A0A096NJ94_PAPAN Loading...

[Pyruvate dehydrogenase [acetyl-transferring]]-phosphatase 2, mitochondrial

Mitochondrial enzyme that catalyzes the dephosphorylation and concomitant reactivation of the alpha subunit of the E1 component of the pyruvate dehydrogenase complex (PDC), thereby stimulating the conversion of pyruvate into acetyl-CoA. Acts as a crucial regulator of T cell metabolism and function, with a particular focus on T-helper Th17.

AlphaFold DB , UniProt , Accession A0A096NJ94, Species PAPAN (Papio anubis, Olive baboon), Gene PDP2, Length 529 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.7	Very low	26.3	Very low	246 Å²	246	156 Å²	156	100%	1.212	82%	0.823	S	S	*	*				0	146.8	0	-65.4	179.3	85.5	0	0	107.7
2	S	27	Very low	26.2	Very low	106 Å²	106	152.2 Å²	152.2	74%	0.741	82%	0.819	S	S	*	*			trans	-81.4	142.4	-173.7	-175.6	0	0	0	0	112.1
3	S	28.5	Very low	26.4	Very low	116 Å²	116	149.5 Å²	149.5	81%	0.811	81%	0.812	S	S	*	*			trans	-144.9	87.4	157.9	53.3	0	0	0	0	109.6
4	T	27.7	Very low	26.5	Very low	117 Å²	117	155.5 Å²	155.5	72%	0.718	82%	0.816	S	S	*	*			trans	-72.8	131.2	170.6	43.5	0	0	0	0	110.5
5	V	26.6	Very low	26.5	Very low	134 Å²	134	156.4 Å²	156.4	81%	0.812	82%	0.822	S	S	*	*			trans	-115.4	121.4	165.1	179.3	0	0	0	0	108.4
6	S	24.5	Very low	26.4	Very low	93 Å²	93	153.6 Å²	153.6	65%	0.65	82%	0.819	S	S	*	*			trans	-94.6	117.8	-168.1	-43.9	0	0	0	0	111.5
7	Y	23.4	Very low	26.3	Very low	215 Å²	215	154.4 Å²	154.4	84%	0.843	82%	0.822	S	S	*	*			trans	-81.5	128.6	165.9	-92.6	-92.5	0	0	0	110.5	I9	Y7-I9 PolarHBondContact O-N 3.28Å
8	W	23.6	Very low	26.2	Very low	235 Å²	235	150.7 Å²	150.7	89%	0.89	82%	0.816	S	S	*	*			trans	-82.1	110.3	175.1	-85.9	77.7	0	0	0	110.6
9	I	25.6	Very low	26.1	Very low	141 Å²	141	150.1 Å²	150.1	72%	0.723	82%	0.818	S	S	*	*			trans	-90.7	112.7	169.1	-62.9	171.6	0	0	0	108	Y7 N11	Y7-I9 PolarHBondContact O-N 3.28Å; I9-N11 PolarHBondContact O-N 3.05Å
10	L	24.1	Very low	26.1	Very low	162 Å²	162	151.2 Å²	151.2	85%	0.848	82%	0.822	S	S	*	*			trans	-88	97.7	168.6	-87.3	166.6	0	0	0	109.9
11	N	23.1	Very low	26.1	Very low	151 Å²	151	153.3 Å²	153.3	81%	0.807	83%	0.827	S	S	*	*			trans	-87.3	127.1	167.5	-106.6	-30.9	0	0	0	109.8	I9	I9-N11 PolarHBondContact O-N 3.05Å
12	S	25.3	Very low	25.7	Very low	110 Å²	110	145.2 Å²	145.2	77%	0.769	81%	0.806	S	S	*	*			trans	-143.7	87.4	163.3	-162.8	0	0	0	0	112.3
13	T	29.2	Very low	25.7	Very low	118 Å²	118	143.6 Å²	143.6	72%	0.724	81%	0.807	S	S	*	*			trans	36	114.9	146.3	57.1	0	0	0	0	121.5
14	R	27.6	Very low	25.6	Very low	233 Å²	233	150 Å²	150	88%	0.879	81%	0.813	S	S	*	*				46.8	117.7	126	-72.3	179.4	164.4	172.5	-5.3	118.7
15	N	26.1	Very low	25.7	Very low	169 Å²	169	154.6 Å²	154.6	90%	0.904	82%	0.817	S	S	*	*				-135.3	129.3	119.5	-105.3	-27.6	0	0	0	110.7
16	S	24.8	Very low	25.7	Very low	111 Å²	111	156.6 Å²	156.6	78%	0.776	82%	0.822	S	S	*	*			trans	-97.5	125.1	178.8	51.9	0	0	0	0	110.1
17	I	25.9	Very low	25.7	Very low	168 Å²	168	161.4 Å²	161.4	86%	0.862	83%	0.827	S	S	*	*			trans	-122.8	133.6	161.9	-63	-176.8	0	0	0	107.9
18	A	24.3	Very low	25.8	Very low	87 Å²	87	157 Å²	157	72%	0.719	83%	0.829	S	S	*	*			trans	-78.3	143.1	-165.3	0	0	0	0	0	113.1	L20	A18-L20 PolarHBondContact O-N 3.34Å
19	T	24.7	Very low	25.9	Very low	140 Å²	140	156.5 Å²	156.5	86%	0.859	83%	0.826	S	S	*	*			trans	-63.2	120.7	162.9	47.9	0	0	0	0	110.5
20	L	24.6	Very low	25.8	Very low	171 Å²	171	160.6 Å²	160.6	90%	0.895	83%	0.834	S	S	*	*			trans	-111	99.8	164.4	-100.4	164.6	0	0	0	109.2	A18 G22	A18-L20 PolarHBondContact O-N 3.34Å; L20-G22 PolarHBondContact O-N 3.03Å
21	Q	26	Very low	25.8	Very low	197 Å²	197	158.8 Å²	158.8	92%	0.921	83%	0.83	S	S	*	*			trans	-68	120.5	164	-79.8	-176.3	-27	0	0	109.1
22	G	26	Very low	25.9	Very low	76 Å²	76	156.5 Å²	156.5	78%	0.784	83%	0.826	S	S	*	*			trans	-147.4	75.6	176.7	0	0	0	0	0	110.6	L20	L20-G22 PolarHBondContact O-N 3.03Å
23	G	27.5	Very low	25.9	Very low	72 Å²	72	158.8 Å²	158.8	74%	0.742	83%	0.829	S	S	*	*			trans	-75.3	135.9	-178.3	0	0	0	0	0	113
24	R	27.9	Very low	25.7	Very low	251 Å²	251	163.1 Å²	163.1	95%	0.947	83%	0.832	S	S	*	*			trans	-169.9	140.6	137.5	-104.2	160.2	-167.4	-142.7	2.1	112.1
25	R	27.9	Very low	25.8	Very low	213 Å²	213	157.5 Å²	157.5	80%	0.804	82%	0.819	S	S	*	*			trans	-57.8	146.8	176.6	-59.3	167.9	174.2	170.3	-5.4	112.3
26	L	27	Very low	25.9	Very low	176 Å²	176	158 Å²	158	92%	0.921	81%	0.813	S	S	*	*			trans	-134.7	141.6	145	-78.8	178.3	0	0	0	110.1
27	Y	25.9	Very low	25.9	Very low	193 Å²	193	159.6 Å²	159.6	76%	0.757	81%	0.813	S	S	*	*			trans	-84.3	139	-177.9	-69.6	-100.5	0	0	0	110.8	R29	Y27-R29 PolarHBondContact O-N 3.02Å
28	S	25.3	Very low	25.8	Very low	124 Å²	124	161.5 Å²	161.5	87%	0.867	82%	0.815	S	S	*	*			trans	-73.7	121.2	156.2	-177.6	0	0	0	0	108.9
29	R	25.1	Very low	25.8	Very low	223 Å²	223	167.5 Å²	167.5	84%	0.842	82%	0.819	S	S	*	*			trans	-108.5	126	168.7	-101.8	-172.4	177.5	-179.8	-0	109.1	Y27 V31	Y27-R29 PolarHBondContact O-N 3.02Å; R29-V31 PolarHBondContact O-N 2.93Å
30	Y	23	Very low	25.7	Very low	228 Å²	228	172.7 Å²	172.7	89%	0.894	82%	0.823	S	S	*	*			trans	-44.2	126.1	165.6	-126.6	-107.3	0	0	0	111.7
31	V	24.6	Very low	25.7	Very low	124 Å²	124	170.9 Å²	170.9	75%	0.752	81%	0.813	S	S	*	*			trans	-127.9	96.7	164.4	179.2	0	0	0	0	108	R29	R29-V31 PolarHBondContact O-N 2.93Å
32	S	25.4	Very low	25.6	Very low	103 Å²	103	171.2 Å²	171.2	72%	0.72	81%	0.812	S	S	*	*			trans	-66.4	130	164.9	-176.8	0	0	0	0	108.6
33	N	24.9	Very low	25.6	Very low	157 Å²	157	172.1 Å²	172.1	84%	0.84	81%	0.807	S	S	*	*			trans	-127.8	125.8	173.4	-146.8	-5.2	0	0	0	110.7
34	R	26.2	Very low	25.5	Very low	209 Å²	209	180.2 Å²	180.2	79%	0.789	82%	0.815	S	S	*	*			trans	-131.1	132.4	-167.7	-153.7	-177.9	-171.2	-173.1	5.9	109.2
35	N	27.7	Very low	25.6	Very low	115 Å²	115	174.7 Å²	174.7	62%	0.615	81%	0.808	S	S	*	*			trans	93.2	113.2	161.1	-61.7	-54	0	0	0	121.6
36	K	28.2	Very low	26.1	Very low	179 Å²	179	169.8 Å²	169.8	78%	0.778	81%	0.805	S	S	*	*				74.3	100.6	118.1	-63.5	175	-176.8	179.2	0	121
37	L	26.2	Very low	27	Very low	145 Å²	145	166.2 Å²	166.2	76%	0.759	79%	0.792	S	S	*	*				28.9	121.9	116.7	-78.4	158.5	0	0	0	119.3
38	K	24.4	Very low	27.1	Very low	208 Å²	208	163 Å²	163	90%	0.904	79%	0.792	S	S	*	*				-169	138.7	114	-107.3	169.6	-176.5	178.4	0	114.5
39	W	23.6	Very low	27.3	Very low	214 Å²	214	164.4 Å²	164.4	81%	0.811	79%	0.789	S	S	*	*			trans	-77	152.9	177.4	-64	84.1	0	0	0	114
40	R	23.2	Very low	27.3	Very low	249 Å²	249	160.6 Å²	160.6	94%	0.94	79%	0.786	S	S	*	*			trans	-149.7	131.9	144.7	-71.2	-159.3	178.8	-156.3	-1.1	112.4
41	L	24.3	Very low	27.5	Very low	133 Å²	133	155.7 Å²	155.7	70%	0.696	79%	0.785	S	S	*	*			trans	-80.9	157.6	160.9	-75.4	81.3	0	0	0	110.2
42	F	24.3	Very low	27.6	Very low	203 Å²	203	155.2 Å²	155.2	89%	0.89	79%	0.787	S	S	*	*				178.3	162.8	105.7	-98	-69.3	0	0	0	113.1
43	S	24.8	Very low	28.4	Very low	96 Å²	96	155.5 Å²	155.5	67%	0.671	79%	0.786	S	S	*	*			trans	-104.8	158.8	-165.5	52.2	0	0	0	0	115
44	R	25.8	Very low	28.4	Very low	241 Å²	241	154 Å²	154	91%	0.909	79%	0.787	S	S	*	*				170.4	160.8	123.7	-95.5	176.6	167.9	-173.5	-4.1	115.8
45	V	29.3	Very low	28.3	Very low	135 Å²	135	148 Å²	148	82%	0.818	79%	0.789	S	S	*	*			trans	-140.8	152.6	-173.9	-163.5	0	0	0	0	105.6
46	P	39.8	Very low	28.2	Very low	111 Å²	111	145.9 Å²	145.9	72%	0.721	80%	0.795	S	S	*	*			cis	-145.1	-138.9	41	43.1	-17.5	0	0	0	112.1
47	P	45.9	Very low	28	Very low	100 Å²	100	147.6 Å²	147.6	65%	0.649	80%	0.803	S	S	*	*			cis	-141.6	-175.3	-15.7	30.3	-5.1	0	0	0	118.5
48	T	27.5	Very low	28.2	Very low	126 Å²	126	147.2 Å²	147.2	77%	0.773	81%	0.807	S	S	*	*			trans	89.2	149.1	158	77	0	0	0	0	118.9
49	L	28.9	Very low	28.3	Very low	153 Å²	153	144 Å²	144	80%	0.801	80%	0.799	S	S	*	*			cis	-149.7	173.2	13.7	-142.4	136.5	0	0	0	113.3
50	N	25.4	Very low	28.7	Very low	143 Å²	143	140.3 Å²	140.3	77%	0.765	80%	0.804	S	S	*	*			trans	-75.3	161.3	-164.2	-54.2	-37.3	0	0	0	119.1
51	S	26.4	Very low	28.9	Very low	126 Å²	126	136.4 Å²	136.4	88%	0.881	79%	0.794	S	S	*	*				177.1	158.5	118.4	46.6	0	0	0	0	115.2
52	S	26.4	Very low	29.4	Very low	113 Å²	113	135.1 Å²	135.1	79%	0.79	80%	0.802	S	S	*	*			trans	-158	-178.6	175	67.7	0	0	0	0	108.4
53	P	43	Very low	29.5	Very low	109 Å²	109	136 Å²	136	71%	0.708	80%	0.801	S	S	*	*			cis	-135.4	-162.3	-6.4	37.7	-15.9	0	0	0	114.2
54	C	24.9	Very low	29.7	Very low	127 Å²	127	142 Å²	142	86%	0.858	81%	0.809	S	S	*	*			trans	112.1	134.1	151.8	-72.1	0	0	0	0	120.9
55	G	24.3	Very low	29.8	Very low	81 Å²	81	139.8 Å²	139.8	84%	0.835	81%	0.809	S	S	*	*			trans	98	102.4	141.9	0	0	0	0	0	117.1
56	G	24.7	Very low	29.8	Very low	71 Å²	71	138.7 Å²	138.7	73%	0.732	80%	0.803	S	S	*	*			trans	-89.5	162.1	177.3	0	0	0	0	0	114.6
57	F	25.8	Very low	29.7	Very low	216 Å²	216	138.6 Å²	138.6	95%	0.947	80%	0.804	S	S	*	*			trans	-157	140.1	143.4	-101.8	-70.8	0	0	0	109.8
58	T	28.7	Very low	29.3	Very low	137 Å²	137	139.5 Å²	139.5	84%	0.84	81%	0.808	S	S	*	*			trans	-76.9	134.4	179.9	31	0	0	0	0	112.1
59	L	27.5	Very low	29.8	Very low	140 Å²	140	141.2 Å²	141.2	73%	0.733	81%	0.808	S	S	*	*			trans	-134.6	107.7	162.9	-157.1	92	0	0	0	109.6	K61	L59-K61 HydrophobicContact CD2-CD 4.07Å; L59-K61 HydrophobicContact CD2-CG 4.18Å; L59-K61 PolarHBondContact O-N 3.01Å
60	C	31.8	Very low	30.3	Very low	137 Å²	137	142.3 Å²	142.3	93%	0.926	81%	0.808	S	S	*	*			trans	-63.2	116.1	168.9	-82.5	0	0	0	0	109.8
61	K	27.8	Very low	30.9	Very low	167 Å²	167	141.5 Å²	141.5	73%	0.726	80%	0.804	S	S	*	*			trans	-130.3	131.9	160.3	-85.2	-177.1	174.5	175.7	0	108.8	L59 Y63	L59-K61 HydrophobicContact CD2-CD 4.07Å; L59-K61 HydrophobicContact CD2-CG 4.18Å; L59-K61 PolarHBondContact O-N 3.01Å; K61-Y63 PolarHBondContact O-N 2.73Å
62	A	34.5	Very low	31.4	Very low	105 Å²	105	141.7 Å²	141.7	87%	0.868	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-59.8	121.1	-173.7	0	0	0	0	0	111.2
63	Y	26.3	Very low	32.2	Very low	222 Å²	222	145 Å²	145	87%	0.871	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-78.9	124	161.1	-90.4	-93.2	0	0	0	108.4	K61	K61-Y63 PolarHBondContact O-N 2.73Å
64	R	28.9	Very low	32.4	Very low	221 Å²	221	146.3 Å²	146.3	83%	0.834	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-60.9	141.7	165.6	-68.1	173	172.4	168.1	-4.8	107.6	T66	R64-T66 VanDerWaalsContact C-N 3.31Å; R64-T66 PolarHBondContact O-N 3.39Å
65	H	27.3	Very low	33.9	Very low	195 Å²	195	146.8 Å²	146.8	90%	0.903	79%	0.786	S	S	*	*			trans	-61.3	98.8	161.7	-72.2	-91	0	0	0	108.1
66	T	30.9	Very low	36.1	Very low	113 Å²	113	148.8 Å²	148.8	69%	0.693	77%	0.773	S	S	*	*			trans	-88.6	94.1	156.3	48.8	0	0	0	0	105.8	R64 T68	R64-T66 VanDerWaalsContact C-N 3.31Å; R64-T66 PolarHBondContact O-N 3.39Å; T66-T68 PolarHBondContact O-N 3.4Å
67	S	35.7	Very low	38.8	Very low	108 Å²	108	147.4 Å²	147.4	76%	0.755	75%	0.749	S	S	*	*			trans	-66	83.3	165.7	50.8	0	0	0	0	108.4
68	T	38.8	Very low	41.6	Very low	120 Å²	120	138.8 Å²	138.8	74%	0.736	72%	0.715	S	S	*	*			trans	-93.2	63.2	152.6	54.9	0	0	0	0	106.7	T66	T66-T68 PolarHBondContact O-N 3.4Å
69	E	37.3	Very low	44.2	Very low	162 Å²	162	135.9 Å²	135.9	76%	0.757	70%	0.699	S	S	*	*			trans	-76.7	111	146.6	-71.5	-179.5	171.1	0	0	103.2	D71	E69-D71 PolarHBondContact O-N 3.4Å
70	E	39.2	Very low	47	Very low	175 Å²	175	134.6 Å²	134.6	82%	0.818	69%	0.689	S	S	*	*			trans	-66.6	97.8	162.5	-68.7	175.7	149.9	0	0	104.2	D72	E70-D72 PolarHBondContact O-N 3.33Å
71	D	37.7	Very low	49.7	Very low	127 Å²	127	132.4 Å²	132.4	68%	0.679	67%	0.665	S	S	*	*			trans	-61.7	88.3	167.1	-80.2	-38.5	0	0	0	106.6	E69 F73	E69-D71 PolarHBondContact O-N 3.4Å; D71-F73 VanDerWaalsContact C-N 3.27Å; D71-F73 HydrophobicContact CB-CD2 4.4Å; D71-F73 HydrophobicContact CB-CE2 4.33Å; D71-F73 WeakPolarHBondContact O-CD2 3.48Å; D71-F73 PolarHBondContact O-N 3.43Å
72	D	38.3	Very low	52.6	Low	129 Å²	129	125 Å²	125	69%	0.69	63%	0.634	S	S	*	*			trans	-56.2	99	161.7	-88.7	-34.1	0	0	0	106	E70 H74	E70-D72 PolarHBondContact O-N 3.33Å; D72-H74 PolarHBondContact O-CD2 3.3Å; D72-H74 VanDerWaalsContact O-CD2 3.27Å; D72-H74 PolarHBondContact O-N 3.49Å
73	F	42.3	Very low	55.2	Low	183 Å²	183	121.2 Å²	121.2	80%	0.803	60%	0.598	S	S	*	*			trans	-65.7	82	176.3	-91.6	-93.6	0	0	0	108.6	D71 L75	D71-F73 VanDerWaalsContact C-N 3.27Å; D71-F73 HydrophobicContact CB-CD2 4.4Å; D71-F73 HydrophobicContact CB-CE2 4.33Å; D71-F73 WeakPolarHBondContact O-CD2 3.48Å; D71-F73 PolarHBondContact O-N 3.43Å; F73-L75 VanDerWaalsContact C-N 3.3Å; F73-L75 PolarHBondContact O-N 2.93Å
74	H	47.9	Very low	58.2	Low	136 Å²	136	117.5 Å²	117.5	63%	0.63	59%	0.589	S	S	*	*			trans	-64.6	91.1	172	-81.1	-88.4	0	0	0	108.8	D72 Q76	D72-H74 PolarHBondContact O-CD2 3.3Å; D72-H74 VanDerWaalsContact O-CD2 3.27Å; D72-H74 PolarHBondContact O-N 3.49Å; H74-Q76 PolarHBondContact O-N 3.08Å
75	L	56.4	Low	61.2	Low	138 Å²	138	110.9 Å²	110.9	72%	0.723	57%	0.57	S	S	*	*			trans	-67.8	20.4	168.9	-71.6	164.5	0	0	0	112.9	F73 T497	F73-L75 VanDerWaalsContact C-N 3.3Å; F73-L75 PolarHBondContact O-N 2.93Å; L75-T497 HydrophobicContact CB-CG2 4.35Å; L75-T497 WeakPolarHBondContact O-CG2 3.34Å; L75-T497 PolarHBondContact O-OG1 3.28Å
76	Q	71	Confident	64.3	Low	123 Å²	123	101.8 Å²	101.8	58%	0.575	53%	0.528	S	S	*	.			trans	-88.4	110.9	176.6	-73	179	-40.4	0	0	108.3	H74 S78	H74-Q76 PolarHBondContact O-N 3.08Å; Q76-S78 PolarHBondContact O-N 3.24Å
77	L	80.4	Confident	67.2	Low	41 Å²	41	100 Å²	100	22%	0.215	51%	0.508	C	S	.	.			trans	-54.3	136.8	171.8	-67.1	163.4	0	0	0	109.8	Q81 I82 L85 L496 T497	L77-Q81 HydrophobicContact CB-CB 4.32Å; L77-Q81 HydrophobicContact CD2-CB 4.15Å; L77-I82 HydrophobicContact CB-CD1 4.24Å; L77-I82 HydrophobicContact CB-CG1 3.72Å; L77-I82 HydrophobicContact CD1-CG1 4.35Å; L77-L85 HydrophobicContact CD1-CD1 3.69Å; L77-L85 HydrophobicContact CD2-CD1 4.17Å; L77-L496 HydrophobicContact CD1-CB 3.79Å; L77-T497 WeakPolarHBondContact CD1-OG1 3.44Å; L77-T497 WeakPolarHBondContact CG-OG1 3.32Å
78	S	84.6	Confident	69.8	Low	36 Å²	36	98.2 Å²	98.2	25%	0.252	50%	0.5	S	S	.	.			trans	-66.5	156.9	173	93.9	0	0	0	0	110.7	Q76 E80 Q81 I82	Q76-S78 PolarHBondContact O-N 3.24Å; S78-E80 VanDerWaalsContact CB-OE2 3.24Å; S78-E80 WeakPolarHBondContact CB-OE2 3.18Å; S78-E80 PolarHBondContact O-N 2.8Å; S78-E80 VanDerWaalsContact O-N 3.17Å; S78-E80 PolarHBondContact OG-N 2.71Å; S78-E80 PolarHBondContact OG-OE2 2.88Å; S78-Q81 PolarHBondContact O-N 2.91Å; S78-Q81 PolarHBondContact OG-N 2.71Å; S78-I82 WeakPolarHBondContact O-CG1 3.45Å; S78-I82 PolarHBondContact O-N 3.09Å
79	P	83.8	Confident	72.3	Confident	75 Å²	75	93 Å²	93	49%	0.487	47%	0.471	S	S	.	.	H	α-helix	trans	-54.7	-33.9	175.2	-26.5	36	0	0	0	113.2	N83	P79-N83 WeakPolarHBondContact O-CB 3.32Å; P79-N83 PolarHBondContact O-N 2.85Å; P79-N83 PolarHBondContact O-ND2 2.78Å
80	E	85.4	Confident	74.9	Confident	113 Å²	113	87.6 Å²	87.6	53%	0.528	45%	0.445	S	S	.	.	H	α-helix	trans	-67.1	-47.1	175	-56	74.2	-161.6	0	0	111.3	S78 I82 N83 E84	S78-E80 VanDerWaalsContact CB-OE2 3.24Å; S78-E80 WeakPolarHBondContact CB-OE2 3.18Å; S78-E80 PolarHBondContact O-N 2.8Å; S78-E80 VanDerWaalsContact O-N 3.17Å; S78-E80 PolarHBondContact OG-N 2.71Å; S78-E80 PolarHBondContact OG-OE2 2.88Å; E80-I82 VanDerWaalsContact C-N 3.34Å; E80-I82 PolarHBondContact O-N 3.45Å; E80-N83 CarbonylContact O-C 3.37Å; E80-N83 WeakPolarHBondContact O-CB 3.39Å; E80-N83 PolarHBondContact O-N 3.01Å; E80-N83 VanDerWaalsContact O-N 3.1Å; E80-E84 WeakPolarHBondContact O-CG 3.29Å; E80-E84 PolarHBondContact O-N 2.95Å
81	Q	88.4	Confident	77.5	Confident	91 Å²	91	79.7 Å²	79.7	43%	0.425	41%	0.409	S	S	.	.	H	α-helix	trans	-62.8	-39.4	177	-66.6	176.6	-47.9	0	0	112.2	L77 S78 N83 E84 L85	L77-Q81 HydrophobicContact CB-CB 4.32Å; L77-Q81 HydrophobicContact CD2-CB 4.15Å; S78-Q81 PolarHBondContact O-N 2.91Å; S78-Q81 PolarHBondContact OG-N 2.71Å; Q81-N83 VanDerWaalsContact C-N 3.3Å; Q81-N83 PolarHBondContact O-N 2.82Å; Q81-E84 PolarHBondContact O-N 3.12Å; Q81-L85 WeakPolarHBondContact O-CB 3.48Å; Q81-L85 WeakPolarHBondContact O-CG 3.29Å; Q81-L85 PolarHBondContact O-N 2.75Å
82	I	89	Confident	80.2	Confident	13 Å²	13	76.8 Å²	76.8	7%	0.067	40%	0.403	C	S	.	.	H	α-helix	trans	-59.7	-42.8	172.8	-72	169.9	0	0	0	110.6	L77 S78 E80 L86 L492 A493 L496	L77-I82 HydrophobicContact CB-CD1 4.24Å; L77-I82 HydrophobicContact CB-CG1 3.72Å; L77-I82 HydrophobicContact CD1-CG1 4.35Å; S78-I82 WeakPolarHBondContact O-CG1 3.45Å; S78-I82 PolarHBondContact O-N 3.09Å; E80-I82 VanDerWaalsContact C-N 3.34Å; E80-I82 PolarHBondContact O-N 3.45Å; I82-L86 HydrophobicContact CG2-CD1 3.92Å; I82-L86 WeakPolarHBondContact O-CB 3.36Å; I82-L86 WeakPolarHBondContact O-CG 3.5Å; I82-L86 PolarHBondContact O-N 3.37Å; I82-L492 HydrophobicContact CG2-CD2 3.71Å; I82-L492 HydrophobicContact CG2-CG 4.05Å; I82-A493 HydrophobicContact CD1-CB 3.75Å; I82-L496 HydrophobicContact CB-CD1 4.36Å; I82-L496 HydrophobicContact CG1-CD1 4.27Å; I82-L496 HydrophobicContact CG2-CD1 3.78Å
83	N	89.3	Confident	82.8	Confident	24 Å²	24	73.3 Å²	73.3	13%	0.128	38%	0.382	C	S	.	.	H	α-helix	trans	-69.2	-38.1	177.6	-68.9	-21	0	0	0	112.3	P79 E80 Q81 R87 R476	P79-N83 WeakPolarHBondContact O-CB 3.32Å; P79-N83 PolarHBondContact O-N 2.85Å; P79-N83 PolarHBondContact O-ND2 2.78Å; E80-N83 CarbonylContact O-C 3.37Å; E80-N83 WeakPolarHBondContact O-CB 3.39Å; E80-N83 PolarHBondContact O-N 3.01Å; E80-N83 VanDerWaalsContact O-N 3.1Å; Q81-N83 VanDerWaalsContact C-N 3.3Å; Q81-N83 PolarHBondContact O-N 2.82Å; N83-R87 WeakPolarHBondContact O-CB 3.06Å; N83-R87 WeakPolarHBondContact O-CG 3.49Å; N83-R87 PolarHBondContact O-N 3.2Å; N83-R476 PolarHBondContact OD1-NH1 2.64Å; N83-R476 PolarHBondContact OD1-NH2 2.99Å
84	E	90	Very high	85.1	Confident	145 Å²	145	72.6 Å²	72.6	68%	0.678	38%	0.379	S	S	*	.	H	α-helix	trans	-63	-45.6	174.3	-73.2	179.6	169.2	0	0	111.7	E80 Q81 R87 A88	E80-E84 WeakPolarHBondContact O-CG 3.29Å; E80-E84 PolarHBondContact O-N 2.95Å; Q81-E84 PolarHBondContact O-N 3.12Å; E84-R87 PolarHBondContact O-N 3.13Å; E84-A88 PolarHBondContact O-N 3.18Å; E84-A88 VanDerWaalsContact O-N 3.09Å
85	L	91.1	Very high	86.9	Confident	82 Å²	82	67.6 Å²	67.6	43%	0.429	36%	0.356	S	S	.	.	H	α-helix	trans	-61.6	-48.3	176.5	-72.7	169	0	0	0	112	L77 Q81 R87 A88	L77-L85 HydrophobicContact CD1-CD1 3.69Å; L77-L85 HydrophobicContact CD2-CD1 4.17Å; Q81-L85 WeakPolarHBondContact O-CB 3.48Å; Q81-L85 WeakPolarHBondContact O-CG 3.29Å; Q81-L85 PolarHBondContact O-N 2.75Å; L85-R87 VanDerWaalsContact C-N 3.33Å; L85-R87 PolarHBondContact O-N 3.08Å; L85-A88 WeakPolarHBondContact O-CB 3.48Å; L85-A88 PolarHBondContact O-N 2.97Å
86	L	92.2	Very high	87.6	Confident	3 Å²	3	67.2 Å²	67.2	2%	0.016	35%	0.354	C	S	.	.	H	α-helix	trans	-67.9	-30.5	179	-71.6	171.3	0	0	0	112.8	I82 N112 T472 I475 R476 I479 L492 L496	I82-L86 HydrophobicContact CG2-CD1 3.92Å; I82-L86 WeakPolarHBondContact O-CB 3.36Å; I82-L86 WeakPolarHBondContact O-CG 3.5Å; I82-L86 PolarHBondContact O-N 3.37Å; L86-N112 PolarHBondContact O-ND2 2.96Å; L86-T472 HydrophobicContact CB-CG2 4.11Å; L86-I475 HydrophobicContact CD2-CG2 3.9Å; L86-R476 HydrophobicContact CD1-CB 4.1Å; L86-R476 HydrophobicContact CD1-CG 4.01Å; L86-I479 HydrophobicContact CD2-CD1 4.27Å; L86-L492 HydrophobicContact CD1-CD1 4.35Å; L86-L496 HydrophobicContact CD1-CD1 4.3Å; L86-L496 HydrophobicContact CD2-CD1 4.29Å; L86-L496 HydrophobicContact CD2-CD2 4.27Å; L86-L496 HydrophobicContact CG-CD1 4.06Å
87	R	92.3	Very high	87.2	Confident	76 Å²	76	66 Å²	66	29%	0.287	35%	0.352	S	S	.	.	H	α-helix	trans	-84.3	-7.3	178.2	-67.7	173.8	-176.3	171.8	4.3	113.3	N83 E84 L85 G89 E90 E465 T472	N83-R87 WeakPolarHBondContact O-CB 3.06Å; N83-R87 WeakPolarHBondContact O-CG 3.49Å; N83-R87 PolarHBondContact O-N 3.2Å; E84-R87 PolarHBondContact O-N 3.13Å; L85-R87 VanDerWaalsContact C-N 3.33Å; L85-R87 PolarHBondContact O-N 3.08Å; R87-G89 VanDerWaalsContact C-N 3.31Å; R87-G89 PolarHBondContact O-N 3.48Å; R87-E90 WeakPolarHBondContact O-CB 3.48Å; R87-E90 PolarHBondContact O-N 3.02Å; R87-E90 VanDerWaalsContact O-N 3.11Å; R87-E465 IonicContact CZ-OE2 3.44Å; R87-E465 IonicContact NH1-OE2 3.34Å; R87-E465 PolarHBondContact NH1-OE2 2.89Å; R87-E465 IonicContact NH2-OE2 2.88Å; R87-E465 PolarHBondContact NH2-OE2 3.22Å; R87-T472 HydrophobicContact CG-CG2 4.42Å
88	A	90.9	Very high	85.8	Confident	70 Å²	70	70.3 Å²	70.3	58%	0.579	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-31.2	-174.9	0	0	0	0	0	114.5	E84 L85	E84-A88 PolarHBondContact O-N 3.18Å; E84-A88 VanDerWaalsContact O-N 3.09Å; L85-A88 WeakPolarHBondContact O-CB 3.48Å; L85-A88 PolarHBondContact O-N 2.97Å
89	G	89.9	Confident	84	Confident	12 Å²	12	78 Å²	78	12%	0.124	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	3.9	175.4	0	0	0	0	0	114.5	R87 N112 R124	R87-G89 VanDerWaalsContact C-N 3.31Å; R87-G89 PolarHBondContact O-N 3.48Å; G89-N112 VanDerWaalsContact CA-OD1 3.29Å; G89-N112 WeakPolarHBondContact CA-OD1 3.39Å; G89-N112 PolarHBondContact O-OD1 2.9Å; G89-R124 PolarHBondContact O-NH1 3.02Å; G89-R124 PolarHBondContact O-NH2 2.94Å
90	E	93.9	Very high	82.3	Confident	48 Å²	48	77.5 Å²	77.5	22%	0.224	41%	0.405	C	S	.	.			trans	-72.2	128.8	-167.8	-168.2	176.1	120.4	0	0	112.4	R87 N112 H192 N469 T472	R87-E90 WeakPolarHBondContact O-CB 3.48Å; R87-E90 PolarHBondContact O-N 3.02Å; R87-E90 VanDerWaalsContact O-N 3.11Å; E90-N112 PolarHBondContact N-OD1 3Å; E90-H192 PolarHBondContact O-CD2 2.89Å; E90-N469 HydrophobicContact CG-CB 3.78Å; E90-N469 WeakPolarHBondContact CG-ND2 3.07Å; E90-N469 WeakPolarHBondContact OE1-CB 3.05Å; E90-T472 WeakPolarHBondContact CG-OG1 3.41Å; E90-T472 WeakPolarHBondContact OE2-CB 3.47Å; E90-T472 PolarHBondContact OE2-OG1 3.4Å
91	S	93.7	Very high	80.6	Confident	9 Å²	9	84.1 Å²	84.1	6%	0.063	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	140.8	170.9	102.5	0	0	0	0	110.9	E110 S111 N469	S91-E110 CarbonylContact O-C 3.54Å; S91-E110 WeakPolarHBondContact O-CA 3.22Å; S91-S111 PolarHBondContact N-O 2.92Å; S91-S111 PolarHBondContact O-N 3.44Å; S91-S111 PolarHBondContact OG-OG 3.29Å; S91-N469 PolarHBondContact O-ND2 3.15Å
92	A	93.6	Very high	79	Confident	65 Å²	65	84.4 Å²	84.4	54%	0.537	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	122.1	176.3	0	0	0	0	0	109.5	E110	A92-E110 HydrophobicContact CB-CG 4.18Å
93	H	93.1	Very high	77.9	Confident	56 Å²	56	86.6 Å²	86.6	26%	0.259	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	130.6	-175	-67.8	92.7	0	0	0	110.1	R108 F109	H93-R108 CarbonylContact O-C 3.54Å; H93-R108 WeakPolarHBondContact O-CA 3.38Å; H93-R108 VanDerWaalsContact O-CB 3.28Å; H93-R108 WeakPolarHBondContact O-CB 3.45Å; H93-F109 HydrophobicContact CB-CD1 3.96Å; H93-F109 HydrophobicContact CB-CE1 3.42Å; H93-F109 VanDerWaalsContact CB-CE1 3.42Å; H93-F109 HydrophobicContact CB-CE2 4.19Å; H93-F109 HydrophobicContact CB-CZ 3.56Å; H93-F109 AromaticContact CG-CE1 3.95Å; H93-F109 AromaticContact CG-CZ 3.57Å; H93-F109 PolarHBondContact N-O 2.79Å; H93-F109 AromaticContact ND1-CE2 3.51Å; H93-F109 AromaticContact ND1-CZ 3.27Å; H93-F109 VanDerWaalsContact ND1-CZ 3.27Å; H93-F109 WeakPolarHBondContact ND1-CZ 3.49Å; H93-F109 PolarHBondContact O-N 2.82Å
94	K	90.7	Very high	77.5	Confident	169 Å²	169	87.3 Å²	87.3	74%	0.735	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	131.9	168.1	-67	-180	-178.6	175.6	0	108.3	R108	K94-R108 HydrophobicContact CG-CB 4.18Å
95	I	85.6	Confident	77.6	Confident	30 Å²	30	80.5 Å²	80.5	15%	0.154	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-80.9	124.8	175.5	-53	-53.2	0	0	0	107.2	N104 V106 L107 F109 L135 L190	I95-N104 WeakPolarHBondContact CG2-ND2 3.43Å; I95-V106 HydrophobicContact CG1-CB 4.36Å; I95-V106 HydrophobicContact CG1-CG1 3.81Å; I95-L107 PolarHBondContact N-O 3.01Å; I95-F109 HydrophobicContact CD1-CD1 4.06Å; I95-F109 HydrophobicContact CD1-CE1 4.09Å; I95-L135 HydrophobicContact CD1-CD2 3.64Å; I95-L135 HydrophobicContact CG1-CD2 3.78Å; I95-L135 HydrophobicContact CG2-CD2 4.09Å; I95-L190 HydrophobicContact CD1-CD1 3.98Å
96	L	70.8	Confident	77.7	Confident	130 Å²	130	76.7 Å²	76.7	68%	0.681	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-95.1	134.4	176.4	-63	174.6	0	0	0	108.3	L98	L96-L98 HydrophobicContact CB-CD1 4.27Å; L96-L98 PolarHBondContact O-N 3.35Å
97	D	62.2	Low	77.8	Confident	97 Å²	97	80.5 Å²	80.5	52%	0.519	42%	0.42	S	S	.	.			trans	-68	83.4	170.5	-73	-34.5	0	0	0	109.5	N104	D97-N104 VanDerWaalsContact OD1-CB 3.26Å; D97-N104 WeakPolarHBondContact OD1-CB 3.43Å; D97-N104 PolarHBondContact OD1-N 3.01Å
98	L	51.1	Low	77.9	Confident	133 Å²	133	79.1 Å²	79.1	70%	0.696	42%	0.415	S	S	*	.			trans	-83.6	117.3	173	-86.7	143.9	0	0	0	109.5	L96 S100	L96-L98 HydrophobicContact CB-CD1 4.27Å; L96-L98 PolarHBondContact O-N 3.35Å; L98-S100 PolarHBondContact O-N 2.75Å
99	E	47.7	Very low	78.2	Confident	196 Å²	196	75.8 Å²	75.8	92%	0.916	39%	0.387	S	S	*	.	S	Bend	trans	69.8	-30	163.5	-50.6	-167.3	154	0	0	118.3
100	S	47.9	Very low	78.5	Confident	65 Å²	65	75.4 Å²	75.4	46%	0.455	38%	0.382	S	S	.	.			trans	-80.1	138.3	177.5	135.1	0	0	0	0	112.5	L98 V102	L98-S100 PolarHBondContact O-N 2.75Å; S100-V102 PolarHBondContact O-N 3.02Å; S100-V102 WeakPolarHBondContact OG-CB 3.48Å; S100-V102 PolarHBondContact OG-N 3.2Å; S100-V102 PolarHBondContact OG-O 2.96Å
101	R	49	Very low	78.7	Confident	253 Å²	253	73.3 Å²	73.3	96%	0.955	37%	0.373	S	S	*	.	S	Bend	trans	-77.9	2.6	171.4	-69.3	-173.1	179.4	-176.1	0.7	113.6
102	V	54.9	Low	78.9	Confident	97 Å²	97	72.9 Å²	72.9	59%	0.588	37%	0.37	S	S	*	.	S	Bend	trans	-99.4	120.4	177	-175.6	0	0	0	0	107.3	S100	S100-V102 PolarHBondContact O-N 3.02Å; S100-V102 WeakPolarHBondContact OG-CB 3.48Å; S100-V102 PolarHBondContact OG-N 3.2Å; S100-V102 PolarHBondContact OG-O 2.96Å
103	P	65.3	Low	79	Confident	59 Å²	59	71.7 Å²	71.7	38%	0.383	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-71	133.2	-176.9	31.5	-36.2	0	0	0	109.9	S521	P103-S521 WeakPolarHBondContact CB-OG 3.34Å
104	N	82.6	Confident	79.1	Confident	38 Å²	38	70 Å²	70	20%	0.203	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-63.8	142.1	-176.1	-159.4	-34.9	0	0	0	111.2	I95 D97 V106 L135 S521	I95-N104 WeakPolarHBondContact CG2-ND2 3.43Å; D97-N104 VanDerWaalsContact OD1-CB 3.26Å; D97-N104 WeakPolarHBondContact OD1-CB 3.43Å; D97-N104 PolarHBondContact OD1-N 3.01Å; N104-V106 VanDerWaalsContact C-N 3.32Å; N104-V106 PolarHBondContact OD1-N 3.35Å; N104-L135 WeakPolarHBondContact ND2-CD1 3.5Å; N104-S521 WeakPolarHBondContact O-CB 3.5Å; N104-S521 PolarHBondContact O-OG 3.48Å
105	S	90.9	Very high	79.3	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.021	33%	0.327	C	S	.	.	S	Bend	trans	-76.2	-21	174.1	60.1	0	0	0	0	112.5	V274 G276 F517 N518	S105-V274 WeakPolarHBondContact OG-CG1 3.44Å; S105-G276 WeakPolarHBondContact CB-O 3.12Å; S105-G276 PolarHBondContact OG-O 2.95Å; S105-F517 CarbonylContact O-C 3.55Å; S105-F517 WeakPolarHBondContact O-CA 3.4Å; S105-N518 PolarHBondContact O-N 3.4Å
106	V	94.3	Very high	79.7	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.012	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123.1	172.1	-177.4	0	0	0	0	109.5	I95 N104 L135 F137 V274 V515 F517	I95-V106 HydrophobicContact CG1-CB 4.36Å; I95-V106 HydrophobicContact CG1-CG1 3.81Å; N104-V106 VanDerWaalsContact C-N 3.32Å; N104-V106 PolarHBondContact OD1-N 3.35Å; V106-L135 HydrophobicContact CB-CD2 4.44Å; V106-F137 HydrophobicContact CG1-CZ 4.19Å; V106-F137 HydrophobicContact CG2-CE2 4.4Å; V106-V274 HydrophobicContact CG2-CB 4.25Å; V106-V274 HydrophobicContact CG2-CG1 3.91Å; V106-V274 HydrophobicContact CG2-CG2 4.47Å; V106-V515 HydrophobicContact CB-CG1 4.49Å; V106-V515 HydrophobicContact CG1-CG1 3.6Å; V106-V515 HydrophobicContact CG2-CG1 4.09Å; V106-F517 HydrophobicContact CG2-CD1 4.34Å; V106-F517 HydrophobicContact CG2-CE1 4.27Å
107	L	92.8	Very high	80.8	Confident	82 Å²	82	57.8 Å²	57.8	43%	0.429	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-45.5	177.1	179	65.9	0	0	0	111.7	I95 Y516 N518	I95-L107 PolarHBondContact N-O 3.01Å; L107-Y516 PolarHBondContact N-O 3.42Å; L107-N518 HydrophobicContact CB-CB 4.26Å
108	R	94.9	Very high	82.1	Confident	47 Å²	47	56.9 Å²	56.9	18%	0.177	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	162	-171.6	65	-169.5	-162.1	99.2	-0.4	109.7	H93 K94 E110 Y516	H93-R108 CarbonylContact O-C 3.54Å; H93-R108 WeakPolarHBondContact O-CA 3.38Å; H93-R108 VanDerWaalsContact O-CB 3.28Å; H93-R108 WeakPolarHBondContact O-CB 3.45Å; K94-R108 HydrophobicContact CG-CB 4.18Å; R108-E110 IonicContact CZ-OE1 2.79Å; R108-E110 VanDerWaalsContact NH1-CD 3.27Å; R108-E110 IonicContact NH1-OE1 3.77Å; R108-E110 PolarHBondContact NH1-OE1 2.86Å; R108-E110 IonicContact NH1-OE2 2.69Å; R108-E110 IonicContact NH2-OE1 3.68Å; R108-Y516 HydrophobicContact CG-CD2 3.68Å; R108-Y516 HydrophobicContact CG-CG 4.05Å; R108-Y516 VanDerWaalsContact CZ-CE2 3.47Å; R108-Y516 VanDerWaalsContact NH2-CE2 3.33Å; R108-Y516 PolarHBondContact NH2-OH 2.89Å; R108-Y516 PolarHBondContact O-N 3.34Å
109	F	96.9	Very high	84	Confident	1 Å²	1	54.2 Å²	54.2	0%	0.004	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	160	164.8	71.7	-90.6	0	0	0	111.3	H93 I95 V126 F137 L190 T513 V514 V515	H93-F109 HydrophobicContact CB-CD1 3.96Å; H93-F109 HydrophobicContact CB-CE1 3.42Å; H93-F109 VanDerWaalsContact CB-CE1 3.42Å; H93-F109 HydrophobicContact CB-CE2 4.19Å; H93-F109 HydrophobicContact CB-CZ 3.56Å; H93-F109 AromaticContact CG-CE1 3.95Å; H93-F109 AromaticContact CG-CZ 3.57Å; H93-F109 PolarHBondContact N-O 2.79Å; H93-F109 AromaticContact ND1-CE2 3.51Å; H93-F109 AromaticContact ND1-CZ 3.27Å; H93-F109 VanDerWaalsContact ND1-CZ 3.27Å; H93-F109 WeakPolarHBondContact ND1-CZ 3.49Å; H93-F109 PolarHBondContact O-N 2.82Å; I95-F109 HydrophobicContact CD1-CD1 4.06Å; I95-F109 HydrophobicContact CD1-CE1 4.09Å; F109-V126 HydrophobicContact CD1-CG1 4.29Å; F109-V126 HydrophobicContact CD2-CG2 4.33Å; F109-V126 HydrophobicContact CE1-CB 4.42Å; F109-V126 HydrophobicContact CE1-CG1 3.65Å; F109-V126 HydrophobicContact CE2-CB 4.31Å; F109-V126 HydrophobicContact CE2-CG1 4.32Å; F109-V126 HydrophobicContact CE2-CG2 3.81Å; F109-V126 HydrophobicContact CZ-CB 3.92Å; F109-V126 HydrophobicContact CZ-CG1 3.67Å; F109-V126 HydrophobicContact CZ-CG2 3.94Å; F109-F137 HydrophobicContact CB-CE1 3.94Å; F109-F137 AromaticContact CD1-CE1 3.7Å; F109-F137 HydrophobicContact CD1-CE1 3.7Å; F109-F137 HydrophobicContact CD1-CZ 4.45Å; F109-F137 HydrophobicContact CE1-CE1 4.31Å; F109-F137 AromaticContact CG-CE1 3.83Å; F109-F137 HydrophobicContact CG-CE1 3.83Å; F109-L190 HydrophobicContact CE1-CB 4.28Å; F109-L190 HydrophobicContact CE1-CD1 3.83Å; F109-L190 HydrophobicContact CZ-CB 3.96Å; F109-L190 HydrophobicContact CZ-CD1 4.36Å; F109-T513 HydrophobicContact CD2-CG2 4.35Å; F109-V514 CarbonylContact C-O 3.6Å; F109-V514 VanDerWaalsContact CA-O 3.23Å; F109-V514 WeakPolarHBondContact CA-O 3.19Å; F109-V515 HydrophobicContact CB-CG2 4.22Å
110	E	97.5	Very high	86.2	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.019	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	135.1	176.2	-75.4	172.8	168.6	0	0	107.9	S91 A92 R108 H430 A470 T513 V514 Y516	S91-E110 CarbonylContact O-C 3.54Å; S91-E110 WeakPolarHBondContact O-CA 3.22Å; A92-E110 HydrophobicContact CB-CG 4.18Å; R108-E110 IonicContact CZ-OE1 2.79Å; R108-E110 VanDerWaalsContact NH1-CD 3.27Å; R108-E110 IonicContact NH1-OE1 3.77Å; R108-E110 PolarHBondContact NH1-OE1 2.86Å; R108-E110 IonicContact NH1-OE2 2.69Å; R108-E110 IonicContact NH2-OE1 3.68Å; E110-H430 IonicContact OE1-NE2 3.91Å; E110-H430 IonicContact OE2-NE2 2.68Å; E110-A470 WeakPolarHBondContact OE2-CB 3.32Å; E110-A470 PolarHBondContact OE2-N 3.45Å; E110-T513 CarbonylContact O-C 3.53Å; E110-T513 WeakPolarHBondContact O-CA 3.45Å; E110-V514 PolarHBondContact N-O 2.94Å; E110-V514 PolarHBondContact O-N 3.34Å; E110-Y516 HydrophobicContact CB-CE2 4.29Å; E110-Y516 HydrophobicContact CG-CE2 4.03Å; E110-Y516 VanDerWaalsContact OE2-CE2 3.27Å; E110-Y516 WeakPolarHBondContact OE2-CE2 3.35Å; E110-Y516 PolarHBondContact OE2-OH 3.19Å
111	S	97.4	Very high	88.5	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.021	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	153.9	174.1	69.2	0	0	0	0	111.8	S91 R124 V512 T513	S91-S111 PolarHBondContact N-O 2.92Å; S91-S111 PolarHBondContact O-N 3.44Å; S91-S111 PolarHBondContact OG-OG 3.29Å; S111-R124 PolarHBondContact OG-NH1 2.61Å; S111-V512 CarbonylContact C-O 3.53Å; S111-V512 WeakPolarHBondContact CA-O 3.23Å; S111-V512 VanDerWaalsContact CB-O 3.23Å; S111-V512 WeakPolarHBondContact CB-O 3.13Å; S111-T513 VanDerWaalsContact CB-OG1 3.27Å; S111-T513 WeakPolarHBondContact CB-OG1 3.27Å
112	N	97.6	Very high	90.8	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	160.8	175.3	-160.5	-5.6	0	0	0	109.9	L86 G89 E90 R124 A471 T472 I475 V512	L86-N112 PolarHBondContact O-ND2 2.96Å; G89-N112 VanDerWaalsContact CA-OD1 3.29Å; G89-N112 WeakPolarHBondContact CA-OD1 3.39Å; G89-N112 PolarHBondContact O-OD1 2.9Å; E90-N112 PolarHBondContact N-OD1 3Å; N112-R124 VanDerWaalsContact CA-NH1 3.32Å; N112-A471 HydrophobicContact CB-CB 3.78Å; N112-T472 PolarHBondContact ND2-OG1 2.91Å; N112-I475 HydrophobicContact CB-CD1 3.78Å; N112-V512 PolarHBondContact N-O 3.18Å; N112-V512 PolarHBondContact O-N 3.35Å
113	Q	96.4	Very high	92.9	Very high	39 Å²	39	29.2 Å²	29.2	18%	0.182	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	134.6	178.8	178.8	170	68.3	0	0	109.8	V120 D122 I510 T511	Q113-V120 HydrophobicContact CG-CG2 4.36Å; Q113-D122 VanDerWaalsContact NE2-C 3.33Å; Q113-D122 PolarHBondContact NE2-O 3.14Å; Q113-I510 CarbonylContact C-O 3.54Å; Q113-I510 VanDerWaalsContact CA-O 3.27Å; Q113-I510 WeakPolarHBondContact CA-O 3.36Å; Q113-T511 HydrophobicContact CB-CG2 4.27Å; Q113-T511 HydrophobicContact CG-CG2 4.48Å; Q113-T511 WeakPolarHBondContact CG-OG1 3.48Å; Q113-T511 PolarHBondContact NE2-OG1 3.38Å
114	L	95.6	Very high	94.3	Very high	20 Å²	20	27.2 Å²	27.2	11%	0.105	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	122.3	171.5	175.9	66.9	0	0	0	109.5	I475 I479 L496 I510	L114-I475 HydrophobicContact CB-CD1 4.3Å; L114-I475 HydrophobicContact CB-CG2 3.73Å; L114-I475 HydrophobicContact CD2-CG2 3.65Å; L114-I475 HydrophobicContact CG-CG2 4.32Å; L114-I479 HydrophobicContact CD2-CD1 3.68Å; L114-I479 HydrophobicContact CD2-CG2 4.1Å; L114-L496 HydrophobicContact CD1-CD2 3.97Å; L114-L496 HydrophobicContact CD2-CD2 4.13Å; L114-I510 PolarHBondContact N-O 3.46Å; L114-I510 PolarHBondContact O-N 3.1Å
115	A	94.9	Very high	94.9	Very high	41 Å²	41	25.5 Å²	25.5	34%	0.339	15%	0.145	S	C	.	.			trans	-80.7	144	179.1	0	0	0	0	0	113	V120 R507 D509	A115-V120 HydrophobicContact CB-CB 3.94Å; A115-V120 HydrophobicContact CB-CG2 4.03Å; A115-R507 PolarHBondContact O-NE 2.91Å; A115-R507 VanDerWaalsContact O-NE 3.12Å; A115-R507 PolarHBondContact O-NH2 2.84Å; A115-D509 WeakPolarHBondContact CA-OD1 3.44Å
116	A	94.3	Very high	95.2	Very high	3 Å²	3	25.7 Å²	25.7	3%	0.025	15%	0.146	C	C	.	.	S	Bend	trans	-112.9	-29.5	159	0	0	0	0	0	111.6	A503 R507 D508 D509	A116-A503 HydrophobicContact CB-CB 4.42Å; A116-R507 HydrophobicContact CB-CG 3.84Å; A116-R507 WeakPolarHBondContact CB-O 3.47Å; A116-D508 WeakPolarHBondContact CB-O 3.49Å; A116-D509 PolarHBondContact N-OD1 2.93Å
117	N	92.2	Very high	95.3	Very high	29 Å²	29	25.6 Å²	25.6	16%	0.155	15%	0.146	C	C	.	.	S	Bend	trans	-93	155.5	175.4	-58.6	-64.3	0	0	0	111.9	P119 V120 E121 R504 D509	N117-P119 VanDerWaalsContact C-C 3.49Å; N117-P119 CarbonylContact C-O 3.55Å; N117-P119 WeakPolarHBondContact CB-O 3.36Å; N117-P119 CarbonylContact O-C 3.58Å; N117-V120 PolarHBondContact O-N 2.62Å; N117-E121 HydrophobicContact CB-CG 3.97Å; N117-R504 PolarHBondContact ND2-NE 3.4Å; N117-R504 WeakPolarHBondContact OD1-CD 3.42Å; N117-R504 VanDerWaalsContact OD1-CG 3.32Å; N117-R504 WeakPolarHBondContact OD1-CG 3.5Å; N117-R504 PolarHBondContact OD1-NE 2.95Å; N117-R504 VanDerWaalsContact OD1-NE 3.15Å; N117-D509 PolarHBondContact N-OD1 3.25Å; N117-D509 PolarHBondContact ND2-OD1 2.76Å; N117-D509 PolarHBondContact ND2-OD2 2.67Å
118	S	89.3	Confident	95.4	Very high	79 Å²	79	23.3 Å²	23.3	55%	0.552	14%	0.137	S	C	*	.	S	Bend	trans	-133.7	104.6	175.4	-170.8	0	0	0	0	109.8	E500	S118-E500 WeakPolarHBondContact CB-OE2 3.44Å; S118-E500 PolarHBondContact OG-OE2 2.78Å
119	P	92.6	Very high	95.3	Very high	77 Å²	77	21.4 Å²	21.4	50%	0.5	13%	0.13	S	C	.	.	S	Bend	cis	-66.3	155.9	-4.4	31	-36.9	0	0	0	113	N117 H146	N117-P119 VanDerWaalsContact C-C 3.49Å; N117-P119 CarbonylContact C-O 3.55Å; N117-P119 WeakPolarHBondContact CB-O 3.36Å; N117-P119 CarbonylContact O-C 3.58Å; P119-H146 WeakPolarHBondContact CG-ND1 3.45Å
120	V	94	Very high	95.2	Very high	29 Å²	29	25.1 Å²	25.1	18%	0.176	15%	0.15	C	C	.	.			trans	-54.6	136	169.3	65	0	0	0	0	110.1	Q113 A115 N117 D122 R123 H146 D509	Q113-V120 HydrophobicContact CG-CG2 4.36Å; A115-V120 HydrophobicContact CB-CB 3.94Å; A115-V120 HydrophobicContact CB-CG2 4.03Å; N117-V120 PolarHBondContact O-N 2.62Å; V120-D122 HydrophobicContact CG2-CB 4.14Å; V120-R123 PolarHBondContact O-NH1 3.01Å; V120-R123 PolarHBondContact O-NH2 3.03Å; V120-H146 VanDerWaalsContact O-CB 3.28Å; V120-H146 WeakPolarHBondContact O-CB 3.02Å; V120-D509 HydrophobicContact CG2-CB 4.17Å; V120-D509 WeakPolarHBondContact CG2-OD2 3.4Å
121	E	96	Very high	94.9	Very high	29 Å²	29	27.9 Å²	27.9	14%	0.136	16%	0.162	C	C	.	.			trans	-91	-40.3	-179.7	-52.1	-160.3	107.3	0	0	110.9	N117 R123 G142 G145 H146 A149 D509	N117-E121 HydrophobicContact CB-CG 3.97Å; E121-R123 PolarHBondContact O-NH1 3.04Å; E121-G142 WeakPolarHBondContact CB-O 3.5Å; E121-G145 WeakPolarHBondContact OE1-CA 3.25Å; E121-G145 PolarHBondContact OE1-N 2.91Å; E121-H146 HydrophobicContact CB-CB 4.5Å; E121-A149 VanDerWaalsContact O-CB 3.3Å; E121-A149 WeakPolarHBondContact O-CB 3.11Å; E121-D509 PolarHBondContact N-OD2 3.39Å
122	D	97.6	Very high	94.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.171	C	C	.	.			trans	-59.3	145	178.7	-148.1	4	0	0	0	113.6	Q113 V120 F140 D141 S411 D509 T511	Q113-D122 VanDerWaalsContact NE2-C 3.33Å; Q113-D122 PolarHBondContact NE2-O 3.14Å; V120-D122 HydrophobicContact CG2-CB 4.14Å; D122-F140 CarbonylContact C-O 3.54Å; D122-D141 VanDerWaalsContact OD1-CA 3.28Å; D122-D141 WeakPolarHBondContact OD1-CA 3.49Å; D122-S411 WeakPolarHBondContact OD1-CB 3.34Å; D122-S411 WeakPolarHBondContact OD2-CB 3.44Å; D122-S411 PolarHBondContact OD2-OG 2.77Å; D122-D509 HydrophobicContact CB-CB 3.48Å; D122-D509 VanDerWaalsContact CB-CB 3.48Å; D122-D509 PolarHBondContact N-OD2 3.33Å; D122-T511 WeakPolarHBondContact OD2-CB 3.37Å; D122-T511 PolarHBondContact OD2-N 3.34Å; D122-T511 VanDerWaalsContact OD2-N 3.08Å; D122-T511 PolarHBondContact OD2-OG1 2.85Å
123	R	97.4	Very high	94	Very high	28 Å²	28	35 Å²	35	11%	0.106	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	159	-179.4	-67.4	-63	-178.8	-76.1	0.7	113.3	V120 E121 I139 F140 A149 Q150	V120-R123 PolarHBondContact O-NH1 3.01Å; V120-R123 PolarHBondContact O-NH2 3.03Å; E121-R123 PolarHBondContact O-NH1 3.04Å; R123-I139 WeakPolarHBondContact O-CA 3.35Å; R123-F140 HydrophobicContact CB-CB 4.21Å; R123-F140 HydrophobicContact CB-CD2 4.24Å; R123-F140 PolarHBondContact N-O 3.21Å; R123-F140 PolarHBondContact O-N 3.19Å; R123-A149 HydrophobicContact CB-CB 4.41Å; R123-A149 HydrophobicContact CG-CB 3.93Å; R123-Q150 VanDerWaalsContact NH2-OE1 3.13Å
