A0A061IG29_CRIGR Loading...

Cleavage and polyadenylation specificity factor subunit 6

Component of the cleavage factor Im (CFIm) complex that functions as an activator of the pre-mRNA 3'-end cleavage and polyadenylation processing required for the maturation of pre-mRNA into functional mRNAs. CFIm contributes to the recruitment of multiprotein complexes on specific sequences on the pre-mRNA 3'-end, so called cleavage and polyadenylation signals (pA signals). Most pre-mRNAs contain multiple pA signals, resulting in alternative cleavage and polyadenylation (APA) producing mRNAs with variable 3'-end formation. The CFIm complex acts as a key regulator of cleavage and polyadenylation site choice during APA through its binding to 5'-UGUA-3' elements localized in the 3'-untranslated region (UTR) for a huge number of pre-mRNAs. CPSF6 enhances NUDT21/CPSF5 binding to 5'-UGUA-3' elements localized upstream of pA signals and promotes RNA looping, and hence activates directly the mRNA 3'-processing machinery. Plays a role in mRNA export.

AlphaFold DB (A0A5N4DGY3), UniProt , Accession A0A061IG29, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Cpsf6, Length 588 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	38	Very low	48.1	Very low	238 Å²	238	146.9 Å²	146.9	100%	1.172	79%	0.793	S	S	*	*				0	99.8	0	-68.2	150.7	172.6	0	0	104.6
2	A	39.4	Very low	48.4	Very low	94 Å²	94	141.8 Å²	141.8	78%	0.777	79%	0.785	S	S	*	*				63.4	132.6	53.7	0	0	0	0	0	110.2
3	D	42.5	Very low	48.9	Very low	162 Å²	162	142.8 Å²	142.8	87%	0.866	79%	0.788	S	S	*	*			cis	-155.1	179.2	0.1	-157	-88.4	0	0	0	108.4
4	G	44	Very low	49.1	Very low	59 Å²	59	141.3 Å²	141.3	61%	0.608	79%	0.785	S	S	*	*			trans	133	62.1	169.4	0	0	0	0	0	117
5	V	50.5	Low	49	Very low	123 Å²	123	136.7 Å²	136.7	75%	0.745	78%	0.783	S	S	*	*			trans	-132.7	101.9	150.6	-175.9	0	0	0	0	107.1	H7	V5-H7 PolarHBondContact O-N 3.09Å
6	D	54.2	Low	48.9	Very low	152 Å²	152	140 Å²	140	81%	0.813	79%	0.789	S	S	*	*			trans	-59.7	118.4	-178.3	-60.6	-79.9	0	0	0	111.2	I8	D6-I8 PolarHBondContact O-N 3.12Å
7	H	50.1	Low	48.8	Very low	180 Å²	180	142.8 Å²	142.8	83%	0.833	79%	0.794	S	S	*	*			trans	-74.2	108.2	170.4	-71.1	-49.7	0	0	0	109.3	V5 D9	V5-H7 PolarHBondContact O-N 3.09Å; H7-D9 PolarHBondContact O-N 3.25Å; H7-D9 VanDerWaalsContact O-N 3.1Å
8	I	50.9	Low	48.3	Very low	149 Å²	149	146.7 Å²	146.7	76%	0.764	80%	0.802	S	S	*	*			trans	-65.4	107.8	166.2	-63.7	169.9	0	0	0	107.2	D6 I10	D6-I8 PolarHBondContact O-N 3.12Å; I8-I10 HydrophobicContact CG2-CG1 4.27Å; I8-I10 PolarHBondContact O-N 3.08Å; I8-I10 VanDerWaalsContact O-N 3.16Å
9	D	49.6	Very low	48	Very low	120 Å²	120	147 Å²	147	64%	0.642	80%	0.803	S	S	*	*			trans	-81.8	94.5	-176.2	-155.2	-16	0	0	0	110.5	H7 Y11 A12	H7-D9 PolarHBondContact O-N 3.25Å; H7-D9 VanDerWaalsContact O-N 3.1Å; D9-Y11 PolarHBondContact O-N 2.97Å; D9-Y11 VanDerWaalsContact O-N 3.15Å; D9-A12 PolarHBondContact O-N 3.3Å
10	I	60	Low	47.7	Very low	139 Å²	139	149.4 Å²	149.4	71%	0.713	81%	0.808	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-7.5	-174.2	-63.6	170.1	0	0	0	112.1	I8	I8-I10 HydrophobicContact CG2-CG1 4.27Å; I8-I10 PolarHBondContact O-N 3.08Å; I8-I10 VanDerWaalsContact O-N 3.16Å
11	Y	49.8	Very low	47.3	Very low	200 Å²	200	151.7 Å²	151.7	78%	0.784	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	2.7	-178.4	-81.8	-79.2	0	0	0	115.4	D9 D13	D9-Y11 PolarHBondContact O-N 2.97Å; D9-Y11 VanDerWaalsContact O-N 3.15Å; Y11-D13 VanDerWaalsContact C-N 3.28Å; Y11-D13 PolarHBondContact O-N 3.46Å
12	A	51.5	Low	47.6	Very low	85 Å²	85	144.7 Å²	144.7	70%	0.702	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-17.9	-178.4	0	0	0	0	0	115	D9	D9-A12 PolarHBondContact O-N 3.3Å
13	D	55.5	Low	47.7	Very low	155 Å²	155	149.6 Å²	149.6	83%	0.829	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.2	33.7	-162.3	-142.6	9.6	0	0	0	114.4	Y11	Y11-D13 VanDerWaalsContact C-N 3.28Å; Y11-D13 PolarHBondContact O-N 3.46Å
14	V	51.1	Low	47.3	Very low	122 Å²	122	153.2 Å²	153.2	74%	0.739	80%	0.804	S	S	*	*	S	Bend	trans	-123.6	9.8	173.6	-150.8	0	0	0	0	112.2
15	G	47.2	Very low	46.9	Very low	73 Å²	73	153.5 Å²	153.5	75%	0.753	81%	0.807	S	S	*	*	S	Bend	trans	-97.1	-23.2	-173.6	0	0	0	0	0	116.1
16	E	48.8	Very low	46.7	Very low	189 Å²	189	151.4 Å²	151.4	88%	0.883	81%	0.81	S	S	*	*	S	Bend	trans	-107.8	-10.8	-168.3	-67.3	-153.6	132.6	0	0	115.9	F18	E16-F18 PolarHBondContact O-N 3.25Å
17	E	46.8	Very low	46.5	Very low	188 Å²	188	152.2 Å²	152.2	88%	0.879	81%	0.809	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	6.1	-172	-138.1	-173.7	168.3	0	0	115.8
18	F	39.3	Very low	46.3	Very low	212 Å²	212	149.6 Å²	149.6	93%	0.93	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	25.5	-179.2	-109.4	-83.6	0	0	0	115.1	E16	E16-F18 PolarHBondContact O-N 3.25Å
19	N	41.8	Very low	45.9	Very low	153 Å²	153	151.2 Å²	151.2	82%	0.818	81%	0.805	S	S	*	*			trans	-139.3	57.1	173.3	-161.2	18.5	0	0	0	113.3
20	Q	42.8	Very low	45.8	Very low	195 Å²	195	151.7 Å²	151.7	91%	0.911	81%	0.806	S	S	*	*			trans	-130.1	59.5	169.4	-166.9	163.6	97.7	0	0	111.3
21	E	38.8	Very low	45.3	Very low	197 Å²	197	151.1 Å²	151.1	92%	0.921	81%	0.805	S	S	*	*			trans	-134	64.7	163.3	-156.7	171.9	146.1	0	0	110.9
22	A	45.5	Very low	46	Very low	92 Å²	92	148.5 Å²	148.5	76%	0.76	80%	0.804	S	S	*	*	S	Bend	trans	-137.4	129.7	158.7	0	0	0	0	0	108.4
23	E	41.6	Very low	45.8	Very low	196 Å²	196	154.8 Å²	154.8	92%	0.916	81%	0.811	S	S	*	*			trans	80.6	74.4	170.7	-146.4	158.8	136.7	0	0	118.2
24	Y	34.4	Very low	45.5	Very low	238 Å²	238	153.2 Å²	153.2	93%	0.933	80%	0.802	S	S	*	*			trans	-136.5	140.8	135.1	-139.6	-95.8	0	0	0	112.1
25	G	34.6	Very low	45.5	Very low	66 Å²	66	154.8 Å²	154.8	68%	0.68	81%	0.806	S	S	*	*			trans	-61.4	157.3	-159.2	0	0	0	0	0	118.2	H27	G25-H27 PolarHBondContact O-N 3.11Å
26	G	47.4	Very low	45.7	Very low	79 Å²	79	157 Å²	157	81%	0.814	81%	0.805	S	S	*	*			trans	-70.5	105.1	175.2	0	0	0	0	0	113.8
27	H	48.2	Very low	45.7	Very low	169 Å²	169	155.3 Å²	155.3	78%	0.782	80%	0.801	S	S	*	*			trans	-152.3	166.7	147.8	-117.1	57.3	0	0	0	108.8	G25	G25-H27 PolarHBondContact O-N 3.11Å
28	D	45.7	Very low	45.2	Very low	124 Å²	124	150.9 Å²	150.9	66%	0.663	79%	0.79	S	S	*	*			trans	74.5	36.2	173.6	-52.7	-50.5	0	0	0	118.4	I30	D28-I30 WeakPolarHBondContact OD1-CD1 3.22Å
29	Q	42.5	Very low	45.2	Very low	184 Å²	184	147 Å²	147	86%	0.86	79%	0.787	S	S	*	*			trans	-92.2	84.7	132.4	-81.7	-167.6	42.9	0	0	108.2
30	I	47.8	Very low	44.9	Very low	129 Å²	129	145.3 Å²	145.3	66%	0.662	79%	0.787	S	S	*	*			trans	-80.8	116.7	166.6	-67.1	159.3	0	0	0	106.4	D28 L32	D28-I30 WeakPolarHBondContact OD1-CD1 3.22Å; I30-L32 PolarHBondContact O-N 2.64Å
31	D	50.3	Low	44.6	Very low	127 Å²	127	140.3 Å²	140.3	68%	0.679	78%	0.779	S	S	*	*			trans	-63.7	89.5	-173.8	-76.8	-60.1	0	0	0	113.1	Y33	D31-Y33 PolarHBondContact O-N 3.39Å
32	L	63.4	Low	44.3	Very low	145 Å²	145	138.1 Å²	138.1	76%	0.759	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	24.4	177.7	-144.6	77.8	0	0	0	113.7	I30	I30-L32 PolarHBondContact O-N 2.64Å
33	Y	47.9	Very low	43.7	Very low	217 Å²	217	141.5 Å²	141.5	85%	0.851	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.9	5.2	-178.9	-93.2	-73.3	0	0	0	114.7	D31	D31-Y33 PolarHBondContact O-N 3.39Å
34	D	48.9	Very low	43.4	Very low	122 Å²	122	135.3 Å²	135.3	65%	0.652	77%	0.767	S	S	*	*	S	Bend	trans	-94	-21.1	175.3	-148.1	34.3	0	0	0	113	V36	D34-V36 VanDerWaalsContact C-N 3.3Å; D34-V36 PolarHBondContact O-N 2.99Å
35	D	51.5	Low	43.3	Very low	155 Å²	155	132.2 Å²	132.2	83%	0.829	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	5.4	-174.6	-90.7	-17.5	0	0	0	116
36	V	51.5	Low	43.4	Very low	119 Å²	119	133 Å²	133	72%	0.721	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	-16.9	-175.1	-163.3	0	0	0	0	113.7	D34	D34-V36 VanDerWaalsContact C-N 3.3Å; D34-V36 PolarHBondContact O-N 2.99Å
37	I	49.3	Very low	43.6	Very low	154 Å²	154	134 Å²	134	79%	0.79	76%	0.759	S	S	*	*	S	Bend	trans	-138.7	56.1	177.8	-40.7	-177.4	0	0	0	112.3
38	S	36.4	Very low	43.1	Very low	95 Å²	95	134.3 Å²	134.3	66%	0.664	76%	0.761	S	S	*	*			trans	-132.5	98.3	159.5	-86.9	0	0	0	0	110.8	S40	S38-S40 PolarHBondContact O-N 3.49Å
39	P	38.4	Very low	42.4	Very low	131 Å²	131	135.7 Å²	135.7	85%	0.851	77%	0.768	S	S	*	*			trans	-77.6	109	171.5	30.9	-30.9	0	0	0	109.8
40	S	36.1	Very low	42.3	Very low	118 Å²	118	136.4 Å²	136.4	83%	0.825	76%	0.763	S	S	*	*			trans	-137	102.7	169.7	-171	0	0	0	0	111.7	S38	S38-S40 PolarHBondContact O-N 3.49Å
41	A	35.5	Very low	41.5	Very low	89 Å²	89	136.8 Å²	136.8	74%	0.736	77%	0.767	S	S	*	*			trans	-176.4	74.7	146.7	0	0	0	0	0	111.1	N43	A41-N43 PolarHBondContact O-N 2.91Å
42	N	34.1	Very low	40.8	Very low	151 Å²	151	140.3 Å²	140.3	81%	0.807	77%	0.772	S	S	*	*			trans	7.7	110.1	141.5	-168.1	54.5	0	0	0	118.1
43	N	32.4	Very low	39.4	Very low	163 Å²	163	140 Å²	140	87%	0.872	77%	0.768	S	S	*	*			trans	-136.7	122.9	139.8	-78.9	-78.2	0	0	0	105.8	A41	A41-N43 PolarHBondContact O-N 2.91Å
44	G	35.9	Very low	38.7	Very low	66 Å²	66	135.7 Å²	135.7	68%	0.68	76%	0.76	S	S	*	*			trans	-96	165.1	-166.7	0	0	0	0	0	114.6
45	D	30.7	Very low	37.8	Very low	174 Å²	174	136 Å²	136	93%	0.93	77%	0.766	S	S	*	*				-157.1	179.6	123.2	-150.7	-104.5	0	0	0	109.3
46	A	37.2	Very low	37	Very low	81 Å²	81	136.2 Å²	136.2	67%	0.669	77%	0.767	S	S	*	*			trans	-106.9	-158.3	-157.4	0	0	0	0	0	114.3
47	P	50.9	Low	36.5	Very low	101 Å²	101	134.2 Å²	134.2	66%	0.656	76%	0.756	S	S	*	*				-133.7	-166.4	-84.9	43.2	-27.2	0	0	0	115
48	E	38.6	Very low	37.4	Very low	176 Å²	176	131.4 Å²	131.4	82%	0.822	75%	0.748	S	S	*	*			trans	70.3	154.1	160.6	-66	167.5	147.1	0	0	116.7
49	D	31.2	Very low	37.2	Very low	152 Å²	152	130.3 Å²	130.3	81%	0.813	74%	0.737	S	S	*	*			cis	-144.3	-176.6	6.4	-160.6	-160.4	0	0	0	113.3
50	R	40.6	Very low	37.3	Very low	199 Å²	199	130.9 Å²	130.9	75%	0.751	74%	0.738	S	S	*	*			trans	-90	166.8	-172.3	-121.2	-179.1	-179.9	100	-4.5	115.1
51	D	31.4	Very low	37.3	Very low	138 Å²	138	128.7 Å²	128.7	74%	0.738	73%	0.734	S	S	*	*			trans	66.8	149	158.5	-47.4	-32.6	0	0	0	116.5
52	Y	35.4	Very low	37.4	Very low	201 Å²	201	131.8 Å²	131.8	79%	0.788	74%	0.738	S	S	*	*				175.6	132.4	72.5	-178	-99.5	0	0	0	112.4
53	M	33.8	Very low	37.5	Very low	139 Å²	139	131.6 Å²	131.6	69%	0.685	74%	0.737	S	S	*	*			trans	47.4	133.2	157.6	-52.6	-59.3	135.2	0	0	120.9
54	D	32.1	Very low	37.9	Very low	126 Å²	126	130.2 Å²	130.2	67%	0.674	73%	0.734	S	S	*	*			cis	65.4	102.7	42.9	-158.1	24.8	0	0	0	114.6
55	T	31.1	Very low	37.9	Very low	129 Å²	129	130.1 Å²	130.1	79%	0.791	73%	0.733	S	S	*	*				-178.9	171.2	92.1	30.5	0	0	0	0	113.7
56	L	34	Very low	38.1	Very low	159 Å²	159	132.3 Å²	132.3	83%	0.832	74%	0.735	S	S	*	*			trans	-91.2	-153.8	-164.6	-57	158.8	0	0	0	115.1
57	P	42.2	Very low	37.8	Very low	77 Å²	77	132.4 Å²	132.4	50%	0.5	74%	0.743	S	S	.	*			cis	-135.1	-168.3	-27.4	14.4	14.7	0	0	0	117	I264	P57-I264 VanDerWaalsContact C-CG1 3.5Å; P57-I264 HydrophobicContact CB-CB 4.49Å; P57-I264 HydrophobicContact CB-CD1 4.46Å; P57-I264 HydrophobicContact CB-CG1 3.52Å; P57-I264 HydrophobicContact CG-CB 4.34Å; P57-I264 HydrophobicContact CG-CG1 3.58Å; P57-I264 PolarHBondContact O-N 2.83Å
58	P	66.3	Low	36.8	Very low	95 Å²	95	132.4 Å²	132.4	62%	0.617	75%	0.752	S	S	*	*			trans	-123.4	178.8	-167.8	46.4	-34.9	0	0	0	120.5	P263 I264	P58-P263 CarbonylContact C-O 3.14Å; P58-P263 WeakPolarHBondContact CA-O 3.35Å; P58-I264 WeakPolarHBondContact O-CA 3.5Å; P58-I264 VanDerWaalsContact O-CD1 3.28Å; P58-I264 WeakPolarHBondContact O-CD1 3.21Å; P58-I264 WeakPolarHBondContact O-CG1 3.41Å
59	T	32.3	Very low	36.5	Very low	72 Å²	72	128.8 Å²	128.8	44%	0.442	75%	0.752	S	S	.	*			trans	-159.1	-165.2	166.5	20.7	0	0	0	0	112.3	P263 I264 F265	T59-P263 PolarHBondContact N-O 3.26Å; T59-P263 PolarHBondContact OG1-O 2.9Å; T59-I264 WeakPolarHBondContact OG1-CA 3.42Å; T59-F265 HydrophobicContact CG2-CB 4.35Å; T59-F265 PolarHBondContact OG1-N 2.98Å
60	V	41.1	Very low	36.6	Very low	142 Å²	142	127 Å²	127	86%	0.861	75%	0.748	S	S	*	*				-165.5	149.6	-90.4	147.1	0	0	0	0	111.6
61	G	36.3	Very low	36.3	Very low	72 Å²	72	124.8 Å²	124.8	74%	0.742	75%	0.752	S	S	*	*			trans	170	134.4	167.9	0	0	0	0	0	117.5
62	D	36.7	Very low	36.5	Very low	154 Å²	154	123.2 Å²	123.2	82%	0.824	75%	0.747	S	S	*	*			trans	-85.4	170.8	-176.6	-70.2	-96.8	0	0	0	114.2
63	D	38.2	Very low	36.5	Very low	147 Å²	147	119 Å²	119	79%	0.786	74%	0.742	S	S	*	*				-171.2	138.7	72.7	-112.7	-74.2	0	0	0	116.1
64	V	40.1	Very low	36.5	Very low	135 Å²	135	119.9 Å²	119.9	82%	0.818	74%	0.738	S	S	*	*			trans	30.1	139.2	139.9	-179.7	0	0	0	0	122.4
65	G	35.9	Very low	36.5	Very low	64 Å²	64	119.7 Å²	119.7	66%	0.66	74%	0.742	S	S	*	*			cis	162.7	-170.8	-2	0	0	0	0	0	116
66	K	34.5	Very low	37.1	Very low	220 Å²	220	118.4 Å²	118.4	96%	0.957	72%	0.723	S	S	*	*			trans	74	130.3	-178.7	-56.1	-179.4	-179.6	177.6	0	117.4
67	G	30.8	Very low	37.3	Very low	82 Å²	82	117.9 Å²	117.9	85%	0.845	73%	0.727	S	S	*	*			cis	165.2	110.9	-10.1	0	0	0	0	0	113.8
68	A	29.3	Very low	37.5	Very low	102 Å²	102	116.6 Å²	116.6	84%	0.843	73%	0.728	S	S	*	*			trans	-159.8	157.4	164.5	0	0	0	0	0	109.4
69	A	32.4	Very low	37.4	Very low	99 Å²	99	121.4 Å²	121.4	82%	0.818	74%	0.739	S	S	*	*			trans	-61.3	134.2	-165.3	0	0	0	0	0	114.5	N71	A69-N71 PolarHBondContact O-N 3.46Å
70	P	35	Very low	39.5	Very low	114 Å²	114	127.7 Å²	127.7	74%	0.74	76%	0.755	S	S	*	*			trans	-77.6	105.3	177.7	31.1	-32.9	0	0	0	110.7	V72	P70-V72 PolarHBondContact O-N 3.41Å
71	N	33.8	Very low	41.6	Very low	154 Å²	154	123 Å²	123	82%	0.824	72%	0.724	S	S	*	*			trans	-68.6	115	157.5	-159.9	-5.2	0	0	0	106.8	A69 V73	A69-N71 PolarHBondContact O-N 3.46Å; N71-V73 PolarHBondContact O-N 2.9Å
72	V	35.3	Very low	44.2	Very low	104 Å²	104	120.6 Å²	120.6	63%	0.63	70%	0.698	S	S	*	*			trans	-76.5	76.1	-168.5	-173.5	0	0	0	0	110.8	P70 Y74	P70-V72 PolarHBondContact O-N 3.41Å; V72-Y74 HydrophobicContact CG1-CD2 3.67Å; V72-Y74 HydrophobicContact CG1-CE2 3.74Å; V72-Y74 PolarHBondContact O-N 2.65Å
73	V	35.5	Very low	46.8	Very low	113 Å²	113	113.4 Å²	113.4	69%	0.685	66%	0.659	S	S	*	*			trans	-75.9	98.9	160	178.7	0	0	0	0	106.8	N71 T75	N71-V73 PolarHBondContact O-N 2.9Å; V73-T75 PolarHBondContact O-N 2.94Å
74	Y	34.7	Very low	49.5	Very low	158 Å²	158	107.5 Å²	107.5	62%	0.62	63%	0.626	S	S	*	*			trans	-63.1	106.4	167.3	-93.2	-88.9	0	0	0	109.2	V72 Y76	V72-Y74 HydrophobicContact CG1-CD2 3.67Å; V72-Y74 HydrophobicContact CG1-CE2 3.74Å; V72-Y74 PolarHBondContact O-N 2.65Å; Y74-Y76 AromaticContact CD1-CE1 3.81Å; Y74-Y76 HydrophobicContact CD1-CE1 3.81Å; Y74-Y76 HydrophobicContact CD1-CE2 4.4Å; Y74-Y76 AromaticContact CD1-CZ 3.73Å; Y74-Y76 HydrophobicContact CG-CE1 4.12Å; Y74-Y76 AromaticContact CG-CE2 3.89Å; Y74-Y76 HydrophobicContact CG-CE2 3.89Å; Y74-Y76 AromaticContact CG-CZ 3.56Å; Y74-Y76 WeakPolarHBondContact O-CD2 3.32Å; Y74-Y76 PolarHBondContact O-N 2.98Å
75	T	31.7	Very low	52	Low	121 Å²	121	101 Å²	101	74%	0.742	59%	0.587	S	S	*	*			trans	-72.6	76.5	167.8	40.3	0	0	0	0	109.6	V73 T77	V73-T75 PolarHBondContact O-N 2.94Å; T75-T77 PolarHBondContact O-N 3.31Å
76	Y	42.3	Very low	54.7	Low	102 Å²	102	98 Å²	98	40%	0.4	56%	0.555	S	S	.	*			trans	-66.5	97.9	178	-69.3	-72.4	0	0	0	111.5	Y74 L110	Y74-Y76 AromaticContact CD1-CE1 3.81Å; Y74-Y76 HydrophobicContact CD1-CE1 3.81Å; Y74-Y76 HydrophobicContact CD1-CE2 4.4Å; Y74-Y76 AromaticContact CD1-CZ 3.73Å; Y74-Y76 HydrophobicContact CG-CE1 4.12Å; Y74-Y76 AromaticContact CG-CE2 3.89Å; Y74-Y76 HydrophobicContact CG-CE2 3.89Å; Y74-Y76 AromaticContact CG-CZ 3.56Å; Y74-Y76 WeakPolarHBondContact O-CD2 3.32Å; Y74-Y76 PolarHBondContact O-N 2.98Å; Y76-L110 HydrophobicContact CD2-CD2 3.85Å; Y76-L110 HydrophobicContact CE1-CD2 4.03Å; Y76-L110 HydrophobicContact CE2-CD2 3.19Å; Y76-L110 HydrophobicContact CG-CD2 4.48Å
77	T	38	Very low	57.4	Low	149 Å²	149	89.4 Å²	89.4	91%	0.914	52%	0.52	S	S	*	.			trans	-85.9	11.9	166.8	51.6	0	0	0	0	112.7	T75	T75-T77 PolarHBondContact O-N 3.31Å
78	G	47.7	Very low	60.3	Low	50 Å²	50	85.9 Å²	85.9	52%	0.515	48%	0.482	S	S	.	.	S	Bend	trans	-100	158.2	-178.5	0	0	0	0	0	114.1	R80	G78-R80 PolarHBondContact O-N 2.93Å
79	K	63.6	Low	63.3	Low	195 Å²	195	81.7 Å²	81.7	85%	0.848	45%	0.445	S	S	*	.			trans	-65.7	112.8	169.8	-64.9	172.5	-176.5	170.4	0	108.7	I81	K79-I81 PolarHBondContact O-N 2.91Å
80	R	77.4	Confident	66.2	Low	205 Å²	205	83.7 Å²	83.7	77%	0.774	43%	0.432	S	S	*	.			trans	-58.8	130.6	170.2	64.1	-176.8	177.3	-172.7	-3	110	G78 L110	G78-R80 PolarHBondContact O-N 2.93Å; R80-L110 HydrophobicContact CB-CD1 4.23Å
81	I	85.3	Confident	68.9	Low	42 Å²	42	84.5 Å²	84.5	22%	0.215	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	120.7	-179.4	-65.7	160	0	0	0	107.6	K79 V131 E134 S137	K79-I81 PolarHBondContact O-N 2.91Å; I81-V131 HydrophobicContact CB-CG2 4.15Å; I81-V131 HydrophobicContact CG2-CG2 4.34Å; I81-V131 PolarHBondContact N-O 2.67Å; I81-V131 WeakPolarHBondContact O-CG2 3.39Å; I81-V131 PolarHBondContact O-N 2.98Å; I81-E134 HydrophobicContact CD1-CB 3.7Å; I81-E134 HydrophobicContact CD1-CG 4.09Å; I81-S137 WeakPolarHBondContact CG2-OG 3.44Å
82	A	90.4	Very high	71.6	Confident	23 Å²	23	77.5 Å²	77.5	19%	0.19	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	142.5	177	0	0	0	0	0	110.5	L128 V129 C159	A82-L128 HydrophobicContact CB-CD1 4.2Å; A82-L128 HydrophobicContact CB-CD2 4.31Å; A82-L128 HydrophobicContact CB-CG 4.23Å; A82-V129 WeakPolarHBondContact CA-O 3.37Å; A82-C159 HydrophobicContact CB-CB 3.88Å; A82-C159 WeakPolarHBondContact O-CB 3.14Å; A82-C159 PolarHBondContact O-N 3.36Å; A82-C159 PolarHBondContact O-SG 3.19Å
83	L	92	Very high	74.2	Confident	2 Å²	2	75.3 Å²	75.3	1%	0.01	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	148.9	175.4	-63.1	-179.3	0	0	0	109.9	L128 V129 L140 M141 V156	L83-L128 CarbonylContact O-C 3.53Å; L83-L128 WeakPolarHBondContact O-CA 3.48Å; L83-V129 PolarHBondContact N-O 3.05Å; L83-V129 PolarHBondContact O-N 3.32Å; L83-L140 HydrophobicContact CD1-CB 3.95Å; L83-L140 HydrophobicContact CD1-CD1 3.96Å; L83-M141 HydrophobicContact CD2-CE 3.38Å; L83-V156 HydrophobicContact CB-CG1 4.39Å; L83-V156 HydrophobicContact CD1-CG1 3.99Å
84	Y	94	Very high	76.9	Confident	23 Å²	23	74.6 Å²	74.6	9%	0.09	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	128.9	165.9	-67.4	-63.5	0	0	0	109.3	F115 A127 L128 V156 T157 C159 L164	Y84-F115 HydrophobicContact CD1-CE2 4.25Å; Y84-F115 AromaticContact CE1-CE2 3.79Å; Y84-F115 HydrophobicContact CE1-CE2 3.79Å; Y84-F115 AromaticContact CE1-CZ 3.86Å; Y84-F115 HydrophobicContact CE1-CZ 3.86Å; Y84-A127 WeakPolarHBondContact CA-O 3.31Å; Y84-L128 HydrophobicContact CD1-CB 4.05Å; Y84-L128 HydrophobicContact CE1-CB 3.99Å; Y84-L128 HydrophobicContact CE1-CD1 3.95Å; Y84-L128 HydrophobicContact CE1-CG 4.4Å; Y84-V156 CarbonylContact O-C 3.57Å; Y84-V156 WeakPolarHBondContact O-CA 3.42Å; Y84-T157 PolarHBondContact N-O 2.79Å; Y84-T157 PolarHBondContact O-N 3.46Å; Y84-C159 HydrophobicContact CE2-CB 4.27Å; Y84-L164 HydrophobicContact CE1-CD1 4.21Å; Y84-L164 HydrophobicContact CE2-CB 4.13Å
85	I	92.6	Very high	79.6	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	109.9	172.3	-52.3	177.7	0	0	0	106.7	L88 L97 F126 A127 V129 L144 P154 V156	I85-L88 HydrophobicContact CG2-CD1 4.26Å; I85-L88 HydrophobicContact CG2-CD2 4.21Å; I85-L88 HydrophobicContact CG2-CG 4.43Å; I85-L97 HydrophobicContact CD1-CD1 3.97Å; I85-L97 HydrophobicContact CD1-CD2 4.49Å; I85-L97 HydrophobicContact CG2-CD1 4.2Å; I85-F126 CarbonylContact O-C 3.57Å; I85-F126 WeakPolarHBondContact O-CA 3.39Å; I85-F126 WeakPolarHBondContact O-CB 3.47Å; I85-A127 PolarHBondContact N-O 2.85Å; I85-A127 PolarHBondContact O-N 3Å; I85-V129 HydrophobicContact CD1-CB 4.13Å; I85-V129 HydrophobicContact CD1-CG2 3.57Å; I85-V129 HydrophobicContact CG1-CG2 4.24Å; I85-L144 HydrophobicContact CD1-CD1 3.6Å; I85-L144 HydrophobicContact CG1-CD1 4.3Å; I85-L144 HydrophobicContact CG2-CD1 4.44Å; I85-P154 HydrophobicContact CG2-CB 3.85Å; I85-V156 HydrophobicContact CG1-CG2 4.24Å; I85-V156 HydrophobicContact CG2-CG2 4.41Å
86	G	92	Very high	82.4	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	-170.4	179.2	0	0	0	0	0	113.1	L88 G125 P154 V155	G86-L88 PolarHBondContact O-N 3.41Å; G86-G125 CarbonylContact C-O 3.54Å; G86-P154 WeakPolarHBondContact O-CA 3.17Å; G86-V155 PolarHBondContact N-O 3.37Å; G86-V155 PolarHBondContact O-N 2.93Å
87	N	92.4	Very high	84.7	Confident	39 Å²	39	65.7 Å²	65.7	21%	0.209	32%	0.323	C	S	.	.	S	Bend	trans	56.6	34.4	-170.3	-159	60.5	0	0	0	113.2	G125 Q152 N153 V155 Q170	N87-G125 PolarHBondContact N-O 3.34Å; N87-Q152 PolarHBondContact ND2-OE1 2.99Å; N87-Q152 VanDerWaalsContact O-CB 3.3Å; N87-Q152 WeakPolarHBondContact O-CB 3.41Å; N87-N153 PolarHBondContact ND2-O 2.95Å; N87-V155 HydrophobicContact CB-CB 4.29Å; N87-V155 HydrophobicContact CB-CG2 3.76Å; N87-Q170 PolarHBondContact OD1-NE2 2.96Å
88	L	91.6	Very high	87.2	Confident	9 Å²	9	60.4 Å²	60.4	5%	0.047	29%	0.29	C	S	.	.			trans	-90.9	155.5	172.5	-55.3	-179.7	0	0	0	110	I85 G86 T92 L97 F114 G125 L149 P154	I85-L88 HydrophobicContact CG2-CD1 4.26Å; I85-L88 HydrophobicContact CG2-CD2 4.21Å; I85-L88 HydrophobicContact CG2-CG 4.43Å; G86-L88 PolarHBondContact O-N 3.41Å; L88-T92 HydrophobicContact CB-CG2 4.35Å; L88-T92 HydrophobicContact CD1-CG2 4.35Å; L88-T92 HydrophobicContact CD2-CG2 4.47Å; L88-L97 HydrophobicContact CD1-CD1 4.42Å; L88-L97 HydrophobicContact CD1-CD2 4.43Å; L88-F114 HydrophobicContact CD1-CE1 4.23Å; L88-G125 PolarHBondContact N-O 2.91Å; L88-G125 WeakPolarHBondContact O-CA 3.24Å; L88-L149 HydrophobicContact CD2-CD1 3.92Å; L88-P154 HydrophobicContact CD2-CB 3.97Å; L88-P154 HydrophobicContact CD2-CG 4.08Å
89	T	92.3	Very high	89.3	Confident	13 Å²	13	64.3 Å²	64.3	8%	0.08	30%	0.295	C	S	.	.			trans	-74.2	156.6	172.1	67.7	0	0	0	0	110.3	W91 T92 H150 Q152	T89-W91 VanDerWaalsContact CB-CE2 3.5Å; T89-W91 HydrophobicContact CG2-CH2 4.27Å; T89-W91 HydrophobicContact CG2-CZ2 3.65Å; T89-W91 PolarHBondContact O-N 3.49Å; T89-W91 VanDerWaalsContact O-N 3.16Å; T89-W91 VanDerWaalsContact OG1-CD1 3.25Å; T89-W91 VanDerWaalsContact OG1-CE2 3.31Å; T89-W91 PolarHBondContact OG1-NE1 3.36Å; T89-W91 VanDerWaalsContact OG1-NE1 3.11Å; T89-T92 PolarHBondContact N-OG1 2.75Å; T89-T92 VanDerWaalsContact N-OG1 3.09Å; T89-T92 WeakPolarHBondContact O-CB 3.45Å; T89-T92 PolarHBondContact O-N 3.39Å; T89-T92 PolarHBondContact O-OG1 2.76Å; T89-T92 PolarHBondContact OG1-N 3.33Å; T89-T92 PolarHBondContact OG1-OG1 2.69Å; T89-H150 HydrophobicContact CG2-CB 3.82Å; T89-Q152 HydrophobicContact CG2-CG 3.97Å
90	W	92.5	Very high	90.5	Very high	141 Å²	141	55.5 Å²	55.5	53%	0.534	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-9.8	179.4	60.2	-102.3	0	0	0	113.8	Q122 S123	W90-Q122 HydrophobicContact CB-CG 4.12Å; W90-Q122 HydrophobicContact CG-CG 4.46Å; W90-S123 WeakPolarHBondContact CB-O 3.4Å
91	W	91.2	Very high	91.1	Very high	132 Å²	132	45.8 Å²	45.8	50%	0.5	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	3.7	172.5	61.8	78.3	0	0	0	113.5	T89 T93 H150	T89-W91 VanDerWaalsContact CB-CE2 3.5Å; T89-W91 HydrophobicContact CG2-CH2 4.27Å; T89-W91 HydrophobicContact CG2-CZ2 3.65Å; T89-W91 PolarHBondContact O-N 3.49Å; T89-W91 VanDerWaalsContact O-N 3.16Å; T89-W91 VanDerWaalsContact OG1-CD1 3.25Å; T89-W91 VanDerWaalsContact OG1-CE2 3.31Å; T89-W91 PolarHBondContact OG1-NE1 3.36Å; T89-W91 VanDerWaalsContact OG1-NE1 3.11Å; W91-T93 PolarHBondContact O-N 2.9Å; W91-H150 AromaticContact NE1-CG 3.6Å; W91-H150 AromaticContact NE1-ND1 3.83Å
