A0A3Q0KKL7_SCHMA Loading...

Putative smad nuclear interacting protein

AlphaFold DB , UniProt , Accession A0A3Q0KKL7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 816 aa.

						>A0A3Q0KKL7_SCHMA|A0A3Q0KKL7
MEVDISNNPLHETNMDTTSELEGTITENAEKHKNQIVNTEELVTTTCSDDSASLEIETCTDFESISIDVKKPDENTLTTPNIYCPPSWALNCPPSLDYKLEVIKNGLQLSECTVCLSSPSDINLQSSCDNGLSYCLFGRQPQLNYAQSGTMNGQCSVLAHPSISRLHAVLQYGKPPHSVGHVSENEKDTTGWYLKDLESTHGTFVNKRRLPPGRYVRIRVGYVLRFGGSTRLHILQGPEDDTEQQTSQSWFDLKKSHEEYKMNSKMERNISSIQNSNTVKLECNWGMSLEDPVSEPIPTLLQSGTCLSHEKLYRDDPKRALNAYFEREGIDPIPQFEFVEAPFGKQHCRIELPLSSGTVTAEALVSGKRKEAVVACALEACQLLDRLGEFDPDKDRSTAFKYTRSRAYWEDRDYYSSDEDTYVDRTGAVERKRLNRMRQLGVKDDEIKTTSELLDNHNAEIHLEKAKRVSQNATMITMLSELEKIGEEIVSIEEELEAINKEFSSKEANPSQLDELEAYMNALKTNSSKCAQRSKLKARLISLRQTELQLFHRAGLPRVGKTLKQLSNRQNNNSEYISSSDAAAAVRAARQKLNNDASEQQSENDQQNAVISEQKIKNIRADRNALKRSLQNHARTLYVSQKKIEIDKPFEVENDDDDDNDDNGDTNVNDIGEKEETQKIDMSIDSEENKIDTAISIPQYKLSKCSDSSCQSTSALNSTTTMNIVNNNANPIDDPSINISNEQSMEENSTEIKLHVDKKQPTKVLGPTLPPSQKLLEVNKKTKDYIENYSDDYVEWFPPSDQSGDGTTSLNAKYGY
					

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	40.9	Very low	42.1	Very low	218 Å²	218	142.9 Å²	142.9	100%	1.074	76%	0.763	S	S	*	*				0	55.3	0	-48.8	178.5	-161.4	0	0	107.3
2	E	38.8	Very low	42.2	Very low	169 Å²	169	144.5 Å²	144.5	79%	0.79	76%	0.763	S	S	*	*				72.1	113.6	67.6	-67.4	145.3	150.6	0	0	110
3	V	41.7	Very low	42.3	Very low	116 Å²	116	141.5 Å²	141.5	70%	0.703	75%	0.754	S	S	*	*			cis	116.1	160	32	160.9	0	0	0	0	108
4	D	43.4	Very low	42.2	Very low	137 Å²	137	140.4 Å²	140.4	73%	0.733	75%	0.748	S	S	*	*			trans	75.5	122.3	-176.2	-55.3	-42.9	0	0	0	116.2
5	I	42.8	Very low	42.3	Very low	137 Å²	137	140.8 Å²	140.8	70%	0.703	75%	0.746	S	S	*	*			cis	111	111	9.8	-60.2	164.6	0	0	0	114.3
6	S	42.6	Very low	42.2	Very low	90 Å²	90	140.2 Å²	140.2	63%	0.629	74%	0.743	S	S	*	*			trans	84.5	156.9	146.1	75.6	0	0	0	0	123.3
7	N	40.9	Very low	42.1	Very low	152 Å²	152	139.6 Å²	139.6	81%	0.813	75%	0.747	S	S	*	*			trans	95.5	95.1	151.7	-59.3	-27.7	0	0	0	121.2
8	N	38	Very low	42	Very low	155 Å²	155	139.2 Å²	139.2	83%	0.829	75%	0.75	S	S	*	*			trans	-48.5	171	136.5	-117.2	4.5	0	0	0	111.8
9	P	47.4	Very low	42.1	Very low	100 Å²	100	138.2 Å²	138.2	65%	0.649	76%	0.755	S	S	*	*				-159.2	-163.8	51.2	39.3	-13.7	0	0	0	117.8
10	L	43	Very low	41.9	Very low	152 Å²	152	140.8 Å²	140.8	80%	0.796	76%	0.761	S	S	*	*			trans	73.8	149.8	156.8	-64.6	174	0	0	0	118.7
11	H	43.8	Very low	42	Very low	146 Å²	146	142.5 Å²	142.5	68%	0.676	77%	0.77	S	S	*	*			cis	-166.7	-174.1	-20.1	-164.2	-106.7	0	0	0	110
12	E	43.3	Very low	41.7	Very low	162 Å²	162	141.3 Å²	141.3	76%	0.757	76%	0.761	S	S	*	*			trans	81.2	110.5	168.6	-61.5	179.3	-165.4	0	0	116.3
13	T	43.5	Very low	41.9	Very low	106 Å²	106	137 Å²	137	65%	0.65	76%	0.762	S	S	*	*				75	140	65.8	63.1	0	0	0	0	114.1
14	N	40.8	Very low	41.5	Very low	125 Å²	125	137.8 Å²	137.8	67%	0.668	77%	0.767	S	S	*	*			cis	-165.2	159.6	15.8	-130.5	3.7	0	0	0	112.4
15	M	43.1	Very low	41.4	Very low	147 Å²	147	138.9 Å²	138.9	72%	0.724	77%	0.771	S	S	*	*			trans	61.6	158.9	166.4	-49.8	-33.2	-165.2	0	0	116.8
16	D	41.5	Very low	41.2	Very low	131 Å²	131	138.4 Å²	138.4	70%	0.701	78%	0.775	S	S	*	*			cis	-166.2	168.1	-22.3	-102.2	-35.9	0	0	0	106.2
17	T	39.8	Very low	40.9	Very low	130 Å²	130	142.7 Å²	142.7	80%	0.798	79%	0.785	S	S	*	*			cis	-147.3	-173.8	4.4	-4.2	0	0	0	0	110
18	T	39.8	Very low	40.9	Very low	132 Å²	132	143 Å²	143	81%	0.81	79%	0.787	S	S	*	*			trans	-104.9	148.1	-175.2	54.1	0	0	0	0	116.1
19	S	44.9	Very low	41	Very low	120 Å²	120	139.5 Å²	139.5	84%	0.839	78%	0.779	S	S	*	*				-177.1	118.8	118.6	60.2	0	0	0	0	113.4
20	E	38.5	Very low	40.5	Very low	190 Å²	190	142 Å²	142	89%	0.888	78%	0.782	S	S	*	*			trans	-111.9	150.7	163.6	-66.1	177.3	141.9	0	0	109.4
21	L	44.2	Very low	40.4	Very low	178 Å²	178	142.2 Å²	142.2	93%	0.932	78%	0.777	S	S	*	*			trans	-147.9	90.3	169	-93	176.8	0	0	0	110.8
22	E	34.8	Very low	40.4	Very low	193 Å²	193	144.7 Å²	144.7	90%	0.902	79%	0.788	S	S	*	*			trans	-100.6	145.8	154.6	-69.6	-164	146	0	0	109.4
23	G	41.1	Very low	40.1	Very low	77 Å²	77	145 Å²	145	79%	0.794	79%	0.787	S	S	*	*			trans	-146.2	107	-178.4	0	0	0	0	0	112
24	T	34.4	Very low	39.7	Very low	133 Å²	133	146.6 Å²	146.6	82%	0.816	79%	0.792	S	S	*	*			trans	-104.3	124.9	-174.2	47.7	0	0	0	0	111.9
25	I	40.8	Very low	39.6	Very low	160 Å²	160	148.8 Å²	148.8	82%	0.821	80%	0.798	S	S	*	*			trans	-137.1	97.7	172.9	-61.2	-174.1	0	0	0	111.7
26	T	38.7	Very low	39.4	Very low	127 Å²	127	148.5 Å²	148.5	78%	0.779	80%	0.798	S	S	*	*			trans	38.6	134.1	144.1	63.9	0	0	0	0	123.1
27	E	35.9	Very low	39.3	Very low	181 Å²	181	147.8 Å²	147.8	85%	0.846	80%	0.798	S	S	*	*			trans	-64.3	163.9	161.5	-52.7	164.5	103.5	0	0	113.8
28	N	42	Very low	38.8	Very low	159 Å²	159	149 Å²	149	85%	0.85	80%	0.799	S	S	*	*			trans	-165.4	122.1	140.9	-107.3	-57.3	0	0	0	115.3
29	A	39.7	Very low	38.9	Very low	81 Å²	81	149.1 Å²	149.1	67%	0.669	80%	0.8	S	S	*	*			trans	32.4	109.8	146.4	0	0	0	0	0	123.3
30	E	37.6	Very low	38.5	Very low	151 Å²	151	152.5 Å²	152.5	71%	0.706	80%	0.803	S	S	*	*				56.5	143.8	116.9	-70	-161.8	110.2	0	0	125.1
31	K	39.2	Very low	38.6	Very low	158 Å²	158	153 Å²	153	69%	0.687	81%	0.805	S	S	*	*			trans	69.2	113.9	148.4	-69.7	152.9	-175.3	150.1	0	119.2
32	H	44.5	Very low	38.2	Very low	198 Å²	198	151.5 Å²	151.5	92%	0.917	80%	0.797	S	S	*	*				-155.4	168.2	105	-114	-88.1	0	0	0	110.9
33	K	37.4	Very low	38.4	Very low	168 Å²	168	148.2 Å²	148.2	73%	0.73	79%	0.79	S	S	*	*			trans	-141.1	124.9	-157.9	175.5	-175.7	178.1	-179.3	0	113.5
34	N	34.1	Very low	37.7	Very low	140 Å²	140	150.6 Å²	150.6	75%	0.749	79%	0.79	S	S	*	*			trans	58.9	151.4	163.6	-58.6	9	0	0	0	117.9
35	Q	39.5	Very low	37.9	Very low	170 Å²	170	150.3 Å²	150.3	79%	0.794	79%	0.788	S	S	*	*				158.8	114.2	110.3	-175	148.9	21.5	0	0	114.6
36	I	38.3	Very low	37.4	Very low	142 Å²	142	149.2 Å²	149.2	73%	0.728	79%	0.789	S	S	*	*			trans	96.7	136.8	137.2	-107.8	172.8	0	0	0	124.5
37	V	39.3	Very low	37.2	Very low	116 Å²	116	149.7 Å²	149.7	70%	0.703	80%	0.795	S	S	*	*			trans	82.4	121.4	152.6	164.8	0	0	0	0	121.2
38	N	29.7	Very low	37.2	Very low	154 Å²	154	145.7 Å²	145.7	82%	0.824	79%	0.787	S	S	*	*			trans	-100.8	150.1	160	-47.7	-10.3	0	0	0	108.8
39	T	41.4	Very low	37	Very low	136 Å²	136	144.9 Å²	144.9	83%	0.834	78%	0.783	S	S	*	*			trans	-149.3	123.5	148.6	43.2	0	0	0	0	109.1
40	E	36.6	Very low	36.9	Very low	190 Å²	190	148.1 Å²	148.1	89%	0.888	79%	0.789	S	S	*	*			trans	-93.2	145.4	166.9	-59.7	170.6	143.6	0	0	108.6
41	E	41.9	Very low	36.8	Very low	200 Å²	200	146 Å²	146	94%	0.935	79%	0.791	S	S	*	*			trans	-153.8	148.6	155	-136.1	169.9	-145.7	0	0	110.5
42	L	36.3	Very low	36.7	Very low	147 Å²	147	143.5 Å²	143.5	77%	0.77	80%	0.8	S	S	*	*			trans	-128.2	122.2	-162.8	178.6	154.5	0	0	0	110.3
43	V	38	Very low	36.2	Very low	124 Å²	124	139.6 Å²	139.6	75%	0.752	80%	0.795	S	S	*	*			trans	-140.3	113.5	173.5	-176.5	0	0	0	0	110.9	T45	V43-T45 HydrophobicContact CG1-CG2 4.08Å
44	T	27.4	Very low	36.3	Very low	128 Å²	128	140 Å²	140	79%	0.785	80%	0.804	S	S	*	*			trans	-104.1	123.9	164.3	49.1	0	0	0	0	109.8
45	T	36.7	Very low	36.3	Very low	126 Å²	126	141.9 Å²	141.9	77%	0.773	81%	0.809	S	S	*	*			trans	-136.9	118.8	170.6	49.3	0	0	0	0	111.5	V43	V43-T45 HydrophobicContact CG1-CG2 4.08Å
46	T	30.5	Very low	36.4	Very low	138 Å²	138	142.1 Å²	142.1	85%	0.847	81%	0.813	S	S	*	*			trans	-82.3	145.8	168.5	50.3	0	0	0	0	111.3
47	C	35.6	Very low	36.3	Very low	136 Å²	136	143.2 Å²	143.2	92%	0.919	82%	0.815	S	S	*	*			trans	-154.5	160.2	154.2	-111.2	0	0	0	0	110.1
48	S	36.6	Very low	36.2	Very low	97 Å²	97	144.6 Å²	144.6	68%	0.678	82%	0.824	S	S	*	*			trans	-119.9	173	-162.6	-36.4	0	0	0	0	113.1
49	D	36.3	Very low	36.4	Very low	143 Å²	143	142 Å²	142	77%	0.765	82%	0.817	S	S	*	*			trans	40.3	123	144.7	-42.3	-32.6	0	0	0	119.4
50	D	38.6	Very low	36.3	Very low	149 Å²	149	142.2 Å²	142.2	80%	0.797	82%	0.819	S	S	*	*				-172.4	148.7	93.8	-127	-37.5	0	0	0	116.7
51	S	36.1	Very low	36.4	Very low	106 Å²	106	139.5 Å²	139.5	74%	0.741	81%	0.81	S	S	*	*			trans	-21.8	138.8	159.9	-47.5	0	0	0	0	121.2
52	A	36.9	Very low	36.4	Very low	106 Å²	106	140 Å²	140	88%	0.876	81%	0.809	S	S	*	*				-175.1	137	127.7	0	0	0	0	0	113.3
53	S	33.5	Very low	36.7	Very low	115 Å²	115	141.4 Å²	141.4	80%	0.804	81%	0.812	S	S	*	*			trans	-107.9	152.7	176.2	-49.4	0	0	0	0	112.2
54	L	38.4	Very low	36.7	Very low	178 Å²	178	140.4 Å²	140.4	93%	0.932	81%	0.811	S	S	*	*			trans	-144.4	129.7	159.4	-96.3	174.5	0	0	0	111
55	E	35	Very low	37.1	Very low	179 Å²	179	142.9 Å²	142.9	84%	0.836	82%	0.817	S	S	*	*			trans	-111.3	143.4	-179.1	-57.5	172.2	146.4	0	0	109.9
56	I	40.4	Very low	37	Very low	174 Å²	174	142.1 Å²	142.1	89%	0.892	82%	0.817	S	S	*	*			trans	-140.9	134.8	156.2	-60.6	-174.4	0	0	0	108.6
57	E	37.5	Very low	37.5	Very low	165 Å²	165	143.2 Å²	143.2	77%	0.771	82%	0.816	S	S	*	*			trans	-88.9	165.4	-174	-48.8	167.8	126.1	0	0	112.9
58	T	37.5	Very low	37.4	Very low	145 Å²	145	144.5 Å²	144.5	89%	0.89	81%	0.814	S	S	*	*				-172.3	150.2	117	19	0	0	0	0	113.3
59	C	33.3	Very low	37.5	Very low	99 Å²	99	146.5 Å²	146.5	67%	0.669	82%	0.821	S	S	*	*			trans	-84.2	163.3	-164.2	-38.3	0	0	0	0	115.1
60	T	40	Very low	37.6	Very low	142 Å²	142	149 Å²	149	87%	0.871	83%	0.825	S	S	*	*				-169.6	153.5	109.6	18.4	0	0	0	0	112
61	D	37.9	Very low	37.4	Very low	132 Å²	132	150.7 Å²	150.7	71%	0.706	83%	0.826	S	S	*	*			trans	-105.5	157.1	-156.6	-41.2	-94.2	0	0	0	114.4
62	F	42.8	Very low	37.5	Very low	210 Å²	210	151.5 Å²	151.5	92%	0.921	83%	0.828	S	S	*	*			trans	-154.1	143.7	142.6	-92.1	-62.8	0	0	0	111.8
63	E	42.1	Very low	37.4	Very low	177 Å²	177	153.2 Å²	153.2	83%	0.827	82%	0.823	S	S	*	*			trans	-69	128.5	-172.6	-65.3	158.7	128.3	0	0	111.8
64	S	36.9	Very low	37.4	Very low	103 Å²	103	156.3 Å²	156.3	72%	0.72	83%	0.825	S	S	*	*			cis	86.7	94.9	49.7	81.4	0	0	0	0	115.4
65	I	36	Very low	37	Very low	181 Å²	181	155.5 Å²	155.5	93%	0.928	82%	0.821	S	S	*	*			trans	-131.2	130.4	149.6	-64.6	-177.9	0	0	0	106.6
66	S	35.8	Very low	36.9	Very low	110 Å²	110	152.9 Å²	152.9	77%	0.769	82%	0.818	S	S	*	*			trans	-113.9	141.9	-162	43.7	0	0	0	0	114.7
67	I	40.1	Very low	36.5	Very low	161 Å²	161	151.7 Å²	151.7	83%	0.826	81%	0.812	S	S	*	*			trans	-136.8	135.4	156.6	-61.4	179.7	0	0	0	106	V69	I67-V69 PolarHBondContact O-N 2.77Å
68	D	34.1	Very low	36.1	Very low	163 Å²	163	150.1 Å²	150.1	87%	0.872	81%	0.814	S	S	*	*			trans	-62.1	127.9	-165.9	-67.9	-69.9	0	0	0	115
69	V	38.4	Very low	36.2	Very low	138 Å²	138	148.4 Å²	148.4	84%	0.836	80%	0.804	S	S	*	*			trans	-117.8	107.6	164.7	179.8	0	0	0	0	108.3	I67	I67-V69 PolarHBondContact O-N 2.77Å
70	K	39.3	Very low	37	Very low	195 Å²	195	149.1 Å²	149.1	85%	0.848	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-74.6	142.8	164.5	-73.2	-172.9	174	-174.5	0	109.3
71	K	34.1	Very low	37.9	Very low	186 Å²	186	147.4 Å²	147.4	81%	0.809	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-56.5	143.9	170.6	-69.3	-178	175	-176.8	0	109.9
72	P	37.7	Very low	39.3	Very low	122 Å²	122	143.9 Å²	143.9	79%	0.792	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-74.1	128.2	162.6	31.4	-30.9	0	0	0	109.1
73	D	34.5	Very low	41	Very low	143 Å²	143	134.7 Å²	134.7	77%	0.765	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-76.3	140.7	170.4	-58	-57.8	0	0	0	109.8
74	E	33.5	Very low	42.8	Very low	180 Å²	180	130 Å²	130	84%	0.841	72%	0.718	S	S	*	*	S	Bend	trans	-68.5	147.9	175.3	-63.2	-174.5	140.7	0	0	110.8
75	N	29.5	Very low	45	Very low	161 Å²	161	126.8 Å²	126.8	86%	0.861	70%	0.695	S	S	*	*			trans	78.2	61.6	-175.9	-50.8	-63.9	0	0	0	117.2
76	T	32.9	Very low	47.3	Very low	123 Å²	123	119.4 Å²	119.4	76%	0.755	66%	0.659	S	S	*	*			trans	-131.1	119.4	153.9	41.5	0	0	0	0	114.1
77	L	31.9	Very low	49.5	Very low	150 Å²	150	120.6 Å²	120.6	79%	0.785	67%	0.667	S	S	*	*			trans	29.4	109.2	154.3	-73	69.5	0	0	0	119.6
78	T	30.5	Very low	51.7	Low	131 Å²	131	114.2 Å²	114.2	80%	0.804	63%	0.632	S	S	*	*			trans	11.7	112.1	138	38.8	0	0	0	0	118.6	P80	T78-P80 VanDerWaalsContact O-CD 3.3Å; T78-P80 WeakPolarHBondContact O-CD 3.11Å
79	T	38.8	Very low	54.2	Low	110 Å²	110	107 Å²	107	68%	0.675	60%	0.595	S	S	*	*			trans	-101	94.9	164.9	44.2	0	0	0	0	110.8	N81	T79-N81 PolarHBondContact O-N 3.32Å
80	P	51	Low	56.3	Low	114 Å²	114	104 Å²	104	74%	0.74	58%	0.575	S	S	*	*			trans	-77.9	16.7	-163.4	33.3	-39.7	0	0	0	115.6	T78	T78-P80 VanDerWaalsContact O-CD 3.3Å; T78-P80 WeakPolarHBondContact O-CD 3.11Å
81	N	57.7	Low	58.3	Low	105 Å²	105	96.9 Å²	96.9	56%	0.561	55%	0.546	S	S	*	.			trans	-116.7	25.3	-166.9	-67	-60.2	0	0	0	114	T79 L166	T79-N81 PolarHBondContact O-N 3.32Å; N81-L166 HydrophobicContact CB-CD1 4.25Å; N81-L166 WeakPolarHBondContact O-CD1 3.47Å
82	I	67.8	Low	60.4	Low	59 Å²	59	88 Å²	88	30%	0.303	51%	0.507	S	S	.	.			trans	-95.1	117.6	174.6	-56.1	-177.8	0	0	0	108.2	Y145 Q147	I82-Y145 HydrophobicContact CB-CD1 4.38Å; I82-Y145 HydrophobicContact CG1-CD1 4.13Å; I82-Y145 HydrophobicContact CG2-CD1 4.33Å; I82-Q147 HydrophobicContact CD1-CG 4.31Å; I82-Q147 HydrophobicContact CG2-CG 4.26Å
83	Y	78.6	Confident	62.2	Low	17 Å²	17	84.6 Å²	84.6	7%	0.067	49%	0.485	C	S	.	.			trans	-72.5	136.8	165.9	178.9	-109.9	0	0	0	109.4	P85 P86 Y134 L136 Y145 V169 Q171 L197 Y215	Y83-P85 HydrophobicContact CE1-CB 4.25Å; Y83-P86 WeakPolarHBondContact OH-CD 3.45Å; Y83-Y134 HydrophobicContact CD1-CD2 4.07Å; Y83-Y134 HydrophobicContact CD1-CE2 4.1Å; Y83-Y134 HydrophobicContact CE1-CD2 4.07Å; Y83-Y134 HydrophobicContact CE1-CG 4.29Å; Y83-L136 HydrophobicContact CD1-CD2 4.39Å; Y83-L136 HydrophobicContact CG-CD2 4.32Å; Y83-Y145 CarbonylContact O-C 3.59Å; Y83-V169 HydrophobicContact CD1-CG2 4.15Å; Y83-V169 HydrophobicContact CD2-CG1 4.24Å; Y83-V169 HydrophobicContact CE1-CG2 3.69Å; Y83-V169 HydrophobicContact CE2-CB 4.34Å; Y83-V169 HydrophobicContact CE2-CG1 3.67Å; Y83-V169 HydrophobicContact CE2-CG2 4.16Å; Y83-Q171 PolarHBondContact OH-OE1 2.89Å; Y83-L197 HydrophobicContact CD2-CD2 4.48Å; Y83-Y215 PolarHBondContact OH-OH 3.39Å
84	C	80.5	Confident	64.1	Low	77 Å²	77	80.9 Å²	80.9	52%	0.52	47%	0.469	S	S	.	.			trans	-115.5	125.8	168	-67.4	0	0	0	0	108.2
85	P	83	Confident	66.1	Low	36 Å²	36	77.1 Å²	77.1	23%	0.234	46%	0.462	C	S	.	.			trans	-63	142.4	174.3	27.1	-33.6	0	0	0	110	Y83 A89 M151	Y83-P85 HydrophobicContact CE1-CB 4.25Å; P85-A89 HydrophobicContact CB-CB 4.05Å; P85-M151 HydrophobicContact CG-CG 4.37Å
86	P	83.8	Confident	68.2	Low	27 Å²	27	71.3 Å²	71.3	18%	0.175	43%	0.431	C	S	.	.			trans	-69.5	159	179.2	30.1	-35.6	0	0	0	111.4	Y83 W88 A89 Q171	Y83-P86 WeakPolarHBondContact OH-CD 3.45Å; P86-W88 HydrophobicContact CB-CD2 4.07Å; P86-W88 HydrophobicContact CB-CG 4.16Å; P86-W88 HydrophobicContact CB-CZ2 4.14Å; P86-W88 HydrophobicContact CG-CD2 3.72Å; P86-W88 VanDerWaalsContact CG-CE2 3.43Å; P86-W88 HydrophobicContact CG-CE3 4.11Å; P86-W88 HydrophobicContact CG-CG 4.27Å; P86-W88 HydrophobicContact CG-CH2 3.99Å; P86-W88 HydrophobicContact CG-CZ2 3.59Å; P86-W88 HydrophobicContact CG-CZ3 4.24Å; P86-W88 PolarHBondContact O-N 3.4Å; P86-A89 HydrophobicContact CG-CB 4.34Å; P86-A89 WeakPolarHBondContact O-CB 3.39Å; P86-A89 PolarHBondContact O-N 3.27Å; P86-Q171 HydrophobicContact CG-CG 3.98Å
87	S	82.2	Confident	70.6	Confident	134 Å²	134	70.9 Å²	70.9	94%	0.937	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-14.8	178.4	52.1	0	0	0	0	115.1
88	W	86.7	Confident	73.2	Confident	27 Å²	27	64 Å²	64	10%	0.102	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	2.9	174.1	55.6	-102.3	0	0	0	114.2	P86 Q171 G173 K174 P175 P176 V179 Y193 Y215	P86-W88 HydrophobicContact CB-CD2 4.07Å; P86-W88 HydrophobicContact CB-CG 4.16Å; P86-W88 HydrophobicContact CB-CZ2 4.14Å; P86-W88 HydrophobicContact CG-CD2 3.72Å; P86-W88 VanDerWaalsContact CG-CE2 3.43Å; P86-W88 HydrophobicContact CG-CE3 4.11Å; P86-W88 HydrophobicContact CG-CG 4.27Å; P86-W88 HydrophobicContact CG-CH2 3.99Å; P86-W88 HydrophobicContact CG-CZ2 3.59Å; P86-W88 HydrophobicContact CG-CZ3 4.24Å; P86-W88 PolarHBondContact O-N 3.4Å; W88-Q171 HydrophobicContact CH2-CB 4.45Å; W88-Q171 HydrophobicContact CH2-CG 3.93Å; W88-Q171 HydrophobicContact CZ3-CG 3.78Å; W88-G173 WeakPolarHBondContact O-CA 3.2Å; W88-K174 VanDerWaalsContact CB-O 3.32Å; W88-K174 WeakPolarHBondContact CB-O 3.44Å; W88-K174 PolarHBondContact O-N 3Å; W88-P175 HydrophobicContact CD2-CB 3.82Å; W88-P175 HydrophobicContact CE3-CB 4.11Å; W88-P175 HydrophobicContact CG-CB 4.3Å; W88-P175 HydrophobicContact CH2-CB 4.28Å; W88-P175 HydrophobicContact CZ2-CB 3.96Å; W88-P175 HydrophobicContact CZ3-CB 4.34Å; W88-P175 HydrophobicContact CZ3-CG 4.48Å; W88-P176 VanDerWaalsContact CD1-CD 3.44Å; W88-V179 HydrophobicContact CZ2-CG1 4.22Å; W88-Y193 HydrophobicContact CH2-CD2 4.34Å; W88-Y193 HydrophobicContact CH2-CG 4.21Å; W88-Y193 HydrophobicContact CZ3-CD2 4.07Å; W88-Y193 HydrophobicContact CZ3-CG 4.41Å; W88-Y215 AromaticContact CH2-CD1 3.92Å; W88-Y215 HydrophobicContact CH2-CD1 3.92Å; W88-Y215 HydrophobicContact CH2-CD2 4.45Å; W88-Y215 HydrophobicContact CH2-CE1 4.09Å; W88-Y215 HydrophobicContact CH2-CG 4.12Å; W88-Y215 HydrophobicContact CZ2-CD1 4.09Å; W88-Y215 AromaticContact CZ2-CD2 3.8Å; W88-Y215 HydrophobicContact CZ2-CD2 3.8Å; W88-Y215 HydrophobicContact CZ2-CE1 4.17Å; W88-Y215 AromaticContact CZ2-CE2 3.87Å; W88-Y215 HydrophobicContact CZ2-CE2 3.87Å; W88-Y215 AromaticContact CZ2-CG 3.91Å; W88-Y215 HydrophobicContact CZ2-CG 3.91Å
89	A	85.4	Confident	76	Confident	11 Å²	11	61.3 Å²	61.3	9%	0.091	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-59.8	136.4	174.4	0	0	0	0	0	111.1	P85 P86 M151	P85-A89 HydrophobicContact CB-CB 4.05Å; P86-A89 HydrophobicContact CG-CB 4.34Å; P86-A89 WeakPolarHBondContact O-CB 3.39Å; P86-A89 PolarHBondContact O-N 3.27Å; A89-M151 HydrophobicContact CB-CE 3.95Å; A89-M151 WeakPolarHBondContact O-CE 3.5Å
90	L	82.4	Confident	78.4	Confident	77 Å²	77	56 Å²	56	40%	0.403	33%	0.332	S	S	.	.			trans	-127.4	155.6	172.1	-61.8	173.3	0	0	0	109.1	S133 Y172 K174	L90-S133 WeakPolarHBondContact O-CA 3.48Å; L90-Y172 HydrophobicContact CB-CD1 3.99Å; L90-Y172 HydrophobicContact CB-CE1 4.32Å; L90-Y172 PolarHBondContact N-O 2.77Å; L90-K174 HydrophobicContact CD1-CG 4.33Å
91	N	80.9	Confident	80.4	Confident	45 Å²	45	51.5 Å²	51.5	24%	0.241	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-68.3	137.9	162.9	-65.8	74.9	0	0	0	109.4	P93 G131 S133 Y172	N91-P93 WeakPolarHBondContact O-CD 3.2Å; N91-G131 WeakPolarHBondContact CB-O 3.21Å; N91-G131 PolarHBondContact ND2-O 3.4Å; N91-S133 PolarHBondContact ND2-OG 3.14Å; N91-S133 VanDerWaalsContact ND2-OG 3.11Å; N91-Y172 WeakPolarHBondContact O-CD1 3.46Å; N91-Y172 WeakPolarHBondContact O-CE1 3.42Å
92	C	79.1	Confident	82	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-66	124.3	166.2	-173	0	0	0	0	108.6	G131 L132 Y172 W192	C92-G131 CarbonylContact O-C 3.54Å; C92-G131 VanDerWaalsContact O-CA 3.22Å; C92-G131 WeakPolarHBondContact O-CA 3.19Å; C92-L132 VanDerWaalsContact CB-O 3.24Å; C92-L132 WeakPolarHBondContact CB-O 3.42Å; C92-L132 PolarHBondContact N-O 3.25Å; C92-Y172 HydrophobicContact CB-CD1 4.23Å; C92-Y172 HydrophobicContact CB-CD2 4.41Å; C92-Y172 HydrophobicContact CB-CG 4.17Å; C92-W192 HydrophobicContact CB-CH2 4.16Å; C92-W192 HydrophobicContact CB-CZ2 3.71Å
93	P	76.6	Confident	83.2	Confident	49 Å²	49	45.8 Å²	45.8	32%	0.318	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-67.7	142.4	172.3	29	-33.8	0	0	0	109.3	N91 S95 L96	N91-P93 WeakPolarHBondContact O-CD 3.2Å; P93-S95 PolarHBondContact O-N 3.04Å; P93-S95 VanDerWaalsContact O-N 3.16Å; P93-L96 HydrophobicContact CG-CD1 3.58Å; P93-L96 HydrophobicContact CG-CG 3.94Å; P93-L96 PolarHBondContact O-N 3.28Å
94	P	73.3	Confident	83.8	Confident	66 Å²	66	49.2 Å²	49.2	43%	0.429	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-63.6	-23.6	-176.3	24.3	-33.7	0	0	0	112.9	L96 D97	P94-L96 PolarHBondContact O-N 3.12Å; P94-L96 VanDerWaalsContact O-N 3.1Å; P94-D97 PolarHBondContact O-N 3.25Å
95	S	75.3	Confident	84.1	Confident	100 Å²	100	52 Å²	52	70%	0.699	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-66.6	-5.8	-178.8	61.7	0	0	0	0	116.2	P93	P93-S95 PolarHBondContact O-N 3.04Å; P93-S95 VanDerWaalsContact O-N 3.16Å
96	L	74.2	Confident	84.2	Confident	40 Å²	40	53.5 Å²	53.5	21%	0.209	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-102.5	-0.9	-177.7	-63	175.9	0	0	0	114	P93 P94 Y98 Y172 P238	P93-L96 HydrophobicContact CG-CD1 3.58Å; P93-L96 HydrophobicContact CG-CG 3.94Å; P93-L96 PolarHBondContact O-N 3.28Å; P94-L96 PolarHBondContact O-N 3.12Å; P94-L96 VanDerWaalsContact O-N 3.1Å; L96-Y98 HydrophobicContact CB-CD2 3.66Å; L96-Y98 HydrophobicContact CB-CE2 3.59Å; L96-Y98 HydrophobicContact CD1-CE2 3.9Å; L96-Y98 HydrophobicContact CG-CE2 4.35Å; L96-Y98 PolarHBondContact O-N 3.37Å; L96-Y172 WeakPolarHBondContact CD1-OH 3.31Å; L96-P238 HydrophobicContact CB-CG 4.29Å; L96-P238 HydrophobicContact CD2-CG 4.05Å; L96-P238 VanDerWaalsContact O-CD 3.3Å; L96-P238 WeakPolarHBondContact O-CD 3.33Å
97	D	82.6	Confident	84.4	Confident	114 Å²	114	58.2 Å²	58.2	61%	0.61	34%	0.342	S	S	*	.			trans	44.3	33.6	171.6	-82.7	-21.6	0	0	0	117.4	P94 K99 S117	P94-D97 PolarHBondContact O-N 3.25Å; D97-K99 PolarHBondContact O-N 3.06Å; D97-S117 PolarHBondContact OD1-OG 3.5Å
98	Y	86.9	Confident	84.6	Confident	5 Å²	5	56.9 Å²	56.9	2%	0.02	32%	0.32	C	S	.	.			trans	-63.4	129.5	173.2	-74.2	-78.8	0	0	0	111.3	L96 L116 S117 Y172 W192 V220 L235 Q236 P238 D241	L96-Y98 HydrophobicContact CB-CD2 3.66Å; L96-Y98 HydrophobicContact CB-CE2 3.59Å; L96-Y98 HydrophobicContact CD1-CE2 3.9Å; L96-Y98 HydrophobicContact CG-CE2 4.35Å; L96-Y98 PolarHBondContact O-N 3.37Å; Y98-L116 WeakPolarHBondContact O-CA 3.47Å; Y98-L116 WeakPolarHBondContact O-CB 3.37Å; Y98-L116 PolarHBondContact O-N 2.86Å; Y98-S117 PolarHBondContact O-N 3.42Å; Y98-S117 VanDerWaalsContact O-N 3.09Å; Y98-Y172 HydrophobicContact CE2-CE2 4.2Å; Y98-W192 AromaticContact CD1-CD1 3.61Å; Y98-W192 AromaticContact CD1-NE1 3.4Å; Y98-W192 AromaticContact CD2-NE1 3.39Å; Y98-W192 AromaticContact CE1-CD1 3.61Å; Y98-W192 AromaticContact CE1-NE1 3.76Å; Y98-W192 AromaticContact CE2-NE1 3.75Å; Y98-W192 AromaticContact CG-CD1 3.92Å; Y98-W192 AromaticContact CG-NE1 3.2Å; Y98-W192 AromaticContact CZ-CD1 3.92Å; Y98-W192 AromaticContact CZ-NE1 3.93Å; Y98-V220 HydrophobicContact CD1-CG2 4.44Å; Y98-V220 HydrophobicContact CE1-CG2 3.85Å; Y98-L235 HydrophobicContact CD1-CD1 4.04Å; Y98-L235 HydrophobicContact CD1-CD2 4.49Å; Y98-L235 HydrophobicContact CD1-CG 4.34Å; Y98-Q236 VanDerWaalsContact CA-O 3.3Å; Y98-Q236 WeakPolarHBondContact CA-O 3.4Å; Y98-P238 HydrophobicContact CE2-CG 4.45Å; Y98-D241 WeakPolarHBondContact OH-CB 3.36Å; Y98-D241 PolarHBondContact OH-OD2 3.4Å
99	K	89	Confident	84.4	Confident	74 Å²	74	57.8 Å²	57.8	32%	0.322	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	144.6	173.2	57.8	176.4	167.4	139.8	0	110.2	D97 E101 T113 V114 Q236	D97-K99 PolarHBondContact O-N 3.06Å; K99-E101 HydrophobicContact CD-CG 4.23Å; K99-E101 HydrophobicContact CG-CG 4.37Å; K99-E101 IonicContact NZ-OE1 3.66Å; K99-E101 PolarHBondContact NZ-OE1 2.88Å; K99-T113 HydrophobicContact CB-CG2 4.23Å; K99-V114 WeakPolarHBondContact CA-O 3.34Å; K99-Q236 HydrophobicContact CG-CB 3.97Å; K99-Q236 PolarHBondContact N-O 3.5Å; K99-Q236 PolarHBondContact O-N 3.32Å
100	L	90.5	Very high	84.1	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	96.1	178	-173.7	71.7	0	0	0	109.1	T113 V114 L116 F137 L224 H233 L235	L100-T113 WeakPolarHBondContact O-CA 3.3Å; L100-V114 HydrophobicContact CB-CB 4.24Å; L100-V114 PolarHBondContact N-O 3.16Å; L100-V114 PolarHBondContact O-N 3.32Å; L100-L116 HydrophobicContact CB-CD1 4.35Å; L100-F137 HydrophobicContact CD2-CE1 3.64Å; L100-F137 HydrophobicContact CD2-CE2 4.43Å; L100-F137 HydrophobicContact CD2-CZ 3.36Å; L100-L224 HydrophobicContact CD1-CD1 3.93Å; L100-H233 HydrophobicContact CD1-CB 3.86Å; L100-H233 HydrophobicContact CD2-CB 4.03Å; L100-H233 HydrophobicContact CG-CB 3.88Å; L100-L235 HydrophobicContact CD1-CB 4.31Å
101	E	91.8	Very high	83.7	Confident	18 Å²	18	66.8 Å²	66.8	8%	0.084	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	136	-176.9	-60.6	-159	147.7	0	0	111.7	K99 Q108 T113 H233 I234 Q236	K99-E101 HydrophobicContact CD-CG 4.23Å; K99-E101 HydrophobicContact CG-CG 4.37Å; K99-E101 IonicContact NZ-OE1 3.66Å; K99-E101 PolarHBondContact NZ-OE1 2.88Å; E101-Q108 PolarHBondContact OE1-NE2 2.93Å; E101-Q108 PolarHBondContact OE2-NE2 3.02Å; E101-T113 HydrophobicContact CG-CG2 4.06Å; E101-H233 CarbonylContact O-C 3.57Å; E101-H233 WeakPolarHBondContact O-CA 3.33Å; E101-I234 PolarHBondContact N-O 2.92Å; E101-I234 PolarHBondContact O-N 3.23Å; E101-Q236 VanDerWaalsContact CD-CD 3.45Å; E101-Q236 VanDerWaalsContact CD-NE2 3.27Å; E101-Q236 PolarHBondContact OE1-OE1 3.29Å; E101-Q236 PolarHBondContact OE2-NE2 3.01Å; E101-Q236 PolarHBondContact OE2-OE1 3.47Å
102	V	92.3	Very high	83.5	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.012	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.1	-175.9	-177.4	0	0	0	0	110.7	L109 C112 R231 L232	V102-L109 PolarHBondContact O-N 2.96Å; V102-C112 HydrophobicContact CB-CB 3.88Å; V102-C112 HydrophobicContact CG1-CB 4.16Å; V102-C112 HydrophobicContact CG2-CB 4.03Å; V102-C112 WeakPolarHBondContact CG2-O 3.24Å; V102-R231 HydrophobicContact CG1-CB 4.05Å; V102-R231 HydrophobicContact CG1-CG 4.34Å; V102-L232 CarbonylContact C-O 3.49Å; V102-L232 WeakPolarHBondContact CA-O 3.25Å
103	I	92.2	Very high	83.5	Confident	43 Å²	43	67.7 Å²	67.7	22%	0.221	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	131.3	177.7	-57.3	-177.3	0	0	0	109.6	L107 R231 L232 I234	I103-L107 CarbonylContact C-O 3.57Å; I103-L107 WeakPolarHBondContact CA-O 3.4Å; I103-R231 WeakPolarHBondContact O-CA 3.23Å; I103-L232 PolarHBondContact N-O 3.39Å; I103-L232 PolarHBondContact O-N 2.91Å; I103-I234 HydrophobicContact CD1-CD1 3.69Å; I103-I234 HydrophobicContact CD1-CG1 4.49Å
104	K	90.7	Very high	83.6	Confident	89 Å²	89	65.8 Å²	65.8	39%	0.387	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	122.6	175.2	-174.9	-170.4	174	-165.7	0	109.3	G106 L107 L109 R231	K104-G106 PolarHBondContact O-N 3.15Å; K104-G106 VanDerWaalsContact O-N 3.14Å; K104-L107 PolarHBondContact N-O 2.61Å; K104-L107 PolarHBondContact O-N 3.41Å; K104-L109 HydrophobicContact CB-CD1 3.72Å; K104-L109 HydrophobicContact CB-CG 4.29Å; K104-L109 HydrophobicContact CD-CD1 4.17Å; K104-R231 HydrophobicContact CB-CG 4.43Å; K104-R231 HydrophobicContact CG-CG 4.44Å
105	N	87.9	Confident	83.9	Confident	134 Å²	134	64.7 Å²	64.7	72%	0.717	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	31.2	178.8	-57.1	6.2	0	0	0	114.1
106	G	84.6	Confident	84	Confident	69 Å²	69	60 Å²	60	71%	0.711	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.2	-7.8	-177.2	0	0	0	0	0	115.5	K104	K104-G106 PolarHBondContact O-N 3.15Å; K104-G106 VanDerWaalsContact O-N 3.14Å
107	L	87.4	Confident	83.7	Confident	126 Å²	126	58.4 Å²	58.4	66%	0.66	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	131.9	172.5	-62.1	177.3	0	0	0	110.7	I103 K104	I103-L107 CarbonylContact C-O 3.57Å; I103-L107 WeakPolarHBondContact CA-O 3.4Å; K104-L107 PolarHBondContact N-O 2.61Å; K104-L107 PolarHBondContact O-N 3.41Å
108	Q	86	Confident	82.7	Confident	106 Å²	106	55.7 Å²	55.7	50%	0.495	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	128.3	170.5	-177.3	178.3	-8	0	0	109.7	E101	E101-Q108 PolarHBondContact OE1-NE2 2.93Å; E101-Q108 PolarHBondContact OE2-NE2 3.02Å
109	L	82.8	Confident	81.2	Confident	45 Å²	45	59.9 Å²	59.9	24%	0.236	34%	0.342	C	S	.	.			trans	-103.8	86	179.8	-61.6	179.5	0	0	0	109.2	V102 K104 E111 C112 T113	V102-L109 PolarHBondContact O-N 2.96Å; K104-L109 HydrophobicContact CB-CD1 3.72Å; K104-L109 HydrophobicContact CB-CG 4.29Å; K104-L109 HydrophobicContact CD-CD1 4.17Å; L109-E111 PolarHBondContact O-N 2.71Å; L109-C112 HydrophobicContact CB-CB 4.07Å; L109-C112 PolarHBondContact O-N 2.66Å; L109-T113 PolarHBondContact O-N 3.14Å
110	S	79	Confident	79.4	Confident	94 Å²	94	58.8 Å²	58.8	66%	0.657	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-53.4	-39.8	176.9	47.8	0	0	0	0	112.8	C112 T113	S110-C112 PolarHBondContact O-N 3.48Å; S110-T113 WeakPolarHBondContact O-CB 3.23Å; S110-T113 PolarHBondContact O-N 3.18Å; S110-T113 VanDerWaalsContact O-N 3.07Å
111	E	74.8	Confident	77.5	Confident	184 Å²	184	63.3 Å²	63.3	86%	0.86	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-55.9	-20.2	174	-59.9	175	173.1	0	0	114.5	L109	L109-E111 PolarHBondContact O-N 2.71Å
112	C	76.4	Confident	75.3	Confident	37 Å²	37	69.3 Å²	69.3	25%	0.25	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-112.3	-0.9	-178.7	-65.2	0	0	0	0	112.9	V102 L109 S110 V114 R231	V102-C112 HydrophobicContact CB-CB 3.88Å; V102-C112 HydrophobicContact CG1-CB 4.16Å; V102-C112 HydrophobicContact CG2-CB 4.03Å; V102-C112 WeakPolarHBondContact CG2-O 3.24Å; L109-C112 HydrophobicContact CB-CB 4.07Å; L109-C112 PolarHBondContact O-N 2.66Å; S110-C112 PolarHBondContact O-N 3.48Å; C112-V114 PolarHBondContact O-N 3.37Å; C112-R231 PolarHBondContact SG-NH1 2.73Å
113	T	78.9	Confident	72.8	Confident	26 Å²	26	76.9 Å²	76.9	16%	0.16	44%	0.439	C	S	.	.			trans	-68.7	121.7	178	-68	0	0	0	0	109.5	K99 L100 E101 L109 S110	K99-T113 HydrophobicContact CB-CG2 4.23Å; L100-T113 WeakPolarHBondContact O-CA 3.3Å; E101-T113 HydrophobicContact CG-CG2 4.06Å; L109-T113 PolarHBondContact O-N 3.14Å; S110-T113 WeakPolarHBondContact O-CB 3.23Å; S110-T113 PolarHBondContact O-N 3.18Å; S110-T113 VanDerWaalsContact O-N 3.07Å
114	V	80	Confident	70.5	Confident	9 Å²	9	81.2 Å²	81.2	6%	0.055	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	110.4	179.1	-171.9	0	0	0	0	108.5	K99 L100 C112 L116	K99-V114 WeakPolarHBondContact CA-O 3.34Å; L100-V114 HydrophobicContact CB-CB 4.24Å; L100-V114 PolarHBondContact N-O 3.16Å; L100-V114 PolarHBondContact O-N 3.32Å; C112-V114 PolarHBondContact O-N 3.37Å; V114-L116 HydrophobicContact CG1-CD2 3.9Å; V114-L116 PolarHBondContact O-N 2.76Å
115	C	78.1	Confident	67.8	Low	44 Å²	44	85.7 Å²	85.7	30%	0.297	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	121	171.5	-63.4	0	0	0	0	109	S118 L132	C115-S118 VanDerWaalsContact CB-O 3.25Å; C115-S118 WeakPolarHBondContact CB-O 3.31Å; C115-L132 WeakPolarHBondContact O-CD1 3.27Å
116	L	77.5	Confident	65.5	Low	0 Å²	0	82.5 Å²	82.5	0%	0	47%	0.473	C	S	.	.	S	Bend	trans	-99.8	-26.8	-176.9	-58.4	172.7	0	0	0	112.1	Y98 L100 V114 C135 L170 W192 L235	Y98-L116 WeakPolarHBondContact O-CA 3.47Å; Y98-L116 WeakPolarHBondContact O-CB 3.37Å; Y98-L116 PolarHBondContact O-N 2.86Å; L100-L116 HydrophobicContact CB-CD1 4.35Å; V114-L116 HydrophobicContact CG1-CD2 3.9Å; V114-L116 PolarHBondContact O-N 2.76Å; L116-C135 HydrophobicContact CD2-CB 4.11Å; L116-L170 HydrophobicContact CD1-CD2 4.05Å; L116-W192 HydrophobicContact CB-CH2 3.95Å; L116-W192 HydrophobicContact CB-CZ2 3.57Å; L116-W192 HydrophobicContact CD1-CD2 4.39Å; L116-W192 HydrophobicContact CD1-CH2 4.29Å; L116-W192 HydrophobicContact CD1-CZ2 3.95Å; L116-W192 HydrophobicContact CD2-CH2 4.27Å; L116-W192 HydrophobicContact CG-CH2 4.4Å; L116-W192 HydrophobicContact CG-CZ2 4.24Å; L116-L235 HydrophobicContact CD1-CD1 3.83Å
117	S	67.3	Low	63.2	Low	8 Å²	8	85.3 Å²	85.3	6%	0.056	48%	0.481	C	S	.	.	S	Bend	trans	-73.9	-35.5	174.2	63.1	0	0	0	0	113.5	D97 Y98	D97-S117 PolarHBondContact OD1-OG 3.5Å; Y98-S117 PolarHBondContact O-N 3.42Å; Y98-S117 VanDerWaalsContact O-N 3.09Å
118	S	62	Low	60.9	Low	56 Å²	56	82.2 Å²	82.2	39%	0.392	47%	0.47	S	S	.	.	S	Bend	trans	-134.9	135.9	-174.4	-64.5	0	0	0	0	111.2	C115 S120	C115-S118 VanDerWaalsContact CB-O 3.25Å; C115-S118 WeakPolarHBondContact CB-O 3.31Å; S118-S120 PolarHBondContact O-N 3.11Å; S118-S120 VanDerWaalsContact O-N 3.14Å
119	P	56.6	Low	59.1	Low	93 Å²	93	84.8 Å²	84.8	60%	0.604	49%	0.487	S	S	*	.			trans	-66.8	112.6	177.6	27.6	-33.5	0	0	0	110.7	D121	P119-D121 PolarHBondContact O-N 2.86Å
120	S	51.2	Low	57.9	Low	52 Å²	52	87.2 Å²	87.2	36%	0.364	50%	0.5	S	S	.	.			trans	-70.4	-17.8	180	53.3	0	0	0	0	114.3	S118 I122 Q154	S118-S120 PolarHBondContact O-N 3.11Å; S118-S120 VanDerWaalsContact O-N 3.14Å; S120-I122 PolarHBondContact O-N 3Å; S120-Q154 PolarHBondContact OG-NE2 2.73Å
121	D	50.3	Low	57.2	Low	94 Å²	94	82.9 Å²	82.9	50%	0.503	47%	0.471	S	S	.	.			trans	-93.3	99.4	-166.1	-60	-33.9	0	0	0	111.2	P119 N123 L124 Q154	P119-D121 PolarHBondContact O-N 2.86Å; D121-N123 PolarHBondContact O-N 2.95Å; D121-L124 PolarHBondContact O-N 3.46Å; D121-Q154 PolarHBondContact OD2-NE2 2.83Å
122	I	44.6	Very low	57.3	Low	144 Å²	144	74.7 Å²	74.7	74%	0.738	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-8.7	-171.5	-64.3	161.5	0	0	0	114.8	S120	S120-I122 PolarHBondContact O-N 3Å
123	N	41.4	Very low	57.5	Low	161 Å²	161	73 Å²	73	86%	0.861	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	5.5	-175.7	-68.1	-60.7	0	0	0	115.4	D121	D121-N123 PolarHBondContact O-N 2.95Å
124	L	42.6	Very low	57.9	Low	134 Å²	134	71.9 Å²	71.9	70%	0.702	41%	0.414	S	S	*	.			trans	-111.3	58.3	173.3	-100.3	163.2	0	0	0	112.2	D121 S126	D121-L124 PolarHBondContact O-N 3.46Å; L124-S126 PolarHBondContact O-N 2.99Å
125	Q	34.2	Very low	58.3	Low	183 Å²	183	71.4 Å²	71.4	86%	0.855	41%	0.411	S	S	*	.			trans	-74.7	64	171.4	-68.7	-175.4	-14.7	0	0	111.6
126	S	39.9	Very low	58.9	Low	67 Å²	67	69.6 Å²	69.6	47%	0.469	40%	0.398	S	S	.	.	S	Bend	trans	-146.5	91.6	176.2	60.2	0	0	0	0	113.1	L124 C128	L124-S126 PolarHBondContact O-N 2.99Å; S126-C128 PolarHBondContact O-N 2.86Å
127	S	37.1	Very low	59.6	Low	128 Å²	128	69.7 Å²	69.7	90%	0.895	40%	0.399	S	S	*	.	S	Bend	trans	55.5	48.5	142.2	66.6	0	0	0	0	119.5
128	C	38.8	Very low	60.7	Low	62 Å²	62	69.3 Å²	69.3	42%	0.419	40%	0.396	S	S	.	.			trans	-156.4	118.1	156	48.2	0	0	0	0	113.1	S126 N130 N152	S126-C128 PolarHBondContact O-N 2.86Å; C128-N130 HydrophobicContact CB-CB 4.35Å; C128-N130 PolarHBondContact O-N 3.44Å; C128-N152 PolarHBondContact SG-ND2 3.27Å
129	D	48.6	Very low	61.9	Low	160 Å²	160	73 Å²	73	86%	0.856	40%	0.402	S	S	*	.			trans	-75.3	18.2	172	-53.8	-67.2	0	0	0	112.9
130	N	56.6	Low	63	Low	95 Å²	95	71.6 Å²	71.6	51%	0.508	39%	0.387	S	S	.	.			trans	-98.7	109.5	-170.5	-62	-16.7	0	0	0	109.3	C128 N152	C128-N130 HydrophobicContact CB-CB 4.35Å; C128-N130 PolarHBondContact O-N 3.44Å; N130-N152 PolarHBondContact O-ND2 3.02Å
131	G	65.2	Low	63.7	Low	4 Å²	4	73.3 Å²	73.3	4%	0.041	40%	0.397	C	S	.	.			trans	-60.2	170.5	-179.6	0	0	0	0	0	113.9	N91 C92 S133	N91-G131 WeakPolarHBondContact CB-O 3.21Å; N91-G131 PolarHBondContact ND2-O 3.4Å; C92-G131 CarbonylContact O-C 3.54Å; C92-G131 VanDerWaalsContact O-CA 3.22Å; C92-G131 WeakPolarHBondContact O-CA 3.19Å; G131-S133 PolarHBondContact O-N 3.04Å
132	L	75.5	Confident	64.1	Low	12 Å²	12	74.5 Å²	74.5	6%	0.063	40%	0.399	C	S	.	.			trans	-65.5	135.5	-168.9	-69.9	165.2	0	0	0	111.7	C92 C115 N152 Q154	C92-L132 VanDerWaalsContact CB-O 3.24Å; C92-L132 WeakPolarHBondContact CB-O 3.42Å; C92-L132 PolarHBondContact N-O 3.25Å; C115-L132 WeakPolarHBondContact O-CD1 3.27Å; L132-N152 HydrophobicContact CD2-CB 4.28Å; L132-Q154 HydrophobicContact CD1-CB 4.01Å; L132-Q154 HydrophobicContact CD2-CB 3.93Å