124	R	96.2	Very high	93.7	Very high	17 Å²	17	33.4 Å²	33.4	6%	0.064	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	148.3	173.2	59	-174.7	179.5	-168.2	-8.9	111.2	G89 S111 N112 G138 I139 H192 D195 T511	G89-R124 PolarHBondContact O-NH1 3.02Å; G89-R124 PolarHBondContact O-NH2 2.94Å; S111-R124 PolarHBondContact OG-NH1 2.61Å; N112-R124 VanDerWaalsContact CA-NH1 3.32Å; R124-G138 CarbonylContact C-O 3.5Å; R124-G138 VanDerWaalsContact CA-O 3.3Å; R124-G138 WeakPolarHBondContact CA-O 3.36Å; R124-I139 HydrophobicContact CB-CD1 4.16Å; R124-H192 VanDerWaalsContact NH2-CB 3.25Å; R124-H192 VanDerWaalsContact NH2-CG 3.29Å; R124-H192 PolarHBondContact NH2-ND1 3.45Å; R124-D195 IonicContact CZ-OD1 3.85Å; R124-D195 IonicContact NE-OD1 3.13Å; R124-D195 IonicContact NE-OD2 3.2Å; R124-D195 IonicContact NH2-OD1 2.7Å; R124-D195 PolarHBondContact NH2-OD1 2.57Å; R124-T511 HydrophobicContact CB-CG2 3.8Å; R124-T511 HydrophobicContact CG-CG2 4.24Å
125	G	95.3	Very high	93.7	Very high	2 Å²	2	33 Å²	33	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	136.4	173.6	0	0	0	0	0	111.1	F137 G138 F157	G125-F137 CarbonylContact O-C 3.55Å; G125-F137 WeakPolarHBondContact O-CA 3.46Å; G125-G138 PolarHBondContact N-O 3.04Å; G125-G138 PolarHBondContact O-N 3.26Å; G125-F157 VanDerWaalsContact C-CE2 3.5Å; G125-F157 WeakPolarHBondContact O-CZ 3.24Å
126	V	96.4	Very high	93.9	Very high	7 Å²	7	31 Å²	31	4%	0.042	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	129	167.1	-171.8	0	0	0	0	109.8	F109 M136 F137 L190	F109-V126 HydrophobicContact CD1-CG1 4.29Å; F109-V126 HydrophobicContact CD2-CG2 4.33Å; F109-V126 HydrophobicContact CE1-CB 4.42Å; F109-V126 HydrophobicContact CE1-CG1 3.65Å; F109-V126 HydrophobicContact CE2-CB 4.31Å; F109-V126 HydrophobicContact CE2-CG1 4.32Å; F109-V126 HydrophobicContact CE2-CG2 3.81Å; F109-V126 HydrophobicContact CZ-CB 3.92Å; F109-V126 HydrophobicContact CZ-CG1 3.67Å; F109-V126 HydrophobicContact CZ-CG2 3.94Å; V126-M136 VanDerWaalsContact CA-O 3.32Å; V126-M136 WeakPolarHBondContact CA-O 3.47Å; V126-F137 HydrophobicContact CB-CD1 4.39Å; V126-F137 HydrophobicContact CG1-CD1 3.67Å; V126-F137 HydrophobicContact CG1-CE1 3.58Å; V126-F137 HydrophobicContact CG1-CZ 4.43Å; V126-F137 HydrophobicContact CG2-CD1 3.86Å; V126-F137 HydrophobicContact CG2-CE1 4.43Å; V126-L190 HydrophobicContact CB-CB 4.27Å; V126-L190 HydrophobicContact CG1-CB 4.21Å; V126-L190 HydrophobicContact CG1-CD1 4.33Å; V126-L190 PolarHBondContact O-N 3.03Å
127	A	95.9	Very high	94.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	149.3	176	0	0	0	0	0	112.4	M136 F157 L187 H188 W189	A127-M136 PolarHBondContact N-O 3.4Å; A127-M136 PolarHBondContact O-N 3.2Å; A127-F157 HydrophobicContact CB-CD2 3.72Å; A127-F157 HydrophobicContact CB-CE2 4.21Å; A127-L187 HydrophobicContact CB-CB 4.33Å; A127-L187 HydrophobicContact CB-CD1 4.3Å; A127-L187 HydrophobicContact CB-CD2 4.39Å; A127-H188 CarbonylContact C-O 3.6Å; A127-H188 VanDerWaalsContact CA-O 3.27Å; A127-H188 WeakPolarHBondContact CA-O 3.22Å; A127-W189 HydrophobicContact CB-CD2 4.1Å; A127-W189 HydrophobicContact CB-CE3 3.99Å; A127-W189 HydrophobicContact CB-CZ3 4.37Å
128	S	94.7	Very high	94.4	Very high	34 Å²	34	29.5 Å²	29.5	24%	0.238	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	136.5	162.4	-170.4	0	0	0	0	109.4	L187 H188	S128-L187 WeakPolarHBondContact O-CA 3.42Å; S128-H188 PolarHBondContact N-O 3.18Å; S128-H188 PolarHBondContact O-N 3.21Å
129	C	94.2	Very high	94.8	Very high	6 Å²	6	25.8 Å²	25.8	4%	0.041	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	146.9	161.2	-65.6	0	0	0	0	109.7	T132 G134	C129-T132 CarbonylContact C-O 3.55Å; C129-T132 WeakPolarHBondContact CB-O 3.4Å; C129-T132 VanDerWaalsContact CB-OG1 3.24Å; C129-T132 WeakPolarHBondContact CB-OG1 3.49Å; C129-G134 PolarHBondContact N-O 3.47Å
130	L	93	Very high	95.1	Very high	80 Å²	80	22.1 Å²	22.1	42%	0.419	12%	0.119	S	C	.	.	S	Bend	trans	-117.8	-21.5	177.5	-67.2	175.6	0	0	0	113.4	P185 I186 H188	L130-P185 VanDerWaalsContact CB-O 3.29Å; L130-P185 WeakPolarHBondContact CB-O 3.17Å; L130-P185 HydrophobicContact CD1-CB 3.7Å; L130-P185 HydrophobicContact CD1-CG 3.99Å; L130-I186 PolarHBondContact N-O 2.69Å; L130-H188 HydrophobicContact CD1-CB 4.13Å; L130-H188 HydrophobicContact CD2-CB 4.03Å; L130-H188 HydrophobicContact CG-CB 4.19Å
131	Q	91.7	Very high	95.3	Very high	61 Å²	61	21.1 Å²	21.1	29%	0.285	11%	0.113	S	C	.	.	S	Bend	trans	-98.9	-14.3	174.9	-56	-50.9	-53.5	0	0	112.8	M165 T169 P185	Q131-M165 HydrophobicContact CB-CE 3.9Å; Q131-M165 HydrophobicContact CB-CG 4.28Å; Q131-M165 HydrophobicContact CB-SD 3.91Å; Q131-M165 HydrophobicContact CG-CE 3.79Å; Q131-M165 HydrophobicContact CG-SD 4.02Å; Q131-T169 HydrophobicContact CB-CG2 4.2Å; Q131-T169 HydrophobicContact CG-CG2 4.28Å; Q131-P185 PolarHBondContact NE2-O 3.12Å
132	T	90.5	Very high	95.4	Very high	33 Å²	33	19.8 Å²	19.8	20%	0.202	11%	0.107	C	C	.	.	S	Bend	trans	-134.2	163.9	176.3	58.7	0	0	0	0	108.9	C129 L164	C129-T132 CarbonylContact C-O 3.55Å; C129-T132 WeakPolarHBondContact CB-O 3.4Å; C129-T132 VanDerWaalsContact CB-OG1 3.24Å; C129-T132 WeakPolarHBondContact CB-OG1 3.49Å; T132-L164 HydrophobicContact CG2-CB 4.12Å; T132-L164 VanDerWaalsContact CG2-O 3.28Å; T132-L164 WeakPolarHBondContact CG2-O 3.24Å
133	N	85.8	Confident	95.3	Very high	120 Å²	120	21.2 Å²	21.2	64%	0.642	11%	0.114	S	C	*	.	S	Bend	trans	-80.6	130.3	168.9	-59.9	-32.9	0	0	0	108.5	D275	N133-D275 WeakPolarHBondContact CB-OD1 3.45Å
134	G	91.2	Very high	95	Very high	7 Å²	7	23.1 Å²	23.1	7%	0.072	14%	0.142	C	C	.	.			trans	165.1	136.3	178	0	0	0	0	0	112.9	C129 V274	C129-G134 PolarHBondContact N-O 3.47Å; G134-V274 CarbonylContact C-O 3.56Å; G134-V274 WeakPolarHBondContact CA-O 3.39Å
135	L	95.7	Very high	94.9	Very high	10 Å²	10	23.4 Å²	23.4	5%	0.052	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	131.5	161.2	-78.3	84.6	0	0	0	109.1	I95 N104 V106 F137 V274	I95-L135 HydrophobicContact CD1-CD2 3.64Å; I95-L135 HydrophobicContact CG1-CD2 3.78Å; I95-L135 HydrophobicContact CG2-CD2 4.09Å; N104-L135 WeakPolarHBondContact ND2-CD1 3.5Å; V106-L135 HydrophobicContact CB-CD2 4.44Å; L135-F137 HydrophobicContact CB-CE2 3.71Å; L135-F137 HydrophobicContact CB-CZ 4.02Å; L135-F137 HydrophobicContact CD2-CZ 4.05Å; L135-V274 PolarHBondContact N-O 3.48Å; L135-V274 PolarHBondContact O-N 3.4Å
136	M	97.8	Very high	94.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	130	179.7	-67.8	-176.9	-63.5	0	0	110.2	V126 A127 F157 V160 A161 L187 M271 A272	V126-M136 VanDerWaalsContact CA-O 3.32Å; V126-M136 WeakPolarHBondContact CA-O 3.47Å; A127-M136 PolarHBondContact N-O 3.4Å; A127-M136 PolarHBondContact O-N 3.2Å; M136-F157 HydrophobicContact CB-CD1 4.3Å; M136-F157 HydrophobicContact CB-CD2 4.06Å; M136-F157 HydrophobicContact CB-CE1 4.18Å; M136-F157 HydrophobicContact CB-CE2 3.92Å; M136-F157 HydrophobicContact CB-CG 4.25Å; M136-F157 HydrophobicContact CB-CZ 3.99Å; M136-F157 HydrophobicContact CE-CB 3.68Å; M136-F157 HydrophobicContact CE-CD2 4.29Å; M136-F157 HydrophobicContact CE-CG 4Å; M136-F157 HydrophobicContact SD-CB 4.33Å; M136-F157 HydrophobicContact SD-CD1 4.43Å; M136-F157 HydrophobicContact SD-CG 4.33Å; M136-V160 HydrophobicContact SD-CB 4.22Å; M136-V160 HydrophobicContact SD-CG1 3.91Å; M136-A161 HydrophobicContact CE-CB 4.37Å; M136-L187 HydrophobicContact CE-CD2 3.42Å; M136-L187 VanDerWaalsContact CE-CD2 3.42Å; M136-M271 HydrophobicContact CB-CE 4Å; M136-M271 HydrophobicContact CG-CE 3.68Å; M136-M271 HydrophobicContact SD-CE 3.26Å; M136-M271 WeakPolarHBondContact SD-CE 3.5Å; M136-A272 WeakPolarHBondContact CA-O 3.24Å
137	F	98.4	Very high	94.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	138.1	175.5	-55.3	-89.8	0	0	0	108	V106 F109 G125 V126 L135 M271 A272 V274 L409 T513 V515	V106-F137 HydrophobicContact CG1-CZ 4.19Å; V106-F137 HydrophobicContact CG2-CE2 4.4Å; F109-F137 HydrophobicContact CB-CE1 3.94Å; F109-F137 AromaticContact CD1-CE1 3.7Å; F109-F137 HydrophobicContact CD1-CE1 3.7Å; F109-F137 HydrophobicContact CD1-CZ 4.45Å; F109-F137 HydrophobicContact CE1-CE1 4.31Å; F109-F137 AromaticContact CG-CE1 3.83Å; F109-F137 HydrophobicContact CG-CE1 3.83Å; G125-F137 CarbonylContact O-C 3.55Å; G125-F137 WeakPolarHBondContact O-CA 3.46Å; V126-F137 HydrophobicContact CB-CD1 4.39Å; V126-F137 HydrophobicContact CG1-CD1 3.67Å; V126-F137 HydrophobicContact CG1-CE1 3.58Å; V126-F137 HydrophobicContact CG1-CZ 4.43Å; V126-F137 HydrophobicContact CG2-CD1 3.86Å; V126-F137 HydrophobicContact CG2-CE1 4.43Å; L135-F137 HydrophobicContact CB-CE2 3.71Å; L135-F137 HydrophobicContact CB-CZ 4.02Å; L135-F137 HydrophobicContact CD2-CZ 4.05Å; F137-M271 CarbonylContact O-C 3.52Å; F137-M271 VanDerWaalsContact O-CA 3.28Å; F137-M271 WeakPolarHBondContact O-CA 3.24Å; F137-A272 PolarHBondContact N-O 3.08Å; F137-A272 PolarHBondContact O-N 3.35Å; F137-V274 HydrophobicContact CD2-CG2 4.44Å; F137-V274 HydrophobicContact CE2-CG2 4.25Å; F137-L409 HydrophobicContact CB-CD1 4.18Å; F137-T513 HydrophobicContact CD1-CG2 4.16Å; F137-V515 HydrophobicContact CB-CG2 4.47Å; F137-V515 HydrophobicContact CD1-CG2 3.54Å; F137-V515 HydrophobicContact CD2-CG2 4.02Å; F137-V515 HydrophobicContact CE1-CG1 4.2Å; F137-V515 HydrophobicContact CE1-CG2 3.67Å; F137-V515 HydrophobicContact CE2-CG1 3.96Å; F137-V515 HydrophobicContact CE2-CG2 4.14Å; F137-V515 HydrophobicContact CG-CG2 3.73Å; F137-V515 HydrophobicContact CZ-CG1 3.76Å; F137-V515 HydrophobicContact CZ-CG2 3.98Å
138	G	98.2	Very high	94.7	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.01	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	137.8	-176	0	0	0	0	0	111.7	R124 G125 C270	R124-G138 CarbonylContact C-O 3.5Å; R124-G138 VanDerWaalsContact CA-O 3.3Å; R124-G138 WeakPolarHBondContact CA-O 3.36Å; G125-G138 PolarHBondContact N-O 3.04Å; G125-G138 PolarHBondContact O-N 3.26Å; G138-C270 WeakPolarHBondContact CA-O 3.34Å
139	I	98.5	Very high	94.9	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	137.6	165.5	-53.3	-68.5	0	0	0	107	R123 R124 C270 L409 T511	R123-I139 WeakPolarHBondContact O-CA 3.35Å; R124-I139 HydrophobicContact CB-CD1 4.16Å; I139-C270 PolarHBondContact N-O 2.83Å; I139-C270 PolarHBondContact O-N 3.24Å; I139-L409 HydrophobicContact CG1-CB 3.64Å; I139-T511 HydrophobicContact CD1-CG2 3.88Å
140	F	98.6	Very high	95	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	96.6	-177.1	-43.8	-90.5	0	0	0	107.9	D122 R123 A149 V152 S153 L156 F157 T268 A269	D122-F140 CarbonylContact C-O 3.54Å; R123-F140 HydrophobicContact CB-CB 4.21Å; R123-F140 HydrophobicContact CB-CD2 4.24Å; R123-F140 PolarHBondContact N-O 3.21Å; R123-F140 PolarHBondContact O-N 3.19Å; F140-A149 HydrophobicContact CB-CB 4.42Å; F140-V152 HydrophobicContact CD1-CB 4.42Å; F140-V152 HydrophobicContact CD1-CG1 3.63Å; F140-V152 HydrophobicContact CE1-CG1 3.76Å; F140-S153 VanDerWaalsContact CD2-CB 3.47Å; F140-L156 HydrophobicContact CE1-CD2 3.82Å; F140-F157 AromaticContact CZ-CE1 3.98Å; F140-F157 HydrophobicContact CZ-CE1 3.98Å; F140-F157 HydrophobicContact CZ-CZ 4.44Å; F140-T268 VanDerWaalsContact CA-O 3.3Å; F140-T268 WeakPolarHBondContact CA-O 3.48Å; F140-A269 HydrophobicContact CD1-CB 3.64Å; F140-A269 HydrophobicContact CE1-CB 3.94Å
141	D	98.5	Very high	95.1	Very high	9 Å²	9	20.2 Å²	20.2	5%	0.048	13%	0.129	C	C	.	.			trans	-76.9	135.2	172.4	166.8	41.6	0	0	0	109.2	D122 A267 T268	D122-D141 VanDerWaalsContact OD1-CA 3.28Å; D122-D141 WeakPolarHBondContact OD1-CA 3.49Å; D141-A267 CarbonylContact O-C 3.41Å; D141-A267 WeakPolarHBondContact O-CA 3.36Å; D141-T268 WeakPolarHBondContact CB-OG1 3.09Å; D141-T268 PolarHBondContact N-OG1 2.88Å; D141-T268 PolarHBondContact O-N 3.07Å; D141-T268 PolarHBondContact O-OG1 3.11Å
142	G	97.7	Very high	95.4	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	145.1	-170.1	0	0	0	0	0	111.1	E121	E121-G142 WeakPolarHBondContact CB-O 3.5Å
143	H	95.1	Very high	95.6	Very high	31 Å²	31	16 Å²	16	14%	0.144	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	149.6	-178.6	58	-99.5	0	0	0	112.5	G145 G266 L342 D350	H143-G145 PolarHBondContact O-N 2.89Å; H143-G266 PolarHBondContact N-O 2.84Å; H143-G266 WeakPolarHBondContact NE2-CA 3.39Å; H143-G266 PolarHBondContact O-N 3.09Å; H143-L342 WeakPolarHBondContact NE2-CD1 3.49Å; H143-D350 IonicContact CD2-OD1 3.91Å; H143-D350 IonicContact CD2-OD2 3.9Å; H143-D350 IonicContact CE1-OD2 3.77Å; H143-D350 PolarHBondContact CE1-OD2 3.25Å; H143-D350 IonicContact NE2-OD1 3.25Å; H143-D350 PolarHBondContact NE2-OD1 3.19Å; H143-D350 IonicContact NE2-OD2 3.69Å; H143-D350 PolarHBondContact NE2-OD2 3.25Å
144	G	91.9	Very high	96	Very high	68 Å²	68	11 Å²	11	70%	0.701	8%	0.079	S	C	*	.	S	Bend	trans	68.4	22.2	-174.6	0	0	0	0	0	112.9	S265	G144-S265 WeakPolarHBondContact O-CB 3.34Å
145	G	93.1	Very high	96.3	Very high	23 Å²	23	10.9 Å²	10.9	24%	0.237	8%	0.077	C	C	.	.	S	Bend	trans	123.7	139.4	-174.4	0	0	0	0	0	112.5	E121 H143 A147 S265	E121-G145 WeakPolarHBondContact OE1-CA 3.25Å; E121-G145 PolarHBondContact OE1-N 2.91Å; H143-G145 PolarHBondContact O-N 2.89Å; G145-A147 PolarHBondContact O-N 2.93Å; G145-A147 VanDerWaalsContact O-N 3.08Å; G145-S265 WeakPolarHBondContact O-CB 3.48Å
146	H	93.9	Very high	96.4	Very high	54 Å²	54	10.4 Å²	10.4	25%	0.25	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-6.2	175.8	69.1	-84.7	0	0	0	116.3	P119 V120 E121 Q150 Y198	P119-H146 WeakPolarHBondContact CG-ND1 3.45Å; V120-H146 VanDerWaalsContact O-CB 3.28Å; V120-H146 WeakPolarHBondContact O-CB 3.02Å; E121-H146 HydrophobicContact CB-CB 4.5Å; H146-Q150 WeakPolarHBondContact O-CB 3.48Å; H146-Q150 PolarHBondContact O-N 3.45Å; H146-Y198 PolarHBondContact CD2-OH 3.26Å; H146-Y198 PolarHBondContact NE2-OH 2.89Å
147	A	94.8	Very high	96.5	Very high	5 Å²	5	10.4 Å²	10.4	4%	0.041	8%	0.075	C	C	.	.	H	α-helix	trans	-70.1	-44.3	-166.2	0	0	0	0	0	112.4	G145 Q150 A151 L258 Q261 V262	G145-A147 PolarHBondContact O-N 2.93Å; G145-A147 VanDerWaalsContact O-N 3.08Å; A147-Q150 PolarHBondContact O-N 2.83Å; A147-A151 WeakPolarHBondContact O-CB 3.45Å; A147-A151 PolarHBondContact O-N 2.81Å; A147-L258 HydrophobicContact CB-CD1 4.48Å; A147-Q261 HydrophobicContact CB-CB 3.88Å; A147-V262 HydrophobicContact CB-CG2 4.05Å
148	C	96.7	Very high	96.4	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-61.6	-50	176.6	-165.9	0	0	0	0	111.3	Q150 A151 V152 V262 S265 A267	C148-Q150 VanDerWaalsContact C-N 3.33Å; C148-Q150 PolarHBondContact O-N 2.82Å; C148-A151 PolarHBondContact O-N 2.93Å; C148-A151 VanDerWaalsContact O-N 3.14Å; C148-V152 VanDerWaalsContact O-CG2 3.32Å; C148-V152 WeakPolarHBondContact O-CG2 3.34Å; C148-V152 PolarHBondContact O-N 3.46Å; C148-V262 WeakPolarHBondContact CB-O 3.22Å; C148-S265 WeakPolarHBondContact CB-OG 3.42Å; C148-S265 PolarHBondContact N-OG 2.8Å; C148-A267 HydrophobicContact CB-CB 4.04Å
149	A	97.3	Very high	96.4	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-60.3	-41.3	179.7	0	0	0	0	0	112	E121 R123 F140 S153 A267	E121-A149 VanDerWaalsContact O-CB 3.3Å; E121-A149 WeakPolarHBondContact O-CB 3.11Å; R123-A149 HydrophobicContact CB-CB 4.41Å; R123-A149 HydrophobicContact CG-CB 3.93Å; F140-A149 HydrophobicContact CB-CB 4.42Å; A149-S153 WeakPolarHBondContact O-CB 3.44Å; A149-S153 PolarHBondContact O-N 3.37Å; A149-S153 PolarHBondContact O-OG 3.45Å; A149-A267 HydrophobicContact CB-CB 3.84Å
150	Q	95.9	Very high	96.4	Very high	3 Å²	3	13.9 Å²	13.9	1%	0.014	9%	0.088	C	C	.	.	H	α-helix	trans	-58.5	-53.3	172.7	-174.7	75.7	47.5	0	0	111.2	R123 H146 A147 C148 V152 S153 E154 S196 Y198	R123-Q150 VanDerWaalsContact NH2-OE1 3.13Å; H146-Q150 WeakPolarHBondContact O-CB 3.48Å; H146-Q150 PolarHBondContact O-N 3.45Å; A147-Q150 PolarHBondContact O-N 2.83Å; C148-Q150 VanDerWaalsContact C-N 3.33Å; C148-Q150 PolarHBondContact O-N 2.82Å; Q150-V152 PolarHBondContact O-N 3.4Å; Q150-S153 PolarHBondContact O-N 2.91Å; Q150-S153 PolarHBondContact O-OG 2.81Å; Q150-E154 PolarHBondContact NE2-OE1 3.26Å; Q150-E154 PolarHBondContact O-N 2.97Å; Q150-E154 VanDerWaalsContact O-N 3.13Å; Q150-S196 PolarHBondContact NE2-O 2.84Å; Q150-S196 PolarHBondContact NE2-OG 2.99Å; Q150-S196 PolarHBondContact OE1-OG 2.88Å; Q150-Y198 HydrophobicContact CB-CD2 4.39Å; Q150-Y198 HydrophobicContact CB-CE2 3.72Å; Q150-Y198 HydrophobicContact CG-CD2 3.59Å; Q150-Y198 HydrophobicContact CG-CE1 4.26Å; Q150-Y198 HydrophobicContact CG-CE2 3.29Å; Q150-Y198 HydrophobicContact CG-CG 4.22Å
151	A	95.8	Very high	96.3	Very high	0 Å²	0	14 Å²	14	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-61.6	-44	-178.4	0	0	0	0	0	112.6	A147 C148 E154 R155 V262	A147-A151 WeakPolarHBondContact O-CB 3.45Å; A147-A151 PolarHBondContact O-N 2.81Å; C148-A151 PolarHBondContact O-N 2.93Å; C148-A151 VanDerWaalsContact O-N 3.14Å; A151-E154 PolarHBondContact O-N 2.88Å; A151-R155 VanDerWaalsContact O-CB 3.25Å; A151-R155 WeakPolarHBondContact O-CB 3.39Å; A151-R155 WeakPolarHBondContact O-CD 3.31Å; A151-R155 WeakPolarHBondContact O-CG 3.26Å; A151-R155 PolarHBondContact O-N 2.96Å; A151-V262 HydrophobicContact CB-CB 4.46Å; A151-V262 HydrophobicContact CB-CG1 3.62Å; A151-V262 HydrophobicContact CB-CG2 3.89Å
152	V	97.6	Very high	96.2	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-64.4	-44.5	177.3	177.3	0	0	0	0	110.7	F140 C148 Q150 E154 R155 L156 L238 I242 F348	F140-V152 HydrophobicContact CD1-CB 4.42Å; F140-V152 HydrophobicContact CD1-CG1 3.63Å; F140-V152 HydrophobicContact CE1-CG1 3.76Å; C148-V152 VanDerWaalsContact O-CG2 3.32Å; C148-V152 WeakPolarHBondContact O-CG2 3.34Å; C148-V152 PolarHBondContact O-N 3.46Å; Q150-V152 PolarHBondContact O-N 3.4Å; V152-E154 PolarHBondContact O-N 3.34Å; V152-R155 PolarHBondContact O-N 2.94Å; V152-L156 HydrophobicContact CG1-CB 4.14Å; V152-L156 HydrophobicContact CG1-CD2 4.19Å; V152-L156 VanDerWaalsContact O-CB 3.29Å; V152-L156 WeakPolarHBondContact O-CB 3.36Å; V152-L156 PolarHBondContact O-N 3Å; V152-L238 HydrophobicContact CG1-CD2 4.21Å; V152-L238 HydrophobicContact CG2-CD2 4.37Å; V152-I242 HydrophobicContact CG2-CD1 4.11Å; V152-F348 HydrophobicContact CG1-CD2 3.9Å; V152-F348 HydrophobicContact CG1-CE2 3.94Å; V152-F348 HydrophobicContact CG1-CG 4.21Å; V152-F348 HydrophobicContact CG1-CZ 4.28Å; V152-F348 HydrophobicContact CG2-CB 3.65Å; V152-F348 HydrophobicContact CG2-CD1 3.91Å; V152-F348 HydrophobicContact CG2-CD2 4.1Å; V152-F348 HydrophobicContact CG2-CG 3.62Å
153	S	96.4	Very high	96.1	Very high	4 Å²	4	13.9 Å²	13.9	3%	0.028	9%	0.089	C	C	.	.	H	α-helix	trans	-63.3	-27.3	179.8	76.2	0	0	0	0	114.1	F140 A149 Q150 W189	F140-S153 VanDerWaalsContact CD2-CB 3.47Å; A149-S153 WeakPolarHBondContact O-CB 3.44Å; A149-S153 PolarHBondContact O-N 3.37Å; A149-S153 PolarHBondContact O-OG 3.45Å; Q150-S153 PolarHBondContact O-N 2.91Å; Q150-S153 PolarHBondContact O-OG 2.81Å; S153-W189 VanDerWaalsContact O-CH2 3.23Å; S153-W189 WeakPolarHBondContact O-CH2 3.27Å
154	E	93.9	Very high	96	Very high	15 Å²	15	14 Å²	14	7%	0.07	9%	0.09	C	C	.	.	H	α-helix	trans	-85.6	-33.3	175.2	-71.7	-177.3	-145.2	0	0	113.1	Q150 A151 V152 Y158 W189 I197 Y198	Q150-E154 PolarHBondContact NE2-OE1 3.26Å; Q150-E154 PolarHBondContact O-N 2.97Å; Q150-E154 VanDerWaalsContact O-N 3.13Å; A151-E154 PolarHBondContact O-N 2.88Å; V152-E154 PolarHBondContact O-N 3.34Å; E154-Y158 VanDerWaalsContact O-CD2 3.27Å; E154-Y158 WeakPolarHBondContact O-CD2 3.14Å; E154-Y158 WeakPolarHBondContact O-CE2 3.45Å; E154-W189 WeakPolarHBondContact O-CZ2 3.47Å; E154-I197 VanDerWaalsContact OE1-CA 3.29Å; E154-I197 WeakPolarHBondContact OE1-CA 3.47Å; E154-I197 WeakPolarHBondContact OE2-CG2 3.16Å; E154-Y198 PolarHBondContact OE1-N 2.98Å; E154-Y198 PolarHBondContact OE2-N 3.29Å
155	R	97	Very high	96.1	Very high	6 Å²	6	11.5 Å²	11.5	2%	0.023	6%	0.06	C	C	.	.	H	α-helix	trans	-98.3	-43.6	-167.9	-66.4	168.8	65.8	161.4	4.1	113.8	A151 V152 F157 Y158 Y159 H205 L238 E245	A151-R155 VanDerWaalsContact O-CB 3.25Å; A151-R155 WeakPolarHBondContact O-CB 3.39Å; A151-R155 WeakPolarHBondContact O-CD 3.31Å; A151-R155 WeakPolarHBondContact O-CG 3.26Å; A151-R155 PolarHBondContact O-N 2.96Å; V152-R155 PolarHBondContact O-N 2.94Å; R155-F157 PolarHBondContact O-N 3.36Å; R155-F157 VanDerWaalsContact O-N 3.11Å; R155-Y158 WeakPolarHBondContact O-CB 3.43Å; R155-Y158 PolarHBondContact O-N 2.96Å; R155-Y159 HydrophobicContact CB-CD2 4.44Å; R155-Y159 HydrophobicContact CB-CE2 4.22Å; R155-Y159 PolarHBondContact NH2-OH 3.5Å; R155-Y159 VanDerWaalsContact NH2-OH 3.11Å; R155-Y159 WeakPolarHBondContact O-CD2 3.34Å; R155-Y159 PolarHBondContact O-N 3.44Å; R155-H205 HydrophobicContact CG-CB 4.4Å; R155-H205 PolarHBondContact NH1-CE1 2.87Å; R155-H205 VanDerWaalsContact NH1-CE1 3.3Å; R155-H205 PolarHBondContact NH1-ND1 2.87Å; R155-H205 VanDerWaalsContact NH1-ND1 3.17Å; R155-L238 HydrophobicContact CB-CD1 3.75Å; R155-L238 HydrophobicContact CB-CD2 4.14Å; R155-L238 HydrophobicContact CG-CD1 4.46Å; R155-E245 IonicContact CZ-OE1 3.05Å; R155-E245 VanDerWaalsContact NH1-CD 3.27Å; R155-E245 IonicContact NH1-OE1 3.79Å; R155-E245 PolarHBondContact NH1-OE1 3.28Å; R155-E245 IonicContact NH1-OE2 2.7Å; R155-E245 PolarHBondContact NH1-OE2 3.28Å; R155-E245 IonicContact NH2-OE1 3.18Å; R155-E245 PolarHBondContact NH2-OE1 3.08Å
156	L	98.4	Very high	96	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-55.7	-39.7	-165.3	-176.7	62.9	0	0	0	113.2	F140 V152 Y158 Y159 V160 F235 L238 A269 M271 F348	F140-L156 HydrophobicContact CE1-CD2 3.82Å; V152-L156 HydrophobicContact CG1-CB 4.14Å; V152-L156 HydrophobicContact CG1-CD2 4.19Å; V152-L156 VanDerWaalsContact O-CB 3.29Å; V152-L156 WeakPolarHBondContact O-CB 3.36Å; V152-L156 PolarHBondContact O-N 3Å; L156-Y158 VanDerWaalsContact C-N 3.28Å; L156-Y158 PolarHBondContact O-N 2.82Å; L156-Y159 PolarHBondContact O-N 2.92Å; L156-Y159 VanDerWaalsContact O-N 3.17Å; L156-V160 HydrophobicContact CD1-CG2 4.48Å; L156-V160 WeakPolarHBondContact O-CG2 3.27Å; L156-V160 PolarHBondContact O-N 2.83Å; L156-F235 HydrophobicContact CD1-CD2 3.69Å; L156-F235 HydrophobicContact CD1-CE2 4.07Å; L156-F235 HydrophobicContact CD1-CG 4.1Å; L156-F235 HydrophobicContact CD2-CD2 4.14Å; L156-F235 HydrophobicContact CD2-CE1 4.22Å; L156-F235 HydrophobicContact CD2-CE2 3.71Å; L156-F235 HydrophobicContact CD2-CZ 3.76Å; L156-F235 HydrophobicContact CG-CD2 4.37Å; L156-F235 HydrophobicContact CG-CE2 4.25Å; L156-L238 HydrophobicContact CB-CD2 3.73Å; L156-L238 HydrophobicContact CD1-CD2 3.82Å; L156-L238 HydrophobicContact CG-CD2 4.37Å; L156-A269 HydrophobicContact CD2-CB 4.42Å; L156-M271 HydrophobicContact CD2-SD 3.92Å; L156-M271 HydrophobicContact CG-SD 4.13Å; L156-F348 HydrophobicContact CD1-CZ 3.98Å; L156-F348 HydrophobicContact CD2-CE2 4.47Å; L156-F348 HydrophobicContact CD2-CZ 4.32Å
157	F	98	Very high	95.9	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-63.9	-30.6	178.2	-71.9	6.4	0	0	0	113.1	G125 A127 M136 F140 R155 A161 L187 W189 M271	G125-F157 VanDerWaalsContact C-CE2 3.5Å; G125-F157 WeakPolarHBondContact O-CZ 3.24Å; A127-F157 HydrophobicContact CB-CD2 3.72Å; A127-F157 HydrophobicContact CB-CE2 4.21Å; M136-F157 HydrophobicContact CB-CD1 4.3Å; M136-F157 HydrophobicContact CB-CD2 4.06Å; M136-F157 HydrophobicContact CB-CE1 4.18Å; M136-F157 HydrophobicContact CB-CE2 3.92Å; M136-F157 HydrophobicContact CB-CG 4.25Å; M136-F157 HydrophobicContact CB-CZ 3.99Å; M136-F157 HydrophobicContact CE-CB 3.68Å; M136-F157 HydrophobicContact CE-CD2 4.29Å; M136-F157 HydrophobicContact CE-CG 4Å; M136-F157 HydrophobicContact SD-CB 4.33Å; M136-F157 HydrophobicContact SD-CD1 4.43Å; M136-F157 HydrophobicContact SD-CG 4.33Å; F140-F157 AromaticContact CZ-CE1 3.98Å; F140-F157 HydrophobicContact CZ-CE1 3.98Å; F140-F157 HydrophobicContact CZ-CZ 4.44Å; R155-F157 PolarHBondContact O-N 3.36Å; R155-F157 VanDerWaalsContact O-N 3.11Å; F157-A161 WeakPolarHBondContact O-CB 3.09Å; F157-A161 PolarHBondContact O-N 2.87Å; F157-L187 HydrophobicContact CB-CD1 3.61Å; F157-W189 HydrophobicContact CB-CH2 3.98Å; F157-W189 HydrophobicContact CB-CZ2 4.26Å; F157-W189 HydrophobicContact CD2-CE3 4.41Å; F157-W189 AromaticContact CD2-CH2 3.5Å; F157-W189 HydrophobicContact CD2-CH2 3.5Å; F157-W189 VanDerWaalsContact CD2-CH2 3.5Å; F157-W189 HydrophobicContact CD2-CZ2 4.36Å; F157-W189 AromaticContact CD2-CZ3 3.54Å; F157-W189 HydrophobicContact CD2-CZ3 3.54Å; F157-W189 HydrophobicContact CE2-CH2 4.27Å; F157-W189 AromaticContact CE2-CZ3 3.91Å; F157-W189 HydrophobicContact CE2-CZ3 3.91Å; F157-W189 AromaticContact CG-CH2 3.99Å; F157-W189 HydrophobicContact CG-CH2 3.99Å; F157-W189 HydrophobicContact CG-CZ3 4.44Å; F157-M271 HydrophobicContact CD1-CE 3.61Å; F157-M271 HydrophobicContact CD1-SD 3.79Å; F157-M271 HydrophobicContact CE1-CE 3.82Å; F157-M271 HydrophobicContact CE1-CG 3.91Å; F157-M271 HydrophobicContact CE1-SD 3.74Å
158	Y	97.8	Very high	95.7	Very high	71 Å²	71	21.3 Å²	21.3	28%	0.278	11%	0.106	S	C	.	.	H	α-helix	trans	-71.3	-39.7	173.9	-73	-76.2	0	0	0	111.7	E154 R155 L156 A161 V162 I186 L187 W189 L209	E154-Y158 VanDerWaalsContact O-CD2 3.27Å; E154-Y158 WeakPolarHBondContact O-CD2 3.14Å; E154-Y158 WeakPolarHBondContact O-CE2 3.45Å; R155-Y158 WeakPolarHBondContact O-CB 3.43Å; R155-Y158 PolarHBondContact O-N 2.96Å; L156-Y158 VanDerWaalsContact C-N 3.28Å; L156-Y158 PolarHBondContact O-N 2.82Å; Y158-A161 PolarHBondContact O-N 3.39Å; Y158-V162 VanDerWaalsContact O-CB 3.29Å; Y158-V162 WeakPolarHBondContact O-CB 3.37Å; Y158-V162 VanDerWaalsContact O-CG2 3.3Å; Y158-V162 WeakPolarHBondContact O-CG2 3.46Å; Y158-V162 PolarHBondContact O-N 3.5Å; Y158-I186 HydrophobicContact CD1-CB 3.96Å; Y158-I186 HydrophobicContact CD1-CD1 3.97Å; Y158-I186 HydrophobicContact CD1-CG2 3.92Å; Y158-I186 HydrophobicContact CE1-CB 4.04Å; Y158-I186 HydrophobicContact CE1-CD1 4.41Å; Y158-I186 HydrophobicContact CE1-CG2 4.44Å; Y158-L187 HydrophobicContact CD1-CD1 3.77Å; Y158-L187 HydrophobicContact CD1-CG 3.94Å; Y158-L187 HydrophobicContact CD2-CD1 3.99Å; Y158-L187 HydrophobicContact CE1-CB 4.15Å; Y158-L187 HydrophobicContact CE1-CD1 3.79Å; Y158-L187 HydrophobicContact CE1-CG 3.85Å; Y158-L187 HydrophobicContact CE2-CD1 4.01Å; Y158-L187 HydrophobicContact CG-CD1 3.87Å; Y158-W189 HydrophobicContact CD2-CZ2 4.27Å; Y158-W189 AromaticContact CE2-CZ2 3.78Å; Y158-W189 HydrophobicContact CE2-CZ2 3.78Å; Y158-W189 AromaticContact CE2-NE1 3.67Å; Y158-W189 AromaticContact CZ-NE1 3.52Å; Y158-W189 PolarHBondContact OH-NE1 3.02Å; Y158-L209 HydrophobicContact CD1-CD2 4.3Å; Y158-L209 HydrophobicContact CG-CD2 4.27Å
159	Y	98.3	Very high	95.5	Very high	3 Å²	3	22.5 Å²	22.5	1%	0.012	11%	0.113	C	C	.	.	H	α-helix	trans	-64.2	-48.2	177.4	-74.5	-114.2	0	0	0	109.8	R155 L156 A161 V162 S163 L209 Y212 S234 R237 L238 D241	R155-Y159 HydrophobicContact CB-CD2 4.44Å; R155-Y159 HydrophobicContact CB-CE2 4.22Å; R155-Y159 PolarHBondContact NH2-OH 3.5Å; R155-Y159 VanDerWaalsContact NH2-OH 3.11Å; R155-Y159 WeakPolarHBondContact O-CD2 3.34Å; R155-Y159 PolarHBondContact O-N 3.44Å; L156-Y159 PolarHBondContact O-N 2.92Å; L156-Y159 VanDerWaalsContact O-N 3.17Å; Y159-A161 PolarHBondContact O-N 2.99Å; Y159-V162 PolarHBondContact O-N 3.18Å; Y159-S163 PolarHBondContact O-N 3.37Å; Y159-S163 PolarHBondContact O-OG 2.98Å; Y159-S163 VanDerWaalsContact O-OG 3.06Å; Y159-L209 HydrophobicContact CD2-CD1 3.75Å; Y159-L209 HydrophobicContact CE2-CD1 3.85Å; Y159-L209 HydrophobicContact CG-CD1 4.15Å; Y159-Y212 AromaticContact CD1-CD1 3.64Å; Y159-Y212 HydrophobicContact CD1-CD1 3.64Å; Y159-Y212 AromaticContact CD1-CE1 3.8Å; Y159-Y212 HydrophobicContact CD1-CE1 3.8Å; Y159-Y212 HydrophobicContact CD1-CG 4.19Å; Y159-Y212 HydrophobicContact CE1-CD1 4.2Å; Y159-Y212 HydrophobicContact CE1-CG 4.37Å; Y159-Y212 HydrophobicContact CG-CD1 4.23Å; Y159-Y212 HydrophobicContact CG-CE1 4.27Å; Y159-S234 PolarHBondContact O-OG 2.92Å; Y159-R237 HydrophobicContact CD1-CB 4.25Å; Y159-R237 HydrophobicContact CD1-CG 3.8Å; Y159-R237 HydrophobicContact CE1-CG 3.76Å; Y159-L238 HydrophobicContact CD1-CB 4.21Å; Y159-L238 HydrophobicContact CD2-CD1 4.37Å; Y159-L238 HydrophobicContact CE1-CB 4.38Å; Y159-L238 HydrophobicContact CE2-CD1 3.99Å; Y159-L238 HydrophobicContact CG-CB 4.37Å; Y159-D241 WeakPolarHBondContact CE1-OD2 3.23Å; Y159-D241 PolarHBondContact OH-OD2 2.91Å
160	V	97.9	Very high	95.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.7	-46.3	175.4	175.2	0	0	0	0	111.8	M136 L156 V162 S163 L164 L231 S234 M271	M136-V160 HydrophobicContact SD-CB 4.22Å; M136-V160 HydrophobicContact SD-CG1 3.91Å; L156-V160 HydrophobicContact CD1-CG2 4.48Å; L156-V160 WeakPolarHBondContact O-CG2 3.27Å; L156-V160 PolarHBondContact O-N 2.83Å; V160-V162 VanDerWaalsContact C-N 3.34Å; V160-V162 PolarHBondContact O-N 2.97Å; V160-S163 PolarHBondContact O-N 3.24Å; V160-L164 HydrophobicContact CG1-CD1 3.87Å; V160-L164 HydrophobicContact CG1-CG 4.49Å; V160-L164 VanDerWaalsContact O-CG 3.27Å; V160-L164 WeakPolarHBondContact O-CG 3.33Å; V160-L164 PolarHBondContact O-N 3.1Å; V160-L164 VanDerWaalsContact O-N 3.15Å; V160-L231 HydrophobicContact CG1-CD2 3.8Å; V160-L231 HydrophobicContact CG2-CD2 3.97Å; V160-S234 WeakPolarHBondContact CA-OG 3.39Å; V160-S234 PolarHBondContact N-OG 3.48Å; V160-M271 HydrophobicContact CB-CE 3.92Å; V160-M271 HydrophobicContact CG1-CE 3.8Å; V160-M271 HydrophobicContact CG2-CE 3.82Å; V160-M271 HydrophobicContact CG2-SD 4.04Å
161	A	96.9	Very high	95.2	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-62.8	-40.1	179.2	0	0	0	0	0	112.6	M136 F157 Y158 Y159 L164 M165 I186 L187	M136-A161 HydrophobicContact CE-CB 4.37Å; F157-A161 WeakPolarHBondContact O-CB 3.09Å; F157-A161 PolarHBondContact O-N 2.87Å; Y158-A161 PolarHBondContact O-N 3.39Å; Y159-A161 PolarHBondContact O-N 2.99Å; A161-L164 PolarHBondContact O-N 3.47Å; A161-M165 WeakPolarHBondContact O-CG 3.48Å; A161-M165 PolarHBondContact O-N 2.86Å; A161-I186 HydrophobicContact CB-CG2 3.66Å; A161-L187 HydrophobicContact CB-CD2 3.77Å
162	V	95.7	Very high	95.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.8	-44.9	175.4	160.2	0	0	0	0	111.5	Y158 Y159 V160 L164 M165 L170 I186 L209 Y212 W213 L216	Y158-V162 VanDerWaalsContact O-CB 3.29Å; Y158-V162 WeakPolarHBondContact O-CB 3.37Å; Y158-V162 VanDerWaalsContact O-CG2 3.3Å; Y158-V162 WeakPolarHBondContact O-CG2 3.46Å; Y158-V162 PolarHBondContact O-N 3.5Å; Y159-V162 PolarHBondContact O-N 3.18Å; V160-V162 VanDerWaalsContact C-N 3.34Å; V160-V162 PolarHBondContact O-N 2.97Å; V162-L164 PolarHBondContact O-N 3.07Å; V162-M165 HydrophobicContact CG2-CE 4.2Å; V162-M165 WeakPolarHBondContact O-CB 3.37Å; V162-M165 PolarHBondContact O-N 2.87Å; V162-M165 VanDerWaalsContact O-N 3.11Å; V162-L170 HydrophobicContact CG1-CD2 4.25Å; V162-I186 HydrophobicContact CG2-CD1 4.38Å; V162-L209 HydrophobicContact CB-CD1 4.41Å; V162-L209 HydrophobicContact CG2-CD1 3.97Å; V162-L209 HydrophobicContact CG2-CD2 4.39Å; V162-L209 HydrophobicContact CG2-CG 4.23Å; V162-Y212 HydrophobicContact CG1-CD1 3.99Å; V162-Y212 HydrophobicContact CG1-CE1 4.32Å; V162-W213 HydrophobicContact CG1-CB 3.7Å; V162-W213 HydrophobicContact CG2-CE3 4.27Å; V162-L216 HydrophobicContact CG1-CD1 3.73Å
163	S	95.1	Very high	94.9	Very high	8 Å²	8	33.2 Å²	33.2	6%	0.056	16%	0.163	C	C	.	.	H	α-helix	trans	-62.6	-24.6	176.6	-64	0	0	0	0	114.5	Y159 V160 Y212 S234	Y159-S163 PolarHBondContact O-N 3.37Å; Y159-S163 PolarHBondContact O-OG 2.98Å; Y159-S163 VanDerWaalsContact O-OG 3.06Å; V160-S163 PolarHBondContact O-N 3.24Å; S163-Y212 WeakPolarHBondContact OG-CE1 3.31Å; S163-Y212 PolarHBondContact OG-OH 3.47Å; S163-S234 WeakPolarHBondContact CB-OG 3.29Å; S163-S234 PolarHBondContact OG-OG 2.93Å
164	L	94.2	Very high	94.8	Very high	33 Å²	33	33.9 Å²	33.9	17%	0.173	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-7.3	177.8	-66.4	172	0	0	0	113.4	T132 V160 A161 V162 I227 A230	T132-L164 HydrophobicContact CG2-CB 4.12Å; T132-L164 VanDerWaalsContact CG2-O 3.28Å; T132-L164 WeakPolarHBondContact CG2-O 3.24Å; V160-L164 HydrophobicContact CG1-CD1 3.87Å; V160-L164 HydrophobicContact CG1-CG 4.49Å; V160-L164 VanDerWaalsContact O-CG 3.27Å; V160-L164 WeakPolarHBondContact O-CG 3.33Å; V160-L164 PolarHBondContact O-N 3.1Å; V160-L164 VanDerWaalsContact O-N 3.15Å; A161-L164 PolarHBondContact O-N 3.47Å; V162-L164 PolarHBondContact O-N 3.07Å; L164-I227 HydrophobicContact CD2-CB 4.35Å; L164-I227 HydrophobicContact CD2-CG1 3.92Å; L164-I227 HydrophobicContact CD2-CG2 4.4Å; L164-A230 HydrophobicContact CD2-CB 3.74Å; L164-A230 HydrophobicContact CG-CB 4.26Å
165	M	92.6	Very high	94.9	Very high	15 Å²	15	34.5 Å²	34.5	7%	0.074	18%	0.176	C	C	.	.	S	Bend	trans	-74.5	151.3	-178.9	-62.6	-161.9	-165.7	0	0	112.8	Q131 A161 V162 T169 L170 M173 I186	Q131-M165 HydrophobicContact CB-CE 3.9Å; Q131-M165 HydrophobicContact CB-CG 4.28Å; Q131-M165 HydrophobicContact CB-SD 3.91Å; Q131-M165 HydrophobicContact CG-CE 3.79Å; Q131-M165 HydrophobicContact CG-SD 4.02Å; A161-M165 WeakPolarHBondContact O-CG 3.48Å; A161-M165 PolarHBondContact O-N 2.86Å; V162-M165 HydrophobicContact CG2-CE 4.2Å; V162-M165 WeakPolarHBondContact O-CB 3.37Å; V162-M165 PolarHBondContact O-N 2.87Å; V162-M165 VanDerWaalsContact O-N 3.11Å; M165-T169 HydrophobicContact CB-CG2 4.41Å; M165-T169 HydrophobicContact CG-CG2 4.44Å; M165-T169 HydrophobicContact SD-CG2 3.6Å; M165-T169 VanDerWaalsContact SD-CG2 3.6Å; M165-L170 HydrophobicContact CB-CD2 3.73Å; M165-L170 HydrophobicContact CB-CG 4.05Å; M165-L170 HydrophobicContact CG-CD2 4.21Å; M165-L170 HydrophobicContact SD-CD2 3.93Å; M165-M173 HydrophobicContact CE-SD 3.94Å; M165-M173 HydrophobicContact SD-SD 3.53Å; M165-I186 HydrophobicContact CE-CB 4.27Å; M165-I186 HydrophobicContact CE-CG1 4.09Å; M165-I186 HydrophobicContact CE-CG2 3.55Å
166	S	91.4	Very high	94.7	Very high	60 Å²	60	34.4 Å²	34.4	42%	0.42	18%	0.177	S	C	.	.			trans	-66.7	149.2	169.4	84	0	0	0	0	111.3	Q168 T169 L170	S166-Q168 PolarHBondContact O-N 2.91Å; S166-T169 WeakPolarHBondContact O-CA 3.46Å; S166-T169 WeakPolarHBondContact O-CB 3.31Å; S166-T169 PolarHBondContact O-N 2.86Å; S166-T169 PolarHBondContact OG-N 3.38Å; S166-T169 PolarHBondContact OG-OG1 3.19Å; S166-L170 PolarHBondContact O-N 3.4Å; S166-L170 VanDerWaalsContact O-N 3.13Å
167	H	91.2	Very high	94.5	Very high	76 Å²	76	36.2 Å²	36.2	35%	0.352	19%	0.186	S	C	.	.	H	α-helix	trans	-51.3	-42.5	174.9	-171	87.8	0	0	0	112	T169 L170 E171	H167-T169 VanDerWaalsContact C-N 3.3Å; H167-T169 PolarHBondContact O-N 3.41Å; H167-L170 PolarHBondContact O-N 3.15Å; H167-L170 VanDerWaalsContact O-N 3.13Å; H167-E171 IonicContact CD2-OE2 2.67Å; H167-E171 IonicContact NE2-OE1 3.82Å; H167-E171 WeakPolarHBondContact O-CG 3.48Å; H167-E171 PolarHBondContact O-N 3.35Å
168	Q	91.4	Very high	94.3	Very high	152 Å²	152	43.1 Å²	43.1	71%	0.71	22%	0.218	S	C	*	.	H	α-helix	trans	-60.3	-35.7	176.2	-173.4	-179.5	23.3	0	0	113.3	S166 H172	S166-Q168 PolarHBondContact O-N 2.91Å; Q168-H172 WeakPolarHBondContact O-CB 3.39Å; Q168-H172 PolarHBondContact O-N 2.96Å; Q168-H172 VanDerWaalsContact O-N 3.12Å
169	T	92.9	Very high	94.1	Very high	26 Å²	26	42.7 Å²	42.7	16%	0.16	23%	0.225	C	C	.	.	H	α-helix	trans	-68.9	-42.1	175.9	-47.9	0	0	0	0	110.6	Q131 M165 S166 H167 H172 M173	Q131-T169 HydrophobicContact CB-CG2 4.2Å; Q131-T169 HydrophobicContact CG-CG2 4.28Å; M165-T169 HydrophobicContact CB-CG2 4.41Å; M165-T169 HydrophobicContact CG-CG2 4.44Å; M165-T169 HydrophobicContact SD-CG2 3.6Å; M165-T169 VanDerWaalsContact SD-CG2 3.6Å; S166-T169 WeakPolarHBondContact O-CA 3.46Å; S166-T169 WeakPolarHBondContact O-CB 3.31Å; S166-T169 PolarHBondContact O-N 2.86Å; S166-T169 PolarHBondContact OG-N 3.38Å; S166-T169 PolarHBondContact OG-OG1 3.19Å; H167-T169 VanDerWaalsContact C-N 3.3Å; H167-T169 PolarHBondContact O-N 3.41Å; T169-H172 WeakPolarHBondContact O-CB 3.27Å; T169-H172 PolarHBondContact O-N 2.86Å; T169-M173 WeakPolarHBondContact O-CG 3.36Å; T169-M173 PolarHBondContact O-N 3.36Å
170	L	93.3	Very high	93.8	Very high	6 Å²	6	51.1 Å²	51.1	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-65.9	-43.5	177.8	-61.1	-174.9	0	0	0	111.6	V162 M165 S166 H167 H172 M173 E174 W213 L216 L217	V162-L170 HydrophobicContact CG1-CD2 4.25Å; M165-L170 HydrophobicContact CB-CD2 3.73Å; M165-L170 HydrophobicContact CB-CG 4.05Å; M165-L170 HydrophobicContact CG-CD2 4.21Å; M165-L170 HydrophobicContact SD-CD2 3.93Å; S166-L170 PolarHBondContact O-N 3.4Å; S166-L170 VanDerWaalsContact O-N 3.13Å; H167-L170 PolarHBondContact O-N 3.15Å; H167-L170 VanDerWaalsContact O-N 3.13Å; L170-H172 VanDerWaalsContact C-N 3.27Å; L170-H172 PolarHBondContact O-N 3.32Å; L170-M173 PolarHBondContact O-N 3.01Å; L170-E174 PolarHBondContact O-N 3.19Å; L170-W213 HydrophobicContact CD2-CB 4.05Å; L170-L216 HydrophobicContact CD1-CB 3.92Å; L170-L216 HydrophobicContact CD1-CD1 4.31Å; L170-L217 HydrophobicContact CB-CD1 4.38Å; L170-L217 HydrophobicContact CB-CD2 3.67Å; L170-L217 HydrophobicContact CB-CG 3.99Å
171	E	93.3	Very high	93.6	Very high	107 Å²	107	57.2 Å²	57.2	50%	0.5	29%	0.293	S	S	.	.	H	α-helix	trans	-56.8	-41.6	172.5	-72.7	-177.4	120.1	0	0	111.4	H167 G175 L217	H167-E171 IonicContact CD2-OE2 2.67Å; H167-E171 IonicContact NE2-OE1 3.82Å; H167-E171 WeakPolarHBondContact O-CG 3.48Å; H167-E171 PolarHBondContact O-N 3.35Å; E171-G175 PolarHBondContact O-N 2.92Å; E171-L217 HydrophobicContact CG-CD2 3.79Å
172	H	93.6	Very high	93.2	Very high	114 Å²	114	63.1 Å²	63.1	53%	0.528	33%	0.332	S	S	.	.	H	α-helix	trans	-66.5	-40.8	177.6	-169.3	98.4	0	0	0	112.3	Q168 T169 L170 A176	Q168-H172 WeakPolarHBondContact O-CB 3.39Å; Q168-H172 PolarHBondContact O-N 2.96Å; Q168-H172 VanDerWaalsContact O-N 3.12Å; T169-H172 WeakPolarHBondContact O-CB 3.27Å; T169-H172 PolarHBondContact O-N 2.86Å; L170-H172 VanDerWaalsContact C-N 3.27Å; L170-H172 PolarHBondContact O-N 3.32Å; H172-A176 VanDerWaalsContact O-CB 3.28Å; H172-A176 WeakPolarHBondContact O-CB 3.28Å; H172-A176 PolarHBondContact O-N 3.35Å
173	M	93.7	Very high	93	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.005	35%	0.345	C	S	.	.	H	α-helix	trans	-66.2	-43.4	177.2	-75.3	178.4	54.4	0	0	111.9	M165 T169 L170 A176 M177 I186 W213	M165-M173 HydrophobicContact CE-SD 3.94Å; M165-M173 HydrophobicContact SD-SD 3.53Å; T169-M173 WeakPolarHBondContact O-CG 3.36Å; T169-M173 PolarHBondContact O-N 3.36Å; L170-M173 PolarHBondContact O-N 3.01Å; M173-A176 WeakPolarHBondContact O-CB 3.24Å; M173-A176 PolarHBondContact O-N 3.38Å; M173-M177 PolarHBondContact O-N 2.8Å; M173-I186 HydrophobicContact CE-CD1 3.69Å; M173-I186 HydrophobicContact CE-CG1 4.02Å; M173-W213 HydrophobicContact CE-CD2 4.38Å; M173-W213 HydrophobicContact CE-CE3 3.82Å; M173-W213 HydrophobicContact CE-CH2 4.1Å; M173-W213 HydrophobicContact CE-CZ3 3.67Å
174	E	95	Very high	92.7	Very high	18 Å²	18	68.1 Å²	68.1	8%	0.084	36%	0.357	C	S	.	.	H	α-helix	trans	-66.9	-46.7	177.4	-175.8	56.1	-161.2	0	0	111.4	L170 A176 M177 E178 R210 W213 Q214 L217	L170-E174 PolarHBondContact O-N 3.19Å; E174-A176 PolarHBondContact O-N 3.2Å; E174-M177 WeakPolarHBondContact O-CB 3.36Å; E174-M177 PolarHBondContact O-N 3.11Å; E174-E178 PolarHBondContact O-N 3.4Å; E174-R210 IonicContact OE1-CZ 3.94Å; E174-R210 IonicContact OE1-NE 3.73Å; E174-R210 PolarHBondContact OE1-NE 3.24Å; E174-R210 IonicContact OE1-NH2 3.32Å; E174-R210 PolarHBondContact OE1-NH2 3.37Å; E174-R210 IonicContact OE2-CZ 3.88Å; E174-R210 IonicContact OE2-NE 2.8Å; E174-R210 PolarHBondContact OE2-NE 3.15Å; E174-R210 IonicContact OE2-NH2 3.62Å; E174-W213 PolarHBondContact OE2-NE1 3.17Å; E174-Q214 VanDerWaalsContact CD-NE2 3.33Å; E174-Q214 PolarHBondContact OE1-NE2 3.09Å; E174-Q214 PolarHBondContact OE2-NE2 3.33Å; E174-L217 HydrophobicContact CB-CD1 4.09Å; E174-L217 HydrophobicContact CG-CD1 4.49Å