92	T	90.3	Very high	91.3	Very high	7 Å²	7	48.2 Å²	48.2	4%	0.043	23%	0.233	C	C	.	.			trans	-65.8	124.8	171.7	-57.9	0	0	0	0	108.6	L88 T89 D96	L88-T92 HydrophobicContact CB-CG2 4.35Å; L88-T92 HydrophobicContact CD1-CG2 4.35Å; L88-T92 HydrophobicContact CD2-CG2 4.47Å; T89-T92 PolarHBondContact N-OG1 2.75Å; T89-T92 VanDerWaalsContact N-OG1 3.09Å; T89-T92 WeakPolarHBondContact O-CB 3.45Å; T89-T92 PolarHBondContact O-N 3.39Å; T89-T92 PolarHBondContact O-OG1 2.76Å; T89-T92 PolarHBondContact OG1-N 3.33Å; T89-T92 PolarHBondContact OG1-OG1 2.69Å; T92-D96 HydrophobicContact CG2-CB 4.16Å
93	T	91.4	Very high	91.2	Very high	57 Å²	57	50.6 Å²	50.6	35%	0.35	25%	0.248	S	C	.	.			trans	-89	167.9	-178.3	63.7	0	0	0	0	112.2	W91 E95 D96 L97	W91-T93 PolarHBondContact O-N 2.9Å; T93-E95 VanDerWaalsContact C-N 3.27Å; T93-E95 PolarHBondContact OG1-N 3.47Å; T93-D96 PolarHBondContact N-OD2 3.48Å; T93-D96 PolarHBondContact OG1-N 3.11Å; T93-D96 PolarHBondContact OG1-OD1 2.82Å; T93-D96 PolarHBondContact OG1-OD2 2.98Å; T93-D96 VanDerWaalsContact OG1-OD2 3.05Å; T93-L97 PolarHBondContact O-N 3.5Å
94	D	90.6	Very high	90.9	Very high	99 Å²	99	51.5 Å²	51.5	53%	0.529	25%	0.253	S	S	.	.	H	α-helix	trans	-64.9	-31.3	165.9	54.4	-65.3	0	0	0	112.3	L97 T98 I112 F114	D94-L97 PolarHBondContact O-N 3.02Å; D94-T98 WeakPolarHBondContact O-CB 3.22Å; D94-T98 PolarHBondContact O-N 3.35Å; D94-T98 PolarHBondContact O-OG1 2.87Å; D94-I112 HydrophobicContact CB-CG2 4.43Å; D94-F114 HydrophobicContact CB-CE2 3.87Å
95	E	91.7	Very high	90.4	Very high	149 Å²	149	52.4 Å²	52.4	70%	0.696	27%	0.269	S	S	*	.	H	α-helix	trans	-66	-49.6	175.4	-170.6	168.2	-158.4	0	0	111.3	T93 L97 T98 E99	T93-E95 VanDerWaalsContact C-N 3.27Å; T93-E95 PolarHBondContact OG1-N 3.47Å; E95-L97 VanDerWaalsContact C-N 3.27Å; E95-L97 PolarHBondContact O-N 3.45Å; E95-T98 PolarHBondContact O-N 3.05Å; E95-T98 VanDerWaalsContact O-N 3.13Å; E95-E99 PolarHBondContact O-N 2.92Å
96	D	91.3	Very high	90.1	Very high	45 Å²	45	52.4 Å²	52.4	24%	0.241	27%	0.269	C	S	.	.	H	α-helix	trans	-54.8	-44.6	174.9	-61.5	-37	0	0	0	111.3	T92 T93 A100 H150	T92-D96 HydrophobicContact CG2-CB 4.16Å; T93-D96 PolarHBondContact N-OD2 3.48Å; T93-D96 PolarHBondContact OG1-N 3.11Å; T93-D96 PolarHBondContact OG1-OD1 2.82Å; T93-D96 PolarHBondContact OG1-OD2 2.98Å; T93-D96 VanDerWaalsContact OG1-OD2 3.05Å; D96-A100 VanDerWaalsContact O-CB 3.29Å; D96-A100 WeakPolarHBondContact O-CB 3.49Å; D96-A100 PolarHBondContact O-N 3.44Å; D96-H150 IonicContact OD1-NE2 3.78Å; D96-H150 IonicContact OD2-CD2 2.82Å; D96-H150 IonicContact OD2-CE1 2.65Å; D96-H150 IonicContact OD2-NE2 3.83Å; D96-H150 PolarHBondContact OD2-NE2 3.11Å
97	L	90.1	Very high	89.8	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-69.7	-38.4	-178.6	-172.7	61	0	0	0	111.1	I85 L88 T93 D94 E95 V101 I112 F114 A127 V129 L149	I85-L97 HydrophobicContact CD1-CD1 3.97Å; I85-L97 HydrophobicContact CD1-CD2 4.49Å; I85-L97 HydrophobicContact CG2-CD1 4.2Å; L88-L97 HydrophobicContact CD1-CD1 4.42Å; L88-L97 HydrophobicContact CD1-CD2 4.43Å; T93-L97 PolarHBondContact O-N 3.5Å; D94-L97 PolarHBondContact O-N 3.02Å; E95-L97 VanDerWaalsContact C-N 3.27Å; E95-L97 PolarHBondContact O-N 3.45Å; L97-V101 WeakPolarHBondContact O-CB 3.37Å; L97-V101 WeakPolarHBondContact O-CG2 3.29Å; L97-V101 PolarHBondContact O-N 3.45Å; L97-I112 HydrophobicContact CD2-CG2 3.99Å; L97-F114 HydrophobicContact CD2-CZ 4.16Å; L97-A127 HydrophobicContact CD2-CB 4.14Å; L97-V129 HydrophobicContact CD2-CG2 3.92Å; L97-L149 HydrophobicContact CD1-CD1 4.19Å
98	T	90.9	Very high	89.6	Confident	37 Å²	37	58 Å²	58	23%	0.227	30%	0.299	C	S	.	.	H	α-helix	trans	-66.5	-46.1	176.3	-62.3	0	0	0	0	111.2	D94 E95 A100 V101 H102 I109 I112	D94-T98 WeakPolarHBondContact O-CB 3.22Å; D94-T98 PolarHBondContact O-N 3.35Å; D94-T98 PolarHBondContact O-OG1 2.87Å; E95-T98 PolarHBondContact O-N 3.05Å; E95-T98 VanDerWaalsContact O-N 3.13Å; T98-A100 VanDerWaalsContact C-N 3.33Å; T98-A100 PolarHBondContact O-N 2.86Å; T98-V101 PolarHBondContact O-N 3.42Å; T98-H102 VanDerWaalsContact CG2-CE1 3.41Å; T98-H102 WeakPolarHBondContact CG2-CE1 3.22Å; T98-H102 WeakPolarHBondContact O-CB 3.25Å; T98-H102 VanDerWaalsContact O-CG 3.28Å; T98-H102 PolarHBondContact O-N 2.76Å; T98-I109 HydrophobicContact CG2-CD1 4.06Å; T98-I112 VanDerWaalsContact OG1-CD1 3.25Å; T98-I112 WeakPolarHBondContact OG1-CD1 3.41Å
99	E	91.1	Very high	89.4	Confident	132 Å²	132	59.5 Å²	59.5	62%	0.617	31%	0.307	S	S	*	.	H	α-helix	trans	-61.3	-42.6	176.1	-172.6	-178.9	-170.3	0	0	111.3	E95 V101 H102 S103	E95-E99 PolarHBondContact O-N 2.92Å; E99-V101 VanDerWaalsContact C-N 3.32Å; E99-V101 PolarHBondContact O-N 3.33Å; E99-H102 PolarHBondContact O-N 2.68Å; E99-S103 VanDerWaalsContact O-CB 3.22Å; E99-S103 WeakPolarHBondContact O-CB 3.39Å; E99-S103 PolarHBondContact O-N 3.13Å; E99-S103 PolarHBondContact O-OG 2.84Å
100	A	89.3	Confident	89.2	Confident	11 Å²	11	62.2 Å²	62.2	9%	0.091	32%	0.32	C	S	.	.	H	α-helix	trans	-61.5	-38.8	176	0	0	0	0	0	112.6	D96 T98 L104 L144 L149	D96-A100 VanDerWaalsContact O-CB 3.29Å; D96-A100 WeakPolarHBondContact O-CB 3.49Å; D96-A100 PolarHBondContact O-N 3.44Å; T98-A100 VanDerWaalsContact C-N 3.33Å; T98-A100 PolarHBondContact O-N 2.86Å; A100-L104 WeakPolarHBondContact O-CG 3.46Å; A100-L144 HydrophobicContact CB-CD2 4.35Å; A100-L149 HydrophobicContact CB-CD1 4.23Å; A100-L149 HydrophobicContact CB-CD2 3.72Å
101	V	89.4	Confident	89	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-72.6	-46.6	177.5	169.7	0	0	0	0	111.3	L97 T98 E99 S103 L104 V106 I109 L140 L144	L97-V101 WeakPolarHBondContact O-CB 3.37Å; L97-V101 WeakPolarHBondContact O-CG2 3.29Å; L97-V101 PolarHBondContact O-N 3.45Å; T98-V101 PolarHBondContact O-N 3.42Å; E99-V101 VanDerWaalsContact C-N 3.32Å; E99-V101 PolarHBondContact O-N 3.33Å; V101-S103 VanDerWaalsContact C-N 3.27Å; V101-S103 PolarHBondContact O-N 3.21Å; V101-L104 WeakPolarHBondContact O-CB 3.42Å; V101-L104 PolarHBondContact O-N 2.89Å; V101-V106 HydrophobicContact CG1-CB 3.68Å; V101-V106 HydrophobicContact CG1-CG1 3.4Å; V101-V106 VanDerWaalsContact CG1-CG1 3.4Å; V101-V106 PolarHBondContact O-N 3.08Å; V101-I109 HydrophobicContact CB-CD1 3.91Å; V101-I109 HydrophobicContact CG1-CD1 3.49Å; V101-I109 VanDerWaalsContact CG1-CD1 3.49Å; V101-I109 HydrophobicContact CG1-CG1 3.7Å; V101-L140 HydrophobicContact CB-CD2 4.38Å; V101-L140 HydrophobicContact CG1-CD2 4.06Å; V101-L140 HydrophobicContact CG2-CD2 3.81Å; V101-L144 HydrophobicContact CG2-CD1 4.48Å
102	H	90.2	Very high	89	Confident	93 Å²	93	56 Å²	56	43%	0.431	30%	0.304	S	S	.	.	H	α-helix	trans	-58.9	-38.4	174.9	-72.2	-177.5	0	0	0	111.7	T98 E99 L104 G105 V106	T98-H102 VanDerWaalsContact CG2-CE1 3.41Å; T98-H102 WeakPolarHBondContact CG2-CE1 3.22Å; T98-H102 WeakPolarHBondContact O-CB 3.25Å; T98-H102 VanDerWaalsContact O-CG 3.28Å; T98-H102 PolarHBondContact O-N 2.76Å; E99-H102 PolarHBondContact O-N 2.68Å; H102-L104 PolarHBondContact O-N 3.24Å; H102-L104 VanDerWaalsContact O-N 3.11Å; H102-G105 PolarHBondContact O-N 3.28Å; H102-V106 PolarHBondContact CD2-O 2.82Å; H102-V106 VanDerWaalsContact CD2-O 3.28Å
103	S	88.4	Confident	89.2	Confident	74 Å²	74	61.6 Å²	61.6	52%	0.517	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-12	175	-65.4	0	0	0	0	114.6	E99 V101	E99-S103 VanDerWaalsContact O-CB 3.22Å; E99-S103 WeakPolarHBondContact O-CB 3.39Å; E99-S103 PolarHBondContact O-N 3.13Å; E99-S103 PolarHBondContact O-OG 2.84Å; V101-S103 VanDerWaalsContact C-N 3.27Å; V101-S103 PolarHBondContact O-N 3.21Å
104	L	85.4	Confident	89.3	Confident	20 Å²	20	61.2 Å²	61.2	11%	0.105	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	3.6	171.9	-60.6	176.4	0	0	0	112.9	A100 V101 H102 L140 L143 L144 R147	A100-L104 WeakPolarHBondContact O-CG 3.46Å; V101-L104 WeakPolarHBondContact O-CB 3.42Å; V101-L104 PolarHBondContact O-N 2.89Å; H102-L104 PolarHBondContact O-N 3.24Å; H102-L104 VanDerWaalsContact O-N 3.11Å; L104-L140 HydrophobicContact CD1-CD2 4.14Å; L104-L143 HydrophobicContact CD1-CB 3.95Å; L104-L143 HydrophobicContact CD2-CB 3.68Å; L104-L143 HydrophobicContact CD2-CD1 4.09Å; L104-L143 HydrophobicContact CD2-CG 4.5Å; L104-L143 HydrophobicContact CG-CB 4.39Å; L104-L144 HydrophobicContact CD1-CB 4.49Å; L104-L144 HydrophobicContact CD1-CD2 3.72Å; L104-L144 HydrophobicContact CD1-CG 3.69Å; L104-R147 HydrophobicContact CD2-CG 4.48Å
105	G	84.3	Confident	89.3	Confident	42 Å²	42	58.7 Å²	58.7	43%	0.433	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	43.8	-175.3	0	0	0	0	0	112	H102 K139	H102-G105 PolarHBondContact O-N 3.28Å; G105-K139 PolarHBondContact O-NZ 2.79Å
106	V	85.9	Confident	89.4	Confident	1 Å²	1	57 Å²	57	1%	0.006	30%	0.297	C	S	.	.			trans	-120.1	110.9	173	168.1	0	0	0	0	106.7	V101 H102 K139 L140	V101-V106 HydrophobicContact CG1-CB 3.68Å; V101-V106 HydrophobicContact CG1-CG1 3.4Å; V101-V106 VanDerWaalsContact CG1-CG1 3.4Å; V101-V106 PolarHBondContact O-N 3.08Å; H102-V106 PolarHBondContact CD2-O 2.82Å; H102-V106 VanDerWaalsContact CD2-O 3.28Å; V106-K139 HydrophobicContact CG2-CB 4.18Å; V106-K139 HydrophobicContact CG2-CD 3.94Å; V106-L140 HydrophobicContact CG2-CD2 4.48Å
107	N	85.9	Confident	89.4	Confident	125 Å²	125	57.3 Å²	57.3	67%	0.668	30%	0.299	S	S	*	.			trans	-120	7.6	-175.7	-56.3	-23.8	0	0	0	111.8
108	D	87.3	Confident	89.3	Confident	32 Å²	32	69.1 Å²	69.1	17%	0.171	34%	0.344	C	S	.	.			trans	-103.4	35.8	-175.5	60	-65.7	0	0	0	112.4	L110 V131 G132 S133 S136	D108-L110 PolarHBondContact O-N 3.45Å; D108-V131 WeakPolarHBondContact O-CA 3.48Å; D108-G132 PolarHBondContact O-N 3.11Å; D108-G132 PolarHBondContact OD2-N 3.23Å; D108-S133 WeakPolarHBondContact OD2-CB 3.44Å; D108-S133 PolarHBondContact OD2-N 3.05Å; D108-S136 WeakPolarHBondContact OD1-CB 3.15Å; D108-S136 PolarHBondContact OD1-OG 3.3Å; D108-S136 WeakPolarHBondContact OD2-CB 3.31Å; D108-S136 PolarHBondContact OD2-OG 3.14Å
109	I	87.3	Confident	89.1	Confident	39 Å²	39	72.3 Å²	72.3	20%	0.2	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	124	172.7	-50.6	176.3	0	0	0	108.5	T98 V101 I112 V129	T98-I109 HydrophobicContact CG2-CD1 4.06Å; V101-I109 HydrophobicContact CB-CD1 3.91Å; V101-I109 HydrophobicContact CG1-CD1 3.49Å; V101-I109 VanDerWaalsContact CG1-CD1 3.49Å; V101-I109 HydrophobicContact CG1-CG1 3.7Å; I109-I112 HydrophobicContact CG2-CD1 4.1Å; I109-I112 HydrophobicContact CG2-CG1 3.76Å; I109-V129 HydrophobicContact CG2-CG1 4.18Å
110	L	88.8	Confident	89	Confident	70 Å²	70	70.9 Å²	70.9	37%	0.366	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-46.9	179.4	-57.7	179.4	0	0	0	112.1	Y76 R80 D108 G130	Y76-L110 HydrophobicContact CD2-CD2 3.85Å; Y76-L110 HydrophobicContact CE1-CD2 4.03Å; Y76-L110 HydrophobicContact CE2-CD2 3.19Å; Y76-L110 HydrophobicContact CG-CD2 4.48Å; R80-L110 HydrophobicContact CB-CD1 4.23Å; D108-L110 PolarHBondContact O-N 3.45Å; L110-G130 PolarHBondContact N-O 3.02Å
111	E	88.1	Confident	88.9	Confident	94 Å²	94	72.4 Å²	72.4	44%	0.439	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	142.4	-177.9	61.7	179.8	157.4	0	0	110	L128 V129 G130	E111-L128 HydrophobicContact CG-CD2 4.27Å; E111-V129 CarbonylContact O-C 3.56Å; E111-V129 WeakPolarHBondContact O-CA 3.31Å; E111-G130 PolarHBondContact O-N 3.03Å
112	I	92.1	Very high	89	Confident	48 Å²	48	74.8 Å²	74.8	25%	0.246	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126.7	166.1	-58.7	-178	0	0	0	106.8	D94 L97 T98 I109 F114 A127 V129	D94-I112 HydrophobicContact CB-CG2 4.43Å; L97-I112 HydrophobicContact CD2-CG2 3.99Å; T98-I112 VanDerWaalsContact OG1-CD1 3.25Å; T98-I112 WeakPolarHBondContact OG1-CD1 3.41Å; I109-I112 HydrophobicContact CG2-CD1 4.1Å; I109-I112 HydrophobicContact CG2-CG1 3.76Å; I112-F114 HydrophobicContact CG2-CD2 4.14Å; I112-F114 HydrophobicContact CG2-CE2 3.77Å; I112-A127 HydrophobicContact CG2-CB 4.48Å; I112-V129 HydrophobicContact CG1-CG1 4.45Å; I112-V129 HydrophobicContact CG1-CG2 4.24Å; I112-V129 HydrophobicContact CG2-CG2 4.41Å
113	K	93.1	Very high	89.1	Confident	126 Å²	126	71.2 Å²	71.2	55%	0.548	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	102	-178.8	-177.5	172.2	-177.4	169.5	0	110.4	A127 L128	K113-A127 CarbonylContact O-C 3.6Å; K113-A127 WeakPolarHBondContact O-CA 3.37Å; K113-L128 PolarHBondContact N-O 2.96Å; K113-L128 PolarHBondContact O-N 3.33Å
114	F	93.8	Very high	89.2	Confident	49 Å²	49	69.9 Å²	69.9	22%	0.215	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	144	170.9	-76.6	-90	0	0	0	111.2	L88 D94 L97 I112 A127	L88-F114 HydrophobicContact CD1-CE1 4.23Å; D94-F114 HydrophobicContact CB-CE2 3.87Å; L97-F114 HydrophobicContact CD2-CZ 4.16Å; I112-F114 HydrophobicContact CG2-CD2 4.14Å; I112-F114 HydrophobicContact CG2-CE2 3.77Å; F114-A127 HydrophobicContact CD1-CB 3.91Å; F114-A127 HydrophobicContact CD2-CB 4.4Å; F114-A127 HydrophobicContact CE1-CB 4Å; F114-A127 HydrophobicContact CE2-CB 4.46Å; F114-A127 HydrophobicContact CG-CB 4.13Å; F114-A127 HydrophobicContact CZ-CB 4.28Å
115	F	91.9	Very high	89.5	Confident	45 Å²	45	69.3 Å²	69.3	20%	0.197	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	118.5	166.9	-73.7	-103.1	0	0	0	108.1	Y84 K124 F126 L128 L164	Y84-F115 HydrophobicContact CD1-CE2 4.25Å; Y84-F115 AromaticContact CE1-CE2 3.79Å; Y84-F115 HydrophobicContact CE1-CE2 3.79Å; Y84-F115 AromaticContact CE1-CZ 3.86Å; Y84-F115 HydrophobicContact CE1-CZ 3.86Å; F115-K124 HydrophobicContact CB-CD 4.19Å; F115-K124 WeakPolarHBondContact O-CB 3.44Å; F115-K124 WeakPolarHBondContact O-CG 3Å; F115-K124 PolarHBondContact O-N 3.45Å; F115-F126 HydrophobicContact CB-CD1 4.31Å; F115-F126 HydrophobicContact CB-CD2 4.04Å; F115-F126 HydrophobicContact CB-CE1 3.86Å; F115-F126 HydrophobicContact CB-CE2 3.56Å; F115-F126 HydrophobicContact CB-CG 4.4Å; F115-F126 HydrophobicContact CB-CZ 3.45Å; F115-F126 VanDerWaalsContact CB-CZ 3.45Å; F115-F126 AromaticContact CD1-CE2 3.75Å; F115-F126 HydrophobicContact CD1-CE2 3.75Å; F115-F126 AromaticContact CD1-CZ 3.88Å; F115-F126 HydrophobicContact CD1-CZ 3.88Å; F115-F126 AromaticContact CD2-CD2 3.59Å; F115-F126 HydrophobicContact CD2-CD2 3.59Å; F115-F126 AromaticContact CD2-CE2 3.3Å; F115-F126 HydrophobicContact CD2-CE2 3.3Å; F115-F126 HydrophobicContact CD2-CZ 4.1Å; F115-F126 HydrophobicContact CE1-CE2 4.26Å; F115-F126 HydrophobicContact CE2-CD2 4.25Å; F115-F126 AromaticContact CE2-CE2 3.87Å; F115-F126 HydrophobicContact CE2-CE2 3.87Å; F115-F126 AromaticContact CG-CD2 3.9Å; F115-F126 HydrophobicContact CG-CD2 3.9Å; F115-F126 HydrophobicContact CG-CE1 4.42Å; F115-F126 AromaticContact CG-CE2 3.23Å; F115-F126 HydrophobicContact CG-CE2 3.23Å; F115-F126 AromaticContact CG-CZ 3.54Å; F115-F126 HydrophobicContact CG-CZ 3.54Å; F115-F126 HydrophobicContact CZ-CE2 4.32Å; F115-F126 PolarHBondContact N-O 2.92Å; F115-L128 HydrophobicContact CE2-CB 3.86Å; F115-L164 HydrophobicContact CD1-CD1 4.39Å; F115-L164 HydrophobicContact CE1-CD1 3.88Å; F115-L164 HydrophobicContact CZ-CD1 4.11Å
116	E	93.5	Very high	89.9	Confident	113 Å²	113	67.4 Å²	67.4	53%	0.528	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	163.2	-175.3	58.5	174.3	-152.1	0	0	112	R118 Q122 K124	E116-R118 PolarHBondContact O-N 3.04Å; E116-Q122 CarbonylContact C-O 3.57Å; E116-Q122 VanDerWaalsContact CA-O 3.31Å; E116-Q122 WeakPolarHBondContact CA-O 3.43Å; E116-K124 WeakPolarHBondContact O-CE 3.08Å
117	N	90.2	Very high	90.3	Very high	52 Å²	52	67.3 Å²	67.3	28%	0.278	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	108.5	170.9	-81.5	-21.9	0	0	0	110	A119 N120 G121 Q122 K124	N117-A119 PolarHBondContact O-N 3.49Å; N117-N120 WeakPolarHBondContact CB-OD1 3.28Å; N117-N120 PolarHBondContact O-N 3.27Å; N117-N120 PolarHBondContact O-OD1 3.28Å; N117-G121 PolarHBondContact O-N 3.25Å; N117-Q122 PolarHBondContact N-O 3.18Å; N117-K124 WeakPolarHBondContact OD1-CE 3.42Å
118	R	88.8	Confident	90.6	Very high	249 Å²	249	62.6 Å²	62.6	94%	0.94	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-18.8	-179.4	-170	175.2	-178.4	179.4	2.6	115.3	E116	E116-R118 PolarHBondContact O-N 3.04Å
119	A	87.3	Confident	90.9	Very high	104 Å²	104	61.1 Å²	61.1	86%	0.86	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-28.2	178.2	0	0	0	0	0	114.1	N117	N117-A119 PolarHBondContact O-N 3.49Å
120	N	87.8	Confident	91.1	Very high	101 Å²	101	59.3 Å²	59.3	54%	0.54	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143	2.4	-171.9	69.2	-10.3	0	0	0	114.9	N117 Q122	N117-N120 WeakPolarHBondContact CB-OD1 3.28Å; N117-N120 PolarHBondContact O-N 3.27Å; N117-N120 PolarHBondContact O-OD1 3.28Å; N120-Q122 PolarHBondContact ND2-OE1 2.86Å; N120-Q122 PolarHBondContact O-N 2.82Å; N120-Q122 VanDerWaalsContact OD1-CB 3.31Å; N120-Q122 WeakPolarHBondContact OD1-CB 3.3Å; N120-Q122 PolarHBondContact OD1-N 3.03Å; N120-Q122 VanDerWaalsContact OD1-N 3.14Å
121	G	87.9	Confident	91.2	Very high	44 Å²	44	56 Å²	56	45%	0.454	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	8.1	-178.4	0	0	0	0	0	114.7	N117 S123	N117-G121 PolarHBondContact O-N 3.25Å; G121-S123 PolarHBondContact O-N 3.46Å
122	Q	90.4	Very high	91	Very high	50 Å²	50	52.5 Å²	52.5	23%	0.234	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	127.2	-177.2	-171	178.6	24.1	0	0	110.6	W90 E116 N117 N120 K124	W90-Q122 HydrophobicContact CB-CG 4.12Å; W90-Q122 HydrophobicContact CG-CG 4.46Å; E116-Q122 CarbonylContact C-O 3.57Å; E116-Q122 VanDerWaalsContact CA-O 3.31Å; E116-Q122 WeakPolarHBondContact CA-O 3.43Å; N117-Q122 PolarHBondContact N-O 3.18Å; N120-Q122 PolarHBondContact ND2-OE1 2.86Å; N120-Q122 PolarHBondContact O-N 2.82Å; N120-Q122 VanDerWaalsContact OD1-CB 3.31Å; N120-Q122 WeakPolarHBondContact OD1-CB 3.3Å; N120-Q122 PolarHBondContact OD1-N 3.03Å; N120-Q122 VanDerWaalsContact OD1-N 3.14Å; Q122-K124 PolarHBondContact O-N 2.7Å
123	S	92.4	Very high	90.8	Very high	18 Å²	18	52.5 Å²	52.5	13%	0.126	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	133.2	172	173.5	0	0	0	0	111	W90 G121 G125	W90-S123 WeakPolarHBondContact CB-O 3.4Å; G121-S123 PolarHBondContact O-N 3.46Å; S123-G125 PolarHBondContact O-N 2.99Å; S123-G125 PolarHBondContact OG-N 3.22Å
124	K	91.6	Very high	90.5	Very high	46 Å²	46	53.7 Å²	53.7	20%	0.2	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	2.2	174.9	-66.8	-178.4	-178.6	172.2	0	112.8	F115 E116 N117 Q122 F126 E168 S171	F115-K124 HydrophobicContact CB-CD 4.19Å; F115-K124 WeakPolarHBondContact O-CB 3.44Å; F115-K124 WeakPolarHBondContact O-CG 3Å; F115-K124 PolarHBondContact O-N 3.45Å; E116-K124 WeakPolarHBondContact O-CE 3.08Å; N117-K124 WeakPolarHBondContact OD1-CE 3.42Å; Q122-K124 PolarHBondContact O-N 2.7Å; K124-F126 HydrophobicContact CB-CD1 3.79Å; K124-F126 HydrophobicContact CB-CE1 3.65Å; K124-F126 HydrophobicContact CD-CE1 3.85Å; K124-F126 HydrophobicContact CD-CZ 4.35Å; K124-F126 HydrophobicContact CG-CE1 4.43Å; K124-E168 IonicContact NZ-OE1 3.84Å; K124-E168 PolarHBondContact NZ-OE1 2.71Å; K124-S171 WeakPolarHBondContact O-CB 3.23Å
125	G	91.3	Very high	90.2	Very high	8 Å²	8	54.4 Å²	54.4	8%	0.082	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	77.2	21.9	-177.2	0	0	0	0	0	114	G86 N87 L88 S123	G86-G125 CarbonylContact C-O 3.54Å; N87-G125 PolarHBondContact N-O 3.34Å; L88-G125 PolarHBondContact N-O 2.91Å; L88-G125 WeakPolarHBondContact O-CA 3.24Å; S123-G125 PolarHBondContact O-N 2.99Å; S123-G125 PolarHBondContact OG-N 3.22Å
126	F	93.6	Very high	90	Very high	1 Å²	1	52.4 Å²	52.4	0%	0.004	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	150.5	168.8	73.1	-83.1	0	0	0	112.6	I85 F115 K124 L164 F167 E168	I85-F126 CarbonylContact O-C 3.57Å; I85-F126 WeakPolarHBondContact O-CA 3.39Å; I85-F126 WeakPolarHBondContact O-CB 3.47Å; F115-F126 HydrophobicContact CB-CD1 4.31Å; F115-F126 HydrophobicContact CB-CD2 4.04Å; F115-F126 HydrophobicContact CB-CE1 3.86Å; F115-F126 HydrophobicContact CB-CE2 3.56Å; F115-F126 HydrophobicContact CB-CG 4.4Å; F115-F126 HydrophobicContact CB-CZ 3.45Å; F115-F126 VanDerWaalsContact CB-CZ 3.45Å; F115-F126 AromaticContact CD1-CE2 3.75Å; F115-F126 HydrophobicContact CD1-CE2 3.75Å; F115-F126 AromaticContact CD1-CZ 3.88Å; F115-F126 HydrophobicContact CD1-CZ 3.88Å; F115-F126 AromaticContact CD2-CD2 3.59Å; F115-F126 HydrophobicContact CD2-CD2 3.59Å; F115-F126 AromaticContact CD2-CE2 3.3Å; F115-F126 HydrophobicContact CD2-CE2 3.3Å; F115-F126 HydrophobicContact CD2-CZ 4.1Å; F115-F126 HydrophobicContact CE1-CE2 4.26Å; F115-F126 HydrophobicContact CE2-CD2 4.25Å; F115-F126 AromaticContact CE2-CE2 3.87Å; F115-F126 HydrophobicContact CE2-CE2 3.87Å; F115-F126 AromaticContact CG-CD2 3.9Å; F115-F126 HydrophobicContact CG-CD2 3.9Å; F115-F126 HydrophobicContact CG-CE1 4.42Å; F115-F126 AromaticContact CG-CE2 3.23Å; F115-F126 HydrophobicContact CG-CE2 3.23Å; F115-F126 AromaticContact CG-CZ 3.54Å; F115-F126 HydrophobicContact CG-CZ 3.54Å; F115-F126 HydrophobicContact CZ-CE2 4.32Å; F115-F126 PolarHBondContact N-O 2.92Å; K124-F126 HydrophobicContact CB-CD1 3.79Å; K124-F126 HydrophobicContact CB-CE1 3.65Å; K124-F126 HydrophobicContact CD-CE1 3.85Å; K124-F126 HydrophobicContact CD-CZ 4.35Å; K124-F126 HydrophobicContact CG-CE1 4.43Å; F126-L164 HydrophobicContact CE2-CD1 3.73Å; F126-L164 HydrophobicContact CZ-CD1 4.09Å; F126-F167 HydrophobicContact CB-CB 4.25Å; F126-F167 HydrophobicContact CB-CG 4.29Å; F126-F167 HydrophobicContact CD1-CB 3.72Å; F126-F167 HydrophobicContact CD2-CB 3.99Å; F126-F167 HydrophobicContact CD2-CG 4.47Å; F126-F167 HydrophobicContact CE1-CB 3.94Å; F126-F167 HydrophobicContact CE2-CB 4.2Å; F126-F167 HydrophobicContact CG-CB 3.74Å; F126-F167 HydrophobicContact CG-CG 4.25Å; F126-F167 HydrophobicContact CZ-CB 4.18Å; F126-E168 HydrophobicContact CE1-CG 4.28Å; F126-E168 HydrophobicContact CZ-CG 3.83Å
127	A	93.3	Very high	89.8	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	153.8	178.4	0	0	0	0	0	111	Y84 I85 L97 I112 K113 F114	Y84-A127 WeakPolarHBondContact CA-O 3.31Å; I85-A127 PolarHBondContact N-O 2.85Å; I85-A127 PolarHBondContact O-N 3Å; L97-A127 HydrophobicContact CD2-CB 4.14Å; I112-A127 HydrophobicContact CG2-CB 4.48Å; K113-A127 CarbonylContact O-C 3.6Å; K113-A127 WeakPolarHBondContact O-CA 3.37Å; F114-A127 HydrophobicContact CD1-CB 3.91Å; F114-A127 HydrophobicContact CD2-CB 4.4Å; F114-A127 HydrophobicContact CE1-CB 4Å; F114-A127 HydrophobicContact CE2-CB 4.46Å; F114-A127 HydrophobicContact CG-CB 4.13Å; F114-A127 HydrophobicContact CZ-CB 4.28Å
128	L	93.2	Very high	89.7	Confident	26 Å²	26	51 Å²	51	14%	0.136	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	132.9	160.5	176.3	154.2	0	0	0	108.4	A82 L83 Y84 E111 K113 F115	A82-L128 HydrophobicContact CB-CD1 4.2Å; A82-L128 HydrophobicContact CB-CD2 4.31Å; A82-L128 HydrophobicContact CB-CG 4.23Å; L83-L128 CarbonylContact O-C 3.53Å; L83-L128 WeakPolarHBondContact O-CA 3.48Å; Y84-L128 HydrophobicContact CD1-CB 4.05Å; Y84-L128 HydrophobicContact CE1-CB 3.99Å; Y84-L128 HydrophobicContact CE1-CD1 3.95Å; Y84-L128 HydrophobicContact CE1-CG 4.4Å; E111-L128 HydrophobicContact CG-CD2 4.27Å; K113-L128 PolarHBondContact N-O 2.96Å; K113-L128 PolarHBondContact O-N 3.33Å; F115-L128 HydrophobicContact CE2-CB 3.86Å
129	V	92.6	Very high	89.8	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	122.2	172.5	180	0	0	0	0	108.5	A82 L83 I85 L97 I109 E111 I112 V131	A82-V129 WeakPolarHBondContact CA-O 3.37Å; L83-V129 PolarHBondContact N-O 3.05Å; L83-V129 PolarHBondContact O-N 3.32Å; I85-V129 HydrophobicContact CD1-CB 4.13Å; I85-V129 HydrophobicContact CD1-CG2 3.57Å; I85-V129 HydrophobicContact CG1-CG2 4.24Å; L97-V129 HydrophobicContact CD2-CG2 3.92Å; I109-V129 HydrophobicContact CG2-CG1 4.18Å; E111-V129 CarbonylContact O-C 3.56Å; E111-V129 WeakPolarHBondContact O-CA 3.31Å; I112-V129 HydrophobicContact CG1-CG1 4.45Å; I112-V129 HydrophobicContact CG1-CG2 4.24Å; I112-V129 HydrophobicContact CG2-CG2 4.41Å; V129-V131 HydrophobicContact CG1-CG1 4.26Å
130	G	91.4	Very high	89.9	Confident	2 Å²	2	38.3 Å²	38.3	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	130.7	171.3	0	0	0	0	0	110.4	L110 E111	L110-G130 PolarHBondContact N-O 3.02Å; E111-G130 PolarHBondContact O-N 3.03Å
