RANB3_MOUSE Loading...

Ran-binding protein 3

Acts as a cofactor for XPO1/CRM1-mediated nuclear export, perhaps as export complex scaffolding protein. Bound to XPO1/CRM1, stabilizes the XPO1/CRM1-cargo interaction. In the absence of Ran-bound GTP prevents binding of XPO1/CRM1 to the nuclear pore complex. Binds to CHC1/RCC1 and increases the guanine nucleotide exchange activity of CHC1/RCC1. Recruits XPO1/CRM1 to CHC1/RCC1 in a Ran-dependent manner. Negative regulator of TGF-beta signaling through interaction with the R-SMAD proteins, SMAD2 and SMAD3, and mediating their nuclear export.

AlphaFold DB , UniProt , Accession Q9CT10, Species MOUSE (Mus musculus, Mouse), Gene Ranbp3, Length 491 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.4	Very low	49.8	Very low	245 Å²	245	153.4 Å²	153.4	100%	1.207	86%	0.859	S	S	*	*				0	99.3	0	-152.7	158.6	-171.9	0	0	105.2
2	A	44	Very low	50.2	Low	92 Å²	92	152.5 Å²	152.5	76%	0.76	86%	0.86	S	S	*	*			trans	-142.6	96.4	-169.1	0	0	0	0	0	107.7	L4	A2-L4 PolarHBondContact O-N 3.22Å
3	D	45.2	Very low	50.5	Low	164 Å²	164	147 Å²	147	88%	0.877	85%	0.845	S	S	*	*			trans	-80.1	113	169.6	-76.7	-51.3	0	0	0	108.3	A5	D3-A5 PolarHBondContact O-N 3.24Å
4	L	52.8	Low	50.5	Low	169 Å²	169	144.4 Å²	144.4	89%	0.885	84%	0.836	S	S	*	*			trans	-82.5	104.9	170.1	-76.1	166.7	0	0	0	108.1	A2 N6	A2-L4 PolarHBondContact O-N 3.22Å; L4-N6 PolarHBondContact O-N 3.16Å
5	A	54.6	Low	51.3	Low	101 Å²	101	140.8 Å²	140.8	84%	0.835	82%	0.822	S	S	*	*			trans	-64.5	119.1	173	0	0	0	0	0	109.9	D3 E7	D3-A5 PolarHBondContact O-N 3.24Å; A5-E7 PolarHBondContact O-N 2.93Å
6	N	47.7	Very low	52.1	Low	160 Å²	160	138.8 Å²	138.8	86%	0.856	81%	0.812	S	S	*	*			trans	-88.5	96.4	178.8	-160.3	35	0	0	0	108.6	L4 E8	L4-N6 PolarHBondContact O-N 3.16Å; N6-E8 PolarHBondContact O-N 2.56Å
7	E	51.2	Low	52.6	Low	185 Å²	185	138 Å²	138	86%	0.864	80%	0.797	S	S	*	*			trans	-82	102.8	-179.6	-158.6	-171.3	135.8	0	0	110.7	A5 K9	A5-E7 PolarHBondContact O-N 2.93Å; E7-K9 PolarHBondContact O-N 3.17Å
8	E	50.7	Low	53.5	Low	179 Å²	179	137.1 Å²	137.1	84%	0.836	79%	0.793	S	S	*	*			trans	-75.1	106.9	178.8	-170.2	-179	127.2	0	0	111	N6	N6-E8 PolarHBondContact O-N 2.56Å
9	K	54.5	Low	53.8	Low	183 Å²	183	139.8 Å²	139.8	80%	0.796	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-73.1	120.5	178.4	-170	176.5	-173.5	174.6	0	110.6	E7 A11	E7-K9 PolarHBondContact O-N 3.17Å; K9-A11 PolarHBondContact O-N 3.5Å
10	P	50.7	Low	54.3	Low	110 Å²	110	141.4 Å²	141.4	71%	0.714	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-68.5	124.4	-175.7	26.3	-33.9	0	0	0	111.6	V12	P10-V12 PolarHBondContact O-N 3.31Å
11	A	47.3	Very low	55	Low	99 Å²	99	143.5 Å²	143.5	82%	0.818	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-71	118.5	177.5	0	0	0	0	0	111.1	K9 A13	K9-A11 PolarHBondContact O-N 3.5Å; A11-A13 PolarHBondContact O-N 2.81Å; A11-A13 VanDerWaalsContact O-N 3.14Å
12	V	54.3	Low	55.6	Low	143 Å²	143	138.8 Å²	138.8	87%	0.867	78%	0.776	S	S	*	*			trans	-73.5	105.3	177.7	-179.6	0	0	0	0	109.7	P10	P10-V12 PolarHBondContact O-N 3.31Å
13	A	54.1	Low	56.2	Low	81 Å²	81	143.3 Å²	143.3	67%	0.669	78%	0.778	S	S	*	*			trans	-65.7	142.4	176.8	0	0	0	0	0	112.1	A11	A11-A13 PolarHBondContact O-N 2.81Å; A11-A13 VanDerWaalsContact O-N 3.14Å
14	P	50.8	Low	56.1	Low	111 Å²	111	139.2 Å²	139.2	72%	0.721	78%	0.775	S	S	*	*			trans	-67.6	145.7	178.1	28	-34.5	0	0	0	111.9	V16	P14-V16 PolarHBondContact O-N 2.78Å
15	S	62	Low	55.9	Low	90 Å²	90	139.9 Å²	139.9	63%	0.629	77%	0.774	S	S	*	*			trans	-64.6	114.8	179.1	179.4	0	0	0	0	111.8
16	V	63.5	Low	55.5	Low	108 Å²	108	145 Å²	145	66%	0.655	78%	0.777	S	S	*	*			trans	-93.6	116.6	172.8	179.9	0	0	0	0	109.6	P14 V18	P14-V16 PolarHBondContact O-N 2.78Å; V16-V18 HydrophobicContact CG1-CG2 4.34Å; V16-V18 PolarHBondContact O-N 3.5Å
17	F	61.4	Low	55.4	Low	126 Å²	126	148.7 Å²	148.7	55%	0.553	78%	0.779	S	S	*	*			trans	-79.3	108	173.4	-100.1	-90.9	0	0	0	111.2	F19 S374	F17-F19 HydrophobicContact CD1-CE2 4.38Å; F17-S374 VanDerWaalsContact CZ-CA 3.47Å
18	V	68	Low	55.2	Low	122 Å²	122	145.5 Å²	145.5	74%	0.739	78%	0.777	S	S	*	*			trans	-94.6	106	170.1	-175.6	0	0	0	0	109.7	V16 Q20	V16-V18 HydrophobicContact CG1-CG2 4.34Å; V16-V18 PolarHBondContact O-N 3.5Å; V18-Q20 PolarHBondContact O-N 3.16Å; V18-Q20 VanDerWaalsContact O-N 3.1Å
19	F	59.6	Low	54.9	Low	188 Å²	188	141.8 Å²	141.8	83%	0.825	78%	0.777	S	S	*	*			trans	-75.9	93.9	171.3	-90.8	-89.5	0	0	0	110.7	F17 K21	F17-F19 HydrophobicContact CD1-CE2 4.38Å; F19-K21 PolarHBondContact O-N 3.07Å
20	Q	64.1	Low	54.5	Low	171 Å²	171	136.8 Å²	136.8	80%	0.799	78%	0.778	S	S	*	*			trans	-74.1	105.8	173.4	-165.4	153.9	26.9	0	0	110.2	V18 D22	V18-Q20 PolarHBondContact O-N 3.16Å; V18-Q20 VanDerWaalsContact O-N 3.1Å; Q20-D22 PolarHBondContact O-N 3.16Å
21	K	68.2	Low	54.3	Low	186 Å²	186	137.2 Å²	137.2	81%	0.809	78%	0.783	S	S	*	*			trans	-86.6	94	176	-178.5	175.8	-180	171	0	109.9	F19 K23	F19-K21 PolarHBondContact O-N 3.07Å; K21-K23 PolarHBondContact O-N 3.1Å; K21-K23 VanDerWaalsContact O-N 3.12Å
22	D	63.5	Low	54.4	Low	146 Å²	146	138.7 Å²	138.7	78%	0.781	79%	0.788	S	S	*	*			trans	-59	115.9	172.1	-83.1	-38.2	0	0	0	111.2	Q20	Q20-D22 PolarHBondContact O-N 3.16Å
23	K	55	Low	54.4	Low	187 Å²	187	137.1 Å²	137.1	81%	0.813	78%	0.783	S	S	*	*			trans	-86.9	106.1	164	-78.2	-176.5	177.1	175.5	0	107.6	K21 Q25	K21-K23 PolarHBondContact O-N 3.1Å; K21-K23 VanDerWaalsContact O-N 3.12Å; K23-Q25 PolarHBondContact O-N 3.49Å; K23-Q25 VanDerWaalsContact O-N 3.07Å
24	G	44.1	Very low	54.5	Low	79 Å²	79	138.6 Å²	138.6	81%	0.814	79%	0.785	S	S	*	*			trans	-51.3	114	-178.5	0	0	0	0	0	113	K26	G24-K26 PolarHBondContact O-N 3.01Å
25	Q	47.6	Very low	54.7	Low	183 Å²	183	142 Å²	142	86%	0.855	79%	0.792	S	S	*	*			trans	-84.1	109.8	-178.3	-164.5	166.8	-6.3	0	0	110.2	K23 R27	K23-Q25 PolarHBondContact O-N 3.49Å; K23-Q25 VanDerWaalsContact O-N 3.07Å; Q25-R27 PolarHBondContact O-N 3.49Å
26	K	48	Very low	54.3	Low	209 Å²	209	142 Å²	142	91%	0.909	80%	0.798	S	S	*	*			trans	-70.9	95.6	-177.2	-165.1	-177.6	-171.9	-174.9	0	110.1	G24	G24-K26 PolarHBondContact O-N 3.01Å
27	R	43.9	Very low	54	Low	237 Å²	237	140.4 Å²	140.4	89%	0.894	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-74.6	126.6	173.3	-73.7	-166.7	-77.5	-177.4	-3.7	110.5	Q25	Q25-R27 PolarHBondContact O-N 3.49Å
28	S	48.7	Very low	53.8	Low	117 Å²	117	143.1 Å²	143.1	82%	0.818	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-77.8	149	171.5	-173.1	0	0	0	0	110.4
29	A	43.9	Very low	53.2	Low	101 Å²	101	144.4 Å²	144.4	84%	0.835	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-69.3	146.7	166.8	0	0	0	0	0	110.7
30	G	45.2	Very low	53.1	Low	79 Å²	79	140.6 Å²	140.6	81%	0.814	82%	0.816	S	S	*	*			trans	-170.1	113.6	175.2	0	0	0	0	0	108.6
31	S	46.7	Very low	52.6	Low	119 Å²	119	140 Å²	140	83%	0.832	82%	0.819	S	S	*	*			trans	-104.1	130.3	-166.6	52.2	0	0	0	0	113.2
32	S	48.8	Very low	52.1	Low	130 Å²	130	139.4 Å²	139.4	91%	0.909	82%	0.819	S	S	*	*			trans	-165.1	161.3	145.7	50.9	0	0	0	0	110.6
33	S	55	Low	51.7	Low	110 Å²	110	140.9 Å²	140.9	77%	0.769	82%	0.821	S	S	*	*			trans	-162.9	176.6	-163.7	-166.2	0	0	0	0	107.1
34	P	56.7	Low	51.7	Low	111 Å²	111	139.2 Å²	139.2	72%	0.721	82%	0.821	S	S	*	*			cis	-120.3	-173.5	-45.5	30.4	-11.6	0	0	0	111.3
35	E	55.7	Low	52.1	Low	182 Å²	182	138.2 Å²	138.2	85%	0.85	81%	0.81	S	S	*	*			trans	-161.8	114	146.2	-89.1	-80.8	91.7	0	0	103.8
36	A	53.3	Low	52.5	Low	92 Å²	92	137.8 Å²	137.8	76%	0.76	81%	0.814	S	S	*	*				75.8	116.7	82.1	0	0	0	0	0	113.3
37	G	55.8	Low	52.3	Low	73 Å²	73	137.5 Å²	137.5	75%	0.753	81%	0.808	S	S	*	*			trans	167.6	99.2	179.6	0	0	0	0	0	112.5
38	E	58.3	Low	52.7	Low	184 Å²	184	132.2 Å²	132.2	86%	0.86	81%	0.806	S	S	*	*			trans	-70.6	175.6	168.3	-49.3	116.3	133.8	0	0	110.1
39	D	55.4	Low	53.1	Low	148 Å²	148	130 Å²	130	79%	0.791	79%	0.789	S	S	*	*			cis	-162.9	170.9	8	-153.4	-9.9	0	0	0	109.2
40	S	56.5	Low	53.3	Low	108 Å²	108	130.5 Å²	130.5	76%	0.755	78%	0.784	S	S	*	*			trans	111.1	101.9	153	-44.5	0	0	0	0	117.8
41	D	54.1	Low	53.8	Low	160 Å²	160	133 Å²	133	86%	0.856	78%	0.783	S	S	*	*			trans	-81.6	150.6	165.1	-66	-56.1	0	0	0	112.5
42	H	58.2	Low	53.9	Low	173 Å²	173	136.6 Å²	136.6	80%	0.801	78%	0.784	S	S	*	*			trans	-144.3	107.2	149.2	-165	-23.2	0	0	0	109.1	D44	H42-D44 IonicContact CE1-OD2 3.95Å
43	E	54.7	Low	54.3	Low	177 Å²	177	141.5 Å²	141.5	83%	0.827	78%	0.782	S	S	*	*			trans	-90.1	140.6	168.7	-69.2	-132.2	123.7	0	0	110.6
44	D	56.1	Low	53.8	Low	152 Å²	152	145.5 Å²	145.5	81%	0.813	79%	0.789	S	S	*	*			trans	-154.8	131.9	148.8	-93.2	-44.9	0	0	0	104.6	H42	H42-D44 IonicContact CE1-OD2 3.95Å
45	G	52.5	Low	53.3	Low	57 Å²	57	151.8 Å²	151.8	59%	0.588	80%	0.798	S	S	*	*			cis	132.8	76.9	14.5	0	0	0	0	0	109.3
46	N	54.9	Low	52.6	Low	175 Å²	175	149.5 Å²	149.5	94%	0.936	80%	0.797	S	S	*	*			trans	165.5	105.8	141.1	-84.6	-14.4	0	0	0	113.6
47	Y	44.7	Very low	52.1	Low	202 Å²	202	151 Å²	151	79%	0.792	80%	0.801	S	S	*	*			trans	-100.2	137.8	163.8	167.6	-112	0	0	0	109.1	P49	Y47-P49 HydrophobicContact CD1-CG 4.14Å; Y47-P49 HydrophobicContact CE1-CB 4.2Å; Y47-P49 HydrophobicContact CE1-CG 3.44Å; Y47-P49 VanDerWaalsContact CE1-CG 3.44Å
48	C	50.9	Low	51.4	Low	126 Å²	126	153.2 Å²	153.2	85%	0.851	81%	0.806	S	S	*	*			trans	-136.7	108.3	179.9	-172.4	0	0	0	0	112.1
49	P	56.8	Low	50.5	Low	70 Å²	70	151.9 Å²	151.9	46%	0.455	80%	0.804	S	S	.	*			trans	-121	-173.6	167.4	44.9	-37	0	0	0	111.2	Y47	Y47-P49 HydrophobicContact CD1-CG 4.14Å; Y47-P49 HydrophobicContact CE1-CB 4.2Å; Y47-P49 HydrophobicContact CE1-CG 3.44Å; Y47-P49 VanDerWaalsContact CE1-CG 3.44Å
50	P	49.5	Very low	49.8	Very low	112 Å²	112	150.4 Å²	150.4	73%	0.727	80%	0.8	S	S	*	*				-124.8	176.3	-53.2	36.1	-22	0	0	0	110.1
51	V	55.8	Low	48.8	Very low	131 Å²	131	153.8 Å²	153.8	79%	0.794	80%	0.804	S	S	*	*			trans	-128	114.6	165	-165.2	0	0	0	0	110.8
52	K	49.1	Very low	48.1	Very low	195 Å²	195	151.4 Å²	151.4	85%	0.848	80%	0.799	S	S	*	*			trans	-72.4	134.6	167.2	-65.9	175.4	178.6	176.2	0	109
53	R	57.1	Low	47.2	Very low	233 Å²	233	150.7 Å²	150.7	88%	0.879	80%	0.796	S	S	*	*			trans	-139.3	117.7	157.5	-114.2	-176.6	-179.8	100.9	-0.3	109.8
54	E	42.9	Very low	46.7	Very low	194 Å²	194	150.9 Å²	150.9	91%	0.907	80%	0.798	S	S	*	*			trans	-75.6	140.6	168.6	-58	-179.8	128	0	0	109.3
55	R	48	Very low	46	Very low	243 Å²	243	152.7 Å²	152.7	92%	0.917	80%	0.798	S	S	*	*			trans	-150.6	128.3	143.5	-159.4	170.4	-177	120.3	-1.6	110.5
56	T	40.3	Very low	46	Very low	134 Å²	134	155.5 Å²	155.5	82%	0.822	81%	0.808	S	S	*	*			trans	-76.8	137.9	174.9	44.1	0	0	0	0	111.3
57	S	43.4	Very low	46.1	Very low	123 Å²	123	151.8 Å²	151.8	86%	0.86	80%	0.796	S	S	*	*			trans	-156.1	112.7	150	49.8	0	0	0	0	110.5
58	S	41.2	Very low	46.7	Very low	120 Å²	120	145.6 Å²	145.6	84%	0.839	79%	0.794	S	S	*	*			trans	-79	133.8	173.1	50.4	0	0	0	0	110.9
59	L	38.9	Very low	47.1	Very low	156 Å²	156	148.3 Å²	148.3	82%	0.817	79%	0.792	S	S	*	*			trans	-146	114.5	159.9	-158.9	63.9	0	0	0	112
60	T	40.1	Very low	47.5	Very low	118 Å²	118	156.3 Å²	156.3	72%	0.724	81%	0.813	S	S	*	*			trans	33.5	116.1	157.8	59.2	0	0	0	0	120
61	H	35.7	Very low	48	Very low	179 Å²	179	158.1 Å²	158.1	83%	0.829	82%	0.816	S	S	*	*			trans	-65.2	134.4	156.7	-73.9	-125.5	0	0	0	111.1
62	S	39.1	Very low	48.5	Very low	109 Å²	109	160.9 Å²	160.9	76%	0.762	82%	0.817	S	S	*	*			trans	-123.6	114.6	155	48.5	0	0	0	0	108.6	E64	S62-E64 PolarHBondContact O-N 3.08Å
63	E	38.7	Very low	49.2	Very low	158 Å²	158	156.8 Å²	156.8	74%	0.738	81%	0.81	S	S	*	*			trans	-86.5	88.5	-174.7	-60.2	-160.6	161.6	0	0	112
64	E	44.6	Very low	49.7	Very low	182 Å²	182	151.8 Å²	151.8	85%	0.85	81%	0.808	S	S	*	*			trans	-92.8	107.5	166.3	-75.2	-162.2	116.4	0	0	111.8	S62 S66	S62-E64 PolarHBondContact O-N 3.08Å; E64-S66 VanDerWaalsContact C-N 3.34Å; E64-S66 PolarHBondContact O-N 2.71Å
65	K	41.8	Very low	50.8	Low	190 Å²	190	148.3 Å²	148.3	83%	0.826	80%	0.8	S	S	*	*			trans	-70	85.1	172.9	-76.3	163	176.8	154.6	0	110.7	S67	K65-S67 PolarHBondContact O-N 3.33Å; K65-S67 VanDerWaalsContact O-N 3.08Å
66	S	53.5	Low	51.3	Low	115 Å²	115	144.4 Å²	144.4	80%	0.804	80%	0.797	S	S	*	*			trans	-70.1	100.4	165.6	51	0	0	0	0	110.1	E64 G68	E64-S66 VanDerWaalsContact C-N 3.34Å; E64-S66 PolarHBondContact O-N 2.71Å; S66-G68 VanDerWaalsContact C-N 3.31Å; S66-G68 PolarHBondContact O-N 3.22Å
67	S	56.1	Low	52.4	Low	97 Å²	97	145 Å²	145	68%	0.678	79%	0.793	S	S	*	*			trans	-72.7	83.7	175.6	51.8	0	0	0	0	110.7	K65 F69	K65-S67 PolarHBondContact O-N 3.33Å; K65-S67 VanDerWaalsContact O-N 3.08Å; S67-F69 PolarHBondContact O-N 3.06Å
68	G	56.4	Low	53.2	Low	73 Å²	73	147.3 Å²	147.3	75%	0.753	79%	0.79	S	S	*	*			trans	-63.4	91.2	177.1	0	0	0	0	0	112.8	S66 R70	S66-G68 VanDerWaalsContact C-N 3.31Å; S66-G68 PolarHBondContact O-N 3.22Å; G68-R70 VanDerWaalsContact C-N 3.28Å; G68-R70 PolarHBondContact O-N 3.04Å
69	F	60.8	Low	53.5	Low	183 Å²	183	145.2 Å²	145.2	80%	0.803	79%	0.788	S	S	*	*			trans	-67.4	83.8	170.2	-92.2	-90	0	0	0	110.8	S67 L71	S67-F69 PolarHBondContact O-N 3.06Å; F69-L71 VanDerWaalsContact C-N 3.31Å; F69-L71 PolarHBondContact O-N 3.34Å
70	R	64.2	Low	54.1	Low	237 Å²	237	146.7 Å²	146.7	89%	0.894	79%	0.791	S	S	*	*			trans	-75.2	85.4	169.2	-168.3	174.6	-170.5	160	3.3	109.4	G68 K72	G68-R70 VanDerWaalsContact C-N 3.28Å; G68-R70 PolarHBondContact O-N 3.04Å; R70-K72 PolarHBondContact O-N 3.12Å; R70-K72 VanDerWaalsContact O-N 3.17Å
71	L	60.2	Low	54.4	Low	150 Å²	150	145.3 Å²	145.3	79%	0.785	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-55.2	120.7	168.9	-66.4	177	0	0	0	108.9	F69	F69-L71 VanDerWaalsContact C-N 3.31Å; F69-L71 PolarHBondContact O-N 3.34Å
72	K	66.7	Low	55.3	Low	189 Å²	189	142.8 Å²	142.8	82%	0.822	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-66.1	138.3	167.6	-70.5	177.9	179	174.5	0	107.6	R70	R70-K72 PolarHBondContact O-N 3.12Å; R70-K72 VanDerWaalsContact O-N 3.17Å
73	P	64.6	Low	56.1	Low	109 Å²	109	143.3 Å²	143.3	71%	0.708	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-57.6	137.6	173.2	25.9	-33.7	0	0	0	108.9	T75	P73-T75 PolarHBondContact O-N 3.09Å
74	P	67.5	Low	56.8	Low	129 Å²	129	140.8 Å²	140.8	84%	0.838	80%	0.8	S	S	*	*			trans	-63.1	109.2	-178.8	24.8	-33	0	0	0	109.6	L76	P74-L76 PolarHBondContact O-N 3.08Å
75	T	65.1	Low	56.8	Low	120 Å²	120	135.7 Å²	135.7	74%	0.736	80%	0.797	S	S	*	*			trans	-63.1	122.2	166.6	39.6	0	0	0	0	108.3	P73 I77	P73-T75 PolarHBondContact O-N 3.09Å; T75-I77 VanDerWaalsContact C-N 3.33Å; T75-I77 PolarHBondContact O-N 2.88Å
76	L	59.2	Low	57.3	Low	162 Å²	162	134.8 Å²	134.8	85%	0.848	80%	0.8	S	S	*	*			trans	-70.7	88.5	177.9	-165.6	129.9	0	0	0	109.3	P74 H78	P74-L76 PolarHBondContact O-N 3.08Å; L76-H78 PolarHBondContact O-N 2.72Å
77	I	63.6	Low	56.8	Low	146 Å²	146	135.5 Å²	135.5	75%	0.749	80%	0.803	S	S	*	*			trans	-72.4	114.7	176.1	-53.8	177.6	0	0	0	107.2	T75 G79	T75-I77 VanDerWaalsContact C-N 3.33Å; T75-I77 PolarHBondContact O-N 2.88Å; I77-G79 PolarHBondContact O-N 3.18Å
78	H	60.3	Low	56.7	Low	171 Å²	171	136.9 Å²	136.9	79%	0.792	81%	0.812	S	S	*	*			trans	-62.9	122	175.4	-144.2	76.9	0	0	0	108.8	L76 Q80	L76-H78 PolarHBondContact O-N 2.72Å; H78-Q80 PolarHBondContact O-N 3.33Å
79	G	47	Very low	56.3	Low	77 Å²	77	141.6 Å²	141.6	79%	0.794	81%	0.814	S	S	*	*			trans	-70.1	111.3	-172.6	0	0	0	0	0	112	I77	I77-G79 PolarHBondContact O-N 3.18Å
80	Q	51.1	Low	55.6	Low	186 Å²	186	142.2 Å²	142.2	87%	0.869	82%	0.817	S	S	*	*			trans	-107.7	110.1	165.5	-170	156.1	-12	0	0	108.4	H78	H78-Q80 PolarHBondContact O-N 3.33Å
81	A	47	Very low	54.3	Low	90 Å²	90	136.3 Å²	136.3	74%	0.744	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-69.8	131.1	-176.8	0	0	0	0	0	111
82	P	54.9	Low	53.6	Low	126 Å²	126	140.6 Å²	140.6	82%	0.818	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-73.5	128.8	170.5	-11.8	27.6	0	0	0	110.4
83	S	54.2	Low	52.7	Low	120 Å²	120	139 Å²	139	84%	0.839	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-68	140.2	166	-64.7	0	0	0	0	110.6
84	A	54.8	Low	51.9	Low	104 Å²	104	140.5 Å²	140.5	86%	0.86	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-60.8	140.1	177.8	0	0	0	0	0	111.6
85	G	43.9	Very low	51	Low	76 Å²	76	142.3 Å²	142.3	78%	0.784	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-80.8	142.2	-174.8	0	0	0	0	0	114
86	L	53.3	Low	50.2	Low	170 Å²	170	148.6 Å²	148.6	89%	0.89	82%	0.815	S	S	*	*			trans	-119.8	127.2	154.5	-93.7	124.3	0	0	0	107.8
87	P	43.1	Very low	49.7	Very low	131 Å²	131	144.6 Å²	144.6	85%	0.851	81%	0.813	S	S	*	*			trans	-86.2	126.7	177.1	32.6	-30.9	0	0	0	110.9
88	S	52.6	Low	48.8	Very low	126 Å²	126	143.5 Å²	143.5	88%	0.881	81%	0.813	S	S	*	*			trans	-144.9	151.8	161.1	-165.6	0	0	0	0	111.2
89	Q	47.5	Very low	48.5	Very low	171 Å²	171	143.8 Å²	143.8	80%	0.799	82%	0.82	S	S	*	*			trans	-86.9	137	-158.9	-56.8	172.8	-8	0	0	113.6
90	K	46.6	Very low	49	Very low	196 Å²	196	150.8 Å²	150.8	85%	0.852	82%	0.822	S	S	*	*				176.3	151.1	112.6	-94.4	166	-176.5	177.3	0	112.4
91	P	38.3	Very low	49.4	Very low	113 Å²	113	148.1 Å²	148.1	73%	0.734	82%	0.821	S	S	*	*			trans	-109.6	174.6	-172.8	41	-34.9	0	0	0	115.6
92	R	45.4	Very low	49.8	Very low	240 Å²	240	148.5 Å²	148.5	91%	0.906	82%	0.824	S	S	*	*			trans	83.4	142.4	-178.5	-52.3	-174.4	174.2	-163.4	-1.9	112.7
93	E	47.9	Very low	49.8	Very low	157 Å²	157	149.1 Å²	149.1	73%	0.734	83%	0.825	S	S	*	*			cis	-154.3	141.7	29.7	-170.7	155.2	-163.8	0	0	115.3
94	Q	47.7	Very low	49.5	Very low	139 Å²	139	151.8 Å²	151.8	65%	0.65	83%	0.829	S	S	*	*			trans	27.9	130.5	152.2	-61.9	-178	52.8	0	0	125.8
95	Q	47.9	Very low	49.7	Very low	167 Å²	167	155 Å²	155	78%	0.78	83%	0.826	S	S	*	*				87.1	145.4	130	-77.5	-176.4	7.9	0	0	124.2
96	R	47.6	Very low	50.2	Low	252 Å²	252	155 Å²	155	95%	0.951	82%	0.82	S	S	*	*			trans	66.9	137.6	176	-65.1	-175.8	169.2	-144.8	-2.2	116.4
97	G	50.1	Low	50.2	Low	78 Å²	78	153 Å²	153	80%	0.804	82%	0.817	S	S	*	*			cis	-169.1	153.1	-4.9	0	0	0	0	0	111.2
98	V	44.1	Very low	50.9	Low	124 Å²	124	154.5 Å²	154.5	75%	0.752	81%	0.812	S	S	*	*			trans	-89.2	135.7	-170.8	178.1	0	0	0	0	112.3
99	L	53.4	Low	50.7	Low	176 Å²	176	154.1 Å²	154.1	92%	0.921	81%	0.807	S	S	*	*			trans	-141.4	119.5	152.8	-72.8	178.9	0	0	0	110.6
100	R	57.2	Low	50.9	Low	224 Å²	224	155.8 Å²	155.8	85%	0.845	81%	0.812	S	S	*	*			trans	-114.1	138.2	166	-75.5	-173.5	174.1	117.9	-2.5	108.6
101	P	60.9	Low	50.5	Low	130 Å²	130	153.1 Å²	153.1	84%	0.844	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-63.6	145.2	172.7	-21.5	33.8	0	0	0	112.2
102	A	53.8	Low	50.6	Low	99 Å²	99	155.4 Å²	155.4	82%	0.818	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-78	144.5	-178	0	0	0	0	0	112.9
103	V	55	Low	50.5	Low	138 Å²	138	148.1 Å²	148.1	84%	0.836	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-83.8	121.1	164.9	171.5	0	0	0	0	108.2	Q105	V103-Q105 PolarHBondContact O-N 2.76Å
104	L	49.3	Very low	50.2	Low	176 Å²	176	149.6 Å²	149.6	92%	0.921	81%	0.809	S	S	*	*			trans	-72.3	109.5	172.5	-89.6	159	0	0	0	109.9