133	S	82	Confident	64.6	Low	0 Å²	0	74.2 Å²	74.2	0%	0	40%	0.399	C	S	.	.	S	Bend	trans	-88.4	-40	175.4	-44.8	0	0	0	0	111.2	L90 N91 G131 N152 Q171 Y172	L90-S133 WeakPolarHBondContact O-CA 3.48Å; N91-S133 PolarHBondContact ND2-OG 3.14Å; N91-S133 VanDerWaalsContact ND2-OG 3.11Å; G131-S133 PolarHBondContact O-N 3.04Å; S133-N152 WeakPolarHBondContact CB-O 3.41Å; S133-N152 PolarHBondContact N-O 3.34Å; S133-N152 PolarHBondContact OG-N 2.84Å; S133-Q171 PolarHBondContact O-NE2 3.33Å; S133-Y172 PolarHBondContact O-N 3.48Å
134	Y	87.2	Confident	65.2	Low	3 Å²	3	71.6 Å²	71.6	1%	0.012	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	150.3	-178.2	68.1	-80.5	0	0	0	113.7	Y83 L136 Y145 M151 N152 G153 Q154 V169 L170	Y83-Y134 HydrophobicContact CD1-CD2 4.07Å; Y83-Y134 HydrophobicContact CD1-CE2 4.1Å; Y83-Y134 HydrophobicContact CE1-CD2 4.07Å; Y83-Y134 HydrophobicContact CE1-CG 4.29Å; Y134-L136 HydrophobicContact CD2-CD1 4.48Å; Y134-L136 HydrophobicContact CD2-CG 4.04Å; Y134-L136 HydrophobicContact CE2-CD1 3.97Å; Y134-L136 HydrophobicContact CE2-CG 4.03Å; Y134-Y145 PolarHBondContact OH-O 2.9Å; Y134-Y145 VanDerWaalsContact OH-O 3.11Å; Y134-M151 HydrophobicContact CE1-CB 4.49Å; Y134-N152 PolarHBondContact N-O 3.48Å; Y134-G153 WeakPolarHBondContact O-CA 3.47Å; Y134-Q154 PolarHBondContact O-N 2.75Å; Y134-V169 HydrophobicContact CD2-CG2 4.36Å; Y134-L170 CarbonylContact C-O 3.52Å; Y134-L170 VanDerWaalsContact CA-O 3.27Å; Y134-L170 WeakPolarHBondContact CA-O 3.35Å
135	C	88.7	Confident	65.8	Low	0 Å²	0	68.2 Å²	68.2	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	124.2	171.8	-169.1	0	0	0	0	110.3	L116 F137 Q154 V169 L170	L116-C135 HydrophobicContact CD2-CB 4.11Å; C135-F137 HydrophobicContact CB-CE2 4.05Å; C135-F137 HydrophobicContact CB-CZ 4.11Å; C135-F137 VanDerWaalsContact SG-CZ 3.5Å; C135-Q154 CarbonylContact C-O 3.55Å; C135-Q154 WeakPolarHBondContact CA-O 3.16Å; C135-V169 WeakPolarHBondContact O-CA 3.46Å; C135-L170 HydrophobicContact CB-CB 4.46Å; C135-L170 PolarHBondContact N-O 3.18Å; C135-L170 PolarHBondContact O-N 2.9Å
136	L	89.5	Confident	66.7	Low	6 Å²	6	60.9 Å²	60.9	3%	0.031	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	129.6	174.7	-71.6	171.2	0	0	0	110.2	Y83 Y134 Y145 Q154 C155 S156 V169 L197	Y83-L136 HydrophobicContact CD1-CD2 4.39Å; Y83-L136 HydrophobicContact CG-CD2 4.32Å; Y134-L136 HydrophobicContact CD2-CD1 4.48Å; Y134-L136 HydrophobicContact CD2-CG 4.04Å; Y134-L136 HydrophobicContact CE2-CD1 3.97Å; Y134-L136 HydrophobicContact CE2-CG 4.03Å; L136-Y145 HydrophobicContact CD1-CD2 4.1Å; L136-Q154 PolarHBondContact N-O 3.41Å; L136-C155 CarbonylContact O-C 3.5Å; L136-C155 WeakPolarHBondContact O-CA 3.45Å; L136-S156 PolarHBondContact O-N 3.09Å; L136-V169 HydrophobicContact CD2-CB 3.84Å; L136-V169 HydrophobicContact CD2-CG2 3.72Å; L136-L197 HydrophobicContact CD2-CD1 4.31Å
137	F	91.7	Very high	67.2	Low	1 Å²	1	65.4 Å²	65.4	0%	0.004	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.2	174.4	-62.9	-80.7	0	0	0	110	L100 C135 L158 H167 A168 L170 F226	L100-F137 HydrophobicContact CD2-CE1 3.64Å; L100-F137 HydrophobicContact CD2-CE2 4.43Å; L100-F137 HydrophobicContact CD2-CZ 3.36Å; C135-F137 HydrophobicContact CB-CE2 4.05Å; C135-F137 HydrophobicContact CB-CZ 4.11Å; C135-F137 VanDerWaalsContact SG-CZ 3.5Å; F137-L158 HydrophobicContact CB-CD1 4.03Å; F137-L158 HydrophobicContact CD1-CD1 3.99Å; F137-L158 HydrophobicContact CD1-CG 4.46Å; F137-L158 HydrophobicContact CG-CD1 4.44Å; F137-H167 WeakPolarHBondContact O-CA 3.33Å; F137-H167 WeakPolarHBondContact O-CB 3Å; F137-H167 PolarHBondContact O-N 2.92Å; F137-A168 PolarHBondContact N-O 3.04Å; F137-A168 PolarHBondContact O-N 2.96Å; F137-L170 HydrophobicContact CE2-CB 3.82Å; F137-L170 HydrophobicContact CE2-CD2 4.46Å; F137-F226 HydrophobicContact CB-CD2 4.49Å; F137-F226 HydrophobicContact CB-CE1 4.33Å; F137-F226 HydrophobicContact CB-CE2 4.21Å; F137-F226 HydrophobicContact CB-CZ 4.12Å; F137-F226 HydrophobicContact CD1-CD2 4.34Å; F137-F226 AromaticContact CD1-CE2 3.59Å; F137-F226 HydrophobicContact CD1-CE2 3.59Å; F137-F226 AromaticContact CD1-CZ 3.9Å; F137-F226 HydrophobicContact CD1-CZ 3.9Å; F137-F226 HydrophobicContact CD2-CE1 4.23Å; F137-F226 HydrophobicContact CD2-CE2 4.21Å; F137-F226 AromaticContact CD2-CZ 3.64Å; F137-F226 HydrophobicContact CD2-CZ 3.64Å; F137-F226 HydrophobicContact CE1-CE2 4.03Å; F137-F226 HydrophobicContact CE1-CZ 4.29Å; F137-F226 HydrophobicContact CE2-CZ 4.06Å; F137-F226 HydrophobicContact CG-CD2 4.42Å; F137-F226 HydrophobicContact CG-CE1 4.21Å; F137-F226 AromaticContact CG-CE2 3.7Å; F137-F226 HydrophobicContact CG-CE2 3.7Å; F137-F226 AromaticContact CG-CZ 3.56Å; F137-F226 HydrophobicContact CG-CZ 3.56Å; F137-F226 HydrophobicContact CZ-CZ 4.38Å
138	G	90.2	Very high	67.7	Low	1 Å²	1	63.5 Å²	63.5	1%	0.01	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.7	-178.7	-174.7	0	0	0	0	0	114.1	S156 V157 L158 R165	G138-S156 PolarHBondContact N-O 3.06Å; G138-V157 WeakPolarHBondContact O-CA 3.13Å; G138-L158 PolarHBondContact O-N 2.97Å; G138-R165 CarbonylContact C-O 3.34Å; G138-R165 WeakPolarHBondContact CA-O 3.35Å
139	R	88.4	Confident	68.4	Low	133 Å²	133	64.9 Å²	64.9	50%	0.502	36%	0.359	S	S	.	.	S	Bend	trans	-91.7	-10.8	177.4	-76.6	174.4	65	179.9	-4.4	114.4	L158 H160 P161 I163 S164 R165	R139-L158 WeakPolarHBondContact CG-O 3.49Å; R139-H160 WeakPolarHBondContact CD-O 3.39Å; R139-P161 PolarHBondContact NH1-O 3.15Å; R139-P161 VanDerWaalsContact NH1-O 3.09Å; R139-I163 WeakPolarHBondContact CD-O 3.41Å; R139-I163 HydrophobicContact CG-CB 4.22Å; R139-I163 HydrophobicContact CG-CG2 4.2Å; R139-S164 PolarHBondContact N-O 3.09Å; R139-S164 VanDerWaalsContact N-O 3.12Å; R139-R165 PolarHBondContact N-O 3.44Å; R139-R165 VanDerWaalsContact N-O 3.09Å
140	Q	79.9	Confident	68.9	Low	63 Å²	63	62.1 Å²	62.1	29%	0.294	35%	0.348	S	S	.	.			trans	-108	123.7	-171.9	-174.5	166.2	-18.3	0	0	111	Q142 C155	Q140-Q142 VanDerWaalsContact C-N 3.31Å; Q140-Q142 HydrophobicContact CG-CB 4.44Å; Q140-Q142 PolarHBondContact O-N 2.83Å; Q140-C155 PolarHBondContact O-SG 2.74Å; Q140-C155 VanDerWaalsContact O-SG 3.36Å
141	P	65.9	Low	69.2	Low	88 Å²	88	59.6 Å²	59.6	57%	0.571	33%	0.334	S	S	*	.			trans	-81.9	4.2	-172	32.8	-37.5	0	0	0	115.5	V157	P141-V157 HydrophobicContact CB-CG2 3.77Å
142	Q	59.2	Low	69.5	Low	119 Å²	119	62 Å²	62	56%	0.556	35%	0.346	S	S	*	.			trans	-99.7	115.8	-161.3	-74.6	174.8	-34.3	0	0	114	Q140	Q140-Q142 VanDerWaalsContact C-N 3.31Å; Q140-Q142 HydrophobicContact CG-CB 4.44Å; Q140-Q142 PolarHBondContact O-N 2.83Å
143	L	54.8	Low	69.4	Low	139 Å²	139	62 Å²	62	73%	0.728	35%	0.35	S	S	*	.			trans	38.3	112.2	155.3	-87.8	66.3	0	0	0	119.4	Y145	L143-Y145 PolarHBondContact O-N 3.48Å
144	N	52.6	Low	69.3	Low	106 Å²	106	63.2 Å²	63.2	57%	0.567	36%	0.355	S	S	*	.			trans	30.2	68.4	132.3	-59.1	20.6	0	0	0	116.5	A146	N144-A146 VanDerWaalsContact C-N 3.29Å; N144-A146 PolarHBondContact O-N 2.97Å
145	Y	56.4	Low	69	Low	62 Å²	62	65 Å²	65	24%	0.243	37%	0.367	C	S	.	.			trans	-69.7	88.3	164.7	-62.9	-70.8	0	0	0	110.1	I82 Y83 Y134 L136 L143 L166	I82-Y145 HydrophobicContact CB-CD1 4.38Å; I82-Y145 HydrophobicContact CG1-CD1 4.13Å; I82-Y145 HydrophobicContact CG2-CD1 4.33Å; Y83-Y145 CarbonylContact O-C 3.59Å; Y134-Y145 PolarHBondContact OH-O 2.9Å; Y134-Y145 VanDerWaalsContact OH-O 3.11Å; L136-Y145 HydrophobicContact CD1-CD2 4.1Å; L143-Y145 PolarHBondContact O-N 3.48Å; Y145-L166 HydrophobicContact CD2-CD2 4.46Å; Y145-L166 HydrophobicContact CE2-CD2 4.3Å
146	A	52.6	Low	68.9	Low	30 Å²	30	65.8 Å²	65.8	25%	0.248	37%	0.373	C	S	.	.			trans	-155.4	115	162.8	0	0	0	0	0	108.3	N144 S148	N144-A146 VanDerWaalsContact C-N 3.29Å; N144-A146 PolarHBondContact O-N 2.97Å; A146-S148 PolarHBondContact O-N 3.33Å
147	Q	51.1	Low	68.8	Low	161 Å²	161	69 Å²	69	75%	0.752	39%	0.393	S	S	*	.	S	Bend	trans	-78.2	19.2	-178.8	-71.1	179.7	-48.5	0	0	113.8	I82	I82-Q147 HydrophobicContact CD1-CG 4.31Å; I82-Q147 HydrophobicContact CG2-CG 4.26Å
148	S	47.1	Very low	68.6	Low	89 Å²	89	69.3 Å²	69.3	62%	0.622	39%	0.394	S	S	*	.	S	Bend	trans	-152.5	130.2	173.2	-157.1	0	0	0	0	110.3	A146 T150	A146-S148 PolarHBondContact O-N 3.33Å; S148-T150 VanDerWaalsContact C-N 3.29Å; S148-T150 PolarHBondContact O-N 3.5Å
149	G	52.8	Low	68.4	Low	91 Å²	91	73.2 Å²	73.2	94%	0.938	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	53.6	-164.5	0	0	0	0	0	115.6
150	T	58.8	Low	68.4	Low	102 Å²	102	69.3 Å²	69.3	63%	0.626	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	-30	-175.4	-43.8	0	0	0	0	114	S148	S148-T150 VanDerWaalsContact C-N 3.29Å; S148-T150 PolarHBondContact O-N 3.5Å
151	M	64.3	Low	68.9	Low	41 Å²	41	71.1 Å²	71.1	20%	0.202	43%	0.431	C	S	.	.	S	Bend	trans	-119.2	128.5	-168	-52.6	-54.5	-84	0	0	112.2	P85 A89 Y134	P85-M151 HydrophobicContact CG-CG 4.37Å; A89-M151 HydrophobicContact CB-CE 3.95Å; A89-M151 WeakPolarHBondContact O-CE 3.5Å; Y134-M151 HydrophobicContact CE1-CB 4.49Å
152	N	70.5	Confident	70.2	Confident	54 Å²	54	67.8 Å²	67.8	29%	0.289	41%	0.41	S	S	.	.			trans	-79.8	122.5	-178.8	-75.9	-18.6	0	0	0	110.9	C128 N130 L132 S133 Y134	C128-N152 PolarHBondContact SG-ND2 3.27Å; N130-N152 PolarHBondContact O-ND2 3.02Å; L132-N152 HydrophobicContact CD2-CB 4.28Å; S133-N152 WeakPolarHBondContact CB-O 3.41Å; S133-N152 PolarHBondContact N-O 3.34Å; S133-N152 PolarHBondContact OG-N 2.84Å; Y134-N152 PolarHBondContact N-O 3.48Å
153	G	74.1	Confident	71.8	Confident	14 Å²	14	62.3 Å²	62.3	14%	0.144	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	145.8	178.1	0	0	0	0	0	112.6	Y134	Y134-G153 WeakPolarHBondContact O-CA 3.47Å
154	Q	79.5	Confident	73.5	Confident	25 Å²	25	56.9 Å²	56.9	12%	0.117	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	146.5	173	-162.4	-179.2	23	0	0	110.4	S120 D121 L132 Y134 C135 L136	S120-Q154 PolarHBondContact OG-NE2 2.73Å; D121-Q154 PolarHBondContact OD2-NE2 2.83Å; L132-Q154 HydrophobicContact CD1-CB 4.01Å; L132-Q154 HydrophobicContact CD2-CB 3.93Å; Y134-Q154 PolarHBondContact O-N 2.75Å; C135-Q154 CarbonylContact C-O 3.55Å; C135-Q154 WeakPolarHBondContact CA-O 3.16Å; L136-Q154 PolarHBondContact N-O 3.41Å
155	C	81.7	Confident	75.3	Confident	40 Å²	40	60.7 Å²	60.7	27%	0.27	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	117.8	173.9	-171	0	0	0	0	110.6	L136 Q140	L136-C155 CarbonylContact O-C 3.5Å; L136-C155 WeakPolarHBondContact O-CA 3.45Å; Q140-C155 PolarHBondContact O-SG 2.74Å; Q140-C155 VanDerWaalsContact O-SG 3.36Å
156	S	85	Confident	76.8	Confident	17 Å²	17	59.5 Å²	59.5	12%	0.119	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	115.2	176	-172.6	0	0	0	0	110.4	L136 G138 L158	L136-S156 PolarHBondContact O-N 3.09Å; G138-S156 PolarHBondContact N-O 3.06Å; S156-L158 PolarHBondContact O-N 3.43Å
157	V	87.7	Confident	78.6	Confident	73 Å²	73	58 Å²	58	44%	0.442	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	106.1	-168.4	-173.2	0	0	0	0	111	G138 P141	G138-V157 WeakPolarHBondContact O-CA 3.13Å; P141-V157 HydrophobicContact CB-CG2 3.77Å
158	L	88.2	Confident	80.6	Confident	7 Å²	7	50.4 Å²	50.4	4%	0.037	31%	0.314	C	S	.	.			trans	-101.2	98.5	-173.8	-57.8	-177	0	0	0	111.7	F137 G138 R139 S156 H160 I163 F226	F137-L158 HydrophobicContact CB-CD1 4.03Å; F137-L158 HydrophobicContact CD1-CD1 3.99Å; F137-L158 HydrophobicContact CD1-CG 4.46Å; F137-L158 HydrophobicContact CG-CD1 4.44Å; G138-L158 PolarHBondContact O-N 2.97Å; R139-L158 WeakPolarHBondContact CG-O 3.49Å; S156-L158 PolarHBondContact O-N 3.43Å; L158-H160 VanDerWaalsContact C-N 3.34Å; L158-H160 PolarHBondContact O-N 2.81Å; L158-I163 HydrophobicContact CB-CD1 3.51Å; L158-I163 HydrophobicContact CB-CG2 4.39Å; L158-I163 HydrophobicContact CD1-CD1 3.85Å; L158-I163 HydrophobicContact CG-CD1 4.36Å; L158-F226 HydrophobicContact CD1-CB 4.07Å; L158-F226 HydrophobicContact CD1-CD2 3.32Å; L158-F226 HydrophobicContact CD1-CE2 4Å; L158-F226 HydrophobicContact CD1-CG 3.92Å
159	A	84.8	Confident	82.7	Confident	84 Å²	84	46.1 Å²	46.1	69%	0.694	29%	0.285	S	S	*	.			trans	-71.2	80.1	176.6	0	0	0	0	0	112.7
160	H	89.1	Confident	84.6	Confident	50 Å²	50	41.9 Å²	41.9	23%	0.231	24%	0.24	C	C	.	.			trans	-145.5	137.1	169.8	-162.7	-102	0	0	0	111	R139 L158 S162 I163 G228	R139-H160 WeakPolarHBondContact CD-O 3.39Å; L158-H160 VanDerWaalsContact C-N 3.34Å; L158-H160 PolarHBondContact O-N 2.81Å; H160-S162 VanDerWaalsContact C-N 3.33Å; H160-S162 PolarHBondContact CE1-OG 3.47Å; H160-S162 PolarHBondContact ND1-OG 2.78Å; H160-S162 PolarHBondContact O-N 3.38Å; H160-I163 HydrophobicContact CB-CD1 3.8Å; H160-I163 HydrophobicContact CB-CG1 4.04Å; H160-I163 PolarHBondContact O-N 3.25Å; H160-G228 PolarHBondContact CE1-O 3.2Å; H160-G228 VanDerWaalsContact CE1-O 3.23Å
161	P	91.5	Very high	86.1	Confident	102 Å²	102	37 Å²	37	66%	0.662	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-34.1	-173.9	23	-34.2	0	0	0	114	R139 I163	R139-P161 PolarHBondContact NH1-O 3.15Å; R139-P161 VanDerWaalsContact NH1-O 3.09Å; P161-I163 VanDerWaalsContact C-N 3.26Å; P161-I163 PolarHBondContact O-N 3.48Å
162	S	93	Very high	87.4	Confident	17 Å²	17	35.3 Å²	35.3	12%	0.119	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	19.1	179.3	64	0	0	0	0	114.8	H160 H201 G228	H160-S162 VanDerWaalsContact C-N 3.33Å; H160-S162 PolarHBondContact CE1-OG 3.47Å; H160-S162 PolarHBondContact ND1-OG 2.78Å; H160-S162 PolarHBondContact O-N 3.38Å; S162-H201 WeakPolarHBondContact CB-CD2 3.47Å; S162-H201 WeakPolarHBondContact CB-NE2 3.22Å; S162-H201 PolarHBondContact O-CD2 2.71Å; S162-G228 WeakPolarHBondContact OG-CA 3.32Å; S162-G228 PolarHBondContact OG-N 2.74Å; S162-G228 VanDerWaalsContact OG-N 3.16Å
163	I	92.8	Very high	88.1	Confident	4 Å²	4	32.8 Å²	32.8	2%	0.021	19%	0.188	C	C	.	.	S	Bend	trans	-103.1	142.7	167.3	-66	178.6	0	0	0	107.7	R139 L158 H160 P161 H167 F226	R139-I163 WeakPolarHBondContact CD-O 3.41Å; R139-I163 HydrophobicContact CG-CB 4.22Å; R139-I163 HydrophobicContact CG-CG2 4.2Å; L158-I163 HydrophobicContact CB-CD1 3.51Å; L158-I163 HydrophobicContact CB-CG2 4.39Å; L158-I163 HydrophobicContact CD1-CD1 3.85Å; L158-I163 HydrophobicContact CG-CD1 4.36Å; H160-I163 HydrophobicContact CB-CD1 3.8Å; H160-I163 HydrophobicContact CB-CG1 4.04Å; H160-I163 PolarHBondContact O-N 3.25Å; P161-I163 VanDerWaalsContact C-N 3.26Å; P161-I163 PolarHBondContact O-N 3.48Å; I163-H167 HydrophobicContact CG2-CB 3.7Å; I163-F226 HydrophobicContact CD1-CB 3.94Å; I163-F226 HydrophobicContact CG1-CB 4.29Å
164	S	90.9	Very high	88.6	Confident	25 Å²	25	36.8 Å²	36.8	18%	0.175	20%	0.202	C	C	.	.			trans	-75.2	171.8	178.5	-69.2	0	0	0	0	111.6	R139 L166 S199	R139-S164 PolarHBondContact N-O 3.09Å; R139-S164 VanDerWaalsContact N-O 3.12Å; S164-L166 WeakPolarHBondContact CB-O 3.29Å; S164-S199 PolarHBondContact OG-OG 3.29Å
165	R	88.6	Confident	88.6	Confident	187 Å²	187	36.5 Å²	36.5	71%	0.706	20%	0.202	S	C	*	.	S	Bend	trans	-61.2	-49.3	172.1	-68.8	-175	-173.6	165.2	1.7	110.9	G138 R139	G138-R165 CarbonylContact C-O 3.34Å; G138-R165 WeakPolarHBondContact CA-O 3.35Å; R139-R165 PolarHBondContact N-O 3.44Å; R139-R165 VanDerWaalsContact N-O 3.09Å
166	L	88.5	Confident	88.3	Confident	36 Å²	36	37.7 Å²	37.7	19%	0.188	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	127.1	159.3	-59.9	172.8	0	0	0	106.7	N81 Y145 S164 L197	N81-L166 HydrophobicContact CB-CD1 4.25Å; N81-L166 WeakPolarHBondContact O-CD1 3.47Å; Y145-L166 HydrophobicContact CD2-CD2 4.46Å; Y145-L166 HydrophobicContact CE2-CD2 4.3Å; S164-L166 WeakPolarHBondContact CB-O 3.29Å; L166-L197 HydrophobicContact CB-CD1 4.09Å
167	H	91.1	Very high	87.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	-47.1	-174.6	-179.6	98	0	0	0	112.1	F137 I163 L197 S199 G202 T203 F226 G227	F137-H167 WeakPolarHBondContact O-CA 3.33Å; F137-H167 WeakPolarHBondContact O-CB 3Å; F137-H167 PolarHBondContact O-N 2.92Å; I163-H167 HydrophobicContact CG2-CB 3.7Å; H167-L197 PolarHBondContact O-N 3.13Å; H167-S199 PolarHBondContact CE1-OG 2.85Å; H167-S199 VanDerWaalsContact CE1-OG 3.22Å; H167-S199 VanDerWaalsContact ND1-CB 3.3Å; H167-S199 WeakPolarHBondContact ND1-CB 3.21Å; H167-S199 PolarHBondContact ND1-OG 3.46Å; H167-G202 PolarHBondContact CE1-O 3.23Å; H167-G202 PolarHBondContact NE2-O 3.44Å; H167-T203 PolarHBondContact CD2-OG1 2.98Å; H167-T203 PolarHBondContact NE2-OG1 3.41Å; H167-F226 AromaticContact CD2-CD1 3.42Å; H167-F226 VanDerWaalsContact CD2-CD1 3.42Å; H167-F226 WeakPolarHBondContact CD2-CD1 3.3Å; H167-F226 AromaticContact CD2-CG 3.86Å; H167-F226 VanDerWaalsContact NE2-CA 3.31Å; H167-F226 WeakPolarHBondContact NE2-CA 3.49Å; H167-F226 WeakPolarHBondContact NE2-CB 3.5Å; H167-F226 AromaticContact NE2-CD1 3.62Å; H167-F226 AromaticContact NE2-CG 3.96Å; H167-G227 PolarHBondContact CE1-N 3.02Å; H167-G227 PolarHBondContact NE2-N 3.45Å
168	A	93	Very high	86.1	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	161.1	176.4	0	0	0	0	0	111	F137 L194 K195 F226	F137-A168 PolarHBondContact N-O 3.04Å; F137-A168 PolarHBondContact O-N 2.96Å; A168-L194 HydrophobicContact CB-CD1 3.85Å; A168-K195 CarbonylContact C-O 3.58Å; A168-K195 VanDerWaalsContact CA-O 3.3Å; A168-K195 WeakPolarHBondContact CA-O 3.46Å; A168-F226 HydrophobicContact CB-CD1 4.21Å; A168-F226 HydrophobicContact CB-CE1 3.84Å
169	V	91.5	Very high	84.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	131.9	173.5	63.5	0	0	0	0	110.5	Y83 Y134 C135 L136 L194 K195 L197	Y83-V169 HydrophobicContact CD1-CG2 4.15Å; Y83-V169 HydrophobicContact CD2-CG1 4.24Å; Y83-V169 HydrophobicContact CE1-CG2 3.69Å; Y83-V169 HydrophobicContact CE2-CB 4.34Å; Y83-V169 HydrophobicContact CE2-CG1 3.67Å; Y83-V169 HydrophobicContact CE2-CG2 4.16Å; Y134-V169 HydrophobicContact CD2-CG2 4.36Å; C135-V169 WeakPolarHBondContact O-CA 3.46Å; L136-V169 HydrophobicContact CD2-CB 3.84Å; L136-V169 HydrophobicContact CD2-CG2 3.72Å; V169-L194 WeakPolarHBondContact O-CA 3.45Å; V169-L194 WeakPolarHBondContact O-CD1 3.46Å; V169-K195 HydrophobicContact CG1-CB 3.94Å; V169-K195 HydrophobicContact CG1-CG 4.37Å; V169-K195 PolarHBondContact N-O 2.76Å; V169-K195 PolarHBondContact O-N 2.9Å; V169-L197 HydrophobicContact CB-CD1 4.25Å; V169-L197 HydrophobicContact CG1-CD1 4.41Å; V169-L197 HydrophobicContact CG1-CD2 4Å; V169-L197 HydrophobicContact CG1-CG 4.26Å
170	L	92.5	Very high	83.6	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	111.7	174.6	-171.9	72.4	0	0	0	107.8	L116 Y134 C135 F137 W192 L194 I218	L116-L170 HydrophobicContact CD1-CD2 4.05Å; Y134-L170 CarbonylContact C-O 3.52Å; Y134-L170 VanDerWaalsContact CA-O 3.27Å; Y134-L170 WeakPolarHBondContact CA-O 3.35Å; C135-L170 HydrophobicContact CB-CB 4.46Å; C135-L170 PolarHBondContact N-O 3.18Å; C135-L170 PolarHBondContact O-N 2.9Å; F137-L170 HydrophobicContact CE2-CB 3.82Å; F137-L170 HydrophobicContact CE2-CD2 4.46Å; L170-W192 HydrophobicContact CD1-CB 4.06Å; L170-W192 HydrophobicContact CD2-CD2 4.43Å; L170-W192 HydrophobicContact CD2-CE3 4.12Å; L170-W192 HydrophobicContact CG-CB 4.33Å; L170-W192 HydrophobicContact CG-CD2 4.35Å; L170-W192 HydrophobicContact CG-CE3 3.76Å; L170-W192 HydrophobicContact CG-CZ3 4.45Å; L170-L194 HydrophobicContact CB-CD1 4.24Å; L170-L194 HydrophobicContact CD1-CB 3.86Å; L170-L194 HydrophobicContact CD1-CD1 4.18Å; L170-L194 HydrophobicContact CD1-CG 4.5Å; L170-I218 HydrophobicContact CD1-CG1 4.09Å
171	Q	90.6	Very high	82	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130	-172.1	175.1	62.8	70.2	0	0	110	Y83 P86 W88 S133 Y193 Y215	Y83-Q171 PolarHBondContact OH-OE1 2.89Å; P86-Q171 HydrophobicContact CG-CG 3.98Å; W88-Q171 HydrophobicContact CH2-CB 4.45Å; W88-Q171 HydrophobicContact CH2-CG 3.93Å; W88-Q171 HydrophobicContact CZ3-CG 3.78Å; S133-Q171 PolarHBondContact O-NE2 3.33Å; Q171-Y193 PolarHBondContact N-O 3.31Å; Q171-Y193 PolarHBondContact O-N 3.26Å; Q171-Y215 HydrophobicContact CB-CE1 4.18Å
172	Y	90.5	Very high	80.3	Confident	6 Å²	6	49 Å²	49	2%	0.024	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	143	171.2	-170.3	-102.9	0	0	0	111.1	L90 N91 C92 L96 Y98 S133 T190 G191 W192	L90-Y172 HydrophobicContact CB-CD1 3.99Å; L90-Y172 HydrophobicContact CB-CE1 4.32Å; L90-Y172 PolarHBondContact N-O 2.77Å; N91-Y172 WeakPolarHBondContact O-CD1 3.46Å; N91-Y172 WeakPolarHBondContact O-CE1 3.42Å; C92-Y172 HydrophobicContact CB-CD1 4.23Å; C92-Y172 HydrophobicContact CB-CD2 4.41Å; C92-Y172 HydrophobicContact CB-CG 4.17Å; L96-Y172 WeakPolarHBondContact CD1-OH 3.31Å; Y98-Y172 HydrophobicContact CE2-CE2 4.2Å; S133-Y172 PolarHBondContact O-N 3.48Å; Y172-T190 WeakPolarHBondContact OH-CB 3.38Å; Y172-G191 WeakPolarHBondContact CA-O 3.5Å; Y172-W192 AromaticContact CD2-CD2 3.88Å; Y172-W192 HydrophobicContact CD2-CD2 3.88Å; Y172-W192 AromaticContact CD2-CE2 3.66Å; Y172-W192 HydrophobicContact CD2-CE3 4.44Å; Y172-W192 HydrophobicContact CD2-CG 4.14Å; Y172-W192 HydrophobicContact CD2-CZ2 4.06Å; Y172-W192 AromaticContact CD2-NE1 3.74Å; Y172-W192 HydrophobicContact CG-CD2 4.48Å; Y172-W192 HydrophobicContact CG-CZ2 4.35Å
173	G	86.7	Confident	78.4	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.5	-159.8	173.7	0	0	0	0	0	115.5	W88 G191	W88-G173 WeakPolarHBondContact O-CA 3.2Å; G173-G191 PolarHBondContact N-O 3.42Å; G173-G191 VanDerWaalsContact N-O 3.08Å; G173-G191 PolarHBondContact O-N 3.47Å
174	K	83.9	Confident	76.5	Confident	98 Å²	98	58.4 Å²	58.4	43%	0.426	31%	0.306	S	S	.	.			trans	-128.5	85.2	176.3	-72.8	-162.9	171.8	-148.6	0	111.1	W88 L90 D188 T190	W88-K174 VanDerWaalsContact CB-O 3.32Å; W88-K174 WeakPolarHBondContact CB-O 3.44Å; W88-K174 PolarHBondContact O-N 3Å; L90-K174 HydrophobicContact CD1-CG 4.33Å; K174-D188 WeakPolarHBondContact CE-O 3.41Å; K174-D188 PolarHBondContact NZ-O 3.22Å; K174-D188 IonicContact NZ-OD1 3.61Å; K174-T190 HydrophobicContact CD-CG2 4.2Å; K174-T190 VanDerWaalsContact CE-CG2 3.44Å; K174-T190 HydrophobicContact CG-CG2 3.8Å
175	P	79.7	Confident	74.6	Confident	20 Å²	20	64.6 Å²	64.6	13%	0.13	34%	0.337	C	S	.	.			trans	-64.6	142.7	-179.3	25.8	-33	0	0	0	112.1	W88 V179 Y193	W88-P175 HydrophobicContact CD2-CB 3.82Å; W88-P175 HydrophobicContact CE3-CB 4.11Å; W88-P175 HydrophobicContact CG-CB 4.3Å; W88-P175 HydrophobicContact CH2-CB 4.28Å; W88-P175 HydrophobicContact CZ2-CB 3.96Å; W88-P175 HydrophobicContact CZ3-CB 4.34Å; W88-P175 HydrophobicContact CZ3-CG 4.48Å; P175-V179 HydrophobicContact CB-CB 4.27Å; P175-V179 HydrophobicContact CB-CG1 4.4Å; P175-Y193 VanDerWaalsContact CD-CZ 3.42Å; P175-Y193 HydrophobicContact CG-CD1 4.04Å; P175-Y193 HydrophobicContact CG-CD2 4.17Å; P175-Y193 HydrophobicContact CG-CE1 3.5Å; P175-Y193 HydrophobicContact CG-CE2 3.68Å; P175-Y193 HydrophobicContact CG-CG 4.35Å
176	P	74	Confident	73.1	Confident	65 Å²	65	58.2 Å²	58.2	42%	0.422	32%	0.315	S	S	.	.			trans	-66.6	154.1	170.3	30	-34.2	0	0	0	110.4	W88 S178 V179	W88-P176 VanDerWaalsContact CD1-CD 3.44Å; P176-S178 PolarHBondContact O-N 2.85Å; P176-V179 HydrophobicContact CG-CG2 3.9Å; P176-V179 PolarHBondContact O-N 2.76Å
177	H	63.7	Low	71.3	Confident	141 Å²	141	61.5 Å²	61.5	65%	0.653	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-17.4	-171.3	-53.4	-51.8	0	0	0	115.6
178	S	63.1	Low	69.7	Low	111 Å²	111	67.4 Å²	67.4	78%	0.776	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-15.9	178	53.9	0	0	0	0	115.2	P176	P176-S178 PolarHBondContact O-N 2.85Å
179	V	64.6	Low	68.4	Low	52 Å²	52	70.1 Å²	70.1	32%	0.315	38%	0.376	S	S	.	.	S	Bend	trans	-95.8	-17.5	-166.9	175.2	0	0	0	0	113.8	W88 P175 P176 Y215	W88-V179 HydrophobicContact CZ2-CG1 4.22Å; P175-V179 HydrophobicContact CB-CB 4.27Å; P175-V179 HydrophobicContact CB-CG1 4.4Å; P176-V179 HydrophobicContact CG-CG2 3.9Å; P176-V179 PolarHBondContact O-N 2.76Å; V179-Y215 HydrophobicContact CG1-CD2 3.81Å
180	G	56.5	Low	67.9	Low	21 Å²	21	72.6 Å²	72.6	22%	0.216	39%	0.392	C	S	.	.	S	Bend	trans	-151.3	151.1	177.5	0	0	0	0	0	112.7	V182	G180-V182 PolarHBondContact O-N 3.19Å
181	H	54.8	Low	67.6	Low	203 Å²	203	72.6 Å²	72.6	94%	0.94	39%	0.391	S	S	*	.			trans	-71.6	72.2	167.2	-77.5	-78.1	0	0	0	109.9
182	V	56.1	Low	67.6	Low	43 Å²	43	72.6 Å²	72.6	26%	0.261	39%	0.391	S	S	.	.			trans	-79.7	132.3	164.3	179.6	0	0	0	0	106.7	G180 E186 Y193	G180-V182 PolarHBondContact O-N 3.19Å; V182-E186 HydrophobicContact CG1-CB 3.61Å; V182-Y193 HydrophobicContact CG2-CE1 4.4Å
183	S	53.8	Low	67.7	Low	75 Å²	75	72.7 Å²	72.7	52%	0.524	39%	0.392	S	S	.	.			trans	-66.5	149.4	178.7	-166.9	0	0	0	0	110	N185 E186	S183-N185 PolarHBondContact O-N 3.07Å; S183-E186 PolarHBondContact O-N 3.07Å
184	E	53.5	Low	68	Low	143 Å²	143	72.7 Å²	72.7	67%	0.668	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-10.2	-173.2	-70.1	-149.7	106.3	0	0	115.2	K187	E184-K187 WeakPolarHBondContact O-CD 3.49Å; E184-K187 WeakPolarHBondContact O-CE 3.39Å; E184-K187 WeakPolarHBondContact O-CG 3.47Å; E184-K187 PolarHBondContact O-NZ 2.95Å; E184-K187 IonicContact OE1-NZ 2.81Å
185	N	49.2	Very low	68.5	Low	155 Å²	155	70.4 Å²	70.4	83%	0.829	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-7.8	177.8	-60.2	-7.8	0	0	0	113.3	S183	S183-N185 PolarHBondContact O-N 3.07Å
186	E	58.2	Low	69.2	Low	52 Å²	52	69.5 Å²	69.5	24%	0.243	38%	0.376	C	S	.	.			trans	-108.5	24.7	-174.1	-62	-173.6	148.5	0	0	113.2	V182 S183 D188 R219	V182-E186 HydrophobicContact CG1-CB 3.61Å; S183-E186 PolarHBondContact O-N 3.07Å; E186-D188 VanDerWaalsContact C-N 3.25Å; E186-D188 PolarHBondContact O-N 3.32Å; E186-R219 IonicContact OE1-CZ 2.74Å; E186-R219 IonicContact OE1-NE 3.38Å; E186-R219 PolarHBondContact OE1-NE 3.33Å; E186-R219 IonicContact OE1-NH2 2.61Å; E186-R219 PolarHBondContact OE1-NH2 2.98Å
187	K	51.3	Low	70	Confident	106 Å²	106	68.4 Å²	68.4	46%	0.461	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-19.1	-160.3	-81.9	168.8	172	132.7	0	117.5	E184	E184-K187 WeakPolarHBondContact O-CD 3.49Å; E184-K187 WeakPolarHBondContact O-CE 3.39Å; E184-K187 WeakPolarHBondContact O-CG 3.47Å; E184-K187 PolarHBondContact O-NZ 2.95Å; E184-K187 IonicContact OE1-NZ 2.81Å
188	D	55.8	Low	71.2	Confident	124 Å²	124	69 Å²	69	66%	0.663	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.4	-2.3	-169.8	-90.2	-72.1	0	0	0	117.3	K174 E186 T190	K174-D188 WeakPolarHBondContact CE-O 3.41Å; K174-D188 PolarHBondContact NZ-O 3.22Å; K174-D188 IonicContact NZ-OD1 3.61Å; E186-D188 VanDerWaalsContact C-N 3.25Å; E186-D188 PolarHBondContact O-N 3.32Å; D188-T190 PolarHBondContact O-N 3.09Å
189	T	66.7	Low	72.5	Confident	56 Å²	56	63.9 Å²	63.9	34%	0.344	33%	0.334	S	S	.	.			trans	-70.4	122.4	-170.3	70.8	0	0	0	0	112.8	R217	T189-R217 PolarHBondContact OG1-NH2 3.15Å; T189-R217 VanDerWaalsContact OG1-NH2 3.17Å
190	T	81.2	Confident	73.9	Confident	53 Å²	53	66.5 Å²	66.5	33%	0.325	35%	0.35	S	S	.	.			trans	-62.1	139.3	162.5	44.8	0	0	0	0	109.9	Y172 K174 D188 R217	Y172-T190 WeakPolarHBondContact OH-CB 3.38Å; K174-T190 HydrophobicContact CD-CG2 4.2Å; K174-T190 VanDerWaalsContact CE-CG2 3.44Å; K174-T190 HydrophobicContact CG-CG2 3.8Å; D188-T190 PolarHBondContact O-N 3.09Å; T190-R217 PolarHBondContact O-NH2 2.95Å
191	G	86.2	Confident	75.7	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.8	-168	171.5	0	0	0	0	0	115.2	Y172 G173 Y193	Y172-G191 WeakPolarHBondContact CA-O 3.5Å; G173-G191 PolarHBondContact N-O 3.42Å; G173-G191 VanDerWaalsContact N-O 3.08Å; G173-G191 PolarHBondContact O-N 3.47Å; G191-Y193 WeakPolarHBondContact O-CD2 3.26Å
192	W	90.6	Very high	77.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	129.8	-175.6	-67.6	99.5	0	0	0	112.4	C92 Y98 L116 L170 Y172 R217 I218 L235	C92-W192 HydrophobicContact CB-CH2 4.16Å; C92-W192 HydrophobicContact CB-CZ2 3.71Å; Y98-W192 AromaticContact CD1-CD1 3.61Å; Y98-W192 AromaticContact CD1-NE1 3.4Å; Y98-W192 AromaticContact CD2-NE1 3.39Å; Y98-W192 AromaticContact CE1-CD1 3.61Å; Y98-W192 AromaticContact CE1-NE1 3.76Å; Y98-W192 AromaticContact CE2-NE1 3.75Å; Y98-W192 AromaticContact CG-CD1 3.92Å; Y98-W192 AromaticContact CG-NE1 3.2Å; Y98-W192 AromaticContact CZ-CD1 3.92Å; Y98-W192 AromaticContact CZ-NE1 3.93Å; L116-W192 HydrophobicContact CB-CH2 3.95Å; L116-W192 HydrophobicContact CB-CZ2 3.57Å; L116-W192 HydrophobicContact CD1-CD2 4.39Å; L116-W192 HydrophobicContact CD1-CH2 4.29Å; L116-W192 HydrophobicContact CD1-CZ2 3.95Å; L116-W192 HydrophobicContact CD2-CH2 4.27Å; L116-W192 HydrophobicContact CG-CH2 4.4Å; L116-W192 HydrophobicContact CG-CZ2 4.24Å; L170-W192 HydrophobicContact CD1-CB 4.06Å; L170-W192 HydrophobicContact CD2-CD2 4.43Å; L170-W192 HydrophobicContact CD2-CE3 4.12Å; L170-W192 HydrophobicContact CG-CB 4.33Å; L170-W192 HydrophobicContact CG-CD2 4.35Å; L170-W192 HydrophobicContact CG-CE3 3.76Å; L170-W192 HydrophobicContact CG-CZ3 4.45Å; Y172-W192 AromaticContact CD2-CD2 3.88Å; Y172-W192 HydrophobicContact CD2-CD2 3.88Å; Y172-W192 AromaticContact CD2-CE2 3.66Å; Y172-W192 HydrophobicContact CD2-CE3 4.44Å; Y172-W192 HydrophobicContact CD2-CG 4.14Å; Y172-W192 HydrophobicContact CD2-CZ2 4.06Å; Y172-W192 AromaticContact CD2-NE1 3.74Å; Y172-W192 HydrophobicContact CG-CD2 4.48Å; Y172-W192 HydrophobicContact CG-CZ2 4.35Å; W192-R217 WeakPolarHBondContact O-CD 3.49Å; W192-I218 PolarHBondContact O-N 3.31Å; W192-L235 HydrophobicContact CB-CD2 4.25Å; W192-L235 HydrophobicContact CG-CD2 4.38Å
193	Y	92.2	Very high	79.4	Confident	8 Å²	8	58.2 Å²	58.2	3%	0.031	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	121.6	179.6	-68.4	-94.1	0	0	0	110.1	W88 Q171 P175 V182 G191 V216 R217	W88-Y193 HydrophobicContact CH2-CD2 4.34Å; W88-Y193 HydrophobicContact CH2-CG 4.21Å; W88-Y193 HydrophobicContact CZ3-CD2 4.07Å; W88-Y193 HydrophobicContact CZ3-CG 4.41Å; Q171-Y193 PolarHBondContact N-O 3.31Å; Q171-Y193 PolarHBondContact O-N 3.26Å; P175-Y193 VanDerWaalsContact CD-CZ 3.42Å; P175-Y193 HydrophobicContact CG-CD1 4.04Å; P175-Y193 HydrophobicContact CG-CD2 4.17Å; P175-Y193 HydrophobicContact CG-CE1 3.5Å; P175-Y193 HydrophobicContact CG-CE2 3.68Å; P175-Y193 HydrophobicContact CG-CG 4.35Å; V182-Y193 HydrophobicContact CG2-CE1 4.4Å; G191-Y193 WeakPolarHBondContact O-CD2 3.26Å; Y193-V216 CarbonylContact C-O 3.6Å; Y193-V216 WeakPolarHBondContact CA-O 3.41Å; Y193-R217 HydrophobicContact CD1-CB 4.07Å; Y193-R217 HydrophobicContact CE1-CB 3.69Å; Y193-R217 HydrophobicContact CE1-CG 4.2Å
194	L	93.7	Very high	81.4	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	127.8	179.5	-175	55.2	0	0	0	109.9	A168 V169 L170 T203 V205 L210 V216 I218 L224 F226	A168-L194 HydrophobicContact CB-CD1 3.85Å; V169-L194 WeakPolarHBondContact O-CA 3.45Å; V169-L194 WeakPolarHBondContact O-CD1 3.46Å; L170-L194 HydrophobicContact CB-CD1 4.24Å; L170-L194 HydrophobicContact CD1-CB 3.86Å; L170-L194 HydrophobicContact CD1-CD1 4.18Å; L170-L194 HydrophobicContact CD1-CG 4.5Å; L194-T203 HydrophobicContact CD2-CG2 3.84Å; L194-T203 HydrophobicContact CG-CG2 4.38Å; L194-V205 HydrophobicContact CD2-CG2 3.91Å; L194-L210 HydrophobicContact CB-CD1 4.32Å; L194-L210 HydrophobicContact CD2-CD1 3.92Å; L194-L210 HydrophobicContact CG-CD1 3.87Å; L194-V216 PolarHBondContact N-O 3.06Å; L194-V216 PolarHBondContact O-N 3.16Å; L194-I218 HydrophobicContact CB-CD1 3.81Å; L194-I218 HydrophobicContact CB-CG1 3.53Å; L194-I218 HydrophobicContact CD2-CD1 4.01Å; L194-I218 HydrophobicContact CD2-CG1 4.22Å; L194-L224 HydrophobicContact CD2-CD1 4.02Å; L194-L224 HydrophobicContact CD2-CD2 3.92Å; L194-L224 HydrophobicContact CD2-CG 4.43Å; L194-F226 HydrophobicContact CD1-CE1 4.4Å
195	K	92.7	Very high	83.3	Confident	51 Å²	51	50.4 Å²	50.4	22%	0.222	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	126.2	171.6	166.2	169.8	169.1	149.9	0	109.9	A168 V169 L197 G213 R214 Y215	A168-K195 CarbonylContact C-O 3.58Å; A168-K195 VanDerWaalsContact CA-O 3.3Å; A168-K195 WeakPolarHBondContact CA-O 3.46Å; V169-K195 HydrophobicContact CG1-CB 3.94Å; V169-K195 HydrophobicContact CG1-CG 4.37Å; V169-K195 PolarHBondContact N-O 2.76Å; V169-K195 PolarHBondContact O-N 2.9Å; K195-L197 HydrophobicContact CD-CD2 4.5Å; K195-L197 HydrophobicContact CG-CD2 4.3Å; K195-G213 WeakPolarHBondContact CD-O 3.38Å; K195-G213 WeakPolarHBondContact CE-O 3.35Å; K195-G213 PolarHBondContact NZ-O 2.95Å; K195-R214 WeakPolarHBondContact CA-O 3.41Å; K195-Y215 HydrophobicContact CB-CD1 3.54Å; K195-Y215 HydrophobicContact CB-CE1 3.64Å; K195-Y215 HydrophobicContact CB-CG 4.08Å; K195-Y215 HydrophobicContact CD-CD1 4.36Å; K195-Y215 HydrophobicContact CD-CD2 4.17Å; K195-Y215 HydrophobicContact CD-CE1 4.01Å; K195-Y215 HydrophobicContact CD-CE2 3.82Å; K195-Y215 HydrophobicContact CD-CG 4.43Å; K195-Y215 HydrophobicContact CG-CE1 4.46Å
196	D	94.5	Very high	85.4	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	121.4	170.7	-172.4	-24.2	0	0	0	108.7	E198 S199 G202 T203 G213	D196-E198 PolarHBondContact O-N 3.31Å; D196-E198 PolarHBondContact OD1-N 3.43Å; D196-S199 PolarHBondContact OD1-N 3.17Å; D196-G202 VanDerWaalsContact OD2-CA 3.23Å; D196-G202 WeakPolarHBondContact OD2-CA 3.4Å; D196-T203 PolarHBondContact OD2-N 2.97Å; D196-G213 PolarHBondContact O-N 3.45Å
197	L	91	Very high	87	Confident	41 Å²	41	53.6 Å²	53.6	22%	0.215	27%	0.268	C	S	.	.			trans	-86	53.3	-178.8	-63.3	177.3	0	0	0	110	Y83 L136 L166 H167 V169 K195 S199	Y83-L197 HydrophobicContact CD2-CD2 4.48Å; L136-L197 HydrophobicContact CD2-CD1 4.31Å; L166-L197 HydrophobicContact CB-CD1 4.09Å; H167-L197 PolarHBondContact O-N 3.13Å; V169-L197 HydrophobicContact CB-CD1 4.25Å; V169-L197 HydrophobicContact CG1-CD1 4.41Å; V169-L197 HydrophobicContact CG1-CD2 4Å; V169-L197 HydrophobicContact CG1-CG 4.26Å; K195-L197 HydrophobicContact CD-CD2 4.5Å; K195-L197 HydrophobicContact CG-CD2 4.3Å; L197-S199 VanDerWaalsContact C-N 3.27Å; L197-S199 PolarHBondContact O-N 3.41Å
198	E	89.2	Confident	89	Confident	153 Å²	153	58.4 Å²	58.4	72%	0.715	28%	0.283	S	S	*	.			trans	52.3	40.6	179.1	-50.1	-162.8	151.9	0	0	113.5	D196 T200 P212	D196-E198 PolarHBondContact O-N 3.31Å; D196-E198 PolarHBondContact OD1-N 3.43Å; E198-T200 PolarHBondContact O-N 2.94Å; E198-P212 HydrophobicContact CG-CB 4.3Å
199	S	91.2	Very high	90.8	Very high	4 Å²	4	59 Å²	59	3%	0.028	28%	0.276	C	S	.	.			trans	-67	136.4	-176.5	-173.7	0	0	0	0	112.5	S164 H167 D196 L197 H201 G202	S164-S199 PolarHBondContact OG-OG 3.29Å; H167-S199 PolarHBondContact CE1-OG 2.85Å; H167-S199 VanDerWaalsContact CE1-OG 3.22Å; H167-S199 VanDerWaalsContact ND1-CB 3.3Å; H167-S199 WeakPolarHBondContact ND1-CB 3.21Å; H167-S199 PolarHBondContact ND1-OG 3.46Å; D196-S199 PolarHBondContact OD1-N 3.17Å; L197-S199 VanDerWaalsContact C-N 3.27Å; L197-S199 PolarHBondContact O-N 3.41Å; S199-H201 VanDerWaalsContact C-N 3.25Å; S199-H201 PolarHBondContact O-N 3.46Å; S199-H201 VanDerWaalsContact O-N 3.14Å; S199-G202 WeakPolarHBondContact O-CA 3.39Å; S199-G202 PolarHBondContact O-N 3.35Å
200	T	93	Very high	92	Very high	107 Å²	107	57 Å²	57	66%	0.656	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.1	-42.9	178.7	53.8	0	0	0	0	113.5	E198	E198-T200 PolarHBondContact O-N 2.94Å
201	H	93.8	Very high	92.6	Very high	94 Å²	94	56.9 Å²	56.9	44%	0.435	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-11.4	177.4	-62.7	-83.1	0	0	0	113.8	S162 S199 F204	S162-H201 WeakPolarHBondContact CB-CD2 3.47Å; S162-H201 WeakPolarHBondContact CB-NE2 3.22Å; S162-H201 PolarHBondContact O-CD2 2.71Å; S199-H201 VanDerWaalsContact C-N 3.25Å; S199-H201 PolarHBondContact O-N 3.46Å; S199-H201 VanDerWaalsContact O-N 3.14Å; H201-F204 WeakPolarHBondContact O-CE2 3.38Å