131	V	90.8	Very high	89.9	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	149.4	174.5	-64.7	0	0	0	0	111.6	I81 D108 V129 L140	I81-V131 HydrophobicContact CB-CG2 4.15Å; I81-V131 HydrophobicContact CG2-CG2 4.34Å; I81-V131 PolarHBondContact N-O 2.67Å; I81-V131 WeakPolarHBondContact O-CG2 3.39Å; I81-V131 PolarHBondContact O-N 2.98Å; D108-V131 WeakPolarHBondContact O-CA 3.48Å; V129-V131 HydrophobicContact CG1-CG1 4.26Å; V131-L140 HydrophobicContact CG1-CD1 3.89Å
132	G	85.1	Confident	90	Very high	21 Å²	21	38.2 Å²	38.2	22%	0.216	21%	0.206	C	C	.	.	S	Bend	trans	-82.9	-21.4	179.5	0	0	0	0	0	114.4	D108	D108-G132 PolarHBondContact O-N 3.11Å; D108-G132 PolarHBondContact OD2-N 3.23Å
133	S	86.8	Confident	89.8	Confident	47 Å²	47	39 Å²	39	33%	0.329	21%	0.212	S	C	.	.			trans	-113.5	145	-176.7	-168.4	0	0	0	0	113.4	D108 A135 S136 S137	D108-S133 WeakPolarHBondContact OD2-CB 3.44Å; D108-S133 PolarHBondContact OD2-N 3.05Å; S133-A135 VanDerWaalsContact C-N 3.32Å; S133-A135 PolarHBondContact OG-N 3.05Å; S133-S136 WeakPolarHBondContact CB-OG 3.41Å; S133-S136 PolarHBondContact O-OG 3.23Å; S133-S137 PolarHBondContact O-N 3.26Å
134	E	86.5	Confident	89.5	Confident	152 Å²	152	38.2 Å²	38.2	71%	0.71	21%	0.206	S	C	*	.	H	α-helix	trans	-72.5	-30.1	169.3	-168.3	171.8	173.8	0	0	111.6	I81 S137 K138	I81-E134 HydrophobicContact CD1-CB 3.7Å; I81-E134 HydrophobicContact CD1-CG 4.09Å; E134-S137 WeakPolarHBondContact O-CB 3.44Å; E134-S137 PolarHBondContact O-N 3.45Å; E134-K138 PolarHBondContact O-N 2.95Å
135	A	87.5	Confident	89.4	Confident	63 Å²	63	38.5 Å²	38.5	52%	0.521	21%	0.213	S	C	.	.	H	α-helix	trans	-68.3	-36.7	177.8	0	0	0	0	0	112.2	S133 K139	S133-A135 VanDerWaalsContact C-N 3.32Å; S133-A135 PolarHBondContact OG-N 3.05Å; A135-K139 WeakPolarHBondContact O-CG 3.42Å; A135-K139 PolarHBondContact O-N 3.16Å; A135-K139 VanDerWaalsContact O-N 3.12Å
136	S	87.3	Confident	89.1	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-69.7	-46.1	173.7	55.2	0	0	0	0	111.3	D108 S133 K138 K139 L140	D108-S136 WeakPolarHBondContact OD1-CB 3.15Å; D108-S136 PolarHBondContact OD1-OG 3.3Å; D108-S136 WeakPolarHBondContact OD2-CB 3.31Å; D108-S136 PolarHBondContact OD2-OG 3.14Å; S133-S136 WeakPolarHBondContact CB-OG 3.41Å; S133-S136 PolarHBondContact O-OG 3.23Å; S136-K138 VanDerWaalsContact C-N 3.28Å; S136-K138 PolarHBondContact O-N 2.94Å; S136-K139 WeakPolarHBondContact O-CB 3.15Å; S136-K139 PolarHBondContact O-N 2.72Å; S136-K139 VanDerWaalsContact O-N 3.1Å; S136-L140 VanDerWaalsContact O-CG 3.31Å; S136-L140 WeakPolarHBondContact O-CG 3.42Å; S136-L140 PolarHBondContact O-N 3.24Å
137	S	89.3	Confident	88.6	Confident	11 Å²	11	51.6 Å²	51.6	8%	0.077	26%	0.264	C	S	.	.	H	α-helix	trans	-49.5	-48.5	173.7	173.3	0	0	0	0	112.3	I81 S133 E134 L140 M141	I81-S137 WeakPolarHBondContact CG2-OG 3.44Å; S133-S137 PolarHBondContact O-N 3.26Å; E134-S137 WeakPolarHBondContact O-CB 3.44Å; E134-S137 PolarHBondContact O-N 3.45Å; S137-L140 PolarHBondContact O-N 3.2Å; S137-M141 PolarHBondContact O-N 3.49Å; S137-M141 VanDerWaalsContact O-N 3.14Å
138	K	89.3	Confident	88.3	Confident	124 Å²	124	57.9 Å²	57.9	54%	0.539	29%	0.294	S	S	.	.	H	α-helix	trans	-66.8	-41.9	178.2	-168.5	174.7	-174.4	-58.9	0	113	E134 S136 L140 M141 D142	E134-K138 PolarHBondContact O-N 2.95Å; S136-K138 VanDerWaalsContact C-N 3.28Å; S136-K138 PolarHBondContact O-N 2.94Å; K138-L140 VanDerWaalsContact C-N 3.27Å; K138-L140 PolarHBondContact O-N 3.14Å; K138-M141 PolarHBondContact O-N 3.32Å; K138-D142 IonicContact NZ-OD2 3.77Å; K138-D142 PolarHBondContact NZ-OD2 3.41Å; K138-D142 PolarHBondContact O-N 3.14Å
139	K	90.3	Very high	87.9	Confident	87 Å²	87	57.7 Å²	57.7	38%	0.378	29%	0.293	S	S	.	.	H	α-helix	trans	-57.2	-40.8	172.8	-76.5	177.1	-179.2	-171.7	0	111.8	G105 V106 A135 S136 D142 L143	G105-K139 PolarHBondContact O-NZ 2.79Å; V106-K139 HydrophobicContact CG2-CB 4.18Å; V106-K139 HydrophobicContact CG2-CD 3.94Å; A135-K139 WeakPolarHBondContact O-CG 3.42Å; A135-K139 PolarHBondContact O-N 3.16Å; A135-K139 VanDerWaalsContact O-N 3.12Å; S136-K139 WeakPolarHBondContact O-CB 3.15Å; S136-K139 PolarHBondContact O-N 2.72Å; S136-K139 VanDerWaalsContact O-N 3.1Å; K139-D142 PolarHBondContact O-N 2.76Å; K139-L143 HydrophobicContact CB-CD1 4.35Å; K139-L143 WeakPolarHBondContact O-CB 3.45Å; K139-L143 WeakPolarHBondContact O-CG 3.3Å; K139-L143 PolarHBondContact O-N 3.09Å
140	L	89.5	Confident	87.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-63.7	-46.2	178.9	-66.9	173.6	0	0	0	111.2	L83 V101 L104 V106 V131 S136 S137 K138 D142 L144 V156	L83-L140 HydrophobicContact CD1-CB 3.95Å; L83-L140 HydrophobicContact CD1-CD1 3.96Å; V101-L140 HydrophobicContact CB-CD2 4.38Å; V101-L140 HydrophobicContact CG1-CD2 4.06Å; V101-L140 HydrophobicContact CG2-CD2 3.81Å; L104-L140 HydrophobicContact CD1-CD2 4.14Å; V106-L140 HydrophobicContact CG2-CD2 4.48Å; V131-L140 HydrophobicContact CG1-CD1 3.89Å; S136-L140 VanDerWaalsContact O-CG 3.31Å; S136-L140 WeakPolarHBondContact O-CG 3.42Å; S136-L140 PolarHBondContact O-N 3.24Å; S137-L140 PolarHBondContact O-N 3.2Å; K138-L140 VanDerWaalsContact C-N 3.27Å; K138-L140 PolarHBondContact O-N 3.14Å; L140-D142 PolarHBondContact O-N 2.84Å; L140-L144 HydrophobicContact CB-CD1 4.22Å; L140-L144 HydrophobicContact CD2-CD1 3.61Å; L140-L144 HydrophobicContact CD2-CG 3.88Å; L140-L144 HydrophobicContact CG-CD1 4.46Å; L140-L144 WeakPolarHBondContact O-CB 3.41Å; L140-L144 PolarHBondContact O-N 3.22Å; L140-V156 HydrophobicContact CB-CG1 4.44Å
141	M	88.4	Confident	87.2	Confident	68 Å²	68	64.7 Å²	64.7	34%	0.335	34%	0.339	S	S	.	.	H	α-helix	trans	-60.1	-43.2	174.6	-65.8	-172.4	-166.5	0	0	112.9	L83 S137 K138 P145 V156 P158	L83-M141 HydrophobicContact CD2-CE 3.38Å; S137-M141 PolarHBondContact O-N 3.49Å; S137-M141 VanDerWaalsContact O-N 3.14Å; K138-M141 PolarHBondContact O-N 3.32Å; M141-P145 WeakPolarHBondContact O-CD 3.49Å; M141-V156 HydrophobicContact CG-CG1 3.99Å; M141-P158 HydrophobicContact CE-CB 4.32Å; M141-P158 HydrophobicContact CE-CG 3.77Å
142	D	88.9	Confident	87	Confident	75 Å²	75	68.5 Å²	68.5	40%	0.401	36%	0.357	S	S	.	.	H	α-helix	trans	-80	-22.9	-173.6	-72.3	-30.6	0	0	0	114	K138 K139 L140 K146	K138-D142 IonicContact NZ-OD2 3.77Å; K138-D142 PolarHBondContact NZ-OD2 3.41Å; K138-D142 PolarHBondContact O-N 3.14Å; K139-D142 PolarHBondContact O-N 2.76Å; L140-D142 PolarHBondContact O-N 2.84Å; D142-K146 WeakPolarHBondContact O-CE 3.45Å; D142-K146 PolarHBondContact O-NZ 3.29Å
143	L	87.8	Confident	87.3	Confident	68 Å²	68	70.9 Å²	70.9	36%	0.356	37%	0.365	S	S	.	.	H	α-helix	trans	-122.9	-32.2	-168.2	-57.7	172.4	0	0	0	115.6	L104 K139 K146	L104-L143 HydrophobicContact CD1-CB 3.95Å; L104-L143 HydrophobicContact CD2-CB 3.68Å; L104-L143 HydrophobicContact CD2-CD1 4.09Å; L104-L143 HydrophobicContact CD2-CG 4.5Å; L104-L143 HydrophobicContact CG-CB 4.39Å; K139-L143 HydrophobicContact CB-CD1 4.35Å; K139-L143 WeakPolarHBondContact O-CB 3.45Å; K139-L143 WeakPolarHBondContact O-CG 3.3Å; K139-L143 PolarHBondContact O-N 3.09Å; L143-K146 PolarHBondContact O-N 3.07Å
144	L	85.1	Confident	87.4	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-62.8	-39.5	178.6	-84.6	179.4	0	0	0	113.5	I85 A100 V101 L104 L140 K146 R147 P154 V156	I85-L144 HydrophobicContact CD1-CD1 3.6Å; I85-L144 HydrophobicContact CG1-CD1 4.3Å; I85-L144 HydrophobicContact CG2-CD1 4.44Å; A100-L144 HydrophobicContact CB-CD2 4.35Å; V101-L144 HydrophobicContact CG2-CD1 4.48Å; L104-L144 HydrophobicContact CD1-CB 4.49Å; L104-L144 HydrophobicContact CD1-CD2 3.72Å; L104-L144 HydrophobicContact CD1-CG 3.69Å; L140-L144 HydrophobicContact CB-CD1 4.22Å; L140-L144 HydrophobicContact CD2-CD1 3.61Å; L140-L144 HydrophobicContact CD2-CG 3.88Å; L140-L144 HydrophobicContact CG-CD1 4.46Å; L140-L144 WeakPolarHBondContact O-CB 3.41Å; L140-L144 PolarHBondContact O-N 3.22Å; L144-K146 PolarHBondContact O-N 3.27Å; L144-R147 WeakPolarHBondContact O-CB 3.5Å; L144-R147 PolarHBondContact O-N 3.48Å; L144-P154 WeakPolarHBondContact O-CD 3.36Å; L144-V156 HydrophobicContact CB-CG2 3.5Å; L144-V156 HydrophobicContact CD1-CG2 3.58Å; L144-V156 HydrophobicContact CG-CG2 4.18Å
145	P	88.7	Confident	87.7	Confident	53 Å²	53	64.1 Å²	64.1	34%	0.344	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-62.9	-15.6	176.8	-24.1	35.2	0	0	0	114.6	M141 N153 P154	M141-P145 WeakPolarHBondContact O-CD 3.49Å; P145-N153 PolarHBondContact O-ND2 3.49Å; P145-P154 VanDerWaalsContact CA-O 3.24Å; P145-P154 WeakPolarHBondContact CA-O 3.18Å
146	K	86.2	Confident	87.9	Confident	158 Å²	158	62 Å²	62	69%	0.687	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-93.7	-1.6	175.2	-60.9	167.8	-176.1	148.8	0	112.7	D142 L143 L144	D142-K146 WeakPolarHBondContact O-CE 3.45Å; D142-K146 PolarHBondContact O-NZ 3.29Å; L143-K146 PolarHBondContact O-N 3.07Å; L144-K146 PolarHBondContact O-N 3.27Å
147	R	82.6	Confident	88	Confident	125 Å²	125	62.4 Å²	62.4	47%	0.472	32%	0.315	S	S	.	.	S	Bend	trans	-96.4	158.1	167	-62.4	-56.2	-168.3	172.7	4.5	108.9	L104 L144 P154	L104-R147 HydrophobicContact CD2-CG 4.48Å; L144-R147 WeakPolarHBondContact O-CB 3.5Å; L144-R147 PolarHBondContact O-N 3.48Å; R147-P154 WeakPolarHBondContact O-CD 3.33Å
148	E	87	Confident	88	Confident	133 Å²	133	64.9 Å²	64.9	62%	0.621	33%	0.331	S	S	*	.			trans	-121.2	123.1	173.8	-71.5	174.5	-170	0	0	107.6	Q152 N153	E148-Q152 CarbonylContact C-O 3.55Å; E148-Q152 WeakPolarHBondContact CA-O 3.49Å; E148-N153 WeakPolarHBondContact CG-ND2 3.45Å
149	L	85.8	Confident	87.9	Confident	22 Å²	22	62.4 Å²	62.4	12%	0.115	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-106.7	116.8	172.4	-59.1	-176.8	0	0	0	107.1	L88 L97 A100 G151 Q152 P154	L88-L149 HydrophobicContact CD2-CD1 3.92Å; L97-L149 HydrophobicContact CD1-CD1 4.19Å; A100-L149 HydrophobicContact CB-CD1 4.23Å; A100-L149 HydrophobicContact CB-CD2 3.72Å; L149-G151 PolarHBondContact O-N 2.83Å; L149-G151 VanDerWaalsContact O-N 3.14Å; L149-Q152 PolarHBondContact N-O 2.99Å; L149-Q152 PolarHBondContact O-N 3.21Å; L149-P154 HydrophobicContact CB-CG 4.31Å; L149-P154 HydrophobicContact CD1-CG 3.71Å; L149-P154 HydrophobicContact CG-CG 3.71Å
150	H	84.2	Confident	87.8	Confident	92 Å²	92	62 Å²	62	43%	0.426	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	34.8	-178.8	-56.3	-69	0	0	0	114.2	T89 W91 D96	T89-H150 HydrophobicContact CG2-CB 3.82Å; W91-H150 AromaticContact NE1-CG 3.6Å; W91-H150 AromaticContact NE1-ND1 3.83Å; D96-H150 IonicContact OD1-NE2 3.78Å; D96-H150 IonicContact OD2-CD2 2.82Å; D96-H150 IonicContact OD2-CE1 2.65Å; D96-H150 IonicContact OD2-NE2 3.83Å; D96-H150 PolarHBondContact OD2-NE2 3.11Å
151	G	84	Confident	87.6	Confident	56 Å²	56	70 Å²	70	58%	0.577	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	16.7	-177.9	0	0	0	0	0	115	L149	L149-G151 PolarHBondContact O-N 2.83Å; L149-G151 VanDerWaalsContact O-N 3.14Å
152	Q	87.4	Confident	87.7	Confident	81 Å²	81	73.4 Å²	73.4	38%	0.379	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-120.4	137.1	172.1	-67.1	-66.6	-27.3	0	0	110.7	N87 T89 E148 L149 P154	N87-Q152 PolarHBondContact ND2-OE1 2.99Å; N87-Q152 VanDerWaalsContact O-CB 3.3Å; N87-Q152 WeakPolarHBondContact O-CB 3.41Å; T89-Q152 HydrophobicContact CG2-CG 3.97Å; E148-Q152 CarbonylContact C-O 3.55Å; E148-Q152 WeakPolarHBondContact CA-O 3.49Å; L149-Q152 PolarHBondContact N-O 2.99Å; L149-Q152 PolarHBondContact O-N 3.21Å; Q152-P154 WeakPolarHBondContact O-CD 3.22Å
153	N	89.9	Confident	87.7	Confident	70 Å²	70	72.9 Å²	72.9	37%	0.374	37%	0.374	S	S	.	.			trans	-79.1	119.2	172.3	-57.7	86	0	0	0	109.7	N87 P145 E148 V155	N87-N153 PolarHBondContact ND2-O 2.95Å; P145-N153 PolarHBondContact O-ND2 3.49Å; E148-N153 WeakPolarHBondContact CG-ND2 3.45Å; N153-V155 PolarHBondContact O-N 3.03Å
154	P	90.5	Very high	87.7	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.367	C	S	.	.			trans	-65.9	130	177.8	-21.5	34.2	0	0	0	111.8	I85 G86 L88 L144 P145 R147 L149 Q152	I85-P154 HydrophobicContact CG2-CB 3.85Å; G86-P154 WeakPolarHBondContact O-CA 3.17Å; L88-P154 HydrophobicContact CD2-CB 3.97Å; L88-P154 HydrophobicContact CD2-CG 4.08Å; L144-P154 WeakPolarHBondContact O-CD 3.36Å; P145-P154 VanDerWaalsContact CA-O 3.24Å; P145-P154 WeakPolarHBondContact CA-O 3.18Å; R147-P154 WeakPolarHBondContact O-CD 3.33Å; L149-P154 HydrophobicContact CB-CG 4.31Å; L149-P154 HydrophobicContact CD1-CG 3.71Å; L149-P154 HydrophobicContact CG-CG 3.71Å; Q152-P154 WeakPolarHBondContact O-CD 3.22Å
155	V	91.4	Very high	88	Confident	58 Å²	58	73.9 Å²	73.9	35%	0.352	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	107.2	177.5	178.8	0	0	0	0	109.1	G86 N87 N153 T157 F167	G86-V155 PolarHBondContact N-O 3.37Å; G86-V155 PolarHBondContact O-N 2.93Å; N87-V155 HydrophobicContact CB-CB 4.29Å; N87-V155 HydrophobicContact CB-CG2 3.76Å; N153-V155 PolarHBondContact O-N 3.03Å; V155-T157 HydrophobicContact CG1-CG2 4.22Å; V155-F167 HydrophobicContact CB-CE1 4.25Å; V155-F167 HydrophobicContact CB-CZ 4.35Å; V155-F167 HydrophobicContact CG1-CE1 4.21Å; V155-F167 HydrophobicContact CG1-CZ 4.05Å
156	V	91.8	Very high	88	Confident	17 Å²	17	76 Å²	76	10%	0.103	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	132.5	177.9	-173.2	0	0	0	0	110.6	L83 Y84 I85 L140 M141 L144	L83-V156 HydrophobicContact CB-CG1 4.39Å; L83-V156 HydrophobicContact CD1-CG1 3.99Å; Y84-V156 CarbonylContact O-C 3.57Å; Y84-V156 WeakPolarHBondContact O-CA 3.42Å; I85-V156 HydrophobicContact CG1-CG2 4.24Å; I85-V156 HydrophobicContact CG2-CG2 4.41Å; L140-V156 HydrophobicContact CB-CG1 4.44Å; M141-V156 HydrophobicContact CG-CG1 3.99Å; L144-V156 HydrophobicContact CB-CG2 3.5Å; L144-V156 HydrophobicContact CD1-CG2 3.58Å; L144-V156 HydrophobicContact CG-CG2 4.18Å
157	T	90.5	Very high	88.2	Confident	12 Å²	12	68.7 Å²	68.7	7%	0.074	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	154.5	177	61	0	0	0	0	111.6	Y84 V155 F163 F167	Y84-T157 PolarHBondContact N-O 2.79Å; Y84-T157 PolarHBondContact O-N 3.46Å; V155-T157 HydrophobicContact CG1-CG2 4.22Å; T157-F163 HydrophobicContact CG2-CD1 3.89Å; T157-F163 HydrophobicContact CG2-CD2 4.36Å; T157-F163 HydrophobicContact CG2-CE1 4.15Å; T157-F163 HydrophobicContact CG2-CG 4.03Å; T157-F167 HydrophobicContact CG2-CE2 4.27Å; T157-F167 HydrophobicContact CG2-CZ 4.05Å; T157-F167 WeakPolarHBondContact OG1-CE2 3.34Å
158	P	88.3	Confident	88.6	Confident	63 Å²	63	65.8 Å²	65.8	41%	0.409	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	154.2	170.3	-19.4	29.7	0	0	0	112.3	M141 N160	M141-P158 HydrophobicContact CE-CB 4.32Å; M141-P158 HydrophobicContact CE-CG 3.77Å; P158-N160 VanDerWaalsContact C-N 3.25Å; P158-N160 PolarHBondContact O-N 2.91Å
159	C	86.6	Confident	88.7	Confident	72 Å²	72	64.8 Å²	64.8	49%	0.486	35%	0.346	S	S	.	.	S	Bend	trans	-68.4	71.4	176.4	61.7	0	0	0	0	114.1	A82 Y84	A82-C159 HydrophobicContact CB-CB 3.88Å; A82-C159 WeakPolarHBondContact O-CB 3.14Å; A82-C159 PolarHBondContact O-N 3.36Å; A82-C159 PolarHBondContact O-SG 3.19Å; Y84-C159 HydrophobicContact CE2-CB 4.27Å
160	N	89.6	Confident	88.8	Confident	78 Å²	78	66.9 Å²	66.9	42%	0.417	36%	0.355	S	S	.	.			trans	-109.4	142.2	177	-169.6	-24.9	0	0	0	111	P158 Q162 F163 L164	P158-N160 VanDerWaalsContact C-N 3.25Å; P158-N160 PolarHBondContact O-N 2.91Å; N160-Q162 PolarHBondContact O-N 3.01Å; N160-Q162 PolarHBondContact OD1-N 3.03Å; N160-F163 HydrophobicContact CB-CD2 3.79Å; N160-F163 HydrophobicContact CB-CE2 4.35Å; N160-F163 PolarHBondContact O-N 3.46Å; N160-F163 VanDerWaalsContact O-N 3.16Å; N160-L164 PolarHBondContact O-N 3.45Å; N160-L164 VanDerWaalsContact O-N 3.14Å
161	K	84.9	Confident	88.7	Confident	170 Å²	170	63 Å²	63	74%	0.739	34%	0.338	S	S	*	.	H	α-helix	trans	-55.9	-30.8	173.6	-171	179.3	179.8	-175.3	0	112.9	S165	K161-S165 PolarHBondContact O-N 3.07Å; K161-S165 PolarHBondContact O-OG 3.38Å
162	Q	90.4	Very high	88.7	Confident	139 Å²	139	68.9 Å²	68.9	65%	0.65	34%	0.343	S	S	*	.	H	α-helix	trans	-66.4	-44.7	176.4	-62.5	-63.1	-7.9	0	0	112.3	N160 S165 Q166	N160-Q162 PolarHBondContact O-N 3.01Å; N160-Q162 PolarHBondContact OD1-N 3.03Å; Q162-S165 PolarHBondContact O-N 2.96Å; Q162-Q166 PolarHBondContact O-N 3.19Å; Q162-Q166 VanDerWaalsContact O-N 3.12Å
163	F	89.4	Confident	87.9	Confident	64 Å²	64	72.5 Å²	72.5	28%	0.281	36%	0.357	S	S	.	.	H	α-helix	trans	-70.4	-34.7	177.9	-65.9	-57.4	0	0	0	112.4	T157 N160 S165 Q166 F167	T157-F163 HydrophobicContact CG2-CD1 3.89Å; T157-F163 HydrophobicContact CG2-CD2 4.36Å; T157-F163 HydrophobicContact CG2-CE1 4.15Å; T157-F163 HydrophobicContact CG2-CG 4.03Å; N160-F163 HydrophobicContact CB-CD2 3.79Å; N160-F163 HydrophobicContact CB-CE2 4.35Å; N160-F163 PolarHBondContact O-N 3.46Å; N160-F163 VanDerWaalsContact O-N 3.16Å; F163-S165 PolarHBondContact O-N 3.04Å; F163-Q166 WeakPolarHBondContact O-CB 3.3Å; F163-Q166 PolarHBondContact O-N 2.95Å; F163-Q166 VanDerWaalsContact O-N 3.13Å; F163-F167 HydrophobicContact CB-CE2 4.35Å; F163-F167 WeakPolarHBondContact O-CD2 3.13Å; F163-F167 PolarHBondContact O-N 3.26Å
164	L	88.3	Confident	86.5	Confident	40 Å²	40	72.8 Å²	72.8	21%	0.209	36%	0.362	C	S	.	.	H	α-helix	trans	-56	-50.5	172	178.9	61.5	0	0	0	111.3	Y84 F115 F126 N160 Q166 F167 E168	Y84-L164 HydrophobicContact CE1-CD1 4.21Å; Y84-L164 HydrophobicContact CE2-CB 4.13Å; F115-L164 HydrophobicContact CD1-CD1 4.39Å; F115-L164 HydrophobicContact CE1-CD1 3.88Å; F115-L164 HydrophobicContact CZ-CD1 4.11Å; F126-L164 HydrophobicContact CE2-CD1 3.73Å; F126-L164 HydrophobicContact CZ-CD1 4.09Å; N160-L164 PolarHBondContact O-N 3.45Å; N160-L164 VanDerWaalsContact O-N 3.14Å; L164-Q166 VanDerWaalsContact C-N 3.27Å; L164-Q166 PolarHBondContact O-N 3.42Å; L164-F167 PolarHBondContact O-N 3.42Å; L164-E168 HydrophobicContact CD1-CG 4.42Å; L164-E168 WeakPolarHBondContact O-CG 3.07Å; L164-E168 PolarHBondContact O-N 3.48Å
165	S	89.9	Confident	84.8	Confident	49 Å²	49	76.4 Å²	76.4	34%	0.343	38%	0.384	S	S	.	.	H	α-helix	trans	-59.5	-37.5	175.6	-58.3	0	0	0	0	112.5	K161 Q162 F163 M169	K161-S165 PolarHBondContact O-N 3.07Å; K161-S165 PolarHBondContact O-OG 3.38Å; Q162-S165 PolarHBondContact O-N 2.96Å; F163-S165 PolarHBondContact O-N 3.04Å; S165-M169 WeakPolarHBondContact O-CB 3.5Å; S165-M169 VanDerWaalsContact O-CE 3.32Å; S165-M169 WeakPolarHBondContact O-CE 3.36Å; S165-M169 WeakPolarHBondContact O-CG 3.23Å; S165-M169 PolarHBondContact O-N 3.21Å
166	Q	89.1	Confident	82.7	Confident	98 Å²	98	81.7 Å²	81.7	46%	0.458	41%	0.405	S	S	.	.	H	α-helix	trans	-63.4	-49	177.9	-170	-178.8	95.9	0	0	111.8	Q162 F163 L164 M169 Q170	Q162-Q166 PolarHBondContact O-N 3.19Å; Q162-Q166 VanDerWaalsContact O-N 3.12Å; F163-Q166 WeakPolarHBondContact O-CB 3.3Å; F163-Q166 PolarHBondContact O-N 2.95Å; F163-Q166 VanDerWaalsContact O-N 3.13Å; L164-Q166 VanDerWaalsContact C-N 3.27Å; L164-Q166 PolarHBondContact O-N 3.42Å; Q166-M169 PolarHBondContact O-N 2.88Å; Q166-Q170 WeakPolarHBondContact O-CB 3.46Å; Q166-Q170 PolarHBondContact O-N 3.02Å
167	F	90.9	Very high	80.5	Confident	3 Å²	3	84.9 Å²	84.9	1%	0.013	43%	0.427	C	S	.	.	H	α-helix	trans	-67.3	-36.4	177.4	-67.3	-56.8	0	0	0	112.8	F126 V155 T157 F163 L164 M169 Q170 S171	F126-F167 HydrophobicContact CB-CB 4.25Å; F126-F167 HydrophobicContact CB-CG 4.29Å; F126-F167 HydrophobicContact CD1-CB 3.72Å; F126-F167 HydrophobicContact CD2-CB 3.99Å; F126-F167 HydrophobicContact CD2-CG 4.47Å; F126-F167 HydrophobicContact CE1-CB 3.94Å; F126-F167 HydrophobicContact CE2-CB 4.2Å; F126-F167 HydrophobicContact CG-CB 3.74Å; F126-F167 HydrophobicContact CG-CG 4.25Å; F126-F167 HydrophobicContact CZ-CB 4.18Å; V155-F167 HydrophobicContact CB-CE1 4.25Å; V155-F167 HydrophobicContact CB-CZ 4.35Å; V155-F167 HydrophobicContact CG1-CE1 4.21Å; V155-F167 HydrophobicContact CG1-CZ 4.05Å; T157-F167 HydrophobicContact CG2-CE2 4.27Å; T157-F167 HydrophobicContact CG2-CZ 4.05Å; T157-F167 WeakPolarHBondContact OG1-CE2 3.34Å; F163-F167 HydrophobicContact CB-CE2 4.35Å; F163-F167 WeakPolarHBondContact O-CD2 3.13Å; F163-F167 PolarHBondContact O-N 3.26Å; L164-F167 PolarHBondContact O-N 3.42Å; F167-M169 VanDerWaalsContact C-N 3.3Å; F167-M169 PolarHBondContact O-N 2.98Å; F167-Q170 PolarHBondContact O-N 2.67Å; F167-S171 WeakPolarHBondContact O-CB 3.32Å; F167-S171 PolarHBondContact O-N 3.05Å
168	E	90.4	Very high	78.3	Confident	64 Å²	64	87.7 Å²	87.7	30%	0.299	46%	0.459	S	S	.	.	H	α-helix	trans	-65	-31.1	173.1	-72.7	-149.9	128.4	0	0	113.3	K124 F126 L164 S171 R172	K124-E168 IonicContact NZ-OE1 3.84Å; K124-E168 PolarHBondContact NZ-OE1 2.71Å; F126-E168 HydrophobicContact CE1-CG 4.28Å; F126-E168 HydrophobicContact CZ-CG 3.83Å; L164-E168 HydrophobicContact CD1-CG 4.42Å; L164-E168 WeakPolarHBondContact O-CG 3.07Å; L164-E168 PolarHBondContact O-N 3.48Å; E168-S171 PolarHBondContact O-OG 3.4Å; E168-R172 WeakPolarHBondContact O-CG 3.37Å; E168-R172 PolarHBondContact O-NE 3.4Å
169	M	89.4	Confident	76.1	Confident	113 Å²	113	92.6 Å²	92.6	56%	0.557	48%	0.476	S	S	*	.	H	α-helix	trans	-75.9	-34.2	171.8	-74.2	-174.7	-74.6	0	0	112.3	S165 Q166 F167	S165-M169 WeakPolarHBondContact O-CB 3.5Å; S165-M169 VanDerWaalsContact O-CE 3.32Å; S165-M169 WeakPolarHBondContact O-CE 3.36Å; S165-M169 WeakPolarHBondContact O-CG 3.23Å; S165-M169 PolarHBondContact O-N 3.21Å; Q166-M169 PolarHBondContact O-N 2.88Å; F167-M169 VanDerWaalsContact C-N 3.3Å; F167-M169 PolarHBondContact O-N 2.98Å
170	Q	86.9	Confident	74	Confident	65 Å²	65	98.1 Å²	98.1	30%	0.304	50%	0.497	S	S	.	.	H	α-helix	trans	-69.4	-44	177.4	-170.5	176	2.4	0	0	111.7	N87 Q166 F167 R172 K173 T174	N87-Q170 PolarHBondContact OD1-NE2 2.96Å; Q166-Q170 WeakPolarHBondContact O-CB 3.46Å; Q166-Q170 PolarHBondContact O-N 3.02Å; F167-Q170 PolarHBondContact O-N 2.67Å; Q170-R172 PolarHBondContact O-N 3.09Å; Q170-K173 WeakPolarHBondContact O-CB 3.31Å; Q170-K173 PolarHBondContact O-N 3.38Å; Q170-T174 PolarHBondContact O-N 3.36Å
171	S	83.6	Confident	71.7	Confident	10 Å²	10	101 Å²	101	7%	0.07	52%	0.524	C	S	.	.	H	α-helix	trans	-58.2	-36.9	-178.7	71.7	0	0	0	0	112.6	K124 F167 E168 K173 T174 T175	K124-S171 WeakPolarHBondContact O-CB 3.23Å; F167-S171 WeakPolarHBondContact O-CB 3.32Å; F167-S171 PolarHBondContact O-N 3.05Å; E168-S171 PolarHBondContact O-OG 3.4Å; S171-K173 PolarHBondContact O-N 2.93Å; S171-T174 PolarHBondContact O-N 3.43Å; S171-T175 PolarHBondContact O-N 3.14Å; S171-T175 VanDerWaalsContact O-N 3.17Å; S171-T175 PolarHBondContact O-OG1 3.48Å
172	R	82.9	Confident	69.5	Low	180 Å²	180	96.2 Å²	96.2	68%	0.679	52%	0.522	S	S	*	.	H	α-helix	trans	-60.2	-29.3	176.1	-66.5	174.3	-166	-157	2.5	113.2	E168 Q170	E168-R172 WeakPolarHBondContact O-CG 3.37Å; E168-R172 PolarHBondContact O-NE 3.4Å; Q170-R172 PolarHBondContact O-N 3.09Å
173	K	71.4	Confident	67.2	Low	158 Å²	158	99.5 Å²	99.5	69%	0.687	54%	0.538	S	S	*	.	H	α-helix	trans	-82	-46	179.6	-61.2	-179.8	-179.3	-179	0	111.1	Q170 S171 T175 Q176 S177	Q170-K173 WeakPolarHBondContact O-CB 3.31Å; Q170-K173 PolarHBondContact O-N 3.38Å; S171-K173 PolarHBondContact O-N 2.93Å; K173-T175 VanDerWaalsContact C-N 3.28Å; K173-T175 PolarHBondContact O-N 2.95Å; K173-Q176 PolarHBondContact O-N 2.98Å; K173-S177 PolarHBondContact O-N 3.35Å
174	T	60	Low	64.7	Low	76 Å²	76	100 Å²	100	47%	0.466	56%	0.561	S	S	.	*	H	α-helix	trans	-61.4	-33.3	179.2	-53.5	0	0	0	0	112.8	Q170 S171 Q176 S177	Q170-T174 PolarHBondContact O-N 3.36Å; S171-T174 PolarHBondContact O-N 3.43Å; T174-Q176 PolarHBondContact O-N 2.93Å; T174-S177 PolarHBondContact O-OG 3.32Å
175	T	54.3	Low	62.4	Low	75 Å²	75	108.3 Å²	108.3	46%	0.46	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.2	-24.4	174.3	-50.3	0	0	0	0	112.9	S171 K173	S171-T175 PolarHBondContact O-N 3.14Å; S171-T175 VanDerWaalsContact O-N 3.17Å; S171-T175 PolarHBondContact O-OG1 3.48Å; K173-T175 VanDerWaalsContact C-N 3.28Å; K173-T175 PolarHBondContact O-N 2.95Å
