Å; V276-L428 HydrophobicContact CG1-CD2 4.32Å; V276-L428 HydrophobicContact CG2-CD2 4.37Å; L278-L428 HydrophobicContact CD1-CB 4.24Å; L278-L428 HydrophobicContact CD1-CD1 4.25Å; L278-L428 HydrophobicContact CD1-CD2 4.26Å; L278-L428 HydrophobicContact CD1-CG 4.47Å; L359-L428 HydrophobicContact CD2-CD1 4.37Å; L359-L428 HydrophobicContact CD2-CD2 3.82Å; V426-L428 HydrophobicContact CG1-CD2 3.77Å; V426-L428 HydrophobicContact CG1-CG 4.36Å; L428-P476 HydrophobicContact CB-CB 4.34Å; L428-P476 HydrophobicContact CD1-CB 4.32Å; L428-P476 HydrophobicContact CD1-CG 4.29Å; L428-P476 WeakPolarHBondContact CD1-O 3.38Å; L428-P476 HydrophobicContact CG-CB 3.96Å; L428-P476 HydrophobicContact CG-CG 3.91Å; L428-L478 HydrophobicContact CB-CB 4.41Å
429	V	88.7	Confident	81.1	Confident	37 Å²	37	41.8 Å²	41.8	22%	0.224	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	148.3	-177	-166	0	0	0	0	109	R275 V276 E277 L278 E427	R275-V429 HydrophobicContact CG-CG2 3.89Å; V276-V429 PolarHBondContact O-N 2.84Å; E277-V429 CarbonylContact C-O 3.57Å; E277-V429 WeakPolarHBondContact CA-O 3.48Å; L278-V429 PolarHBondContact N-O 2.84Å; E427-V429 HydrophobicContact CG-CG2 3.94Å
430	A	86.5	Confident	80.1	Confident	29 Å²	29	43.9 Å²	43.9	24%	0.24	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	142.9	165.4	0	0	0	0	0	109.7	I457	A430-I457 HydrophobicContact CB-CD1 3.75Å; A430-I457 HydrophobicContact CB-CG2 4.28Å
431	S	81	Confident	79.2	Confident	8 Å²	8	51.5 Å²	51.5	6%	0.056	26%	0.258	C	S	.	.			trans	-61.8	131	174.3	-176.4	0	0	0	0	110.9	L278 V279 T433 E434	L278-S431 PolarHBondContact O-N 2.91Å; V279-S431 VanDerWaalsContact CG2-CB 3.41Å; S431-T433 VanDerWaalsContact C-N 3.34Å; S431-T433 PolarHBondContact OG-N 2.95Å; S431-E434 PolarHBondContact OG-N 3.21Å
432	P	73.5	Confident	78.1	Confident	56 Å²	56	51.9 Å²	51.9	36%	0.364	27%	0.268	S	S	.	.	S	Bend	trans	-75.5	-29.3	170.6	32	-32.8	0	0	0	110.9	E277 I631	E277-P432 VanDerWaalsContact CD-CD 3.4Å; E277-P432 WeakPolarHBondContact OE1-CD 3.4Å; E277-P432 VanDerWaalsContact OE1-CG 3.27Å; E277-P432 WeakPolarHBondContact OE1-CG 3.33Å; P432-I631 WeakPolarHBondContact O-CD1 3.46Å
433	T	67	Low	77	Confident	33 Å²	33	51.5 Å²	51.5	20%	0.202	27%	0.267	C	S	.	.	S	Bend	trans	-82.1	-19	-175.4	-51.9	0	0	0	0	112.7	R304 S431 I631 K635 I640	R304-T433 PolarHBondContact NH2-OG1 3.08Å; S431-T433 VanDerWaalsContact C-N 3.34Å; S431-T433 PolarHBondContact OG-N 2.95Å; T433-I631 VanDerWaalsContact O-CG2 3.23Å; T433-I631 WeakPolarHBondContact O-CG2 3.35Å; T433-K635 HydrophobicContact CG2-CG 4.18Å; T433-K635 WeakPolarHBondContact O-CE 3.22Å; T433-I640 HydrophobicContact CG2-CD1 4.08Å
434	E	75.7	Confident	76	Confident	54 Å²	54	53.2 Å²	53.2	25%	0.252	28%	0.283	S	S	.	.	S	Bend	trans	-144.5	126.8	-176.2	-71.4	-162.3	152.8	0	0	113.9	V279 S431 K635	V279-E434 HydrophobicContact CG1-CB 4.07Å; V279-E434 HydrophobicContact CG2-CB 3.64Å; S431-E434 PolarHBondContact OG-N 3.21Å; E434-K635 IonicContact OE1-NZ 3.29Å; E434-K635 PolarHBondContact OE1-NZ 2.93Å
435	V	77.7	Confident	75.4	Confident	17 Å²	17	48.2 Å²	48.2	10%	0.103	26%	0.256	C	S	.	.			trans	-75	132.9	173	-64.4	0	0	0	0	111.9	F624 Y627 K628 I631	V435-F624 HydrophobicContact CB-CE2 4.48Å; V435-F624 HydrophobicContact CB-CZ 4.4Å; V435-F624 HydrophobicContact CG2-CZ 4.4Å; V435-Y627 HydrophobicContact CG1-CD1 3.86Å; V435-Y627 HydrophobicContact CG1-CE1 3.88Å; V435-K628 HydrophobicContact CG1-CB 4.35Å; V435-K628 HydrophobicContact CG2-CB 3.99Å; V435-K628 HydrophobicContact CG2-CD 3.82Å; V435-K628 HydrophobicContact CG2-CG 3.7Å; V435-I631 HydrophobicContact CG1-CB 4.46Å; V435-I631 HydrophobicContact CG1-CD1 3.62Å
436	S	79.1	Confident	74.7	Confident	3 Å²	3	46 Å²	46	2%	0.021	25%	0.252	C	S	.	.			trans	-68	130.4	166	-63.3	0	0	0	0	109.5	L280 F480 F624	L280-S436 PolarHBondContact N-OG 3.2Å; L280-S436 CarbonylContact O-C 3.6Å; L280-S436 WeakPolarHBondContact O-CA 3.31Å; L280-S436 WeakPolarHBondContact O-CB 3.41Å; S436-F480 VanDerWaalsContact OG-CE1 3.22Å; S436-F480 WeakPolarHBondContact OG-CE1 3.48Å; S436-F624 WeakPolarHBondContact O-CE2 3.21Å; S436-F624 VanDerWaalsContact O-CZ 3.25Å; S436-F624 WeakPolarHBondContact O-CZ 3.49Å
437	Q	79.6	Confident	73.9	Confident	63 Å²	63	54 Å²	54	29%	0.294	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	164.8	-167.3	59.7	176.7	-7.6	0	0	112.8	L280 I281 F282 F624	L280-Q437 PolarHBondContact O-N 3.42Å; I281-Q437 VanDerWaalsContact CA-O 3.29Å; I281-Q437 WeakPolarHBondContact CA-O 3.4Å; I281-Q437 HydrophobicContact CD1-CG 4.3Å; I281-Q437 HydrophobicContact CG1-CG 4.02Å; I281-Q437 HydrophobicContact CG2-CG 4.29Å; F282-Q437 PolarHBondContact N-O 2.99Å; Q437-F624 HydrophobicContact CB-CZ 4.3Å
438	V	76.1	Confident	73.5	Confident	8 Å²	8	54 Å²	54	5%	0.048	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	125.1	176.6	-174.6	0	0	0	0	110.4	F282 V440 I451 V455 S482	F282-V438 HydrophobicContact CB-CB 4.37Å; F282-V438 HydrophobicContact CB-CG1 4.03Å; F282-V438 HydrophobicContact CB-CG2 4.21Å; F282-V438 HydrophobicContact CD2-CG2 4.06Å; F282-V438 HydrophobicContact CG-CG2 4.44Å; V438-V440 HydrophobicContact CB-CG2 4.39Å; V438-V440 HydrophobicContact CG1-CG2 4.09Å; V438-V440 PolarHBondContact O-N 2.97Å; V438-V440 VanDerWaalsContact O-N 3.08Å; V438-I451 HydrophobicContact CG1-CG2 3.8Å; V438-V455 HydrophobicContact CG2-CG2 3.73Å; V438-S482 WeakPolarHBondContact CG2-OG 3.29Å
439	D	71.6	Confident	73.3	Confident	57 Å²	57	53.8 Å²	53.8	31%	0.305	29%	0.288	S	S	.	.			trans	-80.1	88.8	166.7	-172.4	8.1	0	0	0	110.7	F282 R441 C442	F282-D439 PolarHBondContact O-N 3.17Å; D439-R441 PolarHBondContact O-N 3.14Å; D439-R441 WeakPolarHBondContact OD1-CB 3.49Å; D439-R441 WeakPolarHBondContact OD1-CG 3.48Å; D439-R441 PolarHBondContact OD1-N 3.09Å; D439-C442 PolarHBondContact O-N 3.31Å
440	V	66.9	Low	73	Confident	47 Å²	47	57.6 Å²	57.6	29%	0.285	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-62.3	-18.9	176.9	178.3	0	0	0	0	112.1	V438 C442 H453	V438-V440 HydrophobicContact CB-CG2 4.39Å; V438-V440 HydrophobicContact CG1-CG2 4.09Å; V438-V440 PolarHBondContact O-N 2.97Å; V438-V440 VanDerWaalsContact O-N 3.08Å; V440-C442 VanDerWaalsContact C-N 3.3Å; V440-C442 PolarHBondContact O-N 3.4Å; V440-H453 VanDerWaalsContact CG2-CE1 3.41Å; V440-H453 WeakPolarHBondContact CG2-CE1 3.34Å
441	R	64.5	Low	72.9	Confident	235 Å²	235	56.9 Å²	56.9	89%	0.887	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-67.3	-29.9	178.3	-57.9	176.7	173.6	-174.4	-0.3	112.6	D439	D439-R441 PolarHBondContact O-N 3.14Å; D439-R441 WeakPolarHBondContact OD1-CB 3.49Å; D439-R441 WeakPolarHBondContact OD1-CG 3.48Å; D439-R441 PolarHBondContact OD1-N 3.09Å
442	C	59.5	Low	72.9	Confident	58 Å²	58	57.2 Å²	57.2	39%	0.392	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-100.2	2.9	-175.4	-82	0	0	0	0	114.8	V283 K284 D439 V440 A444	V283-C442 WeakPolarHBondContact O-CB 3.39Å; K284-C442 HydrophobicContact CB-CB 4.36Å; K284-C442 VanDerWaalsContact CD-O 3.27Å; K284-C442 WeakPolarHBondContact CD-O 3.41Å; K284-C442 VanDerWaalsContact CE-O 3.3Å; K284-C442 WeakPolarHBondContact CE-O 3.47Å; K284-C442 VanDerWaalsContact CG-O 3.25Å; K284-C442 WeakPolarHBondContact CG-O 3.34Å; D439-C442 PolarHBondContact O-N 3.31Å; V440-C442 VanDerWaalsContact C-N 3.3Å; V440-C442 PolarHBondContact O-N 3.4Å; C442-A444 PolarHBondContact O-N 3.13Å; C442-A444 VanDerWaalsContact O-N 3.12Å
443	A	61.8	Low	72.9	Confident	12 Å²	12	58.9 Å²	58.9	10%	0.099	30%	0.297	C	S	.	.			trans	-52.6	112.6	176.4	0	0	0	0	0	112.3	D445 I451	A443-D445 VanDerWaalsContact C-N 3.28Å; A443-D445 PolarHBondContact O-N 3.24Å; A443-I451 HydrophobicContact CB-CD1 3.65Å; A443-I451 HydrophobicContact CB-CG1 4.41Å
444	A	60.9	Low	73.5	Confident	56 Å²	56	57.3 Å²	57.3	46%	0.463	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-38.5	-177.2	0	0	0	0	0	112.2	K284 V285 C442	K284-A444 VanDerWaalsContact CE-CB 3.44Å; V285-A444 WeakPolarHBondContact O-CB 3.07Å; V285-A444 PolarHBondContact O-N 2.98Å; C442-A444 PolarHBondContact O-N 3.13Å; C442-A444 VanDerWaalsContact O-N 3.12Å
445	D	67.4	Low	73.8	Confident	27 Å²	27	55.1 Å²	55.1	14%	0.144	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	37.7	-166	-157.5	-4.2	0	0	0	111.6	A443 Q447 E448 W449	A443-D445 VanDerWaalsContact C-N 3.28Å; A443-D445 PolarHBondContact O-N 3.24Å; D445-Q447 PolarHBondContact O-N 3.15Å; D445-E448 PolarHBondContact O-N 3.18Å; D445-E448 WeakPolarHBondContact OD1-CB 3.21Å; D445-E448 PolarHBondContact OD1-N 3.47Å; D445-W449 PolarHBondContact O-N 3.41Å
446	S	68.6	Low	74.1	Confident	58 Å²	58	56.4 Å²	56.4	41%	0.406	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-7.1	178.2	55.2	0	0	0	0	113.7	W449 R487	S446-W449 CarbonylContact C-O 3.5Å; S446-W449 WeakPolarHBondContact CA-O 3.33Å; S446-R487 VanDerWaalsContact O-CZ 3.3Å; S446-R487 PolarHBondContact O-NE 3.05Å; S446-R487 PolarHBondContact O-NH2 3.06Å
447	Q	70.9	Confident	74.4	Confident	167 Å²	167	59.4 Å²	59.4	78%	0.78	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-46.8	173.3	-63.3	-171.3	4.5	0	0	112	D445 R487	D445-Q447 PolarHBondContact O-N 3.15Å; Q447-R487 WeakPolarHBondContact O-CD 3.4Å; Q447-R487 WeakPolarHBondContact O-CG 3.46Å; Q447-R487 PolarHBondContact O-NE 3.36Å
448	E	78.3	Confident	74.7	Confident	98 Å²	98	62.9 Å²	62.9	46%	0.458	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-28.9	176	-63.7	-165.5	-165.2	0	0	112.8	D445 R487	D445-E448 PolarHBondContact O-N 3.18Å; D445-E448 WeakPolarHBondContact OD1-CB 3.21Å; D445-E448 PolarHBondContact OD1-N 3.47Å; E448-R487 WeakPolarHBondContact O-CB 3.16Å; E448-R487 PolarHBondContact O-N 3.5Å
449	W	83.7	Confident	75.1	Confident	6 Å²	6	66.9 Å²	66.9	2%	0.023	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	143.5	-172.5	-60.5	91.8	0	0	0	113.1	V288 Q411 D445 S446 R486	V288-W449 HydrophobicContact CB-CZ2 3.79Å; V288-W449 HydrophobicContact CG1-CH2 4.31Å; V288-W449 HydrophobicContact CG1-CZ2 3.72Å; V288-W449 HydrophobicContact CG2-CD2 4.5Å; V288-W449 HydrophobicContact CG2-CZ2 4.29Å; Q411-W449 HydrophobicContact CB-CZ3 4.33Å; Q411-W449 HydrophobicContact CG-CH2 3.78Å; Q411-W449 HydrophobicContact CG-CZ3 3.87Å; D445-W449 PolarHBondContact O-N 3.41Å; S446-W449 CarbonylContact C-O 3.5Å; S446-W449 WeakPolarHBondContact CA-O 3.33Å; W449-R486 HydrophobicContact CE3-CB 4.21Å; W449-R486 HydrophobicContact CH2-CB 4.42Å; W449-R486 VanDerWaalsContact CH2-NH2 3.29Å; W449-R486 VanDerWaalsContact CZ2-CZ 3.49Å; W449-R486 HydrophobicContact CZ3-CB 3.96Å; W449-R486 HydrophobicContact CZ3-CG 4.49Å
450	K	83.9	Confident	75.6	Confident	118 Å²	118	67.3 Å²	67.3	51%	0.513	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	107.5	160.3	178.6	175.8	176.6	174.3	0	108.1	A485	K450-A485 PolarHBondContact N-O 3.3Å; K450-A485 PolarHBondContact O-N 3.44Å
451	I	82.5	Confident	76.2	Confident	14 Å²	14	70.6 Å²	70.6	7%	0.072	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	141.6	174.8	-42.3	-174.4	0	0	0	108.9	V285 V438 A443	V285-I451 HydrophobicContact CB-CD1 3.68Å; V285-I451 HydrophobicContact CG1-CD1 4.31Å; V285-I451 HydrophobicContact CG2-CD1 3.83Å; V438-I451 HydrophobicContact CG1-CG2 3.8Å; A443-I451 HydrophobicContact CB-CD1 3.65Å; A443-I451 HydrophobicContact CB-CG1 4.41Å
452	F	81.5	Confident	76.8	Confident	14 Å²	14	61.4 Å²	61.4	6%	0.061	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	159.6	174.6	-65.9	-71.9	0	0	0	110.9	R483 A485 M617 D621	F452-R483 HydrophobicContact CB-CB 4.33Å; F452-R483 HydrophobicContact CD2-CB 3.78Å; F452-R483 WeakPolarHBondContact CD2-O 3.25Å; F452-R483 HydrophobicContact CG-CB 4.5Å; F452-R483 PolarHBondContact N-O 3.23Å; F452-A485 HydrophobicContact CE2-CB 3.7Å; F452-A485 HydrophobicContact CZ-CB 3.97Å; F452-M617 HydrophobicContact CD1-CB 4.41Å; F452-M617 HydrophobicContact CD2-CB 4.49Å; F452-M617 HydrophobicContact CE1-CB 3.79Å; F452-M617 HydrophobicContact CE2-CB 3.88Å; F452-M617 HydrophobicContact CE2-CG 3.87Å; F452-M617 HydrophobicContact CZ-CB 3.5Å; F452-M617 VanDerWaalsContact CZ-CB 3.5Å; F452-M617 HydrophobicContact CZ-CG 3.91Å; F452-D621 WeakPolarHBondContact CD1-OD2 3.43Å
453	H	74.2	Confident	77.4	Confident	91 Å²	91	63.4 Å²	63.4	42%	0.421	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-26	-176.1	-75.1	-78.7	0	0	0	113.3	V440 F624	V440-H453 VanDerWaalsContact CG2-CE1 3.41Å; V440-H453 WeakPolarHBondContact CG2-CE1 3.34Å; H453-F624 WeakPolarHBondContact O-CE1 3.28Å
454	H	79.5	Confident	77.5	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.005	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	136	-175.6	65.5	-89.3	0	0	0	112.6	R483 D621 F624	H454-R483 WeakPolarHBondContact NE2-CD 3.46Å; H454-D621 IonicContact CE1-OD1 3.81Å; H454-D621 IonicContact CG-OD1 3.3Å; H454-D621 IonicContact ND1-OD1 2.81Å; H454-D621 PolarHBondContact ND1-OD1 3.07Å; H454-F624 HydrophobicContact CB-CB 3.44Å; H454-F624 VanDerWaalsContact CB-CB 3.44Å; H454-F624 HydrophobicContact CB-CD1 3.9Å; H454-F624 HydrophobicContact CB-CD2 3.73Å; H454-F624 HydrophobicContact CB-CE2 4.45Å; H454-F624 HydrophobicContact CB-CG 3.41Å; H454-F624 VanDerWaalsContact CB-CG 3.41Å
455	V	81	Confident	77.2	Confident	8 Å²	8	64.8 Å²	64.8	5%	0.048	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	112.5	167.1	-177.6	0	0	0	0	107.1	F282 V438 I457 F480 T481	F282-V455 HydrophobicContact CD2-CG2 4.11Å; F282-V455 HydrophobicContact CE2-CG1 4.33Å; F282-V455 HydrophobicContact CE2-CG2 4.22Å; V438-V455 HydrophobicContact CG2-CG2 3.73Å; V455-I457 HydrophobicContact CG1-CG1 4.41Å; V455-F480 HydrophobicContact CG1-CB 3.89Å; V455-F480 HydrophobicContact CG1-CD1 4.24Å; V455-T481 WeakPolarHBondContact CA-O 3.3Å
456	D	84.2	Confident	76.7	Confident	44 Å²	44	73.6 Å²	73.6	24%	0.235	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	137.6	167.4	-62.4	-52.2	0	0	0	108.3	T481 R483 K620	D456-T481 WeakPolarHBondContact CB-OG1 3.42Å; D456-T481 PolarHBondContact N-O 3.41Å; D456-T481 VanDerWaalsContact N-O 3.1Å; D456-T481 PolarHBondContact O-N 2.89Å; D456-T481 PolarHBondContact O-OG1 3.27Å; D456-R483 IonicContact OD2-CZ 3Å; D456-R483 IonicContact OD2-NE 3.76Å; D456-R483 PolarHBondContact OD2-NE 2.91Å; D456-R483 IonicContact OD2-NH2 3.73Å; D456-R483 PolarHBondContact OD2-NH2 3.13Å; D456-K620 IonicContact OD1-NZ 2.78Å; D456-K620 PolarHBondContact OD1-NZ 3.38Å; D456-K620 IonicContact OD2-NZ 3.5Å; D456-K620 PolarHBondContact OD2-NZ 3.07Å
457	I	86.2	Confident	75.8	Confident	65 Å²	65	73 Å²	73	33%	0.333	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	134.8	-179.8	-46.5	174.3	0	0	0	109.2	A430 V455 L478 V479 F480	A430-I457 HydrophobicContact CB-CD1 3.75Å; A430-I457 HydrophobicContact CB-CG2 4.28Å; V455-I457 HydrophobicContact CG1-CG1 4.41Å; I457-L478 HydrophobicContact CG2-CD1 3.69Å; I457-L478 HydrophobicContact CG2-CD2 4.09Å; I457-L478 HydrophobicContact CG2-CG 3.74Å; I457-V479 WeakPolarHBondContact CA-O 3.41Å; I457-F480 HydrophobicContact CD1-CD1 4.06Å; I457-F480 HydrophobicContact CD1-CE1 3.88Å; I457-F480 HydrophobicContact CG1-CD1 3.84Å; I457-F480 HydrophobicContact CG1-CE1 4.13Å; I457-F480 HydrophobicContact CG2-CD1 4.03Å; I457-F480 HydrophobicContact CG2-CE1 3.95Å; I457-F480 HydrophobicContact CG2-CZ 4.44Å
458	K	86.5	Confident	75.2	Confident	137 Å²	137	71.7 Å²	71.7	60%	0.596	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.8	125	-179.3	-178	-177.8	175.9	-171.6	0	111.5	I460 V479	K458-I460 HydrophobicContact CD-CD1 4.36Å; K458-I460 HydrophobicContact CD-CG1 4.37Å; K458-I460 HydrophobicContact CG-CG1 4.24Å; K458-V479 PolarHBondContact N-O 2.56Å; K458-V479 PolarHBondContact O-N 2.92Å
459	S	82.5	Confident	74.3	Confident	92 Å²	92	72 Å²	72	64%	0.643	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	141.1	168.4	48.7	0	0	0	0	111.4
460	I	83.1	Confident	73.2	Confident	65 Å²	65	76 Å²	76	33%	0.333	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	146	179.5	-59.7	-168.4	0	0	0	108.4	K458 I462 G477 V479	K458-I460 HydrophobicContact CD-CD1 4.36Å; K458-I460 HydrophobicContact CD-CG1 4.37Å; K458-I460 HydrophobicContact CG-CG1 4.24Å; I460-I462 HydrophobicContact CG2-CG1 4.23Å; I460-G477 PolarHBondContact N-O 3.2Å; I460-G477 CarbonylContact O-C 3.5Å; I460-G477 WeakPolarHBondContact O-CA 3.36Å; I460-G477 PolarHBondContact O-N 2.73Å; I460-V479 HydrophobicContact CD1-CB 4.43Å; I460-V479 HydrophobicContact CD1-CG2 3.51Å; I460-V479 HydrophobicContact CG1-CG2 4.01Å
461	E	79.8	Confident	72.1	Confident	117 Å²	117	75.3 Å²	75.3	55%	0.547	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	131.2	164.6	-70.3	-175.2	-163.4	0	0	110.3	T423 H474	T423-E461 HydrophobicContact CG2-CG 4.47Å; E461-H474 IonicContact OE2-CE1 2.98Å; E461-H474 IonicContact OE2-CG 3.56Å; E461-H474 IonicContact OE2-ND1 3.41Å; E461-H474 PolarHBondContact OE2-ND1 3.04Å