202	G	93.9	Very high	92.8	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.285	C	S	.	.			trans	70.1	165.7	180	0	0	0	0	0	115.9	H167 D196 S199 G227	H167-G202 PolarHBondContact CE1-O 3.23Å; H167-G202 PolarHBondContact NE2-O 3.44Å; D196-G202 VanDerWaalsContact OD2-CA 3.23Å; D196-G202 WeakPolarHBondContact OD2-CA 3.4Å; S199-G202 WeakPolarHBondContact O-CA 3.39Å; S199-G202 PolarHBondContact O-N 3.35Å; G202-G227 WeakPolarHBondContact O-CA 3.33Å; G202-G227 PolarHBondContact O-N 3.08Å
203	T	95.5	Very high	92.7	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	140.9	174.8	-59.8	0	0	0	0	110.5	H167 L194 D196 L210 F226	H167-T203 PolarHBondContact CD2-OG1 2.98Å; H167-T203 PolarHBondContact NE2-OG1 3.41Å; L194-T203 HydrophobicContact CD2-CG2 3.84Å; L194-T203 HydrophobicContact CG-CG2 4.38Å; D196-T203 PolarHBondContact OD2-N 2.97Å; T203-L210 HydrophobicContact CG2-CD1 3.9Å; T203-L210 HydrophobicContact CG2-CG 4.42Å; T203-L210 PolarHBondContact O-N 2.87Å; T203-F226 HydrophobicContact CG2-CD1 3.83Å; T203-F226 HydrophobicContact CG2-CE1 3.82Å
204	F	95.5	Very high	92.6	Very high	41 Å²	41	68.7 Å²	68.7	18%	0.18	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	138.9	177.1	-59.1	-101.9	0	0	0	110.7	H201 R208 R209 L224 R225	H201-F204 WeakPolarHBondContact O-CE2 3.38Å; F204-R208 CarbonylContact C-O 3.59Å; F204-R208 WeakPolarHBondContact CA-O 3.41Å; F204-R209 HydrophobicContact CD1-CB 3.98Å; F204-R209 HydrophobicContact CD1-CG 4.49Å; F204-R209 HydrophobicContact CE1-CB 3.89Å; F204-R209 HydrophobicContact CE1-CG 4.24Å; F204-R209 HydrophobicContact CZ-CG 4.43Å; F204-L224 CarbonylContact O-C 3.47Å; F204-L224 WeakPolarHBondContact O-CA 3.3Å; F204-R225 HydrophobicContact CB-CB 4.33Å; F204-R225 VanDerWaalsContact CD2-NH2 3.29Å; F204-R225 PolarHBondContact N-O 3.13Å; F204-R225 PolarHBondContact O-N 3.22Å
205	V	94.3	Very high	92.4	Very high	12 Å²	12	70.1 Å²	70.1	7%	0.073	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	127.8	176.4	178.8	0	0	0	0	108.3	L194 K207 R208 L210 I218 Y222 V223 L224	L194-V205 HydrophobicContact CD2-CG2 3.91Å; V205-K207 PolarHBondContact O-N 3.14Å; V205-K207 VanDerWaalsContact O-N 3.11Å; V205-R208 PolarHBondContact N-O 3.41Å; V205-R208 PolarHBondContact O-N 3.43Å; V205-L210 HydrophobicContact CB-CD2 4.04Å; V205-L210 HydrophobicContact CB-CG 4.48Å; V205-L210 HydrophobicContact CG2-CD1 3.8Å; V205-L210 HydrophobicContact CG2-CD2 3.71Å; V205-L210 HydrophobicContact CG2-CG 3.77Å; V205-I218 HydrophobicContact CG1-CD1 3.9Å; V205-I218 HydrophobicContact CG2-CD1 3.87Å; V205-Y222 HydrophobicContact CG1-CD2 3.71Å; V205-Y222 HydrophobicContact CG1-CE2 4.39Å; V205-Y222 HydrophobicContact CG1-CG 4.42Å; V205-V223 WeakPolarHBondContact CA-O 3.34Å; V205-L224 HydrophobicContact CB-CD2 4.45Å; V205-L224 HydrophobicContact CG1-CD2 4.11Å; V205-L224 HydrophobicContact CG2-CD2 3.76Å
206	N	92.3	Very high	92.3	Very high	69 Å²	69	70 Å²	70	37%	0.369	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.6	43.2	-177.8	-62.5	-11.3	0	0	0	112.2	R208 Y222 V223	N206-R208 PolarHBondContact O-N 3.42Å; N206-Y222 WeakPolarHBondContact ND2-CD1 3.47Å; N206-V223 PolarHBondContact N-O 3.5Å; N206-V223 PolarHBondContact OD1-N 3.38Å
207	K	91.7	Very high	92.2	Very high	206 Å²	206	71.1 Å²	71.1	90%	0.896	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	-6.4	-175.2	-52.9	172	-176.1	170.9	0	116.6	V205	V205-K207 PolarHBondContact O-N 3.14Å; V205-K207 VanDerWaalsContact O-N 3.11Å
208	R	93.2	Very high	92.2	Very high	207 Å²	207	69.1 Å²	69.1	78%	0.781	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	144.2	173.7	-61	179.7	178.2	175.7	0.3	110.1	F204 V205 N206	F204-R208 CarbonylContact C-O 3.59Å; F204-R208 WeakPolarHBondContact CA-O 3.41Å; V205-R208 PolarHBondContact N-O 3.41Å; V205-R208 PolarHBondContact O-N 3.43Å; N206-R208 PolarHBondContact O-N 3.42Å
209	R	94.5	Very high	92.2	Very high	137 Å²	137	63.1 Å²	63.1	52%	0.517	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	136.6	172.6	-170.3	-178.3	176.5	163.4	5.2	109.3	F204	F204-R209 HydrophobicContact CD1-CB 3.98Å; F204-R209 HydrophobicContact CD1-CG 4.49Å; F204-R209 HydrophobicContact CE1-CB 3.89Å; F204-R209 HydrophobicContact CE1-CG 4.24Å; F204-R209 HydrophobicContact CZ-CG 4.43Å
210	L	92.8	Very high	92.3	Very high	14 Å²	14	64 Å²	64	7%	0.073	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-72.7	148.5	172.5	-65.7	-173.2	0	0	0	111.3	L194 T203 V205 V216	L194-L210 HydrophobicContact CB-CD1 4.32Å; L194-L210 HydrophobicContact CD2-CD1 3.92Å; L194-L210 HydrophobicContact CG-CD1 3.87Å; T203-L210 HydrophobicContact CG2-CD1 3.9Å; T203-L210 HydrophobicContact CG2-CG 4.42Å; T203-L210 PolarHBondContact O-N 2.87Å; V205-L210 HydrophobicContact CB-CD2 4.04Å; V205-L210 HydrophobicContact CB-CG 4.48Å; V205-L210 HydrophobicContact CG2-CD1 3.8Å; V205-L210 HydrophobicContact CG2-CD2 3.71Å; V205-L210 HydrophobicContact CG2-CG 3.77Å; L210-V216 HydrophobicContact CD2-CB 4.07Å; L210-V216 HydrophobicContact CD2-CG1 4.02Å; L210-V216 HydrophobicContact CD2-CG2 4.11Å
211	P	92.4	Very high	92.1	Very high	49 Å²	49	61 Å²	61	32%	0.318	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-67.1	133.9	165	28.8	-32.6	0	0	0	109.8	R214 V216	P211-R214 HydrophobicContact CG-CB 4.26Å; P211-V216 HydrophobicContact CG-CG2 4.42Å
212	P	91.3	Very high	92.1	Very high	73 Å²	73	58.3 Å²	58.3	47%	0.474	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	152.9	176.8	26.8	-34.3	0	0	0	111.7	E198 R214	E198-P212 HydrophobicContact CG-CB 4.3Å; P212-R214 PolarHBondContact O-N 2.73Å
213	G	88.2	Confident	92.1	Very high	23 Å²	23	60.6 Å²	60.6	24%	0.237	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	-17.5	171.7	0	0	0	0	0	116.4	K195 D196	K195-G213 WeakPolarHBondContact CD-O 3.38Å; K195-G213 WeakPolarHBondContact CE-O 3.35Å; K195-G213 PolarHBondContact NZ-O 2.95Å; D196-G213 PolarHBondContact O-N 3.45Å
214	R	89.6	Confident	92	Very high	161 Å²	161	60.6 Å²	60.6	61%	0.608	29%	0.293	S	S	*	.			trans	-96.7	149.9	-177.9	-63.4	-179.2	-179.5	150	2.8	112.2	K195 P211 P212	K195-R214 WeakPolarHBondContact CA-O 3.41Å; P211-R214 HydrophobicContact CG-CB 4.26Å; P212-R214 PolarHBondContact O-N 2.73Å
215	Y	90.7	Very high	92	Very high	30 Å²	30	62.8 Å²	62.8	12%	0.118	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	130.8	170.8	-72.7	-79.2	0	0	0	110.1	Y83 W88 Q171 V179 K195	Y83-Y215 PolarHBondContact OH-OH 3.39Å; W88-Y215 AromaticContact CH2-CD1 3.92Å; W88-Y215 HydrophobicContact CH2-CD1 3.92Å; W88-Y215 HydrophobicContact CH2-CD2 4.45Å; W88-Y215 HydrophobicContact CH2-CE1 4.09Å; W88-Y215 HydrophobicContact CH2-CG 4.12Å; W88-Y215 HydrophobicContact CZ2-CD1 4.09Å; W88-Y215 AromaticContact CZ2-CD2 3.8Å; W88-Y215 HydrophobicContact CZ2-CD2 3.8Å; W88-Y215 HydrophobicContact CZ2-CE1 4.17Å; W88-Y215 AromaticContact CZ2-CE2 3.87Å; W88-Y215 HydrophobicContact CZ2-CE2 3.87Å; W88-Y215 AromaticContact CZ2-CG 3.91Å; W88-Y215 HydrophobicContact CZ2-CG 3.91Å; Q171-Y215 HydrophobicContact CB-CE1 4.18Å; V179-Y215 HydrophobicContact CG1-CD2 3.81Å; K195-Y215 HydrophobicContact CB-CD1 3.54Å; K195-Y215 HydrophobicContact CB-CE1 3.64Å; K195-Y215 HydrophobicContact CB-CG 4.08Å; K195-Y215 HydrophobicContact CD-CD1 4.36Å; K195-Y215 HydrophobicContact CD-CD2 4.17Å; K195-Y215 HydrophobicContact CD-CE1 4.01Å; K195-Y215 HydrophobicContact CD-CE2 3.82Å; K195-Y215 HydrophobicContact CD-CG 4.43Å; K195-Y215 HydrophobicContact CG-CE1 4.46Å
216	V	90.7	Very high	92	Very high	47 Å²	47	62.2 Å²	62.2	29%	0.285	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	131.5	177.7	178.5	0	0	0	0	109.4	Y193 L194 L210 P211 I218	Y193-V216 CarbonylContact C-O 3.6Å; Y193-V216 WeakPolarHBondContact CA-O 3.41Å; L194-V216 PolarHBondContact N-O 3.06Å; L194-V216 PolarHBondContact O-N 3.16Å; L210-V216 HydrophobicContact CD2-CB 4.07Å; L210-V216 HydrophobicContact CD2-CG1 4.02Å; L210-V216 HydrophobicContact CD2-CG2 4.11Å; P211-V216 HydrophobicContact CG-CG2 4.42Å; V216-I218 PolarHBondContact O-N 3.29Å
217	R	90.7	Very high	92	Very high	25 Å²	25	59 Å²	59	9%	0.094	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	129.2	179.8	-176.1	53.1	151.5	91	13.6	110.7	T189 T190 W192 Y193 D241	T189-R217 PolarHBondContact OG1-NH2 3.15Å; T189-R217 VanDerWaalsContact OG1-NH2 3.17Å; T190-R217 PolarHBondContact O-NH2 2.95Å; W192-R217 WeakPolarHBondContact O-CD 3.49Å; Y193-R217 HydrophobicContact CD1-CB 4.07Å; Y193-R217 HydrophobicContact CE1-CB 3.69Å; Y193-R217 HydrophobicContact CE1-CG 4.2Å; R217-D241 IonicContact CZ-OD1 3.73Å; R217-D241 IonicContact CZ-OD2 3.64Å; R217-D241 IonicContact NH1-OD1 2.64Å; R217-D241 PolarHBondContact NH1-OD1 3.24Å; R217-D241 IonicContact NH1-OD2 3.92Å; R217-D241 PolarHBondContact NH1-OD2 2.83Å; R217-D241 IonicContact NH2-OD1 3.36Å; R217-D241 PolarHBondContact NH2-OD1 2.96Å
218	I	91.7	Very high	92	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	125.2	170.9	-53.2	-54.9	0	0	0	107.1	L170 W192 L194 V205 V216 Y222 L224 L235	L170-I218 HydrophobicContact CD1-CG1 4.09Å; W192-I218 PolarHBondContact O-N 3.31Å; L194-I218 HydrophobicContact CB-CD1 3.81Å; L194-I218 HydrophobicContact CB-CG1 3.53Å; L194-I218 HydrophobicContact CD2-CD1 4.01Å; L194-I218 HydrophobicContact CD2-CG1 4.22Å; V205-I218 HydrophobicContact CG1-CD1 3.9Å; V205-I218 HydrophobicContact CG2-CD1 3.87Å; V216-I218 PolarHBondContact O-N 3.29Å; I218-Y222 HydrophobicContact CB-CD2 4.4Å; I218-Y222 HydrophobicContact CD1-CD2 4.16Å; I218-Y222 HydrophobicContact CG2-CD2 3.99Å; I218-Y222 HydrophobicContact CG2-CG 4.22Å; I218-L224 HydrophobicContact CD1-CD2 3.91Å; I218-L224 HydrophobicContact CG1-CD2 4.28Å; I218-L224 HydrophobicContact CG2-CD2 3.92Å; I218-L235 HydrophobicContact CB-CD2 4.31Å; I218-L235 HydrophobicContact CG2-CB 4.2Å; I218-L235 HydrophobicContact CG2-CD2 3.69Å
219	R	90.2	Very high	91.9	Very high	26 Å²	26	41.5 Å²	41.5	10%	0.098	22%	0.221	C	C	.	.			trans	-100	164.2	174.9	-78.5	176.6	163.1	-83.7	15	110.5	E186 G221 Y222 D241 T242	E186-R219 IonicContact OE1-CZ 2.74Å; E186-R219 IonicContact OE1-NE 3.38Å; E186-R219 PolarHBondContact OE1-NE 3.33Å; E186-R219 IonicContact OE1-NH2 2.61Å; E186-R219 PolarHBondContact OE1-NH2 2.98Å; R219-G221 PolarHBondContact O-N 3.28Å; R219-Y222 HydrophobicContact CB-CD1 4.1Å; R219-Y222 HydrophobicContact CB-CE1 3.81Å; R219-Y222 HydrophobicContact CB-CE2 4.46Å; R219-Y222 WeakPolarHBondContact O-CB 3.37Å; R219-Y222 PolarHBondContact O-N 3Å; R219-D241 VanDerWaalsContact CB-O 3.31Å; R219-D241 WeakPolarHBondContact CB-O 3.38Å; R219-D241 PolarHBondContact NH1-O 2.95Å; R219-T242 PolarHBondContact NH1-O 3.12Å
220	V	91.7	Very high	91.8	Very high	22 Å²	22	38.9 Å²	38.9	13%	0.133	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-60.4	136.5	175.1	170.2	0	0	0	0	110.4	Y98 D241 T242	Y98-V220 HydrophobicContact CD1-CG2 4.44Å; Y98-V220 HydrophobicContact CE1-CG2 3.85Å; V220-D241 HydrophobicContact CB-CB 4.49Å; V220-D241 HydrophobicContact CG2-CB 3.84Å; V220-D241 PolarHBondContact N-O 3.49Å; V220-D241 VanDerWaalsContact N-O 3.08Å; V220-T242 HydrophobicContact CB-CG2 4.16Å; V220-T242 HydrophobicContact CG1-CG2 4.01Å
221	G	89.6	Confident	91.7	Very high	45 Å²	45	40.7 Å²	40.7	46%	0.464	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.6	-10	-174.4	0	0	0	0	0	115.3	R219 L235	R219-G221 PolarHBondContact O-N 3.28Å; G221-L235 PolarHBondContact N-O 2.97Å
222	Y	92.7	Very high	91.7	Very high	37 Å²	37	41.7 Å²	41.7	15%	0.145	23%	0.229	C	C	.	.			trans	-68.7	140.1	-179.9	-81.7	23.4	0	0	0	112.7	V205 N206 I218 R219 I234 L235 E243	V205-Y222 HydrophobicContact CG1-CD2 3.71Å; V205-Y222 HydrophobicContact CG1-CE2 4.39Å; V205-Y222 HydrophobicContact CG1-CG 4.42Å; N206-Y222 WeakPolarHBondContact ND2-CD1 3.47Å; I218-Y222 HydrophobicContact CB-CD2 4.4Å; I218-Y222 HydrophobicContact CD1-CD2 4.16Å; I218-Y222 HydrophobicContact CG2-CD2 3.99Å; I218-Y222 HydrophobicContact CG2-CG 4.22Å; R219-Y222 HydrophobicContact CB-CD1 4.1Å; R219-Y222 HydrophobicContact CB-CE1 3.81Å; R219-Y222 HydrophobicContact CB-CE2 4.46Å; R219-Y222 WeakPolarHBondContact O-CB 3.37Å; R219-Y222 PolarHBondContact O-N 3Å; Y222-I234 WeakPolarHBondContact O-CA 3.35Å; Y222-L235 PolarHBondContact O-N 3.49Å; Y222-E243 HydrophobicContact CE1-CB 4.42Å; Y222-E243 WeakPolarHBondContact CE1-OE2 3.15Å; Y222-E243 PolarHBondContact OH-OE2 3.31Å
223	V	94.1	Very high	91.8	Very high	48 Å²	48	38.2 Å²	38.2	29%	0.291	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	111.9	-178.1	-172.6	0	0	0	0	110.5	V205 N206 L232 I234	V205-V223 WeakPolarHBondContact CA-O 3.34Å; N206-V223 PolarHBondContact N-O 3.5Å; N206-V223 PolarHBondContact OD1-N 3.38Å; V223-L232 HydrophobicContact CG1-CB 3.99Å; V223-L232 HydrophobicContact CG1-CD1 4.18Å; V223-L232 HydrophobicContact CG1-CD2 4.18Å; V223-L232 HydrophobicContact CG1-CG 4.34Å; V223-I234 HydrophobicContact CG1-CG1 4.4Å; V223-I234 HydrophobicContact CG2-CD1 4.25Å; V223-I234 HydrophobicContact CG2-CG1 4.18Å
224	L	95	Very high	92.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	141.1	178.7	-33.9	177	0	0	0	110.7	L100 L194 F204 V205 I218 F226 H233	L100-L224 HydrophobicContact CD1-CD1 3.93Å; L194-L224 HydrophobicContact CD2-CD1 4.02Å; L194-L224 HydrophobicContact CD2-CD2 3.92Å; L194-L224 HydrophobicContact CD2-CG 4.43Å; F204-L224 CarbonylContact O-C 3.47Å; F204-L224 WeakPolarHBondContact O-CA 3.3Å; V205-L224 HydrophobicContact CB-CD2 4.45Å; V205-L224 HydrophobicContact CG1-CD2 4.11Å; V205-L224 HydrophobicContact CG2-CD2 3.76Å; I218-L224 HydrophobicContact CD1-CD2 3.91Å; I218-L224 HydrophobicContact CG1-CD2 4.28Å; I218-L224 HydrophobicContact CG2-CD2 3.92Å; L224-F226 HydrophobicContact CB-CZ 4.4Å; L224-F226 HydrophobicContact CD1-CZ 4.34Å; L224-H233 HydrophobicContact CB-CB 4.26Å; L224-H233 PolarHBondContact N-O 3.34Å; L224-H233 PolarHBondContact O-N 2.99Å
225	R	94.6	Very high	92.2	Very high	88 Å²	88	31.2 Å²	31.2	33%	0.332	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	121.1	171.5	-173.3	-165	71.4	166.6	-1.2	110.2	F204 G227 S229 L232	F204-R225 HydrophobicContact CB-CB 4.33Å; F204-R225 VanDerWaalsContact CD2-NH2 3.29Å; F204-R225 PolarHBondContact N-O 3.13Å; F204-R225 PolarHBondContact O-N 3.22Å; R225-G227 PolarHBondContact NE-O 3.09Å; R225-S229 WeakPolarHBondContact CD-O 3.41Å; R225-S229 WeakPolarHBondContact CG-O 3.33Å; R225-L232 HydrophobicContact CB-CD2 4.04Å; R225-L232 HydrophobicContact CG-CD2 4.17Å
226	F	94.7	Very high	92.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	116.4	-179.1	-59.4	-59.9	0	0	0	111.1	F137 L158 I163 H167 A168 L194 T203 L224 G228 S229 H233	F137-F226 HydrophobicContact CB-CD2 4.49Å; F137-F226 HydrophobicContact CB-CE1 4.33Å; F137-F226 HydrophobicContact CB-CE2 4.21Å; F137-F226 HydrophobicContact CB-CZ 4.12Å; F137-F226 HydrophobicContact CD1-CD2 4.34Å; F137-F226 AromaticContact CD1-CE2 3.59Å; F137-F226 HydrophobicContact CD1-CE2 3.59Å; F137-F226 AromaticContact CD1-CZ 3.9Å; F137-F226 HydrophobicContact CD1-CZ 3.9Å; F137-F226 HydrophobicContact CD2-CE1 4.23Å; F137-F226 HydrophobicContact CD2-CE2 4.21Å; F137-F226 AromaticContact CD2-CZ 3.64Å; F137-F226 HydrophobicContact CD2-CZ 3.64Å; F137-F226 HydrophobicContact CE1-CE2 4.03Å; F137-F226 HydrophobicContact CE1-CZ 4.29Å; F137-F226 HydrophobicContact CE2-CZ 4.06Å; F137-F226 HydrophobicContact CG-CD2 4.42Å; F137-F226 HydrophobicContact CG-CE1 4.21Å; F137-F226 AromaticContact CG-CE2 3.7Å; F137-F226 HydrophobicContact CG-CE2 3.7Å; F137-F226 AromaticContact CG-CZ 3.56Å; F137-F226 HydrophobicContact CG-CZ 3.56Å; F137-F226 HydrophobicContact CZ-CZ 4.38Å; L158-F226 HydrophobicContact CD1-CB 4.07Å; L158-F226 HydrophobicContact CD1-CD2 3.32Å; L158-F226 HydrophobicContact CD1-CE2 4Å; L158-F226 HydrophobicContact CD1-CG 3.92Å; I163-F226 HydrophobicContact CD1-CB 3.94Å; I163-F226 HydrophobicContact CG1-CB 4.29Å; H167-F226 AromaticContact CD2-CD1 3.42Å; H167-F226 VanDerWaalsContact CD2-CD1 3.42Å; H167-F226 WeakPolarHBondContact CD2-CD1 3.3Å; H167-F226 AromaticContact CD2-CG 3.86Å; H167-F226 VanDerWaalsContact NE2-CA 3.31Å; H167-F226 WeakPolarHBondContact NE2-CA 3.49Å; H167-F226 WeakPolarHBondContact NE2-CB 3.5Å; H167-F226 AromaticContact NE2-CD1 3.62Å; H167-F226 AromaticContact NE2-CG 3.96Å; A168-F226 HydrophobicContact CB-CD1 4.21Å; A168-F226 HydrophobicContact CB-CE1 3.84Å; L194-F226 HydrophobicContact CD1-CE1 4.4Å; T203-F226 HydrophobicContact CG2-CD1 3.83Å; T203-F226 HydrophobicContact CG2-CE1 3.82Å; L224-F226 HydrophobicContact CB-CZ 4.4Å; L224-F226 HydrophobicContact CD1-CZ 4.34Å; F226-G228 PolarHBondContact O-N 2.75Å; F226-S229 WeakPolarHBondContact O-CB 3.44Å; F226-S229 PolarHBondContact O-N 3.43Å; F226-S229 VanDerWaalsContact O-N 3.13Å; F226-H233 AromaticContact CD2-CE1 3.56Å; F226-H233 AromaticContact CD2-ND1 3.75Å; F226-H233 AromaticContact CD2-NE2 3.94Å; F226-H233 AromaticContact CE2-CD2 3.95Å; F226-H233 AromaticContact CE2-CE1 3.91Å; F226-H233 AromaticContact CE2-CG 3.88Å; F226-H233 AromaticContact CE2-ND1 3.82Å; F226-H233 AromaticContact CE2-NE2 4Å
227	G	92.6	Very high	91.9	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.01	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	-132	-178.8	0	0	0	0	0	113.2	H167 G202 R225	H167-G227 PolarHBondContact CE1-N 3.02Å; H167-G227 PolarHBondContact NE2-N 3.45Å; G202-G227 WeakPolarHBondContact O-CA 3.33Å; G202-G227 PolarHBondContact O-N 3.08Å; R225-G227 PolarHBondContact NE-O 3.09Å
228	G	91.1	Very high	91.5	Very high	38 Å²	38	31.8 Å²	31.8	39%	0.392	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	16.4	175.9	0	0	0	0	0	114.9	H160 S162 F226	H160-G228 PolarHBondContact CE1-O 3.2Å; H160-G228 VanDerWaalsContact CE1-O 3.23Å; S162-G228 WeakPolarHBondContact OG-CA 3.32Å; S162-G228 PolarHBondContact OG-N 2.74Å; S162-G228 VanDerWaalsContact OG-N 3.16Å; F226-G228 PolarHBondContact O-N 2.75Å
229	S	91.9	Very high	90.7	Very high	7 Å²	7	39.8 Å²	39.8	5%	0.049	22%	0.224	C	C	.	.			trans	-65	143.6	-178	-173.9	0	0	0	0	112.7	R225 F226 R231	R225-S229 WeakPolarHBondContact CD-O 3.41Å; R225-S229 WeakPolarHBondContact CG-O 3.33Å; F226-S229 WeakPolarHBondContact O-CB 3.44Å; F226-S229 PolarHBondContact O-N 3.43Å; F226-S229 VanDerWaalsContact O-N 3.13Å; S229-R231 VanDerWaalsContact C-N 3.28Å; S229-R231 PolarHBondContact OG-N 3.41Å; S229-R231 VanDerWaalsContact OG-N 3.14Å
230	T	91.1	Very high	90.1	Very high	83 Å²	83	45.7 Å²	45.7	51%	0.509	26%	0.257	S	S	.	.	S	Bend	trans	-81.5	-5.4	169.2	56.6	0	0	0	0	113.4
231	R	91.3	Very high	89.5	Confident	52 Å²	52	45 Å²	45	20%	0.196	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	122	172.6	-58.5	-175.7	-175	-141.5	3.5	110.1	V102 I103 K104 C112 S229 H233	V102-R231 HydrophobicContact CG1-CB 4.05Å; V102-R231 HydrophobicContact CG1-CG 4.34Å; I103-R231 WeakPolarHBondContact O-CA 3.23Å; K104-R231 HydrophobicContact CB-CG 4.43Å; K104-R231 HydrophobicContact CG-CG 4.44Å; C112-R231 PolarHBondContact SG-NH1 2.73Å; S229-R231 VanDerWaalsContact C-N 3.28Å; S229-R231 PolarHBondContact OG-N 3.41Å; S229-R231 VanDerWaalsContact OG-N 3.14Å; R231-H233 PolarHBondContact O-ND1 3.04Å
232	L	92.8	Very high	88.9	Confident	70 Å²	70	46 Å²	46	37%	0.366	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	143.9	167.2	-57.6	179.6	0	0	0	108.7	V102 I103 V223 R225	V102-L232 CarbonylContact C-O 3.49Å; V102-L232 WeakPolarHBondContact CA-O 3.25Å; I103-L232 PolarHBondContact N-O 3.39Å; I103-L232 PolarHBondContact O-N 2.91Å; V223-L232 HydrophobicContact CG1-CB 3.99Å; V223-L232 HydrophobicContact CG1-CD1 4.18Å; V223-L232 HydrophobicContact CG1-CD2 4.18Å; V223-L232 HydrophobicContact CG1-CG 4.34Å; R225-L232 HydrophobicContact CB-CD2 4.04Å; R225-L232 HydrophobicContact CG-CD2 4.17Å
233	H	93.6	Very high	88.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	124.7	178.3	-51.4	64	0	0	0	107.1	L100 E101 L224 F226 R231	L100-H233 HydrophobicContact CD1-CB 3.86Å; L100-H233 HydrophobicContact CD2-CB 4.03Å; L100-H233 HydrophobicContact CG-CB 3.88Å; E101-H233 CarbonylContact O-C 3.57Å; E101-H233 WeakPolarHBondContact O-CA 3.33Å; L224-H233 HydrophobicContact CB-CB 4.26Å; L224-H233 PolarHBondContact N-O 3.34Å; L224-H233 PolarHBondContact O-N 2.99Å; F226-H233 AromaticContact CD2-CE1 3.56Å; F226-H233 AromaticContact CD2-ND1 3.75Å; F226-H233 AromaticContact CD2-NE2 3.94Å; F226-H233 AromaticContact CE2-CD2 3.95Å; F226-H233 AromaticContact CE2-CE1 3.91Å; F226-H233 AromaticContact CE2-CG 3.88Å; F226-H233 AromaticContact CE2-ND1 3.82Å; F226-H233 AromaticContact CE2-NE2 4Å; R231-H233 PolarHBondContact O-ND1 3.04Å
234	I	93.4	Very high	86.9	Confident	36 Å²	36	55.4 Å²	55.4	19%	0.185	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	121.8	-176	-53.5	-171.6	0	0	0	108.6	E101 I103 Y222 V223 Q236	E101-I234 PolarHBondContact N-O 2.92Å; E101-I234 PolarHBondContact O-N 3.23Å; I103-I234 HydrophobicContact CD1-CD1 3.69Å; I103-I234 HydrophobicContact CD1-CG1 4.49Å; Y222-I234 WeakPolarHBondContact O-CA 3.35Å; V223-I234 HydrophobicContact CG1-CG1 4.4Å; V223-I234 HydrophobicContact CG2-CD1 4.25Å; V223-I234 HydrophobicContact CG2-CG1 4.18Å; I234-Q236 PolarHBondContact O-N 3.38Å
235	L	91.8	Very high	85.6	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	119.2	175.1	-175.7	64.7	0	0	0	109.1	Y98 L100 L116 W192 I218 G221 Y222	Y98-L235 HydrophobicContact CD1-CD1 4.04Å; Y98-L235 HydrophobicContact CD1-CD2 4.49Å; Y98-L235 HydrophobicContact CD1-CG 4.34Å; L100-L235 HydrophobicContact CD1-CB 4.31Å; L116-L235 HydrophobicContact CD1-CD1 3.83Å; W192-L235 HydrophobicContact CB-CD2 4.25Å; W192-L235 HydrophobicContact CG-CD2 4.38Å; I218-L235 HydrophobicContact CB-CD2 4.31Å; I218-L235 HydrophobicContact CG2-CB 4.2Å; I218-L235 HydrophobicContact CG2-CD2 3.69Å; G221-L235 PolarHBondContact N-O 2.97Å; Y222-L235 PolarHBondContact O-N 3.49Å
236	Q	89.7	Confident	84.4	Confident	58 Å²	58	65 Å²	65	27%	0.271	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	155.7	167.6	-68.4	174.3	10	0	0	109.1	Y98 K99 E101 I234	Y98-Q236 VanDerWaalsContact CA-O 3.3Å; Y98-Q236 WeakPolarHBondContact CA-O 3.4Å; K99-Q236 HydrophobicContact CG-CB 3.97Å; K99-Q236 PolarHBondContact N-O 3.5Å; K99-Q236 PolarHBondContact O-N 3.32Å; E101-Q236 VanDerWaalsContact CD-CD 3.45Å; E101-Q236 VanDerWaalsContact CD-NE2 3.27Å; E101-Q236 PolarHBondContact OE1-OE1 3.29Å; E101-Q236 PolarHBondContact OE2-NE2 3.01Å; E101-Q236 PolarHBondContact OE2-OE1 3.47Å; I234-Q236 PolarHBondContact O-N 3.38Å
237	G	84.9	Confident	83.3	Confident	28 Å²	28	71.1 Å²	71.1	29%	0.289	39%	0.39	S	S	.	.			trans	173.5	-159.2	-171.1	0	0	0	0	0	109.6
238	P	82.4	Confident	82.4	Confident	28 Å²	28	75.9 Å²	75.9	18%	0.182	41%	0.412	C	S	.	.			trans	-79.7	155	-174.1	30.7	-24.8	0	0	0	111.6	L96 Y98 D240 D241	L96-P238 HydrophobicContact CB-CG 4.29Å; L96-P238 HydrophobicContact CD2-CG 4.05Å; L96-P238 VanDerWaalsContact O-CD 3.3Å; L96-P238 WeakPolarHBondContact O-CD 3.33Å; Y98-P238 HydrophobicContact CE2-CG 4.45Å; P238-D240 PolarHBondContact O-N 2.74Å; P238-D241 PolarHBondContact O-N 2.86Å
239	E	76.7	Confident	81.7	Confident	168 Å²	168	77.1 Å²	77.1	79%	0.785	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-63.3	-27.2	-176	-62.4	-172.4	167.2	0	0	112.8	D241 T242	E239-D241 PolarHBondContact O-N 2.83Å; E239-D241 VanDerWaalsContact O-N 3.12Å; E239-T242 WeakPolarHBondContact O-CB 3.14Å; E239-T242 WeakPolarHBondContact O-CG2 3.36Å; E239-T242 PolarHBondContact O-N 2.66Å; E239-T242 PolarHBondContact O-OG1 3.49Å
240	D	75.9	Confident	80.7	Confident	150 Å²	150	86.1 Å²	86.1	80%	0.802	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-55.6	-27.3	175.5	-55.4	-48.5	0	0	0	113.7	P238	P238-D240 PolarHBondContact O-N 2.74Å
241	D	79	Confident	80	Confident	8 Å²	8	88.5 Å²	88.5	4%	0.043	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-98	9.6	-179.5	-165.5	43.4	0	0	0	113.9	Y98 R217 R219 V220 P238 E239	Y98-D241 WeakPolarHBondContact OH-CB 3.36Å; Y98-D241 PolarHBondContact OH-OD2 3.4Å; R217-D241 IonicContact CZ-OD1 3.73Å; R217-D241 IonicContact CZ-OD2 3.64Å; R217-D241 IonicContact NH1-OD1 2.64Å; R217-D241 PolarHBondContact NH1-OD1 3.24Å; R217-D241 IonicContact NH1-OD2 3.92Å; R217-D241 PolarHBondContact NH1-OD2 2.83Å; R217-D241 IonicContact NH2-OD1 3.36Å; R217-D241 PolarHBondContact NH2-OD1 2.96Å; R219-D241 VanDerWaalsContact CB-O 3.31Å; R219-D241 WeakPolarHBondContact CB-O 3.38Å; R219-D241 PolarHBondContact NH1-O 2.95Å; V220-D241 HydrophobicContact CB-CB 4.49Å; V220-D241 HydrophobicContact CG2-CB 3.84Å; V220-D241 PolarHBondContact N-O 3.49Å; V220-D241 VanDerWaalsContact N-O 3.08Å; P238-D241 PolarHBondContact O-N 2.86Å; E239-D241 PolarHBondContact O-N 2.83Å; E239-D241 VanDerWaalsContact O-N 3.12Å
242	T	78.3	Confident	79.6	Confident	65 Å²	65	89.7 Å²	89.7	40%	0.399	46%	0.462	S	S	.	.	B	Isolated β-bridge	trans	-72.5	146	173.6	59.6	0	0	0	0	111.7	R219 V220 E239 Q244	R219-T242 PolarHBondContact NH1-O 3.12Å; V220-T242 HydrophobicContact CB-CG2 4.16Å; V220-T242 HydrophobicContact CG1-CG2 4.01Å; E239-T242 WeakPolarHBondContact O-CB 3.14Å; E239-T242 WeakPolarHBondContact O-CG2 3.36Å; E239-T242 PolarHBondContact O-N 2.66Å; E239-T242 PolarHBondContact O-OG1 3.49Å; T242-Q244 PolarHBondContact O-N 3.09Å
243	E	75	Confident	78.9	Confident	110 Å²	110	89.5 Å²	89.5	51%	0.514	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-71.2	122.1	175	-166.1	177	-165.3	0	0	109.8	Y222 Q245	Y222-E243 HydrophobicContact CE1-CB 4.42Å; Y222-E243 WeakPolarHBondContact CE1-OE2 3.15Å; Y222-E243 PolarHBondContact OH-OE2 3.31Å; E243-Q245 PolarHBondContact O-N 2.99Å
244	Q	69.2	Low	78.4	Confident	174 Å²	174	94 Å²	94	81%	0.813	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-62.3	122.8	177	-70.5	-175.5	-5.1	0	0	109.8	T242 T246	T242-Q244 PolarHBondContact O-N 3.09Å; Q244-T246 PolarHBondContact O-N 2.97Å
245	Q	68	Low	78	Confident	190 Å²	190	97.3 Å²	97.3	89%	0.888	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-64.8	122.7	179.8	-62.9	-177.2	30.3	0	0	109.9	E243 S247	E243-Q245 PolarHBondContact O-N 2.99Å; Q245-S247 PolarHBondContact O-N 3.46Å
246	T	70.2	Confident	77.3	Confident	98 Å²	98	100.1 Å²	100.1	60%	0.601	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-60.8	123	176.1	52.5	0	0	0	0	110.2	Q244 Q248	Q244-T246 PolarHBondContact O-N 2.97Å; T246-Q248 PolarHBondContact O-N 2.61Å
247	S	71.3	Confident	76.9	Confident	129 Å²	129	103.1 Å²	103.1	90%	0.902	53%	0.527	S	S	*	.	S	Bend	trans	-70.3	-8	179.9	54.1	0	0	0	0	114.8	Q245	Q245-S247 PolarHBondContact O-N 3.46Å
248	Q	73.9	Confident	76.6	Confident	102 Å²	102	106.4 Å²	106.4	48%	0.477	54%	0.535	S	S	.	.	S	Bend	trans	-78.6	143.2	178.1	-67.5	-179	-0.3	0	0	111.4	T246 D252 L253	T246-Q248 PolarHBondContact O-N 2.61Å; Q248-D252 HydrophobicContact CB-CB 4.25Å; Q248-L253 HydrophobicContact CB-CD2 4.27Å; Q248-L253 HydrophobicContact CB-CG 3.93Å; Q248-L253 VanDerWaalsContact OE1-CD2 3.32Å
249	S	76.2	Confident	76.7	Confident	64 Å²	64	109.7 Å²	109.7	45%	0.448	55%	0.548	S	S	.	.			trans	-64.3	154.1	171.8	-173.9	0	0	0	0	110.6	F251 D252 L253	S249-F251 PolarHBondContact O-N 3.15Å; S249-F251 VanDerWaalsContact O-N 3.13Å; S249-F251 PolarHBondContact OG-N 3.48Å; S249-D252 WeakPolarHBondContact CB-OD2 3.45Å; S249-D252 PolarHBondContact N-OD2 3.5Å; S249-D252 PolarHBondContact O-N 3.38Å; S249-L253 PolarHBondContact O-N 2.87Å
250	W	70	Confident	77	Confident	195 Å²	195	109.8 Å²	109.8	74%	0.739	54%	0.542	S	S	*	.	H	α-helix	trans	-53.6	-32.9	169.9	177.4	88.2	0	0	0	112.1	K254	W250-K254 HydrophobicContact CH2-CD 3.86Å; W250-K254 HydrophobicContact CZ2-CD 4.35Å; W250-K254 HydrophobicContact CZ3-CD 4.23Å; W250-K254 VanDerWaalsContact O-CB 3.32Å; W250-K254 WeakPolarHBondContact O-CB 3.37Å; W250-K254 PolarHBondContact O-N 3.1Å
251	F	76.7	Confident	77.3	Confident	133 Å²	133	108.3 Å²	108.3	58%	0.583	53%	0.529	S	S	*	.	H	α-helix	trans	-65.7	-43.6	175	-173	-94.6	0	0	0	112.2	S249 K254 K255	S249-F251 PolarHBondContact O-N 3.15Å; S249-F251 VanDerWaalsContact O-N 3.13Å; S249-F251 PolarHBondContact OG-N 3.48Å; F251-K254 PolarHBondContact O-N 2.82Å; F251-K255 WeakPolarHBondContact O-CB 3.28Å; F251-K255 PolarHBondContact O-N 3.16Å
252	D	83.1	Confident	77.4	Confident	77 Å²	77	114 Å²	114	41%	0.412	56%	0.556	S	S	.	*	H	α-helix	trans	-69.3	-42.7	-179.9	-50.5	-40.8	0	0	0	111	Q248 S249 K254 K255 S256	Q248-D252 HydrophobicContact CB-CB 4.25Å; S249-D252 WeakPolarHBondContact CB-OD2 3.45Å; S249-D252 PolarHBondContact N-OD2 3.5Å; S249-D252 PolarHBondContact O-N 3.38Å; D252-K254 VanDerWaalsContact C-N 3.35Å; D252-K254 PolarHBondContact O-N 3.16Å; D252-K255 PolarHBondContact O-N 3.32Å; D252-S256 VanDerWaalsContact O-CB 3.31Å; D252-S256 WeakPolarHBondContact O-CB 3.28Å; D252-S256 PolarHBondContact O-N 3.38Å
253	L	77.1	Confident	77.7	Confident	67 Å²	67	115.4 Å²	115.4	35%	0.351	56%	0.561	S	S	.	*	H	α-helix	trans	-60	-43.4	173.5	-75.1	166.6	0	0	0	111.8	Q248 S249 H257	Q248-L253 HydrophobicContact CB-CD2 4.27Å; Q248-L253 HydrophobicContact CB-CG 3.93Å; Q248-L253 VanDerWaalsContact OE1-CD2 3.32Å; S249-L253 PolarHBondContact O-N 2.87Å; L253-H257 WeakPolarHBondContact O-CB 3.2Å; L253-H257 PolarHBondContact O-N 3.38Å
254	K	83.5	Confident	77.9	Confident	93 Å²	93	111.3 Å²	111.3	40%	0.404	55%	0.545	S	S	.	.	H	α-helix	trans	-63.5	-47.9	175.7	-175	-169.1	165.1	-162.4	0	110.8	W250 F251 D252 H257 E258	W250-K254 HydrophobicContact CH2-CD 3.86Å; W250-K254 HydrophobicContact CZ2-CD 4.35Å; W250-K254 HydrophobicContact CZ3-CD 4.23Å; W250-K254 VanDerWaalsContact O-CB 3.32Å; W250-K254 WeakPolarHBondContact O-CB 3.37Å; W250-K254 PolarHBondContact O-N 3.1Å; F251-K254 PolarHBondContact O-N 2.82Å; D252-K254 VanDerWaalsContact C-N 3.35Å; D252-K254 PolarHBondContact O-N 3.16Å; K254-H257 PolarHBondContact O-N 3.4Å; K254-E258 VanDerWaalsContact CE-CD 3.48Å; K254-E258 WeakPolarHBondContact CE-OE1 3.42Å; K254-E258 IonicContact NZ-OE1 2.75Å; K254-E258 PolarHBondContact NZ-OE1 3.43Å; K254-E258 PolarHBondContact O-N 3.07Å
255	K	84.5	Confident	78.5	Confident	106 Å²	106	108.8 Å²	108.8	46%	0.461	53%	0.531	S	S	.	.	H	α-helix	trans	-58.4	-49	178.5	-179.8	-172.9	162.2	-170.7	0	111.2	F251 D252 H257 E258 E259	F251-K255 WeakPolarHBondContact O-CB 3.28Å; F251-K255 PolarHBondContact O-N 3.16Å; D252-K255 PolarHBondContact O-N 3.32Å; K255-H257 VanDerWaalsContact C-N 3.31Å; K255-H257 PolarHBondContact O-N 3.32Å; K255-E258 PolarHBondContact O-N 2.95Å; K255-E259 WeakPolarHBondContact CE-OE1 3.35Å; K255-E259 WeakPolarHBondContact CE-OE2 3.39Å; K255-E259 HydrophobicContact CG-CG 4.44Å; K255-E259 IonicContact NZ-OE1 2.66Å; K255-E259 PolarHBondContact NZ-OE1 3.49Å; K255-E259 WeakPolarHBondContact O-CG 3.23Å; K255-E259 PolarHBondContact O-N 2.84Å
256	S	77.8	Confident	79	Confident	59 Å²	59	105.6 Å²	105.6	41%	0.413	52%	0.518	S	S	.	.	H	α-helix	trans	-58.5	-40.5	177.5	178.7	0	0	0	0	112.2	D252 E259 Y260	D252-S256 VanDerWaalsContact O-CB 3.31Å; D252-S256 WeakPolarHBondContact O-CB 3.28Å; D252-S256 PolarHBondContact O-N 3.38Å; S256-E259 PolarHBondContact O-N 3.33Å; S256-Y260 WeakPolarHBondContact O-CB 3.37Å; S256-Y260 PolarHBondContact O-N 2.84Å
257	H	81.4	Confident	79.4	Confident	122 Å²	122	106.5 Å²	106.5	57%	0.565	52%	0.515	S	S	*	.	H	α-helix	trans	-65.3	-38	174	-177.5	70.3	0	0	0	113	L253 K254 K255 K261	L253-H257 WeakPolarHBondContact O-CB 3.2Å; L253-H257 PolarHBondContact O-N 3.38Å; K254-H257 PolarHBondContact O-N 3.4Å; K255-H257 VanDerWaalsContact C-N 3.31Å; K255-H257 PolarHBondContact O-N 3.32Å; H257-K261 WeakPolarHBondContact O-CB 3.44Å; H257-K261 PolarHBondContact O-N 2.9Å; H257-K261 VanDerWaalsContact O-N 3.1Å
258	E	79.4	Confident	79.6	Confident	96 Å²	96	107.2 Å²	107.2	45%	0.449	50%	0.498	S	S	.	.	H	α-helix	trans	-70.1	-40.5	176.1	-72.4	176.4	166.4	0	0	111.6	K254 K255 K261 M262	K254-E258 VanDerWaalsContact CE-CD 3.48Å; K254-E258 WeakPolarHBondContact CE-OE1 3.42Å; K254-E258 IonicContact NZ-OE1 2.75Å; K254-E258 PolarHBondContact NZ-OE1 3.43Å; K254-E258 PolarHBondContact O-N 3.07Å; K255-E258 PolarHBondContact O-N 2.95Å; E258-K261 PolarHBondContact O-N 3.48Å; E258-M262 WeakPolarHBondContact O-CG 3.45Å; E258-M262 PolarHBondContact O-N 2.91Å
259	E	84.1	Confident	79.6	Confident	98 Å²	98	107.3 Å²	107.3	46%	0.458	50%	0.502	S	S	.	.	H	α-helix	trans	-62.9	-49.5	173.6	-72.7	174.6	152.3	0	0	111.7	K255 S256 K261 M262 N263	K255-E259 WeakPolarHBondContact CE-OE1 3.35Å; K255-E259 WeakPolarHBondContact CE-OE2 3.39Å; K255-E259 HydrophobicContact CG-CG 4.44Å; K255-E259 IonicContact NZ-OE1 2.66Å; K255-E259 PolarHBondContact NZ-OE1 3.49Å; K255-E259 WeakPolarHBondContact O-CG 3.23Å; K255-E259 PolarHBondContact O-N 2.84Å; S256-E259 PolarHBondContact O-N 3.33Å; E259-K261 VanDerWaalsContact C-N 3.26Å; E259-K261 PolarHBondContact O-N 3.49Å; E259-M262 PolarHBondContact O-N 2.91Å; E259-N263 PolarHBondContact O-N 3.26Å; E259-N263 PolarHBondContact O-OD1 3.02Å
260	Y	82.3	Confident	79.6	Confident	170 Å²	170	107.7 Å²	107.7	67%	0.667	50%	0.498	S	S	*	.	H	α-helix	trans	-56.9	-40	175.4	-176.1	-89.6	0	0	0	112.3	S256 S264	S256-Y260 WeakPolarHBondContact O-CB 3.37Å; S256-Y260 PolarHBondContact O-N 2.84Å; Y260-S264 WeakPolarHBondContact O-CB 3.48Å; Y260-S264 PolarHBondContact O-N 2.86Å; Y260-S264 PolarHBondContact O-OG 3.46Å
261	K	83.5	Confident	79.6	Confident	119 Å²	119	101.4 Å²	101.4	52%	0.517	48%	0.484	S	S	.	.	H	α-helix	trans	-70.4	-29	177.4	-175.2	178.2	-179.4	-179.1	0	113	H257 E258 E259 K265	H257-K261 WeakPolarHBondContact O-CB 3.44Å; H257-K261 PolarHBondContact O-N 2.9Å; H257-K261 VanDerWaalsContact O-N 3.1Å; E258-K261 PolarHBondContact O-N 3.48Å; E259-K261 VanDerWaalsContact C-N 3.26Å; E259-K261 PolarHBondContact O-N 3.49Å; K261-K265 WeakPolarHBondContact O-CG 3.22Å
262	M	79.5	Confident	79.2	Confident	127 Å²	127	98.9 Å²	98.9	63%	0.626	48%	0.483	S	S	*	.	H	α-helix	trans	-75.6	-47.8	172.4	-71.8	-59.7	-150.7	0	0	111.5	E258 E259 S264 K265 M266	E258-M262 WeakPolarHBondContact O-CG 3.45Å; E258-M262 PolarHBondContact O-N 2.91Å; E259-M262 PolarHBondContact O-N 2.91Å; M262-S264 VanDerWaalsContact C-N 3.33Å; M262-S264 PolarHBondContact O-N 3.41Å; M262-K265 WeakPolarHBondContact O-CA 3.44Å; M262-K265 WeakPolarHBondContact O-CB 3.24Å; M262-K265 PolarHBondContact O-N 2.85Å; M262-M266 PolarHBondContact O-N 3.21Å
263	N	84.9	Confident	78.4	Confident	94 Å²	94	100 Å²	100	50%	0.503	49%	0.488	S	S	.	.	H	α-helix	trans	-57.9	-47	176.4	-74.5	24.2	0	0	0	111.1	E259 K265 M266 E267	E259-N263 PolarHBondContact O-N 3.26Å; E259-N263 PolarHBondContact O-OD1 3.02Å; N263-K265 PolarHBondContact O-N 2.85Å; N263-M266 PolarHBondContact O-N 2.73Å; N263-E267 WeakPolarHBondContact O-CG 3.39Å; N263-E267 PolarHBondContact O-N 3.07Å
264	S	79	Confident	77.6	Confident	24 Å²	24	102.6 Å²	102.6	17%	0.168	50%	0.498	C	S	.	.	H	α-helix	trans	-53.7	-25.5	173.4	-74.2	0	0	0	0	114.4	Y260 M262 R268	Y260-S264 WeakPolarHBondContact O-CB 3.48Å; Y260-S264 PolarHBondContact O-N 2.86Å; Y260-S264 PolarHBondContact O-OG 3.46Å; M262-S264 VanDerWaalsContact C-N 3.33Å; M262-S264 PolarHBondContact O-N 3.41Å; S264-R268 WeakPolarHBondContact O-CD 3.49Å; S264-R268 WeakPolarHBondContact O-CG 3.49Å; S264-R268 PolarHBondContact O-NH1 3.16Å