176	Q	48.6	Very low	59.8	Low	170 Å²	170	111.2 Å²	111.2	79%	0.794	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-24.4	-176.7	-157.1	169.5	52.9	0	0	113.2	K173 T174 G178	K173-Q176 PolarHBondContact O-N 2.98Å; T174-Q176 PolarHBondContact O-N 2.93Å; Q176-G178 PolarHBondContact O-N 2.88Å
177	S	45.8	Very low	57.1	Low	83 Å²	83	109.9 Å²	109.9	58%	0.58	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	11.6	177.1	57.8	0	0	0	0	114.6	K173 T174 Q179	K173-S177 PolarHBondContact O-N 3.35Å; T174-S177 PolarHBondContact O-OG 3.32Å; S177-Q179 PolarHBondContact O-N 2.98Å
178	G	44.3	Very low	55.2	Low	71 Å²	71	115.8 Å²	115.8	73%	0.732	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-2.4	178.3	0	0	0	0	0	115.2	Q176	Q176-G178 PolarHBondContact O-N 2.88Å
179	Q	41.8	Very low	53.2	Low	167 Å²	167	119.2 Å²	119.2	78%	0.78	70%	0.701	S	S	*	*	S	Bend	trans	-113.7	137.9	167.1	-66.8	-177.9	0.7	0	0	108.3	S177	S177-Q179 PolarHBondContact O-N 2.98Å
180	M	42.7	Very low	50.6	Low	187 Å²	187	117.7 Å²	117.7	92%	0.921	72%	0.715	S	S	*	*			trans	79.8	65.1	-177.7	-48.7	-179.5	176.7	0	0	116.9
181	S	41.3	Very low	48.1	Very low	139 Å²	139	118.3 Å²	118.3	97%	0.972	74%	0.738	S	S	*	*			trans	-103.6	99.2	138.6	-84.5	0	0	0	0	108.6
182	G	37.5	Very low	45.7	Very low	69 Å²	69	123.6 Å²	123.6	71%	0.711	78%	0.775	S	S	*	*			trans	-136	123.6	168.9	0	0	0	0	0	108.2	G184	G182-G184 PolarHBondContact O-N 3.33Å
183	E	43.1	Very low	43.4	Very low	209 Å²	209	120.9 Å²	120.9	98%	0.977	78%	0.784	S	S	*	*			trans	-58	121.7	-178.7	-72.6	152.9	61.5	0	0	111.5
184	G	35.9	Very low	41.8	Very low	74 Å²	74	125.2 Å²	125.2	76%	0.763	80%	0.796	S	S	*	*			trans	-142.5	120.9	178.6	0	0	0	0	0	110.4	G182	G182-G184 PolarHBondContact O-N 3.33Å
185	K	40	Very low	40.5	Very low	215 Å²	215	126.2 Å²	126.2	94%	0.935	81%	0.812	S	S	*	*			trans	-73.1	155.9	-170.9	-72.3	179.5	173.9	178.6	0	114
186	A	36.6	Very low	39.5	Very low	110 Å²	110	127.3 Å²	127.3	91%	0.909	83%	0.828	S	S	*	*			trans	-41	147.9	176.8	0	0	0	0	0	118.2
187	G	31.6	Very low	38.8	Very low	70 Å²	70	129.1 Å²	129.1	72%	0.722	83%	0.834	S	S	*	*			trans	-160.2	141.8	164	0	0	0	0	0	111
188	P	50.2	Low	38.9	Very low	127 Å²	127	131.3 Å²	131.3	83%	0.825	85%	0.846	S	S	*	*			trans	-93.8	169.2	-163.1	37.1	-37.7	0	0	0	115.7
189	P	50.2	Low	38.7	Very low	136 Å²	136	137.3 Å²	137.3	88%	0.883	86%	0.855	S	S	*	*			trans	-93.1	149.5	-172.3	36.5	-35.5	0	0	0	115.4
190	G	33	Very low	38.3	Very low	81 Å²	81	133.1 Å²	133.1	84%	0.835	86%	0.856	S	S	*	*			trans	172.6	154	168.3	0	0	0	0	0	109.1
191	G	34.7	Very low	37.8	Very low	78 Å²	78	127.3 Å²	127.3	80%	0.804	85%	0.845	S	S	*	*			cis	-176.7	163.6	-2	0	0	0	0	0	108.9
192	S	33.4	Very low	37.6	Very low	120 Å²	120	133 Å²	133	84%	0.839	85%	0.845	S	S	*	*			trans	-41.7	145.1	-174.4	-55.1	0	0	0	0	117.3
193	S	35.8	Very low	37.3	Very low	124 Å²	124	133.3 Å²	133.3	87%	0.867	85%	0.849	S	S	*	*				-164.1	149.7	125.8	-87.6	0	0	0	0	114.7
194	R	37.8	Very low	36.9	Very low	249 Å²	249	134.5 Å²	134.5	94%	0.94	84%	0.844	S	S	*	*			trans	-90.4	145.8	176	-64.9	163.6	164	150	-8.7	110.7
195	A	32.6	Very low	36.8	Very low	97 Å²	97	134.2 Å²	134.2	80%	0.802	84%	0.842	S	S	*	*			trans	-155	111.9	149.8	0	0	0	0	0	107.3
196	A	32.6	Very low	36.3	Very low	97 Å²	97	134.6 Å²	134.6	80%	0.802	84%	0.837	S	S	*	*				87.9	101.5	62.6	0	0	0	0	0	112.5
197	F	32.8	Very low	36	Very low	208 Å²	208	138.8 Å²	138.8	91%	0.912	84%	0.835	S	S	*	*			trans	-63.3	161.5	166.6	-67.7	-96	0	0	0	111.8
198	P	49.1	Very low	36.8	Very low	129 Å²	129	141 Å²	141	84%	0.838	84%	0.837	S	S	*	*			trans	-120.6	154.3	135.9	35.5	-29.4	0	0	0	113.1
199	Q	40.4	Very low	35.8	Very low	198 Å²	198	138.6 Å²	138.6	93%	0.925	84%	0.835	S	S	*	*			trans	-113	144.3	-171.8	167.6	-173.4	-10.4	0	0	111.5
200	G	31.8	Very low	34.9	Very low	78 Å²	78	137.1 Å²	137.1	80%	0.804	83%	0.834	S	S	*	*			trans	136.9	138.8	160.8	0	0	0	0	0	113.5
201	G	33.3	Very low	35.1	Very low	66 Å²	66	139.8 Å²	139.8	68%	0.68	83%	0.834	S	S	*	*			cis	162	150.3	-4.7	0	0	0	0	0	111.6
202	R	36.9	Very low	35.7	Very low	257 Å²	257	142 Å²	142	97%	0.97	83%	0.834	S	S	*	*			trans	71.4	138.2	-173.9	-42.7	177.7	-167.3	-117.3	5.2	113.7
203	G	31.7	Very low	35.5	Very low	77 Å²	77	140.3 Å²	140.3	79%	0.794	84%	0.835	S	S	*	*			cis	111.4	83.2	-4.1	0	0	0	0	0	114.6
204	R	34.3	Very low	35.4	Very low	233 Å²	233	137.6 Å²	137.6	88%	0.879	83%	0.827	S	S	*	*			trans	-167.2	129.2	153.2	-143.8	176.7	-175.3	178.9	2.5	112.3
205	G	32.9	Very low	35.2	Very low	69 Å²	69	133.6 Å²	133.6	71%	0.711	83%	0.825	S	S	*	*			trans	-93.4	159	166.2	0	0	0	0	0	112.5
206	R	31.3	Very low	35.1	Very low	222 Å²	222	139.9 Å²	139.9	84%	0.838	83%	0.828	S	S	*	*			trans	-162.6	103.3	165.9	-126.1	178.7	-176.1	-109.4	1.4	113.7
207	F	29.7	Very low	35	Very low	199 Å²	199	144.4 Å²	144.4	87%	0.873	83%	0.83	S	S	*	*			trans	-79.4	164.4	141.9	-77.2	-75.8	0	0	0	107.7
208	P	47.2	Very low	35.8	Very low	117 Å²	117	140 Å²	140	76%	0.76	82%	0.822	S	S	*	*			cis	-155.6	178.5	46.7	43.5	-21.8	0	0	0	120
209	G	29.3	Very low	35	Very low	75 Å²	75	136.9 Å²	136.9	77%	0.773	81%	0.813	S	S	*	*			trans	100.2	151.9	154.6	0	0	0	0	0	116.1
210	A	31.4	Very low	35.4	Very low	105 Å²	105	133.7 Å²	133.7	87%	0.868	81%	0.81	S	S	*	*			cis	-162.9	157	-15.8	0	0	0	0	0	109.5
211	V	37.7	Very low	35.4	Very low	138 Å²	138	134.8 Å²	134.8	84%	0.836	81%	0.811	S	S	*	*			trans	-82.6	160.3	173.4	-66	0	0	0	0	111.7
212	P	47.7	Very low	35.3	Very low	124 Å²	124	134.9 Å²	134.9	81%	0.805	81%	0.812	S	S	*	*				-155.3	153.5	95.5	38.6	-19.8	0	0	0	118.5
213	G	28.9	Very low	35.8	Very low	84 Å²	84	129.1 Å²	129.1	87%	0.866	81%	0.808	S	S	*	*			trans	78	148.7	149.6	0	0	0	0	0	119.6
214	G	33.3	Very low	35.9	Very low	68 Å²	68	129.4 Å²	129.4	70%	0.701	81%	0.811	S	S	*	*			cis	144.3	69.2	-17.3	0	0	0	0	0	117.6
215	D	35.2	Very low	35.9	Very low	165 Å²	165	121.7 Å²	121.7	88%	0.882	80%	0.804	S	S	*	*			trans	-134.5	92.3	179.8	-81.7	-61.6	0	0	0	116.9
216	R	30.1	Very low	36.4	Very low	229 Å²	229	124.3 Å²	124.3	86%	0.864	81%	0.808	S	S	*	*				28.3	104.9	128.6	-145.1	175.9	-160.1	176.5	5	123.6
217	F	30.3	Very low	36.8	Very low	192 Å²	192	119.4 Å²	119.4	84%	0.842	81%	0.805	S	S	*	*			trans	61.3	166.9	138.9	-87.7	-105.4	0	0	0	120.9
218	P	49.1	Very low	37.7	Very low	115 Å²	115	115.8 Å²	115.8	75%	0.747	80%	0.801	S	S	*	*			cis	-125.1	171.5	-4	40.6	-25.9	0	0	0	115.8
219	G	31.6	Very low	37.7	Very low	63 Å²	63	114.7 Å²	114.7	65%	0.649	80%	0.795	S	S	*	*			trans	-85.4	-179.9	163	0	0	0	0	0	113
220	P	49	Very low	38	Very low	132 Å²	132	120.4 Å²	120.4	86%	0.857	80%	0.799	S	S	*	*				-150.4	167.3	102.6	39.4	-23.3	0	0	0	117.7
221	A	32.4	Very low	38.5	Very low	100 Å²	100	121.3 Å²	121.3	83%	0.826	80%	0.796	S	S	*	*			trans	65	117.6	149.2	0	0	0	0	0	121.7
222	G	32.1	Very low	38.1	Very low	69 Å²	69	118 Å²	118	71%	0.711	79%	0.789	S	S	*	*			trans	-80	-172.5	145.7	0	0	0	0	0	111.4
223	P	47.1	Very low	37.2	Very low	135 Å²	135	119.8 Å²	119.8	88%	0.877	79%	0.792	S	S	*	*				-141.3	172.5	57.7	39.1	-22.1	0	0	0	115.5
224	G	34.1	Very low	37.2	Very low	83 Å²	83	122 Å²	122	86%	0.856	78%	0.783	S	S	*	*			trans	-92.4	155.3	168	0	0	0	0	0	113
225	G	33	Very low	37.2	Very low	71 Å²	71	126.9 Å²	126.9	73%	0.732	79%	0.792	S	S	*	*			trans	-155.6	144.6	170.1	0	0	0	0	0	110.7
226	P	43.5	Very low	37	Very low	124 Å²	124	126.9 Å²	126.9	81%	0.805	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-82	156.4	-178.3	33.9	-35.2	0	0	0	112.4
227	P	39.8	Very low	37.2	Very low	120 Å²	120	125 Å²	125	78%	0.779	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-72.5	152.9	175	30.6	-34.6	0	0	0	112.4
228	P	49.9	Very low	37.2	Very low	122 Å²	122	123.7 Å²	123.7	79%	0.792	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-84.4	156.3	-169.7	34	-37.1	0	0	0	114.3
229	P	46.5	Very low	36.4	Very low	95 Å²	95	124.4 Å²	124.4	62%	0.617	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-100.9	169.8	170.5	35.9	-30.5	0	0	0	114.3
230	F	36.1	Very low	36.4	Very low	195 Å²	195	131 Å²	131	86%	0.855	80%	0.798	S	S	*	*			trans	83.8	157	165.6	-55.8	-58.1	0	0	0	117.8
231	P	40.8	Very low	35.6	Very low	124 Å²	124	128.2 Å²	128.2	81%	0.805	79%	0.793	S	S	*	*			cis	-124.7	155.1	10.3	40	-25.1	0	0	0	116.9
232	G	29.1	Very low	35.6	Very low	68 Å²	68	129.9 Å²	129.9	70%	0.701	79%	0.793	S	S	*	*			trans	-99.1	156.7	156.1	0	0	0	0	0	110.4
233	N	28.6	Very low	35.7	Very low	161 Å²	161	137.3 Å²	137.3	86%	0.861	80%	0.799	S	S	*	*			trans	-136	94.8	172	-132	7.9	0	0	0	112.6
234	L	30.3	Very low	35.1	Very low	131 Å²	131	136.8 Å²	136.8	69%	0.686	80%	0.796	S	S	*	*			trans	7	114.7	143.2	-171.4	73.7	0	0	0	119.2	K236	L234-K236 HydrophobicContact CD1-CG 4.28Å; L234-K236 HydrophobicContact CG-CG 4.43Å
235	I	32.8	Very low	34.9	Very low	171 Å²	171	140.7 Å²	140.7	88%	0.877	80%	0.796	S	S	*	*			trans	-128.9	152.9	136.4	-62.6	-173.7	0	0	0	108.4
236	K	31.3	Very low	34.6	Very low	165 Å²	165	147.1 Å²	147.1	72%	0.717	81%	0.805	S	S	*	*			trans	-99.6	155.8	-154.6	-62.5	159	-178.2	171.5	0	113.8	L234	L234-K236 HydrophobicContact CD1-CG 4.28Å; L234-K236 HydrophobicContact CG-CG 4.43Å
237	H	34.1	Very low	33.8	Very low	188 Å²	188	148.6 Å²	148.6	87%	0.87	81%	0.805	S	S	*	*			trans	-25.7	137.1	165.4	-67.1	92.1	0	0	0	117.4
238	L	30.9	Very low	33.2	Very low	166 Å²	166	149.3 Å²	149.3	87%	0.869	80%	0.798	S	S	*	*			trans	-156.5	155.2	132.2	-150	67	0	0	0	113.1
239	V	31.3	Very low	32.2	Very low	130 Å²	130	149.2 Å²	149.2	79%	0.788	80%	0.795	S	S	*	*			trans	77.5	124.2	166.2	-169	0	0	0	0	118
240	K	31.3	Very low	31.3	Very low	202 Å²	202	153.7 Å²	153.7	88%	0.878	80%	0.8	S	S	*	*			trans	-80.7	142.9	175.6	-63.1	164.6	175.5	173.7	0	110.7
241	G	33.8	Very low	31	Very low	72 Å²	72	150.6 Å²	150.6	74%	0.742	79%	0.791	S	S	*	*			trans	63.3	114.4	142.4	0	0	0	0	0	119
242	T	30.8	Very low	30.5	Very low	136 Å²	136	150 Å²	150	83%	0.834	79%	0.787	S	S	*	*			trans	-161.3	136.7	130.5	-71.7	0	0	0	0	107.1
243	R	34.4	Very low	30.5	Very low	224 Å²	224	157.5 Å²	157.5	85%	0.845	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-86	127.2	174.5	-60.2	169.2	72.2	-169.8	4.3	108.2	L245	R243-L245 PolarHBondContact O-N 3.2Å
244	P	34.2	Very low	30.6	Very low	125 Å²	125	158.9 Å²	158.9	81%	0.812	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-73.1	125.8	163	29.4	-30.1	0	0	0	108.9
245	L	30.3	Very low	30.5	Very low	164 Å²	164	161 Å²	161	86%	0.859	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-74.3	123.6	173.3	-67.4	162.7	0	0	0	108.9	R243	R243-L245 PolarHBondContact O-N 3.2Å
246	F	27.9	Very low	30.1	Very low	206 Å²	206	155.7 Å²	155.7	90%	0.904	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-88.3	119.7	160.9	-126.5	-97.2	0	0	0	107.8	E248	F246-E248 VanDerWaalsContact C-N 3.35Å; F246-E248 PolarHBondContact O-N 3.33Å
247	L	26.4	Very low	29.9	Very low	156 Å²	156	156 Å²	156	82%	0.817	80%	0.795	S	S	*	*			trans	-79.6	85.5	-179.4	-169.5	69	0	0	0	109.2	T249	L247-T249 PolarHBondContact O-N 3.01Å
248	E	26.9	Very low	29.6	Very low	134 Å²	134	152.1 Å²	152.1	63%	0.626	79%	0.789	S	S	*	*			trans	-73	90.4	174.7	-177.1	168.2	133.4	0	0	109.7	F246 R250	F246-E248 VanDerWaalsContact C-N 3.35Å; F246-E248 PolarHBondContact O-N 3.33Å; E248-R250 HydrophobicContact CG-CB 3.81Å; E248-R250 PolarHBondContact O-N 2.96Å; E248-R250 WeakPolarHBondContact OE1-CD 3.05Å; E248-R250 IonicContact OE1-CZ 3.86Å; E248-R250 IonicContact OE1-NE 3.7Å; E248-R250 IonicContact OE1-NH1 2.67Å; E248-R250 PolarHBondContact OE1-NH1 3.39Å
249	T	27.7	Very low	29.5	Very low	120 Å²	120	152.1 Å²	152.1	74%	0.736	79%	0.788	S	S	*	*			trans	-74.2	69.3	171.4	-47.4	0	0	0	0	110.4	L247	L247-T249 PolarHBondContact O-N 3.01Å
250	R	27.6	Very low	29.3	Very low	190 Å²	190	154.3 Å²	154.3	72%	0.717	79%	0.79	S	S	*	*			trans	-91.5	104.3	175.3	170.3	171.3	166.7	-175.7	-3.5	108.7	E248 P252	E248-R250 HydrophobicContact CG-CB 3.81Å; E248-R250 PolarHBondContact O-N 2.96Å; E248-R250 WeakPolarHBondContact OE1-CD 3.05Å; E248-R250 IonicContact OE1-CZ 3.86Å; E248-R250 IonicContact OE1-NE 3.7Å; E248-R250 IonicContact OE1-NH1 2.67Å; E248-R250 PolarHBondContact OE1-NH1 3.39Å; R250-P252 VanDerWaalsContact O-CD 3.31Å; R250-P252 WeakPolarHBondContact O-CD 3.19Å
251	I	31.1	Very low	29	Very low	130 Å²	130	152.3 Å²	152.3	67%	0.667	78%	0.784	S	S	*	*			trans	-70.8	118.9	175.4	-60.4	173.6	0	0	0	108.2
252	P	30.4	Very low	28.9	Very low	112 Å²	112	155.8 Å²	155.8	73%	0.727	78%	0.784	S	S	*	*			trans	-92.3	135.8	177.8	34.7	-28.7	0	0	0	110.9	R250	R250-P252 VanDerWaalsContact O-CD 3.31Å; R250-P252 WeakPolarHBondContact O-CD 3.19Å
253	W	27.9	Very low	29	Very low	225 Å²	225	152.8 Å²	152.8	85%	0.852	77%	0.767	S	S	*	*			trans	-118.1	104.2	168.2	-75.5	105.8	0	0	0	109.8
254	H	32.1	Very low	28.8	Very low	190 Å²	190	145.4 Å²	145.4	88%	0.88	74%	0.743	S	S	*	*			trans	-159.4	98	163.1	-98	-67.9	0	0	0	111.3
255	M	26.7	Very low	28.5	Very low	174 Å²	174	147.8 Å²	147.8	86%	0.857	74%	0.741	S	S	*	*			trans	-179.7	133.2	148.1	-131.6	62.2	176.1	0	0	104
256	G	26.1	Very low	28.4	Very low	60 Å²	60	142.3 Å²	142.3	62%	0.619	72%	0.724	S	S	*	*			cis	98.1	96.8	21.5	0	0	0	0	0	109.3
257	H	26.9	Very low	28.5	Very low	172 Å²	172	140.5 Å²	140.5	80%	0.796	72%	0.723	S	S	*	*			trans	169.5	137.1	137.1	-101.4	-82.3	0	0	0	113.9
258	S	26.7	Very low	28.6	Very low	107 Å²	107	142 Å²	142	75%	0.748	72%	0.723	S	S	*	*			trans	50	136.8	145.3	-55.7	0	0	0	0	123.7
259	I	30.2	Very low	28.9	Very low	165 Å²	165	140.7 Å²	140.7	85%	0.846	74%	0.735	S	S	*	*			trans	-109.3	143.3	168.1	-69.4	164.9	0	0	0	107.9
260	E	26.5	Very low	29	Very low	176 Å²	176	138.5 Å²	138.5	82%	0.822	74%	0.736	S	S	*	*			trans	-139	133.5	161.5	-73.4	-165.7	151.7	0	0	112.2
261	E	25	Very low	29.1	Very low	161 Å²	161	138.8 Å²	138.8	75%	0.752	75%	0.745	S	S	*	*			trans	50.5	113.6	144.1	-54.7	-147.1	128.5	0	0	121.6
262	I	30.6	Very low	29.2	Very low	144 Å²	144	139.1 Å²	139.1	74%	0.738	75%	0.753	S	S	*	*				85.7	152.7	76.4	-74	165.2	0	0	0	112.5
263	P	34	Very low	29.6	Very low	74 Å²	74	139.7 Å²	139.7	48%	0.481	76%	0.757	S	S	.	*			cis	-130.2	-176.2	3.1	33.3	-12.3	0	0	0	117	P58 T59	P58-P263 CarbonylContact C-O 3.14Å; P58-P263 WeakPolarHBondContact CA-O 3.35Å; T59-P263 PolarHBondContact N-O 3.26Å; T59-P263 PolarHBondContact OG1-O 2.9Å
264	I	30.4	Very low	30.3	Very low	68 Å²	68	134.7 Å²	134.7	35%	0.349	75%	0.754	S	S	.	*			trans	-79.4	154.5	162.9	-123	-69.6	0	0	0	114.3	P57 P58 T59	P57-I264 VanDerWaalsContact C-CG1 3.5Å; P57-I264 HydrophobicContact CB-CB 4.49Å; P57-I264 HydrophobicContact CB-CD1 4.46Å; P57-I264 HydrophobicContact CB-CG1 3.52Å; P57-I264 HydrophobicContact CG-CB 4.34Å; P57-I264 HydrophobicContact CG-CG1 3.58Å; P57-I264 PolarHBondContact O-N 2.83Å; P58-I264 WeakPolarHBondContact O-CA 3.5Å; P58-I264 VanDerWaalsContact O-CD1 3.28Å; P58-I264 WeakPolarHBondContact O-CD1 3.21Å; P58-I264 WeakPolarHBondContact O-CG1 3.41Å; T59-I264 WeakPolarHBondContact OG1-CA 3.42Å
265	F	26.9	Very low	30.3	Very low	176 Å²	176	136.2 Å²	136.2	77%	0.772	75%	0.752	S	S	*	*			trans	-130.7	129.4	138.1	-96.9	-82.2	0	0	0	110.6	T59	T59-F265 HydrophobicContact CG2-CB 4.35Å; T59-F265 PolarHBondContact OG1-N 2.98Å
266	G	27.8	Very low	31.1	Very low	48 Å²	48	133.3 Å²	133.3	50%	0.495	75%	0.746	S	S	.	*			trans	-98.2	-154	177.9	0	0	0	0	0	113.3
267	L	29.7	Very low	32.1	Very low	168 Å²	168	135.3 Å²	135.3	88%	0.88	75%	0.748	S	S	*	*			trans	86.5	136.6	-169.7	-54.8	166.8	0	0	0	112.5
268	K	29.5	Very low	32.5	Very low	189 Å²	189	136 Å²	136	82%	0.822	76%	0.756	S	S	*	*			cis	-157.3	154.7	-0.8	-154.5	167	179.3	172.8	0	109.5
269	A	33.8	Very low	33	Very low	106 Å²	106	133.8 Å²	133.8	88%	0.876	75%	0.75	S	S	*	*			trans	-64.3	135.4	169.4	0	0	0	0	0	111.5
270	G	28.5	Very low	33.8	Very low	73 Å²	73	132.1 Å²	132.1	75%	0.753	75%	0.75	S	S	*	*			trans	-131.3	135.3	175.7	0	0	0	0	0	110.7
271	Q	29.3	Very low	34.7	Very low	197 Å²	197	129.8 Å²	129.8	92%	0.921	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-81.1	146.7	-168	-65.9	157.3	-34.8	0	0	112.9
272	T	34.5	Very low	35.5	Very low	136 Å²	136	125.4 Å²	125.4	83%	0.834	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-88.3	126.5	171	47	0	0	0	0	111.6
273	P	39.5	Very low	36.7	Very low	124 Å²	124	124.4 Å²	124.4	81%	0.805	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-85.5	143.9	163.3	32.6	-31.3	0	0	0	111.2
274	P	42.3	Very low	37.4	Very low	120 Å²	120	127.1 Å²	127.1	78%	0.779	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-102.4	166.9	-173.3	38	-36.1	0	0	0	116
275	R	31.6	Very low	38.1	Very low	223 Å²	223	127 Å²	127	84%	0.842	78%	0.784	S	S	*	*			trans	74.5	163	163.1	-92.7	-177.4	161.2	-118.4	-3.4	118.1
276	P	42.8	Very low	39.5	Very low	112 Å²	112	124.6 Å²	124.6	73%	0.727	79%	0.786	S	S	*	*			cis	-127.4	174.4	-1.7	28.9	-6.7	0	0	0	116
277	P	46.8	Very low	40.5	Very low	103 Å²	103	128.3 Å²	128.3	67%	0.669	80%	0.802	S	S	*	*			trans	-95.8	152.9	-179.8	37.2	-34.9	0	0	0	115.3
278	L	36.7	Very low	41.3	Very low	186 Å²	186	123.4 Å²	123.4	97%	0.974	79%	0.791	S	S	*	*			trans	-177.2	154.2	159.9	-94.6	143.8	0	0	0	106.7
279	G	36.5	Very low	42.6	Very low	60 Å²	60	120.6 Å²	120.6	62%	0.619	79%	0.792	S	S	*	*			cis	-173.4	163.3	-8	0	0	0	0	0	109.7
280	P	46	Very low	43.7	Very low	131 Å²	131	121 Å²	121	85%	0.851	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-76	165.5	-176.3	30.6	-34.2	0	0	0	114.3
281	P	46.5	Very low	44.7	Very low	127 Å²	127	123.3 Å²	123.3	83%	0.825	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-92.7	161.2	-147.6	36.1	-38	0	0	0	116.3
282	G	41.3	Very low	45.5	Very low	68 Å²	68	120.2 Å²	120.2	70%	0.701	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-89.2	153.2	169.5	0	0	0	0	0	113.4
283	P	56.8	Low	45.9	Very low	124 Å²	124	117 Å²	117	81%	0.805	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-77.7	151.8	-176.2	31.7	-35.8	0	0	0	113.4
284	P	47.9	Very low	45.9	Very low	130 Å²	130	120.1 Å²	120.1	84%	0.844	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-73.3	143	175.6	30.5	-34.4	0	0	0	112.2
285	G	45.8	Very low	45.7	Very low	65 Å²	65	121 Å²	121	67%	0.67	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-74.6	162.7	175	0	0	0	0	0	113.6
286	P	54.9	Low	46.2	Very low	126 Å²	126	118 Å²	118	82%	0.818	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-71.4	144.8	-176	29.5	-35.3	0	0	0	112.7
287	P	49	Very low	46.6	Very low	127 Å²	127	117.8 Å²	117.8	83%	0.825	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-73.9	142.8	177.2	30.4	-34.3	0	0	0	112.1
288	G	47.1	Very low	47	Very low	64 Å²	64	118.4 Å²	118.4	66%	0.66	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-74.2	162.8	174.2	0	0	0	0	0	113.5
289	P	57.4	Low	47.7	Very low	130 Å²	130	115.6 Å²	115.6	84%	0.844	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-72	142.2	-176.2	29.4	-35	0	0	0	112.8
290	P	57	Low	48.2	Very low	116 Å²	116	121 Å²	121	75%	0.753	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-79.3	154.4	176.9	32.6	-35.1	0	0	0	112.8
291	P	48.3	Very low	48	Very low	120 Å²	120	119.5 Å²	119.5	78%	0.779	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-71.3	150.3	175	30.5	-35.2	0	0	0	112.2
292	P	46	Very low	48.3	Very low	133 Å²	133	116.4 Å²	116.4	86%	0.864	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-82.9	132.3	-173.3	31.6	-34.4	0	0	0	113.7
293	G	42.7	Very low	48.8	Very low	67 Å²	67	119.1 Å²	119.1	69%	0.691	79%	0.79	S	S	*	*			trans	104.3	92.6	153.4	0	0	0	0	0	117.4
294	Q	39.7	Very low	48.4	Very low	190 Å²	190	119.3 Å²	119.3	89%	0.888	79%	0.791	S	S	*	*				-171	122.5	108	-100.1	175.2	94.7	0	0	112.9
295	V	38.7	Very low	48.1	Very low	139 Å²	139	120.8 Å²	120.8	84%	0.842	79%	0.791	S	S	*	*			trans	30.6	110.3	157	-150.9	0	0	0	0	119.7
296	L	41.2	Very low	48.3	Very low	161 Å²	161	129.7 Å²	129.7	84%	0.843	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-96.1	151.1	165.7	-78.1	164.4	0	0	0	111.9
297	P	51.5	Low	47.9	Very low	106 Å²	106	126.9 Å²	126.9	69%	0.688	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-72.1	157.8	166.7	32	-34.6	0	0	0	111.9
298	P	56	Low	47.7	Very low	117 Å²	117	129 Å²	129	76%	0.76	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-70.9	146.5	-176.9	29.2	-35.2	0	0	0	112.7
299	P	50.5	Low	47.5	Very low	127 Å²	127	137.3 Å²	137.3	83%	0.825	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-76.4	144	-176.9	30.8	-35	0	0	0	113
300	L	48.4	Very low	47.1	Very low	172 Å²	172	136.4 Å²	136.4	90%	0.901	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-63.3	135.6	166.5	-98.4	71.9	0	0	0	110.5
301	A	42	Very low	46.8	Very low	100 Å²	100	136.3 Å²	136.3	83%	0.826	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-70	141.4	167.6	0	0	0	0	0	110.8
302	G	51.6	Low	46.9	Very low	62 Å²	62	136 Å²	136	64%	0.639	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-70.6	173.6	177.4	0	0	0	0	0	114.1
303	P	52.1	Low	47.2	Very low	126 Å²	126	135.6 Å²	135.6	82%	0.818	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-67	140.9	-175.9	28	-34.8	0	0	0	112.2
304	P	49	Very low	47.6	Very low	128 Å²	128	138.4 Å²	138.4	83%	0.831	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-70.9	147.2	-178.5	28.5	-34.5	0	0	0	112.4
305	N	40.8	Very low	47.8	Very low	160 Å²	160	137.3 Å²	137.3	86%	0.856	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-77	156.5	-176.9	-139.7	-45.8	0	0	0	112.4	G307	N305-G307 PolarHBondContact O-N 3.17Å
306	R	50	Low	48.1	Very low	253 Å²	253	139.5 Å²	139.5	96%	0.955	81%	0.805	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	75.8	-169.4	-171.9	178.8	-177.3	166.9	-0.9	111.4
307	G	46.1	Very low	47.9	Very low	67 Å²	67	138.2 Å²	138.2	69%	0.691	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.6	-54.5	-177.2	0	0	0	0	0	115.1	N305	N305-G307 PolarHBondContact O-N 3.17Å
308	D	45	Very low	48	Very low	170 Å²	170	136.2 Å²	136.2	91%	0.909	81%	0.805	S	S	*	*			trans	-105.5	110.3	-170.3	-79.8	-85.5	0	0	0	113.2
309	R	43	Very low	47.5	Very low	239 Å²	239	139.2 Å²	139.2	90%	0.902	81%	0.809	S	S	*	*			trans	-129.7	119.7	165.1	-126.7	-177.3	-174.4	-122.3	2.4	108.3
310	P	49.4	Very low	47.1	Very low	112 Å²	112	138.5 Å²	138.5	73%	0.727	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-66.5	151.8	172.1	28.6	-33.8	0	0	0	110.3
311	P	51.7	Low	46.5	Very low	114 Å²	114	140.7 Å²	140.7	74%	0.74	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-67.1	154.4	176.9	29.2	-35	0	0	0	111.4
312	P	50.5	Low	46.7	Very low	114 Å²	114	139.1 Å²	139.1	74%	0.74	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-66.3	147.9	176	29.2	-34.8	0	0	0	111.3
313	P	52.4	Low	46.3	Very low	123 Å²	123	145.3 Å²	145.3	80%	0.799	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-71.1	143.6	179.8	29.8	-34.8	0	0	0	111.7	L315	P313-L315 PolarHBondContact O-N 3.39Å
314	V	49.7	Very low	45.8	Very low	126 Å²	126	144.4 Å²	144.4	76%	0.764	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-77	121.4	175.1	-167.7	0	0	0	0	109.1	F316	V314-F316 PolarHBondContact O-N 2.91Å
315	L	43.9	Very low	45.6	Very low	168 Å²	168	144.6 Å²	144.6	88%	0.88	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-78.1	116.8	176.2	-87.9	155	0	0	0	110.7	P313	P313-L315 PolarHBondContact O-N 3.39Å
316	F	45.1	Very low	45.8	Very low	185 Å²	185	145 Å²	145	81%	0.811	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-82.3	141.3	164	-76.4	-92.8	0	0	0	110	V314 G318	V314-F316 PolarHBondContact O-N 2.91Å; F316-G318 PolarHBondContact O-N 3.45Å
317	P	37.3	Very low	45.7	Very low	133 Å²	133	135.7 Å²	135.7	86%	0.864	79%	0.792	S	S	*	*	S	Bend	trans	-78.9	119.9	-178.9	30.6	-32.8	0	0	0	111.5
318	G	54.5	Low	45.9	Very low	65 Å²	65	139 Å²	139	67%	0.67	80%	0.802	S	S	*	*			trans	135.6	56.2	162.1	0	0	0	0	0	119.1	F316	F316-G318 PolarHBondContact O-N 3.45Å
319	Q	44.1	Very low	45.9	Very low	180 Å²	180	138.5 Å²	138.5	84%	0.841	80%	0.798	S	S	*	*			trans	-143.4	145.2	155.2	-87.2	-57.6	-80.7	0	0	111.6
320	P	42.5	Very low	46.3	Very low	112 Å²	112	132.4 Å²	132.4	73%	0.727	79%	0.789	S	S	*	*			trans	-79.8	156.5	-175.5	32.8	-35	0	0	0	113.6