462	I	77.2	Confident	71.3	Confident	42 Å²	42	81.1 Å²	81.1	22%	0.215	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	120.3	-179.8	-67.7	165.7	0	0	0	108.7	T416 T418 I460 H475	T416-I462 HydrophobicContact CG2-CD1 3.98Å; T418-I462 HydrophobicContact CG2-CD1 3.4Å; T418-I462 VanDerWaalsContact CG2-CD1 3.4Å; I460-I462 HydrophobicContact CG2-CG1 4.23Å; I462-H475 PolarHBondContact N-O 2.9Å; I462-H475 PolarHBondContact O-N 3.37Å
463	Q	72.4	Confident	70.9	Confident	99 Å²	99	87.4 Å²	87.4	46%	0.463	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	113.4	-176.9	-178.4	169.8	89.2	0	0	110.9	K472 R473 H474	Q463-K472 HydrophobicContact CG-CB 4.49Å; Q463-R473 WeakPolarHBondContact CA-O 3.05Å; Q463-H474 PolarHBondContact NE2-NE2 3.1Å
464	T	63.8	Low	71.2	Confident	64 Å²	64	86.4 Å²	86.4	39%	0.393	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	106.2	170.7	62	0	0	0	0	108.9	R473 H475	T464-R473 PolarHBondContact N-O 2.99Å; T464-R473 PolarHBondContact O-N 3.45Å; T464-R473 PolarHBondContact OG1-O 2.94Å; T464-H475 PolarHBondContact OG1-CD2 2.95Å; T464-H475 VanDerWaalsContact OG1-CD2 3.27Å; T464-H475 PolarHBondContact OG1-NE2 2.89Å
465	G	54	Low	71.5	Confident	34 Å²	34	87.2 Å²	87.2	35%	0.351	47%	0.465	S	S	.	.			trans	-165.6	50.7	-165.1	0	0	0	0	0	115.5	S467	G465-S467 VanDerWaalsContact C-N 3.28Å; G465-S467 PolarHBondContact O-N 2.63Å
466	Y	56.3	Low	71.9	Confident	212 Å²	212	87.3 Å²	87.3	83%	0.831	47%	0.466	S	S	*	.	S	Bend	trans	-75.7	-6.6	179.7	-64.1	-78.4	0	0	0	115.1
467	S	49.5	Very low	72.2	Confident	45 Å²	45	85.3 Å²	85.3	32%	0.315	46%	0.455	S	S	.	.	S	Bend	trans	-128.1	134.4	176.4	-178.9	0	0	0	0	110.4	G465 S469 T470	G465-S467 VanDerWaalsContact C-N 3.28Å; G465-S467 PolarHBondContact O-N 2.63Å; S467-S469 PolarHBondContact O-N 2.71Å; S467-S469 PolarHBondContact OG-N 2.88Å; S467-S469 PolarHBondContact OG-OG 3.41Å; S467-T470 PolarHBondContact O-N 2.92Å
468	P	59.4	Low	72.4	Confident	139 Å²	139	82.4 Å²	82.4	90%	0.903	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-13.9	177.4	29.5	-35.9	0	0	0	113.8
469	S	59.4	Low	72.7	Confident	106 Å²	106	76.5 Å²	76.5	74%	0.741	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-14.5	180	58.1	0	0	0	0	114.8	S467	S467-S469 PolarHBondContact O-N 2.71Å; S467-S469 PolarHBondContact OG-N 2.88Å; S467-S469 PolarHBondContact OG-OG 3.41Å
470	T	60.8	Low	73.2	Confident	90 Å²	90	72.1 Å²	72.1	55%	0.552	39%	0.386	S	S	*	.	S	Bend	trans	-93.9	130.7	176.2	-54.1	0	0	0	0	108.8	S467 K472	S467-T470 PolarHBondContact O-N 2.92Å; T470-K472 PolarHBondContact O-N 3.18Å
471	S	60.4	Low	73.6	Confident	102 Å²	102	70.2 Å²	70.2	71%	0.713	38%	0.377	S	S	*	.			trans	-54.2	125.9	178.2	-170.4	0	0	0	0	110.7	R473	S471-R473 PolarHBondContact O-N 3.37Å; S471-R473 VanDerWaalsContact O-N 3.09Å
472	K	66.5	Low	74	Confident	136 Å²	136	64.6 Å²	64.6	59%	0.591	35%	0.351	S	S	*	.			trans	-63.2	108.4	-175.9	-67.5	176.5	175.3	-175.5	0	109.4	Q463 T470	Q463-K472 HydrophobicContact CG-CB 4.49Å; T470-K472 PolarHBondContact O-N 3.18Å
473	R	71.6	Confident	74.6	Confident	146 Å²	146	64.5 Å²	64.5	55%	0.551	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	127.3	176.6	-72.1	-175.4	178.8	-156.6	-4.5	109.7	T422 Q463 T464 S471	T422-R473 HydrophobicContact CG2-CB 4.15Å; T422-R473 HydrophobicContact CG2-CG 4.09Å; Q463-R473 WeakPolarHBondContact CA-O 3.05Å; T464-R473 PolarHBondContact N-O 2.99Å; T464-R473 PolarHBondContact O-N 3.45Å; T464-R473 PolarHBondContact OG1-O 2.94Å; S471-R473 PolarHBondContact O-N 3.37Å; S471-R473 VanDerWaalsContact O-N 3.09Å
474	H	81.1	Confident	75.3	Confident	71 Å²	71	59.8 Å²	59.8	33%	0.329	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	128.5	170	-73.8	-126.5	0	0	0	107.2	T422 T423 E461 Q463	T422-H474 CarbonylContact C-O 3.54Å; T422-H474 WeakPolarHBondContact CA-O 3.37Å; T422-H474 WeakPolarHBondContact CB-O 3.43Å; T423-H474 PolarHBondContact N-O 3.26Å; T423-H474 VanDerWaalsContact OG1-C 3.27Å; T423-H474 PolarHBondContact OG1-O 2.99Å; E461-H474 IonicContact OE2-CE1 2.98Å; E461-H474 IonicContact OE2-CG 3.56Å; E461-H474 IonicContact OE2-ND1 3.41Å; E461-H474 PolarHBondContact OE2-ND1 3.04Å; Q463-H474 PolarHBondContact NE2-NE2 3.1Å
475	H	85.8	Confident	76.6	Confident	17 Å²	17	57.6 Å²	57.6	8%	0.079	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	137.6	175.7	-64.2	-103.5	0	0	0	108.5	C419 D420 R421 I462 T464	C419-H475 PolarHBondContact O-ND1 3.08Å; D420-H475 PolarHBondContact O-CE1 2.8Å; D420-H475 VanDerWaalsContact O-CE1 3.31Å; R421-H475 PolarHBondContact O-ND1 2.85Å; I462-H475 PolarHBondContact N-O 2.9Å; I462-H475 PolarHBondContact O-N 3.37Å; T464-H475 PolarHBondContact OG1-CD2 2.95Å; T464-H475 VanDerWaalsContact OG1-CD2 3.27Å; T464-H475 PolarHBondContact OG1-NE2 2.89Å
476	P	89.1	Confident	78.3	Confident	10 Å²	10	56.7 Å²	56.7	7%	0.065	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	143.3	173.2	33	-35.5	0	0	0	109.4	C419 V426 L428	C419-P476 WeakPolarHBondContact SG-CG 3.36Å; V426-P476 HydrophobicContact CB-CG 4.29Å; V426-P476 HydrophobicContact CG1-CG 4.21Å; L428-P476 HydrophobicContact CB-CB 4.34Å; L428-P476 HydrophobicContact CD1-CB 4.32Å; L428-P476 HydrophobicContact CD1-CG 4.29Å; L428-P476 WeakPolarHBondContact CD1-O 3.38Å; L428-P476 HydrophobicContact CG-CB 3.96Å; L428-P476 HydrophobicContact CG-CG 3.91Å
477	G	90	Very high	79.8	Confident	2 Å²	2	53.5 Å²	53.5	2%	0.021	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	148	175.2	0	0	0	0	0	111.1	I417 I460	I417-G477 CarbonylContact O-C 3.56Å; I417-G477 WeakPolarHBondContact O-CA 3.19Å; I460-G477 PolarHBondContact N-O 3.2Å; I460-G477 CarbonylContact O-C 3.5Å; I460-G477 WeakPolarHBondContact O-CA 3.36Å; I460-G477 PolarHBondContact O-N 2.73Å
478	L	91.3	Very high	81.7	Confident	5 Å²	5	51.8 Å²	51.8	3%	0.026	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	121.4	177.7	-162	65.2	0	0	0	108.8	L278 I417 L428 I457 F480	L278-L478 HydrophobicContact CB-CD2 3.93Å; L278-L478 HydrophobicContact CD1-CB 4.22Å; L278-L478 HydrophobicContact CD1-CD2 3.94Å; L278-L478 HydrophobicContact CG-CD2 4.36Å; I417-L478 PolarHBondContact N-O 2.97Å; I417-L478 PolarHBondContact O-N 2.72Å; L428-L478 HydrophobicContact CB-CB 4.41Å; I457-L478 HydrophobicContact CG2-CD1 3.69Å; I457-L478 HydrophobicContact CG2-CD2 4.09Å; I457-L478 HydrophobicContact CG2-CG 3.74Å; L478-F480 HydrophobicContact CB-CE2 4.11Å; L478-F480 HydrophobicContact CD2-CE1 4.27Å; L478-F480 HydrophobicContact CD2-CE2 3.8Å; L478-F480 HydrophobicContact CD2-CZ 3.46Å; L478-F480 VanDerWaalsContact CD2-CZ 3.46Å; L478-F480 HydrophobicContact CG-CE2 3.87Å; L478-F480 HydrophobicContact CG-CZ 3.96Å
479	V	92.8	Very high	83.1	Confident	13 Å²	13	47.2 Å²	47.2	8%	0.079	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	121.8	-177.3	-174.7	0	0	0	0	109.3	V415 T416 I457 K458 I460 T481	V415-V479 WeakPolarHBondContact O-CA 3.36Å; T416-V479 HydrophobicContact CG2-CG2 4.05Å; I457-V479 WeakPolarHBondContact CA-O 3.41Å; K458-V479 PolarHBondContact N-O 2.56Å; K458-V479 PolarHBondContact O-N 2.92Å; I460-V479 HydrophobicContact CD1-CB 4.43Å; I460-V479 HydrophobicContact CD1-CG2 3.51Å; I460-V479 HydrophobicContact CG1-CG2 4.01Å; V479-T481 HydrophobicContact CG1-CG2 3.92Å
480	F	92	Very high	84.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	114.1	177.1	-62	-95.6	0	0	0	108.5	L278 L280 S414 V415 I417 S436 V455 I457 L478	L278-F480 HydrophobicContact CB-CE2 4.45Å; L278-F480 HydrophobicContact CB-CZ 3.82Å; L280-F480 HydrophobicContact CB-CB 4.25Å; L280-F480 HydrophobicContact CB-CD1 3.6Å; L280-F480 HydrophobicContact CB-CD2 4.04Å; L280-F480 HydrophobicContact CB-CE1 3.82Å; L280-F480 HydrophobicContact CB-CE2 4.24Å; L280-F480 HydrophobicContact CB-CG 3.7Å; L280-F480 HydrophobicContact CB-CZ 4.11Å; L280-F480 HydrophobicContact CD1-CB 4.1Å; L280-F480 HydrophobicContact CD1-CD2 3.89Å; L280-F480 HydrophobicContact CD1-CG 4.02Å; L280-F480 HydrophobicContact CD2-CB 4.2Å; L280-F480 HydrophobicContact CG-CB 4.42Å; L280-F480 HydrophobicContact CG-CG 4.3Å; S414-F480 CarbonylContact C-O 3.53Å; S414-F480 WeakPolarHBondContact CA-O 3.43Å; V415-F480 PolarHBondContact N-O 3.13Å; V415-F480 PolarHBondContact O-N 3.36Å; I417-F480 HydrophobicContact CD1-CD2 3.95Å; I417-F480 HydrophobicContact CD1-CE2 3.68Å; S436-F480 VanDerWaalsContact OG-CE1 3.22Å; S436-F480 WeakPolarHBondContact OG-CE1 3.48Å; V455-F480 HydrophobicContact CG1-CB 3.89Å; V455-F480 HydrophobicContact CG1-CD1 4.24Å; I457-F480 HydrophobicContact CD1-CD1 4.06Å; I457-F480 HydrophobicContact CD1-CE1 3.88Å; I457-F480 HydrophobicContact CG1-CD1 3.84Å; I457-F480 HydrophobicContact CG1-CE1 4.13Å; I457-F480 HydrophobicContact CG2-CD1 4.03Å; I457-F480 HydrophobicContact CG2-CE1 3.95Å; I457-F480 HydrophobicContact CG2-CZ 4.44Å; L478-F480 HydrophobicContact CB-CE2 4.11Å; L478-F480 HydrophobicContact CD2-CE1 4.27Å; L478-F480 HydrophobicContact CD2-CE2 3.8Å; L478-F480 HydrophobicContact CD2-CZ 3.46Å; L478-F480 VanDerWaalsContact CD2-CZ 3.46Å; L478-F480 HydrophobicContact CG-CE2 3.87Å; L478-F480 HydrophobicContact CG-CZ 3.96Å
481	T	91.7	Very high	86.1	Confident	24 Å²	24	45.5 Å²	45.5	15%	0.147	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	116.1	-178.1	65.9	0	0	0	0	111.7	L413 V455 D456 V479	L413-T481 WeakPolarHBondContact O-CA 3.36Å; V455-T481 WeakPolarHBondContact CA-O 3.3Å; D456-T481 WeakPolarHBondContact CB-OG1 3.42Å; D456-T481 PolarHBondContact N-O 3.41Å; D456-T481 VanDerWaalsContact N-O 3.1Å; D456-T481 PolarHBondContact O-N 2.89Å; D456-T481 PolarHBondContact O-OG1 3.27Å; V479-T481 HydrophobicContact CG1-CG2 3.92Å
482	S	89.3	Confident	87.5	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	126.2	172.5	169.4	0	0	0	0	110.4	F282 L413 V438	F282-S482 VanDerWaalsContact CE2-CB 3.43Å; L413-S482 WeakPolarHBondContact CB-O 3.18Å; L413-S482 PolarHBondContact N-O 3.47Å; L413-S482 PolarHBondContact O-N 3.17Å; V438-S482 WeakPolarHBondContact CG2-OG 3.29Å
483	R	88.7	Confident	88.8	Confident	39 Å²	39	41 Å²	41	15%	0.147	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	133	-175.9	-56.3	-156.3	-178.3	-106.6	-16.8	112.1	D412 F452 H454 D456 M617	D412-R483 VanDerWaalsContact CG-CZ 3.48Å; D412-R483 WeakPolarHBondContact OD1-CD 3.4Å; D412-R483 WeakPolarHBondContact OD1-CG 3.48Å; D412-R483 IonicContact OD1-CZ 3.89Å; D412-R483 VanDerWaalsContact OD1-CZ 3.25Å; D412-R483 IonicContact OD1-NE 3.74Å; D412-R483 IonicContact OD1-NH1 3.77Å; D412-R483 PolarHBondContact OD1-NH1 3.43Å; D412-R483 IonicContact OD2-CZ 2.86Å; D412-R483 IonicContact OD2-NH1 3.88Å; D412-R483 PolarHBondContact OD2-NH1 3.39Å; D412-R483 IonicContact OD2-NH2 3.68Å; D412-R483 PolarHBondContact OD2-NH2 3.46Å; D412-R483 VanDerWaalsContact OD2-NH2 3.13Å; F452-R483 HydrophobicContact CB-CB 4.33Å; F452-R483 HydrophobicContact CD2-CB 3.78Å; F452-R483 WeakPolarHBondContact CD2-O 3.25Å; F452-R483 HydrophobicContact CG-CB 4.5Å; F452-R483 PolarHBondContact N-O 3.23Å; H454-R483 WeakPolarHBondContact NE2-CD 3.46Å; D456-R483 IonicContact OD2-CZ 3Å; D456-R483 IonicContact OD2-NE 3.76Å; D456-R483 PolarHBondContact OD2-NE 2.91Å; D456-R483 IonicContact OD2-NH2 3.73Å; D456-R483 PolarHBondContact OD2-NH2 3.13Å; R483-M617 VanDerWaalsContact CD-SD 3.57Å
484	S	88.5	Confident	89.7	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.007	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	120	177.8	-66.6	0	0	0	0	112	C410 Q411	C410-S484 CarbonylContact C-O 3.3Å; C410-S484 WeakPolarHBondContact CA-O 3.37Å; Q411-S484 PolarHBondContact N-O 2.97Å; Q411-S484 PolarHBondContact O-N 2.79Å
485	A	89.4	Confident	90.2	Very high	17 Å²	17	34.6 Å²	34.6	14%	0.14	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	136.2	175.1	0	0	0	0	0	112	K450 F452	K450-A485 PolarHBondContact N-O 3.3Å; K450-A485 PolarHBondContact O-N 3.44Å; F452-A485 HydrophobicContact CE2-CB 3.7Å; F452-A485 HydrophobicContact CZ-CB 3.97Å
486	R	89.7	Confident	90.5	Very high	16 Å²	16	35.7 Å²	35.7	6%	0.06	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	140.2	179.1	-163.6	-179.9	-61.1	-95.4	7.4	112.2	T290 D409 W449 S488	T290-R486 PolarHBondContact OG1-NH1 3Å; T290-R486 PolarHBondContact OG1-NH2 3.47Å; D409-R486 PolarHBondContact O-N 2.89Å; D409-R486 WeakPolarHBondContact OD1-CD 3.35Å; D409-R486 IonicContact OD1-NE 2.83Å; D409-R486 PolarHBondContact OD1-NE 2.98Å; D409-R486 IonicContact OD2-CZ 3.25Å; D409-R486 IonicContact OD2-NE 2.71Å; D409-R486 PolarHBondContact OD2-NE 3.26Å; D409-R486 IonicContact OD2-NH2 2.63Å; D409-R486 PolarHBondContact OD2-NH2 3.41Å; W449-R486 HydrophobicContact CE3-CB 4.21Å; W449-R486 HydrophobicContact CH2-CB 4.42Å; W449-R486 VanDerWaalsContact CH2-NH2 3.29Å; W449-R486 VanDerWaalsContact CZ2-CZ 3.49Å; W449-R486 HydrophobicContact CZ3-CB 3.96Å; W449-R486 HydrophobicContact CZ3-CG 4.49Å; R486-S488 PolarHBondContact O-N 2.82Å
487	R	89	Confident	90.7	Very high	144 Å²	144	39.6 Å²	39.6	54%	0.543	20%	0.203	S	C	.	.			trans	-77.6	82.2	171.2	-63.3	-147.4	-163.4	-135.6	4.6	110.8	S446 Q447 E448 G489	S446-R487 VanDerWaalsContact O-CZ 3.3Å; S446-R487 PolarHBondContact O-NE 3.05Å; S446-R487 PolarHBondContact O-NH2 3.06Å; Q447-R487 WeakPolarHBondContact O-CD 3.4Å; Q447-R487 WeakPolarHBondContact O-CG 3.46Å; Q447-R487 PolarHBondContact O-NE 3.36Å; E448-R487 WeakPolarHBondContact O-CB 3.16Å; E448-R487 PolarHBondContact O-N 3.5Å; R487-G489 PolarHBondContact O-N 3.36Å
488	S	88.4	Confident	90.8	Very high	10 Å²	10	43.2 Å²	43.2	7%	0.07	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-15.4	-174.7	70.2	0	0	0	0	117	P407 F408 R486 Y490 F491 L492	P407-S488 WeakPolarHBondContact O-CB 3.15Å; F408-S488 WeakPolarHBondContact CE1-OG 3.27Å; R486-S488 PolarHBondContact O-N 2.82Å; S488-Y490 PolarHBondContact O-N 3.5Å; S488-F491 PolarHBondContact O-N 3.47Å; S488-L492 WeakPolarHBondContact O-CG 3.47Å; S488-L492 PolarHBondContact O-N 2.66Å
489	G	89.9	Confident	90.9	Very high	42 Å²	42	43 Å²	43	43%	0.433	22%	0.22	S	C	.	.	H	α-helix	trans	-57.4	-42.3	-172.5	0	0	0	0	0	114.6	R487 F491 L492 V493	R487-G489 PolarHBondContact O-N 3.36Å; G489-F491 PolarHBondContact O-N 3.11Å; G489-L492 PolarHBondContact O-N 3.29Å; G489-V493 PolarHBondContact O-N 3.36Å
490	Y	90.6	Very high	90.8	Very high	140 Å²	140	44 Å²	44	55%	0.549	23%	0.227	S	C	.	.	H	α-helix	trans	-58	-49.7	176.8	174.2	-88.5	0	0	0	111.6	S488 L492 V493 N494	S488-Y490 PolarHBondContact O-N 3.5Å; Y490-L492 VanDerWaalsContact C-N 3.35Å; Y490-L492 PolarHBondContact O-N 2.79Å; Y490-V493 PolarHBondContact O-N 3.12Å; Y490-N494 WeakPolarHBondContact CD2-ND2 3.46Å; Y490-N494 HydrophobicContact CE1-CB 4.4Å; Y490-N494 WeakPolarHBondContact CE2-ND2 3.5Å; Y490-N494 WeakPolarHBondContact O-CB 3.45Å; Y490-N494 PolarHBondContact O-N 2.8Å
491	F	91.3	Very high	90.9	Very high	21 Å²	21	47.7 Å²	47.7	9%	0.092	25%	0.249	C	C	.	.	H	α-helix	trans	-70.4	-30.2	-177.9	-62.4	-79.9	0	0	0	112.9	F406 P407 S488 G489 M495 I496	F406-F491 HydrophobicContact CE1-CD1 4.01Å; F406-F491 HydrophobicContact CE1-CE1 4.21Å; F406-F491 HydrophobicContact CE1-CG 4.43Å; F406-F491 HydrophobicContact CE2-CZ 4.43Å; F406-F491 AromaticContact CZ-CD1 3.81Å; F406-F491 HydrophobicContact CZ-CD1 3.81Å; F406-F491 HydrophobicContact CZ-CD2 4.47Å; F406-F491 AromaticContact CZ-CE1 3.59Å; F406-F491 HydrophobicContact CZ-CE1 3.59Å; F406-F491 HydrophobicContact CZ-CE2 4.28Å; F406-F491 HydrophobicContact CZ-CG 4.26Å; F406-F491 AromaticContact CZ-CZ 3.85Å; F406-F491 HydrophobicContact CZ-CZ 3.85Å; P407-F491 HydrophobicContact CB-CB 3.49Å; P407-F491 VanDerWaalsContact CB-CB 3.49Å; P407-F491 HydrophobicContact CB-CD2 3.88Å; P407-F491 HydrophobicContact CB-CG 3.77Å; P407-F491 HydrophobicContact CG-CB 3.71Å; S488-F491 PolarHBondContact O-N 3.47Å; G489-F491 PolarHBondContact O-N 3.11Å; F491-M495 HydrophobicContact CD1-CE 3.79Å; F491-M495 HydrophobicContact CD1-SD 3.87Å; F491-M495 HydrophobicContact CE1-CE 3.87Å; F491-M495 HydrophobicContact CE1-SD 4.46Å; F491-M495 WeakPolarHBondContact O-CB 3.41Å; F491-M495 PolarHBondContact O-N 2.91Å; F491-M495 VanDerWaalsContact O-N 3.09Å; F491-I496 PolarHBondContact O-N 3.41Å
492	L	91.5	Very high	91	Very high	59 Å²	59	47.6 Å²	47.6	31%	0.309	25%	0.248	S	C	.	.	I	π-helix	trans	-63.6	-45.3	174.2	-75.2	163.2	0	0	0	111.8	F408 S488 G489 Y490 I496 L497	F408-L492 HydrophobicContact CE1-CD1 4.08Å; F408-L492 HydrophobicContact CE2-CD2 4.15Å; F408-L492 HydrophobicContact CZ-CD1 3.82Å; F408-L492 HydrophobicContact CZ-CD2 3.76Å; F408-L492 HydrophobicContact CZ-CG 4.18Å; S488-L492 WeakPolarHBondContact O-CG 3.47Å; S488-L492 PolarHBondContact O-N 2.66Å; G489-L492 PolarHBondContact O-N 3.29Å; Y490-L492 VanDerWaalsContact C-N 3.35Å; Y490-L492 PolarHBondContact O-N 2.79Å; L492-I496 HydrophobicContact CD2-CD1 3.86Å; L492-L497 WeakPolarHBondContact O-CB 3.45Å; L492-L497 PolarHBondContact O-N 2.95Å
493	V	92.2	Very high	91.2	Very high	83 Å²	83	47.7 Å²	47.7	50%	0.503	25%	0.248	S	C	.	.	I	π-helix	trans	-80.1	-49.7	-179.9	-179.8	0	0	0	0	111.7	G489 Y490 M495 L497	G489-V493 PolarHBondContact O-N 3.36Å; Y490-V493 PolarHBondContact O-N 3.12Å; V493-M495 PolarHBondContact O-N 2.95Å; V493-L497 HydrophobicContact CG1-CD2 4.32Å; V493-L497 WeakPolarHBondContact O-CB 3.36Å