175	G	95	Very high	92.7	Very high	27 Å²	27	70.4 Å²	70.4	28%	0.278	37%	0.374	S	S	.	.	H	α-helix	trans	-61.6	-26.1	174.2	0	0	0	0	0	113.5	E171 S179	E171-G175 PolarHBondContact O-N 2.92Å; G175-S179 WeakPolarHBondContact O-CB 3.28Å; G175-S179 PolarHBondContact O-N 2.89Å; G175-S179 VanDerWaalsContact O-N 3.14Å; G175-S179 PolarHBondContact O-OG 2.89Å
176	A	94.1	Very high	92.8	Very high	5 Å²	5	70.5 Å²	70.5	4%	0.041	37%	0.374	C	S	.	.	H	α-helix	trans	-72.7	-43.8	170.6	0	0	0	0	0	112.1	H172 M173 E174 S179 M180 K181 L183	H172-A176 VanDerWaalsContact O-CB 3.28Å; H172-A176 WeakPolarHBondContact O-CB 3.28Å; H172-A176 PolarHBondContact O-N 3.35Å; M173-A176 WeakPolarHBondContact O-CB 3.24Å; M173-A176 PolarHBondContact O-N 3.38Å; E174-A176 PolarHBondContact O-N 3.2Å; A176-S179 CarbonylContact O-C 3.5Å; A176-S179 PolarHBondContact O-N 3.32Å; A176-M180 PolarHBondContact O-N 3.03Å; A176-M180 VanDerWaalsContact O-N 3.1Å; A176-K181 HydrophobicContact CB-CB 4.19Å; A176-K181 PolarHBondContact O-N 3.04Å; A176-L183 HydrophobicContact CB-CD2 4.06Å
177	M	93.1	Very high	93	Very high	38 Å²	38	68.4 Å²	68.4	19%	0.187	36%	0.358	C	S	.	.	H	α-helix	trans	-58.4	-52.2	172.5	-77.9	-56.9	-83.9	0	0	112	M173 E174 S179 M180 L183 W213	M173-M177 PolarHBondContact O-N 2.8Å; E174-M177 WeakPolarHBondContact O-CB 3.36Å; E174-M177 PolarHBondContact O-N 3.11Å; M177-S179 VanDerWaalsContact C-N 3.25Å; M177-S179 PolarHBondContact O-N 3.13Å; M177-M180 PolarHBondContact O-N 2.94Å; M177-L183 HydrophobicContact CG-CD2 3.85Å; M177-L183 HydrophobicContact SD-CD1 3.81Å; M177-L183 HydrophobicContact SD-CD2 3.83Å; M177-L183 HydrophobicContact SD-CG 4.09Å; M177-W213 HydrophobicContact CG-CH2 4.36Å; M177-W213 HydrophobicContact CG-CZ2 3.77Å
178	E	93.8	Very high	93.1	Very high	145 Å²	145	69.7 Å²	69.7	68%	0.678	37%	0.365	S	S	*	.	H	α-helix	trans	-59.2	-38	178.8	-67.9	-168.4	138.8	0	0	112.2	E174 M180	E174-E178 PolarHBondContact O-N 3.4Å; E178-M180 VanDerWaalsContact C-N 3.28Å; E178-M180 PolarHBondContact O-N 3.32Å
179	S	94.8	Very high	93.2	Very high	62 Å²	62	65 Å²	65	43%	0.434	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-1.6	177.9	-61.9	0	0	0	0	114.3	G175 A176 M177 K181	G175-S179 WeakPolarHBondContact O-CB 3.28Å; G175-S179 PolarHBondContact O-N 2.89Å; G175-S179 VanDerWaalsContact O-N 3.14Å; G175-S179 PolarHBondContact O-OG 2.89Å; A176-S179 CarbonylContact O-C 3.5Å; A176-S179 PolarHBondContact O-N 3.32Å; M177-S179 VanDerWaalsContact C-N 3.25Å; M177-S179 PolarHBondContact O-N 3.13Å; S179-K181 PolarHBondContact O-N 3.13Å; S179-K181 PolarHBondContact OG-NZ 2.92Å; S179-K181 VanDerWaalsContact OG-NZ 3.13Å
180	M	91.4	Very high	93.2	Very high	179 Å²	179	65.4 Å²	65.4	88%	0.882	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	37.2	-170.7	-62.9	-83.5	-84.1	0	0	113	A176 M177 E178	A176-M180 PolarHBondContact O-N 3.03Å; A176-M180 VanDerWaalsContact O-N 3.1Å; M177-M180 PolarHBondContact O-N 2.94Å; E178-M180 VanDerWaalsContact C-N 3.28Å; E178-M180 PolarHBondContact O-N 3.32Å
181	K	92.9	Very high	92.9	Very high	128 Å²	128	67.3 Å²	67.3	56%	0.557	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-92.2	157.2	176.6	-71.2	169.6	-173.6	146.7	0	110.6	A176 S179 L183	A176-K181 HydrophobicContact CB-CB 4.19Å; A176-K181 PolarHBondContact O-N 3.04Å; S179-K181 PolarHBondContact O-N 3.13Å; S179-K181 PolarHBondContact OG-NZ 2.92Å; S179-K181 VanDerWaalsContact OG-NZ 3.13Å; K181-L183 PolarHBondContact O-N 3.21Å
182	P	89.7	Confident	92.6	Very high	126 Å²	126	64 Å²	64	82%	0.818	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-57.2	132.1	171.3	-22.5	33.8	0	0	0	111.3
183	L	90.2	Very high	92.1	Very high	55 Å²	55	64.9 Å²	64.9	29%	0.288	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-71.2	153.3	174.6	-66	176.5	0	0	0	111.7	A176 M177 K181 L206	A176-L183 HydrophobicContact CB-CD2 4.06Å; M177-L183 HydrophobicContact CG-CD2 3.85Å; M177-L183 HydrophobicContact SD-CD1 3.81Å; M177-L183 HydrophobicContact SD-CD2 3.83Å; M177-L183 HydrophobicContact SD-CG 4.09Å; K181-L183 PolarHBondContact O-N 3.21Å; L183-L206 HydrophobicContact CD1-CD1 4.32Å
184	L	90.1	Very high	91.4	Very high	58 Å²	58	67.7 Å²	67.7	30%	0.304	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-65.8	137.3	166	-61.5	177.2	0	0	0	109.2	I186	L184-I186 PolarHBondContact O-N 2.86Å
185	P	93.3	Very high	90.9	Very high	81 Å²	81	68.8 Å²	68.8	53%	0.526	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-70.3	126.3	178.6	30.8	-35.1	0	0	0	109.5	L130 Q131	L130-P185 VanDerWaalsContact CB-O 3.29Å; L130-P185 WeakPolarHBondContact CB-O 3.17Å; L130-P185 HydrophobicContact CD1-CB 3.7Å; L130-P185 HydrophobicContact CD1-CG 3.99Å; Q131-P185 PolarHBondContact NE2-O 3.12Å
186	I	94.8	Very high	90	Very high	16 Å²	16	70.6 Å²	70.6	8%	0.082	39%	0.393	C	S	.	.			trans	-83.4	-47.8	-174.9	-55.3	173.8	0	0	0	111.2	L130 Y158 A161 V162 M165 M173 L184 L209	L130-I186 PolarHBondContact N-O 2.69Å; Y158-I186 HydrophobicContact CD1-CB 3.96Å; Y158-I186 HydrophobicContact CD1-CD1 3.97Å; Y158-I186 HydrophobicContact CD1-CG2 3.92Å; Y158-I186 HydrophobicContact CE1-CB 4.04Å; Y158-I186 HydrophobicContact CE1-CD1 4.41Å; Y158-I186 HydrophobicContact CE1-CG2 4.44Å; A161-I186 HydrophobicContact CB-CG2 3.66Å; V162-I186 HydrophobicContact CG2-CD1 4.38Å; M165-I186 HydrophobicContact CE-CB 4.27Å; M165-I186 HydrophobicContact CE-CG1 4.09Å; M165-I186 HydrophobicContact CE-CG2 3.55Å; M173-I186 HydrophobicContact CE-CD1 3.69Å; M173-I186 HydrophobicContact CE-CG1 4.02Å; L184-I186 PolarHBondContact O-N 2.86Å; I186-L209 HydrophobicContact CD1-CD2 4.04Å
187	L	95.1	Very high	89.3	Confident	16 Å²	16	74.5 Å²	74.5	8%	0.084	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	146.3	-173.6	-61.4	-177.8	0	0	0	112	A127 S128 M136 F157 Y158 A161 W189	A127-L187 HydrophobicContact CB-CB 4.33Å; A127-L187 HydrophobicContact CB-CD1 4.3Å; A127-L187 HydrophobicContact CB-CD2 4.39Å; S128-L187 WeakPolarHBondContact O-CA 3.42Å; M136-L187 HydrophobicContact CE-CD2 3.42Å; M136-L187 VanDerWaalsContact CE-CD2 3.42Å; F157-L187 HydrophobicContact CB-CD1 3.61Å; Y158-L187 HydrophobicContact CD1-CD1 3.77Å; Y158-L187 HydrophobicContact CD1-CG 3.94Å; Y158-L187 HydrophobicContact CD2-CD1 3.99Å; Y158-L187 HydrophobicContact CE1-CB 4.15Å; Y158-L187 HydrophobicContact CE1-CD1 3.79Å; Y158-L187 HydrophobicContact CE1-CG 3.85Å; Y158-L187 HydrophobicContact CE2-CD1 4.01Å; Y158-L187 HydrophobicContact CG-CD1 3.87Å; A161-L187 HydrophobicContact CB-CD2 3.77Å; L187-W189 HydrophobicContact CD1-CZ2 3.68Å
188	H	94.4	Very high	88.6	Confident	104 Å²	104	75 Å²	75	48%	0.481	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	108.7	160.9	-177.8	68.2	0	0	0	109.8	A127 S128 L130	A127-H188 CarbonylContact C-O 3.6Å; A127-H188 VanDerWaalsContact CA-O 3.27Å; A127-H188 WeakPolarHBondContact CA-O 3.22Å; S128-H188 PolarHBondContact N-O 3.18Å; S128-H188 PolarHBondContact O-N 3.21Å; L130-H188 HydrophobicContact CD1-CB 4.13Å; L130-H188 HydrophobicContact CD2-CB 4.03Å; L130-H188 HydrophobicContact CG-CB 4.19Å
189	W	93.7	Very high	87.9	Confident	53 Å²	53	76 Å²	76	20%	0.201	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	133.3	-177.1	-73.8	97.5	0	0	0	112.6	A127 S153 E154 F157 Y158 L187 K191	A127-W189 HydrophobicContact CB-CD2 4.1Å; A127-W189 HydrophobicContact CB-CE3 3.99Å; A127-W189 HydrophobicContact CB-CZ3 4.37Å; S153-W189 VanDerWaalsContact O-CH2 3.23Å; S153-W189 WeakPolarHBondContact O-CH2 3.27Å; E154-W189 WeakPolarHBondContact O-CZ2 3.47Å; F157-W189 HydrophobicContact CB-CH2 3.98Å; F157-W189 HydrophobicContact CB-CZ2 4.26Å; F157-W189 HydrophobicContact CD2-CE3 4.41Å; F157-W189 AromaticContact CD2-CH2 3.5Å; F157-W189 HydrophobicContact CD2-CH2 3.5Å; F157-W189 VanDerWaalsContact CD2-CH2 3.5Å; F157-W189 HydrophobicContact CD2-CZ2 4.36Å; F157-W189 AromaticContact CD2-CZ3 3.54Å; F157-W189 HydrophobicContact CD2-CZ3 3.54Å; F157-W189 HydrophobicContact CE2-CH2 4.27Å; F157-W189 AromaticContact CE2-CZ3 3.91Å; F157-W189 HydrophobicContact CE2-CZ3 3.91Å; F157-W189 AromaticContact CG-CH2 3.99Å; F157-W189 HydrophobicContact CG-CH2 3.99Å; F157-W189 HydrophobicContact CG-CZ3 4.44Å; Y158-W189 HydrophobicContact CD2-CZ2 4.27Å; Y158-W189 AromaticContact CE2-CZ2 3.78Å; Y158-W189 HydrophobicContact CE2-CZ2 3.78Å; Y158-W189 AromaticContact CE2-NE1 3.67Å; Y158-W189 AromaticContact CZ-NE1 3.52Å; Y158-W189 PolarHBondContact OH-NE1 3.02Å; L187-W189 HydrophobicContact CD1-CZ2 3.68Å; W189-K191 HydrophobicContact CB-CG 4.28Å; W189-K191 HydrophobicContact CE3-CD 4.32Å; W189-K191 VanDerWaalsContact CE3-CE 3.41Å; W189-K191 HydrophobicContact CE3-CG 4.09Å
190	L	92.3	Very high	87	Confident	34 Å²	34	79.3 Å²	79.3	18%	0.178	43%	0.428	C	S	.	.			trans	-110.2	55.2	176.4	-59.2	176.6	0	0	0	110	I95 F109 V126	I95-L190 HydrophobicContact CD1-CD1 3.98Å; F109-L190 HydrophobicContact CE1-CB 4.28Å; F109-L190 HydrophobicContact CE1-CD1 3.83Å; F109-L190 HydrophobicContact CZ-CB 3.96Å; F109-L190 HydrophobicContact CZ-CD1 4.36Å; V126-L190 HydrophobicContact CB-CB 4.27Å; V126-L190 HydrophobicContact CG1-CB 4.21Å; V126-L190 HydrophobicContact CG1-CD1 4.33Å; V126-L190 PolarHBondContact O-N 3.03Å
191	K	86.2	Confident	86.5	Confident	46 Å²	46	71 Å²	71	20%	0.2	39%	0.387	C	S	.	.			trans	-78.4	150.4	-178	-71.8	-173.6	177.7	-159.9	0	112.2	W189 D195 I197	W189-K191 HydrophobicContact CB-CG 4.28Å; W189-K191 HydrophobicContact CE3-CD 4.32Å; W189-K191 VanDerWaalsContact CE3-CE 3.41Å; W189-K191 HydrophobicContact CE3-CG 4.09Å; K191-D195 HydrophobicContact CB-CB 4.32Å; K191-D195 HydrophobicContact CD-CB 4.46Å; K191-I197 HydrophobicContact CD-CD1 4.31Å; K191-I197 HydrophobicContact CD-CG1 4.49Å
192	H	88.1	Confident	86	Confident	38 Å²	38	68.2 Å²	68.2	18%	0.176	38%	0.381	C	S	.	.			trans	-74.5	146.9	168.8	170.3	-100.1	0	0	0	109.9	E90 R124 G194 D195	E90-H192 PolarHBondContact O-CD2 2.89Å; R124-H192 VanDerWaalsContact NH2-CB 3.25Å; R124-H192 VanDerWaalsContact NH2-CG 3.29Å; R124-H192 PolarHBondContact NH2-ND1 3.45Å; H192-G194 PolarHBondContact ND1-N 3.38Å; H192-G194 VanDerWaalsContact ND1-N 3.19Å; H192-G194 PolarHBondContact O-N 2.72Å; H192-D195 WeakPolarHBondContact CB-OD2 3.47Å; H192-D195 PolarHBondContact N-OD2 3.14Å; H192-D195 IonicContact ND1-OD1 3.42Å; H192-D195 WeakPolarHBondContact O-CB 3.33Å; H192-D195 PolarHBondContact O-N 2.76Å
193	P	83.7	Confident	85.8	Confident	133 Å²	133	65.6 Å²	65.6	86%	0.864	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-19.1	-175.6	-27.1	36.8	0	0	0	115.8
194	G	78.8	Confident	85.6	Confident	59 Å²	59	64.1 Å²	64.1	61%	0.608	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-11.5	173.5	0	0	0	0	0	114.9	H192 S196	H192-G194 PolarHBondContact ND1-N 3.38Å; H192-G194 VanDerWaalsContact ND1-N 3.19Å; H192-G194 PolarHBondContact O-N 2.72Å; G194-S196 PolarHBondContact O-N 2.69Å
195	D	83.3	Confident	85.6	Confident	41 Å²	41	62.5 Å²	62.5	22%	0.219	35%	0.35	C	S	.	.			trans	-76.2	118.2	-177.7	-52.8	-16.1	0	0	0	109.4	R124 K191 H192	R124-D195 IonicContact CZ-OD1 3.85Å; R124-D195 IonicContact NE-OD1 3.13Å; R124-D195 IonicContact NE-OD2 3.2Å; R124-D195 IonicContact NH2-OD1 2.7Å; R124-D195 PolarHBondContact NH2-OD1 2.57Å; K191-D195 HydrophobicContact CB-CB 4.32Å; K191-D195 HydrophobicContact CD-CB 4.46Å; H192-D195 WeakPolarHBondContact CB-OD2 3.47Å; H192-D195 PolarHBondContact N-OD2 3.14Å; H192-D195 IonicContact ND1-OD1 3.42Å; H192-D195 WeakPolarHBondContact O-CB 3.33Å; H192-D195 PolarHBondContact O-N 2.76Å
196	S	76.8	Confident	85.5	Confident	65 Å²	65	61.8 Å²	61.8	46%	0.455	34%	0.341	S	S	.	.			trans	-75.7	165.2	-178.2	59.2	0	0	0	0	113	Q150 G194	Q150-S196 PolarHBondContact NE2-O 2.84Å; Q150-S196 PolarHBondContact NE2-OG 2.99Å; Q150-S196 PolarHBondContact OE1-OG 2.88Å; G194-S196 PolarHBondContact O-N 2.69Å
197	I	79.2	Confident	85.3	Confident	88 Å²	88	65.2 Å²	65.2	45%	0.451	36%	0.36	S	S	.	.			trans	-137.7	130.7	174	-60	-176.7	0	0	0	109	E154 K191 K199	E154-I197 VanDerWaalsContact OE1-CA 3.29Å; E154-I197 WeakPolarHBondContact OE1-CA 3.47Å; E154-I197 WeakPolarHBondContact OE2-CG2 3.16Å; K191-I197 HydrophobicContact CD-CD1 4.31Å; K191-I197 HydrophobicContact CD-CG1 4.49Å; I197-K199 PolarHBondContact O-N 2.68Å
198	Y	78.1	Confident	85.3	Confident	48 Å²	48	66.5 Å²	66.5	19%	0.188	37%	0.365	C	S	.	.			trans	-77.1	86.1	174.1	-70.4	-37.6	0	0	0	112	H146 Q150 E154 D200 T202 L258	H146-Y198 PolarHBondContact CD2-OH 3.26Å; H146-Y198 PolarHBondContact NE2-OH 2.89Å; Q150-Y198 HydrophobicContact CB-CD2 4.39Å; Q150-Y198 HydrophobicContact CB-CE2 3.72Å; Q150-Y198 HydrophobicContact CG-CD2 3.59Å; Q150-Y198 HydrophobicContact CG-CE1 4.26Å; Q150-Y198 HydrophobicContact CG-CE2 3.29Å; Q150-Y198 HydrophobicContact CG-CG 4.22Å; E154-Y198 PolarHBondContact OE1-N 2.98Å; E154-Y198 PolarHBondContact OE2-N 3.29Å; Y198-D200 VanDerWaalsContact C-N 3.34Å; Y198-D200 PolarHBondContact O-N 2.86Å; Y198-T202 PolarHBondContact O-OG1 3.49Å; Y198-L258 HydrophobicContact CD1-CD2 4.49Å; Y198-L258 HydrophobicContact CD2-CD1 4.49Å; Y198-L258 HydrophobicContact CD2-CD2 3.99Å; Y198-L258 HydrophobicContact CE2-CD1 3.86Å; Y198-L258 HydrophobicContact CE2-CD2 4.18Å; Y198-L258 HydrophobicContact CG-CD2 4.16Å
199	K	79.3	Confident	85.3	Confident	166 Å²	166	62 Å²	62	72%	0.722	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-62.3	-36.6	-178.6	-65.8	179.6	-177.7	175.1	0	113.9	I197 V201 T202	I197-K199 PolarHBondContact O-N 2.68Å; K199-V201 VanDerWaalsContact C-N 3.29Å; K199-V201 PolarHBondContact O-N 3.21Å; K199-T202 WeakPolarHBondContact CA-OG1 3.46Å; K199-T202 WeakPolarHBondContact O-CB 3.14Å; K199-T202 PolarHBondContact O-N 3.04Å; K199-T202 PolarHBondContact O-OG1 2.98Å
200	D	75.4	Confident	85.4	Confident	131 Å²	131	62.3 Å²	62.3	70%	0.701	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-71.5	-23.7	-169.6	-56.7	-35.8	0	0	0	113.1	Y198	Y198-D200 VanDerWaalsContact C-N 3.34Å; Y198-D200 PolarHBondContact O-N 2.86Å
201	V	81.4	Confident	85.5	Confident	4 Å²	4	63.6 Å²	63.6	2%	0.024	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-105.7	4.2	177.8	-67.8	0	0	0	0	114	K199 S203 V204 H205 T255 L258	K199-V201 VanDerWaalsContact C-N 3.29Å; K199-V201 PolarHBondContact O-N 3.21Å; V201-S203 PolarHBondContact O-N 3.06Å; V201-V204 PolarHBondContact O-N 2.91Å; V201-V204 VanDerWaalsContact O-N 3.1Å; V201-H205 VanDerWaalsContact CG2-NE2 3.28Å; V201-H205 WeakPolarHBondContact CG2-NE2 3.48Å; V201-H205 PolarHBondContact O-CD2 2.96Å; V201-H205 PolarHBondContact O-N 3.23Å; V201-T255 HydrophobicContact CG1-CG2 3.94Å; V201-L258 HydrophobicContact CG1-CD2 3.89Å; V201-L258 HydrophobicContact CG2-CD2 3.84Å
202	T	83.3	Confident	86	Confident	71 Å²	71	61.4 Å²	61.4	44%	0.436	35%	0.345	S	S	.	.	H	α-helix	trans	-59.3	-32.7	-179.4	-61.3	0	0	0	0	112.7	Y198 K199 L206	Y198-T202 PolarHBondContact O-OG1 3.49Å; K199-T202 WeakPolarHBondContact CA-OG1 3.46Å; K199-T202 WeakPolarHBondContact O-CB 3.14Å; K199-T202 PolarHBondContact O-N 3.04Å; K199-T202 PolarHBondContact O-OG1 2.98Å; T202-L206 PolarHBondContact O-N 3.02Å; T202-L206 VanDerWaalsContact O-N 3.09Å
203	S	85.3	Confident	86.2	Confident	70 Å²	70	59.6 Å²	59.6	49%	0.49	34%	0.337	S	S	.	.	H	α-helix	trans	-64	-48.9	173.4	45.9	0	0	0	0	112.1	V201 H205 L206 D207	V201-S203 PolarHBondContact O-N 3.06Å; S203-H205 VanDerWaalsContact C-N 3.28Å; S203-H205 PolarHBondContact O-N 3.49Å; S203-L206 WeakPolarHBondContact O-CB 3.27Å; S203-L206 PolarHBondContact O-N 2.94Å; S203-L206 VanDerWaalsContact O-N 3.09Å; S203-D207 PolarHBondContact O-N 3.05Å
204	V	85.8	Confident	86.7	Confident	25 Å²	25	56.2 Å²	56.2	15%	0.152	31%	0.309	C	S	.	.	H	α-helix	trans	-59.7	-41.2	179	-177.6	0	0	0	0	110.8	V201 D207 H208 T255	V201-V204 PolarHBondContact O-N 2.91Å; V201-V204 VanDerWaalsContact O-N 3.1Å; V204-D207 PolarHBondContact O-N 3.07Å; V204-H208 PolarHBondContact O-N 3.29Å; V204-H208 VanDerWaalsContact O-N 3.16Å; V204-H208 PolarHBondContact O-ND1 2.84Å; V204-T255 HydrophobicContact CG2-CG2 4.06Å
205	H	89.9	Confident	87.4	Confident	24 Å²	24	56.5 Å²	56.5	11%	0.111	30%	0.295	C	S	.	.	H	α-helix	trans	-67	-35.3	176.6	-61	-29.7	0	0	0	113	R155 V201 S203 L209	R155-H205 HydrophobicContact CG-CB 4.4Å; R155-H205 PolarHBondContact NH1-CE1 2.87Å; R155-H205 VanDerWaalsContact NH1-CE1 3.3Å; R155-H205 PolarHBondContact NH1-ND1 2.87Å; R155-H205 VanDerWaalsContact NH1-ND1 3.17Å; V201-H205 VanDerWaalsContact CG2-NE2 3.28Å; V201-H205 WeakPolarHBondContact CG2-NE2 3.48Å; V201-H205 PolarHBondContact O-CD2 2.96Å; V201-H205 PolarHBondContact O-N 3.23Å; S203-H205 VanDerWaalsContact C-N 3.28Å; S203-H205 PolarHBondContact O-N 3.49Å; H205-L209 WeakPolarHBondContact O-CB 3.48Å; H205-L209 PolarHBondContact O-N 3.38Å
206	L	91.1	Very high	87.8	Confident	65 Å²	65	55.3 Å²	55.3	34%	0.34	29%	0.288	S	S	.	.	H	α-helix	trans	-66.7	-40.7	174.2	-173.9	71.5	0	0	0	111.6	L183 T202 S203 L209 R210	L183-L206 HydrophobicContact CD1-CD1 4.32Å; T202-L206 PolarHBondContact O-N 3.02Å; T202-L206 VanDerWaalsContact O-N 3.09Å; S203-L206 WeakPolarHBondContact O-CB 3.27Å; S203-L206 PolarHBondContact O-N 2.94Å; S203-L206 VanDerWaalsContact O-N 3.09Å; L206-L209 PolarHBondContact O-N 3.18Å; L206-R210 PolarHBondContact O-N 3.38Å
207	D	91.2	Very high	88.5	Confident	89 Å²	89	53.4 Å²	53.4	48%	0.476	27%	0.273	S	S	.	.	H	α-helix	trans	-64.7	-42.9	179.2	-70.1	-30.3	0	0	0	111.7	S203 V204 R210 V211	S203-D207 PolarHBondContact O-N 3.05Å; V204-D207 PolarHBondContact O-N 3.07Å; D207-R210 WeakPolarHBondContact O-CB 3.38Å; D207-R210 PolarHBondContact O-N 3.48Å; D207-V211 PolarHBondContact O-N 2.86Å; D207-V211 VanDerWaalsContact O-N 3.07Å
208	H	93.4	Very high	88.9	Confident	43 Å²	43	55.2 Å²	55.2	20%	0.199	28%	0.284	C	S	.	.	H	α-helix	trans	-66.3	-39.9	174.2	-69.8	82.3	0	0	0	112.1	V204 R210 V211 Y212 D241 E245	V204-H208 PolarHBondContact O-N 3.29Å; V204-H208 VanDerWaalsContact O-N 3.16Å; V204-H208 PolarHBondContact O-ND1 2.84Å; H208-R210 PolarHBondContact O-N 2.75Å; H208-V211 PolarHBondContact O-N 3.45Å; H208-Y212 PolarHBondContact O-N 2.8Å; H208-D241 IonicContact CD2-OD1 2.83Å; H208-E245 VanDerWaalsContact CE1-CG 3.42Å; H208-E245 WeakPolarHBondContact CE1-CG 3.29Å; H208-E245 IonicContact CE1-OE1 3.84Å; H208-E245 IonicContact CG-OE1 2.91Å; H208-E245 IonicContact ND1-OE1 3.89Å; H208-E245 WeakPolarHBondContact NE2-CG 3.39Å
209	L	95.6	Very high	89	Confident	8 Å²	8	57.3 Å²	57.3	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-62.3	-33.5	174.4	-171.3	70.6	0	0	0	112	Y158 Y159 V162 I186 H205 L206 Y212 W213	Y158-L209 HydrophobicContact CD1-CD2 4.3Å; Y158-L209 HydrophobicContact CG-CD2 4.27Å; Y159-L209 HydrophobicContact CD2-CD1 3.75Å; Y159-L209 HydrophobicContact CE2-CD1 3.85Å; Y159-L209 HydrophobicContact CG-CD1 4.15Å; V162-L209 HydrophobicContact CB-CD1 4.41Å; V162-L209 HydrophobicContact CG2-CD1 3.97Å; V162-L209 HydrophobicContact CG2-CD2 4.39Å; V162-L209 HydrophobicContact CG2-CG 4.23Å; I186-L209 HydrophobicContact CD1-CD2 4.04Å; H205-L209 WeakPolarHBondContact O-CB 3.48Å; H205-L209 PolarHBondContact O-N 3.38Å; L206-L209 PolarHBondContact O-N 3.18Å; L209-Y212 WeakPolarHBondContact O-CB 3.35Å; L209-Y212 PolarHBondContact O-N 2.9Å; L209-W213 HydrophobicContact CB-CZ3 4.46Å; L209-W213 HydrophobicContact CD2-CZ3 4.07Å; L209-W213 HydrophobicContact CG-CE3 4.05Å; L209-W213 HydrophobicContact CG-CZ3 3.96Å; L209-W213 PolarHBondContact O-N 3.05Å; L209-W213 VanDerWaalsContact O-N 3.11Å
210	R	95.1	Very high	88.3	Confident	61 Å²	61	56.3 Å²	56.3	23%	0.23	30%	0.295	C	S	.	.	H	α-helix	trans	-66.6	-48.5	173.7	177.8	172.1	-172.7	-160.4	-1.4	112.3	E174 L206 D207 H208 Y212 W213 Q214	E174-R210 IonicContact OE1-CZ 3.94Å; E174-R210 IonicContact OE1-NE 3.73Å; E174-R210 PolarHBondContact OE1-NE 3.24Å; E174-R210 IonicContact OE1-NH2 3.32Å; E174-R210 PolarHBondContact OE1-NH2 3.37Å; E174-R210 IonicContact OE2-CZ 3.88Å; E174-R210 IonicContact OE2-NE 2.8Å; E174-R210 PolarHBondContact OE2-NE 3.15Å; E174-R210 IonicContact OE2-NH2 3.62Å; L206-R210 PolarHBondContact O-N 3.38Å; D207-R210 WeakPolarHBondContact O-CB 3.38Å; D207-R210 PolarHBondContact O-N 3.48Å; H208-R210 PolarHBondContact O-N 2.75Å; R210-Y212 PolarHBondContact O-N 2.8Å; R210-W213 HydrophobicContact CB-CD2 4.45Å; R210-W213 HydrophobicContact CB-CH2 3.93Å; R210-W213 HydrophobicContact CB-CZ2 3.64Å; R210-W213 HydrophobicContact CB-CZ3 4.45Å; R210-W213 HydrophobicContact CG-CH2 4.4Å; R210-W213 HydrophobicContact CG-CZ2 3.62Å; R210-W213 PolarHBondContact O-N 2.98Å; R210-Q214 HydrophobicContact CG-CG 4.39Å; R210-Q214 VanDerWaalsContact O-CG 3.31Å; R210-Q214 WeakPolarHBondContact O-CG 3.48Å; R210-Q214 PolarHBondContact O-N 2.93Å
211	V	95.2	Very high	87.8	Confident	60 Å²	60	53.5 Å²	53.5	36%	0.364	28%	0.279	S	S	.	.	H	α-helix	trans	-55.5	-41.1	174.6	174.7	0	0	0	0	110	D207 H208 Q214 E215	D207-V211 PolarHBondContact O-N 2.86Å; D207-V211 VanDerWaalsContact O-N 3.07Å; H208-V211 PolarHBondContact O-N 3.45Å; V211-Q214 PolarHBondContact O-N 2.82Å; V211-E215 PolarHBondContact O-N 2.84Å
212	Y	95.3	Very high	86.7	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-62	-47	177.8	-176.7	-136.1	0	0	0	113.9	Y159 V162 S163 H208 L209 R210 Q214 E215 L216 Y233 S234 R237	Y159-Y212 AromaticContact CD1-CD1 3.64Å; Y159-Y212 HydrophobicContact CD1-CD1 3.64Å; Y159-Y212 AromaticContact CD1-CE1 3.8Å; Y159-Y212 HydrophobicContact CD1-CE1 3.8Å; Y159-Y212 HydrophobicContact CD1-CG 4.19Å; Y159-Y212 HydrophobicContact CE1-CD1 4.2Å; Y159-Y212 HydrophobicContact CE1-CG 4.37Å; Y159-Y212 HydrophobicContact CG-CD1 4.23Å; Y159-Y212 HydrophobicContact CG-CE1 4.27Å; V162-Y212 HydrophobicContact CG1-CD1 3.99Å; V162-Y212 HydrophobicContact CG1-CE1 4.32Å; S163-Y212 WeakPolarHBondContact OG-CE1 3.31Å; S163-Y212 PolarHBondContact OG-OH 3.47Å; H208-Y212 PolarHBondContact O-N 2.8Å; L209-Y212 WeakPolarHBondContact O-CB 3.35Å; L209-Y212 PolarHBondContact O-N 2.9Å; R210-Y212 PolarHBondContact O-N 2.8Å; Y212-Q214 VanDerWaalsContact C-N 3.31Å; Y212-Q214 PolarHBondContact O-N 2.72Å; Y212-E215 PolarHBondContact O-N 3.4Å; Y212-L216 HydrophobicContact CD1-CD1 4.45Å; Y212-L216 HydrophobicContact CE1-CD1 4.21Å; Y212-L216 HydrophobicContact CE2-CD1 4.49Å; Y212-L216 HydrophobicContact CE2-CG 4.42Å; Y212-L216 WeakPolarHBondContact O-CG 3.29Å; Y212-L216 PolarHBondContact O-N 3.29Å; Y212-L216 VanDerWaalsContact O-N 3.11Å; Y212-Y233 AromaticContact CE2-CD1 3.84Å; Y212-Y233 HydrophobicContact CE2-CD1 3.84Å; Y212-Y233 AromaticContact CE2-CE1 3.45Å; Y212-Y233 HydrophobicContact CE2-CE1 3.45Å; Y212-Y233 VanDerWaalsContact CE2-CE1 3.45Å; Y212-Y233 AromaticContact CZ-CD1 3.93Å; Y212-Y233 WeakPolarHBondContact OH-CD1 3.11Å; Y212-S234 WeakPolarHBondContact OH-CA 3.35Å; Y212-R237 HydrophobicContact CD1-CG 4.46Å; Y212-R237 HydrophobicContact CD2-CB 4.27Å; Y212-R237 HydrophobicContact CD2-CG 3.44Å; Y212-R237 VanDerWaalsContact CD2-CG 3.44Å; Y212-R237 HydrophobicContact CE1-CG 4.5Å; Y212-R237 HydrophobicContact CE2-CB 3.77Å; Y212-R237 HydrophobicContact CE2-CG 3.47Å; Y212-R237 VanDerWaalsContact CE2-CG 3.47Å; Y212-R237 HydrophobicContact CG-CG 3.93Å
213	W	93.7	Very high	85.8	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-71.2	-26.4	177.6	72.3	59.3	0	0	0	113.4	V162 L170 M173 E174 M177 L209 R210 L216 L217	V162-W213 HydrophobicContact CG1-CB 3.7Å; V162-W213 HydrophobicContact CG2-CE3 4.27Å; L170-W213 HydrophobicContact CD2-CB 4.05Å; M173-W213 HydrophobicContact CE-CD2 4.38Å; M173-W213 HydrophobicContact CE-CE3 3.82Å; M173-W213 HydrophobicContact CE-CH2 4.1Å; M173-W213 HydrophobicContact CE-CZ3 3.67Å; E174-W213 PolarHBondContact OE2-NE1 3.17Å; M177-W213 HydrophobicContact CG-CH2 4.36Å; M177-W213 HydrophobicContact CG-CZ2 3.77Å; L209-W213 HydrophobicContact CB-CZ3 4.46Å; L209-W213 HydrophobicContact CD2-CZ3 4.07Å; L209-W213 HydrophobicContact CG-CE3 4.05Å; L209-W213 HydrophobicContact CG-CZ3 3.96Å; L209-W213 PolarHBondContact O-N 3.05Å; L209-W213 VanDerWaalsContact O-N 3.11Å; R210-W213 HydrophobicContact CB-CD2 4.45Å; R210-W213 HydrophobicContact CB-CH2 3.93Å; R210-W213 HydrophobicContact CB-CZ2 3.64Å; R210-W213 HydrophobicContact CB-CZ3 4.45Å; R210-W213 HydrophobicContact CG-CH2 4.4Å; R210-W213 HydrophobicContact CG-CZ2 3.62Å; R210-W213 PolarHBondContact O-N 2.98Å; W213-L216 PolarHBondContact O-N 2.61Å; W213-L217 WeakPolarHBondContact O-CG 3.26Å; W213-L217 PolarHBondContact O-N 3.37Å
214	Q	94	Very high	85.3	Confident	62 Å²	62	66.9 Å²	66.9	29%	0.29	34%	0.341	S	S	.	.	H	α-helix	trans	-64.7	-43.4	172	-72.5	171.4	-24	0	0	110.7	E174 R210 V211 Y212 L216 L217 D218	E174-Q214 VanDerWaalsContact CD-NE2 3.33Å; E174-Q214 PolarHBondContact OE1-NE2 3.09Å; E174-Q214 PolarHBondContact OE2-NE2 3.33Å; R210-Q214 HydrophobicContact CG-CG 4.39Å; R210-Q214 VanDerWaalsContact O-CG 3.31Å; R210-Q214 WeakPolarHBondContact O-CG 3.48Å; R210-Q214 PolarHBondContact O-N 2.93Å; V211-Q214 PolarHBondContact O-N 2.82Å; Y212-Q214 VanDerWaalsContact C-N 3.31Å; Y212-Q214 PolarHBondContact O-N 2.72Å; Q214-L216 VanDerWaalsContact C-N 3.34Å; Q214-L216 PolarHBondContact O-N 2.93Å; Q214-L217 WeakPolarHBondContact O-CB 3.47Å; Q214-L217 PolarHBondContact O-N 3.29Å; Q214-D218 PolarHBondContact O-N 3.06Å
215	E	92.8	Very high	85.2	Confident	65 Å²	65	67.7 Å²	67.7	30%	0.304	34%	0.344	S	S	.	.	H	α-helix	trans	-61.3	-39.7	172.6	-70.8	176.6	-156.1	0	0	112.4	V211 Y212 L217 D218 L219 R237	V211-E215 PolarHBondContact O-N 2.84Å; Y212-E215 PolarHBondContact O-N 3.4Å; E215-L217 VanDerWaalsContact C-N 3.31Å; E215-L217 PolarHBondContact O-N 3.04Å; E215-D218 PolarHBondContact O-N 2.83Å; E215-L219 VanDerWaalsContact O-CG 3.32Å; E215-L219 WeakPolarHBondContact O-CG 3.46Å; E215-L219 PolarHBondContact O-N 2.91Å; E215-R237 IonicContact OE1-CZ 3.82Å; E215-R237 IonicContact OE1-NH1 3.75Å; E215-R237 PolarHBondContact OE1-NH1 2.88Å; E215-R237 IonicContact OE1-NH2 2.76Å; E215-R237 IonicContact OE2-CZ 3.3Å; E215-R237 IonicContact OE2-NH1 3.79Å; E215-R237 PolarHBondContact OE2-NH1 2.85Å
216	L	91.9	Very high	85.3	Confident	16 Å²	16	69.1 Å²	69.1	8%	0.084	36%	0.357	C	S	.	.	H	α-helix	trans	-64.9	-31.7	175	-68.9	173.8	0	0	0	113.2	V162 L170 Y212 W213 Q214 L219 L225 Y233	V162-L216 HydrophobicContact CG1-CD1 3.73Å; L170-L216 HydrophobicContact CD1-CB 3.92Å; L170-L216 HydrophobicContact CD1-CD1 4.31Å; Y212-L216 HydrophobicContact CD1-CD1 4.45Å; Y212-L216 HydrophobicContact CE1-CD1 4.21Å; Y212-L216 HydrophobicContact CE2-CD1 4.49Å; Y212-L216 HydrophobicContact CE2-CG 4.42Å; Y212-L216 WeakPolarHBondContact O-CG 3.29Å; Y212-L216 PolarHBondContact O-N 3.29Å; Y212-L216 VanDerWaalsContact O-N 3.11Å; W213-L216 PolarHBondContact O-N 2.61Å; Q214-L216 VanDerWaalsContact C-N 3.34Å; Q214-L216 PolarHBondContact O-N 2.93Å; L216-L219 HydrophobicContact CD2-CD1 4.45Å; L216-L225 HydrophobicContact CD2-CD1 3.98Å; L216-Y233 HydrophobicContact CD2-CD1 4.24Å; L216-Y233 HydrophobicContact CD2-CE1 3.86Å
217	L	91.1	Very high	85.5	Confident	26 Å²	26	68 Å²	68	14%	0.136	35%	0.351	C	S	.	.	H	α-helix	trans	-69.1	-46.8	171.4	-72.5	170.8	0	0	0	111	L170 E171 E174 W213 Q214 E215 L219 H220	L170-L217 HydrophobicContact CB-CD1 4.38Å; L170-L217 HydrophobicContact CB-CD2 3.67Å; L170-L217 HydrophobicContact CB-CG 3.99Å; E171-L217 HydrophobicContact CG-CD2 3.79Å; E174-L217 HydrophobicContact CB-CD1 4.09Å; E174-L217 HydrophobicContact CG-CD1 4.49Å; W213-L217 WeakPolarHBondContact O-CG 3.26Å; W213-L217 PolarHBondContact O-N 3.37Å; Q214-L217 WeakPolarHBondContact O-CB 3.47Å; Q214-L217 PolarHBondContact O-N 3.29Å; E215-L217 VanDerWaalsContact C-N 3.31Å; E215-L217 PolarHBondContact O-N 3.04Å; L217-L219 VanDerWaalsContact C-N 3.26Å; L217-L219 PolarHBondContact O-N 2.87Å; L217-H220 PolarHBondContact O-N 2.62Å
218	D	87.9	Confident	85.7	Confident	125 Å²	125	68.5 Å²	68.5	67%	0.668	35%	0.351	S	S	*	.	H	α-helix	trans	-63.6	-26.8	-179.2	-82.3	-17.2	0	0	0	113.6	Q214 E215 H220	Q214-D218 PolarHBondContact O-N 3.06Å; E215-D218 PolarHBondContact O-N 2.83Å; D218-H220 PolarHBondContact O-N 2.85Å; D218-H220 PolarHBondContact O-ND1 3.47Å
219	L	80.6	Confident	85.8	Confident	92 Å²	92	71.3 Å²	71.3	48%	0.482	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-9	176.7	-75.4	168.9	0	0	0	114.4	E215 L216 L217 M221	E215-L219 VanDerWaalsContact O-CG 3.32Å; E215-L219 WeakPolarHBondContact O-CG 3.46Å; E215-L219 PolarHBondContact O-N 2.91Å; L216-L219 HydrophobicContact CD2-CD1 4.45Å; L217-L219 VanDerWaalsContact C-N 3.26Å; L217-L219 PolarHBondContact O-N 2.87Å; L219-M221 HydrophobicContact CB-CG 4.17Å; L219-M221 HydrophobicContact CB-SD 4.49Å; L219-M221 PolarHBondContact O-N 2.76Å
220	H	65.2	Low	85.8	Confident	146 Å²	146	70.9 Å²	70.9	68%	0.676	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	35.1	174.5	-72.7	76	0	0	0	114.6	L217 D218 E222	L217-H220 PolarHBondContact O-N 2.62Å; D218-H220 PolarHBondContact O-N 2.85Å; D218-H220 PolarHBondContact O-ND1 3.47Å; H220-E222 PolarHBondContact O-N 3.23Å
221	M	64	Low	85.9	Confident	71 Å²	71	68 Å²	68	35%	0.35	35%	0.351	S	S	.	.			trans	-77.4	90.6	-177.8	-70	-175	59.7	0	0	111.8	L219 M223 G224 L225	L219-M221 HydrophobicContact CB-CG 4.17Å; L219-M221 HydrophobicContact CB-SD 4.49Å; L219-M221 PolarHBondContact O-N 2.76Å; M221-M223 PolarHBondContact O-N 2.94Å; M221-G224 WeakPolarHBondContact CE-O 3.23Å; M221-G224 PolarHBondContact O-N 2.63Å; M221-L225 HydrophobicContact CE-CD2 3.61Å; M221-L225 HydrophobicContact CE-CG 4.02Å; M221-L225 HydrophobicContact SD-CD2 3.94Å; M221-L225 HydrophobicContact SD-CG 4.31Å
222	E	59.6	Low	86.1	Confident	201 Å²	201	67.6 Å²	67.6	94%	0.939	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-26.8	-179.2	-68.8	-171.3	162.1	0	0	114.7	H220	H220-E222 PolarHBondContact O-N 3.23Å
223	M	63.3	Low	86.1	Confident	186 Å²	186	71 Å²	71	92%	0.916	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	0.1	179.9	-60.2	-154.8	-54	0	0	115	M221	M221-M223 PolarHBondContact O-N 2.94Å
224	G	74.4	Confident	86.3	Confident	39 Å²	39	71 Å²	71	40%	0.402	36%	0.359	S	S	.	.			trans	67.2	179.3	-172.8	0	0	0	0	0	114.2	M221	M221-G224 WeakPolarHBondContact CE-O 3.23Å; M221-G224 PolarHBondContact O-N 2.63Å
225	L	84.1	Confident	86.5	Confident	42 Å²	42	68 Å²	68	22%	0.22	35%	0.345	C	S	.	.			trans	-81.8	147.2	174.6	-69.1	163.9	0	0	0	110.4	L216 M221 E229 A230 Y233	L216-L225 HydrophobicContact CD2-CD1 3.98Å; M221-L225 HydrophobicContact CE-CD2 3.61Å; M221-L225 HydrophobicContact CE-CG 4.02Å; M221-L225 HydrophobicContact SD-CD2 3.94Å; M221-L225 HydrophobicContact SD-CG 4.31Å; L225-E229 HydrophobicContact CB-CB 4.4Å; L225-E229 HydrophobicContact CD2-CB 3.99Å; L225-A230 HydrophobicContact CB-CB 4.07Å; L225-A230 HydrophobicContact CD1-CB 4.46Å; L225-Y233 HydrophobicContact CD1-CD1 4.21Å
226	S	92.4	Very high	86.8	Confident	54 Å²	54	68 Å²	68	38%	0.378	35%	0.345	S	S	.	.			trans	-66.7	159.9	162.8	67.7	0	0	0	0	110.6	E228 E229 A230	S226-E228 PolarHBondContact O-N 3.49Å; S226-E229 VanDerWaalsContact CB-OE2 3.22Å; S226-E229 WeakPolarHBondContact CB-OE2 3.4Å; S226-E229 PolarHBondContact N-OE2 2.98Å; S226-E229 PolarHBondContact O-N 3.05Å; S226-E229 WeakPolarHBondContact OG-CB 3.44Å; S226-E229 VanDerWaalsContact OG-CG 3.25Å; S226-E229 WeakPolarHBondContact OG-CG 3.36Å; S226-E229 PolarHBondContact OG-N 3.18Å; S226-E229 PolarHBondContact OG-OE2 2.92Å; S226-A230 VanDerWaalsContact O-CB 3.24Å; S226-A230 WeakPolarHBondContact O-CB 3.16Å; S226-A230 PolarHBondContact O-N 3.27Å
227	I	94.5	Very high	87.1	Confident	43 Å²	43	68.7 Å²	68.7	22%	0.221	35%	0.346	C	S	.	.	H	α-helix	trans	-61.5	-34.9	-179.6	-60.5	170.7	0	0	0	111.2	L164 L231 H280	L164-I227 HydrophobicContact CD2-CB 4.35Å; L164-I227 HydrophobicContact CD2-CG1 3.92Å; L164-I227 HydrophobicContact CD2-CG2 4.4Å; I227-L231 HydrophobicContact CG2-CD1 4Å; I227-L231 HydrophobicContact CG2-CG 4.47Å; I227-L231 WeakPolarHBondContact O-CB 3.22Å; I227-L231 WeakPolarHBondContact O-CD1 3.45Å; I227-L231 VanDerWaalsContact O-CG 3.24Å; I227-L231 WeakPolarHBondContact O-CG 3.4Å; I227-L231 PolarHBondContact O-N 2.93Å; I227-H280 HydrophobicContact CG2-CB 4.15Å
228	E	96.2	Very high	87.4	Confident	99 Å²	99	67.5 Å²	67.5	46%	0.463	34%	0.34	S	S	.	.	H	α-helix	trans	-64.3	-52	175.2	-178.6	170.4	179.4	0	0	111.8	S226 A230 L231 M232 V395	S226-E228 PolarHBondContact O-N 3.49Å; E228-A230 VanDerWaalsContact C-N 3.35Å; E228-A230 PolarHBondContact O-N 3.43Å; E228-L231 PolarHBondContact O-N 2.92Å; E228-M232 HydrophobicContact CG-SD 4.37Å; E228-M232 WeakPolarHBondContact O-CG 3.28Å; E228-M232 PolarHBondContact O-N 3.28Å; E228-V395 HydrophobicContact CB-CG1 4.41Å; E228-V395 HydrophobicContact CG-CB 4.05Å; E228-V395 HydrophobicContact CG-CG1 4.11Å; E228-V395 HydrophobicContact CG-CG2 4.47Å
229	E	95.1	Very high	87.9	Confident	101 Å²	101	62.4 Å²	62.4	47%	0.472	31%	0.313	S	S	.	.	H	α-helix	trans	-62.3	-40.8	176.4	-67.3	160.6	140.7	0	0	111.8	L225 S226 L231 M232 Y233	L225-E229 HydrophobicContact CB-CB 4.4Å; L225-E229 HydrophobicContact CD2-CB 3.99Å; S226-E229 VanDerWaalsContact CB-OE2 3.22Å; S226-E229 WeakPolarHBondContact CB-OE2 3.4Å; S226-E229 PolarHBondContact N-OE2 2.98Å; S226-E229 PolarHBondContact O-N 3.05Å; S226-E229 WeakPolarHBondContact OG-CB 3.44Å; S226-E229 VanDerWaalsContact OG-CG 3.25Å; S226-E229 WeakPolarHBondContact OG-CG 3.36Å; S226-E229 PolarHBondContact OG-N 3.18Å; S226-E229 PolarHBondContact OG-OE2 2.92Å; E229-L231 PolarHBondContact O-N 3.02Å; E229-M232 PolarHBondContact O-N 3.11Å; E229-Y233 WeakPolarHBondContact O-CB 3.45Å; E229-Y233 PolarHBondContact O-N 2.95Å
230	A	95.9	Very high	88.7	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.5	-42	177.2	0	0	0	0	0	111.9	L164 L225 S226 E228 S234	L164-A230 HydrophobicContact CD2-CB 3.74Å; L164-A230 HydrophobicContact CG-CB 4.26Å; L225-A230 HydrophobicContact CB-CB 4.07Å; L225-A230 HydrophobicContact CD1-CB 4.46Å; S226-A230 VanDerWaalsContact O-CB 3.24Å; S226-A230 WeakPolarHBondContact O-CB 3.16Å; S226-A230 PolarHBondContact O-N 3.27Å; E228-A230 VanDerWaalsContact C-N 3.35Å; E228-A230 PolarHBondContact O-N 3.43Å; A230-S234 WeakPolarHBondContact O-CB 3.15Å; A230-S234 PolarHBondContact O-N 3.18Å; A230-S234 PolarHBondContact O-OG 3.44Å
231	L	97.8	Very high	90.2	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.4	-51	174.5	-74.4	165.7	0	0	0	111.1	V160 I227 E228 E229 Y233 S234 F235 M271 H280 A282 V395	V160-L231 HydrophobicContact CG1-CD2 3.8Å; V160-L231 HydrophobicContact CG2-CD2 3.97Å; I227-L231 HydrophobicContact CG2-CD1 4Å; I227-L231 HydrophobicContact CG2-CG 4.47Å; I227-L231 WeakPolarHBondContact O-CB 3.22Å; I227-L231 WeakPolarHBondContact O-CD1 3.45Å; I227-L231 VanDerWaalsContact O-CG 3.24Å; I227-L231 WeakPolarHBondContact O-CG 3.4Å; I227-L231 PolarHBondContact O-N 2.93Å; E228-L231 PolarHBondContact O-N 2.92Å; E229-L231 PolarHBondContact O-N 3.02Å; L231-Y233 PolarHBondContact O-N 3.42Å; L231-S234 PolarHBondContact O-N 3.44Å; L231-F235 WeakPolarHBondContact O-CD2 3.33Å; L231-F235 PolarHBondContact O-N 3.35Å; L231-M271 HydrophobicContact CD2-CE 4.29Å; L231-M271 HydrophobicContact CD2-SD 4.39Å; L231-H280 HydrophobicContact CD1-CB 3.71Å; L231-A282 HydrophobicContact CB-CB 4.19Å; L231-A282 HydrophobicContact CD1-CB 4.29Å; L231-A282 HydrophobicContact CD2-CB 4.21Å; L231-A282 HydrophobicContact CG-CB 4.47Å; L231-V395 HydrophobicContact CB-CG2 4.19Å; L231-V395 HydrophobicContact CD1-CG1 4.04Å
232	M	97.8	Very high	91.7	Very high	51 Å²	51	50.6 Å²	50.6	25%	0.251	26%	0.261	S	S	.	.	H	α-helix	trans	-58.3	-49.2	179.5	-69.3	178.8	70.5	0	0	112.1	E228 E229 S234 F235 Q236 E392 P393 V395	E228-M232 HydrophobicContact CG-SD 4.37Å; E228-M232 WeakPolarHBondContact O-CG 3.28Å; E228-M232 PolarHBondContact O-N 3.28Å; E229-M232 PolarHBondContact O-N 3.11Å; M232-S234 PolarHBondContact O-N 3.32Å; M232-F235 PolarHBondContact O-N 2.84Å; M232-Q236 WeakPolarHBondContact O-CG 3.32Å; M232-Q236 PolarHBondContact O-N 2.93Å; M232-Q236 VanDerWaalsContact O-N 3.08Å; M232-E392 HydrophobicContact CE-CG 4.07Å; M232-E392 VanDerWaalsContact CE-OE1 3.23Å; M232-E392 WeakPolarHBondContact CE-OE1 3.2Å; M232-P393 HydrophobicContact CG-CG 4.29Å; M232-V395 HydrophobicContact CG-CG2 3.78Å
233	Y	96.3	Very high	93.4	Very high	71 Å²	71	42.1 Å²	42.1	28%	0.278	22%	0.224	S	C	.	.	H	α-helix	trans	-67	-36.7	-177.5	-168.9	-127.2	0	0	0	112.1	Y212 L216 L225 E229 L231 R237	Y212-Y233 AromaticContact CE2-CD1 3.84Å; Y212-Y233 HydrophobicContact CE2-CD1 3.84Å; Y212-Y233 AromaticContact CE2-CE1 3.45Å; Y212-Y233 HydrophobicContact CE2-CE1 3.45Å; Y212-Y233 VanDerWaalsContact CE2-CE1 3.45Å; Y212-Y233 AromaticContact CZ-CD1 3.93Å; Y212-Y233 WeakPolarHBondContact OH-CD1 3.11Å; L216-Y233 HydrophobicContact CD2-CD1 4.24Å; L216-Y233 HydrophobicContact CD2-CE1 3.86Å; L225-Y233 HydrophobicContact CD1-CD1 4.21Å; E229-Y233 WeakPolarHBondContact O-CB 3.45Å; E229-Y233 PolarHBondContact O-N 2.95Å; L231-Y233 PolarHBondContact O-N 3.42Å; Y233-R237 WeakPolarHBondContact O-CB 3.45Å; Y233-R237 PolarHBondContact O-N 2.88Å
234	S	98	Very high	94.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.2	-39.4	177.4	-61	0	0	0	0	112.9	Y159 V160 S163 Y212 A230 L231 M232 L238	Y159-S234 PolarHBondContact O-OG 2.92Å; V160-S234 WeakPolarHBondContact CA-OG 3.39Å; V160-S234 PolarHBondContact N-OG 3.48Å; S163-S234 WeakPolarHBondContact CB-OG 3.29Å; S163-S234 PolarHBondContact OG-OG 2.93Å; Y212-S234 WeakPolarHBondContact OH-CA 3.35Å; A230-S234 WeakPolarHBondContact O-CB 3.15Å; A230-S234 PolarHBondContact O-N 3.18Å; A230-S234 PolarHBondContact O-OG 3.44Å; L231-S234 PolarHBondContact O-N 3.44Å; M232-S234 PolarHBondContact O-N 3.32Å; S234-L238 WeakPolarHBondContact O-CB 3.33Å; S234-L238 PolarHBondContact O-N 3.32Å
235	F	98.6	Very high	95.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66	-52.2	175.1	-84	-125.4	0	0	0	110.8	L156 L231 M232 R237 L238 D239 A269 M271 A282 A284 F348 A391 P393	L156-F235 HydrophobicContact CD1-CD2 3.69Å; L156-F235 HydrophobicContact CD1-CE2 4.07Å; L156-F235 HydrophobicContact CD1-CG 4.1Å; L156-F235 HydrophobicContact CD2-CD2 4.14Å; L156-F235 HydrophobicContact CD2-CE1 4.22Å; L156-F235 HydrophobicContact CD2-CE2 3.71Å; L156-F235 HydrophobicContact CD2-CZ 3.76Å; L156-F235 HydrophobicContact CG-CD2 4.37Å; L156-F235 HydrophobicContact CG-CE2 4.25Å; L231-F235 WeakPolarHBondContact O-CD2 3.33Å; L231-F235 PolarHBondContact O-N 3.35Å; M232-F235 PolarHBondContact O-N 2.84Å; F235-R237 VanDerWaalsContact C-N 3.29Å; F235-R237 PolarHBondContact O-N 3.02Å; F235-L238 PolarHBondContact O-N 3.01Å; F235-D239 PolarHBondContact O-N 3.35Å; F235-D239 VanDerWaalsContact O-N 3.14Å; F235-A269 HydrophobicContact CE1-CB 3.84Å; F235-A269 HydrophobicContact CZ-CB 4.39Å; F235-M271 HydrophobicContact CE2-CB 4.49Å; F235-M271 HydrophobicContact CE2-SD 4.13Å; F235-M271 HydrophobicContact CZ-CB 4.06Å; F235-A282 HydrophobicContact CE1-CB 4.48Å; F235-A282 HydrophobicContact CE2-CB 3.74Å; F235-A282 HydrophobicContact CZ-CB 3.63Å; F235-A284 HydrophobicContact CD1-CB 4.05Å; F235-A284 HydrophobicContact CE1-CB 4.01Å; F235-F348 HydrophobicContact CB-CE1 4.49Å; F235-F348 HydrophobicContact CB-CZ 3.85Å; F235-F348 AromaticContact CD1-CE2 3.55Å; F235-F348 HydrophobicContact CD1-CE2 3.55Å; F235-F348 AromaticContact CD1-CZ 3.46Å; F235-F348 HydrophobicContact CD1-CZ 3.46Å; F235-F348 VanDerWaalsContact CD1-CZ 3.46Å; F235-F348 AromaticContact CE1-CE2 3.96Å; F235-F348 HydrophobicContact CE1-CE2 3.96Å; F235-F348 HydrophobicContact CE1-CZ 4.22Å; F235-F348 HydrophobicContact CG-CE2 4.27Å; F235-F348 AromaticContact CG-CZ 3.71Å; F235-F348 HydrophobicContact CG-CZ 3.71Å; F235-F348 VanDerWaalsContact O-CE1 3.28Å; F235-F348 WeakPolarHBondContact O-CE1 3.39Å; F235-A391 WeakPolarHBondContact CD1-O 3.39Å; F235-P393 HydrophobicContact CB-CG 3.98Å; F235-P393 HydrophobicContact CD1-CB 3.76Å; F235-P393 HydrophobicContact CD1-CG 3.76Å; F235-P393 HydrophobicContact CD2-CG 4Å; F235-P393 HydrophobicContact CE1-CB 3.77Å; F235-P393 HydrophobicContact CE1-CG 4.15Å; F235-P393 HydrophobicContact CE2-CG 4.36Å; F235-P393 HydrophobicContact CG-CB 4.21Å; F235-P393 HydrophobicContact CG-CG 3.67Å; F235-P393 HydrophobicContact CZ-CB 4.21Å; F235-P393 HydrophobicContact CZ-CG 4.43Å