321	F	35.3	Very low	46.3	Very low	218 Å²	218	133.3 Å²	133.3	96%	0.956	80%	0.795	S	S	*	*			trans	-74.6	139.7	-177.5	-94	-109	0	0	0	113.7
322	G	46.3	Very low	46.2	Very low	67 Å²	67	130.9 Å²	130.9	69%	0.691	79%	0.791	S	S	*	*			trans	141.9	72.7	150.5	0	0	0	0	0	118.1
323	Q	44.2	Very low	46.5	Very low	192 Å²	192	131.5 Å²	131.5	90%	0.897	80%	0.795	S	S	*	*			trans	-172.2	151.2	144.5	-105.2	165.3	26.3	0	0	111
324	P	41.3	Very low	46.6	Very low	107 Å²	107	131.2 Å²	131.2	70%	0.695	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-78.4	152.3	-177.8	32.4	-34.7	0	0	0	112.5	L326	P324-L326 PolarHBondContact O-N 2.89Å
325	P	43.6	Very low	46.8	Very low	131 Å²	131	130.9 Å²	130.9	85%	0.851	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-76	118.8	-176.2	30.3	-33.8	0	0	0	111.8
326	L	45.7	Very low	47.1	Very low	169 Å²	169	128.8 Å²	128.8	89%	0.885	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-79.1	138.7	165.5	-66.9	171	0	0	0	109.6	P324	P324-L326 PolarHBondContact O-N 2.89Å
327	G	48.2	Very low	47.3	Very low	57 Å²	57	126 Å²	126	59%	0.588	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-65.2	162.7	177.8	0	0	0	0	0	113.2	L329	G327-L329 PolarHBondContact O-N 3.06Å
328	P	49.3	Very low	47.6	Very low	138 Å²	138	126 Å²	126	90%	0.896	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-66.4	120.6	-173.2	26.6	-34.1	0	0	0	112.2
329	L	45.9	Very low	47.5	Very low	159 Å²	159	126.5 Å²	126.5	83%	0.832	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-72.6	151.2	167.2	-74.2	162.8	0	0	0	110.5	G327	G327-L329 PolarHBondContact O-N 3.06Å
330	P	51.9	Low	47.6	Very low	110 Å²	110	128.7 Å²	128.7	71%	0.714	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-64.2	153.3	173.9	28.6	-35.1	0	0	0	111.4	G332	P330-G332 PolarHBondContact O-N 3.18Å
331	P	49.3	Very low	48.1	Very low	132 Å²	132	126.4 Å²	126.4	86%	0.857	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-64.8	125.3	-174.7	26.2	-34.2	0	0	0	111.7
332	G	49.7	Very low	48.9	Very low	63 Å²	63	121.9 Å²	121.9	65%	0.649	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-70.4	160.9	172.6	0	0	0	0	0	112.8	P330	P330-G332 PolarHBondContact O-N 3.18Å
333	P	56.5	Low	49.4	Very low	126 Å²	126	124.2 Å²	124.2	82%	0.818	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-66.9	154.3	-179.7	28.8	-35.2	0	0	0	112.4
334	P	54.6	Low	50	Low	117 Å²	117	121.3 Å²	121.3	76%	0.76	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-68.5	155	-176.3	28.9	-35.8	0	0	0	113
335	P	53.5	Low	50.6	Low	120 Å²	120	119 Å²	119	78%	0.779	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-69.4	147.9	-178.1	29.1	-35.4	0	0	0	112.4
336	P	49.3	Very low	51.3	Low	124 Å²	124	118.6 Å²	118.6	81%	0.805	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-76.7	144.2	-176.5	31	-35.1	0	0	0	112.9
337	V	51.2	Low	52.1	Low	125 Å²	125	116.1 Å²	116.1	76%	0.758	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-73.1	138.8	171.3	-72.7	0	0	0	0	111.3	G339	V337-G339 PolarHBondContact O-N 3.31Å
338	P	42	Very low	52.6	Low	135 Å²	135	118.7 Å²	118.7	88%	0.877	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	130	178	-18.4	31.7	0	0	0	111.9
339	G	53	Low	52.5	Low	74 Å²	74	117.9 Å²	117.9	76%	0.763	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	136.1	-13.6	166.7	0	0	0	0	0	116.9	V337	V337-G339 PolarHBondContact O-N 3.31Å
340	Y	47.3	Very low	52.6	Low	227 Å²	227	119.5 Å²	119.5	89%	0.89	78%	0.776	S	S	*	*			trans	-119.3	119.3	174.3	-84.5	-98.6	0	0	0	110.7
341	G	51.9	Low	52.4	Low	64 Å²	64	123.5 Å²	123.5	66%	0.66	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-66.2	151	170.8	0	0	0	0	0	111.2
342	P	53.2	Low	52.4	Low	123 Å²	123	119.8 Å²	119.8	80%	0.799	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-62.2	143.2	-179.6	26.6	-34.3	0	0	0	110.8
343	P	56.7	Low	53	Low	115 Å²	115	122.6 Å²	122.6	75%	0.747	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-62	143.7	175.7	27.3	-34.2	0	0	0	110	G345	P343-G345 PolarHBondContact O-N 2.86Å
344	P	56.8	Low	52.9	Low	131 Å²	131	122.1 Å²	122.1	85%	0.851	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-61.2	126.7	178.7	25.3	-33.2	0	0	0	109.9
345	G	53.2	Low	53	Low	59 Å²	59	122.1 Å²	122.1	61%	0.608	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-62.2	158	176.5	0	0	0	0	0	112.1	P343	P343-G345 PolarHBondContact O-N 2.86Å
346	P	59	Low	53.3	Low	123 Å²	123	122 Å²	122	80%	0.799	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-58	141	177.6	25.5	-34.1	0	0	0	110.4
347	P	60.8	Low	53.2	Low	116 Å²	116	122.1 Å²	122.1	75%	0.753	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-62.7	149.5	-177.6	26.6	-34.6	0	0	0	110.9
348	P	59.2	Low	53.1	Low	112 Å²	112	118.6 Å²	118.6	73%	0.727	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-58.4	144	172.9	26.7	-34.4	0	0	0	109.5	Q350	P348-Q350 PolarHBondContact O-N 3.45Å; P348-Q350 VanDerWaalsContact O-N 3.12Å
349	P	47.6	Very low	53.6	Low	121 Å²	121	118.5 Å²	118.5	79%	0.786	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-58	122.9	176.9	24.2	-32.8	0	0	0	108.9	Q351	P349-Q351 PolarHBondContact O-N 2.86Å; P349-Q351 VanDerWaalsContact O-N 3.08Å
350	Q	48.2	Very low	53.2	Low	192 Å²	192	124 Å²	124	90%	0.897	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-57.2	119	173.5	-71.3	-174.9	30.4	0	0	108.2	P348 G352	P348-Q350 PolarHBondContact O-N 3.45Å; P348-Q350 VanDerWaalsContact O-N 3.12Å; Q350-G352 VanDerWaalsContact C-N 3.34Å; Q350-G352 PolarHBondContact O-N 2.8Å
351	Q	47.3	Very low	53.4	Low	195 Å²	195	118.6 Å²	118.6	91%	0.911	76%	0.759	S	S	*	*			trans	-67.5	100.9	164.5	-65.6	-178.2	13.5	0	0	106.5	P349	P349-Q351 PolarHBondContact O-N 2.86Å; P349-Q351 VanDerWaalsContact O-N 3.08Å
352	G	48.8	Very low	53.6	Low	53 Å²	53	121.8 Å²	121.8	55%	0.546	77%	0.768	S	S	.	*	P	Polyproline II helix	trans	-57.6	155.2	170.8	0	0	0	0	0	110.5	Q350	Q350-G352 VanDerWaalsContact C-N 3.34Å; Q350-G352 PolarHBondContact O-N 2.8Å
353	P	63.8	Low	53.1	Low	122 Å²	122	127.1 Å²	127.1	79%	0.792	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-56.9	145.3	179.4	25.1	-34.2	0	0	0	110.8
354	P	53.6	Low	52.4	Low	117 Å²	117	127 Å²	127	76%	0.76	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-61.3	136.7	-174.2	24.7	-34.2	0	0	0	111.2
355	P	57.7	Low	51.9	Low	117 Å²	117	127 Å²	127	76%	0.76	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-65.2	149.8	173	28.3	-34.1	0	0	0	110.6
356	P	58.2	Low	51.3	Low	117 Å²	117	127 Å²	127	76%	0.76	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-65.2	147.8	-178.9	27.8	-35.2	0	0	0	111.5	G358	P356-G358 PolarHBondContact O-N 3.07Å; P356-G358 VanDerWaalsContact O-N 3.09Å
357	P	46.9	Very low	50.7	Low	126 Å²	126	127.8 Å²	127.8	82%	0.818	78%	0.776	S	S	*	*			trans	-69.1	108.6	179.5	27.6	-33.5	0	0	0	111.2
358	G	50.8	Low	49.8	Very low	51 Å²	51	130.4 Å²	130.4	53%	0.526	78%	0.783	S	S	.	*	P	Polyproline II helix	trans	-70.9	160.7	166.4	0	0	0	0	0	112.4	P356	P356-G358 PolarHBondContact O-N 3.07Å; P356-G358 VanDerWaalsContact O-N 3.09Å
359	P	51.8	Low	49	Very low	134 Å²	134	128.1 Å²	128.1	87%	0.87	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-73.1	130.3	-164	27.9	-35.1	0	0	0	113.9
360	F	43.4	Very low	49	Very low	188 Å²	188	128.2 Å²	128.2	83%	0.825	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-80.2	140.5	169.6	-71.7	-91	0	0	0	111.6
361	P	52.1	Low	48.9	Very low	114 Å²	114	125.1 Å²	125.1	74%	0.74	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-71.2	155.7	165.6	30.5	-33.4	0	0	0	111.6
362	P	56.3	Low	48.8	Very low	132 Å²	132	123.7 Å²	123.7	86%	0.857	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-77.2	146.7	-162	29.8	-36.3	0	0	0	114.7
363	R	42	Very low	48.2	Very low	235 Å²	235	127.5 Å²	127.5	89%	0.887	79%	0.788	S	S	*	*			trans	-116.7	136.8	175.3	-168.9	174.9	-173.6	-101.4	4.3	109.7
364	P	43.5	Very low	46.8	Very low	111 Å²	111	130.3 Å²	130.3	72%	0.721	80%	0.795	S	S	*	*			trans	-69.4	155.3	-177.7	27.4	-34.5	0	0	0	113
365	P	45.3	Very low	45.9	Very low	133 Å²	133	129.1 Å²	129.1	86%	0.864	80%	0.795	S	S	*	*			trans	-84	141.2	-163.4	32.4	-35.9	0	0	0	114.4
366	G	41	Very low	45.4	Very low	58 Å²	58	129.2 Å²	129.2	60%	0.598	80%	0.796	S	S	*	*			trans	-114.9	159.8	160.3	0	0	0	0	0	110.6
367	P	46.3	Very low	44.7	Very low	139 Å²	139	129.4 Å²	129.4	90%	0.903	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-67.3	134.1	-168.6	-20.7	33.7	0	0	0	113.7
368	L	41.7	Very low	44.9	Very low	171 Å²	171	128.4 Å²	128.4	90%	0.895	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-80.5	127.8	179.4	-67.5	163.6	0	0	0	111.3
369	G	43.4	Very low	44.4	Very low	65 Å²	65	133.3 Å²	133.3	67%	0.67	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-82.2	137.2	156.6	0	0	0	0	0	110.1
370	P	47	Very low	44	Very low	123 Å²	123	134.2 Å²	134.2	80%	0.799	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-87.4	137.3	-178.5	32.9	-33.2	0	0	0	112.7
371	P	45.3	Very low	44	Very low	127 Å²	127	130.9 Å²	130.9	83%	0.825	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-87.9	166.5	165.6	34.5	-31.9	0	0	0	112.9
372	L	46.8	Very low	43.7	Very low	165 Å²	165	129 Å²	129	86%	0.864	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-66.4	147.2	-168.5	-55.1	163.6	0	0	0	115.2
373	T	35.5	Very low	43.2	Very low	132 Å²	132	128.7 Å²	128.7	81%	0.81	79%	0.793	S	S	*	*				171.8	115.6	128.2	45.9	0	0	0	0	113.2
374	L	34.4	Very low	43.5	Very low	181 Å²	181	123.2 Å²	123.2	95%	0.948	79%	0.787	S	S	*	*				179.2	167	129.9	-121.8	66.9	0	0	0	112
375	A	34	Very low	43.6	Very low	92 Å²	92	124.4 Å²	124.4	76%	0.76	80%	0.795	S	S	*	*			trans	-85.7	161.8	-164	0	0	0	0	0	116.5
376	P	48.6	Very low	44	Very low	120 Å²	120	122 Å²	122	78%	0.779	80%	0.795	S	S	*	*			trans	-88.3	159.8	175.7	38.6	-36.8	0	0	0	112.4
377	P	42.9	Very low	44.4	Very low	121 Å²	121	123.6 Å²	123.6	79%	0.786	80%	0.802	S	S	*	*				-155.9	-160.1	73.2	45.1	-24.3	0	0	0	114
378	P	51.6	Low	44.7	Very low	104 Å²	104	122.4 Å²	122.4	68%	0.675	80%	0.795	S	S	*	*			cis	-125.4	-172.4	-23.9	33.5	-14	0	0	0	114.2
379	H	39.7	Very low	45.3	Very low	155 Å²	155	120 Å²	120	72%	0.718	79%	0.789	S	S	*	*			trans	65.3	106.8	151.3	88.4	-45.7	0	0	0	123
380	L	43.2	Very low	45.6	Very low	152 Å²	152	123 Å²	123	80%	0.796	80%	0.797	S	S	*	*				172.2	157.3	106	-88.8	167.8	0	0	0	110.7
381	P	44.2	Very low	45.5	Very low	119 Å²	119	121.3 Å²	121.3	77%	0.773	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-84.4	146.4	-158.2	33	-36.7	0	0	0	115.1
382	G	44.3	Very low	45.6	Very low	74 Å²	74	120.6 Å²	120.6	76%	0.763	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-91.9	148.2	178.6	0	0	0	0	0	114.8
383	P	46.8	Very low	46	Very low	126 Å²	126	121.4 Å²	121.4	82%	0.818	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-80.1	168.8	163.7	-8.6	27.2	0	0	0	112.8
384	P	48.7	Very low	46.7	Very low	119 Å²	119	120.7 Å²	120.7	77%	0.773	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-83.2	160.1	-160	33.1	-37.3	0	0	0	115.7
385	P	45.1	Very low	47.3	Very low	136 Å²	136	117.8 Å²	117.8	88%	0.883	77%	0.768	S	S	*	*	S	Bend	trans	-76.3	135.3	177.3	31.8	-34.4	0	0	0	111.9
386	G	53.9	Low	48.5	Very low	83 Å²	83	118.9 Å²	118.9	86%	0.856	77%	0.768	S	S	*	*			trans	157.5	-8.5	171.7	0	0	0	0	0	118
387	A	49.3	Very low	48.5	Very low	91 Å²	91	117.5 Å²	117.5	75%	0.752	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-100.6	140.5	179.7	0	0	0	0	0	112.4
388	P	53.1	Low	48.7	Very low	115 Å²	115	120.9 Å²	120.9	75%	0.747	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-68.2	148.2	174	29.5	-34.6	0	0	0	111.3
389	P	53.7	Low	48.5	Very low	121 Å²	121	124.4 Å²	124.4	79%	0.786	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-67.7	140.1	-177.8	27.7	-34.5	0	0	0	111.8
390	P	48.9	Very low	48.9	Very low	128 Å²	128	122.6 Å²	122.6	83%	0.831	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-67.4	138.7	173.5	28.5	-33.7	0	0	0	110.7
391	A	45.3	Very low	49.2	Very low	86 Å²	86	120.6 Å²	120.6	71%	0.711	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-65.5	143.1	-176.2	0	0	0	0	0	112.6	H393	A391-H393 PolarHBondContact O-N 2.95Å
392	P	48.6	Very low	49.1	Very low	113 Å²	113	121 Å²	121	73%	0.734	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-70.7	118.3	176.4	29.1	-33.3	0	0	0	110.4	V394	P392-V394 PolarHBondContact O-N 3.38Å
393	H	54.5	Low	48.7	Very low	182 Å²	182	124.3 Å²	124.3	84%	0.843	78%	0.78	S	S	*	*			trans	-77.1	100.5	172.4	46.7	-83.7	0	0	0	109.1	A391	A391-H393 PolarHBondContact O-N 2.95Å
394	V	51	Low	48.2	Very low	116 Å²	116	125.9 Å²	125.9	70%	0.703	78%	0.781	S	S	*	*			trans	-86.5	131.2	179.7	-178.5	0	0	0	0	110.3	P392	P392-V394 PolarHBondContact O-N 3.38Å
395	N	46.2	Very low	47.5	Very low	120 Å²	120	125.8 Å²	125.8	64%	0.642	78%	0.784	S	S	*	*			trans	-69.4	128.7	-176	-169.9	-5.8	0	0	0	111.2	A397	N395-A397 PolarHBondContact O-N 2.88Å
396	P	59.2	Low	46.9	Very low	116 Å²	116	122.7 Å²	122.7	75%	0.753	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-65.6	-11.2	-172.7	-23.2	34.2	0	0	0	116	F398	P396-F398 PolarHBondContact O-N 3.48Å
397	A	49	Very low	46.1	Very low	90 Å²	90	127.2 Å²	127.2	74%	0.744	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-74.9	3.2	-173.5	0	0	0	0	0	115.6	N395	N395-A397 PolarHBondContact O-N 2.88Å
398	F	45.8	Very low	45.6	Very low	193 Å²	193	129 Å²	129	85%	0.846	78%	0.782	S	S	*	*	G	3₁₀ helix	trans	-111.2	13.8	-174.9	-141.2	-96.1	0	0	0	114.9	P396	P396-F398 PolarHBondContact O-N 3.48Å
399	F	47.9	Very low	44.7	Very low	178 Å²	178	129 Å²	129	78%	0.781	78%	0.78	S	S	*	*			trans	-115.8	124.5	174.9	-93.5	-90.3	0	0	0	111.9
400	P	48.2	Very low	43.9	Very low	116 Å²	116	128.2 Å²	128.2	75%	0.753	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-72.6	131.9	165.4	29.9	-31.7	0	0	0	109.9
401	P	48.7	Very low	43	Very low	110 Å²	110	128.8 Å²	128.8	71%	0.714	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-79.3	154.1	-176.9	31.1	-35.1	0	0	0	113.1
402	P	42.9	Very low	42.5	Very low	128 Å²	128	129.3 Å²	129.3	83%	0.831	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-71.4	132.5	175.1	29.9	-34.5	0	0	0	111.7	N404	P402-N404 PolarHBondContact O-N 3.02Å
403	T	36.5	Very low	41.8	Very low	144 Å²	144	136.3 Å²	136.3	88%	0.883	78%	0.783	S	S	*	*			trans	-85.7	91.1	-179.1	52.4	0	0	0	0	112.2
404	N	35.6	Very low	40.6	Very low	158 Å²	158	131.4 Å²	131.4	85%	0.845	78%	0.782	S	S	*	*			trans	-161.7	104.3	149.3	-159.3	0.5	0	0	0	114.1	P402	P402-N404 PolarHBondContact O-N 3.02Å
405	S	34.9	Very low	40.8	Very low	117 Å²	117	131.8 Å²	131.8	82%	0.818	79%	0.787	S	S	*	*			trans	-177	134.3	148.4	52.9	0	0	0	0	109.9
406	G	31.6	Very low	40.6	Very low	71 Å²	71	131.9 Å²	131.9	73%	0.732	79%	0.794	S	S	*	*			trans	-86.4	168.5	-178.9	0	0	0	0	0	115.2
407	M	37.5	Very low	40.1	Very low	178 Å²	178	132.3 Å²	132.3	88%	0.877	80%	0.797	S	S	*	*			trans	60	140.9	176.3	-69.3	-169.7	175	0	0	117.1
408	P	38.6	Very low	40.1	Very low	130 Å²	130	134.4 Å²	134.4	84%	0.844	80%	0.801	S	S	*	*				-130.6	164.3	100.9	36.8	-29.2	0	0	0	114.7
409	T	35.1	Very low	39.7	Very low	114 Å²	114	132.6 Å²	132.6	70%	0.699	80%	0.8	S	S	*	*			trans	-85.2	154	178.2	49.4	0	0	0	0	113
410	S	35.5	Very low	39.5	Very low	105 Å²	105	128.5 Å²	128.5	73%	0.734	79%	0.791	S	S	*	*			trans	39.8	134.6	151.5	-54.3	0	0	0	0	119.9
411	D	29.7	Very low	39	Very low	139 Å²	139	133.7 Å²	133.7	74%	0.743	80%	0.797	S	S	*	*				-164.2	133.9	59.7	-121	-65	0	0	0	115.4
412	S	36.2	Very low	38.7	Very low	98 Å²	98	132.3 Å²	132.3	69%	0.685	80%	0.803	S	S	*	*			trans	38	111.1	136.5	-54.4	0	0	0	0	122.8
413	R	32.7	Very low	38.5	Very low	259 Å²	259	137.5 Å²	137.5	98%	0.977	81%	0.806	S	S	*	*			trans	-173.7	113.7	130.2	-106.9	169.5	-173.8	-170	2.4	115.5
414	G	30	Very low	39.3	Very low	79 Å²	79	135.5 Å²	135.5	81%	0.814	80%	0.795	S	S	*	*			trans	97.7	117.5	146.4	0	0	0	0	0	119.5
415	P	55.7	Low	40	Very low	124 Å²	124	133.4 Å²	133.4	81%	0.805	79%	0.791	S	S	*	*			trans	-111.5	166.5	173.4	40.5	-32.4	0	0	0	114.3
416	P	41.6	Very low	40.8	Very low	122 Å²	122	131.5 Å²	131.5	79%	0.792	78%	0.775	S	S	*	*			trans	-124.5	170.9	151.3	42.8	-31.7	0	0	0	111.2
417	P	47.7	Very low	41	Very low	125 Å²	125	138.4 Å²	138.4	81%	0.812	78%	0.781	S	S	*	*				-100.8	161.9	-98.5	37.3	-27.1	0	0	0	114.5
418	T	49.6	Very low	41.4	Very low	134 Å²	134	137.3 Å²	137.3	82%	0.822	78%	0.779	S	S	*	*			trans	-80.8	130.9	168.3	49.2	0	0	0	0	111.7
419	D	37.4	Very low	41.2	Very low	155 Å²	155	142.9 Å²	142.9	83%	0.829	78%	0.783	S	S	*	*			trans	-110.4	150.2	157.9	-105.7	-37.6	0	0	0	109.9
420	P	44.7	Very low	41.2	Very low	92 Å²	92	140.6 Å²	140.6	60%	0.597	78%	0.782	S	S	*	*				-121.2	14.2	-121.9	12.3	12.1	0	0	0	115.1
421	Y	36.2	Very low	41.4	Very low	225 Å²	225	142.3 Å²	142.3	88%	0.882	78%	0.783	S	S	*	*			trans	-111.7	68.3	-173.1	-69.1	-71.9	0	0	0	113.7	R423	Y421-R423 PolarHBondContact O-N 2.83Å
422	G	43.4	Very low	42	Very low	81 Å²	81	145.9 Å²	145.9	84%	0.835	79%	0.787	S	S	*	*			trans	-79.3	111.3	166.5	0	0	0	0	0	112.2
423	R	38.9	Very low	42	Very low	238 Å²	238	144.2 Å²	144.2	90%	0.898	79%	0.786	S	S	*	*			trans	-141.8	145.5	152.5	-119.6	-143.8	164.8	-158.8	-3.6	110.6	Y421	Y421-R423 PolarHBondContact O-N 2.83Å
424	P	53.1	Low	42.4	Very low	102 Å²	102	137.9 Å²	137.9	66%	0.662	78%	0.778	S	S	*	*			trans	-84.1	-176.1	-172.9	42.9	-40.2	0	0	0	109.7
425	P	50.1	Low	43.1	Very low	114 Å²	114	140 Å²	140	74%	0.74	78%	0.778	S	S	*	*			cis	-142.1	-129.3	25.2	32.7	-3.4	0	0	0	113.9
426	P	51.2	Low	42.2	Very low	77 Å²	77	137.5 Å²	137.5	50%	0.5	77%	0.774	S	S	.	*				-134.3	-173.7	-89	40.6	-23.5	0	0	0	115.6
427	Y	36.3	Very low	42.1	Very low	215 Å²	215	143.2 Å²	143.2	84%	0.843	78%	0.78	S	S	*	*			trans	56.1	115.5	155.8	-44.7	-46.9	0	0	0	119.1
428	D	45.9	Very low	41.6	Very low	156 Å²	156	145.9 Å²	145.9	83%	0.834	78%	0.781	S	S	*	*				42.9	101.3	125	-140.6	-56.1	0	0	0	118.9
429	R	33.8	Very low	41.4	Very low	247 Å²	247	148.1 Å²	148.1	93%	0.932	79%	0.785	S	S	*	*			trans	-150.3	118.2	143	-144.4	178.8	-158.9	-162.1	4.3	109.5
430	G	36.1	Very low	41.4	Very low	66 Å²	66	147.6 Å²	147.6	68%	0.68	78%	0.782	S	S	*	*			trans	-83.4	-166.9	-175.7	0	0	0	0	0	115.4
431	D	39	Very low	41.4	Very low	140 Å²	140	149 Å²	149	75%	0.749	79%	0.789	S	S	*	*			trans	90.8	143	164.8	-145.6	14.3	0	0	0	118.7
432	Y	41.8	Very low	41.5	Very low	215 Å²	215	142.3 Å²	142.3	84%	0.843	78%	0.78	S	S	*	*			trans	66.3	84.6	-179.8	-65.8	-80.3	0	0	0	120
433	G	36.8	Very low	41.9	Very low	63 Å²	63	147.4 Å²	147.4	65%	0.649	77%	0.774	S	S	*	*			trans	-161.1	128.6	150.8	0	0	0	0	0	109.7
434	P	41.4	Very low	43	Very low	125 Å²	125	141.2 Å²	141.2	81%	0.812	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-65.6	136.4	-174.5	27	-33.8	0	0	0	110.3	G436	P434-G436 PolarHBondContact O-N 2.9Å
435	P	44.2	Very low	43.7	Very low	125 Å²	125	142.2 Å²	142.2	81%	0.812	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-59.1	130.2	175.8	25.7	-33.1	0	0	0	108.3	R437	P435-R437 PolarHBondContact O-N 3.28Å; P435-R437 VanDerWaalsContact O-N 3.14Å
436	G	37.1	Very low	44.6	Very low	71 Å²	71	138.8 Å²	138.8	73%	0.732	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-53.3	124.5	-178.8	0	0	0	0	0	109.3	P434 E438	P434-G436 PolarHBondContact O-N 2.9Å; G436-E438 VanDerWaalsContact C-N 3.3Å; G436-E438 PolarHBondContact O-N 3.1Å
437	R	39.7	Very low	46	Very low	242 Å²	242	137.8 Å²	137.8	91%	0.913	74%	0.74	S	S	*	*			trans	-59.4	104	160.9	-73.9	-177.2	177.6	177.3	-1.4	106.1	P435 M439	P435-R437 PolarHBondContact O-N 3.28Å; P435-R437 VanDerWaalsContact O-N 3.14Å; R437-M439 PolarHBondContact O-N 3.26Å
438	E	36.4	Very low	48.3	Very low	180 Å²	180	135.6 Å²	135.6	84%	0.841	74%	0.737	S	S	*	*			trans	-43.8	132	143.8	-69.2	-171.2	144	0	0	106.2	G436 D440	G436-E438 VanDerWaalsContact C-N 3.3Å; G436-E438 PolarHBondContact O-N 3.1Å; E438-D440 PolarHBondContact O-N 2.82Å
439	M	45.8	Very low	50.4	Low	182 Å²	182	131.6 Å²	131.6	90%	0.897	73%	0.726	S	S	*	*			trans	-78.3	63	-174.8	-138.1	168	178.2	0	0	108.6	R437 T441	R437-M439 PolarHBondContact O-N 3.26Å; M439-T441 PolarHBondContact O-N 2.87Å
440	D	36.7	Very low	52.9	Low	144 Å²	144	124.2 Å²	124.2	77%	0.77	70%	0.702	S	S	*	*			trans	-42.4	110.6	158	-153.5	-30.7	0	0	0	104.9	E438 A442	E438-D440 PolarHBondContact O-N 2.82Å; D440-A442 PolarHBondContact O-N 2.83Å
441	T	44.8	Very low	55.4	Low	120 Å²	120	123.5 Å²	123.5	74%	0.736	68%	0.68	S	S	*	*			trans	-69.2	91.8	-169	-66.4	0	0	0	0	105.5	M439 R443	M439-T441 PolarHBondContact O-N 2.87Å; T441-R443 VanDerWaalsContact C-N 3.34Å; T441-R443 PolarHBondContact O-N 2.81Å
442	A	39.3	Very low	57.9	Low	85 Å²	85	122.8 Å²	122.8	70%	0.702	67%	0.672	S	S	*	*			trans	-50.8	104.3	-170.6	0	0	0	0	0	106.7	D440 T444	D440-A442 PolarHBondContact O-N 2.83Å; A442-T444 PolarHBondContact O-N 2.6Å
443	R	52	Low	60.3	Low	188 Å²	188	118.1 Å²	118.1	71%	0.709	66%	0.658	S	S	*	*			trans	-62.5	96.8	-179.3	-80.7	171.4	152.8	158.6	-9.5	104.8	T441 P445	T441-R443 VanDerWaalsContact C-N 3.34Å; T441-R443 PolarHBondContact O-N 2.81Å; R443-P445 WeakPolarHBondContact O-CD 3.48Å; R443-P445 VanDerWaalsContact O-N 3.09Å
444	T	62.4	Low	62.9	Low	108 Å²	108	116.2 Å²	116.2	66%	0.663	63%	0.633	S	S	*	*			trans	-48.5	121.7	159.4	33.3	0	0	0	0	104.8	A442 L446	A442-T444 PolarHBondContact O-N 2.6Å; T444-L446 PolarHBondContact O-N 3.36Å
445	P	66.9	Low	65.3	Low	123 Å²	123	110.8 Å²	110.8	80%	0.799	60%	0.597	S	S	*	*			trans	-56.4	115.8	176.6	22.9	-31.4	0	0	0	105.6	R443 S447	R443-P445 WeakPolarHBondContact O-CD 3.48Å; R443-P445 VanDerWaalsContact O-N 3.09Å; P445-S447 PolarHBondContact O-N 2.84Å
446	L	68.8	Low	67.6	Low	43 Å²	43	108.8 Å²	108.8	23%	0.225	58%	0.579	C	S	.	*			trans	-54.7	134.1	179.3	-70.5	166.3	0	0	0	106.9	T444 E450 I454 K496 V497	T444-L446 PolarHBondContact O-N 3.36Å; L446-E450 HydrophobicContact CB-CB 4.48Å; L446-E450 HydrophobicContact CD2-CB 4.45Å; L446-I454 HydrophobicContact CD1-CD1 4.08Å; L446-I454 HydrophobicContact CD2-CD1 4.48Å; L446-K496 HydrophobicContact CD1-CB 3.78Å; L446-K496 HydrophobicContact CD1-CD 4.33Å; L446-K496 HydrophobicContact CD2-CD 3.95Å; L446-V497 HydrophobicContact CD1-CG1 3.98Å
447	S	81.9	Confident	70.3	Confident	56 Å²	56	110.7 Å²	110.7	39%	0.392	56%	0.564	S	S	.	*			trans	-58.6	148.2	173.3	64	0	0	0	0	108.9	P445 A449 E450 F451	P445-S447 PolarHBondContact O-N 2.84Å; S447-A449 PolarHBondContact O-N 2.93Å; S447-A449 VanDerWaalsContact O-N 3.11Å; S447-E450 WeakPolarHBondContact CB-OE2 3.34Å; S447-E450 PolarHBondContact N-OE2 2.84Å; S447-E450 PolarHBondContact O-N 2.73Å; S447-E450 VanDerWaalsContact OG-CD 3.28Å; S447-E450 WeakPolarHBondContact OG-CG 3.42Å; S447-E450 PolarHBondContact OG-N 3.28Å; S447-E450 PolarHBondContact OG-OE2 3.27Å; S447-F451 PolarHBondContact O-N 3.19Å
448	E	84.1	Confident	73	Confident	168 Å²	168	99.4 Å²	99.4	79%	0.785	52%	0.522	S	S	*	.	H	α-helix	trans	-56.8	-33.1	-176.3	-171.6	162.7	-162.2	0	0	111.8	F451 E452	E448-F451 PolarHBondContact O-N 3.04Å; E448-E452 WeakPolarHBondContact O-CB 3.31Å; E448-E452 PolarHBondContact O-N 3.25Å
449	A	88.6	Confident	75.8	Confident	72 Å²	72	97.4 Å²	97.4	60%	0.595	51%	0.507	S	S	*	.	H	α-helix	trans	-64.4	-46.3	171.7	0	0	0	0	0	113.6	S447 F451 E452 E453	S447-A449 PolarHBondContact O-N 2.93Å; S447-A449 VanDerWaalsContact O-N 3.11Å; A449-F451 VanDerWaalsContact C-N 3.34Å; A449-E452 PolarHBondContact O-N 2.9Å; A449-E453 WeakPolarHBondContact O-CB 3.35Å; A449-E453 PolarHBondContact O-N 3.02Å
450	E	87.6	Confident	78.1	Confident	92 Å²	92	91.3 Å²	91.3	43%	0.43	49%	0.485	S	S	.	.	H	α-helix	trans	-65	-38.7	175.5	-71.9	166.5	117.8	0	0	111.5	L446 S447 E453 I454	L446-E450 HydrophobicContact CB-CB 4.48Å; L446-E450 HydrophobicContact CD2-CB 4.45Å; S447-E450 WeakPolarHBondContact CB-OE2 3.34Å; S447-E450 PolarHBondContact N-OE2 2.84Å; S447-E450 PolarHBondContact O-N 2.73Å; S447-E450 VanDerWaalsContact OG-CD 3.28Å; S447-E450 WeakPolarHBondContact OG-CG 3.42Å; S447-E450 PolarHBondContact OG-N 3.28Å; S447-E450 PolarHBondContact OG-OE2 3.27Å; E450-E453 PolarHBondContact O-N 3.37Å; E450-I454 WeakPolarHBondContact O-CB 3.22Å; E450-I454 VanDerWaalsContact O-CD1 3.32Å; E450-I454 WeakPolarHBondContact O-CD1 3.33Å; E450-I454 WeakPolarHBondContact O-CG1 3.45Å; E450-I454 PolarHBondContact O-N 2.93Å