494	N	91.6	Very high	91.3	Very high	70 Å²	70	49.4 Å²	49.4	37%	0.374	26%	0.26	S	S	.	.	I	π-helix	trans	-86.3	-8	-169.7	-64.7	-26.2	0	0	0	114.2	Y490 I498	Y490-N494 WeakPolarHBondContact CD2-ND2 3.46Å; Y490-N494 HydrophobicContact CE1-CB 4.4Å; Y490-N494 WeakPolarHBondContact CE2-ND2 3.5Å; Y490-N494 WeakPolarHBondContact O-CB 3.45Å; Y490-N494 PolarHBondContact O-N 2.8Å; N494-I498 WeakPolarHBondContact O-CD1 3.48Å
495	M	91.8	Very high	91.5	Very high	14 Å²	14	53.5 Å²	53.5	7%	0.069	28%	0.281	C	S	.	.	I	π-helix	trans	-127.3	-57.9	174.4	-59	-170.7	-171.5	0	0	113.1	F491 V493 S499 F532 A536 N539 L549	F491-M495 HydrophobicContact CD1-CE 3.79Å; F491-M495 HydrophobicContact CD1-SD 3.87Å; F491-M495 HydrophobicContact CE1-CE 3.87Å; F491-M495 HydrophobicContact CE1-SD 4.46Å; F491-M495 WeakPolarHBondContact O-CB 3.41Å; F491-M495 PolarHBondContact O-N 2.91Å; F491-M495 VanDerWaalsContact O-N 3.09Å; V493-M495 PolarHBondContact O-N 2.95Å; M495-S499 WeakPolarHBondContact O-CB 3.18Å; M495-S499 PolarHBondContact O-N 3.09Å; M495-F532 HydrophobicContact CB-CZ 3.96Å; M495-F532 HydrophobicContact CG-CZ 4.41Å; M495-F532 VanDerWaalsContact O-CZ 3.28Å; M495-F532 WeakPolarHBondContact O-CZ 3.38Å; M495-A536 HydrophobicContact SD-CB 4.35Å; M495-N539 HydrophobicContact CE-CB 4.29Å; M495-N539 WeakPolarHBondContact CE-ND2 3.35Å; M495-L549 HydrophobicContact CB-CD1 3.88Å; M495-L549 HydrophobicContact CG-CD1 4.35Å; M495-L549 HydrophobicContact SD-CD1 3.59Å; M495-L549 VanDerWaalsContact SD-CD1 3.59Å; M495-L549 HydrophobicContact SD-CD2 4.43Å
496	I	92.4	Very high	91.6	Very high	39 Å²	39	52.8 Å²	52.8	20%	0.2	28%	0.275	C	S	.	.	I	π-helix	trans	-67.9	-46.8	-173.2	-70.6	166.1	0	0	0	111.6	P407 F491 L492 S499 C500 V552	P407-I496 HydrophobicContact CG-CD1 4.29Å; F491-I496 PolarHBondContact O-N 3.41Å; L492-I496 HydrophobicContact CD2-CD1 3.86Å; I496-S499 PolarHBondContact O-N 3.35Å; I496-C500 WeakPolarHBondContact O-CB 3.39Å; I496-C500 PolarHBondContact O-N 2.86Å; I496-V552 HydrophobicContact CG2-CG1 4.44Å
497	L	92.5	Very high	91.7	Very high	93 Å²	93	53.1 Å²	53.1	49%	0.487	28%	0.277	S	S	.	.	I	π-helix	trans	-63.5	-45.6	176.8	175.8	65.9	0	0	0	111.9	L492 V493 S499 C500 V501	L492-L497 WeakPolarHBondContact O-CB 3.45Å; L492-L497 PolarHBondContact O-N 2.95Å; V493-L497 HydrophobicContact CG1-CD2 4.32Å; V493-L497 WeakPolarHBondContact O-CB 3.36Å; L497-S499 VanDerWaalsContact C-N 3.35Å; L497-S499 PolarHBondContact O-N 3.45Å; L497-C500 WeakPolarHBondContact O-CB 3.5Å; L497-C500 PolarHBondContact O-N 2.81Å; L497-V501 HydrophobicContact CD1-CG2 4.17Å; L497-V501 HydrophobicContact CG-CG2 4.45Å; L497-V501 WeakPolarHBondContact O-CG2 3.27Å; L497-V501 PolarHBondContact O-N 3.43Å
498	I	92.6	Very high	91.7	Very high	77 Å²	77	49 Å²	49	40%	0.395	27%	0.27	S	S	.	.	H	α-helix	trans	-60	-44.7	177.5	-63.6	-174.4	0	0	0	111.1	N494 C500 V501 L502 F532	N494-I498 WeakPolarHBondContact O-CD1 3.48Å; I498-C500 VanDerWaalsContact C-N 3.34Å; I498-C500 PolarHBondContact O-N 2.85Å; I498-V501 PolarHBondContact O-N 2.91Å; I498-L502 HydrophobicContact CG2-CD1 4.44Å; I498-L502 WeakPolarHBondContact O-CG 3.34Å; I498-L502 PolarHBondContact O-N 3.32Å; I498-F532 HydrophobicContact CB-CE2 4.35Å; I498-F532 HydrophobicContact CG2-CD2 4.28Å; I498-F532 HydrophobicContact CG2-CE2 4.13Å
499	S	92.1	Very high	91.7	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.007	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-38.8	177.3	-164	0	0	0	0	112.4	M495 I496 L497 L502 C503 N556	M495-S499 WeakPolarHBondContact O-CB 3.18Å; M495-S499 PolarHBondContact O-N 3.09Å; I496-S499 PolarHBondContact O-N 3.35Å; L497-S499 VanDerWaalsContact C-N 3.35Å; L497-S499 PolarHBondContact O-N 3.45Å; S499-L502 PolarHBondContact O-N 2.94Å; S499-C503 PolarHBondContact O-N 2.83Å; S499-N556 VanDerWaalsContact C-ND2 3.31Å; S499-N556 WeakPolarHBondContact CB-ND2 3.36Å; S499-N556 PolarHBondContact O-ND2 3.36Å; S499-N556 PolarHBondContact OG-ND2 3.23Å
500	C	92.5	Very high	91.6	Very high	34 Å²	34	47.6 Å²	47.6	23%	0.23	25%	0.251	C	S	.	.	H	α-helix	trans	-64.4	-44.4	173.7	-173.6	0	0	0	0	111.9	I496 L497 I498 L502 C503 L504	I496-C500 WeakPolarHBondContact O-CB 3.39Å; I496-C500 PolarHBondContact O-N 2.86Å; L497-C500 WeakPolarHBondContact O-CB 3.5Å; L497-C500 PolarHBondContact O-N 2.81Å; I498-C500 VanDerWaalsContact C-N 3.34Å; I498-C500 PolarHBondContact O-N 2.85Å; C500-L502 VanDerWaalsContact C-N 3.34Å; C500-L502 PolarHBondContact O-N 3.49Å; C500-C503 PolarHBondContact O-N 2.85Å; C500-C503 VanDerWaalsContact O-N 3.12Å; C500-L504 WeakPolarHBondContact O-CG 3.47Å; C500-L504 PolarHBondContact O-N 3.48Å
501	V	93.4	Very high	91.4	Very high	78 Å²	78	46 Å²	46	47%	0.473	26%	0.261	S	S	.	.	H	α-helix	trans	-62.2	-39	176.9	169.8	0	0	0	0	111.7	L497 I498 C503 L504 L505	L497-V501 HydrophobicContact CD1-CG2 4.17Å; L497-V501 HydrophobicContact CG-CG2 4.45Å; L497-V501 WeakPolarHBondContact O-CG2 3.27Å; L497-V501 PolarHBondContact O-N 3.43Å; I498-V501 PolarHBondContact O-N 2.91Å; V501-C503 VanDerWaalsContact C-N 3.33Å; V501-C503 PolarHBondContact O-N 3.09Å; V501-L504 PolarHBondContact O-N 3.48Å; V501-L505 WeakPolarHBondContact O-CB 3.25Å; V501-L505 PolarHBondContact O-N 2.94Å
502	L	93.7	Very high	91.2	Very high	22 Å²	22	47.1 Å²	47.1	12%	0.115	27%	0.269	C	S	.	.	H	α-helix	trans	-61.6	-40.4	173.1	-71.7	172.1	0	0	0	112.2	I498 S499 C500 S506 T528 F532	I498-L502 HydrophobicContact CG2-CD1 4.44Å; I498-L502 WeakPolarHBondContact O-CG 3.34Å; I498-L502 PolarHBondContact O-N 3.32Å; S499-L502 PolarHBondContact O-N 2.94Å; C500-L502 VanDerWaalsContact C-N 3.34Å; C500-L502 PolarHBondContact O-N 3.49Å; L502-S506 PolarHBondContact O-N 3.03Å; L502-T528 HydrophobicContact CD1-CG2 4.03Å; L502-T528 HydrophobicContact CD2-CG2 3.69Å; L502-F532 HydrophobicContact CD1-CB 4.45Å
503	C	92.8	Very high	90.6	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.007	28%	0.28	C	S	.	.	H	α-helix	trans	-70.2	-40.3	176.8	-160.6	0	0	0	0	112	S499 C500 V501 S506 F507 N556 Y595	S499-C503 PolarHBondContact O-N 2.83Å; C500-C503 PolarHBondContact O-N 2.85Å; C500-C503 VanDerWaalsContact O-N 3.12Å; V501-C503 VanDerWaalsContact C-N 3.33Å; V501-C503 PolarHBondContact O-N 3.09Å; C503-S506 WeakPolarHBondContact O-CB 3.4Å; C503-S506 PolarHBondContact O-N 2.84Å; C503-S506 PolarHBondContact O-OG 2.79Å; C503-F507 WeakPolarHBondContact O-CD2 3.38Å; C503-N556 HydrophobicContact CB-CB 4.25Å; C503-Y595 HydrophobicContact CB-CE1 4.23Å; C503-Y595 HydrophobicContact CB-CE2 4.13Å; C503-Y595 WeakPolarHBondContact CB-OH 3.26Å; C503-Y595 WeakPolarHBondContact SG-CE2 3.35Å
504	L	92.6	Very high	89.8	Confident	76 Å²	76	44.6 Å²	44.6	40%	0.398	26%	0.259	S	S	.	.	H	α-helix	trans	-66.9	-41.4	175.7	-70.5	173.9	0	0	0	112.3	C500 V501 S506 F507 L592 Y595	C500-L504 WeakPolarHBondContact O-CG 3.47Å; C500-L504 PolarHBondContact O-N 3.48Å; V501-L504 PolarHBondContact O-N 3.48Å; L504-S506 PolarHBondContact O-N 2.85Å; L504-F507 PolarHBondContact O-N 3.04Å; L504-F507 VanDerWaalsContact O-N 3.1Å; L504-L592 HydrophobicContact CD2-CD1 4.23Å; L504-Y595 HydrophobicContact CD2-CD1 4.14Å; L504-Y595 HydrophobicContact CD2-CE1 3.95Å; L504-Y595 HydrophobicContact CG-CE1 4.22Å
505	L	92.5	Very high	88.8	Confident	87 Å²	87	46.6 Å²	46.6	46%	0.455	27%	0.269	S	S	.	.	H	α-helix	trans	-58.2	-30.1	174.9	179.5	60.1	0	0	0	111.8	V501 F507 S508 L525	V501-L505 WeakPolarHBondContact O-CB 3.25Å; V501-L505 PolarHBondContact O-N 2.94Å; L505-F507 PolarHBondContact O-N 2.86Å; L505-S508 VanDerWaalsContact O-CB 3.28Å; L505-S508 WeakPolarHBondContact O-CB 3.22Å; L505-S508 PolarHBondContact O-N 3.36Å; L505-S508 PolarHBondContact O-OG 2.83Å; L505-L525 HydrophobicContact CD2-CD2 3.9Å; L505-L525 HydrophobicContact CG-CD2 4.23Å
506	S	91.5	Very high	88.2	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.014	29%	0.29	C	S	.	.	H	α-helix	trans	-63.2	-27.3	177.9	83.9	0	0	0	0	114.1	L502 C503 L504 S508 A509 L563	L502-S506 PolarHBondContact O-N 3.03Å; C503-S506 WeakPolarHBondContact O-CB 3.4Å; C503-S506 PolarHBondContact O-N 2.84Å; C503-S506 PolarHBondContact O-OG 2.79Å; L504-S506 PolarHBondContact O-N 2.85Å; S506-S508 PolarHBondContact O-N 3.05Å; S506-A509 VanDerWaalsContact O-CB 3.31Å; S506-A509 WeakPolarHBondContact O-CB 3.28Å; S506-A509 PolarHBondContact O-N 2.8Å; S506-A509 VanDerWaalsContact O-N 3.14Å; S506-L563 VanDerWaalsContact CB-CD2 3.41Å; S506-L563 WeakPolarHBondContact OG-CD2 3.31Å
507	F	91.1	Very high	87.9	Confident	23 Å²	23	54.7 Å²	54.7	10%	0.101	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-69.2	-17.8	173.6	-66.4	-84.7	0	0	0	113.1	C503 L504 L505 A509 F510 M588 L591 L592 Y595	C503-F507 WeakPolarHBondContact O-CD2 3.38Å; L504-F507 PolarHBondContact O-N 3.04Å; L504-F507 VanDerWaalsContact O-N 3.1Å; L505-F507 PolarHBondContact O-N 2.86Å; F507-A509 PolarHBondContact O-N 2.98Å; F507-F510 HydrophobicContact CD1-CD2 4.29Å; F507-F510 AromaticContact CD1-CE2 3.82Å; F507-F510 HydrophobicContact CD1-CE2 3.82Å; F507-F510 HydrophobicContact CE1-CE2 4.39Å; F507-F510 WeakPolarHBondContact O-CD2 3.45Å; F507-F510 PolarHBondContact O-N 3.42Å; F507-M588 HydrophobicContact CD1-CG 4.26Å; F507-L591 HydrophobicContact CE1-CB 4.02Å; F507-L591 HydrophobicContact CZ-CB 4.49Å; F507-L592 HydrophobicContact CD1-CB 4.01Å; F507-L592 HydrophobicContact CD1-CD1 4.36Å; F507-L592 HydrophobicContact CD2-CD1 3.87Å; F507-L592 HydrophobicContact CE1-CB 3.67Å; F507-L592 HydrophobicContact CE1-CD1 4.29Å; F507-L592 HydrophobicContact CE2-CD1 3.79Å; F507-L592 HydrophobicContact CG-CD1 4.16Å; F507-L592 HydrophobicContact CZ-CB 4Å; F507-L592 HydrophobicContact CZ-CD1 4.01Å; F507-Y595 HydrophobicContact CE2-CD1 4.42Å
508	S	88.5	Confident	87.7	Confident	57 Å²	57	50.6 Å²	50.6	40%	0.399	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-64.3	-23.1	171.3	72.8	0	0	0	0	113	L505 S506 F510 S511	L505-S508 VanDerWaalsContact O-CB 3.28Å; L505-S508 WeakPolarHBondContact O-CB 3.22Å; L505-S508 PolarHBondContact O-N 3.36Å; L505-S508 PolarHBondContact O-OG 2.83Å; S506-S508 PolarHBondContact O-N 3.05Å; S508-F510 PolarHBondContact O-N 3.06Å; S508-S511 VanDerWaalsContact O-CB 3.31Å; S508-S511 WeakPolarHBondContact O-CB 3.44Å; S508-S511 PolarHBondContact O-N 3.39Å
509	A	88.6	Confident	87.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-67	-17	178.1	0	0	0	0	0	113.6	S506 F507 S511 V512 R518 L521 H567	S506-A509 VanDerWaalsContact O-CB 3.31Å; S506-A509 WeakPolarHBondContact O-CB 3.28Å; S506-A509 PolarHBondContact O-N 2.8Å; S506-A509 VanDerWaalsContact O-N 3.14Å; F507-A509 PolarHBondContact O-N 2.98Å; A509-S511 VanDerWaalsContact C-N 3.28Å; A509-V512 PolarHBondContact O-N 2.75Å; A509-R518 WeakPolarHBondContact O-CD 3.25Å; A509-R518 WeakPolarHBondContact O-CG 3.27Å; A509-R518 PolarHBondContact O-NE 3.45Å; A509-R518 VanDerWaalsContact O-NE 3.12Å; A509-L521 HydrophobicContact CB-CD2 3.9Å; A509-L521 HydrophobicContact CB-CG 4.42Å; A509-H567 WeakPolarHBondContact CB-NE2 3.46Å
510	F	87.4	Confident	87.5	Confident	22 Å²	22	55.8 Å²	55.8	10%	0.096	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-70.9	-21.9	169.1	-69.6	-97.1	0	0	0	113	F507 S508 V512 L563 W566 E584 M588 L591	F507-F510 HydrophobicContact CD1-CD2 4.29Å; F507-F510 AromaticContact CD1-CE2 3.82Å; F507-F510 HydrophobicContact CD1-CE2 3.82Å; F507-F510 HydrophobicContact CE1-CE2 4.39Å; F507-F510 WeakPolarHBondContact O-CD2 3.45Å; F507-F510 PolarHBondContact O-N 3.42Å; S508-F510 PolarHBondContact O-N 3.06Å; F510-V512 PolarHBondContact O-N 3.12Å; F510-L563 HydrophobicContact CD2-CD1 4.35Å; F510-L563 HydrophobicContact CE2-CD1 3.32Å; F510-L563 HydrophobicContact CZ-CD1 3.48Å; F510-L563 VanDerWaalsContact CZ-CD1 3.48Å; F510-W566 AromaticContact CE1-CD1 3.8Å; F510-W566 AromaticContact CE1-NE1 3.69Å; F510-E584 HydrophobicContact CD1-CG 4.06Å; F510-E584 VanDerWaalsContact CD1-OE1 3.28Å; F510-E584 WeakPolarHBondContact CD1-OE1 3.47Å; F510-E584 HydrophobicContact CE1-CG 4.24Å; F510-M588 HydrophobicContact CB-CG 4.17Å; F510-M588 HydrophobicContact CB-SD 3.71Å; F510-M588 HydrophobicContact CD1-CB 3.63Å; F510-M588 HydrophobicContact CD1-CG 3.92Å; F510-M588 HydrophobicContact CD1-SD 4.46Å; F510-M588 HydrophobicContact CD2-CB 4.3Å; F510-M588 HydrophobicContact CD2-CG 3.73Å; F510-M588 HydrophobicContact CD2-SD 4.29Å; F510-M588 HydrophobicContact CE1-CB 3.67Å; F510-M588 HydrophobicContact CE1-CG 4.18Å; F510-M588 HydrophobicContact CE2-CB 4.29Å; F510-M588 HydrophobicContact CE2-CG 3.96Å; F510-M588 HydrophobicContact CG-CB 3.97Å; F510-M588 HydrophobicContact CG-CG 3.7Å; F510-M588 HydrophobicContact CG-SD 3.95Å; F510-M588 HydrophobicContact CZ-CB 4.01Å; F510-M588 HydrophobicContact CZ-CG 4.2Å; F510-L591 HydrophobicContact CZ-CD1 4.44Å
511	S	86	Confident	87.4	Confident	108 Å²	108	56.8 Å²	56.8	76%	0.755	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-76.3	-4.3	174.9	-168.7	0	0	0	0	113.4	S508 A509	S508-S511 VanDerWaalsContact O-CB 3.31Å; S508-S511 WeakPolarHBondContact O-CB 3.44Å; S508-S511 PolarHBondContact O-N 3.39Å; A509-S511 VanDerWaalsContact C-N 3.28Å
512	V	87	Confident	87.3	Confident	43 Å²	43	53.1 Å²	53.1	26%	0.261	29%	0.293	S	S	.	.	S	Bend	trans	-100.3	125.2	180	-176.8	0	0	0	0	109.2	A509 F510 E516 R518 L521	A509-V512 PolarHBondContact O-N 2.75Å; F510-V512 PolarHBondContact O-N 3.12Å; V512-E516 HydrophobicContact CG1-CB 4.09Å; V512-R518 HydrophobicContact CB-CB 4.22Å; V512-R518 HydrophobicContact CB-CG 4.5Å; V512-R518 HydrophobicContact CG1-CB 4Å; V512-R518 WeakPolarHBondContact O-CD 3.25Å; V512-L521 HydrophobicContact CG2-CD2 4.48Å
513	P	80.8	Confident	87.3	Confident	84 Å²	84	56.5 Å²	56.5	55%	0.545	31%	0.31	S	S	.	.			trans	-61.1	140.7	-179.4	22.7	-31.8	0	0	0	112	N515 E516	P513-N515 PolarHBondContact O-N 3.41Å; P513-E516 HydrophobicContact CG-CG 3.86Å; P513-E516 WeakPolarHBondContact O-CB 3.36Å; P513-E516 PolarHBondContact O-N 3.24Å
514	A	74.3	Confident	87.4	Confident	6 Å²	6	61.1 Å²	61.1	5%	0.05	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-14	-166.6	0	0	0	0	0	115.5	E516 R571 L581	A514-E516 VanDerWaalsContact C-N 3.34Å; A514-R571 PolarHBondContact O-NH1 3.46Å; A514-L581 HydrophobicContact CB-CD1 4.05Å
515	N	71	Confident	87.4	Confident	112 Å²	112	58 Å²	58	60%	0.599	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-28.6	176.1	-63.1	-6.4	0	0	0	112.1	P513 R571	P513-N515 PolarHBondContact O-N 3.41Å; N515-R571 VanDerWaalsContact C-NH1 3.34Å; N515-R571 PolarHBondContact O-NH1 3.44Å
516	E	79	Confident	87.5	Confident	109 Å²	109	55.4 Å²	55.4	51%	0.509	30%	0.304	S	S	.	.	S	Bend	trans	-89.2	-169.7	-171.1	-60.8	-57.2	146.9	0	0	113.5	V512 P513 A514 R518	V512-E516 HydrophobicContact CG1-CB 4.09Å; P513-E516 HydrophobicContact CG-CG 3.86Å; P513-E516 WeakPolarHBondContact O-CB 3.36Å; P513-E516 PolarHBondContact O-N 3.24Å; A514-E516 VanDerWaalsContact C-N 3.34Å; E516-R518 PolarHBondContact O-N 3.09Å
517	N	86.3	Confident	87.7	Confident	113 Å²	113	60.4 Å²	60.4	60%	0.604	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	18.8	-177.6	-63.3	-27.7	0	0	0	116	L519 Q520 L521	N517-L519 VanDerWaalsContact C-N 3.31Å; N517-L519 PolarHBondContact O-N 2.99Å; N517-Q520 HydrophobicContact CB-CB 4.33Å; N517-Q520 VanDerWaalsContact O-CB 3.32Å; N517-Q520 WeakPolarHBondContact O-CB 3.36Å; N517-Q520 PolarHBondContact O-N 2.81Å; N517-L521 PolarHBondContact O-N 3.21Å; N517-L521 VanDerWaalsContact O-N 3.08Å
518	R	87.7	Confident	87.8	Confident	7 Å²	7	61.9 Å²	61.9	3%	0.026	34%	0.341	C	S	.	.	H	α-helix	trans	-54.3	-42.4	179	179.4	178.2	-178.9	174.7	6.2	113.3	A509 V512 E516 L521 S522 H567 E584	A509-R518 WeakPolarHBondContact O-CD 3.25Å; A509-R518 WeakPolarHBondContact O-CG 3.27Å; A509-R518 PolarHBondContact O-NE 3.45Å; A509-R518 VanDerWaalsContact O-NE 3.12Å; V512-R518 HydrophobicContact CB-CB 4.22Å; V512-R518 HydrophobicContact CB-CG 4.5Å; V512-R518 HydrophobicContact CG1-CB 4Å; V512-R518 WeakPolarHBondContact O-CD 3.25Å; E516-R518 PolarHBondContact O-N 3.09Å; R518-L521 PolarHBondContact O-N 3.2Å; R518-S522 PolarHBondContact O-N 2.93Å; R518-S522 VanDerWaalsContact O-N 3.15Å; R518-H567 PolarHBondContact NE-CD2 3.39Å; R518-H567 PolarHBondContact NE-CE1 2.85Å; R518-H567 PolarHBondContact NE-NE2 2.99Å; R518-H567 PolarHBondContact NH2-CE1 3.01Å; R518-H567 PolarHBondContact NH2-ND1 3.18Å; R518-E584 IonicContact CZ-OE1 3.18Å; R518-E584 IonicContact CZ-OE2 3.63Å; R518-E584 IonicContact NH1-OE1 2.87Å; R518-E584 PolarHBondContact NH1-OE1 2.92Å; R518-E584 IonicContact NH1-OE2 2.78Å; R518-E584 PolarHBondContact NH1-OE2 2.89Å; R518-E584 VanDerWaalsContact NH2-CD 3.32Å; R518-E584 IonicContact NH2-OE1 2.72Å; R518-E584 PolarHBondContact NH2-OE1 3.06Å; R518-E584 IonicContact NH2-OE2 3.76Å