236	Q	98	Very high	95.6	Very high	66 Å²	66	33.9 Å²	33.9	31%	0.308	17%	0.174	S	C	.	.	H	α-helix	trans	-59.4	-39.6	178.4	-72.1	175.4	-28.9	0	0	112.1	M232 S240 E392	M232-Q236 WeakPolarHBondContact O-CG 3.32Å; M232-Q236 PolarHBondContact O-N 2.93Å; M232-Q236 VanDerWaalsContact O-N 3.08Å; Q236-S240 WeakPolarHBondContact O-CB 3.38Å; Q236-S240 PolarHBondContact O-N 2.96Å; Q236-S240 VanDerWaalsContact O-N 3.07Å; Q236-S240 PolarHBondContact O-OG 3.23Å; Q236-E392 HydrophobicContact CG-CB 4Å; Q236-E392 HydrophobicContact CG-CG 4.26Å; Q236-E392 PolarHBondContact NE2-OE2 2.53Å
237	R	97.8	Very high	95.3	Very high	30 Å²	30	34.1 Å²	34.1	11%	0.113	17%	0.169	C	C	.	.	H	α-helix	trans	-64.2	-51.8	176.8	178.7	72.4	-160.8	-166.4	2.2	111.6	Y159 Y212 E215 Y233 F235 D239 S240 D241	Y159-R237 HydrophobicContact CD1-CB 4.25Å; Y159-R237 HydrophobicContact CD1-CG 3.8Å; Y159-R237 HydrophobicContact CE1-CG 3.76Å; Y212-R237 HydrophobicContact CD1-CG 4.46Å; Y212-R237 HydrophobicContact CD2-CB 4.27Å; Y212-R237 HydrophobicContact CD2-CG 3.44Å; Y212-R237 VanDerWaalsContact CD2-CG 3.44Å; Y212-R237 HydrophobicContact CE1-CG 4.5Å; Y212-R237 HydrophobicContact CE2-CB 3.77Å; Y212-R237 HydrophobicContact CE2-CG 3.47Å; Y212-R237 VanDerWaalsContact CE2-CG 3.47Å; Y212-R237 HydrophobicContact CG-CG 3.93Å; E215-R237 IonicContact OE1-CZ 3.82Å; E215-R237 IonicContact OE1-NH1 3.75Å; E215-R237 PolarHBondContact OE1-NH1 2.88Å; E215-R237 IonicContact OE1-NH2 2.76Å; E215-R237 IonicContact OE2-CZ 3.3Å; E215-R237 IonicContact OE2-NH1 3.79Å; E215-R237 PolarHBondContact OE2-NH1 2.85Å; Y233-R237 WeakPolarHBondContact O-CB 3.45Å; Y233-R237 PolarHBondContact O-N 2.88Å; F235-R237 VanDerWaalsContact C-N 3.29Å; F235-R237 PolarHBondContact O-N 3.02Å; R237-D239 VanDerWaalsContact C-N 3.29Å; R237-D239 PolarHBondContact O-N 3.28Å; R237-S240 CarbonylContact O-C 3.58Å; R237-S240 WeakPolarHBondContact O-CA 3.2Å; R237-S240 VanDerWaalsContact O-CB 3.31Å; R237-S240 WeakPolarHBondContact O-CB 3.49Å; R237-S240 PolarHBondContact O-N 3.13Å; R237-D241 IonicContact CZ-OD1 2.63Å; R237-D241 IonicContact CZ-OD2 3.96Å; R237-D241 IonicContact NE-OD1 2.78Å; R237-D241 PolarHBondContact NE-OD1 3.04Å; R237-D241 IonicContact NE-OD2 3.03Å; R237-D241 PolarHBondContact NE-OD2 3.15Å; R237-D241 IonicContact NH2-OD1 3.99Å; R237-D241 PolarHBondContact NH2-OD1 2.93Å; R237-D241 IonicContact NH2-OD2 3.73Å; R237-D241 PolarHBondContact NH2-OD2 2.91Å; R237-D241 PolarHBondContact O-N 2.88Å
238	L	98.4	Very high	94.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.6	-41.5	-177.2	172.2	62.6	0	0	0	111.7	V152 R155 L156 Y159 S234 F235 S240 D241 I242 F348	V152-L238 HydrophobicContact CG1-CD2 4.21Å; V152-L238 HydrophobicContact CG2-CD2 4.37Å; R155-L238 HydrophobicContact CB-CD1 3.75Å; R155-L238 HydrophobicContact CB-CD2 4.14Å; R155-L238 HydrophobicContact CG-CD1 4.46Å; L156-L238 HydrophobicContact CB-CD2 3.73Å; L156-L238 HydrophobicContact CD1-CD2 3.82Å; L156-L238 HydrophobicContact CG-CD2 4.37Å; Y159-L238 HydrophobicContact CD1-CB 4.21Å; Y159-L238 HydrophobicContact CD2-CD1 4.37Å; Y159-L238 HydrophobicContact CE1-CB 4.38Å; Y159-L238 HydrophobicContact CE2-CD1 3.99Å; Y159-L238 HydrophobicContact CG-CB 4.37Å; S234-L238 WeakPolarHBondContact O-CB 3.33Å; S234-L238 PolarHBondContact O-N 3.32Å; F235-L238 PolarHBondContact O-N 3.01Å; L238-S240 VanDerWaalsContact C-N 3.31Å; L238-S240 PolarHBondContact O-N 3.14Å; L238-D241 PolarHBondContact O-N 3.18Å; L238-I242 HydrophobicContact CD1-CD1 4.14Å; L238-I242 HydrophobicContact CD1-CG1 4.33Å; L238-I242 HydrophobicContact CG-CD1 4.05Å; L238-I242 WeakPolarHBondContact O-CG1 3.18Å; L238-I242 PolarHBondContact O-N 2.96Å; L238-F348 HydrophobicContact CB-CE1 4.02Å; L238-F348 HydrophobicContact CD2-CD1 4.44Å; L238-F348 HydrophobicContact CD2-CE1 3.91Å; L238-F348 HydrophobicContact CD2-CZ 4.45Å; L238-F348 HydrophobicContact CG-CD1 4.39Å; L238-F348 HydrophobicContact CG-CE1 4Å
239	D	98.4	Very high	93.5	Very high	19 Å²	19	35.4 Å²	35.4	10%	0.102	19%	0.193	C	C	.	.	H	α-helix	trans	-65	-36.2	175.2	-165.9	57	0	0	0	112.4	F235 R237 S243 F348 G349 K354 A391	F235-D239 PolarHBondContact O-N 3.35Å; F235-D239 VanDerWaalsContact O-N 3.14Å; R237-D239 VanDerWaalsContact C-N 3.29Å; R237-D239 PolarHBondContact O-N 3.28Å; D239-S243 WeakPolarHBondContact O-CB 3.38Å; D239-S243 PolarHBondContact O-N 3.04Å; D239-F348 HydrophobicContact CB-CD1 3.8Å; D239-F348 HydrophobicContact CB-CE1 4.12Å; D239-F348 WeakPolarHBondContact OD1-CA 3.5Å; D239-G349 PolarHBondContact OD1-N 3.37Å; D239-K354 IonicContact OD1-NZ 2.76Å; D239-K354 PolarHBondContact OD1-NZ 3.03Å; D239-K354 WeakPolarHBondContact OD2-CE 3.34Å; D239-K354 IonicContact OD2-NZ 2.64Å; D239-K354 PolarHBondContact OD2-NZ 2.84Å; D239-A391 HydrophobicContact CB-CB 3.5Å; D239-A391 VanDerWaalsContact CB-CB 3.5Å
240	S	96.9	Very high	92.6	Very high	58 Å²	58	32.6 Å²	32.6	41%	0.406	18%	0.181	S	C	.	.	H	α-helix	trans	-65.2	-43.5	173.3	-58.8	0	0	0	0	112	Q236 R237 L238 S243 L244	Q236-S240 WeakPolarHBondContact O-CB 3.38Å; Q236-S240 PolarHBondContact O-N 2.96Å; Q236-S240 VanDerWaalsContact O-N 3.07Å; Q236-S240 PolarHBondContact O-OG 3.23Å; R237-S240 CarbonylContact O-C 3.58Å; R237-S240 WeakPolarHBondContact O-CA 3.2Å; R237-S240 VanDerWaalsContact O-CB 3.31Å; R237-S240 WeakPolarHBondContact O-CB 3.49Å; R237-S240 PolarHBondContact O-N 3.13Å; L238-S240 VanDerWaalsContact C-N 3.31Å; L238-S240 PolarHBondContact O-N 3.14Å; S240-S243 WeakPolarHBondContact O-CB 3.29Å; S240-S243 PolarHBondContact O-N 3.3Å; S240-L244 WeakPolarHBondContact O-CB 3.36Å; S240-L244 VanDerWaalsContact O-CG 3.25Å; S240-L244 WeakPolarHBondContact O-CG 3.26Å; S240-L244 PolarHBondContact O-N 3.28Å
241	D	96.3	Very high	91.5	Very high	1 Å²	1	42 Å²	42	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-67.3	-41.1	177.2	-74.9	-39	0	0	0	111.8	Y159 H208 R237 L238 S243 L244 E245	Y159-D241 WeakPolarHBondContact CE1-OD2 3.23Å; Y159-D241 PolarHBondContact OH-OD2 2.91Å; H208-D241 IonicContact CD2-OD1 2.83Å; R237-D241 IonicContact CZ-OD1 2.63Å; R237-D241 IonicContact CZ-OD2 3.96Å; R237-D241 IonicContact NE-OD1 2.78Å; R237-D241 PolarHBondContact NE-OD1 3.04Å; R237-D241 IonicContact NE-OD2 3.03Å; R237-D241 PolarHBondContact NE-OD2 3.15Å; R237-D241 IonicContact NH2-OD1 3.99Å; R237-D241 PolarHBondContact NH2-OD1 2.93Å; R237-D241 IonicContact NH2-OD2 3.73Å; R237-D241 PolarHBondContact NH2-OD2 2.91Å; R237-D241 PolarHBondContact O-N 2.88Å; L238-D241 PolarHBondContact O-N 3.18Å; D241-S243 VanDerWaalsContact C-N 3.26Å; D241-S243 PolarHBondContact O-N 3.32Å; D241-L244 PolarHBondContact O-N 3.04Å; D241-L244 VanDerWaalsContact O-N 3.08Å; D241-E245 WeakPolarHBondContact O-CB 3.49Å; D241-E245 VanDerWaalsContact O-CG 3.31Å; D241-E245 WeakPolarHBondContact O-CG 3.27Å; D241-E245 PolarHBondContact O-N 2.91Å
242	I	95.6	Very high	90.9	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-55.3	-43.5	170.8	-73.7	165.6	0	0	0	111	V152 L238 V262 A263 F348	V152-I242 HydrophobicContact CG2-CD1 4.11Å; L238-I242 HydrophobicContact CD1-CD1 4.14Å; L238-I242 HydrophobicContact CD1-CG1 4.33Å; L238-I242 HydrophobicContact CG-CD1 4.05Å; L238-I242 WeakPolarHBondContact O-CG1 3.18Å; L238-I242 PolarHBondContact O-N 2.96Å; I242-V262 HydrophobicContact CD1-CG1 4.3Å; I242-V262 HydrophobicContact CG1-CG1 4.1Å; I242-V262 HydrophobicContact CG2-CG1 3.93Å; I242-A263 HydrophobicContact CG2-CB 4.22Å; I242-F348 HydrophobicContact CD1-CD1 4.49Å
243	S	94.8	Very high	90.3	Very high	24 Å²	24	49 Å²	49	17%	0.168	26%	0.26	C	S	.	.	H	α-helix	trans	-66.9	-34.2	176.6	170.7	0	0	0	0	112.9	D239 S240 D241 I246 Q247 W355	D239-S243 WeakPolarHBondContact O-CB 3.38Å; D239-S243 PolarHBondContact O-N 3.04Å; S240-S243 WeakPolarHBondContact O-CB 3.29Å; S240-S243 PolarHBondContact O-N 3.3Å; D241-S243 VanDerWaalsContact C-N 3.26Å; D241-S243 PolarHBondContact O-N 3.32Å; S243-I246 WeakPolarHBondContact O-CG2 3.49Å; S243-Q247 WeakPolarHBondContact O-CG 3.18Å; S243-Q247 PolarHBondContact O-NE2 3.13Å; S243-Q247 PolarHBondContact OG-NE2 2.96Å; S243-W355 PolarHBondContact OG-NE1 3.33Å
244	L	92.3	Very high	89.8	Confident	85 Å²	85	49.9 Å²	49.9	45%	0.445	27%	0.272	S	S	.	.	H	α-helix	trans	-81.8	-36.7	-178.5	-72.6	170.1	0	0	0	113.4	S240 D241 I246 Q247 A248	S240-L244 WeakPolarHBondContact O-CB 3.36Å; S240-L244 VanDerWaalsContact O-CG 3.25Å; S240-L244 WeakPolarHBondContact O-CG 3.26Å; S240-L244 PolarHBondContact O-N 3.28Å; D241-L244 PolarHBondContact O-N 3.04Å; D241-L244 VanDerWaalsContact O-N 3.08Å; L244-I246 PolarHBondContact O-N 2.76Å; L244-Q247 WeakPolarHBondContact O-CA 3.48Å; L244-Q247 WeakPolarHBondContact O-CB 3.29Å; L244-Q247 PolarHBondContact O-N 2.98Å; L244-A248 PolarHBondContact O-N 2.88Å; L244-A248 VanDerWaalsContact O-N 3.09Å
245	E	90.2	Very high	89.2	Confident	6 Å²	6	50.5 Å²	50.5	3%	0.028	28%	0.276	C	S	.	.	H	α-helix	trans	-51.1	-43.5	179.7	-85.1	166.8	-155.1	0	0	112.7	R155 H208 D241 L250	R155-E245 IonicContact CZ-OE1 3.05Å; R155-E245 VanDerWaalsContact NH1-CD 3.27Å; R155-E245 IonicContact NH1-OE1 3.79Å; R155-E245 PolarHBondContact NH1-OE1 3.28Å; R155-E245 IonicContact NH1-OE2 2.7Å; R155-E245 PolarHBondContact NH1-OE2 3.28Å; R155-E245 IonicContact NH2-OE1 3.18Å; R155-E245 PolarHBondContact NH2-OE1 3.08Å; H208-E245 VanDerWaalsContact CE1-CG 3.42Å; H208-E245 WeakPolarHBondContact CE1-CG 3.29Å; H208-E245 IonicContact CE1-OE1 3.84Å; H208-E245 IonicContact CG-OE1 2.91Å; H208-E245 IonicContact ND1-OE1 3.89Å; H208-E245 WeakPolarHBondContact NE2-CG 3.39Å; D241-E245 WeakPolarHBondContact O-CB 3.49Å; D241-E245 VanDerWaalsContact O-CG 3.31Å; D241-E245 WeakPolarHBondContact O-CG 3.27Å; D241-E245 PolarHBondContact O-N 2.91Å; E245-L250 WeakPolarHBondContact O-CD1 3.46Å
246	I	87.4	Confident	88.6	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-19.5	-179.8	-176.1	56.1	0	0	0	113.5	S243 L244 L260 A263 W355 V363 R366 F368	S243-I246 WeakPolarHBondContact O-CG2 3.49Å; L244-I246 PolarHBondContact O-N 2.76Å; I246-L260 HydrophobicContact CD1-CB 3.71Å; I246-L260 HydrophobicContact CD1-CD1 3.74Å; I246-L260 HydrophobicContact CD1-CG 4.31Å; I246-L260 HydrophobicContact CG1-CB 4.37Å; I246-L260 HydrophobicContact CG1-CD1 3.78Å; I246-A263 HydrophobicContact CG2-CB 3.88Å; I246-W355 HydrophobicContact CG1-CH2 4.4Å; I246-W355 HydrophobicContact CG2-CH2 3.46Å; I246-W355 VanDerWaalsContact CG2-CH2 3.46Å; I246-W355 HydrophobicContact CG2-CZ2 3.55Å; I246-V363 HydrophobicContact CD1-CG1 4.32Å; I246-V363 HydrophobicContact CG1-CG1 3.82Å; I246-R366 PolarHBondContact O-NH1 3.33Å; I246-F368 HydrophobicContact CD1-CE1 4.46Å; I246-F368 HydrophobicContact CD1-CE2 4.33Å; I246-F368 HydrophobicContact CD1-CZ 3.69Å
247	Q	85.2	Confident	88.2	Confident	59 Å²	59	52 Å²	52	28%	0.276	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-30.4	173.5	-70.3	178.5	69.1	0	0	111.6	S243 L244 W355 L359 R366	S243-Q247 WeakPolarHBondContact O-CG 3.18Å; S243-Q247 PolarHBondContact O-NE2 3.13Å; S243-Q247 PolarHBondContact OG-NE2 2.96Å; L244-Q247 WeakPolarHBondContact O-CA 3.48Å; L244-Q247 WeakPolarHBondContact O-CB 3.29Å; L244-Q247 PolarHBondContact O-N 2.98Å; Q247-W355 HydrophobicContact CG-CZ2 4.3Å; Q247-L359 HydrophobicContact CG-CD1 4.21Å; Q247-R366 PolarHBondContact O-NH1 2.91Å; Q247-R366 PolarHBondContact O-NH2 3.2Å
248	A	81.9	Confident	87.8	Confident	45 Å²	45	51.8 Å²	51.8	37%	0.372	28%	0.282	S	S	.	.	S	Bend	trans	-65.5	148.1	173.8	0	0	0	0	0	112.8	L244 L250	L244-A248 PolarHBondContact O-N 2.88Å; L244-A248 VanDerWaalsContact O-N 3.09Å; A248-L250 PolarHBondContact O-N 2.76Å; A248-L250 VanDerWaalsContact O-N 3.15Å
249	P	70.6	Confident	87.5	Confident	125 Å²	125	52 Å²	52	81%	0.812	28%	0.284	S	S	*	.			trans	-78.4	94.9	173.1	31.4	-32.6	0	0	0	110.5
250	L	75.9	Confident	87.1	Confident	42 Å²	42	51.1 Å²	51.1	22%	0.22	28%	0.279	C	S	.	.			trans	-82.2	126.7	173.6	-66.5	163.9	0	0	0	110.8	E245 A248 T255 R256	E245-L250 WeakPolarHBondContact O-CD1 3.46Å; A248-L250 PolarHBondContact O-N 2.76Å; A248-L250 VanDerWaalsContact O-N 3.15Å; L250-T255 HydrophobicContact CD1-CG2 4.14Å; L250-T255 HydrophobicContact CD2-CG2 4.2Å; L250-R256 HydrophobicContact CB-CB 3.86Å; L250-R256 HydrophobicContact CB-CG 4.06Å; L250-R256 HydrophobicContact CD1-CB 4.29Å; L250-R256 HydrophobicContact CD1-CG 4.5Å
251	E	73.4	Confident	86.9	Confident	198 Å²	198	51.3 Å²	51.3	93%	0.925	27%	0.273	S	S	*	.	S	Bend	trans	-76.4	-36	179.1	-63.5	-168.9	163.9	0	0	112.9
252	D	84.9	Confident	86.8	Confident	79 Å²	79	51.5 Å²	51.5	42%	0.422	28%	0.275	S	S	.	.			trans	-78	125.7	178.9	173.1	48.5	0	0	0	111.9	V254 T255 R256	D252-V254 PolarHBondContact O-N 3.25Å; D252-V254 PolarHBondContact OD1-N 2.85Å; D252-V254 PolarHBondContact OD2-N 2.91Å; D252-T255 VanDerWaalsContact OD2-CB 3.23Å; D252-T255 WeakPolarHBondContact OD2-CB 3.27Å; D252-T255 PolarHBondContact OD2-N 3.26Å; D252-T255 PolarHBondContact OD2-OG1 2.68Å; D252-R256 WeakPolarHBondContact O-CB 3.27Å; D252-R256 PolarHBondContact O-N 3.16Å
253	E	85.1	Confident	86.8	Confident	119 Å²	119	51.5 Å²	51.5	56%	0.556	28%	0.275	S	S	*	.	H	α-helix	trans	-67.1	-35.3	-178.1	176.6	165.5	-154.4	0	0	112.7	R256 N257	E253-R256 IonicContact OE1-NH2 3.49Å; E253-N257 WeakPolarHBondContact CG-ND2 3.32Å; E253-N257 VanDerWaalsContact O-CB 3.26Å; E253-N257 WeakPolarHBondContact O-CB 3.17Å; E253-N257 PolarHBondContact O-N 3.2Å; E253-N257 PolarHBondContact O-ND2 2.7Å
254	V	85	Confident	86.7	Confident	89 Å²	89	51.1 Å²	51.1	54%	0.539	27%	0.27	S	S	.	.	H	α-helix	trans	-68.3	-53.6	-178.3	179.7	0	0	0	0	110.1	D252 R256 N257 L258	D252-V254 PolarHBondContact O-N 3.25Å; D252-V254 PolarHBondContact OD1-N 2.85Å; D252-V254 PolarHBondContact OD2-N 2.91Å; V254-R256 VanDerWaalsContact C-N 3.34Å; V254-R256 PolarHBondContact O-N 2.99Å; V254-N257 PolarHBondContact O-N 2.98Å; V254-L258 WeakPolarHBondContact O-CB 3.23Å; V254-L258 PolarHBondContact O-N 3.09Å
255	T	85.8	Confident	86.9	Confident	13 Å²	13	47.2 Å²	47.2	8%	0.08	25%	0.25	C	C	.	.	H	α-helix	trans	-55.4	-48.6	175	-57.6	0	0	0	0	110.8	V201 V204 L250 D252 N257 L258 S259	V201-T255 HydrophobicContact CG1-CG2 3.94Å; V204-T255 HydrophobicContact CG2-CG2 4.06Å; L250-T255 HydrophobicContact CD1-CG2 4.14Å; L250-T255 HydrophobicContact CD2-CG2 4.2Å; D252-T255 VanDerWaalsContact OD2-CB 3.23Å; D252-T255 WeakPolarHBondContact OD2-CB 3.27Å; D252-T255 PolarHBondContact OD2-N 3.26Å; D252-T255 PolarHBondContact OD2-OG1 2.68Å; T255-N257 PolarHBondContact O-N 2.85Å; T255-L258 PolarHBondContact O-N 3.49Å; T255-S259 PolarHBondContact O-N 3.47Å; T255-S259 PolarHBondContact O-OG 3.36Å
256	R	87.4	Confident	87.2	Confident	63 Å²	63	47 Å²	47	24%	0.238	25%	0.249	C	C	.	.	H	α-helix	trans	-62.1	-40.3	-179.1	-168.2	-166	64.6	-152.4	-4.7	112.8	L250 D252 E253 V254 L260 F368	L250-R256 HydrophobicContact CB-CB 3.86Å; L250-R256 HydrophobicContact CB-CG 4.06Å; L250-R256 HydrophobicContact CD1-CB 4.29Å; L250-R256 HydrophobicContact CD1-CG 4.5Å; D252-R256 WeakPolarHBondContact O-CB 3.27Å; D252-R256 PolarHBondContact O-N 3.16Å; E253-R256 IonicContact OE1-NH2 3.49Å; V254-R256 VanDerWaalsContact C-N 3.34Å; V254-R256 PolarHBondContact O-N 2.99Å; R256-L260 PolarHBondContact O-N 3.41Å; R256-F368 HydrophobicContact CG-CE1 3.66Å; R256-F368 HydrophobicContact CG-CZ 3.69Å
257	N	89.1	Confident	87.7	Confident	33 Å²	33	46.9 Å²	46.9	18%	0.176	25%	0.248	C	C	.	.	H	α-helix	trans	-71.4	-38.6	177.2	-70.2	-13.2	0	0	0	111.5	E253 V254 T255 L260 Q261 L373	E253-N257 WeakPolarHBondContact CG-ND2 3.32Å; E253-N257 VanDerWaalsContact O-CB 3.26Å; E253-N257 WeakPolarHBondContact O-CB 3.17Å; E253-N257 PolarHBondContact O-N 3.2Å; E253-N257 PolarHBondContact O-ND2 2.7Å; V254-N257 PolarHBondContact O-N 2.98Å; T255-N257 PolarHBondContact O-N 2.85Å; N257-L260 PolarHBondContact O-N 2.87Å; N257-Q261 WeakPolarHBondContact O-CG 3.4Å; N257-Q261 PolarHBondContact O-N 2.9Å; N257-L373 HydrophobicContact CB-CD1 4.21Å; N257-L373 HydrophobicContact CB-CD2 4.03Å
258	L	89.7	Confident	88.4	Confident	26 Å²	26	44 Å²	44	14%	0.136	24%	0.235	C	C	.	.	H	α-helix	trans	-66.9	-46.9	176.1	-178.4	57.7	0	0	0	111.7	A147 Y198 V201 V254 T255 L260 Q261 V262	A147-L258 HydrophobicContact CB-CD1 4.48Å; Y198-L258 HydrophobicContact CD1-CD2 4.49Å; Y198-L258 HydrophobicContact CD2-CD1 4.49Å; Y198-L258 HydrophobicContact CD2-CD2 3.99Å; Y198-L258 HydrophobicContact CE2-CD1 3.86Å; Y198-L258 HydrophobicContact CE2-CD2 4.18Å; Y198-L258 HydrophobicContact CG-CD2 4.16Å; V201-L258 HydrophobicContact CG1-CD2 3.89Å; V201-L258 HydrophobicContact CG2-CD2 3.84Å; V254-L258 WeakPolarHBondContact O-CB 3.23Å; V254-L258 PolarHBondContact O-N 3.09Å; T255-L258 PolarHBondContact O-N 3.49Å; L258-L260 PolarHBondContact O-N 3.29Å; L258-Q261 CarbonylContact O-C 3.59Å; L258-Q261 PolarHBondContact O-N 3.44Å; L258-V262 HydrophobicContact CD1-CG2 4.11Å; L258-V262 HydrophobicContact CG-CG2 4.27Å; L258-V262 VanDerWaalsContact O-CG2 3.31Å; L258-V262 WeakPolarHBondContact O-CG2 3.43Å; L258-V262 PolarHBondContact O-N 2.85Å
259	S	90.8	Very high	89.2	Confident	6 Å²	6	41.9 Å²	41.9	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-58.4	-35.5	174.5	-65.4	0	0	0	0	112.2	T255 A263	T255-S259 PolarHBondContact O-N 3.47Å; T255-S259 PolarHBondContact O-OG 3.36Å; S259-A263 WeakPolarHBondContact O-CB 3.29Å; S259-A263 PolarHBondContact O-N 3Å
260	L	91.3	Very high	90.5	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-65.8	-45.1	172.6	-171.6	74	0	0	0	111.4	I246 R256 N257 L258 A263 F264 V363 F368 L373 I375	I246-L260 HydrophobicContact CD1-CB 3.71Å; I246-L260 HydrophobicContact CD1-CD1 3.74Å; I246-L260 HydrophobicContact CD1-CG 4.31Å; I246-L260 HydrophobicContact CG1-CB 4.37Å; I246-L260 HydrophobicContact CG1-CD1 3.78Å; R256-L260 PolarHBondContact O-N 3.41Å; N257-L260 PolarHBondContact O-N 2.87Å; L258-L260 PolarHBondContact O-N 3.29Å; L260-A263 PolarHBondContact O-N 2.83Å; L260-F264 HydrophobicContact CD1-CD2 3.52Å; L260-F264 HydrophobicContact CD1-CE2 3.42Å; L260-F264 VanDerWaalsContact CD1-CE2 3.42Å; L260-F264 HydrophobicContact CD1-CZ 4.41Å; L260-F264 HydrophobicContact CG-CD2 4.03Å; L260-F264 HydrophobicContact CG-CE2 4.38Å; L260-F264 WeakPolarHBondContact O-CB 3.4Å; L260-F264 WeakPolarHBondContact O-CD2 3.28Å; L260-F264 PolarHBondContact O-N 3.33Å; L260-V363 HydrophobicContact CD1-CG1 3.92Å; L260-F368 HydrophobicContact CB-CE1 4.08Å; L260-F368 HydrophobicContact CB-CZ 4.39Å; L260-F368 HydrophobicContact CD1-CE2 4.36Å; L260-F368 HydrophobicContact CD1-CZ 4.44Å; L260-F368 HydrophobicContact CD2-CB 3.9Å; L260-F368 HydrophobicContact CD2-CD1 3.52Å; L260-F368 HydrophobicContact CD2-CD2 4Å; L260-F368 HydrophobicContact CD2-CE1 3.88Å; L260-F368 HydrophobicContact CD2-CE2 4.34Å; L260-F368 HydrophobicContact CD2-CG 3.56Å; L260-F368 HydrophobicContact CD2-CZ 4.28Å; L260-F368 HydrophobicContact CG-CE1 4.44Å; L260-L373 HydrophobicContact CD2-CD1 3.88Å; L260-I375 HydrophobicContact CB-CD1 4.41Å; L260-I375 HydrophobicContact CD2-CD1 3.43Å; L260-I375 VanDerWaalsContact CD2-CD1 3.43Å; L260-I375 HydrophobicContact CG-CD1 3.53Å
261	Q	92.3	Very high	91.6	Very high	61 Å²	61	34 Å²	34	29%	0.285	17%	0.168	S	C	.	.	H	α-helix	trans	-62.6	-42.6	176.5	-73.2	-178	-42.9	0	0	112.4	A147 N257 L258 A263 F264 S265 L373 I375	A147-Q261 HydrophobicContact CB-CB 3.88Å; N257-Q261 WeakPolarHBondContact O-CG 3.4Å; N257-Q261 PolarHBondContact O-N 2.9Å; L258-Q261 CarbonylContact O-C 3.59Å; L258-Q261 PolarHBondContact O-N 3.44Å; Q261-A263 VanDerWaalsContact C-N 3.34Å; Q261-A263 PolarHBondContact O-N 3.42Å; Q261-F264 PolarHBondContact O-N 2.83Å; Q261-S265 WeakPolarHBondContact O-CB 3.5Å; Q261-S265 PolarHBondContact O-N 3.06Å; Q261-S265 PolarHBondContact O-OG 3.46Å; Q261-L373 HydrophobicContact CG-CB 4.25Å; Q261-L373 HydrophobicContact CG-CD2 4.29Å; Q261-L373 PolarHBondContact NE2-O 2.83Å; Q261-I375 HydrophobicContact CG-CD1 4.48Å
262	V	94.1	Very high	92.8	Very high	6 Å²	6	24.5 Å²	24.5	4%	0.036	12%	0.124	C	C	.	.	H	α-helix	trans	-62	-39.1	176.9	171.9	0	0	0	0	111.7	A147 C148 A151 I242 L258	A147-V262 HydrophobicContact CB-CG2 4.05Å; C148-V262 WeakPolarHBondContact CB-O 3.22Å; A151-V262 HydrophobicContact CB-CB 4.46Å; A151-V262 HydrophobicContact CB-CG1 3.62Å; A151-V262 HydrophobicContact CB-CG2 3.89Å; I242-V262 HydrophobicContact CD1-CG1 4.3Å; I242-V262 HydrophobicContact CG1-CG1 4.1Å; I242-V262 HydrophobicContact CG2-CG1 3.93Å; L258-V262 HydrophobicContact CD1-CG2 4.11Å; L258-V262 HydrophobicContact CG-CG2 4.27Å; L258-V262 VanDerWaalsContact O-CG2 3.31Å; L258-V262 WeakPolarHBondContact O-CG2 3.43Å; L258-V262 PolarHBondContact O-N 2.85Å
263	A	94.6	Very high	93.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-76.6	-32.8	178.5	0	0	0	0	0	113.6	I242 I246 S259 L260 Q261 G349 D350 V351	I242-A263 HydrophobicContact CG2-CB 4.22Å; I246-A263 HydrophobicContact CG2-CB 3.88Å; S259-A263 WeakPolarHBondContact O-CB 3.29Å; S259-A263 PolarHBondContact O-N 3Å; L260-A263 PolarHBondContact O-N 2.83Å; Q261-A263 VanDerWaalsContact C-N 3.34Å; Q261-A263 PolarHBondContact O-N 3.42Å; A263-G349 CarbonylContact O-C 3.59Å; A263-D350 PolarHBondContact O-N 2.98Å; A263-V351 HydrophobicContact CB-CG1 3.97Å; A263-V351 HydrophobicContact CB-CG2 4.21Å; A263-V351 WeakPolarHBondContact O-CG1 3.31Å; A263-V351 WeakPolarHBondContact O-CG2 3.42Å; A263-V351 PolarHBondContact O-N 2.9Å
264	F	93.9	Very high	94	Very high	17 Å²	17	15.3 Å²	15.3	8%	0.075	8%	0.078	C	C	.	.	H	α-helix	trans	-93.9	-20.9	-175.6	-87.2	-101.6	0	0	0	115.1	L260 Q261 V351 Q352 W355 L364 I375	L260-F264 HydrophobicContact CD1-CD2 3.52Å; L260-F264 HydrophobicContact CD1-CE2 3.42Å; L260-F264 VanDerWaalsContact CD1-CE2 3.42Å; L260-F264 HydrophobicContact CD1-CZ 4.41Å; L260-F264 HydrophobicContact CG-CD2 4.03Å; L260-F264 HydrophobicContact CG-CE2 4.38Å; L260-F264 WeakPolarHBondContact O-CB 3.4Å; L260-F264 WeakPolarHBondContact O-CD2 3.28Å; L260-F264 PolarHBondContact O-N 3.33Å; Q261-F264 PolarHBondContact O-N 2.83Å; F264-V351 HydrophobicContact CD2-CG2 3.74Å; F264-V351 HydrophobicContact CE1-CG2 4.49Å; F264-V351 HydrophobicContact CE2-CG2 3.63Å; F264-V351 HydrophobicContact CG-CG2 4.23Å; F264-V351 HydrophobicContact CZ-CG2 4.04Å; F264-Q352 HydrophobicContact CD1-CG 3.8Å; F264-Q352 HydrophobicContact CE1-CG 3.76Å; F264-W355 HydrophobicContact CE2-CH2 4.43Å; F264-W355 HydrophobicContact CE2-CZ3 4.03Å; F264-W355 HydrophobicContact CZ-CZ3 4.35Å; F264-L364 HydrophobicContact CE1-CD1 4.46Å; F264-L364 HydrophobicContact CE1-CD2 4.14Å; F264-L364 HydrophobicContact CZ-CD1 4.36Å; F264-L364 HydrophobicContact CZ-CD2 3.85Å; F264-L364 HydrophobicContact CZ-CG 4.12Å; F264-I375 HydrophobicContact CB-CD1 4.1Å; F264-I375 HydrophobicContact CB-CG1 4.23Å; F264-I375 HydrophobicContact CB-CG2 4.12Å; F264-I375 HydrophobicContact CD1-CG2 3.45Å; F264-I375 VanDerWaalsContact CD1-CG2 3.45Å; F264-I375 HydrophobicContact CE1-CG2 4.02Å; F264-I375 HydrophobicContact CG-CD1 4.35Å; F264-I375 HydrophobicContact CG-CG2 3.87Å
265	S	95.4	Very high	94.4	Very high	3 Å²	3	13.4 Å²	13.4	2%	0.021	7%	0.066	C	C	.	.	S	Bend	trans	-80.1	165.7	158.9	53.8	0	0	0	0	109.8	G144 G145 C148 Q261 G349 D350	G144-S265 WeakPolarHBondContact O-CB 3.34Å; G145-S265 WeakPolarHBondContact O-CB 3.48Å; C148-S265 WeakPolarHBondContact CB-OG 3.42Å; C148-S265 PolarHBondContact N-OG 2.8Å; Q261-S265 WeakPolarHBondContact O-CB 3.5Å; Q261-S265 PolarHBondContact O-N 3.06Å; Q261-S265 PolarHBondContact O-OG 3.46Å; S265-G349 WeakPolarHBondContact O-CA 3.4Å; S265-D350 PolarHBondContact O-N 3.17Å
266	G	97.3	Very high	94.7	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	165.4	174.9	0	0	0	0	0	112.4	H143 F348	H143-G266 PolarHBondContact N-O 2.84Å; H143-G266 WeakPolarHBondContact NE2-CA 3.39Å; H143-G266 PolarHBondContact O-N 3.09Å; G266-F348 VanDerWaalsContact CA-O 3.22Å; G266-F348 WeakPolarHBondContact CA-O 3.41Å
267	A	98.5	Very high	95	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	134.7	171.7	0	0	0	0	0	112.1	D141 C148 A149 A347 F348	D141-A267 CarbonylContact O-C 3.41Å; D141-A267 WeakPolarHBondContact O-CA 3.36Å; C148-A267 HydrophobicContact CB-CB 4.04Å; A149-A267 HydrophobicContact CB-CB 3.84Å; A267-A347 CarbonylContact O-C 3.44Å; A267-A347 WeakPolarHBondContact O-CA 3.5Å; A267-A347 WeakPolarHBondContact O-CB 3.48Å; A267-F348 PolarHBondContact N-O 2.66Å; A267-F348 VanDerWaalsContact N-O 3.07Å; A267-F348 PolarHBondContact O-N 3.27Å
268	T	98.6	Very high	95.3	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.071	C	C	.	.			trans	-74.3	165.9	163.6	72.4	0	0	0	0	110.2	F140 D141 A284 D286 C287 P344	F140-T268 VanDerWaalsContact CA-O 3.3Å; F140-T268 WeakPolarHBondContact CA-O 3.48Å; D141-T268 WeakPolarHBondContact CB-OG1 3.09Å; D141-T268 PolarHBondContact N-OG1 2.88Å; D141-T268 PolarHBondContact O-N 3.07Å; D141-T268 PolarHBondContact O-OG1 3.11Å; T268-A284 CarbonylContact C-O 3.49Å; T268-A284 WeakPolarHBondContact CA-O 3.29Å; T268-A284 WeakPolarHBondContact CB-O 3.16Å; T268-D286 WeakPolarHBondContact CG2-OD1 3.27Å; T268-C287 PolarHBondContact OG1-SG 3.28Å; T268-P344 HydrophobicContact CG2-CB 4.05Å; T268-P344 HydrophobicContact CG2-CG 4.04Å
269	A	98.7	Very high	95.7	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	119.5	173	0	0	0	0	0	111.5	F140 L156 F235 N283 A284 F348	F140-A269 HydrophobicContact CD1-CB 3.64Å; F140-A269 HydrophobicContact CE1-CB 3.94Å; L156-A269 HydrophobicContact CD2-CB 4.42Å; F235-A269 HydrophobicContact CE1-CB 3.84Å; F235-A269 HydrophobicContact CZ-CB 4.39Å; A269-N283 CarbonylContact O-C 3.57Å; A269-N283 WeakPolarHBondContact O-CA 3.42Å; A269-N283 PolarHBondContact O-OD1 2.87Å; A269-A284 PolarHBondContact N-O 2.76Å; A269-A284 PolarHBondContact O-N 3.5Å; A269-F348 HydrophobicContact CB-CD2 4.04Å; A269-F348 HydrophobicContact CB-CE2 3.63Å
270	C	98.8	Very high	96.1	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	111.7	166.9	-175.2	0	0	0	0	109.1	G138 I139 N283 C287	G138-C270 WeakPolarHBondContact CA-O 3.34Å; I139-C270 PolarHBondContact N-O 2.83Å; I139-C270 PolarHBondContact O-N 3.24Å; C270-N283 WeakPolarHBondContact CB-OD1 3.49Å; C270-C287 HydrophobicContact CB-CB 3.42Å; C270-C287 VanDerWaalsContact CB-CB 3.42Å
271	M	98.5	Very high	96.4	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	126.8	-172.5	178.4	177.7	171.2	0	0	111.4	M136 F137 L156 F157 V160 L231 F235 V281 A282	M136-M271 HydrophobicContact CB-CE 4Å; M136-M271 HydrophobicContact CG-CE 3.68Å; M136-M271 HydrophobicContact SD-CE 3.26Å; M136-M271 WeakPolarHBondContact SD-CE 3.5Å; F137-M271 CarbonylContact O-C 3.52Å; F137-M271 VanDerWaalsContact O-CA 3.28Å; F137-M271 WeakPolarHBondContact O-CA 3.24Å; L156-M271 HydrophobicContact CD2-SD 3.92Å; L156-M271 HydrophobicContact CG-SD 4.13Å; F157-M271 HydrophobicContact CD1-CE 3.61Å; F157-M271 HydrophobicContact CD1-SD 3.79Å; F157-M271 HydrophobicContact CE1-CE 3.82Å; F157-M271 HydrophobicContact CE1-CG 3.91Å; F157-M271 HydrophobicContact CE1-SD 3.74Å; V160-M271 HydrophobicContact CB-CE 3.92Å; V160-M271 HydrophobicContact CG1-CE 3.8Å; V160-M271 HydrophobicContact CG2-CE 3.82Å; V160-M271 HydrophobicContact CG2-SD 4.04Å; L231-M271 HydrophobicContact CD2-CE 4.29Å; L231-M271 HydrophobicContact CD2-SD 4.39Å; F235-M271 HydrophobicContact CE2-CB 4.49Å; F235-M271 HydrophobicContact CE2-SD 4.13Å; F235-M271 HydrophobicContact CZ-CB 4.06Å; M271-V281 CarbonylContact O-C 3.49Å; M271-V281 WeakPolarHBondContact O-CA 3.47Å; M271-A282 PolarHBondContact N-O 3.12Å; M271-A282 PolarHBondContact O-N 3.29Å
272	A	98.7	Very high	96.8	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.053	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129.4	171.3	0	0	0	0	0	111.2	M136 F137 L279 H280 V281 L407 L409	M136-A272 WeakPolarHBondContact CA-O 3.24Å; F137-A272 PolarHBondContact N-O 3.08Å; F137-A272 PolarHBondContact O-N 3.35Å; A272-L279 HydrophobicContact CB-CD1 4.01Å; A272-H280 CarbonylContact C-O 3.52Å; A272-H280 WeakPolarHBondContact CA-O 3.47Å; A272-V281 HydrophobicContact CB-CG2 4.18Å; A272-L407 HydrophobicContact CB-CD2 3.74Å; A272-L409 HydrophobicContact CB-CD1 4.48Å; A272-L409 HydrophobicContact CB-CD2 3.98Å
273	H	98.3	Very high	97	Very high	3 Å²	3	8.9 Å²	8.9	1%	0.014	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	121.7	170.1	178.7	-87.1	0	0	0	109.5	H280	H273-H280 PolarHBondContact N-O 3.47Å; H273-H280 PolarHBondContact O-N 3.37Å
274	V	97.1	Very high	97.2	Very high	1 Å²	1	8.9 Å²	8.9	1%	0.006	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	109	-179	-171.1	0	0	0	0	109.9	S105 V106 G134 L135 F137 L279 L400 F517	S105-V274 WeakPolarHBondContact OG-CG1 3.44Å; V106-V274 HydrophobicContact CG2-CB 4.25Å; V106-V274 HydrophobicContact CG2-CG1 3.91Å; V106-V274 HydrophobicContact CG2-CG2 4.47Å; G134-V274 CarbonylContact C-O 3.56Å; G134-V274 WeakPolarHBondContact CA-O 3.39Å; L135-V274 PolarHBondContact N-O 3.48Å; L135-V274 PolarHBondContact O-N 3.4Å; F137-V274 HydrophobicContact CD2-CG2 4.44Å; F137-V274 HydrophobicContact CE2-CG2 4.25Å; V274-L279 HydrophobicContact CG2-CD1 3.84Å; V274-L400 HydrophobicContact CG1-CD1 4.11Å; V274-F517 HydrophobicContact CG1-CE1 4.36Å; V274-F517 HydrophobicContact CG2-CE1 4.43Å
275	D	93.8	Very high	97.4	Very high	50 Å²	50	8 Å²	8	27%	0.267	5%	0.048	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	109.9	170.1	177	23.2	0	0	0	110	N133 I277 H278	N133-D275 WeakPolarHBondContact CB-OD1 3.45Å; D275-I277 PolarHBondContact O-N 2.89Å; D275-I277 VanDerWaalsContact O-N 3.13Å; D275-H278 PolarHBondContact N-O 2.88Å; D275-H278 WeakPolarHBondContact O-CA 3.43Å; D275-H278 WeakPolarHBondContact O-CB 3.3Å; D275-H278 PolarHBondContact O-N 3.27Å
276	G	91.2	Very high	97.4	Very high	31 Å²	31	8.2 Å²	8.2	32%	0.32	5%	0.049	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	-120.6	-173.4	0	0	0	0	0	111.2	S105 H278	S105-G276 WeakPolarHBondContact CB-O 3.12Å; S105-G276 PolarHBondContact OG-O 2.95Å; G276-H278 VanDerWaalsContact C-N 3.34Å
277	I	94.3	Very high	97.5	Very high	3 Å²	3	8.2 Å²	8.2	2%	0.015	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	3.2	177.8	63	156.5	0	0	0	114.3	D275 R399 L400 I522 Y525	D275-I277 PolarHBondContact O-N 2.89Å; D275-I277 VanDerWaalsContact O-N 3.13Å; I277-R399 HydrophobicContact CD1-CG 3.92Å; I277-R399 VanDerWaalsContact CD1-NE 3.31Å; I277-L400 HydrophobicContact CB-CB 4.39Å; I277-L400 WeakPolarHBondContact O-CB 3.45Å; I277-L400 PolarHBondContact O-N 2.84Å; I277-I522 HydrophobicContact CG2-CG1 4.47Å; I277-I522 HydrophobicContact CG2-CG2 4.2Å; I277-Y525 HydrophobicContact CD1-CD1 3.63Å; I277-Y525 HydrophobicContact CD1-CE1 3.31Å; I277-Y525 HydrophobicContact CD1-CE2 4.47Å; I277-Y525 HydrophobicContact CD1-CG 4.37Å; I277-Y525 HydrophobicContact CG1-CD1 4.22Å; I277-Y525 HydrophobicContact CG1-CE1 3.97Å; I277-Y525 HydrophobicContact CG1-CE2 4.26Å; I277-Y525 HydrophobicContact CG1-CG 4.5Å; I277-Y525 HydrophobicContact CG2-CD1 4.14Å; I277-Y525 HydrophobicContact CG2-CD2 4.2Å; I277-Y525 HydrophobicContact CG2-CG 3.87Å
278	H	95.9	Very high	97.5	Very high	58 Å²	58	10.1 Å²	10.1	27%	0.269	6%	0.056	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	107.4	-176.8	-58.3	-84.9	0	0	0	110.2	D275 G276 Y397	D275-H278 PolarHBondContact N-O 2.88Å; D275-H278 WeakPolarHBondContact O-CA 3.43Å; D275-H278 WeakPolarHBondContact O-CB 3.3Å; D275-H278 PolarHBondContact O-N 3.27Å; G276-H278 VanDerWaalsContact C-N 3.34Å; H278-Y397 HydrophobicContact CB-CE2 4.1Å; H278-Y397 AromaticContact ND1-CE2 3.67Å; H278-Y397 AromaticContact ND1-CZ 3.75Å; H278-Y397 PolarHBondContact ND1-OH 3.02Å
279	L	98.3	Very high	97.5	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	122.9	172.7	168.9	62	0	0	0	108.6	A272 V274 V281 L291 L305 H398 L400 L407 F517	A272-L279 HydrophobicContact CB-CD1 4.01Å; V274-L279 HydrophobicContact CG2-CD1 3.84Å; L279-V281 HydrophobicContact CD1-CG2 3.88Å; L279-V281 HydrophobicContact CG-CG2 4.12Å; L279-L291 HydrophobicContact CD2-CD1 4.23Å; L279-L305 HydrophobicContact CD2-CD1 3.53Å; L279-L305 HydrophobicContact CG-CD1 4.38Å; L279-H398 HydrophobicContact CB-CB 4.45Å; L279-H398 WeakPolarHBondContact CB-O 3.35Å; L279-H398 HydrophobicContact CD2-CB 4.38Å; L279-H398 PolarHBondContact N-O 3.05Å; L279-H398 PolarHBondContact O-N 2.93Å; L279-L400 HydrophobicContact CB-CD1 4.43Å; L279-L400 HydrophobicContact CB-CD2 4.32Å; L279-L400 HydrophobicContact CB-CG 4.1Å; L279-L400 HydrophobicContact CD2-CD2 4.15Å; L279-L407 HydrophobicContact CD1-CD2 3.94Å; L279-L407 HydrophobicContact CD2-CD2 4.35Å; L279-F517 HydrophobicContact CD2-CZ 4.46Å
280	H	98.6	Very high	97.5	Very high	18 Å²	18	10.1 Å²	10.1	8%	0.083	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	134.6	168.7	-61	75.7	0	0	0	108.2	I227 L231 A272 H273 T396 Y397	I227-H280 HydrophobicContact CG2-CB 4.15Å; L231-H280 HydrophobicContact CD1-CB 3.71Å; A272-H280 CarbonylContact C-O 3.52Å; A272-H280 WeakPolarHBondContact CA-O 3.47Å; H273-H280 PolarHBondContact N-O 3.47Å; H273-H280 PolarHBondContact O-N 3.37Å; H280-T396 WeakPolarHBondContact CA-O 3.34Å; H280-Y397 AromaticContact CD2-CD2 3.83Å; H280-Y397 AromaticContact CE1-CD2 3.59Å; H280-Y397 AromaticContact CE1-CE2 3.91Å; H280-Y397 AromaticContact NE2-CD2 3.4Å; H280-Y397 WeakPolarHBondContact NE2-CD2 3.17Å
281	V	98.8	Very high	97.5	Very high	1 Å²	1	10.1 Å²	10.1	1%	0.006	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	116.9	175.8	-172.2	0	0	0	0	109.1	M271 A272 L279 A289 L305 T306 V395 T396	M271-V281 CarbonylContact O-C 3.49Å; M271-V281 WeakPolarHBondContact O-CA 3.47Å; A272-V281 HydrophobicContact CB-CG2 4.18Å; L279-V281 HydrophobicContact CD1-CG2 3.88Å; L279-V281 HydrophobicContact CG-CG2 4.12Å; V281-A289 HydrophobicContact CG1-CB 3.96Å; V281-L305 HydrophobicContact CB-CB 4.5Å; V281-L305 HydrophobicContact CG2-CB 4.15Å; V281-L305 HydrophobicContact CG2-CD1 3.85Å; V281-T306 HydrophobicContact CB-CG2 4.42Å; V281-T306 HydrophobicContact CG1-CG2 3.49Å; V281-T306 VanDerWaalsContact CG1-CG2 3.49Å; V281-V395 CarbonylContact O-C 3.55Å; V281-V395 WeakPolarHBondContact O-CA 3.29Å; V281-T396 PolarHBondContact N-O 3.38Å; V281-T396 PolarHBondContact O-N 2.86Å
282	A	98.8	Very high	97.5	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	122	174.9	0	0	0	0	0	109.3	L231 F235 M271 P393 E394 V395	L231-A282 HydrophobicContact CB-CB 4.19Å; L231-A282 HydrophobicContact CD1-CB 4.29Å; L231-A282 HydrophobicContact CD2-CB 4.21Å; L231-A282 HydrophobicContact CG-CB 4.47Å; F235-A282 HydrophobicContact CE1-CB 4.48Å; F235-A282 HydrophobicContact CE2-CB 3.74Å; F235-A282 HydrophobicContact CZ-CB 3.63Å; M271-A282 PolarHBondContact N-O 3.12Å; M271-A282 PolarHBondContact O-N 3.29Å; A282-P393 HydrophobicContact CB-CB 3.88Å; A282-P393 HydrophobicContact CB-CG 4.17Å; A282-E394 WeakPolarHBondContact CA-O 3.46Å; A282-V395 HydrophobicContact CB-CG2 4.08Å
283	N	98.7	Very high	97.4	Very high	1 Å²	1	10.2 Å²	10.2	1%	0.005	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	130.1	-179.6	-172	47.5	0	0	0	112.6	A269 C270 G285 C287 T306 R307 H309 P393 E394	A269-N283 CarbonylContact O-C 3.57Å; A269-N283 WeakPolarHBondContact O-CA 3.42Å; A269-N283 PolarHBondContact O-OD1 2.87Å; C270-N283 WeakPolarHBondContact CB-OD1 3.49Å; N283-G285 PolarHBondContact ND2-O 3.21Å; N283-C287 PolarHBondContact ND2-O 2.99Å; N283-C287 PolarHBondContact OD1-O 3.48Å; N283-C287 VanDerWaalsContact OD1-O 3.09Å; N283-T306 HydrophobicContact CB-CG2 3.67Å; N283-R307 PolarHBondContact ND2-O 3.19Å; N283-H309 PolarHBondContact O-CE1 2.86Å; N283-P393 CarbonylContact O-C 3.57Å; N283-P393 WeakPolarHBondContact O-CA 3.19Å; N283-E394 PolarHBondContact N-O 3.32Å; N283-E394 PolarHBondContact O-N 2.83Å
284	A	98.6	Very high	97.3	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	80.9	171.7	0	0	0	0	0	109.2	F235 T268 A269 R346 P393	F235-A284 HydrophobicContact CD1-CB 4.05Å; F235-A284 HydrophobicContact CE1-CB 4.01Å; T268-A284 CarbonylContact C-O 3.49Å; T268-A284 WeakPolarHBondContact CA-O 3.29Å; T268-A284 WeakPolarHBondContact CB-O 3.16Å; A269-A284 PolarHBondContact N-O 2.76Å; A269-A284 PolarHBondContact O-N 3.5Å; A284-R346 CarbonylContact C-O 3.57Å; A284-R346 HydrophobicContact CB-CB 4.39Å; A284-P393 HydrophobicContact CB-CB 4.46Å
285	G	98.1	Very high	97.1	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.085	C	C	.	.	S	Bend	trans	143.1	-155.2	176.1	0	0	0	0	0	112.2	N283 H309 R346	N283-G285 PolarHBondContact ND2-O 3.21Å; G285-H309 PolarHBondContact N-ND1 3.36Å; G285-H309 PolarHBondContact O-N 2.98Å; G285-R346 VanDerWaalsContact CA-O 3.29Å; G285-R346 WeakPolarHBondContact CA-O 3.38Å
286	D	97.1	Very high	96.9	Very high	7 Å²	7	21 Å²	21	4%	0.037	11%	0.11	C	C	.	.	S	Bend	trans	-102.6	-1.6	-179.4	23.2	29.9	0	0	0	114.4	T268 D308 I343 P344	T268-D286 WeakPolarHBondContact CG2-OD1 3.27Å; D286-D308 HydrophobicContact CB-CB 4.19Å; D286-I343 WeakPolarHBondContact OD2-CG2 3.19Å; D286-P344 WeakPolarHBondContact OD2-CD 3.15Å
287	C	98.1	Very high	96.9	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.125	C	C	.	.			trans	-51	143.2	155.1	-76.9	0	0	0	0	110.6	T268 C270 N283	T268-C287 PolarHBondContact OG1-SG 3.28Å; C270-C287 HydrophobicContact CB-CB 3.42Å; C270-C287 VanDerWaalsContact CB-CB 3.42Å; N283-C287 PolarHBondContact ND2-O 2.99Å; N283-C287 PolarHBondContact OD1-O 3.48Å; N283-C287 VanDerWaalsContact OD1-O 3.09Å
288	R	98.4	Very high	96.6	Very high	40 Å²	40	27 Å²	27	15%	0.151	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	145.3	-175.5	-162.5	-168.3	-64.7	147.7	8.8	112.7	I290 T306 D308 A410 W415 N420	R288-I290 HydrophobicContact CG-CG2 4.36Å; R288-T306 WeakPolarHBondContact CA-OG1 3.3Å; R288-T306 WeakPolarHBondContact CG-OG1 3.49Å; R288-D308 IonicContact CZ-OD1 3.52Å; R288-D308 IonicContact CZ-OD2 3.49Å; R288-D308 IonicContact NE-OD1 3.34Å; R288-D308 PolarHBondContact NE-OD1 3.11Å; R288-D308 IonicContact NE-OD2 3.56Å; R288-D308 PolarHBondContact NE-OD2 3.23Å; R288-D308 IonicContact NH2-OD1 3.49Å; R288-D308 IonicContact NH2-OD2 3.55Å; R288-D308 PolarHBondContact NH2-OD2 3.45Å; R288-A410 PolarHBondContact N-O 3.26Å; R288-A410 PolarHBondContact O-N 3Å; R288-A410 VanDerWaalsContact O-N 3.11Å; R288-W415 HydrophobicContact CB-CD2 4.16Å; R288-W415 HydrophobicContact CB-CG 4.18Å; R288-W415 HydrophobicContact CB-CZ2 4.29Å; R288-W415 WeakPolarHBondContact O-CZ2 3.35Å; R288-N420 PolarHBondContact NH1-OD1 3.33Å
289	A	98.7	Very high	96.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	134	169.2	0	0	0	0	0	112.4	V281 L305 T306 L407 V408 L409	V281-A289 HydrophobicContact CG1-CB 3.96Å; A289-L305 PolarHBondContact O-N 3.36Å; A289-T306 HydrophobicContact CB-CG2 4Å; A289-T306 PolarHBondContact N-OG1 3.19Å; A289-L407 HydrophobicContact CB-CD1 4.14Å; A289-V408 CarbonylContact C-O 3.58Å; A289-V408 WeakPolarHBondContact CA-O 3.44Å; A289-L409 HydrophobicContact CB-CG 4.12Å