105	Q	57.5	Low	49.7	Very low	171 Å²	171	149.3 Å²	149.3	80%	0.799	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-84	131.9	174.1	-179.5	175.4	-9.7	0	0	110	V103	V103-Q105 PolarHBondContact O-N 2.76Å
106	A	55.4	Low	49.3	Very low	78 Å²	78	147.2 Å²	147.2	65%	0.645	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-69	138.7	174	0	0	0	0	0	111
107	P	53.2	Low	49.2	Very low	128 Å²	128	140.8 Å²	140.8	83%	0.831	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-71.7	137	-178.8	28.5	-33.7	0	0	0	112
108	Q	58	Low	48.9	Very low	161 Å²	161	141.7 Å²	141.7	75%	0.752	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-78.3	141.9	172.4	-71.5	-86.3	-38.6	0	0	110.5
109	P	48.3	Very low	48.9	Very low	119 Å²	119	142 Å²	142	77%	0.773	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-72.9	128.6	173.8	30.6	-32.7	0	0	0	110.3
110	K	50.7	Low	48.5	Very low	206 Å²	206	136.9 Å²	136.9	90%	0.896	80%	0.798	S	S	*	*			trans	-113.1	121.1	170.7	-77.3	-177	176.5	179.1	0	110.1
111	V	38.1	Very low	48.1	Very low	140 Å²	140	131.9 Å²	131.9	85%	0.848	79%	0.792	S	S	*	*			trans	-88.6	124.3	169.3	175.1	0	0	0	0	108.4
112	L	42	Very low	47.2	Very low	160 Å²	160	133.2 Å²	133.2	84%	0.838	79%	0.792	S	S	*	*			trans	-157.8	109.2	153.7	-156.4	63.5	0	0	0	113.9
113	S	41.6	Very low	46.5	Very low	88 Å²	88	131.6 Å²	131.6	62%	0.615	79%	0.786	S	S	*	*			trans	21	135.2	141.1	-48.3	0	0	0	0	124
114	Q	41.8	Very low	46	Very low	187 Å²	187	132 Å²	132	87%	0.874	79%	0.788	S	S	*	*			trans	64.2	138.2	147	-64	177.6	-2.3	0	0	117.3
115	T	37.7	Very low	45.6	Very low	134 Å²	134	128.3 Å²	128.3	82%	0.822	78%	0.777	S	S	*	*			cis	-152.8	154.3	39.3	-53.6	0	0	0	0	111.9
116	V	38.7	Very low	44.8	Very low	123 Å²	123	128.5 Å²	128.5	75%	0.745	78%	0.78	S	S	*	*			trans	-85.9	167.9	179	-148.3	0	0	0	0	111.1
117	P	45.5	Very low	44.3	Very low	116 Å²	116	130.5 Å²	130.5	75%	0.753	79%	0.787	S	S	*	*				-152.7	138.4	88.2	39.4	-19.5	0	0	0	118.5
118	S	44.9	Very low	43.7	Very low	97 Å²	97	128.2 Å²	128.2	68%	0.678	78%	0.779	S	S	*	*			trans	54.3	118.4	136.5	64.2	0	0	0	0	124.3
119	S	44.6	Very low	42.9	Very low	130 Å²	130	127.8 Å²	127.8	91%	0.909	78%	0.781	S	S	*	*				177	136.2	121.9	-74.6	0	0	0	0	109.5
120	G	43.4	Very low	42.5	Very low	69 Å²	69	127.9 Å²	127.9	71%	0.711	78%	0.784	S	S	*	*			cis	178.9	156	-11.7	0	0	0	0	0	112.8
121	T	49.8	Very low	42	Very low	119 Å²	119	124.2 Å²	124.2	73%	0.73	78%	0.779	S	S	*	*			trans	63.9	106.5	154.8	177.3	0	0	0	0	123.8
122	N	42.1	Very low	42	Very low	158 Å²	158	120.7 Å²	120.7	85%	0.845	77%	0.771	S	S	*	*				50.4	148.5	119.9	-40.3	-40.1	0	0	0	121.6
123	G	38.7	Very low	42.2	Very low	66 Å²	66	119.2 Å²	119.2	68%	0.68	77%	0.77	S	S	*	*			cis	134.6	158.4	4.6	0	0	0	0	0	112.4
124	V	45	Very low	42.1	Very low	146 Å²	146	119.2 Å²	119.2	89%	0.885	78%	0.776	S	S	*	*			trans	77.6	143	172.2	178.1	0	0	0	0	116.4
125	S	40.6	Very low	42	Very low	99 Å²	99	116 Å²	116	69%	0.692	77%	0.77	S	S	*	*			cis	-168.8	163.2	-25.4	-86.5	0	0	0	0	110.1
126	M	40	Very low	42.2	Very low	174 Å²	174	114.4 Å²	114.4	86%	0.857	76%	0.763	S	S	*	*			trans	-75.1	156.8	169.9	-62.8	-83.7	91.4	0	0	112.8
127	P	44.9	Very low	42.4	Very low	121 Å²	121	115 Å²	115	79%	0.786	77%	0.767	S	S	*	*				-139.4	145.4	93.7	29.6	-11	0	0	0	113.1
128	A	42.1	Very low	42	Very low	80 Å²	80	114.8 Å²	114.8	66%	0.661	77%	0.768	S	S	*	*				86	134.1	68.1	0	0	0	0	0	116.2
129	D	41.2	Very low	42.2	Very low	151 Å²	151	115.8 Å²	115.8	81%	0.807	77%	0.773	S	S	*	*			trans	84.6	139.4	154.7	-62.2	-26.9	0	0	0	124.5
130	C	39.4	Very low	42	Very low	122 Å²	122	119 Å²	119	82%	0.824	77%	0.774	S	S	*	*			trans	71.3	140	157.6	-66.4	0	0	0	0	119.3
131	T	40.2	Very low	41.6	Very low	129 Å²	129	122.9 Å²	122.9	79%	0.791	78%	0.778	S	S	*	*			cis	-162	158.7	-9.4	-78.9	0	0	0	0	108.2
132	G	36.9	Very low	41.1	Very low	66 Å²	66	125.5 Å²	125.5	68%	0.68	79%	0.786	S	S	*	*			trans	-71.6	-163.3	176.7	0	0	0	0	0	115.6
133	P	47.6	Very low	40.8	Very low	128 Å²	128	123 Å²	123	83%	0.831	78%	0.777	S	S	*	*			cis	-149.1	175.3	48.6	42	-22.1	0	0	0	118.8
134	A	39.5	Very low	40.6	Very low	89 Å²	89	128.2 Å²	128.2	74%	0.736	78%	0.784	S	S	*	*			trans	30	143.1	142.9	0	0	0	0	0	122
135	T	39.5	Very low	40.2	Very low	120 Å²	120	133 Å²	133	74%	0.736	79%	0.786	S	S	*	*				-167.1	119.4	69.6	-56.8	0	0	0	0	109.9
136	S	42.1	Very low	39.8	Very low	99 Å²	99	133.4 Å²	133.4	69%	0.692	79%	0.789	S	S	*	*				39.9	134	108.8	95.3	0	0	0	0	116.1
137	V	41.8	Very low	39.9	Very low	135 Å²	135	130.8 Å²	130.8	82%	0.818	78%	0.784	S	S	*	*				-163.3	178.1	53	-85.5	0	0	0	0	109.7
138	S	36.8	Very low	39.4	Very low	112 Å²	112	130 Å²	130	78%	0.783	78%	0.782	S	S	*	*			cis	-170.4	166.7	-37.3	-151.5	0	0	0	0	107.4
139	P	49.1	Very low	39.1	Very low	119 Å²	119	135.4 Å²	135.4	77%	0.773	79%	0.794	S	S	*	*			trans	-112	173.1	-168.6	41.6	-33.8	0	0	0	115.6
140	E	42.3	Very low	39.1	Very low	198 Å²	198	134.3 Å²	134.3	93%	0.925	80%	0.797	S	S	*	*			trans	-151.3	159.6	160	-125.4	167.8	-167.7	0	0	114.4
141	N	34	Very low	39	Very low	149 Å²	149	132.9 Å²	132.9	80%	0.797	79%	0.794	S	S	*	*			trans	-85.9	164.8	-169.1	-73.2	-73.4	0	0	0	114.3
142	L	39.7	Very low	39	Very low	174 Å²	174	135.2 Å²	135.2	91%	0.911	80%	0.796	S	S	*	*				-162.7	169.7	126.5	-106.5	166.5	0	0	0	112.5
143	T	35.2	Very low	38.9	Very low	105 Å²	105	140.4 Å²	140.4	64%	0.644	80%	0.803	S	S	*	*			trans	-133.4	161.3	-141.1	-25.5	0	0	0	0	114.2
144	Q	35.2	Very low	38.1	Very low	177 Å²	177	139.7 Å²	139.7	83%	0.827	80%	0.797	S	S	*	*			trans	62.5	115.6	152.3	-82.3	171.9	-13.2	0	0	120.6
145	R	36.1	Very low	37.9	Very low	246 Å²	246	143.6 Å²	143.6	93%	0.928	80%	0.799	S	S	*	*				-175.6	136.1	108.8	-105.3	177.5	172	-174.4	-3.3	114
146	S	32.5	Very low	37.3	Very low	108 Å²	108	144 Å²	144	76%	0.755	80%	0.801	S	S	*	*			trans	-108.2	161	150.5	-48.7	0	0	0	0	107.2
147	P	41	Very low	37.2	Very low	118 Å²	118	147.1 Å²	147.1	77%	0.766	81%	0.81	S	S	*	*				-135.7	169	72.9	18.3	7.1	0	0	0	112.1
148	S	36.4	Very low	36.9	Very low	104 Å²	104	149.2 Å²	149.2	73%	0.727	81%	0.81	S	S	*	*			cis	76.2	112.2	46.3	-58.3	0	0	0	0	116.5
149	E	35.3	Very low	36.9	Very low	195 Å²	195	152.2 Å²	152.2	91%	0.911	81%	0.812	S	S	*	*			trans	57.9	117.8	150.4	-63	-179.7	117.7	0	0	122.5
150	S	41.7	Very low	36.1	Very low	127 Å²	127	155.9 Å²	155.9	89%	0.888	82%	0.816	S	S	*	*			trans	-156.6	142.8	136.7	57.9	0	0	0	0	110.1
151	A	36.8	Very low	35.9	Very low	92 Å²	92	151.9 Å²	151.9	76%	0.76	81%	0.805	S	S	*	*			trans	-102.2	-158.9	-179.3	0	0	0	0	0	111.9
152	E	39.3	Very low	35.9	Very low	178 Å²	178	149.9 Å²	149.9	83%	0.832	80%	0.8	S	S	*	*			trans	86.8	112.1	-175.5	-55.9	-178.9	170.5	0	0	112.8
153	E	35	Very low	35.4	Very low	176 Å²	176	151.2 Å²	151.2	82%	0.822	80%	0.802	S	S	*	*				61.9	121.2	77.1	-71.2	-165.2	165.5	0	0	110.6
154	T	31.5	Very low	35.4	Very low	113 Å²	113	155.5 Å²	155.5	69%	0.693	81%	0.811	S	S	*	*			cis	-165.2	-169.2	36.9	11.5	0	0	0	0	111.2
155	H	34.5	Very low	35.1	Very low	170 Å²	170	153.5 Å²	153.5	79%	0.787	81%	0.811	S	S	*	*			trans	94.1	76.7	162.6	-65.1	-76.9	0	0	0	119.3
156	T	27.3	Very low	35.3	Very low	128 Å²	128	147.5 Å²	147.5	79%	0.785	80%	0.804	S	S	*	*			trans	-47.8	137.2	142	-35	0	0	0	0	112.1
157	L	39.3	Very low	35.2	Very low	166 Å²	166	151.5 Å²	151.5	87%	0.869	81%	0.81	S	S	*	*			trans	-137.5	104	156.4	-101.2	169.4	0	0	0	109.1
158	E	35.8	Very low	34.9	Very low	178 Å²	178	149.4 Å²	149.4	83%	0.832	81%	0.81	S	S	*	*			trans	-75.3	121.2	158.8	-75.4	-168.3	105.3	0	0	108.3
159	E	37.2	Very low	34.5	Very low	176 Å²	176	150 Å²	150	82%	0.822	81%	0.809	S	S	*	*			trans	-96.3	107.4	165.5	-169.8	174.8	139.3	0	0	110.3	V161	E159-V161 HydrophobicContact CG-CG2 3.82Å; E159-V161 WeakPolarHBondContact OE1-CG2 3.43Å
160	K	33	Very low	34.6	Very low	196 Å²	196	146.5 Å²	146.5	85%	0.852	81%	0.807	S	S	*	*			trans	-115	92	175.7	-172.9	-172.9	-176.5	-175.5	0	109.2
161	V	37.3	Very low	34.1	Very low	113 Å²	113	148.9 Å²	148.9	69%	0.685	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-98	135.9	177.6	173.4	0	0	0	0	110.2	E159	E159-V161 HydrophobicContact CG-CG2 3.82Å; E159-V161 WeakPolarHBondContact OE1-CG2 3.43Å
162	P	34.6	Very low	34.2	Very low	107 Å²	107	154 Å²	154	70%	0.695	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-96.4	159.2	-153.6	36.6	-36.9	0	0	0	115.4	K164	P162-K164 PolarHBondContact O-N 2.94Å
163	Q	28.9	Very low	33.7	Very low	203 Å²	203	149.4 Å²	149.4	95%	0.949	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-55.9	134.5	161.3	-75.8	177.6	-39.3	0	0	111
164	K	34.9	Very low	33.8	Very low	194 Å²	194	148.4 Å²	148.4	84%	0.843	81%	0.807	S	S	*	*			trans	-145.6	96.6	164.6	-154.9	174.5	-172.2	-179.8	0	110.9	P162	P162-K164 PolarHBondContact O-N 2.94Å
165	T	29	Very low	33.5	Very low	136 Å²	136	148.8 Å²	148.8	83%	0.834	81%	0.813	S	S	*	*			trans	-71.5	148.4	158.9	40.5	0	0	0	0	109.7
166	P	40.6	Very low	33.5	Very low	119 Å²	119	148.8 Å²	148.8	77%	0.773	81%	0.813	S	S	*	*			trans	-131.1	143.6	133.4	34	-24.1	0	0	0	112.3
167	H	29.6	Very low	33.6	Very low	192 Å²	192	150.9 Å²	150.9	89%	0.889	81%	0.814	S	S	*	*			trans	-63.3	146.4	160.9	-100	-105	0	0	0	110.2
168	G	35.2	Very low	33.2	Very low	74 Å²	74	152 Å²	152	76%	0.763	82%	0.815	S	S	*	*			trans	-169.7	79.6	175.2	0	0	0	0	0	111.4
169	T	28.6	Very low	33.2	Very low	116 Å²	116	151.7 Å²	151.7	71%	0.712	81%	0.813	S	S	*	*			trans	-65.9	132	176.5	-42	0	0	0	0	110.4
170	S	35.6	Very low	33.1	Very low	122 Å²	122	147.5 Å²	147.5	85%	0.853	81%	0.809	S	S	*	*			trans	-153.3	129	156.2	-72.4	0	0	0	0	108.4
171	E	32.6	Very low	33.6	Very low	177 Å²	177	142 Å²	142	83%	0.827	80%	0.8	S	S	*	*			trans	-91.5	135	-176.2	-58.9	165.1	165.9	0	0	108.7
172	E	38.4	Very low	33.9	Very low	201 Å²	201	142.8 Å²	142.8	94%	0.939	81%	0.808	S	S	*	*			trans	-159.4	129.9	146.8	-117.2	169.2	-148.8	0	0	108.8
173	G	29.8	Very low	34.7	Very low	80 Å²	80	146.3 Å²	146.3	83%	0.825	82%	0.815	S	S	*	*			trans	-98.8	145.6	-169.4	0	0	0	0	0	112.9
174	H	35.3	Very low	35.8	Very low	156 Å²	156	140.8 Å²	140.8	72%	0.722	80%	0.804	S	S	*	*			trans	-130.4	115.1	157	-156.3	-63.1	0	0	0	108.6	E176	H174-E176 IonicContact CE1-OE1 3.45Å; H174-E176 PolarHBondContact CE1-OE1 3Å; H174-E176 IonicContact CE1-OE2 3.82Å
175	C	25.3	Very low	37.4	Very low	120 Å²	120	139.2 Å²	139.2	81%	0.811	80%	0.797	S	S	*	*			trans	-81.2	135.8	168.8	-57.2	0	0	0	0	108.3
176	E	34.9	Very low	39.6	Very low	170 Å²	170	136.7 Å²	136.7	79%	0.794	78%	0.782	S	S	*	*			trans	-158.7	153.7	158.4	-117.5	159.3	-151.2	0	0	110.8	H174	H174-E176 IonicContact CE1-OE1 3.45Å; H174-E176 PolarHBondContact CE1-OE1 3Å; H174-E176 IonicContact CE1-OE2 3.82Å
177	E	30.5	Very low	40.3	Very low	173 Å²	173	140.1 Å²	140.1	81%	0.808	78%	0.784	S	S	*	*			trans	-73.6	131.2	-150	-66.6	169.9	103.7	0	0	116	Q179	E177-Q179 PolarHBondContact O-N 2.8Å
178	E	30.2	Very low	42.3	Very low	188 Å²	188	133.6 Å²	133.6	88%	0.879	77%	0.769	S	S	*	*			trans	-74.5	90.6	164.2	-171	179.8	152.7	0	0	110.1	A180	E178-A180 PolarHBondContact O-N 2.99Å
179	Q	36.2	Very low	44.2	Very low	172 Å²	172	135.8 Å²	135.8	80%	0.804	76%	0.759	S	S	*	*			trans	-69.4	97	169.2	-75.1	-171.9	1.1	0	0	110.5	E177 A181	E177-Q179 PolarHBondContact O-N 2.8Å; Q179-A181 PolarHBondContact O-N 3.21Å
180	A	35.1	Very low	45.9	Very low	89 Å²	89	134.4 Å²	134.4	74%	0.736	75%	0.748	S	S	*	*			trans	-60.4	102.7	176.7	0	0	0	0	0	111.8	E178	E178-A180 PolarHBondContact O-N 2.99Å
181	A	43.1	Very low	47.5	Very low	79 Å²	79	134.1 Å²	134.1	65%	0.653	74%	0.736	S	S	*	*			trans	-62.3	145	169.5	0	0	0	0	0	110.6	Q179 Q183	Q179-A181 PolarHBondContact O-N 3.21Å; A181-Q183 PolarHBondContact O-N 2.56Å
182	P	42.7	Very low	49.1	Very low	131 Å²	131	136.2 Å²	136.2	85%	0.851	74%	0.736	S	S	*	*			trans	-66.7	106.3	-174.1	26.5	-34.5	0	0	0	111.2	A184	P182-A184 PolarHBondContact O-N 3.26Å; P182-A184 VanDerWaalsContact O-N 3.08Å
183	Q	52.5	Low	50.3	Low	181 Å²	181	132 Å²	132	85%	0.846	72%	0.721	S	S	*	*			trans	-62.1	112.1	173	-75	-172.9	-3.1	0	0	109.9	A181 F185	A181-Q183 PolarHBondContact O-N 2.56Å; Q183-F185 PolarHBondContact O-N 3.07Å
184	A	52.3	Low	51.9	Low	87 Å²	87	137 Å²	137	72%	0.719	71%	0.714	S	S	*	*			trans	-60	126.7	176.1	0	0	0	0	0	110.5	P182 V186	P182-A184 PolarHBondContact O-N 3.26Å; P182-A184 VanDerWaalsContact O-N 3.08Å; A184-V186 PolarHBondContact O-N 2.99Å
185	F	67.7	Low	53.2	Low	161 Å²	161	134.9 Å²	134.9	71%	0.706	71%	0.713	S	S	*	*			trans	-67.3	104.4	-178.9	-179.7	-91.2	0	0	0	111.1	Q183 F187	Q183-F185 PolarHBondContact O-N 3.07Å; F185-F187 HydrophobicContact CE1-CB 4.24Å; F185-F187 HydrophobicContact CE1-CD2 4.39Å
186	V	74.8	Confident	54.2	Low	83 Å²	83	138 Å²	138	50%	0.503	71%	0.712	S	S	.	*			trans	-97.2	111.7	171.8	-178.9	0	0	0	0	109.5	A184 G188 Q189	A184-V186 PolarHBondContact O-N 2.99Å; V186-G188 PolarHBondContact O-N 3.39Å; V186-G188 VanDerWaalsContact O-N 3.13Å; V186-Q189 HydrophobicContact CB-CB 4.02Å; V186-Q189 HydrophobicContact CG1-CB 4.19Å; V186-Q189 PolarHBondContact O-N 3.21Å; V186-Q189 VanDerWaalsContact O-N 3.16Å
187	F	56.5	Low	54.6	Low	190 Å²	190	137.6 Å²	137.6	83%	0.833	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	115.7	178.2	-177.7	-94.9	0	0	0	111	F185	F185-F187 HydrophobicContact CE1-CB 4.24Å; F185-F187 HydrophobicContact CE1-CD2 4.39Å
188	G	71.7	Confident	55	Low	55 Å²	55	138.4 Å²	138.4	57%	0.567	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	100.6	-9.3	179.4	0	0	0	0	0	115.7	V186	V186-G188 PolarHBondContact O-N 3.39Å; V186-G188 VanDerWaalsContact O-N 3.13Å
189	Q	74.4	Confident	55.3	Low	120 Å²	120	137 Å²	137	56%	0.561	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	148.8	172.5	-155.4	106.5	45.3	0	0	110.6	V186 L191	V186-Q189 HydrophobicContact CB-CB 4.02Å; V186-Q189 HydrophobicContact CG1-CB 4.19Å; V186-Q189 PolarHBondContact O-N 3.21Å; V186-Q189 VanDerWaalsContact O-N 3.16Å; Q189-L191 PolarHBondContact O-N 2.99Å; Q189-L191 VanDerWaalsContact O-N 3.11Å
190	N	65	Low	55.4	Low	88 Å²	88	137.6 Å²	137.6	47%	0.471	72%	0.722	S	S	.	*	T	Hydrogen-bonded Turn	trans	55.5	28.5	175	-54.5	-9.8	0	0	0	114.9	R192 D193 R194	N190-R192 PolarHBondContact O-N 3.17Å; N190-D193 WeakPolarHBondContact CA-OD2 3Å; N190-D193 HydrophobicContact CB-CB 4.47Å; N190-D193 WeakPolarHBondContact CB-OD2 3.11Å; N190-D193 PolarHBondContact O-N 2.85Å; N190-R194 WeakPolarHBondContact O-CG 3.29Å; N190-R194 PolarHBondContact O-N 3.47Å; N190-R194 VanDerWaalsContact O-N 3.1Å
191	L	67.7	Low	55.6	Low	116 Å²	116	140.9 Å²	140.9	61%	0.607	73%	0.727	S	S	*	*	H	α-helix	trans	-62.3	-29.1	-179.5	-161.4	73.4	0	0	0	112.5	Q189 V195	Q189-L191 PolarHBondContact O-N 2.99Å; Q189-L191 VanDerWaalsContact O-N 3.11Å; L191-V195 WeakPolarHBondContact O-CB 3.42Å; L191-V195 WeakPolarHBondContact O-CG2 3.36Å; L191-V195 PolarHBondContact O-N 2.9Å
192	R	67	Low	55.3	Low	220 Å²	220	142.2 Å²	142.2	83%	0.83	74%	0.739	S	S	*	*	H	α-helix	trans	-72.4	-37.1	177.5	-62	-177.4	-173.9	171.4	2.9	112	N190	N190-R192 PolarHBondContact O-N 3.17Å
193	D	63.2	Low	55.3	Low	114 Å²	114	141.4 Å²	141.4	61%	0.61	74%	0.736	S	S	*	*	H	α-helix	trans	-76.7	-34.7	-177.1	-42.3	-57.3	0	0	0	110.6	N190 V195	N190-D193 WeakPolarHBondContact CA-OD2 3Å; N190-D193 HydrophobicContact CB-CB 4.47Å; N190-D193 WeakPolarHBondContact CB-OD2 3.11Å; N190-D193 PolarHBondContact O-N 2.85Å; D193-V195 VanDerWaalsContact C-N 3.35Å; D193-V195 PolarHBondContact O-N 2.88Å
194	R	63.3	Low	54.7	Low	183 Å²	183	139.9 Å²	139.9	69%	0.691	74%	0.738	S	S	*	*	H	α-helix	trans	-77.2	-14.2	176.7	-65.3	-179.8	69.1	178.3	3.5	114.9	N190	N190-R194 WeakPolarHBondContact O-CG 3.29Å; N190-R194 PolarHBondContact O-N 3.47Å; N190-R194 VanDerWaalsContact O-N 3.1Å
195	V	64.1	Low	54.4	Low	113 Å²	113	140 Å²	140	69%	0.685	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-5.2	178.1	169.2	0	0	0	0	111.7	L191 D193 L197	L191-V195 WeakPolarHBondContact O-CB 3.42Å; L191-V195 WeakPolarHBondContact O-CG2 3.36Å; L191-V195 PolarHBondContact O-N 2.9Å; D193-V195 VanDerWaalsContact C-N 3.35Å; D193-V195 PolarHBondContact O-N 2.88Å; V195-L197 PolarHBondContact O-N 2.97Å
196	K	45.9	Very low	52.9	Low	184 Å²	184	140 Å²	140	80%	0.8	75%	0.747	S	S	*	*			trans	-103.5	63.6	-173.1	-148.4	-179.2	-174.9	-166.3	0	113
197	L	43.7	Very low	51.8	Low	162 Å²	162	142.3 Å²	142.3	85%	0.848	76%	0.761	S	S	*	*			trans	-128.2	147	163.5	-93.6	159.2	0	0	0	108.1	V195	V195-L197 PolarHBondContact O-N 2.97Å
198	M	38.9	Very low	50.8	Low	191 Å²	191	140.6 Å²	140.6	94%	0.941	76%	0.761	S	S	*	*	S	Bend	trans	77.9	57.9	172.9	-155.2	161.1	158.4	0	0	116.9
199	N	35.4	Very low	49.3	Very low	157 Å²	157	144 Å²	144	84%	0.84	78%	0.775	S	S	*	*			trans	-157.9	62.2	153.2	-169.2	77	0	0	0	113
200	E	39.4	Very low	47.3	Very low	185 Å²	185	143.3 Å²	143.3	86%	0.864	79%	0.791	S	S	*	*			trans	-142.6	158.3	160.9	-71.2	-164.1	123.9	0	0	109.9
201	N	38.3	Very low	45.8	Very low	158 Å²	158	143.6 Å²	143.6	85%	0.845	81%	0.805	S	S	*	*			trans	85.1	84.2	175.2	-54.9	-9	0	0	0	117.7
202	A	36	Very low	44.3	Very low	108 Å²	108	147.2 Å²	147.2	89%	0.893	82%	0.818	S	S	*	*			trans	-113.5	96.1	154.6	0	0	0	0	0	109.9
203	S	44.3	Very low	42.9	Very low	114 Å²	114	142.8 Å²	142.8	80%	0.797	82%	0.818	S	S	*	*			trans	-155.9	148.8	166.8	58.1	0	0	0	0	110.7
204	V	39.8	Very low	41.4	Very low	148 Å²	148	142.6 Å²	142.6	90%	0.897	83%	0.826	S	S	*	*			trans	-106.4	128.6	-155.3	-173.1	0	0	0	0	113.1
205	A	44.5	Very low	40	Very low	91 Å²	91	139.5 Å²	139.5	75%	0.752	83%	0.832	S	S	*	*			trans	169.1	109.7	151.2	0	0	0	0	0	107.2
206	D	37.9	Very low	38.7	Very low	160 Å²	160	142.9 Å²	142.9	86%	0.856	84%	0.841	S	S	*	*				83.6	153	74.6	-159.1	14.2	0	0	0	113.4
207	V	51.7	Low	38.4	Very low	131 Å²	131	140.6 Å²	140.6	79%	0.794	84%	0.842	S	S	*	*			trans	88.5	114.3	-175.9	-165.3	0	0	0	0	117.6
208	D	35.1	Very low	38.3	Very low	155 Å²	155	138.5 Å²	138.5	83%	0.829	84%	0.838	S	S	*	*			trans	-53.2	144.3	170.9	-95.7	-48.6	0	0	0	115.5
209	S	39.5	Very low	38.4	Very low	125 Å²	125	135 Å²	135	87%	0.874	83%	0.832	S	S	*	*				-167.7	133.3	129.7	-84.6	0	0	0	0	112.1
210	A	32.5	Very low	39	Very low	107 Å²	107	131 Å²	131	88%	0.884	82%	0.822	S	S	*	*			trans	-81.4	131.3	-174.1	0	0	0	0	0	113.8
211	A	33.9	Very low	39.3	Very low	93 Å²	93	128.4 Å²	128.4	77%	0.769	82%	0.818	S	S	*	*			trans	-156.1	134.4	155.3	0	0	0	0	0	110.7
212	H	35	Very low	40.2	Very low	192 Å²	192	125.9 Å²	125.9	89%	0.889	81%	0.805	S	S	*	*			trans	-76.6	140.1	-179.7	-54.8	-95.4	0	0	0	112.1
213	P	38.6	Very low	41.8	Very low	127 Å²	127	130.5 Å²	130.5	83%	0.825	80%	0.801	S	S	*	*			trans	-94.9	111.8	152.6	31.6	-24.7	0	0	0	109.8
214	S	31.7	Very low	42.7	Very low	110 Å²	110	132.3 Å²	132.3	77%	0.769	80%	0.795	S	S	*	*			trans	-66.2	156.3	171.5	41.8	0	0	0	0	112.3	E216	S214-E216 PolarHBondContact O-N 3.39Å
215	S	33	Very low	44.2	Very low	119 Å²	119	130.2 Å²	130.2	83%	0.832	78%	0.778	S	S	*	*			trans	-66.6	115.2	-175.8	56	0	0	0	0	113.9
216	E	37.6	Very low	45.2	Very low	183 Å²	183	132.1 Å²	132.1	86%	0.855	77%	0.771	S	S	*	*			trans	-127.8	107.4	156.6	-71.7	-163.3	148.6	0	0	109.9	S214 P218	S214-E216 PolarHBondContact O-N 3.39Å; E216-P218 WeakPolarHBondContact O-CD 3.32Å