265	K	83.1	Confident	76.3	Confident	122 Å²	122	103.7 Å²	103.7	53%	0.53	51%	0.508	S	S	.	.	H	α-helix	trans	-88.4	-41.9	173.5	-74.9	178.5	169.7	-165.1	0	111.8	K261 M262 N263 R268 N269	K261-K265 WeakPolarHBondContact O-CG 3.22Å; M262-K265 WeakPolarHBondContact O-CA 3.44Å; M262-K265 WeakPolarHBondContact O-CB 3.24Å; M262-K265 PolarHBondContact O-N 2.85Å; N263-K265 PolarHBondContact O-N 2.85Å; K265-R268 PolarHBondContact O-N 2.83Å; K265-N269 PolarHBondContact O-N 3.47Å
266	M	77	Confident	74.6	Confident	122 Å²	122	102.1 Å²	102.1	60%	0.601	51%	0.511	S	S	*	.	H	α-helix	trans	-64.2	-40.8	-178.9	-171.6	163.3	179.3	0	0	111.7	M262 N263 N269 I270	M262-M266 PolarHBondContact O-N 3.21Å; N263-M266 PolarHBondContact O-N 2.73Å; M266-N269 PolarHBondContact O-N 3.11Å; M266-I270 HydrophobicContact CE-CD1 4.21Å; M266-I270 HydrophobicContact CG-CD1 3.86Å; M266-I270 HydrophobicContact CG-CG1 4.45Å; M266-I270 WeakPolarHBondContact O-CB 2.99Å; M266-I270 VanDerWaalsContact O-CG1 3.28Å; M266-I270 WeakPolarHBondContact O-CG1 3.37Å; M266-I270 PolarHBondContact O-N 2.82Å
267	E	78.4	Confident	73.3	Confident	118 Å²	118	105.6 Å²	105.6	55%	0.551	53%	0.525	S	S	*	.	H	α-helix	trans	-59.3	-48.8	173.5	-71.6	165.1	-177.4	0	0	111.7	N263 N269 I270 S271	N263-E267 WeakPolarHBondContact O-CG 3.39Å; N263-E267 PolarHBondContact O-N 3.07Å; E267-N269 VanDerWaalsContact C-N 3.29Å; E267-N269 PolarHBondContact O-N 3.34Å; E267-I270 PolarHBondContact O-N 2.93Å; E267-I270 VanDerWaalsContact O-N 3.16Å; E267-S271 PolarHBondContact O-N 3.14Å; E267-S271 PolarHBondContact O-OG 2.81Å
268	R	76.8	Confident	71.8	Confident	144 Å²	144	105.1 Å²	105.1	54%	0.543	53%	0.531	S	S	.	.	H	α-helix	trans	-57.5	-41.1	175.8	-72.3	177.4	173.4	97.2	-4.1	112.1	S264 K265 S272	S264-R268 WeakPolarHBondContact O-CD 3.49Å; S264-R268 WeakPolarHBondContact O-CG 3.49Å; S264-R268 PolarHBondContact O-NH1 3.16Å; K265-R268 PolarHBondContact O-N 2.83Å; R268-S272 PolarHBondContact O-N 3.36Å; R268-S272 VanDerWaalsContact O-N 3.11Å
269	N	74.1	Confident	70.2	Confident	104 Å²	104	105.4 Å²	105.4	56%	0.556	54%	0.539	S	S	*	.	H	α-helix	trans	-68.7	-41.5	176.5	-71.8	1.3	0	0	0	112.2	K265 M266 E267 S272 I273	K265-N269 PolarHBondContact O-N 3.47Å; M266-N269 PolarHBondContact O-N 3.11Å; E267-N269 VanDerWaalsContact C-N 3.29Å; E267-N269 PolarHBondContact O-N 3.34Å; N269-S272 WeakPolarHBondContact O-CB 3.31Å; N269-S272 PolarHBondContact O-N 2.95Å; N269-I273 WeakPolarHBondContact O-CG1 3.47Å; N269-I273 PolarHBondContact O-N 2.9Å
270	I	75	Confident	68.4	Low	72 Å²	72	110 Å²	110	37%	0.369	56%	0.557	S	S	.	*	H	α-helix	trans	-63.6	-46.5	177.9	-71.5	165.8	0	0	0	110.6	M266 E267 S272 I273 Q274	M266-I270 HydrophobicContact CE-CD1 4.21Å; M266-I270 HydrophobicContact CG-CD1 3.86Å; M266-I270 HydrophobicContact CG-CG1 4.45Å; M266-I270 WeakPolarHBondContact O-CB 2.99Å; M266-I270 VanDerWaalsContact O-CG1 3.28Å; M266-I270 WeakPolarHBondContact O-CG1 3.37Å; M266-I270 PolarHBondContact O-N 2.82Å; E267-I270 PolarHBondContact O-N 2.93Å; E267-I270 VanDerWaalsContact O-N 3.16Å; I270-S272 VanDerWaalsContact C-N 3.26Å; I270-S272 PolarHBondContact O-N 3.19Å; I270-I273 PolarHBondContact O-N 2.92Å; I270-I273 VanDerWaalsContact O-N 3.15Å; I270-Q274 HydrophobicContact CG2-CG 4.26Å; I270-Q274 WeakPolarHBondContact O-CB 3.26Å; I270-Q274 WeakPolarHBondContact O-CG 3.22Å; I270-Q274 PolarHBondContact O-N 3.28Å
271	S	70.5	Confident	66.3	Low	63 Å²	63	109.5 Å²	109.5	44%	0.441	57%	0.565	S	S	.	*	H	α-helix	trans	-60.3	-36.2	175	-58.3	0	0	0	0	112.2	E267 N275	E267-S271 PolarHBondContact O-N 3.14Å; E267-S271 PolarHBondContact O-OG 2.81Å; S271-N275 WeakPolarHBondContact O-CB 3.5Å; S271-N275 VanDerWaalsContact O-CG 3.28Å; S271-N275 PolarHBondContact O-N 2.88Å; S271-N275 VanDerWaalsContact O-N 3.08Å
272	S	69.2	Low	64.4	Low	80 Å²	80	111.6 Å²	111.6	56%	0.559	58%	0.577	S	S	*	*	H	α-helix	trans	-65	-41.5	174.2	-168.2	0	0	0	0	112.7	R268 N269 I270 S276	R268-S272 PolarHBondContact O-N 3.36Å; R268-S272 VanDerWaalsContact O-N 3.11Å; N269-S272 WeakPolarHBondContact O-CB 3.31Å; N269-S272 PolarHBondContact O-N 2.95Å; I270-S272 VanDerWaalsContact C-N 3.26Å; I270-S272 PolarHBondContact O-N 3.19Å; S272-S276 PolarHBondContact O-N 3.12Å; S272-S276 VanDerWaalsContact O-N 3.11Å
273	I	65.8	Low	62.7	Low	99 Å²	99	111.7 Å²	111.7	51%	0.508	59%	0.589	S	S	.	*	H	α-helix	trans	-74.9	-34.3	-178.9	-66.5	163.1	0	0	0	111.5	N269 I270 S276 N277	N269-I273 WeakPolarHBondContact O-CG1 3.47Å; N269-I273 PolarHBondContact O-N 2.9Å; I270-I273 PolarHBondContact O-N 2.92Å; I270-I273 VanDerWaalsContact O-N 3.15Å; I273-S276 WeakPolarHBondContact CA-OG 3.29Å; I273-S276 PolarHBondContact O-N 3.29Å; I273-S276 PolarHBondContact O-OG 3.43Å; I273-N277 PolarHBondContact O-N 3.25Å
274	Q	59.5	Low	60.8	Low	122 Å²	122	111 Å²	111	57%	0.57	59%	0.585	S	S	*	*	H	α-helix	trans	-66.5	-42.3	174.3	-73.9	176.8	-14.1	0	0	111.1	I270 S276 N277 T278	I270-Q274 HydrophobicContact CG2-CG 4.26Å; I270-Q274 WeakPolarHBondContact O-CB 3.26Å; I270-Q274 WeakPolarHBondContact O-CG 3.22Å; I270-Q274 PolarHBondContact O-N 3.28Å; Q274-S276 PolarHBondContact O-N 2.95Å; Q274-N277 PolarHBondContact O-N 3.34Å; Q274-T278 PolarHBondContact O-OG1 3.47Å
275	N	56.2	Low	59.2	Low	116 Å²	116	121.4 Å²	121.4	62%	0.62	62%	0.621	S	S	*	*	H	α-helix	trans	-68.1	-29.4	175.4	-72.8	-2.1	0	0	0	113.4	S271	S271-N275 WeakPolarHBondContact O-CB 3.5Å; S271-N275 VanDerWaalsContact O-CG 3.28Å; S271-N275 PolarHBondContact O-N 2.88Å; S271-N275 VanDerWaalsContact O-N 3.08Å
276	S	48.3	Very low	57.9	Low	73 Å²	73	119.2 Å²	119.2	51%	0.51	63%	0.633	S	S	.	*	H	α-helix	trans	-76	-24.7	177.8	64.3	0	0	0	0	113.9	S272 I273 Q274	S272-S276 PolarHBondContact O-N 3.12Å; S272-S276 VanDerWaalsContact O-N 3.11Å; I273-S276 WeakPolarHBondContact CA-OG 3.29Å; I273-S276 PolarHBondContact O-N 3.29Å; I273-S276 PolarHBondContact O-OG 3.43Å; Q274-S276 PolarHBondContact O-N 2.95Å
277	N	51.2	Low	56.5	Low	132 Å²	132	121.3 Å²	121.3	71%	0.706	64%	0.643	S	S	*	*	H	α-helix	trans	-90.9	-10.2	-173.4	-73	-5.8	0	0	0	114.3	I273 Q274	I273-N277 PolarHBondContact O-N 3.25Å; Q274-N277 PolarHBondContact O-N 3.34Å
278	T	50.7	Low	55.1	Low	113 Å²	113	119.8 Å²	119.8	69%	0.693	65%	0.646	S	S	*	*	S	Bend	trans	-98.9	-11.8	-178.5	49.5	0	0	0	0	114.3	Q274	Q274-T278 PolarHBondContact O-OG1 3.47Å
279	V	45	Very low	53.6	Low	102 Å²	102	118.8 Å²	118.8	62%	0.618	65%	0.651	S	S	*	*			trans	-110.7	94.1	-174.4	-172.1	0	0	0	0	110.8
280	K	47	Very low	52.2	Low	193 Å²	193	123.2 Å²	123.2	84%	0.839	67%	0.668	S	S	*	*			trans	-106.5	111.9	178.1	-171.6	178.2	-176.8	-179.7	0	110.2
281	L	38.4	Very low	50.7	Low	160 Å²	160	126 Å²	126	84%	0.838	68%	0.683	S	S	*	*	S	Bend	trans	67.7	62.2	172.6	-64.3	163.4	0	0	0	116.7
282	E	42.5	Very low	49.6	Very low	163 Å²	163	128 Å²	128	76%	0.762	70%	0.695	S	S	*	*			trans	-161.5	119.3	139	-118	170.2	-151.7	0	0	111.4	N284	E282-N284 VanDerWaalsContact C-N 3.31Å; E282-N284 PolarHBondContact O-N 2.9Å
283	C	43	Very low	48.4	Very low	130 Å²	130	131.5 Å²	131.5	88%	0.878	71%	0.713	S	S	*	*			trans	-85.7	68.7	-178.7	-74.2	0	0	0	0	111.6	W285	C283-W285 PolarHBondContact O-N 2.97Å
284	N	46.1	Very low	47.2	Very low	80 Å²	80	131.4 Å²	131.4	43%	0.428	72%	0.721	S	S	.	*			trans	-82.3	113.1	179.8	-170.8	0.9	0	0	0	110.7	E282 G286 M287 S288	E282-N284 VanDerWaalsContact C-N 3.31Å; E282-N284 PolarHBondContact O-N 2.9Å; N284-G286 PolarHBondContact O-N 3.49Å; N284-M287 PolarHBondContact OD1-N 3.36Å; N284-S288 WeakPolarHBondContact ND2-CB 3.46Å; N284-S288 PolarHBondContact ND2-N 3.49Å; N284-S288 PolarHBondContact ND2-O 3.29Å; N284-S288 PolarHBondContact OD1-N 2.87Å
285	W	46.3	Very low	46.3	Very low	242 Å²	242	133.9 Å²	133.9	92%	0.917	73%	0.732	S	S	*	*			trans	-73.6	43.8	175.4	-80.1	89.6	0	0	0	112.6	C283 M287	C283-W285 PolarHBondContact O-N 2.97Å; W285-M287 VanDerWaalsContact C-N 3.3Å; W285-M287 PolarHBondContact O-N 3.47Å
286	G	54.2	Low	45.4	Very low	76 Å²	76	133.3 Å²	133.3	78%	0.784	74%	0.735	S	S	*	*	S	Bend	trans	64.8	26.9	-179.5	0	0	0	0	0	114.8	N284	N284-G286 PolarHBondContact O-N 3.49Å
287	M	47.2	Very low	44.7	Very low	165 Å²	165	137.1 Å²	137.1	81%	0.813	75%	0.748	S	S	*	*			trans	-125.1	-9.1	-167.2	-81.9	-155.4	72.4	0	0	116.7	N284 W285	N284-M287 PolarHBondContact OD1-N 3.36Å; W285-M287 VanDerWaalsContact C-N 3.3Å; W285-M287 PolarHBondContact O-N 3.47Å
288	S	50.1	Low	43.9	Very low	87 Å²	87	136.8 Å²	136.8	61%	0.608	75%	0.753	S	S	*	*			trans	-108.5	134	174.9	-162	0	0	0	0	112.1	N284	N284-S288 WeakPolarHBondContact ND2-CB 3.46Å; N284-S288 PolarHBondContact ND2-N 3.49Å; N284-S288 PolarHBondContact ND2-O 3.29Å; N284-S288 PolarHBondContact OD1-N 2.87Å
289	L	45.9	Very low	43.2	Very low	123 Å²	123	136.7 Å²	136.7	64%	0.644	75%	0.753	S	S	*	*			cis	172.9	123.3	-32.9	162.2	68.7	0	0	0	105.9
290	E	44.6	Very low	42.9	Very low	196 Å²	196	140.2 Å²	140.2	92%	0.916	77%	0.767	S	S	*	*			trans	-170.9	77.6	156.9	-112	168.9	-157.9	0	0	111.6
291	D	43.4	Very low	42.6	Very low	130 Å²	130	138.6 Å²	138.6	70%	0.695	77%	0.767	S	S	*	*				13.4	163.7	124.1	-87.8	11.2	0	0	0	121.4
292	P	46.5	Very low	42.6	Very low	106 Å²	106	139.3 Å²	139.3	69%	0.688	77%	0.766	S	S	*	*			cis	-144.4	140.4	-39.2	37.1	-19.2	0	0	0	113.9
293	V	45	Very low	42.1	Very low	153 Å²	153	136.1 Å²	136.1	93%	0.927	76%	0.761	S	S	*	*			trans	-138.2	141.9	162.9	-173	0	0	0	0	110.8
294	S	40	Very low	42.3	Very low	97 Å²	97	134.2 Å²	134.2	68%	0.678	76%	0.763	S	S	*	*			trans	-91.8	168.3	-156.6	48.7	0	0	0	0	117.3
295	E	41.1	Very low	42.4	Very low	175 Å²	175	136.4 Å²	136.4	82%	0.818	78%	0.78	S	S	*	*			trans	85.7	153.8	161.8	-44.3	-152.4	168	0	0	117.9
296	P	36.3	Very low	42.8	Very low	104 Å²	104	128.2 Å²	128.2	68%	0.675	76%	0.759	S	S	*	*				-133.2	151.6	-67.6	35.9	-20.5	0	0	0	115.3
297	I	33.8	Very low	43.2	Very low	152 Å²	152	127.1 Å²	127.1	78%	0.779	74%	0.735	S	S	*	*			trans	60	92.5	162.6	-49.9	157.3	0	0	0	116.8
298	P	35.8	Very low	44.1	Very low	125 Å²	125	123.4 Å²	123.4	81%	0.812	73%	0.725	S	S	*	*			trans	-89.6	109.4	160.6	26.8	-16.7	0	0	0	111.5	L300	P298-L300 PolarHBondContact O-N 2.81Å; P298-L300 VanDerWaalsContact O-N 3.16Å
299	T	35.1	Very low	45.3	Very low	112 Å²	112	121 Å²	121	69%	0.687	70%	0.704	S	S	*	*			trans	-34.8	105.8	174.7	-50.4	0	0	0	0	115.3	L301	T299-L301 HydrophobicContact CG2-CB 4.34Å; T299-L301 PolarHBondContact O-N 3.29Å
300	L	39.8	Very low	47.1	Very low	176 Å²	176	118.1 Å²	118.1	92%	0.921	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	3.4	-174.5	-164.3	63.5	0	0	0	115.8	P298	P298-L300 PolarHBondContact O-N 2.81Å; P298-L300 VanDerWaalsContact O-N 3.16Å
301	L	40.8	Very low	48.8	Very low	159 Å²	159	117.7 Å²	117.7	83%	0.832	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	2.6	-156	-125.8	73	0	0	0	116.6	T299	T299-L301 HydrophobicContact CG2-CB 4.34Å; T299-L301 PolarHBondContact O-N 3.29Å
302	Q	37	Very low	50.5	Low	175 Å²	175	116 Å²	116	82%	0.818	67%	0.673	S	S	*	*	S	Bend	trans	-141.2	27.2	-162.5	-144.8	168	8.2	0	0	117.6
303	S	33.4	Very low	52.4	Low	95 Å²	95	111 Å²	111	66%	0.664	64%	0.641	S	S	*	*			trans	-130.1	97.4	174.6	-68.8	0	0	0	0	112.5	T305	S303-T305 PolarHBondContact O-N 3.07Å
304	G	45.9	Very low	54.4	Low	90 Å²	90	111.5 Å²	111.5	93%	0.928	63%	0.626	S	S	*	*			trans	-78.1	62.2	176.5	0	0	0	0	0	113.2
305	T	48.4	Very low	56.5	Low	126 Å²	126	113.7 Å²	113.7	77%	0.773	63%	0.63	S	S	*	*			trans	-123.9	13.6	-165.9	54.2	0	0	0	0	115.1	S303	S303-T305 PolarHBondContact O-N 3.07Å
306	C	53.8	Low	58.7	Low	71 Å²	71	109.9 Å²	109.9	48%	0.48	62%	0.615	S	S	.	*			trans	-127.4	17.3	-171.5	56.5	0	0	0	0	116.1	S308	C306-S308 PolarHBondContact O-N 3.36Å; C306-S308 VanDerWaalsContact O-N 3.15Å
307	L	62.6	Low	61.3	Low	53 Å²	53	105.3 Å²	105.3	28%	0.277	59%	0.585	S	S	.	*			trans	-85.1	75.2	171.2	-58.7	-177.8	0	0	0	110.6	H309 E310 Q382 D385 R386	L307-H309 VanDerWaalsContact C-N 3.27Å; L307-H309 PolarHBondContact O-N 2.99Å; L307-E310 HydrophobicContact CB-CB 4.21Å; L307-E310 HydrophobicContact CD1-CG 4.37Å; L307-Q382 HydrophobicContact CD1-CG 4.02Å; L307-Q382 HydrophobicContact CD2-CB 4.1Å; L307-Q382 HydrophobicContact CD2-CG 4.2Å; L307-D385 WeakPolarHBondContact CA-OD2 3.5Å; L307-D385 HydrophobicContact CD2-CB 3.85Å; L307-R386 HydrophobicContact CD2-CG 3.91Å
308	S	66.7	Low	64	Low	86 Å²	86	103.1 Å²	103.1	60%	0.601	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-28.7	-176.8	43.2	0	0	0	0	113.5	C306	C306-S308 PolarHBondContact O-N 3.36Å; C306-S308 VanDerWaalsContact O-N 3.15Å
309	H	76.1	Confident	66.5	Low	37 Å²	37	106 Å²	106	17%	0.171	57%	0.565	C	S	.	*	T	Hydrogen-bonded Turn	trans	-113.7	13.7	-170.9	-49.5	112.8	0	0	0	113.7	L307 K311 L312 Y313 D385 F390	L307-H309 VanDerWaalsContact C-N 3.27Å; L307-H309 PolarHBondContact O-N 2.99Å; H309-K311 PolarHBondContact O-N 3.41Å; H309-L312 HydrophobicContact CB-CD1 3.99Å; H309-L312 PolarHBondContact O-N 3.19Å; H309-Y313 VanDerWaalsContact C-CE1 3.49Å; H309-Y313 HydrophobicContact CB-CE1 4.31Å; H309-Y313 WeakPolarHBondContact O-CD1 3.44Å; H309-Y313 WeakPolarHBondContact O-CE1 3.29Å; H309-D385 VanDerWaalsContact CB-OD1 3.31Å; H309-D385 WeakPolarHBondContact CB-OD1 3.47Å; H309-D385 IonicContact CE1-OD1 2.7Å; H309-D385 IonicContact CG-OD1 2.73Å; H309-D385 PolarHBondContact N-OD1 3.01Å; H309-D385 PolarHBondContact N-OD2 3.46Å; H309-D385 VanDerWaalsContact N-OD2 3.12Å; H309-D385 IonicContact ND1-OD1 3.2Å; H309-D385 PolarHBondContact ND1-OD1 3.43Å; H309-F390 HydrophobicContact CB-CD1 4.01Å; H309-F390 PolarHBondContact ND1-O 3.48Å
310	E	83.3	Confident	69	Low	62 Å²	62	101.4 Å²	101.4	29%	0.29	54%	0.538	S	S	.	.	H	α-helix	trans	-45.2	-38.2	-177.9	-154.2	-150.6	131.1	0	0	113.5	L307 L312 Y313 R314 D385	L307-E310 HydrophobicContact CB-CB 4.21Å; L307-E310 HydrophobicContact CD1-CG 4.37Å; E310-L312 VanDerWaalsContact C-N 3.28Å; E310-L312 PolarHBondContact O-N 3.02Å; E310-Y313 VanDerWaalsContact CA-CZ 3.46Å; E310-Y313 HydrophobicContact CG-CE2 4.16Å; E310-Y313 PolarHBondContact O-N 3.26Å; E310-R314 WeakPolarHBondContact O-CB 3.46Å; E310-R314 PolarHBondContact O-N 2.89Å; E310-R314 WeakPolarHBondContact OE1-CD 3.21Å; E310-R314 IonicContact OE1-CZ 3.35Å; E310-R314 IonicContact OE1-NE 3.4Å; E310-R314 IonicContact OE1-NH1 3.98Å; E310-R314 PolarHBondContact OE1-NH1 2.88Å; E310-D385 PolarHBondContact N-OD2 3.07Å
311	K	80.6	Confident	71.3	Confident	187 Å²	187	93 Å²	93	81%	0.813	50%	0.495	S	S	*	.	H	α-helix	trans	-63.2	-24.8	179.8	-62.4	173.2	-174.1	166.5	0	114.6	H309	H309-K311 PolarHBondContact O-N 3.41Å
312	L	78.6	Confident	73.5	Confident	96 Å²	96	87.8 Å²	87.8	50%	0.503	47%	0.467	S	S	.	.	H	α-helix	trans	-83.4	-29.9	-177.8	-73.8	100.1	0	0	0	113.2	H309 E310 P392	H309-L312 HydrophobicContact CB-CD1 3.99Å; H309-L312 PolarHBondContact O-N 3.19Å; E310-L312 VanDerWaalsContact C-N 3.28Å; E310-L312 PolarHBondContact O-N 3.02Å; L312-P392 HydrophobicContact CD1-CG 4.32Å; L312-P392 HydrophobicContact CD2-CB 3.86Å; L312-P392 HydrophobicContact CD2-CG 3.78Å
313	Y	86.5	Confident	75.8	Confident	1 Å²	1	81.7 Å²	81.7	0%	0.004	45%	0.447	C	S	.	.	H	α-helix	trans	-107.3	-5.7	-179.5	55.3	-97.6	0	0	0	114.2	H309 E310 D315 P317 C381 Q382 D385 F390	H309-Y313 VanDerWaalsContact C-CE1 3.49Å; H309-Y313 HydrophobicContact CB-CE1 4.31Å; H309-Y313 WeakPolarHBondContact O-CD1 3.44Å; H309-Y313 WeakPolarHBondContact O-CE1 3.29Å; E310-Y313 VanDerWaalsContact CA-CZ 3.46Å; E310-Y313 HydrophobicContact CG-CE2 4.16Å; E310-Y313 PolarHBondContact O-N 3.26Å; Y313-D315 PolarHBondContact O-N 3.29Å; Y313-P317 WeakPolarHBondContact O-CA 3.32Å; Y313-P317 WeakPolarHBondContact O-CB 3.42Å; Y313-P317 WeakPolarHBondContact O-CD 3.44Å; Y313-P317 VanDerWaalsContact O-N 3.11Å; Y313-C381 HydrophobicContact CD1-CB 3.73Å; Y313-C381 HydrophobicContact CD2-CB 3.48Å; Y313-C381 VanDerWaalsContact CD2-CB 3.48Å; Y313-C381 HydrophobicContact CE1-CB 4.12Å; Y313-C381 HydrophobicContact CE2-CB 3.92Å; Y313-C381 HydrophobicContact CG-CB 3.37Å; Y313-Q382 HydrophobicContact CE2-CG 3.66Å; Y313-D385 HydrophobicContact CE1-CB 4.33Å; Y313-D385 WeakPolarHBondContact CE1-OD2 3.5Å; Y313-D385 PolarHBondContact OH-OD2 2.91Å; Y313-F390 AromaticContact CD1-CD1 3.86Å; Y313-F390 HydrophobicContact CD1-CD1 3.86Å; Y313-F390 AromaticContact CD1-CE1 3.5Å; Y313-F390 HydrophobicContact CD1-CE1 3.5Å; Y313-F390 VanDerWaalsContact CD1-CE1 3.5Å; Y313-F390 HydrophobicContact CD1-CZ 4.14Å; Y313-F390 HydrophobicContact CE1-CD1 4Å; Y313-F390 HydrophobicContact CE1-CE1 4.13Å; Y313-F390 HydrophobicContact CG-CE1 4.44Å
314	R	86.1	Confident	78.2	Confident	162 Å²	162	77.3 Å²	77.3	61%	0.611	42%	0.416	S	S	*	.	S	Bend	trans	-67.7	-30.6	179.9	-176.8	166.6	-177.4	139	1.6	114.4	E310	E310-R314 WeakPolarHBondContact O-CB 3.46Å; E310-R314 PolarHBondContact O-N 2.89Å; E310-R314 WeakPolarHBondContact OE1-CD 3.21Å; E310-R314 IonicContact OE1-CZ 3.35Å; E310-R314 IonicContact OE1-NE 3.4Å; E310-R314 IonicContact OE1-NH1 3.98Å; E310-R314 PolarHBondContact OE1-NH1 2.88Å
315	D	84	Confident	80.1	Confident	143 Å²	143	73.3 Å²	73.3	77%	0.765	37%	0.373	S	S	*	.	S	Bend	trans	-89.8	-47.7	-179.6	-68.3	-24	0	0	0	112.4	Y313	Y313-D315 PolarHBondContact O-N 3.29Å
316	D	88.4	Confident	81.8	Confident	95 Å²	95	74 Å²	74	51%	0.508	37%	0.367	S	S	.	.			trans	-128.8	73.3	177	-85.9	-41.3	0	0	0	111.6	K318 R319 A320	D316-K318 VanDerWaalsContact C-N 3.28Å; D316-K318 PolarHBondContact O-N 3.35Å; D316-R319 HydrophobicContact CB-CB 3.74Å; D316-R319 PolarHBondContact O-N 2.88Å; D316-A320 PolarHBondContact O-N 2.82Å
317	P	91.7	Very high	82.9	Confident	8 Å²	8	73.8 Å²	73.8	5%	0.052	36%	0.356	C	S	.	.	H	α-helix	trans	-61.3	-36.4	-174.1	20.8	-30.9	0	0	0	112.6	Y313 R319 A320 L321 V374 A377 L378	Y313-P317 WeakPolarHBondContact O-CA 3.32Å; Y313-P317 WeakPolarHBondContact O-CB 3.42Å; Y313-P317 WeakPolarHBondContact O-CD 3.44Å; Y313-P317 VanDerWaalsContact O-N 3.11Å; P317-R319 PolarHBondContact O-N 2.95Å; P317-A320 PolarHBondContact O-N 3.02Å; P317-L321 WeakPolarHBondContact O-CB 3.48Å; P317-L321 PolarHBondContact O-N 3.21Å; P317-V374 HydrophobicContact CG-CG1 3.82Å; P317-A377 HydrophobicContact CB-CB 4.08Å; P317-L378 HydrophobicContact CB-CB 4.09Å; P317-L378 HydrophobicContact CG-CB 4.36Å
318	K	90	Very high	83.5	Confident	107 Å²	107	74.6 Å²	74.6	47%	0.465	36%	0.359	S	S	.	.	H	α-helix	trans	-64.1	-38.7	176.2	-172.6	-177.2	176.3	-171	0	112.3	D316 N322 A377	D316-K318 VanDerWaalsContact C-N 3.28Å; D316-K318 PolarHBondContact O-N 3.35Å; K318-N322 WeakPolarHBondContact O-CB 3.28Å; K318-N322 PolarHBondContact O-N 3.14Å; K318-N322 PolarHBondContact O-OD1 3.07Å; K318-A377 HydrophobicContact CB-CB 4.43Å
319	R	88.6	Confident	83.8	Confident	184 Å²	184	73.3 Å²	73.3	69%	0.694	36%	0.359	S	S	*	.	H	α-helix	trans	-69.1	-42.6	178.7	-174.1	-177.2	174.7	-171.7	-2.8	110.7	D316 P317 L321 N322 A323	D316-R319 HydrophobicContact CB-CB 3.74Å; D316-R319 PolarHBondContact O-N 2.88Å; P317-R319 PolarHBondContact O-N 2.95Å; R319-L321 VanDerWaalsContact C-N 3.34Å; R319-N322 PolarHBondContact O-N 3.02Å; R319-A323 WeakPolarHBondContact O-CB 3.44Å; R319-A323 PolarHBondContact O-N 3.34Å
320	A	87.5	Confident	83.4	Confident	16 Å²	16	73.1 Å²	73.1	13%	0.132	36%	0.359	C	S	.	.	H	α-helix	trans	-65	-38.1	178.8	0	0	0	0	0	111.8	D316 P317 Y324 F390	D316-A320 PolarHBondContact O-N 2.82Å; P317-A320 PolarHBondContact O-N 3.02Å; A320-Y324 PolarHBondContact O-N 3.11Å; A320-Y324 VanDerWaalsContact O-N 3.16Å; A320-F390 HydrophobicContact CB-CZ 3.88Å
321	L	88.4	Confident	82.7	Confident	1 Å²	1	77.1 Å²	77.1	1%	0.005	38%	0.382	C	S	.	.	H	α-helix	trans	-71	-40.4	174.6	-168.6	64.6	0	0	0	113	P317 R319 A323 Y324 F325 F336 I350 L352 A377 A380 L384	P317-L321 WeakPolarHBondContact O-CB 3.48Å; P317-L321 PolarHBondContact O-N 3.21Å; R319-L321 VanDerWaalsContact C-N 3.34Å; L321-A323 VanDerWaalsContact C-N 3.34Å; L321-A323 PolarHBondContact O-N 3.4Å; L321-Y324 WeakPolarHBondContact O-CB 3.35Å; L321-Y324 PolarHBondContact O-N 2.93Å; L321-F325 HydrophobicContact CD1-CE2 4.31Å; L321-F325 HydrophobicContact CD1-CZ 4.13Å; L321-F325 HydrophobicContact CD2-CE2 4.12Å; L321-F325 HydrophobicContact CD2-CZ 4.35Å; L321-F325 HydrophobicContact CG-CD2 4.38Å; L321-F325 HydrophobicContact CG-CE2 3.7Å; L321-F325 HydrophobicContact CG-CZ 4Å; L321-F325 WeakPolarHBondContact O-CD2 3.47Å; L321-F325 PolarHBondContact O-N 3.13Å; L321-F325 VanDerWaalsContact O-N 3.12Å; L321-F336 HydrophobicContact CD2-CZ 4.34Å; L321-I350 HydrophobicContact CD2-CD1 4.02Å; L321-L352 HydrophobicContact CD1-CD2 4.12Å; L321-A377 HydrophobicContact CD2-CB 4.08Å; L321-A380 HydrophobicContact CD1-CB 4.01Å; L321-A380 HydrophobicContact CD2-CB 3.81Å; L321-L384 HydrophobicContact CD1-CD1 3.68Å
322	N	86.8	Confident	82	Confident	48 Å²	48	73.5 Å²	73.5	26%	0.257	38%	0.378	S	S	.	.	H	α-helix	trans	-57.6	-46.9	171.1	-91.8	55.7	0	0	0	111.4	K318 R319 Y324 F325 E326	K318-N322 WeakPolarHBondContact O-CB 3.28Å; K318-N322 PolarHBondContact O-N 3.14Å; K318-N322 PolarHBondContact O-OD1 3.07Å; R319-N322 PolarHBondContact O-N 3.02Å; N322-Y324 PolarHBondContact O-N 3.12Å; N322-F325 PolarHBondContact O-N 3.32Å; N322-F325 VanDerWaalsContact O-N 3.12Å; N322-E326 WeakPolarHBondContact O-CB 3.36Å; N322-E326 WeakPolarHBondContact O-CG 3.47Å; N322-E326 PolarHBondContact O-N 3.31Å
323	A	84.5	Confident	81.7	Confident	47 Å²	47	72.8 Å²	72.8	39%	0.388	37%	0.373	S	S	.	.	H	α-helix	trans	-66	-20	177.9	0	0	0	0	0	113.9	R319 L321 R327	R319-A323 WeakPolarHBondContact O-CB 3.44Å; R319-A323 PolarHBondContact O-N 3.34Å; L321-A323 VanDerWaalsContact C-N 3.34Å; L321-A323 PolarHBondContact O-N 3.4Å; A323-R327 WeakPolarHBondContact O-CB 3.36Å; A323-R327 PolarHBondContact O-N 3Å
324	Y	84.4	Confident	81.1	Confident	4 Å²	4	73.9 Å²	73.9	2%	0.016	38%	0.381	C	S	.	.	H	α-helix	trans	-73.3	-50.4	167.7	170.5	-90.1	0	0	0	111	A320 L321 N322 E326 R327 E328 I330 L384 E389 F390	A320-Y324 PolarHBondContact O-N 3.11Å; A320-Y324 VanDerWaalsContact O-N 3.16Å; L321-Y324 WeakPolarHBondContact O-CB 3.35Å; L321-Y324 PolarHBondContact O-N 2.93Å; N322-Y324 PolarHBondContact O-N 3.12Å; Y324-E326 VanDerWaalsContact C-N 3.31Å; Y324-E326 PolarHBondContact O-N 3.05Å; Y324-R327 PolarHBondContact O-N 3.38Å; Y324-R327 VanDerWaalsContact O-N 3.1Å; Y324-E328 HydrophobicContact CD2-CG 4.15Å; Y324-E328 HydrophobicContact CE1-CG 4.14Å; Y324-E328 HydrophobicContact CE2-CG 3.74Å; Y324-E328 HydrophobicContact CG-CG 4.49Å; Y324-E328 PolarHBondContact O-N 3.37Å; Y324-I330 HydrophobicContact CE1-CD1 4.23Å; Y324-L384 HydrophobicContact CD1-CD1 3.63Å; Y324-L384 HydrophobicContact CD2-CD1 3.91Å; Y324-L384 HydrophobicContact CE1-CD1 3.72Å; Y324-L384 HydrophobicContact CE1-CD2 4.01Å; Y324-L384 HydrophobicContact CE2-CD1 4.01Å; Y324-L384 HydrophobicContact CE2-CD2 4.2Å; Y324-L384 HydrophobicContact CG-CD1 3.75Å; Y324-E389 HydrophobicContact CE2-CB 4.33Å; Y324-F390 HydrophobicContact CD2-CD2 4.18Å
325	F	85.7	Confident	80.8	Confident	6 Å²	6	74 Å²	74	3%	0.026	39%	0.388	C	S	.	.	H	α-helix	trans	-62	-37.4	178	-61.3	-46.9	0	0	0	113	L321 N322 R327 G329 I330 I333 P334 I350 L352	L321-F325 HydrophobicContact CD1-CE2 4.31Å; L321-F325 HydrophobicContact CD1-CZ 4.13Å; L321-F325 HydrophobicContact CD2-CE2 4.12Å; L321-F325 HydrophobicContact CD2-CZ 4.35Å; L321-F325 HydrophobicContact CG-CD2 4.38Å; L321-F325 HydrophobicContact CG-CE2 3.7Å; L321-F325 HydrophobicContact CG-CZ 4Å; L321-F325 WeakPolarHBondContact O-CD2 3.47Å; L321-F325 PolarHBondContact O-N 3.13Å; L321-F325 VanDerWaalsContact O-N 3.12Å; N322-F325 PolarHBondContact O-N 3.32Å; N322-F325 VanDerWaalsContact O-N 3.12Å; F325-R327 VanDerWaalsContact C-N 3.32Å; F325-R327 PolarHBondContact O-N 3.18Å; F325-G329 PolarHBondContact O-N 3.48Å; F325-G329 VanDerWaalsContact O-N 3.14Å; F325-I330 HydrophobicContact CD1-CB 4.44Å; F325-I330 HydrophobicContact CD1-CD1 3.95Å; F325-I330 PolarHBondContact O-N 2.92Å; F325-I333 HydrophobicContact CD2-CG2 3.9Å; F325-I333 HydrophobicContact CE2-CG2 4.45Å; F325-P334 HydrophobicContact CD1-CG 4.25Å; F325-P334 HydrophobicContact CE1-CG 3.7Å; F325-P334 HydrophobicContact CE2-CB 4.45Å; F325-P334 HydrophobicContact CE2-CG 4.28Å; F325-P334 HydrophobicContact CZ-CB 4.05Å; F325-P334 HydrophobicContact CZ-CG 3.71Å; F325-I350 HydrophobicContact CE2-CD1 4.16Å; F325-I350 HydrophobicContact CZ-CD1 4.07Å; F325-L352 HydrophobicContact CE1-CD2 3.89Å; F325-L352 HydrophobicContact CZ-CD2 3.75Å
326	E	83.9	Confident	80.9	Confident	139 Å²	139	69.1 Å²	69.1	65%	0.65	36%	0.36	S	S	*	.	H	α-helix	trans	-65.1	-31	174.6	-72.6	165.4	-158.3	0	0	112.7	N322 Y324	N322-E326 WeakPolarHBondContact O-CB 3.36Å; N322-E326 WeakPolarHBondContact O-CG 3.47Å; N322-E326 PolarHBondContact O-N 3.31Å; Y324-E326 VanDerWaalsContact C-N 3.31Å; Y324-E326 PolarHBondContact O-N 3.05Å
327	R	75.7	Confident	80.7	Confident	67 Å²	67	69.8 Å²	69.8	25%	0.253	36%	0.36	S	S	.	.	H	α-helix	trans	-79	-47.9	176.2	178.8	-179.1	62.4	-121.7	17.3	112.5	A323 Y324 F325 G329 E389 D391 D395	A323-R327 WeakPolarHBondContact O-CB 3.36Å; A323-R327 PolarHBondContact O-N 3Å; Y324-R327 PolarHBondContact O-N 3.38Å; Y324-R327 VanDerWaalsContact O-N 3.1Å; F325-R327 VanDerWaalsContact C-N 3.32Å; F325-R327 PolarHBondContact O-N 3.18Å; R327-G329 PolarHBondContact O-N 3.35Å; R327-E389 PolarHBondContact NH2-O 2.98Å; R327-D391 PolarHBondContact NH2-O 3.49Å; R327-D395 VanDerWaalsContact CD-OD2 3.24Å; R327-D395 WeakPolarHBondContact CD-OD2 3.43Å
328	E	76	Confident	80.5	Confident	71 Å²	71	74 Å²	74	33%	0.332	38%	0.378	S	S	.	.	H	α-helix	trans	-78.2	-1.7	-176.7	-54	-62.3	136.5	0	0	112.7	Y324 I330 K394	Y324-E328 HydrophobicContact CD2-CG 4.15Å; Y324-E328 HydrophobicContact CE1-CG 4.14Å; Y324-E328 HydrophobicContact CE2-CG 3.74Å; Y324-E328 HydrophobicContact CG-CG 4.49Å; Y324-E328 PolarHBondContact O-N 3.37Å; E328-I330 HydrophobicContact CB-CD1 3.76Å; E328-I330 HydrophobicContact CB-CG1 4.04Å; E328-I330 PolarHBondContact O-N 2.91Å; E328-K394 IonicContact OE1-NZ 3.95Å; E328-K394 IonicContact OE2-NZ 3.12Å
329	G	73.1	Confident	80.1	Confident	58 Å²	58	72.6 Å²	72.6	60%	0.598	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	29.7	173.6	0	0	0	0	0	114.5	F325 R327 D331	F325-G329 PolarHBondContact O-N 3.48Å; F325-G329 VanDerWaalsContact O-N 3.14Å; R327-G329 PolarHBondContact O-N 3.35Å; G329-D331 PolarHBondContact O-N 3.39Å
330	I	68.3	Low	79.5	Confident	34 Å²	34	72.8 Å²	72.8	17%	0.174	39%	0.387	C	S	.	.			trans	-83.9	85.9	-172.2	-60.7	160.9	0	0	0	110	Y324 F325 E328 P332 I333 P334 P353	Y324-I330 HydrophobicContact CE1-CD1 4.23Å; F325-I330 HydrophobicContact CD1-CB 4.44Å; F325-I330 HydrophobicContact CD1-CD1 3.95Å; F325-I330 PolarHBondContact O-N 2.92Å; E328-I330 HydrophobicContact CB-CD1 3.76Å; E328-I330 HydrophobicContact CB-CG1 4.04Å; E328-I330 PolarHBondContact O-N 2.91Å; I330-P332 CarbonylContact O-C 3.6Å; I330-I333 PolarHBondContact O-N 3.26Å; I330-P334 HydrophobicContact CG2-CG 4.4Å; I330-P353 HydrophobicContact CD1-CG 4.1Å; I330-P353 HydrophobicContact CG1-CG 4.44Å; I330-P353 HydrophobicContact CG2-CG 3.66Å
331	D	68	Low	78.8	Confident	146 Å²	146	73.2 Å²	73.2	78%	0.781	39%	0.39	S	S	*	.	S	Bend	trans	-98.4	127.8	168.3	-93.8	-41	0	0	0	111.4	G329	G329-D331 PolarHBondContact O-N 3.39Å
332	P	66	Low	77.9	Confident	110 Å²	110	77.9 Å²	77.9	71%	0.714	42%	0.421	S	S	*	.	S	Bend	cis	-80.8	145.8	-1.1	33.3	-34.9	0	0	0	113.1	I330	I330-P332 CarbonylContact O-C 3.6Å
333	I	72.3	Confident	76.7	Confident	81 Å²	81	85.1 Å²	85.1	42%	0.415	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-51.9	125.7	174.9	-56	171.8	0	0	0	110.7	F325 I330 Q335	F325-I333 HydrophobicContact CD2-CG2 3.9Å; F325-I333 HydrophobicContact CE2-CG2 4.45Å; I330-I333 PolarHBondContact O-N 3.26Å; I333-Q335 PolarHBondContact O-N 2.86Å
334	P	73.9	Confident	76.2	Confident	24 Å²	24	85.9 Å²	85.9	16%	0.156	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-56.7	133.8	-179.9	-29.3	37.1	0	0	0	113.7	F325 I330 I350 E351	F325-P334 HydrophobicContact CD1-CG 4.25Å; F325-P334 HydrophobicContact CE1-CG 3.7Å; F325-P334 HydrophobicContact CE2-CB 4.45Å; F325-P334 HydrophobicContact CE2-CG 4.28Å; F325-P334 HydrophobicContact CZ-CB 4.05Å; F325-P334 HydrophobicContact CZ-CG 3.71Å; I330-P334 HydrophobicContact CG2-CG 4.4Å; P334-I350 HydrophobicContact CB-CD1 4.15Å; P334-I350 HydrophobicContact CB-CG1 3.93Å; P334-E351 VanDerWaalsContact CB-O 3.29Å; P334-E351 WeakPolarHBondContact CB-O 3.44Å; P334-E351 WeakPolarHBondContact CG-O 3.34Å
335	Q	80.4	Confident	76.1	Confident	166 Å²	166	90.4 Å²	90.4	78%	0.776	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-92	145.7	-178.1	-59.7	-171.9	20.1	0	0	111.2	I333 E337	I333-Q335 PolarHBondContact O-N 2.86Å; Q335-E337 PolarHBondContact O-N 2.86Å
336	F	84.3	Confident	76	Confident	40 Å²	40	92.5 Å²	92.5	18%	0.175	49%	0.492	C	S	.	.			trans	-78	108.4	175	-68.8	-88.6	0	0	0	109.9	L321 I350 V373 C376 A377	L321-F336 HydrophobicContact CD2-CZ 4.34Å; F336-I350 HydrophobicContact CD1-CB 4.32Å; F336-I350 HydrophobicContact CD1-CD1 4.24Å; F336-I350 HydrophobicContact CE1-CB 4.46Å; F336-I350 HydrophobicContact CE1-CD1 3.89Å; F336-I350 HydrophobicContact CE2-CD1 4.23Å; F336-I350 HydrophobicContact CZ-CD1 3.88Å; F336-V373 HydrophobicContact CB-CG2 4.41Å; F336-V373 HydrophobicContact CD1-CG1 4.05Å; F336-V373 HydrophobicContact CD1-CG2 4.46Å; F336-V373 HydrophobicContact CD2-CG1 4.19Å; F336-V373 HydrophobicContact CE1-CG1 3.95Å; F336-V373 HydrophobicContact CE2-CG1 4.11Å; F336-V373 HydrophobicContact CG-CG1 4.17Å; F336-V373 HydrophobicContact CG-CG2 4.36Å; F336-V373 HydrophobicContact CZ-CG1 3.98Å; F336-C376 HydrophobicContact CD1-CB 4.34Å; F336-C376 HydrophobicContact CE1-CB 4.33Å; F336-A377 HydrophobicContact CE1-CB 4.24Å; F336-A377 HydrophobicContact CZ-CB 4.2Å
337	E	86.1	Confident	76.2	Confident	109 Å²	109	87.1 Å²	87.1	51%	0.509	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	146.3	171.9	-64.4	-163	140.1	0	0	110.7	Q335 C348 R349	Q335-E337 PolarHBondContact O-N 2.86Å; E337-C348 VanDerWaalsContact O-CA 3.31Å; E337-C348 WeakPolarHBondContact O-CA 3.32Å; E337-C348 PolarHBondContact O-SG 2.82Å; E337-R349 HydrophobicContact CB-CB 4.45Å; E337-R349 PolarHBondContact N-O 3.06Å; E337-R349 PolarHBondContact O-N 2.75Å
338	F	85.8	Confident	76.8	Confident	95 Å²	95	84 Å²	84	42%	0.417	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	121.9	175	-65.7	-88.8	0	0	0	109.3	H347 C348 R369 V373	F338-H347 WeakPolarHBondContact CA-O 3.49Å; F338-C348 HydrophobicContact CD1-CB 4.46Å; F338-R369 HydrophobicContact CD1-CG 4.45Å; F338-R369 HydrophobicContact CE1-CB 3.99Å; F338-R369 HydrophobicContact CE1-CG 4.11Å; F338-R369 HydrophobicContact CZ-CB 4.35Å; F338-V373 HydrophobicContact CE1-CG2 3.92Å; F338-V373 HydrophobicContact CZ-CG2 3.49Å; F338-V373 VanDerWaalsContact CZ-CG2 3.49Å
339	V	82.2	Confident	77.5	Confident	79 Å²	79	84.6 Å²	84.6	48%	0.479	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	138.8	174.6	-172.3	0	0	0	0	108.5	A341 H347	V339-A341 PolarHBondContact O-N 2.95Å; V339-A341 VanDerWaalsContact O-N 3.17Å; V339-H347 HydrophobicContact CB-CB 4.26Å; V339-H347 PolarHBondContact N-O 3.38Å; V339-H347 VanDerWaalsContact N-O 3.07Å; V339-H347 WeakPolarHBondContact O-CB 3.37Å; V339-H347 PolarHBondContact O-N 2.85Å
340	E	75.1	Confident	78.3	Confident	188 Å²	188	81.9 Å²	81.9	88%	0.879	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	104.8	-179.4	-62.4	-160.1	145.7	0	0	110.8
341	A	74.1	Confident	79.3	Confident	24 Å²	24	84.2 Å²	84.2	20%	0.198	44%	0.437	C	S	.	.			trans	-91.1	146.4	178.4	0	0	0	0	0	111.8	V339 K345 H347 L364	V339-A341 PolarHBondContact O-N 2.95Å; V339-A341 VanDerWaalsContact O-N 3.17Å; A341-K345 HydrophobicContact CB-CB 4.34Å; A341-H347 HydrophobicContact CB-CB 4.05Å; A341-L364 HydrophobicContact CB-CD2 4.32Å
342	P	69.1	Low	80	Confident	100 Å²	100	77.3 Å²	77.3	65%	0.649	40%	0.4	S	S	*	.	S	Bend	trans	-66.3	156.5	178.3	28.3	-35.4	0	0	0	112.4
343	F	61.7	Low	80.5	Confident	200 Å²	200	74.3 Å²	74.3	88%	0.877	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	39.9	178.4	-55.8	-80.7	0	0	0	116	K345	F343-K345 PolarHBondContact O-N 2.94Å; F343-K345 VanDerWaalsContact O-N 3.13Å
344	G	74.7	Confident	80.6	Confident	63 Å²	63	71.6 Å²	71.6	65%	0.649	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	10.3	167.6	0	0	0	0	0	115.2
345	K	81.6	Confident	80.3	Confident	99 Å²	99	76.2 Å²	76.2	43%	0.43	40%	0.399	S	S	.	.			trans	-79.4	155.3	170.2	-60.6	177.5	-175.6	178.5	0	109.4	A341 F343 V365	A341-K345 HydrophobicContact CB-CB 4.34Å; F343-K345 PolarHBondContact O-N 2.94Å; F343-K345 VanDerWaalsContact O-N 3.13Å; K345-V365 WeakPolarHBondContact CA-O 3.44Å
346	Q	84.3	Confident	79.6	Confident	49 Å²	49	74.1 Å²	74.1	23%	0.229	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.9	168.9	-59.6	-69.5	-98.7	0	0	107.1	V365 A372	Q346-V365 PolarHBondContact N-O 3.48Å; Q346-V365 PolarHBondContact O-N 3.02Å; Q346-V365 VanDerWaalsContact O-N 3.08Å; Q346-A372 HydrophobicContact CB-CB 3.8Å
347	H	86.7	Confident	79.3	Confident	27 Å²	27	73.9 Å²	73.9	13%	0.125	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	130.4	166.5	175.9	101.6	0	0	0	108	F338 V339 A341 E362 A363 L364	F338-H347 WeakPolarHBondContact CA-O 3.49Å; V339-H347 HydrophobicContact CB-CB 4.26Å; V339-H347 PolarHBondContact N-O 3.38Å; V339-H347 VanDerWaalsContact N-O 3.07Å; V339-H347 WeakPolarHBondContact O-CB 3.37Å; V339-H347 PolarHBondContact O-N 2.85Å; A341-H347 HydrophobicContact CB-CB 4.05Å; H347-E362 IonicContact CE1-OE2 3.46Å; H347-E362 PolarHBondContact CE1-OE2 3.4Å; H347-A363 WeakPolarHBondContact CA-O 3.3Å; H347-L364 HydrophobicContact CB-CD2 3.71Å
348	C	89.3	Confident	79.1	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	133.8	175.4	-172.9	0	0	0	0	109.5	E337 F338 E362 A363 A372 C376	E337-C348 VanDerWaalsContact O-CA 3.31Å; E337-C348 WeakPolarHBondContact O-CA 3.32Å; E337-C348 PolarHBondContact O-SG 2.82Å; F338-C348 HydrophobicContact CD1-CB 4.46Å; C348-E362 WeakPolarHBondContact O-CA 3.33Å; C348-A363 PolarHBondContact N-O 3.27Å; C348-A363 PolarHBondContact O-N 3.31Å; C348-A372 HydrophobicContact CB-CB 4.12Å; C348-C376 HydrophobicContact CB-CB 3.95Å
349	R	90.3	Very high	79	Confident	84 Å²	84	71.8 Å²	71.8	32%	0.317	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	146.6	-178.4	169.6	177.4	168.2	156.2	-10.2	109.7	E337 E351 A361	E337-R349 HydrophobicContact CB-CB 4.45Å; E337-R349 PolarHBondContact N-O 3.06Å; E337-R349 PolarHBondContact O-N 2.75Å; R349-E351 IonicContact CZ-OE1 3.75Å; R349-E351 IonicContact NE-OE1 3.92Å; R349-E351 PolarHBondContact NE-OE1 3.21Å; R349-E351 IonicContact NH2-OE1 2.67Å; R349-E351 PolarHBondContact NH2-OE1 3.02Å; R349-A361 WeakPolarHBondContact CA-O 3.5Å
350	I	90.8	Very high	79.3	Confident	1 Å²	1	71 Å²	71	1%	0.005	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	144.6	167.8	-166.9	171.3	0	0	0	109.4	L321 F325 P334 F336 A361 A380	L321-I350 HydrophobicContact CD2-CD1 4.02Å; F325-I350 HydrophobicContact CE2-CD1 4.16Å; F325-I350 HydrophobicContact CZ-CD1 4.07Å; P334-I350 HydrophobicContact CB-CD1 4.15Å; P334-I350 HydrophobicContact CB-CG1 3.93Å; F336-I350 HydrophobicContact CD1-CB 4.32Å; F336-I350 HydrophobicContact CD1-CD1 4.24Å; F336-I350 HydrophobicContact CE1-CB 4.46Å; F336-I350 HydrophobicContact CE1-CD1 3.89Å; F336-I350 HydrophobicContact CE2-CD1 4.23Å; F336-I350 HydrophobicContact CZ-CD1 3.88Å; I350-A361 HydrophobicContact CG2-CB 3.98Å; I350-A361 PolarHBondContact N-O 2.97Å; I350-A361 PolarHBondContact O-N 3.48Å; I350-A380 HydrophobicContact CG2-CB 3.99Å
