A0A093H415_STRCA Loading...

Zinc finger protein 319

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A093H415, Species STRCA (Struthio camelus australis), Gene n/a, Length 553 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	45.3	Very low	41.4	Very low	242 Å²	242	169.7 Å²	169.7	100%	1.192	83%	0.828	S	S	*	*				0	67.5	0	-70.8	-138.2	-80.3	0	0	108.7
2	S	41.7	Very low	41	Very low	109 Å²	109	163.5 Å²	163.5	76%	0.762	83%	0.825	S	S	*	*			trans	-159.4	78.3	-164.9	41.6	0	0	0	0	106
3	E	38.8	Very low	41.2	Very low	177 Å²	177	164.8 Å²	164.8	83%	0.827	83%	0.826	S	S	*	*			trans	-165.2	2.8	173.7	-114	162.2	-163.8	0	0	115.5
4	S	42.4	Very low	41	Very low	109 Å²	109	166.3 Å²	166.3	76%	0.762	83%	0.829	S	S	*	*	S	Bend	trans	-99	-8.8	-178.7	149.4	0	0	0	0	115.2
5	W	36.4	Very low	40.5	Very low	204 Å²	204	168.2 Å²	168.2	77%	0.773	83%	0.834	S	S	*	*	S	Bend	trans	-98.2	-6.9	-173.6	-106.5	89	0	0	0	115.3
6	Q	39.7	Very low	40.2	Very low	158 Å²	158	164.9 Å²	164.9	74%	0.738	83%	0.829	S	S	*	*	S	Bend	trans	-89.6	-10.8	-177.1	-84.6	171.6	-33.1	0	0	114.4
7	Q	41.6	Very low	40	Very low	176 Å²	176	162.2 Å²	162.2	82%	0.822	83%	0.826	S	S	*	*	S	Bend	trans	-95.1	-5	-173.6	-140.7	150.2	19.8	0	0	114.7
8	Q	43.1	Very low	39.4	Very low	172 Å²	172	160.4 Å²	160.4	80%	0.804	83%	0.827	S	S	*	*	S	Bend	trans	-102.8	-2.6	-179.4	-135.1	168.4	8	0	0	114.3
9	Q	43.8	Very low	38.9	Very low	151 Å²	151	161.2 Å²	161.2	71%	0.706	83%	0.826	S	S	*	*	S	Bend	trans	-94.7	-5	177.9	-79.5	-170.6	-14.1	0	0	114.8
10	Q	41.6	Very low	38.5	Very low	170 Å²	170	163 Å²	163	79%	0.794	83%	0.831	S	S	*	*	S	Bend	trans	-93.6	0.2	-174.8	-87.9	178.2	-2.7	0	0	116.1
11	Q	40.5	Very low	37.9	Very low	199 Å²	199	163.6 Å²	163.6	93%	0.93	83%	0.83	S	S	*	*	S	Bend	trans	-103.7	6.4	-179.5	-90	-177.6	-10.2	0	0	116.1
12	A	37.7	Very low	37.3	Very low	95 Å²	95	160.5 Å²	160.5	79%	0.785	81%	0.813	S	S	*	*	S	Bend	trans	-111.8	20.1	-178.4	0	0	0	0	0	114.9
13	Q	43.3	Very low	36.6	Very low	180 Å²	180	162.4 Å²	162.4	84%	0.841	82%	0.82	S	S	*	*			trans	-123.6	56.5	178.1	-74	-170.8	-3	0	0	112.8
14	Q	37.6	Very low	35.8	Very low	186 Å²	186	157.5 Å²	157.5	87%	0.869	82%	0.817	S	S	*	*			trans	-148.1	97.2	158.4	-64	-171.2	12.3	0	0	109.3
15	Q	34.1	Very low	34.9	Very low	195 Å²	195	157.5 Å²	157.5	91%	0.911	82%	0.823	S	S	*	*			trans	177.3	136.6	132	-94	-178.2	11.7	0	0	111.4
16	P	35.9	Very low	34.3	Very low	115 Å²	115	152.1 Å²	152.1	75%	0.747	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-86.6	163.9	-177.1	34.9	-34	0	0	0	113.1
17	P	36.7	Very low	33.5	Very low	120 Å²	120	151.3 Å²	151.3	78%	0.779	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-88.6	143.6	-175.3	34.8	-30.4	0	0	0	111.6
18	P	29.8	Very low	32.8	Very low	130 Å²	130	150.5 Å²	150.5	84%	0.844	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-101.2	144.8	164.2	20.2	-3.1	0	0	0	112.8
19	Q	28.5	Very low	32.2	Very low	174 Å²	174	147.6 Å²	147.6	81%	0.813	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-77	154.2	-171.5	-64.9	163.9	-40.4	0	0	112.8
20	Q	31.2	Very low	31.1	Very low	197 Å²	197	148.1 Å²	148.1	92%	0.921	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-81.9	127	167.4	-68.7	-177.8	-17.9	0	0	110.3
21	H	26.8	Very low	30.4	Very low	176 Å²	176	147.7 Å²	147.7	82%	0.815	83%	0.825	S	S	*	*			trans	-131	139.3	165.4	-98.2	-79.7	0	0	0	110.7
22	H	31.1	Very low	29.5	Very low	178 Å²	178	143.8 Å²	143.8	82%	0.824	82%	0.82	S	S	*	*			trans	-81.3	169.6	175.1	-81.1	-80.3	0	0	0	113.4
23	T	27	Very low	29.3	Very low	149 Å²	149	146.8 Å²	146.8	91%	0.914	82%	0.821	S	S	*	*			trans	96.3	139.4	170.2	74.3	0	0	0	0	113.6
24	G	23.2	Very low	28.7	Very low	74 Å²	74	143.7 Å²	143.7	76%	0.763	82%	0.816	S	S	*	*			cis	161	138.1	1.2	0	0	0	0	0	109.8
25	A	23.1	Very low	28.3	Very low	108 Å²	108	140 Å²	140	89%	0.893	81%	0.808	S	S	*	*			trans	69.9	145.5	152.7	0	0	0	0	0	124.4
26	A	23.3	Very low	27.8	Very low	91 Å²	91	135.5 Å²	135.5	75%	0.752	80%	0.799	S	S	*	*			trans	80.1	134.7	159.3	0	0	0	0	0	117.2
27	T	23.9	Very low	27.2	Very low	141 Å²	141	135.9 Å²	135.9	87%	0.865	80%	0.799	S	S	*	*			cis	-167	150.5	17.2	-7.5	0	0	0	0	109.7
28	L	27	Very low	26.6	Very low	160 Å²	160	134.5 Å²	134.5	84%	0.838	80%	0.797	S	S	*	*			trans	-69.8	164	167.2	-75	162.4	0	0	0	111.7
29	P	30.2	Very low	26.3	Very low	111 Å²	111	137.3 Å²	137.3	72%	0.721	80%	0.8	S	S	*	*				-145.6	171.6	80.6	33.5	-12.7	0	0	0	113.2
30	E	21.6	Very low	26.2	Very low	161 Å²	161	136.3 Å²	136.3	75%	0.752	80%	0.8	S	S	*	*			cis	-166.2	148.4	-13	-105.7	-175.5	125.1	0	0	106.9
31	H	25.6	Very low	26.2	Very low	162 Å²	162	132 Å²	132	75%	0.75	79%	0.789	S	S	*	*			trans	16.4	136.3	151.2	-60.8	-69.6	0	0	0	121.2
32	S	22.8	Very low	26.3	Very low	117 Å²	117	131.7 Å²	131.7	82%	0.818	79%	0.792	S	S	*	*				-166.4	136.1	72.9	-62.8	0	0	0	0	113.5
33	I	33.1	Very low	25.9	Very low	157 Å²	157	126.9 Å²	126.9	81%	0.805	79%	0.791	S	S	*	*			trans	-111.4	148.2	158.8	-45.5	173	0	0	0	105.5
34	P	29.7	Very low	25.9	Very low	115 Å²	115	126.3 Å²	126.3	75%	0.747	79%	0.791	S	S	*	*				-154.8	-174.7	100.6	38.2	-17.7	0	0	0	113.5
35	P	30.8	Very low	25.9	Very low	108 Å²	108	126.9 Å²	126.9	70%	0.701	79%	0.789	S	S	*	*			cis	-137.8	179.6	-48.5	38.1	-22	0	0	0	113.5
36	S	23.2	Very low	26	Very low	102 Å²	102	128.2 Å²	128.2	71%	0.713	79%	0.786	S	S	*	*			trans	76.3	138	143.9	-146.7	0	0	0	0	117
37	T	22.7	Very low	26.2	Very low	123 Å²	123	134.5 Å²	134.5	76%	0.755	79%	0.791	S	S	*	*			cis	-178.1	147.4	-0.3	17.2	0	0	0	0	105.4
38	A	23.6	Very low	26.1	Very low	90 Å²	90	130.9 Å²	130.9	74%	0.744	78%	0.782	S	S	*	*			trans	78.4	127.2	145.8	0	0	0	0	0	120.5
39	E	24.3	Very low	26.2	Very low	190 Å²	190	131.2 Å²	131.2	89%	0.888	78%	0.783	S	S	*	*			trans	89.9	96.3	148.9	-63	179.5	171.6	0	0	120.2
40	N	26.6	Very low	26	Very low	152 Å²	152	133.5 Å²	133.5	81%	0.813	79%	0.788	S	S	*	*			trans	-60	152.2	148.3	-117.9	-22.9	0	0	0	109.5
41	P	31.4	Very low	26.3	Very low	108 Å²	108	134 Å²	134	70%	0.701	80%	0.795	S	S	*	*				-150.4	152.2	59.4	35.6	-13.8	0	0	0	118.1
42	L	28	Very low	26.3	Very low	169 Å²	169	135 Å²	135	89%	0.885	80%	0.8	S	S	*	*			trans	50.2	87.7	141.9	-64.5	166.9	0	0	0	118.5
43	G	22	Very low	26.5	Very low	76 Å²	76	135.2 Å²	135.2	78%	0.784	80%	0.798	S	S	*	*			trans	-106.6	125.1	161.3	0	0	0	0	0	112.1	A45	G43-A45 PolarHBondContact O-N 2.78Å
44	C	26.9	Very low	26.3	Very low	138 Å²	138	134.6 Å²	134.6	93%	0.932	80%	0.797	S	S	*	*			trans	-55.1	126.6	164.2	-81.7	0	0	0	0	110.8
45	A	24.4	Very low	26.4	Very low	85 Å²	85	134.6 Å²	134.6	70%	0.702	80%	0.797	S	S	*	*			trans	-124.9	102.9	163.5	0	0	0	0	0	109.6	G43	G43-A45 PolarHBondContact O-N 2.78Å
46	V	24.8	Very low	26.5	Very low	137 Å²	137	136.1 Å²	136.1	83%	0.83	80%	0.799	S	S	*	*			trans	-66.4	118.2	166.4	172.8	0	0	0	0	107.9
47	Y	26.7	Very low	26.8	Very low	223 Å²	223	139.3 Å²	139.3	88%	0.875	81%	0.807	S	S	*	*			trans	-94.5	110.1	162.5	-92.8	-84.8	0	0	0	109.7
48	G	23.5	Very low	27.1	Very low	64 Å²	64	141.7 Å²	141.7	66%	0.66	81%	0.81	S	S	*	*			trans	-77.5	144.4	167.8	0	0	0	0	0	111.3
49	I	27.6	Very low	27.3	Very low	168 Å²	168	146.4 Å²	146.4	86%	0.862	82%	0.816	S	S	*	*			trans	-118.6	119.2	155.6	-63.4	179.8	0	0	0	106.4
50	L	26.4	Very low	27.4	Very low	159 Å²	159	144.8 Å²	144.8	83%	0.832	81%	0.808	S	S	*	*			trans	-54.4	133.4	176.5	-78.1	142.7	0	0	0	112
51	L	27.6	Very low	27.6	Very low	170 Å²	170	146.5 Å²	146.5	89%	0.89	81%	0.811	S	S	*	*			trans	-132.4	123.2	152.3	-75.7	170.7	0	0	0	107.2
52	Q	26.2	Very low	27.3	Very low	184 Å²	184	149.3 Å²	149.3	86%	0.86	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-69.9	147.4	-172.8	-65.6	-175.8	-48.7	0	0	112.6
53	P	27.6	Very low	27.3	Very low	121 Å²	121	145.2 Å²	145.2	79%	0.786	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-85.6	147.2	167.6	26.4	-18.2	0	0	0	112.6
54	D	29.4	Very low	27.6	Very low	144 Å²	144	147.7 Å²	147.7	77%	0.77	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-64.9	136	179.5	-153.9	-26.5	0	0	0	112.1	N56	D54-N56 PolarHBondContact O-N 2.76Å
55	P	30.7	Very low	27.5	Very low	116 Å²	116	148.8 Å²	148.8	75%	0.753	80%	0.803	S	S	*	*	S	Bend	trans	-84.4	8.4	-167.6	-9.7	27.8	0	0	0	117.5
56	N	32.3	Very low	27.7	Very low	139 Å²	139	153.3 Å²	153.3	74%	0.743	81%	0.809	S	S	*	*			trans	-118.6	59.3	-171.3	-85.9	-52.2	0	0	0	115.2	D54	D54-N56 PolarHBondContact O-N 2.76Å
57	L	29.4	Very low	28.1	Very low	170 Å²	170	152.4 Å²	152.4	89%	0.89	82%	0.816	S	S	*	*			trans	-124.9	96.1	159.7	-119.2	87.9	0	0	0	109.7	H59	L57-H59 PolarHBondContact O-N 3.43Å
58	Q	29	Very low	28.2	Very low	172 Å²	172	145.3 Å²	145.3	80%	0.804	81%	0.81	S	S	*	*			trans	-68	127.2	170.2	-79.8	175.2	-31	0	0	110.2	H60	Q58-H60 PolarHBondContact O-N 2.75Å
59	H	28.1	Very low	28.7	Very low	190 Å²	190	151 Å²	151	88%	0.88	82%	0.82	S	S	*	*			trans	-70.8	114.7	167.1	-85.5	-43.1	0	0	0	110.1	L57	L57-H59 PolarHBondContact O-N 3.43Å
60	H	27.6	Very low	29.3	Very low	156 Å²	156	146.6 Å²	146.6	72%	0.722	80%	0.802	S	S	*	*			trans	-91	115.3	158.3	-89.2	-70.6	0	0	0	109.7	Q58	Q58-H60 PolarHBondContact O-N 2.75Å
61	Q	29.5	Very low	30.1	Very low	187 Å²	187	140.8 Å²	140.8	87%	0.874	78%	0.775	S	S	*	*			trans	-73.3	135.3	163.4	-69.1	175.3	-17	0	0	108.8
62	H	26.5	Very low	31.4	Very low	167 Å²	167	135.5 Å²	135.5	77%	0.773	75%	0.746	S	S	*	*			trans	-121.2	131.3	165.4	-82.4	-74.5	0	0	0	110.9
63	A	26.8	Very low	32.7	Very low	83 Å²	83	131.2 Å²	131.2	69%	0.686	72%	0.724	S	S	*	*			trans	-74.6	170	171.9	0	0	0	0	0	111.4
64	P	28.2	Very low	33.9	Very low	128 Å²	128	126 Å²	126	83%	0.831	69%	0.69	S	S	*	*			trans	-76.7	138.6	-166.6	31.5	-31.1	0	0	0	112.1
65	I	26.4	Very low	34.8	Very low	162 Å²	162	121.3 Å²	121.3	83%	0.831	68%	0.676	S	S	*	*			trans	-107.7	127.2	179.5	-60.6	177.3	0	0	0	110.4
66	Q	27.2	Very low	35.5	Very low	180 Å²	180	119.5 Å²	119.5	84%	0.841	66%	0.663	S	S	*	*			trans	-68.1	162.1	174.3	-66.6	177.4	-20.9	0	0	112.4	G68	Q66-G68 PolarHBondContact O-N 3.26Å
67	A	34.4	Very low	36.4	Very low	117 Å²	117	115.6 Å²	115.6	97%	0.967	65%	0.646	S	S	*	*			trans	-58.1	125.6	178.1	0	0	0	0	0	112.2
68	G	28.4	Very low	37.7	Very low	74 Å²	74	109.7 Å²	109.7	76%	0.763	63%	0.626	S	S	*	*			trans	-138.1	152.7	176.3	0	0	0	0	0	111.9	Q66	Q66-G68 PolarHBondContact O-N 3.26Å
69	E	33.3	Very low	39	Very low	183 Å²	183	106.9 Å²	106.9	86%	0.855	61%	0.613	S	S	*	*			trans	-53.1	159.1	-176	-70.8	177.9	142.1	0	0	115.1	S71	E69-S71 PolarHBondContact O-N 3.38Å
70	P	40.4	Very low	40.3	Very low	77 Å²	77	101.6 Å²	101.6	50%	0.5	59%	0.591	S	S	.	*			trans	-63.4	105.2	-175	23.5	-32.1	0	0	0	112.6
71	S	43.8	Very low	41.9	Very low	36 Å²	36	95.8 Å²	95.8	25%	0.252	57%	0.565	S	S	.	*			trans	-78.8	129.4	172.1	71.5	0	0	0	0	111.5	E69 T103	E69-S71 PolarHBondContact O-N 3.38Å; S71-T103 WeakPolarHBondContact O-CG2 3.47Å; S71-T103 PolarHBondContact O-OG1 3.21Å
72	H	54.6	Low	43.1	Very low	60 Å²	60	89.6 Å²	89.6	28%	0.278	54%	0.54	S	S	.	.			trans	-101.3	113.8	176.1	-65.9	94.2	0	0	0	109.1	L81	H72-L81 WeakPolarHBondContact O-CB 3.01Å; H72-L81 PolarHBondContact O-N 3.43Å
73	K	53.4	Low	44.2	Very low	93 Å²	93	89.9 Å²	89.9	40%	0.404	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	144.4	-174.3	-60.7	-171.8	-179.5	-172	0	112.6	G75 H79	K73-G75 PolarHBondContact O-N 2.94Å; K73-H79 VanDerWaalsContact CA-O 3.3Å; K73-H79 WeakPolarHBondContact CA-O 3.12Å
74	C	51.6	Low	45.5	Very low	11 Å²	11	89.2 Å²	89.2	7%	0.074	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	124.9	169.4	176.7	0	0	0	0	110.1	V76 C77 G78 H79 L81	C74-V76 PolarHBondContact O-N 3.19Å; C74-V76 VanDerWaalsContact O-N 3.15Å; C74-C77 VanDerWaalsContact CB-SG 3.56Å; C74-G78 VanDerWaalsContact O-CA 3.3Å; C74-G78 WeakPolarHBondContact O-CA 3.14Å; C74-G78 PolarHBondContact O-N 2.08Å; C74-H79 PolarHBondContact N-O 2.83Å; C74-L81 HydrophobicContact CB-CD1 4.22Å
75	G	49	Very low	46.5	Very low	47 Å²	47	89.4 Å²	89.4	49%	0.485	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-10.9	-177.1	0	0	0	0	0	115.1	K73	K73-G75 PolarHBondContact O-N 2.94Å
76	V	45.1	Very low	47.5	Very low	78 Å²	78	85.5 Å²	85.5	47%	0.473	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-39.4	-176.8	-175.4	0	0	0	0	112.4	C74	C74-V76 PolarHBondContact O-N 3.19Å; C74-V76 VanDerWaalsContact O-N 3.15Å
77	C	52	Low	48.3	Very low	57 Å²	57	79.4 Å²	79.4	39%	0.385	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-9.9	-178.3	69.2	0	0	0	0	114.5	C74 H79 H90	C74-C77 VanDerWaalsContact CB-SG 3.56Å; C77-H79 PolarHBondContact O-N 3.4Å; C77-H79 PolarHBondContact SG-ND1 3.07Å; C77-H79 VanDerWaalsContact SG-ND1 3.42Å; C77-H90 VanDerWaalsContact SG-CE1 3.53Å
78	G	56.4	Low	48.8	Very low	45 Å²	45	81 Å²	81	46%	0.464	47%	0.474	S	S	.	.			trans	73.8	3.6	179.5	0	0	0	0	0	115.7	C74	C74-G78 VanDerWaalsContact O-CA 3.3Å; C74-G78 WeakPolarHBondContact O-CA 3.14Å; C74-G78 PolarHBondContact O-N 2.08Å
79	H	55.6	Low	49.6	Very low	114 Å²	114	84.6 Å²	84.6	53%	0.528	47%	0.471	S	S	.	.			trans	-63.3	141	175.9	-75.6	145	0	0	0	111.7	K73 C74 C77 H90	K73-H79 VanDerWaalsContact CA-O 3.3Å; K73-H79 WeakPolarHBondContact CA-O 3.12Å; C74-H79 PolarHBondContact N-O 2.83Å; C77-H79 PolarHBondContact O-N 3.4Å; C77-H79 PolarHBondContact SG-ND1 3.07Å; C77-H79 VanDerWaalsContact SG-ND1 3.42Å; H79-H90 AromaticContact CG-NE2 3.99Å; H79-H90 AromaticContact ND1-NE2 3.42Å; H79-H90 PolarHBondContact ND1-NE2 3.4Å
80	D	56.1	Low	50.6	Low	79 Å²	79	78 Å²	78	42%	0.422	44%	0.44	S	S	.	.	B	Isolated β-bridge	trans	-80.9	121.2	176.6	-160.5	7	0	0	0	110	T82	D80-T82 VanDerWaalsContact OD1-CG2 3.23Å; D80-T82 WeakPolarHBondContact OD1-CG2 3.4Å; D80-T82 PolarHBondContact OD1-OG1 3.34Å; D80-T82 VanDerWaalsContact OD1-OG1 3.08Å; D80-T82 PolarHBondContact OD2-OG1 2.93Å; D80-T82 VanDerWaalsContact OD2-OG1 3.12Å
81	L	61	Low	51.1	Low	33 Å²	33	82.4 Å²	82.4	17%	0.173	45%	0.454	C	S	.	.			trans	-100	1.4	-174.1	-56.6	175.4	0	0	0	112	H72 C74 H83 L84 H90 F100	H72-L81 WeakPolarHBondContact O-CB 3.01Å; H72-L81 PolarHBondContact O-N 3.43Å; C74-L81 HydrophobicContact CB-CD1 4.22Å; L81-H83 PolarHBondContact O-N 3.04Å; L81-H83 VanDerWaalsContact O-N 3.12Å; L81-L84 HydrophobicContact CB-CD1 4.47Å; L81-L84 HydrophobicContact CD2-CD1 3.59Å; L81-L84 PolarHBondContact O-N 3.42Å; L81-H90 HydrophobicContact CD2-CB 4.31Å; L81-F100 HydrophobicContact CD1-CD1 4.43Å
82	T	54.4	Low	51.4	Low	57 Å²	57	82.5 Å²	82.5	35%	0.35	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-27.4	-177.7	41.5	0	0	0	0	115	D80	D80-T82 VanDerWaalsContact OD1-CG2 3.23Å; D80-T82 WeakPolarHBondContact OD1-CG2 3.4Å; D80-T82 PolarHBondContact OD1-OG1 3.34Å; D80-T82 VanDerWaalsContact OD1-OG1 3.08Å; D80-T82 PolarHBondContact OD2-OG1 2.93Å; D80-T82 VanDerWaalsContact OD2-OG1 3.12Å
83	H	50.9	Low	50.9	Low	173 Å²	173	87 Å²	87	80%	0.801	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	1.3	-176.6	-67.6	-74.6	0	0	0	114.6	L81	L81-H83 PolarHBondContact O-N 3.04Å; L81-H83 VanDerWaalsContact O-N 3.12Å
84	L	53.1	Low	50.1	Low	70 Å²	70	88.9 Å²	88.9	37%	0.366	50%	0.501	S	S	.	.			trans	-88.5	112.7	-179	-77.1	160.8	0	0	0	110.7	L81 N86 H90	L81-L84 HydrophobicContact CB-CD1 4.47Å; L81-L84 HydrophobicContact CD2-CD1 3.59Å; L81-L84 PolarHBondContact O-N 3.42Å; L84-N86 PolarHBondContact O-N 3.33Å; L84-H90 HydrophobicContact CD1-CB 4.26Å
85	S	49.9	Very low	49.8	Very low	132 Å²	132	92 Å²	92	92%	0.923	54%	0.536	S	S	*	.	S	Bend	trans	-70.9	-18.8	177	-46.5	0	0	0	0	113.4
86	N	47	Very low	49.5	Very low	80 Å²	80	96.7 Å²	96.7	43%	0.428	54%	0.544	S	S	.	.			trans	-137.1	112.8	174.9	-171.2	-6.4	0	0	0	111.6	L84 H88 E89	L84-N86 PolarHBondContact O-N 3.33Å; N86-H88 PolarHBondContact O-N 2.58Å; N86-H88 PolarHBondContact OD1-N 3.31Å; N86-E89 PolarHBondContact O-N 3.1Å
87	P	44.8	Very low	49.4	Very low	52 Å²	52	99.7 Å²	99.7	34%	0.338	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-73.2	-7	-175.5	25	-30.7	0	0	0	114.9	E89 A112 L116	P87-E89 VanDerWaalsContact C-N 3.29Å; P87-E89 PolarHBondContact O-N 3.06Å; P87-A112 HydrophobicContact CB-CB 3.98Å; P87-A112 HydrophobicContact CG-CB 4.29Å; P87-L116 HydrophobicContact CG-CD1 4.46Å
88	H	43.2	Very low	49.5	Very low	151 Å²	151	102.2 Å²	102.2	70%	0.699	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-73.3	-17	175.1	-90.8	-69.6	0	0	0	114.3	N86	N86-H88 PolarHBondContact O-N 2.58Å; N86-H88 PolarHBondContact OD1-N 3.31Å
89	E	46.5	Very low	49.3	Very low	149 Å²	149	101.8 Å²	101.8	70%	0.696	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-78.7	-20	-178.9	-65.7	-168.6	147.9	0	0	113.4	N86 P87 Q91	N86-E89 PolarHBondContact O-N 3.1Å; P87-E89 VanDerWaalsContact C-N 3.29Å; P87-E89 PolarHBondContact O-N 3.06Å; E89-Q91 PolarHBondContact O-N 3.45Å
90	H	53.5	Low	49.3	Very low	44 Å²	44	97.9 Å²	97.9	20%	0.204	53%	0.531	C	S	.	.			trans	-80.5	88.5	-180	-170.8	-82.5	0	0	0	111.6	C77 H79 L81 L84 C92	C77-H90 VanDerWaalsContact SG-CE1 3.53Å; H79-H90 AromaticContact CG-NE2 3.99Å; H79-H90 AromaticContact ND1-NE2 3.42Å; H79-H90 PolarHBondContact ND1-NE2 3.4Å; L81-H90 HydrophobicContact CD2-CB 4.31Å; L84-H90 HydrophobicContact CD1-CB 4.26Å; H90-C92 PolarHBondContact CE1-SG 3.25Å; H90-C92 PolarHBondContact O-N 3.39Å
91	Q	50.1	Low	48.9	Very low	170 Å²	170	97.6 Å²	97.6	79%	0.794	53%	0.527	S	S	*	.			trans	-86.3	103.1	173.4	-85.5	179.3	-4.4	0	0	112.1	E89	E89-Q91 PolarHBondContact O-N 3.45Å
92	C	51.4	Low	48.6	Very low	37 Å²	37	96.4 Å²	96.4	25%	0.25	52%	0.521	C	S	.	.			trans	-75.7	148.6	156.8	-72.7	0	0	0	0	110.5	H90	H90-C92 PolarHBondContact CE1-SG 3.25Å; H90-C92 PolarHBondContact O-N 3.39Å
93	L	43.3	Very low	48.3	Very low	155 Å²	155	96.7 Å²	96.7	81%	0.812	52%	0.523	S	S	*	.			trans	-46	148.5	-177.9	-69.3	164.4	0	0	0	113.8	G95	L93-G95 PolarHBondContact O-N 3.43Å
94	P	37.6	Very low	48.1	Very low	133 Å²	133	95.2 Å²	95.2	86%	0.864	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	123.9	-171.2	-8.8	25.2	0	0	0	112
95	G	44.8	Very low	48.1	Very low	77 Å²	77	94.5 Å²	94.5	79%	0.794	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	135.3	-3.1	171.1	0	0	0	0	0	117	L93	L93-G95 PolarHBondContact O-N 3.43Å
96	H	43.2	Very low	48.2	Very low	145 Å²	145	93.6 Å²	93.6	67%	0.671	50%	0.501	S	S	*	.	S	Bend	trans	-113.8	133.7	179.6	-74.4	-90	0	0	0	112.1	R98	H96-R98 PolarHBondContact O-N 3.04Å; H96-R98 VanDerWaalsContact O-N 3.16Å
97	D	42	Very low	48.4	Very low	140 Å²	140	95.6 Å²	95.6	75%	0.749	51%	0.506	S	S	*	.			trans	-57.8	115.6	173.6	-105.3	-37.2	0	0	0	110.2	S99	D97-S99 PolarHBondContact O-N 3.16Å
98	R	53.9	Low	48.7	Very low	111 Å²	111	97.7 Å²	97.7	42%	0.419	51%	0.513	S	S	.	.			trans	-68.9	112	179.6	-68.9	-179.7	175.6	-168.7	-3.6	108.4	H96 F100	H96-R98 PolarHBondContact O-N 3.04Å; H96-R98 VanDerWaalsContact O-N 3.16Å; R98-F100 HydrophobicContact CB-CE2 4.3Å; R98-F100 HydrophobicContact CB-CZ 4.39Å
99	S	53.7	Low	49.4	Very low	36 Å²	36	91.7 Å²	91.7	25%	0.252	49%	0.485	S	S	.	.			trans	-130.6	134.1	177.8	51.5	0	0	0	0	110.5	D97 F109	D97-S99 PolarHBondContact O-N 3.16Å; S99-F109 CarbonylContact C-O 3.5Å; S99-F109 VanDerWaalsContact CA-O 3.32Å; S99-F109 WeakPolarHBondContact CA-O 3.01Å
100	F	55.1	Low	49.8	Very low	32 Å²	32	91 Å²	91	14%	0.14	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	128.5	-172.6	-54.7	-86	0	0	0	108.6	L81 R98 I108 F109 A112 L115	L81-F100 HydrophobicContact CD1-CD1 4.43Å; R98-F100 HydrophobicContact CB-CE2 4.3Å; R98-F100 HydrophobicContact CB-CZ 4.39Å; F100-I108 CarbonylContact O-C 3.31Å; F100-I108 WeakPolarHBondContact O-CA 3.22Å; F100-F109 PolarHBondContact N-O 2.86Å; F100-F109 PolarHBondContact O-N 3.13Å; F100-A112 HydrophobicContact CD1-CB 4.24Å; F100-A112 HydrophobicContact CD2-CB 4.3Å; F100-A112 HydrophobicContact CE1-CB 3.92Å; F100-A112 HydrophobicContact CE2-CB 3.99Å; F100-A112 HydrophobicContact CG-CB 4.42Å; F100-A112 HydrophobicContact CZ-CB 3.79Å; F100-L115 HydrophobicContact CB-CB 4.31Å; F100-L115 HydrophobicContact CB-CD2 3.7Å
101	Q	48.1	Very low	49.9	Very low	72 Å²	72	94.4 Å²	94.4	34%	0.336	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.2	-172.9	-176.3	177.9	-20.8	0	0	110.5	T103 K107 I108	Q101-T103 PolarHBondContact O-N 3.31Å; Q101-K107 WeakPolarHBondContact CA-O 3.25Å; Q101-I108 HydrophobicContact CG-CG1 4.35Å
102	C	54.5	Low	50	Low	9 Å²	9	87.3 Å²	87.3	6%	0.061	47%	0.468	C	S	.	.			trans	-69.7	123.2	171.7	179.5	0	0	0	0	109.5	Q104 C105 L106 K107 F109 L115	C102-Q104 PolarHBondContact O-N 2.93Å; C102-C105 VanDerWaalsContact CB-SG 3.57Å; C102-C105 VanDerWaalsContact SG-SG 3.66Å; C102-L106 WeakPolarHBondContact O-CA 3.47Å; C102-L106 PolarHBondContact O-N 2.87Å; C102-K107 PolarHBondContact N-O 3.39Å; C102-F109 HydrophobicContact CB-CE2 4.3Å; C102-L115 HydrophobicContact CB-CD1 3.7Å
103	T	46.7	Very low	49.9	Very low	63 Å²	63	88.8 Å²	88.8	39%	0.387	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-19.1	-178.4	48.3	0	0	0	0	113.1	S71 Q101	S71-T103 WeakPolarHBondContact O-CG2 3.47Å; S71-T103 PolarHBondContact O-OG1 3.21Å; Q101-T103 PolarHBondContact O-N 3.31Å
104	Q	47.7	Very low	50.4	Low	141 Å²	141	84.5 Å²	84.5	66%	0.659	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-37.4	-179	-65	-74.8	1.4	0	0	113.5	C102	C102-Q104 PolarHBondContact O-N 2.93Å
105	C	52.4	Low	51.3	Low	55 Å²	55	78.8 Å²	78.8	37%	0.372	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	-3.1	-176.7	73.6	0	0	0	0	114.2	C102 K107 H118	C102-C105 VanDerWaalsContact CB-SG 3.57Å; C102-C105 VanDerWaalsContact SG-SG 3.66Å; C105-K107 PolarHBondContact O-N 2.73Å; C105-K107 VanDerWaalsContact O-N 3.09Å; C105-K107 VanDerWaalsContact SG-CB 3.53Å; C105-H118 PolarHBondContact SG-NE2 3.18Å; C105-H118 VanDerWaalsContact SG-NE2 3.37Å
106	L	52.6	Low	51.4	Low	114 Å²	114	80.8 Å²	80.8	60%	0.597	41%	0.408	S	S	*	.			trans	57.4	16.2	-178.6	-51.4	176.1	0	0	0	114.8	C102	C102-L106 WeakPolarHBondContact O-CA 3.47Å; C102-L106 PolarHBondContact O-N 2.87Å
107	K	51.4	Low	51.6	Low	121 Å²	121	81.3 Å²	81.3	53%	0.526	41%	0.411	S	S	.	.			trans	-72.5	136	174.9	-163.4	175.5	-179.1	-172.2	0	109.9	Q101 C102 C105 F109	Q101-K107 WeakPolarHBondContact CA-O 3.25Å; C102-K107 PolarHBondContact N-O 3.39Å; C105-K107 PolarHBondContact O-N 2.73Å; C105-K107 VanDerWaalsContact O-N 3.09Å; C105-K107 VanDerWaalsContact SG-CB 3.53Å; K107-F109 HydrophobicContact CB-CE2 3.97Å; K107-F109 HydrophobicContact CB-CZ 4.26Å; K107-F109 HydrophobicContact CD-CE1 4.42Å; K107-F109 HydrophobicContact CD-CE2 4.41Å; K107-F109 HydrophobicContact CD-CZ 3.86Å; K107-F109 HydrophobicContact CG-CE2 4.17Å; K107-F109 HydrophobicContact CG-CZ 4.09Å
108	I	50	Low	52.1	Low	97 Å²	97	77.1 Å²	77.1	50%	0.497	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	129.9	-176.6	-56.3	175.9	0	0	0	109.1	F100 Q101	F100-I108 CarbonylContact O-C 3.31Å; F100-I108 WeakPolarHBondContact O-CA 3.22Å; Q101-I108 HydrophobicContact CG-CG1 4.35Å
109	F	57.9	Low	51.6	Low	24 Å²	24	79.8 Å²	79.8	11%	0.105	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	146.6	-179.9	-61	-91	0	0	0	109.8	S99 F100 C102 K107 D114 L115 H118	S99-F109 CarbonylContact C-O 3.5Å; S99-F109 VanDerWaalsContact CA-O 3.32Å; S99-F109 WeakPolarHBondContact CA-O 3.01Å; F100-F109 PolarHBondContact N-O 2.86Å; F100-F109 PolarHBondContact O-N 3.13Å; C102-F109 HydrophobicContact CB-CE2 4.3Å; K107-F109 HydrophobicContact CB-CE2 3.97Å; K107-F109 HydrophobicContact CB-CZ 4.26Å; K107-F109 HydrophobicContact CD-CE1 4.42Å; K107-F109 HydrophobicContact CD-CE2 4.41Å; K107-F109 HydrophobicContact CD-CZ 3.86Å; K107-F109 HydrophobicContact CG-CE2 4.17Å; K107-F109 HydrophobicContact CG-CZ 4.09Å; F109-D114 HydrophobicContact CB-CB 4.34Å; F109-D114 HydrophobicContact CD1-CB 3.74Å; F109-D114 HydrophobicContact CG-CB 4.39Å; F109-L115 HydrophobicContact CB-CB 4.39Å; F109-L115 HydrophobicContact CD2-CB 4.12Å; F109-L115 HydrophobicContact CD2-CD1 3.79Å; F109-L115 HydrophobicContact CE2-CD1 3.85Å; F109-L115 HydrophobicContact CG-CB 4.3Å; F109-H118 HydrophobicContact CE1-CB 4.22Å; F109-H118 HydrophobicContact CE2-CB 4.35Å; F109-H118 AromaticContact CE2-CD2 3.97Å; F109-H118 HydrophobicContact CZ-CB 3.76Å; F109-H118 AromaticContact CZ-CD2 3.73Å; F109-H118 AromaticContact CZ-CG 3.47Å; F109-H118 VanDerWaalsContact CZ-CG 3.47Å; F109-H118 AromaticContact CZ-ND1 3.77Å
110	H	56.4	Low	51.1	Low	134 Å²	134	81.3 Å²	81.3	62%	0.62	41%	0.413	S	S	*	.	S	Bend	trans	-97.2	-9.5	-178.9	-67.6	-77	0	0	0	112.9
111	Q	55.2	Low	50.3	Low	117 Å²	117	86.9 Å²	86.9	55%	0.547	44%	0.443	S	S	.	.	S	Bend	trans	-127.3	144.2	172	-54.5	-175.7	33.6	0	0	110.1	T113 D114	Q111-T113 VanDerWaalsContact C-N 3.32Å; Q111-D114 PolarHBondContact O-N 3.36Å
112	A	52.5	Low	50.1	Low	20 Å²	20	91 Å²	91	17%	0.165	46%	0.462	C	S	.	.	H	α-helix	trans	-70.3	-30.5	-178.4	0	0	0	0	0	112.4	P87 F100 L115 L116	P87-A112 HydrophobicContact CB-CB 3.98Å; P87-A112 HydrophobicContact CG-CB 4.29Å; F100-A112 HydrophobicContact CD1-CB 4.24Å; F100-A112 HydrophobicContact CD2-CB 4.3Å; F100-A112 HydrophobicContact CE1-CB 3.92Å; F100-A112 HydrophobicContact CE2-CB 3.99Å; F100-A112 HydrophobicContact CG-CB 4.42Å; F100-A112 HydrophobicContact CZ-CB 3.79Å; A112-L115 PolarHBondContact O-N 2.83Å; A112-L116 PolarHBondContact O-N 3.2Å
113	T	48.8	Very low	49.2	Very low	68 Å²	68	96.2 Å²	96.2	42%	0.417	49%	0.494	S	S	.	.	H	α-helix	trans	-62.2	-41.7	174.9	47.1	0	0	0	0	111.4	Q111 L115 L116 E117	Q111-T113 VanDerWaalsContact C-N 3.32Å; T113-L115 VanDerWaalsContact C-N 3.25Å; T113-L115 PolarHBondContact O-N 3.35Å; T113-L116 PolarHBondContact O-N 2.94Å; T113-L116 VanDerWaalsContact O-N 3.11Å; T113-E117 WeakPolarHBondContact O-CB 3.38Å; T113-E117 WeakPolarHBondContact O-CG 3.36Å; T113-E117 PolarHBondContact O-N 2.77Å
114	D	54	Low	48.9	Very low	66 Å²	66	101.5 Å²	101.5	35%	0.353	51%	0.514	S	S	.	.	H	α-helix	trans	-65.2	-28.6	177.5	-58.8	-22.8	0	0	0	112.6	F109 Q111 H118	F109-D114 HydrophobicContact CB-CB 4.34Å; F109-D114 HydrophobicContact CD1-CB 3.74Å; F109-D114 HydrophobicContact CG-CB 4.39Å; Q111-D114 PolarHBondContact O-N 3.36Å; D114-H118 VanDerWaalsContact O-CB 3.24Å; D114-H118 WeakPolarHBondContact O-CB 3.07Å; D114-H118 PolarHBondContact O-N 2.78Å; D114-H118 VanDerWaalsContact O-N 3.16Å
115	L	56.4	Low	48.8	Very low	13 Å²	13	103.5 Å²	103.5	7%	0.068	52%	0.523	C	S	.	.	H	α-helix	trans	-77.3	-35.7	173.3	176.8	63.6	0	0	0	111.8	F100 C102 F109 A112 T113 H118	F100-L115 HydrophobicContact CB-CB 4.31Å; F100-L115 HydrophobicContact CB-CD2 3.7Å; C102-L115 HydrophobicContact CB-CD1 3.7Å; F109-L115 HydrophobicContact CB-CB 4.39Å; F109-L115 HydrophobicContact CD2-CB 4.12Å; F109-L115 HydrophobicContact CD2-CD1 3.79Å; F109-L115 HydrophobicContact CE2-CD1 3.85Å; F109-L115 HydrophobicContact CG-CB 4.3Å; A112-L115 PolarHBondContact O-N 2.83Å; T113-L115 VanDerWaalsContact C-N 3.25Å; T113-L115 PolarHBondContact O-N 3.35Å; L115-H118 WeakPolarHBondContact O-CB 3.42Å; L115-H118 PolarHBondContact O-N 3.18Å
116	L	48	Very low	48.8	Very low	119 Å²	119	106.7 Å²	106.7	62%	0.623	53%	0.531	S	S	*	.	H	α-helix	trans	-74	-35.9	177.7	-76.4	160.6	0	0	0	112.2	P87 A112 T113 H118	P87-L116 HydrophobicContact CG-CD1 4.46Å; A112-L116 PolarHBondContact O-N 3.2Å; T113-L116 PolarHBondContact O-N 2.94Å; T113-L116 VanDerWaalsContact O-N 3.11Å; L116-H118 VanDerWaalsContact C-N 3.28Å
117	E	46.4	Very low	48.5	Very low	156 Å²	156	104.2 Å²	104.2	73%	0.729	52%	0.521	S	S	*	.	S	Bend	trans	-79.4	-11.6	172.4	-68.9	-176.6	174.8	0	0	112.6	T113 Q119	T113-E117 WeakPolarHBondContact O-CB 3.38Å; T113-E117 WeakPolarHBondContact O-CG 3.36Å; T113-E117 PolarHBondContact O-N 2.77Å; E117-Q119 PolarHBondContact O-N 2.99Å
118	H	52.6	Low	48.5	Very low	51 Å²	51	101.8 Å²	101.8	24%	0.236	51%	0.511	C	S	.	.			trans	-69.2	82.3	173	-178.3	55.5	0	0	0	110.8	C105 F109 D114 L115 L116 C120	C105-H118 PolarHBondContact SG-NE2 3.18Å; C105-H118 VanDerWaalsContact SG-NE2 3.37Å; F109-H118 HydrophobicContact CE1-CB 4.22Å; F109-H118 HydrophobicContact CE2-CB 4.35Å; F109-H118 AromaticContact CE2-CD2 3.97Å; F109-H118 HydrophobicContact CZ-CB 3.76Å; F109-H118 AromaticContact CZ-CD2 3.73Å; F109-H118 AromaticContact CZ-CG 3.47Å; F109-H118 VanDerWaalsContact CZ-CG 3.47Å; F109-H118 AromaticContact CZ-ND1 3.77Å; D114-H118 VanDerWaalsContact O-CB 3.24Å; D114-H118 WeakPolarHBondContact O-CB 3.07Å; D114-H118 PolarHBondContact O-N 2.78Å; D114-H118 VanDerWaalsContact O-N 3.16Å; L115-H118 WeakPolarHBondContact O-CB 3.42Å; L115-H118 PolarHBondContact O-N 3.18Å; L116-H118 VanDerWaalsContact C-N 3.28Å; H118-C120 PolarHBondContact O-N 3.43Å; H118-C120 VanDerWaalsContact O-N 3.17Å
119	Q	43.6	Very low	48.6	Very low	168 Å²	168	99.7 Å²	99.7	79%	0.785	50%	0.502	S	S	*	.			trans	-68.7	109.1	161.5	-71.4	-178	-3.9	0	0	107.9	E117 I121	E117-Q119 PolarHBondContact O-N 2.99Å; Q119-I121 VanDerWaalsContact C-N 3.34Å; Q119-I121 PolarHBondContact O-N 3.4Å
120	C	43.4	Very low	48.3	Very low	67 Å²	67	98.6 Å²	98.6	45%	0.453	50%	0.498	S	S	.	.			trans	-67.6	96.4	175.5	-161.7	0	0	0	0	108	H118 Q122	H118-C120 PolarHBondContact O-N 3.43Å; H118-C120 VanDerWaalsContact O-N 3.17Å; C120-Q122 PolarHBondContact O-N 3.26Å
121	I	36.9	Very low	48	Very low	150 Å²	150	93.7 Å²	93.7	77%	0.769	48%	0.484	S	S	*	.			trans	-57	102.4	178.9	-57.8	170.6	0	0	0	108.6	Q119 V123	Q119-I121 VanDerWaalsContact C-N 3.34Å; Q119-I121 PolarHBondContact O-N 3.4Å; I121-V123 WeakPolarHBondContact CG2-O 3.47Å
122	Q	44.4	Very low	47.8	Very low	159 Å²	159	92.3 Å²	92.3	74%	0.743	48%	0.483	S	S	*	.			trans	-77.9	149.9	149.3	-72.3	-88	-18.7	0	0	106.9	C120	C120-Q122 PolarHBondContact O-N 3.26Å
123	V	36	Very low	47.8	Very low	118 Å²	118	94 Å²	94	72%	0.715	49%	0.493	S	S	*	.			trans	68.9	121.6	175.5	-124.4	0	0	0	0	113.7	I121	I121-V123 WeakPolarHBondContact CG2-O 3.47Å
124	E	40.4	Very low	48	Very low	173 Å²	173	98.3 Å²	98.3	81%	0.808	51%	0.506	S	S	*	.	S	Bend	cis	-153.1	115.4	19.5	-70	173.2	162.7	0	0	105.2
125	Q	45.4	Very low	47.7	Very low	184 Å²	184	99.6 Å²	99.6	86%	0.86	51%	0.511	S	S	*	.				-169.3	75.9	95.8	-78.7	-175.3	13.3	0	0	107	P127	Q125-P127 WeakPolarHBondContact O-CD 3.32Å
126	K	51.5	Low	47.3	Very low	122 Å²	122	99.9 Å²	99.9	53%	0.53	52%	0.517	S	S	.	.			trans	-105.6	96.9	169.5	-69.9	-168.6	-173.4	174.2	0	107.8	F128 G136 F137	K126-F128 PolarHBondContact O-N 2.75Å; K126-G136 VanDerWaalsContact CD-C 3.42Å; K126-G136 WeakPolarHBondContact CD-O 3.08Å; K126-G136 PolarHBondContact NZ-O 2.71Å; K126-F137 WeakPolarHBondContact CB-O 3.49Å
127	P	47.4	Very low	47.8	Very low	61 Å²	61	95.2 Å²	95.2	40%	0.396	49%	0.492	S	S	.	.			trans	-69.6	-11.4	-170.8	22.2	-29.4	0	0	0	114.1	Q125 I159	Q125-P127 WeakPolarHBondContact O-CD 3.32Å; P127-I159 HydrophobicContact CB-CD1 4.12Å
128	F	51.2	Low	47.9	Very low	71 Å²	71	91.5 Å²	91.5	31%	0.311	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	109.3	-175.6	-53.8	-69.8	0	0	0	110.8	K126 F137 L140 L143	K126-F128 PolarHBondContact O-N 2.75Å; F128-F137 HydrophobicContact CB-CB 4.42Å; F128-F137 PolarHBondContact N-O 2.89Å; F128-F137 PolarHBondContact O-N 3.25Å; F128-L140 HydrophobicContact CD1-CB 4.2Å; F128-L140 HydrophobicContact CD1-CD1 3.67Å; F128-L140 HydrophobicContact CD2-CB 4.25Å; F128-L140 HydrophobicContact CE1-CB 4.02Å; F128-L140 HydrophobicContact CE1-CD1 3.92Å; F128-L140 HydrophobicContact CE1-CG 4.4Å; F128-L140 HydrophobicContact CE2-CB 4.06Å; F128-L140 HydrophobicContact CG-CB 4.31Å; F128-L140 HydrophobicContact CG-CD1 4.27Å; F128-L140 HydrophobicContact CZ-CB 3.95Å; F128-L143 HydrophobicContact CB-CB 4.45Å; F128-L143 HydrophobicContact CB-CD2 3.84Å
129	V	52.2	Low	47.9	Very low	52 Å²	52	93.9 Å²	93.9	32%	0.315	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	132.1	-177.8	-177.3	0	0	0	0	109.4	G131 K134 M135	V129-G131 PolarHBondContact O-N 2.96Å; V129-K134 WeakPolarHBondContact CG1-O 3.37Å; V129-M135 WeakPolarHBondContact CA-O 3.24Å