519	L	87.8	Confident	88.1	Confident	60 Å²	60	59.3 Å²	59.3	31%	0.314	32%	0.323	S	S	.	.	H	α-helix	trans	-64.3	-41.5	177.4	-175.7	63	0	0	0	111.2	N517 L521 S522 L523 A568	N517-L519 VanDerWaalsContact C-N 3.31Å; N517-L519 PolarHBondContact O-N 2.99Å; L519-L521 PolarHBondContact O-N 2.77Å; L519-S522 PolarHBondContact O-N 3.03Å; L519-S522 PolarHBondContact O-OG 3.33Å; L519-L523 HydrophobicContact CG-CD1 4.15Å; L519-L523 WeakPolarHBondContact O-CG 3.5Å; L519-L523 PolarHBondContact O-N 3.32Å; L519-A568 HydrophobicContact CD1-CB 4.46Å
520	Q	91.9	Very high	88.3	Confident	127 Å²	127	62.7 Å²	62.7	59%	0.593	34%	0.343	S	S	*	.	H	α-helix	trans	-60.7	-43.6	177.2	-171.3	-174.2	11.9	0	0	111.7	N517 S522 L523 L524	N517-Q520 HydrophobicContact CB-CB 4.33Å; N517-Q520 VanDerWaalsContact O-CB 3.32Å; N517-Q520 WeakPolarHBondContact O-CB 3.36Å; N517-Q520 PolarHBondContact O-N 2.81Å; Q520-S522 VanDerWaalsContact C-N 3.35Å; Q520-S522 PolarHBondContact O-N 3.37Å; Q520-L523 PolarHBondContact O-N 2.87Å; Q520-L524 WeakPolarHBondContact O-CB 3.3Å; Q520-L524 PolarHBondContact O-N 2.9Å
521	L	91.8	Very high	88.6	Confident	56 Å²	56	65.8 Å²	65.8	29%	0.293	36%	0.364	S	S	.	.	H	α-helix	trans	-60.5	-42.9	175	178.2	60.3	0	0	0	111.9	A509 V512 N517 R518 L519 L524 L525	A509-L521 HydrophobicContact CB-CD2 3.9Å; A509-L521 HydrophobicContact CB-CG 4.42Å; V512-L521 HydrophobicContact CG2-CD2 4.48Å; N517-L521 PolarHBondContact O-N 3.21Å; N517-L521 VanDerWaalsContact O-N 3.08Å; R518-L521 PolarHBondContact O-N 3.2Å; L519-L521 PolarHBondContact O-N 2.77Å; L521-L524 WeakPolarHBondContact O-CB 3.4Å; L521-L524 PolarHBondContact O-N 2.86Å; L521-L525 WeakPolarHBondContact O-CG 3.4Å; L521-L525 PolarHBondContact O-N 3.28Å; L521-L525 VanDerWaalsContact O-N 3.08Å
522	S	91.7	Very high	88.9	Confident	1 Å²	1	62 Å²	62	1%	0.007	33%	0.334	C	S	.	.	H	α-helix	trans	-68.4	-36.5	178.8	68.8	0	0	0	0	113.1	R518 L519 Q520 L525 L526 T564	R518-S522 PolarHBondContact O-N 2.93Å; R518-S522 VanDerWaalsContact O-N 3.15Å; L519-S522 PolarHBondContact O-N 3.03Å; L519-S522 PolarHBondContact O-OG 3.33Å; Q520-S522 VanDerWaalsContact C-N 3.35Å; Q520-S522 PolarHBondContact O-N 3.37Å; S522-L525 PolarHBondContact O-N 2.97Å; S522-L526 PolarHBondContact O-N 3.02Å; S522-T564 WeakPolarHBondContact O-CG2 3.44Å
523	L	92.7	Very high	89.1	Confident	92 Å²	92	64.4 Å²	64.4	48%	0.482	34%	0.341	S	S	.	.	H	α-helix	trans	-68.8	-35.8	173.6	-70	171.2	0	0	0	112.1	L519 Q520 L526 L527	L519-L523 HydrophobicContact CG-CD1 4.15Å; L519-L523 WeakPolarHBondContact O-CG 3.5Å; L519-L523 PolarHBondContact O-N 3.32Å; Q520-L523 PolarHBondContact O-N 2.87Å; L523-L526 PolarHBondContact O-N 3.02Å; L523-L527 WeakPolarHBondContact O-CB 3.31Å; L523-L527 PolarHBondContact O-N 2.87Å
524	L	94.8	Very high	89.7	Confident	98 Å²	98	66.9 Å²	66.9	51%	0.513	34%	0.344	S	S	.	.	H	α-helix	trans	-61.7	-47.4	173.3	177.9	62.2	0	0	0	111.2	Q520 L521 L526 L527 T528	Q520-L524 WeakPolarHBondContact O-CB 3.3Å; Q520-L524 PolarHBondContact O-N 2.9Å; L521-L524 WeakPolarHBondContact O-CB 3.4Å; L521-L524 PolarHBondContact O-N 2.86Å; L524-L526 VanDerWaalsContact C-N 3.33Å; L524-L526 PolarHBondContact O-N 3.37Å; L524-L527 PolarHBondContact O-N 3.02Å; L524-T528 PolarHBondContact O-N 3.32Å; L524-T528 PolarHBondContact O-OG1 2.84Å; L524-T528 VanDerWaalsContact O-OG1 3.05Å
525	L	93.6	Very high	90.4	Very high	10 Å²	10	68.8 Å²	68.8	5%	0.052	36%	0.36	C	S	.	.	H	α-helix	trans	-64.9	-35.5	177.9	-69.4	170.5	0	0	0	112.9	L505 L521 S522 T529 L560	L505-L525 HydrophobicContact CD2-CD2 3.9Å; L505-L525 HydrophobicContact CG-CD2 4.23Å; L521-L525 WeakPolarHBondContact O-CG 3.4Å; L521-L525 PolarHBondContact O-N 3.28Å; L521-L525 VanDerWaalsContact O-N 3.08Å; S522-L525 PolarHBondContact O-N 2.97Å; L525-T529 WeakPolarHBondContact O-CB 3.2Å; L525-T529 PolarHBondContact O-N 2.89Å; L525-T529 PolarHBondContact O-OG1 3.15Å; L525-L560 HydrophobicContact CB-CD2 4.35Å
526	L	94	Very high	91.3	Very high	34 Å²	34	63.7 Å²	63.7	18%	0.178	33%	0.333	C	S	.	.	H	α-helix	trans	-63	-46.2	172.3	-174.6	64.8	0	0	0	111	S522 L523 L524 T529 V530 F557 L560 V561 T564	S522-L526 PolarHBondContact O-N 3.02Å; L523-L526 PolarHBondContact O-N 3.02Å; L524-L526 VanDerWaalsContact C-N 3.33Å; L524-L526 PolarHBondContact O-N 3.37Å; L526-T529 PolarHBondContact O-N 2.96Å; L526-V530 WeakPolarHBondContact O-CG2 3.43Å; L526-V530 PolarHBondContact O-N 3.01Å; L526-F557 HydrophobicContact CD1-CD2 3.88Å; L526-F557 HydrophobicContact CD1-CE2 3.6Å; L526-F557 HydrophobicContact CD1-CZ 4.34Å; L526-L560 HydrophobicContact CD1-CB 4.19Å; L526-V561 HydrophobicContact CD1-CG2 3.88Å; L526-T564 HydrophobicContact CB-CG2 4.45Å; L526-T564 HydrophobicContact CD2-CG2 4.44Å
527	L	94.9	Very high	91.7	Very high	107 Å²	107	61.3 Å²	61.3	56%	0.56	33%	0.328	S	S	*	.	H	α-helix	trans	-62	-46.4	175.7	179.6	62.2	0	0	0	112	L523 L524 T529 V530 T531	L523-L527 WeakPolarHBondContact O-CB 3.31Å; L523-L527 PolarHBondContact O-N 2.87Å; L524-L527 PolarHBondContact O-N 3.02Å; L527-T529 PolarHBondContact O-N 3.18Å; L527-V530 PolarHBondContact O-N 2.9Å; L527-V530 VanDerWaalsContact O-N 3.13Å; L527-T531 PolarHBondContact O-N 3.46Å; L527-T531 PolarHBondContact O-OG1 3.4Å
528	T	95	Very high	91.9	Very high	54 Å²	54	61.5 Å²	61.5	33%	0.331	33%	0.326	S	S	.	.	H	α-helix	trans	-56.3	-38.8	175	-58.9	0	0	0	0	111.5	L502 L524 T531 F532	L502-T528 HydrophobicContact CD1-CG2 4.03Å; L502-T528 HydrophobicContact CD2-CG2 3.69Å; L524-T528 PolarHBondContact O-N 3.32Å; L524-T528 PolarHBondContact O-OG1 2.84Å; L524-T528 VanDerWaalsContact O-OG1 3.05Å; T528-T531 PolarHBondContact O-N 2.9Å; T528-F532 VanDerWaalsContact O-CB 3.28Å; T528-F532 WeakPolarHBondContact O-CB 3.29Å; T528-F532 PolarHBondContact O-N 3Å
529	T	93.1	Very high	91.8	Very high	2 Å²	2	64.3 Å²	64.3	1%	0.012	34%	0.341	C	S	.	.	H	α-helix	trans	-71.9	-34.4	178.5	-57.1	0	0	0	0	112.7	L525 L526 L527 K533 F557 L560	L525-T529 WeakPolarHBondContact O-CB 3.2Å; L525-T529 PolarHBondContact O-N 2.89Å; L525-T529 PolarHBondContact O-OG1 3.15Å; L526-T529 PolarHBondContact O-N 2.96Å; L527-T529 PolarHBondContact O-N 3.18Å; T529-K533 WeakPolarHBondContact O-CB 3.31Å; T529-K533 PolarHBondContact O-N 2.96Å; T529-F557 HydrophobicContact CG2-CB 4.24Å; T529-F557 HydrophobicContact CG2-CD2 4.46Å; T529-L560 HydrophobicContact CG2-CD1 3.95Å; T529-L560 WeakPolarHBondContact OG1-CD1 3.49Å
530	V	93.9	Very high	91.8	Very high	71 Å²	71	62 Å²	62	43%	0.43	33%	0.329	S	S	.	.	H	α-helix	trans	-66	-45.1	171.5	172.8	0	0	0	0	111.1	L526 L527 F532 K533 F534 F557	L526-V530 WeakPolarHBondContact O-CG2 3.43Å; L526-V530 PolarHBondContact O-N 3.01Å; L527-V530 PolarHBondContact O-N 2.9Å; L527-V530 VanDerWaalsContact O-N 3.13Å; V530-F532 VanDerWaalsContact C-N 3.35Å; V530-F532 PolarHBondContact O-N 2.8Å; V530-K533 PolarHBondContact O-N 2.94Å; V530-F534 PolarHBondContact O-N 2.8Å; V530-F557 HydrophobicContact CG2-CD2 4.27Å; V530-F557 HydrophobicContact CG2-CE2 3.73Å
531	T	93.9	Very high	91.7	Very high	87 Å²	87	56.8 Å²	56.8	53%	0.534	31%	0.306	S	S	.	.	H	α-helix	trans	-61	-43.2	175	-59.7	0	0	0	0	111.5	L527 T528 F534 A535	L527-T531 PolarHBondContact O-N 3.46Å; L527-T531 PolarHBondContact O-OG1 3.4Å; T528-T531 PolarHBondContact O-N 2.9Å; T531-F534 PolarHBondContact O-N 2.79Å; T531-A535 PolarHBondContact O-N 3.4Å
532	F	92.3	Very high	91.5	Very high	29 Å²	29	64.6 Å²	64.6	13%	0.127	34%	0.338	C	S	.	.	H	α-helix	trans	-63.7	-41.7	175.6	174.8	-93.5	0	0	0	112.2	M495 I498 L502 T528 V530 F534 A535 A536 V553	M495-F532 HydrophobicContact CB-CZ 3.96Å; M495-F532 HydrophobicContact CG-CZ 4.41Å; M495-F532 VanDerWaalsContact O-CZ 3.28Å; M495-F532 WeakPolarHBondContact O-CZ 3.38Å; I498-F532 HydrophobicContact CB-CE2 4.35Å; I498-F532 HydrophobicContact CG2-CD2 4.28Å; I498-F532 HydrophobicContact CG2-CE2 4.13Å; L502-F532 HydrophobicContact CD1-CB 4.45Å; T528-F532 VanDerWaalsContact O-CB 3.28Å; T528-F532 WeakPolarHBondContact O-CB 3.29Å; T528-F532 PolarHBondContact O-N 3Å; V530-F532 VanDerWaalsContact C-N 3.35Å; V530-F532 PolarHBondContact O-N 2.8Å; F532-F534 VanDerWaalsContact C-N 3.32Å; F532-F534 PolarHBondContact O-N 3.23Å; F532-A535 PolarHBondContact O-N 3.27Å; F532-A536 PolarHBondContact O-N 2.83Å; F532-V553 HydrophobicContact CD1-CG1 4.3Å; F532-V553 HydrophobicContact CD1-CG2 4.5Å; F532-V553 HydrophobicContact CE1-CG1 4.38Å; F532-V553 HydrophobicContact CE1-CG2 3.79Å
533	K	91.6	Very high	91.4	Very high	94 Å²	94	66.5 Å²	66.5	41%	0.409	35%	0.348	S	S	.	.	H	α-helix	trans	-59.3	-41.8	173	-179.7	-176.4	174.4	-175.7	0	111.7	T529 V530 A536 S537 V553	T529-K533 WeakPolarHBondContact O-CB 3.31Å; T529-K533 PolarHBondContact O-N 2.96Å; V530-K533 PolarHBondContact O-N 2.94Å; K533-A536 PolarHBondContact O-N 3.06Å; K533-S537 WeakPolarHBondContact O-CB 3.42Å; K533-S537 PolarHBondContact O-N 3.26Å; K533-S537 PolarHBondContact O-OG 3.35Å; K533-V553 HydrophobicContact CB-CG1 3.91Å; K533-V553 HydrophobicContact CG-CG1 4.17Å
534	F	91.7	Very high	91.3	Very high	135 Å²	135	68.5 Å²	68.5	59%	0.592	37%	0.369	S	S	*	.	H	α-helix	trans	-62.7	-45.9	176	-177.2	-113.6	0	0	0	111.4	V530 T531 F532 A536 S537 Q538	V530-F534 PolarHBondContact O-N 2.8Å; T531-F534 PolarHBondContact O-N 2.79Å; F532-F534 VanDerWaalsContact C-N 3.32Å; F532-F534 PolarHBondContact O-N 3.23Å; F534-A536 PolarHBondContact O-N 3.42Å; F534-S537 PolarHBondContact O-N 3.25Å; F534-S537 PolarHBondContact O-OG 3.24Å; F534-Q538 PolarHBondContact O-N 3.35Å
535	A	90.7	Very high	91.2	Very high	47 Å²	47	68.2 Å²	68.2	39%	0.388	36%	0.362	S	S	.	.	H	α-helix	trans	-60	-43.3	175.3	0	0	0	0	0	112.6	T531 F532 S537 Q538 N539	T531-A535 PolarHBondContact O-N 3.4Å; F532-A535 PolarHBondContact O-N 3.27Å; A535-S537 VanDerWaalsContact C-N 3.35Å; A535-S537 PolarHBondContact O-N 3.33Å; A535-Q538 PolarHBondContact O-N 2.58Å; A535-N539 PolarHBondContact O-ND2 3.23Å
536	A	88.5	Confident	91	Very high	4 Å²	4	71.4 Å²	71.4	3%	0.033	38%	0.379	C	S	.	.	H	α-helix	trans	-58.4	-46.3	174.6	0	0	0	0	0	111.5	M495 F532 K533 F534 Q538 N539 L549	M495-A536 HydrophobicContact SD-CB 4.35Å; F532-A536 PolarHBondContact O-N 2.83Å; K533-A536 PolarHBondContact O-N 3.06Å; F534-A536 PolarHBondContact O-N 3.42Å; A536-Q538 PolarHBondContact O-N 2.98Å; A536-Q538 VanDerWaalsContact O-N 3.07Å; A536-N539 PolarHBondContact O-N 3.3Å; A536-N539 PolarHBondContact O-ND2 3.15Å; A536-L549 HydrophobicContact CB-CD2 4.12Å
537	S	88.2	Confident	91	Very high	59 Å²	59	69.8 Å²	69.8	41%	0.413	37%	0.37	S	S	.	.	H	α-helix	trans	-65.5	-8.6	-178.5	71.9	0	0	0	0	115.8	K533 F534 A535	K533-S537 WeakPolarHBondContact O-CB 3.42Å; K533-S537 PolarHBondContact O-N 3.26Å; K533-S537 PolarHBondContact O-OG 3.35Å; F534-S537 PolarHBondContact O-N 3.25Å; F534-S537 PolarHBondContact O-OG 3.24Å; A535-S537 VanDerWaalsContact C-N 3.35Å; A535-S537 PolarHBondContact O-N 3.33Å
538	Q	89.4	Confident	90.9	Very high	118 Å²	118	66.7 Å²	66.7	55%	0.551	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-16.4	173.1	-67.4	175.1	3	0	0	113.1	F534 A535 A536	F534-Q538 PolarHBondContact O-N 3.35Å; A535-Q538 PolarHBondContact O-N 2.58Å; A536-Q538 PolarHBondContact O-N 2.98Å; A536-Q538 VanDerWaalsContact O-N 3.07Å
539	N	85.4	Confident	90.7	Very high	66 Å²	66	64.2 Å²	64.2	35%	0.353	34%	0.336	S	S	.	.	S	Bend	trans	-95.5	1.7	-177.7	-54	-87.6	0	0	0	112.8	M495 A535 A536	M495-N539 HydrophobicContact CE-CB 4.29Å; M495-N539 WeakPolarHBondContact CE-ND2 3.35Å; A535-N539 PolarHBondContact O-ND2 3.23Å; A536-N539 PolarHBondContact O-N 3.3Å; A536-N539 PolarHBondContact O-ND2 3.15Å
540	L	87.7	Confident	90.6	Very high	12 Å²	12	65.6 Å²	65.6	6%	0.063	34%	0.343	C	S	.	.	S	Bend	trans	-132.4	145.4	-174.7	-71.8	168.4	0	0	0	110	L403 F406 T547	L403-L540 HydrophobicContact CD1-CD2 4.06Å; L403-L540 HydrophobicContact CD2-CD2 4.49Å; F406-L540 HydrophobicContact CD1-CD1 4.26Å; F406-L540 HydrophobicContact CD1-CD2 3.92Å; F406-L540 HydrophobicContact CD2-CD2 3.95Å; F406-L540 HydrophobicContact CE1-CD1 4.22Å; F406-L540 HydrophobicContact CE1-CD2 3.88Å; F406-L540 HydrophobicContact CE1-CG 4.28Å; F406-L540 HydrophobicContact CE2-CD2 3.9Å; F406-L540 HydrophobicContact CG-CD2 3.96Å; F406-L540 HydrophobicContact CZ-CD2 3.86Å; F406-L540 HydrophobicContact CZ-CG 4.45Å; L540-T547 HydrophobicContact CD1-CG2 4.41Å
541	P	89.8	Confident	90.6	Very high	17 Å²	17	64.7 Å²	64.7	11%	0.11	33%	0.334	C	S	.	.			trans	-68.8	163.8	170.5	29.5	-30.4	0	0	0	110.5	T290 E293 L403 I543	T290-P541 VanDerWaalsContact O-CD 3.26Å; T290-P541 WeakPolarHBondContact O-CD 3.43Å; T290-P541 WeakPolarHBondContact O-CG 3.43Å; E293-P541 HydrophobicContact CG-CB 4.4Å; E293-P541 HydrophobicContact CG-CG 4.34Å; L403-P541 HydrophobicContact CD1-CG 3.4Å; P541-I543 HydrophobicContact CG-CG2 4.18Å; P541-I543 PolarHBondContact O-N 3.11Å
542	K	88.6	Confident	90.5	Very high	219 Å²	219	61.4 Å²	61.4	95%	0.952	31%	0.313	S	S	*	.			trans	-79.6	65.2	-175	-67.1	177.9	-178.9	173	0	112.5
543	I	88.9	Confident	90.6	Very high	42 Å²	42	60.3 Å²	60.3	22%	0.215	31%	0.309	C	S	.	.			trans	-70.2	146.8	179.1	52	179.6	0	0	0	113.1	L403 P541 Y545 T547	L403-I543 HydrophobicContact CB-CD1 4.22Å; P541-I543 HydrophobicContact CG-CG2 4.18Å; P541-I543 PolarHBondContact O-N 3.11Å; I543-Y545 VanDerWaalsContact C-N 3.3Å; I543-Y545 HydrophobicContact CB-CD1 4.36Å; I543-Y545 HydrophobicContact CB-CE1 4.11Å; I543-Y545 HydrophobicContact CB-CE2 4.35Å; I543-Y545 HydrophobicContact CD1-CD2 4.05Å; I543-Y545 HydrophobicContact CD1-CE2 3.64Å; I543-Y545 HydrophobicContact CG1-CE2 4.49Å; I543-Y545 HydrophobicContact CG2-CE1 4.1Å; I543-T547 HydrophobicContact CD1-CG2 3.47Å; I543-T547 VanDerWaalsContact CD1-CG2 3.47Å
544	S	90.5	Very high	90.6	Very high	134 Å²	134	57.7 Å²	57.7	94%	0.937	30%	0.299	S	S	*	.	S	Bend	trans	-84	-1.9	178.8	-164.1	0	0	0	0	113.7
545	Y	92.9	Very high	90.7	Very high	92 Å²	92	55 Å²	55	36%	0.361	29%	0.293	S	S	.	.	S	Bend	trans	-123.4	157.8	-177	61	-103.4	0	0	0	111.6	L401 L403 R404 I543	L401-Y545 PolarHBondContact O-OH 3.04Å; L403-Y545 HydrophobicContact CB-CE2 4.45Å; L403-Y545 PolarHBondContact N-OH 3.44Å; R404-Y545 HydrophobicContact CB-CD2 4.23Å; R404-Y545 HydrophobicContact CB-CE2 3.99Å; I543-Y545 VanDerWaalsContact C-N 3.3Å; I543-Y545 HydrophobicContact CB-CD1 4.36Å; I543-Y545 HydrophobicContact CB-CE1 4.11Å; I543-Y545 HydrophobicContact CB-CE2 4.35Å; I543-Y545 HydrophobicContact CD1-CD2 4.05Å; I543-Y545 HydrophobicContact CD1-CE2 3.64Å; I543-Y545 HydrophobicContact CG1-CE2 4.49Å; I543-Y545 HydrophobicContact CG2-CE1 4.1Å
546	L	90.1	Very high	90.8	Very high	76 Å²	76	52.9 Å²	52.9	40%	0.398	28%	0.276	S	S	.	.			trans	-94.3	121.9	-171.3	-162.6	72.4	0	0	0	112.4	D550 K551 L554	L546-D550 HydrophobicContact CD1-CB 3.38Å; L546-D550 HydrophobicContact CG-CB 3.93Å; L546-K551 HydrophobicContact CD2-CD 4.44Å; L546-K551 HydrophobicContact CD2-CG 3.46Å; L546-K551 VanDerWaalsContact CD2-CG 3.46Å; L546-K551 HydrophobicContact CG-CG 3.91Å; L546-K551 VanDerWaalsContact O-CE 3.25Å; L546-K551 WeakPolarHBondContact O-CE 3.25Å; L546-K551 PolarHBondContact O-NZ 2.84Å; L546-L554 HydrophobicContact CD1-CD1 3.65Å; L546-L554 HydrophobicContact CD2-CD1 4.05Å
547	T	93.5	Very high	91	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.286	C	S	.	.			trans	-71.9	177.3	177.9	72.9	0	0	0	0	112.5	L403 F406 L540 I543 L549 D550 K551	L403-T547 HydrophobicContact CB-CG2 4.43Å; L403-T547 VanDerWaalsContact O-CG2 3.25Å; L403-T547 WeakPolarHBondContact O-CG2 3.34Å; F406-T547 HydrophobicContact CB-CG2 4.39Å; L540-T547 HydrophobicContact CD1-CG2 4.41Å; I543-T547 HydrophobicContact CD1-CG2 3.47Å; I543-T547 VanDerWaalsContact CD1-CG2 3.47Å; T547-L549 PolarHBondContact OG1-N 2.93Å; T547-D550 WeakPolarHBondContact CB-OD2 3.14Å; T547-D550 VanDerWaalsContact CG2-OD2 3.28Å; T547-D550 WeakPolarHBondContact CG2-OD2 3.44Å; T547-D550 PolarHBondContact N-OD2 2.79Å; T547-D550 VanDerWaalsContact OG1-CG 3.28Å; T547-D550 PolarHBondContact OG1-N 2.96Å; T547-D550 PolarHBondContact OG1-OD2 3.08Å; T547-K551 VanDerWaalsContact O-CD 3.24Å; T547-K551 WeakPolarHBondContact O-CD 3.25Å; T547-K551 VanDerWaalsContact O-CE 3.25Å; T547-K551 WeakPolarHBondContact O-CE 3.34Å; T547-K551 VanDerWaalsContact O-CG 3.23Å; T547-K551 WeakPolarHBondContact O-CG 3.44Å; T547-K551 PolarHBondContact O-N 3.14Å; T547-K551 PolarHBondContact O-NZ 3.46Å
548	Y	92.2	Very high	91.2	Very high	43 Å²	43	58.3 Å²	58.3	17%	0.169	29%	0.292	C	S	.	.	H	α-helix	trans	-70.2	-36.7	167.5	-73.8	-45.3	0	0	0	112.2	R404 H405 K551 V552 F602 V606 D609	R404-Y548 PolarHBondContact O-N 2.82Å; H405-Y548 HydrophobicContact CB-CD2 4.13Å; H405-Y548 HydrophobicContact CB-CE2 3.93Å; H405-Y548 AromaticContact CD2-CE2 3.7Å; H405-Y548 AromaticContact CD2-CZ 4Å; Y548-K551 HydrophobicContact CD1-CD 4.19Å; Y548-K551 PolarHBondContact O-N 2.92Å; Y548-V552 PolarHBondContact O-N 3.48Å; Y548-F602 HydrophobicContact CD1-CE2 4.25Å; Y548-F602 AromaticContact CD1-CZ 3.87Å; Y548-F602 HydrophobicContact CD1-CZ 3.87Å; Y548-F602 HydrophobicContact CG-CZ 4.4Å; Y548-V606 HydrophobicContact CD1-CG2 3.8Å; Y548-V606 HydrophobicContact CD2-CG1 4.18Å; Y548-V606 HydrophobicContact CD2-CG2 4.09Å; Y548-V606 HydrophobicContact CE1-CG2 3.94Å; Y548-V606 HydrophobicContact CE2-CG1 4.43Å; Y548-V606 HydrophobicContact CE2-CG2 4.22Å; Y548-V606 HydrophobicContact CG-CG2 3.91Å; Y548-D609 PolarHBondContact OH-OD2 2.61Å