451	F	88.3	Confident	80.9	Confident	51 Å²	51	86.5 Å²	86.5	22%	0.224	46%	0.459	C	S	.	.	H	α-helix	trans	-61.6	-48.4	175.1	176.6	-88.7	0	0	0	111.1	S447 E448 A449 I454 M455 V497 D500	S447-F451 PolarHBondContact O-N 3.19Å; E448-F451 PolarHBondContact O-N 3.04Å; A449-F451 VanDerWaalsContact C-N 3.34Å; F451-I454 PolarHBondContact O-N 2.82Å; F451-M455 HydrophobicContact CD1-CG 4.22Å; F451-M455 HydrophobicContact CE1-CG 3.76Å; F451-M455 HydrophobicContact CE2-CG 4.47Å; F451-M455 HydrophobicContact CZ-CG 3.89Å; F451-M455 WeakPolarHBondContact O-CB 3.37Å; F451-M455 WeakPolarHBondContact O-CG 3.39Å; F451-M455 PolarHBondContact O-N 2.91Å; F451-V497 HydrophobicContact CD2-CB 4.18Å; F451-V497 HydrophobicContact CD2-CG1 3.39Å; F451-V497 HydrophobicContact CE2-CB 3.92Å; F451-V497 HydrophobicContact CE2-CG1 3.67Å; F451-V497 HydrophobicContact CG-CG1 4.28Å; F451-D500 HydrophobicContact CE2-CB 4.26Å; F451-D500 HydrophobicContact CZ-CB 4.25Å
452	E	90.8	Very high	83.3	Confident	126 Å²	126	81 Å²	81	59%	0.589	43%	0.425	S	S	*	.	H	α-helix	trans	-64.5	-40.5	178.1	-173.6	168.6	-151	0	0	112	E448 A449 M455 N456	E448-E452 WeakPolarHBondContact O-CB 3.31Å; E448-E452 PolarHBondContact O-N 3.25Å; A449-E452 PolarHBondContact O-N 2.9Å; E452-M455 PolarHBondContact O-N 3.38Å; E452-N456 WeakPolarHBondContact O-CB 3.44Å; E452-N456 PolarHBondContact O-N 3.45Å
453	E	91.9	Very high	86	Confident	116 Å²	116	80 Å²	80	54%	0.542	41%	0.413	S	S	.	.	H	α-helix	trans	-62.6	-44.9	176.2	-159.4	-154.3	144.5	0	0	111.6	A449 E450 M455 N456 R457	A449-E453 WeakPolarHBondContact O-CB 3.35Å; A449-E453 PolarHBondContact O-N 3.02Å; E450-E453 PolarHBondContact O-N 3.37Å; E453-M455 VanDerWaalsContact C-N 3.34Å; E453-M455 PolarHBondContact O-N 3.46Å; E453-N456 PolarHBondContact O-N 3.25Å; E453-R457 WeakPolarHBondContact O-CB 3.42Å; E453-R457 PolarHBondContact O-N 2.89Å; E453-R457 IonicContact OE1-CZ 3.26Å; E453-R457 IonicContact OE1-NH2 3.99Å; E453-R457 PolarHBondContact OE1-NH2 3.12Å; E453-R457 IonicContact OE2-NH2 2.91Å
454	I	92.1	Very high	88.1	Confident	24 Å²	24	74 Å²	74	12%	0.123	40%	0.401	C	S	.	.	H	α-helix	trans	-64.1	-40.2	175.7	-62.2	160.2	0	0	0	110.5	L446 E450 F451 R457 N458 V497	L446-I454 HydrophobicContact CD1-CD1 4.08Å; L446-I454 HydrophobicContact CD2-CD1 4.48Å; E450-I454 WeakPolarHBondContact O-CB 3.22Å; E450-I454 VanDerWaalsContact O-CD1 3.32Å; E450-I454 WeakPolarHBondContact O-CD1 3.33Å; E450-I454 WeakPolarHBondContact O-CG1 3.45Å; E450-I454 PolarHBondContact O-N 2.93Å; F451-I454 PolarHBondContact O-N 2.82Å; I454-R457 WeakPolarHBondContact O-CB 3.38Å; I454-R457 PolarHBondContact O-N 3.26Å; I454-N458 WeakPolarHBondContact O-CB 3.2Å; I454-N458 VanDerWaalsContact O-CG 3.27Å; I454-N458 PolarHBondContact O-N 2.94Å; I454-V497 HydrophobicContact CB-CG1 4.25Å; I454-V497 HydrophobicContact CB-CG2 4.36Å; I454-V497 HydrophobicContact CD1-CG1 4.38Å; I454-V497 HydrophobicContact CG2-CB 4.47Å; I454-V497 HydrophobicContact CG2-CG1 4.08Å; I454-V497 HydrophobicContact CG2-CG2 3.51Å
455	M	91.2	Very high	89.7	Confident	11 Å²	11	69.2 Å²	69.2	5%	0.054	37%	0.371	C	S	.	.	H	α-helix	trans	-64.6	-42.5	176.3	-83.9	-60	-54.4	0	0	113	F451 E452 E453 R457 N458 R459 V497 R502 C503 L506	F451-M455 HydrophobicContact CD1-CG 4.22Å; F451-M455 HydrophobicContact CE1-CG 3.76Å; F451-M455 HydrophobicContact CE2-CG 4.47Å; F451-M455 HydrophobicContact CZ-CG 3.89Å; F451-M455 WeakPolarHBondContact O-CB 3.37Å; F451-M455 WeakPolarHBondContact O-CG 3.39Å; F451-M455 PolarHBondContact O-N 2.91Å; E452-M455 PolarHBondContact O-N 3.38Å; E453-M455 VanDerWaalsContact C-N 3.34Å; E453-M455 PolarHBondContact O-N 3.46Å; M455-R457 VanDerWaalsContact C-N 3.33Å; M455-N458 PolarHBondContact O-N 2.95Å; M455-R459 WeakPolarHBondContact O-CB 3.37Å; M455-R459 PolarHBondContact O-N 3.33Å; M455-V497 HydrophobicContact SD-CG2 4.15Å; M455-R502 HydrophobicContact CE-CB 3.48Å; M455-R502 VanDerWaalsContact CE-CB 3.48Å; M455-R502 HydrophobicContact SD-CB 4.41Å; M455-C503 PolarHBondContact SD-SG 3.22Å; M455-L506 HydrophobicContact CE-CD1 4.33Å
456	N	93.9	Very high	91.1	Very high	83 Å²	83	65.4 Å²	65.4	44%	0.444	34%	0.344	S	S	.	.	H	α-helix	trans	-64.6	-39.4	175	-110.4	-9.8	0	0	0	111.3	E452 E453 R459 A460	E452-N456 WeakPolarHBondContact O-CB 3.44Å; E452-N456 PolarHBondContact O-N 3.45Å; E453-N456 PolarHBondContact O-N 3.25Å; N456-R459 PolarHBondContact O-N 3.46Å; N456-R459 PolarHBondContact OD1-NH1 3.09Å; N456-A460 PolarHBondContact O-N 2.85Å
457	R	94.2	Very high	92.4	Very high	111 Å²	111	67 Å²	67	42%	0.419	36%	0.359	S	S	.	.	H	α-helix	trans	-61.9	-45.9	173.3	-161.1	-176.5	-55.2	115.8	-0.9	111.7	E453 I454 M455 R459 A460 I461	E453-R457 WeakPolarHBondContact O-CB 3.42Å; E453-R457 PolarHBondContact O-N 2.89Å; E453-R457 IonicContact OE1-CZ 3.26Å; E453-R457 IonicContact OE1-NH2 3.99Å; E453-R457 PolarHBondContact OE1-NH2 3.12Å; E453-R457 IonicContact OE2-NH2 2.91Å; I454-R457 WeakPolarHBondContact O-CB 3.38Å; I454-R457 PolarHBondContact O-N 3.26Å; M455-R457 VanDerWaalsContact C-N 3.33Å; R457-R459 VanDerWaalsContact C-N 3.34Å; R457-R459 PolarHBondContact O-N 3.46Å; R457-A460 PolarHBondContact O-N 2.98Å; R457-I461 HydrophobicContact CG-CD1 4.15Å; R457-I461 VanDerWaalsContact O-CG1 3.3Å; R457-I461 WeakPolarHBondContact O-CG1 3.19Å; R457-I461 PolarHBondContact O-N 3.49Å
458	N	94.8	Very high	93	Very high	5 Å²	5	72.5 Å²	72.5	3%	0.027	37%	0.371	C	S	.	.	H	α-helix	trans	-63.9	-37.4	177.2	-73.8	-6.9	0	0	0	112.3	I454 M455 I461 S462 I492 S495 V497 C503 L506	I454-N458 WeakPolarHBondContact O-CB 3.2Å; I454-N458 VanDerWaalsContact O-CG 3.27Å; I454-N458 PolarHBondContact O-N 2.94Å; M455-N458 PolarHBondContact O-N 2.95Å; N458-I461 PolarHBondContact O-N 2.88Å; N458-S462 WeakPolarHBondContact O-CB 3.28Å; N458-S462 PolarHBondContact O-N 3.15Å; N458-S462 PolarHBondContact O-OG 3.34Å; N458-I492 HydrophobicContact CB-CG1 4.23Å; N458-S495 PolarHBondContact ND2-OG 3.48Å; N458-V497 WeakPolarHBondContact ND2-CG2 3.37Å; N458-C503 PolarHBondContact ND2-SG 3.24Å; N458-L506 HydrophobicContact CB-CD1 4.26Å
459	R	95	Very high	93.6	Very high	138 Å²	138	64.5 Å²	64.5	52%	0.521	33%	0.334	S	S	.	.	H	α-helix	trans	-62.5	-43.6	173	-174.4	-174.9	-72	143.5	-9.9	111.5	M455 N456 R457 S462 S463	M455-R459 WeakPolarHBondContact O-CB 3.37Å; M455-R459 PolarHBondContact O-N 3.33Å; N456-R459 PolarHBondContact O-N 3.46Å; N456-R459 PolarHBondContact OD1-NH1 3.09Å; R457-R459 VanDerWaalsContact C-N 3.34Å; R457-R459 PolarHBondContact O-N 3.46Å; R459-S462 PolarHBondContact O-N 3.25Å; R459-S463 PolarHBondContact O-N 2.81Å; R459-S463 PolarHBondContact O-OG 2.99Å; R459-S463 VanDerWaalsContact O-OG 3.08Å
460	A	95.4	Very high	93.8	Very high	53 Å²	53	64.9 Å²	64.9	44%	0.438	33%	0.328	S	S	.	.	H	α-helix	trans	-68.3	-39.7	176.3	0	0	0	0	0	113.1	N456 R457 S463 S464	N456-A460 PolarHBondContact O-N 2.85Å; R457-A460 PolarHBondContact O-N 2.98Å; A460-S463 PolarHBondContact O-OG 3.18Å; A460-S464 VanDerWaalsContact O-CB 3.28Å; A460-S464 WeakPolarHBondContact O-CB 3.44Å; A460-S464 PolarHBondContact O-N 3.18Å; A460-S464 PolarHBondContact O-OG 3.04Å
461	I	95.1	Very high	94.1	Very high	43 Å²	43	63.6 Å²	63.6	22%	0.221	33%	0.33	C	S	.	.	H	α-helix	trans	-61.5	-45.6	173.4	-70.2	164.6	0	0	0	110	R457 N458 S464 A465 A488 I492	R457-I461 HydrophobicContact CG-CD1 4.15Å; R457-I461 VanDerWaalsContact O-CG1 3.3Å; R457-I461 WeakPolarHBondContact O-CG1 3.19Å; R457-I461 PolarHBondContact O-N 3.49Å; N458-I461 PolarHBondContact O-N 2.88Å; I461-S464 PolarHBondContact O-OG 3.31Å; I461-A465 WeakPolarHBondContact O-CB 3.37Å; I461-A465 PolarHBondContact O-N 3.4Å; I461-A488 HydrophobicContact CG2-CB 4.01Å; I461-I492 HydrophobicContact CG2-CD1 4.3Å; I461-I492 HydrophobicContact CG2-CG1 4.33Å
462	S	95.9	Very high	94.3	Very high	4 Å²	4	63.7 Å²	63.7	3%	0.028	33%	0.332	C	S	.	.	H	α-helix	trans	-61.9	-51	179.6	-54.1	0	0	0	0	112	N458 R459 A465 I466 I492	N458-S462 WeakPolarHBondContact O-CB 3.28Å; N458-S462 PolarHBondContact O-N 3.15Å; N458-S462 PolarHBondContact O-OG 3.34Å; R459-S462 PolarHBondContact O-N 3.25Å; S462-A465 PolarHBondContact O-N 2.76Å; S462-I466 VanDerWaalsContact O-CG1 3.3Å; S462-I466 WeakPolarHBondContact O-CG1 3.33Å; S462-I466 PolarHBondContact O-N 3.27Å; S462-I492 WeakPolarHBondContact OG-CD1 3.38Å
463	S	95.3	Very high	94.3	Very high	64 Å²	64	58.3 Å²	58.3	45%	0.448	31%	0.31	S	S	.	.	H	α-helix	trans	-66.4	-42.9	-178.2	56.5	0	0	0	0	112.4	R459 A460 I466 S467	R459-S463 PolarHBondContact O-N 2.81Å; R459-S463 PolarHBondContact O-OG 2.99Å; R459-S463 VanDerWaalsContact O-OG 3.08Å; A460-S463 PolarHBondContact O-OG 3.18Å; S463-I466 PolarHBondContact O-N 3.26Å; S463-S467 WeakPolarHBondContact O-CB 3.49Å; S463-S467 PolarHBondContact O-N 3.23Å; S463-S467 PolarHBondContact O-OG 2.87Å
464	S	96.2	Very high	94.2	Very high	64 Å²	64	57.7 Å²	57.7	45%	0.448	32%	0.318	S	S	.	.	H	α-helix	trans	-66.3	-37.1	177.3	59.6	0	0	0	0	113.1	A460 I461 R468	A460-S464 VanDerWaalsContact O-CB 3.28Å; A460-S464 WeakPolarHBondContact O-CB 3.44Å; A460-S464 PolarHBondContact O-N 3.18Å; A460-S464 PolarHBondContact O-OG 3.04Å; I461-S464 PolarHBondContact O-OG 3.31Å; S464-R468 WeakPolarHBondContact O-CB 3.4Å; S464-R468 WeakPolarHBondContact O-CG 3.29Å; S464-R468 PolarHBondContact O-N 3.39Å
465	A	96.4	Very high	94.1	Very high	6 Å²	6	60 Å²	60	5%	0.05	34%	0.341	C	S	.	.	H	α-helix	trans	-66.8	-44.7	175.6	0	0	0	0	0	112.2	I461 S462 R468 A469 T484 L485 A488 L510	I461-A465 WeakPolarHBondContact O-CB 3.37Å; I461-A465 PolarHBondContact O-N 3.4Å; S462-A465 PolarHBondContact O-N 2.76Å; A465-R468 PolarHBondContact O-N 3.21Å; A465-A469 VanDerWaalsContact O-CB 3.25Å; A465-A469 WeakPolarHBondContact O-CB 3.32Å; A465-A469 PolarHBondContact O-N 3.41Å; A465-T484 HydrophobicContact CB-CG2 4.21Å; A465-L485 HydrophobicContact CB-CD2 4.38Å; A465-A488 HydrophobicContact CB-CB 3.4Å; A465-A488 VanDerWaalsContact CB-CB 3.4Å; A465-L510 HydrophobicContact CB-CD2 4.11Å
466	I	95.3	Very high	93.8	Very high	44 Å²	44	61.2 Å²	61.2	23%	0.226	36%	0.356	C	S	.	.	H	α-helix	trans	-61.2	-48.5	174.7	-67.1	167.9	0	0	0	110.4	S462 S463 R468 A469 V470 L485 L510 C513	S462-I466 VanDerWaalsContact O-CG1 3.3Å; S462-I466 WeakPolarHBondContact O-CG1 3.33Å; S462-I466 PolarHBondContact O-N 3.27Å; S463-I466 PolarHBondContact O-N 3.26Å; I466-R468 VanDerWaalsContact C-N 3.33Å; I466-R468 PolarHBondContact O-N 2.84Å; I466-A469 PolarHBondContact O-N 2.96Å; I466-V470 HydrophobicContact CG2-CG2 4.21Å; I466-V470 WeakPolarHBondContact O-CB 3.43Å; I466-V470 VanDerWaalsContact O-CG2 3.28Å; I466-V470 WeakPolarHBondContact O-CG2 3.48Å; I466-V470 PolarHBondContact O-N 2.86Å; I466-L485 HydrophobicContact CG1-CD2 4.32Å; I466-L510 HydrophobicContact CD1-CD2 4.17Å; I466-L510 HydrophobicContact CG1-CD2 3.72Å; I466-C513 HydrophobicContact CG1-CB 4.4Å
467	S	96.1	Very high	93.7	Very high	77 Å²	77	62 Å²	62	54%	0.538	36%	0.36	S	S	.	.	H	α-helix	trans	-61.3	-39.8	-179.4	-62.6	0	0	0	0	112.8	S463 S471	S463-S467 WeakPolarHBondContact O-CB 3.49Å; S463-S467 PolarHBondContact O-N 3.23Å; S463-S467 PolarHBondContact O-OG 2.87Å; S467-S471 WeakPolarHBondContact O-CB 3.37Å; S467-S471 PolarHBondContact O-N 2.85Å; S467-S471 PolarHBondContact O-OG 3.02Å
468	R	95.5	Very high	93.7	Very high	171 Å²	171	58.9 Å²	58.9	65%	0.645	35%	0.348	S	S	*	.	H	α-helix	trans	-67.4	-53.3	174.4	-80.4	-178	167.3	174.5	-4.2	111.5	S464 A465 I466 V470 S471 D472 T484	S464-R468 WeakPolarHBondContact O-CB 3.4Å; S464-R468 WeakPolarHBondContact O-CG 3.29Å; S464-R468 PolarHBondContact O-N 3.39Å; A465-R468 PolarHBondContact O-N 3.21Å; I466-R468 VanDerWaalsContact C-N 3.33Å; I466-R468 PolarHBondContact O-N 2.84Å; R468-V470 VanDerWaalsContact C-N 3.29Å; R468-V470 PolarHBondContact O-N 2.76Å; R468-S471 CarbonylContact O-C 3.57Å; R468-S471 WeakPolarHBondContact O-CA 3.31Å; R468-S471 WeakPolarHBondContact O-CB 3.46Å; R468-S471 PolarHBondContact O-N 3.46Å; R468-D472 VanDerWaalsContact O-CG 3.25Å; R468-D472 PolarHBondContact O-N 3.19Å; R468-T484 HydrophobicContact CB-CG2 4.16Å
469	A	96	Very high	93.5	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-60.6	-36.4	-177.7	0	0	0	0	0	113.2	A465 I466 A473 A481 L485 I517	A465-A469 VanDerWaalsContact O-CB 3.25Å; A465-A469 WeakPolarHBondContact O-CB 3.32Å; A465-A469 PolarHBondContact O-N 3.41Å; I466-A469 PolarHBondContact O-N 2.96Å; A469-A473 WeakPolarHBondContact O-CB 3.39Å; A469-A473 PolarHBondContact O-N 3.37Å; A469-A481 HydrophobicContact CB-CB 4.07Å; A469-A481 WeakPolarHBondContact CB-O 3.36Å; A469-A481 WeakPolarHBondContact O-CB 3.25Å; A469-L485 HydrophobicContact CB-CD1 3.64Å; A469-L485 HydrophobicContact CB-CD2 3.85Å; A469-L485 HydrophobicContact CB-CG 3.51Å; A469-I517 HydrophobicContact CB-CD1 4.04Å
470	V	93.8	Very high	93.4	Very high	79 Å²	79	57.2 Å²	57.2	48%	0.479	37%	0.366	S	S	.	.	H	α-helix	trans	-67.4	-37.7	172.6	171.6	0	0	0	0	111.8	I466 R468 S474	I466-V470 HydrophobicContact CG2-CG2 4.21Å; I466-V470 WeakPolarHBondContact O-CB 3.43Å; I466-V470 VanDerWaalsContact O-CG2 3.28Å; I466-V470 WeakPolarHBondContact O-CG2 3.48Å; I466-V470 PolarHBondContact O-N 2.86Å; R468-V470 VanDerWaalsContact C-N 3.29Å; R468-V470 PolarHBondContact O-N 2.76Å; V470-S474 WeakPolarHBondContact O-CB 3.41Å; V470-S474 PolarHBondContact O-N 2.9Å
471	S	94.1	Very high	93.3	Very high	66 Å²	66	54.7 Å²	54.7	46%	0.462	35%	0.345	S	S	.	.	H	α-helix	trans	-66.5	-48.6	175.2	-57.6	0	0	0	0	111.5	S467 R468 A473 S474 A475	S467-S471 WeakPolarHBondContact O-CB 3.37Å; S467-S471 PolarHBondContact O-N 2.85Å; S467-S471 PolarHBondContact O-OG 3.02Å; R468-S471 CarbonylContact O-C 3.57Å; R468-S471 WeakPolarHBondContact O-CA 3.31Å; R468-S471 WeakPolarHBondContact O-CB 3.46Å; R468-S471 PolarHBondContact O-N 3.46Å; S471-A473 PolarHBondContact O-N 2.69Å; S471-S474 WeakPolarHBondContact O-CA 3.31Å; S471-S474 WeakPolarHBondContact O-CB 3.46Å; S471-S474 PolarHBondContact O-N 2.87Å; S471-S474 PolarHBondContact O-OG 2.87Å; S471-A475 PolarHBondContact O-N 3.12Å
472	D	91.9	Very high	93.3	Very high	52 Å²	52	54 Å²	54	28%	0.278	34%	0.342	S	S	.	.	H	α-helix	trans	-65.3	-41.1	180	-58	-25.2	0	0	0	110.9	R468 S474 A475 G476 D477 A481	R468-D472 VanDerWaalsContact O-CG 3.25Å; R468-D472 PolarHBondContact O-N 3.19Å; D472-S474 PolarHBondContact O-N 2.92Å; D472-A475 WeakPolarHBondContact O-CB 3.24Å; D472-A475 PolarHBondContact O-N 3.04Å; D472-A475 VanDerWaalsContact O-N 3.15Å; D472-G476 PolarHBondContact O-N 3.3Å; D472-D477 PolarHBondContact O-N 3.14Å; D472-A481 HydrophobicContact CB-CB 3.98Å
473	A	91.1	Very high	93.2	Very high	14 Å²	14	60 Å²	60	12%	0.116	37%	0.369	C	S	.	.	H	α-helix	trans	-64.7	-24.5	171.8	0	0	0	0	0	113.3	A469 S471 Y478 A481 I517	A469-A473 WeakPolarHBondContact O-CB 3.39Å; A469-A473 PolarHBondContact O-N 3.37Å; S471-A473 PolarHBondContact O-N 2.69Å; A473-Y478 HydrophobicContact CB-CD1 3.89Å; A473-Y478 HydrophobicContact CB-CE1 3.88Å; A473-Y478 WeakPolarHBondContact O-CE1 3.38Å; A473-A481 HydrophobicContact CB-CB 4.28Å; A473-I517 HydrophobicContact CB-CD1 4.06Å; A473-I517 HydrophobicContact CB-CG1 4.11Å; A473-I517 HydrophobicContact CB-CG2 4.18Å
474	S	89.3	Confident	93.2	Very high	103 Å²	103	59 Å²	59	72%	0.72	36%	0.36	S	S	*	.	H	α-helix	trans	-79.6	-31.2	172.7	82.2	0	0	0	0	112.8	V470 S471 D472 G476	V470-S474 WeakPolarHBondContact O-CB 3.41Å; V470-S474 PolarHBondContact O-N 2.9Å; S471-S474 WeakPolarHBondContact O-CA 3.31Å; S471-S474 WeakPolarHBondContact O-CB 3.46Å; S471-S474 PolarHBondContact O-N 2.87Å; S471-S474 PolarHBondContact O-OG 2.87Å; D472-S474 PolarHBondContact O-N 2.92Å; S474-G476 VanDerWaalsContact C-N 3.27Å
475	A	89	Confident	93.2	Very high	73 Å²	73	55.9 Å²	55.9	60%	0.603	34%	0.339	S	S	*	.	H	α-helix	trans	-70	-26.6	169.2	0	0	0	0	0	112.1	S471 D472	S471-A475 PolarHBondContact O-N 3.12Å; D472-A475 WeakPolarHBondContact O-CB 3.24Å; D472-A475 PolarHBondContact O-N 3.04Å; D472-A475 VanDerWaalsContact O-N 3.15Å
476	G	86.6	Confident	93.1	Very high	35 Å²	35	58.8 Å²	58.8	36%	0.361	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.5	-0.3	-179.2	0	0	0	0	0	113.8	D472 S474 Y478	D472-G476 PolarHBondContact O-N 3.3Å; S474-G476 VanDerWaalsContact C-N 3.27Å; G476-Y478 WeakPolarHBondContact O-CD2 3.39Å; G476-Y478 PolarHBondContact O-N 3.44Å
477	D	91.3	Very high	93.2	Very high	100 Å²	100	60.5 Å²	60.5	54%	0.535	37%	0.368	S	S	.	.			trans	-84.4	62.2	179.8	-66.8	-50.8	0	0	0	111	D472 G479 S480 A481	D472-D477 PolarHBondContact O-N 3.14Å; D477-G479 PolarHBondContact O-N 2.87Å; D477-G479 VanDerWaalsContact O-N 3.16Å; D477-S480 PolarHBondContact O-N 3.24Å; D477-A481 PolarHBondContact O-N 3.36Å
478	Y	92.8	Very high	93.2	Very high	45 Å²	45	57 Å²	57	18%	0.176	34%	0.344	C	S	.	.	H	α-helix	trans	-58.9	-27.6	-177.1	-61.4	-73	0	0	0	113.6	A473 G476 I482 I517 S521	A473-Y478 HydrophobicContact CB-CD1 3.89Å; A473-Y478 HydrophobicContact CB-CE1 3.88Å; A473-Y478 WeakPolarHBondContact O-CE1 3.38Å; G476-Y478 WeakPolarHBondContact O-CD2 3.39Å; G476-Y478 PolarHBondContact O-N 3.44Å; Y478-I482 VanDerWaalsContact O-CD1 3.32Å; Y478-I482 WeakPolarHBondContact O-CD1 3.49Å; Y478-I482 WeakPolarHBondContact O-CG1 3.39Å; Y478-I482 PolarHBondContact O-N 3.07Å; Y478-I517 HydrophobicContact CD1-CG2 4.03Å; Y478-S521 WeakPolarHBondContact CB-OG 3.39Å
479	G	91.9	Very high	93.1	Very high	47 Å²	47	49.8 Å²	49.8	49%	0.485	32%	0.318	S	S	.	.	H	α-helix	trans	-62.7	-54.8	176.9	0	0	0	0	0	112.2	D477 A481 I482 E483	D477-G479 PolarHBondContact O-N 2.87Å; D477-G479 VanDerWaalsContact O-N 3.16Å; G479-A481 VanDerWaalsContact C-N 3.28Å; G479-A481 PolarHBondContact O-N 3.31Å; G479-I482 PolarHBondContact O-N 3.41Å; G479-E483 PolarHBondContact O-N 2.85Å
480	S	91.8	Very high	93.1	Very high	62 Å²	62	52.1 Å²	52.1	43%	0.434	34%	0.335	S	S	.	.	H	α-helix	trans	-64	-33.1	178.3	-54.4	0	0	0	0	112.6	D477 T484	D477-S480 PolarHBondContact O-N 3.24Å; S480-T484 WeakPolarHBondContact O-CB 3.32Å; S480-T484 PolarHBondContact O-N 3.01Å; S480-T484 PolarHBondContact O-OG1 2.73Å
481	A	94.3	Very high	93.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.8	-46.4	172.5	0	0	0	0	0	112.5	A469 D472 A473 D477 G479 L485 I517	A469-A481 HydrophobicContact CB-CB 4.07Å; A469-A481 WeakPolarHBondContact CB-O 3.36Å; A469-A481 WeakPolarHBondContact O-CB 3.25Å; D472-A481 HydrophobicContact CB-CB 3.98Å; A473-A481 HydrophobicContact CB-CB 4.28Å; D477-A481 PolarHBondContact O-N 3.36Å; G479-A481 VanDerWaalsContact C-N 3.28Å; G479-A481 PolarHBondContact O-N 3.31Å; A481-L485 WeakPolarHBondContact O-CG 3.19Å; A481-L485 PolarHBondContact O-N 3.15Å; A481-I517 HydrophobicContact CB-CG2 4.16Å
482	I	94	Very high	93	Very high	28 Å²	28	49.2 Å²	49.2	14%	0.144	31%	0.311	C	S	.	.	H	α-helix	trans	-67.5	-46.7	179.9	-68.2	161.4	0	0	0	110.4	Y478 G479 T484 L485 V486 I517 E518	Y478-I482 VanDerWaalsContact O-CD1 3.32Å; Y478-I482 WeakPolarHBondContact O-CD1 3.49Å; Y478-I482 WeakPolarHBondContact O-CG1 3.39Å; Y478-I482 PolarHBondContact O-N 3.07Å; G479-I482 PolarHBondContact O-N 3.41Å; I482-T484 VanDerWaalsContact C-N 3.31Å; I482-T484 PolarHBondContact O-N 3.19Å; I482-L485 PolarHBondContact O-N 2.99Å; I482-L485 VanDerWaalsContact O-N 3.15Å; I482-V486 HydrophobicContact CG2-CG2 4.16Å; I482-V486 WeakPolarHBondContact O-CG2 3.43Å; I482-V486 PolarHBondContact O-N 3.03Å; I482-I517 HydrophobicContact CG1-CG2 4.02Å; I482-E518 HydrophobicContact CD1-CG 3.84Å; I482-E518 HydrophobicContact CG1-CG 4.09Å
483	E	94.8	Very high	93	Very high	131 Å²	131	52.9 Å²	52.9	61%	0.612	32%	0.324	S	S	*	.	H	α-helix	trans	-55.2	-46.1	176.2	-72.8	177	177.4	0	0	111.6	G479 L485 V486 T487	G479-E483 PolarHBondContact O-N 2.85Å; E483-L485 VanDerWaalsContact C-N 3.32Å; E483-L485 PolarHBondContact O-N 2.65Å; E483-V486 PolarHBondContact O-N 3.49Å; E483-T487 WeakPolarHBondContact O-CB 3.49Å; E483-T487 PolarHBondContact O-N 2.9Å; E483-T487 PolarHBondContact O-OG1 3.23Å
484	T	95.1	Very high	93	Very high	41 Å²	41	59.4 Å²	59.4	25%	0.252	35%	0.352	S	S	.	.	H	α-helix	trans	-57.5	-42.1	177.7	-63.1	0	0	0	0	112.5	A465 R468 S480 I482 A488	A465-T484 HydrophobicContact CB-CG2 4.21Å; R468-T484 HydrophobicContact CB-CG2 4.16Å; S480-T484 WeakPolarHBondContact O-CB 3.32Å; S480-T484 PolarHBondContact O-N 3.01Å; S480-T484 PolarHBondContact O-OG1 2.73Å; I482-T484 VanDerWaalsContact C-N 3.31Å; I482-T484 PolarHBondContact O-N 3.19Å; T484-A488 WeakPolarHBondContact O-CB 3.28Å; T484-A488 PolarHBondContact O-N 3.04Å; T484-A488 VanDerWaalsContact O-N 3.09Å
485	L	95.8	Very high	93	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-72.5	-43.4	178.4	-67.8	171.7	0	0	0	112.4	A465 I466 A469 A481 I482 E483 T487 A488 I489 L510 C513 L514 I517	A465-L485 HydrophobicContact CB-CD2 4.38Å; I466-L485 HydrophobicContact CG1-CD2 4.32Å; A469-L485 HydrophobicContact CB-CD1 3.64Å; A469-L485 HydrophobicContact CB-CD2 3.85Å; A469-L485 HydrophobicContact CB-CG 3.51Å; A481-L485 WeakPolarHBondContact O-CG 3.19Å; A481-L485 PolarHBondContact O-N 3.15Å; I482-L485 PolarHBondContact O-N 2.99Å; I482-L485 VanDerWaalsContact O-N 3.15Å; E483-L485 VanDerWaalsContact C-N 3.32Å; E483-L485 PolarHBondContact O-N 2.65Å; L485-T487 VanDerWaalsContact C-N 3.33Å; L485-T487 PolarHBondContact O-N 3.3Å; L485-A488 PolarHBondContact O-N 3Å; L485-I489 VanDerWaalsContact O-CG1 3.31Å; L485-I489 WeakPolarHBondContact O-CG1 3.48Å; L485-I489 PolarHBondContact O-N 3.05Å; L485-L510 HydrophobicContact CD2-CD2 3.65Å; L485-C513 HydrophobicContact CD1-CB 4.31Å; L485-L514 HydrophobicContact CB-CB 4.23Å; L485-L514 HydrophobicContact CB-CD1 4.04Å; L485-L514 HydrophobicContact CD1-CB 3.9Å; L485-I517 HydrophobicContact CD1-CD1 3.96Å
486	V	95.1	Very high	92.9	Very high	67 Å²	67	58.6 Å²	58.6	41%	0.406	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-41.5	177	174.6	0	0	0	0	111.1	I482 E483 S490 L514	I482-V486 HydrophobicContact CG2-CG2 4.16Å; I482-V486 WeakPolarHBondContact O-CG2 3.43Å; I482-V486 PolarHBondContact O-N 3.03Å; E483-V486 PolarHBondContact O-N 3.49Å; V486-S490 WeakPolarHBondContact O-CB 3.36Å; V486-S490 PolarHBondContact O-N 2.86Å; V486-S490 PolarHBondContact O-OG 3.32Å; V486-L514 HydrophobicContact CG2-CD1 3.53Å
487	T	96.4	Very high	93	Very high	80 Å²	80	57.2 Å²	57.2	49%	0.491	31%	0.309	S	S	.	.	H	α-helix	trans	-63.2	-45.5	174.6	-59.5	0	0	0	0	111.4	E483 L485 I489 S490 L491	E483-T487 WeakPolarHBondContact O-CB 3.49Å; E483-T487 PolarHBondContact O-N 2.9Å; E483-T487 PolarHBondContact O-OG1 3.23Å; L485-T487 VanDerWaalsContact C-N 3.33Å; L485-T487 PolarHBondContact O-N 3.3Å; T487-I489 PolarHBondContact O-N 2.98Å; T487-S490 WeakPolarHBondContact O-CB 3.47Å; T487-S490 PolarHBondContact O-N 2.95Å; T487-L491 HydrophobicContact CG2-CD1 4.13Å; T487-L491 HydrophobicContact CG2-CG 4.46Å; T487-L491 WeakPolarHBondContact O-CG 3.49Å; T487-L491 PolarHBondContact O-N 3.22Å
488	A	96.1	Very high	92.7	Very high	4 Å²	4	54 Å²	54	3%	0.033	29%	0.294	C	S	.	.	H	α-helix	trans	-61.7	-43.7	177.8	0	0	0	0	0	112.9	I461 A465 T484 L485 S490 L491 I492 L510	I461-A488 HydrophobicContact CG2-CB 4.01Å; A465-A488 HydrophobicContact CB-CB 3.4Å; A465-A488 VanDerWaalsContact CB-CB 3.4Å; T484-A488 WeakPolarHBondContact O-CB 3.28Å; T484-A488 PolarHBondContact O-N 3.04Å; T484-A488 VanDerWaalsContact O-N 3.09Å; L485-A488 PolarHBondContact O-N 3Å; A488-S490 VanDerWaalsContact C-N 3.3Å; A488-S490 PolarHBondContact O-N 3.13Å; A488-L491 PolarHBondContact O-N 3.05Å; A488-I492 WeakPolarHBondContact O-CG1 3.43Å; A488-I492 PolarHBondContact O-N 2.93Å; A488-L510 HydrophobicContact CB-CD1 4.26Å; A488-L510 HydrophobicContact CB-CD2 4.32Å