130	C	51.6	Low	48.1	Very low	2 Å²	2	91 Å²	91	1%	0.014	49%	0.486	C	S	.	.			trans	-67.8	124.7	174.5	-179.6	0	0	0	0	110	V132 C133 K134 M135 F137 L143	C130-V132 PolarHBondContact O-N 3.3Å; C130-C133 WeakPolarHBondContact CB-SG 3.27Å; C130-K134 WeakPolarHBondContact O-CA 3.5Å; C130-K134 PolarHBondContact O-N 3.37Å; C130-M135 PolarHBondContact N-O 2.95Å; C130-F137 HydrophobicContact CB-CE2 4.07Å; C130-L143 HydrophobicContact CB-CD1 3.73Å
131	G	51	Low	48.3	Very low	31 Å²	31	92.8 Å²	92.8	32%	0.32	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-24.1	-177.4	0	0	0	0	0	114.6	V129	V129-G131 PolarHBondContact O-N 2.96Å
132	V	49.9	Very low	48.8	Very low	88 Å²	88	87.7 Å²	87.7	53%	0.533	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-51	-174	-177.2	0	0	0	0	111.8	C130	C130-V132 PolarHBondContact O-N 3.3Å
133	C	53.3	Low	49.3	Very low	54 Å²	54	80.4 Å²	80.4	37%	0.365	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	0.2	-177.6	66.9	0	0	0	0	114	C130 M135 H146	C130-C133 WeakPolarHBondContact CB-SG 3.27Å; C133-M135 PolarHBondContact O-N 3.36Å; C133-M135 VanDerWaalsContact SG-CB 3.53Å; C133-H146 PolarHBondContact SG-NE2 3.49Å
134	K	52.7	Low	50.2	Low	159 Å²	159	77.2 Å²	77.2	69%	0.691	43%	0.425	S	S	*	.			trans	57.7	15.4	-178	-56	-61.2	-174.8	-174.8	0	114.9	V129 C130	V129-K134 WeakPolarHBondContact CG1-O 3.37Å; C130-K134 WeakPolarHBondContact O-CA 3.5Å; C130-K134 PolarHBondContact O-N 3.37Å
135	M	47.3	Very low	50.8	Low	93 Å²	93	76.1 Å²	76.1	46%	0.458	42%	0.42	S	S	.	.			trans	-75.2	129.5	179.4	-148.5	-179.8	92.9	0	0	111	V129 C130 C133 F137	V129-M135 WeakPolarHBondContact CA-O 3.24Å; C130-M135 PolarHBondContact N-O 2.95Å; C133-M135 PolarHBondContact O-N 3.36Å; C133-M135 VanDerWaalsContact SG-CB 3.53Å; M135-F137 HydrophobicContact CB-CE2 4.13Å; M135-F137 HydrophobicContact CB-CZ 4.35Å; M135-F137 HydrophobicContact CE-CD1 4.31Å; M135-F137 HydrophobicContact CE-CE1 3.31Å; M135-F137 HydrophobicContact CE-CE2 4.07Å; M135-F137 HydrophobicContact CE-CZ 3.16Å; M135-F137 VanDerWaalsContact O-CD2 3.32Å; M135-F137 WeakPolarHBondContact O-CD2 3.45Å; M135-F137 WeakPolarHBondContact O-CE2 3.32Å; M135-F137 HydrophobicContact SD-CZ 4.44Å
136	G	47.5	Very low	51.3	Low	19 Å²	19	68.8 Å²	68.8	20%	0.196	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	137	-178.3	0	0	0	0	0	113.6	K126	K126-G136 VanDerWaalsContact CD-C 3.42Å; K126-G136 WeakPolarHBondContact CD-O 3.08Å; K126-G136 PolarHBondContact NZ-O 2.71Å
137	F	59.4	Low	51.4	Low	22 Å²	22	66.9 Å²	66.9	10%	0.096	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	143.1	-179.5	-57.7	-92.8	0	0	0	111	K126 F128 C130 M135 L143 H146	K126-F137 WeakPolarHBondContact CB-O 3.49Å; F128-F137 HydrophobicContact CB-CB 4.42Å; F128-F137 PolarHBondContact N-O 2.89Å; F128-F137 PolarHBondContact O-N 3.25Å; C130-F137 HydrophobicContact CB-CE2 4.07Å; M135-F137 HydrophobicContact CB-CE2 4.13Å; M135-F137 HydrophobicContact CB-CZ 4.35Å; M135-F137 HydrophobicContact CE-CD1 4.31Å; M135-F137 HydrophobicContact CE-CE1 3.31Å; M135-F137 HydrophobicContact CE-CE2 4.07Å; M135-F137 HydrophobicContact CE-CZ 3.16Å; M135-F137 VanDerWaalsContact O-CD2 3.32Å; M135-F137 WeakPolarHBondContact O-CD2 3.45Å; M135-F137 WeakPolarHBondContact O-CE2 3.32Å; M135-F137 HydrophobicContact SD-CZ 4.44Å; F137-L143 HydrophobicContact CB-CB 4.22Å; F137-L143 HydrophobicContact CD2-CB 3.85Å; F137-L143 HydrophobicContact CD2-CD1 3.63Å; F137-L143 HydrophobicContact CD2-CG 4.25Å; F137-L143 HydrophobicContact CE2-CB 4.4Å; F137-L143 HydrophobicContact CE2-CD1 3.53Å; F137-L143 HydrophobicContact CG-CB 4Å; F137-L143 HydrophobicContact CZ-CD1 4.39Å; F137-H146 HydrophobicContact CE1-CB 3.82Å; F137-H146 HydrophobicContact CE2-CB 4.36Å; F137-H146 AromaticContact CE2-CD2 3.99Å; F137-H146 HydrophobicContact CZ-CB 3.49Å; F137-H146 VanDerWaalsContact CZ-CB 3.49Å; F137-H146 AromaticContact CZ-CD2 3.58Å; F137-H146 AromaticContact CZ-CG 3.35Å; F137-H146 AromaticContact CZ-ND1 3.77Å
138	S	47.6	Very low	51.7	Low	78 Å²	78	70.2 Å²	70.2	55%	0.545	39%	0.393	S	S	.	.	S	Bend	trans	-80.3	-20.6	177.2	47.5	0	0	0	0	113.4
139	L	52.1	Low	51.8	Low	100 Å²	100	71.6 Å²	71.6	52%	0.524	41%	0.407	S	S	.	.	S	Bend	trans	-134	140.8	-178.5	-62.6	172.2	0	0	0	110.8	T141 S142 L143	L139-T141 VanDerWaalsContact C-N 3.25Å; L139-T141 PolarHBondContact O-N 3.44Å; L139-S142 WeakPolarHBondContact O-CB 3.25Å; L139-S142 PolarHBondContact O-N 3.36Å; L139-S142 VanDerWaalsContact O-N 3.09Å; L139-L143 PolarHBondContact O-N 2.95Å
140	L	48	Very low	51.8	Low	108 Å²	108	72.2 Å²	72.2	57%	0.565	41%	0.406	S	S	*	.	H	α-helix	trans	-61.7	-32.6	178.9	-175.1	65.1	0	0	0	112.4	F128 S142 L143 A144	F128-L140 HydrophobicContact CD1-CB 4.2Å; F128-L140 HydrophobicContact CD1-CD1 3.67Å; F128-L140 HydrophobicContact CD2-CB 4.25Å; F128-L140 HydrophobicContact CE1-CB 4.02Å; F128-L140 HydrophobicContact CE1-CD1 3.92Å; F128-L140 HydrophobicContact CE1-CG 4.4Å; F128-L140 HydrophobicContact CE2-CB 4.06Å; F128-L140 HydrophobicContact CG-CB 4.31Å; F128-L140 HydrophobicContact CG-CD1 4.27Å; F128-L140 HydrophobicContact CZ-CB 3.95Å; L140-S142 VanDerWaalsContact C-N 3.34Å; L140-S142 PolarHBondContact O-N 3.01Å; L140-L143 PolarHBondContact O-N 3.17Å; L140-A144 WeakPolarHBondContact O-CB 3.45Å; L140-A144 PolarHBondContact O-N 3.17Å
141	T	48.1	Very low	51.9	Low	104 Å²	104	79.2 Å²	79.2	64%	0.638	44%	0.444	S	S	*	.	H	α-helix	trans	-66.7	-31.9	175.1	36.8	0	0	0	0	113	L139 A144 Q145	L139-T141 VanDerWaalsContact C-N 3.25Å; L139-T141 PolarHBondContact O-N 3.44Å; T141-A144 PolarHBondContact O-N 3.4Å; T141-Q145 WeakPolarHBondContact O-CB 3.3Å; T141-Q145 PolarHBondContact O-N 2.84Å
142	S	48.6	Very low	52	Low	44 Å²	44	80.7 Å²	80.7	31%	0.308	46%	0.458	S	S	.	.	H	α-helix	trans	-72.7	-35.6	174.7	-56.4	0	0	0	0	112	L139 L140 Q145 H146	L139-S142 WeakPolarHBondContact O-CB 3.25Å; L139-S142 PolarHBondContact O-N 3.36Å; L139-S142 VanDerWaalsContact O-N 3.09Å; L140-S142 VanDerWaalsContact C-N 3.34Å; L140-S142 PolarHBondContact O-N 3.01Å; S142-Q145 PolarHBondContact O-N 3.39Å; S142-H146 PolarHBondContact O-N 2.88Å; S142-H146 VanDerWaalsContact O-N 3.16Å
143	L	54.8	Low	52	Low	5 Å²	5	82.6 Å²	82.6	3%	0.026	47%	0.465	C	S	.	.	H	α-helix	trans	-67	-41.3	170.4	176.5	58.7	0	0	0	111.3	F128 C130 F137 L139 L140 Q145 H146 H147 M155	F128-L143 HydrophobicContact CB-CB 4.45Å; F128-L143 HydrophobicContact CB-CD2 3.84Å; C130-L143 HydrophobicContact CB-CD1 3.73Å; F137-L143 HydrophobicContact CB-CB 4.22Å; F137-L143 HydrophobicContact CD2-CB 3.85Å; F137-L143 HydrophobicContact CD2-CD1 3.63Å; F137-L143 HydrophobicContact CD2-CG 4.25Å; F137-L143 HydrophobicContact CE2-CB 4.4Å; F137-L143 HydrophobicContact CE2-CD1 3.53Å; F137-L143 HydrophobicContact CG-CB 4Å; F137-L143 HydrophobicContact CZ-CD1 4.39Å; L139-L143 PolarHBondContact O-N 2.95Å; L140-L143 PolarHBondContact O-N 3.17Å; L143-Q145 VanDerWaalsContact C-N 3.31Å; L143-Q145 PolarHBondContact O-N 3.5Å; L143-H146 WeakPolarHBondContact O-CB 3.29Å; L143-H146 PolarHBondContact O-N 3.1Å; L143-H146 VanDerWaalsContact O-N 3.1Å; L143-H147 PolarHBondContact O-CD2 3.48Å; L143-H147 PolarHBondContact O-N 3.26Å; L143-M155 HydrophobicContact CD1-CE 4.15Å; L143-M155 HydrophobicContact CD1-SD 4.2Å; L143-M155 HydrophobicContact CD2-CE 3.48Å; L143-M155 VanDerWaalsContact CD2-CE 3.48Å; L143-M155 HydrophobicContact CD2-SD 4.39Å; L143-M155 HydrophobicContact CG-CE 3.8Å
144	A	53.9	Low	51.7	Low	51 Å²	51	82.1 Å²	82.1	42%	0.421	47%	0.466	S	S	.	.	H	α-helix	trans	-63.4	-35.1	175.9	0	0	0	0	0	112.7	L140 T141 H146 H147	L140-A144 WeakPolarHBondContact O-CB 3.45Å; L140-A144 PolarHBondContact O-N 3.17Å; T141-A144 PolarHBondContact O-N 3.4Å; A144-H146 VanDerWaalsContact C-N 3.3Å; A144-H147 WeakPolarHBondContact O-CB 3.25Å; A144-H147 PolarHBondContact O-N 3.42Å
145	Q	52.8	Low	51.4	Low	150 Å²	150	76.1 Å²	76.1	70%	0.701	44%	0.441	S	S	*	.	H	α-helix	trans	-72.5	-26.4	175.3	-151.4	169.3	11.3	0	0	112.4	T141 S142 L143 H147	T141-Q145 WeakPolarHBondContact O-CB 3.3Å; T141-Q145 PolarHBondContact O-N 2.84Å; S142-Q145 PolarHBondContact O-N 3.39Å; L143-Q145 VanDerWaalsContact C-N 3.31Å; L143-Q145 PolarHBondContact O-N 3.5Å; Q145-H147 VanDerWaalsContact C-N 3.34Å
146	H	56.5	Low	51.1	Low	31 Å²	31	77.4 Å²	77.4	14%	0.144	44%	0.444	C	S	.	.	H	α-helix	trans	-75.2	-17.4	172.7	-179.3	79.4	0	0	0	113.3	C133 F137 S142 L143 A144 N148 V149 H150	C133-H146 PolarHBondContact SG-NE2 3.49Å; F137-H146 HydrophobicContact CE1-CB 3.82Å; F137-H146 HydrophobicContact CE2-CB 4.36Å; F137-H146 AromaticContact CE2-CD2 3.99Å; F137-H146 HydrophobicContact CZ-CB 3.49Å; F137-H146 VanDerWaalsContact CZ-CB 3.49Å; F137-H146 AromaticContact CZ-CD2 3.58Å; F137-H146 AromaticContact CZ-CG 3.35Å; F137-H146 AromaticContact CZ-ND1 3.77Å; S142-H146 PolarHBondContact O-N 2.88Å; S142-H146 VanDerWaalsContact O-N 3.16Å; L143-H146 WeakPolarHBondContact O-CB 3.29Å; L143-H146 PolarHBondContact O-N 3.1Å; L143-H146 VanDerWaalsContact O-N 3.1Å; A144-H146 VanDerWaalsContact C-N 3.3Å; H146-N148 PolarHBondContact O-N 3.5Å; H146-N148 VanDerWaalsContact O-N 3.14Å; H146-V149 WeakPolarHBondContact O-CB 3.29Å; H146-V149 WeakPolarHBondContact O-CG2 3.31Å; H146-V149 PolarHBondContact O-N 3.05Å; H146-H150 AromaticContact NE2-CD2 3.74Å; H146-H150 AromaticContact NE2-NE2 3.49Å; H146-H150 PolarHBondContact NE2-NE2 2.88Å
147	H	53.3	Low	50.8	Low	82 Å²	82	78.2 Å²	78.2	38%	0.38	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-59	-26	176.6	-72.6	-176.5	0	0	0	114.1	L143 A144 Q145 V149 H150 M155	L143-H147 PolarHBondContact O-CD2 3.48Å; L143-H147 PolarHBondContact O-N 3.26Å; A144-H147 WeakPolarHBondContact O-CB 3.25Å; A144-H147 PolarHBondContact O-N 3.42Å; Q145-H147 VanDerWaalsContact C-N 3.34Å; H147-V149 PolarHBondContact O-N 3.2Å; H147-V149 VanDerWaalsContact O-N 3.07Å; H147-H150 PolarHBondContact O-N 3.27Å; H147-H150 VanDerWaalsContact O-N 3.15Å; H147-M155 WeakPolarHBondContact NE2-CE 3.45Å
148	N	53.8	Low	49.8	Very low	131 Å²	131	81.5 Å²	81.5	70%	0.701	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-65	-10.8	177.4	-63.3	-27.4	0	0	0	113.1	H146	H146-N148 PolarHBondContact O-N 3.5Å; H146-N148 VanDerWaalsContact O-N 3.14Å
149	V	53.2	Low	49.3	Very low	99 Å²	99	84.1 Å²	84.1	60%	0.6	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-87.4	-22	178	-176.5	0	0	0	0	112.3	H146 H147	H146-V149 WeakPolarHBondContact O-CB 3.29Å; H146-V149 WeakPolarHBondContact O-CG2 3.31Å; H146-V149 PolarHBondContact O-N 3.05Å; H147-V149 PolarHBondContact O-N 3.2Å; H147-V149 VanDerWaalsContact O-N 3.07Å
150	H	52.8	Low	48.8	Very low	66 Å²	66	82.2 Å²	82.2	31%	0.306	47%	0.472	S	S	.	.	S	Bend	trans	-118.7	11.2	-169.1	-68.5	-53.3	0	0	0	115.7	H146 H147 G152	H146-H150 AromaticContact NE2-CD2 3.74Å; H146-H150 AromaticContact NE2-NE2 3.49Å; H146-H150 PolarHBondContact NE2-NE2 2.88Å; H147-H150 PolarHBondContact O-N 3.27Å; H147-H150 VanDerWaalsContact O-N 3.15Å; H150-G152 PolarHBondContact O-N 3.06Å
151	N	53.1	Low	48.5	Very low	149 Å²	149	83.9 Å²	83.9	80%	0.797	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	34.1	65.2	172.2	-88.1	2.3	0	0	0	115.2
152	G	53.7	Low	48	Very low	61 Å²	61	85.5 Å²	85.5	63%	0.629	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.7	18.1	151.7	0	0	0	0	0	119.9	H150	H150-G152 PolarHBondContact O-N 3.06Å
153	N	49.1	Very low	47.7	Very low	128 Å²	128	87.7 Å²	87.7	68%	0.684	49%	0.487	S	S	*	.			trans	-101.1	149.8	177.6	-75.9	-6.2	0	0	0	115.4
154	A	47.9	Very low	47.3	Very low	45 Å²	45	94.2 Å²	94.2	37%	0.372	51%	0.512	S	S	.	.			trans	-67.7	145	-173.2	0	0	0	0	0	114.1	T163 Y164 K165	A154-T163 HydrophobicContact CB-CG2 4.11Å; A154-Y164 WeakPolarHBondContact CA-O 3.18Å; A154-K165 HydrophobicContact CB-CG 3.65Å
155	M	46	Very low	46.9	Very low	33 Å²	33	99.3 Å²	99.3	16%	0.163	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	136.9	-176.8	-67.5	-137.1	-60.3	0	0	112.9	L143 H147 T163 Y164	L143-M155 HydrophobicContact CD1-CE 4.15Å; L143-M155 HydrophobicContact CD1-SD 4.2Å; L143-M155 HydrophobicContact CD2-CE 3.48Å; L143-M155 VanDerWaalsContact CD2-CE 3.48Å; L143-M155 HydrophobicContact CD2-SD 4.39Å; L143-M155 HydrophobicContact CG-CE 3.8Å; H147-M155 WeakPolarHBondContact NE2-CE 3.45Å; M155-T163 CarbonylContact O-C 3.46Å; M155-T163 VanDerWaalsContact O-CA 3.3Å; M155-T163 WeakPolarHBondContact O-CA 3.28Å; M155-Y164 PolarHBondContact N-O 3.17Å; M155-Y164 PolarHBondContact O-N 3.45Å
156	K	41.7	Very low	46.4	Very low	120 Å²	120	96.1 Å²	96.1	52%	0.522	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	123.9	171.6	-168.4	179.3	-180	-175.7	0	110.7	E161	K156-E161 WeakPolarHBondContact CE-O 3.46Å
157	C	39.9	Very low	45.6	Very low	36 Å²	36	100.9 Å²	100.9	24%	0.243	55%	0.551	C	S	.	*			trans	-68.4	122.6	173.6	175.5	0	0	0	0	110.3	C160 E161 K162 Y164	C157-C160 HydrophobicContact CB-CB 4.35Å; C157-C160 WeakPolarHBondContact CB-SG 3.37Å; C157-C160 WeakPolarHBondContact SG-CB 3.33Å; C157-C160 PolarHBondContact SG-N 3.1Å; C157-C160 CovalentContact SG-SG 2.06Å; C157-C160 PolarHBondContact SG-SG 3.29Å; C157-E161 WeakPolarHBondContact O-CA 3.13Å; C157-E161 PolarHBondContact O-N 3.34Å; C157-K162 WeakPolarHBondContact CB-O 3.25Å; C157-K162 PolarHBondContact N-O 3.37Å; C157-Y164 HydrophobicContact CB-CE2 4.14Å
158	S	39.4	Very low	44.7	Very low	91 Å²	91	104.4 Å²	104.4	64%	0.636	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-9.9	178.9	40.7	0	0	0	0	114.5
159	I	36.4	Very low	44.3	Very low	133 Å²	133	103.3 Å²	103.3	68%	0.682	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-29.8	176.7	-59.6	172.9	0	0	0	111.2	P127	P127-I159 HydrophobicContact CB-CD1 4.12Å
160	C	41.8	Very low	43.4	Very low	60 Å²	60	105.6 Å²	105.6	41%	0.405	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-126.3	2.9	-170.9	66.7	0	0	0	0	114	C157 K162	C157-C160 HydrophobicContact CB-CB 4.35Å; C157-C160 WeakPolarHBondContact CB-SG 3.37Å; C157-C160 WeakPolarHBondContact SG-CB 3.33Å; C157-C160 PolarHBondContact SG-N 3.1Å; C157-C160 CovalentContact SG-SG 2.06Å; C157-C160 PolarHBondContact SG-SG 3.29Å; C160-K162 PolarHBondContact O-N 3.02Å
161	E	41.9	Very low	42.7	Very low	142 Å²	142	110.5 Å²	110.5	66%	0.664	60%	0.603	S	S	*	*			trans	53.1	0.9	-177.5	-62.1	-158.2	173.2	0	0	117.8	K156 C157	K156-E161 WeakPolarHBondContact CE-O 3.46Å; C157-E161 WeakPolarHBondContact O-CA 3.13Å; C157-E161 PolarHBondContact O-N 3.34Å
162	K	36.9	Very low	42.4	Very low	138 Å²	138	109.4 Å²	109.4	60%	0.6	61%	0.607	S	S	*	*			trans	-74.8	134.6	-178.3	-74.4	-178.1	179.4	-178.1	0	112.7	C157 C160 Y164	C157-K162 WeakPolarHBondContact CB-O 3.25Å; C157-K162 PolarHBondContact N-O 3.37Å; C160-K162 PolarHBondContact O-N 3.02Å; K162-Y164 HydrophobicContact CB-CE2 3.91Å
163	T	43.3	Very low	41.6	Very low	90 Å²	90	114.2 Å²	114.2	55%	0.552	61%	0.614	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-89.5	117.7	172.9	-50.2	0	0	0	0	109.7	A154 M155	A154-T163 HydrophobicContact CB-CG2 4.11Å; M155-T163 CarbonylContact O-C 3.46Å; M155-T163 VanDerWaalsContact O-CA 3.3Å; M155-T163 WeakPolarHBondContact O-CA 3.28Å
164	Y	46.2	Very low	41.5	Very low	143 Å²	143	114.6 Å²	114.6	56%	0.561	62%	0.623	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97	113.2	175.4	-68.5	-90.9	0	0	0	109.2	A154 M155 C157 K162	A154-Y164 WeakPolarHBondContact CA-O 3.18Å; M155-Y164 PolarHBondContact N-O 3.17Å; M155-Y164 PolarHBondContact O-N 3.45Å; C157-Y164 HydrophobicContact CB-CE2 4.14Å; K162-Y164 HydrophobicContact CB-CE2 3.91Å
165	K	45.4	Very low	41.4	Very low	157 Å²	157	119 Å²	119	68%	0.683	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-94.1	143.1	165.4	-75.8	-179.7	174.5	-173.8	0	108.9	A154	A154-K165 HydrophobicContact CB-CG 3.65Å
166	P	41.8	Very low	41.5	Very low	83 Å²	83	123.2 Å²	123.2	54%	0.539	66%	0.663	S	S	.	*	P	Polyproline II helix	trans	-63	152.1	170.4	3.6	6.6	0	0	0	110.1	E168	P166-E168 PolarHBondContact O-N 3.45Å
167	P	39.8	Very low	42	Very low	132 Å²	132	123 Å²	123	86%	0.857	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-59.3	126	173.3	-14.5	27.9	0	0	0	108.9	A169	P167-A169 PolarHBondContact O-N 2.88Å
168	E	35.2	Very low	42.6	Very low	156 Å²	156	126 Å²	126	73%	0.729	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-59.2	127.4	-179.2	-71.7	164.6	172.8	0	0	109.8	P166 E170	P166-E168 PolarHBondContact O-N 3.45Å; E168-E170 HydrophobicContact CB-CG 4.45Å; E168-E170 PolarHBondContact O-N 2.82Å
169	A	45	Very low	43.6	Very low	107 Å²	107	127.8 Å²	127.8	88%	0.884	69%	0.694	S	S	*	*			trans	-73.2	82.9	167.4	0	0	0	0	0	108	P167	P167-A169 PolarHBondContact O-N 2.88Å
170	E	34.8	Very low	45.3	Very low	148 Å²	148	126.4 Å²	126.4	69%	0.692	68%	0.683	S	S	*	*			trans	-93.9	126.2	164.7	-69.7	-147.3	150.7	0	0	110	E168	E168-E170 HydrophobicContact CB-CG 4.45Å; E168-E170 PolarHBondContact O-N 2.82Å
171	H	37.7	Very low	46.9	Very low	168 Å²	168	127.9 Å²	127.9	78%	0.778	69%	0.691	S	S	*	*			trans	83.1	80.7	173.9	-61.3	76.3	0	0	0	117.1	Q173	H171-Q173 PolarHBondContact O-N 2.87Å; H171-Q173 VanDerWaalsContact O-N 3.14Å
172	S	45.9	Very low	48.4	Very low	126 Å²	126	125.6 Å²	125.6	88%	0.881	68%	0.677	S	S	*	*			trans	-59.1	100.9	151.5	-41.6	0	0	0	0	110.5
173	Q	37.7	Very low	50.3	Low	162 Å²	162	122 Å²	122	76%	0.757	67%	0.669	S	S	*	*			trans	-123.5	145.7	150.3	-74.5	-165.9	-43.5	0	0	108.9	H171 L175	H171-Q173 PolarHBondContact O-N 2.87Å; H171-Q173 VanDerWaalsContact O-N 3.14Å; Q173-L175 PolarHBondContact O-N 2.95Å
174	P	47.6	Very low	52.1	Low	137 Å²	137	117.7 Å²	117.7	89%	0.89	64%	0.643	S	S	*	*			trans	-72.2	106.6	-172.7	-4	20.7	0	0	0	109.2
175	L	44.7	Very low	53.4	Low	138 Å²	138	115.5 Å²	115.5	72%	0.723	65%	0.648	S	S	*	*			trans	-88.5	139.5	174.6	-74.9	166.5	0	0	0	110.9	Q173	Q173-L175 PolarHBondContact O-N 2.95Å
176	D	48.8	Very low	55	Low	121 Å²	121	113.2 Å²	113.2	65%	0.647	64%	0.643	S	S	*	*			trans	-46.9	137.9	-174.6	-140	-48.1	0	0	0	113.6	S178	D176-S178 PolarHBondContact O-N 2.97Å
177	P	50.9	Low	56.7	Low	116 Å²	116	111.5 Å²	111.5	75%	0.753	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	7.6	-176.3	-23.4	33.9	0	0	0	117.3
178	S	53.5	Low	58.7	Low	98 Å²	98	112.1 Å²	112.1	69%	0.685	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	-10.5	-170.1	-147.1	0	0	0	0	114.7	D176 K180	D176-S178 PolarHBondContact O-N 2.97Å; S178-K180 PolarHBondContact O-N 2.76Å
179	E	59.9	Low	60.6	Low	129 Å²	129	110.8 Å²	110.8	60%	0.603	62%	0.615	S	S	*	*			trans	-74.9	127.5	179.5	-65.4	-163.5	161.2	0	0	111.8	P181	E179-P181 WeakPolarHBondContact O-CD 3.32Å
180	K	71.7	Confident	62.3	Low	104 Å²	104	108.9 Å²	108.9	45%	0.452	59%	0.593	S	S	.	*			trans	-108.4	85	175.2	-68.7	-178.1	-173.5	173	0	108.2	S178 Y182 T190 F191 K192	S178-K180 PolarHBondContact O-N 2.76Å; K180-Y182 PolarHBondContact O-N 3.4Å; K180-T190 WeakPolarHBondContact CD-O 3.48Å; K180-T190 WeakPolarHBondContact O-CB 3.42Å; K180-F191 CarbonylContact C-O 3.58Å; K180-F191 WeakPolarHBondContact CA-O 3.2Å; K180-K192 HydrophobicContact CG-CG 3.91Å
181	P	75.4	Confident	64.5	Low	91 Å²	91	103.6 Å²	103.6	59%	0.591	57%	0.568	S	S	*	*			trans	-72.9	-13.5	-166.2	26.1	-33.6	0	0	0	114.1	E179	E179-P181 WeakPolarHBondContact O-CD 3.32Å
182	Y	75	Confident	66.5	Low	94 Å²	94	100.9 Å²	100.9	37%	0.369	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.4	107.4	-175.2	-56.5	-76.8	0	0	0	111	K180 T190 F191 K192 L194	K180-Y182 PolarHBondContact O-N 3.4Å; Y182-T190 CarbonylContact O-C 3.57Å; Y182-T190 VanDerWaalsContact O-CA 3.29Å; Y182-T190 WeakPolarHBondContact O-CA 3.43Å; Y182-F191 PolarHBondContact N-O 2.77Å; Y182-F191 PolarHBondContact O-N 3.29Å; Y182-K192 WeakPolarHBondContact CD2-O 3.5Å; Y182-K192 WeakPolarHBondContact CE2-O 3.38Å; Y182-L194 HydrophobicContact CD1-CB 4.04Å; Y182-L194 HydrophobicContact CD1-CD1 3.8Å; Y182-L194 HydrophobicContact CE1-CB 3.93Å; Y182-L194 HydrophobicContact CE1-CD1 4.15Å; Y182-L194 HydrophobicContact CG-CB 4.45Å
183	S	75.6	Confident	68.1	Low	61 Å²	61	100 Å²	100	43%	0.427	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	144.1	179.9	61.4	0	0	0	0	112.9	K189 L197	S183-K189 CarbonylContact C-O 3.48Å; S183-K189 WeakPolarHBondContact CA-O 3.39Å; S183-L197 WeakPolarHBondContact O-CD2 3.25Å
184	C	80.6	Confident	69.8	Low	0 Å²	0	97 Å²	97	0%	0	52%	0.524	C	S	.	.			trans	-81.5	122.6	172.3	180	0	0	0	0	110.4	I186 Q188 K189 F191 L197	C184-I186 PolarHBondContact O-N 3.03Å; C184-Q188 WeakPolarHBondContact O-CA 3.23Å; C184-Q188 PolarHBondContact O-N 3.34Å; C184-K189 PolarHBondContact N-O 3.33Å; C184-F191 HydrophobicContact CB-CE2 4.33Å; C184-L197 VanDerWaalsContact CA-CD1 3.49Å; C184-L197 HydrophobicContact CB-CD1 3.61Å
185	S	74.4	Confident	71.2	Confident	97 Å²	97	94.6 Å²	94.6	68%	0.678	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-24.9	179.6	54.4	0	0	0	0	114.2
186	I	78.2	Confident	72.7	Confident	110 Å²	110	90.8 Å²	90.8	56%	0.564	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-39.7	-175.3	-59.7	172.8	0	0	0	112.2	C184 H204	C184-I186 PolarHBondContact O-N 3.03Å; I186-H204 HydrophobicContact CD1-CB 3.54Å; I186-H204 HydrophobicContact CG2-CB 4.49Å
187	C	78	Confident	74.1	Confident	46 Å²	46	85.6 Å²	85.6	31%	0.311	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.9	6.2	-173.6	77.2	0	0	0	0	114.2	K189 H200	C187-K189 PolarHBondContact O-N 2.66Å; C187-K189 VanDerWaalsContact SG-CG 3.6Å; C187-H200 PolarHBondContact SG-NE2 3.17Å
188	Q	81	Confident	75.2	Confident	146 Å²	146	82.4 Å²	82.4	68%	0.682	44%	0.441	S	S	*	.			trans	58	11.9	178.4	-63	-82.7	28.9	0	0	115	C184	C184-Q188 WeakPolarHBondContact O-CA 3.23Å; C184-Q188 PolarHBondContact O-N 3.34Å
189	K	76.4	Confident	76.4	Confident	128 Å²	128	82.8 Å²	82.8	56%	0.557	43%	0.428	S	S	*	.			trans	-69.9	134.7	175.8	-74	-176.3	-179.9	-176.1	0	110.8	S183 C184 C187 F191	S183-K189 CarbonylContact C-O 3.48Å; S183-K189 WeakPolarHBondContact CA-O 3.39Å; C184-K189 PolarHBondContact N-O 3.33Å; C187-K189 PolarHBondContact O-N 2.66Å; C187-K189 VanDerWaalsContact SG-CG 3.6Å; K189-F191 HydrophobicContact CB-CE2 3.95Å; K189-F191 HydrophobicContact CB-CZ 3.98Å; K189-F191 WeakPolarHBondContact O-CD2 3.47Å; K189-F191 VanDerWaalsContact O-CE2 3.26Å; K189-F191 WeakPolarHBondContact O-CE2 3.41Å
190	T	80.6	Confident	77.4	Confident	67 Å²	67	77.7 Å²	77.7	41%	0.411	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	145.9	-178.7	57.9	0	0	0	0	112.6	K180 Y182	K180-T190 WeakPolarHBondContact CD-O 3.48Å; K180-T190 WeakPolarHBondContact O-CB 3.42Å; Y182-T190 CarbonylContact O-C 3.57Å; Y182-T190 VanDerWaalsContact O-CA 3.29Å; Y182-T190 WeakPolarHBondContact O-CA 3.43Å
191	F	81.8	Confident	77.5	Confident	37 Å²	37	75.9 Å²	75.9	16%	0.162	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	152.8	-174.6	-60.2	-83.2	0	0	0	111	K180 Y182 C184 K189 E196 L197 H200	K180-F191 CarbonylContact C-O 3.58Å; K180-F191 WeakPolarHBondContact CA-O 3.2Å; Y182-F191 PolarHBondContact N-O 2.77Å; Y182-F191 PolarHBondContact O-N 3.29Å; C184-F191 HydrophobicContact CB-CE2 4.33Å; K189-F191 HydrophobicContact CB-CE2 3.95Å; K189-F191 HydrophobicContact CB-CZ 3.98Å; K189-F191 WeakPolarHBondContact O-CD2 3.47Å; K189-F191 VanDerWaalsContact O-CE2 3.26Å; K189-F191 WeakPolarHBondContact O-CE2 3.41Å; F191-E196 HydrophobicContact CB-CB 4.01Å; F191-E196 HydrophobicContact CD1-CB 3.82Å; F191-E196 HydrophobicContact CG-CB 4.16Å; F191-L197 HydrophobicContact CB-CB 4.25Å; F191-L197 HydrophobicContact CD2-CB 3.77Å; F191-L197 HydrophobicContact CD2-CD1 3.72Å; F191-L197 HydrophobicContact CD2-CG 4.34Å; F191-L197 HydrophobicContact CE2-CD1 3.84Å; F191-L197 HydrophobicContact CG-CB 4.18Å; F191-H200 HydrophobicContact CE1-CB 3.87Å; F191-H200 HydrophobicContact CE2-CB 3.8Å; F191-H200 AromaticContact CE2-CD2 3.72Å; F191-H200 AromaticContact CE2-CG 3.69Å; F191-H200 HydrophobicContact CZ-CB 3.34Å; F191-H200 AromaticContact CZ-CD2 3.66Å; F191-H200 AromaticContact CZ-CG 3.2Å; F191-H200 AromaticContact CZ-ND1 3.61Å
192	K	79.3	Confident	77.9	Confident	110 Å²	110	74.6 Å²	74.6	48%	0.478	38%	0.38	S	S	.	.	S	Bend	trans	-77.9	-30	179.6	-69	-170.4	173.6	-160.2	0	111.8	K180 Y182 E196	K180-K192 HydrophobicContact CG-CG 3.91Å; Y182-K192 WeakPolarHBondContact CD2-O 3.5Å; Y182-K192 WeakPolarHBondContact CE2-O 3.38Å; K192-E196 PolarHBondContact N-OE2 3.34Å
193	H	79.9	Confident	78	Confident	109 Å²	109	75.8 Å²	75.8	51%	0.505	39%	0.392	S	S	.	.	S	Bend	trans	-130.3	147	-179.4	-54.5	-62.7	0	0	0	111.8	S195 E196 L197	H193-S195 PolarHBondContact O-N 3.32Å; H193-E196 HydrophobicContact CB-CG 4.25Å; H193-E196 WeakPolarHBondContact O-CB 3.37Å; H193-E196 PolarHBondContact O-N 3.07Å; H193-L197 PolarHBondContact O-N 3.11Å
194	L	73.1	Confident	77.8	Confident	98 Å²	98	76.3 Å²	76.3	51%	0.513	39%	0.387	S	S	.	.	H	α-helix	trans	-57.1	-36.3	175.7	-172.5	67	0	0	0	112.2	Y182 E196 L197 S198	Y182-L194 HydrophobicContact CD1-CB 4.04Å; Y182-L194 HydrophobicContact CD1-CD1 3.8Å; Y182-L194 HydrophobicContact CE1-CB 3.93Å; Y182-L194 HydrophobicContact CE1-CD1 4.15Å; Y182-L194 HydrophobicContact CG-CB 4.45Å; L194-E196 VanDerWaalsContact C-N 3.27Å; L194-E196 PolarHBondContact O-N 3.48Å; L194-L197 HydrophobicContact CD1-CD2 4.31Å; L194-L197 WeakPolarHBondContact O-CB 3Å; L194-L197 PolarHBondContact O-N 3.38Å; L194-S198 PolarHBondContact O-N 3.31Å; L194-S198 PolarHBondContact O-OG 3.42Å; L194-S198 VanDerWaalsContact O-OG 3.11Å
195	S	75.7	Confident	77.5	Confident	86 Å²	86	80.3 Å²	80.3	60%	0.601	41%	0.412	S	S	*	.	H	α-helix	trans	-62.7	-31.2	177.3	59.9	0	0	0	0	113.4	H193 R199	H193-S195 PolarHBondContact O-N 3.32Å; S195-R199 WeakPolarHBondContact O-CB 3.48Å; S195-R199 PolarHBondContact O-N 3.46Å; S195-R199 VanDerWaalsContact O-N 3.12Å
196	E	77	Confident	77.6	Confident	58 Å²	58	77.8 Å²	77.8	27%	0.271	40%	0.402	S	S	.	.	H	α-helix	trans	-75.2	-40.2	175.5	-61	-175.1	137.9	0	0	111.4	F191 K192 H193 L194 R199 H200	F191-E196 HydrophobicContact CB-CB 4.01Å; F191-E196 HydrophobicContact CD1-CB 3.82Å; F191-E196 HydrophobicContact CG-CB 4.16Å; K192-E196 PolarHBondContact N-OE2 3.34Å; H193-E196 HydrophobicContact CB-CG 4.25Å; H193-E196 WeakPolarHBondContact O-CB 3.37Å; H193-E196 PolarHBondContact O-N 3.07Å; L194-E196 VanDerWaalsContact C-N 3.27Å; L194-E196 PolarHBondContact O-N 3.48Å; E196-R199 PolarHBondContact O-N 3.49Å; E196-H200 WeakPolarHBondContact O-CB 3.36Å; E196-H200 PolarHBondContact O-N 3.5Å
197	L	77.4	Confident	77.5	Confident	13 Å²	13	77.9 Å²	77.9	7%	0.068	40%	0.399	C	S	.	.	H	α-helix	trans	-60.8	-51.8	172.6	172.6	59.2	0	0	0	110.6	S183 C184 F191 H193 L194 R199 H200 E201	S183-L197 WeakPolarHBondContact O-CD2 3.25Å; C184-L197 VanDerWaalsContact CA-CD1 3.49Å; C184-L197 HydrophobicContact CB-CD1 3.61Å; F191-L197 HydrophobicContact CB-CB 4.25Å; F191-L197 HydrophobicContact CD2-CB 3.77Å; F191-L197 HydrophobicContact CD2-CD1 3.72Å; F191-L197 HydrophobicContact CD2-CG 4.34Å; F191-L197 HydrophobicContact CE2-CD1 3.84Å; F191-L197 HydrophobicContact CG-CB 4.18Å; H193-L197 PolarHBondContact O-N 3.11Å; L194-L197 HydrophobicContact CD1-CD2 4.31Å; L194-L197 WeakPolarHBondContact O-CB 3Å; L194-L197 PolarHBondContact O-N 3.38Å; L197-R199 PolarHBondContact O-N 3.07Å; L197-H200 CarbonylContact O-C 3.47Å; L197-H200 WeakPolarHBondContact O-CA 3.43Å; L197-H200 WeakPolarHBondContact O-CB 3.26Å; L197-H200 PolarHBondContact O-N 3.14Å; L197-E201 HydrophobicContact CD1-CG 4.02Å; L197-E201 HydrophobicContact CG-CG 4.44Å; L197-E201 WeakPolarHBondContact O-CG 3.38Å; L197-E201 PolarHBondContact O-N 2.9Å
198	S	75.4	Confident	77.6	Confident	48 Å²	48	81.5 Å²	81.5	34%	0.336	41%	0.41	S	S	.	.	H	α-helix	trans	-60.8	-32.5	178.3	-57	0	0	0	0	112.7	L194 R202	L194-S198 PolarHBondContact O-N 3.31Å; L194-S198 PolarHBondContact O-OG 3.42Å; L194-S198 VanDerWaalsContact O-OG 3.11Å; S198-R202 WeakPolarHBondContact O-CG 3.4Å
199	R	78.9	Confident	77.5	Confident	106 Å²	106	77.9 Å²	77.9	40%	0.4	40%	0.399	S	S	.	.	H	α-helix	trans	-71.1	-36.4	172.9	-179.1	177.3	66.7	-172	-9.3	112	S195 E196 L197 Q221	S195-R199 WeakPolarHBondContact O-CB 3.48Å; S195-R199 PolarHBondContact O-N 3.46Å; S195-R199 VanDerWaalsContact O-N 3.12Å; E196-R199 PolarHBondContact O-N 3.49Å; L197-R199 PolarHBondContact O-N 3.07Å; R199-Q221 HydrophobicContact CG-CG 4.16Å
200	H	80	Confident	77.9	Confident	23 Å²	23	75.8 Å²	75.8	11%	0.106	39%	0.388	C	S	.	.	H	α-helix	trans	-68.5	-40.9	176.6	173	76	0	0	0	112	C187 F191 E196 L197 R202 I203 H204	C187-H200 PolarHBondContact SG-NE2 3.17Å; F191-H200 HydrophobicContact CE1-CB 3.87Å; F191-H200 HydrophobicContact CE2-CB 3.8Å; F191-H200 AromaticContact CE2-CD2 3.72Å; F191-H200 AromaticContact CE2-CG 3.69Å; F191-H200 HydrophobicContact CZ-CB 3.34Å; F191-H200 AromaticContact CZ-CD2 3.66Å; F191-H200 AromaticContact CZ-CG 3.2Å; F191-H200 AromaticContact CZ-ND1 3.61Å; E196-H200 WeakPolarHBondContact O-CB 3.36Å; E196-H200 PolarHBondContact O-N 3.5Å; L197-H200 CarbonylContact O-C 3.47Å; L197-H200 WeakPolarHBondContact O-CA 3.43Å; L197-H200 WeakPolarHBondContact O-CB 3.26Å; L197-H200 PolarHBondContact O-N 3.14Å; H200-R202 PolarHBondContact O-N 3.12Å; H200-R202 VanDerWaalsContact O-N 3.17Å; H200-I203 WeakPolarHBondContact O-CB 3.27Å; H200-I203 VanDerWaalsContact O-CG1 3.29Å; H200-I203 WeakPolarHBondContact O-CG1 3.22Å; H200-I203 PolarHBondContact O-N 3.39Å; H200-H204 AromaticContact CD2-NE2 3.93Å; H200-H204 AromaticContact CE1-NE2 3.99Å; H200-H204 AromaticContact NE2-NE2 3.19Å; H200-H204 PolarHBondContact NE2-NE2 3.11Å; H200-H204 VanDerWaalsContact NE2-NE2 3.19Å
201	E	74.7	Confident	77.9	Confident	65 Å²	65	79.8 Å²	79.8	30%	0.304	40%	0.4	S	S	.	.	H	α-helix	trans	-59.1	-29.2	179.7	-73.3	176	144.4	0	0	112.9	L197 I203 H204 T205	L197-E201 HydrophobicContact CD1-CG 4.02Å; L197-E201 HydrophobicContact CG-CG 4.44Å; L197-E201 WeakPolarHBondContact O-CG 3.38Å; L197-E201 PolarHBondContact O-N 2.9Å; E201-I203 PolarHBondContact O-N 2.94Å; E201-I203 VanDerWaalsContact O-N 3.08Å; E201-H204 PolarHBondContact O-N 2.83Å; E201-T205 PolarHBondContact O-N 3.41Å; E201-T205 VanDerWaalsContact O-N 3.12Å
202	R	82.1	Confident	78	Confident	64 Å²	64	78.6 Å²	78.6	24%	0.242	40%	0.396	C	S	.	.	H	α-helix	trans	-60.2	-18.5	173	-62.4	175.7	-168.4	-179.6	-0.9	114.1	S198 H200 H204 T205 G206 E207 S220	S198-R202 WeakPolarHBondContact O-CG 3.4Å; H200-R202 PolarHBondContact O-N 3.12Å; H200-R202 VanDerWaalsContact O-N 3.17Å; R202-H204 VanDerWaalsContact C-N 3.32Å; R202-T205 WeakPolarHBondContact CA-OG1 3.5Å; R202-G206 WeakPolarHBondContact O-CA 3.48Å; R202-G206 PolarHBondContact O-N 3.42Å; R202-E207 HydrophobicContact CB-CB 4.39Å; R202-E207 HydrophobicContact CG-CB 4.2Å; R202-E207 PolarHBondContact O-N 3.16Å; R202-S220 PolarHBondContact NH1-O 3.15Å
203	I	77.3	Confident	78.2	Confident	120 Å²	120	79 Å²	79	62%	0.615	41%	0.408	S	S	*	.	H	α-helix	trans	-69.6	-36	173.7	-60.3	173.4	0	0	0	110.2	H200 E201	H200-I203 WeakPolarHBondContact O-CB 3.27Å; H200-I203 VanDerWaalsContact O-CG1 3.29Å; H200-I203 WeakPolarHBondContact O-CG1 3.22Å; H200-I203 PolarHBondContact O-N 3.39Å; E201-I203 PolarHBondContact O-N 2.94Å; E201-I203 VanDerWaalsContact O-N 3.08Å
204	H	71.9	Confident	78.1	Confident	71 Å²	71	79.1 Å²	79.1	33%	0.329	41%	0.412	S	S	.	.	H	α-helix	trans	-82.9	-41.3	-179	-56.7	-56.9	0	0	0	111.7	I186 H200 E201 R202 G206	I186-H204 HydrophobicContact CD1-CB 3.54Å; I186-H204 HydrophobicContact CG2-CB 4.49Å; H200-H204 AromaticContact CD2-NE2 3.93Å; H200-H204 AromaticContact CE1-NE2 3.99Å; H200-H204 AromaticContact NE2-NE2 3.19Å; H200-H204 PolarHBondContact NE2-NE2 3.11Å; H200-H204 VanDerWaalsContact NE2-NE2 3.19Å; E201-H204 PolarHBondContact O-N 2.83Å; R202-H204 VanDerWaalsContact C-N 3.32Å; H204-G206 VanDerWaalsContact C-N 3.31Å