549	L	91.4	Very high	91.4	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-62	-48.3	176.6	-169.3	145.7	0	0	0	111.5	F406 M495 A536 T547 K551 V552 V553	F406-L549 HydrophobicContact CD1-CB 4.18Å; F406-L549 HydrophobicContact CD1-CD1 4.32Å; F406-L549 HydrophobicContact CE1-CD1 3.98Å; F406-L549 PolarHBondContact O-N 3.23Å; M495-L549 HydrophobicContact CB-CD1 3.88Å; M495-L549 HydrophobicContact CG-CD1 4.35Å; M495-L549 HydrophobicContact SD-CD1 3.59Å; M495-L549 VanDerWaalsContact SD-CD1 3.59Å; M495-L549 HydrophobicContact SD-CD2 4.43Å; A536-L549 HydrophobicContact CB-CD2 4.12Å; T547-L549 PolarHBondContact OG1-N 2.93Å; L549-K551 VanDerWaalsContact C-N 3.26Å; L549-K551 PolarHBondContact O-N 2.87Å; L549-V552 PolarHBondContact O-N 3.31Å; L549-V552 VanDerWaalsContact O-N 3.12Å; L549-V553 HydrophobicContact CD2-CG2 3.98Å; L549-V553 WeakPolarHBondContact O-CG2 3.39Å; L549-V553 PolarHBondContact O-N 2.95Å
550	D	92.3	Very high	91.8	Very high	31 Å²	31	51.1 Å²	51.1	17%	0.166	26%	0.256	C	S	.	.	H	α-helix	trans	-63.4	-32.4	179	-60.2	-62.7	0	0	0	112.3	L546 T547 V553 L554	L546-D550 HydrophobicContact CD1-CB 3.38Å; L546-D550 HydrophobicContact CG-CB 3.93Å; T547-D550 WeakPolarHBondContact CB-OD2 3.14Å; T547-D550 VanDerWaalsContact CG2-OD2 3.28Å; T547-D550 WeakPolarHBondContact CG2-OD2 3.44Å; T547-D550 PolarHBondContact N-OD2 2.79Å; T547-D550 VanDerWaalsContact OG1-CG 3.28Å; T547-D550 PolarHBondContact OG1-N 2.96Å; T547-D550 PolarHBondContact OG1-OD2 3.08Å; D550-V553 PolarHBondContact O-N 3.32Å; D550-L554 VanDerWaalsContact O-CB 3.28Å; D550-L554 WeakPolarHBondContact O-CB 3.13Å; D550-L554 VanDerWaalsContact O-CG 3.29Å; D550-L554 WeakPolarHBondContact O-CG 3.24Å; D550-L554 PolarHBondContact O-N 3.47Å
551	K	92.6	Very high	92.1	Very high	53 Å²	53	52.8 Å²	52.8	23%	0.23	27%	0.267	C	S	.	.	H	α-helix	trans	-61.4	-45.1	173.5	-74.4	161.4	-159.5	138.2	0	111.3	L546 T547 Y548 L549 V555 F602	L546-K551 HydrophobicContact CD2-CD 4.44Å; L546-K551 HydrophobicContact CD2-CG 3.46Å; L546-K551 VanDerWaalsContact CD2-CG 3.46Å; L546-K551 HydrophobicContact CG-CG 3.91Å; L546-K551 VanDerWaalsContact O-CE 3.25Å; L546-K551 WeakPolarHBondContact O-CE 3.25Å; L546-K551 PolarHBondContact O-NZ 2.84Å; T547-K551 VanDerWaalsContact O-CD 3.24Å; T547-K551 WeakPolarHBondContact O-CD 3.25Å; T547-K551 VanDerWaalsContact O-CE 3.25Å; T547-K551 WeakPolarHBondContact O-CE 3.34Å; T547-K551 VanDerWaalsContact O-CG 3.23Å; T547-K551 WeakPolarHBondContact O-CG 3.44Å; T547-K551 PolarHBondContact O-N 3.14Å; T547-K551 PolarHBondContact O-NZ 3.46Å; Y548-K551 HydrophobicContact CD1-CD 4.19Å; Y548-K551 PolarHBondContact O-N 2.92Å; L549-K551 VanDerWaalsContact C-N 3.26Å; L549-K551 PolarHBondContact O-N 2.87Å; K551-V555 WeakPolarHBondContact O-CB 3.23Å; K551-V555 VanDerWaalsContact O-CG2 3.24Å; K551-V555 WeakPolarHBondContact O-CG2 3.25Å; K551-V555 PolarHBondContact O-N 2.91Å; K551-F602 HydrophobicContact CB-CE2 3.9Å; K551-F602 HydrophobicContact CB-CZ 3.92Å; K551-F602 HydrophobicContact CD-CE2 4.23Å
552	V	92.9	Very high	92.3	Very high	18 Å²	18	56 Å²	56	11%	0.109	28%	0.282	C	S	.	.	H	α-helix	trans	-60.9	-49.5	175.5	177	0	0	0	0	110.5	I496 Y548 L549 L554 V555 N556 F602	I496-V552 HydrophobicContact CG2-CG1 4.44Å; Y548-V552 PolarHBondContact O-N 3.48Å; L549-V552 PolarHBondContact O-N 3.31Å; L549-V552 VanDerWaalsContact O-N 3.12Å; V552-L554 PolarHBondContact O-N 3.04Å; V552-V555 PolarHBondContact O-N 3.47Å; V552-N556 WeakPolarHBondContact O-CB 3.08Å; V552-N556 PolarHBondContact O-N 3.48Å; V552-N556 PolarHBondContact O-ND2 3.02Å; V552-F602 HydrophobicContact CG2-CD1 3.92Å; V552-F602 HydrophobicContact CG2-CE1 3.34Å; V552-F602 HydrophobicContact CG2-CZ 4.01Å
553	V	92.8	Very high	92.5	Very high	5 Å²	5	46 Å²	46	3%	0.03	24%	0.239	C	C	.	.	H	α-helix	trans	-65.8	-37.8	-177.1	-178.7	0	0	0	0	112	F532 K533 L549 D550 F557	F532-V553 HydrophobicContact CD1-CG1 4.3Å; F532-V553 HydrophobicContact CD1-CG2 4.5Å; F532-V553 HydrophobicContact CE1-CG1 4.38Å; F532-V553 HydrophobicContact CE1-CG2 3.79Å; K533-V553 HydrophobicContact CB-CG1 3.91Å; K533-V553 HydrophobicContact CG-CG1 4.17Å; L549-V553 HydrophobicContact CD2-CG2 3.98Å; L549-V553 WeakPolarHBondContact O-CG2 3.39Å; L549-V553 PolarHBondContact O-N 2.95Å; D550-V553 PolarHBondContact O-N 3.32Å; V553-F557 VanDerWaalsContact O-CB 3.3Å; V553-F557 WeakPolarHBondContact O-CB 3.39Å; V553-F557 PolarHBondContact O-N 3.09Å
554	L	92.5	Very high	92.6	Very high	40 Å²	40	44.7 Å²	44.7	21%	0.209	23%	0.233	C	C	.	.	H	α-helix	trans	-70.9	-40.5	174.6	-72.1	-174.6	0	0	0	112.8	L546 D550 V552 F557 F558	L546-L554 HydrophobicContact CD1-CD1 3.65Å; L546-L554 HydrophobicContact CD2-CD1 4.05Å; D550-L554 VanDerWaalsContact O-CB 3.28Å; D550-L554 WeakPolarHBondContact O-CB 3.13Å; D550-L554 VanDerWaalsContact O-CG 3.29Å; D550-L554 WeakPolarHBondContact O-CG 3.24Å; D550-L554 PolarHBondContact O-N 3.47Å; V552-L554 PolarHBondContact O-N 3.04Å; L554-F557 PolarHBondContact O-N 2.86Å; L554-F558 HydrophobicContact CB-CD2 4.41Å; L554-F558 HydrophobicContact CB-CE2 4.27Å; L554-F558 WeakPolarHBondContact O-CD2 3.13Å; L554-F558 PolarHBondContact O-N 3.12Å
555	V	92.7	Very high	92.7	Very high	77 Å²	77	42 Å²	42	47%	0.467	21%	0.211	S	C	.	.	H	α-helix	trans	-60.5	-46.8	174.7	166.1	0	0	0	0	110.3	K551 V552 F557 F558 M559	K551-V555 WeakPolarHBondContact O-CB 3.23Å; K551-V555 VanDerWaalsContact O-CG2 3.24Å; K551-V555 WeakPolarHBondContact O-CG2 3.25Å; K551-V555 PolarHBondContact O-N 2.91Å; V552-V555 PolarHBondContact O-N 3.47Å; V555-F557 VanDerWaalsContact C-N 3.34Å; V555-F557 PolarHBondContact O-N 3.36Å; V555-F558 PolarHBondContact O-N 3.24Å; V555-M559 WeakPolarHBondContact O-CG 3.4Å; V555-M559 PolarHBondContact O-N 2.9Å
556	N	92.9	Very high	92.6	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-61.6	-41.4	176.3	-65.7	-14.4	0	0	0	111.5	S499 C503 V552 M559 L560 Y595	S499-N556 VanDerWaalsContact C-ND2 3.31Å; S499-N556 WeakPolarHBondContact CB-ND2 3.36Å; S499-N556 PolarHBondContact O-ND2 3.36Å; S499-N556 PolarHBondContact OG-ND2 3.23Å; C503-N556 HydrophobicContact CB-CB 4.25Å; V552-N556 WeakPolarHBondContact O-CB 3.08Å; V552-N556 PolarHBondContact O-N 3.48Å; V552-N556 PolarHBondContact O-ND2 3.02Å; N556-M559 PolarHBondContact O-N 3.3Å; N556-L560 VanDerWaalsContact O-CG 3.32Å; N556-L560 WeakPolarHBondContact O-CG 3.28Å; N556-L560 PolarHBondContact O-N 3.39Å; N556-Y595 VanDerWaalsContact OD1-CE2 3.26Å; N556-Y595 WeakPolarHBondContact OD1-CE2 3.49Å; N556-Y595 PolarHBondContact OD1-OH 3.29Å
557	F	93.2	Very high	92.6	Very high	54 Å²	54	36.3 Å²	36.3	24%	0.237	18%	0.184	C	C	.	.	H	α-helix	trans	-61.2	-46.9	173.8	175.8	-95.2	0	0	0	112.6	L526 T529 V530 V553 L554 V555 M559 L560 V561	L526-F557 HydrophobicContact CD1-CD2 3.88Å; L526-F557 HydrophobicContact CD1-CE2 3.6Å; L526-F557 HydrophobicContact CD1-CZ 4.34Å; T529-F557 HydrophobicContact CG2-CB 4.24Å; T529-F557 HydrophobicContact CG2-CD2 4.46Å; V530-F557 HydrophobicContact CG2-CD2 4.27Å; V530-F557 HydrophobicContact CG2-CE2 3.73Å; V553-F557 VanDerWaalsContact O-CB 3.3Å; V553-F557 WeakPolarHBondContact O-CB 3.39Å; V553-F557 PolarHBondContact O-N 3.09Å; L554-F557 PolarHBondContact O-N 2.86Å; V555-F557 VanDerWaalsContact C-N 3.34Å; V555-F557 PolarHBondContact O-N 3.36Å; F557-M559 PolarHBondContact O-N 2.82Å; F557-L560 PolarHBondContact O-N 2.9Å; F557-V561 HydrophobicContact CD1-CG2 4.35Å; F557-V561 HydrophobicContact CE1-CG2 3.92Å; F557-V561 HydrophobicContact CE2-CG2 4.45Å; F557-V561 HydrophobicContact CZ-CG2 3.98Å; F557-V561 WeakPolarHBondContact O-CG2 3.37Å; F557-V561 PolarHBondContact O-N 2.9Å
558	F	93.7	Very high	92.4	Very high	123 Å²	123	38.5 Å²	38.5	54%	0.539	20%	0.202	S	C	.	.	H	α-helix	trans	-65.3	-37.5	178	-74.4	-59.4	0	0	0	112.3	L554 V555 L560 V561 I562	L554-F558 HydrophobicContact CB-CD2 4.41Å; L554-F558 HydrophobicContact CB-CE2 4.27Å; L554-F558 WeakPolarHBondContact O-CD2 3.13Å; L554-F558 PolarHBondContact O-N 3.12Å; V555-F558 PolarHBondContact O-N 3.24Å; F558-L560 VanDerWaalsContact C-N 3.34Å; F558-L560 PolarHBondContact O-N 3.36Å; F558-V561 PolarHBondContact O-N 3.42Å; F558-I562 WeakPolarHBondContact O-CG1 3.43Å; F558-I562 PolarHBondContact O-N 3.4Å
559	M	92.5	Very high	92.2	Very high	29 Å²	29	40.1 Å²	40.1	14%	0.143	21%	0.213	C	C	.	.	H	α-helix	trans	-61.9	-40.3	172.9	-72	-60	-57.1	0	0	112.2	V555 N556 F557 I562 L563 L591 Y595	V555-M559 WeakPolarHBondContact O-CG 3.4Å; V555-M559 PolarHBondContact O-N 2.9Å; N556-M559 PolarHBondContact O-N 3.3Å; F557-M559 PolarHBondContact O-N 2.82Å; M559-I562 PolarHBondContact O-N 3.03Å; M559-I562 HydrophobicContact SD-CD1 4.38Å; M559-L563 WeakPolarHBondContact O-CB 3.26Å; M559-L563 PolarHBondContact O-N 2.91Å; M559-L591 HydrophobicContact CE-CD2 4.33Å; M559-Y595 HydrophobicContact CG-CD2 4.07Å
560	L	93.5	Very high	92	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-67.9	-32.4	174	-69.9	167.1	0	0	0	112.8	L525 L526 T529 N556 F557 F558 L563 T564	L525-L560 HydrophobicContact CB-CD2 4.35Å; L526-L560 HydrophobicContact CD1-CB 4.19Å; T529-L560 HydrophobicContact CG2-CD1 3.95Å; T529-L560 WeakPolarHBondContact OG1-CD1 3.49Å; N556-L560 VanDerWaalsContact O-CG 3.32Å; N556-L560 WeakPolarHBondContact O-CG 3.28Å; N556-L560 PolarHBondContact O-N 3.39Å; F557-L560 PolarHBondContact O-N 2.9Å; F558-L560 VanDerWaalsContact C-N 3.34Å; F558-L560 PolarHBondContact O-N 3.36Å; L560-L563 PolarHBondContact O-N 3.33Å; L560-T564 WeakPolarHBondContact O-CB 3.28Å; L560-T564 WeakPolarHBondContact O-CG2 3.39Å; L560-T564 PolarHBondContact O-N 3.07Å; L560-T564 PolarHBondContact O-OG1 3.33Å
561	V	94.4	Very high	91.7	Very high	48 Å²	48	44.6 Å²	44.6	29%	0.291	23%	0.228	S	C	.	.	H	α-helix	trans	-67.6	-45.3	171.8	172.7	0	0	0	0	110.8	L526 F557 F558 L563 T564 V565	L526-V561 HydrophobicContact CD1-CG2 3.88Å; F557-V561 HydrophobicContact CD1-CG2 4.35Å; F557-V561 HydrophobicContact CE1-CG2 3.92Å; F557-V561 HydrophobicContact CE2-CG2 4.45Å; F557-V561 HydrophobicContact CZ-CG2 3.98Å; F557-V561 WeakPolarHBondContact O-CG2 3.37Å; F557-V561 PolarHBondContact O-N 2.9Å; F558-V561 PolarHBondContact O-N 3.42Å; V561-L563 VanDerWaalsContact C-N 3.27Å; V561-L563 PolarHBondContact O-N 3.06Å; V561-T564 WeakPolarHBondContact CA-OG1 3.23Å; V561-T564 PolarHBondContact O-N 3.22Å; V561-T564 PolarHBondContact O-OG1 2.9Å; V561-V565 WeakPolarHBondContact O-CB 3.24Å; V561-V565 VanDerWaalsContact O-CG2 3.3Å; V561-V565 WeakPolarHBondContact O-CG2 3.37Å; V561-V565 PolarHBondContact O-N 2.98Å
562	I	93.6	Very high	91.4	Very high	85 Å²	85	45.4 Å²	45.4	44%	0.436	24%	0.244	S	C	.	.	H	α-helix	trans	-58.7	-41.5	174.2	-68.5	164.3	0	0	0	110.6	F558 M559 W566 L591	F558-I562 WeakPolarHBondContact O-CG1 3.43Å; F558-I562 PolarHBondContact O-N 3.4Å; M559-I562 PolarHBondContact O-N 3.03Å; M559-I562 HydrophobicContact SD-CD1 4.38Å; I562-W566 WeakPolarHBondContact O-CB 3.28Å; I562-W566 PolarHBondContact O-N 2.98Å; I562-L591 HydrophobicContact CG2-CD2 4.03Å
563	L	92.7	Very high	91.1	Very high	7 Å²	7	46.4 Å²	46.4	4%	0.037	25%	0.25	C	S	.	.	H	α-helix	trans	-68.5	-45.1	179.3	-175.5	66.6	0	0	0	113.6	S506 F510 M559 L560 V561 V565 W566 H567	S506-L563 VanDerWaalsContact CB-CD2 3.41Å; S506-L563 WeakPolarHBondContact OG-CD2 3.31Å; F510-L563 HydrophobicContact CD2-CD1 4.35Å; F510-L563 HydrophobicContact CE2-CD1 3.32Å; F510-L563 HydrophobicContact CZ-CD1 3.48Å; F510-L563 VanDerWaalsContact CZ-CD1 3.48Å; M559-L563 WeakPolarHBondContact O-CB 3.26Å; M559-L563 PolarHBondContact O-N 2.91Å; L560-L563 PolarHBondContact O-N 3.33Å; V561-L563 VanDerWaalsContact C-N 3.27Å; V561-L563 PolarHBondContact O-N 3.06Å; L563-V565 VanDerWaalsContact C-N 3.32Å; L563-V565 PolarHBondContact O-N 3.43Å; L563-W566 WeakPolarHBondContact O-CB 3.22Å; L563-W566 PolarHBondContact O-N 3.09Å; L563-H567 WeakPolarHBondContact CD1-CE1 3.44Å; L563-H567 PolarHBondContact O-N 3.49Å; L563-H567 PolarHBondContact O-ND1 3.4Å
564	T	92.3	Very high	90.6	Very high	15 Å²	15	47.4 Å²	47.4	9%	0.092	26%	0.258	C	S	.	.	H	α-helix	trans	-63.5	-39.5	177.1	45.6	0	0	0	0	111.1	S522 L526 L560 V561 H567 A568	S522-T564 WeakPolarHBondContact O-CG2 3.44Å; L526-T564 HydrophobicContact CB-CG2 4.45Å; L526-T564 HydrophobicContact CD2-CG2 4.44Å; L560-T564 WeakPolarHBondContact O-CB 3.28Å; L560-T564 WeakPolarHBondContact O-CG2 3.39Å; L560-T564 PolarHBondContact O-N 3.07Å; L560-T564 PolarHBondContact O-OG1 3.33Å; V561-T564 WeakPolarHBondContact CA-OG1 3.23Å; V561-T564 PolarHBondContact O-N 3.22Å; V561-T564 PolarHBondContact O-OG1 2.9Å; T564-H567 PolarHBondContact O-N 3.45Å; T564-A568 PolarHBondContact O-N 2.93Å
565	V	92.8	Very high	89.9	Confident	79 Å²	79	50 Å²	50	48%	0.479	29%	0.285	S	S	.	.	H	α-helix	trans	-62.7	-44.6	171	170.8	0	0	0	0	111.4	V561 L563 H567 A568 I569	V561-V565 WeakPolarHBondContact O-CB 3.24Å; V561-V565 VanDerWaalsContact O-CG2 3.3Å; V561-V565 WeakPolarHBondContact O-CG2 3.37Å; V561-V565 PolarHBondContact O-N 2.98Å; L563-V565 VanDerWaalsContact C-N 3.32Å; L563-V565 PolarHBondContact O-N 3.43Å; V565-H567 VanDerWaalsContact C-N 3.33Å; V565-H567 PolarHBondContact O-N 3.17Å; V565-A568 PolarHBondContact O-N 2.89Å; V565-I569 HydrophobicContact CG1-CD1 3.85Å; V565-I569 WeakPolarHBondContact O-CG1 3.14Å; V565-I569 PolarHBondContact O-N 3.07Å
566	W	90.9	Very high	89.5	Confident	42 Å²	42	50.7 Å²	50.7	16%	0.159	29%	0.293	C	S	.	.	H	α-helix	trans	-58.6	-42.6	174.4	177.2	-109.6	0	0	0	112.1	F510 I562 L563 I569 A570 F580 E584 V587	F510-W566 AromaticContact CE1-CD1 3.8Å; F510-W566 AromaticContact CE1-NE1 3.69Å; I562-W566 WeakPolarHBondContact O-CB 3.28Å; I562-W566 PolarHBondContact O-N 2.98Å; L563-W566 WeakPolarHBondContact O-CB 3.22Å; L563-W566 PolarHBondContact O-N 3.09Å; W566-I569 PolarHBondContact O-N 3.48Å; W566-A570 WeakPolarHBondContact O-CB 3.43Å; W566-A570 PolarHBondContact O-N 2.84Å; W566-F580 AromaticContact CH2-CE1 3.64Å; W566-F580 HydrophobicContact CH2-CE1 3.64Å; W566-F580 AromaticContact CH2-CZ 3.88Å; W566-F580 HydrophobicContact CH2-CZ 3.88Å; W566-F580 HydrophobicContact CZ2-CE1 4.33Å; W566-F580 HydrophobicContact CZ3-CE1 4.37Å; W566-F580 HydrophobicContact CZ3-CZ 4.46Å; W566-E584 HydrophobicContact CZ2-CG 4.19Å; W566-V587 HydrophobicContact CD2-CG1 3.85Å; W566-V587 HydrophobicContact CE3-CG1 4.16Å; W566-V587 HydrophobicContact CG-CG1 4.41Å; W566-V587 HydrophobicContact CH2-CB 4.26Å; W566-V587 HydrophobicContact CH2-CG1 4.13Å; W566-V587 HydrophobicContact CH2-CG2 3.75Å; W566-V587 HydrophobicContact CZ2-CB 3.84Å; W566-V587 HydrophobicContact CZ2-CG1 3.82Å; W566-V587 HydrophobicContact CZ2-CG2 3.78Å; W566-V587 HydrophobicContact CZ3-CG1 4.28Å; W566-V587 HydrophobicContact CZ3-CG2 4.43Å
567	H	89.4	Confident	89	Confident	5 Å²	5	57.4 Å²	57.4	2%	0.023	32%	0.322	C	S	.	.	H	α-helix	trans	-67.8	-35.4	178.6	-69.7	11.1	0	0	0	112.9	A509 R518 L563 T564 V565 R571	A509-H567 WeakPolarHBondContact CB-NE2 3.46Å; R518-H567 PolarHBondContact NE-CD2 3.39Å; R518-H567 PolarHBondContact NE-CE1 2.85Å; R518-H567 PolarHBondContact NE-NE2 2.99Å; R518-H567 PolarHBondContact NH2-CE1 3.01Å; R518-H567 PolarHBondContact NH2-ND1 3.18Å; L563-H567 WeakPolarHBondContact CD1-CE1 3.44Å; L563-H567 PolarHBondContact O-N 3.49Å; L563-H567 PolarHBondContact O-ND1 3.4Å; T564-H567 PolarHBondContact O-N 3.45Å; V565-H567 VanDerWaalsContact C-N 3.33Å; V565-H567 PolarHBondContact O-N 3.17Å; H567-R571 PolarHBondContact O-N 2.95Å
568	A	89.3	Confident	88.3	Confident	46 Å²	46	59.3 Å²	59.3	38%	0.38	34%	0.34	S	S	.	.	H	α-helix	trans	-64.8	-44	172.1	0	0	0	0	0	111.8	L519 T564 V565 R571 A572	L519-A568 HydrophobicContact CD1-CB 4.46Å; T564-A568 PolarHBondContact O-N 2.93Å; V565-A568 PolarHBondContact O-N 2.89Å; A568-R571 PolarHBondContact O-N 2.96Å; A568-A572 PolarHBondContact O-N 3.44Å; A568-A572 VanDerWaalsContact O-N 3.08Å
569	I	88.7	Confident	87.5	Confident	77 Å²	77	61.2 Å²	61.2	40%	0.395	35%	0.348	S	S	.	.	H	α-helix	trans	-63.7	-46.4	175.2	-66.9	166.9	0	0	0	110.7	V565 W566 R571 A572 V573	V565-I569 HydrophobicContact CG1-CD1 3.85Å; V565-I569 WeakPolarHBondContact O-CG1 3.14Å; V565-I569 PolarHBondContact O-N 3.07Å; W566-I569 PolarHBondContact O-N 3.48Å; I569-R571 VanDerWaalsContact C-N 3.31Å; I569-R571 PolarHBondContact O-N 3.33Å; I569-A572 PolarHBondContact O-N 3.28Å; I569-A572 VanDerWaalsContact O-N 3.13Å; I569-V573 HydrophobicContact CG2-CG2 4.07Å; I569-V573 WeakPolarHBondContact O-CG2 3.42Å; I569-V573 PolarHBondContact O-N 3.44Å
570	A	87.3	Confident	86.8	Confident	4 Å²	4	63.9 Å²	63.9	3%	0.033	36%	0.359	C	S	.	.	H	α-helix	trans	-58.2	-42.1	178.6	0	0	0	0	0	111.9	W566 S574	W566-A570 WeakPolarHBondContact O-CB 3.43Å; W566-A570 PolarHBondContact O-N 2.84Å; A570-S574 VanDerWaalsContact O-CB 3.28Å; A570-S574 WeakPolarHBondContact O-CB 3.44Å; A570-S574 PolarHBondContact O-N 3.27Å