290	I	98.7	Very high	96.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	144.8	178.1	71	174.8	0	0	0	111.6	R288 L407 V408 W415 N420 V423 V424	R288-I290 HydrophobicContact CG-CG2 4.36Å; I290-L407 WeakPolarHBondContact O-CA 3.46Å; I290-L407 WeakPolarHBondContact O-CD1 3.48Å; I290-V408 HydrophobicContact CG1-CB 4.05Å; I290-V408 HydrophobicContact CG1-CG2 4.47Å; I290-V408 PolarHBondContact N-O 3.12Å; I290-V408 PolarHBondContact O-N 2.97Å; I290-W415 HydrophobicContact CD1-CH2 3.6Å; I290-W415 HydrophobicContact CD1-CZ3 3.76Å; I290-W415 HydrophobicContact CG1-CH2 3.78Å; I290-W415 HydrophobicContact CG1-CZ3 4.4Å; I290-W415 HydrophobicContact CG2-CH2 4.13Å; I290-W415 HydrophobicContact CG2-CZ3 4.43Å; I290-N420 HydrophobicContact CD1-CB 4.16Å; I290-V423 HydrophobicContact CD1-CB 4.16Å; I290-V423 HydrophobicContact CD1-CG1 3.96Å; I290-V424 HydrophobicContact CD1-CG2 4.06Å
291	L	98.6	Very high	96.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	123.4	177.8	-165.8	75.2	0	0	0	110.2	L279 V293 L303 L305 H398 D404 F406 L407 F517	L279-L291 HydrophobicContact CD2-CD1 4.23Å; L291-V293 HydrophobicContact CD2-CG2 3.94Å; L291-V293 HydrophobicContact CG-CG2 4.09Å; L291-L303 HydrophobicContact CB-CB 4.22Å; L291-L303 HydrophobicContact CD2-CD2 4.17Å; L291-L303 PolarHBondContact N-O 3.25Å; L291-L303 PolarHBondContact O-N 2.86Å; L291-L305 HydrophobicContact CB-CD1 4.14Å; L291-L305 HydrophobicContact CB-CG 4.21Å; L291-L305 HydrophobicContact CD1-CD1 4.49Å; L291-H398 WeakPolarHBondContact CD2-NE2 3.19Å; L291-D404 HydrophobicContact CD1-CB 4.38Å; L291-D404 HydrophobicContact CD2-CB 3.95Å; L291-D404 HydrophobicContact CG-CB 4.3Å; L291-F406 WeakPolarHBondContact CD1-O 3.4Å; L291-L407 HydrophobicContact CD1-CB 4.27Å; L291-F517 HydrophobicContact CD1-CD2 4.44Å; L291-F517 HydrophobicContact CD1-CE2 3.63Å; L291-F517 HydrophobicContact CD1-CZ 4.43Å
292	G	98.1	Very high	96.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	112	171.7	0	0	0	0	0	110.6	K405 F406	G292-K405 PolarHBondContact O-N 3.03Å; G292-F406 PolarHBondContact N-O 2.69Å; G292-F406 PolarHBondContact O-N 3.34Å
293	V	97.7	Very high	96.1	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	134.1	-175.5	179.6	0	0	0	0	109.4	L291 W300 S301 L303 Q403 D404	L291-V293 HydrophobicContact CD2-CG2 3.94Å; L291-V293 HydrophobicContact CG-CG2 4.09Å; V293-W300 WeakPolarHBondContact O-CA 3.29Å; V293-S301 WeakPolarHBondContact CB-OG 3.42Å; V293-S301 PolarHBondContact N-O 2.81Å; V293-S301 PolarHBondContact O-N 2.79Å; V293-L303 HydrophobicContact CG2-CB 4.44Å; V293-Q403 HydrophobicContact CG1-CB 3.94Å; V293-D404 WeakPolarHBondContact CG2-OD1 3.39Å
294	Q	96.3	Very high	96	Very high	68 Å²	68	41.5 Å²	41.5	32%	0.318	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	109.9	172.3	-170.2	179.7	30.9	0	0	109.1	W300 Q403 K405	Q294-W300 HydrophobicContact CB-CD2 4.08Å; Q294-W300 HydrophobicContact CB-CE3 3.95Å; Q294-W300 HydrophobicContact CB-CH2 3.96Å; Q294-W300 HydrophobicContact CB-CZ2 4.03Å; Q294-W300 HydrophobicContact CB-CZ3 3.89Å; Q294-W300 HydrophobicContact CG-CD2 4.23Å; Q294-W300 HydrophobicContact CG-CH2 4.45Å; Q294-W300 HydrophobicContact CG-CZ2 4.02Å; Q294-Q403 PolarHBondContact N-O 2.97Å; Q294-Q403 VanDerWaalsContact O-CB 3.29Å; Q294-Q403 WeakPolarHBondContact O-CB 3.2Å; Q294-Q403 WeakPolarHBondContact O-CG 3.36Å; Q294-K405 HydrophobicContact CB-CD 4.46Å; Q294-K405 HydrophobicContact CB-CG 3.85Å
295	E	92.9	Very high	96	Very high	67 Å²	67	41.8 Å²	41.8	31%	0.313	23%	0.226	S	C	.	.			trans	-69.8	159.9	178.6	-56.1	-61.9	165.2	0	0	111.4	N297 G298 M299 S301	E295-N297 WeakPolarHBondContact CB-OD1 3.33Å; E295-N297 PolarHBondContact O-N 2.88Å; E295-G298 WeakPolarHBondContact O-CA 3.46Å; E295-G298 PolarHBondContact O-N 2.85Å; E295-M299 PolarHBondContact N-O 3.29Å; E295-S301 PolarHBondContact OE1-OG 3.17Å
296	D	89.4	Confident	96	Very high	147 Å²	147	42.2 Å²	42.2	79%	0.786	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.3	-176.1	-61.4	-25.2	0	0	0	113.9	G298 Q403	D296-G298 VanDerWaalsContact C-N 3.31Å; D296-Q403 PolarHBondContact OD1-NE2 3.22Å
297	N	90.6	Very high	96	Very high	119 Å²	119	48 Å²	48	64%	0.636	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	1.3	173.3	68.1	-1	0	0	0	113.6	E295 M299	E295-N297 WeakPolarHBondContact CB-OD1 3.33Å; E295-N297 PolarHBondContact O-N 2.88Å; N297-M299 VanDerWaalsContact C-N 3.3Å; N297-M299 WeakPolarHBondContact OD1-CB 3.37Å; N297-M299 PolarHBondContact OD1-N 2.99Å
298	G	89.3	Confident	96	Very high	41 Å²	41	49.6 Å²	49.6	42%	0.423	26%	0.259	S	S	.	.	S	Bend	trans	81.8	-1.2	-176.6	0	0	0	0	0	115	E295 D296	E295-G298 WeakPolarHBondContact O-CA 3.46Å; E295-G298 PolarHBondContact O-N 2.85Å; D296-G298 VanDerWaalsContact C-N 3.31Å
299	M	92.6	Very high	96	Very high	115 Å²	115	47.7 Å²	47.7	57%	0.567	25%	0.252	S	S	*	.			trans	-74	147	174.5	-167.2	173.9	72	0	0	110.4	E295 N297	E295-M299 PolarHBondContact N-O 3.29Å; N297-M299 VanDerWaalsContact C-N 3.3Å; N297-M299 WeakPolarHBondContact OD1-CB 3.37Å; N297-M299 PolarHBondContact OD1-N 2.99Å
300	W	95.6	Very high	95.8	Very high	70 Å²	70	48.3 Å²	48.3	27%	0.265	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	136.2	176.4	-69.9	87.6	0	0	0	110.8	V293 Q294 K405 F406 V424 V428 L431	V293-W300 WeakPolarHBondContact O-CA 3.29Å; Q294-W300 HydrophobicContact CB-CD2 4.08Å; Q294-W300 HydrophobicContact CB-CE3 3.95Å; Q294-W300 HydrophobicContact CB-CH2 3.96Å; Q294-W300 HydrophobicContact CB-CZ2 4.03Å; Q294-W300 HydrophobicContact CB-CZ3 3.89Å; Q294-W300 HydrophobicContact CG-CD2 4.23Å; Q294-W300 HydrophobicContact CG-CH2 4.45Å; Q294-W300 HydrophobicContact CG-CZ2 4.02Å; W300-K405 HydrophobicContact CH2-CB 3.82Å; W300-K405 HydrophobicContact CH2-CG 3.55Å; W300-K405 HydrophobicContact CZ3-CB 3.78Å; W300-K405 HydrophobicContact CZ3-CG 3.65Å; W300-F406 HydrophobicContact CE3-CE1 4.24Å; W300-F406 HydrophobicContact CH2-CE1 4.13Å; W300-F406 HydrophobicContact CZ3-CD1 4.15Å; W300-F406 AromaticContact CZ3-CE1 3.56Å; W300-F406 HydrophobicContact CZ3-CE1 3.56Å; W300-F406 HydrophobicContact CZ3-CZ 4.48Å; W300-V424 HydrophobicContact CB-CG1 4.23Å; W300-V428 HydrophobicContact CB-CG2 4.48Å; W300-V428 HydrophobicContact CD2-CB 4.42Å; W300-V428 HydrophobicContact CD2-CG1 4.2Å; W300-V428 HydrophobicContact CD2-CG2 3.31Å; W300-V428 VanDerWaalsContact CE2-CG2 3.49Å; W300-V428 HydrophobicContact CE3-CG2 3.51Å; W300-V428 HydrophobicContact CG-CG1 4.24Å; W300-V428 HydrophobicContact CG-CG2 3.77Å; W300-V428 HydrophobicContact CH2-CG2 3.93Å; W300-V428 HydrophobicContact CZ2-CG1 4.12Å; W300-V428 HydrophobicContact CZ2-CG2 3.81Å; W300-V428 HydrophobicContact CZ3-CG2 3.81Å; W300-L431 HydrophobicContact CH2-CD1 4.45Å
301	S	95.6	Very high	95.6	Very high	32 Å²	32	48.8 Å²	48.8	22%	0.224	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	153.2	174.6	59.8	0	0	0	0	109.7	V293 E295	V293-S301 WeakPolarHBondContact CB-OG 3.42Å; V293-S301 PolarHBondContact N-O 2.81Å; V293-S301 PolarHBondContact O-N 2.79Å; E295-S301 PolarHBondContact OE1-OG 3.17Å
302	C	96.8	Very high	95.4	Very high	32 Å²	32	56.3 Å²	56.3	22%	0.216	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	129.7	174.1	-178.6	0	0	0	0	109	V424	C302-V424 HydrophobicContact CB-CG2 3.93Å
303	L	97.8	Very high	95.3	Very high	67 Å²	67	57.4 Å²	57.4	35%	0.351	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	103.5	172.2	176.7	63.1	0	0	0	109.2	L291 V293 L305	L291-L303 HydrophobicContact CB-CB 4.22Å; L291-L303 HydrophobicContact CD2-CD2 4.17Å; L291-L303 PolarHBondContact N-O 3.25Å; L291-L303 PolarHBondContact O-N 2.86Å; V293-L303 HydrophobicContact CG2-CB 4.44Å; L303-L305 HydrophobicContact CD2-CD2 4.24Å; L303-L305 HydrophobicContact CG-CD2 4.19Å; L303-L305 PolarHBondContact O-N 2.96Å
304	P	97.9	Very high	95.2	Very high	65 Å²	65	63.7 Å²	63.7	42%	0.422	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	132.2	170.7	-21.4	33.6	0	0	0	110.7
305	L	98.4	Very high	95.2	Very high	7 Å²	7	62.5 Å²	62.5	4%	0.037	32%	0.324	C	S	.	.			trans	-105.1	-8.6	177.2	-62.3	-177.3	0	0	0	112.8	L279 V281 A289 L291 L303 T396 H398 L407	L279-L305 HydrophobicContact CD2-CD1 3.53Å; L279-L305 HydrophobicContact CG-CD1 4.38Å; V281-L305 HydrophobicContact CB-CB 4.5Å; V281-L305 HydrophobicContact CG2-CB 4.15Å; V281-L305 HydrophobicContact CG2-CD1 3.85Å; A289-L305 PolarHBondContact O-N 3.36Å; L291-L305 HydrophobicContact CB-CD1 4.14Å; L291-L305 HydrophobicContact CB-CG 4.21Å; L291-L305 HydrophobicContact CD1-CD1 4.49Å; L303-L305 HydrophobicContact CD2-CD2 4.24Å; L303-L305 HydrophobicContact CG-CD2 4.19Å; L303-L305 PolarHBondContact O-N 2.96Å; L305-T396 HydrophobicContact CD2-CG2 4.49Å; L305-T396 WeakPolarHBondContact O-CB 3.34Å; L305-T396 PolarHBondContact O-OG1 2.69Å; L305-H398 HydrophobicContact CD2-CB 4.14Å; L305-L407 HydrophobicContact CD1-CD1 3.76Å
306	T	98.1	Very high	95.4	Very high	9 Å²	9	59.5 Å²	59.5	6%	0.055	31%	0.31	C	S	.	.			trans	-130.1	162	176.6	63.5	0	0	0	0	110.2	V281 N283 R288 A289	V281-T306 HydrophobicContact CB-CG2 4.42Å; V281-T306 HydrophobicContact CG1-CG2 3.49Å; V281-T306 VanDerWaalsContact CG1-CG2 3.49Å; N283-T306 HydrophobicContact CB-CG2 3.67Å; R288-T306 WeakPolarHBondContact CA-OG1 3.3Å; R288-T306 WeakPolarHBondContact CG-OG1 3.49Å; A289-T306 HydrophobicContact CB-CG2 4Å; A289-T306 PolarHBondContact N-OG1 3.19Å
307	R	96.9	Very high	95.6	Very high	128 Å²	128	54.1 Å²	54.1	48%	0.483	28%	0.281	S	S	.	.			trans	-120.6	129.6	167.9	-63	-179.5	-71.6	-177.8	1.6	107.5	N283 H309 E394	N283-R307 PolarHBondContact ND2-O 3.19Å; R307-H309 PolarHBondContact O-CD2 3.29Å; R307-H309 PolarHBondContact O-N 3.42Å; R307-E394 IonicContact CZ-OE1 3.58Å; R307-E394 VanDerWaalsContact CZ-OE1 3.23Å; R307-E394 IonicContact CZ-OE2 3.55Å; R307-E394 IonicContact NE-OE1 3.23Å; R307-E394 PolarHBondContact NE-OE1 3.2Å; R307-E394 IonicContact NE-OE2 3.51Å; R307-E394 IonicContact NH2-OE1 3.89Å; R307-E394 PolarHBondContact NH2-OE1 3.03Å; R307-E394 IonicContact NH2-OE2 3.99Å; R307-E394 PolarHBondContact NH2-OE2 3.32Å
308	D	97.7	Very high	95.9	Very high	34 Å²	34	51.1 Å²	51.1	18%	0.182	27%	0.269	C	S	.	.			trans	-61.5	132.4	179.9	-45.1	-1.5	0	0	0	109.3	D286 R288 N310 N313	D286-D308 HydrophobicContact CB-CB 4.19Å; R288-D308 IonicContact CZ-OD1 3.52Å; R288-D308 IonicContact CZ-OD2 3.49Å; R288-D308 IonicContact NE-OD1 3.34Å; R288-D308 PolarHBondContact NE-OD1 3.11Å; R288-D308 IonicContact NE-OD2 3.56Å; R288-D308 PolarHBondContact NE-OD2 3.23Å; R288-D308 IonicContact NH2-OD1 3.49Å; R288-D308 IonicContact NH2-OD2 3.55Å; R288-D308 PolarHBondContact NH2-OD2 3.45Å; D308-N310 WeakPolarHBondContact CB-ND2 3.27Å; D308-N310 PolarHBondContact O-N 3.31Å; D308-N313 VanDerWaalsContact O-CB 3.24Å; D308-N313 WeakPolarHBondContact O-CB 3.23Å; D308-N313 PolarHBondContact O-ND2 3Å
309	H	97.9	Very high	96.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.253	C	S	.	.			trans	-92.3	75.7	179.6	-64.3	154.5	0	0	0	110	N283 G285 R307 E316 P344 C345 R346 E394	N283-H309 PolarHBondContact O-CE1 2.86Å; G285-H309 PolarHBondContact N-ND1 3.36Å; G285-H309 PolarHBondContact O-N 2.98Å; R307-H309 PolarHBondContact O-CD2 3.29Å; R307-H309 PolarHBondContact O-N 3.42Å; H309-E316 HydrophobicContact CB-CG 4.4Å; H309-P344 CarbonylContact O-C 3.56Å; H309-P344 WeakPolarHBondContact O-CA 3.42Å; H309-C345 WeakPolarHBondContact O-CB 3.4Å; H309-C345 PolarHBondContact O-N 3.14Å; H309-R346 HydrophobicContact CB-CB 4.25Å; H309-R346 HydrophobicContact CB-CG 4.1Å; H309-R346 WeakPolarHBondContact ND1-CD 3.41Å; H309-E394 IonicContact NE2-OE2 3.74Å
310	N	95.7	Very high	96.4	Very high	13 Å²	13	44.8 Å²	44.8	7%	0.07	23%	0.227	C	C	.	.	S	Bend	trans	-138.3	-179.5	-180	58.4	34.6	0	0	0	111.3	D308 W312 N313 I343	D308-N310 WeakPolarHBondContact CB-ND2 3.27Å; D308-N310 PolarHBondContact O-N 3.31Å; N310-W312 HydrophobicContact CB-CE3 4.12Å; N310-W312 HydrophobicContact CB-CZ3 4.26Å; N310-W312 VanDerWaalsContact CG-CE3 3.45Å; N310-W312 PolarHBondContact O-N 3.11Å; N310-W312 VanDerWaalsContact O-N 3.1Å; N310-W312 PolarHBondContact OD1-N 2.88Å; N310-N313 PolarHBondContact O-N 3.45Å; N310-N313 VanDerWaalsContact O-N 3.08Å; N310-I343 HydrophobicContact CB-CG2 4.17Å
311	A	93.9	Very high	96.4	Very high	9 Å²	9	45.9 Å²	45.9	7%	0.074	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-18	-175.7	0	0	0	0	0	115.1	L317 I333 D336	A311-L317 WeakPolarHBondContact O-CD1 3.38Å; A311-I333 HydrophobicContact CB-CG2 3.87Å; A311-D336 HydrophobicContact CB-CB 4.08Å; A311-D336 WeakPolarHBondContact CB-O 3.38Å
312	W	94.4	Very high	96.4	Very high	158 Å²	158	53.2 Å²	53.2	60%	0.598	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-16.2	177.9	-55.5	-69.2	0	0	0	112.7	N310 Q314 D336 I343	N310-W312 HydrophobicContact CB-CE3 4.12Å; N310-W312 HydrophobicContact CB-CZ3 4.26Å; N310-W312 VanDerWaalsContact CG-CE3 3.45Å; N310-W312 PolarHBondContact O-N 3.11Å; N310-W312 VanDerWaalsContact O-N 3.1Å; N310-W312 PolarHBondContact OD1-N 2.88Å; W312-Q314 PolarHBondContact O-N 3.01Å; W312-D336 HydrophobicContact CZ2-CB 3.89Å; W312-I343 HydrophobicContact CZ3-CG2 4.28Å
313	N	96.1	Very high	96.4	Very high	23 Å²	23	56.4 Å²	56.4	12%	0.123	27%	0.268	C	S	.	.			trans	-80.9	103.5	177.6	-176.3	-14.5	0	0	0	111.8	D308 N310 A315 E316 L317	D308-N313 VanDerWaalsContact O-CB 3.24Å; D308-N313 WeakPolarHBondContact O-CB 3.23Å; D308-N313 PolarHBondContact O-ND2 3Å; N310-N313 PolarHBondContact O-N 3.45Å; N310-N313 VanDerWaalsContact O-N 3.08Å; N313-A315 PolarHBondContact O-N 2.95Å; N313-A315 WeakPolarHBondContact OD1-CB 3.27Å; N313-A315 PolarHBondContact OD1-N 2.67Å; N313-E316 HydrophobicContact CB-CB 3.96Å; N313-E316 WeakPolarHBondContact O-CB 3.11Å; N313-E316 PolarHBondContact O-N 2.78Å; N313-E316 PolarHBondContact OD1-N 2.8Å; N313-L317 PolarHBondContact O-N 2.99Å
314	Q	96.1	Very high	96.3	Very high	133 Å²	133	53.8 Å²	53.8	62%	0.621	25%	0.254	S	S	*	.	H	α-helix	trans	-60.9	-28	-179.5	-65.4	-63.8	-28.8	0	0	114.2	W312 S318	W312-Q314 PolarHBondContact O-N 3.01Å; Q314-S318 VanDerWaalsContact O-CB 3.27Å; Q314-S318 WeakPolarHBondContact O-CB 3.45Å; Q314-S318 PolarHBondContact O-N 3.14Å; Q314-S318 PolarHBondContact O-OG 2.73Å
315	A	95.9	Very high	96.2	Very high	44 Å²	44	53.5 Å²	53.5	36%	0.364	25%	0.252	S	S	.	.	H	α-helix	trans	-70.1	-38.4	175.5	0	0	0	0	0	110.9	N313 S318 R319	N313-A315 PolarHBondContact O-N 2.95Å; N313-A315 WeakPolarHBondContact OD1-CB 3.27Å; N313-A315 PolarHBondContact OD1-N 2.67Å; A315-S318 CarbonylContact O-C 3.47Å; A315-S318 WeakPolarHBondContact O-CB 3.49Å; A315-S318 PolarHBondContact O-N 3.31Å; A315-R319 PolarHBondContact O-N 3.38Å
316	E	96.2	Very high	96.1	Very high	4 Å²	4	61.7 Å²	61.7	2%	0.019	29%	0.29	C	S	.	.	H	α-helix	trans	-73	-42.7	178.7	-166.4	63.4	-175.2	0	0	111.9	H309 N313 S318 R319 L320 C345 R346	H309-E316 HydrophobicContact CB-CG 4.4Å; N313-E316 HydrophobicContact CB-CB 3.96Å; N313-E316 WeakPolarHBondContact O-CB 3.11Å; N313-E316 PolarHBondContact O-N 2.78Å; N313-E316 PolarHBondContact OD1-N 2.8Å; E316-S318 PolarHBondContact O-N 3.35Å; E316-R319 VanDerWaalsContact CD-NE 3.26Å; E316-R319 WeakPolarHBondContact O-CB 3.3Å; E316-R319 PolarHBondContact O-N 2.87Å; E316-R319 IonicContact OE1-CZ 2.75Å; E316-R319 IonicContact OE1-NE 3.37Å; E316-R319 PolarHBondContact OE1-NE 3.1Å; E316-R319 IonicContact OE1-NH2 2.72Å; E316-R319 PolarHBondContact OE1-NH2 3.19Å; E316-R319 IonicContact OE2-NE 3.67Å; E316-R319 PolarHBondContact OE2-NE 3.26Å; E316-R319 VanDerWaalsContact OE2-NE 3.13Å; E316-L320 WeakPolarHBondContact O-CG 3.44Å; E316-L320 PolarHBondContact O-N 2.84Å; E316-C345 HydrophobicContact CG-CB 3.63Å; E316-R346 VanDerWaalsContact OE1-CG 3.24Å; E316-R346 WeakPolarHBondContact OE1-CG 3.22Å; E316-R346 IonicContact OE1-CZ 2.68Å; E316-R346 IonicContact OE1-NE 3.55Å; E316-R346 PolarHBondContact OE1-NE 2.91Å; E316-R346 IonicContact OE1-NH2 2.75Å; E316-R346 IonicContact OE2-CZ 2.67Å; E316-R346 IonicContact OE2-NE 2.75Å; E316-R346 PolarHBondContact OE2-NE 3.04Å; E316-R346 IonicContact OE2-NH2 3.19Å; E316-R346 PolarHBondContact OE2-NH2 3.2Å
317	L	95.1	Very high	95.9	Very high	33 Å²	33	66.2 Å²	66.2	17%	0.173	32%	0.322	C	S	.	.	H	α-helix	trans	-55	-41.7	167.8	-66.9	-174.9	0	0	0	111.9	A311 N313 R319 K321 I333	A311-L317 WeakPolarHBondContact O-CD1 3.38Å; N313-L317 PolarHBondContact O-N 2.99Å; L317-R319 VanDerWaalsContact C-N 3.32Å; L317-K321 WeakPolarHBondContact O-CB 3.4Å; L317-K321 VanDerWaalsContact O-CG 3.3Å; L317-K321 WeakPolarHBondContact O-CG 3.45Å; L317-K321 PolarHBondContact O-N 3.27Å; L317-K321 VanDerWaalsContact O-N 3.15Å; L317-I333 HydrophobicContact CD2-CD1 4.34Å; L317-I333 HydrophobicContact CD2-CG1 3.62Å
318	S	95.7	Very high	95.8	Very high	56 Å²	56	60.4 Å²	60.4	39%	0.392	30%	0.3	S	S	.	.	H	α-helix	trans	-71.4	-26.2	178.2	-59.7	0	0	0	0	112.7	Q314 A315 E316 R322	Q314-S318 VanDerWaalsContact O-CB 3.27Å; Q314-S318 WeakPolarHBondContact O-CB 3.45Å; Q314-S318 PolarHBondContact O-N 3.14Å; Q314-S318 PolarHBondContact O-OG 2.73Å; A315-S318 CarbonylContact O-C 3.47Å; A315-S318 WeakPolarHBondContact O-CB 3.49Å; A315-S318 PolarHBondContact O-N 3.31Å; E316-S318 PolarHBondContact O-N 3.35Å; S318-R322 VanDerWaalsContact C-NH1 3.32Å; S318-R322 WeakPolarHBondContact O-CG 3.31Å; S318-R322 VanDerWaalsContact O-CZ 3.32Å; S318-R322 PolarHBondContact O-NH1 3.25Å
319	R	96.4	Very high	95.6	Very high	23 Å²	23	61.5 Å²	61.5	9%	0.087	31%	0.306	C	S	.	.	H	α-helix	trans	-68.1	-58.6	172	179.4	-173.8	74.2	79	1.3	109.7	A315 E316 L317 K321 R322 E323 C345	A315-R319 PolarHBondContact O-N 3.38Å; E316-R319 VanDerWaalsContact CD-NE 3.26Å; E316-R319 WeakPolarHBondContact O-CB 3.3Å; E316-R319 PolarHBondContact O-N 2.87Å; E316-R319 IonicContact OE1-CZ 2.75Å; E316-R319 IonicContact OE1-NE 3.37Å; E316-R319 PolarHBondContact OE1-NE 3.1Å; E316-R319 IonicContact OE1-NH2 2.72Å; E316-R319 PolarHBondContact OE1-NH2 3.19Å; E316-R319 IonicContact OE2-NE 3.67Å; E316-R319 PolarHBondContact OE2-NE 3.26Å; E316-R319 VanDerWaalsContact OE2-NE 3.13Å; L317-R319 VanDerWaalsContact C-N 3.32Å; R319-K321 VanDerWaalsContact C-N 3.3Å; R319-K321 PolarHBondContact O-N 2.75Å; R319-R322 WeakPolarHBondContact O-CB 3.23Å; R319-R322 PolarHBondContact O-N 3.24Å; R319-E323 WeakPolarHBondContact CD-OE1 3.46Å; R319-E323 WeakPolarHBondContact CG-OE1 3.44Å; R319-E323 IonicContact CZ-OE1 2.95Å; R319-E323 IonicContact CZ-OE2 3.74Å; R319-E323 IonicContact NE-OE1 3.34Å; R319-E323 IonicContact NH1-OE1 3.75Å; R319-E323 PolarHBondContact NH1-OE1 2.68Å; R319-E323 IonicContact NH1-OE2 3.06Å; R319-E323 PolarHBondContact NH1-OE2 2.95Å; R319-E323 PolarHBondContact O-N 3.25Å; R319-C345 PolarHBondContact NH2-O 3.37Å
320	L	96.1	Very high	95.3	Very high	1 Å²	1	72.3 Å²	72.3	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-55	-43.1	-177.8	-67	167.5	0	0	0	112.2	E316 R322 E323 H324 I332 I333 L338 C345	E316-L320 WeakPolarHBondContact O-CG 3.44Å; E316-L320 PolarHBondContact O-N 2.84Å; L320-R322 PolarHBondContact O-N 3.27Å; L320-E323 PolarHBondContact O-N 3.1Å; L320-E323 VanDerWaalsContact O-N 3.14Å; L320-H324 PolarHBondContact O-CD2 2.89Å; L320-H324 VanDerWaalsContact O-CD2 3.27Å; L320-H324 PolarHBondContact O-N 3.01Å; L320-I332 HydrophobicContact CB-CG2 3.85Å; L320-I332 HydrophobicContact CD1-CG2 4.1Å; L320-I332 HydrophobicContact CG-CG2 4.44Å; L320-I333 HydrophobicContact CD1-CD1 3.99Å; L320-L338 HydrophobicContact CD1-CD1 4.18Å; L320-L338 HydrophobicContact CD2-CD1 4.27Å; L320-C345 HydrophobicContact CD1-CB 4.22Å
321	K	95.1	Very high	95.2	Very high	93 Å²	93	72.8 Å²	72.8	40%	0.404	35%	0.35	S	S	.	.	H	α-helix	trans	-65.2	-18.3	176.4	-71.7	-178.4	175.4	-141.3	0	115.5	L317 R319 D329	L317-K321 WeakPolarHBondContact O-CB 3.4Å; L317-K321 VanDerWaalsContact O-CG 3.3Å; L317-K321 WeakPolarHBondContact O-CG 3.45Å; L317-K321 PolarHBondContact O-N 3.27Å; L317-K321 VanDerWaalsContact O-N 3.15Å; R319-K321 VanDerWaalsContact C-N 3.3Å; R319-K321 PolarHBondContact O-N 2.75Å; K321-D329 WeakPolarHBondContact CD-OD2 3.39Å; K321-D329 WeakPolarHBondContact CE-OD2 3.29Å; K321-D329 IonicContact NZ-OD2 3.42Å; K321-D329 PolarHBondContact NZ-OD2 2.82Å
322	R	96.3	Very high	95.2	Very high	185 Å²	185	72.5 Å²	72.5	70%	0.698	35%	0.348	S	S	*	.	H	α-helix	trans	-89.2	-22.9	173.6	-69.3	-175.2	-46.9	-99.2	4.7	112.7	S318 R319 L320	S318-R322 VanDerWaalsContact C-NH1 3.32Å; S318-R322 WeakPolarHBondContact O-CG 3.31Å; S318-R322 VanDerWaalsContact O-CZ 3.32Å; S318-R322 PolarHBondContact O-NH1 3.25Å; R319-R322 WeakPolarHBondContact O-CB 3.23Å; R319-R322 PolarHBondContact O-N 3.24Å; L320-R322 PolarHBondContact O-N 3.27Å
323	E	96.1	Very high	95.2	Very high	99 Å²	99	66.9 Å²	66.9	46%	0.463	33%	0.329	S	S	.	.	H	α-helix	trans	-83.1	-28.3	-179	-70.9	169.8	-168.6	0	0	112	R319 L320	R319-E323 WeakPolarHBondContact CD-OE1 3.46Å; R319-E323 WeakPolarHBondContact CG-OE1 3.44Å; R319-E323 IonicContact CZ-OE1 2.95Å; R319-E323 IonicContact CZ-OE2 3.74Å; R319-E323 IonicContact NE-OE1 3.34Å; R319-E323 IonicContact NH1-OE1 3.75Å; R319-E323 PolarHBondContact NH1-OE1 2.68Å; R319-E323 IonicContact NH1-OE2 3.06Å; R319-E323 PolarHBondContact NH1-OE2 2.95Å; R319-E323 PolarHBondContact O-N 3.25Å; L320-E323 PolarHBondContact O-N 3.1Å; L320-E323 VanDerWaalsContact O-N 3.14Å
324	H	96.2	Very high	95	Very high	12 Å²	12	68 Å²	68	6%	0.056	33%	0.334	C	S	.	.	S	Bend	trans	-111	158	-180	-58.5	-70.5	0	0	0	112.9	L320 E328 I332 T385 P387 Y388	L320-H324 PolarHBondContact O-CD2 2.89Å; L320-H324 VanDerWaalsContact O-CD2 3.27Å; L320-H324 PolarHBondContact O-N 3.01Å; H324-E328 HydrophobicContact CB-CB 4.46Å; H324-I332 HydrophobicContact CB-CD1 3.79Å; H324-I332 HydrophobicContact CB-CG1 4.34Å; H324-T385 PolarHBondContact CE1-O 3.31Å; H324-T385 VanDerWaalsContact CE1-O 3.22Å; H324-T385 PolarHBondContact ND1-O 3.11Å; H324-T385 PolarHBondContact ND1-OG1 3.06Å; H324-P387 PolarHBondContact CE1-O 2.9Å; H324-P387 VanDerWaalsContact CE1-O 3.3Å; H324-Y388 AromaticContact CD2-CD1 3.87Å; H324-Y388 AromaticContact CE1-CD1 3.2Å; H324-Y388 WeakPolarHBondContact CE1-CD1 3.14Å; H324-Y388 AromaticContact CE1-CE1 3.42Å; H324-Y388 VanDerWaalsContact CE1-CE1 3.42Å; H324-Y388 WeakPolarHBondContact CE1-CE1 3.46Å; H324-Y388 AromaticContact CE1-CG 3.62Å; H324-Y388 AromaticContact CG-CE1 3.96Å; H324-Y388 AromaticContact ND1-CD1 3.79Å; H324-Y388 AromaticContact ND1-CE1 3.52Å; H324-Y388 AromaticContact NE2-CD1 3.21Å; H324-Y388 WeakPolarHBondContact NE2-CD1 3.49Å; H324-Y388 AromaticContact NE2-CE1 3.76Å; H324-Y388 AromaticContact NE2-CG 3.8Å
325	P	96.6	Very high	94.8	Very high	60 Å²	60	70.3 Å²	70.3	39%	0.39	35%	0.345	S	S	.	.			trans	-65.1	147.8	176	-20	32.6	0	0	0	113.3	S327 E328 T385	P325-S327 PolarHBondContact O-N 3.42Å; P325-E328 WeakPolarHBondContact CD-OE1 3.39Å; P325-E328 WeakPolarHBondContact O-CB 3.48Å; P325-E328 PolarHBondContact O-N 3.25Å; P325-T385 HydrophobicContact CG-CG2 4.12Å
326	E	94.9	Very high	94.8	Very high	179 Å²	179	72.5 Å²	72.5	84%	0.836	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-54.4	-18.4	178.9	-61.4	-176.8	169.2	0	0	114.8	E328 D329	E326-E328 PolarHBondContact O-N 2.72Å; E326-D329 WeakPolarHBondContact O-CB 3.48Å
327	S	94.9	Very high	94.7	Very high	103 Å²	103	77.2 Å²	77.2	72%	0.72	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-66.4	-21.8	172.6	49.5	0	0	0	0	113.6	P325	P325-S327 PolarHBondContact O-N 3.42Å
328	E	94.8	Very high	94.7	Very high	6 Å²	6	75.7 Å²	75.7	3%	0.028	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-99	-3.5	-175.5	-55.2	-168.5	-140.6	0	0	113.1	H324 P325 E326 R330 T331 I332 Y384 T385 Y388	H324-E328 HydrophobicContact CB-CB 4.46Å; P325-E328 WeakPolarHBondContact CD-OE1 3.39Å; P325-E328 WeakPolarHBondContact O-CB 3.48Å; P325-E328 PolarHBondContact O-N 3.25Å; E326-E328 PolarHBondContact O-N 2.72Å; E328-R330 PolarHBondContact O-N 2.97Å; E328-T331 WeakPolarHBondContact CA-OG1 3.3Å; E328-T331 PolarHBondContact O-N 3.12Å; E328-T331 PolarHBondContact O-OG1 2.83Å; E328-T331 VanDerWaalsContact O-OG1 3.04Å; E328-I332 HydrophobicContact CB-CD1 4.11Å; E328-I332 HydrophobicContact CB-CG1 4.02Å; E328-I332 WeakPolarHBondContact O-CD1 3.21Å; E328-I332 VanDerWaalsContact O-CG1 3.28Å; E328-I332 WeakPolarHBondContact O-CG1 3.19Å; E328-I332 PolarHBondContact O-N 3.48Å; E328-Y384 HydrophobicContact CG-CD2 4.17Å; E328-T385 VanDerWaalsContact CD-OG1 3.32Å; E328-T385 VanDerWaalsContact OE1-CG2 3.26Å; E328-T385 WeakPolarHBondContact OE1-CG2 3.49Å; E328-T385 PolarHBondContact OE1-OG1 3.07Å; E328-T385 PolarHBondContact OE2-OG1 3.25Å; E328-Y388 WeakPolarHBondContact OE2-CE1 3.49Å; E328-Y388 PolarHBondContact OE2-OH 3.42Å
329	D	92.8	Very high	94.6	Very high	58 Å²	58	73 Å²	73	31%	0.31	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-21.6	-177.4	-116.4	52.5	0	0	0	115.2	K321 E326	K321-D329 WeakPolarHBondContact CD-OD2 3.39Å; K321-D329 WeakPolarHBondContact CE-OD2 3.29Å; K321-D329 IonicContact NZ-OD2 3.42Å; K321-D329 PolarHBondContact NZ-OD2 2.82Å; E326-D329 WeakPolarHBondContact O-CB 3.48Å
330	R	91.3	Very high	94.4	Very high	226 Å²	226	73.5 Å²	73.5	85%	0.853	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	-3.1	-177.8	-54.2	-175.1	70.6	165	4.1	113.8	E328	E328-R330 PolarHBondContact O-N 2.97Å
331	T	93.6	Very high	94.3	Very high	23 Å²	23	75.9 Å²	75.9	14%	0.141	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	-21.7	-176.8	53.4	0	0	0	0	113	E328 I333 L339 H382	E328-T331 WeakPolarHBondContact CA-OG1 3.3Å; E328-T331 PolarHBondContact O-N 3.12Å; E328-T331 PolarHBondContact O-OG1 2.83Å; E328-T331 VanDerWaalsContact O-OG1 3.04Å; T331-I333 VanDerWaalsContact C-N 3.34Å; T331-I333 PolarHBondContact O-N 3.45Å; T331-L339 WeakPolarHBondContact O-CD2 3.44Å; T331-H382 HydrophobicContact CG2-CB 3.97Å
332	I	93.9	Very high	94.2	Very high	4 Å²	4	72.2 Å²	72.2	2%	0.021	35%	0.353	C	S	.	.	S	Bend	trans	-56.6	-46.3	175.9	-67.7	156.3	0	0	0	111.3	L320 H324 E328 L338 L339	L320-I332 HydrophobicContact CB-CG2 3.85Å; L320-I332 HydrophobicContact CD1-CG2 4.1Å; L320-I332 HydrophobicContact CG-CG2 4.44Å; H324-I332 HydrophobicContact CB-CD1 3.79Å; H324-I332 HydrophobicContact CB-CG1 4.34Å; E328-I332 HydrophobicContact CB-CD1 4.11Å; E328-I332 HydrophobicContact CB-CG1 4.02Å; E328-I332 WeakPolarHBondContact O-CD1 3.21Å; E328-I332 VanDerWaalsContact O-CG1 3.28Å; E328-I332 WeakPolarHBondContact O-CG1 3.19Å; E328-I332 PolarHBondContact O-N 3.48Å; I332-L338 HydrophobicContact CG2-CD1 4.23Å; I332-L339 PolarHBondContact O-N 3.45Å
333	I	94.8	Very high	94.2	Very high	40 Å²	40	65.6 Å²	65.6	21%	0.205	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.8	171.7	-56.7	-58.9	0	0	0	108.7	A311 L317 L320 T331 R337 L338	A311-I333 HydrophobicContact CB-CG2 3.87Å; L317-I333 HydrophobicContact CD2-CD1 4.34Å; L317-I333 HydrophobicContact CD2-CG1 3.62Å; L320-I333 HydrophobicContact CD1-CD1 3.99Å; T331-I333 VanDerWaalsContact C-N 3.34Å; T331-I333 PolarHBondContact O-N 3.45Å; I333-R337 WeakPolarHBondContact CA-O 3.27Å; I333-L338 HydrophobicContact CD1-CB 4.42Å; I333-L338 HydrophobicContact CD1-CD1 4.22Å
334	M	93.2	Very high	94.2	Very high	46 Å²	46	61.2 Å²	61.2	23%	0.227	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	133.4	175.1	-64.1	-177.3	-68.4	0	0	108.1	D336 R337 L339 G340 P381	M334-D336 PolarHBondContact O-N 2.95Å; M334-R337 PolarHBondContact N-O 2.89Å; M334-R337 PolarHBondContact O-N 2.87Å; M334-R337 VanDerWaalsContact O-O 3.06Å; M334-L339 VanDerWaalsContact CE-O 3.23Å; M334-L339 WeakPolarHBondContact CE-O 3.15Å; M334-G340 WeakPolarHBondContact O-CA 3.37Å; M334-P381 HydrophobicContact CE-CG 4.1Å
335	E	91.9	Very high	94.3	Very high	182 Å²	182	60.7 Å²	60.7	85%	0.85	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	45	-178.5	-55.5	-173.3	172.9	0	0	112.7	R337	E335-R337 PolarHBondContact O-N 3.14Å; E335-R337 VanDerWaalsContact O-N 3.12Å
336	D	94.2	Very high	94.3	Very high	90 Å²	90	58.7 Å²	58.7	48%	0.481	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	21.5	-177	-55.4	-32.6	0	0	0	115.1	A311 W312 M334	A311-D336 HydrophobicContact CB-CB 4.08Å; A311-D336 WeakPolarHBondContact CB-O 3.38Å; W312-D336 HydrophobicContact CZ2-CB 3.89Å; M334-D336 PolarHBondContact O-N 2.95Å
337	R	95.2	Very high	94.5	Very high	103 Å²	103	50.1 Å²	50.1	39%	0.389	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	145.1	179.9	-70.2	167.6	177.9	-92.3	-7.7	112.6	I333 M334 E335 L339 G340 V341 L342 I343	I333-R337 WeakPolarHBondContact CA-O 3.27Å; M334-R337 PolarHBondContact N-O 2.89Å; M334-R337 PolarHBondContact O-N 2.87Å; M334-R337 VanDerWaalsContact O-O 3.06Å; E335-R337 PolarHBondContact O-N 3.14Å; E335-R337 VanDerWaalsContact O-N 3.12Å; R337-L339 PolarHBondContact O-N 3.41Å; R337-G340 PolarHBondContact O-N 3.04Å; R337-V341 PolarHBondContact NH1-O 2.96Å; R337-L342 CarbonylContact C-O 3.54Å; R337-L342 WeakPolarHBondContact CA-O 3.48Å; R337-L342 WeakPolarHBondContact CB-O 3.45Å; R337-I343 HydrophobicContact CG-CG1 4.15Å
338	L	94.9	Very high	94.7	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	117.7	170.4	-175.2	65.8	0	0	0	109.9	L320 I332 I333 G340 V341 L342 L353 L389	L320-L338 HydrophobicContact CD1-CD1 4.18Å; L320-L338 HydrophobicContact CD2-CD1 4.27Å; I332-L338 HydrophobicContact CG2-CD1 4.23Å; I333-L338 HydrophobicContact CD1-CB 4.42Å; I333-L338 HydrophobicContact CD1-CD1 4.22Å; L338-G340 PolarHBondContact O-N 2.78Å; L338-V341 PolarHBondContact O-N 2.8Å; L338-L342 HydrophobicContact CB-CB 4.48Å; L338-L342 PolarHBondContact N-O 2.75Å; L338-L342 PolarHBondContact O-N 3.35Å; L338-L353 HydrophobicContact CD2-CD1 4.28Å; L338-L389 HydrophobicContact CD2-CB 4.17Å; L338-L389 HydrophobicContact CD2-CD1 3.95Å
339	L	94.2	Very high	94.8	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	24.4	-171.4	-57.9	178	0	0	0	114.8	T331 I332 M334 R337 V341 L353 P380 Y383 Y388	T331-L339 WeakPolarHBondContact O-CD2 3.44Å; I332-L339 PolarHBondContact O-N 3.45Å; M334-L339 VanDerWaalsContact CE-O 3.23Å; M334-L339 WeakPolarHBondContact CE-O 3.15Å; R337-L339 PolarHBondContact O-N 3.41Å; L339-V341 VanDerWaalsContact C-N 3.28Å; L339-L353 HydrophobicContact CD1-CD2 4.07Å; L339-P380 HydrophobicContact CB-CB 3.85Å; L339-P380 HydrophobicContact CD1-CB 3.86Å; L339-P380 HydrophobicContact CD1-CG 4.12Å; L339-Y383 HydrophobicContact CD1-CD2 3.63Å; L339-Y383 HydrophobicContact CD1-CE2 4.26Å; L339-Y388 HydrophobicContact CD1-CD1 4.11Å; L339-Y388 HydrophobicContact CD1-CD2 3.92Å; L339-Y388 HydrophobicContact CD1-CE1 4.43Å; L339-Y388 HydrophobicContact CD1-CE2 4.22Å; L339-Y388 HydrophobicContact CD1-CG 3.84Å; L339-Y388 HydrophobicContact CD2-CD1 4.04Å; L339-Y388 HydrophobicContact CD2-CE1 3.97Å; L339-Y388 HydrophobicContact CG-CD1 4.29Å; L339-Y388 HydrophobicContact CG-CG 4.42Å
340	G	92.4	Very high	95	Very high	34 Å²	34	43.1 Å²	43.1	35%	0.351	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	75	12.8	-174.6	0	0	0	0	0	114.7	M334 R337 L338	M334-G340 WeakPolarHBondContact O-CA 3.37Å; R337-G340 PolarHBondContact O-N 3.04Å; L338-G340 PolarHBondContact O-N 2.78Å
341	V	92.1	Very high	95.1	Very high	51 Å²	51	32.4 Å²	32.4	31%	0.309	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-65.1	-175	-172.5	0	0	0	0	111.2	R337 L338 L339 F378 P380	R337-V341 PolarHBondContact NH1-O 2.96Å; L338-V341 PolarHBondContact O-N 2.8Å; L339-V341 VanDerWaalsContact C-N 3.28Å; V341-F378 HydrophobicContact CG2-CD1 4.37Å; V341-F378 HydrophobicContact CG2-CE1 3.61Å; V341-F378 HydrophobicContact CG2-CZ 4.48Å; V341-P380 HydrophobicContact CG2-CB 4.23Å; V341-P380 HydrophobicContact CG2-CG 4.2Å
342	L	93.9	Very high	95	Very high	15 Å²	15	32.9 Å²	32.9	8%	0.079	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-106.9	139.1	-163	-172.2	62.2	0	0	0	111.5	H143 R337 L338 P344 D350 L353 L389	H143-L342 WeakPolarHBondContact NE2-CD1 3.49Å; R337-L342 CarbonylContact C-O 3.54Å; R337-L342 WeakPolarHBondContact CA-O 3.48Å; R337-L342 WeakPolarHBondContact CB-O 3.45Å; L338-L342 HydrophobicContact CB-CB 4.48Å; L338-L342 PolarHBondContact N-O 2.75Å; L338-L342 PolarHBondContact O-N 3.35Å; L342-P344 HydrophobicContact CD1-CG 3.86Å; L342-P344 HydrophobicContact CD2-CG 4.21Å; L342-P344 VanDerWaalsContact CD2-O 3.29Å; L342-P344 WeakPolarHBondContact CD2-O 3.48Å; L342-P344 HydrophobicContact CG-CG 3.81Å; L342-P344 WeakPolarHBondContact CG-O 3.37Å; L342-D350 WeakPolarHBondContact CD2-OD2 3.49Å; L342-L353 HydrophobicContact CB-CD1 4.07Å; L342-L353 HydrophobicContact CD2-CD1 3.75Å; L342-L389 HydrophobicContact CD2-CD1 4.2Å; L342-L389 HydrophobicContact CD2-CD2 4Å
343	I	95.6	Very high	95.1	Very high	46 Å²	46	33 Å²	33	24%	0.236	17%	0.169	C	C	.	.	S	Bend	trans	-73.6	-55.9	173.9	-58.5	178	0	0	0	110.2	D286 N310 W312 R337 C345	D286-I343 WeakPolarHBondContact OD2-CG2 3.19Å; N310-I343 HydrophobicContact CB-CG2 4.17Å; W312-I343 HydrophobicContact CZ3-CG2 4.28Å; R337-I343 HydrophobicContact CG-CG1 4.15Å; I343-C345 PolarHBondContact O-N 3.22Å
344	P	97.3	Very high	95.1	Very high	8 Å²	8	32.3 Å²	32.3	5%	0.052	16%	0.164	C	C	.	.			trans	-64.6	131.5	176.4	20	-30.6	0	0	0	111.9	T268 D286 H309 L342 R346	T268-P344 HydrophobicContact CG2-CB 4.05Å; T268-P344 HydrophobicContact CG2-CG 4.04Å; D286-P344 WeakPolarHBondContact OD2-CD 3.15Å; H309-P344 CarbonylContact O-C 3.56Å; H309-P344 WeakPolarHBondContact O-CA 3.42Å; L342-P344 HydrophobicContact CD1-CG 3.86Å; L342-P344 HydrophobicContact CD2-CG 4.21Å; L342-P344 VanDerWaalsContact CD2-O 3.29Å; L342-P344 WeakPolarHBondContact CD2-O 3.48Å; L342-P344 HydrophobicContact CG-CG 3.81Å; L342-P344 WeakPolarHBondContact CG-O 3.37Å; P344-R346 VanDerWaalsContact C-N 3.31Å
345	C	97.1	Very high	95.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.156	C	C	.	.	S	Bend	trans	-86.8	-3.3	173.8	-64	0	0	0	0	112.6	H309 E316 R319 L320 I343 L389	H309-C345 WeakPolarHBondContact O-CB 3.4Å; H309-C345 PolarHBondContact O-N 3.14Å; E316-C345 HydrophobicContact CG-CB 3.63Å; R319-C345 PolarHBondContact NH2-O 3.37Å; L320-C345 HydrophobicContact CD1-CB 4.22Å; I343-C345 PolarHBondContact O-N 3.22Å; C345-L389 VanDerWaalsContact C-CD1 3.49Å; C345-L389 WeakPolarHBondContact O-CD1 3.45Å
346	R	98.5	Very high	95.3	Very high	18 Å²	18	24.4 Å²	24.4	7%	0.068	13%	0.132	C	C	.	.	B	Isolated β-bridge	trans	-142.8	132.6	171	-56.9	-163	-155.9	173.2	12.9	110.5	A284 G285 H309 E316 P344 T390 E392	A284-R346 CarbonylContact C-O 3.57Å; A284-R346 HydrophobicContact CB-CB 4.39Å; G285-R346 VanDerWaalsContact CA-O 3.29Å; G285-R346 WeakPolarHBondContact CA-O 3.38Å; H309-R346 HydrophobicContact CB-CB 4.25Å; H309-R346 HydrophobicContact CB-CG 4.1Å; H309-R346 WeakPolarHBondContact ND1-CD 3.41Å; E316-R346 VanDerWaalsContact OE1-CG 3.24Å; E316-R346 WeakPolarHBondContact OE1-CG 3.22Å; E316-R346 IonicContact OE1-CZ 2.68Å; E316-R346 IonicContact OE1-NE 3.55Å; E316-R346 PolarHBondContact OE1-NE 2.91Å; E316-R346 IonicContact OE1-NH2 2.75Å; E316-R346 IonicContact OE2-CZ 2.67Å; E316-R346 IonicContact OE2-NE 2.75Å; E316-R346 PolarHBondContact OE2-NE 3.04Å; E316-R346 IonicContact OE2-NH2 3.19Å; E316-R346 PolarHBondContact OE2-NH2 3.2Å; P344-R346 VanDerWaalsContact C-N 3.31Å; R346-T390 CarbonylContact C-O 3.51Å; R346-T390 WeakPolarHBondContact CA-O 3.45Å; R346-T390 VanDerWaalsContact CB-O 3.27Å; R346-T390 WeakPolarHBondContact CB-O 3.22Å; R346-T390 HydrophobicContact CG-CG2 3.97Å; R346-E392 WeakPolarHBondContact CD-O 3.43Å; R346-E392 PolarHBondContact NH1-O 2.77Å
347	A	98.5	Very high	95.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.125	C	C	.	.			trans	-163.9	155.6	177.4	0	0	0	0	0	110.7	A267 K354 L389 T390	A267-A347 CarbonylContact O-C 3.44Å; A267-A347 WeakPolarHBondContact O-CA 3.5Å; A267-A347 WeakPolarHBondContact O-CB 3.48Å; A347-K354 PolarHBondContact O-NZ 3.09Å; A347-L389 HydrophobicContact CB-CD1 4.45Å; A347-L389 HydrophobicContact CB-CD2 4.3Å; A347-T390 PolarHBondContact N-O 3.04Å
348	F	98.8	Very high	94.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	158.2	161.7	-72.1	-89.6	0	0	0	111	V152 L156 F235 L238 D239 I242 G266 A267 A269 A391	V152-F348 HydrophobicContact CG1-CD2 3.9Å; V152-F348 HydrophobicContact CG1-CE2 3.94Å; V152-F348 HydrophobicContact CG1-CG 4.21Å; V152-F348 HydrophobicContact CG1-CZ 4.28Å; V152-F348 HydrophobicContact CG2-CB 3.65Å; V152-F348 HydrophobicContact CG2-CD1 3.91Å; V152-F348 HydrophobicContact CG2-CD2 4.1Å; V152-F348 HydrophobicContact CG2-CG 3.62Å; L156-F348 HydrophobicContact CD1-CZ 3.98Å; L156-F348 HydrophobicContact CD2-CE2 4.47Å; L156-F348 HydrophobicContact CD2-CZ 4.32Å; F235-F348 HydrophobicContact CB-CE1 4.49Å; F235-F348 HydrophobicContact CB-CZ 3.85Å; F235-F348 AromaticContact CD1-CE2 3.55Å; F235-F348 HydrophobicContact CD1-CE2 3.55Å; F235-F348 AromaticContact CD1-CZ 3.46Å; F235-F348 HydrophobicContact CD1-CZ 3.46Å; F235-F348 VanDerWaalsContact CD1-CZ 3.46Å; F235-F348 AromaticContact CE1-CE2 3.96Å; F235-F348 HydrophobicContact CE1-CE2 3.96Å; F235-F348 HydrophobicContact CE1-CZ 4.22Å; F235-F348 HydrophobicContact CG-CE2 4.27Å; F235-F348 AromaticContact CG-CZ 3.71Å; F235-F348 HydrophobicContact CG-CZ 3.71Å; F235-F348 VanDerWaalsContact O-CE1 3.28Å; F235-F348 WeakPolarHBondContact O-CE1 3.39Å; L238-F348 HydrophobicContact CB-CE1 4.02Å; L238-F348 HydrophobicContact CD2-CD1 4.44Å; L238-F348 HydrophobicContact CD2-CE1 3.91Å; L238-F348 HydrophobicContact CD2-CZ 4.45Å; L238-F348 HydrophobicContact CG-CD1 4.39Å; L238-F348 HydrophobicContact CG-CE1 4Å; D239-F348 HydrophobicContact CB-CD1 3.8Å; D239-F348 HydrophobicContact CB-CE1 4.12Å; D239-F348 WeakPolarHBondContact OD1-CA 3.5Å; I242-F348 HydrophobicContact CD1-CD1 4.49Å; G266-F348 VanDerWaalsContact CA-O 3.22Å; G266-F348 WeakPolarHBondContact CA-O 3.41Å; A267-F348 PolarHBondContact N-O 2.66Å; A267-F348 VanDerWaalsContact N-O 3.07Å; A267-F348 PolarHBondContact O-N 3.27Å; A269-F348 HydrophobicContact CB-CD2 4.04Å; A269-F348 HydrophobicContact CB-CE2 3.63Å; F348-A391 HydrophobicContact CD1-CB 3.88Å; F348-A391 HydrophobicContact CD2-CB 4.35Å; F348-A391 HydrophobicContact CE1-CB 4Å; F348-A391 HydrophobicContact CE2-CB 4.45Å; F348-A391 HydrophobicContact CG-CB 4.07Å; F348-A391 HydrophobicContact CZ-CB 4.29Å
349	G	97.2	Very high	94.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	71.6	-134.5	177.3	0	0	0	0	0	111.3	D239 A263 S265 V351 K354	D239-G349 PolarHBondContact OD1-N 3.37Å; A263-G349 CarbonylContact O-C 3.59Å; S265-G349 WeakPolarHBondContact O-CA 3.4Å; G349-V351 PolarHBondContact O-N 3.47Å; G349-V351 VanDerWaalsContact O-N 3.12Å; G349-K354 WeakPolarHBondContact O-CD 3.28Å; G349-K354 WeakPolarHBondContact O-CE 3.3Å; G349-K354 PolarHBondContact O-NZ 3.49Å
350	D	96	Very high	94.5	Very high	19 Å²	19	27 Å²	27	10%	0.102	15%	0.145	C	C	.	.			trans	47.6	42.6	177.4	-76.8	-43.5	0	0	0	113.2	H143 A263 S265 L342 Q352 L353 L389	H143-D350 IonicContact CD2-OD1 3.91Å; H143-D350 IonicContact CD2-OD2 3.9Å; H143-D350 IonicContact CE1-OD2 3.77Å; H143-D350 PolarHBondContact CE1-OD2 3.25Å; H143-D350 IonicContact NE2-OD1 3.25Å; H143-D350 PolarHBondContact NE2-OD1 3.19Å; H143-D350 IonicContact NE2-OD2 3.69Å; H143-D350 PolarHBondContact NE2-OD2 3.25Å; A263-D350 PolarHBondContact O-N 2.98Å; S265-D350 PolarHBondContact O-N 3.17Å; L342-D350 WeakPolarHBondContact CD2-OD2 3.49Å; D350-Q352 PolarHBondContact O-N 3.39Å; D350-L353 HydrophobicContact CB-CD1 4.48Å; D350-L353 PolarHBondContact O-N 3.44Å; D350-L389 HydrophobicContact CB-CD2 3.29Å