205	T	75.2	Confident	78.7	Confident	84 Å²	84	76.2 Å²	76.2	52%	0.515	40%	0.4	S	S	.	.	H	α-helix	trans	-78.8	-16.8	179.3	63.8	0	0	0	0	113	E201 R202 E207	E201-T205 PolarHBondContact O-N 3.41Å; E201-T205 VanDerWaalsContact O-N 3.12Å; R202-T205 WeakPolarHBondContact CA-OG1 3.5Å; T205-E207 PolarHBondContact O-N 2.82Å; T205-E207 WeakPolarHBondContact OG1-CG 3.2Å
206	G	75.6	Confident	79.1	Confident	45 Å²	45	80.2 Å²	80.2	46%	0.464	41%	0.414	S	S	.	.			trans	72.8	8.1	-177	0	0	0	0	0	114.2	R202 H204 K208	R202-G206 WeakPolarHBondContact O-CA 3.48Å; R202-G206 PolarHBondContact O-N 3.42Å; H204-G206 VanDerWaalsContact C-N 3.31Å; G206-K208 PolarHBondContact O-N 3.49Å
207	E	76.3	Confident	79.2	Confident	111 Å²	111	83.5 Å²	83.5	52%	0.519	43%	0.427	S	S	.	.			trans	-60.3	127.2	-178.5	-76.4	-179.5	-178.1	0	0	112.3	R202 T205	R202-E207 HydrophobicContact CB-CB 4.39Å; R202-E207 HydrophobicContact CG-CB 4.2Å; R202-E207 PolarHBondContact O-N 3.16Å; T205-E207 PolarHBondContact O-N 2.82Å; T205-E207 WeakPolarHBondContact OG1-CG 3.2Å
208	K	81.1	Confident	79.6	Confident	122 Å²	122	84.4 Å²	84.4	53%	0.53	44%	0.435	S	S	.	.			trans	-127.8	76.2	179.4	-72.4	167.4	175.7	-174.5	0	110.5	G206 Y210 S218 F219	G206-K208 PolarHBondContact O-N 3.49Å; K208-Y210 PolarHBondContact O-N 3.46Å; K208-S218 WeakPolarHBondContact CD-O 3.12Å; K208-F219 CarbonylContact C-O 3.57Å; K208-F219 VanDerWaalsContact C-O 3.24Å; K208-F219 WeakPolarHBondContact CA-O 3.44Å
209	P	78.5	Confident	80	Confident	71 Å²	71	84.2 Å²	84.2	46%	0.461	43%	0.428	S	S	.	.			trans	-65.1	-22.1	-172.9	-22.1	34.7	0	0	0	113.9
210	Y	83.4	Confident	80.1	Confident	83 Å²	83	80.7 Å²	80.7	33%	0.325	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	94.7	-170.7	-56.3	-78.7	0	0	0	111	K208 S218 F219 S220 S222	K208-Y210 PolarHBondContact O-N 3.46Å; Y210-S218 CarbonylContact O-C 3.33Å; Y210-S218 WeakPolarHBondContact O-CA 3.46Å; Y210-F219 WeakPolarHBondContact CB-O 3.49Å; Y210-F219 WeakPolarHBondContact CD2-O 3.37Å; Y210-F219 PolarHBondContact N-O 3.14Å; Y210-F219 PolarHBondContact O-N 3.38Å; Y210-S220 WeakPolarHBondContact CE2-O 3.44Å; Y210-S222 VanDerWaalsContact CE2-N 3.35Å
211	K	81.1	Confident	80.3	Confident	152 Å²	152	81.8 Å²	81.8	66%	0.661	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	141.2	-179	-52.2	-164.7	176.2	175.5	0	112.1	S218 L225	K211-S218 WeakPolarHBondContact CG-OG 3.26Å; K211-L225 WeakPolarHBondContact O-CD2 3.45Å
212	C	84.4	Confident	80.5	Confident	12 Å²	12	81.6 Å²	81.6	8%	0.081	43%	0.431	C	S	.	.			trans	-76.5	137.3	168.7	-167	0	0	0	0	109.9	L214 C215 K217 L225 H232	C212-L214 VanDerWaalsContact C-N 3.32Å; C212-C215 CarbonylContact C-O 3.58Å; C212-C215 WeakPolarHBondContact CB-O 3.33Å; C212-K217 VanDerWaalsContact CB-O 3.25Å; C212-K217 WeakPolarHBondContact CB-O 3.21Å; C212-K217 PolarHBondContact N-O 2.81Å; C212-L225 HydrophobicContact CB-CD1 3.84Å; C212-H232 PolarHBondContact SG-NE2 2.96Å
213	T	82.9	Confident	80.3	Confident	117 Å²	117	80.9 Å²	80.9	72%	0.718	44%	0.436	S	S	*	.	S	Bend	trans	-85.3	-10.8	177.1	52.5	0	0	0	0	112.5
214	L	79.1	Confident	80.6	Confident	112 Å²	112	79 Å²	79	59%	0.586	42%	0.424	S	S	*	.	S	Bend	trans	-105.9	-9.3	-176.8	-58.5	176	0	0	0	112.7	C212 H232	C212-L214 VanDerWaalsContact C-N 3.32Å; L214-H232 HydrophobicContact CD1-CB 3.58Å
215	C	83.8	Confident	81.1	Confident	38 Å²	38	76.7 Å²	76.7	26%	0.257	41%	0.414	S	S	.	.	S	Bend	trans	-163	168.7	174	69.5	0	0	0	0	111	C212 K217 H228 H232	C212-C215 CarbonylContact C-O 3.58Å; C212-C215 WeakPolarHBondContact CB-O 3.33Å; C215-K217 PolarHBondContact O-N 2.9Å; C215-H228 PolarHBondContact SG-NE2 2.82Å; C215-H232 PolarHBondContact SG-NE2 2.82Å; C215-H232 VanDerWaalsContact SG-NE2 3.37Å
216	D	84.2	Confident	81.2	Confident	169 Å²	169	76.4 Å²	76.4	90%	0.904	41%	0.412	S	S	*	.	S	Bend	trans	-72.2	8.3	-175.5	-55.3	-41.6	0	0	0	115.1
217	K	80.9	Confident	81.3	Confident	127 Å²	127	78 Å²	78	55%	0.552	41%	0.407	S	S	*	.			trans	-79.5	129.7	-177.6	-67.8	-175.2	178.4	-178.4	0	111.4	C212 C215 F219	C212-K217 VanDerWaalsContact CB-O 3.25Å; C212-K217 WeakPolarHBondContact CB-O 3.21Å; C212-K217 PolarHBondContact N-O 2.81Å; C215-K217 PolarHBondContact O-N 2.9Å; K217-F219 HydrophobicContact CB-CE2 3.96Å; K217-F219 HydrophobicContact CB-CZ 3.96Å
218	S	84.9	Confident	81.5	Confident	33 Å²	33	73.6 Å²	73.6	23%	0.231	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	147.7	176.6	-53.5	0	0	0	0	111.2	K208 Y210 K211	K208-S218 WeakPolarHBondContact CD-O 3.12Å; Y210-S218 CarbonylContact O-C 3.33Å; Y210-S218 WeakPolarHBondContact O-CA 3.46Å; K211-S218 WeakPolarHBondContact CG-OG 3.26Å
219	F	83.8	Confident	81.3	Confident	43 Å²	43	72.1 Å²	72.1	19%	0.189	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	149.8	-173.6	-57.4	-88.5	0	0	0	111.2	K208 Y210 K217 Q221 H224 L225 H228	K208-F219 CarbonylContact C-O 3.57Å; K208-F219 VanDerWaalsContact C-O 3.24Å; K208-F219 WeakPolarHBondContact CA-O 3.44Å; Y210-F219 WeakPolarHBondContact CB-O 3.49Å; Y210-F219 WeakPolarHBondContact CD2-O 3.37Å; Y210-F219 PolarHBondContact N-O 3.14Å; Y210-F219 PolarHBondContact O-N 3.38Å; K217-F219 HydrophobicContact CB-CE2 3.96Å; K217-F219 HydrophobicContact CB-CZ 3.96Å; F219-Q221 VanDerWaalsContact C-N 3.3Å; F219-H224 HydrophobicContact CB-CB 4.07Å; F219-H224 HydrophobicContact CD1-CB 3.91Å; F219-H224 HydrophobicContact CG-CB 4.18Å; F219-L225 HydrophobicContact CB-CB 4.45Å; F219-L225 HydrophobicContact CD2-CB 3.95Å; F219-L225 HydrophobicContact CD2-CD1 3.91Å; F219-L225 HydrophobicContact CE2-CD1 4.12Å; F219-L225 HydrophobicContact CG-CB 4.43Å; F219-H228 HydrophobicContact CE1-CB 3.99Å; F219-H228 HydrophobicContact CE2-CB 3.64Å; F219-H228 AromaticContact CE2-CD2 3.34Å; F219-H228 WeakPolarHBondContact CE2-CD2 3.13Å; F219-H228 AromaticContact CE2-CG 3.5Å; F219-H228 HydrophobicContact CZ-CB 3.34Å; F219-H228 AromaticContact CZ-CD2 3.46Å; F219-H228 VanDerWaalsContact CZ-CD2 3.46Å; F219-H228 WeakPolarHBondContact CZ-CD2 3.32Å; F219-H228 AromaticContact CZ-CG 3.17Å; F219-H228 AromaticContact CZ-ND1 3.75Å
220	S	81.7	Confident	81.2	Confident	32 Å²	32	71.4 Å²	71.4	22%	0.224	37%	0.368	C	S	.	.	S	Bend	trans	-78.9	-13.3	177.1	54.6	0	0	0	0	113.5	R202 Y210	R202-S220 PolarHBondContact NH1-O 3.15Å; Y210-S220 WeakPolarHBondContact CE2-O 3.44Å
221	Q	82.9	Confident	80.8	Confident	46 Å²	46	70.9 Å²	70.9	22%	0.215	37%	0.374	C	S	.	.	S	Bend	trans	-134.8	143.4	-179.1	-55.3	-174.1	33.2	0	0	111.6	R199 F219 H224 L225	R199-Q221 HydrophobicContact CG-CG 4.16Å; F219-Q221 VanDerWaalsContact C-N 3.3Å; Q221-H224 HydrophobicContact CB-CB 4.46Å; Q221-H224 PolarHBondContact O-N 3.26Å; Q221-L225 PolarHBondContact O-N 3.3Å
222	S	79.8	Confident	80.6	Confident	62 Å²	62	67.5 Å²	67.5	43%	0.434	36%	0.36	S	S	.	.	H	α-helix	trans	-64.7	-40.3	179.3	54.1	0	0	0	0	112.4	Y210 H224 L225 V226	Y210-S222 VanDerWaalsContact CE2-N 3.35Å; S222-H224 VanDerWaalsContact C-N 3.28Å; S222-H224 PolarHBondContact O-N 3.42Å; S222-L225 WeakPolarHBondContact O-CB 3.27Å; S222-L225 PolarHBondContact O-N 2.99Å; S222-L225 VanDerWaalsContact O-N 3.1Å; S222-V226 WeakPolarHBondContact O-CG2 3.31Å; S222-V226 PolarHBondContact O-N 3.22Å
223	S	78.5	Confident	79.7	Confident	49 Å²	49	68.7 Å²	68.7	34%	0.343	37%	0.369	S	S	.	.	H	α-helix	trans	-57.9	-39.7	176.4	57.6	0	0	0	0	112.4	V226 H227	S223-V226 PolarHBondContact O-N 3.4Å; S223-H227 WeakPolarHBondContact O-CB 3.47Å; S223-H227 VanDerWaalsContact O-CG 3.31Å; S223-H227 PolarHBondContact O-N 3.36Å
224	H	83.1	Confident	78.8	Confident	81 Å²	81	68.7 Å²	68.7	38%	0.375	37%	0.373	S	S	.	.	H	α-helix	trans	-67.6	-37.8	176.4	-64.9	172.2	0	0	0	112	F219 Q221 S222 H227 H228	F219-H224 HydrophobicContact CB-CB 4.07Å; F219-H224 HydrophobicContact CD1-CB 3.91Å; F219-H224 HydrophobicContact CG-CB 4.18Å; Q221-H224 HydrophobicContact CB-CB 4.46Å; Q221-H224 PolarHBondContact O-N 3.26Å; S222-H224 VanDerWaalsContact C-N 3.28Å; S222-H224 PolarHBondContact O-N 3.42Å; H224-H227 PolarHBondContact O-N 2.95Å; H224-H228 VanDerWaalsContact O-CB 3.27Å; H224-H228 WeakPolarHBondContact O-CB 3.25Å; H224-H228 PolarHBondContact O-N 3.24Å
225	L	81.2	Confident	78.2	Confident	21 Å²	21	69.3 Å²	69.3	11%	0.11	37%	0.373	C	S	.	.	H	α-helix	trans	-64.1	-45.1	173.1	172.5	62.1	0	0	0	111.2	K211 C212 F219 Q221 S222 H227 H228 K229	K211-L225 WeakPolarHBondContact O-CD2 3.45Å; C212-L225 HydrophobicContact CB-CD1 3.84Å; F219-L225 HydrophobicContact CB-CB 4.45Å; F219-L225 HydrophobicContact CD2-CB 3.95Å; F219-L225 HydrophobicContact CD2-CD1 3.91Å; F219-L225 HydrophobicContact CE2-CD1 4.12Å; F219-L225 HydrophobicContact CG-CB 4.43Å; Q221-L225 PolarHBondContact O-N 3.3Å; S222-L225 WeakPolarHBondContact O-CB 3.27Å; S222-L225 PolarHBondContact O-N 2.99Å; S222-L225 VanDerWaalsContact O-N 3.1Å; L225-H227 VanDerWaalsContact C-N 3.33Å; L225-H227 PolarHBondContact O-N 3.21Å; L225-H228 PolarHBondContact O-N 3.36Å; L225-H228 VanDerWaalsContact O-N 3.15Å; L225-K229 HydrophobicContact CD1-CG 4.23Å; L225-K229 WeakPolarHBondContact O-CG 3.42Å; L225-K229 PolarHBondContact O-N 3.07Å
226	V	78.9	Confident	77.7	Confident	78 Å²	78	73.6 Å²	73.6	47%	0.473	38%	0.384	S	S	.	.	H	α-helix	trans	-59.1	-45.4	177	172.9	0	0	0	0	110.8	S222 S223 H228 K229	S222-V226 WeakPolarHBondContact O-CG2 3.31Å; S222-V226 PolarHBondContact O-N 3.22Å; S223-V226 PolarHBondContact O-N 3.4Å; V226-H228 PolarHBondContact O-N 2.96Å; V226-K229 PolarHBondContact O-N 3.49Å
227	H	76.3	Confident	77.2	Confident	80 Å²	80	69.3 Å²	69.3	37%	0.37	37%	0.366	S	S	.	.	H	α-helix	trans	-62.5	-40.7	174.3	-75.2	176.8	0	0	0	112.9	S223 H224 L225 R230 H249	S223-H227 WeakPolarHBondContact O-CB 3.47Å; S223-H227 VanDerWaalsContact O-CG 3.31Å; S223-H227 PolarHBondContact O-N 3.36Å; H224-H227 PolarHBondContact O-N 2.95Å; L225-H227 VanDerWaalsContact C-N 3.33Å; L225-H227 PolarHBondContact O-N 3.21Å; H227-R230 WeakPolarHBondContact O-CB 3.5Å; H227-R230 PolarHBondContact O-N 3.35Å; H227-H249 AromaticContact CG-CE1 3.87Å
228	H	80.8	Confident	77.1	Confident	18 Å²	18	66.2 Å²	66.2	8%	0.083	35%	0.351	C	S	.	.	H	α-helix	trans	-67.1	-37.1	177.5	174.6	60.8	0	0	0	112.4	C215 F219 H224 L225 V226 R230 T231 H232	C215-H228 PolarHBondContact SG-NE2 2.82Å; F219-H228 HydrophobicContact CE1-CB 3.99Å; F219-H228 HydrophobicContact CE2-CB 3.64Å; F219-H228 AromaticContact CE2-CD2 3.34Å; F219-H228 WeakPolarHBondContact CE2-CD2 3.13Å; F219-H228 AromaticContact CE2-CG 3.5Å; F219-H228 HydrophobicContact CZ-CB 3.34Å; F219-H228 AromaticContact CZ-CD2 3.46Å; F219-H228 VanDerWaalsContact CZ-CD2 3.46Å; F219-H228 WeakPolarHBondContact CZ-CD2 3.32Å; F219-H228 AromaticContact CZ-CG 3.17Å; F219-H228 AromaticContact CZ-ND1 3.75Å; H224-H228 VanDerWaalsContact O-CB 3.27Å; H224-H228 WeakPolarHBondContact O-CB 3.25Å; H224-H228 PolarHBondContact O-N 3.24Å; L225-H228 PolarHBondContact O-N 3.36Å; L225-H228 VanDerWaalsContact O-N 3.15Å; V226-H228 PolarHBondContact O-N 2.96Å; H228-R230 PolarHBondContact O-N 3.29Å; H228-T231 PolarHBondContact CE1-OG1 2.78Å; H228-T231 VanDerWaalsContact CE1-OG1 3.3Å; H228-T231 PolarHBondContact ND1-OG1 3.25Å; H228-T231 WeakPolarHBondContact O-CA 3.3Å; H228-T231 VanDerWaalsContact O-CB 3.28Å; H228-T231 WeakPolarHBondContact O-CB 3.4Å; H228-T231 WeakPolarHBondContact O-CG2 3.46Å; H228-T231 PolarHBondContact O-N 3.43Å; H228-T231 PolarHBondContact O-OG1 3.45Å; H228-H232 AromaticContact CE1-NE2 3.74Å; H228-H232 AromaticContact NE2-CD2 3.94Å; H228-H232 AromaticContact NE2-NE2 3.21Å; H228-H232 PolarHBondContact NE2-NE2 2.74Å
229	K	77.6	Confident	76.8	Confident	90 Å²	90	70 Å²	70	39%	0.391	36%	0.363	S	S	.	.	H	α-helix	trans	-57.4	-32.3	176.1	-76	-176.4	175.9	-168.8	0	112.2	L225 V226 T231 H232 S233	L225-K229 HydrophobicContact CD1-CG 4.23Å; L225-K229 WeakPolarHBondContact O-CG 3.42Å; L225-K229 PolarHBondContact O-N 3.07Å; V226-K229 PolarHBondContact O-N 3.49Å; K229-T231 PolarHBondContact O-N 3.49Å; K229-T231 VanDerWaalsContact O-N 3.13Å; K229-H232 PolarHBondContact O-N 3.24Å; K229-S233 PolarHBondContact O-N 3.03Å
230	R	76.6	Confident	76.6	Confident	56 Å²	56	67.9 Å²	67.9	21%	0.211	35%	0.354	C	S	.	.	H	α-helix	trans	-66.3	-8.9	171.9	-56.5	178.4	-176.2	172.6	0.4	114.3	H227 H228 K248	H227-R230 WeakPolarHBondContact O-CB 3.5Å; H227-R230 PolarHBondContact O-N 3.35Å; H228-R230 PolarHBondContact O-N 3.29Å; R230-K248 PolarHBondContact O-NZ 3.07Å
231	T	74.6	Confident	76.3	Confident	73 Å²	73	72.4 Å²	72.4	45%	0.448	38%	0.38	S	S	.	.	H	α-helix	trans	-79.1	-28.1	171.7	67.6	0	0	0	0	112.2	H228 K229 K248	H228-T231 PolarHBondContact CE1-OG1 2.78Å; H228-T231 VanDerWaalsContact CE1-OG1 3.3Å; H228-T231 PolarHBondContact ND1-OG1 3.25Å; H228-T231 WeakPolarHBondContact O-CA 3.3Å; H228-T231 VanDerWaalsContact O-CB 3.28Å; H228-T231 WeakPolarHBondContact O-CB 3.4Å; H228-T231 WeakPolarHBondContact O-CG2 3.46Å; H228-T231 PolarHBondContact O-N 3.43Å; H228-T231 PolarHBondContact O-OG1 3.45Å; K229-T231 PolarHBondContact O-N 3.49Å; K229-T231 VanDerWaalsContact O-N 3.13Å; T231-K248 PolarHBondContact O-NZ 2.8Å
232	H	75.8	Confident	76	Confident	81 Å²	81	74.5 Å²	74.5	38%	0.375	40%	0.396	S	S	.	.	H	α-helix	trans	-81.6	-29.9	176.1	-62.3	-65.2	0	0	0	112.4	C212 L214 C215 H228 K229	C212-H232 PolarHBondContact SG-NE2 2.96Å; L214-H232 HydrophobicContact CD1-CB 3.58Å; C215-H232 PolarHBondContact SG-NE2 2.82Å; C215-H232 VanDerWaalsContact SG-NE2 3.37Å; H228-H232 AromaticContact CE1-NE2 3.74Å; H228-H232 AromaticContact NE2-CD2 3.94Å; H228-H232 AromaticContact NE2-NE2 3.21Å; H228-H232 PolarHBondContact NE2-NE2 2.74Å; K229-H232 PolarHBondContact O-N 3.24Å
233	S	67.1	Low	75.9	Confident	37 Å²	37	73.8 Å²	73.8	26%	0.259	39%	0.39	S	S	.	.	S	Bend	trans	-85.9	148.4	169.4	71.5	0	0	0	0	112	K229 E235 K248	K229-S233 PolarHBondContact O-N 3.03Å; S233-E235 PolarHBondContact O-N 3.08Å; S233-E235 PolarHBondContact OG-OE2 2.98Å; S233-K248 PolarHBondContact O-NZ 3.41Å; S233-K248 VanDerWaalsContact O-NZ 3.11Å
234	S	63.4	Low	75.9	Confident	116 Å²	116	77.6 Å²	77.6	81%	0.811	40%	0.403	S	S	*	.			trans	-75.3	-0.2	169.2	54.5	0	0	0	0	112.4	R236	S234-R236 PolarHBondContact O-N 3.27Å
235	E	66.4	Low	75.6	Confident	125 Å²	125	79.7 Å²	79.7	58%	0.584	41%	0.411	S	S	*	.			trans	-62.1	125.6	-179.5	-65.6	-179.9	152.2	0	0	111.3	S233	S233-E235 PolarHBondContact O-N 3.08Å; S233-E235 PolarHBondContact OG-OE2 2.98Å
236	R	72.6	Confident	75.5	Confident	128 Å²	128	81.2 Å²	81.2	48%	0.483	42%	0.421	S	S	.	.			trans	-128.6	76.9	175.9	-63.9	170.5	98	109.8	2.1	107.4	S234 Y238 T246 F247 K248	S234-R236 PolarHBondContact O-N 3.27Å; R236-Y238 PolarHBondContact O-N 3.34Å; R236-T246 WeakPolarHBondContact CB-OG1 3.45Å; R236-T246 VanDerWaalsContact CD-OG1 3.32Å; R236-T246 WeakPolarHBondContact CD-OG1 3.37Å; R236-T246 PolarHBondContact NE-O 3.28Å; R236-F247 CarbonylContact C-O 3.32Å; R236-F247 VanDerWaalsContact C-O 3.31Å; R236-F247 WeakPolarHBondContact CA-O 3.45Å; R236-K248 HydrophobicContact CG-CG 4Å
237	P	75	Confident	75.5	Confident	80 Å²	80	79.2 Å²	79.2	52%	0.519	41%	0.406	S	S	.	.			trans	-63.9	-16.6	-166.3	-22.6	34.1	0	0	0	114.1
238	Y	77.6	Confident	75.4	Confident	62 Å²	62	77.5 Å²	77.5	24%	0.243	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	97	-173.3	-53.7	-74.4	0	0	0	109.9	R236 T246 F247 R250	R236-Y238 PolarHBondContact O-N 3.34Å; Y238-T246 CarbonylContact O-C 3.45Å; Y238-T246 WeakPolarHBondContact O-CA 3.46Å; Y238-F247 WeakPolarHBondContact CD2-O 3.49Å; Y238-F247 PolarHBondContact N-O 3.18Å; Y238-F247 PolarHBondContact O-N 2.85Å; Y238-R250 HydrophobicContact CD1-CB 3.95Å; Y238-R250 HydrophobicContact CD1-CG 4.41Å; Y238-R250 HydrophobicContact CE1-CB 3.7Å; Y238-R250 HydrophobicContact CE1-CG 4.32Å; Y238-R250 HydrophobicContact CE2-CB 4.4Å; Y238-R250 HydrophobicContact CG-CB 4.41Å
239	K	78.9	Confident	75.1	Confident	111 Å²	111	78.8 Å²	78.8	48%	0.483	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	136.1	177.5	-174	175.9	176.9	-174.4	0	111.1	E244 T246	K239-E244 IonicContact NZ-OE1 3.45Å; K239-E244 PolarHBondContact NZ-OE1 3.26Å; K239-T246 HydrophobicContact CB-CG2 4Å; K239-T246 HydrophobicContact CG-CG2 3.96Å
240	C	79.3	Confident	74.9	Confident	0 Å²	0	82.7 Å²	82.7	0%	0	42%	0.416	C	S	.	.			trans	-74.8	127.3	168.3	175.6	0	0	0	0	109.8	V242 C243 E244 K245 F247 L253 H256 M257 H260	C240-V242 VanDerWaalsContact C-N 3.29Å; C240-V242 PolarHBondContact O-N 3.01Å; C240-V242 PolarHBondContact SG-N 2.89Å; C240-V242 VanDerWaalsContact SG-N 3.41Å; C240-C243 PolarHBondContact SG-N 2.81Å; C240-C243 VanDerWaalsContact SG-N 3.44Å; C240-E244 WeakPolarHBondContact O-CA 3.34Å; C240-E244 PolarHBondContact O-N 3.1Å; C240-E244 VanDerWaalsContact O-N 3.08Å; C240-K245 HydrophobicContact CB-CB 4.46Å; C240-K245 VanDerWaalsContact CB-O 3.27Å; C240-K245 WeakPolarHBondContact CB-O 3.49Å; C240-K245 PolarHBondContact N-O 3.16Å; C240-F247 HydrophobicContact CB-CE2 4.21Å; C240-L253 HydrophobicContact CB-CD1 3.75Å; C240-H256 PolarHBondContact SG-NE2 3.1Å; C240-M257 HydrophobicContact CB-SD 4.3Å; C240-M257 PolarHBondContact SG-SD 3.49Å; C240-H260 PolarHBondContact SG-NE2 3.38Å; C240-H260 VanDerWaalsContact SG-NE2 3.45Å
241	T	76.1	Confident	74.6	Confident	126 Å²	126	83.6 Å²	83.6	77%	0.773	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-19.4	179.2	50.3	0	0	0	0	113.3
242	V	76.8	Confident	74.8	Confident	91 Å²	91	83.6 Å²	83.6	55%	0.552	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-40.7	-174.4	179.5	0	0	0	0	113.1	C240 M257 H260	C240-V242 VanDerWaalsContact C-N 3.29Å; C240-V242 PolarHBondContact O-N 3.01Å; C240-V242 PolarHBondContact SG-N 2.89Å; C240-V242 VanDerWaalsContact SG-N 3.41Å; V242-M257 HydrophobicContact CG2-CE 3.87Å; V242-H260 HydrophobicContact CB-CB 4.48Å; V242-H260 HydrophobicContact CG1-CB 4.18Å; V242-H260 HydrophobicContact CG2-CB 4.49Å
243	C	78.2	Confident	74.7	Confident	46 Å²	46	81 Å²	81	31%	0.311	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.1	15.4	-177.4	75.6	0	0	0	0	113.9	C240 K245 H256 H260	C240-C243 PolarHBondContact SG-N 2.81Å; C240-C243 VanDerWaalsContact SG-N 3.44Å; C243-K245 PolarHBondContact O-N 3.41Å; C243-H256 PolarHBondContact SG-NE2 3.42Å; C243-H260 PolarHBondContact SG-CE1 2.92Å; C243-H260 PolarHBondContact SG-NE2 3.06Å
244	E	77.8	Confident	74.9	Confident	129 Å²	129	81.9 Å²	81.9	60%	0.603	42%	0.418	S	S	*	.			trans	60.3	1.4	175.2	-53.5	-153.9	113.6	0	0	116.8	K239 C240 T246	K239-E244 IonicContact NZ-OE1 3.45Å; K239-E244 PolarHBondContact NZ-OE1 3.26Å; C240-E244 WeakPolarHBondContact O-CA 3.34Å; C240-E244 PolarHBondContact O-N 3.1Å; C240-E244 VanDerWaalsContact O-N 3.08Å; E244-T246 PolarHBondContact O-N 3.4Å
245	K	77.1	Confident	75.1	Confident	125 Å²	125	80.8 Å²	80.8	54%	0.543	40%	0.396	S	S	.	.			trans	-61.6	135.7	176.7	-72.7	179.9	-174.7	171.9	0	111.2	C240 C243 F247	C240-K245 HydrophobicContact CB-CB 4.46Å; C240-K245 VanDerWaalsContact CB-O 3.27Å; C240-K245 WeakPolarHBondContact CB-O 3.49Å; C240-K245 PolarHBondContact N-O 3.16Å; C243-K245 PolarHBondContact O-N 3.41Å; K245-F247 HydrophobicContact CB-CE2 3.93Å; K245-F247 HydrophobicContact CB-CZ 3.94Å; K245-F247 VanDerWaalsContact O-CE2 3.3Å; K245-F247 WeakPolarHBondContact O-CE2 3.39Å
246	T	78	Confident	75.5	Confident	54 Å²	54	76.3 Å²	76.3	33%	0.331	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	140.3	-177.2	57.6	0	0	0	0	112.4	R236 Y238 K239 E244	R236-T246 WeakPolarHBondContact CB-OG1 3.45Å; R236-T246 VanDerWaalsContact CD-OG1 3.32Å; R236-T246 WeakPolarHBondContact CD-OG1 3.37Å; R236-T246 PolarHBondContact NE-O 3.28Å; Y238-T246 CarbonylContact O-C 3.45Å; Y238-T246 WeakPolarHBondContact O-CA 3.46Å; K239-T246 HydrophobicContact CB-CG2 4Å; K239-T246 HydrophobicContact CG-CG2 3.96Å; E244-T246 PolarHBondContact O-N 3.4Å
247	F	79.2	Confident	75.2	Confident	36 Å²	36	72.8 Å²	72.8	16%	0.158	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	149	-173.4	-57.5	-88.6	0	0	0	111.3	R236 Y238 C240 K245 H252 L253 H256	R236-F247 CarbonylContact C-O 3.32Å; R236-F247 VanDerWaalsContact C-O 3.31Å; R236-F247 WeakPolarHBondContact CA-O 3.45Å; Y238-F247 WeakPolarHBondContact CD2-O 3.49Å; Y238-F247 PolarHBondContact N-O 3.18Å; Y238-F247 PolarHBondContact O-N 2.85Å; C240-F247 HydrophobicContact CB-CE2 4.21Å; K245-F247 HydrophobicContact CB-CE2 3.93Å; K245-F247 HydrophobicContact CB-CZ 3.94Å; K245-F247 VanDerWaalsContact O-CE2 3.3Å; K245-F247 WeakPolarHBondContact O-CE2 3.39Å; F247-H252 HydrophobicContact CB-CB 4.21Å; F247-H252 HydrophobicContact CD1-CB 3.93Å; F247-H252 HydrophobicContact CG-CB 4.33Å; F247-L253 HydrophobicContact CB-CB 4.25Å; F247-L253 HydrophobicContact CD2-CB 3.78Å; F247-L253 HydrophobicContact CD2-CD1 3.7Å; F247-L253 HydrophobicContact CD2-CG 4.33Å; F247-L253 HydrophobicContact CE2-CD1 3.82Å; F247-L253 HydrophobicContact CG-CB 4.17Å; F247-H256 HydrophobicContact CE1-CB 3.87Å; F247-H256 HydrophobicContact CE2-CB 3.91Å; F247-H256 AromaticContact CE2-CD2 3.38Å; F247-H256 WeakPolarHBondContact CE2-CD2 3.49Å; F247-H256 AromaticContact CE2-CG 3.7Å; F247-H256 HydrophobicContact CZ-CB 3.4Å; F247-H256 AromaticContact CZ-CD2 3.31Å; F247-H256 WeakPolarHBondContact CZ-CD2 3.44Å; F247-H256 AromaticContact CZ-CG 3.17Å; F247-H256 AromaticContact CZ-ND1 3.76Å; F247-H256 AromaticContact CZ-NE2 3.91Å
248	K	74	Confident	75	Confident	44 Å²	44	71.4 Å²	71.4	19%	0.191	35%	0.35	C	S	.	.	S	Bend	trans	-80.2	-18.6	176.9	-62.8	-167.4	173.1	-146.6	0	113.4	R230 T231 S233 R236	R230-K248 PolarHBondContact O-NZ 3.07Å; T231-K248 PolarHBondContact O-NZ 2.8Å; S233-K248 PolarHBondContact O-NZ 3.41Å; S233-K248 VanDerWaalsContact O-NZ 3.11Å; R236-K248 HydrophobicContact CG-CG 4Å
249	H	74.8	Confident	74.4	Confident	44 Å²	44	72.3 Å²	72.3	20%	0.204	37%	0.37	C	S	.	.	S	Bend	trans	-132.9	140.8	-178.7	-58.1	-67.7	0	0	0	111.3	H227 S251 H252 L253	H227-H249 AromaticContact CG-CE1 3.87Å; H249-S251 VanDerWaalsContact C-N 3.33Å; H249-S251 PolarHBondContact O-N 3.33Å; H249-H252 HydrophobicContact CB-CB 4.45Å; H249-H252 AromaticContact CD2-CE1 3.66Å; H249-H252 AromaticContact CD2-ND1 3.78Å; H249-H252 WeakPolarHBondContact O-CB 3.14Å; H249-H252 PolarHBondContact O-N 3.3Å; H249-H252 VanDerWaalsContact O-N 3.14Å; H249-L253 PolarHBondContact O-N 2.99Å
250	R	73.6	Confident	73.9	Confident	172 Å²	172	70.6 Å²	70.6	65%	0.649	36%	0.363	S	S	*	.	H	α-helix	trans	-58.2	-43.3	176.3	-175.6	178.3	170.6	94.1	-0.6	111.9	Y238 H252 L253 V254	Y238-R250 HydrophobicContact CD1-CB 3.95Å; Y238-R250 HydrophobicContact CD1-CG 4.41Å; Y238-R250 HydrophobicContact CE1-CB 3.7Å; Y238-R250 HydrophobicContact CE1-CG 4.32Å; Y238-R250 HydrophobicContact CE2-CB 4.4Å; Y238-R250 HydrophobicContact CG-CB 4.41Å; R250-H252 PolarHBondContact O-N 3.02Å; R250-L253 PolarHBondContact O-N 3.49Å; R250-L253 VanDerWaalsContact O-N 3.11Å; R250-V254 HydrophobicContact CG-CG2 4.28Å; R250-V254 WeakPolarHBondContact O-CG2 3.14Å; R250-V254 PolarHBondContact O-N 3.36Å
251	S	70.8	Confident	73.2	Confident	76 Å²	76	73.7 Å²	73.7	53%	0.531	39%	0.385	S	S	.	.	H	α-helix	trans	-57.7	-34.4	177.7	54.2	0	0	0	0	112.8	H249 R255	H249-S251 VanDerWaalsContact C-N 3.33Å; H249-S251 PolarHBondContact O-N 3.33Å; S251-R255 WeakPolarHBondContact O-CB 3.39Å; S251-R255 PolarHBondContact O-N 2.95Å
252	H	77.7	Confident	72.3	Confident	72 Å²	72	70.1 Å²	70.1	33%	0.333	37%	0.373	S	S	.	.	H	α-helix	trans	-74.4	-37.1	177.5	-65.5	179.7	0	0	0	112.4	F247 H249 R250 R255 H256	F247-H252 HydrophobicContact CB-CB 4.21Å; F247-H252 HydrophobicContact CD1-CB 3.93Å; F247-H252 HydrophobicContact CG-CB 4.33Å; H249-H252 HydrophobicContact CB-CB 4.45Å; H249-H252 AromaticContact CD2-CE1 3.66Å; H249-H252 AromaticContact CD2-ND1 3.78Å; H249-H252 WeakPolarHBondContact O-CB 3.14Å; H249-H252 PolarHBondContact O-N 3.3Å; H249-H252 VanDerWaalsContact O-N 3.14Å; R250-H252 PolarHBondContact O-N 3.02Å; H252-R255 PolarHBondContact CD2-NH2 3.31Å; H252-R255 VanDerWaalsContact CD2-NH2 3.32Å; H252-H256 VanDerWaalsContact O-CB 3.25Å; H252-H256 WeakPolarHBondContact O-CB 3.27Å; H252-H256 PolarHBondContact O-N 3.08Å
253	L	73.9	Confident	71.4	Confident	27 Å²	27	72.3 Å²	72.3	14%	0.141	38%	0.377	C	S	.	.	H	α-helix	trans	-63.3	-50.1	171.9	171.2	61.3	0	0	0	110.2	C240 F247 H249 R250 R255 H256 M257	C240-L253 HydrophobicContact CB-CD1 3.75Å; F247-L253 HydrophobicContact CB-CB 4.25Å; F247-L253 HydrophobicContact CD2-CB 3.78Å; F247-L253 HydrophobicContact CD2-CD1 3.7Å; F247-L253 HydrophobicContact CD2-CG 4.33Å; F247-L253 HydrophobicContact CE2-CD1 3.82Å; F247-L253 HydrophobicContact CG-CB 4.17Å; H249-L253 PolarHBondContact O-N 2.99Å; R250-L253 PolarHBondContact O-N 3.49Å; R250-L253 VanDerWaalsContact O-N 3.11Å; L253-R255 VanDerWaalsContact C-N 3.33Å; L253-R255 PolarHBondContact O-N 3.21Å; L253-H256 CarbonylContact O-C 3.32Å; L253-H256 WeakPolarHBondContact O-CA 3.08Å; L253-H256 WeakPolarHBondContact O-CB 3.47Å; L253-H256 PolarHBondContact O-N 2.8Å; L253-M257 HydrophobicContact CD1-CG 4.15Å; L253-M257 HydrophobicContact CD1-SD 4.07Å; L253-M257 HydrophobicContact CG-CG 4.44Å; L253-M257 WeakPolarHBondContact O-CG 3.17Å; L253-M257 PolarHBondContact O-N 3.39Å
254	V	70.8	Confident	70.4	Confident	55 Å²	55	74 Å²	74	33%	0.333	38%	0.38	S	S	.	.	H	α-helix	trans	-57.1	-46.9	178.2	173.9	0	0	0	0	110.6	R250 H256 M257 Y258	R250-V254 HydrophobicContact CG-CG2 4.28Å; R250-V254 WeakPolarHBondContact O-CG2 3.14Å; R250-V254 PolarHBondContact O-N 3.36Å; V254-H256 VanDerWaalsContact C-N 3.27Å; V254-H256 PolarHBondContact O-N 3.33Å; V254-M257 PolarHBondContact O-N 2.94Å; V254-M257 VanDerWaalsContact O-N 3.14Å; V254-Y258 HydrophobicContact CG1-CE2 3.88Å; V254-Y258 WeakPolarHBondContact CG1-OH 3.35Å; V254-Y258 VanDerWaalsContact O-CD2 3.31Å; V254-Y258 WeakPolarHBondContact O-CD2 3.31Å; V254-Y258 VanDerWaalsContact O-CE2 3.31Å; V254-Y258 WeakPolarHBondContact O-CE2 3.45Å
255	R	68.1	Low	69.5	Low	93 Å²	93	72.6 Å²	72.6	35%	0.351	38%	0.377	S	S	.	.	H	α-helix	trans	-59.1	-38.2	174.3	-176.2	175.1	58.6	-163.1	-9.4	113	S251 H252 L253 E277	S251-R255 WeakPolarHBondContact O-CB 3.39Å; S251-R255 PolarHBondContact O-N 2.95Å; H252-R255 PolarHBondContact CD2-NH2 3.31Å; H252-R255 VanDerWaalsContact CD2-NH2 3.32Å; L253-R255 VanDerWaalsContact C-N 3.33Å; L253-R255 PolarHBondContact O-N 3.21Å; R255-E277 IonicContact CZ-OE2 3.59Å; R255-E277 IonicContact NH1-OE2 3.81Å; R255-E277 PolarHBondContact NH1-OE2 3.21Å
256	H	75	Confident	68.7	Low	31 Å²	31	69.7 Å²	69.7	14%	0.144	36%	0.364	C	S	.	.	H	α-helix	trans	-69.7	-33.8	178	170.6	67.2	0	0	0	112.6	C240 C243 F247 H252 L253 V254 Y258 A259 H260	C240-H256 PolarHBondContact SG-NE2 3.1Å; C243-H256 PolarHBondContact SG-NE2 3.42Å; F247-H256 HydrophobicContact CE1-CB 3.87Å; F247-H256 HydrophobicContact CE2-CB 3.91Å; F247-H256 AromaticContact CE2-CD2 3.38Å; F247-H256 WeakPolarHBondContact CE2-CD2 3.49Å; F247-H256 AromaticContact CE2-CG 3.7Å; F247-H256 HydrophobicContact CZ-CB 3.4Å; F247-H256 AromaticContact CZ-CD2 3.31Å; F247-H256 WeakPolarHBondContact CZ-CD2 3.44Å; F247-H256 AromaticContact CZ-CG 3.17Å; F247-H256 AromaticContact CZ-ND1 3.76Å; F247-H256 AromaticContact CZ-NE2 3.91Å; H252-H256 VanDerWaalsContact O-CB 3.25Å; H252-H256 WeakPolarHBondContact O-CB 3.27Å; H252-H256 PolarHBondContact O-N 3.08Å; L253-H256 CarbonylContact O-C 3.32Å; L253-H256 WeakPolarHBondContact O-CA 3.08Å; L253-H256 WeakPolarHBondContact O-CB 3.47Å; L253-H256 PolarHBondContact O-N 2.8Å; V254-H256 VanDerWaalsContact C-N 3.27Å; V254-H256 PolarHBondContact O-N 3.33Å; H256-Y258 PolarHBondContact O-N 2.99Å; H256-A259 VanDerWaalsContact O-CB 3.31Å; H256-A259 WeakPolarHBondContact O-CB 3.48Å; H256-A259 PolarHBondContact O-N 3.35Å; H256-H260 AromaticContact CD2-NE2 3.8Å; H256-H260 AromaticContact CE1-NE2 3.35Å; H256-H260 PolarHBondContact CE1-NE2 3.06Å; H256-H260 AromaticContact NE2-CD2 3.75Å; H256-H260 AromaticContact NE2-NE2 2.98Å; H256-H260 PolarHBondContact NE2-NE2 3.34Å
257	M	66.4	Low	67.6	Low	55 Å²	55	71.1 Å²	71.1	27%	0.271	37%	0.366	S	S	.	.	H	α-helix	trans	-61.6	-29.9	177.9	-67.3	-54.9	-64.7	0	0	112.6	C240 V242 L253 V254 A259 H260 S261	C240-M257 HydrophobicContact CB-SD 4.3Å; C240-M257 PolarHBondContact SG-SD 3.49Å; V242-M257 HydrophobicContact CG2-CE 3.87Å; L253-M257 HydrophobicContact CD1-CG 4.15Å; L253-M257 HydrophobicContact CD1-SD 4.07Å; L253-M257 HydrophobicContact CG-CG 4.44Å; L253-M257 WeakPolarHBondContact O-CG 3.17Å; L253-M257 PolarHBondContact O-N 3.39Å; V254-M257 PolarHBondContact O-N 2.94Å; V254-M257 VanDerWaalsContact O-N 3.14Å; M257-A259 PolarHBondContact O-N 2.77Å; M257-H260 WeakPolarHBondContact O-CB 3.41Å; M257-H260 PolarHBondContact O-N 3.34Å; M257-S261 PolarHBondContact O-N 3.39Å; M257-S261 VanDerWaalsContact O-N 3.12Å
258	Y	70.1	Confident	66.7	Low	51 Å²	51	69.5 Å²	69.5	20%	0.2	36%	0.359	C	S	.	.	H	α-helix	trans	-63.8	-25.2	173.5	-59.7	-56.4	0	0	0	113.8	V254 H256 H260 G262 E263 L265	V254-Y258 HydrophobicContact CG1-CE2 3.88Å; V254-Y258 WeakPolarHBondContact CG1-OH 3.35Å; V254-Y258 VanDerWaalsContact O-CD2 3.31Å; V254-Y258 WeakPolarHBondContact O-CD2 3.31Å; V254-Y258 VanDerWaalsContact O-CE2 3.31Å; V254-Y258 WeakPolarHBondContact O-CE2 3.45Å; H256-Y258 PolarHBondContact O-N 2.99Å; Y258-H260 PolarHBondContact O-N 3.45Å; Y258-G262 PolarHBondContact O-N 3.21Å; Y258-G262 VanDerWaalsContact O-N 3.1Å; Y258-E263 VanDerWaalsContact CD1-O 3.23Å; Y258-E263 WeakPolarHBondContact CD1-O 3.35Å; Y258-L265 HydrophobicContact CD1-CG 4.44Å; Y258-L265 HydrophobicContact CE1-CD1 4.05Å; Y258-L265 HydrophobicContact CE1-CD2 4.02Å; Y258-L265 HydrophobicContact CE1-CG 3.84Å; Y258-L265 HydrophobicContact CE2-CD1 3.66Å; Y258-L265 HydrophobicContact CE2-CG 4.2Å; Y258-L265 VanDerWaalsContact CZ-CD1 3.41Å; Y258-L265 WeakPolarHBondContact OH-CD1 3.19Å
259	A	66.6	Low	65.9	Low	81 Å²	81	74.4 Å²	74.4	67%	0.669	39%	0.387	S	S	*	.	H	α-helix	trans	-71	-17.5	173.6	0	0	0	0	0	112.6	H256 M257	H256-A259 VanDerWaalsContact O-CB 3.31Å; H256-A259 WeakPolarHBondContact O-CB 3.48Å; H256-A259 PolarHBondContact O-N 3.35Å; M257-A259 PolarHBondContact O-N 2.77Å
260	H	66.7	Low	65.2	Low	74 Å²	74	76.9 Å²	76.9	34%	0.343	41%	0.406	S	S	.	.	H	α-helix	trans	-94.8	-39.1	175.6	-64.5	-60.6	0	0	0	112.5	C240 V242 C243 H256 M257 Y258	C240-H260 PolarHBondContact SG-NE2 3.38Å; C240-H260 VanDerWaalsContact SG-NE2 3.45Å; V242-H260 HydrophobicContact CB-CB 4.48Å; V242-H260 HydrophobicContact CG1-CB 4.18Å; V242-H260 HydrophobicContact CG2-CB 4.49Å; C243-H260 PolarHBondContact SG-CE1 2.92Å; C243-H260 PolarHBondContact SG-NE2 3.06Å; H256-H260 AromaticContact CD2-NE2 3.8Å; H256-H260 AromaticContact CE1-NE2 3.35Å; H256-H260 PolarHBondContact CE1-NE2 3.06Å; H256-H260 AromaticContact NE2-CD2 3.75Å; H256-H260 AromaticContact NE2-NE2 2.98Å; H256-H260 PolarHBondContact NE2-NE2 3.34Å; M257-H260 WeakPolarHBondContact O-CB 3.41Å; M257-H260 PolarHBondContact O-N 3.34Å; Y258-H260 PolarHBondContact O-N 3.45Å
261	S	64.7	Low	64.4	Low	66 Å²	66	71.3 Å²	71.3	46%	0.462	39%	0.392	S	S	.	.	H	α-helix	trans	-80.8	-19.6	-178.9	60.4	0	0	0	0	113.7	M257 E263	M257-S261 PolarHBondContact O-N 3.39Å; M257-S261 VanDerWaalsContact O-N 3.12Å; S261-E263 PolarHBondContact O-N 3.49Å; S261-E263 VanDerWaalsContact O-N 3.09Å; S261-E263 PolarHBondContact OG-N 2.9Å