571	R	85.9	Confident	86	Confident	123 Å²	123	67 Å²	67	46%	0.464	38%	0.376	S	S	.	.	H	α-helix	trans	-63.7	-44	174.2	-172.7	175.9	-178	83.6	-3.3	112.4	A514 N515 H567 A568 I569	A514-R571 PolarHBondContact O-NH1 3.46Å; N515-R571 VanDerWaalsContact C-NH1 3.34Å; N515-R571 PolarHBondContact O-NH1 3.44Å; H567-R571 PolarHBondContact O-N 2.95Å; A568-R571 PolarHBondContact O-N 2.96Å; I569-R571 VanDerWaalsContact C-N 3.31Å; I569-R571 PolarHBondContact O-N 3.33Å
572	A	85.9	Confident	85.1	Confident	69 Å²	69	70.9 Å²	70.9	57%	0.57	39%	0.391	S	S	*	.	H	α-helix	trans	-66	-40.1	178.5	0	0	0	0	0	112.6	A568 I569	A568-A572 PolarHBondContact O-N 3.44Å; A568-A572 VanDerWaalsContact O-N 3.08Å; I569-A572 PolarHBondContact O-N 3.28Å; I569-A572 VanDerWaalsContact O-N 3.13Å
573	V	85.6	Confident	84.6	Confident	39 Å²	39	73.7 Å²	73.7	24%	0.236	40%	0.397	C	S	.	.	H	α-helix	trans	-75.8	-32.4	178.9	-179.5	0	0	0	0	111.8	I569 A575 S576 K577 F580	I569-V573 HydrophobicContact CG2-CG2 4.07Å; I569-V573 WeakPolarHBondContact O-CG2 3.42Å; I569-V573 PolarHBondContact O-N 3.44Å; V573-A575 PolarHBondContact O-N 3.01Å; V573-S576 PolarHBondContact O-N 3.45Å; V573-K577 HydrophobicContact CG1-CB 4.4Å; V573-K577 PolarHBondContact O-N 3.4Å; V573-F580 HydrophobicContact CB-CD1 4.13Å; V573-F580 HydrophobicContact CG1-CB 3.62Å; V573-F580 HydrophobicContact CG1-CD1 3.57Å; V573-F580 HydrophobicContact CG1-CD2 4.49Å; V573-F580 HydrophobicContact CG1-CE1 4.35Å; V573-F580 HydrophobicContact CG1-CG 3.64Å
574	S	82.5	Confident	84.3	Confident	26 Å²	26	74.1 Å²	74.1	18%	0.182	40%	0.399	C	S	.	.	H	α-helix	trans	-52.5	-41.7	173.7	-173.9	0	0	0	0	111.9	A570 S576	A570-S574 VanDerWaalsContact O-CB 3.28Å; A570-S574 WeakPolarHBondContact O-CB 3.44Å; A570-S574 PolarHBondContact O-N 3.27Å; S574-S576 PolarHBondContact O-N 3.22Å
575	A	79.1	Confident	83.9	Confident	96 Å²	96	78.8 Å²	78.8	79%	0.793	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-14.1	177.5	0	0	0	0	0	114.9	V573	V573-A575 PolarHBondContact O-N 3.01Å
576	S	83.5	Confident	83.7	Confident	90 Å²	90	82.9 Å²	82.9	63%	0.629	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	-40.3	-176.5	-178.3	0	0	0	0	113.6	V573 S574	V573-S576 PolarHBondContact O-N 3.45Å; S574-S576 PolarHBondContact O-N 3.22Å
577	K	81.7	Confident	83.6	Confident	145 Å²	145	82.7 Å²	82.7	63%	0.63	43%	0.43	S	S	*	.			trans	-147.4	85	-172.7	-67.3	-176.1	-177.8	176.3	0	110.6	V573 K579 F580	V573-K577 HydrophobicContact CG1-CB 4.4Å; V573-K577 PolarHBondContact O-N 3.4Å; K577-K579 PolarHBondContact O-N 3.44Å; K577-K579 VanDerWaalsContact O-N 3.13Å; K577-F580 WeakPolarHBondContact O-CB 3.28Å; K577-F580 PolarHBondContact O-N 3.4Å
578	P	78.2	Confident	83.7	Confident	95 Å²	95	84 Å²	84	62%	0.617	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-59.1	-29.7	-177	21.5	-33.3	0	0	0	113.7	F580 L581	P578-F580 PolarHBondContact O-N 3.31Å; P578-F580 VanDerWaalsContact O-N 3.08Å; P578-L581 WeakPolarHBondContact O-CB 3.47Å; P578-L581 PolarHBondContact O-N 3.07Å
579	K	77.4	Confident	83.8	Confident	162 Å²	162	88.6 Å²	88.6	70%	0.704	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-58.8	-18.7	174	-65.1	-167.6	174.1	-169	0	114.7	K577 L581	K577-K579 PolarHBondContact O-N 3.44Å; K577-K579 VanDerWaalsContact O-N 3.13Å; K579-L581 PolarHBondContact O-N 2.72Å
580	F	78.6	Confident	84	Confident	86 Å²	86	88.1 Å²	88.1	38%	0.377	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-68.2	-26.5	174.7	-171	-102.7	0	0	0	112.1	W566 V573 K577 P578 E582 Y583	W566-F580 AromaticContact CH2-CE1 3.64Å; W566-F580 HydrophobicContact CH2-CE1 3.64Å; W566-F580 AromaticContact CH2-CZ 3.88Å; W566-F580 HydrophobicContact CH2-CZ 3.88Å; W566-F580 HydrophobicContact CZ2-CE1 4.33Å; W566-F580 HydrophobicContact CZ3-CE1 4.37Å; W566-F580 HydrophobicContact CZ3-CZ 4.46Å; V573-F580 HydrophobicContact CB-CD1 4.13Å; V573-F580 HydrophobicContact CG1-CB 3.62Å; V573-F580 HydrophobicContact CG1-CD1 3.57Å; V573-F580 HydrophobicContact CG1-CD2 4.49Å; V573-F580 HydrophobicContact CG1-CE1 4.35Å; V573-F580 HydrophobicContact CG1-CG 3.64Å; K577-F580 WeakPolarHBondContact O-CB 3.28Å; K577-F580 PolarHBondContact O-N 3.4Å; P578-F580 PolarHBondContact O-N 3.31Å; P578-F580 VanDerWaalsContact O-N 3.08Å; F580-E582 PolarHBondContact O-N 3.47Å; F580-Y583 PolarHBondContact O-N 3.25Å
581	L	75.5	Confident	84.2	Confident	69 Å²	69	89.4 Å²	89.4	36%	0.361	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-65.6	-26.3	-179.6	-156.7	75.6	0	0	0	112.6	A514 P578 K579 Y583 E584	A514-L581 HydrophobicContact CB-CD1 4.05Å; P578-L581 WeakPolarHBondContact O-CB 3.47Å; P578-L581 PolarHBondContact O-N 3.07Å; K579-L581 PolarHBondContact O-N 2.72Å; L581-Y583 PolarHBondContact O-N 3.17Å; L581-E584 VanDerWaalsContact CD1-OE2 3.25Å; L581-E584 WeakPolarHBondContact CD1-OE2 3.35Å; L581-E584 WeakPolarHBondContact O-CB 3.4Å; L581-E584 PolarHBondContact O-N 2.94Å; L581-E584 VanDerWaalsContact O-N 3.09Å
582	E	77.1	Confident	84.6	Confident	129 Å²	129	86 Å²	86	60%	0.603	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-57.5	-36.2	174.9	-64.1	168.9	-143.8	0	0	111.4	F580 E584	F580-E582 PolarHBondContact O-N 3.47Å; E582-E584 VanDerWaalsContact C-N 3.3Å; E582-E584 PolarHBondContact O-N 3.03Å
583	Y	81.6	Confident	85	Confident	144 Å²	144	85.8 Å²	85.8	57%	0.565	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-78.8	-7.8	-179.9	-64.4	-81.6	0	0	0	114.4	F580 L581 H585 Y586	F580-Y583 PolarHBondContact O-N 3.25Å; L581-Y583 PolarHBondContact O-N 3.17Å; Y583-H585 VanDerWaalsContact C-N 3.26Å; Y583-H585 PolarHBondContact O-N 2.96Å; Y583-Y586 HydrophobicContact CD1-CD2 4.21Å; Y583-Y586 HydrophobicContact CD1-CE2 4.37Å; Y583-Y586 PolarHBondContact O-N 3.49Å; Y583-Y586 VanDerWaalsContact O-N 3.12Å
584	E	86.1	Confident	85.4	Confident	16 Å²	16	87.8 Å²	87.8	8%	0.075	45%	0.454	C	S	.	.	H	α-helix	trans	-61.6	-34.5	-172.9	-162.1	-170.5	110.7	0	0	112.7	F510 R518 W566 L581 E582 Y586 V587 M588	F510-E584 HydrophobicContact CD1-CG 4.06Å; F510-E584 VanDerWaalsContact CD1-OE1 3.28Å; F510-E584 WeakPolarHBondContact CD1-OE1 3.47Å; F510-E584 HydrophobicContact CE1-CG 4.24Å; R518-E584 IonicContact CZ-OE1 3.18Å; R518-E584 IonicContact CZ-OE2 3.63Å; R518-E584 IonicContact NH1-OE1 2.87Å; R518-E584 PolarHBondContact NH1-OE1 2.92Å; R518-E584 IonicContact NH1-OE2 2.78Å; R518-E584 PolarHBondContact NH1-OE2 2.89Å; R518-E584 VanDerWaalsContact NH2-CD 3.32Å; R518-E584 IonicContact NH2-OE1 2.72Å; R518-E584 PolarHBondContact NH2-OE1 3.06Å; R518-E584 IonicContact NH2-OE2 3.76Å; W566-E584 HydrophobicContact CZ2-CG 4.19Å; L581-E584 VanDerWaalsContact CD1-OE2 3.25Å; L581-E584 WeakPolarHBondContact CD1-OE2 3.35Å; L581-E584 WeakPolarHBondContact O-CB 3.4Å; L581-E584 PolarHBondContact O-N 2.94Å; L581-E584 VanDerWaalsContact O-N 3.09Å; E582-E584 VanDerWaalsContact C-N 3.3Å; E582-E584 PolarHBondContact O-N 3.03Å; E584-Y586 VanDerWaalsContact C-N 3.32Å; E584-Y586 PolarHBondContact O-N 3.5Å; E584-V587 PolarHBondContact O-N 2.89Å; E584-V587 VanDerWaalsContact O-N 3.08Å; E584-M588 PolarHBondContact O-N 2.92Å
585	H	84.9	Confident	85.9	Confident	113 Å²	113	86.9 Å²	86.9	52%	0.523	45%	0.447	S	S	.	.	H	α-helix	trans	-58.1	-40.8	176.3	-60.7	94.6	0	0	0	112.5	Y583 V587 M588 Y589	Y583-H585 VanDerWaalsContact C-N 3.26Å; Y583-H585 PolarHBondContact O-N 2.96Å; H585-V587 VanDerWaalsContact C-N 3.28Å; H585-V587 PolarHBondContact O-N 3.26Å; H585-M588 WeakPolarHBondContact O-CB 3.43Å; H585-M588 PolarHBondContact O-N 3.44Å; H585-Y589 HydrophobicContact CB-CE2 4.15Å; H585-Y589 WeakPolarHBondContact O-CD2 3.08Å; H585-Y589 PolarHBondContact O-N 3.24Å
586	Y	88.9	Confident	86.6	Confident	165 Å²	165	85 Å²	85	65%	0.647	43%	0.428	S	S	*	.	H	α-helix	trans	-65.4	-33.4	177.1	-62.2	-75.1	0	0	0	112.1	Y583 E584 S590	Y583-Y586 HydrophobicContact CD1-CD2 4.21Å; Y583-Y586 HydrophobicContact CD1-CE2 4.37Å; Y583-Y586 PolarHBondContact O-N 3.49Å; Y583-Y586 VanDerWaalsContact O-N 3.12Å; E584-Y586 VanDerWaalsContact C-N 3.32Å; E584-Y586 PolarHBondContact O-N 3.5Å; Y586-S590 WeakPolarHBondContact O-CB 3.23Å; Y586-S590 PolarHBondContact O-N 2.87Å; Y586-S590 PolarHBondContact O-OG 3.42Å
587	V	88.7	Confident	87.2	Confident	37 Å²	37	85.2 Å²	85.2	22%	0.224	42%	0.421	C	S	.	.	H	α-helix	trans	-74.3	-37.7	176.2	-177.9	0	0	0	0	111.3	W566 E584 H585 S590 L591	W566-V587 HydrophobicContact CD2-CG1 3.85Å; W566-V587 HydrophobicContact CE3-CG1 4.16Å; W566-V587 HydrophobicContact CG-CG1 4.41Å; W566-V587 HydrophobicContact CH2-CB 4.26Å; W566-V587 HydrophobicContact CH2-CG1 4.13Å; W566-V587 HydrophobicContact CH2-CG2 3.75Å; W566-V587 HydrophobicContact CZ2-CB 3.84Å; W566-V587 HydrophobicContact CZ2-CG1 3.82Å; W566-V587 HydrophobicContact CZ2-CG2 3.78Å; W566-V587 HydrophobicContact CZ3-CG1 4.28Å; W566-V587 HydrophobicContact CZ3-CG2 4.43Å; E584-V587 PolarHBondContact O-N 2.89Å; E584-V587 VanDerWaalsContact O-N 3.08Å; H585-V587 VanDerWaalsContact C-N 3.28Å; H585-V587 PolarHBondContact O-N 3.26Å; V587-S590 PolarHBondContact O-OG 3.47Å; V587-L591 HydrophobicContact CG1-CD1 3.93Å; V587-L591 HydrophobicContact CG1-CG 4.34Å; V587-L591 WeakPolarHBondContact O-CB 3.32Å; V587-L591 WeakPolarHBondContact O-CG 3.06Å; V587-L591 PolarHBondContact O-N 2.96Å
588	M	90.7	Very high	87.7	Confident	33 Å²	33	80.1 Å²	80.1	16%	0.163	41%	0.409	C	S	.	.	H	α-helix	trans	-58	-51.6	170	-174.2	-169.9	63.7	0	0	111	F507 F510 E584 H585 S590 L592	F507-M588 HydrophobicContact CD1-CG 4.26Å; F510-M588 HydrophobicContact CB-CG 4.17Å; F510-M588 HydrophobicContact CB-SD 3.71Å; F510-M588 HydrophobicContact CD1-CB 3.63Å; F510-M588 HydrophobicContact CD1-CG 3.92Å; F510-M588 HydrophobicContact CD1-SD 4.46Å; F510-M588 HydrophobicContact CD2-CB 4.3Å; F510-M588 HydrophobicContact CD2-CG 3.73Å; F510-M588 HydrophobicContact CD2-SD 4.29Å; F510-M588 HydrophobicContact CE1-CB 3.67Å; F510-M588 HydrophobicContact CE1-CG 4.18Å; F510-M588 HydrophobicContact CE2-CB 4.29Å; F510-M588 HydrophobicContact CE2-CG 3.96Å; F510-M588 HydrophobicContact CG-CB 3.97Å; F510-M588 HydrophobicContact CG-CG 3.7Å; F510-M588 HydrophobicContact CG-SD 3.95Å; F510-M588 HydrophobicContact CZ-CB 4.01Å; F510-M588 HydrophobicContact CZ-CG 4.2Å; E584-M588 PolarHBondContact O-N 2.92Å; H585-M588 WeakPolarHBondContact O-CB 3.43Å; H585-M588 PolarHBondContact O-N 3.44Å; M588-S590 PolarHBondContact O-N 3.38Å; M588-L592 VanDerWaalsContact O-CB 3.25Å; M588-L592 WeakPolarHBondContact O-CB 3.29Å; M588-L592 PolarHBondContact O-N 3.27Å
589	Y	91.6	Very high	88.4	Confident	143 Å²	143	77.7 Å²	77.7	56%	0.561	39%	0.394	S	S	*	.	H	α-helix	trans	-65.7	-37.3	-178.9	-65.8	-51.5	0	0	0	112.8	H585 S593	H585-Y589 HydrophobicContact CB-CE2 4.15Å; H585-Y589 WeakPolarHBondContact O-CD2 3.08Å; H585-Y589 PolarHBondContact O-N 3.24Å; Y589-S593 WeakPolarHBondContact O-CB 3.35Å; Y589-S593 PolarHBondContact O-N 2.85Å
590	S	92.6	Very high	89.2	Confident	66 Å²	66	74.9 Å²	74.9	46%	0.462	39%	0.391	S	S	.	.	H	α-helix	trans	-70.4	-42.3	178.4	69.3	0	0	0	0	112.5	Y586 V587 M588 S593 C594	Y586-S590 WeakPolarHBondContact O-CB 3.23Å; Y586-S590 PolarHBondContact O-N 2.87Å; Y586-S590 PolarHBondContact O-OG 3.42Å; V587-S590 PolarHBondContact O-OG 3.47Å; M588-S590 PolarHBondContact O-N 3.38Å; S590-S593 PolarHBondContact O-N 2.85Å; S590-C594 WeakPolarHBondContact O-CB 3.3Å; S590-C594 PolarHBondContact O-N 3.19Å
591	L	93	Very high	89.9	Confident	31 Å²	31	75.6 Å²	75.6	16%	0.162	40%	0.398	C	S	.	.	H	α-helix	trans	-66	-40.8	174.9	-70.9	173.8	0	0	0	112	F507 F510 M559 I562 V587 Y595	F507-L591 HydrophobicContact CE1-CB 4.02Å; F507-L591 HydrophobicContact CZ-CB 4.49Å; F510-L591 HydrophobicContact CZ-CD1 4.44Å; M559-L591 HydrophobicContact CE-CD2 4.33Å; I562-L591 HydrophobicContact CG2-CD2 4.03Å; V587-L591 HydrophobicContact CG1-CD1 3.93Å; V587-L591 HydrophobicContact CG1-CG 4.34Å; V587-L591 WeakPolarHBondContact O-CB 3.32Å; V587-L591 WeakPolarHBondContact O-CG 3.06Å; V587-L591 PolarHBondContact O-N 2.96Å; L591-Y595 WeakPolarHBondContact O-CB 3.5Å; L591-Y595 PolarHBondContact O-N 3.43Å
592	L	94	Very high	90.8	Very high	53 Å²	53	75.2 Å²	75.2	28%	0.277	39%	0.394	S	S	.	.	H	α-helix	trans	-67.1	-43.4	176.4	-179.1	60.2	0	0	0	111.7	L504 F507 M588 Y595 C596	L504-L592 HydrophobicContact CD2-CD1 4.23Å; F507-L592 HydrophobicContact CD1-CB 4.01Å; F507-L592 HydrophobicContact CD1-CD1 4.36Å; F507-L592 HydrophobicContact CD2-CD1 3.87Å; F507-L592 HydrophobicContact CE1-CB 3.67Å; F507-L592 HydrophobicContact CE1-CD1 4.29Å; F507-L592 HydrophobicContact CE2-CD1 3.79Å; F507-L592 HydrophobicContact CG-CD1 4.16Å; F507-L592 HydrophobicContact CZ-CB 4Å; F507-L592 HydrophobicContact CZ-CD1 4.01Å; M588-L592 VanDerWaalsContact O-CB 3.25Å; M588-L592 WeakPolarHBondContact O-CB 3.29Å; M588-L592 PolarHBondContact O-N 3.27Å; L592-Y595 PolarHBondContact O-N 3.36Å; L592-C596 WeakPolarHBondContact O-CB 3.32Å; L592-C596 PolarHBondContact O-N 2.91Å; L592-C596 PolarHBondContact O-SG 2.9Å; L592-C596 VanDerWaalsContact O-SG 3.33Å
593	S	93.8	Very high	91.5	Very high	63 Å²	63	70.9 Å²	70.9	44%	0.441	38%	0.383	S	S	.	.	H	α-helix	trans	-62.2	-46.7	175.7	-176.8	0	0	0	0	111.3	Y589 S590 Y595 C596 I597	Y589-S593 WeakPolarHBondContact O-CB 3.35Å; Y589-S593 PolarHBondContact O-N 2.85Å; S590-S593 PolarHBondContact O-N 2.85Å; S593-Y595 VanDerWaalsContact C-N 3.33Å; S593-Y595 PolarHBondContact O-N 3.12Å; S593-C596 PolarHBondContact O-N 3.44Å; S593-I597 WeakPolarHBondContact O-CB 3.47Å; S593-I597 WeakPolarHBondContact O-CD1 3.25Å; S593-I597 VanDerWaalsContact O-CG1 3.23Å; S593-I597 WeakPolarHBondContact O-CG1 3.45Å; S593-I597 PolarHBondContact O-N 3.21Å
594	C	93.9	Very high	92	Very high	81 Å²	81	68.3 Å²	68.3	55%	0.547	38%	0.379	S	S	.	.	H	α-helix	trans	-58.7	-43.6	175.1	-173.1	0	0	0	0	111.8	S590 G598	S590-C594 WeakPolarHBondContact O-CB 3.3Å; S590-C594 PolarHBondContact O-N 3.19Å; C594-G598 PolarHBondContact O-N 3.05Å
595	Y	94	Very high	92.3	Very high	8 Å²	8	71.5 Å²	71.5	3%	0.031	40%	0.4	C	S	.	.	H	α-helix	trans	-61	-54.4	176	-178.3	-111.9	0	0	0	111.7	C503 L504 F507 N556 M559 L591 L592 S593 I597 G598 S599	C503-Y595 HydrophobicContact CB-CE1 4.23Å; C503-Y595 HydrophobicContact CB-CE2 4.13Å; C503-Y595 WeakPolarHBondContact CB-OH 3.26Å; C503-Y595 WeakPolarHBondContact SG-CE2 3.35Å; L504-Y595 HydrophobicContact CD2-CD1 4.14Å; L504-Y595 HydrophobicContact CD2-CE1 3.95Å; L504-Y595 HydrophobicContact CG-CE1 4.22Å; F507-Y595 HydrophobicContact CE2-CD1 4.42Å; N556-Y595 VanDerWaalsContact OD1-CE2 3.26Å; N556-Y595 WeakPolarHBondContact OD1-CE2 3.49Å; N556-Y595 PolarHBondContact OD1-OH 3.29Å; M559-Y595 HydrophobicContact CG-CD2 4.07Å; L591-Y595 WeakPolarHBondContact O-CB 3.5Å; L591-Y595 PolarHBondContact O-N 3.43Å; L592-Y595 PolarHBondContact O-N 3.36Å; S593-Y595 VanDerWaalsContact C-N 3.33Å; S593-Y595 PolarHBondContact O-N 3.12Å; Y595-I597 PolarHBondContact O-N 3.21Å; Y595-G598 PolarHBondContact O-N 3.24Å; Y595-S599 WeakPolarHBondContact O-CB 3.37Å; Y595-S599 PolarHBondContact O-N 2.99Å; Y595-S599 PolarHBondContact O-OG 3.46Å
596	C	93.6	Very high	92.7	Very high	56 Å²	56	66.5 Å²	66.5	38%	0.378	38%	0.377	S	S	.	.	H	α-helix	trans	-60	-43.7	-179.3	-70.8	0	0	0	0	112.4	L592 S593 S599 V600	L592-C596 WeakPolarHBondContact O-CB 3.32Å; L592-C596 PolarHBondContact O-N 2.91Å; L592-C596 PolarHBondContact O-SG 2.9Å; L592-C596 VanDerWaalsContact O-SG 3.33Å; S593-C596 PolarHBondContact O-N 3.44Å; C596-S599 PolarHBondContact O-N 3.26Å; C596-V600 WeakPolarHBondContact O-CB 3.45Å; C596-V600 VanDerWaalsContact O-CG2 3.28Å; C596-V600 WeakPolarHBondContact O-CG2 3.43Å; C596-V600 PolarHBondContact O-N 3.37Å
597	I	95	Very high	92.8	Very high	94 Å²	94	66.8 Å²	66.8	48%	0.482	38%	0.378	S	S	.	.	H	α-helix	trans	-63.7	-47	176.9	-68.2	166.2	0	0	0	110.3	S593 Y595 S599 V600 L601	S593-I597 WeakPolarHBondContact O-CB 3.47Å; S593-I597 WeakPolarHBondContact O-CD1 3.25Å; S593-I597 VanDerWaalsContact O-CG1 3.23Å; S593-I597 WeakPolarHBondContact O-CG1 3.45Å; S593-I597 PolarHBondContact O-N 3.21Å; Y595-I597 PolarHBondContact O-N 3.21Å; I597-S599 PolarHBondContact O-N 2.96Å; I597-V600 PolarHBondContact O-N 3.48Å; I597-L601 HydrophobicContact CG2-CD1 3.79Å; I597-L601 HydrophobicContact CG2-CG 4.33Å; I597-L601 WeakPolarHBondContact O-CB 3.44Å; I597-L601 VanDerWaalsContact O-CG 3.29Å; I597-L601 WeakPolarHBondContact O-CG 3.49Å; I597-L601 PolarHBondContact O-N 3.28Å
598	G	93.5	Very high	92.9	Very high	38 Å²	38	70 Å²	70	39%	0.392	39%	0.393	S	S	.	.	H	α-helix	trans	-59.7	-44.3	176.7	0	0	0	0	0	112.9	C594 Y595 L601 F602	C594-G598 PolarHBondContact O-N 3.05Å; Y595-G598 PolarHBondContact O-N 3.24Å; G598-L601 PolarHBondContact O-N 3.48Å; G598-F602 VanDerWaalsContact O-CB 3.31Å; G598-F602 WeakPolarHBondContact O-CB 3.35Å; G598-F602 PolarHBondContact O-N 3.08Å