351	E	87.9	Confident	79.9	Confident	83 Å²	83	62.3 Å²	62.3	39%	0.388	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	128.1	176.6	-49.4	-150.4	139.6	0	0	110	P334 R349 P353 T360	P334-E351 VanDerWaalsContact CB-O 3.29Å; P334-E351 WeakPolarHBondContact CB-O 3.44Å; P334-E351 WeakPolarHBondContact CG-O 3.34Å; R349-E351 IonicContact CZ-OE1 3.75Å; R349-E351 IonicContact NE-OE1 3.92Å; R349-E351 PolarHBondContact NE-OE1 3.21Å; R349-E351 IonicContact NH2-OE1 2.67Å; R349-E351 PolarHBondContact NH2-OE1 3.02Å; E351-P353 WeakPolarHBondContact O-CD 3.44Å; E351-T360 HydrophobicContact CG-CG2 4.31Å
352	L	84	Confident	80.7	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.005	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	106.7	179.5	-60.1	167.4	0	0	0	107.8	L321 F325 L354 T358 V359 A361 A380 L383 L384	L321-L352 HydrophobicContact CD1-CD2 4.12Å; F325-L352 HydrophobicContact CE1-CD2 3.89Å; F325-L352 HydrophobicContact CZ-CD2 3.75Å; L352-L354 HydrophobicContact CB-CD1 4.04Å; L352-L354 PolarHBondContact O-N 3.26Å; L352-T358 WeakPolarHBondContact O-CA 3.49Å; L352-V359 WeakPolarHBondContact CB-O 3.48Å; L352-V359 PolarHBondContact N-O 3.39Å; L352-V359 PolarHBondContact O-N 3.48Å; L352-A361 HydrophobicContact CD1-CB 4.28Å; L352-A380 HydrophobicContact CD1-CB 4.02Å; L352-A380 HydrophobicContact CD2-CB 4.3Å; L352-L383 HydrophobicContact CD1-CD2 4.17Å; L352-L384 HydrophobicContact CD1-CD2 4.14Å; L352-L384 HydrophobicContact CD1-CG 4.18Å; L352-L384 HydrophobicContact CD2-CD1 4.39Å
353	P	76.6	Confident	81.7	Confident	48 Å²	48	62.6 Å²	62.6	31%	0.312	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	116.6	168.1	29.8	-29.6	0	0	0	108.9	I330 E351 T358	I330-P353 HydrophobicContact CD1-CG 4.1Å; I330-P353 HydrophobicContact CG1-CG 4.44Å; I330-P353 HydrophobicContact CG2-CG 3.66Å; E351-P353 WeakPolarHBondContact O-CD 3.44Å; P353-T358 HydrophobicContact CB-CG2 4.34Å
354	L	73.2	Confident	82.9	Confident	24 Å²	24	58.6 Å²	58.6	13%	0.126	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	165.6	171.8	-64.6	109.9	0	0	0	110.6	L352 S356 G357 V359 L384 L387 E389	L352-L354 HydrophobicContact CB-CD1 4.04Å; L352-L354 PolarHBondContact O-N 3.26Å; L354-S356 PolarHBondContact O-N 3.33Å; L354-S356 VanDerWaalsContact O-N 3.11Å; L354-G357 PolarHBondContact N-O 3.34Å; L354-G357 PolarHBondContact O-N 2.83Å; L354-V359 HydrophobicContact CD1-CB 3.92Å; L354-V359 HydrophobicContact CD1-CG2 3.6Å; L354-L384 HydrophobicContact CD1-CD2 4.38Å; L354-L384 HydrophobicContact CD2-CD2 3.72Å; L354-L384 HydrophobicContact CG-CD2 4.18Å; L354-L387 HydrophobicContact CD1-CD1 3.93Å; L354-L387 HydrophobicContact CD2-CB 4.4Å; L354-L387 HydrophobicContact CD2-CD1 3.76Å; L354-E389 HydrophobicContact CD2-CB 4.17Å; L354-E389 HydrophobicContact CD2-CG 3.99Å
355	S	67.3	Low	83.4	Confident	120 Å²	120	57.2 Å²	57.2	84%	0.839	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-32.2	173.6	-171.2	0	0	0	0	113.1
356	S	66.1	Low	83.4	Confident	122 Å²	122	57.2 Å²	57.2	85%	0.853	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-1.1	179.5	-46.8	0	0	0	0	115.3	L354	L354-S356 PolarHBondContact O-N 3.33Å; L354-S356 VanDerWaalsContact O-N 3.11Å
357	G	78.3	Confident	83.2	Confident	35 Å²	35	56.3 Å²	56.3	36%	0.361	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	134.7	178.5	-178.8	0	0	0	0	0	113.9	L354	L354-G357 PolarHBondContact N-O 3.34Å; L354-G357 PolarHBondContact O-N 2.83Å
358	T	81.5	Confident	83.2	Confident	108 Å²	108	61.9 Å²	61.9	66%	0.663	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	131.4	173.9	45.2	0	0	0	0	111.2	L352 P353	L352-T358 WeakPolarHBondContact O-CA 3.49Å; P353-T358 HydrophobicContact CB-CG2 4.34Å
359	V	84.8	Confident	83	Confident	52 Å²	52	69.7 Å²	69.7	32%	0.315	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	132.5	178.3	-167.7	0	0	0	0	109.5	L352 L354 L383	L352-V359 WeakPolarHBondContact CB-O 3.48Å; L352-V359 PolarHBondContact N-O 3.39Å; L352-V359 PolarHBondContact O-N 3.48Å; L354-V359 HydrophobicContact CD1-CB 3.92Å; L354-V359 HydrophobicContact CD1-CG2 3.6Å; V359-L383 HydrophobicContact CB-CD2 4.43Å; V359-L383 HydrophobicContact CG1-CD2 3.58Å; V359-L383 HydrophobicContact CG1-CG 4.38Å
360	T	87.6	Confident	83	Confident	64 Å²	64	74 Å²	74	39%	0.393	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	124.6	-177.9	54.1	0	0	0	0	111	E351	E351-T360 HydrophobicContact CG-CG2 4.31Å
361	A	88.4	Confident	82.9	Confident	4 Å²	4	78 Å²	78	3%	0.033	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	136.6	166.4	0	0	0	0	0	109.7	R349 I350 L352 A380 L383	R349-A361 WeakPolarHBondContact CA-O 3.5Å; I350-A361 HydrophobicContact CG2-CB 3.98Å; I350-A361 PolarHBondContact N-O 2.97Å; I350-A361 PolarHBondContact O-N 3.48Å; L352-A361 HydrophobicContact CD1-CB 4.28Å; A361-A380 HydrophobicContact CB-CB 3.91Å; A361-L383 HydrophobicContact CB-CD2 4.26Å
362	E	91	Very high	83	Confident	120 Å²	120	74.1 Å²	74.1	56%	0.561	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.2	145	-178.5	56.8	169.2	-154.2	0	0	111.9	H347 C348	H347-E362 IonicContact CE1-OE2 3.46Å; H347-E362 PolarHBondContact CE1-OE2 3.4Å; C348-E362 WeakPolarHBondContact O-CA 3.33Å
363	A	89.1	Confident	83.3	Confident	11 Å²	11	75.1 Å²	75.1	9%	0.091	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	136.1	177.4	0	0	0	0	0	112.5	H347 C348 A375 C376	H347-A363 WeakPolarHBondContact CA-O 3.3Å; C348-A363 PolarHBondContact N-O 3.27Å; C348-A363 PolarHBondContact O-N 3.31Å; A363-A375 HydrophobicContact CB-CB 4Å; A363-C376 HydrophobicContact CB-CB 4.07Å
364	L	87.7	Confident	84.1	Confident	115 Å²	115	76.3 Å²	76.3	60%	0.602	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.5	94.7	179.3	-74.1	171.6	0	0	0	111	A341 H347	A341-L364 HydrophobicContact CB-CD2 4.32Å; H347-L364 HydrophobicContact CB-CD2 3.71Å
365	V	85.9	Confident	84.9	Confident	34 Å²	34	76.5 Å²	76.5	21%	0.206	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	132.1	-175.1	-179.2	0	0	0	0	112.1	K345 Q346 G367 E371 A372 A375	K345-V365 WeakPolarHBondContact CA-O 3.44Å; Q346-V365 PolarHBondContact N-O 3.48Å; Q346-V365 PolarHBondContact O-N 3.02Å; Q346-V365 VanDerWaalsContact O-N 3.08Å; V365-G367 PolarHBondContact O-N 3.33Å; V365-E371 HydrophobicContact CG1-CB 4.31Å; V365-A372 HydrophobicContact CB-CB 4.2Å; V365-A375 HydrophobicContact CG2-CB 3.43Å; V365-A375 VanDerWaalsContact CG2-CB 3.43Å
366	S	80.5	Confident	86.1	Confident	99 Å²	99	70.8 Å²	70.8	69%	0.692	40%	0.395	S	S	*	.	S	Bend	trans	-84.8	87.9	168.3	177.8	0	0	0	0	109.9
367	G	80.7	Confident	87.3	Confident	30 Å²	30	65 Å²	65	31%	0.309	36%	0.355	S	S	.	.	S	Bend	trans	-179.8	-162.8	-174.9	0	0	0	0	0	114.1	V365 E371	V365-G367 PolarHBondContact O-N 3.33Å; G367-E371 WeakPolarHBondContact CA-OE2 3.3Å
368	K	86.6	Confident	88	Confident	144 Å²	144	65.8 Å²	65.8	63%	0.626	35%	0.35	S	S	*	.			trans	-74.7	154.2	176.4	-59.6	168.1	-164.5	136.3	0	110.2	K370 E371 A372	K368-K370 PolarHBondContact O-N 3.2Å; K368-E371 PolarHBondContact N-OE2 3.27Å; K368-E371 IonicContact NZ-OE1 3.47Å; K368-E371 PolarHBondContact NZ-OE1 3.4Å; K368-E371 WeakPolarHBondContact O-CB 3.44Å; K368-E371 PolarHBondContact O-N 2.86Å; K368-A372 PolarHBondContact O-N 2.85Å
369	R	85.7	Confident	88.5	Confident	165 Å²	165	64.1 Å²	64.1	62%	0.623	34%	0.335	S	S	*	.	H	α-helix	trans	-48.4	-36	174.5	-71.3	-178	-176.8	171.3	-0.7	114	F338 E371 A372 V373	F338-R369 HydrophobicContact CD1-CG 4.45Å; F338-R369 HydrophobicContact CE1-CB 3.99Å; F338-R369 HydrophobicContact CE1-CG 4.11Å; F338-R369 HydrophobicContact CZ-CB 4.35Å; R369-E371 PolarHBondContact O-N 3.44Å; R369-A372 PolarHBondContact O-N 3.43Å; R369-V373 WeakPolarHBondContact O-CG2 3.47Å; R369-V373 PolarHBondContact O-N 3.44Å; R369-V373 VanDerWaalsContact O-N 3.12Å
370	K	88.6	Confident	88.8	Confident	175 Å²	175	61.6 Å²	61.6	76%	0.761	32%	0.32	S	S	*	.	H	α-helix	trans	-62.5	-39.3	176.2	-66	-169.2	177	-171.4	0	113.1	K368 V374	K368-K370 PolarHBondContact O-N 3.2Å; K370-V374 WeakPolarHBondContact O-CG2 3.37Å; K370-V374 PolarHBondContact O-N 2.87Å
371	E	89.2	Confident	88.9	Confident	85 Å²	85	58.6 Å²	58.6	40%	0.397	30%	0.301	S	S	.	.	H	α-helix	trans	-73	-35.6	-178.9	-67.3	146.3	-168.7	0	0	110.4	V365 G367 K368 R369 V374 A375	V365-E371 HydrophobicContact CG1-CB 4.31Å; G367-E371 WeakPolarHBondContact CA-OE2 3.3Å; K368-E371 PolarHBondContact N-OE2 3.27Å; K368-E371 IonicContact NZ-OE1 3.47Å; K368-E371 PolarHBondContact NZ-OE1 3.4Å; K368-E371 WeakPolarHBondContact O-CB 3.44Å; K368-E371 PolarHBondContact O-N 2.86Å; R369-E371 PolarHBondContact O-N 3.44Å; E371-V374 PolarHBondContact O-N 3.02Å; E371-A375 PolarHBondContact O-N 3.17Å; E371-A375 VanDerWaalsContact O-N 3.1Å
372	A	89.3	Confident	89	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.3	-41.1	172.9	0	0	0	0	0	113.4	Q346 C348 V365 K368 R369 A375 C376	Q346-A372 HydrophobicContact CB-CB 3.8Å; C348-A372 HydrophobicContact CB-CB 4.12Å; V365-A372 HydrophobicContact CB-CB 4.2Å; K368-A372 PolarHBondContact O-N 2.85Å; R369-A372 PolarHBondContact O-N 3.43Å; A372-A375 PolarHBondContact O-N 2.96Å; A372-C376 VanDerWaalsContact O-CB 3.31Å; A372-C376 WeakPolarHBondContact O-CB 3.43Å; A372-C376 PolarHBondContact O-N 3.35Å
373	V	91.8	Very high	88.9	Confident	22 Å²	22	56 Å²	56	13%	0.133	29%	0.289	C	S	.	.	H	α-helix	trans	-63.4	-41.7	174.8	169.7	0	0	0	0	111.7	F336 F338 R369 C376 A377	F336-V373 HydrophobicContact CB-CG2 4.41Å; F336-V373 HydrophobicContact CD1-CG1 4.05Å; F336-V373 HydrophobicContact CD1-CG2 4.46Å; F336-V373 HydrophobicContact CD2-CG1 4.19Å; F336-V373 HydrophobicContact CE1-CG1 3.95Å; F336-V373 HydrophobicContact CE2-CG1 4.11Å; F336-V373 HydrophobicContact CG-CG1 4.17Å; F336-V373 HydrophobicContact CG-CG2 4.36Å; F336-V373 HydrophobicContact CZ-CG1 3.98Å; F338-V373 HydrophobicContact CE1-CG2 3.92Å; F338-V373 HydrophobicContact CZ-CG2 3.49Å; F338-V373 VanDerWaalsContact CZ-CG2 3.49Å; R369-V373 WeakPolarHBondContact O-CG2 3.47Å; R369-V373 PolarHBondContact O-N 3.44Å; R369-V373 VanDerWaalsContact O-N 3.12Å; V373-C376 PolarHBondContact O-N 3Å; V373-A377 WeakPolarHBondContact O-CB 3.43Å; V373-A377 PolarHBondContact O-N 3.3Å
374	V	91.9	Very high	88.7	Confident	74 Å²	74	55.4 Å²	55.4	45%	0.448	29%	0.285	S	S	.	.	H	α-helix	trans	-64.3	-41.4	178.1	168.4	0	0	0	0	111.4	P317 K370 E371 L378	P317-V374 HydrophobicContact CG-CG1 3.82Å; K370-V374 WeakPolarHBondContact O-CG2 3.37Å; K370-V374 PolarHBondContact O-N 2.87Å; E371-V374 PolarHBondContact O-N 3.02Å; V374-L378 WeakPolarHBondContact O-CB 3.4Å; V374-L378 PolarHBondContact O-N 3.02Å
375	A	91.2	Very high	88.7	Confident	28 Å²	28	50.2 Å²	50.2	23%	0.231	26%	0.258	C	S	.	.	H	α-helix	trans	-69.4	-40.3	176.1	0	0	0	0	0	113	A363 V365 E371 A372 L378 E379	A363-A375 HydrophobicContact CB-CB 4Å; V365-A375 HydrophobicContact CG2-CB 3.43Å; V365-A375 VanDerWaalsContact CG2-CB 3.43Å; E371-A375 PolarHBondContact O-N 3.17Å; E371-A375 VanDerWaalsContact O-N 3.1Å; A372-A375 PolarHBondContact O-N 2.96Å; A375-L378 WeakPolarHBondContact O-CB 3.46Å; A375-L378 PolarHBondContact O-N 3.22Å; A375-L378 VanDerWaalsContact O-N 3.15Å; A375-E379 PolarHBondContact O-N 3.29Å
376	C	92	Very high	88.6	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.6	-43.3	175	-176.2	0	0	0	0	111.4	F336 C348 A363 A372 V373 L378 E379 A380	F336-C376 HydrophobicContact CD1-CB 4.34Å; F336-C376 HydrophobicContact CE1-CB 4.33Å; C348-C376 HydrophobicContact CB-CB 3.95Å; A363-C376 HydrophobicContact CB-CB 4.07Å; A372-C376 VanDerWaalsContact O-CB 3.31Å; A372-C376 WeakPolarHBondContact O-CB 3.43Å; A372-C376 PolarHBondContact O-N 3.35Å; V373-C376 PolarHBondContact O-N 3Å; C376-L378 VanDerWaalsContact C-N 3.3Å; C376-L378 PolarHBondContact O-N 3.18Å; C376-E379 PolarHBondContact O-N 3.04Å; C376-A380 VanDerWaalsContact O-CB 3.32Å; C376-A380 WeakPolarHBondContact O-CB 3.25Å; C376-A380 PolarHBondContact O-N 3.44Å
377	A	92.6	Very high	88.7	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.7	-31.8	173.6	0	0	0	0	0	113.1	P317 K318 L321 F336 V373 C381	P317-A377 HydrophobicContact CB-CB 4.08Å; K318-A377 HydrophobicContact CB-CB 4.43Å; L321-A377 HydrophobicContact CD2-CB 4.08Å; F336-A377 HydrophobicContact CE1-CB 4.24Å; F336-A377 HydrophobicContact CZ-CB 4.2Å; V373-A377 WeakPolarHBondContact O-CB 3.43Å; V373-A377 PolarHBondContact O-N 3.3Å; A377-C381 PolarHBondContact O-N 3.05Å; A377-C381 PolarHBondContact O-SG 3.03Å
378	L	92.3	Very high	88.5	Confident	52 Å²	52	54.8 Å²	54.8	27%	0.272	27%	0.27	S	S	.	.	H	α-helix	trans	-71	-46.9	177	-174.3	157.8	0	0	0	111.7	P317 V374 A375 C376 A380 C381 Q382	P317-L378 HydrophobicContact CB-CB 4.09Å; P317-L378 HydrophobicContact CG-CB 4.36Å; V374-L378 WeakPolarHBondContact O-CB 3.4Å; V374-L378 PolarHBondContact O-N 3.02Å; A375-L378 WeakPolarHBondContact O-CB 3.46Å; A375-L378 PolarHBondContact O-N 3.22Å; A375-L378 VanDerWaalsContact O-N 3.15Å; C376-L378 VanDerWaalsContact C-N 3.3Å; C376-L378 PolarHBondContact O-N 3.18Å; L378-A380 VanDerWaalsContact C-N 3.3Å; L378-A380 PolarHBondContact O-N 2.94Å; L378-C381 PolarHBondContact O-N 3.32Å; L378-Q382 HydrophobicContact CD2-CG 4.24Å; L378-Q382 WeakPolarHBondContact O-CG 3.25Å; L378-Q382 PolarHBondContact O-N 3.14Å
379	E	91.3	Very high	87.9	Confident	72 Å²	72	50.2 Å²	50.2	34%	0.336	25%	0.251	S	S	.	.	H	α-helix	trans	-62.5	-38.3	172.6	-76.6	-61.9	155.3	0	0	111.3	A375 C376 Q382 L383 R386	A375-E379 PolarHBondContact O-N 3.29Å; C376-E379 PolarHBondContact O-N 3.04Å; E379-Q382 PolarHBondContact O-N 3.32Å; E379-L383 VanDerWaalsContact O-CB 3.29Å; E379-L383 WeakPolarHBondContact O-CB 3.46Å; E379-L383 PolarHBondContact O-N 3.31Å; E379-R386 IonicContact OE2-CZ 2.69Å; E379-R386 IonicContact OE2-NH1 3.67Å; E379-R386 IonicContact OE2-NH2 3.78Å; E379-R386 PolarHBondContact OE2-NH2 2.87Å
380	A	91.6	Very high	87.3	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59	-50.2	173.8	0	0	0	0	0	112.1	L321 I350 L352 A361 C376 L378 Q382 L383 L384	L321-A380 HydrophobicContact CD1-CB 4.01Å; L321-A380 HydrophobicContact CD2-CB 3.81Å; I350-A380 HydrophobicContact CG2-CB 3.99Å; L352-A380 HydrophobicContact CD1-CB 4.02Å; L352-A380 HydrophobicContact CD2-CB 4.3Å; A361-A380 HydrophobicContact CB-CB 3.91Å; C376-A380 VanDerWaalsContact O-CB 3.32Å; C376-A380 WeakPolarHBondContact O-CB 3.25Å; C376-A380 PolarHBondContact O-N 3.44Å; L378-A380 VanDerWaalsContact C-N 3.3Å; L378-A380 PolarHBondContact O-N 2.94Å; A380-Q382 PolarHBondContact O-N 3.36Å; A380-L383 WeakPolarHBondContact O-CB 3.39Å; A380-L383 PolarHBondContact O-N 3.36Å; A380-L383 VanDerWaalsContact O-N 3.16Å; A380-L384 WeakPolarHBondContact O-CG 3.47Å; A380-L384 PolarHBondContact O-N 3.07Å
381	C	89.7	Confident	86.3	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.4	-42.7	175.6	-69.5	0	0	0	0	112.3	Y313 A377 L378 L383 L384 D385 F390	Y313-C381 HydrophobicContact CD1-CB 3.73Å; Y313-C381 HydrophobicContact CD2-CB 3.48Å; Y313-C381 VanDerWaalsContact CD2-CB 3.48Å; Y313-C381 HydrophobicContact CE1-CB 4.12Å; Y313-C381 HydrophobicContact CE2-CB 3.92Å; Y313-C381 HydrophobicContact CG-CB 3.37Å; A377-C381 PolarHBondContact O-N 3.05Å; A377-C381 PolarHBondContact O-SG 3.03Å; L378-C381 PolarHBondContact O-N 3.32Å; C381-L383 VanDerWaalsContact C-N 3.28Å; C381-L383 PolarHBondContact O-N 3.24Å; C381-L384 PolarHBondContact O-N 2.86Å; C381-D385 WeakPolarHBondContact O-CB 3.36Å; C381-D385 PolarHBondContact O-N 2.89Å; C381-F390 HydrophobicContact CB-CE2 4.3Å; C381-F390 HydrophobicContact CB-CZ 4.42Å
382	Q	90.4	Very high	85.2	Confident	35 Å²	35	34.9 Å²	34.9	16%	0.164	19%	0.194	C	C	.	.	H	α-helix	trans	-61.8	-35.7	174.3	-73.3	-165.2	19.5	0	0	112.6	L307 Y313 L378 E379 A380 D385 R386	L307-Q382 HydrophobicContact CD1-CG 4.02Å; L307-Q382 HydrophobicContact CD2-CB 4.1Å; L307-Q382 HydrophobicContact CD2-CG 4.2Å; Y313-Q382 HydrophobicContact CE2-CG 3.66Å; L378-Q382 HydrophobicContact CD2-CG 4.24Å; L378-Q382 WeakPolarHBondContact O-CG 3.25Å; L378-Q382 PolarHBondContact O-N 3.14Å; E379-Q382 PolarHBondContact O-N 3.32Å; A380-Q382 PolarHBondContact O-N 3.36Å; Q382-D385 WeakPolarHBondContact O-CB 3.44Å; Q382-D385 PolarHBondContact O-N 3.49Å; Q382-R386 WeakPolarHBondContact O-CB 3.39Å; Q382-R386 WeakPolarHBondContact O-CG 3.49Å; Q382-R386 PolarHBondContact O-N 3.03Å
383	L	88.5	Confident	83.8	Confident	34 Å²	34	38.3 Å²	38.3	18%	0.178	21%	0.212	C	C	.	.	H	α-helix	trans	-68.6	-43	179.1	-161.7	63.6	0	0	0	111	L352 V359 A361 E379 A380 C381 D385 R386 L387	L352-L383 HydrophobicContact CD1-CD2 4.17Å; V359-L383 HydrophobicContact CB-CD2 4.43Å; V359-L383 HydrophobicContact CG1-CD2 3.58Å; V359-L383 HydrophobicContact CG1-CG 4.38Å; A361-L383 HydrophobicContact CB-CD2 4.26Å; E379-L383 VanDerWaalsContact O-CB 3.29Å; E379-L383 WeakPolarHBondContact O-CB 3.46Å; E379-L383 PolarHBondContact O-N 3.31Å; A380-L383 WeakPolarHBondContact O-CB 3.39Å; A380-L383 PolarHBondContact O-N 3.36Å; A380-L383 VanDerWaalsContact O-N 3.16Å; C381-L383 VanDerWaalsContact C-N 3.28Å; C381-L383 PolarHBondContact O-N 3.24Å; L383-D385 VanDerWaalsContact C-N 3.31Å; L383-D385 PolarHBondContact O-N 2.99Å; L383-R386 PolarHBondContact O-N 3.46Å; L383-L387 HydrophobicContact CG-CD1 4.36Å; L383-L387 WeakPolarHBondContact O-CB 3.47Å; L383-L387 WeakPolarHBondContact O-CD1 3.4Å; L383-L387 WeakPolarHBondContact O-CG 3.43Å; L383-L387 PolarHBondContact O-N 3.5Å
384	L	86.1	Confident	82.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.7	-35.3	172.8	-62.2	174.1	0	0	0	112.1	L321 Y324 L352 L354 A380 C381 L387 G388 E389 F390	L321-L384 HydrophobicContact CD1-CD1 3.68Å; Y324-L384 HydrophobicContact CD1-CD1 3.63Å; Y324-L384 HydrophobicContact CD2-CD1 3.91Å; Y324-L384 HydrophobicContact CE1-CD1 3.72Å; Y324-L384 HydrophobicContact CE1-CD2 4.01Å; Y324-L384 HydrophobicContact CE2-CD1 4.01Å; Y324-L384 HydrophobicContact CE2-CD2 4.2Å; Y324-L384 HydrophobicContact CG-CD1 3.75Å; L352-L384 HydrophobicContact CD1-CD2 4.14Å; L352-L384 HydrophobicContact CD1-CG 4.18Å; L352-L384 HydrophobicContact CD2-CD1 4.39Å; L354-L384 HydrophobicContact CD1-CD2 4.38Å; L354-L384 HydrophobicContact CD2-CD2 3.72Å; L354-L384 HydrophobicContact CG-CD2 4.18Å; A380-L384 WeakPolarHBondContact O-CG 3.47Å; A380-L384 PolarHBondContact O-N 3.07Å; C381-L384 PolarHBondContact O-N 2.86Å; L384-L387 PolarHBondContact O-N 3.24Å; L384-G388 PolarHBondContact O-N 3.12Å; L384-G388 VanDerWaalsContact O-N 3.12Å; L384-E389 PolarHBondContact O-N 3.24Å; L384-F390 HydrophobicContact CB-CB 3.73Å; L384-F390 HydrophobicContact CB-CD2 3.76Å; L384-F390 HydrophobicContact CB-CG 4.15Å; L384-F390 HydrophobicContact CD1-CD2 3.79Å; L384-F390 HydrophobicContact CD1-CE2 4.31Å; L384-F390 HydrophobicContact CG-CD2 4.44Å; L384-F390 PolarHBondContact O-N 2.87Å
385	D	87	Confident	80.3	Confident	6 Å²	6	42 Å²	42	3%	0.032	23%	0.225	C	C	.	.	H	α-helix	trans	-66.5	-48	174.9	-130.1	13.8	0	0	0	110.9	L307 H309 E310 Y313 C381 Q382 L383 L387 G388 F390	L307-D385 WeakPolarHBondContact CA-OD2 3.5Å; L307-D385 HydrophobicContact CD2-CB 3.85Å; H309-D385 VanDerWaalsContact CB-OD1 3.31Å; H309-D385 WeakPolarHBondContact CB-OD1 3.47Å; H309-D385 IonicContact CE1-OD1 2.7Å; H309-D385 IonicContact CG-OD1 2.73Å; H309-D385 PolarHBondContact N-OD1 3.01Å; H309-D385 PolarHBondContact N-OD2 3.46Å; H309-D385 VanDerWaalsContact N-OD2 3.12Å; H309-D385 IonicContact ND1-OD1 3.2Å; H309-D385 PolarHBondContact ND1-OD1 3.43Å; E310-D385 PolarHBondContact N-OD2 3.07Å; Y313-D385 HydrophobicContact CE1-CB 4.33Å; Y313-D385 WeakPolarHBondContact CE1-OD2 3.5Å; Y313-D385 PolarHBondContact OH-OD2 2.91Å; C381-D385 WeakPolarHBondContact O-CB 3.36Å; C381-D385 PolarHBondContact O-N 2.89Å; Q382-D385 WeakPolarHBondContact O-CB 3.44Å; Q382-D385 PolarHBondContact O-N 3.49Å; L383-D385 VanDerWaalsContact C-N 3.31Å; L383-D385 PolarHBondContact O-N 2.99Å; D385-L387 PolarHBondContact O-N 3.01Å; D385-G388 PolarHBondContact O-N 2.83Å; D385-F390 HydrophobicContact CB-CB 4.34Å
386	R	83.8	Confident	78.3	Confident	114 Å²	114	48.5 Å²	48.5	43%	0.43	24%	0.244	S	C	.	.	H	α-helix	trans	-60.8	-27.5	175.2	-68.3	167.2	-152.2	158.5	7.9	112.5	L307 E379 Q382 L383	L307-R386 HydrophobicContact CD2-CG 3.91Å; E379-R386 IonicContact OE2-CZ 2.69Å; E379-R386 IonicContact OE2-NH1 3.67Å; E379-R386 IonicContact OE2-NH2 3.78Å; E379-R386 PolarHBondContact OE2-NH2 2.87Å; Q382-R386 WeakPolarHBondContact O-CB 3.39Å; Q382-R386 WeakPolarHBondContact O-CG 3.49Å; Q382-R386 PolarHBondContact O-N 3.03Å; L383-R386 PolarHBondContact O-N 3.46Å
387	L	81.5	Confident	76.1	Confident	90 Å²	90	49.8 Å²	49.8	47%	0.471	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-6.7	176.2	-69	167.6	0	0	0	113.4	L354 L383 L384 D385 E389	L354-L387 HydrophobicContact CD1-CD1 3.93Å; L354-L387 HydrophobicContact CD2-CB 4.4Å; L354-L387 HydrophobicContact CD2-CD1 3.76Å; L383-L387 HydrophobicContact CG-CD1 4.36Å; L383-L387 WeakPolarHBondContact O-CB 3.47Å; L383-L387 WeakPolarHBondContact O-CD1 3.4Å; L383-L387 WeakPolarHBondContact O-CG 3.43Å; L383-L387 PolarHBondContact O-N 3.5Å; L384-L387 PolarHBondContact O-N 3.24Å; D385-L387 PolarHBondContact O-N 3.01Å; L387-E389 VanDerWaalsContact C-N 3.28Å; L387-E389 PolarHBondContact O-N 3.44Å
388	G	77.5	Confident	74.1	Confident	55 Å²	55	53.8 Å²	53.8	57%	0.567	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	3.1	179	0	0	0	0	0	115.7	L384 D385	L384-G388 PolarHBondContact O-N 3.12Å; L384-G388 VanDerWaalsContact O-N 3.12Å; D385-G388 PolarHBondContact O-N 2.83Å
389	E	74.7	Confident	72	Confident	47 Å²	47	53.8 Å²	53.8	22%	0.22	29%	0.285	C	S	.	.			trans	-92.2	-13	-177.1	-67.3	-75.3	-153.9	0	0	113.1	Y324 R327 L354 L384 L387 D391 K394	Y324-E389 HydrophobicContact CE2-CB 4.33Å; R327-E389 PolarHBondContact NH2-O 2.98Å; L354-E389 HydrophobicContact CD2-CB 4.17Å; L354-E389 HydrophobicContact CD2-CG 3.99Å; L384-E389 PolarHBondContact O-N 3.24Å; L387-E389 VanDerWaalsContact C-N 3.28Å; L387-E389 PolarHBondContact O-N 3.44Å; E389-D391 PolarHBondContact O-N 3.05Å; E389-K394 IonicContact OE2-NZ 2.67Å; E389-K394 PolarHBondContact OE2-NZ 3.41Å
390	F	71.5	Confident	70.1	Confident	10 Å²	10	57.5 Å²	57.5	4%	0.044	30%	0.3	C	S	.	.			trans	-78.3	35.5	176	-154.1	-97.5	0	0	0	113.8	H309 Y313 A320 Y324 C381 L384 D385 P392	H309-F390 HydrophobicContact CB-CD1 4.01Å; H309-F390 PolarHBondContact ND1-O 3.48Å; Y313-F390 AromaticContact CD1-CD1 3.86Å; Y313-F390 HydrophobicContact CD1-CD1 3.86Å; Y313-F390 AromaticContact CD1-CE1 3.5Å; Y313-F390 HydrophobicContact CD1-CE1 3.5Å; Y313-F390 VanDerWaalsContact CD1-CE1 3.5Å; Y313-F390 HydrophobicContact CD1-CZ 4.14Å; Y313-F390 HydrophobicContact CE1-CD1 4Å; Y313-F390 HydrophobicContact CE1-CE1 4.13Å; Y313-F390 HydrophobicContact CG-CE1 4.44Å; A320-F390 HydrophobicContact CB-CZ 3.88Å; Y324-F390 HydrophobicContact CD2-CD2 4.18Å; C381-F390 HydrophobicContact CB-CE2 4.3Å; C381-F390 HydrophobicContact CB-CZ 4.42Å; L384-F390 HydrophobicContact CB-CB 3.73Å; L384-F390 HydrophobicContact CB-CD2 3.76Å; L384-F390 HydrophobicContact CB-CG 4.15Å; L384-F390 HydrophobicContact CD1-CD2 3.79Å; L384-F390 HydrophobicContact CD1-CE2 4.31Å; L384-F390 HydrophobicContact CG-CD2 4.44Å; L384-F390 PolarHBondContact O-N 2.87Å; D385-F390 HydrophobicContact CB-CB 4.34Å; F390-P392 WeakPolarHBondContact O-CD 3.25Å
391	D	68.8	Low	68.2	Low	53 Å²	53	64.3 Å²	64.3	28%	0.283	33%	0.33	S	S	.	.			trans	-81	108.9	177.8	-161.5	-31.4	0	0	0	110.1	R327 E389 D393 K394	R327-D391 PolarHBondContact NH2-O 3.49Å; E389-D391 PolarHBondContact O-N 3.05Å; D391-D393 PolarHBondContact O-N 3.35Å; D391-D393 PolarHBondContact OD1-N 2.93Å; D391-D393 VanDerWaalsContact OD1-N 3.08Å; D391-K394 HydrophobicContact CB-CB 4.28Å; D391-K394 PolarHBondContact O-N 2.85Å; D391-K394 PolarHBondContact OD1-N 2.92Å
392	P	65.1	Low	66.6	Low	40 Å²	40	70.4 Å²	70.4	26%	0.26	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-19.2	-178.6	33.5	-37.9	0	0	0	112.3	L312 F390	L312-P392 HydrophobicContact CD1-CG 4.32Å; L312-P392 HydrophobicContact CD2-CB 3.86Å; L312-P392 HydrophobicContact CD2-CG 3.78Å; F390-P392 WeakPolarHBondContact O-CD 3.25Å
393	D	61	Low	65.2	Low	73 Å²	73	71.1 Å²	71.1	39%	0.39	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109	23.7	-178.3	-72.2	-54.8	0	0	0	111.5	D391 D395 R396 S397	D391-D393 PolarHBondContact O-N 3.35Å; D391-D393 PolarHBondContact OD1-N 2.93Å; D391-D393 VanDerWaalsContact OD1-N 3.08Å; D393-D395 VanDerWaalsContact C-N 3.31Å; D393-D395 PolarHBondContact O-N 3.02Å; D393-R396 HydrophobicContact CB-CB 4.22Å; D393-R396 PolarHBondContact O-N 3.25Å; D393-R396 WeakPolarHBondContact OD1-CB 3.31Å; D393-R396 VanDerWaalsContact OD1-CD 3.25Å; D393-R396 WeakPolarHBondContact OD1-CD 3.13Å; D393-S397 WeakPolarHBondContact O-CA 3.3Å; D393-S397 WeakPolarHBondContact O-CB 3.43Å; D393-S397 PolarHBondContact O-N 3.12Å; D393-S397 PolarHBondContact O-OG 3.25Å
394	K	59.1	Low	63.8	Low	72 Å²	72	79.9 Å²	79.9	31%	0.313	39%	0.391	S	S	.	.	H	α-helix	trans	-53.8	-47.4	173.7	-149.6	169.6	176.4	-176.2	0	111.1	E328 E389 D391 T398	E328-K394 IonicContact OE1-NZ 3.95Å; E328-K394 IonicContact OE2-NZ 3.12Å; E389-K394 IonicContact OE2-NZ 2.67Å; E389-K394 PolarHBondContact OE2-NZ 3.41Å; D391-K394 HydrophobicContact CB-CB 4.28Å; D391-K394 PolarHBondContact O-N 2.85Å; D391-K394 PolarHBondContact OD1-N 2.92Å; K394-T398 VanDerWaalsContact O-CG2 3.3Å; K394-T398 WeakPolarHBondContact O-CG2 3.29Å; K394-T398 PolarHBondContact O-OG1 2.96Å
395	D	50.9	Low	62.9	Low	100 Å²	100	82.2 Å²	82.2	54%	0.535	41%	0.407	S	S	.	.	H	α-helix	trans	-85.6	-36.3	178	-51.2	-57.1	0	0	0	113.3	R327 D393 T398 A399	R327-D395 VanDerWaalsContact CD-OD2 3.24Å; R327-D395 WeakPolarHBondContact CD-OD2 3.43Å; D393-D395 VanDerWaalsContact C-N 3.31Å; D393-D395 PolarHBondContact O-N 3.02Å; D395-T398 PolarHBondContact O-OG1 3.14Å; D395-A399 PolarHBondContact O-N 3.16Å
396	R	49.7	Very low	62.2	Low	166 Å²	166	87.2 Å²	87.2	63%	0.626	43%	0.426	S	S	*	.	H	α-helix	trans	-70.9	-48.3	-179.8	-76	-178.6	164.8	-158.3	-5.2	111.7	D393 T398 A399 F400	D393-R396 HydrophobicContact CB-CB 4.22Å; D393-R396 PolarHBondContact O-N 3.25Å; D393-R396 WeakPolarHBondContact OD1-CB 3.31Å; D393-R396 VanDerWaalsContact OD1-CD 3.25Å; D393-R396 WeakPolarHBondContact OD1-CD 3.13Å; R396-T398 VanDerWaalsContact C-N 3.34Å; R396-T398 PolarHBondContact O-N 3.12Å; R396-A399 PolarHBondContact O-N 3.08Å; R396-F400 WeakPolarHBondContact O-CB 3.42Å; R396-F400 WeakPolarHBondContact O-CD2 3.42Å; R396-F400 PolarHBondContact O-N 3.26Å
397	S	45.8	Very low	61.8	Low	26 Å²	26	83.8 Å²	83.8	18%	0.182	42%	0.422	C	S	.	.	H	α-helix	trans	-69.5	-32.1	-176.5	81.1	0	0	0	0	111.8	D393 K401	D393-S397 WeakPolarHBondContact O-CA 3.3Å; D393-S397 WeakPolarHBondContact O-CB 3.43Å; D393-S397 PolarHBondContact O-N 3.12Å; D393-S397 PolarHBondContact O-OG 3.25Å; S397-K401 WeakPolarHBondContact O-CB 3.37Å; S397-K401 WeakPolarHBondContact O-CD 3.3Å; S397-K401 WeakPolarHBondContact O-CG 3.44Å; S397-K401 PolarHBondContact O-N 3.09Å; S397-K401 PolarHBondContact OG-NZ 2.86Å
398	T	50.1	Low	61.7	Low	84 Å²	84	80.2 Å²	80.2	52%	0.515	40%	0.402	S	S	.	.	H	α-helix	trans	-64.2	-48.7	172.6	44.8	0	0	0	0	111	K394 D395 R396 K401 Y402	K394-T398 VanDerWaalsContact O-CG2 3.3Å; K394-T398 WeakPolarHBondContact O-CG2 3.29Å; K394-T398 PolarHBondContact O-OG1 2.96Å; D395-T398 PolarHBondContact O-OG1 3.14Å; R396-T398 VanDerWaalsContact C-N 3.34Å; R396-T398 PolarHBondContact O-N 3.12Å; T398-K401 PolarHBondContact O-N 2.72Å; T398-Y402 WeakPolarHBondContact O-CB 3.47Å; T398-Y402 PolarHBondContact O-N 2.97Å
399	A	48.3	Very low	61.9	Low	53 Å²	53	79.7 Å²	79.7	44%	0.438	38%	0.383	S	S	.	.	H	α-helix	trans	-59.4	-50.5	174.4	0	0	0	0	0	112.9	D395 R396 K401 Y402 T403	D395-A399 PolarHBondContact O-N 3.16Å; R396-A399 PolarHBondContact O-N 3.08Å; A399-K401 PolarHBondContact O-N 3.22Å; A399-Y402 PolarHBondContact O-N 3.44Å; A399-T403 WeakPolarHBondContact O-CG2 3.41Å; A399-T403 PolarHBondContact O-N 2.96Å; A399-T403 PolarHBondContact O-OG1 2.69Å
400	F	50.2	Low	62.2	Low	150 Å²	150	81.1 Å²	81.1	66%	0.658	39%	0.39	S	S	*	.	H	α-helix	trans	-72.3	-23	-179	-83.2	-75	0	0	0	114.5	R396 T403 R404	R396-F400 WeakPolarHBondContact O-CB 3.42Å; R396-F400 WeakPolarHBondContact O-CD2 3.42Å; R396-F400 PolarHBondContact O-N 3.26Å; F400-T403 PolarHBondContact O-OG1 3.48Å; F400-R404 WeakPolarHBondContact O-CB 3.07Å
401	K	52.9	Low	62.7	Low	142 Å²	142	86.3 Å²	86.3	62%	0.617	42%	0.418	S	S	*	.	H	α-helix	trans	-75.1	-40.4	168.5	-71.8	160.4	-169.3	156.6	0	110.3	S397 T398 A399 R404 S405	S397-K401 WeakPolarHBondContact O-CB 3.37Å; S397-K401 WeakPolarHBondContact O-CD 3.3Å; S397-K401 WeakPolarHBondContact O-CG 3.44Å; S397-K401 PolarHBondContact O-N 3.09Å; S397-K401 PolarHBondContact OG-NZ 2.86Å; T398-K401 PolarHBondContact O-N 2.72Å; A399-K401 PolarHBondContact O-N 3.22Å; K401-R404 PolarHBondContact O-N 3.44Å; K401-S405 PolarHBondContact O-N 2.77Å
402	Y	55.9	Low	63.2	Low	128 Å²	128	88.6 Å²	88.6	50%	0.502	42%	0.423	S	S	.	.	H	α-helix	trans	-66	-49.2	179.4	-161.5	-103.7	0	0	0	111.8	T398 A399 R404 S405 Y408	T398-Y402 WeakPolarHBondContact O-CB 3.47Å; T398-Y402 PolarHBondContact O-N 2.97Å; A399-Y402 PolarHBondContact O-N 3.44Å; Y402-R404 PolarHBondContact O-N 2.85Å; Y402-S405 VanDerWaalsContact O-CB 3.27Å; Y402-S405 WeakPolarHBondContact O-CB 3.36Å; Y402-S405 PolarHBondContact O-N 3.35Å; Y402-Y408 AromaticContact CD1-CD2 3.59Å; Y402-Y408 HydrophobicContact CD1-CD2 3.59Å; Y402-Y408 HydrophobicContact CD1-CE2 4.43Å; Y402-Y408 HydrophobicContact CD1-CG 4.38Å; Y402-Y408 AromaticContact CE1-CD2 3.77Å; Y402-Y408 HydrophobicContact CE1-CD2 3.77Å; Y402-Y408 WeakPolarHBondContact O-CB 2.81Å
403	T	60.2	Low	64.2	Low	50 Å²	50	91.8 Å²	91.8	31%	0.307	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-14.3	177.1	57.5	0	0	0	0	114.4	A399 F400 Y408 W409	A399-T403 WeakPolarHBondContact O-CG2 3.41Å; A399-T403 PolarHBondContact O-N 2.96Å; A399-T403 PolarHBondContact O-OG1 2.69Å; F400-T403 PolarHBondContact O-OG1 3.48Å; T403-Y408 HydrophobicContact CG2-CD2 4.37Å; T403-Y408 HydrophobicContact CG2-CE1 4.43Å; T403-Y408 HydrophobicContact CG2-CE2 3.68Å; T403-Y408 WeakPolarHBondContact O-CD1 3.1Å; T403-W409 PolarHBondContact O-NE1 3.01Å
404	R	60.1	Low	65.3	Low	218 Å²	218	89.1 Å²	89.1	82%	0.823	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-4.5	176	-160.2	170.6	-176	169.6	2.6	113.4	F400 K401 Y402	F400-R404 WeakPolarHBondContact O-CB 3.07Å; K401-R404 PolarHBondContact O-N 3.44Å; Y402-R404 PolarHBondContact O-N 2.85Å
405	S	66.9	Low	66.6	Low	49 Å²	49	88.6 Å²	88.6	34%	0.343	42%	0.419	S	S	.	.	S	Bend	trans	-72.9	144.8	176	-174.9	0	0	0	0	111.4	K401 Y402 A407 Y408 W409	K401-S405 PolarHBondContact O-N 2.77Å; Y402-S405 VanDerWaalsContact O-CB 3.27Å; Y402-S405 WeakPolarHBondContact O-CB 3.36Å; Y402-S405 PolarHBondContact O-N 3.35Å; S405-A407 VanDerWaalsContact C-N 3.29Å; S405-A407 PolarHBondContact O-N 2.95Å; S405-A407 PolarHBondContact OG-N 3.16Å; S405-Y408 PolarHBondContact O-N 3.13Å; S405-W409 VanDerWaalsContact O-CD1 3.32Å
406	R	72.3	Confident	68.1	Low	112 Å²	112	84.8 Å²	84.8	42%	0.423	40%	0.4	S	S	.	.	H	α-helix	trans	-57	-44.9	172.2	-172.8	-167	168.9	92	17.3	111.2	Y408 W409 E410 L440	R406-Y408 VanDerWaalsContact C-N 3.31Å; R406-Y408 PolarHBondContact O-N 3.46Å; R406-W409 PolarHBondContact O-N 3.29Å; R406-W409 VanDerWaalsContact O-N 3.09Å; R406-E410 HydrophobicContact CG-CG 4.43Å; R406-E410 WeakPolarHBondContact CG-OE2 3.37Å; R406-E410 IonicContact CZ-OE1 2.73Å; R406-E410 VanDerWaalsContact NE-CD 3.29Å; R406-E410 IonicContact NE-OE1 3.38Å; R406-E410 PolarHBondContact NE-OE1 3.2Å; R406-E410 IonicContact NE-OE2 3.88Å; R406-E410 PolarHBondContact NE-OE2 3.2Å; R406-E410 IonicContact NH2-OE1 3.7Å; R406-E410 PolarHBondContact NH2-OE1 2.96Å; R406-E410 PolarHBondContact O-N 3.35Å; R406-L440 HydrophobicContact CB-CD2 4.47Å; R406-L440 HydrophobicContact CG-CD2 4.41Å; R406-L440 PolarHBondContact NH1-O 3.34Å
407	A	76.3	Confident	69.6	Low	42 Å²	42	82 Å²	82	35%	0.347	41%	0.406	S	S	.	.	H	α-helix	trans	-59.4	-38	-179.2	0	0	0	0	0	112.9	S405 W409 E410 D411	S405-A407 VanDerWaalsContact C-N 3.29Å; S405-A407 PolarHBondContact O-N 2.95Å; S405-A407 PolarHBondContact OG-N 3.16Å; A407-W409 VanDerWaalsContact C-N 3.27Å; A407-W409 PolarHBondContact O-N 2.91Å; A407-E410 PolarHBondContact O-N 2.7Å; A407-D411 WeakPolarHBondContact O-CB 3.27Å; A407-D411 VanDerWaalsContact O-CG 3.22Å; A407-D411 PolarHBondContact O-N 3.42Å
408	Y	79.2	Confident	71.3	Confident	15 Å²	15	86.9 Å²	86.9	6%	0.059	43%	0.43	C	S	.	.	H	α-helix	trans	-61.3	-33.8	177	163.8	-82.4	0	0	0	113.1	Y402 T403 S405 R406 R412	Y402-Y408 AromaticContact CD1-CD2 3.59Å; Y402-Y408 HydrophobicContact CD1-CD2 3.59Å; Y402-Y408 HydrophobicContact CD1-CE2 4.43Å; Y402-Y408 HydrophobicContact CD1-CG 4.38Å; Y402-Y408 AromaticContact CE1-CD2 3.77Å; Y402-Y408 HydrophobicContact CE1-CD2 3.77Å; Y402-Y408 WeakPolarHBondContact O-CB 2.81Å; T403-Y408 HydrophobicContact CG2-CD2 4.37Å; T403-Y408 HydrophobicContact CG2-CE1 4.43Å; T403-Y408 HydrophobicContact CG2-CE2 3.68Å; T403-Y408 WeakPolarHBondContact O-CD1 3.1Å; S405-Y408 PolarHBondContact O-N 3.13Å; R406-Y408 VanDerWaalsContact C-N 3.31Å; R406-Y408 PolarHBondContact O-N 3.46Å; Y408-R412 VanDerWaalsContact CE2-NE 3.32Å; Y408-R412 WeakPolarHBondContact O-CB 3.31Å; Y408-R412 WeakPolarHBondContact O-CD 3.49Å; Y408-R412 VanDerWaalsContact O-CG 3.26Å; Y408-R412 WeakPolarHBondContact O-CG 3.48Å; Y408-R412 PolarHBondContact OH-NH1 2.97Å; Y408-R412 VanDerWaalsContact OH-NH1 3.12Å
409	W	81.5	Confident	72.7	Confident	43 Å²	43	84 Å²	84	16%	0.163	41%	0.411	C	S	.	.	H	α-helix	trans	-83.9	-32.8	177.7	-67.3	102.6	0	0	0	111.8	T403 S405 R406 A407 R412 D413 Y414 Y415 L440	T403-W409 PolarHBondContact O-NE1 3.01Å; S405-W409 VanDerWaalsContact O-CD1 3.32Å; R406-W409 PolarHBondContact O-N 3.29Å; R406-W409 VanDerWaalsContact O-N 3.09Å; A407-W409 VanDerWaalsContact C-N 3.27Å; A407-W409 PolarHBondContact O-N 2.91Å; W409-R412 PolarHBondContact O-N 3.4Å; W409-D413 PolarHBondContact O-N 3.48Å; W409-Y414 HydrophobicContact CB-CD1 3.93Å; W409-Y414 HydrophobicContact CB-CE1 4.18Å; W409-Y414 WeakPolarHBondContact O-CA 3.35Å; W409-Y414 PolarHBondContact O-N 3.26Å; W409-Y415 WeakPolarHBondContact CZ3-O 3.27Å; W409-L440 HydrophobicContact CB-CD1 3.64Å; W409-L440 HydrophobicContact CG-CD1 3.79Å
410	E	80.6	Confident	74.3	Confident	78 Å²	78	85.4 Å²	85.4	36%	0.364	41%	0.411	S	S	.	.	H	α-helix	trans	-66.2	-44.2	172.6	-72.5	174	144.8	0	0	111.7	R406 A407 R412 D413 Y414	R406-E410 HydrophobicContact CG-CG 4.43Å; R406-E410 WeakPolarHBondContact CG-OE2 3.37Å; R406-E410 IonicContact CZ-OE1 2.73Å; R406-E410 VanDerWaalsContact NE-CD 3.29Å; R406-E410 IonicContact NE-OE1 3.38Å; R406-E410 PolarHBondContact NE-OE1 3.2Å; R406-E410 IonicContact NE-OE2 3.88Å; R406-E410 PolarHBondContact NE-OE2 3.2Å; R406-E410 IonicContact NH2-OE1 3.7Å; R406-E410 PolarHBondContact NH2-OE1 2.96Å; R406-E410 PolarHBondContact O-N 3.35Å; A407-E410 PolarHBondContact O-N 2.7Å; E410-R412 PolarHBondContact O-N 3.13Å; E410-R412 VanDerWaalsContact O-N 3.08Å; E410-D413 PolarHBondContact O-N 2.95Å; E410-Y414 HydrophobicContact CG-CE2 4.23Å; E410-Y414 VanDerWaalsContact CG-OH 3.24Å; E410-Y414 WeakPolarHBondContact CG-OH 3.32Å