262	G	58.3	Low	63.9	Low	50 Å²	50	73.6 Å²	73.6	52%	0.515	39%	0.394	S	S	.	.			trans	69.4	-1.6	-173.3	0	0	0	0	0	113.7	Y258 H264	Y258-G262 PolarHBondContact O-N 3.21Å; Y258-G262 VanDerWaalsContact O-N 3.1Å; G262-H264 PolarHBondContact O-CD2 3.33Å; G262-H264 VanDerWaalsContact O-CD2 3.23Å; G262-H264 PolarHBondContact O-N 3.29Å
263	E	57	Low	62.8	Low	137 Å²	137	74.8 Å²	74.8	64%	0.64	40%	0.403	S	S	*	.			trans	-78.4	114.7	175.7	-65.7	-173.4	158.8	0	0	109.6	Y258 S261	Y258-E263 VanDerWaalsContact CD1-O 3.23Å; Y258-E263 WeakPolarHBondContact CD1-O 3.35Å; S261-E263 PolarHBondContact O-N 3.49Å; S261-E263 VanDerWaalsContact O-N 3.09Å; S261-E263 PolarHBondContact OG-N 2.9Å
264	H	58.1	Low	62.3	Low	81 Å²	81	78.1 Å²	78.1	38%	0.375	42%	0.417	S	S	.	.			trans	-100.4	118.8	177.3	-68.8	-81.4	0	0	0	109.5	G262 F266 H274 F275	G262-H264 PolarHBondContact O-CD2 3.33Å; G262-H264 VanDerWaalsContact O-CD2 3.23Å; G262-H264 PolarHBondContact O-N 3.29Å; H264-F266 PolarHBondContact O-N 3.48Å; H264-H274 HydrophobicContact CB-CB 3.49Å; H264-H274 VanDerWaalsContact CB-CB 3.49Å; H264-H274 VanDerWaalsContact CD2-CB 3.49Å; H264-H274 WeakPolarHBondContact CD2-CB 3.39Å; H264-F275 WeakPolarHBondContact CB-O 3.49Å
265	L	57.8	Low	62	Low	101 Å²	101	77 Å²	77	53%	0.529	41%	0.408	S	S	.	.	S	Bend	trans	-67.8	-19.2	-176.8	-67.4	178.6	0	0	0	114.4	Y258	Y258-L265 HydrophobicContact CD1-CG 4.44Å; Y258-L265 HydrophobicContact CE1-CD1 4.05Å; Y258-L265 HydrophobicContact CE1-CD2 4.02Å; Y258-L265 HydrophobicContact CE1-CG 3.84Å; Y258-L265 HydrophobicContact CE2-CD1 3.66Å; Y258-L265 HydrophobicContact CE2-CG 4.2Å; Y258-L265 VanDerWaalsContact CZ-CD1 3.41Å; Y258-L265 WeakPolarHBondContact OH-CD1 3.19Å
266	F	60.4	Low	61.6	Low	63 Å²	63	77.6 Å²	77.6	28%	0.276	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	105.1	-169.4	-58.7	-74.4	0	0	0	110.1	H264 F275 L281	H264-F266 PolarHBondContact O-N 3.48Å; F266-F275 HydrophobicContact CB-CB 4.13Å; F266-F275 PolarHBondContact N-O 3.14Å; F266-F275 WeakPolarHBondContact O-CD2 3.35Å; F266-F275 PolarHBondContact O-N 3.02Å; F266-L281 HydrophobicContact CB-CB 4.03Å; F266-L281 HydrophobicContact CB-CD2 3.79Å
267	K	56	Low	60.9	Low	84 Å²	84	78.9 Å²	78.9	37%	0.365	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	133.9	175.5	-177.6	180	175.6	-177.4	0	109.7	N269 E272 L273	K267-N269 PolarHBondContact O-OD1 3.16Å; K267-E272 WeakPolarHBondContact CE-OE1 3.4Å; K267-E272 IonicContact NZ-OE1 2.77Å; K267-E272 PolarHBondContact NZ-OE1 3.27Å; K267-L273 WeakPolarHBondContact CA-O 3.4Å
268	C	60.3	Low	60.5	Low	2 Å²	2	78.7 Å²	78.7	1%	0.014	42%	0.424	C	S	.	.			trans	-77.8	122.9	164.1	161.1	0	0	0	0	107.5	V270 C271 E272 L273 F275 L281 H284 C286	C268-V270 PolarHBondContact O-N 3.37Å; C268-V270 VanDerWaalsContact O-N 3.12Å; C268-C271 PolarHBondContact SG-SG 3.14Å; C268-E272 WeakPolarHBondContact O-CA 3.38Å; C268-E272 PolarHBondContact O-N 2.73Å; C268-L273 PolarHBondContact N-O 2.82Å; C268-F275 HydrophobicContact CB-CE2 4.03Å; C268-L281 HydrophobicContact CB-CD1 3.58Å; C268-H284 VanDerWaalsContact SG-CD2 3.51Å; C268-C286 WeakPolarHBondContact CB-SG 3.27Å; C268-C286 WeakPolarHBondContact SG-CB 3.32Å; C268-C286 CovalentContact SG-SG 2.11Å; C268-C286 PolarHBondContact SG-SG 3.22Å
269	N	57	Low	60.2	Low	147 Å²	147	78.1 Å²	78.1	79%	0.786	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-3.4	-176.6	-61.2	-13.5	0	0	0	113.2	K267	K267-N269 PolarHBondContact O-OD1 3.16Å
270	V	59.3	Low	60	Low	97 Å²	97	77.4 Å²	77.4	59%	0.588	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-41.4	-178.3	-177.8	0	0	0	0	112.5	C268 C286	C268-V270 PolarHBondContact O-N 3.37Å; C268-V270 VanDerWaalsContact O-N 3.12Å; V270-C286 VanDerWaalsContact CB-SG 3.56Å; V270-C286 WeakPolarHBondContact CG2-SG 3.25Å
271	C	58.1	Low	59.8	Low	54 Å²	54	75.8 Å²	75.8	37%	0.365	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	3.9	-175.5	69.6	0	0	0	0	113.8	C268 L273 H284	C268-C271 PolarHBondContact SG-SG 3.14Å; C271-L273 HydrophobicContact CB-CG 4.43Å; C271-L273 PolarHBondContact O-N 2.77Å; C271-L273 VanDerWaalsContact SG-CB 3.57Å; C271-L273 VanDerWaalsContact SG-CG 3.58Å; C271-H284 PolarHBondContact SG-NE2 3.33Å
272	E	59.1	Low	59.6	Low	125 Å²	125	79.4 Å²	79.4	58%	0.584	42%	0.417	S	S	*	.			trans	54.6	15.1	-177.6	-51.5	-149.4	118.9	0	0	115.2	K267 C268 H274	K267-E272 WeakPolarHBondContact CE-OE1 3.4Å; K267-E272 IonicContact NZ-OE1 2.77Å; K267-E272 PolarHBondContact NZ-OE1 3.27Å; C268-E272 WeakPolarHBondContact O-CA 3.38Å; C268-E272 PolarHBondContact O-N 2.73Å; E272-H274 PolarHBondContact O-CE1 2.99Å; E272-H274 VanDerWaalsContact O-CE1 3.25Å; E272-H274 PolarHBondContact O-ND1 2.77Å
273	L	55.9	Low	59.5	Low	96 Å²	96	82 Å²	82	50%	0.503	42%	0.416	S	S	.	.			trans	-74.6	144.9	173.9	-67.6	176.5	0	0	0	110.9	K267 C268 C271 F275	K267-L273 WeakPolarHBondContact CA-O 3.4Å; C268-L273 PolarHBondContact N-O 2.82Å; C271-L273 HydrophobicContact CB-CG 4.43Å; C271-L273 PolarHBondContact O-N 2.77Å; C271-L273 VanDerWaalsContact SG-CB 3.57Å; C271-L273 VanDerWaalsContact SG-CG 3.58Å; L273-F275 HydrophobicContact CB-CE2 3.98Å; L273-F275 HydrophobicContact CB-CZ 3.97Å; L273-F275 WeakPolarHBondContact O-CE2 3.5Å
274	H	62	Low	59.8	Low	98 Å²	98	77.3 Å²	77.3	45%	0.454	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	129.6	-168.7	-78.1	88.9	0	0	0	109.8	H264 E272	H264-H274 HydrophobicContact CB-CB 3.49Å; H264-H274 VanDerWaalsContact CB-CB 3.49Å; H264-H274 VanDerWaalsContact CD2-CB 3.49Å; H264-H274 WeakPolarHBondContact CD2-CB 3.39Å; E272-H274 PolarHBondContact O-CE1 2.99Å; E272-H274 VanDerWaalsContact O-CE1 3.25Å; E272-H274 PolarHBondContact O-ND1 2.77Å
275	F	64.4	Low	59.6	Low	31 Å²	31	75.6 Å²	75.6	14%	0.136	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	144.3	-174.8	-57.9	-87.3	0	0	0	111.3	H264 F266 C268 L273 E280 L281 H284	H264-F275 WeakPolarHBondContact CB-O 3.49Å; F266-F275 HydrophobicContact CB-CB 4.13Å; F266-F275 PolarHBondContact N-O 3.14Å; F266-F275 WeakPolarHBondContact O-CD2 3.35Å; F266-F275 PolarHBondContact O-N 3.02Å; C268-F275 HydrophobicContact CB-CE2 4.03Å; L273-F275 HydrophobicContact CB-CE2 3.98Å; L273-F275 HydrophobicContact CB-CZ 3.97Å; L273-F275 WeakPolarHBondContact O-CE2 3.5Å; F275-E280 HydrophobicContact CB-CB 4.31Å; F275-E280 HydrophobicContact CD1-CB 4.03Å; F275-L281 HydrophobicContact CB-CB 4.27Å; F275-L281 HydrophobicContact CD2-CB 3.98Å; F275-L281 HydrophobicContact CD2-CD1 3.68Å; F275-L281 HydrophobicContact CD2-CG 4.4Å; F275-L281 HydrophobicContact CE2-CD1 3.79Å; F275-L281 HydrophobicContact CG-CB 4.17Å; F275-H284 HydrophobicContact CE1-CB 3.88Å; F275-H284 AromaticContact CE1-CG 3.99Å; F275-H284 AromaticContact CE1-ND1 3.91Å; F275-H284 HydrophobicContact CE2-CB 4.07Å; F275-H284 AromaticContact CE2-CG 3.86Å; F275-H284 HydrophobicContact CZ-CB 3.56Å; F275-H284 AromaticContact CZ-CD2 3.84Å; F275-H284 AromaticContact CZ-CE1 3.84Å; F275-H284 AromaticContact CZ-CG 3.26Å; F275-H284 AromaticContact CZ-ND1 3.29Å; F275-H284 VanDerWaalsContact CZ-ND1 3.29Å; F275-H284 WeakPolarHBondContact CZ-ND1 3.48Å
276	K	59.6	Low	59.4	Low	105 Å²	105	73.4 Å²	73.4	46%	0.457	38%	0.382	S	S	.	.	S	Bend	trans	-84.2	-11.5	179.1	59.1	-178.7	179.8	-166.6	0	113.2	E280	K276-E280 VanDerWaalsContact CE-CD 3.4Å; K276-E280 WeakPolarHBondContact CE-OE1 3.31Å; K276-E280 WeakPolarHBondContact CE-OE2 3.38Å; K276-E280 WeakPolarHBondContact CG-OE2 3.38Å; K276-E280 IonicContact NZ-OE1 2.78Å
277	E	60.2	Low	59	Low	58 Å²	58	73.7 Å²	73.7	27%	0.271	39%	0.389	S	S	.	.	S	Bend	trans	-144.3	141.9	-179.6	-165.7	174.6	147.8	0	0	111.8	R255 S279 E280 L281	R255-E277 IonicContact CZ-OE2 3.59Å; R255-E277 IonicContact NH1-OE2 3.81Å; R255-E277 PolarHBondContact NH1-OE2 3.21Å; E277-S279 VanDerWaalsContact CG-OG 3.3Å; E277-S279 WeakPolarHBondContact CG-OG 3.44Å; E277-S279 PolarHBondContact O-N 2.74Å; E277-S279 PolarHBondContact OE1-OG 2.78Å; E277-E280 HydrophobicContact CB-CB 4.4Å; E277-E280 HydrophobicContact CB-CG 4.02Å; E277-E280 WeakPolarHBondContact O-CB 3.5Å; E277-E280 PolarHBondContact O-N 2.94Å; E277-L281 PolarHBondContact O-N 3.22Å
278	S	58.8	Low	58.6	Low	52 Å²	52	76.5 Å²	76.5	36%	0.364	42%	0.416	S	S	.	.	H	α-helix	trans	-58.7	-36.7	177.1	177.1	0	0	0	0	112.1	E280 L281 L282	S278-E280 VanDerWaalsContact C-N 3.27Å; S278-E280 PolarHBondContact O-N 3.26Å; S278-L281 PolarHBondContact O-N 3.26Å; S278-L282 WeakPolarHBondContact O-CB 3.13Å; S278-L282 WeakPolarHBondContact O-CG 3.4Å; S278-L282 PolarHBondContact O-N 3.13Å
279	S	62.8	Low	58.2	Low	39 Å²	39	78.9 Å²	78.9	27%	0.273	43%	0.433	S	S	.	.	H	α-helix	trans	-65.1	-30.9	176.7	68.2	0	0	0	0	112.7	E277 Q283	E277-S279 VanDerWaalsContact CG-OG 3.3Å; E277-S279 WeakPolarHBondContact CG-OG 3.44Å; E277-S279 PolarHBondContact O-N 2.74Å; E277-S279 PolarHBondContact OE1-OG 2.78Å; S279-Q283 VanDerWaalsContact O-CB 3.31Å; S279-Q283 WeakPolarHBondContact O-CB 3.08Å; S279-Q283 WeakPolarHBondContact O-CG 3.12Å; S279-Q283 PolarHBondContact O-N 2.73Å
280	E	63.3	Low	58.2	Low	65 Å²	65	75.3 Å²	75.3	30%	0.304	43%	0.43	S	S	.	.	H	α-helix	trans	-74.9	-35.9	175.8	-66.7	179.1	177.9	0	0	111.5	F275 K276 E277 S278 Q283 H284	F275-E280 HydrophobicContact CB-CB 4.31Å; F275-E280 HydrophobicContact CD1-CB 4.03Å; K276-E280 VanDerWaalsContact CE-CD 3.4Å; K276-E280 WeakPolarHBondContact CE-OE1 3.31Å; K276-E280 WeakPolarHBondContact CE-OE2 3.38Å; K276-E280 WeakPolarHBondContact CG-OE2 3.38Å; K276-E280 IonicContact NZ-OE1 2.78Å; E277-E280 HydrophobicContact CB-CB 4.4Å; E277-E280 HydrophobicContact CB-CG 4.02Å; E277-E280 WeakPolarHBondContact O-CB 3.5Å; E277-E280 PolarHBondContact O-N 2.94Å; S278-E280 VanDerWaalsContact C-N 3.27Å; S278-E280 PolarHBondContact O-N 3.26Å; E280-Q283 CarbonylContact O-C 3.54Å; E280-H284 WeakPolarHBondContact O-CB 3.23Å; E280-H284 PolarHBondContact O-N 3.22Å
281	L	61.5	Low	58.1	Low	41 Å²	41	76 Å²	76	22%	0.215	43%	0.427	C	S	.	.	H	α-helix	trans	-68.4	-41.5	170.7	175.6	62.4	0	0	0	111.8	F266 C268 F275 E277 S278 Q283 H284	F266-L281 HydrophobicContact CB-CB 4.03Å; F266-L281 HydrophobicContact CB-CD2 3.79Å; C268-L281 HydrophobicContact CB-CD1 3.58Å; F275-L281 HydrophobicContact CB-CB 4.27Å; F275-L281 HydrophobicContact CD2-CB 3.98Å; F275-L281 HydrophobicContact CD2-CD1 3.68Å; F275-L281 HydrophobicContact CD2-CG 4.4Å; F275-L281 HydrophobicContact CE2-CD1 3.79Å; F275-L281 HydrophobicContact CG-CB 4.17Å; E277-L281 PolarHBondContact O-N 3.22Å; S278-L281 PolarHBondContact O-N 3.26Å; L281-Q283 VanDerWaalsContact C-N 3.27Å; L281-Q283 PolarHBondContact O-N 3.43Å; L281-H284 VanDerWaalsContact O-CB 3.27Å; L281-H284 WeakPolarHBondContact O-CB 3.42Å; L281-H284 PolarHBondContact O-N 2.98Å; L281-H284 VanDerWaalsContact O-N 3.09Å
282	L	61	Low	58.5	Low	142 Å²	142	79.5 Å²	79.5	74%	0.743	43%	0.433	S	S	*	.	H	α-helix	trans	-67.2	-28.2	176.4	-72.5	170.2	0	0	0	112.7	S278	S278-L282 WeakPolarHBondContact O-CB 3.13Å; S278-L282 WeakPolarHBondContact O-CG 3.4Å; S278-L282 PolarHBondContact O-N 3.13Å
283	Q	57.1	Low	59	Low	105 Å²	105	78 Å²	78	49%	0.491	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-8.1	172.8	-70.3	173.8	34.6	0	0	112.8	S279 E280 L281 P285	S279-Q283 VanDerWaalsContact O-CB 3.31Å; S279-Q283 WeakPolarHBondContact O-CB 3.08Å; S279-Q283 WeakPolarHBondContact O-CG 3.12Å; S279-Q283 PolarHBondContact O-N 2.73Å; E280-Q283 CarbonylContact O-C 3.54Å; L281-Q283 VanDerWaalsContact C-N 3.27Å; L281-Q283 PolarHBondContact O-N 3.43Å; Q283-P285 WeakPolarHBondContact O-CD 3.17Å
284	H	63	Low	59.9	Low	38 Å²	38	76.9 Å²	76.9	18%	0.176	43%	0.425	C	S	.	.	S	Bend	trans	-72.5	119.9	173.4	175.9	70.7	0	0	0	107.7	C268 C271 F275 E280 L281 C286	C268-H284 VanDerWaalsContact SG-CD2 3.51Å; C271-H284 PolarHBondContact SG-NE2 3.33Å; F275-H284 HydrophobicContact CE1-CB 3.88Å; F275-H284 AromaticContact CE1-CG 3.99Å; F275-H284 AromaticContact CE1-ND1 3.91Å; F275-H284 HydrophobicContact CE2-CB 4.07Å; F275-H284 AromaticContact CE2-CG 3.86Å; F275-H284 HydrophobicContact CZ-CB 3.56Å; F275-H284 AromaticContact CZ-CD2 3.84Å; F275-H284 AromaticContact CZ-CE1 3.84Å; F275-H284 AromaticContact CZ-CG 3.26Å; F275-H284 AromaticContact CZ-ND1 3.29Å; F275-H284 VanDerWaalsContact CZ-ND1 3.29Å; F275-H284 WeakPolarHBondContact CZ-ND1 3.48Å; E280-H284 WeakPolarHBondContact O-CB 3.23Å; E280-H284 PolarHBondContact O-N 3.22Å; L281-H284 VanDerWaalsContact O-CB 3.27Å; L281-H284 WeakPolarHBondContact O-CB 3.42Å; L281-H284 PolarHBondContact O-N 2.98Å; L281-H284 VanDerWaalsContact O-N 3.09Å; H284-C286 VanDerWaalsContact C-N 3.26Å; H284-C286 PolarHBondContact O-N 3.3Å
285	P	53.8	Low	60.8	Low	45 Å²	45	79.2 Å²	79.2	29%	0.292	43%	0.43	S	S	.	.			trans	-69.6	90.1	176.2	28	-30.9	0	0	0	108	Q283 T287	Q283-P285 WeakPolarHBondContact O-CD 3.17Å; P285-T287 PolarHBondContact O-N 3.24Å
286	C	52.9	Low	61.7	Low	55 Å²	55	77.8 Å²	77.8	37%	0.372	42%	0.424	S	S	.	.			trans	-84.4	69.3	174.6	-150	0	0	0	0	104.8	C268 V270 H284	C268-C286 WeakPolarHBondContact CB-SG 3.27Å; C268-C286 WeakPolarHBondContact SG-CB 3.32Å; C268-C286 CovalentContact SG-SG 2.11Å; C268-C286 PolarHBondContact SG-SG 3.22Å; V270-C286 VanDerWaalsContact CB-SG 3.56Å; V270-C286 WeakPolarHBondContact CG2-SG 3.25Å; H284-C286 VanDerWaalsContact C-N 3.26Å; H284-C286 PolarHBondContact O-N 3.3Å
287	T	51.7	Low	62.7	Low	69 Å²	69	75.8 Å²	75.8	42%	0.423	43%	0.432	S	S	.	.	S	Bend	trans	-132.9	144.1	167.6	50	0	0	0	0	109.3	P285 S289	P285-T287 PolarHBondContact O-N 3.24Å; T287-S289 PolarHBondContact O-N 3.04Å; T287-S289 PolarHBondContact OG1-O 3.44Å
288	P	48.9	Very low	63.5	Low	142 Å²	142	80.1 Å²	80.1	92%	0.922	45%	0.453	S	S	*	.	S	Bend	trans	-62.6	-16.1	-174.5	-20.9	32	0	0	0	114.9
289	S	52.4	Low	64.5	Low	53 Å²	53	80 Å²	80	37%	0.371	45%	0.451	S	S	.	.	S	Bend	trans	-112.1	134.4	176.3	138.3	0	0	0	0	106.4	T287 E291	T287-S289 PolarHBondContact O-N 3.04Å; T287-S289 PolarHBondContact OG1-O 3.44Å; S289-E291 WeakPolarHBondContact CB-OE1 3.24Å; S289-E291 PolarHBondContact O-N 3.49Å; S289-E291 VanDerWaalsContact OG-CG 3.25Å; S289-E291 WeakPolarHBondContact OG-CG 2.92Å; S289-E291 PolarHBondContact OG-OE1 2.93Å
290	G	55.6	Low	65.3	Low	71 Å²	71	83.7 Å²	83.7	73%	0.732	46%	0.464	S	S	*	.			trans	-67.4	47.6	178.7	0	0	0	0	0	113.6	R292	G290-R292 PolarHBondContact O-N 3.37Å
291	E	57.1	Low	65.9	Low	112 Å²	112	86.7 Å²	86.7	52%	0.523	48%	0.476	S	S	.	.			trans	-63.4	132	-176.8	-98	161.2	-124	0	0	110.2	S289 P293	S289-E291 WeakPolarHBondContact CB-OE1 3.24Å; S289-E291 PolarHBondContact O-N 3.49Å; S289-E291 VanDerWaalsContact OG-CG 3.25Å; S289-E291 WeakPolarHBondContact OG-CG 2.92Å; S289-E291 PolarHBondContact OG-OE1 2.93Å; E291-P293 WeakPolarHBondContact O-CD 3.44Å
292	R	66.9	Low	66.8	Low	128 Å²	128	85.3 Å²	85.3	48%	0.483	47%	0.471	S	S	.	.			trans	-113	90.5	-178.3	-79.1	158.9	171.6	-136.6	14.9	104.2	G290 F294 A302 F303 K304	G290-R292 PolarHBondContact O-N 3.37Å; R292-F294 PolarHBondContact O-N 3.47Å; R292-F294 VanDerWaalsContact O-N 3.14Å; R292-A302 HydrophobicContact CB-CB 3.28Å; R292-A302 VanDerWaalsContact CD-O 3.28Å; R292-A302 WeakPolarHBondContact CD-O 3.44Å; R292-A302 HydrophobicContact CG-CB 4.23Å; R292-A302 PolarHBondContact NH1-O 3.41Å; R292-F303 CarbonylContact C-O 3.57Å; R292-F303 VanDerWaalsContact C-O 3.27Å; R292-F303 WeakPolarHBondContact CA-O 3.48Å; R292-K304 HydrophobicContact CG-CG 4.08Å
293	P	69.7	Low	67.6	Low	94 Å²	94	80.5 Å²	80.5	61%	0.61	44%	0.444	S	S	*	.			trans	-65.2	-24.3	-164.4	-22.9	34.8	0	0	0	112.8	E291 R295	E291-P293 WeakPolarHBondContact O-CD 3.44Å; P293-R295 PolarHBondContact O-N 3.12Å
294	F	75.9	Confident	68.2	Low	72 Å²	72	81.3 Å²	81.3	32%	0.316	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	97.7	-174.6	-53.8	-73	0	0	0	109.6	R292 A302 F303 P306 L309	R292-F294 PolarHBondContact O-N 3.47Å; R292-F294 VanDerWaalsContact O-N 3.14Å; F294-A302 CarbonylContact O-C 3.44Å; F294-A302 WeakPolarHBondContact O-CA 3.22Å; F294-F303 HydrophobicContact CB-CB 4.37Å; F294-F303 PolarHBondContact N-O 2.91Å; F294-F303 PolarHBondContact O-N 2.81Å; F294-P306 HydrophobicContact CD1-CB 4.22Å; F294-P306 HydrophobicContact CD1-CG 3.98Å; F294-P306 HydrophobicContact CD2-CG 4.34Å; F294-P306 HydrophobicContact CE1-CB 4.23Å; F294-P306 HydrophobicContact CE1-CG 3.56Å; F294-P306 VanDerWaalsContact CE2-CD 3.48Å; F294-P306 HydrophobicContact CE2-CG 3.94Å; F294-P306 HydrophobicContact CG-CG 4.36Å; F294-P306 HydrophobicContact CZ-CG 3.53Å; F294-L309 HydrophobicContact CB-CB 3.97Å; F294-L309 HydrophobicContact CB-CD2 3.79Å; F294-L309 HydrophobicContact CB-CG 4.48Å
295	R	79.1	Confident	68.6	Low	147 Å²	147	84.5 Å²	84.5	56%	0.555	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	141.3	177.6	-65.3	-176.6	-172.2	-95.7	1.8	111.3	P293 K301 A302	P293-R295 PolarHBondContact O-N 3.12Å; R295-K301 WeakPolarHBondContact CA-O 3.46Å; R295-A302 HydrophobicContact CG-CB 3.97Å
296	C	83.6	Confident	69.6	Low	1 Å²	1	84.9 Å²	84.9	1%	0.007	46%	0.459	C	S	.	.			trans	-76.6	126	171.8	-179.7	0	0	0	0	110.5	E298 Q300 K301 F303 L309 H316	C296-E298 PolarHBondContact O-N 2.65Å; C296-Q300 WeakPolarHBondContact O-CA 3.49Å; C296-Q300 PolarHBondContact O-N 3.1Å; C296-K301 PolarHBondContact N-O 3.15Å; C296-F303 HydrophobicContact CB-CE2 4.37Å; C296-L309 HydrophobicContact CB-CD1 3.67Å; C296-H316 VanDerWaalsContact SG-CD2 3.51Å; C296-H316 PolarHBondContact SG-NE2 3.02Å
297	G	81.4	Confident	70.7	Confident	62 Å²	62	84.8 Å²	84.8	64%	0.639	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-31.9	179.2	0	0	0	0	0	113.9	Q300	G297-Q300 PolarHBondContact O-NE2 3.39Å
298	E	76.9	Confident	72	Confident	149 Å²	149	83.2 Å²	83.2	70%	0.696	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-38.5	-173.5	-63.7	-176.2	-156.4	0	0	114.4	C296 H316	C296-E298 PolarHBondContact O-N 2.65Å; E298-H316 WeakPolarHBondContact OE2-CB 3.45Å; E298-H316 IonicContact OE2-CD2 2.86Å; E298-H316 IonicContact OE2-CG 3.77Å
299	C	80.6	Confident	73.5	Confident	50 Å²	50	77.4 Å²	77.4	34%	0.338	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	5.2	-176.6	77.8	0	0	0	0	114.4	K301 H312 H316	C299-K301 PolarHBondContact O-N 3.41Å; C299-H312 VanDerWaalsContact SG-CE1 3.6Å; C299-H312 PolarHBondContact SG-NE2 2.96Å; C299-H316 PolarHBondContact SG-CE1 3.39Å; C299-H316 PolarHBondContact SG-NE2 3.39Å; C299-H316 VanDerWaalsContact SG-NE2 3.42Å
300	Q	78.1	Confident	74.8	Confident	117 Å²	117	81.9 Å²	81.9	55%	0.547	42%	0.418	S	S	.	.			trans	58.2	9	177.4	-60.6	-62.3	-25.3	0	0	115.6	C296 G297 A302	C296-Q300 WeakPolarHBondContact O-CA 3.49Å; C296-Q300 PolarHBondContact O-N 3.1Å; G297-Q300 PolarHBondContact O-NE2 3.39Å; Q300-A302 PolarHBondContact O-N 3.28Å
301	K	77.4	Confident	75.9	Confident	127 Å²	127	81.9 Å²	81.9	55%	0.552	40%	0.399	S	S	*	.			trans	-62.6	133.5	172.4	-77.8	-178.6	-175.7	172.4	0	109.9	R295 C296 C299 F303	R295-K301 WeakPolarHBondContact CA-O 3.46Å; C296-K301 PolarHBondContact N-O 3.15Å; C299-K301 PolarHBondContact O-N 3.41Å; K301-F303 HydrophobicContact CB-CE2 3.73Å; K301-F303 HydrophobicContact CB-CZ 3.9Å; K301-F303 WeakPolarHBondContact O-CD2 3.35Å; K301-F303 VanDerWaalsContact O-CE2 3.23Å; K301-F303 WeakPolarHBondContact O-CE2 3.43Å
302	A	78.6	Confident	77.1	Confident	13 Å²	13	77.4 Å²	77.4	11%	0.107	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	136.6	-174.9	0	0	0	0	0	110.4	R292 F294 R295 Q300	R292-A302 HydrophobicContact CB-CB 3.28Å; R292-A302 VanDerWaalsContact CD-O 3.28Å; R292-A302 WeakPolarHBondContact CD-O 3.44Å; R292-A302 HydrophobicContact CG-CB 4.23Å; R292-A302 PolarHBondContact NH1-O 3.41Å; F294-A302 CarbonylContact O-C 3.44Å; F294-A302 WeakPolarHBondContact O-CA 3.22Å; R295-A302 HydrophobicContact CG-CB 3.97Å; Q300-A302 PolarHBondContact O-N 3.28Å
303	F	78.9	Confident	77.7	Confident	41 Å²	41	75.1 Å²	75.1	18%	0.18	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	152.6	-177.7	-60.9	-87.8	0	0	0	111.2	R292 F294 C296 K301 D308 L309 H312	R292-F303 CarbonylContact C-O 3.57Å; R292-F303 VanDerWaalsContact C-O 3.27Å; R292-F303 WeakPolarHBondContact CA-O 3.48Å; F294-F303 HydrophobicContact CB-CB 4.37Å; F294-F303 PolarHBondContact N-O 2.91Å; F294-F303 PolarHBondContact O-N 2.81Å; C296-F303 HydrophobicContact CB-CE2 4.37Å; K301-F303 HydrophobicContact CB-CE2 3.73Å; K301-F303 HydrophobicContact CB-CZ 3.9Å; K301-F303 WeakPolarHBondContact O-CD2 3.35Å; K301-F303 VanDerWaalsContact O-CE2 3.23Å; K301-F303 WeakPolarHBondContact O-CE2 3.43Å; F303-D308 HydrophobicContact CB-CB 4.18Å; F303-D308 HydrophobicContact CD1-CB 4.01Å; F303-D308 HydrophobicContact CG-CB 4.41Å; F303-L309 HydrophobicContact CB-CB 4.16Å; F303-L309 HydrophobicContact CD2-CB 4Å; F303-L309 HydrophobicContact CD2-CD1 3.71Å; F303-L309 HydrophobicContact CD2-CG 4.47Å; F303-L309 HydrophobicContact CE2-CD1 4.03Å; F303-L309 HydrophobicContact CG-CB 4.22Å; F303-H312 HydrophobicContact CD1-CB 4.42Å; F303-H312 HydrophobicContact CE1-CB 3.64Å; F303-H312 AromaticContact CE1-CG 3.87Å; F303-H312 HydrophobicContact CE2-CB 3.75Å; F303-H312 AromaticContact CE2-CD2 3.18Å; F303-H312 WeakPolarHBondContact CE2-CD2 3.4Å; F303-H312 AromaticContact CE2-CG 3.45Å; F303-H312 VanDerWaalsContact CE2-CG 3.45Å; F303-H312 AromaticContact CE2-NE2 3.87Å; F303-H312 HydrophobicContact CZ-CB 3.28Å; F303-H312 AromaticContact CZ-CD2 3.28Å; F303-H312 WeakPolarHBondContact CZ-CD2 3.14Å; F303-H312 AromaticContact CZ-CG 3.02Å; F303-H312 AromaticContact CZ-ND1 3.56Å; F303-H312 AromaticContact CZ-NE2 3.86Å
304	K	69.2	Low	78	Confident	122 Å²	122	75.6 Å²	75.6	53%	0.53	36%	0.362	S	S	.	.	S	Bend	trans	-80.5	-24.9	179.7	-63.3	-173.7	178.6	-171.9	0	112.8	R292	R292-K304 HydrophobicContact CG-CG 4.08Å
305	R	72.4	Confident	78	Confident	105 Å²	105	75.3 Å²	75.3	40%	0.396	37%	0.366	S	S	.	.	S	Bend	trans	-131.3	148	-178	-58.3	178.9	-63.9	174.5	4.4	111.4	S307 D308 L309	R305-S307 PolarHBondContact O-N 3.13Å; R305-D308 HydrophobicContact CB-CB 4.47Å; R305-D308 WeakPolarHBondContact CB-OD2 3.37Å; R305-D308 IonicContact CZ-OD1 3.75Å; R305-D308 IonicContact CZ-OD2 2.77Å; R305-D308 IonicContact NE-OD1 3.66Å; R305-D308 PolarHBondContact NE-OD1 3.49Å; R305-D308 IonicContact NE-OD2 2.99Å; R305-D308 PolarHBondContact NE-OD2 3.44Å; R305-D308 IonicContact NH2-OD1 2.74Å; R305-D308 PolarHBondContact NH2-OD1 3.15Å; R305-D308 IonicContact NH2-OD2 3.45Å; R305-D308 PolarHBondContact NH2-OD2 3.19Å; R305-D308 PolarHBondContact O-N 2.93Å; R305-D308 VanDerWaalsContact O-N 3.12Å; R305-L309 PolarHBondContact O-N 3.26Å; R305-L309 VanDerWaalsContact O-N 3.15Å
306	P	73.9	Confident	77.8	Confident	53 Å²	53	71.1 Å²	71.1	34%	0.344	35%	0.353	S	S	.	.	H	α-helix	trans	-61.4	-32.7	174.7	-14	23	0	0	0	112.8	F294 D308 L309 R310	F294-P306 HydrophobicContact CD1-CB 4.22Å; F294-P306 HydrophobicContact CD1-CG 3.98Å; F294-P306 HydrophobicContact CD2-CG 4.34Å; F294-P306 HydrophobicContact CE1-CB 4.23Å; F294-P306 HydrophobicContact CE1-CG 3.56Å; F294-P306 VanDerWaalsContact CE2-CD 3.48Å; F294-P306 HydrophobicContact CE2-CG 3.94Å; F294-P306 HydrophobicContact CG-CG 4.36Å; F294-P306 HydrophobicContact CZ-CG 3.53Å; P306-D308 VanDerWaalsContact C-N 3.29Å; P306-D308 PolarHBondContact O-N 3.36Å; P306-L309 PolarHBondContact O-N 3.48Å; P306-R310 WeakPolarHBondContact O-CB 3.43Å; P306-R310 WeakPolarHBondContact O-CG 3.19Å; P306-R310 PolarHBondContact O-N 3.46Å
307	S	77.2	Confident	77.2	Confident	53 Å²	53	73 Å²	73	37%	0.371	37%	0.366	S	S	.	.	H	α-helix	trans	-63.3	-36.5	176.3	55.9	0	0	0	0	112.5	R305 Q311	R305-S307 PolarHBondContact O-N 3.13Å; S307-Q311 WeakPolarHBondContact O-CB 3.44Å; S307-Q311 PolarHBondContact O-N 3.48Å
308	D	79.2	Confident	76.5	Confident	36 Å²	36	78.8 Å²	78.8	19%	0.193	38%	0.377	C	S	.	.	H	α-helix	trans	-75.3	-38.9	-179.1	-58.7	-23.1	0	0	0	110.2	F303 R305 P306 Q311 H312	F303-D308 HydrophobicContact CB-CB 4.18Å; F303-D308 HydrophobicContact CD1-CB 4.01Å; F303-D308 HydrophobicContact CG-CB 4.41Å; R305-D308 HydrophobicContact CB-CB 4.47Å; R305-D308 WeakPolarHBondContact CB-OD2 3.37Å; R305-D308 IonicContact CZ-OD1 3.75Å; R305-D308 IonicContact CZ-OD2 2.77Å; R305-D308 IonicContact NE-OD1 3.66Å; R305-D308 PolarHBondContact NE-OD1 3.49Å; R305-D308 IonicContact NE-OD2 2.99Å; R305-D308 PolarHBondContact NE-OD2 3.44Å; R305-D308 IonicContact NH2-OD1 2.74Å; R305-D308 PolarHBondContact NH2-OD1 3.15Å; R305-D308 IonicContact NH2-OD2 3.45Å; R305-D308 PolarHBondContact NH2-OD2 3.19Å; R305-D308 PolarHBondContact O-N 2.93Å; R305-D308 VanDerWaalsContact O-N 3.12Å; P306-D308 VanDerWaalsContact C-N 3.29Å; P306-D308 PolarHBondContact O-N 3.36Å; D308-Q311 PolarHBondContact O-N 3.06Å; D308-H312 WeakPolarHBondContact O-CB 3.41Å; D308-H312 PolarHBondContact O-N 3.21Å
309	L	80.3	Confident	76.3	Confident	20 Å²	20	78.3 Å²	78.3	11%	0.105	37%	0.374	C	S	.	.	H	α-helix	trans	-59.7	-51.8	170.6	173.3	60	0	0	0	110.9	F294 C296 F303 R305 P306 Q311 H312 E313	F294-L309 HydrophobicContact CB-CB 3.97Å; F294-L309 HydrophobicContact CB-CD2 3.79Å; F294-L309 HydrophobicContact CB-CG 4.48Å; C296-L309 HydrophobicContact CB-CD1 3.67Å; F303-L309 HydrophobicContact CB-CB 4.16Å; F303-L309 HydrophobicContact CD2-CB 4Å; F303-L309 HydrophobicContact CD2-CD1 3.71Å; F303-L309 HydrophobicContact CD2-CG 4.47Å; F303-L309 HydrophobicContact CE2-CD1 4.03Å; F303-L309 HydrophobicContact CG-CB 4.22Å; R305-L309 PolarHBondContact O-N 3.26Å; R305-L309 VanDerWaalsContact O-N 3.15Å; P306-L309 PolarHBondContact O-N 3.48Å; L309-Q311 VanDerWaalsContact C-N 3.25Å; L309-Q311 PolarHBondContact O-N 2.76Å; L309-H312 CarbonylContact O-C 3.54Å; L309-H312 WeakPolarHBondContact O-CA 3.43Å; L309-H312 WeakPolarHBondContact O-CB 3.29Å; L309-H312 PolarHBondContact O-N 3.45Å; L309-E313 HydrophobicContact CD1-CG 3.98Å; L309-E313 HydrophobicContact CG-CG 4.35Å; L309-E313 WeakPolarHBondContact O-CG 3.49Å; L309-E313 PolarHBondContact O-N 2.84Å
310	R	79.3	Confident	76.1	Confident	147 Å²	147	82.5 Å²	82.5	56%	0.555	38%	0.383	S	S	*	.	H	α-helix	trans	-57.5	-38.1	176.9	-75.9	-170.5	-67.8	-95.6	5.2	112.9	P306 H312 E313	P306-R310 WeakPolarHBondContact O-CB 3.43Å; P306-R310 WeakPolarHBondContact O-CG 3.19Å; P306-R310 PolarHBondContact O-N 3.46Å; R310-H312 VanDerWaalsContact C-N 3.34Å; R310-E313 WeakPolarHBondContact CA-OE2 3.48Å
311	Q	78.1	Confident	76.1	Confident	70 Å²	70	80.4 Å²	80.4	33%	0.327	38%	0.379	S	S	.	.	H	α-helix	trans	-68.9	-35.5	175.4	-176.3	178.7	36.5	0	0	112	S307 D308 L309 R314 Q333	S307-Q311 WeakPolarHBondContact O-CB 3.44Å; S307-Q311 PolarHBondContact O-N 3.48Å; D308-Q311 PolarHBondContact O-N 3.06Å; L309-Q311 VanDerWaalsContact C-N 3.25Å; L309-Q311 PolarHBondContact O-N 2.76Å; Q311-R314 WeakPolarHBondContact O-CB 3.07Å; Q311-Q333 VanDerWaalsContact CD-NE2 3.28Å; Q311-Q333 HydrophobicContact CG-CG 4.2Å; Q311-Q333 VanDerWaalsContact CG-NE2 3.29Å; Q311-Q333 VanDerWaalsContact NE2-CD 3.28Å
312	H	81.8	Confident	76.4	Confident	19 Å²	19	76.7 Å²	76.7	9%	0.088	36%	0.363	C	S	.	.	H	α-helix	trans	-72.8	-36.3	175.9	167.2	68.4	0	0	0	112.9	C299 F303 D308 L309 R310 R314 T315 H316	C299-H312 VanDerWaalsContact SG-CE1 3.6Å; C299-H312 PolarHBondContact SG-NE2 2.96Å; F303-H312 HydrophobicContact CD1-CB 4.42Å; F303-H312 HydrophobicContact CE1-CB 3.64Å; F303-H312 AromaticContact CE1-CG 3.87Å; F303-H312 HydrophobicContact CE2-CB 3.75Å; F303-H312 AromaticContact CE2-CD2 3.18Å; F303-H312 WeakPolarHBondContact CE2-CD2 3.4Å; F303-H312 AromaticContact CE2-CG 3.45Å; F303-H312 VanDerWaalsContact CE2-CG 3.45Å; F303-H312 AromaticContact CE2-NE2 3.87Å; F303-H312 HydrophobicContact CZ-CB 3.28Å; F303-H312 AromaticContact CZ-CD2 3.28Å; F303-H312 WeakPolarHBondContact CZ-CD2 3.14Å; F303-H312 AromaticContact CZ-CG 3.02Å; F303-H312 AromaticContact CZ-ND1 3.56Å; F303-H312 AromaticContact CZ-NE2 3.86Å; D308-H312 WeakPolarHBondContact O-CB 3.41Å; D308-H312 PolarHBondContact O-N 3.21Å; L309-H312 CarbonylContact O-C 3.54Å; L309-H312 WeakPolarHBondContact O-CA 3.43Å; L309-H312 WeakPolarHBondContact O-CB 3.29Å; L309-H312 PolarHBondContact O-N 3.45Å; R310-H312 VanDerWaalsContact C-N 3.34Å; H312-R314 PolarHBondContact O-N 2.86Å; H312-T315 PolarHBondContact CE1-OG1 3.37Å; H312-T315 PolarHBondContact ND1-OG1 2.83Å; H312-T315 WeakPolarHBondContact O-CA 3.26Å; H312-T315 WeakPolarHBondContact O-CB 3.46Å; H312-T315 WeakPolarHBondContact O-CG2 3.35Å; H312-T315 PolarHBondContact O-N 3.11Å; H312-T315 PolarHBondContact O-OG1 3.45Å; H312-H316 AromaticContact CD2-NE2 3.85Å; H312-H316 AromaticContact CE1-CE1 3.74Å; H312-H316 AromaticContact CE1-NE2 3.47Å; H312-H316 PolarHBondContact CE1-NE2 3.44Å; H312-H316 AromaticContact NE2-CE1 3.71Å; H312-H316 AromaticContact NE2-NE2 3.04Å; H312-H316 PolarHBondContact NE2-NE2 3.04Å
313	E	79.4	Confident	76.4	Confident	79 Å²	79	82 Å²	82	37%	0.369	38%	0.384	S	S	.	.	H	α-helix	trans	-59.4	-31.6	176.4	-73.2	166.7	160.3	0	0	111.3	L309 R310 T315 H316 S317	L309-E313 HydrophobicContact CD1-CG 3.98Å; L309-E313 HydrophobicContact CG-CG 4.35Å; L309-E313 WeakPolarHBondContact O-CG 3.49Å; L309-E313 PolarHBondContact O-N 2.84Å; R310-E313 WeakPolarHBondContact CA-OE2 3.48Å; E313-T315 PolarHBondContact O-N 3.28Å; E313-H316 PolarHBondContact O-N 3.48Å; E313-S317 PolarHBondContact O-N 3.17Å
314	R	77.8	Confident	76.5	Confident	105 Å²	105	80 Å²	80	40%	0.396	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.3	170	-62.8	176.5	-176.9	165.4	0.6	114	Q311 H312 H316 S317 K332	Q311-R314 WeakPolarHBondContact O-CB 3.07Å; H312-R314 PolarHBondContact O-N 2.86Å; R314-H316 VanDerWaalsContact C-N 3.33Å; R314-S317 VanDerWaalsContact CA-OG 3.27Å; R314-S317 WeakPolarHBondContact CA-OG 3.4Å; R314-S317 PolarHBondContact O-OG 3.42Å; R314-S317 VanDerWaalsContact O-OG 3.13Å; R314-K332 VanDerWaalsContact O-CD 3.32Å; R314-K332 WeakPolarHBondContact O-CD 3.22Å; R314-K332 PolarHBondContact O-NZ 3.46Å
315	T	74.6	Confident	77.1	Confident	65 Å²	65	79.2 Å²	79.2	40%	0.399	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-25.1	175.2	70.3	0	0	0	0	112.8	H312 E313 K332	H312-T315 PolarHBondContact CE1-OG1 3.37Å; H312-T315 PolarHBondContact ND1-OG1 2.83Å; H312-T315 WeakPolarHBondContact O-CA 3.26Å; H312-T315 WeakPolarHBondContact O-CB 3.46Å; H312-T315 WeakPolarHBondContact O-CG2 3.35Å; H312-T315 PolarHBondContact O-N 3.11Å; H312-T315 PolarHBondContact O-OG1 3.45Å; E313-T315 PolarHBondContact O-N 3.28Å; T315-K332 PolarHBondContact O-NZ 2.82Å
316	H	75	Confident	77.4	Confident	60 Å²	60	79.6 Å²	79.6	28%	0.278	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-37.5	173.2	-51.4	-52.9	0	0	0	112.1	C296 E298 C299 H312 E313 R314	C296-H316 VanDerWaalsContact SG-CD2 3.51Å; C296-H316 PolarHBondContact SG-NE2 3.02Å; E298-H316 WeakPolarHBondContact OE2-CB 3.45Å; E298-H316 IonicContact OE2-CD2 2.86Å; E298-H316 IonicContact OE2-CG 3.77Å; C299-H316 PolarHBondContact SG-CE1 3.39Å; C299-H316 PolarHBondContact SG-NE2 3.39Å; C299-H316 VanDerWaalsContact SG-NE2 3.42Å; H312-H316 AromaticContact CD2-NE2 3.85Å; H312-H316 AromaticContact CE1-CE1 3.74Å; H312-H316 AromaticContact CE1-NE2 3.47Å; H312-H316 PolarHBondContact CE1-NE2 3.44Å; H312-H316 AromaticContact NE2-CE1 3.71Å; H312-H316 AromaticContact NE2-NE2 3.04Å; H312-H316 PolarHBondContact NE2-NE2 3.04Å; E313-H316 PolarHBondContact O-N 3.48Å; R314-H316 VanDerWaalsContact C-N 3.33Å
317	S	70.8	Confident	77.6	Confident	39 Å²	39	79.4 Å²	79.4	27%	0.273	39%	0.385	S	S	.	.	S	Bend	trans	-65	141	171.6	71.2	0	0	0	0	111.2	E313 R314 E319 K332	E313-S317 PolarHBondContact O-N 3.17Å; R314-S317 VanDerWaalsContact CA-OG 3.27Å; R314-S317 WeakPolarHBondContact CA-OG 3.4Å; R314-S317 PolarHBondContact O-OG 3.42Å; R314-S317 VanDerWaalsContact O-OG 3.13Å; S317-E319 PolarHBondContact O-N 3.47Å; S317-K332 PolarHBondContact O-NZ 3.28Å