351	V	94.5	Very high	94.3	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.012	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-60	-16.8	-173.8	-64.3	0	0	0	0	113.6	A263 F264 G349 L353 K354 W355	A263-V351 HydrophobicContact CB-CG1 3.97Å; A263-V351 HydrophobicContact CB-CG2 4.21Å; A263-V351 WeakPolarHBondContact O-CG1 3.31Å; A263-V351 WeakPolarHBondContact O-CG2 3.42Å; A263-V351 PolarHBondContact O-N 2.9Å; F264-V351 HydrophobicContact CD2-CG2 3.74Å; F264-V351 HydrophobicContact CE1-CG2 4.49Å; F264-V351 HydrophobicContact CE2-CG2 3.63Å; F264-V351 HydrophobicContact CG-CG2 4.23Å; F264-V351 HydrophobicContact CZ-CG2 4.04Å; G349-V351 PolarHBondContact O-N 3.47Å; G349-V351 VanDerWaalsContact O-N 3.12Å; V351-L353 PolarHBondContact O-N 3.1Å; V351-K354 PolarHBondContact O-N 3.07Å; V351-K354 VanDerWaalsContact O-N 3.13Å; V351-W355 HydrophobicContact CB-CD2 3.64Å; V351-W355 HydrophobicContact CB-CE3 4.04Å; V351-W355 HydrophobicContact CB-CG 4Å; V351-W355 HydrophobicContact CB-CH2 4.29Å; V351-W355 HydrophobicContact CB-CZ2 3.94Å; V351-W355 HydrophobicContact CB-CZ3 4.34Å; V351-W355 HydrophobicContact CG1-CD2 4.28Å; V351-W355 HydrophobicContact CG1-CH2 4.47Å; V351-W355 HydrophobicContact CG1-CZ2 3.8Å; V351-W355 HydrophobicContact CG2-CD2 3.96Å; V351-W355 HydrophobicContact CG2-CE3 3.81Å; V351-W355 HydrophobicContact CG2-CH2 3.85Å; V351-W355 HydrophobicContact CG2-CZ2 4.01Å; V351-W355 HydrophobicContact CG2-CZ3 3.75Å; V351-W355 WeakPolarHBondContact O-CB 3.28Å; V351-W355 PolarHBondContact O-N 3.14Å
352	Q	92	Very high	94.2	Very high	33 Å²	33	32.1 Å²	32.1	15%	0.154	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-57.1	-27.9	169.5	-61.3	-166.4	-5.5	0	0	113.9	F264 D350 Q360 Y376 F378 Y383	F264-Q352 HydrophobicContact CD1-CG 3.8Å; F264-Q352 HydrophobicContact CE1-CG 3.76Å; D350-Q352 PolarHBondContact O-N 3.39Å; Q352-Q360 PolarHBondContact O-NE2 3.31Å; Q352-Y376 PolarHBondContact NE2-O 3.07Å; Q352-F378 PolarHBondContact OE1-O 3.34Å; Q352-Y383 PolarHBondContact O-OH 2.85Å; Q352-Y383 VanDerWaalsContact O-OH 3.1Å
353	L	94.6	Very high	93.9	Very high	5 Å²	5	31.4 Å²	31.4	3%	0.026	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-98.9	-6.9	178.9	-61.3	175.1	0	0	0	113.1	L338 L339 L342 D350 V351 P380 Y383 Y388 L389	L338-L353 HydrophobicContact CD2-CD1 4.28Å; L339-L353 HydrophobicContact CD1-CD2 4.07Å; L342-L353 HydrophobicContact CB-CD1 4.07Å; L342-L353 HydrophobicContact CD2-CD1 3.75Å; D350-L353 HydrophobicContact CB-CD1 4.48Å; D350-L353 PolarHBondContact O-N 3.44Å; V351-L353 PolarHBondContact O-N 3.1Å; L353-P380 HydrophobicContact CD2-CG 3.69Å; L353-Y383 PolarHBondContact O-OH 2.75Å; L353-Y388 PolarHBondContact O-N 3.06Å; L353-L389 HydrophobicContact CB-CB 3.76Å; L353-L389 HydrophobicContact CB-CD2 4.11Å; L353-L389 HydrophobicContact CD1-CB 4.49Å; L353-L389 HydrophobicContact CD1-CD2 3.96Å
354	K	95.8	Very high	93.3	Very high	26 Å²	26	30.6 Å²	30.6	11%	0.113	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111	-45.6	-175.1	-58.6	-179.6	178.9	164.8	0	113.3	D239 A347 G349 V351 Y383 P387 L389	D239-K354 IonicContact OD1-NZ 2.76Å; D239-K354 PolarHBondContact OD1-NZ 3.03Å; D239-K354 WeakPolarHBondContact OD2-CE 3.34Å; D239-K354 IonicContact OD2-NZ 2.64Å; D239-K354 PolarHBondContact OD2-NZ 2.84Å; A347-K354 PolarHBondContact O-NZ 3.09Å; G349-K354 WeakPolarHBondContact O-CD 3.28Å; G349-K354 WeakPolarHBondContact O-CE 3.3Å; G349-K354 PolarHBondContact O-NZ 3.49Å; V351-K354 PolarHBondContact O-N 3.07Å; V351-K354 VanDerWaalsContact O-N 3.13Å; K354-Y383 PolarHBondContact N-OH 3.32Å; K354-P387 HydrophobicContact CB-CB 4.36Å; K354-L389 HydrophobicContact CG-CB 4.19Å
355	W	94.9	Very high	92.8	Very high	12 Å²	12	37.1 Å²	37.1	5%	0.045	18%	0.18	C	C	.	.	S	Bend	trans	-80.7	156	-173	-71.6	-5.2	0	0	0	113.9	S243 I246 Q247 F264 V351 L359 Q360 V363 Y383	S243-W355 PolarHBondContact OG-NE1 3.33Å; I246-W355 HydrophobicContact CG1-CH2 4.4Å; I246-W355 HydrophobicContact CG2-CH2 3.46Å; I246-W355 VanDerWaalsContact CG2-CH2 3.46Å; I246-W355 HydrophobicContact CG2-CZ2 3.55Å; Q247-W355 HydrophobicContact CG-CZ2 4.3Å; F264-W355 HydrophobicContact CE2-CH2 4.43Å; F264-W355 HydrophobicContact CE2-CZ3 4.03Å; F264-W355 HydrophobicContact CZ-CZ3 4.35Å; V351-W355 HydrophobicContact CB-CD2 3.64Å; V351-W355 HydrophobicContact CB-CE3 4.04Å; V351-W355 HydrophobicContact CB-CG 4Å; V351-W355 HydrophobicContact CB-CH2 4.29Å; V351-W355 HydrophobicContact CB-CZ2 3.94Å; V351-W355 HydrophobicContact CB-CZ3 4.34Å; V351-W355 HydrophobicContact CG1-CD2 4.28Å; V351-W355 HydrophobicContact CG1-CH2 4.47Å; V351-W355 HydrophobicContact CG1-CZ2 3.8Å; V351-W355 HydrophobicContact CG2-CD2 3.96Å; V351-W355 HydrophobicContact CG2-CE3 3.81Å; V351-W355 HydrophobicContact CG2-CH2 3.85Å; V351-W355 HydrophobicContact CG2-CZ2 4.01Å; V351-W355 HydrophobicContact CG2-CZ3 3.75Å; V351-W355 WeakPolarHBondContact O-CB 3.28Å; V351-W355 PolarHBondContact O-N 3.14Å; W355-L359 HydrophobicContact CB-CB 4.37Å; W355-L359 HydrophobicContact CB-CD2 4.04Å; W355-L359 HydrophobicContact CB-CG 4.35Å; W355-L359 HydrophobicContact CD2-CD2 3.74Å; W355-L359 HydrophobicContact CD2-CG 3.91Å; W355-L359 HydrophobicContact CE3-CD2 4.33Å; W355-L359 HydrophobicContact CE3-CG 3.98Å; W355-L359 HydrophobicContact CG-CD2 3.6Å; W355-L359 HydrophobicContact CG-CG 4.12Å; W355-Q360 HydrophobicContact CB-CG 3.75Å; W355-Q360 HydrophobicContact CE3-CG 3.96Å; W355-Q360 PolarHBondContact O-NE2 3.34Å; W355-V363 HydrophobicContact CH2-CB 4.41Å; W355-V363 HydrophobicContact CH2-CG1 4.22Å; W355-V363 HydrophobicContact CH2-CG2 3.96Å; W355-V363 HydrophobicContact CZ3-CB 3.92Å; W355-V363 HydrophobicContact CZ3-CG1 4.06Å; W355-V363 HydrophobicContact CZ3-CG2 3.73Å; W355-Y383 PolarHBondContact N-OH 3.37Å; W355-Y383 WeakPolarHBondContact O-CE1 3.44Å; W355-Y383 PolarHBondContact O-OH 3.01Å
356	S	93.8	Very high	92.1	Very high	50 Å²	50	42.2 Å²	42.2	35%	0.35	20%	0.199	S	C	.	.			trans	-64.5	155.2	167.2	70.5	0	0	0	0	112.2	E358 L359 Q360	S356-E358 PolarHBondContact O-N 3.08Å; S356-L359 PolarHBondContact O-N 2.86Å; S356-L359 VanDerWaalsContact O-N 3.16Å; S356-L359 WeakPolarHBondContact OG-CB 3.11Å; S356-L359 PolarHBondContact OG-N 2.54Å; S356-Q360 WeakPolarHBondContact O-CG 3.4Å; S356-Q360 PolarHBondContact O-N 2.97Å
357	K	90.6	Very high	90.8	Very high	80 Å²	80	44.5 Å²	44.5	35%	0.348	23%	0.228	S	C	.	.	H	α-helix	trans	-62.2	-31.2	179.8	-64.8	177.4	-174.6	170.5	0	112	R361 T379 Y383	K357-R361 WeakPolarHBondContact O-CB 3.27Å; K357-R361 PolarHBondContact O-N 2.85Å; K357-R361 VanDerWaalsContact O-N 3.12Å; K357-T379 HydrophobicContact CD-CG2 4.41Å; K357-T379 HydrophobicContact CG-CG2 4.34Å; K357-Y383 HydrophobicContact CD-CD1 4.5Å; K357-Y383 WeakPolarHBondContact CE-O 3.42Å; K357-Y383 HydrophobicContact CG-CD1 3.99Å; K357-Y383 HydrophobicContact CG-CE1 4.32Å; K357-Y383 PolarHBondContact NZ-O 3.11Å
358	E	91.3	Very high	89.9	Confident	118 Å²	118	45.4 Å²	45.4	55%	0.551	23%	0.232	S	C	*	.	H	α-helix	trans	-68.4	-44.1	176.9	-64.4	63.4	-137.9	0	0	110.7	S356 S362	S356-E358 PolarHBondContact O-N 3.08Å; E358-S362 VanDerWaalsContact O-CB 3.27Å; E358-S362 WeakPolarHBondContact O-CB 3.42Å; E358-S362 PolarHBondContact O-N 2.85Å
359	L	91.3	Very high	88.9	Confident	41 Å²	41	50.1 Å²	50.1	22%	0.215	26%	0.257	C	S	.	.	H	α-helix	trans	-68.3	-47.2	178.2	-179.3	58.3	0	0	0	111.4	Q247 W355 S356 R361 S362 V363	Q247-L359 HydrophobicContact CG-CD1 4.21Å; W355-L359 HydrophobicContact CB-CB 4.37Å; W355-L359 HydrophobicContact CB-CD2 4.04Å; W355-L359 HydrophobicContact CB-CG 4.35Å; W355-L359 HydrophobicContact CD2-CD2 3.74Å; W355-L359 HydrophobicContact CD2-CG 3.91Å; W355-L359 HydrophobicContact CE3-CD2 4.33Å; W355-L359 HydrophobicContact CE3-CG 3.98Å; W355-L359 HydrophobicContact CG-CD2 3.6Å; W355-L359 HydrophobicContact CG-CG 4.12Å; S356-L359 PolarHBondContact O-N 2.86Å; S356-L359 VanDerWaalsContact O-N 3.16Å; S356-L359 WeakPolarHBondContact OG-CB 3.11Å; S356-L359 PolarHBondContact OG-N 2.54Å; L359-R361 VanDerWaalsContact C-N 3.31Å; L359-R361 PolarHBondContact O-N 2.97Å; L359-S362 PolarHBondContact O-N 3.48Å; L359-S362 VanDerWaalsContact O-N 3.16Å; L359-V363 HydrophobicContact CD1-CG2 4.16Å; L359-V363 WeakPolarHBondContact O-CG2 3.32Å; L359-V363 PolarHBondContact O-N 2.72Å
360	Q	89.1	Confident	88	Confident	8 Å²	8	51 Å²	51	4%	0.037	26%	0.263	C	S	.	.	H	α-helix	trans	-53.8	-48.3	175.1	-67.9	179.4	25.3	0	0	111.3	Q352 W355 S356 V363 L364 Y383	Q352-Q360 PolarHBondContact O-NE2 3.31Å; W355-Q360 HydrophobicContact CB-CG 3.75Å; W355-Q360 HydrophobicContact CE3-CG 3.96Å; W355-Q360 PolarHBondContact O-NE2 3.34Å; S356-Q360 WeakPolarHBondContact O-CG 3.4Å; S356-Q360 PolarHBondContact O-N 2.97Å; Q360-V363 PolarHBondContact O-N 2.78Å; Q360-L364 WeakPolarHBondContact O-CB 3.27Å; Q360-L364 VanDerWaalsContact O-CG 3.27Å; Q360-L364 WeakPolarHBondContact O-CG 3.46Å; Q360-L364 PolarHBondContact O-N 3.02Å; Q360-L364 VanDerWaalsContact O-N 3.1Å; Q360-Y383 PolarHBondContact NE2-OH 3.19Å
361	R	87.8	Confident	87	Confident	133 Å²	133	58.2 Å²	58.2	50%	0.502	30%	0.296	S	S	.	.	H	α-helix	trans	-62.3	-47.6	176.6	-170.3	-174.7	-53.6	124.6	11.6	111.9	K357 L359 V363 L364 E365	K357-R361 WeakPolarHBondContact O-CB 3.27Å; K357-R361 PolarHBondContact O-N 2.85Å; K357-R361 VanDerWaalsContact O-N 3.12Å; L359-R361 VanDerWaalsContact C-N 3.31Å; L359-R361 PolarHBondContact O-N 2.97Å; R361-V363 VanDerWaalsContact C-N 3.26Å; R361-V363 PolarHBondContact O-N 3.49Å; R361-L364 PolarHBondContact O-N 2.76Å; R361-E365 VanDerWaalsContact CD-OE1 3.27Å; R361-E365 WeakPolarHBondContact CD-OE1 3.5Å; R361-E365 HydrophobicContact CG-CG 4.14Å; R361-E365 WeakPolarHBondContact CG-OE1 3.29Å; R361-E365 WeakPolarHBondContact O-CB 3.32Å; R361-E365 WeakPolarHBondContact O-CG 3.17Å; R361-E365 PolarHBondContact O-N 2.7Å
362	S	89.8	Confident	86	Confident	61 Å²	61	61.4 Å²	61.4	43%	0.427	32%	0.322	S	S	.	.	H	α-helix	trans	-63.3	-28	-178.1	-180	0	0	0	0	113.8	E358 L359 R366	E358-S362 VanDerWaalsContact O-CB 3.27Å; E358-S362 WeakPolarHBondContact O-CB 3.42Å; E358-S362 PolarHBondContact O-N 2.85Å; L359-S362 PolarHBondContact O-N 3.48Å; L359-S362 VanDerWaalsContact O-N 3.16Å; S362-R366 WeakPolarHBondContact O-CG 3.14Å; S362-R366 PolarHBondContact O-NE 2.78Å
363	V	87.4	Confident	85.3	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-78.1	-47.5	173.3	171.5	0	0	0	0	110.9	I246 L260 W355 L359 Q360 R361 E365 R366 F368	I246-V363 HydrophobicContact CD1-CG1 4.32Å; I246-V363 HydrophobicContact CG1-CG1 3.82Å; L260-V363 HydrophobicContact CD1-CG1 3.92Å; W355-V363 HydrophobicContact CH2-CB 4.41Å; W355-V363 HydrophobicContact CH2-CG1 4.22Å; W355-V363 HydrophobicContact CH2-CG2 3.96Å; W355-V363 HydrophobicContact CZ3-CB 3.92Å; W355-V363 HydrophobicContact CZ3-CG1 4.06Å; W355-V363 HydrophobicContact CZ3-CG2 3.73Å; L359-V363 HydrophobicContact CD1-CG2 4.16Å; L359-V363 WeakPolarHBondContact O-CG2 3.32Å; L359-V363 PolarHBondContact O-N 2.72Å; Q360-V363 PolarHBondContact O-N 2.78Å; R361-V363 VanDerWaalsContact C-N 3.26Å; R361-V363 PolarHBondContact O-N 3.49Å; V363-E365 VanDerWaalsContact C-N 3.33Å; V363-E365 PolarHBondContact O-N 3.39Å; V363-R366 VanDerWaalsContact O-CB 3.31Å; V363-R366 WeakPolarHBondContact O-CB 3.47Å; V363-R366 VanDerWaalsContact O-CG 3.29Å; V363-R366 WeakPolarHBondContact O-CG 3.49Å; V363-R366 PolarHBondContact O-N 2.84Å; V363-F368 HydrophobicContact CG1-CE2 4.34Å; V363-F368 WeakPolarHBondContact O-CD2 3.37Å; V363-F368 WeakPolarHBondContact O-CE2 3.45Å
364	L	84.3	Confident	84.3	Confident	28 Å²	28	66.5 Å²	66.5	15%	0.147	35%	0.351	C	S	.	.	H	α-helix	trans	-65.4	-32.9	-178.4	-67.7	169.6	0	0	0	113	F264 Q360 R361 R366 T370 Q377	F264-L364 HydrophobicContact CE1-CD1 4.46Å; F264-L364 HydrophobicContact CE1-CD2 4.14Å; F264-L364 HydrophobicContact CZ-CD1 4.36Å; F264-L364 HydrophobicContact CZ-CD2 3.85Å; F264-L364 HydrophobicContact CZ-CG 4.12Å; Q360-L364 WeakPolarHBondContact O-CB 3.27Å; Q360-L364 VanDerWaalsContact O-CG 3.27Å; Q360-L364 WeakPolarHBondContact O-CG 3.46Å; Q360-L364 PolarHBondContact O-N 3.02Å; Q360-L364 VanDerWaalsContact O-N 3.1Å; R361-L364 PolarHBondContact O-N 2.76Å; L364-R366 PolarHBondContact O-N 2.94Å; L364-T370 HydrophobicContact CD2-CG2 3.79Å; L364-Q377 HydrophobicContact CD1-CG 4.09Å
365	E	85.4	Confident	83.5	Confident	145 Å²	145	66.1 Å²	66.1	68%	0.678	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-6	177	-75	176.2	175.1	0	0	114.2	R361 V363 G367	R361-E365 VanDerWaalsContact CD-OE1 3.27Å; R361-E365 WeakPolarHBondContact CD-OE1 3.5Å; R361-E365 HydrophobicContact CG-CG 4.14Å; R361-E365 WeakPolarHBondContact CG-OE1 3.29Å; R361-E365 WeakPolarHBondContact O-CB 3.32Å; R361-E365 WeakPolarHBondContact O-CG 3.17Å; R361-E365 PolarHBondContact O-N 2.7Å; V363-E365 VanDerWaalsContact C-N 3.33Å; V363-E365 PolarHBondContact O-N 3.39Å; E365-G367 PolarHBondContact O-N 3.3Å
366	R	82.9	Confident	82.1	Confident	108 Å²	108	74.4 Å²	74.4	41%	0.408	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	10.2	180	-60.5	175.6	-177.5	-162.4	-3.7	115	I246 Q247 S362 V363 L364 F368	I246-R366 PolarHBondContact O-NH1 3.33Å; Q247-R366 PolarHBondContact O-NH1 2.91Å; Q247-R366 PolarHBondContact O-NH2 3.2Å; S362-R366 WeakPolarHBondContact O-CG 3.14Å; S362-R366 PolarHBondContact O-NE 2.78Å; V363-R366 VanDerWaalsContact O-CB 3.31Å; V363-R366 WeakPolarHBondContact O-CB 3.47Å; V363-R366 VanDerWaalsContact O-CG 3.29Å; V363-R366 WeakPolarHBondContact O-CG 3.49Å; V363-R366 PolarHBondContact O-N 2.84Å; L364-R366 PolarHBondContact O-N 2.94Å; R366-F368 HydrophobicContact CB-CD2 4.15Å; R366-F368 HydrophobicContact CB-CE2 3.91Å
367	G	72.1	Confident	81.1	Confident	66 Å²	66	78.1 Å²	78.1	68%	0.68	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	21.9	174.6	0	0	0	0	0	115.2	E365	E365-G367 PolarHBondContact O-N 3.3Å
368	F	78.9	Confident	80.3	Confident	19 Å²	19	78.8 Å²	78.8	8%	0.083	40%	0.397	C	S	.	.			trans	-69.9	139.9	174.8	-68.9	-78.7	0	0	0	112.4	I246 R256 L260 V363 R366 T370 L373	I246-F368 HydrophobicContact CD1-CE1 4.46Å; I246-F368 HydrophobicContact CD1-CE2 4.33Å; I246-F368 HydrophobicContact CD1-CZ 3.69Å; R256-F368 HydrophobicContact CG-CE1 3.66Å; R256-F368 HydrophobicContact CG-CZ 3.69Å; L260-F368 HydrophobicContact CB-CE1 4.08Å; L260-F368 HydrophobicContact CB-CZ 4.39Å; L260-F368 HydrophobicContact CD1-CE2 4.36Å; L260-F368 HydrophobicContact CD1-CZ 4.44Å; L260-F368 HydrophobicContact CD2-CB 3.9Å; L260-F368 HydrophobicContact CD2-CD1 3.52Å; L260-F368 HydrophobicContact CD2-CD2 4Å; L260-F368 HydrophobicContact CD2-CE1 3.88Å; L260-F368 HydrophobicContact CD2-CE2 4.34Å; L260-F368 HydrophobicContact CD2-CG 3.56Å; L260-F368 HydrophobicContact CD2-CZ 4.28Å; L260-F368 HydrophobicContact CG-CE1 4.44Å; V363-F368 HydrophobicContact CG1-CE2 4.34Å; V363-F368 WeakPolarHBondContact O-CD2 3.37Å; V363-F368 WeakPolarHBondContact O-CE2 3.45Å; R366-F368 HydrophobicContact CB-CD2 4.15Å; R366-F368 HydrophobicContact CB-CE2 3.91Å; F368-T370 VanDerWaalsContact C-N 3.34Å; F368-T370 HydrophobicContact CB-CG2 4.33Å; F368-T370 PolarHBondContact O-N 3.26Å; F368-T370 VanDerWaalsContact O-N 3.1Å; F368-L373 HydrophobicContact CD1-CD1 4.47Å
369	N	78.1	Confident	79.6	Confident	98 Å²	98	76.5 Å²	76.5	52%	0.524	39%	0.391	S	S	.	.			trans	-83.5	79.7	168.8	-171.3	-11.5	0	0	0	110	E371 A372 L373	N369-E371 PolarHBondContact O-N 3.18Å; N369-A372 HydrophobicContact CB-CB 4.09Å; N369-A372 VanDerWaalsContact CG-CB 3.45Å; N369-A372 WeakPolarHBondContact ND2-CB 3.47Å; N369-A372 PolarHBondContact O-N 3.3Å; N369-A372 VanDerWaalsContact O-N 3.12Å; N369-A372 PolarHBondContact OD1-N 2.91Å; N369-A372 VanDerWaalsContact OD1-N 3.16Å; N369-L373 WeakPolarHBondContact O-CG 3.21Å; N369-L373 PolarHBondContact O-N 2.81Å
370	T	78.3	Confident	79.1	Confident	19 Å²	19	74.9 Å²	74.9	12%	0.117	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-30.5	-176.2	54.6	0	0	0	0	113.2	L364 F368 L373 N374 I375 Q377	L364-T370 HydrophobicContact CD2-CG2 3.79Å; F368-T370 VanDerWaalsContact C-N 3.34Å; F368-T370 HydrophobicContact CB-CG2 4.33Å; F368-T370 PolarHBondContact O-N 3.26Å; F368-T370 VanDerWaalsContact O-N 3.1Å; T370-L373 PolarHBondContact O-N 3.34Å; T370-N374 PolarHBondContact O-N 2.8Å; T370-I375 PolarHBondContact O-N 2.76Å; T370-Q377 HydrophobicContact CG2-CG 4.48Å; T370-Q377 PolarHBondContact OG1-NE2 2.8Å; T370-Q377 VanDerWaalsContact OG1-NE2 3.14Å
371	E	75.3	Confident	78.6	Confident	170 Å²	170	77.6 Å²	77.6	79%	0.794	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-43.7	174.2	-64.8	-173.9	172.3	0	0	111.7	N369 L373 N374	N369-E371 PolarHBondContact O-N 3.18Å; E371-L373 VanDerWaalsContact C-N 3.27Å; E371-L373 PolarHBondContact O-N 3.35Å; E371-N374 PolarHBondContact O-N 2.61Å
372	A	72.8	Confident	78.7	Confident	69 Å²	69	74.8 Å²	74.8	57%	0.57	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-19.2	178.9	0	0	0	0	0	113.9	N369	N369-A372 HydrophobicContact CB-CB 4.09Å; N369-A372 VanDerWaalsContact CG-CB 3.45Å; N369-A372 WeakPolarHBondContact ND2-CB 3.47Å; N369-A372 PolarHBondContact O-N 3.3Å; N369-A372 VanDerWaalsContact O-N 3.12Å; N369-A372 PolarHBondContact OD1-N 2.91Å; N369-A372 VanDerWaalsContact OD1-N 3.16Å
373	L	76.1	Confident	78.8	Confident	23 Å²	23	72 Å²	72	12%	0.12	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	2.5	178.1	-61.7	175.9	0	0	0	113.2	N257 L260 Q261 F368 N369 T370 E371 I375	N257-L373 HydrophobicContact CB-CD1 4.21Å; N257-L373 HydrophobicContact CB-CD2 4.03Å; L260-L373 HydrophobicContact CD2-CD1 3.88Å; Q261-L373 HydrophobicContact CG-CB 4.25Å; Q261-L373 HydrophobicContact CG-CD2 4.29Å; Q261-L373 PolarHBondContact NE2-O 2.83Å; F368-L373 HydrophobicContact CD1-CD1 4.47Å; N369-L373 WeakPolarHBondContact O-CG 3.21Å; N369-L373 PolarHBondContact O-N 2.81Å; T370-L373 PolarHBondContact O-N 3.34Å; E371-L373 VanDerWaalsContact C-N 3.27Å; E371-L373 PolarHBondContact O-N 3.35Å; L373-I375 HydrophobicContact CB-CD1 3.88Å; L373-I375 HydrophobicContact CB-CG1 3.97Å; L373-I375 HydrophobicContact CD1-CD1 4.31Å; L373-I375 PolarHBondContact O-N 3.45Å
374	N	74.4	Confident	79.1	Confident	123 Å²	123	78.7 Å²	78.7	66%	0.658	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	26.2	-172.5	-65.4	-25.8	0	0	0	114.5	T370 E371 Y376	T370-N374 PolarHBondContact O-N 2.8Å; E371-N374 PolarHBondContact O-N 2.61Å; N374-Y376 PolarHBondContact O-N 2.92Å
375	I	78.3	Confident	79.6	Confident	17 Å²	17	79.9 Å²	79.9	9%	0.087	41%	0.409	C	S	.	.			trans	-90.4	103.1	-178.6	-62.3	174.8	0	0	0	109.4	L260 Q261 F264 T370 L373 Q377	L260-I375 HydrophobicContact CB-CD1 4.41Å; L260-I375 HydrophobicContact CD2-CD1 3.43Å; L260-I375 VanDerWaalsContact CD2-CD1 3.43Å; L260-I375 HydrophobicContact CG-CD1 3.53Å; Q261-I375 HydrophobicContact CG-CD1 4.48Å; F264-I375 HydrophobicContact CB-CD1 4.1Å; F264-I375 HydrophobicContact CB-CG1 4.23Å; F264-I375 HydrophobicContact CB-CG2 4.12Å; F264-I375 HydrophobicContact CD1-CG2 3.45Å; F264-I375 VanDerWaalsContact CD1-CG2 3.45Å; F264-I375 HydrophobicContact CE1-CG2 4.02Å; F264-I375 HydrophobicContact CG-CD1 4.35Å; F264-I375 HydrophobicContact CG-CG2 3.87Å; T370-I375 PolarHBondContact O-N 2.76Å; L373-I375 HydrophobicContact CB-CD1 3.88Å; L373-I375 HydrophobicContact CB-CG1 3.97Å; L373-I375 HydrophobicContact CD1-CD1 4.31Å; L373-I375 PolarHBondContact O-N 3.45Å; I375-Q377 PolarHBondContact O-N 3.37Å
376	Y	67.1	Low	80.1	Confident	186 Å²	186	75.1 Å²	75.1	73%	0.729	39%	0.39	S	S	*	.			trans	-73.2	116.4	174	-63.8	-74.3	0	0	0	110.5	Q352 N374 F378	Q352-Y376 PolarHBondContact NE2-O 3.07Å; N374-Y376 PolarHBondContact O-N 2.92Å; Y376-F378 VanDerWaalsContact C-N 3.33Å; Y376-F378 PolarHBondContact O-N 3.22Å
377	Q	71.4	Confident	80.7	Confident	129 Å²	129	73.7 Å²	73.7	60%	0.603	40%	0.395	S	S	*	.			trans	-72.9	88.5	173.4	-61.2	-173.9	21.3	0	0	109.6	L364 T370 I375	L364-Q377 HydrophobicContact CD1-CG 4.09Å; T370-Q377 HydrophobicContact CG2-CG 4.48Å; T370-Q377 PolarHBondContact OG1-NE2 2.8Å; T370-Q377 VanDerWaalsContact OG1-NE2 3.14Å; I375-Q377 PolarHBondContact O-N 3.37Å
378	F	74.4	Confident	81.9	Confident	94 Å²	94	70.6 Å²	70.6	41%	0.412	36%	0.363	S	S	.	.			trans	-120.1	132.7	178.8	-175.5	-103.7	0	0	0	109.7	V341 Q352 Y376 P380	V341-F378 HydrophobicContact CG2-CD1 4.37Å; V341-F378 HydrophobicContact CG2-CE1 3.61Å; V341-F378 HydrophobicContact CG2-CZ 4.48Å; Q352-F378 PolarHBondContact OE1-O 3.34Å; Y376-F378 VanDerWaalsContact C-N 3.33Å; Y376-F378 PolarHBondContact O-N 3.22Å; F378-P380 HydrophobicContact CD1-CG 4.4Å; F378-P380 HydrophobicContact CE1-CB 4.17Å; F378-P380 HydrophobicContact CE1-CG 4.16Å
379	T	77.3	Confident	82.8	Confident	70 Å²	70	70 Å²	70	43%	0.429	36%	0.361	S	S	.	.			trans	-113.7	122	166.5	-56.1	0	0	0	0	106.6	K357 Y383	K357-T379 HydrophobicContact CD-CG2 4.41Å; K357-T379 HydrophobicContact CG-CG2 4.34Å; T379-Y383 HydrophobicContact CG2-CD1 4.1Å; T379-Y383 HydrophobicContact CG2-CG 4.49Å
380	P	80.6	Confident	83.7	Confident	6 Å²	6	67 Å²	67	4%	0.039	35%	0.346	C	S	.	.			trans	-56.7	145.1	-177.4	-23.8	30.8	0	0	0	112.9	L339 V341 L353 F378 Y383	L339-P380 HydrophobicContact CB-CB 3.85Å; L339-P380 HydrophobicContact CD1-CB 3.86Å; L339-P380 HydrophobicContact CD1-CG 4.12Å; V341-P380 HydrophobicContact CG2-CB 4.23Å; V341-P380 HydrophobicContact CG2-CG 4.2Å; L353-P380 HydrophobicContact CD2-CG 3.69Å; F378-P380 HydrophobicContact CD1-CG 4.4Å; F378-P380 HydrophobicContact CE1-CB 4.17Å; F378-P380 HydrophobicContact CE1-CG 4.16Å; P380-Y383 HydrophobicContact CG-CD2 4.36Å; P380-Y383 WeakPolarHBondContact O-CB 3.34Å; P380-Y383 PolarHBondContact O-N 3.29Å
381	P	78.3	Confident	84.7	Confident	66 Å²	66	66.1 Å²	66.1	43%	0.429	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	146.3	164.3	28.5	-33.8	0	0	0	108.9	M334 Y383	M334-P381 HydrophobicContact CE-CG 4.1Å; P381-Y383 PolarHBondContact O-N 3.36Å
382	H	88.7	Confident	85.8	Confident	74 Å²	74	61.2 Å²	61.2	34%	0.343	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	19.5	179.8	-50.3	-65.5	0	0	0	116.3	T331 Y384 Y388	T331-H382 HydrophobicContact CG2-CB 3.97Å; H382-Y384 VanDerWaalsContact CA-CE2 3.49Å; H382-Y384 HydrophobicContact CB-CD2 4.19Å; H382-Y384 HydrophobicContact CB-CE2 3.58Å; H382-Y384 AromaticContact ND1-CE2 3.73Å; H382-Y384 AromaticContact ND1-CZ 3.72Å; H382-Y384 PolarHBondContact ND1-OH 3.05Å; H382-Y384 WeakPolarHBondContact O-CD2 3.28Å; H382-Y384 PolarHBondContact O-N 3.5Å; H382-Y388 PolarHBondContact O-OH 3.04Å
383	Y	93.1	Very high	87	Confident	2 Å²	2	58 Å²	58	1%	0.008	29%	0.291	C	S	.	.			trans	-70.6	94.9	169.7	-160.3	-119.4	0	0	0	110.5	L339 Q352 L353 K354 W355 K357 Q360 T379 P380 P381 P386 Y388	L339-Y383 HydrophobicContact CD1-CD2 3.63Å; L339-Y383 HydrophobicContact CD1-CE2 4.26Å; Q352-Y383 PolarHBondContact O-OH 2.85Å; Q352-Y383 VanDerWaalsContact O-OH 3.1Å; L353-Y383 PolarHBondContact O-OH 2.75Å; K354-Y383 PolarHBondContact N-OH 3.32Å; W355-Y383 PolarHBondContact N-OH 3.37Å; W355-Y383 WeakPolarHBondContact O-CE1 3.44Å; W355-Y383 PolarHBondContact O-OH 3.01Å; K357-Y383 HydrophobicContact CD-CD1 4.5Å; K357-Y383 WeakPolarHBondContact CE-O 3.42Å; K357-Y383 HydrophobicContact CG-CD1 3.99Å; K357-Y383 HydrophobicContact CG-CE1 4.32Å; K357-Y383 PolarHBondContact NZ-O 3.11Å; Q360-Y383 PolarHBondContact NE2-OH 3.19Å; T379-Y383 HydrophobicContact CG2-CD1 4.1Å; T379-Y383 HydrophobicContact CG2-CG 4.49Å; P380-Y383 HydrophobicContact CG-CD2 4.36Å; P380-Y383 WeakPolarHBondContact O-CB 3.34Å; P380-Y383 PolarHBondContact O-N 3.29Å; P381-Y383 PolarHBondContact O-N 3.36Å; Y383-P386 HydrophobicContact CE1-CB 3.94Å; Y383-P386 HydrophobicContact CE1-CG 4.01Å; Y383-P386 HydrophobicContact CE2-CB 3.92Å; Y383-P386 VanDerWaalsContact CZ-CB 3.48Å; Y383-P386 VanDerWaalsContact OH-CB 3.29Å; Y383-P386 WeakPolarHBondContact OH-CB 3.26Å; Y383-Y388 AromaticContact CD2-CD2 3.54Å; Y383-Y388 HydrophobicContact CD2-CD2 3.54Å; Y383-Y388 AromaticContact CD2-CE2 3.45Å; Y383-Y388 HydrophobicContact CD2-CE2 3.45Å; Y383-Y388 VanDerWaalsContact CD2-CE2 3.45Å; Y383-Y388 AromaticContact CE2-CD2 3.42Å; Y383-Y388 HydrophobicContact CE2-CD2 3.42Å; Y383-Y388 VanDerWaalsContact CE2-CD2 3.42Å; Y383-Y388 AromaticContact CE2-CE2 3.75Å; Y383-Y388 HydrophobicContact CE2-CE2 3.75Å; Y383-Y388 HydrophobicContact CG-CE2 4.21Å
384	Y	93.2	Very high	88	Confident	141 Å²	141	58.8 Å²	58.8	55%	0.553	29%	0.294	S	S	*	.			trans	-115.4	-48.2	-174.3	-58.9	-60.7	0	0	0	113.8	E328 H382 P386 Y388	E328-Y384 HydrophobicContact CG-CD2 4.17Å; H382-Y384 VanDerWaalsContact CA-CE2 3.49Å; H382-Y384 HydrophobicContact CB-CD2 4.19Å; H382-Y384 HydrophobicContact CB-CE2 3.58Å; H382-Y384 AromaticContact ND1-CE2 3.73Å; H382-Y384 AromaticContact ND1-CZ 3.72Å; H382-Y384 PolarHBondContact ND1-OH 3.05Å; H382-Y384 WeakPolarHBondContact O-CD2 3.28Å; H382-Y384 PolarHBondContact O-N 3.5Å; Y384-P386 VanDerWaalsContact C-CD 3.42Å; Y384-P386 WeakPolarHBondContact O-CD 3.49Å; Y384-Y388 PolarHBondContact N-OH 2.84Å
385	T	95.1	Very high	89.2	Confident	52 Å²	52	53.9 Å²	53.9	32%	0.319	27%	0.269	S	S	.	.	S	Bend	trans	-123.5	62.3	-173	52.5	0	0	0	0	112.7	H324 P325 E328 Y388	H324-T385 PolarHBondContact CE1-O 3.31Å; H324-T385 VanDerWaalsContact CE1-O 3.22Å; H324-T385 PolarHBondContact ND1-O 3.11Å; H324-T385 PolarHBondContact ND1-OG1 3.06Å; P325-T385 HydrophobicContact CG-CG2 4.12Å; E328-T385 VanDerWaalsContact CD-OG1 3.32Å; E328-T385 VanDerWaalsContact OE1-CG2 3.26Å; E328-T385 WeakPolarHBondContact OE1-CG2 3.49Å; E328-T385 PolarHBondContact OE1-OG1 3.07Å; E328-T385 PolarHBondContact OE2-OG1 3.25Å; T385-Y388 PolarHBondContact N-OH 2.85Å
386	P	94.9	Very high	90.1	Very high	45 Å²	45	55 Å²	55	29%	0.292	28%	0.277	S	S	.	.	S	Bend	trans	-67.2	154.7	177.1	31	-36.4	0	0	0	112.7	Y383 Y384 Y388	Y383-P386 HydrophobicContact CE1-CB 3.94Å; Y383-P386 HydrophobicContact CE1-CG 4.01Å; Y383-P386 HydrophobicContact CE2-CB 3.92Å; Y383-P386 VanDerWaalsContact CZ-CB 3.48Å; Y383-P386 VanDerWaalsContact OH-CB 3.29Å; Y383-P386 WeakPolarHBondContact OH-CB 3.26Å; Y384-P386 VanDerWaalsContact C-CD 3.42Å; Y384-P386 WeakPolarHBondContact O-CD 3.49Å; P386-Y388 HydrophobicContact CB-CD2 4.15Å; P386-Y388 HydrophobicContact CB-CE2 4.22Å
387	P	96.3	Very high	91.6	Very high	79 Å²	79	51.3 Å²	51.3	51%	0.513	26%	0.262	S	S	.	.			cis	-78.3	147.9	4.2	32.3	-36.4	0	0	0	113.6	H324 K354	H324-P387 PolarHBondContact CE1-O 2.9Å; H324-P387 VanDerWaalsContact CE1-O 3.3Å; K354-P387 HydrophobicContact CB-CB 4.36Å
388	Y	96.6	Very high	92.9	Very high	1 Å²	1	46.4 Å²	46.4	0%	0.004	24%	0.239	C	C	.	.			trans	-105.4	-11.6	173.2	-70.1	-95.9	0	0	0	113.4	H324 E328 L339 L353 H382 Y383 Y384 T385 P386	H324-Y388 AromaticContact CD2-CD1 3.87Å; H324-Y388 AromaticContact CE1-CD1 3.2Å; H324-Y388 WeakPolarHBondContact CE1-CD1 3.14Å; H324-Y388 AromaticContact CE1-CE1 3.42Å; H324-Y388 VanDerWaalsContact CE1-CE1 3.42Å; H324-Y388 WeakPolarHBondContact CE1-CE1 3.46Å; H324-Y388 AromaticContact CE1-CG 3.62Å; H324-Y388 AromaticContact CG-CE1 3.96Å; H324-Y388 AromaticContact ND1-CD1 3.79Å; H324-Y388 AromaticContact ND1-CE1 3.52Å; H324-Y388 AromaticContact NE2-CD1 3.21Å; H324-Y388 WeakPolarHBondContact NE2-CD1 3.49Å; H324-Y388 AromaticContact NE2-CE1 3.76Å; H324-Y388 AromaticContact NE2-CG 3.8Å; E328-Y388 WeakPolarHBondContact OE2-CE1 3.49Å; E328-Y388 PolarHBondContact OE2-OH 3.42Å; L339-Y388 HydrophobicContact CD1-CD1 4.11Å; L339-Y388 HydrophobicContact CD1-CD2 3.92Å; L339-Y388 HydrophobicContact CD1-CE1 4.43Å; L339-Y388 HydrophobicContact CD1-CE2 4.22Å; L339-Y388 HydrophobicContact CD1-CG 3.84Å; L339-Y388 HydrophobicContact CD2-CD1 4.04Å; L339-Y388 HydrophobicContact CD2-CE1 3.97Å; L339-Y388 HydrophobicContact CG-CD1 4.29Å; L339-Y388 HydrophobicContact CG-CG 4.42Å; L353-Y388 PolarHBondContact O-N 3.06Å; H382-Y388 PolarHBondContact O-OH 3.04Å; Y383-Y388 AromaticContact CD2-CD2 3.54Å; Y383-Y388 HydrophobicContact CD2-CD2 3.54Å; Y383-Y388 AromaticContact CD2-CE2 3.45Å; Y383-Y388 HydrophobicContact CD2-CE2 3.45Å; Y383-Y388 VanDerWaalsContact CD2-CE2 3.45Å; Y383-Y388 AromaticContact CE2-CD2 3.42Å; Y383-Y388 HydrophobicContact CE2-CD2 3.42Å; Y383-Y388 VanDerWaalsContact CE2-CD2 3.42Å; Y383-Y388 AromaticContact CE2-CE2 3.75Å; Y383-Y388 HydrophobicContact CE2-CE2 3.75Å; Y383-Y388 HydrophobicContact CG-CE2 4.21Å; Y384-Y388 PolarHBondContact N-OH 2.84Å; T385-Y388 PolarHBondContact N-OH 2.85Å; P386-Y388 HydrophobicContact CB-CD2 4.15Å; P386-Y388 HydrophobicContact CB-CE2 4.22Å
389	L	97.6	Very high	94	Very high	7 Å²	7	47.2 Å²	47.2	4%	0.037	24%	0.239	C	C	.	.			trans	-126.5	143.5	-175.4	-177	68.8	0	0	0	109.4	L338 L342 C345 A347 D350 L353 K354	L338-L389 HydrophobicContact CD2-CB 4.17Å; L338-L389 HydrophobicContact CD2-CD1 3.95Å; L342-L389 HydrophobicContact CD2-CD1 4.2Å; L342-L389 HydrophobicContact CD2-CD2 4Å; C345-L389 VanDerWaalsContact C-CD1 3.49Å; C345-L389 WeakPolarHBondContact O-CD1 3.45Å; A347-L389 HydrophobicContact CB-CD1 4.45Å; A347-L389 HydrophobicContact CB-CD2 4.3Å; D350-L389 HydrophobicContact CB-CD2 3.29Å; L353-L389 HydrophobicContact CB-CB 3.76Å; L353-L389 HydrophobicContact CB-CD2 4.11Å; L353-L389 HydrophobicContact CD1-CB 4.49Å; L353-L389 HydrophobicContact CD1-CD2 3.96Å; K354-L389 HydrophobicContact CG-CB 4.19Å
390	T	98	Very high	95	Very high	33 Å²	33	43.9 Å²	43.9	20%	0.202	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-134	150.1	177	-177	0	0	0	0	110.5	R346 A347 E392	R346-T390 CarbonylContact C-O 3.51Å; R346-T390 WeakPolarHBondContact CA-O 3.45Å; R346-T390 VanDerWaalsContact CB-O 3.27Å; R346-T390 WeakPolarHBondContact CB-O 3.22Å; R346-T390 HydrophobicContact CG-CG2 3.97Å; A347-T390 PolarHBondContact N-O 3.04Å; T390-E392 HydrophobicContact CG2-CB 4.21Å; T390-E392 VanDerWaalsContact OG1-CB 3.3Å; T390-E392 WeakPolarHBondContact OG1-CB 3.42Å; T390-E392 PolarHBondContact OG1-N 2.98Å
391	A	98.4	Very high	95.7	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.008	23%	0.233	C	C	.	.			trans	-90.5	-0.3	167.8	0	0	0	0	0	112.7	F235 D239 F348 P393	F235-A391 WeakPolarHBondContact CD1-O 3.39Å; D239-A391 HydrophobicContact CB-CB 3.5Å; D239-A391 VanDerWaalsContact CB-CB 3.5Å; F348-A391 HydrophobicContact CD1-CB 3.88Å; F348-A391 HydrophobicContact CD2-CB 4.35Å; F348-A391 HydrophobicContact CE1-CB 4Å; F348-A391 HydrophobicContact CE2-CB 4.45Å; F348-A391 HydrophobicContact CG-CB 4.07Å; F348-A391 HydrophobicContact CZ-CB 4.29Å; A391-P393 WeakPolarHBondContact O-CD 3.33Å
392	E	98.1	Very high	96.5	Very high	67 Å²	67	46.7 Å²	46.7	31%	0.313	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-61.2	120.1	-179.4	-177	177.9	158.1	0	0	111.7	M232 Q236 R346 T390	M232-E392 HydrophobicContact CE-CG 4.07Å; M232-E392 VanDerWaalsContact CE-OE1 3.23Å; M232-E392 WeakPolarHBondContact CE-OE1 3.2Å; Q236-E392 HydrophobicContact CG-CB 4Å; Q236-E392 HydrophobicContact CG-CG 4.26Å; Q236-E392 PolarHBondContact NE2-OE2 2.53Å; R346-E392 WeakPolarHBondContact CD-O 3.43Å; R346-E392 PolarHBondContact NH1-O 2.77Å; T390-E392 HydrophobicContact CG2-CB 4.21Å; T390-E392 VanDerWaalsContact OG1-CB 3.3Å; T390-E392 WeakPolarHBondContact OG1-CB 3.42Å; T390-E392 PolarHBondContact OG1-N 2.98Å
393	P	98.4	Very high	96.8	Very high	3 Å²	3	45.4 Å²	45.4	2%	0.019	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-79.4	153.2	-175.1	31.7	-34.7	0	0	0	111.8	M232 F235 A282 N283 A284 A391 V395	M232-P393 HydrophobicContact CG-CG 4.29Å; F235-P393 HydrophobicContact CB-CG 3.98Å; F235-P393 HydrophobicContact CD1-CB 3.76Å; F235-P393 HydrophobicContact CD1-CG 3.76Å; F235-P393 HydrophobicContact CD2-CG 4Å; F235-P393 HydrophobicContact CE1-CB 3.77Å; F235-P393 HydrophobicContact CE1-CG 4.15Å; F235-P393 HydrophobicContact CE2-CG 4.36Å; F235-P393 HydrophobicContact CG-CB 4.21Å; F235-P393 HydrophobicContact CG-CG 3.67Å; F235-P393 HydrophobicContact CZ-CB 4.21Å; F235-P393 HydrophobicContact CZ-CG 4.43Å; A282-P393 HydrophobicContact CB-CB 3.88Å; A282-P393 HydrophobicContact CB-CG 4.17Å; N283-P393 CarbonylContact O-C 3.57Å; N283-P393 WeakPolarHBondContact O-CA 3.19Å; A284-P393 HydrophobicContact CB-CB 4.46Å; A391-P393 WeakPolarHBondContact O-CD 3.33Å; P393-V395 HydrophobicContact CG-CG2 4.18Å
394	E	98.2	Very high	97	Very high	38 Å²	38	45.3 Å²	45.3	18%	0.178	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	126.7	154.4	179.1	168.6	128.2	0	0	108.1	A282 N283 R307 H309	A282-E394 WeakPolarHBondContact CA-O 3.46Å; N283-E394 PolarHBondContact N-O 3.32Å; N283-E394 PolarHBondContact O-N 2.83Å; R307-E394 IonicContact CZ-OE1 3.58Å; R307-E394 VanDerWaalsContact CZ-OE1 3.23Å; R307-E394 IonicContact CZ-OE2 3.55Å; R307-E394 IonicContact NE-OE1 3.23Å; R307-E394 PolarHBondContact NE-OE1 3.2Å; R307-E394 IonicContact NE-OE2 3.51Å; R307-E394 IonicContact NH2-OE1 3.89Å; R307-E394 PolarHBondContact NH2-OE1 3.03Å; R307-E394 IonicContact NH2-OE2 3.99Å; R307-E394 PolarHBondContact NH2-OE2 3.32Å; H309-E394 IonicContact NE2-OE2 3.74Å
395	V	98.4	Very high	97.2	Very high	21 Å²	21	40.7 Å²	40.7	13%	0.127	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	125.7	179.3	-174.7	0	0	0	0	110.1	E228 L231 M232 V281 A282 P393	E228-V395 HydrophobicContact CB-CG1 4.41Å; E228-V395 HydrophobicContact CG-CB 4.05Å; E228-V395 HydrophobicContact CG-CG1 4.11Å; E228-V395 HydrophobicContact CG-CG2 4.47Å; L231-V395 HydrophobicContact CB-CG2 4.19Å; L231-V395 HydrophobicContact CD1-CG1 4.04Å; M232-V395 HydrophobicContact CG-CG2 3.78Å; V281-V395 CarbonylContact O-C 3.55Å; V281-V395 WeakPolarHBondContact O-CA 3.29Å; A282-V395 HydrophobicContact CB-CG2 4.08Å; P393-V395 HydrophobicContact CG-CG2 4.18Å
396	T	98.6	Very high	97.4	Very high	41 Å²	41	38.2 Å²	38.2	25%	0.252	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123.3	172.6	-66.7	0	0	0	0	110	H280 V281 L305	H280-T396 WeakPolarHBondContact CA-O 3.34Å; V281-T396 PolarHBondContact N-O 3.38Å; V281-T396 PolarHBondContact O-N 2.86Å; L305-T396 HydrophobicContact CD2-CG2 4.49Å; L305-T396 WeakPolarHBondContact O-CB 3.34Å; L305-T396 PolarHBondContact O-OG1 2.69Å
397	Y	98.4	Very high	97.5	Very high	107 Å²	107	36.1 Å²	36.1	42%	0.42	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	131.6	168.7	170.6	-115.5	0	0	0	111.2	H278 H280 R399	H278-Y397 HydrophobicContact CB-CE2 4.1Å; H278-Y397 AromaticContact ND1-CE2 3.67Å; H278-Y397 AromaticContact ND1-CZ 3.75Å; H278-Y397 PolarHBondContact ND1-OH 3.02Å; H280-Y397 AromaticContact CD2-CD2 3.83Å; H280-Y397 AromaticContact CE1-CD2 3.59Å; H280-Y397 AromaticContact CE1-CE2 3.91Å; H280-Y397 AromaticContact NE2-CD2 3.4Å; H280-Y397 WeakPolarHBondContact NE2-CD2 3.17Å; Y397-R399 HydrophobicContact CE1-CB 4.35Å
398	H	98.3	Very high	97.7	Very high	27 Å²	27	32.3 Å²	32.3	13%	0.125	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	135.7	169.5	-179.5	67.6	0	0	0	110.7	L279 L291 L305 D404	L279-H398 HydrophobicContact CB-CB 4.45Å; L279-H398 WeakPolarHBondContact CB-O 3.35Å; L279-H398 HydrophobicContact CD2-CB 4.38Å; L279-H398 PolarHBondContact N-O 3.05Å; L279-H398 PolarHBondContact O-N 2.93Å; L291-H398 WeakPolarHBondContact CD2-NE2 3.19Å; L305-H398 HydrophobicContact CD2-CB 4.14Å; H398-D404 IonicContact CD2-OD2 3.45Å; H398-D404 IonicContact CE1-OD2 3.09Å; H398-D404 IonicContact NE2-OD2 2.71Å; H398-D404 PolarHBondContact NE2-OD2 3.21Å
399	R	97.6	Very high	97.8	Very high	111 Å²	111	32.3 Å²	32.3	42%	0.419	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	109.6	175.1	-169.7	-176.4	169	144	6.8	109	I277 Y397 R401 Y526	I277-R399 HydrophobicContact CD1-CG 3.92Å; I277-R399 VanDerWaalsContact CD1-NE 3.31Å; Y397-R399 HydrophobicContact CE1-CB 4.35Å; R399-R401 WeakPolarHBondContact O-CG 3.43Å; R399-Y526 WeakPolarHBondContact CG-OH 3.48Å; R399-Y526 PolarHBondContact NE-OH 3.45Å
400	L	97.5	Very high	97.8	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.147	C	C	.	.			trans	-58.1	138.9	-176.8	-69.6	171.3	0	0	0	112.1	V274 I277 L279 D404 F517 I522 Y526	V274-L400 HydrophobicContact CG1-CD1 4.11Å; I277-L400 HydrophobicContact CB-CB 4.39Å; I277-L400 WeakPolarHBondContact O-CB 3.45Å; I277-L400 PolarHBondContact O-N 2.84Å; L279-L400 HydrophobicContact CB-CD1 4.43Å; L279-L400 HydrophobicContact CB-CD2 4.32Å; L279-L400 HydrophobicContact CB-CG 4.1Å; L279-L400 HydrophobicContact CD2-CD2 4.15Å; L400-D404 WeakPolarHBondContact CA-OD2 3.37Å; L400-D404 HydrophobicContact CD2-CB 4.24Å; L400-F517 HydrophobicContact CD1-CD1 3.92Å; L400-F517 HydrophobicContact CD1-CE1 3.79Å; L400-F517 HydrophobicContact CD1-CZ 4.35Å; L400-F517 HydrophobicContact CD2-CD1 4.33Å; L400-F517 HydrophobicContact CD2-CD2 4.11Å; L400-F517 HydrophobicContact CD2-CE1 4.09Å; L400-F517 HydrophobicContact CD2-CE2 3.86Å; L400-F517 HydrophobicContact CD2-CG 4.36Å; L400-F517 HydrophobicContact CD2-CZ 3.84Å; L400-I522 HydrophobicContact CB-CD1 4.12Å; L400-I522 HydrophobicContact CB-CG2 4.49Å; L400-I522 HydrophobicContact CD1-CD1 4.4Å; L400-Y526 VanDerWaalsContact O-CE2 3.29Å; L400-Y526 WeakPolarHBondContact O-CE2 3.26Å; L400-Y526 PolarHBondContact O-OH 2.88Å
401	R	96.1	Very high	97.9	Very high	88 Å²	88	30.4 Å²	30.4	33%	0.332	14%	0.138	S	C	.	.			trans	-124.1	158.6	-179.1	-50.9	170.5	-64.1	166.6	5.3	109.6	R399 Q403 D404	R399-R401 WeakPolarHBondContact O-CG 3.43Å; R401-Q403 PolarHBondContact O-N 3.26Å; R401-Q403 VanDerWaalsContact O-N 3.12Å; R401-D404 WeakPolarHBondContact CB-OD2 3.45Å; R401-D404 IonicContact CZ-OD1 2.68Å; R401-D404 PolarHBondContact N-OD2 2.79Å; R401-D404 IonicContact NE-OD1 3.66Å; R401-D404 PolarHBondContact NE-OD1 2.76Å; R401-D404 VanDerWaalsContact NE-OD1 3.09Å; R401-D404 IonicContact NE-OD2 3.32Å; R401-D404 PolarHBondContact NE-OD2 3.12Å; R401-D404 IonicContact NH2-OD1 2.85Å; R401-D404 PolarHBondContact NH2-OD1 3.38Å; R401-D404 WeakPolarHBondContact O-CB 3.22Å; R401-D404 PolarHBondContact O-N 3.24Å
402	P	94.9	Very high	97.8	Very high	43 Å²	43	31.4 Å²	31.4	28%	0.279	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-21	176.7	-24.3	35.9	0	0	0	114.7	D404 K405 S519 I522 Y526	P402-D404 VanDerWaalsContact C-N 3.34Å; P402-K405 PolarHBondContact O-NZ 2.9Å; P402-S519 PolarHBondContact O-OG 2.98Å; P402-I522 HydrophobicContact CG-CG2 4.3Å; P402-Y526 HydrophobicContact CG-CD2 4.5Å
403	Q	95.9	Very high	97.7	Very high	47 Å²	47	28.3 Å²	28.3	22%	0.22	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-27	172.5	-69.7	78.2	9.9	0	0	112.9	V293 Q294 D296 R401 K405	V293-Q403 HydrophobicContact CG1-CB 3.94Å; Q294-Q403 PolarHBondContact N-O 2.97Å; Q294-Q403 VanDerWaalsContact O-CB 3.29Å; Q294-Q403 WeakPolarHBondContact O-CB 3.2Å; Q294-Q403 WeakPolarHBondContact O-CG 3.36Å; D296-Q403 PolarHBondContact OD1-NE2 3.22Å; R401-Q403 PolarHBondContact O-N 3.26Å; R401-Q403 VanDerWaalsContact O-N 3.12Å; Q403-K405 WeakPolarHBondContact O-CG 3.49Å; Q403-K405 PolarHBondContact O-N 3.3Å