217	T	39.1	Very low	46.6	Very low	136 Å²	136	130.4 Å²	130.4	83%	0.834	75%	0.754	S	S	*	*			trans	-79.9	115.2	171.8	47.4	0	0	0	0	109.6	S219	T217-S219 PolarHBondContact O-N 3.38Å
218	P	42.4	Very low	47.4	Very low	118 Å²	118	128.8 Å²	128.8	77%	0.766	74%	0.739	S	S	*	*			trans	-69.2	122.9	173.6	28	-32.7	0	0	0	109.6	E216 A220	E216-P218 WeakPolarHBondContact O-CD 3.32Å; P218-A220 PolarHBondContact O-N 2.91Å
219	S	41.3	Very low	48.8	Very low	117 Å²	117	125.4 Å²	125.4	82%	0.818	73%	0.728	S	S	*	*			trans	-64.7	91.4	177	-173.4	0	0	0	0	110.6	T217 T221	T217-S219 PolarHBondContact O-N 3.38Å; S219-T221 PolarHBondContact O-N 3.42Å
220	A	47.6	Very low	49.8	Very low	74 Å²	74	122.3 Å²	122.3	61%	0.612	71%	0.706	S	S	*	*			trans	-86	104.9	-174.5	0	0	0	0	0	111.3	P218 N222	P218-A220 PolarHBondContact O-N 2.91Å; A220-N222 PolarHBondContact O-N 3.19Å
221	T	46.3	Very low	51.1	Low	130 Å²	130	120.7 Å²	120.7	80%	0.798	69%	0.688	S	S	*	*			trans	-74.9	29.1	-171.5	53.5	0	0	0	0	115.6	S219	S219-T221 PolarHBondContact O-N 3.42Å
222	N	57.5	Low	52.1	Low	105 Å²	105	119.5 Å²	119.5	56%	0.561	68%	0.679	S	S	*	*			trans	-148.8	111.7	176.5	-103.3	-71	0	0	0	113	A220 F224 L225	A220-N222 PolarHBondContact O-N 3.19Å; N222-F224 PolarHBondContact O-N 3.14Å; N222-L225 PolarHBondContact O-N 3.43Å; N222-L225 VanDerWaalsContact O-N 3.09Å
223	Y	67.8	Low	53.1	Low	205 Å²	205	117 Å²	117	80%	0.804	67%	0.672	S	S	*	*	H	α-helix	trans	-49.6	-30.2	176.4	-100	-95.8	0	0	0	114.3	L225 Q226	Y223-L225 VanDerWaalsContact C-N 3.34Å; Y223-L225 PolarHBondContact O-N 3.2Å; Y223-Q226 PolarHBondContact O-N 2.85Å
224	F	64.9	Low	53.5	Low	153 Å²	153	117.4 Å²	117.4	67%	0.671	67%	0.667	S	S	*	*	H	α-helix	trans	-64	-35.6	-179	-172	-104	0	0	0	113.2	N222 I228	N222-F224 PolarHBondContact O-N 3.14Å; F224-I228 HydrophobicContact CD1-CD1 4.04Å; F224-I228 HydrophobicContact CE1-CD1 3.65Å; F224-I228 HydrophobicContact CZ-CD1 4.18Å
225	L	70.3	Confident	54	Low	103 Å²	103	116.6 Å²	116.6	54%	0.539	67%	0.667	S	S	.	*	H	α-helix	trans	-73.4	-37.9	179.6	-66.8	173.5	0	0	0	111.6	N222 Y223 Y227 I228 S229	N222-L225 PolarHBondContact O-N 3.43Å; N222-L225 VanDerWaalsContact O-N 3.09Å; Y223-L225 VanDerWaalsContact C-N 3.34Å; Y223-L225 PolarHBondContact O-N 3.2Å; L225-Y227 VanDerWaalsContact C-N 3.27Å; L225-Y227 PolarHBondContact O-N 3.07Å; L225-I228 PolarHBondContact O-N 3.5Å; L225-S229 PolarHBondContact O-N 2.84Å; L225-S229 PolarHBondContact O-OG 3.04Å
226	Q	66.5	Low	54.4	Low	131 Å²	131	116.6 Å²	116.6	61%	0.612	66%	0.662	S	S	*	*	H	α-helix	trans	-60.5	-34.6	-179.7	-169.6	172.6	11.3	0	0	112.9	Y223 S230	Y223-Q226 PolarHBondContact O-N 2.85Å; Q226-S230 PolarHBondContact O-N 3.15Å; Q226-S230 PolarHBondContact O-OG 2.84Å
227	Y	66.2	Low	54.9	Low	125 Å²	125	116.4 Å²	116.4	49%	0.49	66%	0.661	S	S	.	*	H	α-helix	trans	-74.7	-31.1	178.4	-167.4	-102	0	0	0	113.6	L225 S230 S231 R254	L225-Y227 VanDerWaalsContact C-N 3.27Å; L225-Y227 PolarHBondContact O-N 3.07Å; Y227-S230 WeakPolarHBondContact CA-OG 3.46Å; Y227-S230 PolarHBondContact O-OG 2.86Å; Y227-S231 PolarHBondContact O-N 2.93Å; Y227-S231 PolarHBondContact O-OG 2.97Å; Y227-R254 WeakPolarHBondContact OH-CD 3.18Å
228	I	67.8	Low	54.8	Low	96 Å²	96	115.4 Å²	115.4	49%	0.492	66%	0.659	S	S	.	*	H	α-helix	trans	-69.3	-47.2	176.8	-63.1	171.4	0	0	0	109.6	F224 L225 S230 S231	F224-I228 HydrophobicContact CD1-CD1 4.04Å; F224-I228 HydrophobicContact CE1-CD1 3.65Å; F224-I228 HydrophobicContact CZ-CD1 4.18Å; L225-I228 PolarHBondContact O-N 3.5Å; I228-S230 PolarHBondContact O-N 2.92Å; I228-S231 PolarHBondContact O-N 2.92Å
229	S	66.4	Low	54.5	Low	84 Å²	84	114.6 Å²	114.6	59%	0.587	66%	0.663	S	S	*	*	H	α-helix	trans	-59.8	-42.4	177.2	-58.9	0	0	0	0	112.6	L225 S231 A232	L225-S229 PolarHBondContact O-N 2.84Å; L225-S229 PolarHBondContact O-OG 3.04Å; S229-S231 PolarHBondContact O-N 3.17Å; S229-A232 PolarHBondContact O-N 3.42Å
230	S	60	Low	54.4	Low	61 Å²	61	116.3 Å²	116.3	43%	0.427	66%	0.663	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.5	-3.7	-179.8	46.9	0	0	0	0	114.9	Q226 Y227 I228	Q226-S230 PolarHBondContact O-N 3.15Å; Q226-S230 PolarHBondContact O-OG 2.84Å; Y227-S230 WeakPolarHBondContact CA-OG 3.46Å; Y227-S230 PolarHBondContact O-OG 2.86Å; I228-S230 PolarHBondContact O-N 2.92Å
231	S	58.9	Low	54.1	Low	72 Å²	72	119.5 Å²	119.5	50%	0.503	67%	0.67	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.9	-11.1	172.7	-60.2	0	0	0	0	113.4	Y227 I228 S229	Y227-S231 PolarHBondContact O-N 2.93Å; Y227-S231 PolarHBondContact O-OG 2.97Å; I228-S231 PolarHBondContact O-N 2.92Å; S229-S231 PolarHBondContact O-N 3.17Å
232	A	55.9	Low	54	Low	69 Å²	69	119.6 Å²	119.6	57%	0.57	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-35	-178.3	0	0	0	0	0	113.3	S229 N234	S229-A232 PolarHBondContact O-N 3.42Å; A232-N234 PolarHBondContact O-N 3.32Å
233	D	56.1	Low	54	Low	139 Å²	139	120.6 Å²	120.6	74%	0.743	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	0.2	-168.4	-59.9	-42.5	0	0	0	115
234	N	47.1	Very low	53.9	Low	135 Å²	135	119.6 Å²	119.6	72%	0.722	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	17.9	-176.6	-80.7	-50.5	0	0	0	114.2	A232 T236	A232-N234 PolarHBondContact O-N 3.32Å; N234-T236 PolarHBondContact O-N 3.05Å
235	A	41.6	Very low	54.4	Low	93 Å²	93	119.4 Å²	119.4	77%	0.769	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	14.2	-172.3	0	0	0	0	0	116
236	T	40.9	Very low	54.9	Low	120 Å²	120	118 Å²	118	74%	0.736	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	24.8	-165.5	-22.3	0	0	0	0	115.1	N234	N234-T236 PolarHBondContact O-N 3.05Å
237	H	47.2	Very low	55.2	Low	179 Å²	179	120.8 Å²	120.8	83%	0.829	69%	0.691	S	S	*	*	S	Bend	trans	-141.4	127.3	166.9	-91.3	-73.9	0	0	0	114
238	S	38.4	Very low	55.8	Low	114 Å²	114	116.6 Å²	116.6	80%	0.797	69%	0.686	S	S	*	*			trans	64.2	96.8	163.4	-58.8	0	0	0	0	117.8	D240	S238-D240 PolarHBondContact O-N 3.37Å
239	A	34.7	Very low	56.5	Low	102 Å²	102	117.4 Å²	117.4	84%	0.843	69%	0.687	S	S	*	*			trans	-73.2	105.4	157.9	0	0	0	0	0	110.4
240	D	39.2	Very low	57.1	Low	152 Å²	152	117.1 Å²	117.1	81%	0.813	68%	0.679	S	S	*	*			trans	-173.6	156.6	138.5	-106.9	-27.9	0	0	0	111.3	S238	S238-D240 PolarHBondContact O-N 3.37Å
241	N	42.5	Very low	57.9	Low	142 Å²	142	119.7 Å²	119.7	76%	0.759	69%	0.686	S	S	*	*			trans	70	96.2	-178.5	-65.1	-36.8	0	0	0	117.6	T243	N241-T243 HydrophobicContact CB-CG2 4.48Å; N241-T243 PolarHBondContact O-N 3.3Å
242	S	43.8	Very low	58.7	Low	132 Å²	132	121.2 Å²	121.2	92%	0.923	70%	0.696	S	S	*	*			trans	-72.1	58.7	170.8	48.4	0	0	0	0	114	K244	S242-K244 PolarHBondContact O-N 3.49Å
243	T	58.4	Low	59.5	Low	126 Å²	126	124.6 Å²	124.6	77%	0.773	70%	0.7	S	S	*	*			trans	-80.1	91.1	178.2	51	0	0	0	0	112.7	N241 F245	N241-T243 HydrophobicContact CB-CG2 4.48Å; N241-T243 PolarHBondContact O-N 3.3Å; T243-F245 PolarHBondContact O-N 2.98Å
244	K	64.5	Low	60.2	Low	183 Å²	183	122.3 Å²	122.3	80%	0.796	68%	0.681	S	S	*	*			trans	-13.2	121.5	157.4	-174.4	176.2	-173.5	173.8	0	114.8	S242 V246	S242-K244 PolarHBondContact O-N 3.49Å; K244-V246 PolarHBondContact O-N 3.1Å
245	F	76.2	Confident	61.4	Low	149 Å²	149	120.2 Å²	120.2	65%	0.654	67%	0.673	S	S	*	*			trans	-53.7	120.7	171.6	175.7	-85	0	0	0	110.9	T243 F247 R254	T243-F245 PolarHBondContact O-N 2.98Å; F245-F247 HydrophobicContact CE1-CB 4.19Å; F245-R254 VanDerWaalsContact CE2-NH1 3.3Å
246	V	79.8	Confident	62.6	Low	73 Å²	73	123.7 Å²	123.7	44%	0.442	68%	0.678	S	S	.	*			trans	-111.2	120.1	171.3	-178	0	0	0	0	108.6	K244 G248 Q249	K244-V246 PolarHBondContact O-N 3.1Å; V246-G248 PolarHBondContact O-N 3.23Å; V246-Q249 HydrophobicContact CB-CB 4.06Å; V246-Q249 HydrophobicContact CG1-CB 4.43Å; V246-Q249 PolarHBondContact O-N 2.93Å
247	F	74.4	Confident	63.3	Low	191 Å²	191	122.6 Å²	122.6	84%	0.838	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	120.3	173.6	-177	-97.4	0	0	0	109.6	F245	F245-F247 HydrophobicContact CE1-CB 4.19Å
248	G	78.1	Confident	63.7	Low	37 Å²	37	119.6 Å²	119.6	38%	0.381	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	101	-17	-177.6	0	0	0	0	0	116.2	V246 M251	V246-G248 PolarHBondContact O-N 3.23Å; G248-M251 WeakPolarHBondContact O-CG 3.46Å
249	Q	82.8	Confident	64.3	Low	112 Å²	112	120.3 Å²	120.3	52%	0.523	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.5	147.8	175.9	-168.2	160.8	4.1	0	0	111	V246 M251 R254	V246-Q249 HydrophobicContact CB-CB 4.06Å; V246-Q249 HydrophobicContact CG1-CB 4.43Å; V246-Q249 PolarHBondContact O-N 2.93Å; Q249-M251 PolarHBondContact O-N 3.01Å; Q249-R254 PolarHBondContact O-NH2 3.41Å
250	N	78.7	Confident	64.7	Low	78 Å²	78	124.6 Å²	124.6	42%	0.417	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	47.3	34.4	-179.4	-63.1	18.8	0	0	0	114.9	S252 E253 R254	N250-S252 PolarHBondContact O-N 3.4Å; N250-E253 HydrophobicContact CB-CB 4.39Å; N250-E253 HydrophobicContact CB-CG 4.49Å; N250-E253 WeakPolarHBondContact CB-OE2 3.48Å; N250-E253 PolarHBondContact ND2-OE2 2.85Å; N250-E253 PolarHBondContact O-N 2.96Å; N250-R254 PolarHBondContact O-N 3.13Å
251	M	76.7	Confident	64.7	Low	116 Å²	116	125.4 Å²	125.4	57%	0.571	68%	0.676	S	S	*	*	H	α-helix	trans	-58.9	-33.1	174.7	-83.5	177.5	64.9	0	0	112.2	G248 Q249 E253 R254 V255	G248-M251 WeakPolarHBondContact O-CG 3.46Å; Q249-M251 PolarHBondContact O-N 3.01Å; M251-E253 VanDerWaalsContact C-N 3.29Å; M251-E253 PolarHBondContact O-N 3.25Å; M251-R254 PolarHBondContact O-N 2.89Å; M251-V255 VanDerWaalsContact O-CB 3.28Å; M251-V255 WeakPolarHBondContact O-CB 3.24Å; M251-V255 VanDerWaalsContact O-CG2 3.27Å; M251-V255 WeakPolarHBondContact O-CG2 3.2Å; M251-V255 PolarHBondContact O-N 2.91Å
252	S	76	Confident	64.7	Low	103 Å²	103	125.7 Å²	125.7	72%	0.72	68%	0.678	S	S	*	*	H	α-helix	trans	-67	-23.8	177.6	48.6	0	0	0	0	114.7	N250	N250-S252 PolarHBondContact O-N 3.4Å
253	E	71.5	Confident	64.8	Low	140 Å²	140	128.6 Å²	128.6	65%	0.654	68%	0.677	S	S	*	*	H	α-helix	trans	-90.1	-29.2	176	-63.7	171.3	177.5	0	0	111.3	N250 M251	N250-E253 HydrophobicContact CB-CB 4.39Å; N250-E253 HydrophobicContact CB-CG 4.49Å; N250-E253 WeakPolarHBondContact CB-OE2 3.48Å; N250-E253 PolarHBondContact ND2-OE2 2.85Å; N250-E253 PolarHBondContact O-N 2.96Å; M251-E253 VanDerWaalsContact C-N 3.29Å; M251-E253 PolarHBondContact O-N 3.25Å
254	R	71.1	Confident	64	Low	92 Å²	92	126.4 Å²	126.4	35%	0.347	67%	0.671	S	S	.	*	H	α-helix	trans	-91.3	-20.6	-177.5	-63.4	-168.7	-75	-176.7	-0.3	114	Y227 F245 Q249 N250 M251	Y227-R254 WeakPolarHBondContact OH-CD 3.18Å; F245-R254 VanDerWaalsContact CE2-NH1 3.3Å; Q249-R254 PolarHBondContact O-NH2 3.41Å; N250-R254 PolarHBondContact O-N 3.13Å; M251-R254 PolarHBondContact O-N 2.89Å
255	V	72.1	Confident	63	Low	91 Å²	91	125.2 Å²	125.2	55%	0.552	67%	0.674	S	S	*	*	S	Bend	trans	-93.8	103.9	172.1	178	0	0	0	0	108.2	M251 S257	M251-V255 VanDerWaalsContact O-CB 3.28Å; M251-V255 WeakPolarHBondContact O-CB 3.24Å; M251-V255 VanDerWaalsContact O-CG2 3.27Å; M251-V255 WeakPolarHBondContact O-CG2 3.2Å; M251-V255 PolarHBondContact O-N 2.91Å; V255-S257 PolarHBondContact O-N 2.97Å
256	L	67.1	Low	61.4	Low	165 Å²	165	123.6 Å²	123.6	86%	0.864	68%	0.681	S	S	*	*			trans	-56.3	112.4	175.3	-66.9	171	0	0	0	110.1
257	S	56.6	Low	59.5	Low	97 Å²	97	127.5 Å²	127.5	68%	0.678	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-68	140.6	163.9	-65	0	0	0	0	108.7	V255	V255-S257 PolarHBondContact O-N 2.97Å
258	P	54.9	Low	58	Low	117 Å²	117	125 Å²	125	76%	0.76	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-54.3	134.1	177.3	-26.1	34.5	0	0	0	110.9	K260	P258-K260 PolarHBondContact O-N 3.21Å; P258-K260 VanDerWaalsContact O-N 3.12Å
259	P	51.1	Low	56.2	Low	128 Å²	128	128 Å²	128	83%	0.831	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-60.8	119.3	-177.9	-22.1	32.5	0	0	0	110.7	L261	P259-L261 PolarHBondContact O-N 3.13Å; P259-L261 VanDerWaalsContact O-N 3.16Å
260	K	43.9	Very low	54.4	Low	192 Å²	192	134.2 Å²	134.2	84%	0.835	73%	0.734	S	S	*	*			trans	-70.4	107.9	162.5	-80	-174.7	173.5	-177.3	0	107.7	P258 N262	P258-K260 PolarHBondContact O-N 3.21Å; P258-K260 VanDerWaalsContact O-N 3.12Å; K260-N262 PolarHBondContact O-N 3.41Å
261	L	39.2	Very low	52.5	Low	169 Å²	169	139.1 Å²	139.1	89%	0.885	75%	0.754	S	S	*	*			trans	-56.3	109.5	155.6	-86	166.4	0	0	0	107.6	P259	P259-L261 PolarHBondContact O-N 3.13Å; P259-L261 VanDerWaalsContact O-N 3.16Å
262	N	41.5	Very low	50.6	Low	149 Å²	149	139.8 Å²	139.8	80%	0.797	77%	0.765	S	S	*	*			trans	-123.7	118.1	162.7	-119.7	49.3	0	0	0	105.7	K260	K260-N262 PolarHBondContact O-N 3.41Å
263	E	45	Very low	48.6	Very low	193 Å²	193	140.6 Å²	140.6	90%	0.902	77%	0.765	S	S	*	*			trans	-64.8	152	-176.5	-65	176.7	125.5	0	0	111.5
264	A	42.3	Very low	47.1	Very low	79 Å²	79	142.9 Å²	142.9	65%	0.653	78%	0.776	S	S	*	*			trans	-79.2	164.6	175.2	0	0	0	0	0	111.9
265	N	43.3	Very low	45.5	Very low	159 Å²	159	142.2 Å²	142.2	85%	0.85	79%	0.79	S	S	*	*			trans	77.8	119.7	172.2	-43.7	-34.2	0	0	0	113.9
266	S	42.6	Very low	44.2	Very low	115 Å²	115	146.8 Å²	146.8	80%	0.804	81%	0.805	S	S	*	*			cis	-166.9	156.7	28.9	42.9	0	0	0	0	111.8
267	D	40.6	Very low	43	Very low	154 Å²	154	145.2 Å²	145.2	82%	0.824	81%	0.808	S	S	*	*			trans	-65.6	134.1	171.5	-59.7	-81.4	0	0	0	112.1
268	T	43.2	Very low	42.1	Very low	140 Å²	140	143.6 Å²	143.6	86%	0.859	81%	0.807	S	S	*	*				-169	144.7	119	14.1	0	0	0	0	113.2
269	S	40	Very low	41.5	Very low	98 Å²	98	143.4 Å²	143.4	69%	0.685	81%	0.808	S	S	*	*			trans	-61.7	141.8	174.8	50.8	0	0	0	0	113.8
270	R	44.4	Very low	40.9	Very low	243 Å²	243	146.4 Å²	146.4	92%	0.917	81%	0.811	S	S	*	*				-175.9	143.8	102.5	-95.4	164.4	-169	175.1	4.1	114.3
271	E	39	Very low	40.7	Very low	182 Å²	182	143.3 Å²	143.3	85%	0.85	81%	0.814	S	S	*	*			trans	-71.8	142.6	173.3	176.6	179.1	-147.1	0	0	111.8
272	T	37.2	Very low	40.5	Very low	129 Å²	129	140.2 Å²	140.2	79%	0.791	81%	0.806	S	S	*	*			trans	168.1	139.5	131.6	-70	0	0	0	0	111.9
273	T	34.6	Very low	40.7	Very low	120 Å²	120	138.8 Å²	138.8	74%	0.736	81%	0.807	S	S	*	*			trans	-60.4	146.6	179.6	52.7	0	0	0	0	115.9
274	H	38.9	Very low	40.2	Very low	189 Å²	189	139 Å²	139	88%	0.875	81%	0.809	S	S	*	*				-163.3	165.8	112.8	-132.2	62.5	0	0	0	112.9
275	A	38.6	Very low	40.2	Very low	77 Å²	77	144.4 Å²	144.4	64%	0.636	82%	0.82	S	S	*	*			trans	-110.4	174.9	-169.2	0	0	0	0	0	114
276	Q	44	Very low	40.3	Very low	188 Å²	188	141.7 Å²	141.7	88%	0.879	82%	0.82	S	S	*	*			trans	96.6	143.4	159.2	-56.2	-171.6	-20.4	0	0	119.2
277	S	41.2	Very low	40.2	Very low	132 Å²	132	140.2 Å²	140.2	92%	0.923	82%	0.815	S	S	*	*			trans	69.9	138.2	169.7	-135.7	0	0	0	0	116.2
278	G	38.2	Very low	40.8	Very low	63 Å²	63	138.4 Å²	138.4	65%	0.649	81%	0.811	S	S	*	*			cis	165.5	155	-2	0	0	0	0	0	110.8
279	S	42.2	Very low	41.5	Very low	112 Å²	112	141.1 Å²	141.1	78%	0.783	81%	0.811	S	S	*	*			trans	66.6	97.6	171.2	-71.2	0	0	0	0	120.7
280	E	38.1	Very low	42.6	Very low	192 Å²	192	146.4 Å²	146.4	90%	0.897	82%	0.822	S	S	*	*				22.2	116.1	122.9	23.1	-177.3	95.3	0	0	119.7
281	S	41.6	Very low	43.6	Very low	127 Å²	127	141.2 Å²	141.2	89%	0.888	81%	0.808	S	S	*	*			trans	-150.2	150.2	140.2	-165.8	0	0	0	0	111.5
282	S	34.9	Very low	45.6	Very low	104 Å²	104	135.6 Å²	135.6	73%	0.727	79%	0.789	S	S	*	*			trans	-86.1	136.9	-171.2	176.2	0	0	0	0	112.9
283	S	44	Very low	47.7	Very low	118 Å²	118	137 Å²	137	83%	0.825	79%	0.791	S	S	*	*			trans	-151.9	125.1	160.7	-70.7	0	0	0	0	110
284	Q	35.6	Very low	50.1	Low	199 Å²	199	134.7 Å²	134.7	93%	0.93	78%	0.784	S	S	*	*			trans	-74.6	125.3	176.2	-66.5	166.8	-84.1	0	0	109.9
285	E	41.1	Very low	52.3	Low	192 Å²	192	131.5 Å²	131.5	90%	0.897	77%	0.769	S	S	*	*			trans	-134.9	131.8	159.5	-157	165.4	-154.3	0	0	109.5	A287	E285-A287 PolarHBondContact O-N 3.06Å; E285-A287 VanDerWaalsContact O-N 3.13Å
286	A	45.6	Very low	54.2	Low	101 Å²	101	130.3 Å²	130.3	84%	0.835	76%	0.756	S	S	*	*			trans	-76.5	105.5	-162.6	0	0	0	0	0	111.7
287	A	40.7	Very low	56.1	Low	85 Å²	85	124 Å²	124	70%	0.702	74%	0.736	S	S	*	*			trans	-58.6	124.3	171.1	0	0	0	0	0	110.3	E285 K289	E285-A287 PolarHBondContact O-N 3.06Å; E285-A287 VanDerWaalsContact O-N 3.13Å; A287-K289 PolarHBondContact O-N 2.88Å; A287-K289 VanDerWaalsContact O-N 3.11Å
288	P	53.2	Low	58.2	Low	116 Å²	116	120.5 Å²	120.5	75%	0.753	72%	0.715	S	S	*	*			trans	-65	118	174.8	26.6	-32.7	0	0	0	108.2	K290	P288-K290 PolarHBondContact O-N 3.17Å
289	K	59	Low	60.3	Low	196 Å²	196	120.1 Å²	120.1	85%	0.852	71%	0.706	S	S	*	*			trans	-58.6	115.6	173.1	-69.2	178.3	-178.5	174.5	0	107.4	A287 E291	A287-K289 PolarHBondContact O-N 2.88Å; A287-K289 VanDerWaalsContact O-N 3.11Å; K289-E291 PolarHBondContact O-N 3.18Å
290	K	63.1	Low	62.1	Low	209 Å²	209	122.7 Å²	122.7	91%	0.909	70%	0.7	S	S	*	*			trans	-71.5	83.4	176.7	-68.4	177.3	179	175.5	0	108.9	P288 S292	P288-K290 PolarHBondContact O-N 3.17Å; K290-S292 PolarHBondContact O-N 3.47Å
291	E	64.4	Low	64.1	Low	135 Å²	135	117.8 Å²	117.8	63%	0.631	68%	0.683	S	S	*	*			trans	-54.2	132.6	164.1	-68	-176.3	177.5	0	0	108.5	K289	K289-E291 PolarHBondContact O-N 3.18Å
292	S	80.5	Confident	65.9	Low	64 Å²	64	119.8 Å²	119.8	45%	0.448	68%	0.675	S	S	.	*			trans	-69.5	145.9	-178.7	177	0	0	0	0	110	K290 A294 E295 S296	K290-S292 PolarHBondContact O-N 3.47Å; S292-A294 PolarHBondContact O-N 2.9Å; S292-A294 VanDerWaalsContact O-N 3.07Å; S292-A294 PolarHBondContact OG-N 3.37Å; S292-E295 CarbonylContact O-C 3.57Å; S292-E295 WeakPolarHBondContact O-CA 3.23Å; S292-E295 WeakPolarHBondContact O-CB 3.45Å; S292-E295 PolarHBondContact O-N 3.13Å; S292-S296 PolarHBondContact O-N 3.42Å; S292-S296 PolarHBondContact O-OG 2.91Å
293	L	81.7	Confident	67.7	Low	158 Å²	158	117.8 Å²	117.8	83%	0.827	67%	0.665	S	S	*	*	H	α-helix	trans	-52	-33.4	170.8	-83.1	170.5	0	0	0	112.4	E295 A297	L293-E295 VanDerWaalsContact C-N 3.33Å; L293-A297 WeakPolarHBondContact O-CB 3.49Å; L293-A297 PolarHBondContact O-N 3.24Å
294	A	84.8	Confident	69	Low	71 Å²	71	115.1 Å²	115.1	59%	0.587	64%	0.644	S	S	*	*	H	α-helix	trans	-68.1	-32.4	175.1	0	0	0	0	0	112.8	S292 A298	S292-A294 PolarHBondContact O-N 2.9Å; S292-A294 VanDerWaalsContact O-N 3.07Å; S292-A294 PolarHBondContact OG-N 3.37Å; A294-A298 VanDerWaalsContact O-CB 3.24Å; A294-A298 WeakPolarHBondContact O-CB 3.27Å; A294-A298 PolarHBondContact O-N 3.19Å
295	E	84.9	Confident	70.3	Confident	123 Å²	123	108.5 Å²	108.5	58%	0.575	62%	0.624	S	S	*	*	H	α-helix	trans	-78.8	-42.7	178.7	-169.1	160.8	-153.2	0	0	111	S292 L293 A297 A298 A299	S292-E295 CarbonylContact O-C 3.57Å; S292-E295 WeakPolarHBondContact O-CA 3.23Å; S292-E295 WeakPolarHBondContact O-CB 3.45Å; S292-E295 PolarHBondContact O-N 3.13Å; L293-E295 VanDerWaalsContact C-N 3.33Å; E295-A297 PolarHBondContact O-N 2.94Å; E295-A298 PolarHBondContact O-N 2.92Å; E295-A299 VanDerWaalsContact O-CB 3.29Å; E295-A299 WeakPolarHBondContact O-CB 3.37Å; E295-A299 PolarHBondContact O-N 3.28Å
296	S	79.4	Confident	71.4	Confident	52 Å²	52	108.8 Å²	108.8	36%	0.364	62%	0.617	S	S	.	*	H	α-helix	trans	-63.5	-39.1	171.8	-48.1	0	0	0	0	112.2	S292 A299 Y300	S292-S296 PolarHBondContact O-N 3.42Å; S292-S296 PolarHBondContact O-OG 2.91Å; S296-A299 PolarHBondContact O-N 3.3Å; S296-Y300 WeakPolarHBondContact O-CB 3.36Å; S296-Y300 PolarHBondContact O-N 3.48Å