489	I	94.6	Very high	92.4	Very high	18 Å²	18	55 Å²	55	9%	0.092	31%	0.311	C	S	.	.	H	α-helix	trans	-59.6	-43.3	174	-68.4	163.4	0	0	0	110.4	L485 T487 I492 K493 I507 L510 Q511 L514	L485-I489 VanDerWaalsContact O-CG1 3.31Å; L485-I489 WeakPolarHBondContact O-CG1 3.48Å; L485-I489 PolarHBondContact O-N 3.05Å; T487-I489 PolarHBondContact O-N 2.98Å; I489-I492 PolarHBondContact O-N 3.35Å; I489-K493 HydrophobicContact CG2-CD 3.83Å; I489-K493 HydrophobicContact CG2-CG 4.37Å; I489-K493 WeakPolarHBondContact O-CB 3.39Å; I489-K493 VanDerWaalsContact O-CG 3.31Å; I489-K493 WeakPolarHBondContact O-CG 3.42Å; I489-K493 PolarHBondContact O-N 3.04Å; I489-I507 HydrophobicContact CG2-CG2 4.24Å; I489-L510 HydrophobicContact CD1-CB 3.93Å; I489-L510 HydrophobicContact CG1-CB 3.56Å; I489-L510 HydrophobicContact CG1-CD1 4.01Å; I489-L510 HydrophobicContact CG1-CG 4.38Å; I489-Q511 HydrophobicContact CD1-CG 3.85Å; I489-L514 HydrophobicContact CD1-CD1 4.1Å
490	S	95.4	Very high	92.3	Very high	50 Å²	50	54.9 Å²	54.9	35%	0.35	30%	0.3	S	S	.	.	H	α-helix	trans	-63.9	-44.2	-179.7	-59.6	0	0	0	0	112	V486 T487 A488 K493 Q494	V486-S490 WeakPolarHBondContact O-CB 3.36Å; V486-S490 PolarHBondContact O-N 2.86Å; V486-S490 PolarHBondContact O-OG 3.32Å; T487-S490 WeakPolarHBondContact O-CB 3.47Å; T487-S490 PolarHBondContact O-N 2.95Å; A488-S490 VanDerWaalsContact C-N 3.3Å; A488-S490 PolarHBondContact O-N 3.13Å; S490-K493 PolarHBondContact O-N 3.5Å; S490-Q494 WeakPolarHBondContact O-CB 3.49Å; S490-Q494 VanDerWaalsContact O-CG 3.22Å; S490-Q494 WeakPolarHBondContact O-CG 3.36Å; S490-Q494 PolarHBondContact O-N 3.16Å
491	L	93.8	Very high	92.3	Very high	83 Å²	83	57.1 Å²	57.1	44%	0.435	31%	0.307	S	S	.	.	H	α-helix	trans	-61.9	-43.1	176.1	-70.7	170.5	0	0	0	112.3	T487 A488 Q494 S495	T487-L491 HydrophobicContact CG2-CD1 4.13Å; T487-L491 HydrophobicContact CG2-CG 4.46Å; T487-L491 WeakPolarHBondContact O-CG 3.49Å; T487-L491 PolarHBondContact O-N 3.22Å; A488-L491 PolarHBondContact O-N 3.05Å; L491-Q494 PolarHBondContact O-N 3.17Å; L491-S495 PolarHBondContact O-N 3.37Å; L491-S495 VanDerWaalsContact O-N 3.09Å
492	I	92.5	Very high	92.2	Very high	0 Å²	0	65 Å²	65	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-68.8	-39.6	178.6	-64.8	164.9	0	0	0	110.6	N458 I461 S462 A488 I489 Q494 S495 S498 C503 I507 L510	N458-I492 HydrophobicContact CB-CG1 4.23Å; I461-I492 HydrophobicContact CG2-CD1 4.3Å; I461-I492 HydrophobicContact CG2-CG1 4.33Å; S462-I492 WeakPolarHBondContact OG-CD1 3.38Å; A488-I492 WeakPolarHBondContact O-CG1 3.43Å; A488-I492 PolarHBondContact O-N 2.93Å; I489-I492 PolarHBondContact O-N 3.35Å; I492-Q494 VanDerWaalsContact C-N 3.34Å; I492-Q494 PolarHBondContact O-N 3.31Å; I492-S495 VanDerWaalsContact O-CB 3.31Å; I492-S495 WeakPolarHBondContact O-CB 3.37Å; I492-S495 PolarHBondContact O-N 3.26Å; I492-S495 VanDerWaalsContact O-N 3.14Å; I492-S495 PolarHBondContact O-OG 3.18Å; I492-S498 WeakPolarHBondContact O-CB 3.47Å; I492-C503 HydrophobicContact CG2-CB 4.44Å; I492-I507 HydrophobicContact CB-CG1 4.39Å; I492-I507 HydrophobicContact CG2-CD1 4.02Å; I492-I507 HydrophobicContact CG2-CG1 3.81Å; I492-L510 HydrophobicContact CD1-CD1 3.5Å
493	K	91.8	Very high	92.1	Very high	129 Å²	129	63.7 Å²	63.7	56%	0.561	33%	0.33	S	S	*	.	H	α-helix	trans	-66.4	-33.1	175.9	-73.1	-179.8	72.2	175.3	0	113.2	I489 S490 S495 S498 I507	I489-K493 HydrophobicContact CG2-CD 3.83Å; I489-K493 HydrophobicContact CG2-CG 4.37Å; I489-K493 WeakPolarHBondContact O-CB 3.39Å; I489-K493 VanDerWaalsContact O-CG 3.31Å; I489-K493 WeakPolarHBondContact O-CG 3.42Å; I489-K493 PolarHBondContact O-N 3.04Å; S490-K493 PolarHBondContact O-N 3.5Å; K493-S495 VanDerWaalsContact C-N 3.31Å; K493-S498 VanDerWaalsContact O-CB 3.23Å; K493-S498 WeakPolarHBondContact O-CB 3.08Å; K493-S498 PolarHBondContact O-OG 3Å; K493-I507 HydrophobicContact CG-CD1 3.68Å; K493-I507 HydrophobicContact CG-CG1 4.39Å
494	Q	91.2	Very high	92.1	Very high	151 Å²	151	62 Å²	62	71%	0.706	32%	0.321	S	S	*	.	H	α-helix	trans	-74.1	-19.3	172.8	-71.9	169.7	9.8	0	0	113.1	S490 L491 I492	S490-Q494 WeakPolarHBondContact O-CB 3.49Å; S490-Q494 VanDerWaalsContact O-CG 3.22Å; S490-Q494 WeakPolarHBondContact O-CG 3.36Å; S490-Q494 PolarHBondContact O-N 3.16Å; L491-Q494 PolarHBondContact O-N 3.17Å; I492-Q494 VanDerWaalsContact C-N 3.34Å; I492-Q494 PolarHBondContact O-N 3.31Å
495	S	89.5	Confident	92.1	Very high	17 Å²	17	65 Å²	65	12%	0.119	34%	0.338	C	S	.	.	S	Bend	trans	-64.6	143.9	176.6	82.1	0	0	0	0	111.2	N458 L491 I492 K493 V497 S498	N458-S495 PolarHBondContact ND2-OG 3.48Å; L491-S495 PolarHBondContact O-N 3.37Å; L491-S495 VanDerWaalsContact O-N 3.09Å; I492-S495 VanDerWaalsContact O-CB 3.31Å; I492-S495 WeakPolarHBondContact O-CB 3.37Å; I492-S495 PolarHBondContact O-N 3.26Å; I492-S495 VanDerWaalsContact O-N 3.14Å; I492-S495 PolarHBondContact O-OG 3.18Å; K493-S495 VanDerWaalsContact C-N 3.31Å; S495-V497 PolarHBondContact O-N 2.92Å; S495-V497 WeakPolarHBondContact OG-CG2 3.5Å; S495-S498 VanDerWaalsContact O-CB 3.31Å; S495-S498 WeakPolarHBondContact O-CB 3.48Å; S495-S498 PolarHBondContact O-N 3.22Å; S495-S498 PolarHBondContact O-OG 3.28Å; S495-S498 VanDerWaalsContact O-OG 3.11Å
496	K	86.8	Confident	92	Very high	143 Å²	143	66.5 Å²	66.5	62%	0.622	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-16.8	-177.3	-65	-180	179.4	-179.8	0	113.9	L446	L446-K496 HydrophobicContact CD1-CB 3.78Å; L446-K496 HydrophobicContact CD1-CD 4.33Å; L446-K496 HydrophobicContact CD2-CD 3.95Å
497	V	87.4	Confident	92	Very high	6 Å²	6	64.2 Å²	64.2	4%	0.036	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	6.3	-179.5	-56.2	0	0	0	0	113.3	L446 F451 I454 M455 N458 S495 A499 D500	L446-V497 HydrophobicContact CD1-CG1 3.98Å; F451-V497 HydrophobicContact CD2-CB 4.18Å; F451-V497 HydrophobicContact CD2-CG1 3.39Å; F451-V497 HydrophobicContact CE2-CB 3.92Å; F451-V497 HydrophobicContact CE2-CG1 3.67Å; F451-V497 HydrophobicContact CG-CG1 4.28Å; I454-V497 HydrophobicContact CB-CG1 4.25Å; I454-V497 HydrophobicContact CB-CG2 4.36Å; I454-V497 HydrophobicContact CD1-CG1 4.38Å; I454-V497 HydrophobicContact CG2-CB 4.47Å; I454-V497 HydrophobicContact CG2-CG1 4.08Å; I454-V497 HydrophobicContact CG2-CG2 3.51Å; M455-V497 HydrophobicContact SD-CG2 4.15Å; N458-V497 WeakPolarHBondContact ND2-CG2 3.37Å; S495-V497 PolarHBondContact O-N 2.92Å; S495-V497 WeakPolarHBondContact OG-CG2 3.5Å; V497-A499 PolarHBondContact O-N 3.21Å; V497-D500 VanDerWaalsContact O-CB 3.23Å; V497-D500 WeakPolarHBondContact O-CB 3.5Å; V497-D500 PolarHBondContact O-N 3.24Å
498	S	85.5	Confident	92	Very high	33 Å²	33	63.1 Å²	63.1	23%	0.231	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-17.8	-175	60.6	0	0	0	0	115.6	I492 K493 S495	I492-S498 WeakPolarHBondContact O-CB 3.47Å; K493-S498 VanDerWaalsContact O-CB 3.23Å; K493-S498 WeakPolarHBondContact O-CB 3.08Å; K493-S498 PolarHBondContact O-OG 3Å; S495-S498 VanDerWaalsContact O-CB 3.31Å; S495-S498 WeakPolarHBondContact O-CB 3.48Å; S495-S498 PolarHBondContact O-N 3.22Å; S495-S498 PolarHBondContact O-OG 3.28Å; S495-S498 VanDerWaalsContact O-OG 3.11Å
499	A	85.4	Confident	92	Very high	64 Å²	64	65.8 Å²	65.8	53%	0.529	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-13	174.7	0	0	0	0	0	113.9	V497 K504	V497-A499 PolarHBondContact O-N 3.21Å; A499-K504 WeakPolarHBondContact O-CE 3.5Å; A499-K504 PolarHBondContact O-NZ 3.46Å
500	D	90.5	Very high	92	Very high	46 Å²	46	64.9 Å²	64.9	25%	0.246	34%	0.341	C	S	.	.	S	Bend	trans	-73.4	142	179.3	-176.7	-93.8	0	0	0	112	F451 V497 R502 C503 K504	F451-D500 HydrophobicContact CE2-CB 4.26Å; F451-D500 HydrophobicContact CZ-CB 4.25Å; V497-D500 VanDerWaalsContact O-CB 3.23Å; V497-D500 WeakPolarHBondContact O-CB 3.5Å; V497-D500 PolarHBondContact O-N 3.24Å; D500-R502 VanDerWaalsContact C-N 3.26Å; D500-R502 PolarHBondContact O-N 2.96Å; D500-R502 WeakPolarHBondContact OD1-CA 3.32Å; D500-R502 WeakPolarHBondContact OD1-CB 3.35Å; D500-R502 VanDerWaalsContact OD1-CG 3.24Å; D500-R502 WeakPolarHBondContact OD1-CG 3.39Å; D500-R502 PolarHBondContact OD1-N 3.35Å; D500-C503 WeakPolarHBondContact O-CB 3.21Å; D500-C503 PolarHBondContact O-N 3.13Å; D500-K504 PolarHBondContact O-N 3.14Å
501	D	93	Very high	92	Very high	108 Å²	108	66.1 Å²	66.1	58%	0.578	34%	0.341	S	S	*	.	H	α-helix	trans	-63.9	-29.6	-176.7	-62.9	-54.9	0	0	0	113.2	C503 K504 V505	D501-C503 VanDerWaalsContact C-N 3.32Å; D501-C503 PolarHBondContact O-N 3.46Å; D501-K504 PolarHBondContact O-N 3.01Å; D501-K504 WeakPolarHBondContact OD1-CD 3.4Å; D501-K504 WeakPolarHBondContact OD1-CE 3.39Å; D501-K504 IonicContact OD1-NZ 2.95Å; D501-K504 PolarHBondContact OD1-NZ 3.34Å; D501-V505 WeakPolarHBondContact O-CG2 3.45Å; D501-V505 PolarHBondContact O-N 2.98Å
502	R	90.6	Very high	92.1	Very high	167 Å²	167	67.6 Å²	67.6	63%	0.63	35%	0.349	S	S	*	.	H	α-helix	trans	-68.2	-34.9	174.7	-52.1	166.9	174.9	179.5	-0.1	110.8	M455 D500 L506	M455-R502 HydrophobicContact CE-CB 3.48Å; M455-R502 VanDerWaalsContact CE-CB 3.48Å; M455-R502 HydrophobicContact SD-CB 4.41Å; D500-R502 VanDerWaalsContact C-N 3.26Å; D500-R502 PolarHBondContact O-N 2.96Å; D500-R502 WeakPolarHBondContact OD1-CA 3.32Å; D500-R502 WeakPolarHBondContact OD1-CB 3.35Å; D500-R502 VanDerWaalsContact OD1-CG 3.24Å; D500-R502 WeakPolarHBondContact OD1-CG 3.39Å; D500-R502 PolarHBondContact OD1-N 3.35Å; R502-L506 WeakPolarHBondContact O-CG 3.48Å; R502-L506 PolarHBondContact O-N 3.12Å
503	C	93.3	Very high	92.1	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-71	-36.6	171.5	-89.4	0	0	0	0	112.6	M455 N458 I492 D500 D501 V505 L506 I507	M455-C503 PolarHBondContact SD-SG 3.22Å; N458-C503 PolarHBondContact ND2-SG 3.24Å; I492-C503 HydrophobicContact CG2-CB 4.44Å; D500-C503 WeakPolarHBondContact O-CB 3.21Å; D500-C503 PolarHBondContact O-N 3.13Å; D501-C503 VanDerWaalsContact C-N 3.32Å; D501-C503 PolarHBondContact O-N 3.46Å; C503-V505 VanDerWaalsContact C-N 3.34Å; C503-V505 PolarHBondContact O-N 3.24Å; C503-L506 PolarHBondContact O-N 3.3Å; C503-I507 WeakPolarHBondContact O-CG1 3.09Å; C503-I507 PolarHBondContact O-N 3.03Å
504	K	93.9	Very high	92.3	Very high	96 Å²	96	63.3 Å²	63.3	42%	0.417	33%	0.334	S	S	.	.	H	α-helix	trans	-59.3	-45.2	173.8	-64.1	171.9	-158	154.5	0	111.1	A499 D500 D501 L506 I507 S508	A499-K504 WeakPolarHBondContact O-CE 3.5Å; A499-K504 PolarHBondContact O-NZ 3.46Å; D500-K504 PolarHBondContact O-N 3.14Å; D501-K504 PolarHBondContact O-N 3.01Å; D501-K504 WeakPolarHBondContact OD1-CD 3.4Å; D501-K504 WeakPolarHBondContact OD1-CE 3.39Å; D501-K504 IonicContact OD1-NZ 2.95Å; D501-K504 PolarHBondContact OD1-NZ 3.34Å; K504-L506 PolarHBondContact O-N 3.37Å; K504-I507 PolarHBondContact O-N 2.81Å; K504-S508 PolarHBondContact O-N 2.75Å; K504-S508 PolarHBondContact O-OG 3.15Å
505	V	95.1	Very high	92.4	Very high	102 Å²	102	61.1 Å²	61.1	62%	0.618	32%	0.324	S	S	*	.	H	α-helix	trans	-59.4	-42.4	175.8	172.5	0	0	0	0	112.2	D501 C503 S508 S509	D501-V505 WeakPolarHBondContact O-CG2 3.45Å; D501-V505 PolarHBondContact O-N 2.98Å; C503-V505 VanDerWaalsContact C-N 3.34Å; C503-V505 PolarHBondContact O-N 3.24Å; V505-S508 PolarHBondContact O-N 3.32Å; V505-S509 PolarHBondContact O-N 2.76Å
506	L	94.4	Very high	92.5	Very high	33 Å²	33	62.2 Å²	62.2	17%	0.173	34%	0.338	C	S	.	.	H	α-helix	trans	-63.9	-41.5	175.2	-69.9	175.1	0	0	0	112.4	M455 N458 R502 C503 K504 S509 L510	M455-L506 HydrophobicContact CE-CD1 4.33Å; N458-L506 HydrophobicContact CB-CD1 4.26Å; R502-L506 WeakPolarHBondContact O-CG 3.48Å; R502-L506 PolarHBondContact O-N 3.12Å; C503-L506 PolarHBondContact O-N 3.3Å; K504-L506 PolarHBondContact O-N 3.37Å; L506-S509 PolarHBondContact O-N 3.18Å; L506-L510 WeakPolarHBondContact O-CG 3.48Å; L506-L510 PolarHBondContact O-N 2.84Å; L506-L510 VanDerWaalsContact O-N 3.07Å
507	I	94.9	Very high	92.7	Very high	19 Å²	19	56 Å²	56	10%	0.097	31%	0.311	C	S	.	.	H	α-helix	trans	-63.3	-45.5	176.1	-68.7	161.8	0	0	0	110.6	I489 I492 K493 C503 K504 S509 L510 Q511	I489-I507 HydrophobicContact CG2-CG2 4.24Å; I492-I507 HydrophobicContact CB-CG1 4.39Å; I492-I507 HydrophobicContact CG2-CD1 4.02Å; I492-I507 HydrophobicContact CG2-CG1 3.81Å; K493-I507 HydrophobicContact CG-CD1 3.68Å; K493-I507 HydrophobicContact CG-CG1 4.39Å; C503-I507 WeakPolarHBondContact O-CG1 3.09Å; C503-I507 PolarHBondContact O-N 3.03Å; K504-I507 PolarHBondContact O-N 2.81Å; I507-S509 PolarHBondContact O-N 3.01Å; I507-L510 PolarHBondContact O-N 3.22Å; I507-Q511 HydrophobicContact CG2-CG 4.34Å; I507-Q511 VanDerWaalsContact O-CG 3.32Å; I507-Q511 WeakPolarHBondContact O-CG 3.4Å; I507-Q511 PolarHBondContact O-N 3.15Å
508	S	96.1	Very high	92.8	Very high	57 Å²	57	58.2 Å²	58.2	40%	0.399	32%	0.321	S	S	.	.	H	α-helix	trans	-59.5	-44.6	175.6	-62.2	0	0	0	0	111.8	K504 V505 L510 Q511 D512	K504-S508 PolarHBondContact O-N 2.75Å; K504-S508 PolarHBondContact O-OG 3.15Å; V505-S508 PolarHBondContact O-N 3.32Å; S508-L510 VanDerWaalsContact C-N 3.3Å; S508-L510 PolarHBondContact O-N 3.1Å; S508-Q511 PolarHBondContact O-N 3.32Å; S508-Q511 VanDerWaalsContact O-N 3.12Å; S508-D512 PolarHBondContact O-N 3.47Å
509	S	95.3	Very high	92.8	Very high	59 Å²	59	60.5 Å²	60.5	41%	0.413	34%	0.337	S	S	.	.	H	α-helix	trans	-61.1	-35.9	176.8	-178.7	0	0	0	0	113.3	V505 L506 I507 C513	V505-S509 PolarHBondContact O-N 2.76Å; L506-S509 PolarHBondContact O-N 3.18Å; I507-S509 PolarHBondContact O-N 3.01Å; S509-C513 WeakPolarHBondContact O-CB 3.41Å; S509-C513 PolarHBondContact O-N 2.99Å
510	L	95.9	Very high	92.7	Very high	0 Å²	0	64 Å²	64	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-70.8	-39.5	173.6	-74.8	164.3	0	0	0	112	A465 I466 L485 A488 I489 I492 L506 I507 S508 C513 L514	A465-L510 HydrophobicContact CB-CD2 4.11Å; I466-L510 HydrophobicContact CD1-CD2 4.17Å; I466-L510 HydrophobicContact CG1-CD2 3.72Å; L485-L510 HydrophobicContact CD2-CD2 3.65Å; A488-L510 HydrophobicContact CB-CD1 4.26Å; A488-L510 HydrophobicContact CB-CD2 4.32Å; I489-L510 HydrophobicContact CD1-CB 3.93Å; I489-L510 HydrophobicContact CG1-CB 3.56Å; I489-L510 HydrophobicContact CG1-CD1 4.01Å; I489-L510 HydrophobicContact CG1-CG 4.38Å; I492-L510 HydrophobicContact CD1-CD1 3.5Å; L506-L510 WeakPolarHBondContact O-CG 3.48Å; L506-L510 PolarHBondContact O-N 2.84Å; L506-L510 VanDerWaalsContact O-N 3.07Å; I507-L510 PolarHBondContact O-N 3.22Å; S508-L510 VanDerWaalsContact C-N 3.3Å; S508-L510 PolarHBondContact O-N 3.1Å; L510-C513 PolarHBondContact O-N 3.47Å; L510-L514 VanDerWaalsContact O-CB 3.29Å; L510-L514 WeakPolarHBondContact O-CB 3.42Å; L510-L514 PolarHBondContact O-N 3.16Å
511	Q	94.7	Very high	92.2	Very high	75 Å²	75	63.4 Å²	63.4	35%	0.35	34%	0.34	S	S	.	.	H	α-helix	trans	-65.5	-41.8	176.6	-72.7	175.4	-45.5	0	0	112.1	I489 I507 S508 C513 L514 H515	I489-Q511 HydrophobicContact CD1-CG 3.85Å; I507-Q511 HydrophobicContact CG2-CG 4.34Å; I507-Q511 VanDerWaalsContact O-CG 3.32Å; I507-Q511 WeakPolarHBondContact O-CG 3.4Å; I507-Q511 PolarHBondContact O-N 3.15Å; S508-Q511 PolarHBondContact O-N 3.32Å; S508-Q511 VanDerWaalsContact O-N 3.12Å; Q511-C513 PolarHBondContact O-N 3.18Å; Q511-L514 WeakPolarHBondContact O-CB 3.45Å; Q511-L514 PolarHBondContact O-N 3.06Å; Q511-H515 VanDerWaalsContact O-CG 3.25Å; Q511-H515 PolarHBondContact O-N 3.21Å; Q511-H515 PolarHBondContact O-ND1 3.29Å; Q511-H515 VanDerWaalsContact O-ND1 3.13Å
512	D	95.5	Very high	91.1	Very high	114 Å²	114	66.3 Å²	66.3	61%	0.61	34%	0.344	S	S	*	.	H	α-helix	trans	-64.6	-40.2	176.6	-69.8	-28.5	0	0	0	111.8	S508 G516	S508-D512 PolarHBondContact O-N 3.47Å; D512-G516 PolarHBondContact O-N 3.42Å
513	C	93.7	Very high	89.8	Confident	25 Å²	25	60.1 Å²	60.1	17%	0.169	33%	0.332	C	S	.	.	H	α-helix	trans	-61.7	-44.5	172.7	-171.4	0	0	0	0	111.4	I466 L485 S509 L510 Q511 G516 I517	I466-C513 HydrophobicContact CG1-CB 4.4Å; L485-C513 HydrophobicContact CD1-CB 4.31Å; S509-C513 WeakPolarHBondContact O-CB 3.41Å; S509-C513 PolarHBondContact O-N 2.99Å; L510-C513 PolarHBondContact O-N 3.47Å; Q511-C513 PolarHBondContact O-N 3.18Å; C513-G516 PolarHBondContact O-N 3.04Å; C513-I517 WeakPolarHBondContact O-CG1 3.4Å; C513-I517 PolarHBondContact O-N 3.16Å
514	L	94.6	Very high	88.1	Confident	15 Å²	15	62.6 Å²	62.6	8%	0.079	35%	0.35	C	S	.	.	H	α-helix	trans	-62	-52.5	178.5	-179.9	155.4	0	0	0	111.4	L485 V486 I489 L510 Q511 G516 I517 E518	L485-L514 HydrophobicContact CB-CB 4.23Å; L485-L514 HydrophobicContact CB-CD1 4.04Å; L485-L514 HydrophobicContact CD1-CB 3.9Å; V486-L514 HydrophobicContact CG2-CD1 3.53Å; I489-L514 HydrophobicContact CD1-CD1 4.1Å; L510-L514 VanDerWaalsContact O-CB 3.29Å; L510-L514 WeakPolarHBondContact O-CB 3.42Å; L510-L514 PolarHBondContact O-N 3.16Å; Q511-L514 WeakPolarHBondContact O-CB 3.45Å; Q511-L514 PolarHBondContact O-N 3.06Å; L514-G516 VanDerWaalsContact C-N 3.27Å; L514-G516 PolarHBondContact O-N 3.21Å; L514-I517 PolarHBondContact O-N 3.38Å; L514-E518 HydrophobicContact CD2-CG 4Å; L514-E518 WeakPolarHBondContact CD2-OE1 3.32Å; L514-E518 WeakPolarHBondContact CD2-OE2 3.32Å; L514-E518 HydrophobicContact CG-CG 4.49Å; L514-E518 WeakPolarHBondContact O-CG 3.32Å; L514-E518 PolarHBondContact O-N 3.08Å
515	H	93.8	Very high	86.3	Confident	104 Å²	104	60.1 Å²	60.1	48%	0.481	35%	0.351	S	S	.	.	H	α-helix	trans	-60.9	-36.1	177.7	-61.6	141.9	0	0	0	112.2	Q511 I517 E518 S519	Q511-H515 VanDerWaalsContact O-CG 3.25Å; Q511-H515 PolarHBondContact O-N 3.21Å; Q511-H515 PolarHBondContact O-ND1 3.29Å; Q511-H515 VanDerWaalsContact O-ND1 3.13Å; H515-I517 VanDerWaalsContact C-N 3.3Å; H515-I517 PolarHBondContact O-N 3.43Å; H515-E518 IonicContact CD2-OE2 2.67Å; H515-S519 WeakPolarHBondContact O-CB 3.33Å; H515-S519 PolarHBondContact O-N 2.83Å; H515-S519 PolarHBondContact O-OG 3.35Å
516	G	92.2	Very high	84.2	Confident	40 Å²	40	57.8 Å²	57.8	41%	0.412	34%	0.339	S	S	.	.	H	α-helix	trans	-65.7	-30	174.5	0	0	0	0	0	113.7	D512 C513 L514 S519 K520	D512-G516 PolarHBondContact O-N 3.42Å; C513-G516 PolarHBondContact O-N 3.04Å; L514-G516 VanDerWaalsContact C-N 3.27Å; L514-G516 PolarHBondContact O-N 3.21Å; G516-S519 PolarHBondContact O-OG 3.23Å; G516-K520 WeakPolarHBondContact O-CB 3.34Å
517	I	90.7	Very high	82.1	Confident	13 Å²	13	65.9 Å²	65.9	7%	0.067	37%	0.368	C	S	.	.	H	α-helix	trans	-85.2	-42.7	176.8	-72.9	172.7	0	0	0	111.1	A469 A473 Y478 A481 I482 L485 C513 L514 H515 K520 S521	A469-I517 HydrophobicContact CB-CD1 4.04Å; A473-I517 HydrophobicContact CB-CD1 4.06Å; A473-I517 HydrophobicContact CB-CG1 4.11Å; A473-I517 HydrophobicContact CB-CG2 4.18Å; Y478-I517 HydrophobicContact CD1-CG2 4.03Å; A481-I517 HydrophobicContact CB-CG2 4.16Å; I482-I517 HydrophobicContact CG1-CG2 4.02Å; L485-I517 HydrophobicContact CD1-CD1 3.96Å; C513-I517 WeakPolarHBondContact O-CG1 3.4Å; C513-I517 PolarHBondContact O-N 3.16Å; L514-I517 PolarHBondContact O-N 3.38Å; H515-I517 VanDerWaalsContact C-N 3.3Å; H515-I517 PolarHBondContact O-N 3.43Å; I517-K520 WeakPolarHBondContact O-CB 3.03Å; I517-K520 PolarHBondContact O-N 3.46Å; I517-S521 WeakPolarHBondContact O-CB 3.2Å; I517-S521 PolarHBondContact O-N 2.99Å
518	E	89.1	Confident	80.1	Confident	53 Å²	53	74 Å²	74	25%	0.248	40%	0.397	C	S	.	.	H	α-helix	trans	-58.2	-52.7	175.4	-76.2	-175.6	150.4	0	0	112.1	I482 L514 H515 K520 S521 Y522	I482-E518 HydrophobicContact CD1-CG 3.84Å; I482-E518 HydrophobicContact CG1-CG 4.09Å; L514-E518 HydrophobicContact CD2-CG 4Å; L514-E518 WeakPolarHBondContact CD2-OE1 3.32Å; L514-E518 WeakPolarHBondContact CD2-OE2 3.32Å; L514-E518 HydrophobicContact CG-CG 4.49Å; L514-E518 WeakPolarHBondContact O-CG 3.32Å; L514-E518 PolarHBondContact O-N 3.08Å; H515-E518 IonicContact CD2-OE2 2.67Å; E518-K520 PolarHBondContact O-N 3.02Å; E518-K520 VanDerWaalsContact O-N 3.15Å; E518-S521 WeakPolarHBondContact O-CB 3.03Å; E518-S521 PolarHBondContact O-N 3.47Å; E518-S521 VanDerWaalsContact O-N 3.08Å; E518-Y522 HydrophobicContact CB-CD2 4.39Å; E518-Y522 HydrophobicContact CB-CE2 4.05Å; E518-Y522 WeakPolarHBondContact O-CD2 3.31Å; E518-Y522 PolarHBondContact O-N 3.48Å
519	S	85.8	Confident	77.7	Confident	81 Å²	81	78.4 Å²	78.4	57%	0.566	41%	0.411	S	S	*	.	H	α-helix	trans	-57.1	-32.7	178.3	55.9	0	0	0	0	112.7	H515 G516 G523	H515-S519 WeakPolarHBondContact O-CB 3.33Å; H515-S519 PolarHBondContact O-N 2.83Å; H515-S519 PolarHBondContact O-OG 3.35Å; G516-S519 PolarHBondContact O-OG 3.23Å; S519-G523 PolarHBondContact O-N 3.05Å
520	K	83.8	Confident	75.3	Confident	137 Å²	137	83.4 Å²	83.4	60%	0.596	42%	0.421	S	S	*	.	H	α-helix	trans	-77.3	-39.6	176.9	-149.8	173	-172.7	-177	0	112.4	G516 I517 E518 G523 S524	G516-K520 WeakPolarHBondContact O-CB 3.34Å; I517-K520 WeakPolarHBondContact O-CB 3.03Å; I517-K520 PolarHBondContact O-N 3.46Å; E518-K520 PolarHBondContact O-N 3.02Å; E518-K520 VanDerWaalsContact O-N 3.15Å; K520-G523 PolarHBondContact O-N 3.13Å; K520-S524 WeakPolarHBondContact O-CB 3.44Å; K520-S524 PolarHBondContact O-N 2.95Å
521	S	79.9	Confident	73	Confident	33 Å²	33	86.9 Å²	86.9	23%	0.231	45%	0.446	C	S	.	.	H	α-helix	trans	-57	-55.9	174	-175.4	0	0	0	0	111.1	Y478 I517 E518 G523 S524	Y478-S521 WeakPolarHBondContact CB-OG 3.39Å; I517-S521 WeakPolarHBondContact O-CB 3.2Å; I517-S521 PolarHBondContact O-N 2.99Å; E518-S521 WeakPolarHBondContact O-CB 3.03Å; E518-S521 PolarHBondContact O-N 3.47Å; E518-S521 VanDerWaalsContact O-N 3.08Å; S521-G523 VanDerWaalsContact C-N 3.34Å; S521-G523 PolarHBondContact O-N 3.06Å; S521-S524 PolarHBondContact O-N 2.91Å
522	Y	69.1	Low	70.7	Confident	169 Å²	169	92.5 Å²	92.5	66%	0.663	46%	0.464	S	S	*	.	H	α-helix	trans	-66.6	-32.3	-180	-61	-60.5	0	0	0	113.2	E518	E518-Y522 HydrophobicContact CB-CD2 4.39Å; E518-Y522 HydrophobicContact CB-CE2 4.05Å; E518-Y522 WeakPolarHBondContact O-CD2 3.31Å; E518-Y522 PolarHBondContact O-N 3.48Å
523	G	63.6	Low	68.2	Low	38 Å²	38	93.8 Å²	93.8	39%	0.392	47%	0.466	S	S	.	.	H	α-helix	trans	-72.6	-27.9	176.7	0	0	0	0	0	114.9	S519 K520 S521	S519-G523 PolarHBondContact O-N 3.05Å; K520-G523 PolarHBondContact O-N 3.13Å; S521-G523 VanDerWaalsContact C-N 3.34Å; S521-G523 PolarHBondContact O-N 3.06Å
524	S	58.9	Low	65.9	Low	52 Å²	52	100 Å²	100	36%	0.364	49%	0.486	S	S	.	.	H	α-helix	trans	-77	-44.7	-174.4	-170	0	0	0	0	112.9	K520 S521 S526	K520-S524 WeakPolarHBondContact O-CB 3.44Å; K520-S524 PolarHBondContact O-N 2.95Å; S521-S524 PolarHBondContact O-N 2.91Å; S524-S526 PolarHBondContact O-N 3.26Å
525	G	55.9	Low	63.4	Low	44 Å²	44	104.1 Å²	104.1	45%	0.454	51%	0.508	S	S	.	.	H	α-helix	trans	-60	-47.3	-178.3	0	0	0	0	0	113.1	R527 R528	G525-R527 VanDerWaalsContact C-N 3.3Å; G525-R527 PolarHBondContact O-N 3.39Å; G525-R528 PolarHBondContact O-N 3.35Å
526	S	50.9	Low	61.2	Low	52 Å²	52	106.8 Å²	106.8	36%	0.364	52%	0.52	S	S	.	.	H	α-helix	trans	-66.9	-25.6	-172.9	-164.1	0	0	0	0	114.5	S524 R530	S524-S526 PolarHBondContact O-N 3.26Å; S526-R530 WeakPolarHBondContact O-CB 3.25Å; S526-R530 WeakPolarHBondContact O-CD 3.45Å; S526-R530 WeakPolarHBondContact O-CG 3.41Å; S526-R530 PolarHBondContact OG-NH1 2.93Å
527	R	50.9	Low	59	Low	203 Å²	203	108.6 Å²	108.6	77%	0.766	53%	0.527	S	S	*	.	H	α-helix	trans	-83.1	-31	-179.8	-70.1	-175	179.7	-174.8	1.3	113.1	G525 S531	G525-R527 VanDerWaalsContact C-N 3.3Å; G525-R527 PolarHBondContact O-N 3.39Å; R527-S531 PolarHBondContact O-OG 2.87Å; R527-S531 VanDerWaalsContact O-OG 3.13Å
528	R	51.8	Low	57.1	Low	189 Å²	189	115.1 Å²	115.1	71%	0.713	55%	0.551	S	S	*	*	H	α-helix	trans	-81.9	-25.6	-171.7	-143.7	166.3	-170.2	167.9	0.5	113.7	G525	G525-R528 PolarHBondContact O-N 3.35Å
529	E	45.9	Very low	55.1	Low	150 Å²	150	116.6 Å²	116.6	70%	0.701	57%	0.566	S	S	*	*	H	α-helix	trans	-84.9	-47.8	172.9	-66.4	-170.5	142.2	0	0	112.6	S531 R532	E529-S531 PolarHBondContact O-N 3.2Å; E529-R532 PolarHBondContact O-N 3.05Å