404	D	97.3	Very high	97.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	115.4	-176.4	-49.7	-28.5	0	0	0	108.4	L291 V293 H398 L400 R401 P402	L291-D404 HydrophobicContact CD1-CB 4.38Å; L291-D404 HydrophobicContact CD2-CB 3.95Å; L291-D404 HydrophobicContact CG-CB 4.3Å; V293-D404 WeakPolarHBondContact CG2-OD1 3.39Å; H398-D404 IonicContact CD2-OD2 3.45Å; H398-D404 IonicContact CE1-OD2 3.09Å; H398-D404 IonicContact NE2-OD2 2.71Å; H398-D404 PolarHBondContact NE2-OD2 3.21Å; L400-D404 WeakPolarHBondContact CA-OD2 3.37Å; L400-D404 HydrophobicContact CD2-CB 4.24Å; R401-D404 WeakPolarHBondContact CB-OD2 3.45Å; R401-D404 IonicContact CZ-OD1 2.68Å; R401-D404 PolarHBondContact N-OD2 2.79Å; R401-D404 IonicContact NE-OD1 3.66Å; R401-D404 PolarHBondContact NE-OD1 2.76Å; R401-D404 VanDerWaalsContact NE-OD1 3.09Å; R401-D404 IonicContact NE-OD2 3.32Å; R401-D404 PolarHBondContact NE-OD2 3.12Å; R401-D404 IonicContact NH2-OD1 2.85Å; R401-D404 PolarHBondContact NH2-OD1 3.38Å; R401-D404 WeakPolarHBondContact O-CB 3.22Å; R401-D404 PolarHBondContact O-N 3.24Å; P402-D404 VanDerWaalsContact C-N 3.34Å
405	K	96.9	Very high	97.6	Very high	44 Å²	44	27 Å²	27	19%	0.191	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-37.5	-168.7	-57.4	-48.6	-168.9	-177.8	0	113.7	G292 Q294 W300 P402 Q403 F517 S519	G292-K405 PolarHBondContact O-N 3.03Å; Q294-K405 HydrophobicContact CB-CD 4.46Å; Q294-K405 HydrophobicContact CB-CG 3.85Å; W300-K405 HydrophobicContact CH2-CB 3.82Å; W300-K405 HydrophobicContact CH2-CG 3.55Å; W300-K405 HydrophobicContact CZ3-CB 3.78Å; W300-K405 HydrophobicContact CZ3-CG 3.65Å; P402-K405 PolarHBondContact O-NZ 2.9Å; Q403-K405 WeakPolarHBondContact O-CG 3.49Å; Q403-K405 PolarHBondContact O-N 3.3Å; K405-F517 PolarHBondContact O-N 3.09Å; K405-S519 WeakPolarHBondContact CD-OG 3.36Å; K405-S519 PolarHBondContact NZ-OG 3.38Å
406	F	98.3	Very high	97.5	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	158.5	178.9	60.1	-95.2	0	0	0	112	L291 G292 W300 V408 V424 V427 V428 L431 V514 V515 Y516	L291-F406 WeakPolarHBondContact CD1-O 3.4Å; G292-F406 PolarHBondContact N-O 2.69Å; G292-F406 PolarHBondContact O-N 3.34Å; W300-F406 HydrophobicContact CE3-CE1 4.24Å; W300-F406 HydrophobicContact CH2-CE1 4.13Å; W300-F406 HydrophobicContact CZ3-CD1 4.15Å; W300-F406 AromaticContact CZ3-CE1 3.56Å; W300-F406 HydrophobicContact CZ3-CE1 3.56Å; W300-F406 HydrophobicContact CZ3-CZ 4.48Å; F406-V408 HydrophobicContact CD2-CG2 3.81Å; F406-V408 HydrophobicContact CE2-CG2 3.9Å; F406-V424 HydrophobicContact CE2-CG2 4.37Å; F406-V424 HydrophobicContact CZ-CB 4.48Å; F406-V424 HydrophobicContact CZ-CG1 4.21Å; F406-V424 HydrophobicContact CZ-CG2 4.35Å; F406-V427 HydrophobicContact CD1-CG1 3.83Å; F406-V427 HydrophobicContact CD2-CB 4.45Å; F406-V427 HydrophobicContact CD2-CG1 3.85Å; F406-V427 HydrophobicContact CE1-CB 4.19Å; F406-V427 HydrophobicContact CE1-CG1 3.67Å; F406-V427 HydrophobicContact CE2-CB 3.84Å; F406-V427 HydrophobicContact CE2-CG1 3.69Å; F406-V427 HydrophobicContact CE2-CG2 4.2Å; F406-V427 HydrophobicContact CG-CG1 3.91Å; F406-V427 HydrophobicContact CZ-CB 3.68Å; F406-V427 HydrophobicContact CZ-CG1 3.6Å; F406-V428 HydrophobicContact CE1-CG2 3.98Å; F406-V428 HydrophobicContact CZ-CG2 4.21Å; F406-L431 HydrophobicContact CD1-CD1 3.99Å; F406-L431 HydrophobicContact CE1-CD1 4.22Å; F406-V514 HydrophobicContact CB-CG1 4.39Å; F406-V515 CarbonylContact C-O 3.57Å; F406-V515 WeakPolarHBondContact CA-O 3.35Å; F406-V515 VanDerWaalsContact CB-O 3.27Å; F406-V515 WeakPolarHBondContact CB-O 3.25Å; F406-Y516 HydrophobicContact CB-CD1 4Å; F406-Y516 HydrophobicContact CB-CE1 4.45Å
407	L	98.8	Very high	97.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.6	171.6	170.8	68	0	0	0	107.4	A272 L279 A289 I290 L291 L305 L409 V514 V515 F517	A272-L407 HydrophobicContact CB-CD2 3.74Å; L279-L407 HydrophobicContact CD1-CD2 3.94Å; L279-L407 HydrophobicContact CD2-CD2 4.35Å; A289-L407 HydrophobicContact CB-CD1 4.14Å; I290-L407 WeakPolarHBondContact O-CA 3.46Å; I290-L407 WeakPolarHBondContact O-CD1 3.48Å; L291-L407 HydrophobicContact CD1-CB 4.27Å; L305-L407 HydrophobicContact CD1-CD1 3.76Å; L407-L409 HydrophobicContact CD2-CD1 3.87Å; L407-L409 HydrophobicContact CG-CD1 3.86Å; L407-V514 CarbonylContact O-C 3.45Å; L407-V514 WeakPolarHBondContact O-CA 3.48Å; L407-V515 HydrophobicContact CB-CB 4.32Å; L407-V515 PolarHBondContact N-O 2.64Å; L407-V515 PolarHBondContact O-N 2.78Å; L407-F517 HydrophobicContact CB-CE2 3.71Å; L407-F517 HydrophobicContact CB-CZ 3.74Å; L407-F517 HydrophobicContact CD2-CZ 4.36Å
408	V	98.8	Very high	97.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.2	170.6	-173.7	0	0	0	0	108	A289 I290 F406 W415 V423 V427 L474 V512 T513 V514	A289-V408 CarbonylContact C-O 3.58Å; A289-V408 WeakPolarHBondContact CA-O 3.44Å; I290-V408 HydrophobicContact CG1-CB 4.05Å; I290-V408 HydrophobicContact CG1-CG2 4.47Å; I290-V408 PolarHBondContact N-O 3.12Å; I290-V408 PolarHBondContact O-N 2.97Å; F406-V408 HydrophobicContact CD2-CG2 3.81Å; F406-V408 HydrophobicContact CE2-CG2 3.9Å; V408-W415 HydrophobicContact CG1-CH2 4.2Å; V408-W415 HydrophobicContact CG1-CZ2 4.34Å; V408-V423 HydrophobicContact CB-CG1 4.37Å; V408-V423 HydrophobicContact CG1-CG1 4.09Å; V408-V423 HydrophobicContact CG2-CG1 4.06Å; V408-V427 HydrophobicContact CG2-CG2 4.28Å; V408-L474 HydrophobicContact CG1-CD1 4.31Å; V408-V512 HydrophobicContact CG1-CG1 4.08Å; V408-T513 WeakPolarHBondContact CA-O 3.23Å; V408-V514 HydrophobicContact CG1-CG2 4.39Å; V408-V514 HydrophobicContact CG2-CG1 4.38Å; V408-V514 HydrophobicContact CG2-CG2 4.26Å
409	L	98.8	Very high	97	Very high	1 Å²	1	30 Å²	30	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	135.3	164.7	-55.8	90.5	0	0	0	108	F137 I139 A272 A289 L407 T513 V515	F137-L409 HydrophobicContact CB-CD1 4.18Å; I139-L409 HydrophobicContact CG1-CB 3.64Å; A272-L409 HydrophobicContact CB-CD1 4.48Å; A272-L409 HydrophobicContact CB-CD2 3.98Å; A289-L409 HydrophobicContact CB-CG 4.12Å; L407-L409 HydrophobicContact CD2-CD1 3.87Å; L407-L409 HydrophobicContact CG-CD1 3.86Å; L409-T513 PolarHBondContact N-O 3.39Å; L409-T513 PolarHBondContact O-N 3.2Å; L409-V515 HydrophobicContact CD1-CG2 4.29Å
410	A	98.7	Very high	97	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	161.2	172	0	0	0	0	0	113.3	R288 L414 W415 T511 V512	R288-A410 PolarHBondContact N-O 3.26Å; R288-A410 PolarHBondContact O-N 3Å; R288-A410 VanDerWaalsContact O-N 3.11Å; A410-L414 HydrophobicContact CB-CB 3.8Å; A410-L414 HydrophobicContact CB-CD2 3.47Å; A410-L414 VanDerWaalsContact CB-CD2 3.47Å; A410-L414 HydrophobicContact CB-CG 4.26Å; A410-W415 HydrophobicContact CB-CZ2 3.91Å; A410-W415 PolarHBondContact O-NE1 3.34Å; A410-T511 WeakPolarHBondContact CA-O 3.34Å; A410-T511 VanDerWaalsContact CB-O 3.29Å; A410-T511 WeakPolarHBondContact CB-O 3.44Å; A410-V512 HydrophobicContact CB-CB 4.37Å; A410-V512 HydrophobicContact CB-CG1 4.35Å; A410-V512 HydrophobicContact CB-CG2 4.03Å
411	S	98.6	Very high	96.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.158	C	C	.	.			trans	-70.6	163.4	168.2	44.3	0	0	0	0	111.8	D122 G413 L414 T511	D122-S411 WeakPolarHBondContact OD1-CB 3.34Å; D122-S411 WeakPolarHBondContact OD2-CB 3.44Å; D122-S411 PolarHBondContact OD2-OG 2.77Å; S411-G413 PolarHBondContact O-N 3.42Å; S411-L414 PolarHBondContact O-N 3.07Å; S411-L414 VanDerWaalsContact O-N 3.09Å; S411-T511 PolarHBondContact N-O 3.01Å; S411-T511 PolarHBondContact OG-N 2.83Å; S411-T511 PolarHBondContact OG-O 3.12Å
412	D	97	Very high	96.8	Very high	22 Å²	22	29.2 Å²	29.2	12%	0.118	15%	0.153	C	C	.	.	H	α-helix	trans	-58	-31.5	-178.9	69.1	-20	0	0	0	112.8	L414 W415 D416	D412-L414 CarbonylContact O-C 3.53Å; D412-L414 PolarHBondContact O-N 2.7Å; D412-W415 CarbonylContact O-C 3.41Å; D412-W415 PolarHBondContact O-N 3.34Å; D412-D416 WeakPolarHBondContact O-CB 3.47Å; D412-D416 PolarHBondContact O-N 2.88Å
413	G	96.9	Very high	96.9	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-53.6	-20.9	172.6	0	0	0	0	0	115.3	S411 M417 I510	S411-G413 PolarHBondContact O-N 3.42Å; G413-M417 WeakPolarHBondContact O-CG 3.34Å; G413-I510 WeakPolarHBondContact O-CD1 3.3Å
414	L	97.9	Very high	96.9	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-84.2	-48.3	165.7	-172.3	74.2	0	0	0	112.2	A410 S411 D412 D416 M417 L418 V423 L474 A478 I510 V512	A410-L414 HydrophobicContact CB-CB 3.8Å; A410-L414 HydrophobicContact CB-CD2 3.47Å; A410-L414 VanDerWaalsContact CB-CD2 3.47Å; A410-L414 HydrophobicContact CB-CG 4.26Å; S411-L414 PolarHBondContact O-N 3.07Å; S411-L414 VanDerWaalsContact O-N 3.09Å; D412-L414 CarbonylContact O-C 3.53Å; D412-L414 PolarHBondContact O-N 2.7Å; L414-D416 PolarHBondContact O-N 3.46Å; L414-M417 PolarHBondContact O-N 3.48Å; L414-M417 VanDerWaalsContact O-N 3.12Å; L414-L418 HydrophobicContact CD1-CD1 3.99Å; L414-L418 PolarHBondContact O-N 2.99Å; L414-V423 HydrophobicContact CD2-CG2 4.13Å; L414-L474 HydrophobicContact CD1-CB 4.14Å; L414-A478 HydrophobicContact CD1-CB 4.01Å; L414-I510 HydrophobicContact CB-CG2 4.01Å; L414-I510 HydrophobicContact CD1-CG2 4.18Å; L414-V512 HydrophobicContact CB-CG2 4.41Å; L414-V512 HydrophobicContact CD1-CG2 4.01Å; L414-V512 HydrophobicContact CD2-CG1 4.28Å; L414-V512 HydrophobicContact CD2-CG2 3.95Å; L414-V512 HydrophobicContact CG-CG2 4.34Å
415	W	96.9	Very high	96.8	Very high	15 Å²	15	31.5 Å²	31.5	6%	0.057	16%	0.155	C	C	.	.	H	α-helix	trans	-73.7	-23.4	-169.4	-57.2	116.9	0	0	0	114.3	R288 I290 V408 A410 D412 M417 V423	R288-W415 HydrophobicContact CB-CD2 4.16Å; R288-W415 HydrophobicContact CB-CG 4.18Å; R288-W415 HydrophobicContact CB-CZ2 4.29Å; R288-W415 WeakPolarHBondContact O-CZ2 3.35Å; I290-W415 HydrophobicContact CD1-CH2 3.6Å; I290-W415 HydrophobicContact CD1-CZ3 3.76Å; I290-W415 HydrophobicContact CG1-CH2 3.78Å; I290-W415 HydrophobicContact CG1-CZ3 4.4Å; I290-W415 HydrophobicContact CG2-CH2 4.13Å; I290-W415 HydrophobicContact CG2-CZ3 4.43Å; V408-W415 HydrophobicContact CG1-CH2 4.2Å; V408-W415 HydrophobicContact CG1-CZ2 4.34Å; A410-W415 HydrophobicContact CB-CZ2 3.91Å; A410-W415 PolarHBondContact O-NE1 3.34Å; D412-W415 CarbonylContact O-C 3.41Å; D412-W415 PolarHBondContact O-N 3.34Å; W415-M417 VanDerWaalsContact C-N 3.26Å; W415-V423 HydrophobicContact CE3-CG2 4.29Å; W415-V423 HydrophobicContact CH2-CG1 4.14Å; W415-V423 HydrophobicContact CH2-CG2 4.31Å; W415-V423 HydrophobicContact CZ3-CB 4.08Å; W415-V423 HydrophobicContact CZ3-CG1 4.21Å; W415-V423 HydrophobicContact CZ3-CG2 3.66Å
416	D	94.8	Very high	96.7	Very high	126 Å²	126	30.1 Å²	30.1	67%	0.674	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-24.3	169.6	-88.3	12.1	0	0	0	112.4	D412 L414	D412-D416 WeakPolarHBondContact O-CB 3.47Å; D412-D416 PolarHBondContact O-N 2.88Å; L414-D416 PolarHBondContact O-N 3.46Å
417	M	94.2	Very high	96.6	Very high	75 Å²	75	30.1 Å²	30.1	37%	0.369	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-27.4	-174.6	-59.6	-65.3	161.8	0	0	113.4	G413 L414 W415 A478	G413-M417 WeakPolarHBondContact O-CG 3.34Å; L414-M417 PolarHBondContact O-N 3.48Å; L414-M417 VanDerWaalsContact O-N 3.12Å; W415-M417 VanDerWaalsContact C-N 3.26Å; M417-A478 HydrophobicContact CB-CB 3.84Å; M417-A478 HydrophobicContact CG-CB 4.41Å
418	L	95.1	Very high	96.4	Very high	7 Å²	7	31 Å²	31	4%	0.037	16%	0.155	C	C	.	.	S	Bend	trans	-134.1	134.5	-175.8	-63	177.7	0	0	0	111.7	L414 D422 V423 L426 L474 A478	L414-L418 HydrophobicContact CD1-CD1 3.99Å; L414-L418 PolarHBondContact O-N 2.99Å; L418-D422 HydrophobicContact CB-CB 4.33Å; L418-D422 HydrophobicContact CD2-CB 4.35Å; L418-V423 HydrophobicContact CB-CG2 3.8Å; L418-V423 HydrophobicContact CD1-CG2 4.16Å; L418-L426 HydrophobicContact CD1-CD1 4Å; L418-L474 HydrophobicContact CD1-CD2 4.34Å; L418-A478 HydrophobicContact CD1-CB 4.05Å; L418-A478 HydrophobicContact CG-CB 4.17Å
419	S	95.8	Very high	96	Very high	49 Å²	49	31.7 Å²	31.7	34%	0.343	16%	0.162	S	C	.	.			trans	-68.6	159.4	170.6	71.5	0	0	0	0	111.6	E421 D422 V423	S419-E421 PolarHBondContact O-N 2.91Å; S419-D422 WeakPolarHBondContact CB-OD2 3.47Å; S419-D422 PolarHBondContact N-OD2 2.85Å; S419-D422 VanDerWaalsContact N-OD2 3.16Å; S419-D422 WeakPolarHBondContact O-CB 3.46Å; S419-D422 PolarHBondContact O-N 3.16Å; S419-D422 PolarHBondContact OG-N 3.46Å; S419-D422 VanDerWaalsContact OG-N 3.14Å; S419-D422 PolarHBondContact OG-OD2 3.37Å; S419-V423 PolarHBondContact O-N 3.49Å
420	N	97.1	Very high	95.5	Very high	27 Å²	27	32.1 Å²	32.1	14%	0.144	16%	0.164	C	C	.	.	H	α-helix	trans	-56.3	-37.6	176.6	-61.8	-27.3	0	0	0	111.5	R288 I290 V423 V424	R288-N420 PolarHBondContact NH1-OD1 3.33Å; I290-N420 HydrophobicContact CD1-CB 4.16Å; N420-V423 PolarHBondContact O-N 3.25Å; N420-V424 WeakPolarHBondContact O-CG2 3.31Å; N420-V424 PolarHBondContact O-N 3.02Å
421	E	95.7	Very high	95	Very high	117 Å²	117	34 Å²	34	55%	0.547	17%	0.174	S	C	.	.	H	α-helix	trans	-69.6	-36.1	177.6	-66.2	67.2	-150.4	0	0	112.4	S419 R425	S419-E421 PolarHBondContact O-N 2.91Å; E421-R425 VanDerWaalsContact O-CB 3.29Å; E421-R425 WeakPolarHBondContact O-CB 3.25Å; E421-R425 PolarHBondContact O-N 2.92Å
422	D	94.6	Very high	94.3	Very high	40 Å²	40	37.3 Å²	37.3	21%	0.214	19%	0.194	C	C	.	.	H	α-helix	trans	-65.8	-45.8	172.8	-62.2	-46.7	0	0	0	111.1	L418 S419 V424 R425 L426	L418-D422 HydrophobicContact CB-CB 4.33Å; L418-D422 HydrophobicContact CD2-CB 4.35Å; S419-D422 WeakPolarHBondContact CB-OD2 3.47Å; S419-D422 PolarHBondContact N-OD2 2.85Å; S419-D422 VanDerWaalsContact N-OD2 3.16Å; S419-D422 WeakPolarHBondContact O-CB 3.46Å; S419-D422 PolarHBondContact O-N 3.16Å; S419-D422 PolarHBondContact OG-N 3.46Å; S419-D422 VanDerWaalsContact OG-N 3.14Å; S419-D422 PolarHBondContact OG-OD2 3.37Å; D422-V424 PolarHBondContact O-N 2.77Å; D422-R425 PolarHBondContact O-N 3.46Å; D422-R425 IonicContact OD1-CZ 3.5Å; D422-R425 IonicContact OD1-NH1 3.55Å; D422-R425 PolarHBondContact OD1-NH1 2.88Å; D422-R425 IonicContact OD1-NH2 2.76Å; D422-R425 PolarHBondContact OD1-NH2 3.08Å; D422-L426 WeakPolarHBondContact O-CB 3.32Å; D422-L426 VanDerWaalsContact O-CG 3.26Å; D422-L426 WeakPolarHBondContact O-CG 3.35Å; D422-L426 PolarHBondContact O-N 3.04Å
423	V	96.9	Very high	93.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-58.8	-48.9	177.1	172.8	0	0	0	0	110.8	I290 V408 L414 W415 L418 S419 N420 R425 L426 V427 L474	I290-V423 HydrophobicContact CD1-CB 4.16Å; I290-V423 HydrophobicContact CD1-CG1 3.96Å; V408-V423 HydrophobicContact CB-CG1 4.37Å; V408-V423 HydrophobicContact CG1-CG1 4.09Å; V408-V423 HydrophobicContact CG2-CG1 4.06Å; L414-V423 HydrophobicContact CD2-CG2 4.13Å; W415-V423 HydrophobicContact CE3-CG2 4.29Å; W415-V423 HydrophobicContact CH2-CG1 4.14Å; W415-V423 HydrophobicContact CH2-CG2 4.31Å; W415-V423 HydrophobicContact CZ3-CB 4.08Å; W415-V423 HydrophobicContact CZ3-CG1 4.21Å; W415-V423 HydrophobicContact CZ3-CG2 3.66Å; L418-V423 HydrophobicContact CB-CG2 3.8Å; L418-V423 HydrophobicContact CD1-CG2 4.16Å; S419-V423 PolarHBondContact O-N 3.49Å; N420-V423 PolarHBondContact O-N 3.25Å; V423-R425 PolarHBondContact O-N 3.04Å; V423-L426 PolarHBondContact O-N 3.41Å; V423-V427 WeakPolarHBondContact O-CG2 3.16Å; V423-V427 PolarHBondContact O-N 3.35Å; V423-L474 HydrophobicContact CB-CD2 4.13Å; V423-L474 HydrophobicContact CG1-CD1 4Å; V423-L474 HydrophobicContact CG1-CD2 3.82Å; V423-L474 HydrophobicContact CG2-CD2 4.15Å
424	V	96.7	Very high	92.2	Very high	8 Å²	8	40.7 Å²	40.7	5%	0.048	21%	0.214	C	C	.	.	H	α-helix	trans	-60	-46	175.7	169.2	0	0	0	0	111.1	I290 W300 C302 F406 N420 D422 L426 V427 V428	I290-V424 HydrophobicContact CD1-CG2 4.06Å; W300-V424 HydrophobicContact CB-CG1 4.23Å; C302-V424 HydrophobicContact CB-CG2 3.93Å; F406-V424 HydrophobicContact CE2-CG2 4.37Å; F406-V424 HydrophobicContact CZ-CB 4.48Å; F406-V424 HydrophobicContact CZ-CG1 4.21Å; F406-V424 HydrophobicContact CZ-CG2 4.35Å; N420-V424 WeakPolarHBondContact O-CG2 3.31Å; N420-V424 PolarHBondContact O-N 3.02Å; D422-V424 PolarHBondContact O-N 2.77Å; V424-L426 VanDerWaalsContact C-N 3.31Å; V424-L426 PolarHBondContact O-N 2.85Å; V424-V427 PolarHBondContact O-N 3.46Å; V424-V428 HydrophobicContact CG1-CG2 4.19Å; V424-V428 WeakPolarHBondContact O-CB 3.37Å; V424-V428 WeakPolarHBondContact O-CG2 3.37Å; V424-V428 PolarHBondContact O-N 3.47Å
425	R	94.7	Very high	90.7	Very high	130 Å²	130	44.8 Å²	44.8	49%	0.491	24%	0.236	S	C	.	.	H	α-helix	trans	-58.2	-41.4	178.3	-176.3	176.1	70.2	-107.7	3.9	112.4	E421 D422 V423 G429	E421-R425 VanDerWaalsContact O-CB 3.29Å; E421-R425 WeakPolarHBondContact O-CB 3.25Å; E421-R425 PolarHBondContact O-N 2.92Å; D422-R425 PolarHBondContact O-N 3.46Å; D422-R425 IonicContact OD1-CZ 3.5Å; D422-R425 IonicContact OD1-NH1 3.55Å; D422-R425 PolarHBondContact OD1-NH1 2.88Å; D422-R425 IonicContact OD1-NH2 2.76Å; D422-R425 PolarHBondContact OD1-NH2 3.08Å; V423-R425 PolarHBondContact O-N 3.04Å; R425-G429 PolarHBondContact O-N 2.76Å
426	L	94.4	Very high	89	Confident	14 Å²	14	50.1 Å²	50.1	7%	0.073	26%	0.261	C	S	.	.	H	α-helix	trans	-71	-42.5	-178.8	-71.1	172.4	0	0	0	112.8	L418 D422 V423 V424 G429 H430 L474 H477	L418-L426 HydrophobicContact CD1-CD1 4Å; D422-L426 WeakPolarHBondContact O-CB 3.32Å; D422-L426 VanDerWaalsContact O-CG 3.26Å; D422-L426 WeakPolarHBondContact O-CG 3.35Å; D422-L426 PolarHBondContact O-N 3.04Å; V423-L426 PolarHBondContact O-N 3.41Å; V424-L426 VanDerWaalsContact C-N 3.31Å; V424-L426 PolarHBondContact O-N 2.85Å; L426-G429 PolarHBondContact O-N 2.86Å; L426-H430 PolarHBondContact O-N 3.14Å; L426-L474 HydrophobicContact CB-CD2 3.81Å; L426-L474 HydrophobicContact CD1-CD2 3.97Å; L426-H477 HydrophobicContact CD1-CB 3.59Å; L426-H477 HydrophobicContact CD2-CB 4.5Å; L426-H477 VanDerWaalsContact CD2-CD2 3.45Å; L426-H477 WeakPolarHBondContact CD2-CD2 3.48Å
427	V	95.9	Very high	87.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.4	-40.5	175.3	177.9	0	0	0	0	110.9	F406 V408 V423 V424 H430 L431 A470 L474 V514 Y516	F406-V427 HydrophobicContact CD1-CG1 3.83Å; F406-V427 HydrophobicContact CD2-CB 4.45Å; F406-V427 HydrophobicContact CD2-CG1 3.85Å; F406-V427 HydrophobicContact CE1-CB 4.19Å; F406-V427 HydrophobicContact CE1-CG1 3.67Å; F406-V427 HydrophobicContact CE2-CB 3.84Å; F406-V427 HydrophobicContact CE2-CG1 3.69Å; F406-V427 HydrophobicContact CE2-CG2 4.2Å; F406-V427 HydrophobicContact CG-CG1 3.91Å; F406-V427 HydrophobicContact CZ-CB 3.68Å; F406-V427 HydrophobicContact CZ-CG1 3.6Å; V408-V427 HydrophobicContact CG2-CG2 4.28Å; V423-V427 WeakPolarHBondContact O-CG2 3.16Å; V423-V427 PolarHBondContact O-N 3.35Å; V424-V427 PolarHBondContact O-N 3.46Å; V427-H430 PolarHBondContact O-N 3.01Å; V427-L431 HydrophobicContact CG1-CD1 4.43Å; V427-L431 WeakPolarHBondContact O-CG 3.49Å; V427-L431 PolarHBondContact O-N 3.13Å; V427-A470 HydrophobicContact CG1-CB 4.47Å; V427-A470 HydrophobicContact CG2-CB 4.37Å; V427-L474 HydrophobicContact CG2-CD1 3.82Å; V427-L474 HydrophobicContact CG2-CD2 4.31Å; V427-L474 HydrophobicContact CG2-CG 4.27Å; V427-V514 HydrophobicContact CG1-CG1 4.05Å; V427-V514 HydrophobicContact CG2-CG1 4.5Å; V427-V514 HydrophobicContact CG2-CG2 4.46Å; V427-Y516 HydrophobicContact CG1-CE1 4.19Å
428	V	94.2	Very high	85.5	Confident	19 Å²	19	51.4 Å²	51.4	12%	0.115	26%	0.26	C	S	.	.	H	α-helix	trans	-63.5	-43.1	175.1	171	0	0	0	0	111.5	W300 F406 V424 H430 L431 T432	W300-V428 HydrophobicContact CB-CG2 4.48Å; W300-V428 HydrophobicContact CD2-CB 4.42Å; W300-V428 HydrophobicContact CD2-CG1 4.2Å; W300-V428 HydrophobicContact CD2-CG2 3.31Å; W300-V428 VanDerWaalsContact CE2-CG2 3.49Å; W300-V428 HydrophobicContact CE3-CG2 3.51Å; W300-V428 HydrophobicContact CG-CG1 4.24Å; W300-V428 HydrophobicContact CG-CG2 3.77Å; W300-V428 HydrophobicContact CH2-CG2 3.93Å; W300-V428 HydrophobicContact CZ2-CG1 4.12Å; W300-V428 HydrophobicContact CZ2-CG2 3.81Å; W300-V428 HydrophobicContact CZ3-CG2 3.81Å; F406-V428 HydrophobicContact CE1-CG2 3.98Å; F406-V428 HydrophobicContact CZ-CG2 4.21Å; V424-V428 HydrophobicContact CG1-CG2 4.19Å; V424-V428 WeakPolarHBondContact O-CB 3.37Å; V424-V428 WeakPolarHBondContact O-CG2 3.37Å; V424-V428 PolarHBondContact O-N 3.47Å; V428-H430 PolarHBondContact O-N 3.02Å; V428-L431 PolarHBondContact O-N 3.33Å; V428-T432 HydrophobicContact CG1-CG2 4.5Å; V428-T432 WeakPolarHBondContact O-CG2 3.24Å; V428-T432 PolarHBondContact O-N 3.32Å; V428-T432 PolarHBondContact O-OG1 3.44Å
429	G	90.1	Very high	83.7	Confident	15 Å²	15	54.8 Å²	54.8	16%	0.155	28%	0.281	C	S	.	.	H	α-helix	trans	-53.5	-53.2	173	0	0	0	0	0	111.6	R425 L426 L431 T432 E433	R425-G429 PolarHBondContact O-N 2.76Å; L426-G429 PolarHBondContact O-N 2.86Å; G429-L431 PolarHBondContact O-N 2.94Å; G429-T432 PolarHBondContact O-N 2.85Å; G429-T432 PolarHBondContact O-OG1 2.93Å; G429-E433 WeakPolarHBondContact O-CG 3.42Å; G429-E433 PolarHBondContact O-N 3.05Å
430	H	89.5	Confident	81.8	Confident	10 Å²	10	55.7 Å²	55.7	5%	0.046	28%	0.282	C	S	.	.	H	α-helix	trans	-56.2	-44.8	176.5	170.3	83.7	0	0	0	112.8	E110 L426 V427 V428 T432 E433 A434 D467 Q468 A470	E110-H430 IonicContact OE1-NE2 3.91Å; E110-H430 IonicContact OE2-NE2 2.68Å; L426-H430 PolarHBondContact O-N 3.14Å; V427-H430 PolarHBondContact O-N 3.01Å; V428-H430 PolarHBondContact O-N 3.02Å; H430-T432 PolarHBondContact O-N 3.46Å; H430-E433 PolarHBondContact O-N 3.24Å; H430-A434 WeakPolarHBondContact O-CB 3.2Å; H430-A434 PolarHBondContact O-N 3.01Å; H430-D467 PolarHBondContact CE1-O 3.05Å; H430-D467 VanDerWaalsContact CE1-O 3.23Å; H430-D467 PolarHBondContact ND1-O 2.9Å; H430-Q468 PolarHBondContact CE1-O 3.03Å; H430-A470 HydrophobicContact CB-CB 4.44Å
431	L	88	Confident	79.8	Confident	39 Å²	39	60.2 Å²	60.2	20%	0.204	31%	0.306	C	S	.	.	H	α-helix	trans	-59.7	-46.8	176.1	-77.4	173.3	0	0	0	112.5	W300 F406 V427 V428 G429 E433 A434 D435 Y516	W300-L431 HydrophobicContact CH2-CD1 4.45Å; F406-L431 HydrophobicContact CD1-CD1 3.99Å; F406-L431 HydrophobicContact CE1-CD1 4.22Å; V427-L431 HydrophobicContact CG1-CD1 4.43Å; V427-L431 WeakPolarHBondContact O-CG 3.49Å; V427-L431 PolarHBondContact O-N 3.13Å; V428-L431 PolarHBondContact O-N 3.33Å; G429-L431 PolarHBondContact O-N 2.94Å; L431-E433 PolarHBondContact O-N 3.17Å; L431-A434 PolarHBondContact O-N 3.33Å; L431-D435 PolarHBondContact O-N 2.79Å; L431-Y516 HydrophobicContact CD1-CD1 4.39Å; L431-Y516 HydrophobicContact CD1-CE1 4.08Å; L431-Y516 HydrophobicContact CD2-CD1 3.94Å; L431-Y516 HydrophobicContact CD2-CE1 3.56Å; L431-Y516 HydrophobicContact CG-CE1 3.94Å
432	T	84.6	Confident	77.9	Confident	69 Å²	69	58.7 Å²	58.7	42%	0.423	31%	0.313	S	S	.	.	H	α-helix	trans	-67.2	-36.8	-179.3	60.4	0	0	0	0	113	V428 G429 H430 D435 Q436	V428-T432 HydrophobicContact CG1-CG2 4.5Å; V428-T432 WeakPolarHBondContact O-CG2 3.24Å; V428-T432 PolarHBondContact O-N 3.32Å; V428-T432 PolarHBondContact O-OG1 3.44Å; G429-T432 PolarHBondContact O-N 2.85Å; G429-T432 PolarHBondContact O-OG1 2.93Å; H430-T432 PolarHBondContact O-N 3.46Å; T432-D435 PolarHBondContact O-N 3.1Å; T432-Q436 WeakPolarHBondContact O-CG 3.28Å; T432-Q436 PolarHBondContact O-N 3.07Å; T432-Q436 VanDerWaalsContact O-N 3.1Å
433	E	79.6	Confident	76.1	Confident	64 Å²	64	62.5 Å²	62.5	30%	0.299	33%	0.33	S	S	.	.	H	α-helix	trans	-67	-40.7	175.4	-71.8	164.4	-149.4	0	0	111.3	G429 H430 L431 D435 Q436 H437 R473	G429-E433 WeakPolarHBondContact O-CG 3.42Å; G429-E433 PolarHBondContact O-N 3.05Å; H430-E433 PolarHBondContact O-N 3.24Å; L431-E433 PolarHBondContact O-N 3.17Å; E433-D435 VanDerWaalsContact C-N 3.32Å; E433-D435 PolarHBondContact O-N 2.67Å; E433-Q436 PolarHBondContact O-N 3.17Å; E433-H437 WeakPolarHBondContact O-CB 3.42Å; E433-H437 PolarHBondContact O-N 2.74Å; E433-R473 IonicContact OE1-CZ 2.76Å; E433-R473 IonicContact OE1-NH1 3.12Å; E433-R473 PolarHBondContact OE1-NH1 3.09Å; E433-R473 IonicContact OE1-NH2 2.89Å; E433-R473 PolarHBondContact OE1-NH2 2.84Å; E433-R473 IonicContact OE2-CZ 3.56Å; E433-R473 IonicContact OE2-NH1 2.69Å; E433-R473 PolarHBondContact OE2-NH1 2.96Å; E433-R473 IonicContact OE2-NH2 2.72Å
434	A	70.2	Confident	74	Confident	31 Å²	31	73.7 Å²	73.7	26%	0.256	37%	0.372	S	S	.	.	H	α-helix	trans	-62.4	-37.1	177.2	0	0	0	0	0	112.6	H430 L431 K438	H430-A434 WeakPolarHBondContact O-CB 3.2Å; H430-A434 PolarHBondContact O-N 3.01Å; L431-A434 PolarHBondContact O-N 3.33Å; A434-K438 WeakPolarHBondContact O-CG 3.45Å; A434-K438 PolarHBondContact O-N 2.61Å; A434-K438 VanDerWaalsContact O-N 3.15Å
435	D	65.9	Low	72	Confident	86 Å²	86	76.2 Å²	76.2	46%	0.46	39%	0.388	S	S	.	.	H	α-helix	trans	-75.9	-34.7	177.1	-74.5	-19.5	0	0	0	113.1	L431 T432 E433 K438 T439	L431-D435 PolarHBondContact O-N 2.79Å; T432-D435 PolarHBondContact O-N 3.1Å; E433-D435 VanDerWaalsContact C-N 3.32Å; E433-D435 PolarHBondContact O-N 2.67Å; D435-K438 IonicContact OD1-NZ 3.61Å; D435-K438 PolarHBondContact OD1-NZ 3.3Å; D435-T439 PolarHBondContact O-N 2.7Å; D435-T439 VanDerWaalsContact O-N 3.14Å; D435-T439 PolarHBondContact O-OG1 2.93Å
436	Q	61	Low	70.4	Confident	126 Å²	126	74.6 Å²	74.6	59%	0.589	40%	0.403	S	S	*	.	H	α-helix	trans	-61.2	-45.6	168.4	-71	175.5	23.3	0	0	111	T432 E433 K438 T439 D440	T432-Q436 WeakPolarHBondContact O-CG 3.28Å; T432-Q436 PolarHBondContact O-N 3.07Å; T432-Q436 VanDerWaalsContact O-N 3.1Å; E433-Q436 PolarHBondContact O-N 3.17Å; Q436-K438 PolarHBondContact O-N 3.05Å; Q436-T439 WeakPolarHBondContact O-CB 3.42Å; Q436-T439 PolarHBondContact O-N 3.36Å; Q436-D440 PolarHBondContact O-N 3.33Å
437	H	58.4	Low	69.6	Low	98 Å²	98	79.4 Å²	79.4	45%	0.454	43%	0.429	S	S	.	.	H	α-helix	trans	-64.2	-37.5	-178.5	-150	86	0	0	0	112.9	E433 T439 L441	E433-H437 WeakPolarHBondContact O-CB 3.42Å; E433-H437 PolarHBondContact O-N 2.74Å; H437-T439 VanDerWaalsContact C-N 3.34Å; H437-L441 WeakPolarHBondContact O-CB 3.29Å; H437-L441 VanDerWaalsContact O-CG 3.27Å; H437-L441 WeakPolarHBondContact O-CG 3.38Å; H437-L441 PolarHBondContact O-N 2.95Å
438	K	57.9	Low	68.6	Low	131 Å²	131	86.5 Å²	86.5	57%	0.57	47%	0.466	S	S	*	.	H	α-helix	trans	-61.3	-42	170.6	-69.3	166.5	-159.5	159.8	0	111.8	A434 D435 Q436 L441 A442	A434-K438 WeakPolarHBondContact O-CG 3.45Å; A434-K438 PolarHBondContact O-N 2.61Å; A434-K438 VanDerWaalsContact O-N 3.15Å; D435-K438 IonicContact OD1-NZ 3.61Å; D435-K438 PolarHBondContact OD1-NZ 3.3Å; Q436-K438 PolarHBondContact O-N 3.05Å; K438-L441 PolarHBondContact O-N 3.5Å; K438-A442 WeakPolarHBondContact O-CB 3.49Å; K438-A442 PolarHBondContact O-N 2.98Å
439	T	56.1	Low	67.7	Low	78 Å²	78	88.1 Å²	88.1	48%	0.479	49%	0.486	S	S	.	.	H	α-helix	trans	-67.4	-43	-177.8	-54.7	0	0	0	0	111.3	D435 Q436 H437 A442 Q443	D435-T439 PolarHBondContact O-N 2.7Å; D435-T439 VanDerWaalsContact O-N 3.14Å; D435-T439 PolarHBondContact O-OG1 2.93Å; Q436-T439 WeakPolarHBondContact O-CB 3.42Å; Q436-T439 PolarHBondContact O-N 3.36Å; H437-T439 VanDerWaalsContact C-N 3.34Å; T439-A442 PolarHBondContact O-N 3.38Å; T439-Q443 PolarHBondContact O-N 3.15Å
440	D	56	Low	66.9	Low	67 Å²	67	91.6 Å²	91.6	36%	0.358	50%	0.501	S	S	.	.	H	α-helix	trans	-64.1	-42.1	174.4	-87	7.7	0	0	0	112.3	Q436 A442 Q443	Q436-D440 PolarHBondContact O-N 3.33Å; D440-A442 VanDerWaalsContact C-N 3.33Å; D440-A442 PolarHBondContact O-N 3.09Å; D440-Q443 CarbonylContact O-C 3.46Å; D440-Q443 PolarHBondContact O-N 3.16Å; D440-Q443 VanDerWaalsContact O-O 3.11Å
441	L	54.9	Low	66	Low	123 Å²	123	95 Å²	95	64%	0.644	52%	0.518	S	S	*	.	H	α-helix	trans	-68.5	-30.3	177.8	-73.5	172.3	0	0	0	113.1	H437 K438 Q443	H437-L441 WeakPolarHBondContact O-CB 3.29Å; H437-L441 VanDerWaalsContact O-CG 3.27Å; H437-L441 WeakPolarHBondContact O-CG 3.38Å; H437-L441 PolarHBondContact O-N 2.95Å; K438-L441 PolarHBondContact O-N 3.5Å; L441-Q443 VanDerWaalsContact C-N 3.32Å
442	A	55.4	Low	65.5	Low	84 Å²	84	98.3 Å²	98.3	69%	0.694	53%	0.532	S	S	*	.	H	α-helix	trans	-69.2	-31.5	171.9	0	0	0	0	0	112.1	K438 T439 D440 R444	K438-A442 WeakPolarHBondContact O-CB 3.49Å; K438-A442 PolarHBondContact O-N 2.98Å; T439-A442 PolarHBondContact O-N 3.38Å; D440-A442 VanDerWaalsContact C-N 3.33Å; D440-A442 PolarHBondContact O-N 3.09Å; A442-R444 PolarHBondContact O-N 3.37Å
443	Q	56.7	Low	65	Low	121 Å²	121	97.6 Å²	97.6	57%	0.565	53%	0.53	S	S	*	.	S	Bend	trans	-83	86.8	174.4	-68	-174.9	45.2	0	0	111.3	T439 D440 L441 P445	T439-Q443 PolarHBondContact O-N 3.15Å; D440-Q443 CarbonylContact O-C 3.46Å; D440-Q443 PolarHBondContact O-N 3.16Å; D440-Q443 VanDerWaalsContact O-O 3.11Å; L441-Q443 VanDerWaalsContact C-N 3.32Å; Q443-P445 VanDerWaalsContact O-CD 3.31Å; Q443-P445 WeakPolarHBondContact O-CD 3.44Å
444	R	53.6	Low	64.5	Low	234 Å²	234	96.6 Å²	96.6	88%	0.883	53%	0.527	S	S	*	.			trans	-51.7	118.5	167.4	-80	-174.4	174	-178.7	-1.2	109.7	A442 A446	A442-R444 PolarHBondContact O-N 3.37Å; R444-A446 PolarHBondContact O-N 2.97Å
445	P	55	Low	64.5	Low	61 Å²	61	99.7 Å²	99.7	40%	0.396	54%	0.538	S	S	.	.			trans	-69.7	102.7	-174.9	26	-33.4	0	0	0	110	Q443 N447 M451	Q443-P445 VanDerWaalsContact O-CD 3.31Å; Q443-P445 WeakPolarHBondContact O-CD 3.44Å; P445-N447 PolarHBondContact O-N 3.09Å; P445-M451 HydrophobicContact CG-SD 3.88Å
446	A	61.6	Low	64.8	Low	96 Å²	96	100.2 Å²	100.2	79%	0.793	54%	0.541	S	S	*	.			trans	-69.4	-16.3	-176.5	0	0	0	0	0	113.9	R444	R444-A446 PolarHBondContact O-N 2.97Å
447	N	76.4	Confident	65	Low	116 Å²	116	100.6 Å²	100.6	62%	0.62	54%	0.542	S	S	*	.	S	Bend	trans	-132.6	132.5	-174.1	-76.3	-42.5	0	0	0	112.3	P445 G449 L450 M451	P445-N447 PolarHBondContact O-N 3.09Å; N447-G449 PolarHBondContact O-N 3.09Å; N447-L450 WeakPolarHBondContact O-CB 3.03Å; N447-L450 PolarHBondContact O-N 3.35Å; N447-M451 PolarHBondContact O-N 3.06Å
448	L	74.9	Confident	65.2	Low	149 Å²	149	102 Å²	102	78%	0.78	54%	0.544	S	S	*	.	H	α-helix	trans	-53.3	-36	175.2	-83.2	156.6	0	0	0	113.5	M451 Q452	L448-M451 PolarHBondContact O-N 3.21Å; L448-Q452 PolarHBondContact O-N 3.03Å
449	G	76.4	Confident	65.2	Low	53 Å²	53	103.9 Å²	103.9	55%	0.546	55%	0.552	S	S	.	*	H	α-helix	trans	-64.4	-37.5	177.3	0	0	0	0	0	113.6	N447 Q452 S453	N447-G449 PolarHBondContact O-N 3.09Å; G449-Q452 PolarHBondContact O-N 3.1Å; G449-S453 PolarHBondContact O-N 3.23Å; G449-S453 PolarHBondContact O-OG 3.03Å
450	L	73.4	Confident	65.1	Low	87 Å²	87	104.4 Å²	104.4	46%	0.455	56%	0.564	S	S	.	*	H	α-helix	trans	-68.8	-38.7	176.2	-164.5	80.2	0	0	0	110.8	N447 S453 L454	N447-L450 WeakPolarHBondContact O-CB 3.03Å; N447-L450 PolarHBondContact O-N 3.35Å; L450-S453 WeakPolarHBondContact CA-OG 3.5Å; L450-S453 PolarHBondContact O-N 3.31Å; L450-S453 PolarHBondContact O-OG 3.43Å; L450-L454 HydrophobicContact CG-CD1 4.39Å; L450-L454 WeakPolarHBondContact O-CB 3.41Å; L450-L454 VanDerWaalsContact O-CG 3.31Å; L450-L454 WeakPolarHBondContact O-CG 3.23Å; L450-L454 PolarHBondContact O-N 3.22Å
451	M	69.6	Low	64.9	Low	83 Å²	83	105.3 Å²	105.3	41%	0.409	58%	0.576	S	S	.	*	H	α-helix	trans	-65.2	-40.4	175.1	-167.2	140.1	64.7	0	0	111.4	P445 N447 L448 L454 L455	P445-M451 HydrophobicContact CG-SD 3.88Å; N447-M451 PolarHBondContact O-N 3.06Å; L448-M451 PolarHBondContact O-N 3.21Å; M451-L454 PolarHBondContact O-N 3.06Å; M451-L455 HydrophobicContact CG-CD1 4.16Å; M451-L455 WeakPolarHBondContact O-CB 3.38Å; M451-L455 VanDerWaalsContact O-CG 3.23Å; M451-L455 WeakPolarHBondContact O-CG 3.09Å; M451-L455 PolarHBondContact O-N 2.69Å
452	Q	77.2	Confident	64.5	Low	107 Å²	107	101.1 Å²	101.1	50%	0.5	56%	0.562	S	S	.	*	H	α-helix	trans	-64.2	-40.5	174.4	-175.7	62.7	17.5	0	0	112.4	L448 G449 L455 L456	L448-Q452 PolarHBondContact O-N 3.03Å; G449-Q452 PolarHBondContact O-N 3.1Å; Q452-L455 PolarHBondContact O-N 3.27Å; Q452-L456 HydrophobicContact CG-CD1 4.12Å; Q452-L456 WeakPolarHBondContact O-CB 3.4Å; Q452-L456 VanDerWaalsContact O-CG 3.29Å; Q452-L456 WeakPolarHBondContact O-CG 3.41Å; Q452-L456 PolarHBondContact O-N 2.89Å
453	S	75.1	Confident	64	Low	55 Å²	55	104.8 Å²	104.8	39%	0.385	57%	0.569	S	S	.	*	H	α-helix	trans	-66.5	-41	175.7	53	0	0	0	0	112.3	G449 L450 L456 Q457	G449-S453 PolarHBondContact O-N 3.23Å; G449-S453 PolarHBondContact O-OG 3.03Å; L450-S453 WeakPolarHBondContact CA-OG 3.5Å; L450-S453 PolarHBondContact O-N 3.31Å; L450-S453 PolarHBondContact O-OG 3.43Å; S453-L456 PolarHBondContact O-N 2.99Å; S453-Q457 VanDerWaalsContact O-CB 3.31Å; S453-Q457 WeakPolarHBondContact O-CB 3.29Å; S453-Q457 PolarHBondContact O-N 2.67Å
454	L	69.8	Low	63.8	Low	43 Å²	43	104 Å²	104	23%	0.225	57%	0.565	C	S	.	*	H	α-helix	trans	-65.3	-39.5	176.1	-71.5	168.7	0	0	0	112	L450 M451 Q457 R458	L450-L454 HydrophobicContact CG-CD1 4.39Å; L450-L454 WeakPolarHBondContact O-CB 3.41Å; L450-L454 VanDerWaalsContact O-CG 3.31Å; L450-L454 WeakPolarHBondContact O-CG 3.23Å; L450-L454 PolarHBondContact O-N 3.22Å; M451-L454 PolarHBondContact O-N 3.06Å; L454-Q457 PolarHBondContact O-N 3.27Å; L454-R458 WeakPolarHBondContact O-CB 3.34Å; L454-R458 VanDerWaalsContact O-CG 3.29Å; L454-R458 WeakPolarHBondContact O-CG 3.34Å; L454-R458 PolarHBondContact O-N 3.1Å
455	L	69	Low	63.9	Low	95 Å²	95	98.1 Å²	98.1	50%	0.497	55%	0.548	S	S	.	.	H	α-helix	trans	-67.3	-39	174.8	-71.6	170.6	0	0	0	112.3	M451 Q452 K459	M451-L455 HydrophobicContact CG-CD1 4.16Å; M451-L455 WeakPolarHBondContact O-CB 3.38Å; M451-L455 VanDerWaalsContact O-CG 3.23Å; M451-L455 WeakPolarHBondContact O-CG 3.09Å; M451-L455 PolarHBondContact O-N 2.69Å; Q452-L455 PolarHBondContact O-N 3.27Å; L455-K459 WeakPolarHBondContact O-CB 3.33Å; L455-K459 PolarHBondContact O-N 3.02Å
456	L	72.4	Confident	64.3	Low	97 Å²	97	97.9 Å²	97.9	51%	0.508	55%	0.551	S	S	.	*	H	α-helix	trans	-67.9	-37.3	173.7	-74.4	171.4	0	0	0	112.1	Q452 S453 K459 A460	Q452-L456 HydrophobicContact CG-CD1 4.12Å; Q452-L456 WeakPolarHBondContact O-CB 3.4Å; Q452-L456 VanDerWaalsContact O-CG 3.29Å; Q452-L456 WeakPolarHBondContact O-CG 3.41Å; Q452-L456 PolarHBondContact O-N 2.89Å; S453-L456 PolarHBondContact O-N 2.99Å; L456-K459 PolarHBondContact O-N 2.88Å; L456-A460 VanDerWaalsContact O-CB 3.29Å; L456-A460 WeakPolarHBondContact O-CB 3.4Å; L456-A460 PolarHBondContact O-N 3.26Å
457	Q	65.2	Low	65.2	Low	134 Å²	134	93.8 Å²	93.8	63%	0.626	52%	0.516	S	S	*	.	H	α-helix	trans	-64.2	-47.5	174.9	-173.2	174.2	-7	0	0	110.9	S453 L454 K459 A460 S461	S453-Q457 VanDerWaalsContact O-CB 3.31Å; S453-Q457 WeakPolarHBondContact O-CB 3.29Å; S453-Q457 PolarHBondContact O-N 2.67Å; L454-Q457 PolarHBondContact O-N 3.27Å; Q457-K459 VanDerWaalsContact C-N 3.26Å; Q457-K459 PolarHBondContact O-N 3.47Å; Q457-A460 PolarHBondContact O-N 3.49Å; Q457-A460 VanDerWaalsContact O-N 3.09Å; Q457-S461 PolarHBondContact O-N 2.85Å; Q457-S461 PolarHBondContact O-OG 3.26Å
458	R	61.8	Low	65.7	Low	127 Å²	127	95.1 Å²	95.1	48%	0.479	52%	0.519	S	S	.	.	H	α-helix	trans	-60.5	-32	173	-71.2	173.1	-172.1	-170.3	0.8	113.2	L454 S461	L454-R458 WeakPolarHBondContact O-CB 3.34Å; L454-R458 VanDerWaalsContact O-CG 3.29Å; L454-R458 WeakPolarHBondContact O-CG 3.34Å; L454-R458 PolarHBondContact O-N 3.1Å; R458-S461 WeakPolarHBondContact CA-OG 3.36Å; R458-S461 PolarHBondContact O-OG 2.89Å
459	K	58.6	Low	66.6	Low	171 Å²	171	88 Å²	88	74%	0.743	48%	0.482	S	S	*	.	H	α-helix	trans	-76.6	-30.8	174.5	-170.6	173.8	-177.9	177	0	112.6	L455 L456 Q457	L455-K459 WeakPolarHBondContact O-CB 3.33Å; L455-K459 PolarHBondContact O-N 3.02Å; L456-K459 PolarHBondContact O-N 2.88Å; Q457-K459 VanDerWaalsContact C-N 3.26Å; Q457-K459 PolarHBondContact O-N 3.47Å
460	A	53.3	Low	67.5	Low	89 Å²	89	85.6 Å²	85.6	74%	0.736	46%	0.456	S	S	*	.	H	α-helix	trans	-80.5	-27.8	179	0	0	0	0	0	113.1	L456 Q457 G462	L456-A460 VanDerWaalsContact O-CB 3.29Å; L456-A460 WeakPolarHBondContact O-CB 3.4Å; L456-A460 PolarHBondContact O-N 3.26Å; Q457-A460 PolarHBondContact O-N 3.49Å; Q457-A460 VanDerWaalsContact O-N 3.09Å; A460-G462 PolarHBondContact O-N 3.13Å
461	S	53.6	Low	68.7	Low	86 Å²	86	81.4 Å²	81.4	60%	0.601	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	1.4	171.6	52.5	0	0	0	0	114.3	Q457 R458	Q457-S461 PolarHBondContact O-N 2.85Å; Q457-S461 PolarHBondContact O-OG 3.26Å; R458-S461 WeakPolarHBondContact CA-OG 3.36Å; R458-S461 PolarHBondContact O-OG 2.89Å
462	G	44.9	Very low	69.9	Low	35 Å²	35	77.5 Å²	77.5	36%	0.361	42%	0.415	S	S	.	.			trans	77	168.1	-174	0	0	0	0	0	113.2	A460 H464	A460-G462 PolarHBondContact O-N 3.13Å; G462-H464 PolarHBondContact O-N 3.18Å
463	L	44.7	Very low	70.8	Confident	161 Å²	161	74 Å²	74	84%	0.843	40%	0.397	S	S	*	.	S	Bend	trans	-74.8	23.3	-178	-95.2	152	0	0	0	114.2	E465	L463-E465 PolarHBondContact O-N 3Å
464	H	52.6	Low	71.8	Confident	105 Å²	105	71.3 Å²	71.3	49%	0.486	38%	0.379	S	S	.	.			trans	-79.3	100	168.6	-81.1	-72.3	0	0	0	109.5	G462 A466	G462-H464 PolarHBondContact O-N 3.18Å; H464-A466 PolarHBondContact O-N 3.08Å
465	E	56	Low	73.1	Confident	110 Å²	110	69.3 Å²	69.3	51%	0.514	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-51.9	122.1	149.1	-69.1	-166.9	152.4	0	0	107.3	R87 L463 D467	R87-E465 IonicContact CZ-OE2 3.44Å; R87-E465 IonicContact NH1-OE2 3.34Å; R87-E465 PolarHBondContact NH1-OE2 2.89Å; R87-E465 IonicContact NH2-OE2 2.88Å; R87-E465 PolarHBondContact NH2-OE2 3.22Å; L463-E465 PolarHBondContact O-N 3Å; E465-D467 PolarHBondContact O-N 2.87Å
466	A	64.1	Low	74.3	Confident	57 Å²	57	65 Å²	65	47%	0.471	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-57.7	124.7	171.8	0	0	0	0	0	108.3	H464 Q468	H464-A466 PolarHBondContact O-N 3.08Å; A466-Q468 PolarHBondContact O-N 3.4Å
467	D	80.3	Confident	75.3	Confident	10 Å²	10	61.8 Å²	61.8	5%	0.053	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-56.8	124.7	179.6	-74.9	-49.7	0	0	0	109.5	H430 E465 N469 R473 R476	H430-D467 PolarHBondContact CE1-O 3.05Å; H430-D467 VanDerWaalsContact CE1-O 3.23Å; H430-D467 PolarHBondContact ND1-O 2.9Å; E465-D467 PolarHBondContact O-N 2.87Å; D467-N469 PolarHBondContact O-N 2.94Å; D467-R473 HydrophobicContact CB-CB 4Å; D467-R476 IonicContact OD1-CZ 2.72Å; D467-R476 IonicContact OD1-NE 3.89Å; D467-R476 IonicContact OD1-NH2 3.05Å; D467-R476 PolarHBondContact OD1-NH2 2.89Å; D467-R476 IonicContact OD2-CZ 2.76Å; D467-R476 IonicContact OD2-NE 2.78Å; D467-R476 PolarHBondContact OD2-NE 3.18Å; D467-R476 IonicContact OD2-NH2 2.7Å; D467-R476 PolarHBondContact OD2-NH2 2.94Å
468	Q	86.8	Confident	76.7	Confident	144 Å²	144	55.5 Å²	55.5	67%	0.673	30%	0.299	S	S	*	.	S	Bend	trans	-72.4	-7.1	-176.3	-61.3	-174.3	21.9	0	0	112.7	H430 A466	H430-Q468 PolarHBondContact CE1-O 3.03Å; A466-Q468 PolarHBondContact O-N 3.4Å
469	N	94.1	Very high	78.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.277	C	S	.	.	S	Bend	trans	-135.6	127.9	-175	-179.1	-53.2	0	0	0	109.5	E90 S91 D467 A471 T472 R473	E90-N469 HydrophobicContact CG-CB 3.78Å; E90-N469 WeakPolarHBondContact CG-ND2 3.07Å; E90-N469 WeakPolarHBondContact OE1-CB 3.05Å; S91-N469 PolarHBondContact O-ND2 3.15Å; D467-N469 PolarHBondContact O-N 2.94Å; N469-A471 PolarHBondContact O-N 2.84Å; N469-A471 WeakPolarHBondContact OD1-CA 3.4Å; N469-A471 VanDerWaalsContact OD1-CB 3.27Å; N469-A471 WeakPolarHBondContact OD1-CB 3.43Å; N469-A471 PolarHBondContact OD1-N 3.38Å; N469-T472 PolarHBondContact O-N 2.81Å; N469-T472 PolarHBondContact OD1-N 3.26Å; N469-R473 PolarHBondContact O-N 3.45Å; N469-R473 VanDerWaalsContact O-N 3.12Å
470	A	96	Very high	79.7	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-69.3	-30.7	-177.6	0	0	0	0	0	113.5	E110 V427 H430 R473 L474 V514 Y516	E110-A470 WeakPolarHBondContact OE2-CB 3.32Å; E110-A470 PolarHBondContact OE2-N 3.45Å; V427-A470 HydrophobicContact CG1-CB 4.47Å; V427-A470 HydrophobicContact CG2-CB 4.37Å; H430-A470 HydrophobicContact CB-CB 4.44Å; A470-R473 WeakPolarHBondContact O-CB 3.4Å; A470-R473 PolarHBondContact O-N 3.46Å; A470-L474 WeakPolarHBondContact O-CB 3.35Å; A470-L474 VanDerWaalsContact O-CG 3.27Å; A470-L474 WeakPolarHBondContact O-CG 3.42Å; A470-L474 PolarHBondContact O-N 2.98Å; A470-V514 HydrophobicContact CB-CG2 4.2Å; A470-Y516 WeakPolarHBondContact CB-OH 3.5Å