297	A	84	Confident	72.2	Confident	55 Å²	55	109 Å²	109	46%	0.455	61%	0.607	S	S	.	*	H	α-helix	trans	-65.1	-45.1	173.3	0	0	0	0	0	111.7	L293 E295 A299 Y300 T301	L293-A297 WeakPolarHBondContact O-CB 3.49Å; L293-A297 PolarHBondContact O-N 3.24Å; E295-A297 PolarHBondContact O-N 2.94Å; A297-A299 VanDerWaalsContact C-N 3.32Å; A297-A299 PolarHBondContact O-N 3.2Å; A297-Y300 PolarHBondContact O-N 2.81Å; A297-T301 PolarHBondContact O-N 3.06Å; A297-T301 PolarHBondContact O-OG1 2.76Å
298	A	85.3	Confident	73.3	Confident	59 Å²	59	109.6 Å²	109.6	49%	0.488	61%	0.605	S	S	.	*	H	α-helix	trans	-63.4	-37.3	175.4	0	0	0	0	0	112.3	A294 E295 K302	A294-A298 VanDerWaalsContact O-CB 3.24Å; A294-A298 WeakPolarHBondContact O-CB 3.27Å; A294-A298 PolarHBondContact O-N 3.19Å; E295-A298 PolarHBondContact O-N 2.92Å; A298-K302 WeakPolarHBondContact O-CB 3.32Å; A298-K302 PolarHBondContact O-N 2.91Å
299	A	82.4	Confident	74.5	Confident	54 Å²	54	111.5 Å²	111.5	45%	0.446	61%	0.608	S	S	.	*	H	α-helix	trans	-64.3	-45	174.1	0	0	0	0	0	111.3	E295 S296 A297 K302 A303	E295-A299 VanDerWaalsContact O-CB 3.29Å; E295-A299 WeakPolarHBondContact O-CB 3.37Å; E295-A299 PolarHBondContact O-N 3.28Å; S296-A299 PolarHBondContact O-N 3.3Å; A297-A299 VanDerWaalsContact C-N 3.32Å; A297-A299 PolarHBondContact O-N 3.2Å; A299-K302 PolarHBondContact O-N 2.68Å; A299-A303 WeakPolarHBondContact O-CB 3.48Å; A299-A303 PolarHBondContact O-N 2.94Å
300	Y	80.5	Confident	75.7	Confident	167 Å²	167	108.8 Å²	108.8	66%	0.655	60%	0.603	S	S	*	*	H	α-helix	trans	-62	-46.6	175.2	-174.7	-94.8	0	0	0	112.1	S296 A297 K302 A303 T304	S296-Y300 WeakPolarHBondContact O-CB 3.36Å; S296-Y300 PolarHBondContact O-N 3.48Å; A297-Y300 PolarHBondContact O-N 2.81Å; Y300-K302 VanDerWaalsContact C-N 3.35Å; Y300-K302 PolarHBondContact O-N 2.84Å; Y300-A303 CarbonylContact O-C 3.6Å; Y300-A303 PolarHBondContact O-N 2.85Å; Y300-T304 HydrophobicContact CE1-CG2 4.15Å; Y300-T304 HydrophobicContact CE2-CG2 4.49Å; Y300-T304 PolarHBondContact O-N 2.58Å; Y300-T304 PolarHBondContact O-OG1 2.87Å
301	T	78.7	Confident	76.9	Confident	88 Å²	88	107.1 Å²	107.1	54%	0.54	60%	0.598	S	S	.	*	H	α-helix	trans	-61.5	-41.6	175.2	-58.2	0	0	0	0	111.6	A297 T304 A305	A297-T301 PolarHBondContact O-N 3.06Å; A297-T301 PolarHBondContact O-OG1 2.76Å; T301-T304 PolarHBondContact O-N 2.79Å; T301-T304 PolarHBondContact O-OG1 3.29Å; T301-A305 VanDerWaalsContact O-CB 3.24Å; T301-A305 WeakPolarHBondContact O-CB 3.38Å; T301-A305 PolarHBondContact O-N 2.7Å
302	K	80.6	Confident	78.2	Confident	169 Å²	169	110.3 Å²	110.3	74%	0.735	61%	0.61	S	S	*	*	H	α-helix	trans	-67.2	-37.4	176.9	-170.9	-178.8	179.2	-172.4	0	112.2	A298 A299 Y300 T304	A298-K302 WeakPolarHBondContact O-CB 3.32Å; A298-K302 PolarHBondContact O-N 2.91Å; A299-K302 PolarHBondContact O-N 2.68Å; Y300-K302 VanDerWaalsContact C-N 3.35Å; Y300-K302 PolarHBondContact O-N 2.84Å; K302-T304 VanDerWaalsContact C-N 3.29Å; K302-T304 PolarHBondContact O-N 2.98Å
303	A	72.3	Confident	78.7	Confident	62 Å²	62	112.7 Å²	112.7	51%	0.512	62%	0.621	S	S	.	*	H	α-helix	trans	-77.9	-8.3	177.4	0	0	0	0	0	114	A299 Y300 W306	A299-A303 WeakPolarHBondContact O-CB 3.48Å; A299-A303 PolarHBondContact O-N 2.94Å; Y300-A303 CarbonylContact O-C 3.6Å; Y300-A303 PolarHBondContact O-N 2.85Å; A303-W306 PolarHBondContact O-NE1 2.58Å
304	T	70.6	Confident	79.2	Confident	62 Å²	62	113 Å²	113	38%	0.38	62%	0.618	S	S	.	*	H	α-helix	trans	-109	-17.4	169.7	44.5	0	0	0	0	113.2	Y300 T301 K302 W306 T307	Y300-T304 HydrophobicContact CE1-CG2 4.15Å; Y300-T304 HydrophobicContact CE2-CG2 4.49Å; Y300-T304 PolarHBondContact O-N 2.58Å; Y300-T304 PolarHBondContact O-OG1 2.87Å; T301-T304 PolarHBondContact O-N 2.79Å; T301-T304 PolarHBondContact O-OG1 3.29Å; K302-T304 VanDerWaalsContact C-N 3.29Å; K302-T304 PolarHBondContact O-N 2.98Å; T304-W306 VanDerWaalsContact C-N 3.32Å; T304-W306 PolarHBondContact O-N 2.94Å; T304-T307 PolarHBondContact O-OG1 3.03Å; T304-T307 VanDerWaalsContact O-OG1 3.08Å
305	A	64.2	Low	79.5	Confident	61 Å²	61	116 Å²	116	50%	0.504	63%	0.629	S	S	.	*	H	α-helix	trans	-67.8	-24.7	179.5	0	0	0	0	0	114.7	T301 T307 C308	T301-A305 VanDerWaalsContact O-CB 3.24Å; T301-A305 WeakPolarHBondContact O-CB 3.38Å; T301-A305 PolarHBondContact O-N 2.7Å; A305-T307 VanDerWaalsContact C-N 3.29Å; A305-T307 PolarHBondContact O-N 2.62Å; A305-C308 PolarHBondContact O-N 3.27Å
306	W	63.2	Low	79.8	Confident	198 Å²	198	116 Å²	116	75%	0.75	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-13.7	-175.3	68.3	-80.5	0	0	0	114.4	A303 T304	A303-W306 PolarHBondContact O-NE1 2.58Å; T304-W306 VanDerWaalsContact C-N 3.32Å; T304-W306 PolarHBondContact O-N 2.94Å
307	T	63.7	Low	80.4	Confident	105 Å²	105	116.2 Å²	116.2	64%	0.644	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-2.1	177.2	57.7	0	0	0	0	113.5	T304 A305	T304-T307 PolarHBondContact O-OG1 3.03Å; T304-T307 VanDerWaalsContact O-OG1 3.08Å; A305-T307 VanDerWaalsContact C-N 3.29Å; A305-T307 PolarHBondContact O-N 2.62Å
308	C	63.5	Low	80.8	Confident	97 Å²	97	116.1 Å²	116.1	66%	0.655	64%	0.635	S	S	*	*			trans	-132.5	49.6	-175.7	-158.8	0	0	0	0	112.3	A305	A305-C308 PolarHBondContact O-N 3.27Å
309	L	77.5	Confident	81.1	Confident	157 Å²	157	113.9 Å²	113.9	82%	0.822	62%	0.615	S	S	*	*			trans	-97.1	97.4	165.2	-167.5	144.1	0	0	0	108.5
310	L	85.2	Confident	81.5	Confident	139 Å²	139	117.7 Å²	117.7	73%	0.728	62%	0.623	S	S	*	*			trans	-78.2	140.5	173.5	-63	176	0	0	0	109.9
311	E	88.6	Confident	82	Confident	173 Å²	173	114.3 Å²	114.3	81%	0.808	63%	0.63	S	S	*	*			trans	-67.6	147.6	175.4	-175.4	166.6	-164.6	0	0	111.4	V313	E311-V313 PolarHBondContact O-N 2.88Å; E311-V313 VanDerWaalsContact O-N 3.09Å
312	K	90.1	Very high	82.7	Confident	203 Å²	203	111.5 Å²	111.5	88%	0.883	61%	0.611	S	S	*	*			trans	-78	95.2	175.6	-174.5	-167.4	173.5	-168.7	0	109.7
313	V	91.9	Very high	83.4	Confident	114 Å²	114	107.3 Å²	107.3	69%	0.691	60%	0.603	S	S	*	*			trans	-71.5	147	170.5	-171	0	0	0	0	110.5	E311	E311-V313 PolarHBondContact O-N 2.88Å; E311-V313 VanDerWaalsContact O-N 3.09Å
314	E	91.6	Very high	84.6	Confident	164 Å²	164	107.7 Å²	107.7	77%	0.766	60%	0.596	S	S	*	*			trans	-68.4	132.7	170.3	-175.8	170.3	-170.1	0	0	110.9	I316	E314-I316 HydrophobicContact CG-CG1 4.38Å
315	V	91.6	Very high	85.9	Confident	135 Å²	135	107.5 Å²	107.5	82%	0.818	60%	0.595	S	S	*	*			trans	-98.8	97.2	-175.1	-178.2	0	0	0	0	109.5
316	I	92	Very high	87.5	Confident	123 Å²	123	106.2 Å²	106.2	63%	0.631	58%	0.58	S	S	*	*			trans	-90.6	132.4	175.2	-57.6	172.7	0	0	0	109	E314 E320	E314-I316 HydrophobicContact CG-CG1 4.38Å; I316-E320 HydrophobicContact CG2-CG 4.2Å
317	T	91.4	Very high	89.1	Confident	55 Å²	55	101 Å²	101	34%	0.337	56%	0.563	S	S	.	*			trans	-80.3	-22.9	-176	64.7	0	0	0	0	114.3	E319 E320 R370	T317-E319 VanDerWaalsContact C-N 3.28Å; T317-E319 WeakPolarHBondContact OG1-CB 3.35Å; T317-E319 PolarHBondContact OG1-N 2.91Å; T317-E320 VanDerWaalsContact CB-OE1 3.31Å; T317-E320 WeakPolarHBondContact CB-OE1 3.26Å; T317-E320 VanDerWaalsContact CG2-OE1 3.31Å; T317-E320 WeakPolarHBondContact CG2-OE1 3.49Å; T317-E320 PolarHBondContact N-OE1 2.88Å; T317-E320 PolarHBondContact OG1-OE1 2.88Å; T317-R370 PolarHBondContact O-NH2 3.33Å
318	G	91.9	Very high	90.8	Very high	53 Å²	53	96.3 Å²	96.3	55%	0.546	53%	0.534	S	S	.	.	S	Bend	trans	77.6	10.8	-166.4	0	0	0	0	0	113.8	R366	G318-R366 PolarHBondContact O-NH2 2.84Å
319	E	91.6	Very high	92.4	Very high	13 Å²	13	98 Å²	98	6%	0.061	53%	0.533	C	S	.	.			trans	-116.3	-2.2	-179.5	-57.7	166.4	-135.5	0	0	112.2	T317 A321 E322 R351 R370	T317-E319 VanDerWaalsContact C-N 3.28Å; T317-E319 WeakPolarHBondContact OG1-CB 3.35Å; T317-E319 PolarHBondContact OG1-N 2.91Å; E319-A321 VanDerWaalsContact C-N 3.28Å; E319-A321 PolarHBondContact O-N 3.47Å; E319-E322 WeakPolarHBondContact O-CB 3.32Å; E319-E322 PolarHBondContact O-N 2.95Å; E319-R351 WeakPolarHBondContact OE2-CD 3.46Å; E319-R351 IonicContact OE2-CZ 2.62Å; E319-R351 IonicContact OE2-NE 3.42Å; E319-R351 IonicContact OE2-NH1 2.94Å; E319-R351 PolarHBondContact OE2-NH1 2.86Å; E319-R370 IonicContact OE1-CZ 3.28Å; E319-R370 VanDerWaalsContact OE1-CZ 3.28Å; E319-R370 IonicContact OE1-NE 2.94Å; E319-R370 PolarHBondContact OE1-NE 3.26Å; E319-R370 IonicContact OE1-NH2 2.73Å; E319-R370 PolarHBondContact OE1-NH2 2.92Å
320	E	90.6	Very high	93.5	Very high	133 Å²	133	90.9 Å²	90.9	62%	0.621	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-21.6	-170.3	-45.4	-56.2	150.7	0	0	114.9	I316 T317 E322	I316-E320 HydrophobicContact CG2-CG 4.2Å; T317-E320 VanDerWaalsContact CB-OE1 3.31Å; T317-E320 WeakPolarHBondContact CB-OE1 3.26Å; T317-E320 VanDerWaalsContact CG2-OE1 3.31Å; T317-E320 WeakPolarHBondContact CG2-OE1 3.49Å; T317-E320 PolarHBondContact N-OE1 2.88Å; T317-E320 PolarHBondContact OG1-OE1 2.88Å; E320-E322 VanDerWaalsContact C-N 3.32Å
321	A	90.9	Very high	94.1	Very high	97 Å²	97	86.4 Å²	86.4	80%	0.802	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	13.3	179.1	0	0	0	0	0	113	E319	E319-A321 VanDerWaalsContact C-N 3.28Å; E319-A321 PolarHBondContact O-N 3.47Å
322	E	94.6	Very high	94.6	Very high	29 Å²	29	78.1 Å²	78.1	14%	0.136	43%	0.432	C	S	.	.	S	Bend	trans	-124.5	149.3	-173	-41.1	-170.2	132.3	0	0	111.9	E319 E320 N353 M355 R366	E319-E322 WeakPolarHBondContact O-CB 3.32Å; E319-E322 PolarHBondContact O-N 2.95Å; E320-E322 VanDerWaalsContact C-N 3.32Å; E322-N353 HydrophobicContact CB-CB 4Å; E322-N353 WeakPolarHBondContact OE2-CB 3.33Å; E322-N353 PolarHBondContact OE2-ND2 2.76Å; E322-M355 HydrophobicContact CB-CG 4.35Å; E322-M355 HydrophobicContact CG-CG 3.78Å; E322-M355 VanDerWaalsContact OE1-CG 3.31Å; E322-M355 WeakPolarHBondContact OE1-CG 3.32Å; E322-R366 VanDerWaalsContact CD-CZ 3.43Å; E322-R366 IonicContact OE1-CZ 2.98Å; E322-R366 IonicContact OE1-NE 2.76Å; E322-R366 PolarHBondContact OE1-NE 2.87Å; E322-R366 IonicContact OE1-NH1 3.85Å; E322-R366 IonicContact OE1-NH2 3.02Å; E322-R366 PolarHBondContact OE1-NH2 3.44Å; E322-R366 IonicContact OE2-CZ 3.22Å; E322-R366 VanDerWaalsContact OE2-CZ 3.22Å; E322-R366 IonicContact OE2-NE 2.9Å; E322-R366 PolarHBondContact OE2-NE 2.89Å; E322-R366 IonicContact OE2-NH2 2.76Å; E322-R366 PolarHBondContact OE2-NH2 2.85Å
323	S	95.5	Very high	95	Very high	81 Å²	81	70.4 Å²	70.4	57%	0.566	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	122.7	173	-173.3	0	0	0	0	110.5	V325 N353 D354	S323-V325 PolarHBondContact O-N 2.87Å; S323-N353 CarbonylContact O-C 3.55Å; S323-N353 VanDerWaalsContact O-CA 3.31Å; S323-N353 WeakPolarHBondContact O-CA 3.4Å; S323-D354 PolarHBondContact N-O 3.24Å; S323-D354 PolarHBondContact O-N 2.96Å
324	N	96.9	Very high	95.3	Very high	70 Å²	70	66.1 Å²	66.1	37%	0.374	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	115.4	173.1	-177.3	-113.2	0	0	0	110.8	L326 R351 L352 N353	N324-L326 PolarHBondContact ND2-O 3.3Å; N324-R351 WeakPolarHBondContact ND2-CB 3.35Å; N324-L352 PolarHBondContact ND2-O 3.05Å; N324-N353 PolarHBondContact ND2-OD1 3.48Å
325	V	97.2	Very high	95.6	Very high	58 Å²	58	61.2 Å²	61.2	35%	0.352	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	-43.5	-179.4	-177.6	0	0	0	0	111.1	S323 L352 D354	S323-V325 PolarHBondContact O-N 2.87Å; V325-L352 HydrophobicContact CB-CB 4.49Å; V325-L352 HydrophobicContact CB-CD2 4.38Å; V325-L352 HydrophobicContact CB-CG 4.2Å; V325-L352 WeakPolarHBondContact CB-O 3.46Å; V325-L352 HydrophobicContact CG1-CD2 4.33Å; V325-L352 HydrophobicContact CG2-CG 4.39Å; V325-L352 PolarHBondContact N-O 3.38Å; V325-D354 HydrophobicContact CG2-CB 4.01Å; V325-D354 WeakPolarHBondContact CG2-OD2 3.41Å
326	L	97.5	Very high	95.8	Very high	34 Å²	34	57.2 Å²	57.2	18%	0.178	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	141.9	-172.2	177.6	64.5	0	0	0	109	N324 I328 R351 L352 Q423 L424	N324-L326 PolarHBondContact ND2-O 3.3Å; L326-I328 HydrophobicContact CD1-CG2 3.78Å; L326-I328 HydrophobicContact CD2-CG2 4.21Å; L326-I328 HydrophobicContact CG-CG2 3.91Å; L326-R351 WeakPolarHBondContact O-CA 3.44Å; L326-L352 HydrophobicContact CB-CB 4.32Å; L326-L352 PolarHBondContact N-O 2.89Å; L326-L352 PolarHBondContact O-N 3.34Å; L326-Q423 HydrophobicContact CD1-CB 4.41Å; L326-Q423 HydrophobicContact CD2-CB 4.26Å; L326-L424 HydrophobicContact CD2-CB 3.9Å; L326-L424 HydrophobicContact CD2-CD1 4.08Å
327	Q	98.1	Very high	95.9	Very high	88 Å²	88	59.5 Å²	59.5	41%	0.411	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	118.7	175.2	-173.6	178.6	-110.1	0	0	109.5	L349 L350 R351	Q327-L349 VanDerWaalsContact CD-CD2 3.49Å; Q327-L349 HydrophobicContact CG-CD1 3.75Å; Q327-L349 HydrophobicContact CG-CD2 3.89Å; Q327-L349 HydrophobicContact CG-CG 3.63Å; Q327-L349 VanDerWaalsContact OE1-CD2 3.29Å; Q327-L350 CarbonylContact C-O 3.59Å; Q327-L350 WeakPolarHBondContact CA-O 3.26Å; Q327-R351 HydrophobicContact CB-CG 4.43Å; Q327-R351 HydrophobicContact CG-CG 4.02Å
328	I	98.5	Very high	96.2	Very high	6 Å²	6	63.2 Å²	63.2	3%	0.031	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	152.8	-176.8	66.5	166.7	0	0	0	111.7	L326 C330 L350 A416 D420 L424	L326-I328 HydrophobicContact CD1-CG2 3.78Å; L326-I328 HydrophobicContact CD2-CG2 4.21Å; L326-I328 HydrophobicContact CG-CG2 3.91Å; I328-C330 HydrophobicContact CD1-CB 4.21Å; I328-C330 HydrophobicContact CG1-CB 4.44Å; I328-L350 HydrophobicContact CD1-CD2 4.27Å; I328-L350 HydrophobicContact CG1-CB 4.15Å; I328-L350 HydrophobicContact CG1-CD2 4.31Å; I328-L350 PolarHBondContact N-O 2.86Å; I328-L350 PolarHBondContact O-N 2.64Å; I328-A416 HydrophobicContact CD1-CB 3.99Å; I328-D420 HydrophobicContact CB-CB 4.06Å; I328-D420 HydrophobicContact CD1-CB 4.05Å; I328-D420 HydrophobicContact CG2-CB 3.79Å; I328-L424 HydrophobicContact CD1-CB 4.28Å; I328-L424 HydrophobicContact CD1-CD2 3.8Å
329	Q	98.4	Very high	96.4	Very high	134 Å²	134	63.7 Å²	63.7	63%	0.626	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	124.3	166.6	-70.1	-174.8	51.3	0	0	109.5	G348 L349	Q329-G348 WeakPolarHBondContact CA-O 3.27Å; Q329-L349 HydrophobicContact CG-CD1 4Å
330	C	98.6	Very high	96.6	Very high	6 Å²	6	69.1 Å²	69.1	4%	0.041	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	173.1	-177.9	71.4	0	0	0	0	112.4	I328 R347 G348 L350 M369 I414 S415 A416	I328-C330 HydrophobicContact CD1-CB 4.21Å; I328-C330 HydrophobicContact CG1-CB 4.44Å; C330-R347 WeakPolarHBondContact O-CA 3.5Å; C330-G348 PolarHBondContact N-O 3.17Å; C330-G348 PolarHBondContact O-N 2.97Å; C330-L350 WeakPolarHBondContact SG-CB 3.4Å; C330-M369 WeakPolarHBondContact O-CE 3.47Å; C330-M369 WeakPolarHBondContact SG-CE 3.37Å; C330-I414 HydrophobicContact CB-CG2 4Å; C330-S415 CarbonylContact C-O 3.56Å; C330-S415 VanDerWaalsContact CA-O 3.31Å; C330-S415 WeakPolarHBondContact CA-O 3.45Å; C330-S415 VanDerWaalsContact CB-O 3.26Å; C330-S415 WeakPolarHBondContact CB-O 3.24Å; C330-A416 HydrophobicContact CB-CB 3.95Å
331	K	98.7	Very high	97	Very high	45 Å²	45	65 Å²	65	20%	0.196	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	129.5	172	-177.8	172.6	174.6	159.5	0	108.9	F333 E344 S415	K331-F333 HydrophobicContact CB-CE2 4.31Å; K331-F333 HydrophobicContact CD-CE1 4.27Å; K331-F333 HydrophobicContact CD-CE2 3.92Å; K331-F333 HydrophobicContact CD-CZ 3.58Å; K331-F333 VanDerWaalsContact CE-CE1 3.46Å; K331-F333 HydrophobicContact CG-CD2 4.39Å; K331-F333 HydrophobicContact CG-CE2 3.75Å; K331-F333 HydrophobicContact CG-CZ 3.92Å; K331-E344 WeakPolarHBondContact CE-OE1 3.35Å; K331-E344 VanDerWaalsContact CE-OE2 3.3Å; K331-E344 WeakPolarHBondContact CE-OE2 3.32Å; K331-E344 IonicContact NZ-OE1 2.7Å; K331-E344 PolarHBondContact NZ-OE1 2.95Å; K331-E344 IonicContact NZ-OE2 2.64Å; K331-E344 PolarHBondContact NZ-OE2 2.92Å; K331-S415 PolarHBondContact N-O 2.69Å; K331-S415 PolarHBondContact O-N 3.03Å
332	L	98.6	Very high	97.3	Very high	0 Å²	0	65 Å²	65	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	136.9	179.6	-174.3	67.7	0	0	0	110.1	R345 G346 M369 I378 L379 F412 I414	L332-R345 HydrophobicContact CB-CB 4.29Å; L332-R345 HydrophobicContact CD2-CB 4.13Å; L332-R345 HydrophobicContact CD2-CG 3.81Å; L332-R345 HydrophobicContact CG-CB 4.04Å; L332-R345 HydrophobicContact CG-CG 4.28Å; L332-R345 PolarHBondContact O-N 3.04Å; L332-G346 PolarHBondContact N-O 2.9Å; L332-G346 PolarHBondContact O-N 2.98Å; L332-M369 HydrophobicContact CB-CE 4.08Å; L332-M369 HydrophobicContact CB-SD 3.62Å; L332-M369 HydrophobicContact CD2-SD 4Å; L332-M369 HydrophobicContact CG-SD 4.32Å; L332-I378 HydrophobicContact CD2-CD1 4.27Å; L332-I378 HydrophobicContact CD2-CG1 4.47Å; L332-L379 HydrophobicContact CD1-CD2 4.39Å; L332-L379 HydrophobicContact CD2-CB 3.88Å; L332-L379 HydrophobicContact CD2-CD2 4.37Å; L332-F412 HydrophobicContact CD1-CB 4.03Å; L332-F412 HydrophobicContact CD1-CD1 3.87Å; L332-F412 HydrophobicContact CD1-CG 4.34Å; L332-F412 HydrophobicContact CD2-CD1 4.18Å; L332-F412 HydrophobicContact CD2-CE1 4.4Å; L332-F412 HydrophobicContact CG-CD1 4.05Å; L332-I414 HydrophobicContact CD1-CG1 3.85Å
333	F	98.5	Very high	97.5	Very high	41 Å²	41	66.8 Å²	66.8	18%	0.18	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	151.1	169.8	-51.3	-105.7	0	0	0	109.2	K331 W342 V343 E344 F412 L413	K331-F333 HydrophobicContact CB-CE2 4.31Å; K331-F333 HydrophobicContact CD-CE1 4.27Å; K331-F333 HydrophobicContact CD-CE2 3.92Å; K331-F333 HydrophobicContact CD-CZ 3.58Å; K331-F333 VanDerWaalsContact CE-CE1 3.46Å; K331-F333 HydrophobicContact CG-CD2 4.39Å; K331-F333 HydrophobicContact CG-CE2 3.75Å; K331-F333 HydrophobicContact CG-CZ 3.92Å; F333-W342 HydrophobicContact CB-CB 4.25Å; F333-W342 HydrophobicContact CB-CE3 3.99Å; F333-W342 HydrophobicContact CD1-CB 4.29Å; F333-V343 CarbonylContact C-O 3.57Å; F333-V343 WeakPolarHBondContact CA-O 3.49Å; F333-V343 WeakPolarHBondContact CB-O 3.37Å; F333-E344 HydrophobicContact CD1-CB 4.31Å; F333-E344 HydrophobicContact CE1-CB 4.48Å; F333-F412 CarbonylContact O-C 3.53Å; F333-F412 VanDerWaalsContact O-CA 3.22Å; F333-F412 WeakPolarHBondContact O-CA 3.33Å; F333-F412 WeakPolarHBondContact O-CB 3.47Å; F333-F412 WeakPolarHBondContact O-CD1 3.41Å; F333-L413 HydrophobicContact CB-CB 4.22Å; F333-L413 HydrophobicContact CD2-CB 4.35Å; F333-L413 HydrophobicContact CD2-CD2 4.35Å; F333-L413 PolarHBondContact N-O 3.3Å; F333-L413 PolarHBondContact O-N 3.14Å
334	V	97.8	Very high	97.6	Very high	23 Å²	23	68 Å²	68	14%	0.139	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	141.5	169	63.9	0	0	0	0	108.5	D336 V343 K410 F412	V334-D336 PolarHBondContact O-N 2.95Å; V334-V343 HydrophobicContact CG1-CB 4.22Å; V334-V343 PolarHBondContact N-O 2.96Å; V334-V343 PolarHBondContact O-N 2.84Å; V334-K410 HydrophobicContact CG2-CB 4.07Å; V334-K410 HydrophobicContact CG2-CD 3.82Å; V334-F412 HydrophobicContact CB-CD1 3.92Å; V334-F412 HydrophobicContact CB-CE1 3.84Å; V334-F412 HydrophobicContact CG2-CD1 4.16Å; V334-F412 HydrophobicContact CG2-CE1 3.88Å; V334-F412 HydrophobicContact CG2-CZ 4.14Å