411	D	81.8	Confident	75.8	Confident	119 Å²	119	81.8 Å²	81.8	64%	0.636	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-12.2	175.4	-73.1	-14.7	0	0	0	114.3	A407	A407-D411 WeakPolarHBondContact O-CB 3.27Å; A407-D411 VanDerWaalsContact O-CG 3.22Å; A407-D411 PolarHBondContact O-N 3.42Å
412	R	79.5	Confident	76.9	Confident	100 Å²	100	84.9 Å²	84.9	38%	0.377	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.4	18.1	-173.3	-65	-178.4	-179.5	-143.9	-2.7	113.3	Y408 W409 E410 Y414 Y415	Y408-R412 VanDerWaalsContact CE2-NE 3.32Å; Y408-R412 WeakPolarHBondContact O-CB 3.31Å; Y408-R412 WeakPolarHBondContact O-CD 3.49Å; Y408-R412 VanDerWaalsContact O-CG 3.26Å; Y408-R412 WeakPolarHBondContact O-CG 3.48Å; Y408-R412 PolarHBondContact OH-NH1 2.97Å; Y408-R412 VanDerWaalsContact OH-NH1 3.12Å; W409-R412 PolarHBondContact O-N 3.4Å; E410-R412 PolarHBondContact O-N 3.13Å; E410-R412 VanDerWaalsContact O-N 3.08Å; R412-Y414 PolarHBondContact O-N 2.89Å; R412-Y415 WeakPolarHBondContact O-CD2 2.87Å; R412-Y415 PolarHBondContact O-N 3.17Å
413	D	85.6	Confident	78.1	Confident	107 Å²	107	83.8 Å²	83.8	57%	0.572	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	31.7	-175.6	-75.3	-47.5	0	0	0	113.5	W409 E410 Y415 R433	W409-D413 PolarHBondContact O-N 3.48Å; E410-D413 PolarHBondContact O-N 2.95Å; D413-Y415 VanDerWaalsContact C-N 3.3Å; D413-Y415 HydrophobicContact CB-CD2 3.85Å; D413-Y415 HydrophobicContact CB-CE2 3.93Å; D413-Y415 WeakPolarHBondContact O-CD2 3.46Å; D413-Y415 PolarHBondContact O-N 2.97Å; D413-R433 PolarHBondContact O-NE 2.97Å; D413-R433 PolarHBondContact O-NH2 3.22Å
414	Y	84.6	Confident	79	Confident	17 Å²	17	82.9 Å²	82.9	7%	0.067	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.4	24.6	-176.4	-57.5	-102	0	0	0	115.5	W409 E410 R412 R436 M437 L440 V442	W409-Y414 HydrophobicContact CB-CD1 3.93Å; W409-Y414 HydrophobicContact CB-CE1 4.18Å; W409-Y414 WeakPolarHBondContact O-CA 3.35Å; W409-Y414 PolarHBondContact O-N 3.26Å; E410-Y414 HydrophobicContact CG-CE2 4.23Å; E410-Y414 VanDerWaalsContact CG-OH 3.24Å; E410-Y414 WeakPolarHBondContact CG-OH 3.32Å; R412-Y414 PolarHBondContact O-N 2.89Å; Y414-R436 HydrophobicContact CD1-CB 4.31Å; Y414-R436 PolarHBondContact O-NE 3.12Å; Y414-R436 PolarHBondContact O-NH2 3.24Å; Y414-M437 HydrophobicContact CD1-CB 4.31Å; Y414-M437 HydrophobicContact CD1-CG 3.61Å; Y414-M437 HydrophobicContact CD2-CE 4.45Å; Y414-M437 HydrophobicContact CD2-CG 3.59Å; Y414-M437 HydrophobicContact CD2-SD 4.28Å; Y414-M437 HydrophobicContact CE1-CB 4.47Å; Y414-M437 HydrophobicContact CE1-CG 4.03Å; Y414-M437 HydrophobicContact CE2-CG 4.05Å; Y414-M437 HydrophobicContact CG-CG 3.38Å; Y414-M437 HydrophobicContact CG-SD 4.46Å; Y414-L440 HydrophobicContact CD1-CD1 3.92Å; Y414-L440 HydrophobicContact CE1-CB 4.04Å; Y414-L440 HydrophobicContact CE1-CD1 3.56Å; Y414-L440 HydrophobicContact CE1-CG 4.42Å; Y414-V442 HydrophobicContact CE1-CG2 4.16Å; Y414-V442 HydrophobicContact CE2-CG2 4.32Å; Y414-V442 WeakPolarHBondContact OH-CG2 3.31Å
415	Y	86.5	Confident	79.8	Confident	62 Å²	62	84.4 Å²	84.4	24%	0.243	42%	0.416	C	S	.	.			trans	-94	149.4	168.5	-63.1	-84.4	0	0	0	112.5	W409 R412 D413 T421 V429 E430 R433	W409-Y415 WeakPolarHBondContact CZ3-O 3.27Å; R412-Y415 WeakPolarHBondContact O-CD2 2.87Å; R412-Y415 PolarHBondContact O-N 3.17Å; D413-Y415 VanDerWaalsContact C-N 3.3Å; D413-Y415 HydrophobicContact CB-CD2 3.85Å; D413-Y415 HydrophobicContact CB-CE2 3.93Å; D413-Y415 WeakPolarHBondContact O-CD2 3.46Å; D413-Y415 PolarHBondContact O-N 2.97Å; Y415-T421 HydrophobicContact CE1-CG2 3.64Å; Y415-V429 HydrophobicContact CD1-CG1 3.74Å; Y415-V429 HydrophobicContact CE1-CG1 3.71Å; Y415-E430 PolarHBondContact OH-OE2 2.89Å; Y415-R433 VanDerWaalsContact CZ-CD 3.45Å
416	S	82.5	Confident	80.4	Confident	19 Å²	19	87.1 Å²	87.1	13%	0.133	43%	0.431	C	S	.	.			trans	-88.8	160.2	164.1	56.4	0	0	0	0	110.4	D418 E419	S416-D418 WeakPolarHBondContact CB-OD1 3.34Å; S416-D418 PolarHBondContact O-N 3.39Å; S416-D418 VanDerWaalsContact O-N 3.09Å; S416-D418 PolarHBondContact OG-OD1 3.45Å; S416-E419 PolarHBondContact O-N 2.84Å; S416-E419 VanDerWaalsContact O-N 3.15Å; S416-E419 WeakPolarHBondContact OG-CB 3.43Å; S416-E419 WeakPolarHBondContact OG-CG 3.49Å; S416-E419 PolarHBondContact OG-OE1 3.26Å
417	S	80.2	Confident	80.9	Confident	109 Å²	109	83.3 Å²	83.3	76%	0.762	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	0.6	-174.6	50	0	0	0	0	115.2
418	D	81.4	Confident	81.1	Confident	128 Å²	128	83 Å²	83	68%	0.684	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	-5.5	174.5	65.7	-36.1	0	0	0	113.2	S416 D420	S416-D418 WeakPolarHBondContact CB-OD1 3.34Å; S416-D418 PolarHBondContact O-N 3.39Å; S416-D418 VanDerWaalsContact O-N 3.09Å; S416-D418 PolarHBondContact OG-OD1 3.45Å; D418-D420 PolarHBondContact O-N 3.24Å
419	E	80.5	Confident	81.3	Confident	24 Å²	24	82.9 Å²	82.9	11%	0.112	42%	0.424	C	S	.	.			trans	-101.6	84.2	-175.2	-79.9	177.2	-166	0	0	112.1	S416 V429 K432 R436	S416-E419 PolarHBondContact O-N 2.84Å; S416-E419 VanDerWaalsContact O-N 3.15Å; S416-E419 WeakPolarHBondContact OG-CB 3.43Å; S416-E419 WeakPolarHBondContact OG-CG 3.49Å; S416-E419 PolarHBondContact OG-OE1 3.26Å; E419-V429 HydrophobicContact CB-CG1 3.94Å; E419-V429 HydrophobicContact CB-CG2 4.08Å; E419-V429 HydrophobicContact CG-CG2 4.24Å; E419-K432 WeakPolarHBondContact OE1-CD 3.42Å; E419-K432 WeakPolarHBondContact OE1-CE 3.41Å; E419-K432 IonicContact OE1-NZ 3.02Å; E419-K432 PolarHBondContact OE1-NZ 3.23Å; E419-R436 IonicContact OE1-NH1 3.81Å; E419-R436 PolarHBondContact OE1-NH1 2.89Å; E419-R436 IonicContact OE2-CZ 3.41Å; E419-R436 IonicContact OE2-NH1 3.44Å; E419-R436 PolarHBondContact OE2-NH1 3.27Å; E419-R436 IonicContact OE2-NH2 3.64Å; E419-R436 PolarHBondContact OE2-NH2 2.82Å
420	D	82.1	Confident	81.3	Confident	81 Å²	81	83.6 Å²	83.6	43%	0.433	43%	0.429	S	S	.	.			trans	-87	128.4	174.1	174.7	22.3	0	0	0	112	D418 Y422 V423	D418-D420 PolarHBondContact O-N 3.24Å; D420-Y422 WeakPolarHBondContact OD1-CB 3.39Å; D420-Y422 PolarHBondContact OD1-N 2.83Å; D420-V423 HydrophobicContact CB-CG2 4.14Å; D420-V423 WeakPolarHBondContact O-CG2 3.21Å
421	T	80.7	Confident	81.4	Confident	74 Å²	74	86.9 Å²	86.9	45%	0.454	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-19.6	176.2	40.5	0	0	0	0	113.9	Y415 V423 D424 V429	Y415-T421 HydrophobicContact CE1-CG2 3.64Å; T421-V423 VanDerWaalsContact C-N 3.3Å; T421-V423 PolarHBondContact O-N 3.3Å; T421-D424 PolarHBondContact O-N 3.26Å; T421-V429 HydrophobicContact CG2-CB 4.3Å; T421-V429 HydrophobicContact CG2-CG1 3.76Å
422	Y	76.6	Confident	81.6	Confident	207 Å²	207	86.1 Å²	86.1	81%	0.812	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-30.5	-179.7	-179.4	-104.8	0	0	0	112.9	D420	D420-Y422 WeakPolarHBondContact OD1-CB 3.39Å; D420-Y422 PolarHBondContact OD1-N 2.83Å
423	V	80.8	Confident	81.8	Confident	106 Å²	106	83.6 Å²	83.6	64%	0.642	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-18.8	176.6	-69.4	0	0	0	0	114.1	D420 T421 R425	D420-V423 HydrophobicContact CB-CG2 4.14Å; D420-V423 WeakPolarHBondContact O-CG2 3.21Å; T421-V423 VanDerWaalsContact C-N 3.3Å; T421-V423 PolarHBondContact O-N 3.3Å; V423-R425 PolarHBondContact O-N 3.01Å; V423-R425 VanDerWaalsContact O-N 3.15Å
424	D	79.5	Confident	81.7	Confident	30 Å²	30	81.3 Å²	81.3	16%	0.16	41%	0.407	C	S	.	.			trans	-85	87.3	-176.6	-179.8	26.4	0	0	0	113.6	T421 T426 G427 A428 V429	T421-D424 PolarHBondContact O-N 3.26Å; D424-T426 PolarHBondContact O-N 3.48Å; D424-T426 WeakPolarHBondContact OD1-CA 3.36Å; D424-T426 WeakPolarHBondContact OD1-CB 3.31Å; D424-T426 PolarHBondContact OD1-N 2.98Å; D424-T426 PolarHBondContact OD1-OG1 3.06Å; D424-G427 PolarHBondContact OD1-N 3.07Å; D424-G427 VanDerWaalsContact OD1-N 3.12Å; D424-G427 VanDerWaalsContact OD2-C 3.24Å; D424-G427 VanDerWaalsContact OD2-CA 3.26Å; D424-G427 WeakPolarHBondContact OD2-CA 3.49Å; D424-G427 PolarHBondContact OD2-N 3.37Å; D424-A428 PolarHBondContact OD1-N 3.18Å; D424-A428 PolarHBondContact OD2-N 3.5Å; D424-V429 HydrophobicContact CB-CB 4.3Å; D424-V429 HydrophobicContact CB-CG2 3.81Å; D424-V429 WeakPolarHBondContact OD2-CB 3.48Å; D424-V429 PolarHBondContact OD2-N 2.73Å
425	R	77	Confident	81.5	Confident	251 Å²	251	84.6 Å²	84.6	95%	0.947	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-2.8	170.3	-63	-179.2	-179.6	166.2	0.4	114.2	V423	V423-R425 PolarHBondContact O-N 3.01Å; V423-R425 VanDerWaalsContact O-N 3.15Å
426	T	79.3	Confident	81.4	Confident	106 Å²	106	83.1 Å²	83.1	65%	0.65	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-0.6	-175.8	28.6	0	0	0	0	114.4	D424 A428 R431	D424-T426 PolarHBondContact O-N 3.48Å; D424-T426 WeakPolarHBondContact OD1-CA 3.36Å; D424-T426 WeakPolarHBondContact OD1-CB 3.31Å; D424-T426 PolarHBondContact OD1-N 2.98Å; D424-T426 PolarHBondContact OD1-OG1 3.06Å; T426-A428 PolarHBondContact O-N 3.46Å; T426-A428 VanDerWaalsContact O-N 3.12Å; T426-R431 PolarHBondContact O-NH2 2.91Å
427	G	82.3	Confident	81.3	Confident	31 Å²	31	83.1 Å²	83.1	32%	0.32	42%	0.418	S	S	.	.	S	Bend	trans	55.3	29.7	-177.8	0	0	0	0	0	113	D424 R431	D424-G427 PolarHBondContact OD1-N 3.07Å; D424-G427 VanDerWaalsContact OD1-N 3.12Å; D424-G427 VanDerWaalsContact OD2-C 3.24Å; D424-G427 VanDerWaalsContact OD2-CA 3.26Å; D424-G427 WeakPolarHBondContact OD2-CA 3.49Å; D424-G427 PolarHBondContact OD2-N 3.37Å; G427-R431 WeakPolarHBondContact O-CB 3.2Å; G427-R431 VanDerWaalsContact O-CG 3.31Å; G427-R431 WeakPolarHBondContact O-CG 3.4Å; G427-R431 PolarHBondContact O-N 3.41Å; G427-R431 PolarHBondContact O-NE 3.1Å
428	A	81.8	Confident	81.3	Confident	35 Å²	35	85.1 Å²	85.1	29%	0.289	41%	0.409	S	S	.	.	H	α-helix	trans	-75.6	-40.2	176	0	0	0	0	0	111.2	D424 T426 R431 K432	D424-A428 PolarHBondContact OD1-N 3.18Å; D424-A428 PolarHBondContact OD2-N 3.5Å; T426-A428 PolarHBondContact O-N 3.46Å; T426-A428 VanDerWaalsContact O-N 3.12Å; A428-R431 PolarHBondContact O-N 3.27Å; A428-K432 WeakPolarHBondContact O-CG 3.5Å; A428-K432 PolarHBondContact O-N 3.05Å
429	V	82.5	Confident	81.1	Confident	13 Å²	13	86.8 Å²	86.8	8%	0.079	41%	0.412	C	S	.	.	H	α-helix	trans	-59.8	-50	173.9	172.1	0	0	0	0	110	Y415 E419 T421 D424 R431 K432 R433	Y415-V429 HydrophobicContact CD1-CG1 3.74Å; Y415-V429 HydrophobicContact CE1-CG1 3.71Å; E419-V429 HydrophobicContact CB-CG1 3.94Å; E419-V429 HydrophobicContact CB-CG2 4.08Å; E419-V429 HydrophobicContact CG-CG2 4.24Å; T421-V429 HydrophobicContact CG2-CB 4.3Å; T421-V429 HydrophobicContact CG2-CG1 3.76Å; D424-V429 HydrophobicContact CB-CB 4.3Å; D424-V429 HydrophobicContact CB-CG2 3.81Å; D424-V429 WeakPolarHBondContact OD2-CB 3.48Å; D424-V429 PolarHBondContact OD2-N 2.73Å; V429-R431 VanDerWaalsContact C-N 3.34Å; V429-R431 PolarHBondContact O-N 3.36Å; V429-K432 WeakPolarHBondContact O-CB 3.28Å; V429-K432 PolarHBondContact O-N 2.91Å; V429-K432 VanDerWaalsContact O-N 3.11Å; V429-R433 WeakPolarHBondContact O-CB 3.32Å; V429-R433 PolarHBondContact O-N 3.4Å
430	E	82.3	Confident	81	Confident	59 Å²	59	87.9 Å²	87.9	28%	0.276	42%	0.419	S	S	.	.	H	α-helix	trans	-64.5	-38	179.7	-165.7	56.3	-140.9	0	0	111.9	Y415 K432 R433 L434	Y415-E430 PolarHBondContact OH-OE2 2.89Å; E430-K432 PolarHBondContact O-N 3.07Å; E430-R433 WeakPolarHBondContact O-CB 3.34Å; E430-R433 PolarHBondContact O-N 3.01Å; E430-R433 WeakPolarHBondContact OE1-CD 3.37Å; E430-R433 IonicContact OE1-CZ 3.43Å; E430-R433 IonicContact OE1-NE 3.92Å; E430-R433 IonicContact OE1-NH1 3.03Å; E430-R433 PolarHBondContact OE1-NH1 2.7Å; E430-R433 WeakPolarHBondContact OE2-CD 3.15Å; E430-R433 IonicContact OE2-NH1 2.91Å; E430-L434 HydrophobicContact CG-CD1 4.32Å; E430-L434 WeakPolarHBondContact O-CB 3.43Å; E430-L434 VanDerWaalsContact O-CG 3.24Å; E430-L434 WeakPolarHBondContact O-CG 3.19Å; E430-L434 PolarHBondContact O-N 3.03Å
431	R	82.5	Confident	80.5	Confident	146 Å²	146	86.7 Å²	86.7	55%	0.551	43%	0.426	S	S	*	.	H	α-helix	trans	-63.7	-38.1	172.6	-79	177.9	-72.5	146.5	-7.1	112.9	T426 G427 A428 V429 N435	T426-R431 PolarHBondContact O-NH2 2.91Å; G427-R431 WeakPolarHBondContact O-CB 3.2Å; G427-R431 VanDerWaalsContact O-CG 3.31Å; G427-R431 WeakPolarHBondContact O-CG 3.4Å; G427-R431 PolarHBondContact O-N 3.41Å; G427-R431 PolarHBondContact O-NE 3.1Å; A428-R431 PolarHBondContact O-N 3.27Å; V429-R431 VanDerWaalsContact C-N 3.34Å; V429-R431 PolarHBondContact O-N 3.36Å; R431-N435 WeakPolarHBondContact O-CB 3.45Å; R431-N435 PolarHBondContact O-N 3.39Å; R431-N435 VanDerWaalsContact O-N 3.08Å; R431-N435 PolarHBondContact O-ND2 2.79Å
432	K	84.7	Confident	80.2	Confident	103 Å²	103	84.1 Å²	84.1	45%	0.448	41%	0.41	S	S	.	.	H	α-helix	trans	-67	-44.3	173.4	-72.6	179.6	178.4	180	0	111.3	E419 A428 V429 E430 N435 R436	E419-K432 WeakPolarHBondContact OE1-CD 3.42Å; E419-K432 WeakPolarHBondContact OE1-CE 3.41Å; E419-K432 IonicContact OE1-NZ 3.02Å; E419-K432 PolarHBondContact OE1-NZ 3.23Å; A428-K432 WeakPolarHBondContact O-CG 3.5Å; A428-K432 PolarHBondContact O-N 3.05Å; V429-K432 WeakPolarHBondContact O-CB 3.28Å; V429-K432 PolarHBondContact O-N 2.91Å; V429-K432 VanDerWaalsContact O-N 3.11Å; E430-K432 PolarHBondContact O-N 3.07Å; K432-N435 WeakPolarHBondContact O-CB 3.43Å; K432-N435 PolarHBondContact O-N 2.83Å; K432-R436 WeakPolarHBondContact O-CG 3.45Å; K432-R436 PolarHBondContact O-N 2.97Å
433	R	85.2	Confident	79.6	Confident	48 Å²	48	80.4 Å²	80.4	18%	0.181	40%	0.398	C	S	.	.	H	α-helix	trans	-55.2	-52.7	175.2	-179	-179.3	176.7	-97.4	-7.3	111.5	D413 Y415 V429 E430 N435 R436 M437	D413-R433 PolarHBondContact O-NE 2.97Å; D413-R433 PolarHBondContact O-NH2 3.22Å; Y415-R433 VanDerWaalsContact CZ-CD 3.45Å; V429-R433 WeakPolarHBondContact O-CB 3.32Å; V429-R433 PolarHBondContact O-N 3.4Å; E430-R433 WeakPolarHBondContact O-CB 3.34Å; E430-R433 PolarHBondContact O-N 3.01Å; E430-R433 WeakPolarHBondContact OE1-CD 3.37Å; E430-R433 IonicContact OE1-CZ 3.43Å; E430-R433 IonicContact OE1-NE 3.92Å; E430-R433 IonicContact OE1-NH1 3.03Å; E430-R433 PolarHBondContact OE1-NH1 2.7Å; E430-R433 WeakPolarHBondContact OE2-CD 3.15Å; E430-R433 IonicContact OE2-NH1 2.91Å; R433-N435 VanDerWaalsContact C-N 3.32Å; R433-N435 PolarHBondContact O-N 3.29Å; R433-R436 WeakPolarHBondContact O-CB 3.43Å; R433-R436 PolarHBondContact O-N 3.22Å; R433-M437 HydrophobicContact CG-SD 4.38Å; R433-M437 WeakPolarHBondContact O-CG 3.44Å; R433-M437 PolarHBondContact O-N 3.44Å
434	L	83.4	Confident	78.6	Confident	59 Å²	59	79.2 Å²	79.2	31%	0.309	39%	0.388	S	S	.	.	H	α-helix	trans	-58.4	-40.4	175.4	-70.4	169.6	0	0	0	112.6	E430 M437 R438 I447	E430-L434 HydrophobicContact CG-CD1 4.32Å; E430-L434 WeakPolarHBondContact O-CB 3.43Å; E430-L434 VanDerWaalsContact O-CG 3.24Å; E430-L434 WeakPolarHBondContact O-CG 3.19Å; E430-L434 PolarHBondContact O-N 3.03Å; L434-M437 PolarHBondContact O-N 3.12Å; L434-R438 WeakPolarHBondContact O-CB 3.45Å; L434-R438 PolarHBondContact O-N 2.85Å; L434-I447 HydrophobicContact CD2-CD1 4.42Å; L434-I447 HydrophobicContact CD2-CG2 3.36Å
435	N	80.3	Confident	77.5	Confident	85 Å²	85	84.4 Å²	84.4	46%	0.455	42%	0.416	S	S	.	.	H	α-helix	trans	-65.1	-37.8	174	-79.9	-27.5	0	0	0	112.6	R431 K432 R433 R438 Q439	R431-N435 WeakPolarHBondContact O-CB 3.45Å; R431-N435 PolarHBondContact O-N 3.39Å; R431-N435 VanDerWaalsContact O-N 3.08Å; R431-N435 PolarHBondContact O-ND2 2.79Å; K432-N435 WeakPolarHBondContact O-CB 3.43Å; K432-N435 PolarHBondContact O-N 2.83Å; R433-N435 VanDerWaalsContact C-N 3.32Å; R433-N435 PolarHBondContact O-N 3.29Å; N435-R438 PolarHBondContact O-N 3.34Å; N435-Q439 WeakPolarHBondContact O-CB 3.26Å; N435-Q439 VanDerWaalsContact O-CG 3.26Å; N435-Q439 WeakPolarHBondContact O-CG 3.3Å; N435-Q439 PolarHBondContact O-N 3.04Å
436	R	83.9	Confident	76.5	Confident	32 Å²	32	79.6 Å²	79.6	12%	0.121	40%	0.404	C	S	.	.	H	α-helix	trans	-66.6	-42.9	174.2	-70.6	-176.3	-68.1	-110.9	-0.8	111.7	Y414 E419 K432 R433 R438 Q439 L440	Y414-R436 HydrophobicContact CD1-CB 4.31Å; Y414-R436 PolarHBondContact O-NE 3.12Å; Y414-R436 PolarHBondContact O-NH2 3.24Å; E419-R436 IonicContact OE1-NH1 3.81Å; E419-R436 PolarHBondContact OE1-NH1 2.89Å; E419-R436 IonicContact OE2-CZ 3.41Å; E419-R436 IonicContact OE2-NH1 3.44Å; E419-R436 PolarHBondContact OE2-NH1 3.27Å; E419-R436 IonicContact OE2-NH2 3.64Å; E419-R436 PolarHBondContact OE2-NH2 2.82Å; K432-R436 WeakPolarHBondContact O-CG 3.45Å; K432-R436 PolarHBondContact O-N 2.97Å; R433-R436 WeakPolarHBondContact O-CB 3.43Å; R433-R436 PolarHBondContact O-N 3.22Å; R436-R438 VanDerWaalsContact C-N 3.35Å; R436-R438 PolarHBondContact O-N 2.86Å; R436-Q439 PolarHBondContact O-N 3.16Å; R436-L440 WeakPolarHBondContact O-CB 3.44Å; R436-L440 PolarHBondContact O-N 2.93Å
437	M	80.8	Confident	75.3	Confident	18 Å²	18	76.7 Å²	76.7	9%	0.089	38%	0.384	C	S	.	.	H	α-helix	trans	-58.1	-45.4	173.4	-68	176.9	80.2	0	0	111.7	Y414 R433 L434 L440 G441 V442 I447	Y414-M437 HydrophobicContact CD1-CB 4.31Å; Y414-M437 HydrophobicContact CD1-CG 3.61Å; Y414-M437 HydrophobicContact CD2-CE 4.45Å; Y414-M437 HydrophobicContact CD2-CG 3.59Å; Y414-M437 HydrophobicContact CD2-SD 4.28Å; Y414-M437 HydrophobicContact CE1-CB 4.47Å; Y414-M437 HydrophobicContact CE1-CG 4.03Å; Y414-M437 HydrophobicContact CE2-CG 4.05Å; Y414-M437 HydrophobicContact CG-CG 3.38Å; Y414-M437 HydrophobicContact CG-SD 4.46Å; R433-M437 HydrophobicContact CG-SD 4.38Å; R433-M437 WeakPolarHBondContact O-CG 3.44Å; R433-M437 PolarHBondContact O-N 3.44Å; L434-M437 PolarHBondContact O-N 3.12Å; M437-L440 CarbonylContact O-C 3.58Å; M437-L440 PolarHBondContact O-N 2.87Å; M437-G441 PolarHBondContact O-N 2.88Å; M437-G441 VanDerWaalsContact O-N 3.13Å; M437-V442 HydrophobicContact CB-CB 4.15Å; M437-V442 HydrophobicContact CB-CG2 4.14Å; M437-V442 HydrophobicContact CE-CB 4.48Å; M437-V442 HydrophobicContact CE-CG1 3.97Å; M437-V442 PolarHBondContact O-N 3.03Å; M437-I447 HydrophobicContact CB-CD1 4.25Å; M437-I447 HydrophobicContact CE-CD1 4.04Å; M437-I447 HydrophobicContact CE-CG1 3.76Å; M437-I447 HydrophobicContact SD-CD1 4.42Å
438	R	80.2	Confident	73.8	Confident	151 Å²	151	79.6 Å²	79.6	57%	0.57	39%	0.388	S	S	*	.	H	α-helix	trans	-65.9	-40.7	176.7	-177.1	172.1	-73.5	163.2	-2.2	113	L434 N435 R436 L440 G441 D444	L434-R438 WeakPolarHBondContact O-CB 3.45Å; L434-R438 PolarHBondContact O-N 2.85Å; N435-R438 PolarHBondContact O-N 3.34Å; R436-R438 VanDerWaalsContact C-N 3.35Å; R436-R438 PolarHBondContact O-N 2.86Å; R438-L440 VanDerWaalsContact C-N 3.28Å; R438-L440 PolarHBondContact O-N 3.15Å; R438-G441 PolarHBondContact O-N 2.99Å; R438-D444 IonicContact CZ-OD1 3.86Å; R438-D444 IonicContact NE-OD1 2.78Å; R438-D444 IonicContact NH2-OD1 3.92Å; R438-D444 PolarHBondContact NH2-OD1 3.16Å
439	Q	77.7	Confident	71.8	Confident	163 Å²	163	82.4 Å²	82.4	76%	0.762	40%	0.402	S	S	*	.	H	α-helix	trans	-64.7	-31.6	175.5	-75.7	174.4	21.4	0	0	112.8	N435 R436 G441	N435-Q439 WeakPolarHBondContact O-CB 3.26Å; N435-Q439 VanDerWaalsContact O-CG 3.26Å; N435-Q439 WeakPolarHBondContact O-CG 3.3Å; N435-Q439 PolarHBondContact O-N 3.04Å; R436-Q439 PolarHBondContact O-N 3.16Å; Q439-G441 VanDerWaalsContact C-N 3.34Å
440	L	77.4	Confident	70.2	Confident	47 Å²	47	87.7 Å²	87.7	25%	0.246	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	6.5	177	-69.3	165.8	0	0	0	113.3	R406 W409 Y414 R436 M437 R438	R406-L440 HydrophobicContact CB-CD2 4.47Å; R406-L440 HydrophobicContact CG-CD2 4.41Å; R406-L440 PolarHBondContact NH1-O 3.34Å; W409-L440 HydrophobicContact CB-CD1 3.64Å; W409-L440 HydrophobicContact CG-CD1 3.79Å; Y414-L440 HydrophobicContact CD1-CD1 3.92Å; Y414-L440 HydrophobicContact CE1-CB 4.04Å; Y414-L440 HydrophobicContact CE1-CD1 3.56Å; Y414-L440 HydrophobicContact CE1-CG 4.42Å; R436-L440 WeakPolarHBondContact O-CB 3.44Å; R436-L440 PolarHBondContact O-N 2.93Å; M437-L440 CarbonylContact O-C 3.58Å; M437-L440 PolarHBondContact O-N 2.87Å; R438-L440 VanDerWaalsContact C-N 3.28Å; R438-L440 PolarHBondContact O-N 3.15Å
441	G	71.8	Confident	68.5	Low	56 Å²	56	88.9 Å²	88.9	58%	0.577	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	26.1	171.1	0	0	0	0	0	115.2	M437 R438 Q439	M437-G441 PolarHBondContact O-N 2.88Å; M437-G441 VanDerWaalsContact O-N 3.13Å; R438-G441 PolarHBondContact O-N 2.99Å; Q439-G441 VanDerWaalsContact C-N 3.34Å
442	V	74.7	Confident	67.1	Low	20 Å²	20	87.3 Å²	87.3	12%	0.121	45%	0.448	C	S	.	.			trans	-66.2	139.6	163	-173.4	0	0	0	0	108.4	Y414 M437 I447	Y414-V442 HydrophobicContact CE1-CG2 4.16Å; Y414-V442 HydrophobicContact CE2-CG2 4.32Å; Y414-V442 WeakPolarHBondContact OH-CG2 3.31Å; M437-V442 HydrophobicContact CB-CB 4.15Å; M437-V442 HydrophobicContact CB-CG2 4.14Å; M437-V442 HydrophobicContact CE-CB 4.48Å; M437-V442 HydrophobicContact CE-CG1 3.97Å; M437-V442 PolarHBondContact O-N 3.03Å; V442-I447 HydrophobicContact CG1-CD1 4.41Å; V442-I447 HydrophobicContact CG1-CG1 4.37Å
443	K	63.8	Low	65.5	Low	130 Å²	130	86 Å²	86	57%	0.565	45%	0.445	S	S	*	.			trans	-77.6	141.7	-179.1	-64.3	174.9	-175.6	168.1	0	110.7	D445 E446	K443-D445 HydrophobicContact CB-CB 4.4Å; K443-D445 PolarHBondContact O-N 2.85Å; K443-E446 PolarHBondContact O-N 3.33Å; K443-E446 VanDerWaalsContact O-N 3.16Å
444	D	59.7	Low	63.7	Low	81 Å²	81	89.4 Å²	89.4	43%	0.433	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-16.6	174.9	-58.1	-89.7	0	0	0	113.2	R438	R438-D444 IonicContact CZ-OD1 3.86Å; R438-D444 IonicContact NE-OD1 2.78Å; R438-D444 IonicContact NH2-OD1 3.92Å; R438-D444 PolarHBondContact NH2-OD1 3.16Å
445	D	56.8	Low	62.3	Low	139 Å²	139	92.4 Å²	92.4	74%	0.743	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-32.4	175.8	-56	-45.5	0	0	0	114	K443	K443-D445 HydrophobicContact CB-CB 4.4Å; K443-D445 PolarHBondContact O-N 2.85Å
446	E	55	Low	61.1	Low	149 Å²	149	92.5 Å²	92.5	70%	0.696	48%	0.483	S	S	*	.	S	Bend	trans	-89.5	-7.2	-175.8	-70	169.7	171.9	0	0	112.4	K443	K443-E446 PolarHBondContact O-N 3.33Å; K443-E446 VanDerWaalsContact O-N 3.16Å
447	I	55.5	Low	59.5	Low	45 Å²	45	96 Å²	96	23%	0.231	50%	0.501	C	S	.	.	S	Bend	trans	-90.9	-14.8	-169.2	-70.4	-178.9	0	0	0	112.8	L434 M437 V442	L434-I447 HydrophobicContact CD2-CD1 4.42Å; L434-I447 HydrophobicContact CD2-CG2 3.36Å; M437-I447 HydrophobicContact CB-CD1 4.25Å; M437-I447 HydrophobicContact CE-CD1 4.04Å; M437-I447 HydrophobicContact CE-CG1 3.76Å; M437-I447 HydrophobicContact SD-CD1 4.42Å; V442-I447 HydrophobicContact CG1-CD1 4.41Å; V442-I447 HydrophobicContact CG1-CG1 4.37Å
448	K	49	Very low	58.3	Low	93 Å²	93	100 Å²	100	40%	0.404	52%	0.523	S	S	.	.	S	Bend	trans	-122	109.1	-166.3	-60.6	-173.8	177.3	-172.5	0	112.6	L453	K448-L453 HydrophobicContact CB-CD1 4.26Å; K448-L453 HydrophobicContact CB-CD2 3.67Å; K448-L453 HydrophobicContact CB-CG 3.88Å; K448-L453 HydrophobicContact CD-CD2 3.54Å; K448-L453 HydrophobicContact CG-CD2 4.24Å
449	T	40.1	Very low	57.5	Low	94 Å²	94	95.5 Å²	95.5	58%	0.577	52%	0.518	S	S	*	.			trans	-56.7	136	175.3	-54.2	0	0	0	0	111.2	S451 E452	T449-S451 PolarHBondContact O-N 3.26Å; T449-E452 PolarHBondContact O-N 3.03Å; T449-E452 VanDerWaalsContact O-N 3.07Å
450	T	49.4	Very low	56.8	Low	123 Å²	123	93 Å²	93	76%	0.755	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-14	-165.1	50.3	0	0	0	0	115.8
451	S	47.1	Very low	56.2	Low	85 Å²	85	93.9 Å²	93.9	59%	0.594	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-36.3	173.7	48.8	0	0	0	0	113.7	T449 L453	T449-S451 PolarHBondContact O-N 3.26Å; S451-L453 VanDerWaalsContact C-N 3.34Å
452	E	53.2	Low	55.9	Low	112 Å²	112	97.8 Å²	97.8	52%	0.523	51%	0.513	S	S	.	.	H	α-helix	trans	-77	-22.7	-176.2	-69.3	-168.6	162.3	0	0	113.1	T449 L454 D455 N456	T449-E452 PolarHBondContact O-N 3.03Å; T449-E452 VanDerWaalsContact O-N 3.07Å; E452-L454 VanDerWaalsContact C-N 3.26Å; E452-L454 PolarHBondContact O-N 3.43Å; E452-L454 VanDerWaalsContact O-N 3.17Å; E452-D455 PolarHBondContact O-N 3.25Å; E452-N456 VanDerWaalsContact O-CB 3.27Å; E452-N456 WeakPolarHBondContact O-CB 3.49Å; E452-N456 PolarHBondContact O-N 2.7Å
453	L	49.7	Very low	55.7	Low	76 Å²	76	101.5 Å²	101.5	40%	0.398	53%	0.532	S	S	.	.	H	α-helix	trans	-59.3	-28.2	-172.4	-85.9	170.7	0	0	0	114.9	K448 S451 H457	K448-L453 HydrophobicContact CB-CD1 4.26Å; K448-L453 HydrophobicContact CB-CD2 3.67Å; K448-L453 HydrophobicContact CB-CG 3.88Å; K448-L453 HydrophobicContact CD-CD2 3.54Å; K448-L453 HydrophobicContact CG-CD2 4.24Å; S451-L453 VanDerWaalsContact C-N 3.34Å; L453-H457 VanDerWaalsContact O-CB 3.3Å; L453-H457 WeakPolarHBondContact O-CB 3.45Å
454	L	49	Very low	55.9	Low	120 Å²	120	98.6 Å²	98.6	63%	0.628	52%	0.52	S	S	*	.	H	α-helix	trans	-85.6	-40.7	-178.6	-76.4	83.9	0	0	0	112.6	E452 N458	E452-L454 VanDerWaalsContact C-N 3.26Å; E452-L454 PolarHBondContact O-N 3.43Å; E452-L454 VanDerWaalsContact O-N 3.17Å; L454-N458 PolarHBondContact O-ND2 2.96Å
455	D	52.8	Low	56.6	Low	122 Å²	122	98.8 Å²	98.8	65%	0.652	52%	0.517	S	S	*	.	H	α-helix	trans	-78.1	-41.9	-178.9	-67.4	-28.8	0	0	0	111.1	E452 H457 N458 A459	E452-D455 PolarHBondContact O-N 3.25Å; D455-H457 VanDerWaalsContact C-N 3.29Å; D455-H457 PolarHBondContact O-N 2.88Å; D455-N458 PolarHBondContact O-N 3.2Å; D455-A459 PolarHBondContact O-N 2.73Å; D455-A459 VanDerWaalsContact O-N 3.16Å
456	N	55.1	Low	57.4	Low	87 Å²	87	94.9 Å²	94.9	47%	0.465	50%	0.504	S	S	.	.	H	α-helix	trans	-63.2	-32.9	175	-77.2	-20.4	0	0	0	112.2	E452 N458 A459 E460	E452-N456 VanDerWaalsContact O-CB 3.27Å; E452-N456 WeakPolarHBondContact O-CB 3.49Å; E452-N456 PolarHBondContact O-N 2.7Å; N456-N458 PolarHBondContact O-N 2.89Å; N456-A459 PolarHBondContact O-N 2.92Å; N456-E460 WeakPolarHBondContact O-CB 3.45Å; N456-E460 PolarHBondContact O-N 3.31Å
457	H	51.3	Low	58.5	Low	106 Å²	106	92.4 Å²	92.4	49%	0.491	49%	0.491	S	S	.	.	H	α-helix	trans	-64.5	-40.1	178.3	-171.3	55.3	0	0	0	112.4	L453 D455 I461	L453-H457 VanDerWaalsContact O-CB 3.3Å; L453-H457 WeakPolarHBondContact O-CB 3.45Å; D455-H457 VanDerWaalsContact C-N 3.29Å; D455-H457 PolarHBondContact O-N 2.88Å; H457-I461 WeakPolarHBondContact O-CB 3.24Å; H457-I461 WeakPolarHBondContact O-CD1 3.44Å; H457-I461 VanDerWaalsContact O-CG1 3.25Å; H457-I461 WeakPolarHBondContact O-CG1 3.42Å; H457-I461 PolarHBondContact O-N 3.46Å
458	N	55.8	Low	59.4	Low	101 Å²	101	96.6 Å²	96.6	54%	0.54	50%	0.504	S	S	.	.	H	α-helix	trans	-68.7	-40.4	176.1	-70.8	-61.3	0	0	0	112	L454 D455 N456 H462	L454-N458 PolarHBondContact O-ND2 2.96Å; D455-N458 PolarHBondContact O-N 3.2Å; N456-N458 PolarHBondContact O-N 2.89Å; N458-H462 PolarHBondContact O-N 3.42Å
459	A	62.6	Low	60.8	Low	57 Å²	57	96.7 Å²	96.7	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-66.6	-41.2	175.3	0	0	0	0	0	112.4	D455 N456 H462 L463	D455-A459 PolarHBondContact O-N 2.73Å; D455-A459 VanDerWaalsContact O-N 3.16Å; N456-A459 PolarHBondContact O-N 2.92Å; A459-H462 PolarHBondContact O-N 3.17Å; A459-L463 WeakPolarHBondContact O-CB 3.43Å; A459-L463 PolarHBondContact O-N 3.08Å
460	E	62.9	Low	62.6	Low	109 Å²	109	95.7 Å²	95.7	51%	0.509	51%	0.509	S	S	.	.	H	α-helix	trans	-64	-43.2	176.6	-173.2	165.4	-139.3	0	0	110.8	N456 H462 L463 E464	N456-E460 WeakPolarHBondContact O-CB 3.45Å; N456-E460 PolarHBondContact O-N 3.31Å; E460-H462 PolarHBondContact O-N 2.73Å; E460-L463 PolarHBondContact O-N 3.43Å; E460-E464 WeakPolarHBondContact O-CB 3.45Å; E460-E464 PolarHBondContact O-N 3.46Å
461	I	64.7	Low	64	Low	66 Å²	66	95.3 Å²	95.3	34%	0.338	50%	0.499	S	S	.	.	H	α-helix	trans	-60.5	-43.7	171.3	-72.7	166.3	0	0	0	111.6	H457 E464 K465	H457-I461 WeakPolarHBondContact O-CB 3.24Å; H457-I461 WeakPolarHBondContact O-CD1 3.44Å; H457-I461 VanDerWaalsContact O-CG1 3.25Å; H457-I461 WeakPolarHBondContact O-CG1 3.42Å; H457-I461 PolarHBondContact O-N 3.46Å; I461-E464 PolarHBondContact O-N 2.96Å; I461-K465 HydrophobicContact CG2-CD 4.31Å; I461-K465 WeakPolarHBondContact O-CB 3.34Å; I461-K465 WeakPolarHBondContact O-CG 3.39Å; I461-K465 PolarHBondContact O-N 3.34Å
462	H	65.6	Low	65.6	Low	138 Å²	138	93.3 Å²	93.3	64%	0.639	48%	0.481	S	S	*	.	H	α-helix	trans	-67	-41.9	179.3	-110.9	-84.3	0	0	0	112.6	N458 A459 E460 K465 A466	N458-H462 PolarHBondContact O-N 3.42Å; A459-H462 PolarHBondContact O-N 3.17Å; E460-H462 PolarHBondContact O-N 2.73Å; H462-K465 PolarHBondContact O-N 3.31Å; H462-A466 WeakPolarHBondContact O-CB 3.37Å; H462-A466 PolarHBondContact O-N 3.36Å
463	L	71	Confident	67	Low	99 Å²	99	90.4 Å²	90.4	52%	0.518	48%	0.477	S	S	.	.	H	α-helix	trans	-65.9	-38.8	175.7	-179.9	61.3	0	0	0	111.4	A459 E460 A466 K467	A459-L463 WeakPolarHBondContact O-CB 3.43Å; A459-L463 PolarHBondContact O-N 3.08Å; E460-L463 PolarHBondContact O-N 3.43Å; L463-A466 PolarHBondContact O-N 3.08Å; L463-K467 VanDerWaalsContact O-CG 3.29Å; L463-K467 WeakPolarHBondContact O-CG 3.37Å; L463-K467 PolarHBondContact O-N 3.32Å
464	E	68	Low	68.7	Low	69 Å²	69	90.3 Å²	90.3	32%	0.322	48%	0.48	S	S	.	.	H	α-helix	trans	-68.2	-41.7	176.1	-175.4	62.1	-167.7	0	0	112	E460 I461 A466 K467 R468	E460-E464 WeakPolarHBondContact O-CB 3.45Å; E460-E464 PolarHBondContact O-N 3.46Å; I461-E464 PolarHBondContact O-N 2.96Å; E464-A466 PolarHBondContact O-N 2.89Å; E464-K467 PolarHBondContact O-N 3.47Å; E464-K467 IonicContact OE2-NZ 3.55Å; E464-R468 VanDerWaalsContact O-CG 3.31Å; E464-R468 WeakPolarHBondContact O-CG 3.46Å; E464-R468 PolarHBondContact O-N 3.23Å; E464-R468 IonicContact OE1-CZ 2.75Å; E464-R468 IonicContact OE1-NE 3.06Å; E464-R468 PolarHBondContact OE1-NE 2.94Å; E464-R468 IonicContact OE1-NH2 3.7Å; E464-R468 PolarHBondContact OE1-NH2 3.38Å
465	K	73.5	Confident	70.5	Confident	85 Å²	85	87.4 Å²	87.4	37%	0.37	46%	0.464	S	S	.	.	H	α-helix	trans	-58.9	-45	169.3	-76.2	-177.1	177.9	-172.2	0	111.1	I461 H462 R468 V469 N604	I461-K465 HydrophobicContact CG2-CD 4.31Å; I461-K465 WeakPolarHBondContact O-CB 3.34Å; I461-K465 WeakPolarHBondContact O-CG 3.39Å; I461-K465 PolarHBondContact O-N 3.34Å; H462-K465 PolarHBondContact O-N 3.31Å; K465-R468 PolarHBondContact O-N 3.2Å; K465-V469 WeakPolarHBondContact O-CG2 3.26Å; K465-V469 PolarHBondContact O-N 3.38Å; K465-N604 PolarHBondContact NZ-OD1 3.38Å
466	A	74.2	Confident	72.1	Confident	57 Å²	57	85.6 Å²	85.6	47%	0.471	45%	0.453	S	S	.	.	H	α-helix	trans	-64.2	-42.4	178.2	0	0	0	0	0	113.1	H462 L463 E464 V469 S470	H462-A466 WeakPolarHBondContact O-CB 3.37Å; H462-A466 PolarHBondContact O-N 3.36Å; L463-A466 PolarHBondContact O-N 3.08Å; E464-A466 PolarHBondContact O-N 2.89Å; A466-V469 PolarHBondContact O-N 2.77Å; A466-S470 PolarHBondContact O-N 2.89Å
467	K	78.2	Confident	73.7	Confident	97 Å²	97	85.1 Å²	85.1	42%	0.422	45%	0.453	S	S	.	.	H	α-helix	trans	-58	-47.2	172.3	-74.5	166.8	-175.4	163.3	0	111.3	L463 E464 S470 Q471	L463-K467 VanDerWaalsContact O-CG 3.29Å; L463-K467 WeakPolarHBondContact O-CG 3.37Å; L463-K467 PolarHBondContact O-N 3.32Å; E464-K467 PolarHBondContact O-N 3.47Å; E464-K467 IonicContact OE2-NZ 3.55Å; K467-S470 PolarHBondContact O-N 3.49Å; K467-Q471 WeakPolarHBondContact O-CB 3.4Å; K467-Q471 VanDerWaalsContact O-CG 3.3Å; K467-Q471 WeakPolarHBondContact O-CG 3.46Å; K467-Q471 PolarHBondContact O-N 2.82Å
468	R	74.7	Confident	75.4	Confident	133 Å²	133	81 Å²	81	50%	0.502	43%	0.434	S	S	.	.	H	α-helix	trans	-63.7	-40.6	179	-71.1	174.5	-167.5	-166.8	4.8	112.6	E464 K465 S470 Q471 N472	E464-R468 VanDerWaalsContact O-CG 3.31Å; E464-R468 WeakPolarHBondContact O-CG 3.46Å; E464-R468 PolarHBondContact O-N 3.23Å; E464-R468 IonicContact OE1-CZ 2.75Å; E464-R468 IonicContact OE1-NE 3.06Å; E464-R468 PolarHBondContact OE1-NE 2.94Å; E464-R468 IonicContact OE1-NH2 3.7Å; E464-R468 PolarHBondContact OE1-NH2 3.38Å; K465-R468 PolarHBondContact O-N 3.2Å; R468-S470 VanDerWaalsContact C-N 3.35Å; R468-S470 PolarHBondContact O-N 3.49Å; R468-Q471 PolarHBondContact O-N 3.11Å; R468-N472 VanDerWaalsContact O-CB 3.31Å; R468-N472 WeakPolarHBondContact O-CB 3.33Å; R468-N472 VanDerWaalsContact O-CG 3.23Å; R468-N472 PolarHBondContact O-N 2.69Å; R468-N472 PolarHBondContact O-OD1 3.38Å
469	V	77.2	Confident	77	Confident	94 Å²	94	76.3 Å²	76.3	57%	0.57	41%	0.409	S	S	*	.	H	α-helix	trans	-61.5	-42.8	173.9	170.5	0	0	0	0	111.3	K465 A466 N472 A473	K465-V469 WeakPolarHBondContact O-CG2 3.26Å; K465-V469 PolarHBondContact O-N 3.38Å; A466-V469 PolarHBondContact O-N 2.77Å; V469-N472 PolarHBondContact O-N 3.41Å; V469-A473 WeakPolarHBondContact O-CB 3.18Å; V469-A473 PolarHBondContact O-N 3.27Å
470	S	77.8	Confident	78.2	Confident	74 Å²	74	75 Å²	75	52%	0.517	40%	0.397	S	S	.	.	H	α-helix	trans	-66.6	-42.4	176	-173.6	0	0	0	0	113	A466 K467 R468 A473 T474	A466-S470 PolarHBondContact O-N 2.89Å; K467-S470 PolarHBondContact O-N 3.49Å; R468-S470 VanDerWaalsContact C-N 3.35Å; R468-S470 PolarHBondContact O-N 3.49Å; S470-A473 PolarHBondContact O-N 2.69Å; S470-T474 PolarHBondContact O-N 3.18Å; S470-T474 PolarHBondContact O-OG1 2.96Å
471	Q	78.8	Confident	79.6	Confident	114 Å²	114	74.1 Å²	74.1	53%	0.533	39%	0.393	S	S	.	.	H	α-helix	trans	-62.8	-43.7	174.4	-74.4	170.7	-10.3	0	0	111.6	K467 R468 A473 T474 M475	K467-Q471 WeakPolarHBondContact O-CB 3.4Å; K467-Q471 VanDerWaalsContact O-CG 3.3Å; K467-Q471 WeakPolarHBondContact O-CG 3.46Å; K467-Q471 PolarHBondContact O-N 2.82Å; R468-Q471 PolarHBondContact O-N 3.11Å; Q471-A473 PolarHBondContact O-N 2.74Å; Q471-T474 PolarHBondContact O-N 2.74Å; Q471-T474 PolarHBondContact O-OG1 2.98Å; Q471-M475 WeakPolarHBondContact O-CB 3.47Å; Q471-M475 PolarHBondContact O-N 3.14Å
472	N	81.6	Confident	80.8	Confident	43 Å²	43	71.3 Å²	71.3	23%	0.23	38%	0.378	C	S	.	.	H	α-helix	trans	-64.4	-41.4	176.5	-73.2	7.3	0	0	0	111.2	R468 V469 M475 I476 L593	R468-N472 VanDerWaalsContact O-CB 3.31Å; R468-N472 WeakPolarHBondContact O-CB 3.33Å; R468-N472 VanDerWaalsContact O-CG 3.23Å; R468-N472 PolarHBondContact O-N 2.69Å; R468-N472 PolarHBondContact O-OD1 3.38Å; V469-N472 PolarHBondContact O-N 3.41Å; N472-M475 PolarHBondContact O-N 3.12Å; N472-I476 WeakPolarHBondContact O-CD1 3.38Å; N472-I476 WeakPolarHBondContact O-CG1 3.41Å; N472-I476 PolarHBondContact O-N 3.48Å; N472-L593 HydrophobicContact CB-CD2 4.34Å
473	A	82.5	Confident	81.9	Confident	52 Å²	52	68.5 Å²	68.5	43%	0.43	37%	0.366	S	S	.	.	H	α-helix	trans	-59.9	-46.5	174.8	0	0	0	0	0	112.3	V469 S470 Q471 M475 I476 T477	V469-A473 WeakPolarHBondContact O-CB 3.18Å; V469-A473 PolarHBondContact O-N 3.27Å; S470-A473 PolarHBondContact O-N 2.69Å; Q471-A473 PolarHBondContact O-N 2.74Å; A473-M475 VanDerWaalsContact C-N 3.35Å; A473-M475 PolarHBondContact O-N 2.88Å; A473-I476 PolarHBondContact O-N 3.44Å; A473-T477 PolarHBondContact O-N 3.21Å; A473-T477 VanDerWaalsContact O-N 3.12Å
474	T	85.8	Confident	83	Confident	74 Å²	74	70.3 Å²	70.3	45%	0.454	37%	0.369	S	S	.	.	H	α-helix	trans	-70.1	-27.8	177.2	55.4	0	0	0	0	113.4	S470 Q471 T477 M478	S470-T474 PolarHBondContact O-N 3.18Å; S470-T474 PolarHBondContact O-OG1 2.96Å; Q471-T474 PolarHBondContact O-N 2.74Å; Q471-T474 PolarHBondContact O-OG1 2.98Å; T474-T477 PolarHBondContact O-OG1 3.15Å; T474-M478 WeakPolarHBondContact O-CG 3.35Å; T474-M478 PolarHBondContact O-N 2.99Å