318	E	67.6	Low	77.5	Confident	185 Å²	185	82.9 Å²	82.9	86%	0.864	40%	0.396	S	S	*	.			trans	-71.6	-7.6	170.3	-63.3	-158.3	147.2	0	0	113	R320	E318-R320 PolarHBondContact O-N 3.47Å
319	E	72.4	Confident	77.4	Confident	139 Å²	139	86 Å²	86	65%	0.65	41%	0.411	S	S	*	.			trans	-60.2	125.4	179.3	-62.6	-169.2	168.7	0	0	112.1	S317	S317-E319 PolarHBondContact O-N 3.47Å
320	R	76.8	Confident	77.5	Confident	137 Å²	137	86.6 Å²	86.6	52%	0.517	42%	0.417	S	S	.	.			trans	-125	80.9	176	-64.1	-172.9	-171.1	-174.1	3.1	108.8	E318 F322 S330 F331 K332	E318-R320 PolarHBondContact O-N 3.47Å; R320-F322 PolarHBondContact O-N 2.8Å; R320-F322 VanDerWaalsContact O-N 3.14Å; R320-S330 VanDerWaalsContact CB-CB 3.4Å; R320-S330 WeakPolarHBondContact CD-O 3.49Å; R320-F331 CarbonylContact C-O 3.54Å; R320-F331 VanDerWaalsContact C-O 3.32Å; R320-F331 WeakPolarHBondContact CA-O 3.46Å; R320-K332 HydrophobicContact CG-CG 3.95Å
321	P	78.4	Confident	77.6	Confident	73 Å²	73	81.3 Å²	81.3	47%	0.474	40%	0.397	S	S	.	.			trans	-64.6	-22.9	-169.6	-23.4	34.6	0	0	0	113.9
322	F	82.1	Confident	77.5	Confident	49 Å²	49	80.5 Å²	80.5	22%	0.215	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	98	-171.6	-56.5	-78.1	0	0	0	110.5	R320 S330 F331 Q334 L337	R320-F322 PolarHBondContact O-N 2.8Å; R320-F322 VanDerWaalsContact O-N 3.14Å; F322-S330 CarbonylContact O-C 3.24Å; F322-S330 WeakPolarHBondContact O-CA 3.24Å; F322-F331 HydrophobicContact CB-CB 4.35Å; F322-F331 PolarHBondContact N-O 3.08Å; F322-F331 VanDerWaalsContact N-O 3.15Å; F322-F331 PolarHBondContact O-N 3.15Å; F322-Q334 HydrophobicContact CD1-CB 3.72Å; F322-Q334 HydrophobicContact CD1-CG 4.06Å; F322-Q334 HydrophobicContact CE1-CB 3.57Å; F322-Q334 HydrophobicContact CE1-CG 4.08Å; F322-Q334 HydrophobicContact CE2-CB 4.43Å; F322-Q334 HydrophobicContact CG-CB 4.22Å; F322-Q334 HydrophobicContact CZ-CB 3.94Å; F322-L337 HydrophobicContact CB-CB 4.05Å; F322-L337 HydrophobicContact CB-CD2 3.86Å
323	K	79.1	Confident	77.3	Confident	125 Å²	125	81.3 Å²	81.3	54%	0.543	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	143.7	-179	-56	-169.7	176.7	176.1	0	112.1	S330 L337	K323-S330 WeakPolarHBondContact CG-OG 3.36Å; K323-L337 VanDerWaalsContact O-CD2 3.23Å; K323-L337 WeakPolarHBondContact O-CD2 3.27Å
324	C	81.9	Confident	77.2	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	41%	0.407	C	S	.	.			trans	-90.2	116.5	173.3	-173.2	0	0	0	0	110.2	L326 C327 Q328 M329 F331 L337	C324-L326 PolarHBondContact O-N 3.49Å; C324-L326 VanDerWaalsContact O-N 3.14Å; C324-C327 PolarHBondContact O-N 3.24Å; C324-C327 VanDerWaalsContact SG-SG 3.65Å; C324-Q328 WeakPolarHBondContact O-CA 3.45Å; C324-Q328 PolarHBondContact O-N 2.58Å; C324-M329 VanDerWaalsContact CB-O 3.31Å; C324-M329 WeakPolarHBondContact CB-O 3.47Å; C324-M329 PolarHBondContact N-O 3.36Å; C324-F331 HydrophobicContact CB-CE2 4.28Å; C324-L337 VanDerWaalsContact CA-CD1 3.48Å; C324-L337 HydrophobicContact CB-CD1 3.52Å
325	D	81	Confident	77.2	Confident	104 Å²	104	85 Å²	85	56%	0.556	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-23.5	-176.9	-46.5	-24.4	0	0	0	112.8	Q328 R341	D325-Q328 PolarHBondContact O-NE2 3.27Å; D325-R341 IonicContact OD1-NH2 3.45Å; D325-R341 PolarHBondContact OD1-NH2 3.41Å; D325-R341 IonicContact OD2-CZ 3.22Å; D325-R341 IonicContact OD2-NH1 3.45Å; D325-R341 PolarHBondContact OD2-NH1 3.22Å; D325-R341 IonicContact OD2-NH2 2.81Å; D325-R341 PolarHBondContact OD2-NH2 2.99Å
326	L	78.4	Confident	77.4	Confident	113 Å²	113	82.4 Å²	82.4	59%	0.592	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-29.9	-175.1	-61.1	175.9	0	0	0	114.4	C324 H344	C324-L326 PolarHBondContact O-N 3.49Å; C324-L326 VanDerWaalsContact O-N 3.14Å; L326-H344 HydrophobicContact CD1-CB 3.5Å
327	C	78.7	Confident	77.7	Confident	49 Å²	49	80.2 Å²	80.2	33%	0.331	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.8	6.7	-177	68.3	0	0	0	0	113.7	C324 M329 H340 H344	C324-C327 PolarHBondContact O-N 3.24Å; C324-C327 VanDerWaalsContact SG-SG 3.65Å; C327-M329 PolarHBondContact O-N 2.89Å; C327-M329 VanDerWaalsContact SG-CG 3.53Å; C327-H340 PolarHBondContact SG-NE2 2.91Å; C327-H344 PolarHBondContact SG-NE2 3.35Å
328	Q	75.4	Confident	78	Confident	127 Å²	127	83.5 Å²	83.5	59%	0.593	40%	0.401	S	S	*	.			trans	58	7.5	-179.8	-57.9	-59.9	-30.1	0	0	115.4	C324 D325 S330	C324-Q328 WeakPolarHBondContact O-CA 3.45Å; C324-Q328 PolarHBondContact O-N 2.58Å; D325-Q328 PolarHBondContact O-NE2 3.27Å; Q328-S330 PolarHBondContact O-N 3.18Å; Q328-S330 PolarHBondContact O-OG 2.86Å
329	M	77.7	Confident	78.5	Confident	101 Å²	101	79.5 Å²	79.5	50%	0.498	38%	0.378	S	S	.	.			trans	-63	130.3	172.9	-70.1	-171.4	79.5	0	0	110.3	C324 C327 F331	C324-M329 VanDerWaalsContact CB-O 3.31Å; C324-M329 WeakPolarHBondContact CB-O 3.47Å; C324-M329 PolarHBondContact N-O 3.36Å; C327-M329 PolarHBondContact O-N 2.89Å; C327-M329 VanDerWaalsContact SG-CG 3.53Å; M329-F331 HydrophobicContact CB-CE2 3.83Å; M329-F331 HydrophobicContact CB-CZ 4.02Å; M329-F331 WeakPolarHBondContact O-CE2 3.32Å
330	S	81.7	Confident	78.9	Confident	33 Å²	33	74.3 Å²	74.3	23%	0.231	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	141.8	-179	-55.3	0	0	0	0	110.4	R320 F322 K323 Q328	R320-S330 VanDerWaalsContact CB-CB 3.4Å; R320-S330 WeakPolarHBondContact CD-O 3.49Å; F322-S330 CarbonylContact O-C 3.24Å; F322-S330 WeakPolarHBondContact O-CA 3.24Å; K323-S330 WeakPolarHBondContact CG-OG 3.36Å; Q328-S330 PolarHBondContact O-N 3.18Å; Q328-S330 PolarHBondContact O-OG 2.86Å
331	F	81.1	Confident	78.9	Confident	35 Å²	35	71.7 Å²	71.7	15%	0.154	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	149.2	-177.4	-61.2	-90.8	0	0	0	111	R320 F322 C324 M329 Q333 A336 L337 H340	R320-F331 CarbonylContact C-O 3.54Å; R320-F331 VanDerWaalsContact C-O 3.32Å; R320-F331 WeakPolarHBondContact CA-O 3.46Å; F322-F331 HydrophobicContact CB-CB 4.35Å; F322-F331 PolarHBondContact N-O 3.08Å; F322-F331 VanDerWaalsContact N-O 3.15Å; F322-F331 PolarHBondContact O-N 3.15Å; C324-F331 HydrophobicContact CB-CE2 4.28Å; M329-F331 HydrophobicContact CB-CE2 3.83Å; M329-F331 HydrophobicContact CB-CZ 4.02Å; M329-F331 WeakPolarHBondContact O-CE2 3.32Å; F331-Q333 VanDerWaalsContact C-N 3.28Å; F331-Q333 PolarHBondContact O-N 3.25Å; F331-A336 HydrophobicContact CB-CB 4.33Å; F331-A336 HydrophobicContact CD1-CB 4.05Å; F331-A336 HydrophobicContact CG-CB 4.47Å; F331-L337 HydrophobicContact CB-CB 4.23Å; F331-L337 HydrophobicContact CD2-CB 3.82Å; F331-L337 HydrophobicContact CD2-CD1 3.74Å; F331-L337 HydrophobicContact CD2-CG 4.39Å; F331-L337 HydrophobicContact CE2-CD1 3.92Å; F331-L337 HydrophobicContact CG-CB 4.15Å; F331-H340 HydrophobicContact CE1-CB 3.83Å; F331-H340 HydrophobicContact CE2-CB 3.9Å; F331-H340 AromaticContact CE2-CD2 3.42Å; F331-H340 VanDerWaalsContact CE2-CD2 3.42Å; F331-H340 WeakPolarHBondContact CE2-CD2 3.33Å; F331-H340 AromaticContact CE2-CG 3.69Å; F331-H340 HydrophobicContact CZ-CB 3.37Å; F331-H340 AromaticContact CZ-CD2 3.38Å; F331-H340 WeakPolarHBondContact CZ-CD2 3.48Å; F331-H340 AromaticContact CZ-CG 3.17Å; F331-H340 AromaticContact CZ-ND1 3.69Å; F331-H340 AromaticContact CZ-NE2 3.97Å
332	K	75.8	Confident	78.9	Confident	53 Å²	53	72.7 Å²	72.7	23%	0.23	34%	0.339	C	S	.	.	S	Bend	trans	-74.5	-17.7	177.1	-62.4	-173.8	171.5	-136.8	0	113.1	R314 T315 S317 R320	R314-K332 VanDerWaalsContact O-CD 3.32Å; R314-K332 WeakPolarHBondContact O-CD 3.22Å; R314-K332 PolarHBondContact O-NZ 3.46Å; T315-K332 PolarHBondContact O-NZ 2.82Å; S317-K332 PolarHBondContact O-NZ 3.28Å; R320-K332 HydrophobicContact CG-CG 3.95Å
333	Q	78.1	Confident	78.5	Confident	37 Å²	37	74.1 Å²	74.1	17%	0.173	35%	0.351	C	S	.	.	S	Bend	trans	-141.7	142	-173.9	-64.2	168.4	-15.4	0	0	111.5	Q311 F331 Y335 A336 L337	Q311-Q333 VanDerWaalsContact CD-NE2 3.28Å; Q311-Q333 HydrophobicContact CG-CG 4.2Å; Q311-Q333 VanDerWaalsContact CG-NE2 3.29Å; Q311-Q333 VanDerWaalsContact NE2-CD 3.28Å; F331-Q333 VanDerWaalsContact C-N 3.28Å; F331-Q333 PolarHBondContact O-N 3.25Å; Q333-Y335 HydrophobicContact CB-CD1 3.95Å; Q333-Y335 HydrophobicContact CB-CE1 3.83Å; Q333-Y335 HydrophobicContact CG-CE1 4.23Å; Q333-Y335 PolarHBondContact O-N 2.78Å; Q333-Y335 PolarHBondContact OE1-OH 3.23Å; Q333-A336 HydrophobicContact CB-CB 4.38Å; Q333-A336 WeakPolarHBondContact O-CB 3.45Å; Q333-A336 PolarHBondContact O-N 2.86Å; Q333-L337 PolarHBondContact O-N 3Å
334	Q	77.4	Confident	78.1	Confident	123 Å²	123	71.9 Å²	71.9	58%	0.575	34%	0.343	S	S	*	.	H	α-helix	trans	-62.2	-41.3	-177.2	-170.2	176.9	-25.3	0	0	113.3	F322 A336 L337 M338	F322-Q334 HydrophobicContact CD1-CB 3.72Å; F322-Q334 HydrophobicContact CD1-CG 4.06Å; F322-Q334 HydrophobicContact CE1-CB 3.57Å; F322-Q334 HydrophobicContact CE1-CG 4.08Å; F322-Q334 HydrophobicContact CE2-CB 4.43Å; F322-Q334 HydrophobicContact CG-CB 4.22Å; F322-Q334 HydrophobicContact CZ-CB 3.94Å; Q334-A336 PolarHBondContact O-N 3.19Å; Q334-L337 WeakPolarHBondContact O-CB 2.98Å; Q334-L337 PolarHBondContact O-N 3.3Å; Q334-M338 WeakPolarHBondContact O-CG 3.08Å; Q334-M338 PolarHBondContact O-N 3.33Å
335	Y	77.6	Confident	77.4	Confident	138 Å²	138	78.9 Å²	78.9	54%	0.541	37%	0.373	S	S	.	.	H	α-helix	trans	-65.5	-31	179.2	78.7	-99	0	0	0	111.9	Q333 M338 R339	Q333-Y335 HydrophobicContact CB-CD1 3.95Å; Q333-Y335 HydrophobicContact CB-CE1 3.83Å; Q333-Y335 HydrophobicContact CG-CE1 4.23Å; Q333-Y335 PolarHBondContact O-N 2.78Å; Q333-Y335 PolarHBondContact OE1-OH 3.23Å; Y335-M338 PolarHBondContact O-N 3.4Å; Y335-R339 WeakPolarHBondContact O-CB 3.49Å; Y335-R339 PolarHBondContact O-N 3.38Å
336	A	79.4	Confident	76.6	Confident	11 Å²	11	77.8 Å²	77.8	9%	0.091	38%	0.378	C	S	.	.	H	α-helix	trans	-69	-40.1	177.2	0	0	0	0	0	110.7	F331 Q333 Q334 R339 H340	F331-A336 HydrophobicContact CB-CB 4.33Å; F331-A336 HydrophobicContact CD1-CB 4.05Å; F331-A336 HydrophobicContact CG-CB 4.47Å; Q333-A336 HydrophobicContact CB-CB 4.38Å; Q333-A336 WeakPolarHBondContact O-CB 3.45Å; Q333-A336 PolarHBondContact O-N 2.86Å; Q334-A336 PolarHBondContact O-N 3.19Å; A336-R339 PolarHBondContact O-N 2.91Å; A336-H340 WeakPolarHBondContact O-CB 3.46Å; A336-H340 PolarHBondContact O-N 3.27Å
337	L	79.6	Confident	76.1	Confident	13 Å²	13	77 Å²	77	7%	0.068	37%	0.371	C	S	.	.	H	α-helix	trans	-61.2	-48.9	169.9	170.3	63.4	0	0	0	111.4	F322 K323 C324 F331 Q333 Q334 R339 H340 R341	F322-L337 HydrophobicContact CB-CB 4.05Å; F322-L337 HydrophobicContact CB-CD2 3.86Å; K323-L337 VanDerWaalsContact O-CD2 3.23Å; K323-L337 WeakPolarHBondContact O-CD2 3.27Å; C324-L337 VanDerWaalsContact CA-CD1 3.48Å; C324-L337 HydrophobicContact CB-CD1 3.52Å; F331-L337 HydrophobicContact CB-CB 4.23Å; F331-L337 HydrophobicContact CD2-CB 3.82Å; F331-L337 HydrophobicContact CD2-CD1 3.74Å; F331-L337 HydrophobicContact CD2-CG 4.39Å; F331-L337 HydrophobicContact CE2-CD1 3.92Å; F331-L337 HydrophobicContact CG-CB 4.15Å; Q333-L337 PolarHBondContact O-N 3Å; Q334-L337 WeakPolarHBondContact O-CB 2.98Å; Q334-L337 PolarHBondContact O-N 3.3Å; L337-R339 VanDerWaalsContact C-N 3.3Å; L337-R339 PolarHBondContact O-N 2.9Å; L337-H340 CarbonylContact O-C 3.53Å; L337-H340 WeakPolarHBondContact O-CB 3.4Å; L337-H340 PolarHBondContact O-N 3.21Å; L337-H340 VanDerWaalsContact O-N 3.13Å; L337-R341 HydrophobicContact CD1-CG 4.18Å; L337-R341 WeakPolarHBondContact O-CG 3.44Å; L337-R341 PolarHBondContact O-N 3.33Å
338	M	78.9	Confident	75.8	Confident	108 Å²	108	79.2 Å²	79.2	53%	0.532	38%	0.377	S	S	.	.	H	α-helix	trans	-60.1	-40.2	179.3	-72.9	-63.4	-74.2	0	0	112.1	Q334 Y335 R341	Q334-M338 WeakPolarHBondContact O-CG 3.08Å; Q334-M338 PolarHBondContact O-N 3.33Å; Y335-M338 PolarHBondContact O-N 3.4Å; M338-R341 PolarHBondContact O-N 3.23Å
339	R	77.9	Confident	75.7	Confident	101 Å²	101	76.7 Å²	76.7	38%	0.381	37%	0.372	S	S	.	.	H	α-helix	trans	-65.8	-40.9	174.3	-177.2	179.3	69.1	-177.2	-6.1	112.2	Y335 A336 L337 R342 Q361	Y335-R339 WeakPolarHBondContact O-CB 3.49Å; Y335-R339 PolarHBondContact O-N 3.38Å; A336-R339 PolarHBondContact O-N 2.91Å; L337-R339 VanDerWaalsContact C-N 3.3Å; L337-R339 PolarHBondContact O-N 2.9Å; R339-R342 WeakPolarHBondContact O-CB 3.33Å; R339-R342 PolarHBondContact O-N 3.24Å; R339-Q361 HydrophobicContact CG-CG 4.28Å
340	H	79.6	Confident	75.7	Confident	31 Å²	31	74.7 Å²	74.7	14%	0.144	36%	0.36	C	S	.	.	H	α-helix	trans	-65.6	-38.9	175.1	170	73.7	0	0	0	111.9	C327 F331 A336 L337 R342 T343 H344	C327-H340 PolarHBondContact SG-NE2 2.91Å; F331-H340 HydrophobicContact CE1-CB 3.83Å; F331-H340 HydrophobicContact CE2-CB 3.9Å; F331-H340 AromaticContact CE2-CD2 3.42Å; F331-H340 VanDerWaalsContact CE2-CD2 3.42Å; F331-H340 WeakPolarHBondContact CE2-CD2 3.33Å; F331-H340 AromaticContact CE2-CG 3.69Å; F331-H340 HydrophobicContact CZ-CB 3.37Å; F331-H340 AromaticContact CZ-CD2 3.38Å; F331-H340 WeakPolarHBondContact CZ-CD2 3.48Å; F331-H340 AromaticContact CZ-CG 3.17Å; F331-H340 AromaticContact CZ-ND1 3.69Å; F331-H340 AromaticContact CZ-NE2 3.97Å; A336-H340 WeakPolarHBondContact O-CB 3.46Å; A336-H340 PolarHBondContact O-N 3.27Å; L337-H340 CarbonylContact O-C 3.53Å; L337-H340 WeakPolarHBondContact O-CB 3.4Å; L337-H340 PolarHBondContact O-N 3.21Å; L337-H340 VanDerWaalsContact O-N 3.13Å; H340-R342 PolarHBondContact O-N 2.8Å; H340-R342 VanDerWaalsContact O-N 3.1Å; H340-T343 WeakPolarHBondContact O-CB 3.37Å; H340-T343 PolarHBondContact O-N 3.45Å; H340-T343 PolarHBondContact O-OG1 3.23Å; H340-H344 AromaticContact CD2-NE2 3.79Å; H340-H344 AromaticContact CE1-NE2 3.51Å; H340-H344 AromaticContact NE2-CD2 3.8Å; H340-H344 AromaticContact NE2-CE1 3.97Å; H340-H344 AromaticContact NE2-NE2 2.99Å; H340-H344 PolarHBondContact NE2-NE2 3.26Å
341	R	77.1	Confident	75.4	Confident	82 Å²	82	79.6 Å²	79.6	31%	0.309	38%	0.378	S	S	.	.	H	α-helix	trans	-56.6	-30.4	176.6	-77.8	-173.5	-178.3	-140.6	0.2	113.2	D325 L337 M338 T343 H344	D325-R341 IonicContact OD1-NH2 3.45Å; D325-R341 PolarHBondContact OD1-NH2 3.41Å; D325-R341 IonicContact OD2-CZ 3.22Å; D325-R341 IonicContact OD2-NH1 3.45Å; D325-R341 PolarHBondContact OD2-NH1 3.22Å; D325-R341 IonicContact OD2-NH2 2.81Å; D325-R341 PolarHBondContact OD2-NH2 2.99Å; L337-R341 HydrophobicContact CD1-CG 4.18Å; L337-R341 WeakPolarHBondContact O-CG 3.44Å; L337-R341 PolarHBondContact O-N 3.33Å; M338-R341 PolarHBondContact O-N 3.23Å; R341-T343 PolarHBondContact O-N 3.14Å; R341-H344 PolarHBondContact O-N 3.37Å; R341-H344 VanDerWaalsContact O-N 3.15Å
342	R	78.1	Confident	75.2	Confident	94 Å²	94	78 Å²	78	36%	0.355	37%	0.371	S	S	.	.	H	α-helix	trans	-63.1	-25.7	175.5	-61.8	178.2	-177.5	173.3	-1.7	113.2	R339 H340 H344 K345 A346 E347 V360	R339-R342 WeakPolarHBondContact O-CB 3.33Å; R339-R342 PolarHBondContact O-N 3.24Å; H340-R342 PolarHBondContact O-N 2.8Å; H340-R342 VanDerWaalsContact O-N 3.1Å; R342-H344 VanDerWaalsContact C-N 3.3Å; R342-H344 PolarHBondContact O-N 3.15Å; R342-K345 PolarHBondContact O-N 2.81Å; R342-A346 PolarHBondContact O-N 3.32Å; R342-E347 PolarHBondContact O-N 3.25Å; R342-V360 HydrophobicContact CB-CG1 3.54Å
343	T	73.2	Confident	75.1	Confident	79 Å²	79	82.4 Å²	82.4	49%	0.485	40%	0.397	S	S	.	.	H	α-helix	trans	-72.4	-24.9	176.8	69.3	0	0	0	0	112.7	H340 R341 V360	H340-T343 WeakPolarHBondContact O-CB 3.37Å; H340-T343 PolarHBondContact O-N 3.45Å; H340-T343 PolarHBondContact O-OG1 3.23Å; R341-T343 PolarHBondContact O-N 3.14Å; T343-V360 HydrophobicContact CG2-CG1 4.41Å
344	H	71.9	Confident	74.8	Confident	78 Å²	78	86.2 Å²	86.2	36%	0.361	42%	0.418	S	S	.	.	H	α-helix	trans	-78.3	-30.8	176.4	-67.1	-60.3	0	0	0	112.7	L326 C327 H340 R341 R342	L326-H344 HydrophobicContact CD1-CB 3.5Å; C327-H344 PolarHBondContact SG-NE2 3.35Å; H340-H344 AromaticContact CD2-NE2 3.79Å; H340-H344 AromaticContact CE1-NE2 3.51Å; H340-H344 AromaticContact NE2-CD2 3.8Å; H340-H344 AromaticContact NE2-CE1 3.97Å; H340-H344 AromaticContact NE2-NE2 2.99Å; H340-H344 PolarHBondContact NE2-NE2 3.26Å; R341-H344 PolarHBondContact O-N 3.37Å; R341-H344 VanDerWaalsContact O-N 3.15Å; R342-H344 VanDerWaalsContact C-N 3.3Å; R342-H344 PolarHBondContact O-N 3.15Å
345	K	67.7	Low	74.8	Confident	147 Å²	147	82.7 Å²	82.7	64%	0.639	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-0.1	-179.4	-66.8	-167.4	173.4	-168.7	0	114.1	R342 E347	R342-K345 PolarHBondContact O-N 2.81Å; K345-E347 HydrophobicContact CB-CB 4.49Å; K345-E347 HydrophobicContact CB-CG 3.87Å; K345-E347 WeakPolarHBondContact CD-OE1 3.25Å; K345-E347 PolarHBondContact O-N 3.37Å
346	A	63.5	Low	74.4	Confident	80 Å²	80	84 Å²	84	66%	0.661	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.8	27.4	-170.5	0	0	0	0	0	113.2	R342 E348	R342-A346 PolarHBondContact O-N 3.32Å; A346-E348 PolarHBondContact O-N 3Å; A346-E348 VanDerWaalsContact O-N 3.12Å
347	E	67.5	Low	74.2	Confident	96 Å²	96	89.6 Å²	89.6	45%	0.449	44%	0.439	S	S	.	.			trans	-71.9	112.1	175.2	-76	174	-159.1	0	0	106.2	R342 K345 P349	R342-E347 PolarHBondContact O-N 3.25Å; K345-E347 HydrophobicContact CB-CB 4.49Å; K345-E347 HydrophobicContact CB-CG 3.87Å; K345-E347 WeakPolarHBondContact CD-OE1 3.25Å; K345-E347 PolarHBondContact O-N 3.37Å; E347-P349 VanDerWaalsContact O-CD 3.26Å; E347-P349 WeakPolarHBondContact O-CD 3.47Å
348	E	72	Confident	74	Confident	96 Å²	96	89.5 Å²	89.5	45%	0.449	44%	0.441	S	S	.	.			trans	-109	78.3	174.2	-69.6	-172.7	154.8	0	0	108.7	A346 F350 G358 F359 V360	A346-E348 PolarHBondContact O-N 3Å; A346-E348 VanDerWaalsContact O-N 3.12Å; E348-F350 PolarHBondContact O-N 2.88Å; E348-F350 VanDerWaalsContact O-N 3.15Å; E348-G358 VanDerWaalsContact OE2-C 3.3Å; E348-G358 WeakPolarHBondContact OE2-CA 3.41Å; E348-G358 PolarHBondContact OE2-N 3.01Å; E348-F359 CarbonylContact C-O 3.56Å; E348-F359 WeakPolarHBondContact CA-O 3.37Å; E348-V360 HydrophobicContact CG-CG2 4.4Å
349	P	73.6	Confident	74	Confident	74 Å²	74	86.1 Å²	86.1	48%	0.481	42%	0.424	S	S	.	.			trans	-70.7	-16.1	-170.5	-13.6	31.5	0	0	0	112	E347 F359	E347-P349 VanDerWaalsContact O-CD 3.26Å; E347-P349 WeakPolarHBondContact O-CD 3.47Å; P349-F359 WeakPolarHBondContact CD-O 3.18Å
350	F	78.4	Confident	73.8	Confident	60 Å²	60	82.7 Å²	82.7	26%	0.263	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	95.2	-173.4	-53.3	-72.2	0	0	0	108.8	E348 G358 F359 P362 L365	E348-F350 PolarHBondContact O-N 2.88Å; E348-F350 VanDerWaalsContact O-N 3.15Å; F350-G358 CarbonylContact O-C 3.57Å; F350-F359 HydrophobicContact CB-CB 4.37Å; F350-F359 WeakPolarHBondContact CD2-O 3.28Å; F350-F359 PolarHBondContact N-O 2.81Å; F350-F359 PolarHBondContact O-N 3.41Å; F350-P362 HydrophobicContact CD1-CB 4.18Å; F350-P362 HydrophobicContact CD1-CG 4.08Å; F350-P362 HydrophobicContact CD2-CG 4.14Å; F350-P362 HydrophobicContact CE1-CB 4.2Å; F350-P362 HydrophobicContact CE1-CG 3.68Å; F350-P362 VanDerWaalsContact CE2-CD 3.47Å; F350-P362 HydrophobicContact CE2-CG 3.75Å; F350-P362 HydrophobicContact CG-CB 4.41Å; F350-P362 HydrophobicContact CG-CG 4.31Å; F350-P362 HydrophobicContact CZ-CB 4.45Å; F350-P362 HydrophobicContact CZ-CG 3.51Å; F350-L365 HydrophobicContact CB-CB 4.02Å; F350-L365 HydrophobicContact CB-CD2 3.77Å
351	K	75.6	Confident	73.4	Confident	136 Å²	136	83.3 Å²	83.3	59%	0.591	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	143.9	179.1	-62.8	-175.7	-179.7	-176.2	0	111.4
352	C	77	Confident	73.2	Confident	1 Å²	1	82.6 Å²	82.6	1%	0.007	42%	0.423	C	S	.	.			trans	-79.1	121.6	172.9	-176.1	0	0	0	0	110.5	L354 C355 E356 K357 F359 L365	C352-L354 PolarHBondContact O-N 2.95Å; C352-L354 VanDerWaalsContact O-N 3.13Å; C352-C355 PolarHBondContact O-N 2.9Å; C352-E356 WeakPolarHBondContact O-CA 3.14Å; C352-E356 PolarHBondContact O-N 2.93Å; C352-K357 PolarHBondContact N-O 3.37Å; C352-F359 HydrophobicContact CB-CE2 4.37Å; C352-L365 HydrophobicContact CB-CD1 3.71Å
353	N	73.1	Confident	73.1	Confident	146 Å²	146	80.2 Å²	80.2	78%	0.781	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.7	179.2	-59.8	-19.6	0	0	0	114
354	L	71.6	Confident	73.2	Confident	117 Å²	117	80.4 Å²	80.4	61%	0.613	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-23.6	-177.1	-61.7	175.4	0	0	0	113.9	C352 H372	C352-L354 PolarHBondContact O-N 2.95Å; C352-L354 VanDerWaalsContact O-N 3.13Å; L354-H372 HydrophobicContact CD1-CB 3.47Å; L354-H372 VanDerWaalsContact CD1-CB 3.47Å
355	C	76.4	Confident	73.3	Confident	48 Å²	48	77.7 Å²	77.7	32%	0.324	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.6	12	-178.6	72.2	0	0	0	0	114.1	C352 K357 H368 H372	C352-C355 PolarHBondContact O-N 2.9Å; C355-K357 PolarHBondContact O-N 2.75Å; C355-H368 PolarHBondContact SG-NE2 3.38Å; C355-H372 PolarHBondContact SG-NE2 2.9Å
356	E	71.2	Confident	73.6	Confident	165 Å²	165	73.6 Å²	73.6	77%	0.771	39%	0.391	S	S	*	.			trans	57.4	2.2	176.3	-59.7	-173.6	162.1	0	0	116.7	C352 G358	C352-E356 WeakPolarHBondContact O-CA 3.14Å; C352-E356 PolarHBondContact O-N 2.93Å; E356-G358 PolarHBondContact O-N 2.88Å
357	K	75.1	Confident	73.8	Confident	130 Å²	130	73.3 Å²	73.3	57%	0.565	37%	0.373	S	S	*	.			trans	-57.4	125.8	173.2	-74.7	-176.6	177.7	176.9	0	110.4	C352 C355 F359	C352-K357 PolarHBondContact N-O 3.37Å; C355-K357 PolarHBondContact O-N 2.75Å; K357-F359 HydrophobicContact CB-CE2 3.9Å; K357-F359 HydrophobicContact CB-CZ 4.06Å; K357-F359 WeakPolarHBondContact O-CD2 3.38Å; K357-F359 VanDerWaalsContact O-CE2 3.27Å; K357-F359 WeakPolarHBondContact O-CE2 3.23Å
358	G	74.6	Confident	74.1	Confident	10 Å²	10	69.9 Å²	69.9	10%	0.103	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	152	176.1	0	0	0	0	0	112.2	E348 F350 E356	E348-G358 VanDerWaalsContact OE2-C 3.3Å; E348-G358 WeakPolarHBondContact OE2-CA 3.41Å; E348-G358 PolarHBondContact OE2-N 3.01Å; F350-G358 CarbonylContact O-C 3.57Å; E356-G358 PolarHBondContact O-N 2.88Å
359	F	78.3	Confident	73.9	Confident	38 Å²	38	68.2 Å²	68.2	17%	0.167	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	142.9	178.4	-62.2	-87	0	0	0	110.1	E348 P349 F350 C352 K357 Q361 H364 L365 H368	E348-F359 CarbonylContact C-O 3.56Å; E348-F359 WeakPolarHBondContact CA-O 3.37Å; P349-F359 WeakPolarHBondContact CD-O 3.18Å; F350-F359 HydrophobicContact CB-CB 4.37Å; F350-F359 WeakPolarHBondContact CD2-O 3.28Å; F350-F359 PolarHBondContact N-O 2.81Å; F350-F359 PolarHBondContact O-N 3.41Å; C352-F359 HydrophobicContact CB-CE2 4.37Å; K357-F359 HydrophobicContact CB-CE2 3.9Å; K357-F359 HydrophobicContact CB-CZ 4.06Å; K357-F359 WeakPolarHBondContact O-CD2 3.38Å; K357-F359 VanDerWaalsContact O-CE2 3.27Å; K357-F359 WeakPolarHBondContact O-CE2 3.23Å; F359-Q361 VanDerWaalsContact C-N 3.31Å; F359-H364 HydrophobicContact CB-CB 4.23Å; F359-H364 HydrophobicContact CD1-CB 3.75Å; F359-H364 HydrophobicContact CG-CB 4.26Å; F359-L365 HydrophobicContact CB-CB 4.18Å; F359-L365 HydrophobicContact CD2-CB 3.84Å; F359-L365 HydrophobicContact CD2-CD1 3.78Å; F359-L365 HydrophobicContact CD2-CG 4.42Å; F359-L365 HydrophobicContact CE2-CD1 4.03Å; F359-L365 HydrophobicContact CG-CB 4.14Å; F359-H368 HydrophobicContact CE1-CB 3.78Å; F359-H368 AromaticContact CE1-CG 4Å; F359-H368 HydrophobicContact CE2-CB 3.72Å; F359-H368 AromaticContact CE2-CD2 3.36Å; F359-H368 WeakPolarHBondContact CE2-CD2 3.41Å; F359-H368 AromaticContact CE2-CG 3.52Å; F359-H368 HydrophobicContact CZ-CB 3.27Å; F359-H368 AromaticContact CZ-CD2 3.4Å; F359-H368 WeakPolarHBondContact CZ-CD2 3.46Å; F359-H368 AromaticContact CZ-CG 3.07Å; F359-H368 AromaticContact CZ-ND1 3.58Å
360	V	73.8	Confident	73.8	Confident	29 Å²	29	66 Å²	66	18%	0.176	33%	0.333	C	S	.	.	S	Bend	trans	-74.4	-23.9	176.3	-177.5	0	0	0	0	112.1	R342 T343 E348	R342-V360 HydrophobicContact CB-CG1 3.54Å; T343-V360 HydrophobicContact CG2-CG1 4.41Å; E348-V360 HydrophobicContact CG-CG2 4.4Å
361	Q	71.6	Confident	73.2	Confident	44 Å²	44	67.6 Å²	67.6	21%	0.206	35%	0.347	C	S	.	.	S	Bend	trans	-126.2	140.5	-177.8	-60.9	-175.6	34.3	0	0	111.5	R339 F359 S363 H364 L365	R339-Q361 HydrophobicContact CG-CG 4.28Å; F359-Q361 VanDerWaalsContact C-N 3.31Å; Q361-S363 VanDerWaalsContact C-N 3.31Å; Q361-S363 PolarHBondContact O-N 3.48Å; Q361-H364 HydrophobicContact CB-CB 4.42Å; Q361-H364 PolarHBondContact O-N 3.13Å; Q361-L365 PolarHBondContact O-N 2.89Å
362	P	73.9	Confident	72.8	Confident	66 Å²	66	64.7 Å²	64.7	43%	0.429	34%	0.336	S	S	.	.	H	α-helix	trans	-61.4	-38.1	176.4	-12.8	21.2	0	0	0	112.7	F350 H364 L365 V366	F350-P362 HydrophobicContact CD1-CB 4.18Å; F350-P362 HydrophobicContact CD1-CG 4.08Å; F350-P362 HydrophobicContact CD2-CG 4.14Å; F350-P362 HydrophobicContact CE1-CB 4.2Å; F350-P362 HydrophobicContact CE1-CG 3.68Å; F350-P362 VanDerWaalsContact CE2-CD 3.47Å; F350-P362 HydrophobicContact CE2-CG 3.75Å; F350-P362 HydrophobicContact CG-CB 4.41Å; F350-P362 HydrophobicContact CG-CG 4.31Å; F350-P362 HydrophobicContact CZ-CB 4.45Å; F350-P362 HydrophobicContact CZ-CG 3.51Å; P362-H364 VanDerWaalsContact C-N 3.26Å; P362-H364 PolarHBondContact O-N 3.37Å; P362-L365 WeakPolarHBondContact O-CB 3.46Å; P362-L365 PolarHBondContact O-N 3.17Å; P362-L365 VanDerWaalsContact O-N 3.17Å; P362-V366 WeakPolarHBondContact O-CG2 3.16Å; P362-V366 PolarHBondContact O-N 3.46Å
363	S	74.5	Confident	72	Confident	44 Å²	44	67.9 Å²	67.9	31%	0.308	37%	0.368	S	S	.	.	H	α-helix	trans	-59.3	-38.2	178	50.9	0	0	0	0	112.2	Q361 V366 Y367	Q361-S363 VanDerWaalsContact C-N 3.31Å; Q361-S363 PolarHBondContact O-N 3.48Å; S363-V366 PolarHBondContact O-N 3.13Å; S363-Y367 WeakPolarHBondContact O-CD2 3.46Å; S363-Y367 WeakPolarHBondContact O-CE2 3.49Å; S363-Y367 VanDerWaalsContact O-CG 3.24Å; S363-Y367 PolarHBondContact O-N 2.65Å
364	H	75.8	Confident	71.1	Confident	84 Å²	84	66.1 Å²	66.1	39%	0.389	36%	0.358	S	S	.	.	H	α-helix	trans	-70.1	-37.9	177.5	-62.5	177.2	0	0	0	111.8	F359 Q361 P362 Y367 H368	F359-H364 HydrophobicContact CB-CB 4.23Å; F359-H364 HydrophobicContact CD1-CB 3.75Å; F359-H364 HydrophobicContact CG-CB 4.26Å; Q361-H364 HydrophobicContact CB-CB 4.42Å; Q361-H364 PolarHBondContact O-N 3.13Å; P362-H364 VanDerWaalsContact C-N 3.26Å; P362-H364 PolarHBondContact O-N 3.37Å; H364-Y367 PolarHBondContact O-N 3.48Å; H364-H368 VanDerWaalsContact O-CB 3.24Å; H364-H368 WeakPolarHBondContact O-CB 3.32Å; H364-H368 PolarHBondContact O-N 2.81Å
365	L	74.4	Confident	70.5	Confident	21 Å²	21	67 Å²	67	11%	0.11	36%	0.359	C	S	.	.	H	α-helix	trans	-61.3	-46.4	171.2	171.2	61.7	0	0	0	110.6	F350 C352 F359 Q361 P362 Y367 H368 Q369	F350-L365 HydrophobicContact CB-CB 4.02Å; F350-L365 HydrophobicContact CB-CD2 3.77Å; C352-L365 HydrophobicContact CB-CD1 3.71Å; F359-L365 HydrophobicContact CB-CB 4.18Å; F359-L365 HydrophobicContact CD2-CB 3.84Å; F359-L365 HydrophobicContact CD2-CD1 3.78Å; F359-L365 HydrophobicContact CD2-CG 4.42Å; F359-L365 HydrophobicContact CE2-CD1 4.03Å; F359-L365 HydrophobicContact CG-CB 4.14Å; Q361-L365 PolarHBondContact O-N 2.89Å; P362-L365 WeakPolarHBondContact O-CB 3.46Å; P362-L365 PolarHBondContact O-N 3.17Å; P362-L365 VanDerWaalsContact O-N 3.17Å; L365-Y367 PolarHBondContact O-N 3.21Å; L365-H368 CarbonylContact O-C 3.53Å; L365-H368 WeakPolarHBondContact O-CB 3.47Å; L365-H368 PolarHBondContact O-N 3.18Å; L365-H368 VanDerWaalsContact O-N 3.14Å; L365-Q369 HydrophobicContact CD1-CG 3.95Å; L365-Q369 HydrophobicContact CG-CG 4.32Å; L365-Q369 VanDerWaalsContact O-CG 3.32Å; L365-Q369 WeakPolarHBondContact O-CG 3.35Å; L365-Q369 PolarHBondContact O-N 3.49Å
366	V	73	Confident	69.7	Low	61 Å²	61	67.9 Å²	67.9	37%	0.37	36%	0.36	S	S	.	.	H	α-helix	trans	-56.6	-53.3	176.6	172.7	0	0	0	0	109.6	P362 S363 H368 Q369 H370	P362-V366 WeakPolarHBondContact O-CG2 3.16Å; P362-V366 PolarHBondContact O-N 3.46Å; S363-V366 PolarHBondContact O-N 3.13Å; V366-H368 VanDerWaalsContact C-N 3.25Å; V366-H368 PolarHBondContact O-N 3.15Å; V366-Q369 WeakPolarHBondContact O-CB 3.37Å; V366-Q369 PolarHBondContact O-N 3.24Å; V366-Q369 VanDerWaalsContact O-N 3.13Å; V366-H370 PolarHBondContact O-CE1 3.29Å; V366-H370 VanDerWaalsContact O-CE1 3.29Å; V366-H370 PolarHBondContact O-N 3.27Å; V366-H370 PolarHBondContact O-ND1 2.94Å
367	Y	68.9	Low	69.2	Low	73 Å²	73	65.1 Å²	65.1	29%	0.286	35%	0.35	S	S	.	.	H	α-helix	trans	-58.9	-36.4	177.3	-59.5	-43.7	0	0	0	113.5	S363 H364 L365 H370 N388 Q389	S363-Y367 WeakPolarHBondContact O-CD2 3.46Å; S363-Y367 WeakPolarHBondContact O-CE2 3.49Å; S363-Y367 VanDerWaalsContact O-CG 3.24Å; S363-Y367 PolarHBondContact O-N 2.65Å; H364-Y367 PolarHBondContact O-N 3.48Å; L365-Y367 PolarHBondContact O-N 3.21Å; Y367-H370 PolarHBondContact O-N 3.02Å; Y367-N388 WeakPolarHBondContact CD1-O 3.49Å; Y367-Q389 HydrophobicContact CD1-CG 3.92Å; Y367-Q389 HydrophobicContact CD2-CG 3.99Å; Y367-Q389 HydrophobicContact CE1-CG 4.25Å; Y367-Q389 HydrophobicContact CE2-CG 4.33Å; Y367-Q389 HydrophobicContact CG-CG 3.8Å
368	H	72.6	Confident	68.8	Low	25 Å²	25	62 Å²	62	12%	0.116	34%	0.337	C	S	.	.	H	α-helix	trans	-70	-36.6	177.5	175.3	71.6	0	0	0	113	C355 F359 H364 L365 V366 H370 V371 H372	C355-H368 PolarHBondContact SG-NE2 3.38Å; F359-H368 HydrophobicContact CE1-CB 3.78Å; F359-H368 AromaticContact CE1-CG 4Å; F359-H368 HydrophobicContact CE2-CB 3.72Å; F359-H368 AromaticContact CE2-CD2 3.36Å; F359-H368 WeakPolarHBondContact CE2-CD2 3.41Å; F359-H368 AromaticContact CE2-CG 3.52Å; F359-H368 HydrophobicContact CZ-CB 3.27Å; F359-H368 AromaticContact CZ-CD2 3.4Å; F359-H368 WeakPolarHBondContact CZ-CD2 3.46Å; F359-H368 AromaticContact CZ-CG 3.07Å; F359-H368 AromaticContact CZ-ND1 3.58Å; H364-H368 VanDerWaalsContact O-CB 3.24Å; H364-H368 WeakPolarHBondContact O-CB 3.32Å; H364-H368 PolarHBondContact O-N 2.81Å; L365-H368 CarbonylContact O-C 3.53Å; L365-H368 WeakPolarHBondContact O-CB 3.47Å; L365-H368 PolarHBondContact O-N 3.18Å; L365-H368 VanDerWaalsContact O-N 3.14Å; V366-H368 VanDerWaalsContact C-N 3.25Å; V366-H368 PolarHBondContact O-N 3.15Å; H368-H370 PolarHBondContact O-N 3.21Å; H368-V371 WeakPolarHBondContact O-CB 3.5Å; H368-V371 WeakPolarHBondContact O-CG2 3.28Å; H368-V371 PolarHBondContact O-N 3.36Å; H368-H372 AromaticContact CD2-NE2 3.95Å; H368-H372 AromaticContact CE1-NE2 3.74Å; H368-H372 AromaticContact NE2-CD2 4Å; H368-H372 AromaticContact NE2-NE2 3.19Å; H368-H372 PolarHBondContact NE2-NE2 2.95Å; H368-H372 VanDerWaalsContact NE2-NE2 3.19Å
369	Q	68.6	Low	68.3	Low	60 Å²	60	66 Å²	66	28%	0.28	35%	0.351	S	S	.	.	H	α-helix	trans	-59	-30.3	176.2	-76	169.1	-33.2	0	0	112.2	L365 V366 V371 H372	L365-Q369 HydrophobicContact CD1-CG 3.95Å; L365-Q369 HydrophobicContact CG-CG 4.32Å; L365-Q369 VanDerWaalsContact O-CG 3.32Å; L365-Q369 WeakPolarHBondContact O-CG 3.35Å; L365-Q369 PolarHBondContact O-N 3.49Å; V366-Q369 WeakPolarHBondContact O-CB 3.37Å; V366-Q369 PolarHBondContact O-N 3.24Å; V366-Q369 VanDerWaalsContact O-N 3.13Å; Q369-V371 VanDerWaalsContact C-N 3.26Å; Q369-V371 PolarHBondContact O-N 2.81Å; Q369-H372 WeakPolarHBondContact O-CB 3.45Å; Q369-H372 PolarHBondContact O-N 3.45Å; Q369-H372 VanDerWaalsContact O-N 3.15Å
370	H	71.1	Confident	67.9	Low	28 Å²	28	64.2 Å²	64.2	13%	0.13	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-72.5	-17.4	175.8	-60.5	85	0	0	0	113.4	V366 Y367 H368 H372 G373 I374 E375 N388	V366-H370 PolarHBondContact O-CE1 3.29Å; V366-H370 VanDerWaalsContact O-CE1 3.29Å; V366-H370 PolarHBondContact O-N 3.27Å; V366-H370 PolarHBondContact O-ND1 2.94Å; Y367-H370 PolarHBondContact O-N 3.02Å; H368-H370 PolarHBondContact O-N 3.21Å; H370-H372 PolarHBondContact O-N 3.12Å; H370-G373 PolarHBondContact O-N 3.45Å; H370-I374 PolarHBondContact CD2-O 3.31Å; H370-I374 VanDerWaalsContact CD2-O 3.27Å; H370-E375 PolarHBondContact CD2-O 3.22Å; H370-E375 VanDerWaalsContact CD2-O 3.24Å; H370-N388 HydrophobicContact CB-CB 4.16Å