335	F	98	Very high	97.5	Very high	62 Å²	62	67 Å²	67	27%	0.272	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	115.6	173.8	-171.5	-102.1	0	0	0	109.5	Q340 W342 V411	F335-Q340 HydrophobicContact CZ-CB 4.32Å; F335-W342 HydrophobicContact CB-CE3 3.93Å; F335-W342 HydrophobicContact CB-CH2 4.11Å; F335-W342 HydrophobicContact CB-CZ3 3.68Å; F335-W342 HydrophobicContact CD2-CD2 4.15Å; F335-W342 HydrophobicContact CD2-CE3 4.36Å; F335-W342 HydrophobicContact CD2-CZ2 4.33Å; F335-V411 HydrophobicContact CB-CB 4.19Å; F335-V411 PolarHBondContact N-O 2.8Å
336	D	96.2	Very high	97.6	Very high	51 Å²	51	64.7 Å²	64.7	27%	0.273	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	115.7	170.3	168.1	33.4	0	0	0	109.6	V334 T338 S339 Q340 S341 V343	V334-D336 PolarHBondContact O-N 2.95Å; D336-T338 PolarHBondContact O-N 2.97Å; D336-T338 VanDerWaalsContact OD1-CB 3.26Å; D336-T338 WeakPolarHBondContact OD1-CB 3.22Å; D336-T338 PolarHBondContact OD1-N 2.75Å; D336-T338 PolarHBondContact OD1-OG1 2.92Å; D336-S339 WeakPolarHBondContact OD2-CB 3.48Å; D336-S339 PolarHBondContact OD2-N 2.91Å; D336-S339 PolarHBondContact OD2-OG 3.4Å; D336-Q340 VanDerWaalsContact O-CA 3.32Å; D336-Q340 WeakPolarHBondContact O-CA 3.45Å; D336-Q340 PolarHBondContact O-N 3.48Å; D336-S341 PolarHBondContact N-O 2.93Å; D336-S341 PolarHBondContact O-N 3.19Å; D336-V343 HydrophobicContact CB-CG2 3.82Å
337	K	95	Very high	97.6	Very high	171 Å²	171	70.3 Å²	70.3	74%	0.743	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-25	177.2	-171	-178.7	178.2	-175.4	0	112.4	Q340	K337-Q340 PolarHBondContact O-NE2 2.93Å
338	T	96.3	Very high	97.6	Very high	132 Å²	132	66.3 Å²	66.3	81%	0.81	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-51.8	-176.4	-35.9	0	0	0	0	111.3	D336 Q340	D336-T338 PolarHBondContact O-N 2.97Å; D336-T338 VanDerWaalsContact OD1-CB 3.26Å; D336-T338 WeakPolarHBondContact OD1-CB 3.22Å; D336-T338 PolarHBondContact OD1-N 2.75Å; D336-T338 PolarHBondContact OD1-OG1 2.92Å; T338-Q340 VanDerWaalsContact C-N 3.35Å
339	S	96.3	Very high	97.6	Very high	63 Å²	63	69 Å²	69	44%	0.441	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-6.6	175.6	61.4	0	0	0	0	114.4	D336 S341	D336-S339 WeakPolarHBondContact OD2-CB 3.48Å; D336-S339 PolarHBondContact OD2-N 2.91Å; D336-S339 PolarHBondContact OD2-OG 3.4Å; S339-S341 PolarHBondContact O-N 3.37Å; S339-S341 PolarHBondContact OG-OG 2.87Å
340	Q	97.1	Very high	97.6	Very high	127 Å²	127	62.7 Å²	62.7	59%	0.593	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	37.1	-172	-67.1	-70.8	-56.2	0	0	112.4	F335 D336 K337 T338	F335-Q340 HydrophobicContact CZ-CB 4.32Å; D336-Q340 VanDerWaalsContact O-CA 3.32Å; D336-Q340 WeakPolarHBondContact O-CA 3.45Å; D336-Q340 PolarHBondContact O-N 3.48Å; K337-Q340 PolarHBondContact O-NE2 2.93Å; T338-Q340 VanDerWaalsContact C-N 3.35Å
341	S	97.7	Very high	97.6	Very high	48 Å²	48	65.8 Å²	65.8	34%	0.336	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	160.6	-170.1	84	0	0	0	0	113.5	D336 S339	D336-S341 PolarHBondContact N-O 2.93Å; D336-S341 PolarHBondContact O-N 3.19Å; S339-S341 PolarHBondContact O-N 3.37Å; S339-S341 PolarHBondContact OG-OG 2.87Å
342	W	98.1	Very high	97.6	Very high	96 Å²	96	63.7 Å²	63.7	36%	0.364	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	109.1	176	-68.5	107.1	0	0	0	110.8	F333 F335 R398 V411 L413	F333-W342 HydrophobicContact CB-CB 4.25Å; F333-W342 HydrophobicContact CB-CE3 3.99Å; F333-W342 HydrophobicContact CD1-CB 4.29Å; F335-W342 HydrophobicContact CB-CE3 3.93Å; F335-W342 HydrophobicContact CB-CH2 4.11Å; F335-W342 HydrophobicContact CB-CZ3 3.68Å; F335-W342 HydrophobicContact CD2-CD2 4.15Å; F335-W342 HydrophobicContact CD2-CE3 4.36Å; F335-W342 HydrophobicContact CD2-CZ2 4.33Å; W342-R398 HydrophobicContact CH2-CG 4.34Å; W342-V411 HydrophobicContact CH2-CG1 3.93Å; W342-V411 HydrophobicContact CZ3-CG1 4.47Å; W342-L413 HydrophobicContact CD2-CB 4.27Å; W342-L413 HydrophobicContact CD2-CD2 4.43Å; W342-L413 HydrophobicContact CE3-CB 3.81Å; W342-L413 HydrophobicContact CH2-CB 3.79Å; W342-L413 HydrophobicContact CH2-CD1 4.46Å; W342-L413 HydrophobicContact CZ2-CB 4.25Å; W342-L413 HydrophobicContact CZ2-CD1 4.42Å; W342-L413 HydrophobicContact CZ3-CB 3.56Å
343	V	97.7	Very high	97.6	Very high	66 Å²	66	63.9 Å²	63.9	40%	0.4	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	130.2	175.7	-177.7	0	0	0	0	109.3	F333 V334 D336 R345	F333-V343 CarbonylContact C-O 3.57Å; F333-V343 WeakPolarHBondContact CA-O 3.49Å; F333-V343 WeakPolarHBondContact CB-O 3.37Å; V334-V343 HydrophobicContact CG1-CB 4.22Å; V334-V343 PolarHBondContact N-O 2.96Å; V334-V343 PolarHBondContact O-N 2.84Å; D336-V343 HydrophobicContact CB-CG2 3.82Å; V343-R345 PolarHBondContact O-N 2.87Å
344	E	97.5	Very high	97.5	Very high	106 Å²	106	62.8 Å²	62.8	50%	0.495	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	119.4	174.6	170.9	165.3	-156.9	0	0	110.7	K331 F333	K331-E344 WeakPolarHBondContact CE-OE1 3.35Å; K331-E344 VanDerWaalsContact CE-OE2 3.3Å; K331-E344 WeakPolarHBondContact CE-OE2 3.32Å; K331-E344 IonicContact NZ-OE1 2.7Å; K331-E344 PolarHBondContact NZ-OE1 2.95Å; K331-E344 IonicContact NZ-OE2 2.64Å; K331-E344 PolarHBondContact NZ-OE2 2.92Å; F333-E344 HydrophobicContact CD1-CB 4.31Å; F333-E344 HydrophobicContact CE1-CB 4.48Å
345	R	96.4	Very high	97.2	Very high	49 Å²	49	65.5 Å²	65.5	19%	0.185	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-32.8	176.9	-174.8	60	171.5	141.5	2.4	111.8	L332 V343 I378 D403 E405	L332-R345 HydrophobicContact CB-CB 4.29Å; L332-R345 HydrophobicContact CD2-CB 4.13Å; L332-R345 HydrophobicContact CD2-CG 3.81Å; L332-R345 HydrophobicContact CG-CB 4.04Å; L332-R345 HydrophobicContact CG-CG 4.28Å; L332-R345 PolarHBondContact O-N 3.04Å; V343-R345 PolarHBondContact O-N 2.87Å; R345-I378 HydrophobicContact CG-CB 4.31Å; R345-D403 IonicContact NH2-OD1 3.93Å; R345-E405 IonicContact CZ-OE1 3.24Å; R345-E405 VanDerWaalsContact CZ-OE1 3.24Å; R345-E405 IonicContact CZ-OE2 3.42Å; R345-E405 IonicContact NH1-OE1 2.78Å; R345-E405 PolarHBondContact NH1-OE1 3.06Å; R345-E405 IonicContact NH1-OE2 3.02Å; R345-E405 PolarHBondContact NH1-OE2 3.39Å; R345-E405 IonicContact NH2-OE1 2.81Å; R345-E405 PolarHBondContact NH2-OE1 3.45Å; R345-E405 IonicContact NH2-OE2 3.33Å; R345-E405 PolarHBondContact NH2-OE2 3.07Å
346	G	97.6	Very high	96.4	Very high	11 Å²	11	66.6 Å²	66.6	11%	0.113	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.6	173.7	169.8	0	0	0	0	0	114.1	L332	L332-G346 PolarHBondContact N-O 2.9Å; L332-G346 PolarHBondContact O-N 2.98Å
347	R	98.5	Very high	95.4	Very high	152 Å²	152	65.2 Å²	65.2	57%	0.574	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	140.1	172.6	178.7	-175.3	-68.9	-177.4	-2.5	109.8	C330 T371 Q372	C330-R347 WeakPolarHBondContact O-CA 3.5Å; R347-T371 WeakPolarHBondContact O-CA 3.44Å; R347-Q372 PolarHBondContact O-N 3.17Å
348	G	98.4	Very high	94.1	Very high	4 Å²	4	63.5 Å²	63.5	4%	0.041	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.9	-146.4	174.4	0	0	0	0	0	113.3	Q329 C330 R370	Q329-G348 WeakPolarHBondContact CA-O 3.27Å; C330-G348 PolarHBondContact N-O 3.17Å; C330-G348 PolarHBondContact O-N 2.97Å; G348-R370 CarbonylContact C-O 3.56Å; G348-R370 WeakPolarHBondContact CA-O 3.12Å
349	L	98.2	Very high	92.9	Very high	61 Å²	61	63.9 Å²	63.9	32%	0.319	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	119.8	-172.1	-157.2	67.2	0	0	0	108.8	Q327 Q329 M369 R370	Q327-L349 VanDerWaalsContact CD-CD2 3.49Å; Q327-L349 HydrophobicContact CG-CD1 3.75Å; Q327-L349 HydrophobicContact CG-CD2 3.89Å; Q327-L349 HydrophobicContact CG-CG 3.63Å; Q327-L349 VanDerWaalsContact OE1-CD2 3.29Å; Q329-L349 HydrophobicContact CG-CD1 4Å; L349-M369 WeakPolarHBondContact O-CA 3.17Å; L349-M369 WeakPolarHBondContact O-CG 3.26Å; L349-R370 PolarHBondContact N-O 3.18Å; L349-R370 PolarHBondContact O-N 2.92Å
350	L	98.6	Very high	91.9	Very high	2 Å²	2	65.8 Å²	65.8	1%	0.01	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	132.7	173.6	175	72.4	0	0	0	109	Q327 I328 C330 L367 M369 L379 I414 L424	Q327-L350 CarbonylContact C-O 3.59Å; Q327-L350 WeakPolarHBondContact CA-O 3.26Å; I328-L350 HydrophobicContact CD1-CD2 4.27Å; I328-L350 HydrophobicContact CG1-CB 4.15Å; I328-L350 HydrophobicContact CG1-CD2 4.31Å; I328-L350 PolarHBondContact N-O 2.86Å; I328-L350 PolarHBondContact O-N 2.64Å; C330-L350 WeakPolarHBondContact SG-CB 3.4Å; L350-L367 HydrophobicContact CD1-CB 4.28Å; L350-L367 HydrophobicContact CD1-CD2 4.12Å; L350-L367 HydrophobicContact CD2-CD2 4.45Å; L350-L367 HydrophobicContact CG-CD2 4.37Å; L350-M369 HydrophobicContact CB-CB 4.45Å; L350-M369 HydrophobicContact CB-CG 4.09Å; L350-M369 HydrophobicContact CB-SD 4.39Å; L350-M369 HydrophobicContact CD1-CB 3.77Å; L350-M369 HydrophobicContact CD1-CG 4.26Å; L350-L379 HydrophobicContact CD1-CD2 4.31Å; L350-I414 HydrophobicContact CD2-CD1 3.9Å; L350-I414 HydrophobicContact CD2-CG2 3.99Å; L350-L424 HydrophobicContact CD2-CD1 4.41Å; L350-L424 HydrophobicContact CD2-CD2 3.63Å
351	R	98.3	Very high	91	Very high	72 Å²	72	63 Å²	63	27%	0.272	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	140.2	176.3	-70.6	176.9	175.6	175.3	-7	110.1	E319 N324 L326 Q327 L367 V368	E319-R351 WeakPolarHBondContact OE2-CD 3.46Å; E319-R351 IonicContact OE2-CZ 2.62Å; E319-R351 IonicContact OE2-NE 3.42Å; E319-R351 IonicContact OE2-NH1 2.94Å; E319-R351 PolarHBondContact OE2-NH1 2.86Å; N324-R351 WeakPolarHBondContact ND2-CB 3.35Å; L326-R351 WeakPolarHBondContact O-CA 3.44Å; Q327-R351 HydrophobicContact CB-CG 4.43Å; Q327-R351 HydrophobicContact CG-CG 4.02Å; R351-L367 WeakPolarHBondContact O-CA 3.23Å; R351-V368 HydrophobicContact CB-CB 4.49Å; R351-V368 PolarHBondContact N-O 2.7Å; R351-V368 PolarHBondContact O-N 2.86Å
352	L	98.5	Very high	90.3	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.005	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	117.5	159.1	174.2	60.6	0	0	0	107	N324 V325 L326 L367 L383 A427 L428	N324-L352 PolarHBondContact ND2-O 3.05Å; V325-L352 HydrophobicContact CB-CB 4.49Å; V325-L352 HydrophobicContact CB-CD2 4.38Å; V325-L352 HydrophobicContact CB-CG 4.2Å; V325-L352 WeakPolarHBondContact CB-O 3.46Å; V325-L352 HydrophobicContact CG1-CD2 4.33Å; V325-L352 HydrophobicContact CG2-CG 4.39Å; V325-L352 PolarHBondContact N-O 3.38Å; L326-L352 HydrophobicContact CB-CB 4.32Å; L326-L352 PolarHBondContact N-O 2.89Å; L326-L352 PolarHBondContact O-N 3.34Å; L352-L367 HydrophobicContact CB-CD2 4.03Å; L352-L367 HydrophobicContact CD1-CD2 4.1Å; L352-L383 HydrophobicContact CD1-CD1 4.26Å; L352-A427 HydrophobicContact CD2-CB 3.59Å; L352-L428 HydrophobicContact CD1-CD2 4.08Å; L352-L428 HydrophobicContact CD2-CD2 4.43Å
353	N	98	Very high	89.9	Confident	3 Å²	3	62 Å²	62	2%	0.016	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	142.6	179.5	-68.1	-1.1	0	0	0	109.9	E322 S323 N324 S365 R366	E322-N353 HydrophobicContact CB-CB 4Å; E322-N353 WeakPolarHBondContact OE2-CB 3.33Å; E322-N353 PolarHBondContact OE2-ND2 2.76Å; S323-N353 CarbonylContact O-C 3.55Å; S323-N353 VanDerWaalsContact O-CA 3.31Å; S323-N353 WeakPolarHBondContact O-CA 3.4Å; N324-N353 PolarHBondContact ND2-OD1 3.48Å; N353-S365 CarbonylContact O-C 3.59Å; N353-S365 VanDerWaalsContact O-CA 3.28Å; N353-S365 WeakPolarHBondContact O-CA 3.5Å; N353-R366 HydrophobicContact CB-CG 4.44Å; N353-R366 PolarHBondContact N-O 2.72Å; N353-R366 PolarHBondContact O-N 2.81Å
354	D	97.1	Very high	89.8	Confident	19 Å²	19	61.9 Å²	61.9	10%	0.102	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	132.9	172.9	-74.5	-13.6	0	0	0	110.3	S323 V325 L363 S365 R431	S323-D354 PolarHBondContact N-O 3.24Å; S323-D354 PolarHBondContact O-N 2.96Å; V325-D354 HydrophobicContact CG2-CB 4.01Å; V325-D354 WeakPolarHBondContact CG2-OD2 3.41Å; D354-L363 HydrophobicContact CB-CD1 3.85Å; D354-L363 HydrophobicContact CB-CG 4.41Å; D354-S365 VanDerWaalsContact OD1-CB 3.28Å; D354-S365 WeakPolarHBondContact OD1-CB 3.31Å; D354-S365 PolarHBondContact OD1-OG 3.04Å; D354-R431 IonicContact OD1-CZ 3.18Å; D354-R431 IonicContact OD1-NE 3.47Å; D354-R431 PolarHBondContact OD1-NE 3.44Å; D354-R431 IonicContact OD1-NH2 2.72Å; D354-R431 IonicContact OD2-CZ 3.71Å; D354-R431 IonicContact OD2-NE 2.72Å; D354-R431 PolarHBondContact OD2-NE 2.9Å; D354-R431 IonicContact OD2-NH2 3.33Å; D354-R431 PolarHBondContact OD2-NH2 3.09Å
355	M	91	Very high	89.8	Confident	79 Å²	79	57.1 Å²	57.1	39%	0.389	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	125.2	166.6	-63.3	171.5	75.2	0	0	108.1	E322 S357 Q364	E322-M355 HydrophobicContact CB-CG 4.35Å; E322-M355 HydrophobicContact CG-CG 3.78Å; E322-M355 VanDerWaalsContact OE1-CG 3.31Å; E322-M355 WeakPolarHBondContact OE1-CG 3.32Å; M355-S357 PolarHBondContact O-N 2.76Å; M355-Q364 HydrophobicContact CB-CB 4.39Å; M355-Q364 PolarHBondContact N-O 3.02Å; M355-Q364 PolarHBondContact O-N 3.02Å
356	A	81.3	Confident	89.8	Confident	85 Å²	85	57.1 Å²	57.1	70%	0.702	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	121.8	162.1	0	0	0	0	0	108.1	T358	A356-T358 PolarHBondContact O-N 3.37Å
357	S	75.4	Confident	89.8	Confident	23 Å²	23	56.6 Å²	56.6	16%	0.161	32%	0.315	C	S	.	.			trans	-65.9	125.2	167.8	173.6	0	0	0	0	109	M355 D359 G361 T362	M355-S357 PolarHBondContact O-N 2.76Å; S357-D359 PolarHBondContact O-N 3.32Å; S357-G361 PolarHBondContact O-N 3.09Å; S357-T362 WeakPolarHBondContact CB-O 3.43Å; S357-T362 PolarHBondContact N-O 2.7Å
358	T	67.7	Low	89.8	Confident	134 Å²	134	49.6 Å²	49.6	82%	0.822	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-31.4	178.9	-43.6	0	0	0	0	112.6	A356	A356-T358 PolarHBondContact O-N 3.37Å
359	D	70.8	Confident	89.8	Confident	140 Å²	140	49.4 Å²	49.4	75%	0.749	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-49.9	-163.3	-45.8	-55.6	0	0	0	112.3	S357	S357-D359 PolarHBondContact O-N 3.32Å
360	D	76.8	Confident	89.7	Confident	104 Å²	104	49.8 Å²	49.8	56%	0.556	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-9	-177.8	-68.4	-5.5	0	0	0	113.1	T362 R438	D360-T362 HydrophobicContact CB-CG2 3.58Å; D360-T362 WeakPolarHBondContact CB-OG1 3.19Å; D360-T362 PolarHBondContact O-N 3.48Å; D360-R438 IonicContact OD2-CZ 3.65Å; D360-R438 IonicContact OD2-NH1 2.68Å; D360-R438 IonicContact OD2-NH2 3.68Å; D360-R438 PolarHBondContact OD2-NH2 3.31Å
361	G	76.8	Confident	89.7	Confident	69 Å²	69	50.6 Å²	50.6	71%	0.711	29%	0.29	S	S	*	.			trans	65.2	11.1	-165.5	0	0	0	0	0	114.1	S357	S357-G361 PolarHBondContact O-N 3.09Å
362	T	84.7	Confident	89.6	Confident	31 Å²	31	53.5 Å²	53.5	19%	0.19	31%	0.306	C	S	.	.			trans	-86.6	137.1	-171.8	59.9	0	0	0	0	112.5	S357 D360 Q364 R438	S357-T362 WeakPolarHBondContact CB-O 3.43Å; S357-T362 PolarHBondContact N-O 2.7Å; D360-T362 HydrophobicContact CB-CG2 3.58Å; D360-T362 WeakPolarHBondContact CB-OG1 3.19Å; D360-T362 PolarHBondContact O-N 3.48Å; T362-Q364 PolarHBondContact O-N 3.36Å; T362-R438 PolarHBondContact OG1-NH1 3.48Å
363	L	89.7	Confident	89.5	Confident	91 Å²	91	56.3 Å²	56.3	48%	0.476	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	117.6	179.7	-164.3	70	0	0	0	110	D354	D354-L363 HydrophobicContact CB-CD1 3.85Å; D354-L363 HydrophobicContact CB-CG 4.41Å
364	Q	94.1	Very high	89.4	Confident	63 Å²	63	58.3 Å²	58.3	29%	0.294	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	133.4	169.3	-57.9	-165.8	23	0	0	109	M355 T362	M355-Q364 HydrophobicContact CB-CB 4.39Å; M355-Q364 PolarHBondContact N-O 3.02Å; M355-Q364 PolarHBondContact O-N 3.02Å; T362-Q364 PolarHBondContact O-N 3.36Å
365	S	97	Very high	89.3	Confident	7 Å²	7	63 Å²	63	5%	0.049	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	148.7	-177.3	-52.5	0	0	0	0	111.3	N353 D354 L383 R431	N353-S365 CarbonylContact O-C 3.59Å; N353-S365 VanDerWaalsContact O-CA 3.28Å; N353-S365 WeakPolarHBondContact O-CA 3.5Å; D354-S365 VanDerWaalsContact OD1-CB 3.28Å; D354-S365 WeakPolarHBondContact OD1-CB 3.31Å; D354-S365 PolarHBondContact OD1-OG 3.04Å; S365-L383 PolarHBondContact O-N 3.02Å; S365-R431 VanDerWaalsContact OG-CD 3.28Å; S365-R431 WeakPolarHBondContact OG-CD 3.36Å
366	R	97.1	Very high	89.5	Confident	49 Å²	49	66 Å²	66	19%	0.185	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	151.5	173.3	65.9	174.4	-173.2	-176.5	-1.2	113.2	G318 E322 N353 V368 T381	G318-R366 PolarHBondContact O-NH2 2.84Å; E322-R366 VanDerWaalsContact CD-CZ 3.43Å; E322-R366 IonicContact OE1-CZ 2.98Å; E322-R366 IonicContact OE1-NE 2.76Å; E322-R366 PolarHBondContact OE1-NE 2.87Å; E322-R366 IonicContact OE1-NH1 3.85Å; E322-R366 IonicContact OE1-NH2 3.02Å; E322-R366 PolarHBondContact OE1-NH2 3.44Å; E322-R366 IonicContact OE2-CZ 3.22Å; E322-R366 VanDerWaalsContact OE2-CZ 3.22Å; E322-R366 IonicContact OE2-NE 2.9Å; E322-R366 PolarHBondContact OE2-NE 2.89Å; E322-R366 IonicContact OE2-NH2 2.76Å; E322-R366 PolarHBondContact OE2-NH2 2.85Å; N353-R366 HydrophobicContact CB-CG 4.44Å; N353-R366 PolarHBondContact N-O 2.72Å; N353-R366 PolarHBondContact O-N 2.81Å; R366-V368 HydrophobicContact CG-CG2 4Å; R366-T381 CarbonylContact C-O 3.54Å; R366-T381 VanDerWaalsContact CA-O 3.24Å; R366-T381 WeakPolarHBondContact CA-O 3Å; R366-T381 WeakPolarHBondContact CB-O 3.46Å
367	L	98.3	Very high	90.2	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	127	168.8	-74.4	173.4	0	0	0	110	L350 R351 L352 L379 N380 T381 L383 I399 L424 L428	L350-L367 HydrophobicContact CD1-CB 4.28Å; L350-L367 HydrophobicContact CD1-CD2 4.12Å; L350-L367 HydrophobicContact CD2-CD2 4.45Å; L350-L367 HydrophobicContact CG-CD2 4.37Å; R351-L367 WeakPolarHBondContact O-CA 3.23Å; L352-L367 HydrophobicContact CB-CD2 4.03Å; L352-L367 HydrophobicContact CD1-CD2 4.1Å; L367-L379 HydrophobicContact CB-CD2 4.36Å; L367-N380 WeakPolarHBondContact O-CA 3.43Å; L367-T381 HydrophobicContact CB-CG2 3.85Å; L367-T381 HydrophobicContact CD1-CG2 4.46Å; L367-T381 PolarHBondContact N-O 2.73Å; L367-T381 PolarHBondContact O-N 2.93Å; L367-L383 HydrophobicContact CD1-CD2 4.37Å; L367-L383 HydrophobicContact CG-CD2 4.28Å; L367-I399 HydrophobicContact CD1-CD1 3.96Å; L367-L424 HydrophobicContact CD2-CD1 4.05Å; L367-L428 HydrophobicContact CD1-CD1 4.11Å; L367-L428 HydrophobicContact CD1-CD2 3.94Å; L367-L428 HydrophobicContact CD2-CD2 4.07Å; L367-L428 HydrophobicContact CG-CD2 4.02Å
368	V	97.8	Very high	91.2	Very high	5 Å²	5	63.9 Å²	63.9	3%	0.03	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	124.1	-179.8	-176.5	0	0	0	0	108.9	R351 R366 L377 L379	R351-V368 HydrophobicContact CB-CB 4.49Å; R351-V368 PolarHBondContact N-O 2.7Å; R351-V368 PolarHBondContact O-N 2.86Å; R366-V368 HydrophobicContact CG-CG2 4Å; V368-L377 HydrophobicContact CG1-CD1 3.65Å; V368-L379 WeakPolarHBondContact CA-O 3.28Å