530	R	45	Very low	53.5	Low	164 Å²	164	121.4 Å²	121.4	62%	0.619	57%	0.572	S	S	*	*	H	α-helix	trans	-58.6	-24.5	-178.7	-78.2	178.9	169.8	157	-7.2	114.5	S526 R534	S526-R530 WeakPolarHBondContact O-CB 3.25Å; S526-R530 WeakPolarHBondContact O-CD 3.45Å; S526-R530 WeakPolarHBondContact O-CG 3.41Å; S526-R530 PolarHBondContact OG-NH1 2.93Å; R530-R534 VanDerWaalsContact O-CB 3.25Å; R530-R534 WeakPolarHBondContact O-CB 3.43Å; R530-R534 PolarHBondContact O-N 3.19Å
531	S	46.8	Very low	51.8	Low	74 Å²	74	121.5 Å²	121.5	52%	0.517	58%	0.575	S	S	.	*	H	α-helix	trans	-69.1	-30.9	174.4	-66	0	0	0	0	113.2	R527 E529	R527-S531 PolarHBondContact O-OG 2.87Å; R527-S531 VanDerWaalsContact O-OG 3.13Å; E529-S531 PolarHBondContact O-N 3.2Å
532	R	48	Very low	50.1	Low	192 Å²	192	127 Å²	127	73%	0.725	59%	0.594	S	S	*	*	H	α-helix	trans	-82.2	-32.6	-176.7	-67.9	-179	175.1	138.1	-6.6	113.2	E529	E529-R532 PolarHBondContact O-N 3.05Å
533	E	41.7	Very low	49.1	Very low	141 Å²	141	122.8 Å²	122.8	66%	0.659	59%	0.59	S	S	*	*	H	α-helix	trans	-77.4	-32.4	175.8	-63.9	-170.7	135.4	0	0	113.4	D535 H536 S537	E533-D535 VanDerWaalsContact C-N 3.33Å; E533-D535 PolarHBondContact O-N 3.48Å; E533-H536 PolarHBondContact O-N 3.14Å; E533-S537 PolarHBondContact O-N 3.46Å; E533-S537 PolarHBondContact O-OG 3.45Å; E533-S537 VanDerWaalsContact O-OG 3.14Å
534	R	45.5	Very low	48.5	Very low	156 Å²	156	129 Å²	129	59%	0.589	60%	0.602	S	S	*	*	H	α-helix	trans	-68.4	-29.6	-173.2	-176.6	168.3	-82.5	-163.3	-7.2	113.2	R530 R538	R530-R534 VanDerWaalsContact O-CB 3.25Å; R530-R534 WeakPolarHBondContact O-CB 3.43Å; R530-R534 PolarHBondContact O-N 3.19Å; R534-R538 WeakPolarHBondContact O-CD 3.42Å; R534-R538 WeakPolarHBondContact O-CG 3.34Å; R534-R538 PolarHBondContact O-N 3.32Å
535	D	43.2	Very low	47.9	Very low	102 Å²	102	134.7 Å²	134.7	55%	0.545	62%	0.615	S	S	.	*	H	α-helix	trans	-83.1	-31.8	178.5	-67.9	-31	0	0	0	113.2	E533 S537 R538	E533-D535 VanDerWaalsContact C-N 3.33Å; E533-D535 PolarHBondContact O-N 3.48Å; D535-S537 VanDerWaalsContact C-N 3.32Å; D535-S537 PolarHBondContact O-N 3.25Å; D535-R538 IonicContact OD1-NH1 2.69Å; D535-R538 PolarHBondContact OD1-NH1 3.36Å
536	H	45.8	Very low	47.6	Very low	160 Å²	160	138.4 Å²	138.4	74%	0.741	62%	0.62	S	S	*	*	H	α-helix	trans	-66.5	-34.2	172.6	-112	79	0	0	0	112.6	E533 S539	E533-H536 PolarHBondContact O-N 3.14Å; H536-S539 PolarHBondContact O-OG 3.37Å
537	S	46.5	Very low	47.4	Very low	78 Å²	78	144.1 Å²	144.1	55%	0.545	64%	0.639	S	S	.	*	H	α-helix	trans	-71.3	-37.6	178.7	-62.1	0	0	0	0	113.2	E533 D535 S539 R540 E541	E533-S537 PolarHBondContact O-N 3.46Å; E533-S537 PolarHBondContact O-OG 3.45Å; E533-S537 VanDerWaalsContact O-OG 3.14Å; D535-S537 VanDerWaalsContact C-N 3.32Å; D535-S537 PolarHBondContact O-N 3.25Å; S537-S539 PolarHBondContact O-N 3.33Å; S537-R540 PolarHBondContact O-N 3.09Å; S537-E541 PolarHBondContact O-N 3.46Å
538	R	50.2	Low	47.1	Very low	150 Å²	150	138 Å²	138	57%	0.566	63%	0.627	S	S	*	*	H	α-helix	trans	-66.4	-29.4	-175.5	-79.2	167.9	169.1	164.9	-10.4	114.6	R534 D535	R534-R538 WeakPolarHBondContact O-CD 3.42Å; R534-R538 WeakPolarHBondContact O-CG 3.34Å; R534-R538 PolarHBondContact O-N 3.32Å; D535-R538 IonicContact OD1-NH1 2.69Å; D535-R538 PolarHBondContact OD1-NH1 3.36Å
539	S	47.9	Very low	47	Very low	83 Å²	83	136.5 Å²	136.5	58%	0.58	62%	0.621	S	S	*	*	H	α-helix	trans	-70.8	-35.7	179.3	72.8	0	0	0	0	112.6	H536 S537	H536-S539 PolarHBondContact O-OG 3.37Å; S537-S539 PolarHBondContact O-N 3.33Å
540	R	52.5	Low	47	Very low	182 Å²	182	133.6 Å²	133.6	69%	0.687	62%	0.618	S	S	*	*	H	α-helix	trans	-80.5	-30.6	-174.2	-139.3	171.5	-168.6	173.9	3.1	113.1	S537	S537-R540 PolarHBondContact O-N 3.09Å
541	E	48.1	Very low	47.3	Very low	139 Å²	139	135.4 Å²	135.4	65%	0.65	62%	0.624	S	S	*	*	H	α-helix	trans	-67.1	-45.1	173.8	-156.2	74.7	-116.3	0	0	111.5	S537 S543 R544 R545	S537-E541 PolarHBondContact O-N 3.46Å; E541-S543 PolarHBondContact O-N 3.4Å; E541-R544 PolarHBondContact O-N 3.46Å; E541-R545 PolarHBondContact O-N 3.36Å
542	K	44.3	Very low	47.5	Very low	148 Å²	148	136.8 Å²	136.8	64%	0.643	63%	0.626	S	S	*	*	H	α-helix	trans	-63.3	-40.9	-173.8	-160.4	170.4	-175.8	178.4	0	112	R544 H546	K542-R544 PolarHBondContact O-N 3.4Å; K542-H546 PolarHBondContact O-CD2 3.19Å
543	S	47.9	Very low	47.7	Very low	81 Å²	81	137.9 Å²	137.9	57%	0.566	63%	0.63	S	S	*	*	H	α-helix	trans	-68.5	-33.6	-178.4	79	0	0	0	0	113.6	E541	E541-S543 PolarHBondContact O-N 3.4Å
544	R	49.8	Very low	48.2	Very low	169 Å²	169	136.4 Å²	136.4	64%	0.638	62%	0.623	S	S	*	*	H	α-helix	trans	-69.4	-42.1	179.5	-70.4	177.8	172.6	176.6	-3.5	112	E541 K542 H546 K547	E541-R544 PolarHBondContact O-N 3.46Å; K542-R544 PolarHBondContact O-N 3.4Å; R544-H546 VanDerWaalsContact C-N 3.29Å; R544-H546 PolarHBondContact O-N 3.5Å; R544-K547 PolarHBondContact O-N 3.31Å
545	R	47.9	Very low	48.7	Very low	171 Å²	171	134.5 Å²	134.5	65%	0.645	63%	0.625	S	S	*	*	H	α-helix	trans	-69.3	-21.7	-176.1	-151.2	173.7	-169.6	-166.9	4.2	114.2	E541	E541-R545 PolarHBondContact O-N 3.36Å
546	H	49.1	Very low	49.3	Very low	122 Å²	122	134 Å²	134	57%	0.565	62%	0.622	S	S	*	*	H	α-helix	trans	-81.5	-22.4	174.3	-71.2	-67.5	0	0	0	113.8	K542 R544	K542-H546 PolarHBondContact O-CD2 3.19Å; R544-H546 VanDerWaalsContact C-N 3.29Å; R544-H546 PolarHBondContact O-N 3.5Å
547	K	47.5	Very low	50	Low	173 Å²	173	134 Å²	134	75%	0.752	62%	0.617	S	S	*	*	H	α-helix	trans	-75	-37.1	-179.6	-160	76.7	175.8	-175.7	0	112.4	R544	R544-K547 PolarHBondContact O-N 3.31Å
548	S	43.8	Very low	50.8	Low	75 Å²	75	136.8 Å²	136.8	52%	0.524	62%	0.616	S	S	.	*	H	α-helix	trans	-67.9	-52.9	-178.7	-45.5	0	0	0	0	112.2	S550 R551 D552	S548-S550 PolarHBondContact O-N 2.85Å; S548-R551 WeakPolarHBondContact O-CB 3.45Å; S548-R551 PolarHBondContact O-N 2.98Å; S548-D552 VanDerWaalsContact O-OD2 3.09Å
549	R	48.8	Very low	51.4	Low	156 Å²	156	136.6 Å²	136.6	59%	0.589	62%	0.615	S	S	*	*	H	α-helix	trans	-59.4	-18.9	-178	-74.7	177.9	168.9	154.4	-6.9	115.1
550	S	47.4	Very low	51.9	Low	89 Å²	89	138.8 Å²	138.8	62%	0.622	62%	0.616	S	S	*	*	H	α-helix	trans	-84	-13.8	175.2	-168.7	0	0	0	0	113.6	S548	S548-S550 PolarHBondContact O-N 2.85Å
551	R	50	Low	52.4	Low	202 Å²	202	137.8 Å²	137.8	76%	0.762	61%	0.613	S	S	*	*	H	α-helix	trans	-86	-46.9	174.4	-111	179.5	176.9	176.9	-2.7	111.2	S548 R553 H554 D555	S548-R551 WeakPolarHBondContact O-CB 3.45Å; S548-R551 PolarHBondContact O-N 2.98Å; R551-R553 VanDerWaalsContact C-N 3.34Å; R551-R553 PolarHBondContact O-N 3.34Å; R551-H554 WeakPolarHBondContact O-CB 3.44Å; R551-H554 PolarHBondContact O-N 3.38Å; R551-D555 PolarHBondContact O-N 2.82Å
552	D	50.6	Low	53.1	Low	103 Å²	103	134.7 Å²	134.7	55%	0.551	61%	0.606	S	S	*	*	H	α-helix	trans	-58.4	-44.2	-177.7	-53.5	-64.4	0	0	0	112	S548 H554 D555 D556	S548-D552 VanDerWaalsContact O-OD2 3.09Å; D552-H554 PolarHBondContact O-N 3.27Å; D552-H554 VanDerWaalsContact O-N 3.15Å; D552-D555 PolarHBondContact O-N 2.99Å; D552-D556 PolarHBondContact O-N 3.15Å
553	R	52.1	Low	54.1	Low	215 Å²	215	133.2 Å²	133.2	81%	0.811	60%	0.597	S	S	*	*	H	α-helix	trans	-61.5	-21.2	175.5	-85.5	-170.3	176.2	-173.7	-1	115.1	R551	R551-R553 VanDerWaalsContact C-N 3.34Å; R551-R553 PolarHBondContact O-N 3.34Å
554	H	52.8	Low	54.8	Low	111 Å²	111	135.1 Å²	135.1	51%	0.514	60%	0.596	S	S	.	*	H	α-helix	trans	-86	-32.7	-179.2	-172.8	-93.4	0	0	0	111.7	R551 D552 Y558	R551-H554 WeakPolarHBondContact O-CB 3.44Å; R551-H554 PolarHBondContact O-N 3.38Å; D552-H554 PolarHBondContact O-N 3.27Å; D552-H554 VanDerWaalsContact O-N 3.15Å; H554-Y558 AromaticContact CE1-CD2 3.66Å; H554-Y558 AromaticContact CE1-CE2 3.33Å; H554-Y558 WeakPolarHBondContact CE1-CE2 3.33Å; H554-Y558 AromaticContact NE2-CE2 3.63Å; H554-Y558 PolarHBondContact O-N 2.91Å
555	D	56.5	Low	55.7	Low	116 Å²	116	135.9 Å²	135.9	62%	0.62	60%	0.599	S	S	*	*	H	α-helix	trans	-67.2	-44.3	175.6	-115.5	-84.9	0	0	0	111.4	R551 D552 Y557 Y558 R559	R551-D555 PolarHBondContact O-N 2.82Å; D552-D555 PolarHBondContact O-N 2.99Å; D555-Y557 VanDerWaalsContact C-N 3.31Å; D555-Y557 PolarHBondContact O-N 3.33Å; D555-Y558 PolarHBondContact O-N 3.38Å; D555-R559 WeakPolarHBondContact O-CB 3.5Å; D555-R559 PolarHBondContact O-N 3.17Å
556	D	55.9	Low	56.5	Low	91 Å²	91	133.5 Å²	133.5	49%	0.487	60%	0.596	S	S	.	*	H	α-helix	trans	-58.6	-40.9	176.7	-78.6	-41.4	0	0	0	112.3	D552 Y558 R559 E560	D552-D556 PolarHBondContact O-N 3.15Å; D556-Y558 PolarHBondContact O-N 3.42Å; D556-R559 WeakPolarHBondContact O-CB 3.37Å; D556-R559 PolarHBondContact O-N 3.18Å; D556-E560 WeakPolarHBondContact O-CB 3.36Å; D556-E560 PolarHBondContact O-N 3.35Å
557	Y	61.3	Low	57.4	Low	161 Å²	161	136.1 Å²	136.1	63%	0.631	60%	0.6	S	S	*	*	H	α-helix	trans	-64.3	-37.6	177.9	-168.2	-102.3	0	0	0	113	D555 R561	D555-Y557 VanDerWaalsContact C-N 3.31Å; D555-Y557 PolarHBondContact O-N 3.33Å; Y557-R561 WeakPolarHBondContact O-CB 3.33Å; Y557-R561 PolarHBondContact O-N 2.94Å
558	Y	61.4	Low	58.7	Low	135 Å²	135	132.3 Å²	132.3	53%	0.529	59%	0.585	S	S	.	*	H	α-helix	trans	-71.6	-33.3	173.7	-93.8	-96.4	0	0	0	112.7	H554 D555 D556 S562	H554-Y558 AromaticContact CE1-CD2 3.66Å; H554-Y558 AromaticContact CE1-CE2 3.33Å; H554-Y558 WeakPolarHBondContact CE1-CE2 3.33Å; H554-Y558 AromaticContact NE2-CE2 3.63Å; H554-Y558 PolarHBondContact O-N 2.91Å; D555-Y558 PolarHBondContact O-N 3.38Å; D556-Y558 PolarHBondContact O-N 3.42Å; Y558-S562 WeakPolarHBondContact O-CB 3.38Å; Y558-S562 PolarHBondContact O-N 3Å; Y558-S562 PolarHBondContact O-OG 3.21Å
559	R	62.7	Low	60	Low	146 Å²	146	136.8 Å²	136.8	55%	0.551	59%	0.591	S	S	*	*	H	α-helix	trans	-71.7	-42.7	178.4	-158.2	175.7	-150.4	171.3	8.2	112.1	D555 D556 S562 R563	D555-R559 WeakPolarHBondContact O-CB 3.5Å; D555-R559 PolarHBondContact O-N 3.17Å; D556-R559 WeakPolarHBondContact O-CB 3.37Å; D556-R559 PolarHBondContact O-N 3.18Å; R559-S562 PolarHBondContact O-N 3.17Å; R559-R563 WeakPolarHBondContact O-CG 3.48Å; R559-R563 PolarHBondContact O-N 3.34Å
560	E	59.7	Low	61	Low	129 Å²	129	132.7 Å²	132.7	60%	0.603	58%	0.58	S	S	*	*	H	α-helix	trans	-60.1	-49.3	173.9	-156.4	100.1	-101.1	0	0	110.4	D556 S562 R563 E564	D556-E560 WeakPolarHBondContact O-CB 3.36Å; D556-E560 PolarHBondContact O-N 3.35Å; E560-S562 VanDerWaalsContact C-N 3.31Å; E560-S562 PolarHBondContact O-N 3.05Å; E560-R563 PolarHBondContact O-N 3.38Å; E560-R563 VanDerWaalsContact O-N 3.17Å; E560-E564 PolarHBondContact O-N 2.89Å
561	R	63.7	Low	62.2	Low	162 Å²	162	136.1 Å²	136.1	61%	0.611	58%	0.58	S	S	*	*	H	α-helix	trans	-64.1	-32.6	178.8	-164.2	176.5	-170.2	-174.7	4	113.3	Y557 R565	Y557-R561 WeakPolarHBondContact O-CB 3.33Å; Y557-R561 PolarHBondContact O-N 2.94Å; R561-R565 WeakPolarHBondContact O-CB 3.35Å; R561-R565 PolarHBondContact O-N 3.04Å; R561-R565 VanDerWaalsContact O-N 3.15Å
562	S	61.2	Low	63.4	Low	73 Å²	73	129.8 Å²	129.8	51%	0.51	56%	0.561	S	S	.	*	H	α-helix	trans	-68	-46.1	172.6	-64.7	0	0	0	0	111.7	Y558 R559 E560 E564 R565 E566	Y558-S562 WeakPolarHBondContact O-CB 3.38Å; Y558-S562 PolarHBondContact O-N 3Å; Y558-S562 PolarHBondContact O-OG 3.21Å; R559-S562 PolarHBondContact O-N 3.17Å; E560-S562 VanDerWaalsContact C-N 3.31Å; E560-S562 PolarHBondContact O-N 3.05Å; S562-E564 VanDerWaalsContact C-N 3.33Å; S562-E564 PolarHBondContact O-N 3Å; S562-R565 PolarHBondContact O-N 3.01Å; S562-E566 PolarHBondContact O-N 3.46Å
563	R	65.4	Low	64.6	Low	118 Å²	118	131.3 Å²	131.3	45%	0.445	56%	0.559	S	S	.	*	H	α-helix	trans	-62.1	-38.4	176.5	-71.2	166.5	175	157.2	-3.4	112.6	R559 E560 E566 R567	R559-R563 WeakPolarHBondContact O-CG 3.48Å; R559-R563 PolarHBondContact O-N 3.34Å; E560-R563 PolarHBondContact O-N 3.38Å; E560-R563 VanDerWaalsContact O-N 3.17Å; R563-E566 PolarHBondContact O-N 3.45Å; R563-R567 WeakPolarHBondContact O-CG 3.49Å; R563-R567 PolarHBondContact O-N 3.44Å
564	E	63	Low	65.7	Low	120 Å²	120	125.1 Å²	125.1	56%	0.561	54%	0.542	S	S	*	.	H	α-helix	trans	-64.8	-40.9	175.2	-173.4	174.1	-137.2	0	0	111.8	E560 S562 E566 R567 H568	E560-E564 PolarHBondContact O-N 2.89Å; S562-E564 VanDerWaalsContact C-N 3.33Å; S562-E564 PolarHBondContact O-N 3Å; E564-E566 VanDerWaalsContact C-N 3.31Å; E564-E566 PolarHBondContact O-N 3.39Å; E564-R567 PolarHBondContact O-N 3.15Å; E564-H568 PolarHBondContact O-N 3.2Å
565	R	68.8	Low	66.9	Low	185 Å²	185	126.6 Å²	126.6	70%	0.698	54%	0.543	S	S	*	.	H	α-helix	trans	-67.5	-31	176.7	-155.1	175.2	-161.4	-172.8	4.6	113	R561 S562 R569	R561-R565 WeakPolarHBondContact O-CB 3.35Å; R561-R565 PolarHBondContact O-N 3.04Å; R561-R565 VanDerWaalsContact O-N 3.15Å; S562-R565 PolarHBondContact O-N 3.01Å; R565-R569 PolarHBondContact O-N 3.2Å
566	E	64.2	Low	68	Low	122 Å²	122	125.7 Å²	125.7	57%	0.57	54%	0.538	S	S	*	.	H	α-helix	trans	-71.9	-49.6	175.1	-150.7	157	-130.2	0	0	110.8	S562 R563 E564 H568 R569 D570	S562-E566 PolarHBondContact O-N 3.46Å; R563-E566 PolarHBondContact O-N 3.45Å; E564-E566 VanDerWaalsContact C-N 3.31Å; E564-E566 PolarHBondContact O-N 3.39Å; E566-H568 PolarHBondContact O-N 3.01Å; E566-R569 WeakPolarHBondContact O-CB 3.42Å; E566-R569 PolarHBondContact O-N 3.02Å; E566-D570 PolarHBondContact O-N 3.41Å
567	R	69.4	Low	69.2	Low	176 Å²	176	126.9 Å²	126.9	66%	0.664	54%	0.536	S	S	*	.	H	α-helix	trans	-56.1	-34	172.7	-72.8	172.8	176.1	179.1	-0.7	113.5	R563 E564 R571	R563-R567 WeakPolarHBondContact O-CG 3.49Å; R563-R567 PolarHBondContact O-N 3.44Å; E564-R567 PolarHBondContact O-N 3.15Å; R567-R571 WeakPolarHBondContact O-CG 3.32Å; R567-R571 PolarHBondContact O-N 2.86Å; R567-R571 VanDerWaalsContact O-N 3.12Å
568	H	74.2	Confident	69.9	Low	94 Å²	94	124.9 Å²	124.9	44%	0.435	53%	0.532	S	S	.	.	H	α-helix	trans	-65.3	-46.7	173.5	-104.5	-83.8	0	0	0	112.2	E564 E566 D570 R571 D572	E564-H568 PolarHBondContact O-N 3.2Å; E566-H568 PolarHBondContact O-N 3.01Å; H568-D570 VanDerWaalsContact C-N 3.32Å; H568-D570 PolarHBondContact O-N 3.33Å; H568-R571 PolarHBondContact O-N 3.42Å; H568-D572 PolarHBondContact O-N 3.45Å
569	R	70.1	Confident	70.8	Confident	169 Å²	169	125.3 Å²	125.3	64%	0.638	53%	0.533	S	S	*	.	H	α-helix	trans	-61.5	-38.6	176.5	-74.6	175.4	171	169.8	-4.4	112.7	R565 E566 D572 R573	R565-R569 PolarHBondContact O-N 3.2Å; E566-R569 WeakPolarHBondContact O-CB 3.42Å; E566-R569 PolarHBondContact O-N 3.02Å; R569-D572 PolarHBondContact O-N 2.99Å; R569-R573 VanDerWaalsContact O-CB 3.32Å; R569-R573 WeakPolarHBondContact O-CB 3.45Å; R569-R573 PolarHBondContact O-N 3.12Å
570	D	69.6	Low	71.6	Confident	70 Å²	70	122.9 Å²	122.9	37%	0.374	53%	0.531	S	S	.	.	H	α-helix	trans	-68.6	-41.4	178.3	-69.7	-37.1	0	0	0	111.8	E566 H568 D572 R573 D574	E566-D570 PolarHBondContact O-N 3.41Å; H568-D570 VanDerWaalsContact C-N 3.32Å; H568-D570 PolarHBondContact O-N 3.33Å; D570-D572 PolarHBondContact O-N 2.92Å; D570-R573 PolarHBondContact O-N 2.95Å; D570-R573 IonicContact OD1-NH1 3.86Å; D570-R573 PolarHBondContact OD1-NH1 3.39Å; D570-D574 PolarHBondContact O-N 3.32Å
571	R	73.2	Confident	72.5	Confident	161 Å²	161	124.1 Å²	124.1	61%	0.608	53%	0.53	S	S	*	.	H	α-helix	trans	-60.3	-42.3	171.7	-78.5	-176.9	-176.7	152.4	-0.7	113.3	R567 H568 D574 R575	R567-R571 WeakPolarHBondContact O-CG 3.32Å; R567-R571 PolarHBondContact O-N 2.86Å; R567-R571 VanDerWaalsContact O-N 3.12Å; H568-R571 PolarHBondContact O-N 3.42Å; R571-D574 PolarHBondContact O-N 3.3Å; R571-R575 WeakPolarHBondContact O-CB 3.39Å; R571-R575 PolarHBondContact O-N 3.46Å
572	D	74.6	Confident	73.1	Confident	68 Å²	68	121.1 Å²	121.1	36%	0.364	52%	0.523	S	S	.	.	H	α-helix	trans	-66.5	-41.5	178.6	-68.5	-34.3	0	0	0	110.4	H568 R569 D570 D574 R575 D576	H568-D572 PolarHBondContact O-N 3.45Å; R569-D572 PolarHBondContact O-N 2.99Å; D570-D572 PolarHBondContact O-N 2.92Å; D572-D574 VanDerWaalsContact C-N 3.35Å; D572-D574 PolarHBondContact O-N 2.67Å; D572-R575 PolarHBondContact O-N 3.23Å; D572-R575 IonicContact OD1-CZ 2.9Å; D572-R575 IonicContact OD1-NH1 3.76Å; D572-R575 PolarHBondContact OD1-NH1 3.36Å; D572-D576 PolarHBondContact O-N 2.9Å
573	R	76.3	Confident	73.9	Confident	136 Å²	136	125.5 Å²	125.5	51%	0.513	53%	0.528	S	S	.	.	H	α-helix	trans	-63.9	-34.6	174.5	-169.7	-172.3	-80	151.7	-17.9	113.1	R569 D570 R577	R569-R573 VanDerWaalsContact O-CB 3.32Å; R569-R573 WeakPolarHBondContact O-CB 3.45Å; R569-R573 PolarHBondContact O-N 3.12Å; D570-R573 PolarHBondContact O-N 2.95Å; D570-R573 IonicContact OD1-NH1 3.86Å; D570-R573 PolarHBondContact OD1-NH1 3.39Å; R573-R577 VanDerWaalsContact O-CG 3.32Å; R573-R577 WeakPolarHBondContact O-CG 3.44Å; R573-R577 PolarHBondContact O-N 3.31Å; R573-R577 VanDerWaalsContact O-N 3.13Å
574	D	75.9	Confident	74.3	Confident	84 Å²	84	126.4 Å²	126.4	45%	0.449	54%	0.537	S	S	.	.	H	α-helix	trans	-72.5	-36.7	173.3	-76.2	-27	0	0	0	112.4	D570 R571 D572 D576 R577 E578	D570-D574 PolarHBondContact O-N 3.32Å; R571-D574 PolarHBondContact O-N 3.3Å; D572-D574 VanDerWaalsContact C-N 3.35Å; D572-D574 PolarHBondContact O-N 2.67Å; D574-D576 VanDerWaalsContact C-N 3.33Å; D574-R577 PolarHBondContact O-N 3.13Å; D574-R577 IonicContact OD1-CZ 3.23Å; D574-R577 IonicContact OD1-NH1 3.17Å; D574-R577 PolarHBondContact OD1-NH1 2.96Å; D574-E578 WeakPolarHBondContact O-CB 3.32Å; D574-E578 PolarHBondContact O-N 2.89Å
575	R	78.4	Confident	74.8	Confident	143 Å²	143	130.1 Å²	130.1	54%	0.54	55%	0.548	S	S	.	.	H	α-helix	trans	-67.2	-34.3	174.3	-159.4	-170.8	-73.8	132.2	-8.7	111.9	R571 D572 E578 R579	R571-R575 WeakPolarHBondContact O-CB 3.39Å; R571-R575 PolarHBondContact O-N 3.46Å; D572-R575 PolarHBondContact O-N 3.23Å; D572-R575 IonicContact OD1-CZ 2.9Å; D572-R575 IonicContact OD1-NH1 3.76Å; D572-R575 PolarHBondContact OD1-NH1 3.36Å; R575-E578 PolarHBondContact O-N 2.96Å; R575-R579 WeakPolarHBondContact O-CB 3.36Å; R575-R579 PolarHBondContact O-N 3.48Å
576	D	79.7	Confident	75	Confident	97 Å²	97	130.7 Å²	130.7	52%	0.519	55%	0.55	S	S	.	.	H	α-helix	trans	-65.7	-45.9	171.2	-73	-27.4	0	0	0	111.2	D572 D574 E578 R579 D580	D572-D576 PolarHBondContact O-N 2.9Å; D574-D576 VanDerWaalsContact C-N 3.33Å; D576-E578 VanDerWaalsContact C-N 3.3Å; D576-E578 PolarHBondContact O-N 3.2Å; D576-R579 CarbonylContact O-C 3.59Å; D576-R579 PolarHBondContact O-N 2.84Å; D576-D580 PolarHBondContact O-N 3.43Å
577	R	79.7	Confident	75.1	Confident	116 Å²	116	133.3 Å²	133.3	44%	0.438	56%	0.562	S	S	.	*	H	α-helix	trans	-59.5	-38.8	173.7	-71.1	165.9	179.6	141.7	-3.3	112.9	R573 D574 D580 R581	R573-R577 VanDerWaalsContact O-CG 3.32Å; R573-R577 WeakPolarHBondContact O-CG 3.44Å; R573-R577 PolarHBondContact O-N 3.31Å; R573-R577 VanDerWaalsContact O-N 3.13Å; D574-R577 PolarHBondContact O-N 3.13Å; D574-R577 IonicContact OD1-CZ 3.23Å; D574-R577 IonicContact OD1-NH1 3.17Å; D574-R577 PolarHBondContact OD1-NH1 2.96Å; R577-D580 PolarHBondContact O-N 3.17Å; R577-R581 WeakPolarHBondContact O-CG 3.37Å; R577-R581 PolarHBondContact O-N 3.29Å
578	E	77.6	Confident	74.6	Confident	119 Å²	119	138 Å²	138	56%	0.556	58%	0.58	S	S	*	*	H	α-helix	trans	-67.5	-40.8	176.5	-172.1	166.9	-128.6	0	0	111.4	D574 R575 D576 D580 R581 E582	D574-E578 WeakPolarHBondContact O-CB 3.32Å; D574-E578 PolarHBondContact O-N 2.89Å; R575-E578 PolarHBondContact O-N 2.96Å; D576-E578 VanDerWaalsContact C-N 3.3Å; D576-E578 PolarHBondContact O-N 3.2Å; E578-D580 VanDerWaalsContact C-N 3.34Å; E578-D580 PolarHBondContact O-N 2.88Å; E578-R581 PolarHBondContact O-N 3.17Å; E578-E582 PolarHBondContact O-N 3.49Å
579	R	80.3	Confident	74.6	Confident	143 Å²	143	140.3 Å²	140.3	54%	0.54	59%	0.587	S	S	.	*	H	α-helix	trans	-66	-34.1	173.5	-172.9	175.3	-74.4	-154	-4.1	112.6	R575 D576 E582 R583	R575-R579 WeakPolarHBondContact O-CB 3.36Å; R575-R579 PolarHBondContact O-N 3.48Å; D576-R579 CarbonylContact O-C 3.59Å; D576-R579 PolarHBondContact O-N 2.84Å; R579-E582 PolarHBondContact O-N 3.44Å; R579-R583 WeakPolarHBondContact O-CG 3.35Å; R579-R583 PolarHBondContact O-N 2.99Å
580	D	79	Confident	74.9	Confident	96 Å²	96	138.7 Å²	138.7	51%	0.513	58%	0.584	S	S	.	*	H	α-helix	trans	-70.2	-39.1	173.4	-74	-20.1	0	0	0	111.7	D576 R577 E578 R583 E584	D576-D580 PolarHBondContact O-N 3.43Å; R577-D580 PolarHBondContact O-N 3.17Å; E578-D580 VanDerWaalsContact C-N 3.34Å; E578-D580 PolarHBondContact O-N 2.88Å; D580-R583 WeakPolarHBondContact O-CB 3.31Å; D580-R583 PolarHBondContact O-N 3.5Å; D580-R583 IonicContact OD1-NE 3.81Å; D580-E584 PolarHBondContact O-N 3.39Å
581	R	78.7	Confident	75.1	Confident	155 Å²	155	142.6 Å²	142.6	59%	0.585	60%	0.596	S	S	*	*	H	α-helix	trans	-62.5	-40.1	169.5	-70.3	179.5	-161.9	120.8	-0.9	112.3	R577 E578 R583 E584 Y585	R577-R581 WeakPolarHBondContact O-CG 3.37Å; R577-R581 PolarHBondContact O-N 3.29Å; E578-R581 PolarHBondContact O-N 3.17Å; R581-R583 VanDerWaalsContact C-N 3.33Å; R581-R583 PolarHBondContact O-N 3.33Å; R581-E584 PolarHBondContact O-N 3.49Å; R581-Y585 WeakPolarHBondContact O-CB 3.38Å; R581-Y585 PolarHBondContact O-N 3.49Å
582	E	76.8	Confident	75.3	Confident	99 Å²	99	141.5 Å²	141.5	46%	0.463	60%	0.595	S	S	.	*	H	α-helix	trans	-62.3	-38.4	172.8	-84.6	-158	107.9	0	0	112.2	E578 R579 Y585 R586	E578-E582 PolarHBondContact O-N 3.49Å; R579-E582 PolarHBondContact O-N 3.44Å; E582-Y585 PolarHBondContact O-N 2.98Å; E582-R586 WeakPolarHBondContact O-CB 3.45Å; E582-R586 VanDerWaalsContact O-CG 3.31Å; E582-R586 WeakPolarHBondContact O-CG 3.45Å; E582-R586 PolarHBondContact O-N 3.04Å; E582-R586 IonicContact OE1-NH2 3.88Å; E582-R586 PolarHBondContact OE1-NH2 2.9Å
583	R	77.4	Confident	75.3	Confident	164 Å²	164	146.1 Å²	146.1	62%	0.619	61%	0.61	S	S	*	*	H	α-helix	trans	-64.4	-45.3	174.1	-71.7	171.1	-170.7	-98.9	8.7	111.1	R579 D580 R581 Y585 R586 H587	R579-R583 WeakPolarHBondContact O-CG 3.35Å; R579-R583 PolarHBondContact O-N 2.99Å; D580-R583 WeakPolarHBondContact O-CB 3.31Å; D580-R583 PolarHBondContact O-N 3.5Å; D580-R583 IonicContact OD1-NE 3.81Å; R581-R583 VanDerWaalsContact C-N 3.33Å; R581-R583 PolarHBondContact O-N 3.33Å; R583-Y585 VanDerWaalsContact C-N 3.34Å; R583-Y585 PolarHBondContact O-N 3.35Å; R583-R586 PolarHBondContact O-N 3.18Å; R583-H587 WeakPolarHBondContact O-CB 3.49Å; R583-H587 PolarHBondContact O-N 3.09Å; R583-H587 VanDerWaalsContact O-N 3.09Å
584	E	73.1	Confident	75.2	Confident	137 Å²	137	146.7 Å²	146.7	64%	0.64	62%	0.616	S	S	*	*	H	α-helix	trans	-60	-43.8	176.8	-171.9	178	-166.7	0	0	111.1	D580 R581 R586 H587 R588	D580-E584 PolarHBondContact O-N 3.39Å; R581-E584 PolarHBondContact O-N 3.49Å; E584-R586 VanDerWaalsContact C-N 3.3Å; E584-R586 PolarHBondContact O-N 3.21Å; E584-H587 PolarHBondContact O-N 3.22Å; E584-R588 PolarHBondContact O-N 2.88Å
585	Y	73.7	Confident	75.2	Confident	199 Å²	199	151.2 Å²	151.2	78%	0.78	63%	0.628	S	S	*	*	H	α-helix	trans	-70.2	-21.8	178	-142.2	-82.8	0	0	0	113.9	R581 E582 R583	R581-Y585 WeakPolarHBondContact O-CB 3.38Å; R581-Y585 PolarHBondContact O-N 3.49Å; E582-Y585 PolarHBondContact O-N 2.98Å; R583-Y585 VanDerWaalsContact C-N 3.34Å; R583-Y585 PolarHBondContact O-N 3.35Å
586	R	73	Confident	74.9	Confident	196 Å²	196	151.8 Å²	151.8	74%	0.74	64%	0.635	S	S	*	*	H	α-helix	trans	-88.6	-11.8	172.3	-72.1	-179.6	-164.6	177.7	11.2	113.7	E582 R583 E584	E582-R586 WeakPolarHBondContact O-CB 3.45Å; E582-R586 VanDerWaalsContact O-CG 3.31Å; E582-R586 WeakPolarHBondContact O-CG 3.45Å; E582-R586 PolarHBondContact O-N 3.04Å; E582-R586 IonicContact OE1-NH2 3.88Å; E582-R586 PolarHBondContact OE1-NH2 2.9Å; R583-R586 PolarHBondContact O-N 3.18Å; E584-R586 VanDerWaalsContact C-N 3.3Å; E584-R586 PolarHBondContact O-N 3.21Å
587	H	66.6	Low	74.5	Confident	177 Å²	177	156.4 Å²	156.4	82%	0.819	65%	0.645	S	S	*	*			trans	-101.9	5.4	177.8	-159.1	-62.2	0	0	0	111.8	R583 E584	R583-H587 WeakPolarHBondContact O-CB 3.49Å; R583-H587 PolarHBondContact O-N 3.09Å; R583-H587 VanDerWaalsContact O-N 3.09Å; E584-H587 PolarHBondContact O-N 3.22Å
588	R	58.7	Low	74.1	Confident	276 Å²	276	160.1 Å²	160.1	100%	1.042	66%	0.663	S	S	*	*			trans	-120.6	0	-179.7	-160.1	-178.5	-150.7	-162.3	8.2	110.7	E584	E584-R588 PolarHBondContact O-N 2.88Å

Retrieved 588 of 588 residues in 75.4 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).