371	V	66.9	Low	67.7	Low	94 Å²	94	68.9 Å²	68.9	57%	0.57	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-65.8	-25.3	170.9	-177.9	0	0	0	0	110.8	H368 Q369 G373	H368-V371 WeakPolarHBondContact O-CB 3.5Å; H368-V371 WeakPolarHBondContact O-CG2 3.28Å; H368-V371 PolarHBondContact O-N 3.36Å; Q369-V371 VanDerWaalsContact C-N 3.26Å; Q369-V371 PolarHBondContact O-N 2.81Å; V371-G373 PolarHBondContact O-N 2.77Å
372	H	66.8	Low	67.6	Low	75 Å²	75	72.1 Å²	72.1	35%	0.347	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-83.8	12.2	175.6	-59.2	-68.2	0	0	0	113.6	L354 C355 H368 Q369 H370	L354-H372 HydrophobicContact CD1-CB 3.47Å; L354-H372 VanDerWaalsContact CD1-CB 3.47Å; C355-H372 PolarHBondContact SG-NE2 2.9Å; H368-H372 AromaticContact CD2-NE2 3.95Å; H368-H372 AromaticContact CE1-NE2 3.74Å; H368-H372 AromaticContact NE2-CD2 4Å; H368-H372 AromaticContact NE2-NE2 3.19Å; H368-H372 PolarHBondContact NE2-NE2 2.95Å; H368-H372 VanDerWaalsContact NE2-NE2 3.19Å; Q369-H372 WeakPolarHBondContact O-CB 3.45Å; Q369-H372 PolarHBondContact O-N 3.45Å; Q369-H372 VanDerWaalsContact O-N 3.15Å; H370-H372 PolarHBondContact O-N 3.12Å
373	G	60.4	Low	67.6	Low	67 Å²	67	71 Å²	71	69%	0.691	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.1	8.2	166.2	0	0	0	0	0	116.6	H370 V371	H370-G373 PolarHBondContact O-N 3.45Å; V371-G373 PolarHBondContact O-N 2.77Å
374	I	54.6	Low	67.3	Low	110 Å²	110	75.1 Å²	75.1	56%	0.564	40%	0.398	S	S	*	.	S	Bend	trans	-77.9	127	168.2	-52.3	176.5	0	0	0	107.3	H370	H370-I374 PolarHBondContact CD2-O 3.31Å; H370-I374 VanDerWaalsContact CD2-O 3.27Å
375	E	57.3	Low	67.1	Low	136 Å²	136	77.5 Å²	77.5	64%	0.636	41%	0.407	S	S	*	.			trans	-27.2	133.9	-167.7	-74.5	-164.7	100.6	0	0	117.6	H370 L377 K379	H370-E375 PolarHBondContact CD2-O 3.22Å; H370-E375 VanDerWaalsContact CD2-O 3.24Å; E375-L377 PolarHBondContact O-N 3.38Å; E375-K379 IonicContact OE1-NZ 2.71Å; E375-K379 PolarHBondContact OE1-NZ 3.29Å
376	N	60.5	Low	66.7	Low	65 Å²	65	77.9 Å²	77.9	35%	0.348	42%	0.416	S	S	.	.			trans	-60.1	110.3	168.9	-71.1	-63.2	0	0	0	111.2	F378 K379 G386	N376-F378 PolarHBondContact O-N 3.46Å; N376-K379 WeakPolarHBondContact O-CE 3.39Å; N376-G386 VanDerWaalsContact CB-CA 3.43Å; N376-G386 VanDerWaalsContact CG-C 3.45Å
377	L	60.8	Low	66.7	Low	107 Å²	107	76.5 Å²	76.5	56%	0.56	41%	0.405	S	S	*	.	S	Bend	trans	-59.2	-28	178.4	-70	170	0	0	0	113.4	E375	E375-L377 PolarHBondContact O-N 3.38Å
378	F	65.4	Low	66.5	Low	66 Å²	66	74.7 Å²	74.7	29%	0.289	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	91.9	-173.3	-58.4	-72.3	0	0	0	110.1	N376 F387 S390 L393	N376-F378 PolarHBondContact O-N 3.46Å; F378-F387 HydrophobicContact CB-CB 4.29Å; F378-F387 PolarHBondContact N-O 3.31Å; F378-F387 WeakPolarHBondContact O-CD2 3.38Å; F378-F387 PolarHBondContact O-N 3.18Å; F378-S390 VanDerWaalsContact CD2-N 3.33Å; F378-L393 HydrophobicContact CB-CB 3.97Å; F378-L393 HydrophobicContact CB-CD2 3.72Å; F378-L393 HydrophobicContact CB-CG 4.44Å
379	K	64.3	Low	66.2	Low	93 Å²	93	76.6 Å²	76.6	40%	0.404	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	140.6	176.8	-61	176.6	-173	170.9	0	110.3	E375 N376 N381 L393	E375-K379 IonicContact OE1-NZ 2.71Å; E375-K379 PolarHBondContact OE1-NZ 3.29Å; N376-K379 WeakPolarHBondContact O-CE 3.39Å; K379-N381 PolarHBondContact O-N 3.45Å; K379-N381 PolarHBondContact O-OD1 3.15Å; K379-L393 WeakPolarHBondContact O-CD2 3.33Å
380	C	71.6	Confident	66.1	Low	1 Å²	1	76.2 Å²	76.2	1%	0.007	41%	0.413	C	S	.	.			trans	-79.7	115.3	172.3	-178.6	0	0	0	0	110.1	V382 C383 Q384 K385 F387 L393 H396	C380-V382 PolarHBondContact O-N 3.44Å; C380-C383 PolarHBondContact O-N 3.14Å; C380-Q384 WeakPolarHBondContact O-CA 3.25Å; C380-Q384 PolarHBondContact O-N 2.93Å; C380-K385 PolarHBondContact N-O 2.76Å; C380-F387 HydrophobicContact CB-CE2 4.16Å; C380-L393 HydrophobicContact CB-CD1 3.61Å; C380-H396 PolarHBondContact SG-CD2 3.49Å; C380-H396 PolarHBondContact SG-NE2 2.8Å; C380-H396 VanDerWaalsContact SG-NE2 3.39Å
381	N	69	Low	66	Low	127 Å²	127	78 Å²	78	68%	0.679	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.3	-179.1	-54.5	4.8	0	0	0	113.7	K379	K379-N381 PolarHBondContact O-N 3.45Å; K379-N381 PolarHBondContact O-OD1 3.15Å
382	V	68.7	Low	66.2	Low	111 Å²	111	76 Å²	76	67%	0.673	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-43.4	-178.1	-175.9	0	0	0	0	112.5	C380	C380-V382 PolarHBondContact O-N 3.44Å
383	C	74.3	Confident	66.4	Low	44 Å²	44	73.1 Å²	73.1	30%	0.297	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	5	-175	76.4	0	0	0	0	114.4	C380 K385 H396	C380-C383 PolarHBondContact O-N 3.14Å; C383-K385 PolarHBondContact O-N 2.92Å; C383-H396 PolarHBondContact SG-CE1 3.11Å; C383-H396 PolarHBondContact SG-NE2 3.36Å
384	Q	68.3	Low	66.8	Low	130 Å²	130	75 Å²	75	61%	0.607	39%	0.394	S	S	*	.			trans	55	10.6	-179.3	-58.9	-61.8	-14.4	0	0	115.9	C380 G386	C380-Q384 WeakPolarHBondContact O-CA 3.25Å; C380-Q384 PolarHBondContact O-N 2.93Å; Q384-G386 PolarHBondContact O-N 2.84Å
385	K	71.1	Confident	67.4	Low	133 Å²	133	75.2 Å²	75.2	58%	0.578	39%	0.388	S	S	*	.			trans	-64.8	127.4	171.9	-72.3	-174.9	179	-176.1	0	110.1	C380 C383 F387	C380-K385 PolarHBondContact N-O 2.76Å; C383-K385 PolarHBondContact O-N 2.92Å; K385-F387 HydrophobicContact CB-CE2 3.93Å; K385-F387 HydrophobicContact CB-CZ 4.08Å; K385-F387 WeakPolarHBondContact O-CD2 3.39Å; K385-F387 VanDerWaalsContact O-CE2 3.25Å; K385-F387 WeakPolarHBondContact O-CE2 3.4Å
386	G	66.5	Low	68.2	Low	29 Å²	29	70.1 Å²	70.1	30%	0.299	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	139.5	174.8	0	0	0	0	0	112	N376 Q384	N376-G386 VanDerWaalsContact CB-CA 3.43Å; N376-G386 VanDerWaalsContact CG-C 3.45Å; Q384-G386 PolarHBondContact O-N 2.84Å
387	F	72.1	Confident	68.3	Low	32 Å²	32	70.8 Å²	70.8	14%	0.14	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	143.8	174.4	-59.5	-89.6	0	0	0	109.5	F378 C380 K385 E392 L393 H396	F378-F387 HydrophobicContact CB-CB 4.29Å; F378-F387 PolarHBondContact N-O 3.31Å; F378-F387 WeakPolarHBondContact O-CD2 3.38Å; F378-F387 PolarHBondContact O-N 3.18Å; C380-F387 HydrophobicContact CB-CE2 4.16Å; K385-F387 HydrophobicContact CB-CE2 3.93Å; K385-F387 HydrophobicContact CB-CZ 4.08Å; K385-F387 WeakPolarHBondContact O-CD2 3.39Å; K385-F387 VanDerWaalsContact O-CE2 3.25Å; K385-F387 WeakPolarHBondContact O-CE2 3.4Å; F387-E392 HydrophobicContact CB-CB 4.31Å; F387-E392 HydrophobicContact CD1-CB 3.79Å; F387-E392 HydrophobicContact CG-CB 4.36Å; F387-L393 HydrophobicContact CB-CB 4.15Å; F387-L393 HydrophobicContact CD2-CB 3.82Å; F387-L393 HydrophobicContact CD2-CD1 3.6Å; F387-L393 HydrophobicContact CD2-CG 4.3Å; F387-L393 HydrophobicContact CE2-CD1 3.77Å; F387-L393 HydrophobicContact CG-CB 4.06Å; F387-H396 HydrophobicContact CE1-CB 3.78Å; F387-H396 HydrophobicContact CE2-CB 3.87Å; F387-H396 AromaticContact CE2-CD2 3.75Å; F387-H396 AromaticContact CE2-CG 3.69Å; F387-H396 HydrophobicContact CZ-CB 3.32Å; F387-H396 AromaticContact CZ-CD2 3.73Å; F387-H396 AromaticContact CZ-CG 3.2Å; F387-H396 AromaticContact CZ-ND1 3.54Å
388	N	66.4	Low	68.2	Low	36 Å²	36	69.2 Å²	69.2	19%	0.193	36%	0.36	C	S	.	.	S	Bend	trans	-83.5	-13.6	176.2	61	16.2	0	0	0	112.6	Y367 H370 E392	Y367-N388 WeakPolarHBondContact CD1-O 3.49Å; H370-N388 HydrophobicContact CB-CB 4.16Å; N388-E392 PolarHBondContact OD1-OE2 3.46Å
389	Q	65.5	Low	68	Low	64 Å²	64	68.7 Å²	68.7	30%	0.299	36%	0.363	S	S	.	.	S	Bend	trans	-131.5	139.2	178.4	-68.9	175.2	41	0	0	111.5	Y367 S391 E392 L393	Y367-Q389 HydrophobicContact CD1-CG 3.92Å; Y367-Q389 HydrophobicContact CD2-CG 3.99Å; Y367-Q389 HydrophobicContact CE1-CG 4.25Å; Y367-Q389 HydrophobicContact CE2-CG 4.33Å; Y367-Q389 HydrophobicContact CG-CG 3.8Å; Q389-S391 VanDerWaalsContact C-N 3.28Å; Q389-S391 PolarHBondContact O-N 3.12Å; Q389-S391 PolarHBondContact OE1-OG 3.47Å; Q389-E392 HydrophobicContact CB-CB 4.39Å; Q389-E392 HydrophobicContact CB-CG 3.95Å; Q389-E392 PolarHBondContact O-N 3.03Å; Q389-E392 VanDerWaalsContact O-N 3.15Å; Q389-L393 PolarHBondContact O-N 2.99Å
390	S	67	Low	67.7	Low	52 Å²	52	69 Å²	69	36%	0.364	37%	0.366	S	S	.	.	H	α-helix	trans	-66.2	-31.3	179.2	88	0	0	0	0	112.8	F378 E392 L393 L394	F378-S390 VanDerWaalsContact CD2-N 3.33Å; S390-E392 PolarHBondContact O-N 2.68Å; S390-L393 PolarHBondContact O-N 2.83Å; S390-L394 WeakPolarHBondContact O-CB 3.25Å; S390-L394 WeakPolarHBondContact O-CG 3.49Å; S390-L394 PolarHBondContact O-N 2.79Å
391	S	68.9	Low	67	Low	65 Å²	65	74.1 Å²	74.1	46%	0.455	39%	0.393	S	S	.	.	H	α-helix	trans	-61.2	-34.8	174.7	57.6	0	0	0	0	111.9	Q389 R395	Q389-S391 VanDerWaalsContact C-N 3.28Å; Q389-S391 PolarHBondContact O-N 3.12Å; Q389-S391 PolarHBondContact OE1-OG 3.47Å; S391-R395 VanDerWaalsContact O-CB 3.24Å; S391-R395 WeakPolarHBondContact O-CB 3.37Å; S391-R395 PolarHBondContact O-N 3.43Å
392	E	70.3	Confident	66.4	Low	53 Å²	53	72.1 Å²	72.1	25%	0.248	39%	0.394	C	S	.	.	H	α-helix	trans	-76	-37.9	177.8	-62.2	-164.6	141	0	0	112.1	F387 N388 Q389 S390 R395 H396	F387-E392 HydrophobicContact CB-CB 4.31Å; F387-E392 HydrophobicContact CD1-CB 3.79Å; F387-E392 HydrophobicContact CG-CB 4.36Å; N388-E392 PolarHBondContact OD1-OE2 3.46Å; Q389-E392 HydrophobicContact CB-CB 4.39Å; Q389-E392 HydrophobicContact CB-CG 3.95Å; Q389-E392 PolarHBondContact O-N 3.03Å; Q389-E392 VanDerWaalsContact O-N 3.15Å; S390-E392 PolarHBondContact O-N 2.68Å; E392-R395 PolarHBondContact O-N 3.49Å; E392-R395 IonicContact OE1-NH2 3.39Å; E392-R395 PolarHBondContact OE1-NH2 3.42Å; E392-H396 VanDerWaalsContact O-CB 3.29Å; E392-H396 WeakPolarHBondContact O-CB 3.45Å; E392-H396 PolarHBondContact O-N 2.68Å
393	L	72.3	Confident	66.1	Low	15 Å²	15	73.4 Å²	73.4	8%	0.079	39%	0.393	C	S	.	.	H	α-helix	trans	-63.5	-46.6	171	174.6	61.7	0	0	0	111.3	F378 K379 C380 F387 Q389 S390 R395 H396 K397	F378-L393 HydrophobicContact CB-CB 3.97Å; F378-L393 HydrophobicContact CB-CD2 3.72Å; F378-L393 HydrophobicContact CB-CG 4.44Å; K379-L393 WeakPolarHBondContact O-CD2 3.33Å; C380-L393 HydrophobicContact CB-CD1 3.61Å; F387-L393 HydrophobicContact CB-CB 4.15Å; F387-L393 HydrophobicContact CD2-CB 3.82Å; F387-L393 HydrophobicContact CD2-CD1 3.6Å; F387-L393 HydrophobicContact CD2-CG 4.3Å; F387-L393 HydrophobicContact CE2-CD1 3.77Å; F387-L393 HydrophobicContact CG-CB 4.06Å; Q389-L393 PolarHBondContact O-N 2.99Å; S390-L393 PolarHBondContact O-N 2.83Å; L393-R395 VanDerWaalsContact C-N 3.32Å; L393-R395 PolarHBondContact O-N 3.21Å; L393-H396 WeakPolarHBondContact O-CB 3.24Å; L393-H396 PolarHBondContact O-N 3.11Å; L393-H396 VanDerWaalsContact O-N 3.11Å; L393-K397 HydrophobicContact CD1-CG 4.3Å; L393-K397 HydrophobicContact CG-CD 4.47Å; L393-K397 WeakPolarHBondContact O-CG 3.4Å; L393-K397 PolarHBondContact O-N 3.3Å
394	L	68.1	Low	65.9	Low	105 Å²	105	77.5 Å²	77.5	55%	0.55	40%	0.402	S	S	.	.	H	α-helix	trans	-59.1	-45.5	176.2	-74.7	170	0	0	0	110.8	S390 H396 K397 C398	S390-L394 WeakPolarHBondContact O-CB 3.25Å; S390-L394 WeakPolarHBondContact O-CG 3.49Å; S390-L394 PolarHBondContact O-N 2.79Å; L394-H396 VanDerWaalsContact C-N 3.3Å; L394-H396 PolarHBondContact O-N 3.06Å; L394-K397 PolarHBondContact O-N 3.16Å; L394-C398 PolarHBondContact O-N 3.3Å; L394-C398 PolarHBondContact O-SG 2.62Å; L394-C398 VanDerWaalsContact O-SG 3.33Å
395	R	67.2	Low	65.8	Low	116 Å²	116	75.5 Å²	75.5	44%	0.438	40%	0.4	S	S	.	.	H	α-helix	trans	-60.2	-39.8	173.6	-179.1	179.3	66.6	-173.1	-5.1	112.2	S391 E392 L393 C398 V399	S391-R395 VanDerWaalsContact O-CB 3.24Å; S391-R395 WeakPolarHBondContact O-CB 3.37Å; S391-R395 PolarHBondContact O-N 3.43Å; E392-R395 PolarHBondContact O-N 3.49Å; E392-R395 IonicContact OE1-NH2 3.39Å; E392-R395 PolarHBondContact OE1-NH2 3.42Å; L393-R395 VanDerWaalsContact C-N 3.32Å; L393-R395 PolarHBondContact O-N 3.21Å; R395-C398 PolarHBondContact O-N 3.37Å; R395-V399 VanDerWaalsContact O-CG2 3.25Å; R395-V399 WeakPolarHBondContact O-CG2 3.4Å; R395-V399 PolarHBondContact O-N 3.13Å
396	H	73.3	Confident	65.9	Low	28 Å²	28	73 Å²	73	13%	0.13	39%	0.39	C	S	.	.	H	α-helix	trans	-66.3	-41.3	177.3	170.2	81.1	0	0	0	111.9	C380 C383 F387 E392 L393 L394 C398 V399 Q400	C380-H396 PolarHBondContact SG-CD2 3.49Å; C380-H396 PolarHBondContact SG-NE2 2.8Å; C380-H396 VanDerWaalsContact SG-NE2 3.39Å; C383-H396 PolarHBondContact SG-CE1 3.11Å; C383-H396 PolarHBondContact SG-NE2 3.36Å; F387-H396 HydrophobicContact CE1-CB 3.78Å; F387-H396 HydrophobicContact CE2-CB 3.87Å; F387-H396 AromaticContact CE2-CD2 3.75Å; F387-H396 AromaticContact CE2-CG 3.69Å; F387-H396 HydrophobicContact CZ-CB 3.32Å; F387-H396 AromaticContact CZ-CD2 3.73Å; F387-H396 AromaticContact CZ-CG 3.2Å; F387-H396 AromaticContact CZ-ND1 3.54Å; E392-H396 VanDerWaalsContact O-CB 3.29Å; E392-H396 WeakPolarHBondContact O-CB 3.45Å; E392-H396 PolarHBondContact O-N 2.68Å; L393-H396 WeakPolarHBondContact O-CB 3.24Å; L393-H396 PolarHBondContact O-N 3.11Å; L393-H396 VanDerWaalsContact O-N 3.11Å; L394-H396 VanDerWaalsContact C-N 3.3Å; L394-H396 PolarHBondContact O-N 3.06Å; H396-C398 PolarHBondContact O-N 3.25Å; H396-V399 WeakPolarHBondContact O-CB 3.34Å; H396-V399 PolarHBondContact O-N 2.81Å; H396-Q400 PolarHBondContact O-N 3.18Å
397	K	63.7	Low	66.3	Low	80 Å²	80	78.5 Å²	78.5	35%	0.348	41%	0.405	S	S	.	.	H	α-helix	trans	-61.5	-41.2	173.7	-71	-178.8	177.7	-174.5	0	111.7	L393 L394 V399 Q400 N401	L393-K397 HydrophobicContact CD1-CG 4.3Å; L393-K397 HydrophobicContact CG-CD 4.47Å; L393-K397 WeakPolarHBondContact O-CG 3.4Å; L393-K397 PolarHBondContact O-N 3.3Å; L394-K397 PolarHBondContact O-N 3.16Å; K397-V399 PolarHBondContact O-N 3.01Å; K397-Q400 PolarHBondContact O-N 3.35Å; K397-N401 PolarHBondContact O-N 2.78Å
398	C	58.8	Low	66.4	Low	73 Å²	73	77 Å²	77	49%	0.493	40%	0.398	S	S	.	.	H	α-helix	trans	-67.1	-12	172.4	-64.5	0	0	0	0	114.7	L394 R395 H396 N401	L394-C398 PolarHBondContact O-N 3.3Å; L394-C398 PolarHBondContact O-SG 2.62Å; L394-C398 VanDerWaalsContact O-SG 3.33Å; R395-C398 PolarHBondContact O-N 3.37Å; H396-C398 PolarHBondContact O-N 3.25Å; C398-N401 CarbonylContact C-O 3.58Å
399	V	59.8	Low	66.7	Low	55 Å²	55	79.6 Å²	79.6	33%	0.333	43%	0.425	S	S	.	.	H	α-helix	trans	-90.5	-26.8	176.1	168.7	0	0	0	0	111.2	R395 H396 K397 K416	R395-V399 VanDerWaalsContact O-CG2 3.25Å; R395-V399 WeakPolarHBondContact O-CG2 3.4Å; R395-V399 PolarHBondContact O-N 3.13Å; H396-V399 WeakPolarHBondContact O-CB 3.34Å; H396-V399 PolarHBondContact O-N 2.81Å; K397-V399 PolarHBondContact O-N 3.01Å; V399-K416 HydrophobicContact CG1-CD 4.46Å; V399-K416 HydrophobicContact CG2-CD 4.21Å
400	Q	58.7	Low	66.9	Low	100 Å²	100	81.7 Å²	81.7	47%	0.467	44%	0.442	S	S	.	.	H	α-helix	trans	-78.5	-43.9	177.1	-67.6	-116.8	-41.9	0	0	111.4	H396 K397 A402	H396-Q400 PolarHBondContact O-N 3.18Å; K397-Q400 PolarHBondContact O-N 3.35Å; Q400-A402 PolarHBondContact O-N 3.17Å
401	N	57.6	Low	67.4	Low	108 Å²	108	81.5 Å²	81.5	58%	0.578	44%	0.44	S	S	*	.	S	Bend	trans	-75.1	119.1	162.8	-65.3	-30.3	0	0	0	106.8	K397 C398 E403	K397-N401 PolarHBondContact O-N 2.78Å; C398-N401 CarbonylContact C-O 3.58Å; N401-E403 PolarHBondContact O-N 2.92Å
402	A	56.9	Low	67.4	Low	86 Å²	86	84.3 Å²	84.3	71%	0.711	45%	0.45	S	S	*	.			trans	-67.3	22.2	-172.6	0	0	0	0	0	115	Q400 R404	Q400-A402 PolarHBondContact O-N 3.17Å; A402-R404 PolarHBondContact O-N 3.08Å; A402-R404 VanDerWaalsContact O-N 3.16Å
403	E	61.6	Low	67.6	Low	137 Å²	137	87.7 Å²	87.7	64%	0.64	46%	0.464	S	S	*	.			trans	-66.4	114.4	177.2	-65.9	-172	168.5	0	0	109.7	N401 P405	N401-E403 PolarHBondContact O-N 2.92Å; E403-P405 WeakPolarHBondContact O-CD 3.46Å
404	R	69.5	Low	67.7	Low	131 Å²	131	88.7 Å²	88.7	49%	0.494	47%	0.472	S	S	.	.			trans	-107.3	78.8	172.7	-68.9	175.3	176.5	-167.3	6.8	107.6	A402 F406 S414 Y415 K416	A402-R404 PolarHBondContact O-N 3.08Å; A402-R404 VanDerWaalsContact O-N 3.16Å; R404-F406 PolarHBondContact O-N 2.91Å; R404-S414 VanDerWaalsContact CB-CB 3.41Å; R404-S414 WeakPolarHBondContact CD-O 3.27Å; R404-Y415 CarbonylContact C-O 3.55Å; R404-K416 HydrophobicContact CG-CG 3.91Å
405	P	67.3	Low	68.1	Low	88 Å²	88	86.1 Å²	86.1	57%	0.571	46%	0.456	S	S	*	.			trans	-67.8	-20.9	-168.6	23.5	-32.6	0	0	0	113.2	E403 K407	E403-P405 WeakPolarHBondContact O-CD 3.46Å; P405-K407 PolarHBondContact O-N 3.19Å
406	F	73.4	Confident	68.1	Low	81 Å²	81	84.9 Å²	84.9	36%	0.355	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	95.9	-176.4	-56.2	-74.9	0	0	0	110.6	R404 Y415 R417 A418 L421	R404-F406 PolarHBondContact O-N 2.91Å; F406-Y415 PolarHBondContact N-O 3.19Å; F406-Y415 PolarHBondContact O-N 3.06Å; F406-R417 VanDerWaalsContact CD2-C 3.42Å; F406-A418 HydrophobicContact CD1-CB 3.84Å; F406-A418 VanDerWaalsContact CD2-N 3.33Å; F406-A418 HydrophobicContact CE1-CB 3.69Å; F406-A418 HydrophobicContact CE2-CB 4.43Å; F406-A418 HydrophobicContact CG-CB 4.29Å; F406-A418 HydrophobicContact CZ-CB 4Å; F406-L421 HydrophobicContact CB-CB 3.96Å; F406-L421 HydrophobicContact CB-CD2 3.79Å; F406-L421 HydrophobicContact CB-CG 4.48Å
407	K	73.4	Confident	68	Low	143 Å²	143	89.2 Å²	89.2	62%	0.622	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	138.5	179.6	-57.3	-173.9	-177.7	176.1	0	111.5	P405 L421	P405-K407 PolarHBondContact O-N 3.19Å; K407-L421 WeakPolarHBondContact O-CD2 3.5Å
408	C	74.4	Confident	68.4	Low	0 Å²	0	87.9 Å²	87.9	0%	0	47%	0.472	C	S	.	.			trans	-78.3	121.1	171.8	-176.7	0	0	0	0	110.4	V410 N412 K413 Y415 L421 H424 H428	C408-V410 PolarHBondContact O-N 3.05Å; C408-N412 WeakPolarHBondContact O-CA 3.47Å; C408-N412 PolarHBondContact O-N 3.04Å; C408-N412 PolarHBondContact O-OD1 3.26Å; C408-K413 WeakPolarHBondContact CB-O 3.28Å; C408-K413 PolarHBondContact N-O 3.09Å; C408-Y415 HydrophobicContact CB-CE2 4.37Å; C408-L421 VanDerWaalsContact CA-CD1 3.46Å; C408-L421 HydrophobicContact CB-CD1 3.56Å; C408-H424 PolarHBondContact SG-NE2 2.91Å; C408-H428 VanDerWaalsContact SG-CD2 3.52Å; C408-H428 PolarHBondContact SG-NE2 3.39Å; C408-H428 VanDerWaalsContact SG-NE2 3.42Å
409	A	72.8	Confident	69.1	Low	91 Å²	91	87.5 Å²	87.5	75%	0.752	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-25.3	178.6	0	0	0	0	0	113.9
410	V	70.7	Confident	69.9	Low	109 Å²	109	86.4 Å²	86.4	66%	0.661	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-44.2	-175.3	-178.1	0	0	0	0	112.2	C408	C408-V410 PolarHBondContact O-N 3.05Å
411	C	76	Confident	70.6	Confident	47 Å²	47	82.5 Å²	82.5	32%	0.318	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	12.9	-175.7	81.4	0	0	0	0	114.1	K413 H424 H428	C411-K413 PolarHBondContact O-N 2.94Å; C411-K413 VanDerWaalsContact SG-CG 3.57Å; C411-H424 PolarHBondContact SG-CE1 3.32Å; C411-H424 PolarHBondContact SG-NE2 3.41Å; C411-H428 VanDerWaalsContact SG-CE1 3.55Å; C411-H428 PolarHBondContact SG-NE2 3.15Å
412	N	70.6	Confident	71.2	Confident	124 Å²	124	83.1 Å²	83.1	66%	0.663	45%	0.449	S	S	*	.			trans	53.1	15.7	178.4	-77.9	-33.1	0	0	0	116.4	C408 S414	C408-N412 WeakPolarHBondContact O-CA 3.47Å; C408-N412 PolarHBondContact O-N 3.04Å; C408-N412 PolarHBondContact O-OD1 3.26Å; N412-S414 PolarHBondContact O-N 3.22Å
413	K	74.4	Confident	71.8	Confident	124 Å²	124	84.5 Å²	84.5	54%	0.539	44%	0.439	S	S	.	.			trans	-70.6	127.7	174.4	-74.8	178.9	-175.4	176.3	0	109.6	C408 C411 Y415	C408-K413 WeakPolarHBondContact CB-O 3.28Å; C408-K413 PolarHBondContact N-O 3.09Å; C411-K413 PolarHBondContact O-N 2.94Å; C411-K413 VanDerWaalsContact SG-CG 3.57Å; K413-Y415 HydrophobicContact CB-CE2 3.65Å; K413-Y415 WeakPolarHBondContact CB-OH 3.39Å; K413-Y415 VanDerWaalsContact O-CD2 3.27Å; K413-Y415 WeakPolarHBondContact O-CD2 3.32Å; K413-Y415 WeakPolarHBondContact O-CE2 3.43Å
414	S	74.6	Confident	72.4	Confident	37 Å²	37	79.3 Å²	79.3	26%	0.259	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	136.1	-179.5	-48	0	0	0	0	111	R404 N412	R404-S414 VanDerWaalsContact CB-CB 3.41Å; R404-S414 WeakPolarHBondContact CD-O 3.27Å; N412-S414 PolarHBondContact O-N 3.22Å
415	Y	75.3	Confident	72.3	Confident	50 Å²	50	76.8 Å²	76.8	20%	0.196	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	148.2	-177.4	-63.6	-88	0	0	0	111.1	R404 F406 C408 K413 R417 A420 L421 H424	R404-Y415 CarbonylContact C-O 3.55Å; F406-Y415 PolarHBondContact N-O 3.19Å; F406-Y415 PolarHBondContact O-N 3.06Å; C408-Y415 HydrophobicContact CB-CE2 4.37Å; K413-Y415 HydrophobicContact CB-CE2 3.65Å; K413-Y415 WeakPolarHBondContact CB-OH 3.39Å; K413-Y415 VanDerWaalsContact O-CD2 3.27Å; K413-Y415 WeakPolarHBondContact O-CD2 3.32Å; K413-Y415 WeakPolarHBondContact O-CE2 3.43Å; Y415-R417 VanDerWaalsContact C-N 3.28Å; Y415-R417 PolarHBondContact O-N 3.26Å; Y415-A420 HydrophobicContact CD1-CB 4.09Å; Y415-A420 HydrophobicContact CG-CB 4.5Å; Y415-L421 HydrophobicContact CD2-CB 3.94Å; Y415-L421 HydrophobicContact CD2-CD1 3.67Å; Y415-L421 HydrophobicContact CD2-CG 4.42Å; Y415-L421 HydrophobicContact CE2-CD1 4.01Å; Y415-L421 HydrophobicContact CG-CB 4.16Å; Y415-H424 HydrophobicContact CE1-CB 3.84Å; Y415-H424 HydrophobicContact CE2-CB 3.81Å; Y415-H424 AromaticContact CE2-CD2 3.14Å; Y415-H424 WeakPolarHBondContact CE2-CD2 3.42Å; Y415-H424 AromaticContact CE2-CG 3.52Å; Y415-H424 AromaticContact CE2-NE2 3.75Å; Y415-H424 VanDerWaalsContact CZ-CB 3.42Å; Y415-H424 AromaticContact CZ-CD2 3.34Å; Y415-H424 AromaticContact CZ-CG 3.21Å; Y415-H424 AromaticContact CZ-ND1 3.75Å; Y415-H424 AromaticContact CZ-NE2 3.84Å; Y415-H424 WeakPolarHBondContact OH-CB 3.37Å; Y415-H424 PolarHBondContact OH-CD2 3.34Å; Y415-H424 PolarHBondContact OH-CE1 3.17Å; Y415-H424 PolarHBondContact OH-ND1 3.19Å; Y415-H424 PolarHBondContact OH-NE2 2.94Å
416	K	67.3	Low	72.3	Confident	91 Å²	91	74.7 Å²	74.7	40%	0.396	39%	0.392	S	S	.	.	S	Bend	trans	-76.2	-13.9	176.8	-60.8	-170.9	-178.2	-164.4	0	113.2	V399 R404	V399-K416 HydrophobicContact CG1-CD 4.46Å; V399-K416 HydrophobicContact CG2-CD 4.21Å; R404-K416 HydrophobicContact CG-CG 3.91Å
417	R	71.9	Confident	71.9	Confident	119 Å²	119	74.1 Å²	74.1	45%	0.449	40%	0.403	S	S	.	.	S	Bend	trans	-141.1	140.9	-175.9	-59.4	-175.6	-176.2	97.8	-0.8	110.8	F406 Y415 S419 A420 L421	F406-R417 VanDerWaalsContact CD2-C 3.42Å; Y415-R417 VanDerWaalsContact C-N 3.28Å; Y415-R417 PolarHBondContact O-N 3.26Å; R417-S419 VanDerWaalsContact C-N 3.3Å; R417-S419 PolarHBondContact O-N 3.41Å; R417-A420 HydrophobicContact CB-CB 4.06Å; R417-A420 WeakPolarHBondContact O-CB 3.48Å; R417-A420 PolarHBondContact O-N 2.78Å; R417-L421 PolarHBondContact O-N 3.17Å
418	A	72.4	Confident	71.3	Confident	51 Å²	51	70.8 Å²	70.8	42%	0.421	39%	0.389	S	S	.	.	H	α-helix	trans	-57.5	-41.5	173	0	0	0	0	0	112.1	F406 A420 L421 Q422	F406-A418 HydrophobicContact CD1-CB 3.84Å; F406-A418 VanDerWaalsContact CD2-N 3.33Å; F406-A418 HydrophobicContact CE1-CB 3.69Å; F406-A418 HydrophobicContact CE2-CB 4.43Å; F406-A418 HydrophobicContact CG-CB 4.29Å; F406-A418 HydrophobicContact CZ-CB 4Å; A418-A420 VanDerWaalsContact C-N 3.27Å; A418-A420 PolarHBondContact O-N 3.16Å; A418-L421 WeakPolarHBondContact O-CB 3.44Å; A418-L421 PolarHBondContact O-N 3.4Å; A418-Q422 WeakPolarHBondContact O-CB 3.35Å; A418-Q422 PolarHBondContact O-N 2.88Å
419	S	73	Confident	70.4	Confident	65 Å²	65	73.9 Å²	73.9	46%	0.455	41%	0.41	S	S	.	.	H	α-helix	trans	-65.3	-28.4	176.2	57.6	0	0	0	0	113.5	R417 K423	R417-S419 VanDerWaalsContact C-N 3.3Å; R417-S419 PolarHBondContact O-N 3.41Å; S419-K423 VanDerWaalsContact O-CG 3.3Å; S419-K423 WeakPolarHBondContact O-CG 3.48Å; S419-K423 PolarHBondContact O-N 2.89Å
420	A	75.4	Confident	69.5	Low	33 Å²	33	74.5 Å²	74.5	27%	0.273	42%	0.415	S	S	.	.	H	α-helix	trans	-76.6	-39.2	174.3	0	0	0	0	0	111.3	Y415 R417 A418 K423 H424	Y415-A420 HydrophobicContact CD1-CB 4.09Å; Y415-A420 HydrophobicContact CG-CB 4.5Å; R417-A420 HydrophobicContact CB-CB 4.06Å; R417-A420 WeakPolarHBondContact O-CB 3.48Å; R417-A420 PolarHBondContact O-N 2.78Å; A418-A420 VanDerWaalsContact C-N 3.27Å; A418-A420 PolarHBondContact O-N 3.16Å; A420-K423 PolarHBondContact O-N 3.09Å; A420-H424 WeakPolarHBondContact O-CB 3.32Å; A420-H424 PolarHBondContact O-N 3.42Å
421	L	75.3	Confident	68.8	Low	17 Å²	17	76.3 Å²	76.3	9%	0.089	42%	0.416	C	S	.	.	H	α-helix	trans	-61	-45	170.4	172.2	61.3	0	0	0	110.8	F406 K407 C408 Y415 R417 A418 K423 H424 Q425	F406-L421 HydrophobicContact CB-CB 3.96Å; F406-L421 HydrophobicContact CB-CD2 3.79Å; F406-L421 HydrophobicContact CB-CG 4.48Å; K407-L421 WeakPolarHBondContact O-CD2 3.5Å; C408-L421 VanDerWaalsContact CA-CD1 3.46Å; C408-L421 HydrophobicContact CB-CD1 3.56Å; Y415-L421 HydrophobicContact CD2-CB 3.94Å; Y415-L421 HydrophobicContact CD2-CD1 3.67Å; Y415-L421 HydrophobicContact CD2-CG 4.42Å; Y415-L421 HydrophobicContact CE2-CD1 4.01Å; Y415-L421 HydrophobicContact CG-CB 4.16Å; R417-L421 PolarHBondContact O-N 3.17Å; A418-L421 WeakPolarHBondContact O-CB 3.44Å; A418-L421 PolarHBondContact O-N 3.4Å; L421-K423 PolarHBondContact O-N 3.31Å; L421-H424 CarbonylContact O-C 3.55Å; L421-H424 WeakPolarHBondContact O-CA 3.29Å; L421-H424 WeakPolarHBondContact O-CB 3.21Å; L421-H424 PolarHBondContact O-N 3.17Å; L421-H424 VanDerWaalsContact O-N 3.08Å; L421-Q425 HydrophobicContact CD1-CG 3.89Å; L421-Q425 HydrophobicContact CG-CG 4.21Å; L421-Q425 WeakPolarHBondContact O-CB 3.44Å; L421-Q425 WeakPolarHBondContact O-CG 3.42Å; L421-Q425 PolarHBondContact O-N 3.37Å
422	Q	69.5	Low	68.2	Low	121 Å²	121	78 Å²	78	57%	0.565	42%	0.418	S	S	*	.	H	α-helix	trans	-61.6	-45.3	178.8	-169.1	178.5	6.6	0	0	111.5	A418 H424 Q425 L426	A418-Q422 WeakPolarHBondContact O-CB 3.35Å; A418-Q422 PolarHBondContact O-N 2.88Å; Q422-H424 VanDerWaalsContact C-N 3.26Å; Q422-H424 PolarHBondContact O-N 3.37Å; Q422-Q425 PolarHBondContact O-N 2.75Å; Q422-L426 WeakPolarHBondContact O-CD1 3.32Å; Q422-L426 VanDerWaalsContact O-CG 3.25Å; Q422-L426 WeakPolarHBondContact O-CG 3.49Å; Q422-L426 PolarHBondContact O-N 3.02Å
423	K	68.8	Low	67.7	Low	116 Å²	116	76 Å²	76	50%	0.504	41%	0.412	S	S	.	.	H	α-helix	trans	-58.8	-38.3	172	-76.1	-179.7	-178.8	-166.1	0	112.7	S419 A420 L421	S419-K423 VanDerWaalsContact O-CG 3.3Å; S419-K423 WeakPolarHBondContact O-CG 3.48Å; S419-K423 PolarHBondContact O-N 2.89Å; A420-K423 PolarHBondContact O-N 3.09Å; L421-K423 PolarHBondContact O-N 3.31Å
424	H	73.9	Confident	67	Low	28 Å²	28	72.8 Å²	72.8	13%	0.13	40%	0.4	C	S	.	.	H	α-helix	trans	-72.3	-38.1	176.6	167.4	67.1	0	0	0	113.2	C408 C411 Y415 A420 L421 Q422 L426 A427 H428	C408-H424 PolarHBondContact SG-NE2 2.91Å; C411-H424 PolarHBondContact SG-CE1 3.32Å; C411-H424 PolarHBondContact SG-NE2 3.41Å; Y415-H424 HydrophobicContact CE1-CB 3.84Å; Y415-H424 HydrophobicContact CE2-CB 3.81Å; Y415-H424 AromaticContact CE2-CD2 3.14Å; Y415-H424 WeakPolarHBondContact CE2-CD2 3.42Å; Y415-H424 AromaticContact CE2-CG 3.52Å; Y415-H424 AromaticContact CE2-NE2 3.75Å; Y415-H424 VanDerWaalsContact CZ-CB 3.42Å; Y415-H424 AromaticContact CZ-CD2 3.34Å; Y415-H424 AromaticContact CZ-CG 3.21Å; Y415-H424 AromaticContact CZ-ND1 3.75Å; Y415-H424 AromaticContact CZ-NE2 3.84Å; Y415-H424 WeakPolarHBondContact OH-CB 3.37Å; Y415-H424 PolarHBondContact OH-CD2 3.34Å; Y415-H424 PolarHBondContact OH-CE1 3.17Å; Y415-H424 PolarHBondContact OH-ND1 3.19Å; Y415-H424 PolarHBondContact OH-NE2 2.94Å; A420-H424 WeakPolarHBondContact O-CB 3.32Å; A420-H424 PolarHBondContact O-N 3.42Å; L421-H424 CarbonylContact O-C 3.55Å; L421-H424 WeakPolarHBondContact O-CA 3.29Å; L421-H424 WeakPolarHBondContact O-CB 3.21Å; L421-H424 PolarHBondContact O-N 3.17Å; L421-H424 VanDerWaalsContact O-N 3.08Å; Q422-H424 VanDerWaalsContact C-N 3.26Å; Q422-H424 PolarHBondContact O-N 3.37Å; H424-L426 PolarHBondContact O-N 3.1Å; H424-A427 WeakPolarHBondContact O-CA 3.47Å; H424-A427 VanDerWaalsContact O-CB 3.23Å; H424-A427 WeakPolarHBondContact O-CB 3.17Å; H424-A427 PolarHBondContact O-N 3.36Å; H424-H428 AromaticContact CD2-NE2 3.87Å; H424-H428 AromaticContact CE1-CD2 3.99Å; H424-H428 AromaticContact CE1-CE1 3.91Å; H424-H428 AromaticContact CE1-NE2 3.2Å; H424-H428 PolarHBondContact CE1-NE2 2.85Å; H424-H428 AromaticContact NE2-CD2 3.78Å; H424-H428 AromaticContact NE2-NE2 3.05Å; H424-H428 PolarHBondContact NE2-NE2 3.44Å
425	Q	67.2	Low	66.1	Low	78 Å²	78	75.9 Å²	75.9	36%	0.364	41%	0.409	S	S	.	.	H	α-helix	trans	-63	-33.8	175.2	-76	170.8	-39.4	0	0	111.5	L421 Q422 A427 H428 C429	L421-Q425 HydrophobicContact CD1-CG 3.89Å; L421-Q425 HydrophobicContact CG-CG 4.21Å; L421-Q425 WeakPolarHBondContact O-CB 3.44Å; L421-Q425 WeakPolarHBondContact O-CG 3.42Å; L421-Q425 PolarHBondContact O-N 3.37Å; Q422-Q425 PolarHBondContact O-N 2.75Å; Q425-A427 PolarHBondContact O-N 2.84Å; Q425-H428 WeakPolarHBondContact O-CB 3.43Å; Q425-H428 PolarHBondContact O-N 3.49Å; Q425-C429 PolarHBondContact O-N 3.48Å
426	L	67.7	Low	65	Low	43 Å²	43	73.9 Å²	73.9	23%	0.225	40%	0.402	C	S	.	.	H	α-helix	trans	-64.8	-22.8	172	-66.5	162.6	0	0	0	112.5	Q422 H424 H428 C429 P433 F444	Q422-L426 WeakPolarHBondContact O-CD1 3.32Å; Q422-L426 VanDerWaalsContact O-CG 3.25Å; Q422-L426 WeakPolarHBondContact O-CG 3.49Å; Q422-L426 PolarHBondContact O-N 3.02Å; H424-L426 PolarHBondContact O-N 3.1Å; L426-H428 VanDerWaalsContact C-N 3.32Å; L426-C429 PolarHBondContact O-N 3.34Å; L426-C429 VanDerWaalsContact O-O 3.13Å; L426-P433 HydrophobicContact CD2-CG 4.4Å; L426-F444 HydrophobicContact CB-CB 4.23Å; L426-F444 HydrophobicContact CB-CD1 4.16Å; L426-F444 WeakPolarHBondContact CD1-O 3.33Å; L426-F444 WeakPolarHBondContact O-CD1 2.81Å; L426-F444 WeakPolarHBondContact O-CE1 3.3Å
427	A	64.6	Low	64.4	Low	70 Å²	70	75.6 Å²	75.6	58%	0.579	42%	0.421	S	S	*	.	H	α-helix	trans	-76.4	-18	171.8	0	0	0	0	0	113.4	H424 Q425	H424-A427 WeakPolarHBondContact O-CA 3.47Å; H424-A427 VanDerWaalsContact O-CB 3.23Å; H424-A427 WeakPolarHBondContact O-CB 3.17Å; H424-A427 PolarHBondContact O-N 3.36Å; Q425-A427 PolarHBondContact O-N 2.84Å
428	H	61.9	Low	63.6	Low	73 Å²	73	75.5 Å²	75.5	34%	0.338	43%	0.428	S	S	.	.	H	α-helix	trans	-85.1	-17.4	170.1	-65.8	-62.2	0	0	0	112.4	C408 C411 H424 Q425 L426	C408-H428 VanDerWaalsContact SG-CD2 3.52Å; C408-H428 PolarHBondContact SG-NE2 3.39Å; C408-H428 VanDerWaalsContact SG-NE2 3.42Å; C411-H428 VanDerWaalsContact SG-CE1 3.55Å; C411-H428 PolarHBondContact SG-NE2 3.15Å; H424-H428 AromaticContact CD2-NE2 3.87Å; H424-H428 AromaticContact CE1-CD2 3.99Å; H424-H428 AromaticContact CE1-CE1 3.91Å; H424-H428 AromaticContact CE1-NE2 3.2Å; H424-H428 PolarHBondContact CE1-NE2 2.85Å; H424-H428 AromaticContact NE2-CD2 3.78Å; H424-H428 AromaticContact NE2-NE2 3.05Å; H424-H428 PolarHBondContact NE2-NE2 3.44Å; Q425-H428 WeakPolarHBondContact O-CB 3.43Å; Q425-H428 PolarHBondContact O-N 3.49Å; L426-H428 VanDerWaalsContact C-N 3.32Å
429	C	54.5	Low	62.8	Low	65 Å²	65	75.5 Å²	75.5	44%	0.439	43%	0.425	S	S	.	.			trans	-85.2	122	173.1	-68.7	0	0	0	0	109.5	Q425 L426 E431 F444	Q425-C429 PolarHBondContact O-N 3.48Å; L426-C429 PolarHBondContact O-N 3.34Å; L426-C429 VanDerWaalsContact O-O 3.13Å; C429-E431 PolarHBondContact O-N 2.96Å; C429-F444 WeakPolarHBondContact O-CE1 3.2Å
430	A	55.6	Low	61.8	Low	103 Å²	103	78.7 Å²	78.7	85%	0.851	43%	0.432	S	S	*	.	S	Bend	trans	-66.4	-22	171.6	0	0	0	0	0	112.1	K432	A430-K432 PolarHBondContact O-N 2.89Å
431	E	56	Low	60.6	Low	148 Å²	148	84.6 Å²	84.6	69%	0.692	45%	0.448	S	S	*	.			trans	-87.4	107.3	-180	-63.6	-161.3	164.6	0	0	112.2	C429 P433	C429-E431 PolarHBondContact O-N 2.96Å; E431-P433 WeakPolarHBondContact O-CD 3.43Å