475	M	86.2	Confident	84.1	Confident	59 Å²	59	68.2 Å²	68.2	29%	0.291	36%	0.36	S	S	.	.	H	α-helix	trans	-71.3	-39	170.9	-167.8	174.5	-73.1	0	0	111.7	Q471 N472 A473 T477 M478 L479 L593	Q471-M475 WeakPolarHBondContact O-CB 3.47Å; Q471-M475 PolarHBondContact O-N 3.14Å; N472-M475 PolarHBondContact O-N 3.12Å; A473-M475 VanDerWaalsContact C-N 3.35Å; A473-M475 PolarHBondContact O-N 2.88Å; M475-T477 VanDerWaalsContact C-N 3.35Å; M475-T477 PolarHBondContact O-N 3.22Å; M475-M478 PolarHBondContact O-N 3.45Å; M475-L479 HydrophobicContact CG-CD1 4.17Å; M475-L479 HydrophobicContact CG-CG 4.39Å; M475-L479 WeakPolarHBondContact O-CB 3.47Å; M475-L479 VanDerWaalsContact O-CG 3.29Å; M475-L479 WeakPolarHBondContact O-CG 3.42Å; M475-L479 PolarHBondContact O-N 3.11Å; M475-L593 HydrophobicContact CB-CD1 4.26Å; M475-L593 HydrophobicContact CG-CD1 3.98Å; M475-L593 HydrophobicContact SD-CD1 3.98Å; M475-L593 HydrophobicContact SD-CD2 4.1Å; M475-L593 HydrophobicContact SD-CG 4.36Å
476	I	86.7	Confident	84.9	Confident	84 Å²	84	65.3 Å²	65.3	43%	0.431	35%	0.354	S	S	.	.	H	α-helix	trans	-62.1	-40.3	175.6	-70.3	163.2	0	0	0	111.2	N472 A473 S480 L593	N472-I476 WeakPolarHBondContact O-CD1 3.38Å; N472-I476 WeakPolarHBondContact O-CG1 3.41Å; N472-I476 PolarHBondContact O-N 3.48Å; A473-I476 PolarHBondContact O-N 3.44Å; I476-S480 WeakPolarHBondContact O-CB 3.47Å; I476-S480 PolarHBondContact O-N 2.97Å; I476-S480 VanDerWaalsContact O-N 3.09Å; I476-S480 PolarHBondContact O-OG 3.32Å; I476-L593 HydrophobicContact CG1-CD1 4.02Å
477	T	88.9	Confident	85.7	Confident	76 Å²	76	68.9 Å²	68.9	47%	0.466	36%	0.361	S	S	.	.	H	α-helix	trans	-65.9	-45.8	175.5	56.9	0	0	0	0	111.7	A473 T474 M475 L479 S480 E481	A473-T477 PolarHBondContact O-N 3.21Å; A473-T477 VanDerWaalsContact O-N 3.12Å; T474-T477 PolarHBondContact O-OG1 3.15Å; M475-T477 VanDerWaalsContact C-N 3.35Å; M475-T477 PolarHBondContact O-N 3.22Å; T477-L479 PolarHBondContact O-N 3.31Å; T477-S480 CarbonylContact O-C 3.53Å; T477-S480 WeakPolarHBondContact O-CA 3.39Å; T477-S480 WeakPolarHBondContact O-CB 3.41Å; T477-S480 PolarHBondContact O-N 2.99Å; T477-S480 VanDerWaalsContact O-N 3.08Å; T477-E481 PolarHBondContact O-N 2.96Å
478	M	87.4	Confident	86.3	Confident	20 Å²	20	67.2 Å²	67.2	10%	0.099	36%	0.355	C	S	.	.	H	α-helix	trans	-63.9	-37.2	177.4	-69.7	-171.9	-59.9	0	0	113.3	T474 M475 S480 E481 L482 L550 R553 A554	T474-M478 WeakPolarHBondContact O-CG 3.35Å; T474-M478 PolarHBondContact O-N 2.99Å; M475-M478 PolarHBondContact O-N 3.45Å; M478-S480 VanDerWaalsContact C-N 3.28Å; M478-S480 PolarHBondContact O-N 2.94Å; M478-E481 PolarHBondContact O-N 3.08Å; M478-L482 WeakPolarHBondContact O-CG 2.93Å; M478-L482 PolarHBondContact O-N 2.9Å; M478-L550 HydrophobicContact CG-CD2 4.37Å; M478-R553 HydrophobicContact CE-CG 4.38Å; M478-R553 HydrophobicContact SD-CB 4.03Å; M478-R553 WeakPolarHBondContact SD-CD 3.33Å; M478-R553 HydrophobicContact SD-CG 3.52Å; M478-R553 VanDerWaalsContact SD-CG 3.52Å; M478-R553 PolarHBondContact SD-NE 3.43Å; M478-R553 VanDerWaalsContact SD-NE 3.44Å; M478-A554 HydrophobicContact CE-CB 4.19Å
479	L	88.2	Confident	87.2	Confident	2 Å²	2	61 Å²	61	1%	0.01	33%	0.331	C	S	.	.	H	α-helix	trans	-64.7	-34.2	173	-70.8	170.6	0	0	0	111.7	M475 T477 E481 L482 E483 L556 V586 A589 L593	M475-L479 HydrophobicContact CG-CD1 4.17Å; M475-L479 HydrophobicContact CG-CG 4.39Å; M475-L479 WeakPolarHBondContact O-CB 3.47Å; M475-L479 VanDerWaalsContact O-CG 3.29Å; M475-L479 WeakPolarHBondContact O-CG 3.42Å; M475-L479 PolarHBondContact O-N 3.11Å; T477-L479 PolarHBondContact O-N 3.31Å; L479-E481 VanDerWaalsContact C-N 3.34Å; L479-L482 HydrophobicContact CD2-CD1 4.46Å; L479-E483 WeakPolarHBondContact O-CB 3.38Å; L479-E483 PolarHBondContact O-N 3.11Å; L479-L556 HydrophobicContact CD2-CD1 4.12Å; L479-V586 HydrophobicContact CD2-CB 4.48Å; L479-V586 HydrophobicContact CD2-CG1 4.08Å; L479-V586 HydrophobicContact CD2-CG2 4.49Å; L479-A589 HydrophobicContact CD1-CB 4.08Å; L479-A589 HydrophobicContact CD2-CB 3.79Å; L479-L593 HydrophobicContact CD1-CD1 3.59Å
480	S	89.2	Confident	87.8	Confident	30 Å²	30	60 Å²	60	21%	0.21	33%	0.325	C	S	.	.	H	α-helix	trans	-75.1	-21.2	176	-52.7	0	0	0	0	113.3	I476 T477 M478 K484	I476-S480 WeakPolarHBondContact O-CB 3.47Å; I476-S480 PolarHBondContact O-N 2.97Å; I476-S480 VanDerWaalsContact O-N 3.09Å; I476-S480 PolarHBondContact O-OG 3.32Å; T477-S480 CarbonylContact O-C 3.53Å; T477-S480 WeakPolarHBondContact O-CA 3.39Å; T477-S480 WeakPolarHBondContact O-CB 3.41Å; T477-S480 PolarHBondContact O-N 2.99Å; T477-S480 VanDerWaalsContact O-N 3.08Å; M478-S480 VanDerWaalsContact C-N 3.28Å; M478-S480 PolarHBondContact O-N 2.94Å; S480-K484 WeakPolarHBondContact O-CD 3.3Å; S480-K484 WeakPolarHBondContact O-CG 3.14Å
481	E	90.9	Very high	88.5	Confident	90 Å²	90	59.3 Å²	59.3	42%	0.421	32%	0.32	S	S	.	.	H	α-helix	trans	-80.3	-41.7	170.3	-71.6	168.5	-179	0	0	111.3	T477 M478 L479 E483 K484 I485 L550	T477-E481 PolarHBondContact O-N 2.96Å; M478-E481 PolarHBondContact O-N 3.08Å; L479-E481 VanDerWaalsContact C-N 3.34Å; E481-E483 VanDerWaalsContact C-N 3.3Å; E481-E483 PolarHBondContact O-N 3.01Å; E481-K484 PolarHBondContact O-N 3.13Å; E481-I485 WeakPolarHBondContact O-CG1 3.42Å; E481-I485 PolarHBondContact O-N 3.21Å; E481-L550 HydrophobicContact CB-CD1 3.83Å
482	L	90.2	Very high	89.1	Confident	8 Å²	8	53.9 Å²	53.9	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-59.6	-38.5	172	-78.8	170	0	0	0	112.6	M478 L479 I485 G486 E547 L550 F551 L556 V586	M478-L482 WeakPolarHBondContact O-CG 2.93Å; M478-L482 PolarHBondContact O-N 2.9Å; L479-L482 HydrophobicContact CD2-CD1 4.46Å; L482-I485 PolarHBondContact O-N 2.75Å; L482-G486 PolarHBondContact O-N 3.36Å; L482-E547 HydrophobicContact CD2-CG 4.41Å; L482-L550 HydrophobicContact CD1-CB 4.25Å; L482-L550 HydrophobicContact CD2-CB 3.55Å; L482-L550 HydrophobicContact CD2-CD1 4.19Å; L482-L550 HydrophobicContact CG-CB 3.77Å; L482-L550 HydrophobicContact CG-CD1 4.16Å; L482-F551 HydrophobicContact CD1-CD2 4.34Å; L482-F551 HydrophobicContact CD1-CE2 4.41Å; L482-F551 HydrophobicContact CD2-CD2 3.6Å; L482-F551 HydrophobicContact CD2-CE2 3.76Å; L482-L556 HydrophobicContact CD1-CD1 3.88Å; L482-V586 HydrophobicContact CB-CG2 3.94Å; L482-V586 HydrophobicContact CD1-CG2 4.12Å
483	E	89.8	Confident	89.5	Confident	79 Å²	79	54.8 Å²	54.8	37%	0.369	30%	0.298	S	S	.	.	H	α-helix	trans	-59.5	-50.4	175.4	-169.7	158.3	-119.1	0	0	111.3	L479 E481 G486 E487 R590	L479-E483 WeakPolarHBondContact O-CB 3.38Å; L479-E483 PolarHBondContact O-N 3.11Å; E481-E483 VanDerWaalsContact C-N 3.3Å; E481-E483 PolarHBondContact O-N 3.01Å; E483-G486 PolarHBondContact O-N 3.17Å; E483-E487 PolarHBondContact O-N 2.67Å; E483-R590 IonicContact OE1-NH1 2.66Å; E483-R590 PolarHBondContact OE1-NH1 2.81Å; E483-R590 IonicContact OE2-CZ 2.76Å; E483-R590 IonicContact OE2-NH1 2.71Å; E483-R590 PolarHBondContact OE2-NH1 3.36Å; E483-R590 IonicContact OE2-NH2 3.34Å
484	K	92.9	Very high	89.9	Confident	137 Å²	137	59 Å²	59	60%	0.596	31%	0.309	S	S	*	.	H	α-helix	trans	-64.1	-40.8	177.4	-66.4	166.2	-173.1	170.3	0	113.4	S480 E481 G486 E487 E488	S480-K484 WeakPolarHBondContact O-CD 3.3Å; S480-K484 WeakPolarHBondContact O-CG 3.14Å; E481-K484 PolarHBondContact O-N 3.13Å; K484-G486 VanDerWaalsContact C-N 3.3Å; K484-E487 PolarHBondContact O-N 2.82Å; K484-E488 PolarHBondContact O-N 3Å
485	I	92	Very high	90.1	Very high	25 Å²	25	59.9 Å²	59.9	13%	0.128	31%	0.308	C	S	.	.	H	α-helix	trans	-66.7	-36.1	177	-73	162.6	0	0	0	110.3	E481 L482 E488 I489 L543 E547 L550	E481-I485 WeakPolarHBondContact O-CG1 3.42Å; E481-I485 PolarHBondContact O-N 3.21Å; L482-I485 PolarHBondContact O-N 2.75Å; I485-E488 PolarHBondContact O-N 2.9Å; I485-I489 HydrophobicContact CG2-CD1 3.75Å; I485-I489 HydrophobicContact CG2-CG1 4.43Å; I485-I489 WeakPolarHBondContact O-CB 3.44Å; I485-I489 WeakPolarHBondContact O-CD1 3.38Å; I485-I489 WeakPolarHBondContact O-CG1 3.39Å; I485-I489 PolarHBondContact O-N 3.45Å; I485-L543 HydrophobicContact CG2-CB 4.42Å; I485-L543 HydrophobicContact CG2-CD2 4.35Å; I485-E547 HydrophobicContact CG2-CB 4.08Å; I485-L550 HydrophobicContact CD1-CD1 3.58Å
486	G	90.2	Very high	90.2	Very high	24 Å²	24	57.7 Å²	57.7	25%	0.247	30%	0.297	C	S	.	.	H	α-helix	trans	-61.5	-44.8	171.9	0	0	0	0	0	113.1	L482 E483 K484 I489 V490	L482-G486 PolarHBondContact O-N 3.36Å; E483-G486 PolarHBondContact O-N 3.17Å; K484-G486 VanDerWaalsContact C-N 3.3Å; G486-I489 PolarHBondContact O-N 3.1Å; G486-V490 WeakPolarHBondContact O-CG2 3.47Å; G486-V490 PolarHBondContact O-N 3.16Å
487	E	90.3	Very high	90.3	Very high	132 Å²	132	60.2 Å²	60.2	62%	0.617	31%	0.307	S	S	*	.	H	α-helix	trans	-60.6	-45.4	173.8	-68.6	175	164.4	0	0	111.9	E483 K484 I489 V490 S491	E483-E487 PolarHBondContact O-N 2.67Å; K484-E487 PolarHBondContact O-N 2.82Å; E487-I489 PolarHBondContact O-N 3.33Å; E487-V490 PolarHBondContact O-N 2.89Å; E487-S491 PolarHBondContact O-N 2.9Å
488	E	91.9	Very high	90.3	Very high	62 Å²	62	59.2 Å²	59.2	29%	0.29	31%	0.306	S	S	.	.	H	α-helix	trans	-64.3	-39.5	178.4	-164.8	-178.7	157.6	0	0	112.1	K484 I485 I492 R539 L543	K484-E488 PolarHBondContact O-N 3Å; I485-E488 PolarHBondContact O-N 2.9Å; E488-I492 HydrophobicContact CG-CD1 3.98Å; E488-I492 WeakPolarHBondContact O-CD1 3.2Å; E488-I492 VanDerWaalsContact O-CG1 3.3Å; E488-I492 WeakPolarHBondContact O-CG1 3.45Å; E488-I492 PolarHBondContact O-N 3.44Å; E488-I492 VanDerWaalsContact O-N 3.09Å; E488-R539 IonicContact OE1-CZ 2.71Å; E488-R539 IonicContact OE1-NE 3.24Å; E488-R539 PolarHBondContact OE1-NE 3.49Å; E488-R539 IonicContact OE1-NH2 2.66Å; E488-R539 PolarHBondContact OE1-NH2 2.74Å; E488-L543 HydrophobicContact CB-CD1 4.12Å; E488-L543 HydrophobicContact CG-CD1 3.64Å; E488-L543 HydrophobicContact CG-CD2 4.37Å; E488-L543 WeakPolarHBondContact OE1-CD1 3.3Å
489	I	91.8	Very high	90.1	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-60.4	-50.3	174	-75.9	162.6	0	0	0	110.8	I485 G486 E487 S491 I492 E493 L540 L543 E547	I485-I489 HydrophobicContact CG2-CD1 3.75Å; I485-I489 HydrophobicContact CG2-CG1 4.43Å; I485-I489 WeakPolarHBondContact O-CB 3.44Å; I485-I489 WeakPolarHBondContact O-CD1 3.38Å; I485-I489 WeakPolarHBondContact O-CG1 3.39Å; I485-I489 PolarHBondContact O-N 3.45Å; G486-I489 PolarHBondContact O-N 3.1Å; E487-I489 PolarHBondContact O-N 3.33Å; I489-S491 VanDerWaalsContact C-N 3.34Å; I489-S491 PolarHBondContact O-N 2.86Å; I489-I492 PolarHBondContact O-N 3.41Å; I489-E493 HydrophobicContact CG2-CG 4.34Å; I489-E493 WeakPolarHBondContact CG2-OE1 3.45Å; I489-E493 WeakPolarHBondContact O-CB 3.44Å; I489-E493 WeakPolarHBondContact O-CG 3.32Å; I489-E493 PolarHBondContact O-N 2.8Å; I489-L540 HydrophobicContact CG2-CD1 4.12Å; I489-L543 HydrophobicContact CD1-CB 4.23Å; I489-L543 HydrophobicContact CG1-CB 3.78Å; I489-L543 HydrophobicContact CG1-CD1 4.29Å; I489-E547 HydrophobicContact CD1-CB 4.32Å
490	V	90.6	Very high	89.9	Confident	74 Å²	74	62 Å²	62	45%	0.448	32%	0.321	S	S	.	.	H	α-helix	trans	-62.2	-42.4	-178.9	170.8	0	0	0	0	111.1	G486 E487 I492 E493 E494	G486-V490 WeakPolarHBondContact O-CG2 3.47Å; G486-V490 PolarHBondContact O-N 3.16Å; E487-V490 PolarHBondContact O-N 2.89Å; V490-I492 VanDerWaalsContact C-N 3.32Å; V490-I492 PolarHBondContact O-N 3.42Å; V490-E493 PolarHBondContact O-N 3.06Å; V490-E494 PolarHBondContact O-N 2.74Å
491	S	92.9	Very high	89.6	Confident	59 Å²	59	68 Å²	68	41%	0.413	34%	0.344	S	S	.	.	H	α-helix	trans	-60.7	-39.2	176	178.3	0	0	0	0	112.6	E487 I489 E495	E487-S491 PolarHBondContact O-N 2.9Å; I489-S491 VanDerWaalsContact C-N 3.34Å; I489-S491 PolarHBondContact O-N 2.86Å; S491-E495 PolarHBondContact O-N 2.97Å
492	I	91.7	Very high	88.9	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-75.5	-33.5	177.7	-68.4	161.3	0	0	0	111.9	E488 I489 V490 E494 L496 L536 R539 L540 L543	E488-I492 HydrophobicContact CG-CD1 3.98Å; E488-I492 WeakPolarHBondContact O-CD1 3.2Å; E488-I492 VanDerWaalsContact O-CG1 3.3Å; E488-I492 WeakPolarHBondContact O-CG1 3.45Å; E488-I492 PolarHBondContact O-N 3.44Å; E488-I492 VanDerWaalsContact O-N 3.09Å; I489-I492 PolarHBondContact O-N 3.41Å; V490-I492 VanDerWaalsContact C-N 3.32Å; V490-I492 PolarHBondContact O-N 3.42Å; I492-E494 VanDerWaalsContact C-N 3.35Å; I492-L496 HydrophobicContact CG2-CD1 4.02Å; I492-L496 HydrophobicContact CG2-CG 4.43Å; I492-L496 VanDerWaalsContact O-CB 3.3Å; I492-L496 WeakPolarHBondContact O-CB 3.36Å; I492-L496 VanDerWaalsContact O-CG 3.25Å; I492-L496 WeakPolarHBondContact O-CG 3.38Å; I492-L496 PolarHBondContact O-N 3.09Å; I492-L536 HydrophobicContact CG1-CD2 4.29Å; I492-L536 HydrophobicContact CG2-CB 4.19Å; I492-L536 HydrophobicContact CG2-CD2 4.21Å; I492-R539 HydrophobicContact CD1-CB 4.22Å; I492-R539 VanDerWaalsContact CD1-CD 3.48Å; I492-R539 HydrophobicContact CD1-CG 3.65Å; I492-L540 HydrophobicContact CG2-CB 3.99Å; I492-L540 HydrophobicContact CG2-CD1 4.29Å; I492-L543 HydrophobicContact CD1-CD1 3.34Å
493	E	89.7	Confident	88	Confident	62 Å²	62	71.5 Å²	71.5	29%	0.29	36%	0.359	S	S	.	.	H	α-helix	trans	-63.2	-41.7	172.6	-74	173.2	176	0	0	110.3	I489 V490 L496 E497 L540 R544 S579	I489-E493 HydrophobicContact CG2-CG 4.34Å; I489-E493 WeakPolarHBondContact CG2-OE1 3.45Å; I489-E493 WeakPolarHBondContact O-CB 3.44Å; I489-E493 WeakPolarHBondContact O-CG 3.32Å; I489-E493 PolarHBondContact O-N 2.8Å; V490-E493 PolarHBondContact O-N 3.06Å; E493-L496 PolarHBondContact O-N 2.83Å; E493-E497 PolarHBondContact O-N 2.81Å; E493-L540 HydrophobicContact CG-CD1 3.89Å; E493-R544 IonicContact OE1-CZ 3.5Å; E493-R544 IonicContact OE1-NE 3.2Å; E493-R544 IonicContact OE1-NH2 2.83Å; E493-R544 PolarHBondContact OE1-NH2 2.96Å; E493-R544 IonicContact OE2-NH2 2.73Å; E493-S579 PolarHBondContact OE2-OG 3.24Å
494	E	90.8	Very high	86.9	Confident	141 Å²	141	72.8 Å²	72.8	66%	0.659	38%	0.377	S	S	*	.	H	α-helix	trans	-66.3	-47.1	173.1	-173.6	176.3	-168.3	0	0	113	V490 I492 L496 E497 A498	V490-E494 PolarHBondContact O-N 2.74Å; I492-E494 VanDerWaalsContact C-N 3.35Å; E494-L496 VanDerWaalsContact C-N 3.26Å; E494-L496 PolarHBondContact O-N 3.32Å; E494-E497 PolarHBondContact O-N 3.36Å; E494-E497 VanDerWaalsContact O-N 3.15Å; E494-A498 WeakPolarHBondContact O-CB 3.38Å; E494-A498 PolarHBondContact O-N 2.76Å
495	E	90.2	Very high	85.3	Confident	91 Å²	91	70.4 Å²	70.4	43%	0.425	38%	0.378	S	S	.	.	H	α-helix	trans	-58.6	-38.8	175.2	-79.1	-169.5	-158.3	0	0	112	S491 I499 L536	S491-E495 PolarHBondContact O-N 2.97Å; E495-I499 WeakPolarHBondContact O-CG1 3.42Å; E495-I499 PolarHBondContact O-N 2.71Å; E495-L536 HydrophobicContact CB-CD1 3.9Å; E495-L536 WeakPolarHBondContact OE2-CD1 3.26Å; E495-L536 VanDerWaalsContact OE2-CD2 3.24Å; E495-L536 WeakPolarHBondContact OE2-CD2 3.32Å
496	L	88.9	Confident	83.5	Confident	13 Å²	13	76.7 Å²	76.7	7%	0.068	40%	0.404	C	S	.	.	H	α-helix	trans	-68.3	-39	176.1	-77.9	171.6	0	0	0	112.3	I492 E493 E494 N500 R533 L536 K537 L540	I492-L496 HydrophobicContact CG2-CD1 4.02Å; I492-L496 HydrophobicContact CG2-CG 4.43Å; I492-L496 VanDerWaalsContact O-CB 3.3Å; I492-L496 WeakPolarHBondContact O-CB 3.36Å; I492-L496 VanDerWaalsContact O-CG 3.25Å; I492-L496 WeakPolarHBondContact O-CG 3.38Å; I492-L496 PolarHBondContact O-N 3.09Å; E493-L496 PolarHBondContact O-N 2.83Å; E494-L496 VanDerWaalsContact C-N 3.26Å; E494-L496 PolarHBondContact O-N 3.32Å; L496-N500 WeakPolarHBondContact O-CB 3.4Å; L496-N500 PolarHBondContact O-N 2.66Å; L496-N500 PolarHBondContact O-ND2 2.83Å; L496-R533 HydrophobicContact CD2-CG 3.93Å; L496-L536 HydrophobicContact CD1-CB 4.38Å; L496-L536 HydrophobicContact CD2-CB 3.68Å; L496-L536 HydrophobicContact CD2-CD1 4.31Å; L496-L536 HydrophobicContact CG-CB 3.91Å; L496-L536 HydrophobicContact CG-CD1 4.48Å; L496-K537 HydrophobicContact CD1-CG 4.12Å; L496-K537 HydrophobicContact CD2-CG 4.01Å; L496-L540 HydrophobicContact CD1-CD2 4.04Å
497	E	87.1	Confident	81.5	Confident	137 Å²	137	82 Å²	82	64%	0.64	42%	0.422	S	S	*	.	H	α-helix	trans	-66.4	-43.4	174.4	-174.6	166	-172.1	0	0	111.8	E493 E494 I499 N500 K501	E493-E497 PolarHBondContact O-N 2.81Å; E494-E497 PolarHBondContact O-N 3.36Å; E494-E497 VanDerWaalsContact O-N 3.15Å; E497-I499 PolarHBondContact O-N 3.41Å; E497-N500 PolarHBondContact O-N 2.84Å; E497-N500 VanDerWaalsContact O-N 3.16Å; E497-K501 WeakPolarHBondContact O-CB 3.24Å; E497-K501 PolarHBondContact O-N 3.22Å
498	A	88.6	Confident	79.6	Confident	55 Å²	55	80.4 Å²	80.4	46%	0.455	43%	0.431	S	S	.	.	H	α-helix	trans	-56	-48.7	174.7	0	0	0	0	0	111.6	E494 N500 K501 E502	E494-A498 WeakPolarHBondContact O-CB 3.38Å; E494-A498 PolarHBondContact O-N 2.76Å; A498-N500 PolarHBondContact O-N 3.34Å; A498-K501 WeakPolarHBondContact O-CB 3.49Å; A498-K501 PolarHBondContact O-N 2.96Å; A498-E502 PolarHBondContact O-N 2.83Å; A498-E502 VanDerWaalsContact O-N 3.12Å
499	I	85	Confident	77.8	Confident	18 Å²	18	84.6 Å²	84.6	9%	0.092	46%	0.456	C	S	.	.	H	α-helix	trans	-63.8	-42.1	176	-68.1	166.3	0	0	0	111.2	E495 E497 K501 E502 F503 Q532 R533 L536	E495-I499 WeakPolarHBondContact O-CG1 3.42Å; E495-I499 PolarHBondContact O-N 2.71Å; E497-I499 PolarHBondContact O-N 3.41Å; I499-K501 VanDerWaalsContact C-N 3.28Å; I499-K501 PolarHBondContact O-N 3.04Å; I499-E502 PolarHBondContact O-N 2.77Å; I499-F503 HydrophobicContact CG2-CD2 3.78Å; I499-F503 HydrophobicContact CG2-CE2 3.76Å; I499-F503 WeakPolarHBondContact O-CD2 3.44Å; I499-F503 PolarHBondContact O-N 2.88Å; I499-Q532 HydrophobicContact CD1-CB 4.37Å; I499-R533 HydrophobicContact CG2-CB 4.13Å; I499-R533 HydrophobicContact CG2-CG 4.27Å; I499-L536 HydrophobicContact CD1-CD1 3.63Å
500	N	83.1	Confident	75.7	Confident	62 Å²	62	90.1 Å²	90.1	33%	0.332	49%	0.492	S	S	.	.	H	α-helix	trans	-60.9	-37.1	176.6	-69.2	-32	0	0	0	112	L496 E497 A498 F503 S504 R533	L496-N500 WeakPolarHBondContact O-CB 3.4Å; L496-N500 PolarHBondContact O-N 2.66Å; L496-N500 PolarHBondContact O-ND2 2.83Å; E497-N500 PolarHBondContact O-N 2.84Å; E497-N500 VanDerWaalsContact O-N 3.16Å; A498-N500 PolarHBondContact O-N 3.34Å; N500-F503 PolarHBondContact O-N 3.11Å; N500-S504 PolarHBondContact O-N 3.4Å; N500-S504 VanDerWaalsContact O-N 3.14Å; N500-R533 PolarHBondContact OD1-NE 3.39Å; N500-R533 PolarHBondContact OD1-NH2 2.85Å
501	K	82.6	Confident	74.2	Confident	158 Å²	158	89.3 Å²	89.3	69%	0.687	49%	0.489	S	S	*	.	H	α-helix	trans	-67.5	-37.5	177.5	-170.9	173.5	-178	174.6	0	112.3	E497 A498 I499 S504 S505	E497-K501 WeakPolarHBondContact O-CB 3.24Å; E497-K501 PolarHBondContact O-N 3.22Å; A498-K501 WeakPolarHBondContact O-CB 3.49Å; A498-K501 PolarHBondContact O-N 2.96Å; I499-K501 VanDerWaalsContact C-N 3.28Å; I499-K501 PolarHBondContact O-N 3.04Å; K501-S504 PolarHBondContact O-N 3.4Å; K501-S505 PolarHBondContact O-N 2.87Å; K501-S505 PolarHBondContact O-OG 2.83Å
502	E	77.7	Confident	72.4	Confident	96 Å²	96	94.5 Å²	94.5	45%	0.449	51%	0.507	S	S	.	.	H	α-helix	trans	-66.2	-35.9	169.9	-65.9	-169.7	116.9	0	0	113	A498 I499 S504 S505 K529	A498-E502 PolarHBondContact O-N 2.83Å; A498-E502 VanDerWaalsContact O-N 3.12Å; I499-E502 PolarHBondContact O-N 2.77Å; E502-S504 PolarHBondContact O-N 2.87Å; E502-S505 PolarHBondContact O-OG 2.94Å; E502-K529 IonicContact OE1-NZ 2.9Å; E502-K529 PolarHBondContact OE1-NZ 2.92Å; E502-K529 WeakPolarHBondContact OE2-CD 3.46Å; E502-K529 WeakPolarHBondContact OE2-CE 3.48Å; E502-K529 IonicContact OE2-NZ 2.74Å; E502-K529 PolarHBondContact OE2-NZ 2.81Å
503	F	69.8	Low	70.7	Confident	75 Å²	75	101.6 Å²	101.6	33%	0.329	54%	0.544	S	S	.	.	H	α-helix	trans	-68.7	-19.7	173.3	-90.5	-77.6	0	0	0	113.6	I499 N500 N526 K529 C530	I499-F503 HydrophobicContact CG2-CD2 3.78Å; I499-F503 HydrophobicContact CG2-CE2 3.76Å; I499-F503 WeakPolarHBondContact O-CD2 3.44Å; I499-F503 PolarHBondContact O-N 2.88Å; N500-F503 PolarHBondContact O-N 3.11Å; F503-N526 HydrophobicContact CE1-CB 3.75Å; F503-N526 HydrophobicContact CZ-CB 3.66Å; F503-K529 HydrophobicContact CE2-CB 4.3Å; F503-C530 HydrophobicContact CZ-CB 4.31Å
504	S	66.7	Low	69.8	Low	105 Å²	105	103.4 Å²	103.4	73%	0.734	56%	0.556	S	S	*	*	H	α-helix	trans	-98.3	-8.5	-175.4	-162.6	0	0	0	0	114.3	N500 K501 E502	N500-S504 PolarHBondContact O-N 3.4Å; N500-S504 VanDerWaalsContact O-N 3.14Å; K501-S504 PolarHBondContact O-N 3.4Å; E502-S504 PolarHBondContact O-N 2.87Å
505	S	59.3	Low	69	Low	88 Å²	88	101.1 Å²	101.1	62%	0.615	55%	0.545	S	S	*	.	S	Bend	trans	-99.9	16.6	-167.8	35.3	0	0	0	0	115.1	K501 E502	K501-S505 PolarHBondContact O-N 2.87Å; K501-S505 PolarHBondContact O-OG 2.83Å; E502-S505 PolarHBondContact O-OG 2.94Å
506	K	54.9	Low	68.2	Low	156 Å²	156	102.5 Å²	102.5	68%	0.678	56%	0.555	S	S	*	*			trans	-147.4	132	175.3	-64.6	-174.7	-176.8	-175.7	0	109.3
507	E	48.6	Very low	67.5	Low	136 Å²	136	108 Å²	108	64%	0.636	58%	0.58	S	S	*	*			cis	-130.2	152.4	-4	-85.2	121.1	-148.6	0	0	110.8	A518	E507-A518 WeakPolarHBondContact OE2-CB 3.43Å
508	A	50.1	Low	66.8	Low	98 Å²	98	102.6 Å²	102.6	81%	0.81	56%	0.559	S	S	*	*			trans	-110.3	83	166.4	0	0	0	0	0	109.3
509	N	53.8	Low	66.1	Low	151 Å²	151	107 Å²	107	81%	0.807	57%	0.565	S	S	*	*			trans	-174.9	107.9	161.3	-91.4	-33.1	0	0	0	108.8
510	P	48.6	Very low	65.7	Low	117 Å²	117	110.2 Å²	110.2	76%	0.76	58%	0.581	S	S	*	*			trans	-82.3	125.8	-176.6	31.2	-33.1	0	0	0	112.5
511	S	57.7	Low	65.1	Low	56 Å²	56	110.8 Å²	110.8	39%	0.392	58%	0.583	S	S	.	*			trans	-146.1	111.1	168.6	171.3	0	0	0	0	106.6	L513 D514 E515	S511-L513 PolarHBondContact O-N 3.28Å; S511-D514 WeakPolarHBondContact CB-OD2 3.37Å; S511-D514 PolarHBondContact O-N 2.79Å; S511-D514 PolarHBondContact OG-OD2 2.86Å; S511-E515 PolarHBondContact N-OE1 3.19Å; S511-E515 WeakPolarHBondContact O-CG 3.46Å; S511-E515 PolarHBondContact O-N 2.86Å
512	Q	55.5	Low	64.5	Low	169 Å²	169	105 Å²	105	79%	0.79	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-13.2	-161.5	-69.2	179.2	-16.9	0	0	115.2
513	L	56.2	Low	64.1	Low	150 Å²	150	104.6 Å²	104.6	79%	0.785	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-41.8	168.6	-92.2	71.5	0	0	0	111.6	S511 E515	S511-L513 PolarHBondContact O-N 3.28Å; L513-E515 VanDerWaalsContact C-N 3.32Å; L513-E515 PolarHBondContact O-N 3.44Å
514	D	70.6	Confident	64.3	Low	99 Å²	99	107.5 Å²	107.5	53%	0.529	58%	0.578	S	S	.	*	H	α-helix	trans	-68.5	-31.8	179.5	-59.4	-63.1	0	0	0	111.5	S511 L516 E517 A518	S511-D514 WeakPolarHBondContact CB-OD2 3.37Å; S511-D514 PolarHBondContact O-N 2.79Å; S511-D514 PolarHBondContact OG-OD2 2.86Å; D514-L516 PolarHBondContact O-N 3.24Å; D514-E517 PolarHBondContact O-N 2.72Å; D514-E517 VanDerWaalsContact O-N 3.14Å; D514-A518 WeakPolarHBondContact O-CB 3.22Å; D514-A518 PolarHBondContact O-N 3.32Å
515	E	74.2	Confident	64.3	Low	94 Å²	94	106.7 Å²	106.7	44%	0.439	57%	0.569	S	S	.	*	H	α-helix	trans	-52.5	-38.5	177.5	-77.1	167.4	-140	0	0	113.2	S511 L513 Y519	S511-E515 PolarHBondContact N-OE1 3.19Å; S511-E515 WeakPolarHBondContact O-CG 3.46Å; S511-E515 PolarHBondContact O-N 2.86Å; L513-E515 VanDerWaalsContact C-N 3.32Å; L513-E515 PolarHBondContact O-N 3.44Å; E515-Y519 VanDerWaalsContact O-CB 3.27Å; E515-Y519 WeakPolarHBondContact O-CB 3.24Å; E515-Y519 PolarHBondContact O-N 2.77Å
516	L	72.9	Confident	64.7	Low	119 Å²	119	104 Å²	104	62%	0.623	55%	0.548	S	S	*	.	H	α-helix	trans	-80.3	-36.3	179.4	-166.5	146.1	0	0	0	112.3	D514 M520	D514-L516 PolarHBondContact O-N 3.24Å; L516-M520 HydrophobicContact CD2-CG 4.03Å; L516-M520 VanDerWaalsContact O-CB 3.31Å; L516-M520 WeakPolarHBondContact O-CB 3.45Å; L516-M520 VanDerWaalsContact O-CG 3.23Å; L516-M520 WeakPolarHBondContact O-CG 3.41Å; L516-M520 PolarHBondContact O-N 3.08Å
517	E	74.8	Confident	65.3	Low	129 Å²	129	100.3 Å²	100.3	60%	0.603	54%	0.541	S	S	*	.	H	α-helix	trans	-68.8	-40	172.2	-70.4	-141.3	155.6	0	0	111.8	D514 M520 N521	D514-E517 PolarHBondContact O-N 2.72Å; D514-E517 VanDerWaalsContact O-N 3.14Å; E517-M520 PolarHBondContact O-N 3.41Å; E517-N521 WeakPolarHBondContact O-CB 3.45Å; E517-N521 PolarHBondContact O-N 3.31Å; E517-N521 PolarHBondContact O-ND2 3.09Å; E517-N521 VanDerWaalsContact O-ND2 3.09Å
518	A	71.4	Confident	66.5	Low	23 Å²	23	97.1 Å²	97.1	19%	0.19	53%	0.534	C	S	.	.	H	α-helix	trans	-60.1	-46.9	172.5	0	0	0	0	0	111.2	E507 D514 N521 A522	E507-A518 WeakPolarHBondContact OE2-CB 3.43Å; D514-A518 WeakPolarHBondContact O-CB 3.22Å; D514-A518 PolarHBondContact O-N 3.32Å; A518-N521 PolarHBondContact O-N 3.03Å; A518-A522 WeakPolarHBondContact O-CB 3.42Å; A518-A522 PolarHBondContact O-N 3.25Å
519	Y	74	Confident	67.9	Low	149 Å²	149	95.3 Å²	95.3	58%	0.584	51%	0.508	S	S	*	.	H	α-helix	trans	-62	-44.4	174.1	179.9	-107.2	0	0	0	112.4	E515 N521 A522 L523	E515-Y519 VanDerWaalsContact O-CB 3.27Å; E515-Y519 WeakPolarHBondContact O-CB 3.24Å; E515-Y519 PolarHBondContact O-N 2.77Å; Y519-N521 PolarHBondContact O-N 3.39Å; Y519-A522 PolarHBondContact O-N 2.83Å; Y519-L523 HydrophobicContact CD1-CD1 4Å; Y519-L523 HydrophobicContact CE1-CD1 3.43Å; Y519-L523 VanDerWaalsContact CE1-CD1 3.43Å; Y519-L523 HydrophobicContact CE1-CG 4.13Å; Y519-L523 HydrophobicContact CE2-CD1 4.48Å; Y519-L523 HydrophobicContact CE2-CG 4.36Å; Y519-L523 WeakPolarHBondContact O-CB 3.45Å; Y519-L523 WeakPolarHBondContact O-CG 3.25Å; Y519-L523 PolarHBondContact O-N 3.42Å
520	M	76.6	Confident	69	Low	85 Å²	85	91.3 Å²	91.3	42%	0.419	49%	0.491	S	S	.	.	H	α-helix	trans	-68.7	-33.2	177.9	-74.6	-66.9	-73.3	0	0	112.8	L516 E517 L523 K524	L516-M520 HydrophobicContact CD2-CG 4.03Å; L516-M520 VanDerWaalsContact O-CB 3.31Å; L516-M520 WeakPolarHBondContact O-CB 3.45Å; L516-M520 VanDerWaalsContact O-CG 3.23Å; L516-M520 WeakPolarHBondContact O-CG 3.41Å; L516-M520 PolarHBondContact O-N 3.08Å; E517-M520 PolarHBondContact O-N 3.41Å; M520-L523 HydrophobicContact SD-CD1 4.28Å; M520-K524 WeakPolarHBondContact O-CD 3.4Å; M520-K524 VanDerWaalsContact O-CG 3.22Å; M520-K524 WeakPolarHBondContact O-CG 3.42Å; M520-K524 PolarHBondContact O-N 2.95Å
521	N	71.7	Confident	70.6	Confident	73 Å²	73	88 Å²	88	39%	0.39	47%	0.474	S	S	.	.	H	α-helix	trans	-74.9	-39.6	174.8	-71.6	-29.8	0	0	0	110.8	E517 A518 Y519 K524 T525	E517-N521 WeakPolarHBondContact O-CB 3.45Å; E517-N521 PolarHBondContact O-N 3.31Å; E517-N521 PolarHBondContact O-ND2 3.09Å; E517-N521 VanDerWaalsContact O-ND2 3.09Å; A518-N521 PolarHBondContact O-N 3.03Å; Y519-N521 PolarHBondContact O-N 3.39Å; N521-K524 PolarHBondContact O-N 2.82Å; N521-K524 VanDerWaalsContact O-N 3.15Å; N521-T525 WeakPolarHBondContact O-CG2 3.19Å; N521-T525 PolarHBondContact O-N 2.85Å; N521-T525 PolarHBondContact O-OG1 2.99Å; N521-T525 VanDerWaalsContact O-OG1 3.11Å
522	A	70.1	Confident	72	Confident	38 Å²	38	90.2 Å²	90.2	31%	0.314	48%	0.478	S	S	.	.	H	α-helix	trans	-60.5	-43.2	170.1	0	0	0	0	0	111.4	A518 Y519 K524 T525 N526	A518-A522 WeakPolarHBondContact O-CB 3.42Å; A518-A522 PolarHBondContact O-N 3.25Å; Y519-A522 PolarHBondContact O-N 2.83Å; A522-K524 VanDerWaalsContact C-N 3.32Å; A522-K524 PolarHBondContact O-N 2.9Å; A522-T525 PolarHBondContact O-OG1 3.14Å; A522-N526 WeakPolarHBondContact O-CA 3.13Å; A522-N526 WeakPolarHBondContact O-CB 3.19Å; A522-N526 PolarHBondContact O-N 2.9Å; A522-N526 PolarHBondContact O-ND2 2.83Å
523	L	69.2	Low	73.5	Confident	87 Å²	87	85.8 Å²	85.8	46%	0.455	45%	0.454	S	S	.	.	H	α-helix	trans	-61.1	-38.7	172.6	-77.3	179.9	0	0	0	112.4	Y519 M520 S527	Y519-L523 HydrophobicContact CD1-CD1 4Å; Y519-L523 HydrophobicContact CE1-CD1 3.43Å; Y519-L523 VanDerWaalsContact CE1-CD1 3.43Å; Y519-L523 HydrophobicContact CE1-CG 4.13Å; Y519-L523 HydrophobicContact CE2-CD1 4.48Å; Y519-L523 HydrophobicContact CE2-CG 4.36Å; Y519-L523 WeakPolarHBondContact O-CB 3.45Å; Y519-L523 WeakPolarHBondContact O-CG 3.25Å; Y519-L523 PolarHBondContact O-N 3.42Å; M520-L523 HydrophobicContact SD-CD1 4.28Å; L523-S527 WeakPolarHBondContact O-CA 3.31Å; L523-S527 WeakPolarHBondContact O-CB 3.38Å; L523-S527 PolarHBondContact O-N 3.4Å
524	K	73.2	Confident	74.9	Confident	136 Å²	136	82.4 Å²	82.4	59%	0.591	44%	0.443	S	S	*	.	H	α-helix	trans	-69.7	-54.3	176.5	-72.3	164.8	-171.3	168.1	0	112.1	M520 N521 A522 N526 S527	M520-K524 WeakPolarHBondContact O-CD 3.4Å; M520-K524 VanDerWaalsContact O-CG 3.22Å; M520-K524 WeakPolarHBondContact O-CG 3.42Å; M520-K524 PolarHBondContact O-N 2.95Å; N521-K524 PolarHBondContact O-N 2.82Å; N521-K524 VanDerWaalsContact O-N 3.15Å; A522-K524 VanDerWaalsContact C-N 3.32Å; A522-K524 PolarHBondContact O-N 2.9Å; K524-N526 VanDerWaalsContact C-N 3.34Å; K524-N526 PolarHBondContact O-N 3.46Å; K524-S527 WeakPolarHBondContact O-CB 3.49Å; K524-S527 PolarHBondContact O-N 2.89Å
525	T	67.9	Low	75.8	Confident	87 Å²	87	85.1 Å²	85.1	53%	0.534	45%	0.45	S	S	.	.	H	α-helix	trans	-66.6	-36.8	-178.4	59.1	0	0	0	0	112	N521 A522 S528	N521-T525 WeakPolarHBondContact O-CG2 3.19Å; N521-T525 PolarHBondContact O-N 2.85Å; N521-T525 PolarHBondContact O-OG1 2.99Å; N521-T525 VanDerWaalsContact O-OG1 3.11Å; A522-T525 PolarHBondContact O-OG1 3.14Å; T525-S528 PolarHBondContact O-OG 2.93Å
526	N	65.9	Low	76.7	Confident	32 Å²	32	81.4 Å²	81.4	17%	0.171	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	10.4	-176.8	-46	-13.5	0	0	0	111.5	F503 A522 K524 S528 K529 C530	F503-N526 HydrophobicContact CE1-CB 3.75Å; F503-N526 HydrophobicContact CZ-CB 3.66Å; A522-N526 WeakPolarHBondContact O-CA 3.13Å; A522-N526 WeakPolarHBondContact O-CB 3.19Å; A522-N526 PolarHBondContact O-N 2.9Å; A522-N526 PolarHBondContact O-ND2 2.83Å; K524-N526 VanDerWaalsContact C-N 3.34Å; K524-N526 PolarHBondContact O-N 3.46Å; N526-S528 VanDerWaalsContact C-N 3.31Å; N526-S528 PolarHBondContact O-N 2.6Å; N526-K529 HydrophobicContact CB-CB 4.27Å; N526-K529 CarbonylContact O-C 3.57Å; N526-K529 PolarHBondContact O-N 3.15Å; N526-C530 WeakPolarHBondContact O-CB 3.32Å; N526-C530 PolarHBondContact O-N 3.09Å
527	S	68.6	Low	77.5	Confident	78 Å²	78	80.4 Å²	80.4	55%	0.545	42%	0.424	S	S	.	.	H	α-helix	trans	-58.3	-45.5	171.9	178.7	0	0	0	0	110.9	L523 K524 C530 A531	L523-S527 WeakPolarHBondContact O-CA 3.31Å; L523-S527 WeakPolarHBondContact O-CB 3.38Å; L523-S527 PolarHBondContact O-N 3.4Å; K524-S527 WeakPolarHBondContact O-CB 3.49Å; K524-S527 PolarHBondContact O-N 2.89Å; S527-C530 PolarHBondContact O-N 3.47Å; S527-A531 WeakPolarHBondContact O-CB 3.34Å; S527-A531 PolarHBondContact O-N 2.89Å
528	S	73.9	Confident	78.2	Confident	70 Å²	70	77.1 Å²	77.1	49%	0.49	42%	0.419	S	S	.	.	H	α-helix	trans	-59.5	-49.7	171.6	52.2	0	0	0	0	112.1	T525 N526 C530 A531 Q532	T525-S528 PolarHBondContact O-OG 2.93Å; N526-S528 VanDerWaalsContact C-N 3.31Å; N526-S528 PolarHBondContact O-N 2.6Å; S528-C530 VanDerWaalsContact C-N 3.34Å; S528-C530 PolarHBondContact O-N 3.5Å; S528-A531 WeakPolarHBondContact O-CB 3.42Å; S528-A531 PolarHBondContact O-N 3.36Å; S528-Q532 WeakPolarHBondContact O-CG 3.43Å; S528-Q532 PolarHBondContact O-N 3.07Å; S528-Q532 PolarHBondContact O-OE1 3.13Å
529	K	79.2	Confident	79.2	Confident	59 Å²	59	82 Å²	82	26%	0.257	43%	0.432	S	S	.	.	H	α-helix	trans	-67	-31.7	-179.5	-60.9	-167.4	175.1	-168.7	0	113.2	E502 F503 N526 Q532 R533	E502-K529 IonicContact OE1-NZ 2.9Å; E502-K529 PolarHBondContact OE1-NZ 2.92Å; E502-K529 WeakPolarHBondContact OE2-CD 3.46Å; E502-K529 WeakPolarHBondContact OE2-CE 3.48Å; E502-K529 IonicContact OE2-NZ 2.74Å; E502-K529 PolarHBondContact OE2-NZ 2.81Å; F503-K529 HydrophobicContact CE2-CB 4.3Å; N526-K529 HydrophobicContact CB-CB 4.27Å; N526-K529 CarbonylContact O-C 3.57Å; N526-K529 PolarHBondContact O-N 3.15Å; K529-Q532 PolarHBondContact O-N 3.3Å; K529-R533 VanDerWaalsContact O-CB 3.23Å; K529-R533 WeakPolarHBondContact O-CB 3.27Å; K529-R533 PolarHBondContact O-N 3.06Å
530	C	76.2	Confident	80.1	Confident	67 Å²	67	76.5 Å²	76.5	45%	0.453	41%	0.413	S	S	.	.	H	α-helix	trans	-71	-41.7	173.7	-168.7	0	0	0	0	110.8	F503 N526 S527 S528 R533 S534	F503-C530 HydrophobicContact CZ-CB 4.31Å; N526-C530 WeakPolarHBondContact O-CB 3.32Å; N526-C530 PolarHBondContact O-N 3.09Å; S527-C530 PolarHBondContact O-N 3.47Å; S528-C530 VanDerWaalsContact C-N 3.34Å; S528-C530 PolarHBondContact O-N 3.5Å; C530-R533 PolarHBondContact O-N 3.45Å; C530-S534 WeakPolarHBondContact O-CB 3.33Å; C530-S534 PolarHBondContact O-N 3.29Å
531	A	83.4	Confident	80.7	Confident	48 Å²	48	76.8 Å²	76.8	40%	0.397	42%	0.415	S	S	.	.	H	α-helix	trans	-63.8	-38.7	171.6	0	0	0	0	0	112.2	S527 S528 S534 K535	S527-A531 WeakPolarHBondContact O-CB 3.34Å; S527-A531 PolarHBondContact O-N 2.89Å; S528-A531 WeakPolarHBondContact O-CB 3.42Å; S528-A531 PolarHBondContact O-N 3.36Å; A531-S534 PolarHBondContact O-N 3.11Å; A531-K535 VanDerWaalsContact O-CG 3.3Å; A531-K535 WeakPolarHBondContact O-CG 3.45Å; A531-K535 PolarHBondContact O-N 3.23Å
532	Q	86.1	Confident	81.6	Confident	102 Å²	102	76.6 Å²	76.6	48%	0.477	42%	0.419	S	S	.	.	H	α-helix	trans	-63.1	-51.8	171.6	-72.9	168.9	-61	0	0	111.2	I499 S528 K529 S534 K535 L536	I499-Q532 HydrophobicContact CD1-CB 4.37Å; S528-Q532 WeakPolarHBondContact O-CG 3.43Å; S528-Q532 PolarHBondContact O-N 3.07Å; S528-Q532 PolarHBondContact O-OE1 3.13Å; K529-Q532 PolarHBondContact O-N 3.3Å; Q532-S534 PolarHBondContact O-N 3.14Å; Q532-K535 WeakPolarHBondContact O-CB 3.38Å; Q532-K535 PolarHBondContact O-N 3.08Å; Q532-K535 VanDerWaalsContact O-N 3.09Å; Q532-L536 WeakPolarHBondContact O-CB 3.47Å; Q532-L536 WeakPolarHBondContact O-CG 3.39Å; Q532-L536 PolarHBondContact O-N 2.96Å
533	R	86.7	Confident	82.7	Confident	77 Å²	77	75.5 Å²	75.5	29%	0.291	41%	0.408	S	S	.	.	H	α-helix	trans	-54.8	-38.4	175.6	-166.9	-177.9	-172.9	-143.2	6.5	112.6	L496 I499 N500 K529 C530 K537	L496-R533 HydrophobicContact CD2-CG 3.93Å; I499-R533 HydrophobicContact CG2-CB 4.13Å; I499-R533 HydrophobicContact CG2-CG 4.27Å; N500-R533 PolarHBondContact OD1-NE 3.39Å; N500-R533 PolarHBondContact OD1-NH2 2.85Å; K529-R533 VanDerWaalsContact O-CB 3.23Å; K529-R533 WeakPolarHBondContact O-CB 3.27Å; K529-R533 PolarHBondContact O-N 3.06Å; C530-R533 PolarHBondContact O-N 3.45Å; R533-K537 WeakPolarHBondContact O-CB 3.49Å; R533-K537 VanDerWaalsContact O-CG 3.32Å; R533-K537 WeakPolarHBondContact O-CG 3.47Å; R533-K537 PolarHBondContact O-N 2.91Å
534	S	85.9	Confident	83.6	Confident	79 Å²	79	71.9 Å²	71.9	55%	0.552	39%	0.388	S	S	*	.	H	α-helix	trans	-68.5	-46.2	175.6	-170.2	0	0	0	0	112	C530 A531 Q532 L536 K537 A538	C530-S534 WeakPolarHBondContact O-CB 3.33Å; C530-S534 PolarHBondContact O-N 3.29Å; A531-S534 PolarHBondContact O-N 3.11Å; Q532-S534 PolarHBondContact O-N 3.14Å; S534-L536 PolarHBondContact O-N 3.06Å; S534-K537 PolarHBondContact O-N 3.47Å; S534-A538 PolarHBondContact O-N 3.28Å
535	K	91.2	Very high	84.4	Confident	156 Å²	156	71 Å²	71	68%	0.678	39%	0.386	S	S	*	.	H	α-helix	trans	-60.7	-43.4	174.5	-73.6	172.5	179.7	-176.1	0	112.5	A531 Q532 A538 R539	A531-K535 VanDerWaalsContact O-CG 3.3Å; A531-K535 WeakPolarHBondContact O-CG 3.45Å; A531-K535 PolarHBondContact O-N 3.23Å; Q532-K535 WeakPolarHBondContact O-CB 3.38Å; Q532-K535 PolarHBondContact O-N 3.08Å; Q532-K535 VanDerWaalsContact O-N 3.09Å; K535-A538 PolarHBondContact O-N 3.3Å; K535-R539 WeakPolarHBondContact O-CB 3.43Å; K535-R539 PolarHBondContact O-N 3.43Å