471	A	97.3	Very high	81.4	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-64.7	-41.8	174.8	0	0	0	0	0	110.9	N112 N469 R473 L474 I475 V512	N112-A471 HydrophobicContact CB-CB 3.78Å; N469-A471 PolarHBondContact O-N 2.84Å; N469-A471 WeakPolarHBondContact OD1-CA 3.4Å; N469-A471 VanDerWaalsContact OD1-CB 3.27Å; N469-A471 WeakPolarHBondContact OD1-CB 3.43Å; N469-A471 PolarHBondContact OD1-N 3.38Å; A471-R473 PolarHBondContact O-N 3.26Å; A471-L474 PolarHBondContact O-N 3.4Å; A471-I475 WeakPolarHBondContact O-CG1 3.49Å; A471-I475 PolarHBondContact O-N 3.12Å; A471-V512 HydrophobicContact CB-CB 4Å; A471-V512 HydrophobicContact CB-CG1 4.05Å
472	T	96.3	Very high	82.7	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.2	-43.4	172.5	-49.6	0	0	0	0	111.9	L86 R87 E90 N112 N469 I475 R476	L86-T472 HydrophobicContact CB-CG2 4.11Å; R87-T472 HydrophobicContact CG-CG2 4.42Å; E90-T472 WeakPolarHBondContact CG-OG1 3.41Å; E90-T472 WeakPolarHBondContact OE2-CB 3.47Å; E90-T472 PolarHBondContact OE2-OG1 3.4Å; N112-T472 PolarHBondContact ND2-OG1 2.91Å; N469-T472 PolarHBondContact O-N 2.81Å; N469-T472 PolarHBondContact OD1-N 3.26Å; T472-I475 PolarHBondContact O-N 3.05Å; T472-R476 WeakPolarHBondContact O-CB 3.36Å; T472-R476 PolarHBondContact O-N 3.46Å
473	R	94.7	Very high	84.2	Confident	33 Å²	33	42.7 Å²	42.7	13%	0.125	22%	0.215	C	C	.	.	H	α-helix	trans	-60.9	-44.7	175.1	-172.1	177.3	-171.9	143.9	-3.9	112.1	E433 D467 N469 A470 A471 R476 H477	E433-R473 IonicContact OE1-CZ 2.76Å; E433-R473 IonicContact OE1-NH1 3.12Å; E433-R473 PolarHBondContact OE1-NH1 3.09Å; E433-R473 IonicContact OE1-NH2 2.89Å; E433-R473 PolarHBondContact OE1-NH2 2.84Å; E433-R473 IonicContact OE2-CZ 3.56Å; E433-R473 IonicContact OE2-NH1 2.69Å; E433-R473 PolarHBondContact OE2-NH1 2.96Å; E433-R473 IonicContact OE2-NH2 2.72Å; D467-R473 HydrophobicContact CB-CB 4Å; N469-R473 PolarHBondContact O-N 3.45Å; N469-R473 VanDerWaalsContact O-N 3.12Å; A470-R473 WeakPolarHBondContact O-CB 3.4Å; A470-R473 PolarHBondContact O-N 3.46Å; A471-R473 PolarHBondContact O-N 3.26Å; R473-R476 PolarHBondContact O-N 2.93Å; R473-H477 PolarHBondContact O-CD2 2.82Å; R473-H477 VanDerWaalsContact O-CD2 3.28Å; R473-H477 PolarHBondContact O-N 3.08Å
474	L	96.6	Very high	85.6	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62	-48.2	179.1	-74.4	172.8	0	0	0	111.4	V408 L414 L418 V423 L426 V427 A470 A471 R476 H477 A478 V512 V514	V408-L474 HydrophobicContact CG1-CD1 4.31Å; L414-L474 HydrophobicContact CD1-CB 4.14Å; L418-L474 HydrophobicContact CD1-CD2 4.34Å; V423-L474 HydrophobicContact CB-CD2 4.13Å; V423-L474 HydrophobicContact CG1-CD1 4Å; V423-L474 HydrophobicContact CG1-CD2 3.82Å; V423-L474 HydrophobicContact CG2-CD2 4.15Å; L426-L474 HydrophobicContact CB-CD2 3.81Å; L426-L474 HydrophobicContact CD1-CD2 3.97Å; V427-L474 HydrophobicContact CG2-CD1 3.82Å; V427-L474 HydrophobicContact CG2-CD2 4.31Å; V427-L474 HydrophobicContact CG2-CG 4.27Å; A470-L474 WeakPolarHBondContact O-CB 3.35Å; A470-L474 VanDerWaalsContact O-CG 3.27Å; A470-L474 WeakPolarHBondContact O-CG 3.42Å; A470-L474 PolarHBondContact O-N 2.98Å; A471-L474 PolarHBondContact O-N 3.4Å; L474-R476 PolarHBondContact O-N 3.37Å; L474-H477 PolarHBondContact O-N 2.72Å; L474-A478 WeakPolarHBondContact O-CB 3.2Å; L474-A478 PolarHBondContact O-N 3.09Å; L474-V512 HydrophobicContact CD1-CG1 3.8Å; L474-V514 HydrophobicContact CD1-CG2 3.96Å
475	I	96.6	Very high	86.6	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-58.8	-45.6	175.3	-67.4	177	0	0	0	111.1	L86 N112 L114 A471 T472 H477 A478 I479 I510 V512	L86-I475 HydrophobicContact CD2-CG2 3.9Å; N112-I475 HydrophobicContact CB-CD1 3.78Å; L114-I475 HydrophobicContact CB-CD1 4.3Å; L114-I475 HydrophobicContact CB-CG2 3.73Å; L114-I475 HydrophobicContact CD2-CG2 3.65Å; L114-I475 HydrophobicContact CG-CG2 4.32Å; A471-I475 WeakPolarHBondContact O-CG1 3.49Å; A471-I475 PolarHBondContact O-N 3.12Å; T472-I475 PolarHBondContact O-N 3.05Å; I475-H477 VanDerWaalsContact C-N 3.34Å; I475-H477 PolarHBondContact O-N 2.8Å; I475-A478 PolarHBondContact O-N 2.96Å; I475-I479 PolarHBondContact O-N 3.21Å; I475-I510 HydrophobicContact CG1-CB 4.48Å; I475-I510 HydrophobicContact CG1-CG2 3.92Å; I475-V512 HydrophobicContact CD1-CG2 4.46Å; I475-V512 HydrophobicContact CG1-CG2 4Å
476	R	94.9	Very high	87.7	Confident	5 Å²	5	41.9 Å²	41.9	2%	0.019	21%	0.209	C	C	.	.	H	α-helix	trans	-56.8	-46.2	178.6	-173.3	-170.6	-61.9	-86.2	3.2	112.1	N83 L86 D467 T472 R473 L474 G480 M487 L492	N83-R476 PolarHBondContact OD1-NH1 2.64Å; N83-R476 PolarHBondContact OD1-NH2 2.99Å; L86-R476 HydrophobicContact CD1-CB 4.1Å; L86-R476 HydrophobicContact CD1-CG 4.01Å; D467-R476 IonicContact OD1-CZ 2.72Å; D467-R476 IonicContact OD1-NE 3.89Å; D467-R476 IonicContact OD1-NH2 3.05Å; D467-R476 PolarHBondContact OD1-NH2 2.89Å; D467-R476 IonicContact OD2-CZ 2.76Å; D467-R476 IonicContact OD2-NE 2.78Å; D467-R476 PolarHBondContact OD2-NE 3.18Å; D467-R476 IonicContact OD2-NH2 2.7Å; D467-R476 PolarHBondContact OD2-NH2 2.94Å; T472-R476 WeakPolarHBondContact O-CB 3.36Å; T472-R476 PolarHBondContact O-N 3.46Å; R473-R476 PolarHBondContact O-N 2.93Å; L474-R476 PolarHBondContact O-N 3.37Å; R476-G480 PolarHBondContact O-N 3.39Å; R476-G480 VanDerWaalsContact O-N 3.1Å; R476-M487 HydrophobicContact CG-CE 4.31Å; R476-M487 HydrophobicContact CG-SD 4.17Å; R476-L492 HydrophobicContact CG-CD1 4.23Å; R476-L492 HydrophobicContact CG-CD2 3.74Å
477	H	93.9	Very high	88.6	Confident	28 Å²	28	41.8 Å²	41.8	13%	0.13	20%	0.199	C	C	.	.	H	α-helix	trans	-71.6	-36.6	178.8	-83.2	-75	0	0	0	112.6	L426 R473 L474 I475 I479 G480 N481	L426-H477 HydrophobicContact CD1-CB 3.59Å; L426-H477 HydrophobicContact CD2-CB 4.5Å; L426-H477 VanDerWaalsContact CD2-CD2 3.45Å; L426-H477 WeakPolarHBondContact CD2-CD2 3.48Å; R473-H477 PolarHBondContact O-CD2 2.82Å; R473-H477 VanDerWaalsContact O-CD2 3.28Å; R473-H477 PolarHBondContact O-N 3.08Å; L474-H477 PolarHBondContact O-N 2.72Å; I475-H477 VanDerWaalsContact C-N 3.34Å; I475-H477 PolarHBondContact O-N 2.8Å; H477-I479 PolarHBondContact O-N 2.89Å; H477-G480 PolarHBondContact O-N 2.69Å; H477-N481 PolarHBondContact ND1-OD1 3.03Å; H477-N481 WeakPolarHBondContact O-CB 3.46Å; H477-N481 PolarHBondContact O-N 3.21Å; H477-N481 PolarHBondContact O-ND2 3.34Å; H477-N481 PolarHBondContact O-OD1 3.39Å
478	A	94.6	Very high	88.9	Confident	3 Å²	3	45.2 Å²	45.2	3%	0.025	22%	0.215	C	C	.	.	H	α-helix	trans	-57.6	-48.3	178.3	0	0	0	0	0	112.3	L414 M417 L418 L474 I475 I510	L414-A478 HydrophobicContact CD1-CB 4.01Å; M417-A478 HydrophobicContact CB-CB 3.84Å; M417-A478 HydrophobicContact CG-CB 4.41Å; L418-A478 HydrophobicContact CD1-CB 4.05Å; L418-A478 HydrophobicContact CG-CB 4.17Å; L474-A478 WeakPolarHBondContact O-CB 3.2Å; L474-A478 PolarHBondContact O-N 3.09Å; I475-A478 PolarHBondContact O-N 2.96Å; A478-I510 HydrophobicContact CB-CD1 4.29Å
479	I	93.3	Very high	88.8	Confident	6 Å²	6	41.3 Å²	41.3	3%	0.031	21%	0.207	C	C	.	.	H	α-helix	trans	-83.5	-26.8	-178.7	68	-175.1	0	0	0	113.5	L86 L114 I475 H477 R491 L492 M495 L496 I510	L86-I479 HydrophobicContact CD2-CD1 4.27Å; L114-I479 HydrophobicContact CD2-CD1 3.68Å; L114-I479 HydrophobicContact CD2-CG2 4.1Å; I475-I479 PolarHBondContact O-N 3.21Å; H477-I479 PolarHBondContact O-N 2.89Å; I479-R491 PolarHBondContact O-NE 2.82Å; I479-R491 VanDerWaalsContact O-NE 3.12Å; I479-L492 HydrophobicContact CD1-CD1 3.53Å; I479-L492 HydrophobicContact CG1-CD1 3.5Å; I479-M495 HydrophobicContact CB-CB 4.39Å; I479-L496 HydrophobicContact CD1-CD1 4.37Å; I479-L496 HydrophobicContact CD1-CD2 3.7Å; I479-L496 HydrophobicContact CD1-CG 3.91Å; I479-I510 HydrophobicContact CG2-CD1 3.7Å
480	G	89.5	Confident	88.4	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-107.1	-5.9	-168.9	0	0	0	0	0	116.9	R476 H477 E488	R476-G480 PolarHBondContact O-N 3.39Å; R476-G480 VanDerWaalsContact O-N 3.1Å; H477-G480 PolarHBondContact O-N 2.69Å; G480-E488 PolarHBondContact O-N 3.49Å
481	N	87.9	Confident	88	Confident	14 Å²	14	51.9 Å²	51.9	8%	0.075	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-71.1	143.9	173.9	-78.4	-8.8	0	0	0	111.7	H477 E486 R491	H477-N481 PolarHBondContact ND1-OD1 3.03Å; H477-N481 WeakPolarHBondContact O-CB 3.46Å; H477-N481 PolarHBondContact O-N 3.21Å; H477-N481 PolarHBondContact O-ND2 3.34Å; H477-N481 PolarHBondContact O-OD1 3.39Å; N481-E486 CarbonylContact C-O 3.51Å; N481-E486 WeakPolarHBondContact CA-O 3.11Å; N481-R491 WeakPolarHBondContact O-CD 3.4Å; N481-R491 PolarHBondContact O-NE 3.23Å; N481-R491 VanDerWaalsContact O-NE 3.14Å; N481-R491 PolarHBondContact O-NH1 2.91Å; N481-R491 VanDerWaalsContact O-NH1 3.09Å
482	N	82.3	Confident	87.7	Confident	40 Å²	40	52 Å²	52	21%	0.214	25%	0.254	C	S	.	.			trans	-82.6	179.3	167.9	70.6	16	0	0	0	111.9	Y484 G485 E486	N482-Y484 PolarHBondContact O-N 3.16Å; N482-Y484 WeakPolarHBondContact OD1-CA 3.38Å; N482-Y484 WeakPolarHBondContact OD1-CB 3.4Å; N482-Y484 PolarHBondContact OD1-N 2.99Å; N482-G485 PolarHBondContact O-N 3.36Å; N482-G485 PolarHBondContact OD1-N 3.01Å; N482-E486 PolarHBondContact N-O 3.26Å; N482-E486 PolarHBondContact OD1-N 3.12Å; N482-E486 PolarHBondContact OD1-O 3.12Å
483	E	76.3	Confident	87.4	Confident	179 Å²	179	52.5 Å²	52.5	84%	0.836	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-14.9	179	-62.4	-179.6	173.7	0	0	114.4
484	Y	74.3	Confident	87.2	Confident	190 Å²	190	53.6 Å²	53.6	75%	0.745	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	2.4	178.8	-54.6	-81.9	0	0	0	113	N482 E486	N482-Y484 PolarHBondContact O-N 3.16Å; N482-Y484 WeakPolarHBondContact OD1-CA 3.38Å; N482-Y484 WeakPolarHBondContact OD1-CB 3.4Å; N482-Y484 PolarHBondContact OD1-N 2.99Å; Y484-E486 VanDerWaalsContact C-N 3.32Å
485	G	72.1	Confident	86.9	Confident	34 Å²	34	55.1 Å²	55.1	35%	0.351	28%	0.282	S	S	.	.	S	Bend	trans	77.1	13.6	-178	0	0	0	0	0	114.7	N482	N482-G485 PolarHBondContact O-N 3.36Å; N482-G485 PolarHBondContact OD1-N 3.01Å
486	E	79.1	Confident	86.7	Confident	134 Å²	134	56 Å²	56	63%	0.626	29%	0.286	S	S	*	.			trans	-92	145.2	175	-59.3	-175.2	150	0	0	111.1	N481 N482 Y484 E488	N481-E486 CarbonylContact C-O 3.51Å; N481-E486 WeakPolarHBondContact CA-O 3.11Å; N482-E486 PolarHBondContact N-O 3.26Å; N482-E486 PolarHBondContact OD1-N 3.12Å; N482-E486 PolarHBondContact OD1-O 3.12Å; Y484-E486 VanDerWaalsContact C-N 3.32Å; E486-E488 PolarHBondContact O-N 3.32Å
487	M	83.5	Confident	86.5	Confident	55 Å²	55	58.3 Å²	58.3	27%	0.271	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	-75.8	116.3	-175.1	-176.3	68.7	-124.3	0	0	111.8	R476 L492	R476-M487 HydrophobicContact CG-CE 4.31Å; R476-M487 HydrophobicContact CG-SD 4.17Å; M487-L492 HydrophobicContact CE-CB 3.69Å; M487-L492 HydrophobicContact CE-CD2 3.72Å; M487-L492 HydrophobicContact CE-CG 4.17Å
488	E	86.9	Confident	86.3	Confident	83 Å²	83	58.8 Å²	58.8	39%	0.388	30%	0.304	S	S	.	.			trans	-108.9	105.7	-179.8	-174.8	171.5	-150.9	0	0	110.9	G480 E486 E490 R491 L492	G480-E488 PolarHBondContact O-N 3.49Å; E486-E488 PolarHBondContact O-N 3.32Å; E488-E490 VanDerWaalsContact C-N 3.3Å; E488-E490 PolarHBondContact O-N 3.16Å; E488-R491 HydrophobicContact CB-CB 3.98Å; E488-R491 HydrophobicContact CG-CB 3.89Å; E488-R491 PolarHBondContact O-N 3.35Å; E488-L492 PolarHBondContact O-N 2.96Å
489	A	84	Confident	86.1	Confident	61 Å²	61	62.3 Å²	62.3	50%	0.504	33%	0.327	S	S	.	.	H	α-helix	trans	-63.1	-33.7	-175.9	0	0	0	0	0	113.3	L492 A493	A489-L492 PolarHBondContact O-N 2.85Å; A489-A493 WeakPolarHBondContact O-CB 3.48Å; A489-A493 PolarHBondContact O-N 3.02Å
490	E	85.9	Confident	85.8	Confident	143 Å²	143	68.2 Å²	68.2	67%	0.668	35%	0.354	S	S	*	.	H	α-helix	trans	-67.4	-41	177.4	-63.8	-175.2	-165	0	0	111.6	E488 A493 A494	E488-E490 VanDerWaalsContact C-N 3.3Å; E488-E490 PolarHBondContact O-N 3.16Å; E490-A493 PolarHBondContact O-N 2.89Å; E490-A494 WeakPolarHBondContact O-CB 3.5Å; E490-A494 PolarHBondContact O-N 2.92Å
491	R	88.9	Confident	85.6	Confident	80 Å²	80	75.9 Å²	75.9	30%	0.302	40%	0.395	S	S	.	.	H	α-helix	trans	-64.3	-45.6	173.5	177.9	179	170.6	148.3	-5.5	111.4	I479 N481 E488 A493 A494 M495	I479-R491 PolarHBondContact O-NE 2.82Å; I479-R491 VanDerWaalsContact O-NE 3.12Å; N481-R491 WeakPolarHBondContact O-CD 3.4Å; N481-R491 PolarHBondContact O-NE 3.23Å; N481-R491 VanDerWaalsContact O-NE 3.14Å; N481-R491 PolarHBondContact O-NH1 2.91Å; N481-R491 VanDerWaalsContact O-NH1 3.09Å; E488-R491 HydrophobicContact CB-CB 3.98Å; E488-R491 HydrophobicContact CG-CB 3.89Å; E488-R491 PolarHBondContact O-N 3.35Å; R491-A493 VanDerWaalsContact C-N 3.35Å; R491-A493 PolarHBondContact O-N 3.24Å; R491-A494 PolarHBondContact O-N 3.27Å; R491-M495 HydrophobicContact CG-CG 4.37Å; R491-M495 WeakPolarHBondContact O-CG 3.28Å; R491-M495 PolarHBondContact O-N 3.28Å
492	L	90.6	Very high	85.7	Confident	4 Å²	4	78.4 Å²	78.4	2%	0.021	41%	0.409	C	S	.	.	H	α-helix	trans	-56.3	-48.9	176.2	177.2	62.1	0	0	0	111.6	I82 L86 R476 I479 M487 E488 A489 M495 L496	I82-L492 HydrophobicContact CG2-CD2 3.71Å; I82-L492 HydrophobicContact CG2-CG 4.05Å; L86-L492 HydrophobicContact CD1-CD1 4.35Å; R476-L492 HydrophobicContact CG-CD1 4.23Å; R476-L492 HydrophobicContact CG-CD2 3.74Å; I479-L492 HydrophobicContact CD1-CD1 3.53Å; I479-L492 HydrophobicContact CG1-CD1 3.5Å; M487-L492 HydrophobicContact CE-CB 3.69Å; M487-L492 HydrophobicContact CE-CD2 3.72Å; M487-L492 HydrophobicContact CE-CG 4.17Å; E488-L492 PolarHBondContact O-N 2.96Å; A489-L492 PolarHBondContact O-N 2.85Å; L492-M495 PolarHBondContact O-N 3.32Å; L492-L496 HydrophobicContact CD1-CD1 3.84Å; L492-L496 HydrophobicContact CD1-CG 4.38Å; L492-L496 HydrophobicContact CG-CD1 4.16Å; L492-L496 WeakPolarHBondContact O-CG 3.45Å; L492-L496 PolarHBondContact O-N 2.9Å; L492-L496 VanDerWaalsContact O-N 3.16Å
493	A	90.3	Very high	86.1	Confident	9 Å²	9	76.6 Å²	76.6	7%	0.074	40%	0.399	C	S	.	.	H	α-helix	trans	-60.5	-48.3	176.4	0	0	0	0	0	111.3	I82 A489 E490 R491 M495 L496 T497	I82-A493 HydrophobicContact CD1-CB 3.75Å; A489-A493 WeakPolarHBondContact O-CB 3.48Å; A489-A493 PolarHBondContact O-N 3.02Å; E490-A493 PolarHBondContact O-N 2.89Å; R491-A493 VanDerWaalsContact C-N 3.35Å; R491-A493 PolarHBondContact O-N 3.24Å; A493-M495 PolarHBondContact O-N 3.15Å; A493-L496 PolarHBondContact O-N 3.19Å; A493-T497 PolarHBondContact O-N 3.24Å; A493-T497 PolarHBondContact O-OG1 3.5Å; A493-T497 VanDerWaalsContact O-OG1 3.09Å
494	A	90.3	Very high	86.8	Confident	57 Å²	57	72.9 Å²	72.9	47%	0.471	38%	0.377	S	S	.	.	H	α-helix	trans	-59.3	-43.4	-179.8	0	0	0	0	0	112.8	E490 R491 T497 L498	E490-A494 WeakPolarHBondContact O-CB 3.5Å; E490-A494 PolarHBondContact O-N 2.92Å; R491-A494 PolarHBondContact O-N 3.27Å; A494-T497 PolarHBondContact O-N 3.19Å; A494-L498 WeakPolarHBondContact O-CG 3.48Å; A494-L498 PolarHBondContact O-N 2.81Å
495	M	90.6	Very high	87.5	Confident	32 Å²	32	70.7 Å²	70.7	16%	0.158	38%	0.375	C	S	.	.	H	α-helix	trans	-65.8	-37.8	178.3	-71	-61.9	-171.9	0	0	112.7	I479 R491 L492 A493 L498 Y506 R507	I479-M495 HydrophobicContact CB-CB 4.39Å; R491-M495 HydrophobicContact CG-CG 4.37Å; R491-M495 WeakPolarHBondContact O-CG 3.28Å; R491-M495 PolarHBondContact O-N 3.28Å; L492-M495 PolarHBondContact O-N 3.32Å; A493-M495 PolarHBondContact O-N 3.15Å; M495-L498 WeakPolarHBondContact O-CG 3.31Å; M495-L498 HydrophobicContact SD-CD1 4Å; M495-Y506 HydrophobicContact CE-CD1 4.41Å; M495-Y506 HydrophobicContact SD-CG 4.48Å; M495-R507 PolarHBondContact O-NH1 2.65Å
496	L	91.1	Very high	88.4	Confident	20 Å²	20	75.4 Å²	75.4	11%	0.105	38%	0.384	C	S	.	.	H	α-helix	trans	-78	-25.2	179.1	-68.5	173.1	0	0	0	113.2	L77 I82 L86 L114 I479 L492 A493 L498	L77-L496 HydrophobicContact CD1-CB 3.79Å; I82-L496 HydrophobicContact CB-CD1 4.36Å; I82-L496 HydrophobicContact CG1-CD1 4.27Å; I82-L496 HydrophobicContact CG2-CD1 3.78Å; L86-L496 HydrophobicContact CD1-CD1 4.3Å; L86-L496 HydrophobicContact CD2-CD1 4.29Å; L86-L496 HydrophobicContact CD2-CD2 4.27Å; L86-L496 HydrophobicContact CG-CD1 4.06Å; L114-L496 HydrophobicContact CD1-CD2 3.97Å; L114-L496 HydrophobicContact CD2-CD2 4.13Å; I479-L496 HydrophobicContact CD1-CD1 4.37Å; I479-L496 HydrophobicContact CD1-CD2 3.7Å; I479-L496 HydrophobicContact CD1-CG 3.91Å; L492-L496 HydrophobicContact CD1-CD1 3.84Å; L492-L496 HydrophobicContact CD1-CG 4.38Å; L492-L496 HydrophobicContact CG-CD1 4.16Å; L492-L496 WeakPolarHBondContact O-CG 3.45Å; L492-L496 PolarHBondContact O-N 2.9Å; L492-L496 VanDerWaalsContact O-N 3.16Å; A493-L496 PolarHBondContact O-N 3.19Å; L496-L498 VanDerWaalsContact C-N 3.31Å
497	T	91.4	Very high	89	Confident	53 Å²	53	70.1 Å²	70.1	33%	0.325	36%	0.358	S	S	.	.	H	α-helix	trans	-76.6	-12.7	173.4	-60.6	0	0	0	0	113.3	L75 L77 A493 A494	L75-T497 HydrophobicContact CB-CG2 4.35Å; L75-T497 WeakPolarHBondContact O-CG2 3.34Å; L75-T497 PolarHBondContact O-OG1 3.28Å; L77-T497 WeakPolarHBondContact CD1-OG1 3.44Å; L77-T497 WeakPolarHBondContact CG-OG1 3.32Å; A493-T497 PolarHBondContact O-N 3.24Å; A493-T497 PolarHBondContact O-OG1 3.5Å; A493-T497 VanDerWaalsContact O-OG1 3.09Å; A494-T497 PolarHBondContact O-N 3.19Å
498	L	89.9	Confident	89.6	Confident	37 Å²	37	68.5 Å²	68.5	19%	0.194	35%	0.35	C	S	.	.	S	Bend	trans	-58.3	131.2	-179.1	-65.7	177.3	0	0	0	111.5	A494 M495 L496 L502 A503 Y506	A494-L498 WeakPolarHBondContact O-CG 3.48Å; A494-L498 PolarHBondContact O-N 2.81Å; M495-L498 WeakPolarHBondContact O-CG 3.31Å; M495-L498 HydrophobicContact SD-CD1 4Å; L496-L498 VanDerWaalsContact C-N 3.31Å; L498-L502 HydrophobicContact CD2-CD2 4.02Å; L498-L502 HydrophobicContact CD2-CG 4.4Å; L498-A503 HydrophobicContact CB-CB 4.43Å; L498-Y506 HydrophobicContact CD1-CD2 3.62Å; L498-Y506 HydrophobicContact CD1-CE2 4.46Å; L498-Y506 HydrophobicContact CD1-CG 3.8Å; L498-Y506 HydrophobicContact CD2-CD2 4.39Å; L498-Y506 HydrophobicContact CD2-CE2 4.47Å
499	P	90.1	Very high	90.1	Very high	78 Å²	78	64.5 Å²	64.5	51%	0.506	33%	0.332	S	S	.	.			trans	-66.7	156.3	174.6	30.2	-35.8	0	0	0	110.7	D501 L502 A503	P499-D501 VanDerWaalsContact C-N 3.32Å; P499-D501 PolarHBondContact O-N 3.39Å; P499-L502 HydrophobicContact CG-CB 3.87Å; P499-L502 CarbonylContact O-C 3.59Å; P499-L502 WeakPolarHBondContact O-CA 3.49Å; P499-L502 PolarHBondContact O-N 2.84Å; P499-A503 PolarHBondContact O-N 3.19Å
500	E	86.3	Confident	90.8	Very high	130 Å²	130	61.6 Å²	61.6	61%	0.607	31%	0.308	S	S	*	.	H	α-helix	trans	-50	-48.4	-175.8	-64.8	171.3	-152.6	0	0	112.4	S118 L502 A503	S118-E500 WeakPolarHBondContact CB-OE2 3.44Å; S118-E500 PolarHBondContact OG-OE2 2.78Å; E500-L502 PolarHBondContact O-N 3.03Å; E500-A503 PolarHBondContact O-N 2.61Å
501	D	85.2	Confident	91.4	Very high	161 Å²	161	54.8 Å²	54.8	86%	0.861	28%	0.276	S	S	*	.	H	α-helix	trans	-58.8	-19.7	178	-62.4	-28	0	0	0	114.8	P499	P499-D501 VanDerWaalsContact C-N 3.32Å; P499-D501 PolarHBondContact O-N 3.39Å
502	L	89.8	Confident	91.8	Very high	67 Å²	67	51 Å²	51	35%	0.351	26%	0.262	S	S	.	.	H	α-helix	trans	-112	-23.6	-175.6	-168.4	61.5	0	0	0	112.6	L498 P499 E500 R504 M505 Y506	L498-L502 HydrophobicContact CD2-CD2 4.02Å; L498-L502 HydrophobicContact CD2-CG 4.4Å; P499-L502 HydrophobicContact CG-CB 3.87Å; P499-L502 CarbonylContact O-C 3.59Å; P499-L502 WeakPolarHBondContact O-CA 3.49Å; P499-L502 PolarHBondContact O-N 2.84Å; E500-L502 PolarHBondContact O-N 3.03Å; L502-R504 VanDerWaalsContact C-N 3.31Å; L502-R504 PolarHBondContact O-N 3.02Å; L502-M505 HydrophobicContact CD1-CB 4.24Å; L502-M505 HydrophobicContact CD1-CG 4.2Å; L502-M505 WeakPolarHBondContact O-CB 3.34Å; L502-M505 PolarHBondContact O-N 3Å; L502-Y506 HydrophobicContact CD1-CD2 4.48Å; L502-Y506 HydrophobicContact CD1-CE2 3.88Å; L502-Y506 HydrophobicContact CD2-CE2 4.23Å; L502-Y506 HydrophobicContact CG-CD2 4.17Å; L502-Y506 HydrophobicContact CG-CE2 3.8Å; L502-Y506 WeakPolarHBondContact O-CD2 3.35Å
503	A	91	Very high	92.2	Very high	2 Å²	2	50.9 Å²	50.9	2%	0.017	26%	0.261	C	S	.	.	H	α-helix	trans	-54.4	-46	-178.5	0	0	0	0	0	112.2	A116 L498 P499 E500 M505 Y506 R507	A116-A503 HydrophobicContact CB-CB 4.42Å; L498-A503 HydrophobicContact CB-CB 4.43Å; P499-A503 PolarHBondContact O-N 3.19Å; E500-A503 PolarHBondContact O-N 2.61Å; A503-M505 PolarHBondContact O-N 3.43Å; A503-M505 VanDerWaalsContact O-N 3.12Å; A503-Y506 PolarHBondContact O-N 3.25Å; A503-R507 WeakPolarHBondContact O-CG 3.27Å; A503-R507 PolarHBondContact O-N 2.79Å; A503-R507 VanDerWaalsContact O-N 3.08Å
504	R	91.6	Very high	92.6	Very high	101 Å²	101	50.4 Å²	50.4	38%	0.381	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-17.1	177.5	-168.9	56	167.6	124.7	-21.2	114.9	N117 L502 R507 D508	N117-R504 PolarHBondContact ND2-NE 3.4Å; N117-R504 WeakPolarHBondContact OD1-CD 3.42Å; N117-R504 VanDerWaalsContact OD1-CG 3.32Å; N117-R504 WeakPolarHBondContact OD1-CG 3.5Å; N117-R504 PolarHBondContact OD1-NE 2.95Å; N117-R504 VanDerWaalsContact OD1-NE 3.15Å; L502-R504 VanDerWaalsContact C-N 3.31Å; L502-R504 PolarHBondContact O-N 3.02Å; R504-R507 WeakPolarHBondContact CA-O 3.48Å; R504-D508 IonicContact CZ-OD1 3.09Å; R504-D508 IonicContact CZ-OD2 3.55Å; R504-D508 IonicContact NE-OD1 2.67Å; R504-D508 IonicContact NH1-OD1 3.49Å; R504-D508 PolarHBondContact NH1-OD1 3.28Å; R504-D508 IonicContact NH1-OD2 2.95Å; R504-D508 PolarHBondContact NH1-OD2 2.93Å; R504-D508 IonicContact NH2-OD1 2.7Å; R504-D508 PolarHBondContact NH2-OD1 3.44Å; R504-D508 IonicContact NH2-OD2 2.88Å; R504-D508 PolarHBondContact NH2-OD2 3.28Å
505	M	89.6	Confident	93	Very high	143 Å²	143	47.7 Å²	47.7	70%	0.704	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-12.1	174.7	-64.3	-62.3	-49.8	0	0	113.7	L502 A503	L502-M505 HydrophobicContact CD1-CB 4.24Å; L502-M505 HydrophobicContact CD1-CG 4.2Å; L502-M505 WeakPolarHBondContact O-CB 3.34Å; L502-M505 PolarHBondContact O-N 3Å; A503-M505 PolarHBondContact O-N 3.43Å; A503-M505 VanDerWaalsContact O-N 3.12Å
506	Y	90.4	Very high	93.3	Very high	133 Å²	133	46.5 Å²	46.5	52%	0.522	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.9	-19.6	-174.4	-70.9	-86.6	0	0	0	114.3	M495 L498 L502 A503	M495-Y506 HydrophobicContact CE-CD1 4.41Å; M495-Y506 HydrophobicContact SD-CG 4.48Å; L498-Y506 HydrophobicContact CD1-CD2 3.62Å; L498-Y506 HydrophobicContact CD1-CE2 4.46Å; L498-Y506 HydrophobicContact CD1-CG 3.8Å; L498-Y506 HydrophobicContact CD2-CD2 4.39Å; L498-Y506 HydrophobicContact CD2-CE2 4.47Å; L502-Y506 HydrophobicContact CD1-CD2 4.48Å; L502-Y506 HydrophobicContact CD1-CE2 3.88Å; L502-Y506 HydrophobicContact CD2-CE2 4.23Å; L502-Y506 HydrophobicContact CG-CD2 4.17Å; L502-Y506 HydrophobicContact CG-CE2 3.8Å; L502-Y506 WeakPolarHBondContact O-CD2 3.35Å; A503-Y506 PolarHBondContact O-N 3.25Å
507	R	92.4	Very high	93.6	Very high	23 Å²	23	46 Å²	46	9%	0.087	23%	0.226	C	C	.	.			trans	-149.7	162.4	174.8	57.2	160.9	-171.8	-77.2	6.3	110.3	A115 A116 M495 A503 R504	A115-R507 PolarHBondContact O-NE 2.91Å; A115-R507 VanDerWaalsContact O-NE 3.12Å; A115-R507 PolarHBondContact O-NH2 2.84Å; A116-R507 HydrophobicContact CB-CG 3.84Å; A116-R507 WeakPolarHBondContact CB-O 3.47Å; M495-R507 PolarHBondContact O-NH1 2.65Å; A503-R507 WeakPolarHBondContact O-CG 3.27Å; A503-R507 PolarHBondContact O-N 2.79Å; A503-R507 VanDerWaalsContact O-N 3.08Å; R504-R507 WeakPolarHBondContact CA-O 3.48Å
508	D	95.4	Very high	93.7	Very high	21 Å²	21	45.3 Å²	45.3	11%	0.112	22%	0.22	C	C	.	.			trans	-88.5	175.3	160.9	-138.2	-36.7	0	0	0	111.4	A116 R504 I510	A116-D508 WeakPolarHBondContact CB-O 3.49Å; R504-D508 IonicContact CZ-OD1 3.09Å; R504-D508 IonicContact CZ-OD2 3.55Å; R504-D508 IonicContact NE-OD1 2.67Å; R504-D508 IonicContact NH1-OD1 3.49Å; R504-D508 PolarHBondContact NH1-OD1 3.28Å; R504-D508 IonicContact NH1-OD2 2.95Å; R504-D508 PolarHBondContact NH1-OD2 2.93Å; R504-D508 IonicContact NH2-OD1 2.7Å; R504-D508 PolarHBondContact NH2-OD1 3.44Å; R504-D508 IonicContact NH2-OD2 2.88Å; R504-D508 PolarHBondContact NH2-OD2 3.28Å; D508-I510 WeakPolarHBondContact O-CG1 3.03Å
509	D	97.3	Very high	93.8	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.221	C	C	.	.			trans	-57.2	139	157.3	-69	-27.4	0	0	0	108.9	A115 A116 N117 V120 E121 D122	A115-D509 WeakPolarHBondContact CA-OD1 3.44Å; A116-D509 PolarHBondContact N-OD1 2.93Å; N117-D509 PolarHBondContact N-OD1 3.25Å; N117-D509 PolarHBondContact ND2-OD1 2.76Å; N117-D509 PolarHBondContact ND2-OD2 2.67Å; V120-D509 HydrophobicContact CG2-CB 4.17Å; V120-D509 WeakPolarHBondContact CG2-OD2 3.4Å; E121-D509 PolarHBondContact N-OD2 3.39Å; D122-D509 HydrophobicContact CB-CB 3.48Å; D122-D509 VanDerWaalsContact CB-CB 3.48Å; D122-D509 PolarHBondContact N-OD2 3.33Å
510	I	98	Very high	93.8	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	111.7	-178.2	-47.3	-177.5	0	0	0	109	Q113 L114 G413 L414 I475 A478 I479 D508 V512	Q113-I510 CarbonylContact C-O 3.54Å; Q113-I510 VanDerWaalsContact CA-O 3.27Å; Q113-I510 WeakPolarHBondContact CA-O 3.36Å; L114-I510 PolarHBondContact N-O 3.46Å; L114-I510 PolarHBondContact O-N 3.1Å; G413-I510 WeakPolarHBondContact O-CD1 3.3Å; L414-I510 HydrophobicContact CB-CG2 4.01Å; L414-I510 HydrophobicContact CD1-CG2 4.18Å; I475-I510 HydrophobicContact CG1-CB 4.48Å; I475-I510 HydrophobicContact CG1-CG2 3.92Å; A478-I510 HydrophobicContact CB-CD1 4.29Å; I479-I510 HydrophobicContact CG2-CD1 3.7Å; D508-I510 WeakPolarHBondContact O-CG1 3.03Å; I510-V512 HydrophobicContact CG2-CG2 4.04Å
511	T	98.4	Very high	93.9	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.5	177.6	-53.9	0	0	0	0	110.1	Q113 D122 R124 I139 A410 S411	Q113-T511 HydrophobicContact CB-CG2 4.27Å; Q113-T511 HydrophobicContact CG-CG2 4.48Å; Q113-T511 WeakPolarHBondContact CG-OG1 3.48Å; Q113-T511 PolarHBondContact NE2-OG1 3.38Å; D122-T511 WeakPolarHBondContact OD2-CB 3.37Å; D122-T511 PolarHBondContact OD2-N 3.34Å; D122-T511 VanDerWaalsContact OD2-N 3.08Å; D122-T511 PolarHBondContact OD2-OG1 2.85Å; R124-T511 HydrophobicContact CB-CG2 3.8Å; R124-T511 HydrophobicContact CG-CG2 4.24Å; I139-T511 HydrophobicContact CD1-CG2 3.88Å; A410-T511 WeakPolarHBondContact CA-O 3.34Å; A410-T511 VanDerWaalsContact CB-O 3.29Å; A410-T511 WeakPolarHBondContact CB-O 3.44Å; S411-T511 PolarHBondContact N-O 3.01Å; S411-T511 PolarHBondContact OG-N 2.83Å; S411-T511 PolarHBondContact OG-O 3.12Å
512	V	98.6	Very high	94.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	136.3	-172.2	-173.1	0	0	0	0	110	S111 N112 V408 A410 L414 A471 L474 I475 I510 V514	S111-V512 CarbonylContact C-O 3.53Å; S111-V512 WeakPolarHBondContact CA-O 3.23Å; S111-V512 VanDerWaalsContact CB-O 3.23Å; S111-V512 WeakPolarHBondContact CB-O 3.13Å; N112-V512 PolarHBondContact N-O 3.18Å; N112-V512 PolarHBondContact O-N 3.35Å; V408-V512 HydrophobicContact CG1-CG1 4.08Å; A410-V512 HydrophobicContact CB-CB 4.37Å; A410-V512 HydrophobicContact CB-CG1 4.35Å; A410-V512 HydrophobicContact CB-CG2 4.03Å; L414-V512 HydrophobicContact CB-CG2 4.41Å; L414-V512 HydrophobicContact CD1-CG2 4.01Å; L414-V512 HydrophobicContact CD2-CG1 4.28Å; L414-V512 HydrophobicContact CD2-CG2 3.95Å; L414-V512 HydrophobicContact CG-CG2 4.34Å; A471-V512 HydrophobicContact CB-CB 4Å; A471-V512 HydrophobicContact CB-CG1 4.05Å; L474-V512 HydrophobicContact CD1-CG1 3.8Å; I475-V512 HydrophobicContact CD1-CG2 4.46Å; I475-V512 HydrophobicContact CG1-CG2 4Å; I510-V512 HydrophobicContact CG2-CG2 4.04Å; V512-V514 HydrophobicContact CG1-CG2 4.23Å
513	T	98.6	Very high	94.2	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.006	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	122.2	167.9	-63.1	0	0	0	0	110.4	F109 E110 S111 F137 V408 L409 V515	F109-T513 HydrophobicContact CD2-CG2 4.35Å; E110-T513 CarbonylContact O-C 3.53Å; E110-T513 WeakPolarHBondContact O-CA 3.45Å; S111-T513 VanDerWaalsContact CB-OG1 3.27Å; S111-T513 WeakPolarHBondContact CB-OG1 3.27Å; F137-T513 HydrophobicContact CD1-CG2 4.16Å; V408-T513 WeakPolarHBondContact CA-O 3.23Å; L409-T513 PolarHBondContact N-O 3.39Å; L409-T513 PolarHBondContact O-N 3.2Å; T513-V515 HydrophobicContact CG2-CG2 4.02Å
514	V	98.6	Very high	94	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	112.8	175.1	-173.6	0	0	0	0	108.7	F109 E110 F406 L407 V408 V427 A470 L474 V512 Y516	F109-V514 CarbonylContact C-O 3.6Å; F109-V514 VanDerWaalsContact CA-O 3.23Å; F109-V514 WeakPolarHBondContact CA-O 3.19Å; E110-V514 PolarHBondContact N-O 2.94Å; E110-V514 PolarHBondContact O-N 3.34Å; F406-V514 HydrophobicContact CB-CG1 4.39Å; L407-V514 CarbonylContact O-C 3.45Å; L407-V514 WeakPolarHBondContact O-CA 3.48Å; V408-V514 HydrophobicContact CG1-CG2 4.39Å; V408-V514 HydrophobicContact CG2-CG1 4.38Å; V408-V514 HydrophobicContact CG2-CG2 4.26Å; V427-V514 HydrophobicContact CG1-CG1 4.05Å; V427-V514 HydrophobicContact CG2-CG1 4.5Å; V427-V514 HydrophobicContact CG2-CG2 4.46Å; A470-V514 HydrophobicContact CB-CG2 4.2Å; L474-V514 HydrophobicContact CD1-CG2 3.96Å; V512-V514 HydrophobicContact CG1-CG2 4.23Å; V514-Y516 HydrophobicContact CB-CE2 4.21Å; V514-Y516 HydrophobicContact CG1-CD2 4.33Å; V514-Y516 HydrophobicContact CG1-CE1 4.01Å; V514-Y516 HydrophobicContact CG1-CE2 3.73Å
515	V	98.4	Very high	93.7	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	126.5	178.4	-173.8	0	0	0	0	108.7	V106 F109 F137 F406 L407 L409 T513 F517	V106-V515 HydrophobicContact CB-CG1 4.49Å; V106-V515 HydrophobicContact CG1-CG1 3.6Å; V106-V515 HydrophobicContact CG2-CG1 4.09Å; F109-V515 HydrophobicContact CB-CG2 4.22Å; F137-V515 HydrophobicContact CB-CG2 4.47Å; F137-V515 HydrophobicContact CD1-CG2 3.54Å; F137-V515 HydrophobicContact CD2-CG2 4.02Å; F137-V515 HydrophobicContact CE1-CG1 4.2Å; F137-V515 HydrophobicContact CE1-CG2 3.67Å; F137-V515 HydrophobicContact CE2-CG1 3.96Å; F137-V515 HydrophobicContact CE2-CG2 4.14Å; F137-V515 HydrophobicContact CG-CG2 3.73Å; F137-V515 HydrophobicContact CZ-CG1 3.76Å; F137-V515 HydrophobicContact CZ-CG2 3.98Å; F406-V515 CarbonylContact C-O 3.57Å; F406-V515 WeakPolarHBondContact CA-O 3.35Å; F406-V515 VanDerWaalsContact CB-O 3.27Å; F406-V515 WeakPolarHBondContact CB-O 3.25Å; L407-V515 HydrophobicContact CB-CB 4.32Å; L407-V515 PolarHBondContact N-O 2.64Å; L407-V515 PolarHBondContact O-N 2.78Å; L409-V515 HydrophobicContact CD1-CG2 4.29Å; T513-V515 HydrophobicContact CG2-CG2 4.02Å; V515-F517 HydrophobicContact CG1-CE1 4.4Å
516	Y	97.4	Very high	93.5	Very high	7 Å²	7	33.6 Å²	33.6	3%	0.027	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	130.4	-178.8	-60.1	-92.6	0	0	0	110.9	L107 R108 E110 F406 V427 L431 A470 V514	L107-Y516 PolarHBondContact N-O 3.42Å; R108-Y516 HydrophobicContact CG-CD2 3.68Å; R108-Y516 HydrophobicContact CG-CG 4.05Å; R108-Y516 VanDerWaalsContact CZ-CE2 3.47Å; R108-Y516 VanDerWaalsContact NH2-CE2 3.33Å; R108-Y516 PolarHBondContact NH2-OH 2.89Å; R108-Y516 PolarHBondContact O-N 3.34Å; E110-Y516 HydrophobicContact CB-CE2 4.29Å; E110-Y516 HydrophobicContact CG-CE2 4.03Å; E110-Y516 VanDerWaalsContact OE2-CE2 3.27Å; E110-Y516 WeakPolarHBondContact OE2-CE2 3.35Å; E110-Y516 PolarHBondContact OE2-OH 3.19Å; F406-Y516 HydrophobicContact CB-CD1 4Å; F406-Y516 HydrophobicContact CB-CE1 4.45Å; V427-Y516 HydrophobicContact CG1-CE1 4.19Å; L431-Y516 HydrophobicContact CD1-CD1 4.39Å; L431-Y516 HydrophobicContact CD1-CE1 4.08Å; L431-Y516 HydrophobicContact CD2-CD1 3.94Å; L431-Y516 HydrophobicContact CD2-CE1 3.56Å; L431-Y516 HydrophobicContact CG-CE1 3.94Å; A470-Y516 WeakPolarHBondContact CB-OH 3.5Å; V514-Y516 HydrophobicContact CB-CE2 4.21Å; V514-Y516 HydrophobicContact CG1-CD2 4.33Å; V514-Y516 HydrophobicContact CG1-CE1 4.01Å; V514-Y516 HydrophobicContact CG1-CE2 3.73Å
517	F	96.5	Very high	93	Very high	10 Å²	10	36.1 Å²	36.1	4%	0.044	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	146.5	-177.7	-61.8	-63.1	0	0	0	112.7	S105 V106 V274 L279 L291 L400 K405 L407 V515 S519 I522	S105-F517 CarbonylContact O-C 3.55Å; S105-F517 WeakPolarHBondContact O-CA 3.4Å; V106-F517 HydrophobicContact CG2-CD1 4.34Å; V106-F517 HydrophobicContact CG2-CE1 4.27Å; V274-F517 HydrophobicContact CG1-CE1 4.36Å; V274-F517 HydrophobicContact CG2-CE1 4.43Å; L279-F517 HydrophobicContact CD2-CZ 4.46Å; L291-F517 HydrophobicContact CD1-CD2 4.44Å; L291-F517 HydrophobicContact CD1-CE2 3.63Å; L291-F517 HydrophobicContact CD1-CZ 4.43Å; L400-F517 HydrophobicContact CD1-CD1 3.92Å; L400-F517 HydrophobicContact CD1-CE1 3.79Å; L400-F517 HydrophobicContact CD1-CZ 4.35Å; L400-F517 HydrophobicContact CD2-CD1 4.33Å; L400-F517 HydrophobicContact CD2-CD2 4.11Å; L400-F517 HydrophobicContact CD2-CE1 4.09Å; L400-F517 HydrophobicContact CD2-CE2 3.86Å; L400-F517 HydrophobicContact CD2-CG 4.36Å; L400-F517 HydrophobicContact CD2-CZ 3.84Å; K405-F517 PolarHBondContact O-N 3.09Å; L407-F517 HydrophobicContact CB-CE2 3.71Å; L407-F517 HydrophobicContact CB-CZ 3.74Å; L407-F517 HydrophobicContact CD2-CZ 4.36Å; V515-F517 HydrophobicContact CG1-CE1 4.4Å; F517-S519 PolarHBondContact O-N 2.72Å; F517-I522 HydrophobicContact CB-CD1 3.87Å; F517-I522 HydrophobicContact CG-CD1 4.48Å
518	N	93.7	Very high	91.7	Very high	37 Å²	37	38.5 Å²	38.5	20%	0.198	21%	0.207	C	C	.	.			trans	-87	94.5	172.9	-170.3	-21.1	0	0	0	109.9	S105 L107 E520 S521 I522	S105-N518 PolarHBondContact O-N 3.4Å; L107-N518 HydrophobicContact CB-CB 4.26Å; N518-E520 PolarHBondContact O-N 3.31Å; N518-E520 WeakPolarHBondContact OD1-CB 3.27Å; N518-E520 PolarHBondContact OD1-N 2.85Å; N518-S521 WeakPolarHBondContact CB-OG 3.41Å; N518-S521 PolarHBondContact ND2-OG 3.42Å; N518-S521 PolarHBondContact O-N 3.38Å; N518-S521 PolarHBondContact OD1-N 3.29Å; N518-I522 WeakPolarHBondContact O-CG1 3.42Å; N518-I522 PolarHBondContact O-N 3.14Å; N518-I522 VanDerWaalsContact O-N 3.08Å
519	S	92.7	Very high	89.4	Confident	30 Å²	30	43.9 Å²	43.9	21%	0.21	27%	0.267	C	S	.	.	H	α-helix	trans	-59.6	-24.4	177.6	-51.7	0	0	0	0	113.5	P402 K405 F517 G523	P402-S519 PolarHBondContact O-OG 2.98Å; K405-S519 WeakPolarHBondContact CD-OG 3.36Å; K405-S519 PolarHBondContact NZ-OG 3.38Å; F517-S519 PolarHBondContact O-N 2.72Å; S519-G523 PolarHBondContact O-N 3.12Å
520	E	89.7	Confident	89	Confident	164 Å²	164	46.1 Å²	46.1	77%	0.766	28%	0.281	S	S	*	.	H	α-helix	trans	-74.1	-46.4	176	-59.3	-172	170.3	0	0	111.2	N518 I522 G523 A524	N518-E520 PolarHBondContact O-N 3.31Å; N518-E520 WeakPolarHBondContact OD1-CB 3.27Å; N518-E520 PolarHBondContact OD1-N 2.85Å; E520-I522 PolarHBondContact O-N 3.04Å; E520-G523 PolarHBondContact O-N 3.26Å; E520-A524 WeakPolarHBondContact O-CB 3.31Å; E520-A524 PolarHBondContact O-N 3.03Å
521	S	89.1	Confident	88.6	Confident	11 Å²	11	48.5 Å²	48.5	8%	0.077	30%	0.295	C	S	.	.	H	α-helix	trans	-56.7	-49.5	173.4	-54.9	0	0	0	0	111.5	P103 N104 N518 G523 A524 Y525	P103-S521 WeakPolarHBondContact CB-OG 3.34Å; N104-S521 WeakPolarHBondContact O-CB 3.5Å; N104-S521 PolarHBondContact O-OG 3.48Å; N518-S521 WeakPolarHBondContact CB-OG 3.41Å; N518-S521 PolarHBondContact ND2-OG 3.42Å; N518-S521 PolarHBondContact O-N 3.38Å; N518-S521 PolarHBondContact OD1-N 3.29Å; S521-G523 PolarHBondContact O-N 2.79Å; S521-A524 PolarHBondContact O-N 3.44Å; S521-Y525 PolarHBondContact O-N 3.38Å; S521-Y525 VanDerWaalsContact O-N 3.08Å
522	I	91.1	Very high	88	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-63.6	-44.3	180	-63.1	163.9	0	0	0	109.7	I277 L400 P402 F517 N518 E520 A524 Y525 Y526	I277-I522 HydrophobicContact CG2-CG1 4.47Å; I277-I522 HydrophobicContact CG2-CG2 4.2Å; L400-I522 HydrophobicContact CB-CD1 4.12Å; L400-I522 HydrophobicContact CB-CG2 4.49Å; L400-I522 HydrophobicContact CD1-CD1 4.4Å; P402-I522 HydrophobicContact CG-CG2 4.3Å; F517-I522 HydrophobicContact CB-CD1 3.87Å; F517-I522 HydrophobicContact CG-CD1 4.48Å; N518-I522 WeakPolarHBondContact O-CG1 3.42Å; N518-I522 PolarHBondContact O-N 3.14Å; N518-I522 VanDerWaalsContact O-N 3.08Å; E520-I522 PolarHBondContact O-N 3.04Å; I522-A524 VanDerWaalsContact C-N 3.33Å; I522-A524 PolarHBondContact O-N 3.1Å; I522-Y525 WeakPolarHBondContact O-CB 3.29Å; I522-Y525 PolarHBondContact O-N 3.16Å; I522-Y526 HydrophobicContact CG2-CD2 4.22Å; I522-Y526 HydrophobicContact CG2-CE2 3.82Å; I522-Y526 WeakPolarHBondContact O-CD2 3.46Å; I522-Y526 PolarHBondContact O-N 2.87Å
523	G	89.3	Confident	87.4	Confident	12 Å²	12	54.2 Å²	54.2	12%	0.124	33%	0.33	C	S	.	.	H	α-helix	trans	-65.3	-31.5	176.3	0	0	0	0	0	114.2	S519 E520 S521 K527	S519-G523 PolarHBondContact O-N 3.12Å; E520-G523 PolarHBondContact O-N 3.26Å; S521-G523 PolarHBondContact O-N 2.79Å; G523-K527 WeakPolarHBondContact O-CD 3.44Å; G523-K527 VanDerWaalsContact O-CG 3.32Å; G523-K527 WeakPolarHBondContact O-CG 3.36Å; G523-K527 PolarHBondContact O-N 3.26Å
524	A	86.9	Confident	86.7	Confident	50 Å²	50	57.5 Å²	57.5	41%	0.413	35%	0.35	S	S	.	.	H	α-helix	trans	-69.1	-40.4	175	0	0	0	0	0	111.5	E520 S521 I522 Y526 K527 G528	E520-A524 WeakPolarHBondContact O-CB 3.31Å; E520-A524 PolarHBondContact O-N 3.03Å; S521-A524 PolarHBondContact O-N 3.44Å; I522-A524 VanDerWaalsContact C-N 3.33Å; I522-A524 PolarHBondContact O-N 3.1Å; A524-Y526 VanDerWaalsContact C-N 3.34Å; A524-Y526 PolarHBondContact O-N 3.42Å; A524-K527 PolarHBondContact O-N 3.37Å; A524-G528 PolarHBondContact O-N 3.36Å
525	Y	85.1	Confident	85.9	Confident	112 Å²	112	61.3 Å²	61.3	44%	0.439	37%	0.374	S	S	.	.	H	α-helix	trans	-54.9	-48.2	174.3	-174.4	-76.7	0	0	0	111.6	I277 S521 I522 K527 G528	I277-Y525 HydrophobicContact CD1-CD1 3.63Å; I277-Y525 HydrophobicContact CD1-CE1 3.31Å; I277-Y525 HydrophobicContact CD1-CE2 4.47Å; I277-Y525 HydrophobicContact CD1-CG 4.37Å; I277-Y525 HydrophobicContact CG1-CD1 4.22Å; I277-Y525 HydrophobicContact CG1-CE1 3.97Å; I277-Y525 HydrophobicContact CG1-CE2 4.26Å; I277-Y525 HydrophobicContact CG1-CG 4.5Å; I277-Y525 HydrophobicContact CG2-CD1 4.14Å; I277-Y525 HydrophobicContact CG2-CD2 4.2Å; I277-Y525 HydrophobicContact CG2-CG 3.87Å; S521-Y525 PolarHBondContact O-N 3.38Å; S521-Y525 VanDerWaalsContact O-N 3.08Å; I522-Y525 WeakPolarHBondContact O-CB 3.29Å; I522-Y525 PolarHBondContact O-N 3.16Å; Y525-K527 PolarHBondContact O-N 3.17Å; Y525-G528 PolarHBondContact O-N 3.48Å
526	Y	85.6	Confident	85	Confident	94 Å²	94	65.7 Å²	65.7	37%	0.369	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-14.2	178.1	-70.3	-73.2	0	0	0	115	R399 L400 P402 I522 A524	R399-Y526 WeakPolarHBondContact CG-OH 3.48Å; R399-Y526 PolarHBondContact NE-OH 3.45Å; L400-Y526 VanDerWaalsContact O-CE2 3.29Å; L400-Y526 WeakPolarHBondContact O-CE2 3.26Å; L400-Y526 PolarHBondContact O-OH 2.88Å; P402-Y526 HydrophobicContact CG-CD2 4.5Å; I522-Y526 HydrophobicContact CG2-CD2 4.22Å; I522-Y526 HydrophobicContact CG2-CE2 3.82Å; I522-Y526 WeakPolarHBondContact O-CD2 3.46Å; I522-Y526 PolarHBondContact O-N 2.87Å; A524-Y526 VanDerWaalsContact C-N 3.34Å; A524-Y526 PolarHBondContact O-N 3.42Å
527	K	80.8	Confident	84.1	Confident	186 Å²	186	70.2 Å²	70.2	81%	0.809	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-15.7	178	-74.2	171.4	-178.7	173.5	0	113.6	G523 A524 Y525	G523-K527 WeakPolarHBondContact O-CD 3.44Å; G523-K527 VanDerWaalsContact O-CG 3.32Å; G523-K527 WeakPolarHBondContact O-CG 3.36Å; G523-K527 PolarHBondContact O-N 3.26Å; A524-K527 PolarHBondContact O-N 3.37Å; Y525-K527 PolarHBondContact O-N 3.17Å
528	G	63.7	Low	83	Confident	72 Å²	72	75.3 Å²	75.3	74%	0.742	46%	0.461	S	S	*	.			trans	-108.6	5.5	-177.3	0	0	0	0	0	115.2	A524 Y525	A524-G528 PolarHBondContact O-N 3.36Å; Y525-G528 PolarHBondContact O-N 3.48Å
529	G	48.5	Very low	82	Confident	134 Å²	134	78.7 Å²	78.7	100%	1.381	49%	0.485	S	S	*	.			trans	-96.8	0	176.5	0	0	0	0	0	113.7

Retrieved 529 of 529 residues in 150 ms (Link to these results)

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