432	K	63.3	Low	59.8	Low	81 Å²	81	89.5 Å²	89.5	35%	0.352	47%	0.465	S	S	.	.			trans	-76.1	113.6	169.9	-70.3	-177.7	-154.3	-179.3	0	109.2	A430 L434 R442 F444	A430-K432 PolarHBondContact O-N 2.89Å; K432-L434 PolarHBondContact O-N 3.31Å; K432-R442 HydrophobicContact CB-CB 3.27Å; K432-R442 HydrophobicContact CB-CG 4.47Å; K432-R442 VanDerWaalsContact CD-C 3.48Å; K432-R442 HydrophobicContact CD-CB 3.89Å; K432-R442 WeakPolarHBondContact CD-O 3.4Å; K432-R442 HydrophobicContact CG-CB 4.16Å; K432-R442 PolarHBondContact O-NE 2.91Å; K432-R442 PolarHBondContact O-NH2 2.66Å; K432-F444 HydrophobicContact CB-CD1 4.41Å; K432-F444 HydrophobicContact CB-CE1 4.35Å; K432-F444 HydrophobicContact CD-CD2 4.11Å; K432-F444 HydrophobicContact CD-CE1 4.17Å; K432-F444 HydrophobicContact CD-CE2 3.69Å; K432-F444 HydrophobicContact CD-CZ 3.73Å; K432-F444 HydrophobicContact CG-CD1 3.62Å; K432-F444 HydrophobicContact CG-CD2 4.02Å; K432-F444 HydrophobicContact CG-CE1 3.26Å; K432-F444 HydrophobicContact CG-CE2 3.71Å; K432-F444 HydrophobicContact CG-CG 4Å; K432-F444 HydrophobicContact CG-CZ 3.33Å
433	P	59.2	Low	59.5	Low	82 Å²	82	85.1 Å²	85.1	53%	0.532	44%	0.444	S	S	.	.	S	Bend	trans	-70.4	-30.2	-169.5	-18.7	31.2	0	0	0	113.9	L426 E431 F443	L426-P433 HydrophobicContact CD2-CG 4.4Å; E431-P433 WeakPolarHBondContact O-CD 3.43Å; P433-F443 WeakPolarHBondContact CD-O 3.39Å
434	L	60.1	Low	58.9	Low	57 Å²	57	82.6 Å²	82.6	30%	0.298	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	104.6	-172.2	-60.6	174.2	0	0	0	109.9	K432 R442 F443 S446 F449	K432-L434 PolarHBondContact O-N 3.31Å; L434-R442 CarbonylContact O-C 3.5Å; L434-R442 WeakPolarHBondContact O-CA 3.32Å; L434-F443 HydrophobicContact CB-CB 4.24Å; L434-F443 PolarHBondContact N-O 3.09Å; L434-F443 PolarHBondContact O-N 3.02Å; L434-S446 VanDerWaalsContact CD1-CA 3.49Å; L434-F449 HydrophobicContact CB-CB 4.36Å; L434-F449 HydrophobicContact CB-CD2 4.15Å; L434-F449 HydrophobicContact CB-CG 4.23Å; L434-F449 HydrophobicContact CD1-CB 3.83Å; L434-F449 HydrophobicContact CD1-CG 4.28Å
435	K	55.3	Low	58	Low	103 Å²	103	81.9 Å²	81.9	45%	0.448	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	124.6	175.2	-176	179.4	177.7	-174.9	0	109.7	T437 E440 R442	K435-T437 PolarHBondContact O-N 3.01Å; K435-E440 WeakPolarHBondContact CE-OE1 3.42Å; K435-E440 IonicContact NZ-OE1 2.78Å; K435-E440 PolarHBondContact NZ-OE1 3.32Å; K435-R442 HydrophobicContact CB-CG 4.07Å; K435-R442 HydrophobicContact CG-CG 4.07Å
436	C	52.8	Low	57.3	Low	7 Å²	7	82 Å²	82	5%	0.047	44%	0.441	C	S	.	.			trans	-71.9	120.3	166.3	-175.7	0	0	0	0	109.2	L438 C439 E440 R441 F443 F449 H452	C436-L438 PolarHBondContact O-N 3.32Å; C436-C439 PolarHBondContact SG-SG 2.85Å; C436-E440 WeakPolarHBondContact O-CA 3.45Å; C436-E440 PolarHBondContact O-N 3.37Å; C436-R441 WeakPolarHBondContact CB-O 3.45Å; C436-R441 PolarHBondContact N-O 3.32Å; C436-F443 HydrophobicContact CB-CE2 4.05Å; C436-F449 HydrophobicContact CB-CE2 4.04Å; C436-H452 PolarHBondContact SG-NE2 3.34Å; C436-H452 VanDerWaalsContact SG-NE2 3.4Å
437	T	54.7	Low	56.7	Low	127 Å²	127	83.3 Å²	83.3	78%	0.779	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-18.8	-179.3	50.9	0	0	0	0	112.8	K435	K435-T437 PolarHBondContact O-N 3.01Å
438	L	53.6	Low	56.5	Low	117 Å²	117	84.4 Å²	84.4	61%	0.613	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-24.9	-176.3	-61.5	175.5	0	0	0	114.2	C436 C454	C436-L438 PolarHBondContact O-N 3.32Å; L438-C454 HydrophobicContact CB-CB 4.05Å; L438-C454 HydrophobicContact CD1-CB 4.26Å; L438-C454 VanDerWaalsContact CD1-O 3.24Å; L438-C454 WeakPolarHBondContact CD1-O 3.48Å
439	C	56.1	Low	56.3	Low	51 Å²	51	84.4 Å²	84.4	35%	0.345	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.5	15	-174.2	53.2	0	0	0	0	112.9	C436 R441 H452 C454	C436-C439 PolarHBondContact SG-SG 2.85Å; C439-R441 PolarHBondContact O-N 2.74Å; C439-H452 PolarHBondContact SG-CE1 3.21Å; C439-H452 PolarHBondContact SG-NE2 3.12Å; C439-C454 HydrophobicContact CB-CB 4.41Å; C439-C454 WeakPolarHBondContact CB-SG 3.41Å; C439-C454 WeakPolarHBondContact SG-CB 3.38Å; C439-C454 CovalentContact SG-SG 2.08Å; C439-C454 PolarHBondContact SG-SG 3.02Å
440	E	53.5	Low	56.5	Low	132 Å²	132	86.7 Å²	86.7	62%	0.617	46%	0.458	S	S	*	.			trans	53.8	1.6	176.7	-55.3	-147.7	112.9	0	0	116.9	K435 C436 R442	K435-E440 WeakPolarHBondContact CE-OE1 3.42Å; K435-E440 IonicContact NZ-OE1 2.78Å; K435-E440 PolarHBondContact NZ-OE1 3.32Å; C436-E440 WeakPolarHBondContact O-CA 3.45Å; C436-E440 PolarHBondContact O-N 3.37Å; E440-R442 PolarHBondContact O-N 2.93Å
441	R	50	Low	56.4	Low	158 Å²	158	89.5 Å²	89.5	60%	0.596	45%	0.453	S	S	*	.			trans	-67.5	129.5	179.2	-117.6	178.5	154.5	154.1	-4.6	109.8	C436 C439 F443	C436-R441 WeakPolarHBondContact CB-O 3.45Å; C436-R441 PolarHBondContact N-O 3.32Å; C439-R441 PolarHBondContact O-N 2.74Å; R441-F443 HydrophobicContact CB-CE2 3.89Å; R441-F443 HydrophobicContact CB-CZ 4Å; R441-F443 WeakPolarHBondContact O-CD2 3.48Å; R441-F443 VanDerWaalsContact O-CE2 3.25Å; R441-F443 WeakPolarHBondContact O-CE2 3.42Å
442	R	57	Low	56.6	Low	120 Å²	120	84.3 Å²	84.3	45%	0.453	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	143.8	178.5	-51.1	175.4	69.3	151.2	-0	110.4	K432 L434 K435 E440	K432-R442 HydrophobicContact CB-CB 3.27Å; K432-R442 HydrophobicContact CB-CG 4.47Å; K432-R442 VanDerWaalsContact CD-C 3.48Å; K432-R442 HydrophobicContact CD-CB 3.89Å; K432-R442 WeakPolarHBondContact CD-O 3.4Å; K432-R442 HydrophobicContact CG-CB 4.16Å; K432-R442 PolarHBondContact O-NE 2.91Å; K432-R442 PolarHBondContact O-NH2 2.66Å; L434-R442 CarbonylContact O-C 3.5Å; L434-R442 WeakPolarHBondContact O-CA 3.32Å; K435-R442 HydrophobicContact CB-CG 4.07Å; K435-R442 HydrophobicContact CG-CG 4.07Å; E440-R442 PolarHBondContact O-N 2.93Å
443	F	63.7	Low	56	Low	29 Å²	29	90.3 Å²	90.3	13%	0.127	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	151.8	-175.4	-62	-89.8	0	0	0	111.2	P433 L434 C436 R441 E448 F449 H452	P433-F443 WeakPolarHBondContact CD-O 3.39Å; L434-F443 HydrophobicContact CB-CB 4.24Å; L434-F443 PolarHBondContact N-O 3.09Å; L434-F443 PolarHBondContact O-N 3.02Å; C436-F443 HydrophobicContact CB-CE2 4.05Å; R441-F443 HydrophobicContact CB-CE2 3.89Å; R441-F443 HydrophobicContact CB-CZ 4Å; R441-F443 WeakPolarHBondContact O-CD2 3.48Å; R441-F443 VanDerWaalsContact O-CE2 3.25Å; R441-F443 WeakPolarHBondContact O-CE2 3.42Å; F443-E448 HydrophobicContact CD1-CB 4.14Å; F443-F449 HydrophobicContact CB-CB 4.21Å; F443-F449 HydrophobicContact CD2-CB 4.47Å; F443-F449 AromaticContact CD2-CD2 3.65Å; F443-F449 HydrophobicContact CD2-CD2 3.65Å; F443-F449 HydrophobicContact CD2-CE2 4.46Å; F443-F449 HydrophobicContact CE2-CD2 4.2Å; F443-F449 HydrophobicContact CG-CB 4.32Å; F443-F449 HydrophobicContact CG-CD2 4.31Å; F443-H452 HydrophobicContact CD1-CB 4.47Å; F443-H452 HydrophobicContact CE1-CB 3.73Å; F443-H452 AromaticContact CE1-CG 3.78Å; F443-H452 HydrophobicContact CE2-CB 4.13Å; F443-H452 AromaticContact CE2-CD2 3.29Å; F443-H452 WeakPolarHBondContact CE2-CD2 3.27Å; F443-H452 AromaticContact CE2-CG 3.61Å; F443-H452 AromaticContact CE2-NE2 3.57Å; F443-H452 HydrophobicContact CZ-CB 3.57Å; F443-H452 AromaticContact CZ-CD2 3.29Å; F443-H452 WeakPolarHBondContact CZ-CD2 3.4Å; F443-H452 AromaticContact CZ-CE1 3.53Å; F443-H452 AromaticContact CZ-CG 3.1Å; F443-H452 AromaticContact CZ-ND1 3.3Å; F443-H452 VanDerWaalsContact CZ-ND1 3.3Å; F443-H452 WeakPolarHBondContact CZ-ND1 3.29Å; F443-H452 AromaticContact CZ-NE2 3.51Å
444	F	55.6	Low	55.3	Low	63 Å²	63	88 Å²	88	28%	0.276	44%	0.435	S	S	.	.	S	Bend	trans	-90.3	-26.8	179.1	-65.6	-74.3	0	0	0	112.5	L426 C429 K432	L426-F444 HydrophobicContact CB-CB 4.23Å; L426-F444 HydrophobicContact CB-CD1 4.16Å; L426-F444 WeakPolarHBondContact CD1-O 3.33Å; L426-F444 WeakPolarHBondContact O-CD1 2.81Å; L426-F444 WeakPolarHBondContact O-CE1 3.3Å; C429-F444 WeakPolarHBondContact O-CE1 3.2Å; K432-F444 HydrophobicContact CB-CD1 4.41Å; K432-F444 HydrophobicContact CB-CE1 4.35Å; K432-F444 HydrophobicContact CD-CD2 4.11Å; K432-F444 HydrophobicContact CD-CE1 4.17Å; K432-F444 HydrophobicContact CD-CE2 3.69Å; K432-F444 HydrophobicContact CD-CZ 3.73Å; K432-F444 HydrophobicContact CG-CD1 3.62Å; K432-F444 HydrophobicContact CG-CD2 4.02Å; K432-F444 HydrophobicContact CG-CE1 3.26Å; K432-F444 HydrophobicContact CG-CE2 3.71Å; K432-F444 HydrophobicContact CG-CG 4Å; K432-F444 HydrophobicContact CG-CZ 3.33Å
445	S	55.3	Low	54.7	Low	13 Å²	13	91.3 Å²	91.3	9%	0.091	45%	0.453	C	S	.	.			trans	-130.4	148.1	-178.9	71.9	0	0	0	0	113.9	S447 E448 F449	S445-S447 VanDerWaalsContact C-N 3.25Å; S445-S447 PolarHBondContact O-N 2.85Å; S445-E448 PolarHBondContact N-OE2 3.31Å; S445-E448 PolarHBondContact O-N 3.26Å; S445-E448 WeakPolarHBondContact OG-CB 3.33Å; S445-E448 WeakPolarHBondContact OG-CG 3.48Å; S445-E448 PolarHBondContact OG-N 3.04Å; S445-E448 PolarHBondContact OG-OE2 3.02Å; S445-F449 PolarHBondContact O-N 3.39Å
446	S	53.5	Low	54.2	Low	79 Å²	79	92.2 Å²	92.2	55%	0.552	47%	0.469	S	S	*	.	H	α-helix	trans	-62.4	-32.4	176.5	62	0	0	0	0	112.3	L434 F449 V450	L434-S446 VanDerWaalsContact CD1-CA 3.49Å; S446-F449 PolarHBondContact O-N 3.18Å; S446-V450 WeakPolarHBondContact O-CB 3.41Å; S446-V450 WeakPolarHBondContact O-CG2 3.31Å; S446-V450 PolarHBondContact O-N 2.78Å
447	S	54.3	Low	54	Low	71 Å²	71	95.3 Å²	95.3	50%	0.497	50%	0.495	S	S	.	.	H	α-helix	trans	-66.6	-41.1	174.7	-49.6	0	0	0	0	112.4	S445 Q451	S445-S447 VanDerWaalsContact C-N 3.25Å; S445-S447 PolarHBondContact O-N 2.85Å; S447-Q451 WeakPolarHBondContact O-CB 3.12Å; S447-Q451 PolarHBondContact O-N 2.82Å
448	E	59.8	Low	53.9	Low	94 Å²	94	101.4 Å²	101.4	44%	0.439	50%	0.504	S	S	.	.	H	α-helix	trans	-69	-35.8	174.7	-72.9	161.8	174.6	0	0	111.7	F443 S445 H452	F443-E448 HydrophobicContact CD1-CB 4.14Å; S445-E448 PolarHBondContact N-OE2 3.31Å; S445-E448 PolarHBondContact O-N 3.26Å; S445-E448 WeakPolarHBondContact OG-CB 3.33Å; S445-E448 WeakPolarHBondContact OG-CG 3.48Å; S445-E448 PolarHBondContact OG-N 3.04Å; S445-E448 PolarHBondContact OG-OE2 3.02Å; E448-H452 WeakPolarHBondContact O-CB 3.11Å; E448-H452 PolarHBondContact O-N 2.98Å
449	F	59.1	Low	53.8	Low	72 Å²	72	101.9 Å²	101.9	32%	0.316	50%	0.503	S	S	.	.	H	α-helix	trans	-67.6	-42.5	174.6	-178.3	-104.9	0	0	0	112.5	L434 C436 F443 S445 S446 H452	L434-F449 HydrophobicContact CB-CB 4.36Å; L434-F449 HydrophobicContact CB-CD2 4.15Å; L434-F449 HydrophobicContact CB-CG 4.23Å; L434-F449 HydrophobicContact CD1-CB 3.83Å; L434-F449 HydrophobicContact CD1-CG 4.28Å; C436-F449 HydrophobicContact CB-CE2 4.04Å; F443-F449 HydrophobicContact CB-CB 4.21Å; F443-F449 HydrophobicContact CD2-CB 4.47Å; F443-F449 AromaticContact CD2-CD2 3.65Å; F443-F449 HydrophobicContact CD2-CD2 3.65Å; F443-F449 HydrophobicContact CD2-CE2 4.46Å; F443-F449 HydrophobicContact CE2-CD2 4.2Å; F443-F449 HydrophobicContact CG-CB 4.32Å; F443-F449 HydrophobicContact CG-CD2 4.31Å; S445-F449 PolarHBondContact O-N 3.39Å; S446-F449 PolarHBondContact O-N 3.18Å; F449-H452 WeakPolarHBondContact O-CA 3.17Å; F449-H452 VanDerWaalsContact O-CB 3.31Å; F449-H452 WeakPolarHBondContact O-CB 3.45Å; F449-H452 PolarHBondContact O-N 2.8Å
450	V	58.3	Low	54	Low	114 Å²	114	105.2 Å²	105.2	69%	0.691	51%	0.512	S	S	*	.	H	α-helix	trans	-70.3	-34.6	176.4	170.5	0	0	0	0	111.4	S446 H452	S446-V450 WeakPolarHBondContact O-CB 3.41Å; S446-V450 WeakPolarHBondContact O-CG2 3.31Å; S446-V450 PolarHBondContact O-N 2.78Å; V450-H452 PolarHBondContact O-N 2.11Å
451	Q	54.2	Low	54.2	Low	162 Å²	162	103.3 Å²	103.3	76%	0.757	51%	0.51	S	S	*	.	H	α-helix	trans	-73.1	-21	172.5	-165.8	174.1	0.8	0	0	112	S447 R453	S447-Q451 WeakPolarHBondContact O-CB 3.12Å; S447-Q451 PolarHBondContact O-N 2.82Å; Q451-R453 PolarHBondContact O-N 3.13Å
452	H	58.8	Low	54.6	Low	38 Å²	38	98.6 Å²	98.6	18%	0.176	50%	0.497	C	S	.	.			trans	-77.1	88.7	171.8	174.2	71.2	0	0	0	110.5	C436 C439 F443 E448 F449 V450 C454	C436-H452 PolarHBondContact SG-NE2 3.34Å; C436-H452 VanDerWaalsContact SG-NE2 3.4Å; C439-H452 PolarHBondContact SG-CE1 3.21Å; C439-H452 PolarHBondContact SG-NE2 3.12Å; F443-H452 HydrophobicContact CD1-CB 4.47Å; F443-H452 HydrophobicContact CE1-CB 3.73Å; F443-H452 AromaticContact CE1-CG 3.78Å; F443-H452 HydrophobicContact CE2-CB 4.13Å; F443-H452 AromaticContact CE2-CD2 3.29Å; F443-H452 WeakPolarHBondContact CE2-CD2 3.27Å; F443-H452 AromaticContact CE2-CG 3.61Å; F443-H452 AromaticContact CE2-NE2 3.57Å; F443-H452 HydrophobicContact CZ-CB 3.57Å; F443-H452 AromaticContact CZ-CD2 3.29Å; F443-H452 WeakPolarHBondContact CZ-CD2 3.4Å; F443-H452 AromaticContact CZ-CE1 3.53Å; F443-H452 AromaticContact CZ-CG 3.1Å; F443-H452 AromaticContact CZ-ND1 3.3Å; F443-H452 VanDerWaalsContact CZ-ND1 3.3Å; F443-H452 WeakPolarHBondContact CZ-ND1 3.29Å; F443-H452 AromaticContact CZ-NE2 3.51Å; E448-H452 WeakPolarHBondContact O-CB 3.11Å; E448-H452 PolarHBondContact O-N 2.98Å; F449-H452 WeakPolarHBondContact O-CA 3.17Å; F449-H452 VanDerWaalsContact O-CB 3.31Å; F449-H452 WeakPolarHBondContact O-CB 3.45Å; F449-H452 PolarHBondContact O-N 2.8Å; V450-H452 PolarHBondContact O-N 2.11Å; H452-C454 PolarHBondContact CE1-SG 3.46Å; H452-C454 PolarHBondContact NE2-SG 3.48Å; H452-C454 PolarHBondContact O-N 3.34Å
453	R	51	Low	55.1	Low	208 Å²	208	98.4 Å²	98.4	79%	0.785	50%	0.499	S	S	*	.			trans	-80.1	104.9	166.9	-53.5	-174	96	123.1	1.9	108.2	Q451	Q451-R453 PolarHBondContact O-N 3.13Å
454	C	45.6	Very low	55.7	Low	34 Å²	34	97 Å²	97	23%	0.23	49%	0.493	C	S	.	.			trans	-92.1	92	167	-110.3	0	0	0	0	107.6	L438 C439 H452	L438-C454 HydrophobicContact CB-CB 4.05Å; L438-C454 HydrophobicContact CD1-CB 4.26Å; L438-C454 VanDerWaalsContact CD1-O 3.24Å; L438-C454 WeakPolarHBondContact CD1-O 3.48Å; C439-C454 HydrophobicContact CB-CB 4.41Å; C439-C454 WeakPolarHBondContact CB-SG 3.41Å; C439-C454 WeakPolarHBondContact SG-CB 3.38Å; C439-C454 CovalentContact SG-SG 2.08Å; C439-C454 PolarHBondContact SG-SG 3.02Å; H452-C454 PolarHBondContact CE1-SG 3.46Å; H452-C454 PolarHBondContact NE2-SG 3.48Å; H452-C454 PolarHBondContact O-N 3.34Å
455	D	45.8	Very low	56.5	Low	126 Å²	126	98.6 Å²	98.6	67%	0.674	51%	0.509	S	S	*	.			trans	-88	128.2	165.9	-85.7	-57	0	0	0	108.9	A457	D455-A457 PolarHBondContact O-N 3.39Å
456	P	45.9	Very low	57.5	Low	121 Å²	121	102.2 Å²	102.2	79%	0.786	53%	0.528	S	S	*	.	S	Bend	trans	-65.8	-18.3	-176.9	-21.2	31.8	0	0	0	115
457	A	48.4	Very low	58.6	Low	72 Å²	72	99.9 Å²	99.9	60%	0.595	51%	0.511	S	S	*	.	S	Bend	trans	-98.9	123.6	-177.6	0	0	0	0	0	110	D455 E459	D455-A457 PolarHBondContact O-N 3.39Å; A457-E459 PolarHBondContact O-N 3.49Å
458	R	51.8	Low	59.3	Low	256 Å²	256	103.8 Å²	103.8	97%	0.966	52%	0.522	S	S	*	.			trans	-69.1	69.3	-176	-158.2	-176	-165.3	-147.5	8.1	111.6
459	E	53.1	Low	59.9	Low	126 Å²	126	105.6 Å²	105.6	59%	0.589	53%	0.528	S	S	*	.			trans	-118.4	118.8	174.5	-71.3	-127.9	157.2	0	0	110.6	A457 P461 R470	A457-E459 PolarHBondContact O-N 3.49Å; E459-P461 WeakPolarHBondContact O-CD 3.47Å; E459-R470 IonicContact OE1-NH1 3.22Å; E459-R470 IonicContact OE2-CZ 3.92Å; E459-R470 IonicContact OE2-NH1 3.26Å; E459-R470 PolarHBondContact OE2-NH1 3.4Å; E459-R470 IonicContact OE2-NH2 3.37Å; E459-R470 PolarHBondContact OE2-NH2 3.4Å
460	K	59.1	Low	60.4	Low	122 Å²	122	106.9 Å²	106.9	53%	0.53	53%	0.531	S	S	.	.			trans	-71.5	101.3	169.6	-65.8	-175.8	-165.1	171.9	0	107	L462 R470 F471	K460-L462 PolarHBondContact O-N 2.88Å; K460-R470 HydrophobicContact CB-CB 3.41Å; K460-R470 VanDerWaalsContact CB-CB 3.41Å; K460-R470 HydrophobicContact CD-CB 4.07Å; K460-R470 WeakPolarHBondContact CD-O 3.43Å; K460-R470 HydrophobicContact CG-CB 4.37Å; K460-R470 PolarHBondContact O-NE 2.88Å; K460-R470 PolarHBondContact O-NH2 3.26Å; K460-R470 VanDerWaalsContact O-NH2 3.13Å; K460-F471 CarbonylContact C-O 3.51Å
461	P	57.5	Low	60.8	Low	91 Å²	91	103.1 Å²	103.1	59%	0.591	51%	0.505	S	S	*	.			trans	-70.8	-22.9	-163.2	-15.2	29.8	0	0	0	112.6	E459 F471	E459-P461 WeakPolarHBondContact O-CD 3.47Å; P461-F471 WeakPolarHBondContact CD-O 3.41Å
462	L	59.2	Low	60.9	Low	60 Å²	60	101.4 Å²	101.4	31%	0.314	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	98	-167.8	-57.4	176.2	0	0	0	109.6	K460 R470 F471 Y473 A474 L477	K460-L462 PolarHBondContact O-N 2.88Å; L462-R470 CarbonylContact O-C 3.58Å; L462-R470 WeakPolarHBondContact O-CA 3.18Å; L462-F471 HydrophobicContact CB-CB 4.48Å; L462-F471 PolarHBondContact N-O 3.15Å; L462-F471 PolarHBondContact O-N 2.78Å; L462-Y473 VanDerWaalsContact CD1-C 3.46Å; L462-A474 VanDerWaalsContact CD1-CA 3.41Å; L462-A474 HydrophobicContact CD1-CB 3.85Å; L462-A474 VanDerWaalsContact CD1-N 3.26Å; L462-L477 HydrophobicContact CB-CB 4.39Å; L462-L477 HydrophobicContact CB-CD2 3.87Å
463	K	68.2	Low	61	Low	116 Å²	116	105.1 Å²	105.1	50%	0.504	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	135.6	172.6	-173.5	174.9	179.2	174.7	0	109.2	E468 R470	K463-E468 IonicContact NZ-OE1 3.43Å; K463-E468 PolarHBondContact NZ-OE1 3.29Å; K463-R470 HydrophobicContact CB-CG 4.42Å
464	C	74.8	Confident	61.4	Low	0 Å²	0	98.4 Å²	98.4	0%	0	50%	0.497	C	S	.	.			trans	-71.9	131.3	168.8	174.1	0	0	0	0	109.4	D466 C467 K469 F471 L477 H484	C464-D466 PolarHBondContact O-N 3.37Å; C464-C467 CarbonylContact C-O 3.58Å; C464-C467 WeakPolarHBondContact CB-O 3.3Å; C464-C467 CarbonylContact O-C 3.55Å; C464-K469 PolarHBondContact N-O 3.48Å; C464-F471 HydrophobicContact CB-CE2 4.06Å; C464-L477 HydrophobicContact CB-CD1 3.54Å; C464-H484 PolarHBondContact SG-CD2 3.15Å; C464-H484 PolarHBondContact SG-NE2 3.46Å
465	P	73.8	Confident	62.1	Low	95 Å²	95	100.5 Å²	100.5	62%	0.617	51%	0.512	S	S	*	.	S	Bend	trans	-67.5	-29.6	179.9	24	-31.4	0	0	0	112.2
466	D	74.6	Confident	63.4	Low	90 Å²	90	96.3 Å²	96.3	48%	0.481	49%	0.49	S	S	.	.	S	Bend	trans	-93.4	-13.3	-174.6	-42.6	-60.7	0	0	0	113	C464 H484	C464-D466 PolarHBondContact O-N 3.37Å; D466-H484 HydrophobicContact CB-CB 4.07Å; D466-H484 IonicContact OD2-CD2 2.73Å
467	C	76.4	Confident	64.7	Low	29 Å²	29	91.9 Å²	91.9	20%	0.196	46%	0.46	C	S	.	.	S	Bend	trans	-154.8	150.3	169.7	78.6	0	0	0	0	110.9	C464 K469 H480 H484	C464-C467 CarbonylContact C-O 3.58Å; C464-C467 WeakPolarHBondContact CB-O 3.3Å; C464-C467 CarbonylContact O-C 3.55Å; C467-K469 PolarHBondContact O-N 3.02Å; C467-H480 PolarHBondContact SG-NE2 2.89Å; C467-H484 PolarHBondContact SG-NE2 2.82Å
468	E	69.8	Low	65.9	Low	153 Å²	153	94.5 Å²	94.5	72%	0.715	46%	0.46	S	S	*	.	S	Bend	trans	-69.7	9.6	-171.6	-52.8	-151	109.1	0	0	115.7	K463 R470	K463-E468 IonicContact NZ-OE1 3.43Å; K463-E468 PolarHBondContact NZ-OE1 3.29Å; E468-R470 PolarHBondContact O-N 2.74Å
469	K	72.4	Confident	67.1	Low	132 Å²	132	86.9 Å²	86.9	57%	0.574	43%	0.431	S	S	*	.			trans	-67.7	125.6	176.2	-66.2	179.1	179.3	175.3	0	110	C464 C467 F471	C464-K469 PolarHBondContact N-O 3.48Å; C467-K469 PolarHBondContact O-N 3.02Å; K469-F471 HydrophobicContact CB-CE2 3.71Å; K469-F471 HydrophobicContact CB-CZ 3.81Å; K469-F471 WeakPolarHBondContact O-CD2 3.12Å; K469-F471 VanDerWaalsContact O-CE2 3.27Å; K469-F471 WeakPolarHBondContact O-CE2 3.42Å
470	R	68.8	Low	68.5	Low	99 Å²	99	82 Å²	82	37%	0.374	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	144.1	175.4	-56.4	177.4	68.6	173.8	4.3	110.3	E459 K460 L462 K463 E468	E459-R470 IonicContact OE1-NH1 3.22Å; E459-R470 IonicContact OE2-CZ 3.92Å; E459-R470 IonicContact OE2-NH1 3.26Å; E459-R470 PolarHBondContact OE2-NH1 3.4Å; E459-R470 IonicContact OE2-NH2 3.37Å; E459-R470 PolarHBondContact OE2-NH2 3.4Å; K460-R470 HydrophobicContact CB-CB 3.41Å; K460-R470 VanDerWaalsContact CB-CB 3.41Å; K460-R470 HydrophobicContact CD-CB 4.07Å; K460-R470 WeakPolarHBondContact CD-O 3.43Å; K460-R470 HydrophobicContact CG-CB 4.37Å; K460-R470 PolarHBondContact O-NE 2.88Å; K460-R470 PolarHBondContact O-NH2 3.26Å; K460-R470 VanDerWaalsContact O-NH2 3.13Å; L462-R470 CarbonylContact O-C 3.58Å; L462-R470 WeakPolarHBondContact O-CA 3.18Å; K463-R470 HydrophobicContact CB-CG 4.42Å; E468-R470 PolarHBondContact O-N 2.74Å
471	F	67.6	Low	69.4	Low	36 Å²	36	81.8 Å²	81.8	16%	0.158	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	149.6	-177.7	-63.2	-86.7	0	0	0	111.7	K460 P461 L462 C464 K469 D476 L477 H480	K460-F471 CarbonylContact C-O 3.51Å; P461-F471 WeakPolarHBondContact CD-O 3.41Å; L462-F471 HydrophobicContact CB-CB 4.48Å; L462-F471 PolarHBondContact N-O 3.15Å; L462-F471 PolarHBondContact O-N 2.78Å; C464-F471 HydrophobicContact CB-CE2 4.06Å; K469-F471 HydrophobicContact CB-CE2 3.71Å; K469-F471 HydrophobicContact CB-CZ 3.81Å; K469-F471 WeakPolarHBondContact O-CD2 3.12Å; K469-F471 VanDerWaalsContact O-CE2 3.27Å; K469-F471 WeakPolarHBondContact O-CE2 3.42Å; F471-D476 HydrophobicContact CB-CB 4.29Å; F471-D476 HydrophobicContact CD1-CB 3.91Å; F471-D476 HydrophobicContact CG-CB 4.43Å; F471-L477 HydrophobicContact CB-CB 4.08Å; F471-L477 HydrophobicContact CD2-CB 4.1Å; F471-L477 HydrophobicContact CD2-CD1 3.74Å; F471-L477 HydrophobicContact CE2-CD1 4.14Å; F471-L477 HydrophobicContact CG-CB 4.18Å; F471-H480 HydrophobicContact CD1-CB 4.39Å; F471-H480 HydrophobicContact CE1-CB 3.64Å; F471-H480 AromaticContact CE1-CG 3.76Å; F471-H480 HydrophobicContact CE2-CB 3.88Å; F471-H480 AromaticContact CE2-CD2 3.25Å; F471-H480 WeakPolarHBondContact CE2-CD2 3.43Å; F471-H480 AromaticContact CE2-CG 3.52Å; F471-H480 AromaticContact CE2-NE2 3.88Å; F471-H480 HydrophobicContact CZ-CB 3.38Å; F471-H480 AromaticContact CZ-CD2 3.25Å; F471-H480 WeakPolarHBondContact CZ-CD2 3.32Å; F471-H480 AromaticContact CZ-CE1 3.88Å; F471-H480 AromaticContact CZ-CG 3.01Å; F471-H480 AromaticContact CZ-ND1 3.45Å; F471-H480 WeakPolarHBondContact CZ-ND1 3.2Å; F471-H480 AromaticContact CZ-NE2 3.76Å
472	K	57.2	Low	70.5	Confident	125 Å²	125	79.5 Å²	79.5	54%	0.543	38%	0.383	S	S	.	.	S	Bend	trans	-82.5	-30.3	-179.8	-171.2	176.5	179.8	-179.2	0	112.6
473	Y	60.8	Low	71.5	Confident	116 Å²	116	80.5 Å²	80.5	46%	0.455	39%	0.392	S	S	.	.	S	Bend	trans	-128.2	146.7	-175.5	-54	-67.9	0	0	0	111.3	L462 S475 D476 L477	L462-Y473 VanDerWaalsContact CD1-C 3.46Å; Y473-S475 VanDerWaalsContact C-N 3.31Å; Y473-S475 PolarHBondContact O-N 2.79Å; Y473-D476 VanDerWaalsContact CD2-OD2 3.28Å; Y473-D476 WeakPolarHBondContact CD2-OD2 3.47Å; Y473-D476 WeakPolarHBondContact O-CB 3.27Å; Y473-D476 PolarHBondContact O-N 2.84Å; Y473-D476 VanDerWaalsContact O-N 3.11Å; Y473-L477 PolarHBondContact O-N 3.24Å; Y473-L477 VanDerWaalsContact O-N 3.12Å
474	A	57.6	Low	72	Confident	67 Å²	67	78.6 Å²	78.6	55%	0.554	39%	0.385	S	S	*	.	H	α-helix	trans	-65.4	-33.6	179.8	0	0	0	0	0	112.8	L462 D476 L477 Q478	L462-A474 VanDerWaalsContact CD1-CA 3.41Å; L462-A474 HydrophobicContact CD1-CB 3.85Å; L462-A474 VanDerWaalsContact CD1-N 3.26Å; A474-D476 VanDerWaalsContact C-N 3.27Å; A474-D476 PolarHBondContact O-N 3.08Å; A474-L477 PolarHBondContact O-N 3.46Å; A474-Q478 WeakPolarHBondContact O-CB 3.45Å; A474-Q478 PolarHBondContact O-N 3.44Å
475	S	61.7	Low	72	Confident	78 Å²	78	81.9 Å²	81.9	55%	0.545	41%	0.405	S	S	.	.	H	α-helix	trans	-61.2	-35.7	172.1	50.2	0	0	0	0	112.6	Y473 R479	Y473-S475 VanDerWaalsContact C-N 3.31Å; Y473-S475 PolarHBondContact O-N 2.79Å; S475-R479 VanDerWaalsContact O-CB 3.26Å; S475-R479 WeakPolarHBondContact O-CB 3.39Å; S475-R479 PolarHBondContact O-N 3.34Å
476	D	72.8	Confident	72.1	Confident	39 Å²	39	79.2 Å²	79.2	21%	0.209	39%	0.394	C	S	.	.	H	α-helix	trans	-74.1	-42.2	177.5	-71.1	-29.7	0	0	0	112.1	F471 Y473 A474 Q478 R479 H480	F471-D476 HydrophobicContact CB-CB 4.29Å; F471-D476 HydrophobicContact CD1-CB 3.91Å; F471-D476 HydrophobicContact CG-CB 4.43Å; Y473-D476 VanDerWaalsContact CD2-OD2 3.28Å; Y473-D476 WeakPolarHBondContact CD2-OD2 3.47Å; Y473-D476 WeakPolarHBondContact O-CB 3.27Å; Y473-D476 PolarHBondContact O-N 2.84Å; Y473-D476 VanDerWaalsContact O-N 3.11Å; A474-D476 VanDerWaalsContact C-N 3.27Å; A474-D476 PolarHBondContact O-N 3.08Å; D476-Q478 VanDerWaalsContact C-N 3.34Å; D476-R479 PolarHBondContact O-N 3.16Å; D476-R479 IonicContact OD1-CZ 2.65Å; D476-R479 IonicContact OD1-NE 3.41Å; D476-R479 IonicContact OD1-NH2 3.53Å; D476-R479 PolarHBondContact OD1-NH2 3.49Å; D476-H480 WeakPolarHBondContact O-CB 3.3Å; D476-H480 PolarHBondContact O-N 3.23Å
477	L	74	Confident	72.3	Confident	27 Å²	27	80.2 Å²	80.2	14%	0.141	40%	0.396	C	S	.	.	H	α-helix	trans	-60	-46.4	172.9	173.3	58.8	0	0	0	110.5	L462 C464 F471 Y473 A474 R479 H480 R481	L462-L477 HydrophobicContact CB-CB 4.39Å; L462-L477 HydrophobicContact CB-CD2 3.87Å; C464-L477 HydrophobicContact CB-CD1 3.54Å; F471-L477 HydrophobicContact CB-CB 4.08Å; F471-L477 HydrophobicContact CD2-CB 4.1Å; F471-L477 HydrophobicContact CD2-CD1 3.74Å; F471-L477 HydrophobicContact CE2-CD1 4.14Å; F471-L477 HydrophobicContact CG-CB 4.18Å; Y473-L477 PolarHBondContact O-N 3.24Å; Y473-L477 VanDerWaalsContact O-N 3.12Å; A474-L477 PolarHBondContact O-N 3.46Å; L477-R479 PolarHBondContact O-N 3.49Å; L477-H480 CarbonylContact O-C 3.54Å; L477-H480 WeakPolarHBondContact O-CB 3.39Å; L477-H480 PolarHBondContact O-N 3.14Å; L477-H480 VanDerWaalsContact O-N 3.16Å; L477-R481 HydrophobicContact CD1-CG 4.09Å; L477-R481 HydrophobicContact CG-CG 4.48Å; L477-R481 WeakPolarHBondContact O-CG 3.42Å; L477-R481 PolarHBondContact O-N 3.09Å
478	Q	72.3	Confident	72.5	Confident	127 Å²	127	84.1 Å²	84.1	59%	0.593	41%	0.41	S	S	*	.	H	α-helix	trans	-63.2	-41.7	178.6	-171.7	-178.9	2.6	0	0	112.1	A474 D476 H480 R481	A474-Q478 WeakPolarHBondContact O-CB 3.45Å; A474-Q478 PolarHBondContact O-N 3.44Å; D476-Q478 VanDerWaalsContact C-N 3.34Å; Q478-H480 VanDerWaalsContact C-N 3.3Å; Q478-H480 PolarHBondContact O-N 3.42Å; Q478-R481 PolarHBondContact O-N 3.25Å
479	R	78.1	Confident	73	Confident	97 Å²	97	80.2 Å²	80.2	37%	0.366	40%	0.398	S	S	.	.	H	α-helix	trans	-63.7	-37.7	173.6	179.4	169.7	64.4	165.2	-7.8	111.9	S475 D476 L477 R482 Q501	S475-R479 VanDerWaalsContact O-CB 3.26Å; S475-R479 WeakPolarHBondContact O-CB 3.39Å; S475-R479 PolarHBondContact O-N 3.34Å; D476-R479 PolarHBondContact O-N 3.16Å; D476-R479 IonicContact OD1-CZ 2.65Å; D476-R479 IonicContact OD1-NE 3.41Å; D476-R479 IonicContact OD1-NH2 3.53Å; D476-R479 PolarHBondContact OD1-NH2 3.49Å; L477-R479 PolarHBondContact O-N 3.49Å; R479-R482 WeakPolarHBondContact O-CB 3.25Å; R479-Q501 HydrophobicContact CG-CG 4.09Å
480	H	81.3	Confident	73.5	Confident	24 Å²	24	77.3 Å²	77.3	11%	0.111	38%	0.384	C	S	.	.	H	α-helix	trans	-70.9	-37.1	177.4	173.6	71	0	0	0	112.7	C467 F471 D476 L477 Q478 R482 V483 H484	C467-H480 PolarHBondContact SG-NE2 2.89Å; F471-H480 HydrophobicContact CD1-CB 4.39Å; F471-H480 HydrophobicContact CE1-CB 3.64Å; F471-H480 AromaticContact CE1-CG 3.76Å; F471-H480 HydrophobicContact CE2-CB 3.88Å; F471-H480 AromaticContact CE2-CD2 3.25Å; F471-H480 WeakPolarHBondContact CE2-CD2 3.43Å; F471-H480 AromaticContact CE2-CG 3.52Å; F471-H480 AromaticContact CE2-NE2 3.88Å; F471-H480 HydrophobicContact CZ-CB 3.38Å; F471-H480 AromaticContact CZ-CD2 3.25Å; F471-H480 WeakPolarHBondContact CZ-CD2 3.32Å; F471-H480 AromaticContact CZ-CE1 3.88Å; F471-H480 AromaticContact CZ-CG 3.01Å; F471-H480 AromaticContact CZ-ND1 3.45Å; F471-H480 WeakPolarHBondContact CZ-ND1 3.2Å; F471-H480 AromaticContact CZ-NE2 3.76Å; D476-H480 WeakPolarHBondContact O-CB 3.3Å; D476-H480 PolarHBondContact O-N 3.23Å; L477-H480 CarbonylContact O-C 3.54Å; L477-H480 WeakPolarHBondContact O-CB 3.39Å; L477-H480 PolarHBondContact O-N 3.14Å; L477-H480 VanDerWaalsContact O-N 3.16Å; Q478-H480 VanDerWaalsContact C-N 3.3Å; Q478-H480 PolarHBondContact O-N 3.42Å; H480-R482 PolarHBondContact O-N 3.38Å; H480-R482 VanDerWaalsContact O-N 3.15Å; H480-V483 WeakPolarHBondContact O-CA 3.35Å; H480-V483 WeakPolarHBondContact O-CB 3.04Å; H480-V483 VanDerWaalsContact O-CG2 3.25Å; H480-V483 WeakPolarHBondContact O-CG2 2.98Å; H480-V483 PolarHBondContact O-N 3.35Å; H480-H484 AromaticContact CD2-NE2 3.98Å; H480-H484 AromaticContact CE1-NE2 3.82Å; H480-H484 AromaticContact NE2-CD2 3.91Å; H480-H484 AromaticContact NE2-NE2 3.18Å; H480-H484 PolarHBondContact NE2-NE2 3.11Å; H480-H484 VanDerWaalsContact NE2-NE2 3.18Å
481	R	77.8	Confident	74	Confident	116 Å²	116	79.9 Å²	79.9	44%	0.438	40%	0.397	S	S	.	.	H	α-helix	trans	-58.4	-27.9	176.2	-74.5	-179.1	74.3	-161.4	0.1	113	L477 Q478 V483 H484 T485	L477-R481 HydrophobicContact CD1-CG 4.09Å; L477-R481 HydrophobicContact CG-CG 4.48Å; L477-R481 WeakPolarHBondContact O-CG 3.42Å; L477-R481 PolarHBondContact O-N 3.09Å; Q478-R481 PolarHBondContact O-N 3.25Å; R481-V483 PolarHBondContact O-N 2.88Å; R481-V483 VanDerWaalsContact O-N 3.14Å; R481-H484 PolarHBondContact O-N 2.06Å; R481-T485 PolarHBondContact O-N 2.99Å; R481-T485 PolarHBondContact O-OG1 2.95Å
482	R	82.2	Confident	74.5	Confident	43 Å²	43	78.2 Å²	78.2	16%	0.162	39%	0.39	C	S	.	.	H	α-helix	trans	-62.8	-15.9	171.1	-58	178.8	-173.6	169.7	1.1	113.8	R479 H480 T485 G486 E487 K500	R479-R482 WeakPolarHBondContact O-CB 3.25Å; H480-R482 PolarHBondContact O-N 3.38Å; H480-R482 VanDerWaalsContact O-N 3.15Å; R482-T485 WeakPolarHBondContact CA-OG1 3.35Å; R482-G486 PolarHBondContact O-N 2.87Å; R482-E487 HydrophobicContact CG-CB 4.4Å; R482-K500 PolarHBondContact NH1-O 2.98Å; R482-K500 VanDerWaalsContact NH1-O 3.08Å; R482-K500 WeakPolarHBondContact O-CD 3.31Å; R482-K500 WeakPolarHBondContact O-CE 3.38Å; R482-K500 PolarHBondContact O-NZ 2.95Å
483	V	79	Confident	75.2	Confident	81 Å²	81	77.6 Å²	77.6	49%	0.491	40%	0.399	S	S	.	.	H	α-helix	trans	-67.7	-45.5	170.7	-178.5	0	0	0	0	109.5	H480 R481 K500	H480-V483 WeakPolarHBondContact O-CA 3.35Å; H480-V483 WeakPolarHBondContact O-CB 3.04Å; H480-V483 VanDerWaalsContact O-CG2 3.25Å; H480-V483 WeakPolarHBondContact O-CG2 2.98Å; H480-V483 PolarHBondContact O-N 3.35Å; R481-V483 PolarHBondContact O-N 2.88Å; R481-V483 VanDerWaalsContact O-N 3.14Å; V483-K500 PolarHBondContact O-NZ 2.84Å
484	H	79.3	Confident	75.6	Confident	77 Å²	77	76 Å²	76	36%	0.356	41%	0.405	S	S	.	.	H	α-helix	trans	-77.9	-45.6	-178.9	-57.2	-54.8	0	0	0	113	C464 D466 C467 H480 R481 G486	C464-H484 PolarHBondContact SG-CD2 3.15Å; C464-H484 PolarHBondContact SG-NE2 3.46Å; D466-H484 HydrophobicContact CB-CB 4.07Å; D466-H484 IonicContact OD2-CD2 2.73Å; C467-H484 PolarHBondContact SG-NE2 2.82Å; H480-H484 AromaticContact CD2-NE2 3.98Å; H480-H484 AromaticContact CE1-NE2 3.82Å; H480-H484 AromaticContact NE2-CD2 3.91Å; H480-H484 AromaticContact NE2-NE2 3.18Å; H480-H484 PolarHBondContact NE2-NE2 3.11Å; H480-H484 VanDerWaalsContact NE2-NE2 3.18Å; R481-H484 PolarHBondContact O-N 2.06Å; H484-G486 PolarHBondContact O-N 3.31Å
485	T	75.6	Confident	76.6	Confident	69 Å²	69	75 Å²	75	42%	0.423	39%	0.393	S	S	.	.	S	Bend	trans	-76.3	-9.8	-179.2	63.2	0	0	0	0	113.4	R481 R482 E487	R481-T485 PolarHBondContact O-N 2.99Å; R481-T485 PolarHBondContact O-OG1 2.95Å; R482-T485 WeakPolarHBondContact CA-OG1 3.35Å; T485-E487 PolarHBondContact O-N 2.91Å; T485-E487 WeakPolarHBondContact OG1-CG 3.19Å
486	G	75.7	Confident	77.1	Confident	38 Å²	38	79.3 Å²	79.3	39%	0.392	41%	0.405	S	S	.	.			trans	67.7	-0.8	-176.5	0	0	0	0	0	114.7	R482 H484 K488	R482-G486 PolarHBondContact O-N 2.87Å; H484-G486 PolarHBondContact O-N 3.31Å; G486-K488 PolarHBondContact O-N 3.02Å
487	E	77.4	Confident	77.3	Confident	112 Å²	112	83.3 Å²	83.3	52%	0.523	42%	0.42	S	S	.	.			trans	-56.7	126.3	-176.2	-75.9	176.6	-166.4	0	0	112	R482 T485 P489	R482-E487 HydrophobicContact CG-CB 4.4Å; T485-E487 PolarHBondContact O-N 2.91Å; T485-E487 WeakPolarHBondContact OG1-CG 3.19Å; E487-P489 WeakPolarHBondContact O-CD 3.38Å