369	M	98.1	Very high	92.6	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	129.3	178.1	-164.5	176.7	173.7	0	0	112.5	C330 L332 L349 L350 I378 L379	C330-M369 WeakPolarHBondContact O-CE 3.47Å; C330-M369 WeakPolarHBondContact SG-CE 3.37Å; L332-M369 HydrophobicContact CB-CE 4.08Å; L332-M369 HydrophobicContact CB-SD 3.62Å; L332-M369 HydrophobicContact CD2-SD 4Å; L332-M369 HydrophobicContact CG-SD 4.32Å; L349-M369 WeakPolarHBondContact O-CA 3.17Å; L349-M369 WeakPolarHBondContact O-CG 3.26Å; L350-M369 HydrophobicContact CB-CB 4.45Å; L350-M369 HydrophobicContact CB-CG 4.09Å; L350-M369 HydrophobicContact CB-SD 4.39Å; L350-M369 HydrophobicContact CD1-CB 3.77Å; L350-M369 HydrophobicContact CD1-CG 4.26Å; M369-I378 HydrophobicContact CB-CG1 4.15Å; M369-I378 HydrophobicContact CE-CD1 4.11Å; M369-I378 HydrophobicContact CG-CD1 4.16Å; M369-I378 HydrophobicContact CG-CG1 4.1Å; M369-I378 WeakPolarHBondContact O-CG1 3.49Å; M369-I378 PolarHBondContact O-N 2.89Å; M369-I378 HydrophobicContact SD-CD1 3.97Å; M369-I378 HydrophobicContact SD-CG1 4.41Å; M369-L379 HydrophobicContact CB-CB 3.78Å; M369-L379 PolarHBondContact N-O 3.45Å; M369-L379 PolarHBondContact O-N 3.46Å
370	R	97.2	Very high	93.9	Very high	69 Å²	69	53.8 Å²	53.8	26%	0.26	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	140.6	176.3	-64.4	177.1	-175.1	-97.4	5.4	110.9	T317 E319 G348 L349 R376 L377	T317-R370 PolarHBondContact O-NH2 3.33Å; E319-R370 IonicContact OE1-CZ 3.28Å; E319-R370 VanDerWaalsContact OE1-CZ 3.28Å; E319-R370 IonicContact OE1-NE 2.94Å; E319-R370 PolarHBondContact OE1-NE 3.26Å; E319-R370 IonicContact OE1-NH2 2.73Å; E319-R370 PolarHBondContact OE1-NH2 2.92Å; G348-R370 CarbonylContact C-O 3.56Å; G348-R370 WeakPolarHBondContact CA-O 3.12Å; L349-R370 PolarHBondContact N-O 3.18Å; L349-R370 PolarHBondContact O-N 2.92Å; R370-R376 CarbonylContact C-O 3.6Å; R370-R376 VanDerWaalsContact CA-O 3.31Å; R370-R376 WeakPolarHBondContact CA-O 3.44Å; R370-L377 HydrophobicContact CG-CD1 4.22Å
371	T	97.8	Very high	94.8	Very high	19 Å²	19	48.9 Å²	48.9	12%	0.117	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	145.4	177.4	50	0	0	0	0	112.4	R347 S374 L375 R376 I378	R347-T371 WeakPolarHBondContact O-CA 3.44Å; T371-S374 PolarHBondContact OG1-OG 2.81Å; T371-L375 VanDerWaalsContact O-CA 3.3Å; T371-L375 WeakPolarHBondContact O-CA 3.34Å; T371-L375 PolarHBondContact O-N 3.02Å; T371-L375 PolarHBondContact OG1-N 2.78Å; T371-R376 PolarHBondContact N-O 2.89Å; T371-R376 PolarHBondContact OG1-N 2.77Å; T371-R376 PolarHBondContact OG1-O 3.48Å; T371-I378 HydrophobicContact CG2-CD1 3.9Å; T371-I378 HydrophobicContact CG2-CG1 4.27Å; T371-I378 HydrophobicContact CG2-CG2 3.71Å
372	Q	96.9	Very high	95.8	Very high	132 Å²	132	51.3 Å²	51.3	62%	0.617	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	138.4	170.3	-166.7	173.1	26.4	0	0	110.3	R347 S374	R347-Q372 PolarHBondContact O-N 3.17Å; Q372-S374 VanDerWaalsContact C-N 3.32Å; Q372-S374 PolarHBondContact O-N 3.07Å; Q372-S374 VanDerWaalsContact O-N 3.09Å
373	G	95.8	Very high	96.4	Very high	60 Å²	60	50 Å²	50	62%	0.619	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	-62.5	179.5	0	0	0	0	0	113.6
374	S	95.6	Very high	96.7	Very high	45 Å²	45	48.8 Å²	48.8	32%	0.315	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-13.8	-178.1	54.4	0	0	0	0	115.3	F17 T371 Q372 R376	F17-S374 VanDerWaalsContact CZ-CA 3.47Å; T371-S374 PolarHBondContact OG1-OG 2.81Å; Q372-S374 VanDerWaalsContact C-N 3.32Å; Q372-S374 PolarHBondContact O-N 3.07Å; Q372-S374 VanDerWaalsContact O-N 3.09Å; S374-R376 PolarHBondContact O-N 3.18Å
375	L	95.4	Very high	96.8	Very high	118 Å²	118	46.3 Å²	46.3	62%	0.618	23%	0.233	S	C	*	.			trans	55	16	-179.3	-52.8	178.9	0	0	0	114.7	T371 L377	T371-L375 VanDerWaalsContact O-CA 3.3Å; T371-L375 WeakPolarHBondContact O-CA 3.34Å; T371-L375 PolarHBondContact O-N 3.02Å; T371-L375 PolarHBondContact OG1-N 2.78Å; L375-L377 PolarHBondContact O-N 3.21Å
376	R	95.4	Very high	96.7	Very high	143 Å²	143	51.4 Å²	51.4	54%	0.54	26%	0.256	S	S	.	.			trans	-65.2	129.4	177.9	175.4	174.4	170.9	170.5	-4.1	108.9	R370 T371 S374 I378 E405	R370-R376 CarbonylContact C-O 3.6Å; R370-R376 VanDerWaalsContact CA-O 3.31Å; R370-R376 WeakPolarHBondContact CA-O 3.44Å; T371-R376 PolarHBondContact N-O 2.89Å; T371-R376 PolarHBondContact OG1-N 2.77Å; T371-R376 PolarHBondContact OG1-O 3.48Å; S374-R376 PolarHBondContact O-N 3.18Å; R376-I378 HydrophobicContact CG-CG2 4.38Å; R376-I378 PolarHBondContact O-N 2.98Å; R376-E405 IonicContact CZ-OE1 3.91Å; R376-E405 IonicContact NH2-OE1 2.77Å; R376-E405 PolarHBondContact NH2-OE1 3.06Å
377	L	95.9	Very high	96.7	Very high	60 Å²	60	49.1 Å²	49.1	31%	0.314	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	126.1	172.1	-171.1	66	0	0	0	109.4	V368 R370 L375 L379 N380	V368-L377 HydrophobicContact CG1-CD1 3.65Å; R370-L377 HydrophobicContact CG-CD1 4.22Å; L375-L377 PolarHBondContact O-N 3.21Å; L377-L379 WeakPolarHBondContact CD1-O 3.3Å; L377-N380 HydrophobicContact CD1-CB 4.25Å; L377-N380 HydrophobicContact CD2-CB 3.99Å; L377-N380 HydrophobicContact CG-CB 4.29Å
378	I	96.6	Very high	96.7	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.015	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	-10.4	-178.2	55.6	164.2	0	0	0	113.9	L332 R345 M369 T371 R376	L332-I378 HydrophobicContact CD2-CD1 4.27Å; L332-I378 HydrophobicContact CD2-CG1 4.47Å; R345-I378 HydrophobicContact CG-CB 4.31Å; M369-I378 HydrophobicContact CB-CG1 4.15Å; M369-I378 HydrophobicContact CE-CD1 4.11Å; M369-I378 HydrophobicContact CG-CD1 4.16Å; M369-I378 HydrophobicContact CG-CG1 4.1Å; M369-I378 WeakPolarHBondContact O-CG1 3.49Å; M369-I378 PolarHBondContact O-N 2.89Å; M369-I378 HydrophobicContact SD-CD1 3.97Å; M369-I378 HydrophobicContact SD-CG1 4.41Å; T371-I378 HydrophobicContact CG2-CD1 3.9Å; T371-I378 HydrophobicContact CG2-CG1 4.27Å; T371-I378 HydrophobicContact CG2-CG2 3.71Å; R376-I378 HydrophobicContact CG-CG2 4.38Å; R376-I378 PolarHBondContact O-N 2.98Å
379	L	97.7	Very high	96.6	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	133	168.2	-173.2	67.1	0	0	0	108.2	L332 L350 L367 V368 M369 L377 T381 A401 F412	L332-L379 HydrophobicContact CD1-CD2 4.39Å; L332-L379 HydrophobicContact CD2-CB 3.88Å; L332-L379 HydrophobicContact CD2-CD2 4.37Å; L350-L379 HydrophobicContact CD1-CD2 4.31Å; L367-L379 HydrophobicContact CB-CD2 4.36Å; V368-L379 WeakPolarHBondContact CA-O 3.28Å; M369-L379 HydrophobicContact CB-CB 3.78Å; M369-L379 PolarHBondContact N-O 3.45Å; M369-L379 PolarHBondContact O-N 3.46Å; L377-L379 WeakPolarHBondContact CD1-O 3.3Å; L379-T381 HydrophobicContact CD1-CG2 4.14Å; L379-T381 HydrophobicContact CD2-CG2 4.35Å; L379-T381 HydrophobicContact CG-CG2 4.14Å; L379-A401 HydrophobicContact CD1-CB 3.96Å; L379-F412 HydrophobicContact CD1-CE1 4.37Å; L379-F412 HydrophobicContact CD1-CE2 4.41Å; L379-F412 HydrophobicContact CD1-CZ 4.25Å
380	N	96.8	Very high	96.6	Very high	62 Å²	62	58 Å²	58	33%	0.332	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	95.4	170.3	-175.9	8.9	0	0	0	107.5	L367 L377	L367-N380 WeakPolarHBondContact O-CA 3.43Å; L377-N380 HydrophobicContact CD1-CB 4.25Å; L377-N380 HydrophobicContact CD2-CB 3.99Å; L377-N380 HydrophobicContact CG-CB 4.29Å
381	T	97.2	Very high	96.6	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.006	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	123.4	-172.9	-171.9	0	0	0	0	110.1	R366 L367 L379 A401 T402	R366-T381 CarbonylContact C-O 3.54Å; R366-T381 VanDerWaalsContact CA-O 3.24Å; R366-T381 WeakPolarHBondContact CA-O 3Å; R366-T381 WeakPolarHBondContact CB-O 3.46Å; L367-T381 HydrophobicContact CB-CG2 3.85Å; L367-T381 HydrophobicContact CD1-CG2 4.46Å; L367-T381 PolarHBondContact N-O 2.73Å; L367-T381 PolarHBondContact O-N 2.93Å; L379-T381 HydrophobicContact CD1-CG2 4.14Å; L379-T381 HydrophobicContact CD2-CG2 4.35Å; L379-T381 HydrophobicContact CG-CG2 4.14Å; T381-A401 HydrophobicContact CG2-CB 3.72Å; T381-T402 PolarHBondContact OG1-N 2.94Å
382	K	96.4	Very high	96.6	Very high	119 Å²	119	60.9 Å²	60.9	52%	0.517	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	148.2	165.2	177.1	167	171.6	172.3	0	109	W384	K382-W384 VanDerWaalsContact O-CE3 3.28Å
383	L	97.3	Very high	96.6	Very high	3 Å²	3	57.1 Å²	57.1	2%	0.016	30%	0.301	C	S	.	.			trans	-82.2	143.7	170.5	-52.9	-172.9	0	0	0	110	L352 S365 L367 M387 L428 R431 L435	L352-L383 HydrophobicContact CD1-CD1 4.26Å; S365-L383 PolarHBondContact O-N 3.02Å; L367-L383 HydrophobicContact CD1-CD2 4.37Å; L367-L383 HydrophobicContact CG-CD2 4.28Å; L383-M387 HydrophobicContact CB-SD 4.33Å; L383-M387 HydrophobicContact CD2-CE 3.86Å; L383-M387 HydrophobicContact CD2-SD 3.53Å; L383-M387 VanDerWaalsContact CD2-SD 3.53Å; L383-M387 HydrophobicContact CG-SD 4.49Å; L383-L428 HydrophobicContact CD1-CD2 3.69Å; L383-L428 HydrophobicContact CD2-CD2 3.75Å; L383-L428 HydrophobicContact CG-CD2 4.39Å; L383-R431 HydrophobicContact CD1-CB 3.74Å; L383-L435 HydrophobicContact CB-CD1 3.94Å
384	W	95.9	Very high	96.8	Very high	66 Å²	66	60 Å²	60	25%	0.25	30%	0.298	C	S	.	.			trans	-133.1	160.3	176	67.1	98.1	0	0	0	111.2	K382 Q386 M387 T400 V409	K382-W384 VanDerWaalsContact O-CE3 3.28Å; W384-Q386 PolarHBondContact O-N 2.84Å; W384-M387 VanDerWaalsContact CD1-N 3.3Å; W384-M387 HydrophobicContact CD2-CB 3.8Å; W384-M387 HydrophobicContact CD2-CG 4.19Å; W384-M387 HydrophobicContact CE3-CB 4.31Å; W384-M387 HydrophobicContact CE3-CG 4.26Å; W384-M387 HydrophobicContact CE3-SD 4.39Å; W384-M387 HydrophobicContact CG-CB 4.09Å; W384-M387 HydrophobicContact CH2-CG 4.13Å; W384-M387 HydrophobicContact CZ2-CB 4.18Å; W384-M387 HydrophobicContact CZ2-CG 4.02Å; W384-M387 HydrophobicContact CZ3-CE 4.44Å; W384-M387 HydrophobicContact CZ3-CG 4.24Å; W384-M387 HydrophobicContact CZ3-SD 4.41Å; W384-M387 WeakPolarHBondContact O-CB 3.19Å; W384-M387 PolarHBondContact O-N 2.95Å; W384-M387 VanDerWaalsContact O-N 3.13Å; W384-T400 WeakPolarHBondContact CH2-O 3.31Å; W384-V409 HydrophobicContact CH2-CG1 4.19Å; W384-V409 HydrophobicContact CH2-CG2 4.48Å; W384-V409 HydrophobicContact CZ2-CG1 4.12Å
385	A	96	Very high	96.9	Very high	11 Å²	11	63.2 Å²	63.2	9%	0.091	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-49	-173.8	0	0	0	0	0	112.9	M387 L435 R436 A439	A385-M387 PolarHBondContact O-N 3.43Å; A385-L435 HydrophobicContact CB-CB 4.07Å; A385-R436 HydrophobicContact CB-CG 4.05Å; A385-R436 WeakPolarHBondContact O-CG 3.42Å; A385-R436 PolarHBondContact O-NE 2.8Å; A385-A439 HydrophobicContact CB-CB 4.01Å
386	Q	95.9	Very high	97	Very high	115 Å²	115	58.1 Å²	58.1	54%	0.537	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	8.4	-178.8	-59.3	80.1	1.4	0	0	113.8	W384 Q388	W384-Q386 PolarHBondContact O-N 2.84Å; Q386-Q388 PolarHBondContact O-N 3.04Å; Q386-Q388 PolarHBondContact O-NE2 2.88Å
387	M	97.4	Very high	97.2	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.255	C	S	.	.			trans	-58.9	126.1	178.9	-169.4	-177.2	-171.4	0	0	109.7	L383 W384 A385 I399 T400 I432 R436	L383-M387 HydrophobicContact CB-SD 4.33Å; L383-M387 HydrophobicContact CD2-CE 3.86Å; L383-M387 HydrophobicContact CD2-SD 3.53Å; L383-M387 VanDerWaalsContact CD2-SD 3.53Å; L383-M387 HydrophobicContact CG-SD 4.49Å; W384-M387 VanDerWaalsContact CD1-N 3.3Å; W384-M387 HydrophobicContact CD2-CB 3.8Å; W384-M387 HydrophobicContact CD2-CG 4.19Å; W384-M387 HydrophobicContact CE3-CB 4.31Å; W384-M387 HydrophobicContact CE3-CG 4.26Å; W384-M387 HydrophobicContact CE3-SD 4.39Å; W384-M387 HydrophobicContact CG-CB 4.09Å; W384-M387 HydrophobicContact CH2-CG 4.13Å; W384-M387 HydrophobicContact CZ2-CB 4.18Å; W384-M387 HydrophobicContact CZ2-CG 4.02Å; W384-M387 HydrophobicContact CZ3-CE 4.44Å; W384-M387 HydrophobicContact CZ3-CG 4.24Å; W384-M387 HydrophobicContact CZ3-SD 4.41Å; W384-M387 WeakPolarHBondContact O-CB 3.19Å; W384-M387 PolarHBondContact O-N 2.95Å; W384-M387 VanDerWaalsContact O-N 3.13Å; A385-M387 PolarHBondContact O-N 3.43Å; M387-I399 HydrophobicContact CE-CB 4.34Å; M387-I399 HydrophobicContact CE-CD1 4.15Å; M387-T400 WeakPolarHBondContact CE-O 3.47Å; M387-T400 WeakPolarHBondContact CG-O 3.48Å; M387-I432 HydrophobicContact CB-CD1 4.15Å; M387-I432 HydrophobicContact CB-CG1 4.4Å; M387-I432 HydrophobicContact CG-CD1 4.22Å; M387-I432 HydrophobicContact SD-CD1 3.83Å; M387-I432 HydrophobicContact SD-CG1 4.31Å; M387-R436 PolarHBondContact O-NH2 3.39Å
388	Q	97.3	Very high	97.3	Very high	114 Å²	114	53.6 Å²	53.6	53%	0.533	26%	0.26	S	S	.	.			trans	-84.9	131.3	176.6	-59.3	-58.2	-59.9	0	0	108.9	Q386 I399 T400	Q386-Q388 PolarHBondContact O-N 3.04Å; Q386-Q388 PolarHBondContact O-NE2 2.88Å; Q388-I399 CarbonylContact O-C 3.59Å; Q388-I399 VanDerWaalsContact O-CA 3.32Å; Q388-I399 WeakPolarHBondContact O-CA 3.49Å; Q388-T400 HydrophobicContact CB-CG2 3.86Å; Q388-T400 HydrophobicContact CG-CG2 4.25Å; Q388-T400 PolarHBondContact N-OG1 3.18Å; Q388-T400 PolarHBondContact O-N 3.05Å; Q388-T400 PolarHBondContact O-OG1 3.5Å
389	M	97	Very high	97.4	Very high	27 Å²	27	53.5 Å²	53.5	13%	0.133	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	129.3	175.1	175.3	176.7	71.4	0	0	109.1	I397 R398 I399 Y425 L428 H429 I432	M389-I397 HydrophobicContact CG-CG2 3.54Å; M389-I397 HydrophobicContact SD-CG2 3.97Å; M389-R398 WeakPolarHBondContact CA-O 3.06Å; M389-I399 HydrophobicContact CB-CG2 4.09Å; M389-I399 HydrophobicContact CG-CG2 3.85Å; M389-I399 HydrophobicContact SD-CG2 4.41Å; M389-Y425 HydrophobicContact CE-CD2 3.87Å; M389-Y425 HydrophobicContact CE-CE2 3.8Å; M389-Y425 HydrophobicContact CE-CG 4.31Å; M389-Y425 WeakPolarHBondContact CE-O 3.41Å; M389-Y425 HydrophobicContact CG-CD2 4.08Å; M389-Y425 HydrophobicContact CG-CE2 3.87Å; M389-Y425 HydrophobicContact SD-CD2 3.87Å; M389-Y425 HydrophobicContact SD-CE2 4.13Å; M389-L428 HydrophobicContact CE-CB 3.79Å; M389-L428 HydrophobicContact SD-CB 3.47Å; M389-L428 WeakPolarHBondContact SD-CB 3.41Å; M389-L428 HydrophobicContact SD-CD1 3.63Å; M389-L428 HydrophobicContact SD-CG 4.2Å; M389-H429 HydrophobicContact CE-CB 3.83Å; M389-I432 HydrophobicContact CB-CD1 4.31Å; M389-I432 HydrophobicContact CE-CD1 4.4Å
390	D	97.2	Very high	97.5	Very high	51 Å²	51	54.8 Å²	54.8	27%	0.273	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	147.9	176	69.5	-87.9	0	0	0	111.8	A392 I397 R398	D390-A392 PolarHBondContact O-N 3.49Å; D390-A392 VanDerWaalsContact O-N 3.08Å; D390-I397 WeakPolarHBondContact O-CA 3.26Å; D390-I397 WeakPolarHBondContact O-CG2 3.35Å; D390-R398 VanDerWaalsContact CG-NH2 3.29Å; D390-R398 PolarHBondContact N-O 3.19Å; D390-R398 PolarHBondContact O-N 3.16Å; D390-R398 WeakPolarHBondContact OD1-CB 3.35Å; D390-R398 IonicContact OD1-CZ 3.81Å; D390-R398 IonicContact OD1-NE 3.17Å; D390-R398 PolarHBondContact OD1-NE 3.25Å; D390-R398 IonicContact OD1-NH2 2.92Å; D390-R398 PolarHBondContact OD1-NH2 3.37Å; D390-R398 IonicContact OD2-CZ 3.34Å; D390-R398 IonicContact OD2-NE 3.8Å; D390-R398 PolarHBondContact OD2-NE 3.1Å; D390-R398 IonicContact OD2-NH2 3.32Å; D390-R398 PolarHBondContact OD2-NH2 3.3Å
391	K	97	Very high	97.5	Very high	99 Å²	99	51.8 Å²	51.8	43%	0.43	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	79.7	-179	-167.7	-178.5	-179.8	-167.8	0	110.4	S393 Y425	K391-S393 VanDerWaalsContact CE-O 3.29Å; K391-S393 WeakPolarHBondContact CE-O 3.32Å; K391-S393 VanDerWaalsContact CG-O 3.27Å; K391-S393 WeakPolarHBondContact CG-O 3.22Å; K391-S393 PolarHBondContact O-N 3.42Å; K391-S393 VanDerWaalsContact O-N 3.17Å; K391-Y425 HydrophobicContact CB-CD2 4.05Å; K391-Y425 HydrophobicContact CB-CE2 3.82Å
392	A	97.7	Very high	97.5	Very high	50 Å²	50	54 Å²	54	41%	0.413	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	-27.6	-178.2	0	0	0	0	0	114.5	D390 S396 R398 L413	D390-A392 PolarHBondContact O-N 3.49Å; D390-A392 VanDerWaalsContact O-N 3.08Å; A392-S396 PolarHBondContact N-O 3.35Å; A392-R398 HydrophobicContact CB-CB 4.14Å; A392-L413 HydrophobicContact CB-CD1 3.95Å
393	S	98	Very high	97.4	Very high	52 Å²	52	48.6 Å²	48.6	36%	0.364	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	178.3	166	77.4	0	0	0	0	111.7	K391 K395 S396	K391-S393 VanDerWaalsContact CE-O 3.29Å; K391-S393 WeakPolarHBondContact CE-O 3.32Å; K391-S393 VanDerWaalsContact CG-O 3.27Å; K391-S393 WeakPolarHBondContact CG-O 3.22Å; K391-S393 PolarHBondContact O-N 3.42Å; K391-S393 VanDerWaalsContact O-N 3.17Å; S393-K395 PolarHBondContact O-N 3.24Å; S393-K395 VanDerWaalsContact O-N 3.09Å; S393-K395 PolarHBondContact OG-N 3.28Å; S393-K395 VanDerWaalsContact OG-N 3.12Å; S393-S396 WeakPolarHBondContact CB-OG 3.45Å; S393-S396 PolarHBondContact N-O 3.22Å; S393-S396 PolarHBondContact N-OG 3.23Å; S393-S396 PolarHBondContact O-N 3.29Å; S393-S396 PolarHBondContact OG-N 3.27Å; S393-S396 PolarHBondContact OG-OG 3.11Å
394	E	98.2	Very high	96.9	Very high	121 Å²	121	50.8 Å²	50.8	57%	0.565	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-27.4	171.1	-158.8	-159.3	134.3	0	0	113.3	S418 T421	E394-S418 WeakPolarHBondContact OE1-CB 3.26Å; E394-S418 PolarHBondContact OE1-OG 2.53Å; E394-T421 WeakPolarHBondContact O-CB 3.35Å; E394-T421 WeakPolarHBondContact O-CG2 3.31Å
395	K	98.5	Very high	96.4	Very high	112 Å²	112	52.4 Å²	52.4	49%	0.487	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	12.7	-173.6	-65.6	176.6	-174.5	171.4	0	113.3	S393 S415 A416 S418 T421	S393-K395 PolarHBondContact O-N 3.24Å; S393-K395 VanDerWaalsContact O-N 3.09Å; S393-K395 PolarHBondContact OG-N 3.28Å; S393-K395 VanDerWaalsContact OG-N 3.12Å; K395-S415 VanDerWaalsContact O-CA 3.27Å; K395-S415 WeakPolarHBondContact O-CA 3.35Å; K395-S415 PolarHBondContact O-OG 3.39Å; K395-A416 PolarHBondContact O-N 3.39Å; K395-S418 WeakPolarHBondContact CE-OG 3.37Å; K395-S418 WeakPolarHBondContact CG-OG 3.2Å; K395-T421 VanDerWaalsContact C-OG1 3.32Å; K395-T421 WeakPolarHBondContact CA-OG1 3.45Å
396	S	98.5	Very high	96.1	Very high	12 Å²	12	57.1 Å²	57.1	8%	0.084	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	142.8	176.4	60.8	0	0	0	0	114.2	A392 S393 I414	A392-S396 PolarHBondContact N-O 3.35Å; S393-S396 WeakPolarHBondContact CB-OG 3.45Å; S393-S396 PolarHBondContact N-O 3.22Å; S393-S396 PolarHBondContact N-OG 3.23Å; S393-S396 PolarHBondContact O-N 3.29Å; S393-S396 PolarHBondContact OG-N 3.27Å; S393-S396 PolarHBondContact OG-OG 3.11Å; S396-I414 CarbonylContact C-O 3.57Å; S396-I414 WeakPolarHBondContact CA-O 3.4Å
397	I	98.7	Very high	95.7	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.5	172.2	-47.7	176.1	0	0	0	107.3	M389 D390 I399 L413 I414 T421 L424 Y425	M389-I397 HydrophobicContact CG-CG2 3.54Å; M389-I397 HydrophobicContact SD-CG2 3.97Å; D390-I397 WeakPolarHBondContact O-CA 3.26Å; D390-I397 WeakPolarHBondContact O-CG2 3.35Å; I397-I399 HydrophobicContact CG2-CG2 3.81Å; I397-L413 WeakPolarHBondContact O-CA 3.44Å; I397-I414 PolarHBondContact N-O 3.3Å; I397-I414 PolarHBondContact O-N 3.23Å; I397-T421 HydrophobicContact CD1-CG2 4.45Å; I397-T421 HydrophobicContact CG1-CG2 3.85Å; I397-L424 HydrophobicContact CD1-CB 4Å; I397-L424 HydrophobicContact CD1-CD2 3.82Å; I397-L424 HydrophobicContact CD1-CG 3.79Å; I397-Y425 HydrophobicContact CD1-CD2 4.28Å; I397-Y425 HydrophobicContact CG1-CD2 4.34Å; I397-Y425 HydrophobicContact CG2-CD2 4.01Å