599	S	92.5	Very high	92.9	Very high	44 Å²	44	70.3 Å²	70.3	31%	0.308	40%	0.396	S	S	.	.	H	α-helix	trans	-63.8	-41.2	176.5	-61.9	0	0	0	0	112.6	Y595 C596 I597 G603	Y595-S599 WeakPolarHBondContact O-CB 3.37Å; Y595-S599 PolarHBondContact O-N 2.99Å; Y595-S599 PolarHBondContact O-OG 3.46Å; C596-S599 PolarHBondContact O-N 3.26Å; I597-S599 PolarHBondContact O-N 2.96Å; S599-G603 PolarHBondContact O-N 2.91Å
600	V	93.1	Very high	92.7	Very high	104 Å²	104	63.8 Å²	63.8	63%	0.63	37%	0.372	S	S	*	.	H	α-helix	trans	-68.4	-43.5	177.1	169.1	0	0	0	0	111.4	C596 I597 G603 L604	C596-V600 WeakPolarHBondContact O-CB 3.45Å; C596-V600 VanDerWaalsContact O-CG2 3.28Å; C596-V600 WeakPolarHBondContact O-CG2 3.43Å; C596-V600 PolarHBondContact O-N 3.37Å; I597-V600 PolarHBondContact O-N 3.48Å; V600-G603 PolarHBondContact O-N 3.43Å; V600-L604 VanDerWaalsContact O-CB 3.31Å; V600-L604 WeakPolarHBondContact O-CB 3.44Å; V600-L604 PolarHBondContact O-N 3.3Å
601	L	94.3	Very high	92.4	Very high	101 Å²	101	61.7 Å²	61.7	53%	0.529	36%	0.36	S	S	.	.	H	α-helix	trans	-64.5	-40.9	176.4	-70.4	173.4	0	0	0	112.1	I597 G598 T605	I597-L601 HydrophobicContact CG2-CD1 3.79Å; I597-L601 HydrophobicContact CG2-CG 4.33Å; I597-L601 WeakPolarHBondContact O-CB 3.44Å; I597-L601 VanDerWaalsContact O-CG 3.29Å; I597-L601 WeakPolarHBondContact O-CG 3.49Å; I597-L601 PolarHBondContact O-N 3.28Å; G598-L601 PolarHBondContact O-N 3.48Å; L601-T605 WeakPolarHBondContact O-CG2 3.36Å; L601-T605 PolarHBondContact O-N 2.89Å; L601-T605 PolarHBondContact O-OG1 3.23Å
602	F	93.8	Very high	92.2	Very high	61 Å²	61	63.8 Å²	63.8	27%	0.268	38%	0.377	S	S	.	.	H	α-helix	trans	-66.1	-46.7	174.5	-175	-91.7	0	0	0	111.3	Y548 K551 V552 G598 L604 T605 V606	Y548-F602 HydrophobicContact CD1-CE2 4.25Å; Y548-F602 AromaticContact CD1-CZ 3.87Å; Y548-F602 HydrophobicContact CD1-CZ 3.87Å; Y548-F602 HydrophobicContact CG-CZ 4.4Å; K551-F602 HydrophobicContact CB-CE2 3.9Å; K551-F602 HydrophobicContact CB-CZ 3.92Å; K551-F602 HydrophobicContact CD-CE2 4.23Å; V552-F602 HydrophobicContact CG2-CD1 3.92Å; V552-F602 HydrophobicContact CG2-CE1 3.34Å; V552-F602 HydrophobicContact CG2-CZ 4.01Å; G598-F602 VanDerWaalsContact O-CB 3.31Å; G598-F602 WeakPolarHBondContact O-CB 3.35Å; G598-F602 PolarHBondContact O-N 3.08Å; F602-L604 VanDerWaalsContact C-N 3.31Å; F602-L604 PolarHBondContact O-N 2.84Å; F602-T605 WeakPolarHBondContact CA-OG1 3.35Å; F602-T605 PolarHBondContact O-N 3.28Å; F602-T605 PolarHBondContact O-OG1 3.02Å; F602-V606 HydrophobicContact CD1-CG2 4.11Å; F602-V606 HydrophobicContact CE1-CG2 3.67Å; F602-V606 HydrophobicContact CE2-CG2 4.36Å; F602-V606 HydrophobicContact CZ-CG2 3.82Å; F602-V606 WeakPolarHBondContact O-CG2 3.35Å; F602-V606 PolarHBondContact O-N 3.4Å
603	G	92.3	Very high	91.8	Very high	37 Å²	37	64.9 Å²	64.9	38%	0.381	38%	0.378	S	S	.	.	H	α-helix	trans	-57.5	-42.1	175.7	0	0	0	0	0	112.8	S599 V600 Y607	S599-G603 PolarHBondContact O-N 2.91Å; V600-G603 PolarHBondContact O-N 3.43Å; G603-Y607 VanDerWaalsContact O-CB 3.25Å; G603-Y607 WeakPolarHBondContact O-CB 3.33Å; G603-Y607 PolarHBondContact O-N 3.45Å
604	L	92.6	Very high	91.3	Very high	90 Å²	90	69 Å²	69	47%	0.471	38%	0.384	S	S	.	.	H	α-helix	trans	-65.9	-44.9	177	-178.6	61.1	0	0	0	112.4	V600 F602 Y607 L608	V600-L604 VanDerWaalsContact O-CB 3.31Å; V600-L604 WeakPolarHBondContact O-CB 3.44Å; V600-L604 PolarHBondContact O-N 3.3Å; F602-L604 VanDerWaalsContact C-N 3.31Å; F602-L604 PolarHBondContact O-N 2.84Å; L604-Y607 PolarHBondContact O-N 3.13Å; L604-L608 HydrophobicContact CD1-CD1 4.05Å; L604-L608 HydrophobicContact CD1-CG 4.16Å; L604-L608 HydrophobicContact CG-CD1 4.01Å; L604-L608 WeakPolarHBondContact O-CB 3.38Å; L604-L608 VanDerWaalsContact O-CG 3.27Å; L604-L608 WeakPolarHBondContact O-CG 3.06Å; L604-L608 PolarHBondContact O-N 3.02Å
605	T	92.4	Very high	90.9	Very high	84 Å²	84	74.6 Å²	74.6	52%	0.515	39%	0.393	S	S	.	.	H	α-helix	trans	-65.2	-40.3	179.2	49.5	0	0	0	0	112	L601 F602 L608 D609	L601-T605 WeakPolarHBondContact O-CG2 3.36Å; L601-T605 PolarHBondContact O-N 2.89Å; L601-T605 PolarHBondContact O-OG1 3.23Å; F602-T605 WeakPolarHBondContact CA-OG1 3.35Å; F602-T605 PolarHBondContact O-N 3.28Å; F602-T605 PolarHBondContact O-OG1 3.02Å; T605-L608 PolarHBondContact O-N 3Å; T605-D609 PolarHBondContact O-N 3.28Å; T605-D609 VanDerWaalsContact O-N 3.09Å
606	V	91.9	Very high	90.6	Very high	8 Å²	8	79 Å²	79	5%	0.048	42%	0.417	C	S	.	.	H	α-helix	trans	-66.9	-40.6	173.5	175.6	0	0	0	0	111.9	F408 Y548 F602 L608 D609 A610	F408-V606 HydrophobicContact CD2-CG1 3.52Å; F408-V606 HydrophobicContact CE2-CG1 3.47Å; F408-V606 VanDerWaalsContact CE2-CG1 3.47Å; F408-V606 HydrophobicContact CG-CG1 4.45Å; F408-V606 HydrophobicContact CZ-CG1 4.35Å; Y548-V606 HydrophobicContact CD1-CG2 3.8Å; Y548-V606 HydrophobicContact CD2-CG1 4.18Å; Y548-V606 HydrophobicContact CD2-CG2 4.09Å; Y548-V606 HydrophobicContact CE1-CG2 3.94Å; Y548-V606 HydrophobicContact CE2-CG1 4.43Å; Y548-V606 HydrophobicContact CE2-CG2 4.22Å; Y548-V606 HydrophobicContact CG-CG2 3.91Å; F602-V606 HydrophobicContact CD1-CG2 4.11Å; F602-V606 HydrophobicContact CE1-CG2 3.67Å; F602-V606 HydrophobicContact CE2-CG2 4.36Å; F602-V606 HydrophobicContact CZ-CG2 3.82Å; F602-V606 WeakPolarHBondContact O-CG2 3.35Å; F602-V606 PolarHBondContact O-N 3.4Å; V606-L608 PolarHBondContact O-N 2.93Å; V606-D609 PolarHBondContact O-N 3.1Å; V606-A610 VanDerWaalsContact O-CB 3.25Å; V606-A610 WeakPolarHBondContact O-CB 3.39Å; V606-A610 PolarHBondContact O-N 2.87Å
607	Y	90.7	Very high	90.1	Very high	170 Å²	170	77.1 Å²	77.1	67%	0.667	40%	0.403	S	S	*	.	H	α-helix	trans	-62.5	-40.3	176.1	178.9	-95	0	0	0	112.3	G603 L604 G611	G603-Y607 VanDerWaalsContact O-CB 3.25Å; G603-Y607 WeakPolarHBondContact O-CB 3.33Å; G603-Y607 PolarHBondContact O-N 3.45Å; L604-Y607 PolarHBondContact O-N 3.13Å; Y607-G611 WeakPolarHBondContact O-CA 2.99Å; Y607-G611 PolarHBondContact O-N 3.3Å
608	L	91.8	Very high	89.6	Confident	105 Å²	105	78.4 Å²	78.4	55%	0.55	41%	0.405	S	S	.	.	H	α-helix	trans	-69.8	-42.4	178.2	-69.5	170.9	0	0	0	112.5	L604 T605 V606 G611 S612	L604-L608 HydrophobicContact CD1-CD1 4.05Å; L604-L608 HydrophobicContact CD1-CG 4.16Å; L604-L608 HydrophobicContact CG-CD1 4.01Å; L604-L608 WeakPolarHBondContact O-CB 3.38Å; L604-L608 VanDerWaalsContact O-CG 3.27Å; L604-L608 WeakPolarHBondContact O-CG 3.06Å; L604-L608 PolarHBondContact O-N 3.02Å; T605-L608 PolarHBondContact O-N 3Å; V606-L608 PolarHBondContact O-N 2.93Å; L608-G611 PolarHBondContact O-N 2.94Å; L608-S612 WeakPolarHBondContact O-CB 3.45Å; L608-S612 PolarHBondContact O-N 3.31Å
609	D	90.4	Very high	89.3	Confident	39 Å²	39	84 Å²	84	21%	0.209	41%	0.414	C	S	.	.	H	α-helix	trans	-62.6	-50.8	173.7	175.8	62.6	0	0	0	111.3	H405 Y548 T605 V606 G611 S612 R613	H405-D609 IonicContact CD2-OD2 3.74Å; Y548-D609 PolarHBondContact OH-OD2 2.61Å; T605-D609 PolarHBondContact O-N 3.28Å; T605-D609 VanDerWaalsContact O-N 3.09Å; V606-D609 PolarHBondContact O-N 3.1Å; D609-G611 VanDerWaalsContact C-N 3.31Å; D609-G611 PolarHBondContact O-N 3.2Å; D609-S612 WeakPolarHBondContact O-CB 3.41Å; D609-S612 PolarHBondContact O-N 3.47Å; D609-R613 WeakPolarHBondContact O-CG 3.36Å; D609-R613 PolarHBondContact O-N 3.4Å; D609-R613 IonicContact OD1-CZ 3.61Å; D609-R613 IonicContact OD1-NE 3.08Å; D609-R613 PolarHBondContact OD1-NE 3.34Å; D609-R613 IonicContact OD1-NH2 3.04Å; D609-R613 PolarHBondContact OD1-NH2 3.49Å; D609-R613 IonicContact OD2-CZ 3.9Å; D609-R613 IonicContact OD2-NE 3.78Å; D609-R613 PolarHBondContact OD2-NE 3.2Å; D609-R613 IonicContact OD2-NH2 2.73Å
610	A	88.6	Confident	89	Confident	7 Å²	7	84.4 Å²	84.4	6%	0.058	41%	0.41	C	S	.	.	H	α-helix	trans	-61.3	-38.2	177	0	0	0	0	0	112.4	F408 V606 R614	F408-A610 HydrophobicContact CB-CB 4.11Å; F408-A610 HydrophobicContact CD1-CB 4Å; F408-A610 HydrophobicContact CG-CB 4.13Å; V606-A610 VanDerWaalsContact O-CB 3.25Å; V606-A610 WeakPolarHBondContact O-CB 3.39Å; V606-A610 PolarHBondContact O-N 2.87Å; A610-R614 WeakPolarHBondContact O-CB 3.45Å; A610-R614 WeakPolarHBondContact O-CG 3.28Å; A610-R614 PolarHBondContact O-N 3.01Å
611	G	86	Confident	88.5	Confident	21 Å²	21	80.7 Å²	80.7	22%	0.216	39%	0.387	C	S	.	.	H	α-helix	trans	-64.6	-41.5	174.5	0	0	0	0	0	112.8	Y607 L608 D609 R615	Y607-G611 WeakPolarHBondContact O-CA 2.99Å; Y607-G611 PolarHBondContact O-N 3.3Å; L608-G611 PolarHBondContact O-N 2.94Å; D609-G611 VanDerWaalsContact C-N 3.31Å; D609-G611 PolarHBondContact O-N 3.2Å; G611-R615 WeakPolarHBondContact O-CG 3.3Å; G611-R615 PolarHBondContact O-N 2.95Å
612	S	88.3	Confident	88	Confident	75 Å²	75	80.4 Å²	80.4	52%	0.524	39%	0.385	S	S	.	.	H	α-helix	trans	-63	-50.3	174.7	-170.5	0	0	0	0	111.4	L608 D609 R614 R615 L616	L608-S612 WeakPolarHBondContact O-CB 3.45Å; L608-S612 PolarHBondContact O-N 3.31Å; D609-S612 WeakPolarHBondContact O-CB 3.41Å; D609-S612 PolarHBondContact O-N 3.47Å; S612-R614 PolarHBondContact O-N 3.27Å; S612-R615 WeakPolarHBondContact O-CB 3.2Å; S612-R615 PolarHBondContact O-N 2.83Å; S612-R615 VanDerWaalsContact O-N 3.1Å; S612-L616 PolarHBondContact O-N 2.89Å
613	R	85.2	Confident	87.7	Confident	76 Å²	76	81.4 Å²	81.4	29%	0.287	39%	0.391	S	S	.	.	H	α-helix	trans	-57.2	-45	177.2	-69.2	172.9	-169.7	-84.2	-17.6	112.4	H405 D609 R615 L616 M617	H405-R613 PolarHBondContact CD2-NH2 2.9Å; H405-R613 PolarHBondContact CE1-NH2 3.27Å; H405-R613 PolarHBondContact NE2-NH2 2.98Å; D609-R613 WeakPolarHBondContact O-CG 3.36Å; D609-R613 PolarHBondContact O-N 3.4Å; D609-R613 IonicContact OD1-CZ 3.61Å; D609-R613 IonicContact OD1-NE 3.08Å; D609-R613 PolarHBondContact OD1-NE 3.34Å; D609-R613 IonicContact OD1-NH2 3.04Å; D609-R613 PolarHBondContact OD1-NH2 3.49Å; D609-R613 IonicContact OD2-CZ 3.9Å; D609-R613 IonicContact OD2-NE 3.78Å; D609-R613 PolarHBondContact OD2-NE 3.2Å; D609-R613 IonicContact OD2-NH2 2.73Å; R613-R615 VanDerWaalsContact C-N 3.3Å; R613-R615 PolarHBondContact O-N 2.88Å; R613-L616 PolarHBondContact O-N 3.38Å; R613-M617 WeakPolarHBondContact O-CG 3.44Å; R613-M617 PolarHBondContact O-N 3.18Å
614	R	83.1	Confident	87.3	Confident	150 Å²	150	80.8 Å²	80.8	57%	0.566	38%	0.377	S	S	*	.	H	α-helix	trans	-62.2	-34.3	177.3	-74.5	171.8	-179.3	-160	0.6	112.9	A610 S612 K618	A610-R614 WeakPolarHBondContact O-CB 3.45Å; A610-R614 WeakPolarHBondContact O-CG 3.28Å; A610-R614 PolarHBondContact O-N 3.01Å; S612-R614 PolarHBondContact O-N 3.27Å; R614-K618 WeakPolarHBondContact O-CG 3.47Å; R614-K618 PolarHBondContact O-N 3.27Å
615	R	86.6	Confident	86.8	Confident	199 Å²	199	79.9 Å²	79.9	75%	0.751	37%	0.373	S	S	*	.	H	α-helix	trans	-70.8	-41	173.7	-68	170	-170	-172.9	3.3	111.7	G611 S612 R613 K618 R619	G611-R615 WeakPolarHBondContact O-CG 3.3Å; G611-R615 PolarHBondContact O-N 2.95Å; S612-R615 WeakPolarHBondContact O-CB 3.2Å; S612-R615 PolarHBondContact O-N 2.83Å; S612-R615 VanDerWaalsContact O-N 3.1Å; R613-R615 VanDerWaalsContact C-N 3.3Å; R613-R615 PolarHBondContact O-N 2.88Å; R615-K618 PolarHBondContact O-N 2.83Å; R615-R619 PolarHBondContact O-N 3.41Å
616	L	87.7	Confident	86.5	Confident	101 Å²	101	80.8 Å²	80.8	53%	0.529	37%	0.371	S	S	.	.	H	α-helix	trans	-61.4	-45	177	-177.8	62.3	0	0	0	112	S612 R613 R619 K620	S612-L616 PolarHBondContact O-N 2.89Å; R613-L616 PolarHBondContact O-N 3.38Å; L616-R619 WeakPolarHBondContact O-CB 3.46Å; L616-R619 PolarHBondContact O-N 3.09Å; L616-K620 PolarHBondContact O-N 3.47Å
617	M	83.5	Confident	86.2	Confident	16 Å²	16	85.9 Å²	85.9	8%	0.079	39%	0.39	C	S	.	.	H	α-helix	trans	-66.6	-43.3	177.5	-60.1	-54.4	-179.3	0	0	112.2	C410 F452 R483 R613 R619 K620 D621	C410-M617 HydrophobicContact CB-CE 3.84Å; F452-M617 HydrophobicContact CD1-CB 4.41Å; F452-M617 HydrophobicContact CD2-CB 4.49Å; F452-M617 HydrophobicContact CE1-CB 3.79Å; F452-M617 HydrophobicContact CE2-CB 3.88Å; F452-M617 HydrophobicContact CE2-CG 3.87Å; F452-M617 HydrophobicContact CZ-CB 3.5Å; F452-M617 VanDerWaalsContact CZ-CB 3.5Å; F452-M617 HydrophobicContact CZ-CG 3.91Å; R483-M617 VanDerWaalsContact CD-SD 3.57Å; R613-M617 WeakPolarHBondContact O-CG 3.44Å; R613-M617 PolarHBondContact O-N 3.18Å; M617-R619 PolarHBondContact O-N 3.41Å; M617-K620 PolarHBondContact O-N 3.24Å; M617-K620 VanDerWaalsContact O-N 3.14Å; M617-K620 HydrophobicContact SD-CD 4.49Å; M617-D621 PolarHBondContact O-N 3.47Å
618	K	82.8	Confident	85.8	Confident	121 Å²	121	79.9 Å²	79.9	53%	0.526	37%	0.368	S	S	.	.	H	α-helix	trans	-56.2	-37	172.4	-80.5	-170.2	177.5	-170.2	0	112.1	R614 R615 I622	R614-K618 WeakPolarHBondContact O-CG 3.47Å; R614-K618 PolarHBondContact O-N 3.27Å; R615-K618 PolarHBondContact O-N 2.83Å; K618-I622 WeakPolarHBondContact O-CD1 3.47Å; K618-I622 WeakPolarHBondContact O-CG1 3.44Å; K618-I622 PolarHBondContact O-N 3.36Å
619	R	88.7	Confident	85.4	Confident	156 Å²	156	81.1 Å²	81.1	59%	0.589	37%	0.371	S	S	*	.	H	α-helix	trans	-67.4	-44.8	176.4	-179.9	177.7	167.5	156.7	5.6	111.8	R615 L616 M617 D621 I622 E623	R615-R619 PolarHBondContact O-N 3.41Å; L616-R619 WeakPolarHBondContact O-CB 3.46Å; L616-R619 PolarHBondContact O-N 3.09Å; M617-R619 PolarHBondContact O-N 3.41Å; R619-D621 VanDerWaalsContact C-N 3.35Å; R619-D621 PolarHBondContact O-N 3.24Å; R619-I622 PolarHBondContact O-N 3.12Å; R619-I622 VanDerWaalsContact O-N 3.14Å; R619-E623 HydrophobicContact CG-CG 4.4Å; R619-E623 IonicContact CZ-OE1 3.92Å; R619-E623 IonicContact NE-OE1 2.66Å; R619-E623 PolarHBondContact NE-OE1 3.45Å; R619-E623 IonicContact NE-OE2 2.76Å; R619-E623 IonicContact NH2-OE1 2.72Å; R619-E623 PolarHBondContact NH2-OE1 3.13Å; R619-E623 WeakPolarHBondContact O-CG 3.2Å; R619-E623 PolarHBondContact O-N 2.67Å
620	K	85.5	Confident	85.2	Confident	52 Å²	52	84.8 Å²	84.8	23%	0.226	39%	0.387	C	S	.	.	H	α-helix	trans	-59.5	-40.9	174.5	-84.3	-179.8	159.3	-83.7	0	113	D456 L616 M617 I622 E623 F624	D456-K620 IonicContact OD1-NZ 2.78Å; D456-K620 PolarHBondContact OD1-NZ 3.38Å; D456-K620 IonicContact OD2-NZ 3.5Å; D456-K620 PolarHBondContact OD2-NZ 3.07Å; L616-K620 PolarHBondContact O-N 3.47Å; M617-K620 PolarHBondContact O-N 3.24Å; M617-K620 VanDerWaalsContact O-N 3.14Å; M617-K620 HydrophobicContact SD-CD 4.49Å; K620-I622 VanDerWaalsContact C-N 3.3Å; K620-I622 PolarHBondContact O-N 3.4Å; K620-E623 PolarHBondContact O-N 3.22Å; K620-F624 VanDerWaalsContact O-CB 3.27Å; K620-F624 WeakPolarHBondContact O-CB 3.32Å; K620-F624 PolarHBondContact O-N 3.43Å
621	D	82.9	Confident	84.8	Confident	25 Å²	25	84.8 Å²	84.8	13%	0.134	39%	0.386	C	S	.	.	H	α-helix	trans	-58.9	-41.5	173.8	-70.5	-40.1	0	0	0	111.9	F452 H454 M617 R619 N625	F452-D621 WeakPolarHBondContact CD1-OD2 3.43Å; H454-D621 IonicContact CE1-OD1 3.81Å; H454-D621 IonicContact CG-OD1 3.3Å; H454-D621 IonicContact ND1-OD1 2.81Å; H454-D621 PolarHBondContact ND1-OD1 3.07Å; M617-D621 PolarHBondContact O-N 3.47Å; R619-D621 VanDerWaalsContact C-N 3.35Å; R619-D621 PolarHBondContact O-N 3.24Å; D621-N625 WeakPolarHBondContact O-CB 3.28Å; D621-N625 PolarHBondContact O-N 2.86Å; D621-N625 PolarHBondContact O-ND2 2.87Å; D621-N625 VanDerWaalsContact O-ND2 3.11Å
622	I	84.5	Confident	84.5	Confident	96 Å²	96	88.1 Å²	88.1	49%	0.492	40%	0.396	S	S	.	.	H	α-helix	trans	-68.1	-47.6	178.9	-66.5	163	0	0	0	111	K618 R619 K620 F624 N625 Q626	K618-I622 WeakPolarHBondContact O-CD1 3.47Å; K618-I622 WeakPolarHBondContact O-CG1 3.44Å; K618-I622 PolarHBondContact O-N 3.36Å; R619-I622 PolarHBondContact O-N 3.12Å; R619-I622 VanDerWaalsContact O-N 3.14Å; K620-I622 VanDerWaalsContact C-N 3.3Å; K620-I622 PolarHBondContact O-N 3.4Å; I622-F624 VanDerWaalsContact C-N 3.32Å; I622-F624 PolarHBondContact O-N 3.08Å; I622-N625 PolarHBondContact O-N 3.2Å; I622-Q626 WeakPolarHBondContact O-CG 3.44Å; I622-Q626 PolarHBondContact O-N 3.33Å
623	E	86.8	Confident	84.1	Confident	82 Å²	82	86.9 Å²	86.9	38%	0.383	39%	0.39	S	S	.	.	H	α-helix	trans	-62.1	-39.5	179	-70.6	170.6	159	0	0	111.4	R619 K620 Y627	R619-E623 HydrophobicContact CG-CG 4.4Å; R619-E623 IonicContact CZ-OE1 3.92Å; R619-E623 IonicContact NE-OE1 2.66Å; R619-E623 PolarHBondContact NE-OE1 3.45Å; R619-E623 IonicContact NE-OE2 2.76Å; R619-E623 IonicContact NH2-OE1 2.72Å; R619-E623 PolarHBondContact NH2-OE1 3.13Å; R619-E623 WeakPolarHBondContact O-CG 3.2Å; R619-E623 PolarHBondContact O-N 2.67Å; K620-E623 PolarHBondContact O-N 3.22Å; E623-Y627 PolarHBondContact O-N 2.97Å; E623-Y627 VanDerWaalsContact O-N 3.1Å
624	F	83.8	Confident	83.7	Confident	23 Å²	23	88.9 Å²	88.9	10%	0.101	40%	0.403	C	S	.	.	H	α-helix	trans	-66.7	-43.1	173.5	176.6	-94.3	0	0	0	113.1	V435 S436 Q437 H453 H454 K620 I622 Q626 Y627 K628	V435-F624 HydrophobicContact CB-CE2 4.48Å; V435-F624 HydrophobicContact CB-CZ 4.4Å; V435-F624 HydrophobicContact CG2-CZ 4.4Å; S436-F624 WeakPolarHBondContact O-CE2 3.21Å; S436-F624 VanDerWaalsContact O-CZ 3.25Å; S436-F624 WeakPolarHBondContact O-CZ 3.49Å; Q437-F624 HydrophobicContact CB-CZ 4.3Å; H453-F624 WeakPolarHBondContact O-CE1 3.28Å; H454-F624 HydrophobicContact CB-CB 3.44Å; H454-F624 VanDerWaalsContact CB-CB 3.44Å; H454-F624 HydrophobicContact CB-CD1 3.9Å; H454-F624 HydrophobicContact CB-CD2 3.73Å; H454-F624 HydrophobicContact CB-CE2 4.45Å; H454-F624 HydrophobicContact CB-CG 3.41Å; H454-F624 VanDerWaalsContact CB-CG 3.41Å; K620-F624 VanDerWaalsContact O-CB 3.27Å; K620-F624 WeakPolarHBondContact O-CB 3.32Å; K620-F624 PolarHBondContact O-N 3.43Å; I622-F624 VanDerWaalsContact C-N 3.32Å; I622-F624 PolarHBondContact O-N 3.08Å; F624-Q626 VanDerWaalsContact C-N 3.3Å; F624-Q626 PolarHBondContact O-N 3.05Å; F624-Y627 PolarHBondContact O-N 3.22Å; F624-K628 WeakPolarHBondContact O-CB 3.42Å; F624-K628 PolarHBondContact O-N 3.29Å