488	K	81.3	Confident	77.7	Confident	110 Å²	110	83.4 Å²	83.4	48%	0.478	43%	0.425	S	S	.	.			trans	-120.6	78.4	177.1	-72.1	163.9	169.5	-167.2	0	109.8	G486 Y490 A498 F499 K500	G486-K488 PolarHBondContact O-N 3.02Å; K488-Y490 PolarHBondContact O-N 3.27Å; K488-A498 HydrophobicContact CB-CB 3.54Å; K488-A498 HydrophobicContact CD-CB 4.07Å; K488-A498 VanDerWaalsContact CD-O 3.27Å; K488-A498 WeakPolarHBondContact CD-O 3.38Å; K488-A498 HydrophobicContact CG-CB 4.38Å; K488-F499 CarbonylContact C-O 3.51Å; K488-F499 VanDerWaalsContact CA-O 3.31Å; K488-F499 WeakPolarHBondContact CA-O 3.42Å; K488-K500 HydrophobicContact CG-CG 3.76Å
489	P	79.6	Confident	78.2	Confident	71 Å²	71	79.3 Å²	79.3	46%	0.461	41%	0.405	S	S	.	.			trans	-68.4	-18.2	-172.3	-20.1	33.5	0	0	0	114.1	E487	E487-P489 WeakPolarHBondContact O-CD 3.38Å
490	Y	82.9	Confident	78.2	Confident	72 Å²	72	77.8 Å²	77.8	28%	0.282	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	96.1	-174.1	-54.8	-74.1	0	0	0	109.6	K488 A498 F499 Q501 R502	K488-Y490 PolarHBondContact O-N 3.27Å; Y490-A498 CarbonylContact O-C 3.58Å; Y490-A498 WeakPolarHBondContact O-CA 3.49Å; Y490-F499 PolarHBondContact N-O 2.85Å; Y490-F499 PolarHBondContact O-N 3.11Å; Y490-Q501 VanDerWaalsContact CD2-C 3.41Å; Y490-R502 HydrophobicContact CD1-CB 4.17Å; Y490-R502 HydrophobicContact CD1-CG 4.37Å; Y490-R502 HydrophobicContact CE1-CB 3.98Å; Y490-R502 HydrophobicContact CE1-CG 4.36Å; Y490-R502 HydrophobicContact CE2-CB 4.32Å; Y490-R502 HydrophobicContact CG-CB 4.44Å
491	K	79.2	Confident	78.1	Confident	152 Å²	152	79 Å²	79	66%	0.661	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	137.7	176.5	-60.6	-174.9	178.6	-174.5	0	110.4	P493 A498	K491-P493 WeakPolarHBondContact O-CD 3.48Å; K491-A498 HydrophobicContact CG-CB 3.97Å
492	C	79.8	Confident	78.1	Confident	1 Å²	1	81.1 Å²	81.1	1%	0.007	42%	0.415	C	S	.	.			trans	-75.4	123.9	168.7	-173	0	0	0	0	109.2	S494 E496 K497 F499 L505 H512	C492-S494 PolarHBondContact O-N 3.29Å; C492-E496 WeakPolarHBondContact O-CA 3.34Å; C492-E496 PolarHBondContact O-N 3.14Å; C492-K497 WeakPolarHBondContact CB-O 3.31Å; C492-K497 PolarHBondContact N-O 2.96Å; C492-F499 HydrophobicContact CB-CE2 4.48Å; C492-L505 HydrophobicContact CB-CD1 3.68Å; C492-H512 PolarHBondContact SG-NE2 2.99Å
493	P	72	Confident	78	Confident	113 Å²	113	84.2 Å²	84.2	73%	0.734	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-24	177.2	-18.7	31.6	0	0	0	113.3	K491	K491-P493 WeakPolarHBondContact O-CD 3.48Å
494	S	68.9	Low	78.1	Confident	83 Å²	83	84.6 Å²	84.6	58%	0.58	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-24.3	-171.2	-53.5	0	0	0	0	114.3	C492	C492-S494 PolarHBondContact O-N 3.29Å
495	C	77.5	Confident	78.2	Confident	45 Å²	45	81.6 Å²	81.6	30%	0.304	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.9	13.3	179.9	70.4	0	0	0	0	113.5	K497 H508 H512	C495-K497 PolarHBondContact O-N 3.37Å; C495-K497 VanDerWaalsContact SG-CG 3.6Å; C495-H508 PolarHBondContact SG-NE2 3.12Å; C495-H512 VanDerWaalsContact SG-CE1 3.56Å; C495-H512 PolarHBondContact SG-NE2 2.96Å
496	E	71.7	Confident	78.4	Confident	168 Å²	168	82.5 Å²	82.5	79%	0.785	42%	0.416	S	S	*	.			trans	58	2	178.5	-56.9	-167.7	152.6	0	0	116.5	C492 A498	C492-E496 WeakPolarHBondContact O-CA 3.34Å; C492-E496 PolarHBondContact O-N 3.14Å; E496-A498 PolarHBondContact O-N 3.1Å
497	K	77.5	Confident	78.4	Confident	124 Å²	124	87.9 Å²	87.9	54%	0.539	43%	0.429	S	S	.	.			trans	-60.4	127.5	176.6	-71.6	-179.6	-175.7	172.5	0	110.6	C492 C495 F499	C492-K497 WeakPolarHBondContact CB-O 3.31Å; C492-K497 PolarHBondContact N-O 2.96Å; C495-K497 PolarHBondContact O-N 3.37Å; C495-K497 VanDerWaalsContact SG-CG 3.6Å; K497-F499 HydrophobicContact CB-CE2 3.89Å; K497-F499 HydrophobicContact CB-CZ 4.02Å; K497-F499 WeakPolarHBondContact O-CD2 3.39Å; K497-F499 WeakPolarHBondContact O-CE2 3.26Å
498	A	82.1	Confident	78.5	Confident	28 Å²	28	83.6 Å²	83.6	23%	0.231	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	136.6	-176	0	0	0	0	0	111.9	K488 Y490 K491 E496	K488-A498 HydrophobicContact CB-CB 3.54Å; K488-A498 HydrophobicContact CD-CB 4.07Å; K488-A498 VanDerWaalsContact CD-O 3.27Å; K488-A498 WeakPolarHBondContact CD-O 3.38Å; K488-A498 HydrophobicContact CG-CB 4.38Å; Y490-A498 CarbonylContact O-C 3.58Å; Y490-A498 WeakPolarHBondContact O-CA 3.49Å; K491-A498 HydrophobicContact CG-CB 3.97Å; E496-A498 PolarHBondContact O-N 3.1Å
499	F	82.7	Confident	78.2	Confident	42 Å²	42	81.7 Å²	81.7	18%	0.184	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	147.3	-176.1	-58.2	-89.6	0	0	0	111.7	K488 Y490 C492 K497 Q501 H504 L505 H508	K488-F499 CarbonylContact C-O 3.51Å; K488-F499 VanDerWaalsContact CA-O 3.31Å; K488-F499 WeakPolarHBondContact CA-O 3.42Å; Y490-F499 PolarHBondContact N-O 2.85Å; Y490-F499 PolarHBondContact O-N 3.11Å; C492-F499 HydrophobicContact CB-CE2 4.48Å; K497-F499 HydrophobicContact CB-CE2 3.89Å; K497-F499 HydrophobicContact CB-CZ 4.02Å; K497-F499 WeakPolarHBondContact O-CD2 3.39Å; K497-F499 WeakPolarHBondContact O-CE2 3.26Å; F499-Q501 VanDerWaalsContact C-N 3.33Å; F499-H504 HydrophobicContact CB-CB 4.23Å; F499-H504 HydrophobicContact CD1-CB 3.85Å; F499-H504 HydrophobicContact CG-CB 4.29Å; F499-L505 HydrophobicContact CB-CB 4.43Å; F499-L505 HydrophobicContact CD2-CB 3.95Å; F499-L505 HydrophobicContact CD2-CD1 3.71Å; F499-L505 HydrophobicContact CD2-CG 4.44Å; F499-L505 HydrophobicContact CE2-CD1 3.83Å; F499-L505 HydrophobicContact CG-CB 4.34Å; F499-H508 HydrophobicContact CE1-CB 4.02Å; F499-H508 HydrophobicContact CE2-CB 3.83Å; F499-H508 AromaticContact CE2-CD2 3.42Å; F499-H508 VanDerWaalsContact CE2-CD2 3.42Å; F499-H508 WeakPolarHBondContact CE2-CD2 3.49Å; F499-H508 AromaticContact CE2-CG 3.67Å; F499-H508 HydrophobicContact CZ-CB 3.4Å; F499-H508 VanDerWaalsContact CZ-CB 3.4Å; F499-H508 AromaticContact CZ-CD2 3.46Å; F499-H508 VanDerWaalsContact CZ-CD2 3.46Å; F499-H508 WeakPolarHBondContact CZ-CD2 3.47Å; F499-H508 AromaticContact CZ-CG 3.25Å; F499-H508 AromaticContact CZ-ND1 3.85Å
500	K	78.7	Confident	77.8	Confident	64 Å²	64	80.9 Å²	80.9	28%	0.278	40%	0.397	S	S	.	.	S	Bend	trans	-73.8	-23	177.7	-58.8	-171.8	176	-168	0	112.9	R482 V483 K488	R482-K500 PolarHBondContact NH1-O 2.98Å; R482-K500 VanDerWaalsContact NH1-O 3.08Å; R482-K500 WeakPolarHBondContact O-CD 3.31Å; R482-K500 WeakPolarHBondContact O-CE 3.38Å; R482-K500 PolarHBondContact O-NZ 2.95Å; V483-K500 PolarHBondContact O-NZ 2.84Å; K488-K500 HydrophobicContact CG-CG 3.76Å
501	Q	78.7	Confident	77.2	Confident	49 Å²	49	80.2 Å²	80.2	23%	0.229	40%	0.401	C	S	.	.	S	Bend	trans	-136.5	150.7	-175.9	-59.8	-174.7	14.3	0	0	111.9	R479 Y490 F499 H504 L505	R479-Q501 HydrophobicContact CG-CG 4.09Å; Y490-Q501 VanDerWaalsContact CD2-C 3.41Å; F499-Q501 VanDerWaalsContact C-N 3.33Å; Q501-H504 PolarHBondContact O-N 3.21Å; Q501-L505 PolarHBondContact O-N 3.26Å
502	R	78.7	Confident	76.6	Confident	162 Å²	162	74 Å²	74	61%	0.611	37%	0.374	S	S	*	.	H	α-helix	trans	-71.8	-33.8	-177.2	-167.6	174.2	-164.6	162.8	6.9	112.5	Y490 H504 L505 N506	Y490-R502 HydrophobicContact CD1-CB 4.17Å; Y490-R502 HydrophobicContact CD1-CG 4.37Å; Y490-R502 HydrophobicContact CE1-CB 3.98Å; Y490-R502 HydrophobicContact CE1-CG 4.36Å; Y490-R502 HydrophobicContact CE2-CB 4.32Å; Y490-R502 HydrophobicContact CG-CB 4.44Å; R502-H504 VanDerWaalsContact C-N 3.25Å; R502-H504 PolarHBondContact O-N 3.32Å; R502-L505 PolarHBondContact O-N 2.75Å; R502-N506 PolarHBondContact O-N 2.74Å
503	E	79.3	Confident	75.8	Confident	108 Å²	108	77.1 Å²	77.1	51%	0.505	40%	0.4	S	S	.	.	H	α-helix	trans	-62.3	-35.7	176.9	-61.4	94.1	170.6	0	0	111.8	N506 K507	E503-N506 PolarHBondContact O-N 2.89Å; E503-K507 WeakPolarHBondContact O-CG 3.47Å; E503-K507 PolarHBondContact O-N 3.26Å
504	H	82.1	Confident	75.1	Confident	88 Å²	88	81.3 Å²	81.3	41%	0.407	40%	0.401	S	S	.	.	H	α-helix	trans	-69.3	-38.8	177	-61	156.4	0	0	0	112.3	F499 Q501 R502 K507 H508	F499-H504 HydrophobicContact CB-CB 4.23Å; F499-H504 HydrophobicContact CD1-CB 3.85Å; F499-H504 HydrophobicContact CG-CB 4.29Å; Q501-H504 PolarHBondContact O-N 3.21Å; R502-H504 VanDerWaalsContact C-N 3.25Å; R502-H504 PolarHBondContact O-N 3.32Å; H504-K507 PolarHBondContact O-N 3.05Å; H504-H508 VanDerWaalsContact O-CB 3.32Å; H504-H508 WeakPolarHBondContact O-CB 3.45Å; H504-H508 PolarHBondContact O-N 3.3Å
505	L	80.9	Confident	74.4	Confident	15 Å²	15	81.7 Å²	81.7	8%	0.079	39%	0.394	C	S	.	.	H	α-helix	trans	-62.9	-42.6	171.8	177.2	63.6	0	0	0	111.3	C492 F499 Q501 R502 K507 H508 H509	C492-L505 HydrophobicContact CB-CD1 3.68Å; F499-L505 HydrophobicContact CB-CB 4.43Å; F499-L505 HydrophobicContact CD2-CB 3.95Å; F499-L505 HydrophobicContact CD2-CD1 3.71Å; F499-L505 HydrophobicContact CD2-CG 4.44Å; F499-L505 HydrophobicContact CE2-CD1 3.83Å; F499-L505 HydrophobicContact CG-CB 4.34Å; Q501-L505 PolarHBondContact O-N 3.26Å; R502-L505 PolarHBondContact O-N 2.75Å; L505-K507 PolarHBondContact O-N 3.47Å; L505-H508 CarbonylContact O-C 3.43Å; L505-H508 WeakPolarHBondContact O-CA 3.49Å; L505-H508 WeakPolarHBondContact O-CB 3.29Å; L505-H508 PolarHBondContact O-N 2.94Å; L505-H508 VanDerWaalsContact O-N 3.1Å; L505-H509 WeakPolarHBondContact CD1-NE2 3.47Å; L505-H509 PolarHBondContact O-N 3.03Å
506	N	78.8	Confident	73.4	Confident	88 Å²	88	83.2 Å²	83.2	47%	0.471	40%	0.396	S	S	.	.	H	α-helix	trans	-63.9	-41.4	178.2	-70.6	-9.7	0	0	0	112	R502 E503 H508 H509 S510	R502-N506 PolarHBondContact O-N 2.74Å; E503-N506 PolarHBondContact O-N 2.89Å; N506-H508 VanDerWaalsContact C-N 3.29Å; N506-H508 PolarHBondContact O-N 3.25Å; N506-H509 PolarHBondContact O-N 3.19Å; N506-S510 PolarHBondContact O-N 2.77Å
507	K	76.6	Confident	72.7	Confident	150 Å²	150	81.6 Å²	81.6	65%	0.652	39%	0.389	S	S	*	.	H	α-helix	trans	-62	-39.7	171.1	-73.4	-178.9	179.8	-174.9	0	111.1	E503 H504 L505 S510	E503-K507 WeakPolarHBondContact O-CG 3.47Å; E503-K507 PolarHBondContact O-N 3.26Å; H504-K507 PolarHBondContact O-N 3.05Å; L505-K507 PolarHBondContact O-N 3.47Å; K507-S510 WeakPolarHBondContact O-CB 3.46Å; K507-S510 PolarHBondContact O-N 3.42Å; K507-S510 PolarHBondContact O-OG 2.97Å
508	H	79.3	Confident	71.8	Confident	22 Å²	22	79.1 Å²	79.1	10%	0.102	38%	0.377	C	S	.	.	H	α-helix	trans	-67.4	-36.3	177.8	178	61	0	0	0	113.4	C495 F499 H504 L505 N506 S510 V511 H512	C495-H508 PolarHBondContact SG-NE2 3.12Å; F499-H508 HydrophobicContact CE1-CB 4.02Å; F499-H508 HydrophobicContact CE2-CB 3.83Å; F499-H508 AromaticContact CE2-CD2 3.42Å; F499-H508 VanDerWaalsContact CE2-CD2 3.42Å; F499-H508 WeakPolarHBondContact CE2-CD2 3.49Å; F499-H508 AromaticContact CE2-CG 3.67Å; F499-H508 HydrophobicContact CZ-CB 3.4Å; F499-H508 VanDerWaalsContact CZ-CB 3.4Å; F499-H508 AromaticContact CZ-CD2 3.46Å; F499-H508 VanDerWaalsContact CZ-CD2 3.46Å; F499-H508 WeakPolarHBondContact CZ-CD2 3.47Å; F499-H508 AromaticContact CZ-CG 3.25Å; F499-H508 AromaticContact CZ-ND1 3.85Å; H504-H508 VanDerWaalsContact O-CB 3.32Å; H504-H508 WeakPolarHBondContact O-CB 3.45Å; H504-H508 PolarHBondContact O-N 3.3Å; L505-H508 CarbonylContact O-C 3.43Å; L505-H508 WeakPolarHBondContact O-CA 3.49Å; L505-H508 WeakPolarHBondContact O-CB 3.29Å; L505-H508 PolarHBondContact O-N 2.94Å; L505-H508 VanDerWaalsContact O-N 3.1Å; N506-H508 VanDerWaalsContact C-N 3.29Å; N506-H508 PolarHBondContact O-N 3.25Å; H508-S510 PolarHBondContact O-N 3.42Å; H508-V511 WeakPolarHBondContact O-CA 3.37Å; H508-V511 WeakPolarHBondContact O-CB 3.23Å; H508-V511 PolarHBondContact O-N 2.88Å; H508-H512 AromaticContact CD2-NE2 3.98Å; H508-H512 AromaticContact CE1-NE2 3.83Å; H508-H512 AromaticContact NE2-CE1 3.98Å; H508-H512 AromaticContact NE2-NE2 3.27Å; H508-H512 PolarHBondContact NE2-NE2 3.04Å
509	H	74.7	Confident	70.8	Confident	70 Å²	70	83.7 Å²	83.7	32%	0.324	39%	0.391	S	S	.	.	H	α-helix	trans	-58.8	-28.2	172	-69.2	165	0	0	0	113	L505 N506 V511 H512 A513	L505-H509 WeakPolarHBondContact CD1-NE2 3.47Å; L505-H509 PolarHBondContact O-N 3.03Å; N506-H509 PolarHBondContact O-N 3.19Å; H509-V511 PolarHBondContact O-N 3.12Å; H509-H512 PolarHBondContact O-N 3.12Å; H509-A513 PolarHBondContact O-N 3.08Å
510	S	71.9	Confident	70.1	Confident	54 Å²	54	81.7 Å²	81.7	38%	0.378	38%	0.382	S	S	.	.	H	α-helix	trans	-68.1	-19.7	173.5	78.3	0	0	0	0	113.4	N506 K507 H508 R514	N506-S510 PolarHBondContact O-N 2.77Å; K507-S510 WeakPolarHBondContact O-CB 3.46Å; K507-S510 PolarHBondContact O-N 3.42Å; K507-S510 PolarHBondContact O-OG 2.97Å; H508-S510 PolarHBondContact O-N 3.42Å; S510-R514 WeakPolarHBondContact O-CG 3.33Å; S510-R514 PolarHBondContact O-N 2.91Å; S510-R514 VanDerWaalsContact O-N 3.1Å
511	V	69.9	Low	69.2	Low	58 Å²	58	86.6 Å²	86.6	35%	0.352	41%	0.408	S	S	.	.	H	α-helix	trans	-71.7	-45.4	172.4	-176.2	0	0	0	0	109.9	H508 H509 A513 R514 E515	H508-V511 WeakPolarHBondContact O-CA 3.37Å; H508-V511 WeakPolarHBondContact O-CB 3.23Å; H508-V511 PolarHBondContact O-N 2.88Å; H509-V511 PolarHBondContact O-N 3.12Å; V511-A513 VanDerWaalsContact C-N 3.28Å; V511-A513 PolarHBondContact O-N 2.78Å; V511-R514 PolarHBondContact O-N 3.25Å; V511-E515 HydrophobicContact CG1-CG 4.49Å; V511-E515 WeakPolarHBondContact O-CG 3.3Å; V511-E515 PolarHBondContact O-N 3.28Å
512	H	67.6	Low	68.4	Low	23 Å²	23	91.9 Å²	91.9	11%	0.106	43%	0.426	C	S	.	.	H	α-helix	trans	-63.8	-33.3	172.1	-63.3	-45.5	0	0	0	113	C492 C495 H508 H509 R514 E515 Q516	C492-H512 PolarHBondContact SG-NE2 2.99Å; C495-H512 VanDerWaalsContact SG-CE1 3.56Å; C495-H512 PolarHBondContact SG-NE2 2.96Å; H508-H512 AromaticContact CD2-NE2 3.98Å; H508-H512 AromaticContact CE1-NE2 3.83Å; H508-H512 AromaticContact NE2-CE1 3.98Å; H508-H512 AromaticContact NE2-NE2 3.27Å; H508-H512 PolarHBondContact NE2-NE2 3.04Å; H509-H512 PolarHBondContact O-N 3.12Å; H512-R514 VanDerWaalsContact C-N 3.27Å; H512-R514 PolarHBondContact O-N 3.19Å; H512-E515 IonicContact ND1-OE2 3.64Å; H512-E515 PolarHBondContact ND1-OE2 3.48Å; H512-E515 PolarHBondContact O-N 3.49Å; H512-Q516 WeakPolarHBondContact O-CB 3.13Å; H512-Q516 WeakPolarHBondContact O-CG 3.49Å; H512-Q516 PolarHBondContact O-N 3.5Å
513	A	62.2	Low	68.1	Low	66 Å²	66	87 Å²	87	55%	0.545	42%	0.417	S	S	.	.	H	α-helix	trans	-68.6	-25.8	174.1	0	0	0	0	0	113.1	H509 V511	H509-A513 PolarHBondContact O-N 3.08Å; V511-A513 VanDerWaalsContact C-N 3.28Å; V511-A513 PolarHBondContact O-N 2.78Å
514	R	57.5	Low	67.2	Low	200 Å²	200	83.4 Å²	83.4	76%	0.755	41%	0.408	S	S	*	.	H	α-helix	trans	-83.5	-32.6	172.3	-73.4	176.2	-175.4	-165.3	-0.6	112.5	S510 V511 H512	S510-R514 WeakPolarHBondContact O-CG 3.33Å; S510-R514 PolarHBondContact O-N 2.91Å; S510-R514 VanDerWaalsContact O-N 3.1Å; V511-R514 PolarHBondContact O-N 3.25Å; H512-R514 VanDerWaalsContact C-N 3.27Å; H512-R514 PolarHBondContact O-N 3.19Å
515	E	54.2	Low	66.3	Low	92 Å²	92	84.8 Å²	84.8	43%	0.43	41%	0.414	S	S	.	.	H	α-helix	trans	-79.1	-22.2	178	-71.9	170	172.9	0	0	112.8	V511 H512 L528	V511-E515 HydrophobicContact CG1-CG 4.49Å; V511-E515 WeakPolarHBondContact O-CG 3.3Å; V511-E515 PolarHBondContact O-N 3.28Å; H512-E515 IonicContact ND1-OE2 3.64Å; H512-E515 PolarHBondContact ND1-OE2 3.48Å; H512-E515 PolarHBondContact O-N 3.49Å; E515-L528 HydrophobicContact CB-CD2 3.83Å; E515-L528 WeakPolarHBondContact O-CA 3.14Å; E515-L528 WeakPolarHBondContact O-CD2 3.33Å
516	Q	57.3	Low	65.6	Low	76 Å²	76	90.5 Å²	90.5	36%	0.355	44%	0.435	S	S	.	.			trans	-111.1	49.1	-179.5	-63.7	-175.8	-12.6	0	0	112.4	H512 R526	H512-Q516 WeakPolarHBondContact O-CB 3.13Å; H512-Q516 WeakPolarHBondContact O-CG 3.49Å; H512-Q516 PolarHBondContact O-N 3.5Å; Q516-R526 HydrophobicContact CB-CB 4.11Å; Q516-R526 HydrophobicContact CG-CB 4.4Å; Q516-R526 PolarHBondContact O-NE 3.45Å; Q516-R526 PolarHBondContact O-NH2 2.99Å
517	Q	55.3	Low	64.9	Low	135 Å²	135	87.7 Å²	87.7	63%	0.631	42%	0.419	S	S	*	.			trans	-73	-27.8	-169.9	-161.9	167	-3.7	0	0	113
518	Y	60.4	Low	64	Low	72 Å²	72	86.6 Å²	86.6	28%	0.282	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	121.6	-175.6	-57.6	-73.5	0	0	0	110.7	R526 F527 D529 L530	Y518-R526 CarbonylContact O-C 3.43Å; Y518-R526 WeakPolarHBondContact O-CA 3.37Å; Y518-F527 PolarHBondContact N-O 3.41Å; Y518-F527 PolarHBondContact O-N 3.46Å; Y518-D529 VanDerWaalsContact CD2-C 3.45Å; Y518-L530 HydrophobicContact CD1-CB 4.21Å; Y518-L530 HydrophobicContact CD1-CD1 3.74Å; Y518-L530 HydrophobicContact CD2-CB 4.46Å; Y518-L530 HydrophobicContact CE1-CB 3.94Å; Y518-L530 HydrophobicContact CE1-CD1 3.88Å; Y518-L530 HydrophobicContact CE1-CG 4.38Å; Y518-L530 HydrophobicContact CE2-CB 4.19Å; Y518-L530 HydrophobicContact CG-CB 4.46Å; Y518-L530 HydrophobicContact CG-CD1 4.46Å
519	K	60.3	Low	63.1	Low	123 Å²	123	89.8 Å²	89.8	54%	0.535	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126.1	-179.8	-178.9	-175.1	174	-169.9	0	108.9	M521 E525 R526	K519-M521 PolarHBondContact O-N 3.36Å; K519-E525 CarbonylContact C-O 3.27Å; K519-E525 WeakPolarHBondContact CA-O 3.44Å; K519-R526 HydrophobicContact CB-CG 4.48Å; K519-R526 HydrophobicContact CG-CG 4.33Å
520	C	68.6	Low	62.6	Low	0 Å²	0	90 Å²	90	0%	0	44%	0.44	C	S	.	.			trans	-64.6	124.6	171.3	179.8	0	0	0	0	109.7	W522 C523 G524 E525 F527 L533	C520-W522 VanDerWaalsContact C-N 3.3Å; C520-C523 VanDerWaalsContact CB-SG 3.56Å; C520-C523 PolarHBondContact SG-SG 3.2Å; C520-G524 WeakPolarHBondContact O-CA 3.13Å; C520-G524 PolarHBondContact O-N 3.31Å; C520-E525 PolarHBondContact N-O 3.4Å; C520-F527 HydrophobicContact CB-CE2 3.83Å; C520-L533 VanDerWaalsContact CA-CD1 3.47Å; C520-L533 HydrophobicContact CB-CD1 3.59Å
521	M	60	Low	62.4	Low	168 Å²	168	88.7 Å²	88.7	83%	0.828	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-23.5	-177.9	-63.4	-165.2	-62.2	0	0	112.5	K519	K519-M521 PolarHBondContact O-N 3.36Å
522	W	60.7	Low	62.4	Low	159 Å²	159	90 Å²	90	60%	0.602	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-41.3	-177.7	-65	-78.7	0	0	0	113.6	C520 H540	C520-W522 VanDerWaalsContact C-N 3.3Å; W522-H540 HydrophobicContact CB-CB 4.28Å; W522-H540 HydrophobicContact CD2-CB 4.04Å; W522-H540 HydrophobicContact CE3-CB 4.17Å; W522-H540 HydrophobicContact CG-CB 4.09Å
523	C	72.6	Confident	62.6	Low	61 Å²	61	90.1 Å²	90.1	41%	0.412	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-11.7	-177.9	64.8	0	0	0	0	114.5	C520 E525 H536	C520-C523 VanDerWaalsContact CB-SG 3.56Å; C520-C523 PolarHBondContact SG-SG 3.2Å; C523-E525 VanDerWaalsContact C-N 3.29Å; C523-E525 HydrophobicContact CB-CG 4.39Å; C523-E525 PolarHBondContact O-N 3.1Å; C523-E525 VanDerWaalsContact SG-CB 3.55Å; C523-E525 WeakPolarHBondContact SG-CG 3.46Å; C523-H536 PolarHBondContact SG-NE2 2.77Å
524	G	61.4	Low	62.7	Low	31 Å²	31	92.3 Å²	92.3	32%	0.32	44%	0.44	S	S	.	.			trans	80.6	-0.4	-179.9	0	0	0	0	0	115.9	C520	C520-G524 WeakPolarHBondContact O-CA 3.13Å; C520-G524 PolarHBondContact O-N 3.31Å
525	E	62.5	Low	63.4	Low	117 Å²	117	89.3 Å²	89.3	55%	0.547	44%	0.435	S	S	.	.			trans	-60.4	146.8	174.2	-69.6	-95.9	117.2	0	0	111.2	K519 C520 C523 F527	K519-E525 CarbonylContact C-O 3.27Å; K519-E525 WeakPolarHBondContact CA-O 3.44Å; C520-E525 PolarHBondContact N-O 3.4Å; C523-E525 VanDerWaalsContact C-N 3.29Å; C523-E525 HydrophobicContact CB-CG 4.39Å; C523-E525 PolarHBondContact O-N 3.1Å; C523-E525 VanDerWaalsContact SG-CB 3.55Å; C523-E525 WeakPolarHBondContact SG-CG 3.46Å; E525-F527 HydrophobicContact CB-CE2 3.6Å; E525-F527 HydrophobicContact CB-CZ 3.75Å; E525-F527 WeakPolarHBondContact O-CE2 3.3Å
526	R	65.1	Low	64.2	Low	135 Å²	135	86.4 Å²	86.4	51%	0.509	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133.9	-174.8	-56.1	-175.3	79.9	137.3	1.8	111	Q516 Y518 K519	Q516-R526 HydrophobicContact CB-CB 4.11Å; Q516-R526 HydrophobicContact CG-CB 4.4Å; Q516-R526 PolarHBondContact O-NE 3.45Å; Q516-R526 PolarHBondContact O-NH2 2.99Å; Y518-R526 CarbonylContact O-C 3.43Å; Y518-R526 WeakPolarHBondContact O-CA 3.37Å; K519-R526 HydrophobicContact CB-CG 4.48Å; K519-R526 HydrophobicContact CG-CG 4.33Å
527	F	65.1	Low	64.5	Low	30 Å²	30	84 Å²	84	13%	0.132	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	148.4	-172.1	-60.2	-89	0	0	0	110.8	Y518 C520 E525 L532 L533 H536	Y518-F527 PolarHBondContact N-O 3.41Å; Y518-F527 PolarHBondContact O-N 3.46Å; C520-F527 HydrophobicContact CB-CE2 3.83Å; E525-F527 HydrophobicContact CB-CE2 3.6Å; E525-F527 HydrophobicContact CB-CZ 3.75Å; E525-F527 WeakPolarHBondContact O-CE2 3.3Å; F527-L532 HydrophobicContact CB-CB 4.38Å; F527-L532 HydrophobicContact CD1-CB 4.03Å; F527-L533 HydrophobicContact CB-CB 4.13Å; F527-L533 HydrophobicContact CD2-CB 4.1Å; F527-L533 HydrophobicContact CD2-CD1 3.74Å; F527-L533 HydrophobicContact CE2-CD1 4Å; F527-L533 HydrophobicContact CG-CB 4.16Å; F527-H536 HydrophobicContact CE1-CB 3.72Å; F527-H536 AromaticContact CE1-CG 3.84Å; F527-H536 HydrophobicContact CE2-CB 4.27Å; F527-H536 AromaticContact CE2-CD2 3.58Å; F527-H536 AromaticContact CE2-CG 3.93Å; F527-H536 HydrophobicContact CZ-CB 3.57Å; F527-H536 AromaticContact CZ-CD2 3.31Å; F527-H536 WeakPolarHBondContact CZ-CD2 3.44Å; F527-H536 AromaticContact CZ-CG 3.22Å; F527-H536 AromaticContact CZ-ND1 3.75Å; F527-H536 AromaticContact CZ-NE2 3.87Å
528	L	56.7	Low	65.2	Low	127 Å²	127	81.7 Å²	81.7	67%	0.665	41%	0.407	S	S	*	.	S	Bend	trans	-79	-23.2	-176.9	-69.1	157.9	0	0	0	112.5	E515	E515-L528 HydrophobicContact CB-CD2 3.83Å; E515-L528 WeakPolarHBondContact O-CA 3.14Å; E515-L528 WeakPolarHBondContact O-CD2 3.33Å
529	D	61.9	Low	65.5	Low	88 Å²	88	84.7 Å²	84.7	47%	0.471	42%	0.424	S	S	.	.	S	Bend	trans	-144.4	154.2	-178.7	179.7	48.3	0	0	0	111.3	Y518 G531 L532 L533	Y518-D529 VanDerWaalsContact CD2-C 3.45Å; D529-G531 VanDerWaalsContact C-N 3.28Å; D529-G531 PolarHBondContact O-N 3.19Å; D529-G531 PolarHBondContact OD2-N 3.47Å; D529-L532 PolarHBondContact O-N 2.87Å; D529-L533 PolarHBondContact O-N 2.74Å
530	L	63.3	Low	65.7	Low	75 Å²	75	81.8 Å²	81.8	39%	0.393	41%	0.412	S	S	.	.	H	α-helix	trans	-65.4	-31.7	-179.7	-174.1	65.7	0	0	0	111.6	Y518 L533 Q534	Y518-L530 HydrophobicContact CD1-CB 4.21Å; Y518-L530 HydrophobicContact CD1-CD1 3.74Å; Y518-L530 HydrophobicContact CD2-CB 4.46Å; Y518-L530 HydrophobicContact CE1-CB 3.94Å; Y518-L530 HydrophobicContact CE1-CD1 3.88Å; Y518-L530 HydrophobicContact CE1-CG 4.38Å; Y518-L530 HydrophobicContact CE2-CB 4.19Å; Y518-L530 HydrophobicContact CG-CB 4.46Å; Y518-L530 HydrophobicContact CG-CD1 4.46Å; L530-L533 HydrophobicContact CD1-CD2 4.31Å; L530-L533 PolarHBondContact O-N 3.12Å; L530-Q534 WeakPolarHBondContact O-CB 3.42Å; L530-Q534 VanDerWaalsContact O-CG 3.32Å; L530-Q534 WeakPolarHBondContact O-CG 3.31Å; L530-Q534 PolarHBondContact O-N 3.38Å
531	G	68.6	Low	65.3	Low	26 Å²	26	85.5 Å²	85.5	27%	0.268	44%	0.435	S	S	.	.	H	α-helix	trans	-64.1	-42.3	177.3	0	0	0	0	0	112.8	D529 Q534 E535	D529-G531 VanDerWaalsContact C-N 3.28Å; D529-G531 PolarHBondContact O-N 3.19Å; D529-G531 PolarHBondContact OD2-N 3.47Å; G531-Q534 WeakPolarHBondContact O-CB 3.31Å; G531-Q534 PolarHBondContact O-N 3.09Å; G531-Q534 VanDerWaalsContact O-N 3.16Å; G531-E535 PolarHBondContact O-N 3.23Å
532	L	69.6	Low	65.2	Low	85 Å²	85	81.5 Å²	81.5	45%	0.445	43%	0.428	S	S	.	.	H	α-helix	trans	-68.1	-35.1	175.5	-67.2	174.1	0	0	0	112.3	F527 D529 Q534 H536	F527-L532 HydrophobicContact CB-CB 4.38Å; F527-L532 HydrophobicContact CD1-CB 4.03Å; D529-L532 PolarHBondContact O-N 2.87Å; L532-Q534 VanDerWaalsContact C-N 3.34Å; L532-H536 VanDerWaalsContact O-CB 3.26Å; L532-H536 WeakPolarHBondContact O-CB 3.32Å; L532-H536 PolarHBondContact O-N 3.27Å
533	L	70.9	Confident	64.7	Low	27 Å²	27	82.4 Å²	82.4	14%	0.141	44%	0.44	C	S	.	.	H	α-helix	trans	-65.8	-39	171.1	173.5	61.6	0	0	0	111.1	C520 F527 D529 L530 H536 S537	C520-L533 VanDerWaalsContact CA-CD1 3.47Å; C520-L533 HydrophobicContact CB-CD1 3.59Å; F527-L533 HydrophobicContact CB-CB 4.13Å; F527-L533 HydrophobicContact CD2-CB 4.1Å; F527-L533 HydrophobicContact CD2-CD1 3.74Å; F527-L533 HydrophobicContact CE2-CD1 4Å; F527-L533 HydrophobicContact CG-CB 4.16Å; D529-L533 PolarHBondContact O-N 2.74Å; L530-L533 HydrophobicContact CD1-CD2 4.31Å; L530-L533 PolarHBondContact O-N 3.12Å; L533-H536 PolarHBondContact O-N 3.36Å; L533-S537 VanDerWaalsContact O-CB 3.25Å; L533-S537 WeakPolarHBondContact O-CB 3.41Å; L533-S537 PolarHBondContact O-N 3.25Å; L533-S537 PolarHBondContact O-OG 3.05Å
534	Q	64.9	Low	63.2	Low	112 Å²	112	82.2 Å²	82.2	52%	0.523	45%	0.447	S	S	.	.	H	α-helix	trans	-65.4	-49.3	178.2	-77.5	173.5	-18.2	0	0	111.2	L530 G531 L532 H536 S537 V538	L530-Q534 WeakPolarHBondContact O-CB 3.42Å; L530-Q534 VanDerWaalsContact O-CG 3.32Å; L530-Q534 WeakPolarHBondContact O-CG 3.31Å; L530-Q534 PolarHBondContact O-N 3.38Å; G531-Q534 WeakPolarHBondContact O-CB 3.31Å; G531-Q534 PolarHBondContact O-N 3.09Å; G531-Q534 VanDerWaalsContact O-N 3.16Å; L532-Q534 VanDerWaalsContact C-N 3.34Å; Q534-H536 VanDerWaalsContact C-N 3.32Å; Q534-H536 PolarHBondContact O-N 3.22Å; Q534-S537 WeakPolarHBondContact CA-OG 3.21Å; Q534-S537 PolarHBondContact O-N 3.07Å; Q534-S537 VanDerWaalsContact O-N 3.11Å; Q534-S537 PolarHBondContact O-OG 3.14Å; Q534-V538 WeakPolarHBondContact O-CG2 3.23Å; Q534-V538 PolarHBondContact O-N 2.99Å
535	E	71.7	Confident	62.2	Low	137 Å²	137	84.8 Å²	84.8	64%	0.64	47%	0.466	S	S	*	.	H	α-helix	trans	-57.6	-43.6	174.3	-73.9	178.1	-178.2	0	0	112.3	G531 V538	G531-E535 PolarHBondContact O-N 3.23Å; E535-V538 WeakPolarHBondContact O-CB 3.36Å; E535-V538 PolarHBondContact O-N 3.26Å
536	H	71.6	Confident	61.2	Low	30 Å²	30	89.9 Å²	89.9	14%	0.139	48%	0.481	C	S	.	.	H	α-helix	trans	-67.3	-36.5	175.6	177	74.1	0	0	0	112.6	C523 F527 L532 L533 Q534 V538 Q539 H540	C523-H536 PolarHBondContact SG-NE2 2.77Å; F527-H536 HydrophobicContact CE1-CB 3.72Å; F527-H536 AromaticContact CE1-CG 3.84Å; F527-H536 HydrophobicContact CE2-CB 4.27Å; F527-H536 AromaticContact CE2-CD2 3.58Å; F527-H536 AromaticContact CE2-CG 3.93Å; F527-H536 HydrophobicContact CZ-CB 3.57Å; F527-H536 AromaticContact CZ-CD2 3.31Å; F527-H536 WeakPolarHBondContact CZ-CD2 3.44Å; F527-H536 AromaticContact CZ-CG 3.22Å; F527-H536 AromaticContact CZ-ND1 3.75Å; F527-H536 AromaticContact CZ-NE2 3.87Å; L532-H536 VanDerWaalsContact O-CB 3.26Å; L532-H536 WeakPolarHBondContact O-CB 3.32Å; L532-H536 PolarHBondContact O-N 3.27Å; L533-H536 PolarHBondContact O-N 3.36Å; Q534-H536 VanDerWaalsContact C-N 3.32Å; Q534-H536 PolarHBondContact O-N 3.22Å; H536-V538 PolarHBondContact O-N 3.36Å; H536-Q539 PolarHBondContact ND1-OE1 3.43Å; H536-Q539 WeakPolarHBondContact O-CB 3.46Å; H536-Q539 PolarHBondContact O-N 2.76Å; H536-Q539 VanDerWaalsContact O-N 3.16Å; H536-H540 AromaticContact CD2-NE2 3.82Å; H536-H540 AromaticContact CE1-NE2 3.7Å; H536-H540 AromaticContact NE2-CD2 3.82Å; H536-H540 AromaticContact NE2-NE2 3.1Å; H536-H540 PolarHBondContact NE2-NE2 3.15Å
537	S	62.5	Low	59.9	Low	25 Å²	25	92.6 Å²	92.6	18%	0.175	50%	0.5	C	S	.	.	H	α-helix	trans	-65.3	-27.6	176.7	71.1	0	0	0	0	112.6	L533 Q534 Q539 H540 T541	L533-S537 VanDerWaalsContact O-CB 3.25Å; L533-S537 WeakPolarHBondContact O-CB 3.41Å; L533-S537 PolarHBondContact O-N 3.25Å; L533-S537 PolarHBondContact O-OG 3.05Å; Q534-S537 WeakPolarHBondContact CA-OG 3.21Å; Q534-S537 PolarHBondContact O-N 3.07Å; Q534-S537 VanDerWaalsContact O-N 3.11Å; Q534-S537 PolarHBondContact O-OG 3.14Å; S537-Q539 PolarHBondContact O-N 3.38Å; S537-H540 WeakPolarHBondContact O-CB 3.47Å; S537-H540 PolarHBondContact O-N 3.18Å; S537-T541 PolarHBondContact O-N 3.14Å
538	V	70.8	Confident	58.6	Low	87 Å²	87	98.1 Å²	98.1	53%	0.527	54%	0.536	S	S	.	.	H	α-helix	trans	-62.3	-30.7	175.7	176.2	0	0	0	0	111.4	Q534 E535 H536 H540 T541 A542	Q534-V538 WeakPolarHBondContact O-CG2 3.23Å; Q534-V538 PolarHBondContact O-N 2.99Å; E535-V538 WeakPolarHBondContact O-CB 3.36Å; E535-V538 PolarHBondContact O-N 3.26Å; H536-V538 PolarHBondContact O-N 3.36Å; V538-H540 VanDerWaalsContact C-N 3.27Å; V538-H540 PolarHBondContact O-N 2.98Å; V538-T541 VanDerWaalsContact CA-OG1 3.27Å; V538-T541 WeakPolarHBondContact CA-OG1 3.37Å; V538-T541 PolarHBondContact O-N 3.05Å; V538-T541 PolarHBondContact O-OG1 3.41Å; V538-T541 VanDerWaalsContact O-OG1 3.14Å; V538-A542 WeakPolarHBondContact O-CB 3.46Å; V538-A542 PolarHBondContact O-N 3.49Å
539	Q	66.9	Low	57.4	Low	135 Å²	135	96.8 Å²	96.8	63%	0.631	54%	0.543	S	S	*	.	H	α-helix	trans	-66	-29.3	174.4	-59.7	-178.7	-30.1	0	0	112.6	H536 S537	H536-Q539 PolarHBondContact ND1-OE1 3.43Å; H536-Q539 WeakPolarHBondContact O-CB 3.46Å; H536-Q539 PolarHBondContact O-N 2.76Å; H536-Q539 VanDerWaalsContact O-N 3.16Å; S537-Q539 PolarHBondContact O-N 3.38Å
540	H	65.3	Low	56.1	Low	63 Å²	63	96.8 Å²	96.8	29%	0.292	56%	0.555	S	S	.	*	H	α-helix	trans	-81.8	-27.3	173.1	-62.4	-76.4	0	0	0	112.2	W522 H536 S537 V538	W522-H540 HydrophobicContact CB-CB 4.28Å; W522-H540 HydrophobicContact CD2-CB 4.04Å; W522-H540 HydrophobicContact CE3-CB 4.17Å; W522-H540 HydrophobicContact CG-CB 4.09Å; H536-H540 AromaticContact CD2-NE2 3.82Å; H536-H540 AromaticContact CE1-NE2 3.7Å; H536-H540 AromaticContact NE2-CD2 3.82Å; H536-H540 AromaticContact NE2-NE2 3.1Å; H536-H540 PolarHBondContact NE2-NE2 3.15Å; S537-H540 WeakPolarHBondContact O-CB 3.47Å; S537-H540 PolarHBondContact O-N 3.18Å; V538-H540 VanDerWaalsContact C-N 3.27Å; V538-H540 PolarHBondContact O-N 2.98Å
541	T	60.2	Low	54.4	Low	78 Å²	78	99.7 Å²	99.7	48%	0.479	58%	0.58	S	S	.	*	H	α-helix	trans	-90.3	-14.8	179.3	60.9	0	0	0	0	114.5	S537 V538 E543 G544	S537-T541 PolarHBondContact O-N 3.14Å; V538-T541 VanDerWaalsContact CA-OG1 3.27Å; V538-T541 WeakPolarHBondContact CA-OG1 3.37Å; V538-T541 PolarHBondContact O-N 3.05Å; V538-T541 PolarHBondContact O-OG1 3.41Å; V538-T541 VanDerWaalsContact O-OG1 3.14Å; T541-E543 PolarHBondContact O-N 3.35Å; T541-G544 PolarHBondContact O-N 3.44Å
542	A	56.3	Low	52.6	Low	83 Å²	83	106.5 Å²	106.5	69%	0.686	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-21.1	173	0	0	0	0	0	112	V538	V538-A542 WeakPolarHBondContact O-CB 3.46Å; V538-A542 PolarHBondContact O-N 3.49Å
543	E	50.6	Low	51.4	Low	179 Å²	179	111.8 Å²	111.8	84%	0.836	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	63.5	170.2	-66	-175.1	169.3	0	0	111.1	T541	T541-E543 PolarHBondContact O-N 3.35Å
544	G	40.8	Very low	50.4	Low	56 Å²	56	116.1 Å²	116.1	58%	0.577	68%	0.675	S	S	*	*			trans	105.5	108.9	154.2	0	0	0	0	0	118.6	T541	T541-G544 PolarHBondContact O-N 3.44Å
545	A	40.5	Very low	49.6	Very low	85 Å²	85	116.3 Å²	116.3	70%	0.702	68%	0.683	S	S	*	*			trans	54.4	111	131.9	0	0	0	0	0	121.6
546	Y	42.4	Very low	48.4	Very low	224 Å²	224	115.1 Å²	115.1	88%	0.878	69%	0.685	S	S	*	*			trans	49.4	107.8	144.5	-57.6	-83.4	0	0	0	120.7
547	Q	37.9	Very low	47	Very low	193 Å²	193	120.1 Å²	120.1	90%	0.902	72%	0.717	S	S	*	*				165.4	121.6	104.8	-91.9	-174.6	-3.4	0	0	110.3
548	V	37.8	Very low	46	Very low	146 Å²	146	126.1 Å²	126.1	89%	0.885	75%	0.751	S	S	*	*			trans	-79.3	116.6	167.5	-179	0	0	0	0	107.7
549	A	30.4	Very low	44.4	Very low	99 Å²	99	128.7 Å²	128.7	82%	0.818	77%	0.766	S	S	*	*			trans	-122.2	102.2	156.6	0	0	0	0	0	107.5
550	A	35.3	Very low	42.8	Very low	88 Å²	88	128.2 Å²	128.2	73%	0.727	78%	0.776	S	S	*	*			trans	-65.5	131.5	176	0	0	0	0	0	110.6
551	C	27.9	Very low	41.1	Very low	135 Å²	135	133.2 Å²	133.2	91%	0.912	81%	0.813	S	S	*	*			trans	-143.8	104.2	150.9	-86.7	0	0	0	0	107.7
552	L	30.4	Very low	39.5	Very low	169 Å²	169	137.8 Å²	137.8	89%	0.885	84%	0.841	S	S	*	*			trans	-117.5	160.5	160.4	-84.8	167.1	0	0	0	106.6
553	P	43.3	Very low	37.9	Very low	197 Å²	197	142.8 Å²	142.8	100%	1.279	86%	0.855	S	S	*	*				-96	0	-55.5	8.9	12	0	0	0	112.8

Retrieved 553 of 553 residues in 179.6 ms (Link to these results)

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