398	R	98.7	Very high	95.5	Very high	107 Å²	107	60.9 Å²	60.9	40%	0.404	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	133.6	167.1	173.8	172.8	56.7	-165.1	-8.7	108.3	W342 M389 D390 A392 V411 F412 L413	W342-R398 HydrophobicContact CH2-CG 4.34Å; M389-R398 WeakPolarHBondContact CA-O 3.06Å; D390-R398 VanDerWaalsContact CG-NH2 3.29Å; D390-R398 PolarHBondContact N-O 3.19Å; D390-R398 PolarHBondContact O-N 3.16Å; D390-R398 WeakPolarHBondContact OD1-CB 3.35Å; D390-R398 IonicContact OD1-CZ 3.81Å; D390-R398 IonicContact OD1-NE 3.17Å; D390-R398 PolarHBondContact OD1-NE 3.25Å; D390-R398 IonicContact OD1-NH2 2.92Å; D390-R398 PolarHBondContact OD1-NH2 3.37Å; D390-R398 IonicContact OD2-CZ 3.34Å; D390-R398 IonicContact OD2-NE 3.8Å; D390-R398 PolarHBondContact OD2-NE 3.1Å; D390-R398 IonicContact OD2-NH2 3.32Å; D390-R398 PolarHBondContact OD2-NH2 3.3Å; A392-R398 HydrophobicContact CB-CB 4.14Å; R398-V411 HydrophobicContact CG-CG1 3.66Å; R398-F412 WeakPolarHBondContact CA-O 3.34Å; R398-L413 HydrophobicContact CB-CD1 4.01Å
399	I	98.6	Very high	95.5	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	151.3	179.3	63.4	171.8	0	0	0	111.1	L367 M387 Q388 M389 I397 A401 V411 F412 I414	L367-I399 HydrophobicContact CD1-CD1 3.96Å; M387-I399 HydrophobicContact CE-CB 4.34Å; M387-I399 HydrophobicContact CE-CD1 4.15Å; Q388-I399 CarbonylContact O-C 3.59Å; Q388-I399 VanDerWaalsContact O-CA 3.32Å; Q388-I399 WeakPolarHBondContact O-CA 3.49Å; M389-I399 HydrophobicContact CB-CG2 4.09Å; M389-I399 HydrophobicContact CG-CG2 3.85Å; M389-I399 HydrophobicContact SD-CG2 4.41Å; I397-I399 HydrophobicContact CG2-CG2 3.81Å; I399-A401 HydrophobicContact CD1-CB 4.22Å; I399-V411 WeakPolarHBondContact O-CA 3.1Å; I399-F412 HydrophobicContact CG1-CB 4.05Å; I399-F412 PolarHBondContact N-O 3.2Å; I399-F412 PolarHBondContact O-N 3.37Å; I399-I414 HydrophobicContact CD1-CD1 3.66Å; I399-I414 HydrophobicContact CD1-CG1 4.46Å; I399-I414 HydrophobicContact CG1-CD1 4.37Å
400	T	98.4	Very high	95.5	Very high	26 Å²	26	61.4 Å²	61.4	16%	0.16	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	131.9	156.5	51.8	0	0	0	0	109.2	W384 M387 Q388 V409 K410	W384-T400 WeakPolarHBondContact CH2-O 3.31Å; M387-T400 WeakPolarHBondContact CE-O 3.47Å; M387-T400 WeakPolarHBondContact CG-O 3.48Å; Q388-T400 HydrophobicContact CB-CG2 3.86Å; Q388-T400 HydrophobicContact CG-CG2 4.25Å; Q388-T400 PolarHBondContact N-OG1 3.18Å; Q388-T400 PolarHBondContact O-N 3.05Å; Q388-T400 PolarHBondContact O-OG1 3.5Å; T400-V409 HydrophobicContact CG2-CG1 4.42Å; T400-K410 WeakPolarHBondContact CA-O 3.17Å
401	A	98	Very high	95.5	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	154.4	175.5	0	0	0	0	0	111	L379 T381 I399 V409 K410 F412	L379-A401 HydrophobicContact CD1-CB 3.96Å; T381-A401 HydrophobicContact CG2-CB 3.72Å; I399-A401 HydrophobicContact CD1-CB 4.22Å; A401-V409 WeakPolarHBondContact O-CA 3.4Å; A401-K410 PolarHBondContact N-O 3.19Å; A401-K410 PolarHBondContact O-N 3.13Å; A401-F412 HydrophobicContact CB-CD2 3.64Å; A401-F412 HydrophobicContact CB-CE2 3.81Å
402	T	96.8	Very high	95.6	Very high	48 Å²	48	56.8 Å²	56.8	29%	0.294	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	126.3	168.2	-49.6	0	0	0	0	108.9	T381 Q407	T381-T402 PolarHBondContact OG1-N 2.94Å; T402-Q407 VanDerWaalsContact CG2-O 3.26Å; T402-Q407 WeakPolarHBondContact CG2-O 3.38Å
403	D	94	Very high	95.6	Very high	5 Å²	5	55.6 Å²	55.6	3%	0.027	30%	0.296	C	S	.	.			trans	-78.5	142.1	177.1	-171.4	23.3	0	0	0	111.7	R345 E405 Q407 G408 K410 F412	R345-D403 IonicContact NH2-OD1 3.93Å; D403-E405 VanDerWaalsContact C-N 3.32Å; D403-E405 PolarHBondContact O-N 2.99Å; D403-Q407 VanDerWaalsContact O-CA 3.26Å; D403-Q407 WeakPolarHBondContact O-CA 3.44Å; D403-Q407 PolarHBondContact O-N 2.98Å; D403-Q407 VanDerWaalsContact O-N 3.07Å; D403-G408 PolarHBondContact N-O 3.03Å; D403-K410 HydrophobicContact CB-CD 3.87Å; D403-K410 HydrophobicContact CB-CG 4.22Å; D403-K410 WeakPolarHBondContact OD2-CE 3.28Å; D403-K410 IonicContact OD2-NZ 2.7Å; D403-K410 PolarHBondContact OD2-NZ 3.17Å; D403-F412 HydrophobicContact CB-CE2 4.49Å; D403-F412 HydrophobicContact CB-CZ 4.01Å
404	A	86.7	Confident	95.7	Very high	49 Å²	49	53.1 Å²	53.1	41%	0.405	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-16.9	-176.6	0	0	0	0	0	113.5
405	E	86.6	Confident	95.7	Very high	99 Å²	99	49.4 Å²	49.4	46%	0.463	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-52.6	178.3	-77.3	166.1	-166.8	0	0	111.2	R345 R376 D403	R345-E405 IonicContact CZ-OE1 3.24Å; R345-E405 VanDerWaalsContact CZ-OE1 3.24Å; R345-E405 IonicContact CZ-OE2 3.42Å; R345-E405 IonicContact NH1-OE1 2.78Å; R345-E405 PolarHBondContact NH1-OE1 3.06Å; R345-E405 IonicContact NH1-OE2 3.02Å; R345-E405 PolarHBondContact NH1-OE2 3.39Å; R345-E405 IonicContact NH2-OE1 2.81Å; R345-E405 PolarHBondContact NH2-OE1 3.45Å; R345-E405 IonicContact NH2-OE2 3.33Å; R345-E405 PolarHBondContact NH2-OE2 3.07Å; R376-E405 IonicContact CZ-OE1 3.91Å; R376-E405 IonicContact NH2-OE1 2.77Å; R376-E405 PolarHBondContact NH2-OE1 3.06Å; D403-E405 VanDerWaalsContact C-N 3.32Å; D403-E405 PolarHBondContact O-N 2.99Å
406	D	88.4	Confident	95.7	Very high	111 Å²	111	44.8 Å²	44.8	59%	0.594	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-8.1	-174.2	-62.1	-14.5	0	0	0	114.8	G408 K410	D406-G408 PolarHBondContact O-N 3.12Å; D406-K410 WeakPolarHBondContact OD2-CE 3.28Å; D406-K410 IonicContact OD2-NZ 2.85Å; D406-K410 PolarHBondContact OD2-NZ 3.1Å
407	Q	88.2	Confident	95.7	Very high	159 Å²	159	46.8 Å²	46.8	74%	0.743	26%	0.263	S	S	*	.			trans	57.6	-3.3	-170.9	-54	-175.3	30.4	0	0	116	T402 D403	T402-Q407 VanDerWaalsContact CG2-O 3.26Å; T402-Q407 WeakPolarHBondContact CG2-O 3.38Å; D403-Q407 VanDerWaalsContact O-CA 3.26Å; D403-Q407 WeakPolarHBondContact O-CA 3.44Å; D403-Q407 PolarHBondContact O-N 2.98Å; D403-Q407 VanDerWaalsContact O-N 3.07Å
408	G	94	Very high	95.7	Very high	34 Å²	34	48.5 Å²	48.5	35%	0.351	28%	0.275	S	S	.	.	S	Bend	trans	-75.7	154.3	172	0	0	0	0	0	113	D403 D406 K410	D403-G408 PolarHBondContact N-O 3.03Å; D406-G408 PolarHBondContact O-N 3.12Å; G408-K410 PolarHBondContact O-N 3.34Å
409	V	96.3	Very high	95.7	Very high	91 Å²	91	51 Å²	51	55%	0.552	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	120.4	172	-179.3	0	0	0	0	109.6	W384 T400 A401	W384-V409 HydrophobicContact CH2-CG1 4.19Å; W384-V409 HydrophobicContact CH2-CG2 4.48Å; W384-V409 HydrophobicContact CZ2-CG1 4.12Å; T400-V409 HydrophobicContact CG2-CG1 4.42Å; A401-V409 WeakPolarHBondContact O-CA 3.4Å
410	K	97.1	Very high	95.7	Very high	61 Å²	61	53 Å²	53	27%	0.265	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	163.4	175.7	-63.6	-176.5	-174.9	169.7	0	110.9	V334 T400 A401 D403 D406 G408 F412	V334-K410 HydrophobicContact CG2-CB 4.07Å; V334-K410 HydrophobicContact CG2-CD 3.82Å; T400-K410 WeakPolarHBondContact CA-O 3.17Å; A401-K410 PolarHBondContact N-O 3.19Å; A401-K410 PolarHBondContact O-N 3.13Å; D403-K410 HydrophobicContact CB-CD 3.87Å; D403-K410 HydrophobicContact CB-CG 4.22Å; D403-K410 WeakPolarHBondContact OD2-CE 3.28Å; D403-K410 IonicContact OD2-NZ 2.7Å; D403-K410 PolarHBondContact OD2-NZ 3.17Å; D406-K410 WeakPolarHBondContact OD2-CE 3.28Å; D406-K410 IonicContact OD2-NZ 2.85Å; D406-K410 PolarHBondContact OD2-NZ 3.1Å; G408-K410 PolarHBondContact O-N 3.34Å; K410-F412 HydrophobicContact CB-CD2 4.28Å; K410-F412 HydrophobicContact CB-CE2 3.7Å; K410-F412 HydrophobicContact CB-CZ 4.21Å; K410-F412 WeakPolarHBondContact O-CD2 3.41Å
411	V	97.9	Very high	95.7	Very high	54 Å²	54	51.8 Å²	51.8	33%	0.327	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	126.3	172.5	-174	0	0	0	0	109.1	F335 W342 R398 I399	F335-V411 HydrophobicContact CB-CB 4.19Å; F335-V411 PolarHBondContact N-O 2.8Å; W342-V411 HydrophobicContact CH2-CG1 3.93Å; W342-V411 HydrophobicContact CZ3-CG1 4.47Å; R398-V411 HydrophobicContact CG-CG1 3.66Å; I399-V411 WeakPolarHBondContact O-CA 3.1Å
412	F	98.5	Very high	95.7	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	154.3	178.8	-67.4	-96.7	0	0	0	111.2	L332 F333 V334 L379 R398 I399 A401 D403 K410	L332-F412 HydrophobicContact CD1-CB 4.03Å; L332-F412 HydrophobicContact CD1-CD1 3.87Å; L332-F412 HydrophobicContact CD1-CG 4.34Å; L332-F412 HydrophobicContact CD2-CD1 4.18Å; L332-F412 HydrophobicContact CD2-CE1 4.4Å; L332-F412 HydrophobicContact CG-CD1 4.05Å; F333-F412 CarbonylContact O-C 3.53Å; F333-F412 VanDerWaalsContact O-CA 3.22Å; F333-F412 WeakPolarHBondContact O-CA 3.33Å; F333-F412 WeakPolarHBondContact O-CB 3.47Å; F333-F412 WeakPolarHBondContact O-CD1 3.41Å; V334-F412 HydrophobicContact CB-CD1 3.92Å; V334-F412 HydrophobicContact CB-CE1 3.84Å; V334-F412 HydrophobicContact CG2-CD1 4.16Å; V334-F412 HydrophobicContact CG2-CE1 3.88Å; V334-F412 HydrophobicContact CG2-CZ 4.14Å; L379-F412 HydrophobicContact CD1-CE1 4.37Å; L379-F412 HydrophobicContact CD1-CE2 4.41Å; L379-F412 HydrophobicContact CD1-CZ 4.25Å; R398-F412 WeakPolarHBondContact CA-O 3.34Å; I399-F412 HydrophobicContact CG1-CB 4.05Å; I399-F412 PolarHBondContact N-O 3.2Å; I399-F412 PolarHBondContact O-N 3.37Å; A401-F412 HydrophobicContact CB-CD2 3.64Å; A401-F412 HydrophobicContact CB-CE2 3.81Å; D403-F412 HydrophobicContact CB-CE2 4.49Å; D403-F412 HydrophobicContact CB-CZ 4.01Å; K410-F412 HydrophobicContact CB-CD2 4.28Å; K410-F412 HydrophobicContact CB-CE2 3.7Å; K410-F412 HydrophobicContact CB-CZ 4.21Å; K410-F412 WeakPolarHBondContact O-CD2 3.41Å
413	L	98.7	Very high	95.8	Very high	24 Å²	24	56.3 Å²	56.3	13%	0.126	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	122.9	170.2	-167.9	76.6	0	0	0	108.9	F333 W342 A392 I397 R398	F333-L413 HydrophobicContact CB-CB 4.22Å; F333-L413 HydrophobicContact CD2-CB 4.35Å; F333-L413 HydrophobicContact CD2-CD2 4.35Å; F333-L413 PolarHBondContact N-O 3.3Å; F333-L413 PolarHBondContact O-N 3.14Å; W342-L413 HydrophobicContact CD2-CB 4.27Å; W342-L413 HydrophobicContact CD2-CD2 4.43Å; W342-L413 HydrophobicContact CE3-CB 3.81Å; W342-L413 HydrophobicContact CH2-CB 3.79Å; W342-L413 HydrophobicContact CH2-CD1 4.46Å; W342-L413 HydrophobicContact CZ2-CB 4.25Å; W342-L413 HydrophobicContact CZ2-CD1 4.42Å; W342-L413 HydrophobicContact CZ3-CB 3.56Å; A392-L413 HydrophobicContact CB-CD1 3.95Å; I397-L413 WeakPolarHBondContact O-CA 3.44Å; R398-L413 HydrophobicContact CB-CD1 4.01Å
414	I	98.8	Very high	96	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	118	172.8	-61.8	168.2	0	0	0	107.3	C330 L332 L350 S396 I397 I399 L424	C330-I414 HydrophobicContact CB-CG2 4Å; L332-I414 HydrophobicContact CD1-CG1 3.85Å; L350-I414 HydrophobicContact CD2-CD1 3.9Å; L350-I414 HydrophobicContact CD2-CG2 3.99Å; S396-I414 CarbonylContact C-O 3.57Å; S396-I414 WeakPolarHBondContact CA-O 3.4Å; I397-I414 PolarHBondContact N-O 3.3Å; I397-I414 PolarHBondContact O-N 3.23Å; I399-I414 HydrophobicContact CD1-CD1 3.66Å; I399-I414 HydrophobicContact CD1-CG1 4.46Å; I399-I414 HydrophobicContact CG1-CD1 4.37Å; I414-L424 HydrophobicContact CD1-CD2 4.16Å; I414-L424 HydrophobicContact CG2-CD2 3.95Å
415	S	98.7	Very high	96.6	Very high	42 Å²	42	57.2 Å²	57.2	29%	0.294	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	129.6	174.3	-174.6	0	0	0	0	111.6	C330 K331 K395	C330-S415 CarbonylContact C-O 3.56Å; C330-S415 VanDerWaalsContact CA-O 3.31Å; C330-S415 WeakPolarHBondContact CA-O 3.45Å; C330-S415 VanDerWaalsContact CB-O 3.26Å; C330-S415 WeakPolarHBondContact CB-O 3.24Å; K331-S415 PolarHBondContact N-O 2.69Å; K331-S415 PolarHBondContact O-N 3.03Å; K395-S415 VanDerWaalsContact O-CA 3.27Å; K395-S415 WeakPolarHBondContact O-CA 3.35Å; K395-S415 PolarHBondContact O-OG 3.39Å
416	A	98.7	Very high	97.1	Very high	16 Å²	16	54.5 Å²	54.5	13%	0.132	31%	0.307	C	S	.	.			trans	-144.9	-169.4	-175.1	0	0	0	0	0	111.3	I328 C330 K395 D420	I328-A416 HydrophobicContact CD1-CB 3.99Å; C330-A416 HydrophobicContact CB-CB 3.95Å; K395-A416 PolarHBondContact O-N 3.39Å; A416-D420 HydrophobicContact CB-CB 3.93Å
417	S	98.5	Very high	97.6	Very high	54 Å²	54	50 Å²	50	38%	0.378	29%	0.285	S	S	.	.			trans	-70.2	154.8	167.5	86.4	0	0	0	0	110.5	K419 D420 T421	S417-K419 PolarHBondContact O-N 3.31Å; S417-K419 VanDerWaalsContact O-N 3.16Å; S417-D420 WeakPolarHBondContact CB-OD2 3.35Å; S417-D420 PolarHBondContact O-N 2.97Å; S417-D420 PolarHBondContact OG-N 2.84Å; S417-D420 PolarHBondContact OG-OD2 3.18Å; S417-T421 WeakPolarHBondContact O-CB 3.33Å; S417-T421 PolarHBondContact O-N 3.38Å; S417-T421 PolarHBondContact O-OG1 2.99Å
418	S	98.3	Very high	98.1	Very high	36 Å²	36	42.4 Å²	42.4	25%	0.252	25%	0.249	S	C	.	.	H	α-helix	trans	-55.3	-36.4	-179.9	-54	0	0	0	0	113.3	E394 K395 G422	E394-S418 WeakPolarHBondContact OE1-CB 3.26Å; E394-S418 PolarHBondContact OE1-OG 2.53Å; K395-S418 WeakPolarHBondContact CE-OG 3.37Å; K395-S418 WeakPolarHBondContact CG-OG 3.2Å; S418-G422 PolarHBondContact O-N 2.74Å
419	K	98.4	Very high	98.3	Very high	158 Å²	158	44.8 Å²	44.8	69%	0.687	25%	0.251	S	S	*	.	H	α-helix	trans	-65.8	-49.8	176.8	-174.6	-174.2	177.7	-172.1	0	110.6	S417 G422 Q423	S417-K419 PolarHBondContact O-N 3.31Å; S417-K419 VanDerWaalsContact O-N 3.16Å; K419-G422 PolarHBondContact O-N 3.08Å; K419-Q423 WeakPolarHBondContact O-CG 3.3Å; K419-Q423 PolarHBondContact O-N 3.19Å
420	D	98.5	Very high	98.3	Very high	45 Å²	45	46.5 Å²	46.5	24%	0.241	25%	0.253	C	S	.	.	H	α-helix	trans	-66.4	-39.7	-178.1	-58.6	-37.5	0	0	0	111.6	I328 A416 S417 G422 Q423 L424	I328-D420 HydrophobicContact CB-CB 4.06Å; I328-D420 HydrophobicContact CD1-CB 4.05Å; I328-D420 HydrophobicContact CG2-CB 3.79Å; A416-D420 HydrophobicContact CB-CB 3.93Å; S417-D420 WeakPolarHBondContact CB-OD2 3.35Å; S417-D420 PolarHBondContact O-N 2.97Å; S417-D420 PolarHBondContact OG-N 2.84Å; S417-D420 PolarHBondContact OG-OD2 3.18Å; D420-G422 VanDerWaalsContact C-N 3.34Å; D420-G422 PolarHBondContact O-N 3.3Å; D420-Q423 PolarHBondContact O-N 3.42Å; D420-L424 VanDerWaalsContact O-CB 3.26Å; D420-L424 WeakPolarHBondContact O-CB 3.31Å; D420-L424 PolarHBondContact O-N 3.18Å
421	T	98.7	Very high	98.3	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-58.8	-44	171.8	-65.1	0	0	0	0	111.3	E394 K395 I397 S417 Y425	E394-T421 WeakPolarHBondContact O-CB 3.35Å; E394-T421 WeakPolarHBondContact O-CG2 3.31Å; K395-T421 VanDerWaalsContact C-OG1 3.32Å; K395-T421 WeakPolarHBondContact CA-OG1 3.45Å; I397-T421 HydrophobicContact CD1-CG2 4.45Å; I397-T421 HydrophobicContact CG1-CG2 3.85Å; S417-T421 WeakPolarHBondContact O-CB 3.33Å; S417-T421 PolarHBondContact O-N 3.38Å; S417-T421 PolarHBondContact O-OG1 2.99Å; T421-Y425 VanDerWaalsContact O-CB 3.24Å; T421-Y425 WeakPolarHBondContact O-CB 3.26Å; T421-Y425 PolarHBondContact O-N 3.35Å
422	G	98.4	Very high	98.3	Very high	32 Å²	32	43.2 Å²	43.2	33%	0.33	23%	0.233	S	C	.	.	H	α-helix	trans	-62.9	-47.7	176	0	0	0	0	0	113.2	S418 K419 D420 A426	S418-G422 PolarHBondContact O-N 2.74Å; K419-G422 PolarHBondContact O-N 3.08Å; D420-G422 VanDerWaalsContact C-N 3.34Å; D420-G422 PolarHBondContact O-N 3.3Å; G422-A426 PolarHBondContact O-N 3.25Å; G422-A426 VanDerWaalsContact O-N 3.1Å
423	Q	98.5	Very high	98.2	Very high	111 Å²	111	47.6 Å²	47.6	52%	0.519	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-46.6	179.2	-68	-64.2	-36.1	0	0	112.1	L326 K419 D420 A426 A427	L326-Q423 HydrophobicContact CD1-CB 4.41Å; L326-Q423 HydrophobicContact CD2-CB 4.26Å; K419-Q423 WeakPolarHBondContact O-CG 3.3Å; K419-Q423 PolarHBondContact O-N 3.19Å; D420-Q423 PolarHBondContact O-N 3.42Å; Q423-A426 PolarHBondContact O-N 3.43Å; Q423-A427 WeakPolarHBondContact O-CB 3.5Å; Q423-A427 PolarHBondContact O-N 3.09Å
424	L	98.6	Very high	98	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.016	27%	0.273	C	S	.	.	H	α-helix	trans	-63.6	-44.7	178.5	178.9	63.2	0	0	0	112	L326 I328 L350 L367 I397 I414 D420 A426 A427 L428	L326-L424 HydrophobicContact CD2-CB 3.9Å; L326-L424 HydrophobicContact CD2-CD1 4.08Å; I328-L424 HydrophobicContact CD1-CB 4.28Å; I328-L424 HydrophobicContact CD1-CD2 3.8Å; L350-L424 HydrophobicContact CD2-CD1 4.41Å; L350-L424 HydrophobicContact CD2-CD2 3.63Å; L367-L424 HydrophobicContact CD2-CD1 4.05Å; I397-L424 HydrophobicContact CD1-CB 4Å; I397-L424 HydrophobicContact CD1-CD2 3.82Å; I397-L424 HydrophobicContact CD1-CG 3.79Å; I414-L424 HydrophobicContact CD1-CD2 4.16Å; I414-L424 HydrophobicContact CG2-CD2 3.95Å; D420-L424 VanDerWaalsContact O-CB 3.26Å; D420-L424 WeakPolarHBondContact O-CB 3.31Å; D420-L424 PolarHBondContact O-N 3.18Å; L424-A426 PolarHBondContact O-N 3.28Å; L424-A427 PolarHBondContact O-N 3.19Å; L424-L428 HydrophobicContact CD1-CD1 3.8Å; L424-L428 HydrophobicContact CD1-CG 3.97Å; L424-L428 HydrophobicContact CG-CD1 3.87Å; L424-L428 HydrophobicContact CG-CG 4.4Å; L424-L428 WeakPolarHBondContact O-CB 3.42Å; L424-L428 WeakPolarHBondContact O-CG 3.41Å; L424-L428 PolarHBondContact O-N 3.33Å
425	Y	98.6	Very high	97.8	Very high	69 Å²	69	51.1 Å²	51.1	27%	0.271	28%	0.283	S	S	.	.	H	α-helix	trans	-60.7	-46.7	179.1	-173.4	-91.4	0	0	0	111.4	M389 K391 I397 T421 H429	M389-Y425 HydrophobicContact CE-CD2 3.87Å; M389-Y425 HydrophobicContact CE-CE2 3.8Å; M389-Y425 HydrophobicContact CE-CG 4.31Å; M389-Y425 WeakPolarHBondContact CE-O 3.41Å; M389-Y425 HydrophobicContact CG-CD2 4.08Å; M389-Y425 HydrophobicContact CG-CE2 3.87Å; M389-Y425 HydrophobicContact SD-CD2 3.87Å; M389-Y425 HydrophobicContact SD-CE2 4.13Å; K391-Y425 HydrophobicContact CB-CD2 4.05Å; K391-Y425 HydrophobicContact CB-CE2 3.82Å; I397-Y425 HydrophobicContact CD1-CD2 4.28Å; I397-Y425 HydrophobicContact CG1-CD2 4.34Å; I397-Y425 HydrophobicContact CG2-CD2 4.01Å; T421-Y425 VanDerWaalsContact O-CB 3.24Å; T421-Y425 WeakPolarHBondContact O-CB 3.26Å; T421-Y425 PolarHBondContact O-N 3.35Å; Y425-H429 WeakPolarHBondContact O-CB 3.43Å; Y425-H429 PolarHBondContact O-N 3.38Å
426	A	98.4	Very high	97.7	Very high	43 Å²	43	53.4 Å²	53.4	36%	0.355	29%	0.285	S	S	.	.	H	α-helix	trans	-61.5	-48.5	177.2	0	0	0	0	0	111.7	G422 Q423 L424 L428 H429 H430	G422-A426 PolarHBondContact O-N 3.25Å; G422-A426 VanDerWaalsContact O-N 3.1Å; Q423-A426 PolarHBondContact O-N 3.43Å; L424-A426 PolarHBondContact O-N 3.28Å; A426-L428 VanDerWaalsContact C-N 3.35Å; A426-L428 PolarHBondContact O-N 3.27Å; A426-H429 PolarHBondContact O-N 3.48Å; A426-H430 PolarHBondContact O-CD2 3.42Å; A426-H430 PolarHBondContact O-N 3.28Å; A426-H430 VanDerWaalsContact O-N 3.14Å
427	A	98.4	Very high	97.5	Very high	16 Å²	16	54.9 Å²	54.9	13%	0.132	29%	0.294	C	S	.	.	H	α-helix	trans	-62.1	-40	-178.3	0	0	0	0	0	112.9	L352 Q423 L424 R431	L352-A427 HydrophobicContact CD2-CB 3.59Å; Q423-A427 WeakPolarHBondContact O-CB 3.5Å; Q423-A427 PolarHBondContact O-N 3.09Å; L424-A427 PolarHBondContact O-N 3.19Å; A427-R431 WeakPolarHBondContact O-CD 3.13Å; A427-R431 PolarHBondContact O-NH1 2.84Å