625	N	82.6	Confident	83.2	Confident	71 Å²	71	85.7 Å²	85.7	38%	0.38	39%	0.393	S	S	.	.	H	α-helix	trans	-64.5	-35.5	177.9	-73.9	-25.8	0	0	0	112	D621 I622 Q629	D621-N625 WeakPolarHBondContact O-CB 3.28Å; D621-N625 PolarHBondContact O-N 2.86Å; D621-N625 PolarHBondContact O-ND2 2.87Å; D621-N625 VanDerWaalsContact O-ND2 3.11Å; I622-N625 PolarHBondContact O-N 3.2Å; N625-Q629 VanDerWaalsContact O-CG 3.31Å; N625-Q629 WeakPolarHBondContact O-CG 3.28Å; N625-Q629 PolarHBondContact O-N 2.62Å
626	Q	86.2	Confident	82.1	Confident	104 Å²	104	84.4 Å²	84.4	49%	0.486	40%	0.395	S	S	.	.	H	α-helix	trans	-65.3	-45	173.2	-72.7	172	-13	0	0	111.8	I622 F624 Q629 Q630	I622-Q626 WeakPolarHBondContact O-CG 3.44Å; I622-Q626 PolarHBondContact O-N 3.33Å; F624-Q626 VanDerWaalsContact C-N 3.3Å; F624-Q626 PolarHBondContact O-N 3.05Å; Q626-Q629 PolarHBondContact O-N 3.28Å; Q626-Q630 WeakPolarHBondContact O-CG 3.46Å; Q626-Q630 PolarHBondContact O-N 3.28Å; Q626-Q630 VanDerWaalsContact O-N 3.12Å
627	Y	84.3	Confident	80.8	Confident	114 Å²	114	87.1 Å²	87.1	45%	0.447	41%	0.405	S	S	.	.	H	α-helix	trans	-63	-41	175.8	-179.5	-118.1	0	0	0	112.4	V435 E623 F624 Q630 I631	V435-Y627 HydrophobicContact CG1-CD1 3.86Å; V435-Y627 HydrophobicContact CG1-CE1 3.88Å; E623-Y627 PolarHBondContact O-N 2.97Å; E623-Y627 VanDerWaalsContact O-N 3.1Å; F624-Y627 PolarHBondContact O-N 3.22Å; Y627-Q630 PolarHBondContact O-N 3.27Å; Y627-I631 HydrophobicContact CD1-CD1 4.25Å; Y627-I631 HydrophobicContact CD2-CD1 4.38Å; Y627-I631 HydrophobicContact CE1-CD1 3.67Å; Y627-I631 HydrophobicContact CE2-CD1 3.8Å; Y627-I631 VanDerWaalsContact CZ-CD1 3.42Å; Y627-I631 PolarHBondContact O-N 3.14Å
628	K	83.5	Confident	79.7	Confident	45 Å²	45	91.2 Å²	91.2	20%	0.196	42%	0.424	C	S	.	.	H	α-helix	trans	-58.7	-47.6	173.2	175.6	167	179.6	172.6	0	111.9	V435 F624 Q630 I631 E632	V435-K628 HydrophobicContact CG1-CB 4.35Å; V435-K628 HydrophobicContact CG2-CB 3.99Å; V435-K628 HydrophobicContact CG2-CD 3.82Å; V435-K628 HydrophobicContact CG2-CG 3.7Å; F624-K628 WeakPolarHBondContact O-CB 3.42Å; F624-K628 PolarHBondContact O-N 3.29Å; K628-Q630 VanDerWaalsContact C-N 3.28Å; K628-Q630 PolarHBondContact O-N 2.96Å; K628-I631 PolarHBondContact O-N 2.88Å; K628-E632 WeakPolarHBondContact CE-OE1 3.37Å; K628-E632 WeakPolarHBondContact CE-OE2 3.28Å; K628-E632 HydrophobicContact CG-CG 4.3Å; K628-E632 IonicContact NZ-OE1 3.62Å; K628-E632 PolarHBondContact NZ-OE1 3.08Å; K628-E632 WeakPolarHBondContact O-CB 3.33Å; K628-E632 WeakPolarHBondContact O-CG 3.31Å; K628-E632 PolarHBondContact O-N 3.32Å
629	Q	83.4	Confident	78.4	Confident	130 Å²	130	88.8 Å²	88.8	61%	0.607	42%	0.422	S	S	*	.	H	α-helix	trans	-62.5	-32.8	178.2	-75.9	173.5	-16.3	0	0	113.2	N625 Q626 A633	N625-Q629 VanDerWaalsContact O-CG 3.31Å; N625-Q629 WeakPolarHBondContact O-CG 3.28Å; N625-Q629 PolarHBondContact O-N 2.62Å; Q626-Q629 PolarHBondContact O-N 3.28Å; Q629-A633 WeakPolarHBondContact O-CB 3.33Å; Q629-A633 PolarHBondContact O-N 3.01Å
630	Q	84.6	Confident	77	Confident	116 Å²	116	84.1 Å²	84.1	54%	0.542	41%	0.408	S	S	.	.	H	α-helix	trans	-65.2	-50.2	174.7	-71.4	165.4	-9.5	0	0	111	Q626 Y627 K628 E632 A633 E634	Q626-Q630 WeakPolarHBondContact O-CG 3.46Å; Q626-Q630 PolarHBondContact O-N 3.28Å; Q626-Q630 VanDerWaalsContact O-N 3.12Å; Y627-Q630 PolarHBondContact O-N 3.27Å; K628-Q630 VanDerWaalsContact C-N 3.28Å; K628-Q630 PolarHBondContact O-N 2.96Å; Q630-E632 PolarHBondContact O-N 3.35Å; Q630-A633 PolarHBondContact O-N 3.45Å; Q630-E634 WeakPolarHBondContact O-CG 3.4Å; Q630-E634 PolarHBondContact O-N 3.06Å
631	I	80.8	Confident	75.6	Confident	8 Å²	8	85 Å²	85	4%	0.041	42%	0.415	C	S	.	.	H	α-helix	trans	-66	-36.6	178.5	-72.2	169.1	0	0	0	111.9	P432 T433 V435 Y627 K628 A633 E634 K635	P432-I631 WeakPolarHBondContact O-CD1 3.46Å; T433-I631 VanDerWaalsContact O-CG2 3.23Å; T433-I631 WeakPolarHBondContact O-CG2 3.35Å; V435-I631 HydrophobicContact CG1-CB 4.46Å; V435-I631 HydrophobicContact CG1-CD1 3.62Å; Y627-I631 HydrophobicContact CD1-CD1 4.25Å; Y627-I631 HydrophobicContact CD2-CD1 4.38Å; Y627-I631 HydrophobicContact CE1-CD1 3.67Å; Y627-I631 HydrophobicContact CE2-CD1 3.8Å; Y627-I631 VanDerWaalsContact CZ-CD1 3.42Å; Y627-I631 PolarHBondContact O-N 3.14Å; K628-I631 PolarHBondContact O-N 2.88Å; I631-A633 VanDerWaalsContact C-N 3.31Å; I631-A633 PolarHBondContact O-N 2.81Å; I631-E634 PolarHBondContact O-N 3.13Å; I631-K635 WeakPolarHBondContact O-CB 3.31Å; I631-K635 PolarHBondContact O-N 2.84Å
632	E	79.8	Confident	74.3	Confident	91 Å²	91	87.1 Å²	87.1	43%	0.425	43%	0.432	S	S	.	.	H	α-helix	trans	-66.5	-31.2	174.4	-73.5	177.8	150.6	0	0	112.5	K628 Q630	K628-E632 WeakPolarHBondContact CE-OE1 3.37Å; K628-E632 WeakPolarHBondContact CE-OE2 3.28Å; K628-E632 HydrophobicContact CG-CG 4.3Å; K628-E632 IonicContact NZ-OE1 3.62Å; K628-E632 PolarHBondContact NZ-OE1 3.08Å; K628-E632 WeakPolarHBondContact O-CB 3.33Å; K628-E632 WeakPolarHBondContact O-CG 3.31Å; K628-E632 PolarHBondContact O-N 3.32Å; Q630-E632 PolarHBondContact O-N 3.35Å
633	A	80.6	Confident	73.1	Confident	49 Å²	49	84 Å²	84	41%	0.405	42%	0.418	S	S	.	.	H	α-helix	trans	-76.7	-36.2	172.8	0	0	0	0	0	113	Q629 Q630 I631 Q636	Q629-A633 WeakPolarHBondContact O-CB 3.33Å; Q629-A633 PolarHBondContact O-N 3.01Å; Q630-A633 PolarHBondContact O-N 3.45Å; I631-A633 VanDerWaalsContact C-N 3.31Å; I631-A633 PolarHBondContact O-N 2.81Å; A633-Q636 PolarHBondContact O-N 2.99Å
634	E	77.1	Confident	71.9	Confident	118 Å²	118	82 Å²	82	55%	0.551	41%	0.413	S	S	*	.	H	α-helix	trans	-66.2	-39.6	173.3	-72.8	175.7	-178.2	0	0	111.4	Q630 I631 Q636 Q637	Q630-E634 WeakPolarHBondContact O-CG 3.4Å; Q630-E634 PolarHBondContact O-N 3.06Å; I631-E634 PolarHBondContact O-N 3.13Å; E634-Q636 PolarHBondContact O-N 3.32Å; E634-Q637 PolarHBondContact O-N 3.44Å
635	K	70.8	Confident	70.8	Confident	82 Å²	82	81.7 Å²	81.7	36%	0.357	41%	0.412	S	S	.	.	H	α-helix	trans	-53.3	-39.2	171.7	-89.9	-161.6	172.6	-156.4	0	113.1	T433 E434 I631 Q637 H638	T433-K635 HydrophobicContact CG2-CG 4.18Å; T433-K635 WeakPolarHBondContact O-CE 3.22Å; E434-K635 IonicContact OE1-NZ 3.29Å; E434-K635 PolarHBondContact OE1-NZ 2.93Å; I631-K635 WeakPolarHBondContact O-CB 3.31Å; I631-K635 PolarHBondContact O-N 2.84Å; K635-Q637 PolarHBondContact O-N 3Å; K635-Q637 VanDerWaalsContact O-N 3.16Å; K635-H638 PolarHBondContact O-N 3.08Å
636	Q	63.5	Low	69.6	Low	173 Å²	173	82.7 Å²	82.7	81%	0.808	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-11.3	-178.7	-72.1	180	-7	0	0	113.8	A633 E634	A633-Q636 PolarHBondContact O-N 2.99Å; E634-Q636 PolarHBondContact O-N 3.32Å
637	Q	61.3	Low	68.3	Low	158 Å²	158	83.5 Å²	83.5	74%	0.738	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-10.3	176.6	-57.6	-175.2	9.8	0	0	113.3	E634 K635	E634-Q637 PolarHBondContact O-N 3.44Å; K635-Q637 PolarHBondContact O-N 3Å; K635-Q637 VanDerWaalsContact O-N 3.16Å
638	H	59.5	Low	67	Low	102 Å²	102	79.4 Å²	79.4	47%	0.472	40%	0.402	S	S	.	.			trans	-123.4	112.6	-175.8	-72.6	-81.8	0	0	0	112.1	K635 I640	K635-H638 PolarHBondContact O-N 3.08Å; H638-I640 PolarHBondContact O-N 3.29Å
639	S	56.5	Low	65.9	Low	69 Å²	69	79.4 Å²	79.4	48%	0.483	40%	0.403	S	S	.	.			trans	-64.4	116.9	163.1	27.4	0	0	0	0	110.2	E380	E380-S639 VanDerWaalsContact OE2-CB 3.25Å; E380-S639 WeakPolarHBondContact OE2-CB 3.25Å; E380-S639 PolarHBondContact OE2-OG 2.78Å
640	I	59.5	Low	64.5	Low	58 Å²	58	77.7 Å²	77.7	30%	0.297	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	117.5	172.4	-59.6	174.2	0	0	0	107.6	E377 T433 H638	E377-I640 HydrophobicContact CB-CG2 4.09Å; E377-I640 HydrophobicContact CG-CG2 3.93Å; T433-I640 HydrophobicContact CG2-CD1 4.08Å; H638-I640 PolarHBondContact O-N 3.29Å
641	L	55.2	Low	62.9	Low	71 Å²	71	73.6 Å²	73.6	37%	0.372	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	103.4	174.5	-166.6	82.4	0	0	0	109.1	F378	F378-L641 PolarHBondContact N-O 3.46Å; F378-L641 PolarHBondContact O-N 2.96Å; F378-L641 VanDerWaalsContact O-N 3.1Å
642	S	57	Low	61.1	Low	70 Å²	70	77.6 Å²	77.6	49%	0.49	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	133.6	174.6	58.6	0	0	0	0	111.5
643	V	57.8	Low	59.7	Low	31 Å²	31	80.1 Å²	80.1	19%	0.188	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	140.8	174.2	-172.8	0	0	0	0	109.4	V376 L645 E647 W648	V376-V643 PolarHBondContact N-O 2.76Å; V376-V643 PolarHBondContact O-N 3.36Å; V643-L645 PolarHBondContact O-N 3.2Å; V643-E647 HydrophobicContact CG1-CB 4.39Å; V643-W648 HydrophobicContact CG1-CB 4.03Å
644	S	61.5	Low	57.7	Low	40 Å²	40	83.9 Å²	83.9	28%	0.28	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	133.1	172.8	174.6	0	0	0	0	110.3	E646 E647 W648	S644-E646 PolarHBondContact O-N 3.15Å; S644-E646 PolarHBondContact OG-N 3.47Å; S644-E647 VanDerWaalsContact CB-OE2 3.31Å; S644-E647 WeakPolarHBondContact CB-OE2 3.41Å; S644-E647 PolarHBondContact O-N 3.47Å; S644-W648 WeakPolarHBondContact O-CB 3.46Å; S644-W648 PolarHBondContact O-N 3.35Å
645	L	61.8	Low	55.9	Low	16 Å²	16	80.6 Å²	80.6	8%	0.084	42%	0.424	C	S	.	.	H	α-helix	trans	-59.8	-34.1	178.4	-178.9	65.3	0	0	0	111.1	L349 H374 V376 L387 V643 L649	L349-L645 HydrophobicContact CD2-CD2 4.2Å; H374-L645 HydrophobicContact CB-CD2 3.83Å; H374-L645 WeakPolarHBondContact O-CB 3.43Å; V376-L645 HydrophobicContact CG2-CB 4.38Å; V376-L645 HydrophobicContact CG2-CD1 3.61Å; L387-L645 HydrophobicContact CD1-CD2 4.47Å; V643-L645 PolarHBondContact O-N 3.2Å; L645-L649 HydrophobicContact CD1-CD1 3.73Å; L645-L649 HydrophobicContact CD1-CG 3.96Å; L645-L649 HydrophobicContact CD2-CD1 4.47Å; L645-L649 HydrophobicContact CG-CD1 3.76Å; L645-L649 HydrophobicContact CG-CG 4.33Å; L645-L649 VanDerWaalsContact O-CB 3.24Å; L645-L649 WeakPolarHBondContact O-CB 3.49Å; L645-L649 WeakPolarHBondContact O-CG 3.32Å; L645-L649 PolarHBondContact O-N 3.12Å
646	E	58	Low	54.7	Low	92 Å²	92	79.7 Å²	79.7	43%	0.43	42%	0.422	S	S	.	.	H	α-helix	trans	-69.9	-37.4	176.1	-64.6	-171.1	178.1	0	0	112.1	S644 N650	S644-E646 PolarHBondContact O-N 3.15Å; S644-E646 PolarHBondContact OG-N 3.47Å; E646-N650 WeakPolarHBondContact O-CB 3.49Å; E646-N650 PolarHBondContact O-N 3.08Å; E646-N650 VanDerWaalsContact O-N 3.16Å; E646-N650 PolarHBondContact O-ND2 3.13Å
647	E	58.7	Low	53.9	Low	121 Å²	121	73.4 Å²	73.4	57%	0.565	40%	0.396	S	S	*	.	H	α-helix	trans	-70.3	-45.5	175.8	-66.7	176.6	142	0	0	111.1	V643 S644 L649 N650 S651	V643-E647 HydrophobicContact CG1-CB 4.39Å; S644-E647 VanDerWaalsContact CB-OE2 3.31Å; S644-E647 WeakPolarHBondContact CB-OE2 3.41Å; S644-E647 PolarHBondContact O-N 3.47Å; E647-L649 PolarHBondContact O-N 3.4Å; E647-N650 PolarHBondContact O-N 3.41Å; E647-S651 VanDerWaalsContact O-CB 3.29Å; E647-S651 WeakPolarHBondContact O-CB 3.49Å; E647-S651 PolarHBondContact O-N 2.98Å; E647-S651 PolarHBondContact O-OG 2.92Å
648	W	56	Low	52.9	Low	28 Å²	28	70.7 Å²	70.7	11%	0.106	39%	0.387	C	S	.	.	H	α-helix	trans	-62.6	-39.8	179.2	-167.7	89	0	0	0	112.6	L310 M313 F378 V643 S644	L310-W648 HydrophobicContact CD2-CH2 3.57Å; L310-W648 HydrophobicContact CD2-CZ3 3.66Å; M313-W648 HydrophobicContact CB-CH2 3.74Å; M313-W648 HydrophobicContact CB-CZ2 4.07Å; M313-W648 HydrophobicContact CE-CH2 3.5Å; M313-W648 HydrophobicContact CE-CZ2 4.48Å; M313-W648 HydrophobicContact CE-CZ3 3.71Å; M313-W648 HydrophobicContact CG-CH2 4.25Å; M313-W648 HydrophobicContact SD-CH2 3.63Å; M313-W648 HydrophobicContact SD-CZ3 4.04Å; F378-W648 AromaticContact CE2-NE1 3.84Å; F378-W648 HydrophobicContact CZ-CZ2 4.09Å; F378-W648 AromaticContact CZ-NE1 3.82Å; V643-W648 HydrophobicContact CG1-CB 4.03Å; S644-W648 WeakPolarHBondContact O-CB 3.46Å; S644-W648 PolarHBondContact O-N 3.35Å
649	L	60.8	Low	52.1	Low	44 Å²	44	71.5 Å²	71.5	23%	0.23	40%	0.395	C	S	.	.	H	α-helix	trans	-80.5	-12.9	177.6	-68.2	175.3	0	0	0	114.6	R342 L645 E647	R342-L649 PolarHBondContact NH1-O 3.02Å; L645-L649 HydrophobicContact CD1-CD1 3.73Å; L645-L649 HydrophobicContact CD1-CG 3.96Å; L645-L649 HydrophobicContact CD2-CD1 4.47Å; L645-L649 HydrophobicContact CG-CD1 3.76Å; L645-L649 HydrophobicContact CG-CG 4.33Å; L645-L649 VanDerWaalsContact O-CB 3.24Å; L645-L649 WeakPolarHBondContact O-CB 3.49Å; L645-L649 WeakPolarHBondContact O-CG 3.32Å; L645-L649 PolarHBondContact O-N 3.12Å; E647-L649 PolarHBondContact O-N 3.4Å
650	N	54.8	Low	51.5	Low	94 Å²	94	72.4 Å²	72.4	50%	0.503	39%	0.393	S	S	.	.	H	α-helix	trans	-110.1	-16.6	179.4	-67.4	-35.8	0	0	0	113.9	R342 E646 E647	R342-N650 WeakPolarHBondContact CD-OD1 3.48Å; R342-N650 PolarHBondContact NH1-OD1 2.78Å; E646-N650 WeakPolarHBondContact O-CB 3.49Å; E646-N650 PolarHBondContact O-N 3.08Å; E646-N650 VanDerWaalsContact O-N 3.16Å; E646-N650 PolarHBondContact O-ND2 3.13Å; E647-N650 PolarHBondContact O-N 3.41Å
651	S	49.6	Very low	50.7	Low	31 Å²	31	76.2 Å²	76.2	22%	0.217	41%	0.414	C	S	.	.	S	Bend	trans	-69.7	133.6	-179.4	-65.5	0	0	0	0	111.5	E647 H653	E647-S651 VanDerWaalsContact O-CB 3.29Å; E647-S651 WeakPolarHBondContact O-CB 3.49Å; E647-S651 PolarHBondContact O-N 2.98Å; E647-S651 PolarHBondContact O-OG 2.92Å; S651-H653 PolarHBondContact O-N 2.82Å
652	P	43.3	Very low	50.1	Low	92 Å²	92	80 Å²	80	60%	0.597	43%	0.434	S	S	*	.			trans	-63.1	128	168.9	27.8	-32.5	0	0	0	108.7	N654 S655	P652-N654 PolarHBondContact O-N 2.92Å; P652-S655 PolarHBondContact O-N 3.26Å; P652-S655 VanDerWaalsContact O-N 3.15Å; P652-S655 PolarHBondContact O-OG 3.24Å
653	H	50	Low	49.5	Very low	143 Å²	143	85 Å²	85	66%	0.662	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	12.1	-167.9	-60.3	-51.7	0	0	0	116.7	S651	S651-H653 PolarHBondContact O-N 2.82Å
654	N	38.8	Very low	48.5	Very low	128 Å²	128	90.3 Å²	90.3	68%	0.684	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.6	-10.8	179.1	-62	17.8	0	0	0	113.3	P652	P652-N654 PolarHBondContact O-N 2.92Å
655	S	40.5	Very low	47.1	Very low	49 Å²	49	96 Å²	96	34%	0.343	50%	0.502	S	S	.	.	H	α-helix	trans	-99.8	-16	-171.1	63.5	0	0	0	0	115.5	P652 N659	P652-S655 PolarHBondContact O-N 3.26Å; P652-S655 VanDerWaalsContact O-N 3.15Å; P652-S655 PolarHBondContact O-OG 3.24Å; S655-N659 PolarHBondContact O-ND2 3.02Å
656	I	45.6	Very low	46.3	Very low	63 Å²	63	104.7 Å²	104.7	32%	0.323	56%	0.559	S	S	.	*	H	α-helix	trans	-83.2	-39.2	-179.9	-65.6	179.7	0	0	0	111.2	D658 L660	I656-D658 PolarHBondContact O-N 3Å; I656-L660 HydrophobicContact CG2-CD1 3.88Å
657	T	45	Very low	45.7	Very low	41 Å²	41	105.3 Å²	105.3	25%	0.252	57%	0.566	S	S	.	*	H	α-helix	trans	-59.9	-46.5	179.2	41.7	0	0	0	0	112.1	N659 L660 L661	T657-N659 PolarHBondContact O-N 3.18Å; T657-L660 PolarHBondContact O-N 2.79Å; T657-L661 PolarHBondContact O-N 3.07Å
658	D	40.9	Very low	45	Very low	101 Å²	101	104.5 Å²	104.5	54%	0.54	57%	0.566	S	S	.	*	H	α-helix	trans	-77.5	-27.9	-165.3	-60.7	19	0	0	0	111.4	I656	I656-D658 PolarHBondContact O-N 3Å
659	N	42.9	Very low	44.4	Very low	120 Å²	120	108.7 Å²	108.7	64%	0.642	59%	0.591	S	S	*	*	H	α-helix	trans	-85.8	-8.5	175.6	-71.2	-75	0	0	0	114.3	S655 T657	S655-N659 PolarHBondContact O-ND2 3.02Å; T657-N659 PolarHBondContact O-N 3.18Å
660	L	44.5	Very low	43.5	Very low	87 Å²	87	112.5 Å²	112.5	46%	0.455	61%	0.612	S	S	.	*	H	α-helix	trans	-102.3	-24.3	177.5	-95	157.1	0	0	0	113	I656 T657	I656-L660 HydrophobicContact CG2-CD1 3.88Å; T657-L660 PolarHBondContact O-N 2.79Å
661	L	42.5	Very low	42.8	Very low	139 Å²	139	113.7 Å²	113.7	73%	0.728	62%	0.619	S	S	*	*	H	α-helix	trans	-75	-30.5	173.9	-78.2	162.6	0	0	0	112.8	T657 K663	T657-L661 PolarHBondContact O-N 3.07Å; L661-K663 PolarHBondContact O-N 2.79Å; L661-K663 VanDerWaalsContact O-N 3.15Å
662	D	42.6	Very low	42.3	Very low	150 Å²	150	119.2 Å²	119.2	80%	0.802	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	20.4	-175.5	-150.6	40	0	0	0	114
663	K	43.7	Very low	42.2	Very low	175 Å²	175	121.1 Å²	121.1	76%	0.761	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.4	2.5	-177.6	-82.7	-166.4	172.6	-173.1	0	115.6	L661	L661-K663 PolarHBondContact O-N 2.79Å; L661-K663 VanDerWaalsContact O-N 3.15Å
664	N	36.9	Very low	41.6	Very low	143 Å²	143	119.5 Å²	119.5	77%	0.765	65%	0.649	S	S	*	*			trans	-121.6	28.8	-175.4	-76.1	-14.2	0	0	0	113.3
665	D	33.3	Very low	41.9	Very low	158 Å²	158	118.8 Å²	118.8	85%	0.845	65%	0.646	S	S	*	*			trans	-87.1	151.5	156	-95.2	-26.5	0	0	0	109.5
666	P	43.9	Very low	42	Very low	199 Å²	199	125.1 Å²	125.1	100%	1.292	67%	0.673	S	S	*	*			trans	-83	0	-155.3	33	-38.8	0	0	0	117.3

Retrieved 666 of 666 residues in 100.4 ms (Link to these results)

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