428	L	98.3	Very high	97.1	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-68.9	-42.1	173.9	-71.9	175	0	0	0	112.2	L352 L367 L383 M389 L424 A426 H430 R431 I432	L352-L428 HydrophobicContact CD1-CD2 4.08Å; L352-L428 HydrophobicContact CD2-CD2 4.43Å; L367-L428 HydrophobicContact CD1-CD1 4.11Å; L367-L428 HydrophobicContact CD1-CD2 3.94Å; L367-L428 HydrophobicContact CD2-CD2 4.07Å; L367-L428 HydrophobicContact CG-CD2 4.02Å; L383-L428 HydrophobicContact CD1-CD2 3.69Å; L383-L428 HydrophobicContact CD2-CD2 3.75Å; L383-L428 HydrophobicContact CG-CD2 4.39Å; M389-L428 HydrophobicContact CE-CB 3.79Å; M389-L428 HydrophobicContact SD-CB 3.47Å; M389-L428 WeakPolarHBondContact SD-CB 3.41Å; M389-L428 HydrophobicContact SD-CD1 3.63Å; M389-L428 HydrophobicContact SD-CG 4.2Å; L424-L428 HydrophobicContact CD1-CD1 3.8Å; L424-L428 HydrophobicContact CD1-CG 3.97Å; L424-L428 HydrophobicContact CG-CD1 3.87Å; L424-L428 HydrophobicContact CG-CG 4.4Å; L424-L428 WeakPolarHBondContact O-CB 3.42Å; L424-L428 WeakPolarHBondContact O-CG 3.41Å; L424-L428 PolarHBondContact O-N 3.33Å; A426-L428 VanDerWaalsContact C-N 3.35Å; A426-L428 PolarHBondContact O-N 3.27Å; L428-H430 PolarHBondContact O-N 2.72Å; L428-R431 PolarHBondContact O-N 3.49Å; L428-I432 HydrophobicContact CB-CD1 4.49Å; L428-I432 WeakPolarHBondContact O-CG1 3.31Å; L428-I432 PolarHBondContact O-N 3.07Å
429	H	97.9	Very high	96.8	Very high	83 Å²	83	55.3 Å²	55.3	38%	0.384	29%	0.287	S	S	.	.	H	α-helix	trans	-59.7	-46.7	-177.2	-177.7	-94	0	0	0	111.5	M389 Y425 A426 R431 I432 L433	M389-H429 HydrophobicContact CE-CB 3.83Å; Y425-H429 WeakPolarHBondContact O-CB 3.43Å; Y425-H429 PolarHBondContact O-N 3.38Å; A426-H429 PolarHBondContact O-N 3.48Å; H429-R431 VanDerWaalsContact C-N 3.34Å; H429-R431 PolarHBondContact O-N 3.22Å; H429-I432 PolarHBondContact O-N 3.36Å; H429-L433 VanDerWaalsContact O-CB 3.23Å; H429-L433 WeakPolarHBondContact O-CB 3.47Å; H429-L433 PolarHBondContact O-N 3.01Å
430	H	97.2	Very high	96.6	Very high	127 Å²	127	53.6 Å²	53.6	59%	0.588	28%	0.281	S	S	*	.	H	α-helix	trans	-61	-39.9	176.9	-74.9	-70.5	0	0	0	113.1	A426 L428 A434	A426-H430 PolarHBondContact O-CD2 3.42Å; A426-H430 PolarHBondContact O-N 3.28Å; A426-H430 VanDerWaalsContact O-N 3.14Å; L428-H430 PolarHBondContact O-N 2.72Å; H430-A434 WeakPolarHBondContact O-CB 3.27Å; H430-A434 PolarHBondContact O-N 3.24Å
431	R	96.9	Very high	96.1	Very high	43 Å²	43	57.8 Å²	57.8	16%	0.162	30%	0.299	C	S	.	.	H	α-helix	trans	-70.8	-44.9	-179.7	-72.6	161.7	176.5	69	13.7	112	D354 S365 L383 A427 L428 H429 L433 A434 L435	D354-R431 IonicContact OD1-CZ 3.18Å; D354-R431 IonicContact OD1-NE 3.47Å; D354-R431 PolarHBondContact OD1-NE 3.44Å; D354-R431 IonicContact OD1-NH2 2.72Å; D354-R431 IonicContact OD2-CZ 3.71Å; D354-R431 IonicContact OD2-NE 2.72Å; D354-R431 PolarHBondContact OD2-NE 2.9Å; D354-R431 IonicContact OD2-NH2 3.33Å; D354-R431 PolarHBondContact OD2-NH2 3.09Å; S365-R431 VanDerWaalsContact OG-CD 3.28Å; S365-R431 WeakPolarHBondContact OG-CD 3.36Å; L383-R431 HydrophobicContact CD1-CB 3.74Å; A427-R431 WeakPolarHBondContact O-CD 3.13Å; A427-R431 PolarHBondContact O-NH1 2.84Å; L428-R431 PolarHBondContact O-N 3.49Å; H429-R431 VanDerWaalsContact C-N 3.34Å; H429-R431 PolarHBondContact O-N 3.22Å; R431-L433 VanDerWaalsContact C-N 3.33Å; R431-L433 PolarHBondContact O-N 3.45Å; R431-A434 PolarHBondContact O-N 3.15Å; R431-L435 WeakPolarHBondContact O-CG 3.35Å; R431-L435 PolarHBondContact O-N 2.99Å
432	I	96.6	Very high	95.6	Very high	4 Å²	4	62.6 Å²	62.6	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-64.5	-40.1	176.5	-65.1	167.2	0	0	0	110.4	M387 M389 L428 H429 L435 R436	M387-I432 HydrophobicContact CB-CD1 4.15Å; M387-I432 HydrophobicContact CB-CG1 4.4Å; M387-I432 HydrophobicContact CG-CD1 4.22Å; M387-I432 HydrophobicContact SD-CD1 3.83Å; M387-I432 HydrophobicContact SD-CG1 4.31Å; M389-I432 HydrophobicContact CB-CD1 4.31Å; M389-I432 HydrophobicContact CE-CD1 4.4Å; L428-I432 HydrophobicContact CB-CD1 4.49Å; L428-I432 WeakPolarHBondContact O-CG1 3.31Å; L428-I432 PolarHBondContact O-N 3.07Å; H429-I432 PolarHBondContact O-N 3.36Å; I432-L435 PolarHBondContact O-N 3.44Å; I432-R436 WeakPolarHBondContact O-CG 3.31Å; I432-R436 PolarHBondContact O-N 3.39Å
433	L	96.2	Very high	95	Very high	91 Å²	91	67.2 Å²	67.2	48%	0.476	34%	0.335	S	S	.	.	H	α-helix	trans	-62	-45.3	175.8	-175	64.1	0	0	0	112	H429 R431 L435 R436 S437	H429-L433 VanDerWaalsContact O-CB 3.23Å; H429-L433 WeakPolarHBondContact O-CB 3.47Å; H429-L433 PolarHBondContact O-N 3.01Å; R431-L433 VanDerWaalsContact C-N 3.33Å; R431-L433 PolarHBondContact O-N 3.45Å; L433-L435 VanDerWaalsContact C-N 3.31Å; L433-L435 PolarHBondContact O-N 3.06Å; L433-R436 WeakPolarHBondContact O-CB 3.41Å; L433-R436 PolarHBondContact O-N 2.87Å; L433-R436 VanDerWaalsContact O-N 3.17Å; L433-S437 PolarHBondContact O-N 2.91Å; L433-S437 PolarHBondContact O-OG 3.29Å
434	A	95.3	Very high	94.4	Very high	58 Å²	58	69.5 Å²	69.5	48%	0.479	35%	0.345	S	S	.	.	H	α-helix	trans	-62.2	-37.6	176.5	0	0	0	0	0	112.7	H430 R431 S437 R438	H430-A434 WeakPolarHBondContact O-CB 3.27Å; H430-A434 PolarHBondContact O-N 3.24Å; R431-A434 PolarHBondContact O-N 3.15Å; A434-S437 WeakPolarHBondContact CA-OG 3.46Å; A434-S437 PolarHBondContact O-OG 3.41Å; A434-R438 PolarHBondContact O-N 2.78Å; A434-R438 VanDerWaalsContact O-N 3.1Å
435	L	95.2	Very high	93.7	Very high	41 Å²	41	73.7 Å²	73.7	22%	0.215	38%	0.381	C	S	.	.	H	α-helix	trans	-66.7	-37.5	173.9	-69.9	169.6	0	0	0	112.3	L383 A385 R431 I432 L433 A439	L383-L435 HydrophobicContact CB-CD1 3.94Å; A385-L435 HydrophobicContact CB-CB 4.07Å; R431-L435 WeakPolarHBondContact O-CG 3.35Å; R431-L435 PolarHBondContact O-N 2.99Å; I432-L435 PolarHBondContact O-N 3.44Å; L433-L435 VanDerWaalsContact C-N 3.31Å; L433-L435 PolarHBondContact O-N 3.06Å; L435-A439 WeakPolarHBondContact O-CB 3.28Å; L435-A439 PolarHBondContact O-N 2.89Å
436	R	95.6	Very high	92.7	Very high	90 Å²	90	79.1 Å²	79.1	34%	0.34	41%	0.405	S	S	.	.	H	α-helix	trans	-64.1	-50.6	174.3	-70.9	173.3	-170.8	178.4	3.5	111.5	A385 M387 I432 L433 R438 A439 E440	A385-R436 HydrophobicContact CB-CG 4.05Å; A385-R436 WeakPolarHBondContact O-CG 3.42Å; A385-R436 PolarHBondContact O-NE 2.8Å; M387-R436 PolarHBondContact O-NH2 3.39Å; I432-R436 WeakPolarHBondContact O-CG 3.31Å; I432-R436 PolarHBondContact O-N 3.39Å; L433-R436 WeakPolarHBondContact O-CB 3.41Å; L433-R436 PolarHBondContact O-N 2.87Å; L433-R436 VanDerWaalsContact O-N 3.17Å; R436-R438 PolarHBondContact O-N 3.42Å; R436-A439 PolarHBondContact O-N 3.45Å; R436-E440 WeakPolarHBondContact O-CB 3.19Å; R436-E440 WeakPolarHBondContact O-CG 3.34Å; R436-E440 PolarHBondContact O-N 3.28Å
437	S	94.1	Very high	91.4	Very high	47 Å²	47	79.9 Å²	79.9	33%	0.329	41%	0.412	S	S	.	.	H	α-helix	trans	-60.2	-33.6	178.4	53.8	0	0	0	0	113.1	L433 A434 Q441	L433-S437 PolarHBondContact O-N 2.91Å; L433-S437 PolarHBondContact O-OG 3.29Å; A434-S437 WeakPolarHBondContact CA-OG 3.46Å; A434-S437 PolarHBondContact O-OG 3.41Å; S437-Q441 WeakPolarHBondContact O-CB 3.37Å; S437-Q441 WeakPolarHBondContact O-CG 3.37Å; S437-Q441 PolarHBondContact O-N 2.92Å; S437-Q441 VanDerWaalsContact O-N 3.13Å; S437-Q441 PolarHBondContact O-NE2 3.48Å
438	R	91.9	Very high	90.3	Very high	78 Å²	78	84.4 Å²	84.4	29%	0.294	44%	0.44	S	S	.	.	H	α-helix	trans	-67.7	-48.7	172.4	-178.8	-178.1	174.8	175.4	9.6	111.4	D360 T362 A434 R436 E440 Q441 E442	D360-R438 IonicContact OD2-CZ 3.65Å; D360-R438 IonicContact OD2-NH1 2.68Å; D360-R438 IonicContact OD2-NH2 3.68Å; D360-R438 PolarHBondContact OD2-NH2 3.31Å; T362-R438 PolarHBondContact OG1-NH1 3.48Å; A434-R438 PolarHBondContact O-N 2.78Å; A434-R438 VanDerWaalsContact O-N 3.1Å; R436-R438 PolarHBondContact O-N 3.42Å; R438-E440 VanDerWaalsContact C-N 3.28Å; R438-E440 PolarHBondContact O-N 2.8Å; R438-Q441 PolarHBondContact O-N 3.27Å; R438-E442 HydrophobicContact CG-CG 4.38Å; R438-E442 IonicContact CZ-OE1 2.76Å; R438-E442 IonicContact NE-OE1 3.33Å; R438-E442 PolarHBondContact NE-OE1 3.29Å; R438-E442 IonicContact NH2-OE1 3.7Å; R438-E442 PolarHBondContact NH2-OE1 2.86Å; R438-E442 WeakPolarHBondContact O-CG 3.24Å; R438-E442 PolarHBondContact O-N 3.26Å
439	A	92	Very high	89	Confident	21 Å²	21	89.7 Å²	89.7	17%	0.174	48%	0.475	C	S	.	.	H	α-helix	trans	-63.7	-33.5	-179.1	0	0	0	0	0	112.8	A385 L435 R436 Q443	A385-A439 HydrophobicContact CB-CB 4.01Å; L435-A439 WeakPolarHBondContact O-CB 3.28Å; L435-A439 PolarHBondContact O-N 2.89Å; R436-A439 PolarHBondContact O-N 3.45Å; A439-Q443 VanDerWaalsContact O-CG 3.26Å; A439-Q443 WeakPolarHBondContact O-CG 3.24Å; A439-Q443 PolarHBondContact O-N 3.36Å
440	E	92.7	Very high	87.5	Confident	122 Å²	122	91.5 Å²	91.5	57%	0.57	49%	0.494	S	S	*	.	H	α-helix	trans	-67.5	-48	172.9	-72.3	158.2	-166.3	0	0	111	R436 R438 E442 Q443 E444	R436-E440 WeakPolarHBondContact O-CB 3.19Å; R436-E440 WeakPolarHBondContact O-CG 3.34Å; R436-E440 PolarHBondContact O-N 3.28Å; R438-E440 VanDerWaalsContact C-N 3.28Å; R438-E440 PolarHBondContact O-N 2.8Å; E440-E442 PolarHBondContact O-N 3.33Å; E440-Q443 PolarHBondContact O-N 3.38Å; E440-Q443 VanDerWaalsContact O-N 3.17Å; E440-E444 WeakPolarHBondContact O-CB 3.21Å; E440-E444 PolarHBondContact O-N 2.85Å
441	Q	89.5	Confident	86	Confident	134 Å²	134	94.2 Å²	94.2	63%	0.626	51%	0.506	S	S	*	.	H	α-helix	trans	-61.2	-39.9	175.9	-73.5	168.8	34.5	0	0	113.1	S437 R438 Q443 A445	S437-Q441 WeakPolarHBondContact O-CB 3.37Å; S437-Q441 WeakPolarHBondContact O-CG 3.37Å; S437-Q441 PolarHBondContact O-N 2.92Å; S437-Q441 VanDerWaalsContact O-N 3.13Å; S437-Q441 PolarHBondContact O-NE2 3.48Å; R438-Q441 PolarHBondContact O-N 3.27Å; Q441-Q443 VanDerWaalsContact C-N 3.3Å; Q441-Q443 PolarHBondContact O-N 2.95Å; Q441-A445 VanDerWaalsContact O-CB 3.23Å; Q441-A445 WeakPolarHBondContact O-CB 3.49Å; Q441-A445 PolarHBondContact O-N 2.73Å
442	E	88	Confident	84	Confident	101 Å²	101	98.1 Å²	98.1	47%	0.472	54%	0.537	S	S	.	.	H	α-helix	trans	-69.4	-26.3	177	-73.1	175.6	174.2	0	0	112.9	R438 E440 K446	R438-E442 HydrophobicContact CG-CG 4.38Å; R438-E442 IonicContact CZ-OE1 2.76Å; R438-E442 IonicContact NE-OE1 3.33Å; R438-E442 PolarHBondContact NE-OE1 3.29Å; R438-E442 IonicContact NH2-OE1 3.7Å; R438-E442 PolarHBondContact NH2-OE1 2.86Å; R438-E442 WeakPolarHBondContact O-CG 3.24Å; R438-E442 PolarHBondContact O-N 3.26Å; E440-E442 PolarHBondContact O-N 3.33Å; E442-K446 WeakPolarHBondContact O-CB 3.29Å
443	Q	85.6	Confident	81.6	Confident	130 Å²	130	101 Å²	101	61%	0.607	57%	0.568	S	S	*	*	H	α-helix	trans	-79.2	-45.5	173	-74.9	173.7	37.6	0	0	111.6	A439 E440 Q441 A445 K446 A447	A439-Q443 VanDerWaalsContact O-CG 3.26Å; A439-Q443 WeakPolarHBondContact O-CG 3.24Å; A439-Q443 PolarHBondContact O-N 3.36Å; E440-Q443 PolarHBondContact O-N 3.38Å; E440-Q443 VanDerWaalsContact O-N 3.17Å; Q441-Q443 VanDerWaalsContact C-N 3.3Å; Q441-Q443 PolarHBondContact O-N 2.95Å; Q443-A445 PolarHBondContact O-N 2.96Å; Q443-K446 PolarHBondContact O-N 3.08Å; Q443-K446 VanDerWaalsContact O-N 3.13Å; Q443-A447 PolarHBondContact O-N 3.3Å
444	E	84.6	Confident	79.1	Confident	158 Å²	158	101.4 Å²	101.4	74%	0.738	59%	0.585	S	S	*	*	H	α-helix	trans	-57.5	-47.9	175.4	-167	77.7	-159.4	0	0	110.9	E440 K446 A447	E440-E444 WeakPolarHBondContact O-CB 3.21Å; E440-E444 PolarHBondContact O-N 2.85Å; E444-K446 PolarHBondContact O-N 2.8Å; E444-A447 WeakPolarHBondContact O-CB 3.17Å; E444-A447 PolarHBondContact O-N 2.92Å
445	A	84.1	Confident	76.4	Confident	92 Å²	92	105.6 Å²	105.6	76%	0.76	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	-14.8	179.2	0	0	0	0	0	114.3	Q441 Q443	Q441-A445 VanDerWaalsContact O-CB 3.23Å; Q441-A445 WeakPolarHBondContact O-CB 3.49Å; Q441-A445 PolarHBondContact O-N 2.73Å; Q443-A445 PolarHBondContact O-N 2.96Å
446	K	77.9	Confident	74.2	Confident	182 Å²	182	114.6 Å²	114.6	79%	0.791	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-9.8	177.7	-169	167.9	-179.3	177.3	0	112.9	E442 Q443 E444	E442-K446 WeakPolarHBondContact O-CB 3.29Å; Q443-K446 PolarHBondContact O-N 3.08Å; Q443-K446 VanDerWaalsContact O-N 3.13Å; E444-K446 PolarHBondContact O-N 2.8Å
447	A	72.2	Confident	71.5	Confident	60 Å²	60	114.1 Å²	114.1	50%	0.496	65%	0.651	S	S	.	*	S	Bend	trans	-65.9	126.7	169.2	0	0	0	0	0	109	Q443 E444	Q443-A447 PolarHBondContact O-N 3.3Å; E444-A447 WeakPolarHBondContact O-CB 3.17Å; E444-A447 PolarHBondContact O-N 2.92Å
448	P	74.5	Confident	69.1	Low	111 Å²	111	118.7 Å²	118.7	72%	0.721	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-63.9	144.4	174.9	27.5	-33.5	0	0	0	109.6
449	P	71.3	Confident	67.2	Low	111 Å²	111	122.9 Å²	122.9	72%	0.721	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-58.7	142.5	174.9	26.2	-34.1	0	0	0	109.6	E451	P449-E451 PolarHBondContact O-N 2.86Å
450	P	67.2	Low	65	Low	121 Å²	121	130.4 Å²	130.4	79%	0.786	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-59.9	125.8	175	25.8	-33.3	0	0	0	108.7
451	E	65	Low	63.2	Low	183 Å²	183	134.2 Å²	134.2	86%	0.855	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-59.2	131	178.3	-71.7	-150.1	143.6	0	0	109.8	P449 G453	P449-E451 PolarHBondContact O-N 2.86Å; E451-G453 PolarHBondContact O-N 3.06Å
452	P	55.6	Low	61.3	Low	125 Å²	125	134.8 Å²	134.8	81%	0.812	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-61.6	130.7	175.1	27	-33.1	0	0	0	108.3	A454	P452-A454 PolarHBondContact O-N 3.05Å
453	G	44.3	Very low	60.1	Low	64 Å²	64	135.2 Å²	135.2	66%	0.66	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-51.7	138.1	-159.3	0	0	0	0	0	114.5	E451 T455	E451-G453 PolarHBondContact O-N 3.06Å; G453-T455 VanDerWaalsContact C-N 3.27Å; G453-T455 PolarHBondContact O-N 3.12Å
454	A	44	Very low	58.2	Low	101 Å²	101	136.7 Å²	136.7	84%	0.835	78%	0.783	S	S	*	*			trans	-62.8	91	165.5	0	0	0	0	0	109.5	P452 R456	P452-A454 PolarHBondContact O-N 3.05Å; A454-R456 PolarHBondContact O-N 3.16Å
455	T	38.9	Very low	57.3	Low	145 Å²	145	138.1 Å²	138.1	89%	0.89	79%	0.789	S	S	*	*			trans	-60.1	80.8	158.2	33.1	0	0	0	0	108.4	G453 A457	G453-T455 VanDerWaalsContact C-N 3.27Å; G453-T455 PolarHBondContact O-N 3.12Å; T455-A457 PolarHBondContact O-N 3.13Å; T455-A457 VanDerWaalsContact O-N 3.16Å
456	R	48.8	Very low	55.9	Low	231 Å²	231	141.4 Å²	141.4	87%	0.872	79%	0.794	S	S	*	*			trans	-74.6	106.2	170.6	-159.9	174.7	-166.3	165.4	3.8	106.8	A454 T458	A454-R456 PolarHBondContact O-N 3.16Å; R456-T458 PolarHBondContact O-N 3.11Å
457	A	38.6	Very low	54.6	Low	80 Å²	80	137 Å²	137	66%	0.661	79%	0.792	S	S	*	*			trans	-45.8	126.7	175.5	0	0	0	0	0	110.3	T455	T455-A457 PolarHBondContact O-N 3.13Å; T455-A457 VanDerWaalsContact O-N 3.16Å
458	T	43.7	Very low	53.6	Low	143 Å²	143	139.9 Å²	139.9	88%	0.877	80%	0.803	S	S	*	*			trans	-116.5	121.9	150.4	-59.6	0	0	0	0	104	R456	R456-T458 PolarHBondContact O-N 3.11Å
459	E	53.3	Low	52.1	Low	165 Å²	165	142.6 Å²	142.6	77%	0.771	81%	0.811	S	S	*	*			trans	-76.6	150.7	-163.6	-65.7	159.7	158.1	0	0	110.6
460	E	45.3	Very low	51.1	Low	180 Å²	180	141.6 Å²	141.6	84%	0.841	81%	0.812	S	S	*	*			trans	19.6	111.6	144.1	-42.6	-69.3	132	0	0	117
461	E	55.1	Low	50.5	Low	202 Å²	202	141.3 Å²	141.3	94%	0.944	81%	0.81	S	S	*	*				-167.8	122.4	118.8	-105.5	170.3	-166.8	0	0	112
462	D	49.3	Very low	49.6	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	81%	0.809	S	S	*	*			trans	-92.3	133.8	176.7	168.2	39.2	0	0	0	109.3
463	S	63	Low	49.2	Very low	109 Å²	109	135.7 Å²	135.7	76%	0.762	81%	0.805	S	S	*	*			trans	-178	101.9	161.1	-81.1	0	0	0	0	112.7
464	D	45.8	Very low	49.5	Very low	162 Å²	162	139.1 Å²	139.1	87%	0.866	81%	0.812	S	S	*	*			trans	-94.7	119.9	156.4	-79.9	-50.5	0	0	0	109.3
465	E	65.3	Low	49.6	Very low	187 Å²	187	141 Å²	141	87%	0.874	81%	0.813	S	S	*	*			trans	-155.2	147.8	155.4	49.1	-173.8	158.3	0	0	115
466	D	53.9	Low	50	Low	162 Å²	162	137.9 Å²	137.9	87%	0.866	81%	0.81	S	S	*	*			trans	-76.3	162.7	-170.8	-76.9	-82.5	0	0	0	115.8
467	A	52.2	Low	49.9	Very low	89 Å²	89	132.3 Å²	132.3	74%	0.736	81%	0.814	S	S	*	*				113	149.6	126.9	0	0	0	0	0	121.3
468	V	50.1	Low	50.4	Low	121 Å²	121	132.2 Å²	132.2	73%	0.733	82%	0.821	S	S	*	*			trans	92.8	89.6	151.5	-161.4	0	0	0	0	120.4
469	L	44	Very low	50.6	Low	168 Å²	168	132.7 Å²	132.7	88%	0.88	82%	0.824	S	S	*	*				59.4	135.6	128.6	-56.2	174.7	0	0	0	123
470	A	50.2	Low	50.4	Low	90 Å²	90	128.5 Å²	128.5	74%	0.744	83%	0.825	S	S	*	*			trans	-82.6	-160.3	170.8	0	0	0	0	0	111.5
471	P	55	Low	51.2	Low	115 Å²	115	127.6 Å²	127.6	75%	0.747	83%	0.826	S	S	*	*			cis	-146.7	-168.9	7.3	42.2	-20	0	0	0	118.1
472	S	45.9	Very low	51	Low	121 Å²	121	127 Å²	127	85%	0.846	82%	0.823	S	S	*	*			trans	104.4	134	157	-41.2	0	0	0	0	117.2
473	G	47	Very low	51.6	Low	69 Å²	69	123.8 Å²	123.8	71%	0.711	83%	0.825	S	S	*	*			cis	174.9	154.2	-10.4	0	0	0	0	0	116.6
474	V	49.5	Very low	51.1	Low	136 Å²	136	126.7 Å²	126.7	82%	0.824	83%	0.832	S	S	*	*			trans	63.1	147.5	140.6	83	0	0	0	0	124
475	T	45.7	Very low	51.8	Low	139 Å²	139	122.3 Å²	122.3	85%	0.853	83%	0.825	S	S	*	*			trans	82.3	137.4	174	69.5	0	0	0	0	116.9
476	G	48.8	Very low	51.3	Low	80 Å²	80	122.1 Å²	122.1	83%	0.825	82%	0.824	S	S	*	*			cis	-165.2	164.6	-1.7	0	0	0	0	0	112
477	A	46.7	Very low	51.3	Low	114 Å²	114	118.4 Å²	118.4	94%	0.942	82%	0.816	S	S	*	*			trans	-95.3	165.7	-165.7	0	0	0	0	0	115.7
478	G	48.1	Very low	51.6	Low	79 Å²	79	120.5 Å²	120.5	81%	0.814	82%	0.822	S	S	*	*			trans	177.5	127.4	166.2	0	0	0	0	0	113.8
479	T	48	Very low	52.3	Low	153 Å²	153	118.6 Å²	118.6	94%	0.939	83%	0.827	S	S	*	*			trans	-114.4	158.9	-172	46.4	0	0	0	0	114
480	G	50.1	Low	53.3	Low	77 Å²	77	116 Å²	116	79%	0.794	82%	0.823	S	S	*	*			trans	125.8	147.2	172.1	0	0	0	0	0	111.7
481	D	61.7	Low	53.8	Low	161 Å²	161	121.7 Å²	121.7	86%	0.861	85%	0.849	S	S	*	*			cis	-155.3	166.8	5.5	-172.9	22.9	0	0	0	109.5
482	E	51.6	Low	53.7	Low	188 Å²	188	122.1 Å²	122.1	88%	0.879	85%	0.854	S	S	*	*			trans	-78	158.5	-176.6	-68.4	176.2	78.8	0	0	113.8
483	G	60.2	Low	54.2	Low	80 Å²	80	122.1 Å²	122.1	83%	0.825	85%	0.854	S	S	*	*			trans	-163.1	79.7	-179.6	0	0	0	0	0	113.3
484	D	52.5	Low	54.6	Low	170 Å²	170	125.1 Å²	125.1	91%	0.909	86%	0.862	S	S	*	*			trans	-75.2	153.7	179.9	-161	-3.3	0	0	0	112.6
485	G	60.5	Low	54.8	Low	70 Å²	70	124.4 Å²	124.4	72%	0.722	86%	0.864	S	S	*	*			trans	-170.5	44.6	-161.3	0	0	0	0	0	118.6
486	Q	54.9	Low	55.4	Low	183 Å²	183	123.5 Å²	123.5	86%	0.855	87%	0.865	S	S	*	*			trans	20.2	123.1	152.8	-148.4	97.2	46.9	0	0	120.9
487	A	54	Low	55.9	Low	84 Å²	84	126.4 Å²	126.4	69%	0.694	87%	0.868	S	S	*	*			trans	-76.1	-164.4	160.8	0	0	0	0	0	111.6
488	P	59.9	Low	56.5	Low	132 Å²	132	127.3 Å²	127.3	86%	0.857	86%	0.862	S	S	*	*			cis	-136.8	-175.7	-6.1	42.4	-24	0	0	0	115
489	G	64.9	Low	57.2	Low	82 Å²	82	131 Å²	131	85%	0.845	87%	0.866	S	S	*	*			trans	-178.3	110.3	165.9	0	0	0	0	0	113.8
490	S	64.3	Low	57.9	Low	114 Å²	114	129.2 Å²	129.2	80%	0.797	86%	0.86	S	S	*	*			trans	-109.8	144.5	-178.8	175.6	0	0	0	0	111.8
491	T	60.7	Low	58.7	Low	209 Å²	209	133.9 Å²	133.9	100%	1.282	87%	0.866	S	S	*	*			trans	-152.1	0	147.5	-58.8	0	0	0	0	108.1

Retrieved 491 of 491 residues in 150.6 ms (Link to these results)

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