536	L	91.1	Very high	85.4	Confident	15 Å²	15	69.1 Å²	69.1	8%	0.079	38%	0.375	C	S	.	.	H	α-helix	trans	-66.3	-41.7	178.2	-71.3	171.3	0	0	0	111.8	I492 E495 L496 I499 Q532 S534 A538 R539 L540	I492-L536 HydrophobicContact CG1-CD2 4.29Å; I492-L536 HydrophobicContact CG2-CB 4.19Å; I492-L536 HydrophobicContact CG2-CD2 4.21Å; E495-L536 HydrophobicContact CB-CD1 3.9Å; E495-L536 WeakPolarHBondContact OE2-CD1 3.26Å; E495-L536 VanDerWaalsContact OE2-CD2 3.24Å; E495-L536 WeakPolarHBondContact OE2-CD2 3.32Å; L496-L536 HydrophobicContact CD1-CB 4.38Å; L496-L536 HydrophobicContact CD2-CB 3.68Å; L496-L536 HydrophobicContact CD2-CD1 4.31Å; L496-L536 HydrophobicContact CG-CB 3.91Å; L496-L536 HydrophobicContact CG-CD1 4.48Å; I499-L536 HydrophobicContact CD1-CD1 3.63Å; Q532-L536 WeakPolarHBondContact O-CB 3.47Å; Q532-L536 WeakPolarHBondContact O-CG 3.39Å; Q532-L536 PolarHBondContact O-N 2.96Å; S534-L536 PolarHBondContact O-N 3.06Å; L536-A538 VanDerWaalsContact C-N 3.35Å; L536-A538 PolarHBondContact O-N 3.02Å; L536-R539 PolarHBondContact O-N 2.87Å; L536-L540 WeakPolarHBondContact O-CB 3.07Å; L536-L540 PolarHBondContact O-N 3.01Å
537	K	90.7	Very high	86.6	Confident	99 Å²	99	68 Å²	68	43%	0.43	37%	0.368	S	S	.	.	H	α-helix	trans	-61.7	-40.1	171.3	-76.8	-176.7	175.7	-164.1	0	112.8	L496 R533 S534 L540 I541	L496-K537 HydrophobicContact CD1-CG 4.12Å; L496-K537 HydrophobicContact CD2-CG 4.01Å; R533-K537 WeakPolarHBondContact O-CB 3.49Å; R533-K537 VanDerWaalsContact O-CG 3.32Å; R533-K537 WeakPolarHBondContact O-CG 3.47Å; R533-K537 PolarHBondContact O-N 2.91Å; S534-K537 PolarHBondContact O-N 3.47Å; K537-L540 PolarHBondContact O-N 2.96Å; K537-I541 WeakPolarHBondContact O-CD1 3.27Å; K537-I541 VanDerWaalsContact O-CG1 3.28Å; K537-I541 WeakPolarHBondContact O-CG1 3.38Å; K537-I541 PolarHBondContact O-N 3.03Å
538	A	89.9	Confident	87.4	Confident	60 Å²	60	66.2 Å²	66.2	50%	0.496	35%	0.353	S	S	.	.	H	α-helix	trans	-65.2	-41.5	175.2	0	0	0	0	0	112.2	S534 K535 L536 I541 S542	S534-A538 PolarHBondContact O-N 3.28Å; K535-A538 PolarHBondContact O-N 3.3Å; L536-A538 VanDerWaalsContact C-N 3.35Å; L536-A538 PolarHBondContact O-N 3.02Å; A538-I541 PolarHBondContact O-N 2.86Å; A538-S542 PolarHBondContact O-N 3.33Å
539	R	92.7	Very high	88.1	Confident	125 Å²	125	68.5 Å²	68.5	47%	0.472	36%	0.355	S	S	.	.	H	α-helix	trans	-63.3	-45.4	174.8	-166.8	177.6	177.8	-176.1	2.1	111.4	E488 I492 K535 L536 I541 S542 L543	E488-R539 IonicContact OE1-CZ 2.71Å; E488-R539 IonicContact OE1-NE 3.24Å; E488-R539 PolarHBondContact OE1-NE 3.49Å; E488-R539 IonicContact OE1-NH2 2.66Å; E488-R539 PolarHBondContact OE1-NH2 2.74Å; I492-R539 HydrophobicContact CD1-CB 4.22Å; I492-R539 VanDerWaalsContact CD1-CD 3.48Å; I492-R539 HydrophobicContact CD1-CG 3.65Å; K535-R539 WeakPolarHBondContact O-CB 3.43Å; K535-R539 PolarHBondContact O-N 3.43Å; L536-R539 PolarHBondContact O-N 2.87Å; R539-I541 PolarHBondContact O-N 3.46Å; R539-S542 WeakPolarHBondContact O-CB 3.35Å; R539-S542 PolarHBondContact O-N 3.08Å; R539-L543 HydrophobicContact CG-CD1 4.11Å; R539-L543 WeakPolarHBondContact O-CG 3.32Å; R539-L543 PolarHBondContact O-N 2.81Å
540	L	91.9	Very high	88.5	Confident	34 Å²	34	66.8 Å²	66.8	18%	0.178	35%	0.349	C	S	.	.	H	α-helix	trans	-56.6	-48.7	174.7	-174.3	69.3	0	0	0	111.7	I489 I492 E493 L496 L536 K537 S542 L543 R544	I489-L540 HydrophobicContact CG2-CD1 4.12Å; I492-L540 HydrophobicContact CG2-CB 3.99Å; I492-L540 HydrophobicContact CG2-CD1 4.29Å; E493-L540 HydrophobicContact CG-CD1 3.89Å; L496-L540 HydrophobicContact CD1-CD2 4.04Å; L536-L540 WeakPolarHBondContact O-CB 3.07Å; L536-L540 PolarHBondContact O-N 3.01Å; K537-L540 PolarHBondContact O-N 2.96Å; L540-S542 VanDerWaalsContact C-N 3.32Å; L540-S542 PolarHBondContact O-N 2.82Å; L540-L543 PolarHBondContact O-N 2.86Å; L540-R544 HydrophobicContact CG-CG 4.48Å; L540-R544 WeakPolarHBondContact O-CB 3.32Å; L540-R544 VanDerWaalsContact O-CG 3.29Å; L540-R544 WeakPolarHBondContact O-CG 3.42Å; L540-R544 PolarHBondContact O-N 2.86Å
541	I	89.4	Confident	89	Confident	91 Å²	91	63.9 Å²	63.9	47%	0.467	33%	0.329	S	S	.	.	H	α-helix	trans	-60.8	-42.2	177.6	-68.5	163.6	0	0	0	110.9	K537 A538 R539 R544 Q545	K537-I541 WeakPolarHBondContact O-CD1 3.27Å; K537-I541 VanDerWaalsContact O-CG1 3.28Å; K537-I541 WeakPolarHBondContact O-CG1 3.38Å; K537-I541 PolarHBondContact O-N 3.03Å; A538-I541 PolarHBondContact O-N 2.86Å; R539-I541 PolarHBondContact O-N 3.46Å; I541-R544 PolarHBondContact O-N 2.98Å; I541-Q545 PolarHBondContact O-N 2.85Å
542	S	91.2	Very high	89	Confident	68 Å²	68	68.3 Å²	68.3	48%	0.476	34%	0.341	S	S	.	.	H	α-helix	trans	-63	-41.8	177	-165.7	0	0	0	0	112.4	A538 R539 L540 Q545 T546	A538-S542 PolarHBondContact O-N 3.33Å; R539-S542 WeakPolarHBondContact O-CB 3.35Å; R539-S542 PolarHBondContact O-N 3.08Å; L540-S542 VanDerWaalsContact C-N 3.32Å; L540-S542 PolarHBondContact O-N 2.82Å; S542-Q545 WeakPolarHBondContact O-CB 3.42Å; S542-Q545 PolarHBondContact O-N 2.89Å; S542-T546 PolarHBondContact O-N 3.04Å
543	L	92.1	Very high	89	Confident	15 Å²	15	72.8 Å²	72.8	8%	0.079	35%	0.354	C	S	.	.	H	α-helix	trans	-71.7	-37.9	178.5	-69.3	166.1	0	0	0	112.5	I485 E488 I489 I492 R539 L540 Q545 T546 E547	I485-L543 HydrophobicContact CG2-CB 4.42Å; I485-L543 HydrophobicContact CG2-CD2 4.35Å; E488-L543 HydrophobicContact CB-CD1 4.12Å; E488-L543 HydrophobicContact CG-CD1 3.64Å; E488-L543 HydrophobicContact CG-CD2 4.37Å; E488-L543 WeakPolarHBondContact OE1-CD1 3.3Å; I489-L543 HydrophobicContact CD1-CB 4.23Å; I489-L543 HydrophobicContact CG1-CB 3.78Å; I489-L543 HydrophobicContact CG1-CD1 4.29Å; I492-L543 HydrophobicContact CD1-CD1 3.34Å; R539-L543 HydrophobicContact CG-CD1 4.11Å; R539-L543 WeakPolarHBondContact O-CG 3.32Å; R539-L543 PolarHBondContact O-N 2.81Å; L540-L543 PolarHBondContact O-N 2.86Å; L543-Q545 PolarHBondContact O-N 3.11Å; L543-T546 WeakPolarHBondContact CA-OG1 3.44Å; L543-T546 PolarHBondContact O-N 2.93Å; L543-T546 PolarHBondContact O-OG1 2.9Å; L543-T546 VanDerWaalsContact O-OG1 3.07Å; L543-E547 WeakPolarHBondContact O-CB 3.46Å; L543-E547 PolarHBondContact O-N 3.43Å
544	R	89	Confident	88.8	Confident	12 Å²	12	69.4 Å²	69.4	5%	0.045	34%	0.342	C	S	.	.	H	α-helix	trans	-64.5	-27.8	171.7	-67.6	-57.6	-170.9	158.2	6.2	111.9	E493 L540 I541 E547 L548 Y576 I577	E493-R544 IonicContact OE1-CZ 3.5Å; E493-R544 IonicContact OE1-NE 3.2Å; E493-R544 IonicContact OE1-NH2 2.83Å; E493-R544 PolarHBondContact OE1-NH2 2.96Å; E493-R544 IonicContact OE2-NH2 2.73Å; L540-R544 HydrophobicContact CG-CG 4.48Å; L540-R544 WeakPolarHBondContact O-CB 3.32Å; L540-R544 VanDerWaalsContact O-CG 3.29Å; L540-R544 WeakPolarHBondContact O-CG 3.42Å; L540-R544 PolarHBondContact O-N 2.86Å; I541-R544 PolarHBondContact O-N 2.98Å; R544-E547 WeakPolarHBondContact CD-OE2 3.38Å; R544-E547 IonicContact CZ-OE2 3.15Å; R544-E547 IonicContact NE-OE2 2.77Å; R544-E547 IonicContact NH1-OE1 3.88Å; R544-E547 PolarHBondContact NH1-OE1 3.35Å; R544-E547 IonicContact NH1-OE2 2.72Å; R544-E547 PolarHBondContact NH1-OE2 2.8Å; R544-L548 WeakPolarHBondContact O-CB 3.21Å; R544-L548 WeakPolarHBondContact O-CD1 3.44Å; R544-L548 VanDerWaalsContact O-CG 3.25Å; R544-L548 WeakPolarHBondContact O-CG 3.49Å; R544-L548 PolarHBondContact O-N 3.06Å; R544-Y576 HydrophobicContact CB-CD1 3.63Å; R544-Y576 HydrophobicContact CB-CE1 3.65Å; R544-Y576 HydrophobicContact CG-CD1 3.95Å; R544-Y576 HydrophobicContact CG-CE1 4.28Å; R544-Y576 HydrophobicContact CG-CG 4.39Å; R544-I577 PolarHBondContact NH1-O 3.5Å; R544-I577 PolarHBondContact NH2-O 3.45Å
545	Q	89.1	Confident	88.5	Confident	117 Å²	117	68.8 Å²	68.8	55%	0.547	35%	0.348	S	S	.	.	H	α-helix	trans	-74	-42.9	172.3	-174.6	174.2	-12.4	0	0	112.4	I541 S542 L543 L548 Q549	I541-Q545 PolarHBondContact O-N 2.85Å; S542-Q545 WeakPolarHBondContact O-CB 3.42Å; S542-Q545 PolarHBondContact O-N 2.89Å; L543-Q545 PolarHBondContact O-N 3.11Å; Q545-L548 PolarHBondContact O-N 3.38Å; Q545-Q549 WeakPolarHBondContact O-CG 3.23Å; Q545-Q549 PolarHBondContact O-N 3.48Å
546	T	89.9	Confident	87.7	Confident	47 Å²	47	62.6 Å²	62.6	29%	0.288	32%	0.322	S	S	.	.	H	α-helix	trans	-70.6	-36.8	176.1	55	0	0	0	0	112.4	S542 L543 Q549 L550	S542-T546 PolarHBondContact O-N 3.04Å; L543-T546 WeakPolarHBondContact CA-OG1 3.44Å; L543-T546 PolarHBondContact O-N 2.93Å; L543-T546 PolarHBondContact O-OG1 2.9Å; L543-T546 VanDerWaalsContact O-OG1 3.07Å; T546-Q549 PolarHBondContact O-N 2.73Å; T546-L550 PolarHBondContact O-N 2.87Å
547	E	90.2	Very high	86.5	Confident	8 Å²	8	66.8 Å²	66.8	4%	0.037	35%	0.35	C	S	.	.	H	α-helix	trans	-51.6	-57.2	168	178.1	-176	-143.8	0	0	110	L482 I485 I489 L543 R544 Q549 L550 F551 A582	L482-E547 HydrophobicContact CD2-CG 4.41Å; I485-E547 HydrophobicContact CG2-CB 4.08Å; I489-E547 HydrophobicContact CD1-CB 4.32Å; L543-E547 WeakPolarHBondContact O-CB 3.46Å; L543-E547 PolarHBondContact O-N 3.43Å; R544-E547 WeakPolarHBondContact CD-OE2 3.38Å; R544-E547 IonicContact CZ-OE2 3.15Å; R544-E547 IonicContact NE-OE2 2.77Å; R544-E547 IonicContact NH1-OE1 3.88Å; R544-E547 PolarHBondContact NH1-OE1 3.35Å; R544-E547 IonicContact NH1-OE2 2.72Å; R544-E547 PolarHBondContact NH1-OE2 2.8Å; E547-Q549 VanDerWaalsContact C-N 3.32Å; E547-Q549 PolarHBondContact O-N 2.9Å; E547-L550 PolarHBondContact O-N 3.12Å; E547-F551 HydrophobicContact CG-CD2 3.78Å; E547-F551 HydrophobicContact CG-CE2 3.86Å; E547-F551 WeakPolarHBondContact O-CD2 3.46Å; E547-F551 PolarHBondContact O-N 3.36Å; E547-A582 VanDerWaalsContact OE1-CB 3.26Å; E547-A582 WeakPolarHBondContact OE1-CB 3.14Å
548	L	85.7	Confident	85.1	Confident	42 Å²	42	69 Å²	69	22%	0.22	36%	0.355	C	S	.	.	H	α-helix	trans	-60	-38.6	179.8	-74.6	169.9	0	0	0	113	R544 Q545 F551 H552 I577	R544-L548 WeakPolarHBondContact O-CB 3.21Å; R544-L548 WeakPolarHBondContact O-CD1 3.44Å; R544-L548 VanDerWaalsContact O-CG 3.25Å; R544-L548 WeakPolarHBondContact O-CG 3.49Å; R544-L548 PolarHBondContact O-N 3.06Å; Q545-L548 PolarHBondContact O-N 3.38Å; L548-F551 PolarHBondContact O-N 2.81Å; L548-H552 PolarHBondContact O-CD2 3.3Å; L548-H552 VanDerWaalsContact O-CD2 3.27Å; L548-H552 PolarHBondContact O-N 2.88Å; L548-I577 HydrophobicContact CD2-CD1 4.18Å
549	Q	88.2	Confident	83.4	Confident	117 Å²	117	68.5 Å²	68.5	55%	0.547	35%	0.347	S	S	.	.	H	α-helix	trans	-64.5	-43.2	175.9	-76.7	179.9	-27.3	0	0	112.4	Q545 T546 E547 H552 R553	Q545-Q549 WeakPolarHBondContact O-CG 3.23Å; Q545-Q549 PolarHBondContact O-N 3.48Å; T546-Q549 PolarHBondContact O-N 2.73Å; E547-Q549 VanDerWaalsContact C-N 3.32Å; E547-Q549 PolarHBondContact O-N 2.9Å; Q549-H552 PolarHBondContact O-N 3.46Å; Q549-R553 WeakPolarHBondContact O-CB 3.08Å; Q549-R553 PolarHBondContact O-N 3.25Å
550	L	87.4	Confident	81.3	Confident	23 Å²	23	65.5 Å²	65.5	12%	0.12	36%	0.355	C	S	.	.	H	α-helix	trans	-69.8	-37.4	176.1	-73	176.9	0	0	0	112.4	M478 E481 L482 I485 T546 E547 H552 R553 A554	M478-L550 HydrophobicContact CG-CD2 4.37Å; E481-L550 HydrophobicContact CB-CD1 3.83Å; L482-L550 HydrophobicContact CD1-CB 4.25Å; L482-L550 HydrophobicContact CD2-CB 3.55Å; L482-L550 HydrophobicContact CD2-CD1 4.19Å; L482-L550 HydrophobicContact CG-CB 3.77Å; L482-L550 HydrophobicContact CG-CD1 4.16Å; I485-L550 HydrophobicContact CD1-CD1 3.58Å; T546-L550 PolarHBondContact O-N 2.87Å; E547-L550 PolarHBondContact O-N 3.12Å; L550-H552 VanDerWaalsContact C-N 3.32Å; L550-H552 PolarHBondContact O-N 3.32Å; L550-R553 PolarHBondContact O-N 2.88Å; L550-A554 VanDerWaalsContact O-CB 3.25Å; L550-A554 WeakPolarHBondContact O-CB 3.39Å; L550-A554 PolarHBondContact O-N 3.34Å
551	F	86.9	Confident	79.2	Confident	7 Å²	7	73.2 Å²	73.2	3%	0.031	39%	0.386	C	S	.	.	H	α-helix	trans	-57.5	-44.9	171.4	-97.5	-90.3	0	0	0	111.6	L482 E547 L548 G555 L556 A582 A585 V586	L482-F551 HydrophobicContact CD1-CD2 4.34Å; L482-F551 HydrophobicContact CD1-CE2 4.41Å; L482-F551 HydrophobicContact CD2-CD2 3.6Å; L482-F551 HydrophobicContact CD2-CE2 3.76Å; E547-F551 HydrophobicContact CG-CD2 3.78Å; E547-F551 HydrophobicContact CG-CE2 3.86Å; E547-F551 WeakPolarHBondContact O-CD2 3.46Å; E547-F551 PolarHBondContact O-N 3.36Å; L548-F551 PolarHBondContact O-N 2.81Å; F551-G555 PolarHBondContact O-N 3.36Å; F551-L556 HydrophobicContact CD1-CB 3.53Å; F551-L556 HydrophobicContact CD1-CD1 3.86Å; F551-L556 HydrophobicContact CD1-CG 4.35Å; F551-L556 HydrophobicContact CE1-CB 3.99Å; F551-L556 HydrophobicContact CE1-CD1 3.83Å; F551-L556 HydrophobicContact CG-CB 4.45Å; F551-L556 HydrophobicContact CG-CD1 4.45Å; F551-L556 HydrophobicContact CZ-CD1 4.42Å; F551-L556 PolarHBondContact O-N 3.48Å; F551-A582 HydrophobicContact CE2-CB 3.99Å; F551-A582 HydrophobicContact CZ-CB 3.83Å; F551-A585 HydrophobicContact CE1-CB 3.84Å; F551-A585 HydrophobicContact CZ-CB 4.25Å; F551-V586 HydrophobicContact CZ-CG2 4.12Å
552	H	84.3	Confident	76.7	Confident	140 Å²	140	74.7 Å²	74.7	65%	0.648	40%	0.4	S	S	*	.	H	α-helix	trans	-64.2	-46.3	174.1	-88.1	-73.7	0	0	0	112.5	L548 Q549 L550 A554 G555	L548-H552 PolarHBondContact O-CD2 3.3Å; L548-H552 VanDerWaalsContact O-CD2 3.27Å; L548-H552 PolarHBondContact O-N 2.88Å; Q549-H552 PolarHBondContact O-N 3.46Å; L550-H552 VanDerWaalsContact C-N 3.32Å; L550-H552 PolarHBondContact O-N 3.32Å; H552-A554 VanDerWaalsContact C-N 3.33Å; H552-A554 PolarHBondContact O-N 3.19Å; H552-G555 PolarHBondContact O-N 2.94Å; H552-G555 VanDerWaalsContact O-N 3.12Å
553	R	85.5	Confident	73.8	Confident	197 Å²	197	78.3 Å²	78.3	74%	0.743	41%	0.413	S	S	*	.	H	α-helix	trans	-66.8	-31.4	-178.8	-168.2	-178.3	164.2	126.6	-0.4	113.1	M478 Q549 L550 G555	M478-R553 HydrophobicContact CE-CG 4.38Å; M478-R553 HydrophobicContact SD-CB 4.03Å; M478-R553 WeakPolarHBondContact SD-CD 3.33Å; M478-R553 HydrophobicContact SD-CG 3.52Å; M478-R553 VanDerWaalsContact SD-CG 3.52Å; M478-R553 PolarHBondContact SD-NE 3.43Å; M478-R553 VanDerWaalsContact SD-NE 3.44Å; Q549-R553 WeakPolarHBondContact O-CB 3.08Å; Q549-R553 PolarHBondContact O-N 3.25Å; L550-R553 PolarHBondContact O-N 2.88Å; R553-G555 VanDerWaalsContact C-N 3.3Å
554	A	82.8	Confident	71.1	Confident	6 Å²	6	86 Å²	86	5%	0.05	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-0.1	174.5	0	0	0	0	0	113.9	M478 L550 H552 L556	M478-A554 HydrophobicContact CE-CB 4.19Å; L550-A554 VanDerWaalsContact O-CB 3.25Å; L550-A554 WeakPolarHBondContact O-CB 3.39Å; L550-A554 PolarHBondContact O-N 3.34Å; H552-A554 VanDerWaalsContact C-N 3.33Å; H552-A554 PolarHBondContact O-N 3.19Å; A554-L556 HydrophobicContact CB-CD1 4.07Å; A554-L556 HydrophobicContact CB-CG 3.9Å; A554-L556 PolarHBondContact O-N 3.22Å
555	G	78.4	Confident	68.3	Low	65 Å²	65	93.6 Å²	93.6	67%	0.67	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	19.4	-179.2	0	0	0	0	0	114.3	F551 H552 R553	F551-G555 PolarHBondContact O-N 3.36Å; H552-G555 PolarHBondContact O-N 2.94Å; H552-G555 VanDerWaalsContact O-N 3.12Å; R553-G555 VanDerWaalsContact C-N 3.3Å
556	L	76	Confident	65.8	Low	26 Å²	26	95.4 Å²	95.4	14%	0.136	50%	0.495	C	S	.	.			trans	-76.7	135	-175.7	-66.3	175.9	0	0	0	110.6	L479 L482 F551 A554 R558 A589	L479-L556 HydrophobicContact CD2-CD1 4.12Å; L482-L556 HydrophobicContact CD1-CD1 3.88Å; F551-L556 HydrophobicContact CD1-CB 3.53Å; F551-L556 HydrophobicContact CD1-CD1 3.86Å; F551-L556 HydrophobicContact CD1-CG 4.35Å; F551-L556 HydrophobicContact CE1-CB 3.99Å; F551-L556 HydrophobicContact CE1-CD1 3.83Å; F551-L556 HydrophobicContact CG-CB 4.45Å; F551-L556 HydrophobicContact CG-CD1 4.45Å; F551-L556 HydrophobicContact CZ-CD1 4.42Å; F551-L556 PolarHBondContact O-N 3.48Å; A554-L556 HydrophobicContact CB-CD1 4.07Å; A554-L556 HydrophobicContact CB-CG 3.9Å; A554-L556 PolarHBondContact O-N 3.22Å; L556-R558 PolarHBondContact O-N 2.75Å; L556-A589 HydrophobicContact CD2-CB 3.6Å
557	P	65.6	Low	63.1	Low	103 Å²	103	98.1 Å²	98.1	67%	0.669	52%	0.516	S	S	*	.			trans	-64.8	122.8	179.5	26.6	-33.7	0	0	0	110.1	V559	P557-V559 PolarHBondContact O-N 3.44Å
558	R	60.3	Low	60.5	Low	145 Å²	145	104.9 Å²	104.9	55%	0.547	55%	0.552	S	S	.	*			trans	-56.4	114.4	173.6	-172.9	176.8	-177.5	-170.8	-1	108.4	L556 G560 I577	L556-R558 PolarHBondContact O-N 2.75Å; R558-G560 PolarHBondContact O-N 2.87Å; R558-I577 HydrophobicContact CG-CD1 4.34Å
559	V	55.5	Low	58.1	Low	51 Å²	51	114.1 Å²	114.1	31%	0.309	58%	0.584	S	S	.	*			trans	-74.5	73.1	-173.1	-168.4	0	0	0	0	110.6	P557 K561 I577 D581 A585	P557-V559 PolarHBondContact O-N 3.44Å; V559-K561 PolarHBondContact O-N 2.88Å; V559-I577 HydrophobicContact CB-CG2 4.26Å; V559-D581 HydrophobicContact CB-CB 4.46Å; V559-D581 HydrophobicContact CG1-CB 4.11Å; V559-A585 HydrophobicContact CG2-CB 4Å
560	G	47.6	Very low	55.6	Low	62 Å²	62	116.8 Å²	116.8	64%	0.639	60%	0.596	S	S	*	*			trans	-89.5	100.8	-177.4	0	0	0	0	0	112.1	R558	R558-G560 PolarHBondContact O-N 2.87Å
561	K	48	Very low	53.3	Low	195 Å²	195	123 Å²	123	85%	0.848	63%	0.63	S	S	*	*			trans	51.9	83.7	160.7	-59.2	178.1	-178.5	176.3	0	115.4	V559 L563	V559-K561 PolarHBondContact O-N 2.88Å; K561-L563 PolarHBondContact O-N 3.16Å
562	T	37.3	Very low	50.8	Low	122 Å²	122	130.4 Å²	130.4	75%	0.748	67%	0.67	S	S	*	*			trans	-66.9	114.6	149.1	50.8	0	0	0	0	107.9	K564	T562-K564 VanDerWaalsContact C-N 3.3Å; T562-K564 PolarHBondContact O-N 3.13Å
563	L	30	Very low	48.6	Very low	145 Å²	145	131.6 Å²	131.6	76%	0.759	68%	0.681	S	S	*	*			trans	-76.2	77	-172.3	-173.6	68.7	0	0	0	111.6	K561 Q565	K561-L563 PolarHBondContact O-N 3.16Å; L563-Q565 HydrophobicContact CG-CG 4.44Å; L563-Q565 PolarHBondContact O-N 3.11Å
564	K	36.1	Very low	46.8	Very low	175 Å²	175	126.5 Å²	126.5	76%	0.761	68%	0.676	S	S	*	*			trans	-77.5	103.7	160.4	-74.7	-172.6	176.9	179.8	0	108.7	T562 L566	T562-K564 VanDerWaalsContact C-N 3.3Å; T562-K564 PolarHBondContact O-N 3.13Å; K564-L566 PolarHBondContact O-N 2.75Å
565	Q	30.5	Very low	45.5	Very low	173 Å²	173	134 Å²	134	81%	0.808	71%	0.709	S	S	*	*			trans	-66.5	98.2	166.1	-71.2	-173.3	-9.1	0	0	109.1	L563	L563-Q565 HydrophobicContact CG-CG 4.44Å; L563-Q565 PolarHBondContact O-N 3.11Å
566	L	35.5	Very low	44.6	Very low	155 Å²	155	136 Å²	136	81%	0.812	70%	0.697	S	S	*	*			trans	-127.5	140	165.8	-76.9	172.5	0	0	0	108.8	K564	K564-L566 PolarHBondContact O-N 2.75Å
567	S	34.2	Very low	44	Very low	104 Å²	104	135.3 Å²	135.3	73%	0.727	69%	0.694	S	S	*	*			trans	-79.8	158.9	-164.5	54.1	0	0	0	0	113.8
568	N	34.5	Very low	44.2	Very low	150 Å²	150	133.3 Å²	133.3	80%	0.802	68%	0.682	S	S	*	*			trans	51.3	92	156	-74.1	-17.4	0	0	0	117.6
569	R	35.1	Very low	44.9	Very low	235 Å²	235	128.1 Å²	128.1	89%	0.887	67%	0.668	S	S	*	*				-172.8	162	89.9	-102.2	170.8	173.2	174.6	-2.4	114	N571	R569-N571 PolarHBondContact O-N 3.08Å
570	Q	35.4	Very low	46	Very low	173 Å²	173	128.8 Å²	128.8	81%	0.808	68%	0.675	S	S	*	*			trans	-53.5	122.9	179.3	-61.1	146.5	-53.4	0	0	112.3
571	N	39.2	Very low	47.6	Very low	155 Å²	155	128.7 Å²	128.7	83%	0.829	66%	0.66	S	S	*	*			trans	-168.8	78.3	149.5	-100.4	-27.3	0	0	0	110.5	R569 N573	R569-N571 PolarHBondContact O-N 3.08Å; N571-N573 VanDerWaalsContact C-N 3.28Å; N571-N573 PolarHBondContact O-N 3.04Å
572	N	34.6	Very low	49.2	Very low	162 Å²	162	119.7 Å²	119.7	87%	0.866	62%	0.622	S	S	*	*			trans	-76.1	75.9	176	-67.3	-2.1	0	0	0	110.4
573	N	38.2	Very low	51.5	Low	165 Å²	165	116 Å²	116	88%	0.882	60%	0.604	S	S	*	*			trans	-166.7	65.9	169.6	-95.6	-37.1	0	0	0	112	N571	N571-N573 VanDerWaalsContact C-N 3.28Å; N571-N573 PolarHBondContact O-N 3.04Å
574	S	47.9	Very low	54.1	Low	90 Å²	90	111.2 Å²	111.2	63%	0.629	59%	0.586	S	S	*	*			trans	-154	120.9	157	-170.4	0	0	0	0	111.9	Y576	S574-Y576 PolarHBondContact OG-N 3.5Å; S574-Y576 VanDerWaalsContact OG-N 3.14Å; S574-Y576 PolarHBondContact OG-O 2.84Å
575	E	55.3	Low	56.5	Low	162 Å²	162	103.7 Å²	103.7	76%	0.757	56%	0.556	S	S	*	*			trans	-105.6	10.1	162.3	-148.7	171.2	-153.2	0	0	111.2
576	Y	60.5	Low	59.1	Low	107 Å²	107	96 Å²	96	42%	0.42	52%	0.521	S	S	.	.	S	Bend	trans	-94.1	149.2	-178.4	-58.2	-72.1	0	0	0	111.5	R544 S574	R544-Y576 HydrophobicContact CB-CD1 3.63Å; R544-Y576 HydrophobicContact CB-CE1 3.65Å; R544-Y576 HydrophobicContact CG-CD1 3.95Å; R544-Y576 HydrophobicContact CG-CE1 4.28Å; R544-Y576 HydrophobicContact CG-CG 4.39Å; S574-Y576 PolarHBondContact OG-N 3.5Å; S574-Y576 VanDerWaalsContact OG-N 3.14Å; S574-Y576 PolarHBondContact OG-O 2.84Å
577	I	62.2	Low	61.5	Low	13 Å²	13	95.7 Å²	95.7	7%	0.067	51%	0.509	C	S	.	.	P	Polyproline II helix	trans	-73.9	137.9	-179.9	-53	173.7	0	0	0	108.6	R544 L548 R558 V559 S579 D581 A582	R544-I577 PolarHBondContact NH1-O 3.5Å; R544-I577 PolarHBondContact NH2-O 3.45Å; L548-I577 HydrophobicContact CD2-CD1 4.18Å; R558-I577 HydrophobicContact CG-CD1 4.34Å; V559-I577 HydrophobicContact CB-CG2 4.26Å; I577-S579 PolarHBondContact O-N 3.04Å; I577-D581 HydrophobicContact CG2-CB 3.95Å; I577-A582 HydrophobicContact CG2-CB 4.21Å
578	S	71.1	Confident	64	Low	60 Å²	60	93 Å²	93	42%	0.42	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-56.4	135.5	171.5	-175.3	0	0	0	0	109.7	S580 D581 A582	S578-S580 WeakPolarHBondContact CB-OG 3.4Å; S578-S580 PolarHBondContact O-N 3.35Å; S578-S580 VanDerWaalsContact O-N 3.16Å; S578-S580 PolarHBondContact OG-OG 3.41Å; S578-D581 PolarHBondContact O-N 3.36Å; S578-A582 PolarHBondContact O-N 3.01Å
579	S	74.9	Confident	66.5	Low	37 Å²	37	86.2 Å²	86.2	26%	0.259	46%	0.458	S	S	.	.	H	α-helix	trans	-58	-29.6	178.2	30.8	0	0	0	0	111.8	E493 I577 D581 A583	E493-S579 PolarHBondContact OE2-OG 3.24Å; I577-S579 PolarHBondContact O-N 3.04Å; S579-D581 VanDerWaalsContact C-N 3.34Å; S579-D581 PolarHBondContact O-N 2.89Å; S579-A583 VanDerWaalsContact O-CB 3.26Å; S579-A583 WeakPolarHBondContact O-CB 3.15Å; S579-A583 PolarHBondContact O-N 2.86Å; S579-A583 VanDerWaalsContact O-N 3.12Å
580	S	78.3	Confident	68.9	Low	64 Å²	64	79.5 Å²	79.5	45%	0.448	43%	0.432	S	S	.	.	H	α-helix	trans	-59.2	-39.5	169.3	57.9	0	0	0	0	114.2	S578 A584	S578-S580 WeakPolarHBondContact CB-OG 3.4Å; S578-S580 PolarHBondContact O-N 3.35Å; S578-S580 VanDerWaalsContact O-N 3.16Å; S578-S580 PolarHBondContact OG-OG 3.41Å; S580-A584 WeakPolarHBondContact O-CB 2.99Å; S580-A584 PolarHBondContact O-N 2.83Å
581	D	80.7	Confident	71.3	Confident	60 Å²	60	77.3 Å²	77.3	32%	0.321	42%	0.422	S	S	.	.	H	α-helix	trans	-87.7	-36.7	-167.6	-66.4	13.6	0	0	0	110.1	V559 I577 S578 S579 A584 A585	V559-D581 HydrophobicContact CB-CB 4.46Å; V559-D581 HydrophobicContact CG1-CB 4.11Å; I577-D581 HydrophobicContact CG2-CB 3.95Å; S578-D581 PolarHBondContact O-N 3.36Å; S579-D581 VanDerWaalsContact C-N 3.34Å; S579-D581 PolarHBondContact O-N 2.89Å; D581-A584 PolarHBondContact O-N 3.48Å; D581-A585 PolarHBondContact O-N 2.75Å
582	A	81.5	Confident	73.4	Confident	6 Å²	6	76.8 Å²	76.8	5%	0.05	41%	0.412	C	S	.	.	H	α-helix	trans	-59.2	-50	166.3	0	0	0	0	0	110.8	E547 F551 I577 S578 A584 A585 V586	E547-A582 VanDerWaalsContact OE1-CB 3.26Å; E547-A582 WeakPolarHBondContact OE1-CB 3.14Å; F551-A582 HydrophobicContact CE2-CB 3.99Å; F551-A582 HydrophobicContact CZ-CB 3.83Å; I577-A582 HydrophobicContact CG2-CB 4.21Å; S578-A582 PolarHBondContact O-N 3.01Å; A582-A584 VanDerWaalsContact C-N 3.27Å; A582-A584 PolarHBondContact O-N 3.46Å; A582-A585 PolarHBondContact O-N 3.24Å; A582-A585 VanDerWaalsContact O-N 3.15Å; A582-V586 WeakPolarHBondContact O-CG2 3.35Å; A582-V586 PolarHBondContact O-N 2.78Å
583	A	85.4	Confident	75.7	Confident	45 Å²	45	69.8 Å²	69.8	37%	0.372	38%	0.375	S	S	.	.	H	α-helix	trans	-64.5	-27.3	176.1	0	0	0	0	0	113.3	S579 R587	S579-A583 VanDerWaalsContact O-CB 3.26Å; S579-A583 WeakPolarHBondContact O-CB 3.15Å; S579-A583 PolarHBondContact O-N 2.86Å; S579-A583 VanDerWaalsContact O-N 3.12Å; A583-R587 WeakPolarHBondContact O-CB 3.36Å; A583-R587 VanDerWaalsContact O-CG 3.31Å; A583-R587 WeakPolarHBondContact O-CG 3.4Å; A583-R587 PolarHBondContact O-N 2.96Å; A583-R587 PolarHBondContact O-NE 3.01Å
584	A	85.6	Confident	77.8	Confident	45 Å²	45	67.1 Å²	67.1	37%	0.372	36%	0.36	S	S	.	.	H	α-helix	trans	-70.7	-43.6	171.3	0	0	0	0	0	111.9	S580 D581 A582 R587 A588	S580-A584 WeakPolarHBondContact O-CB 2.99Å; S580-A584 PolarHBondContact O-N 2.83Å; D581-A584 PolarHBondContact O-N 3.48Å; A582-A584 VanDerWaalsContact C-N 3.27Å; A582-A584 PolarHBondContact O-N 3.46Å; A584-R587 PolarHBondContact O-N 3.46Å; A584-A588 WeakPolarHBondContact O-CB 3.06Å; A584-A588 PolarHBondContact O-N 3.02Å
585	A	85	Confident	79.3	Confident	17 Å²	17	67.1 Å²	67.1	14%	0.14	35%	0.353	C	S	.	.	H	α-helix	trans	-64.1	-44	177.5	0	0	0	0	0	112.7	F551 V559 D581 A582 A588 A589	F551-A585 HydrophobicContact CE1-CB 3.84Å; F551-A585 HydrophobicContact CZ-CB 4.25Å; V559-A585 HydrophobicContact CG2-CB 4Å; D581-A585 PolarHBondContact O-N 2.75Å; A582-A585 PolarHBondContact O-N 3.24Å; A582-A585 VanDerWaalsContact O-N 3.15Å; A585-A588 PolarHBondContact O-N 3.02Å; A585-A589 WeakPolarHBondContact O-CB 3.1Å; A585-A589 PolarHBondContact O-N 2.74Å
586	V	86.4	Confident	80.1	Confident	11 Å²	11	62.5 Å²	62.5	7%	0.067	33%	0.334	C	S	.	.	H	α-helix	trans	-60.9	-44.9	176.1	171.7	0	0	0	0	111.2	L479 L482 F551 A582 A589 R590	L479-V586 HydrophobicContact CD2-CB 4.48Å; L479-V586 HydrophobicContact CD2-CG1 4.08Å; L479-V586 HydrophobicContact CD2-CG2 4.49Å; L482-V586 HydrophobicContact CB-CG2 3.94Å; L482-V586 HydrophobicContact CD1-CG2 4.12Å; F551-V586 HydrophobicContact CZ-CG2 4.12Å; A582-V586 WeakPolarHBondContact O-CG2 3.35Å; A582-V586 PolarHBondContact O-N 2.78Å; V586-A589 PolarHBondContact O-N 2.86Å; V586-R590 PolarHBondContact O-N 3.31Å
587	R	86.2	Confident	80.5	Confident	149 Å²	149	59.7 Å²	59.7	56%	0.562	33%	0.333	S	S	*	.	H	α-helix	trans	-63.7	-42.2	175.7	-75.8	178.4	-67.2	161.9	-1.2	112.6	A583 A584 A589 R590 Q591	A583-R587 WeakPolarHBondContact O-CB 3.36Å; A583-R587 VanDerWaalsContact O-CG 3.31Å; A583-R587 WeakPolarHBondContact O-CG 3.4Å; A583-R587 PolarHBondContact O-N 2.96Å; A583-R587 PolarHBondContact O-NE 3.01Å; A584-R587 PolarHBondContact O-N 3.46Å; R587-A589 VanDerWaalsContact C-N 3.33Å; R587-A589 PolarHBondContact O-N 3.21Å; R587-R590 PolarHBondContact O-N 2.88Å; R587-Q591 WeakPolarHBondContact O-CB 3.4Å; R587-Q591 WeakPolarHBondContact O-CG 3.49Å; R587-Q591 PolarHBondContact O-N 2.89Å
588	A	87.1	Confident	80.5	Confident	46 Å²	46	62.1 Å²	62.1	38%	0.38	35%	0.351	S	S	.	.	H	α-helix	trans	-64.2	-36.2	176.9	0	0	0	0	0	112.4	A584 A585 K592	A584-A588 WeakPolarHBondContact O-CB 3.06Å; A584-A588 PolarHBondContact O-N 3.02Å; A585-A588 PolarHBondContact O-N 3.02Å; A588-K592 WeakPolarHBondContact O-CG 3.5Å; A588-K592 PolarHBondContact O-N 2.85Å; A588-K592 VanDerWaalsContact O-N 3.13Å
589	A	85.6	Confident	80.1	Confident	9 Å²	9	64.9 Å²	64.9	7%	0.074	36%	0.357	C	S	.	.	H	α-helix	trans	-67.4	-44.8	174.4	0	0	0	0	0	112.2	L479 L556 A585 V586 R587 Q591 K592 L593	L479-A589 HydrophobicContact CD1-CB 4.08Å; L479-A589 HydrophobicContact CD2-CB 3.79Å; L556-A589 HydrophobicContact CD2-CB 3.6Å; A585-A589 WeakPolarHBondContact O-CB 3.1Å; A585-A589 PolarHBondContact O-N 2.74Å; V586-A589 PolarHBondContact O-N 2.86Å; R587-A589 VanDerWaalsContact C-N 3.33Å; R587-A589 PolarHBondContact O-N 3.21Å; A589-Q591 VanDerWaalsContact C-N 3.3Å; A589-Q591 PolarHBondContact O-N 3.3Å; A589-K592 WeakPolarHBondContact O-CB 3.37Å; A589-K592 PolarHBondContact O-N 2.89Å; A589-L593 PolarHBondContact O-N 3.35Å; A589-L593 VanDerWaalsContact O-N 3.11Å
590	R	86.1	Confident	79.3	Confident	93 Å²	93	66.6 Å²	66.6	35%	0.351	36%	0.361	S	S	.	.	H	α-helix	trans	-62.6	-36.4	176.2	-154.8	179	-159.9	155.2	8.7	112.1	E483 V586 R587 N594	E483-R590 IonicContact OE1-NH1 2.66Å; E483-R590 PolarHBondContact OE1-NH1 2.81Å; E483-R590 IonicContact OE2-CZ 2.76Å; E483-R590 IonicContact OE2-NH1 2.71Å; E483-R590 PolarHBondContact OE2-NH1 3.36Å; E483-R590 IonicContact OE2-NH2 3.34Å; V586-R590 PolarHBondContact O-N 3.31Å; R587-R590 PolarHBondContact O-N 2.88Å; R590-N594 PolarHBondContact O-N 3.26Å; R590-N594 VanDerWaalsContact O-N 3.13Å; R590-N594 PolarHBondContact O-OD1 3.34Å
591	Q	85	Confident	78.4	Confident	128 Å²	128	70 Å²	70	60%	0.598	37%	0.37	S	S	*	.	H	α-helix	trans	-64.7	-41.3	172.7	-77.3	177	-18.2	0	0	112.6	R587 A589 N594 N595	R587-Q591 WeakPolarHBondContact O-CB 3.4Å; R587-Q591 WeakPolarHBondContact O-CG 3.49Å; R587-Q591 PolarHBondContact O-N 2.89Å; A589-Q591 VanDerWaalsContact C-N 3.3Å; A589-Q591 PolarHBondContact O-N 3.3Å; Q591-N594 PolarHBondContact O-N 3.44Å; Q591-N595 VanDerWaalsContact O-CG 3.23Å; Q591-N595 PolarHBondContact O-N 2.8Å; Q591-N595 PolarHBondContact O-OD1 3.3Å
592	K	84.4	Confident	77.4	Confident	143 Å²	143	69.7 Å²	69.7	62%	0.622	37%	0.373	S	S	*	.	H	α-helix	trans	-59.6	-52.4	174.3	-73.6	179.6	176.6	-171.3	0	111.8	A588 A589 N594 N595 D596	A588-K592 WeakPolarHBondContact O-CG 3.5Å; A588-K592 PolarHBondContact O-N 2.85Å; A588-K592 VanDerWaalsContact O-N 3.13Å; A589-K592 WeakPolarHBondContact O-CB 3.37Å; A589-K592 PolarHBondContact O-N 2.89Å; K592-N594 VanDerWaalsContact C-N 3.25Å; K592-N594 PolarHBondContact O-N 3.09Å; K592-N595 CarbonylContact O-C 3.59Å; K592-N595 WeakPolarHBondContact O-CA 2.9Å; K592-N595 WeakPolarHBondContact O-CB 3.3Å; K592-N595 PolarHBondContact O-N 2.8Å; K592-D596 PolarHBondContact O-N 3.14Å
593	L	81.9	Confident	76.2	Confident	15 Å²	15	74.7 Å²	74.7	8%	0.079	40%	0.395	C	S	.	.	H	α-helix	trans	-58.6	-35.8	179.9	-66.9	171	0	0	0	113	N472 M475 I476 L479 A589 A597	N472-L593 HydrophobicContact CB-CD2 4.34Å; M475-L593 HydrophobicContact CB-CD1 4.26Å; M475-L593 HydrophobicContact CG-CD1 3.98Å; M475-L593 HydrophobicContact SD-CD1 3.98Å; M475-L593 HydrophobicContact SD-CD2 4.1Å; M475-L593 HydrophobicContact SD-CG 4.36Å; I476-L593 HydrophobicContact CG1-CD1 4.02Å; L479-L593 HydrophobicContact CD1-CD1 3.59Å; A589-L593 PolarHBondContact O-N 3.35Å; A589-L593 VanDerWaalsContact O-N 3.11Å; L593-A597 PolarHBondContact O-N 3.09Å
594	N	82	Confident	75	Confident	109 Å²	109	75.5 Å²	75.5	58%	0.583	39%	0.393	S	S	*	.	H	α-helix	trans	-69.1	-41.1	173.7	-74.6	7.4	0	0	0	112.2	R590 Q591 K592 A597 S598	R590-N594 PolarHBondContact O-N 3.26Å; R590-N594 VanDerWaalsContact O-N 3.13Å; R590-N594 PolarHBondContact O-OD1 3.34Å; Q591-N594 PolarHBondContact O-N 3.44Å; K592-N594 VanDerWaalsContact C-N 3.25Å; K592-N594 PolarHBondContact O-N 3.09Å; N594-A597 PolarHBondContact O-N 3.12Å; N594-S598 PolarHBondContact O-N 2.97Å; N594-S598 VanDerWaalsContact O-N 3.14Å
595	N	80.2	Confident	73.9	Confident	90 Å²	90	78.7 Å²	78.7	48%	0.481	40%	0.404	S	S	.	.	H	α-helix	trans	-63.8	-48.8	175.7	-69.2	2.5	0	0	0	110.6	Q591 K592 A597 S598 E599	Q591-N595 VanDerWaalsContact O-CG 3.23Å; Q591-N595 PolarHBondContact O-N 2.8Å; Q591-N595 PolarHBondContact O-OD1 3.3Å; K592-N595 CarbonylContact O-C 3.59Å; K592-N595 WeakPolarHBondContact O-CA 2.9Å; K592-N595 WeakPolarHBondContact O-CB 3.3Å; K592-N595 PolarHBondContact O-N 2.8Å; N595-A597 PolarHBondContact O-N 3.34Å; N595-S598 WeakPolarHBondContact O-CA 3.49Å; N595-S598 PolarHBondContact O-N 3.23Å; N595-S598 PolarHBondContact O-OG 3.37Å; N595-E599 PolarHBondContact O-N 2.95Å
596	D	72.6	Confident	72.9	Confident	65 Å²	65	83.7 Å²	83.7	35%	0.348	43%	0.425	S	S	.	.	H	α-helix	trans	-55.4	-36.2	178.5	-58.8	-24.5	0	0	0	111.6	K592 Q600	K592-D596 PolarHBondContact O-N 3.14Å; D596-Q600 WeakPolarHBondContact O-CB 3.25Å; D596-Q600 WeakPolarHBondContact O-CG 3.35Å; D596-Q600 PolarHBondContact O-N 2.91Å; D596-Q600 VanDerWaalsContact O-N 3.16Å; D596-Q600 PolarHBondContact O-NE2 3.37Å
597	A	68.1	Low	71.6	Confident	49 Å²	49	87.6 Å²	87.6	41%	0.405	44%	0.442	S	S	.	.	H	α-helix	trans	-70.5	-40	174.8	0	0	0	0	0	112.8	L593 N594 N595 Q601	L593-A597 PolarHBondContact O-N 3.09Å; N594-A597 PolarHBondContact O-N 3.12Å; N595-A597 PolarHBondContact O-N 3.34Å; A597-Q601 PolarHBondContact O-N 3.12Å; A597-Q601 VanDerWaalsContact O-N 3.09Å
598	S	63.2	Low	70.5	Confident	63 Å²	63	85.2 Å²	85.2	44%	0.441	44%	0.441	S	S	.	.	H	α-helix	trans	-71.4	-37.2	177.6	70.3	0	0	0	0	113.1	N594 N595 Q601 S602	N594-S598 PolarHBondContact O-N 2.97Å; N594-S598 VanDerWaalsContact O-N 3.14Å; N595-S598 WeakPolarHBondContact O-CA 3.49Å; N595-S598 PolarHBondContact O-N 3.23Å; N595-S598 PolarHBondContact O-OG 3.37Å; S598-Q601 PolarHBondContact O-N 3.47Å; S598-S602 PolarHBondContact O-N 3.49Å; S598-S602 VanDerWaalsContact O-N 3.07Å
599	E	63	Low	69.6	Low	119 Å²	119	85.4 Å²	85.4	56%	0.556	44%	0.442	S	S	*	.	H	α-helix	trans	-63.7	-47.1	173.7	-71.6	-176.1	-176.8	0	0	109.8	N595 Q601 S602 E603	N595-E599 PolarHBondContact O-N 2.95Å; E599-Q601 VanDerWaalsContact C-N 3.32Å; E599-Q601 PolarHBondContact O-N 3.07Å; E599-S602 CarbonylContact O-C 3.55Å; E599-S602 PolarHBondContact O-N 3.08Å; E599-S602 VanDerWaalsContact O-N 3.07Å; E599-S602 PolarHBondContact O-OG 3.38Å; E599-E603 PolarHBondContact O-N 3.47Å
600	Q	58.3	Low	68.8	Low	73 Å²	73	88.7 Å²	88.7	34%	0.341	46%	0.461	S	S	.	.	H	α-helix	trans	-58.1	-37.6	174.5	-78.3	170.6	67.3	0	0	113.5	D596 N604	D596-Q600 WeakPolarHBondContact O-CB 3.25Å; D596-Q600 WeakPolarHBondContact O-CG 3.35Å; D596-Q600 PolarHBondContact O-N 2.91Å; D596-Q600 VanDerWaalsContact O-N 3.16Å; D596-Q600 PolarHBondContact O-NE2 3.37Å; Q600-N604 WeakPolarHBondContact O-CB 3.21Å; Q600-N604 PolarHBondContact O-N 3.11Å; Q600-N604 PolarHBondContact O-ND2 3.07Å
601	Q	58	Low	67.9	Low	134 Å²	134	87.9 Å²	87.9	63%	0.626	46%	0.463	S	S	*	.	H	α-helix	trans	-63.1	-49.7	172.8	-76	178.7	-33.7	0	0	110.7	A597 S598 E599 E603 N604 D605	A597-Q601 PolarHBondContact O-N 3.12Å; A597-Q601 VanDerWaalsContact O-N 3.09Å; S598-Q601 PolarHBondContact O-N 3.47Å; E599-Q601 VanDerWaalsContact C-N 3.32Å; E599-Q601 PolarHBondContact O-N 3.07Å; Q601-E603 VanDerWaalsContact C-N 3.31Å; Q601-E603 PolarHBondContact O-N 2.78Å; Q601-N604 PolarHBondContact O-N 3.48Å; Q601-D605 PolarHBondContact O-N 2.85Å
602	S	59.1	Low	67	Low	55 Å²	55	84.5 Å²	84.5	39%	0.385	45%	0.453	S	S	.	.	H	α-helix	trans	-62.6	-32.4	179.5	79.3	0	0	0	0	114	S598 E599 Q606	S598-S602 PolarHBondContact O-N 3.49Å; S598-S602 VanDerWaalsContact O-N 3.07Å; E599-S602 CarbonylContact O-C 3.55Å; E599-S602 PolarHBondContact O-N 3.08Å; E599-S602 VanDerWaalsContact O-N 3.07Å; E599-S602 PolarHBondContact O-OG 3.38Å; S602-Q606 WeakPolarHBondContact O-CB 2.92Å; S602-Q606 VanDerWaalsContact O-CG 3.29Å; S602-Q606 WeakPolarHBondContact O-CG 3.39Å; S602-Q606 PolarHBondContact O-N 2.84Å; S602-Q606 PolarHBondContact O-NE2 3.05Å
603	E	58.1	Low	66.4	Low	110 Å²	110	82.8 Å²	82.8	51%	0.514	45%	0.448	S	S	.	.	H	α-helix	trans	-73.9	-44.3	174.9	-73.6	-164.1	145.3	0	0	112.1	E599 Q601 D605 Q606 Q607	E599-E603 PolarHBondContact O-N 3.47Å; Q601-E603 VanDerWaalsContact C-N 3.31Å; Q601-E603 PolarHBondContact O-N 2.78Å; E603-D605 VanDerWaalsContact C-N 3.32Å; E603-D605 PolarHBondContact O-N 3Å; E603-Q606 PolarHBondContact O-N 2.92Å; E603-Q607 WeakPolarHBondContact O-CB 3.3Å; E603-Q607 VanDerWaalsContact O-CG 3.3Å; E603-Q607 WeakPolarHBondContact O-CG 3.46Å; E603-Q607 PolarHBondContact O-N 3.45Å
604	N	59.5	Low	65.7	Low	62 Å²	62	87.1 Å²	87.1	33%	0.332	47%	0.467	S	S	.	.	H	α-helix	trans	-64.5	-37.6	177.3	-73.4	-63.2	0	0	0	110.9	K465 Q600 Q601 Q607 N608	K465-N604 PolarHBondContact NZ-OD1 3.38Å; Q600-N604 WeakPolarHBondContact O-CB 3.21Å; Q600-N604 PolarHBondContact O-N 3.11Å; Q600-N604 PolarHBondContact O-ND2 3.07Å; Q601-N604 PolarHBondContact O-N 3.48Å; N604-Q607 PolarHBondContact O-N 3.32Å; N604-N608 VanDerWaalsContact O-CB 3.24Å; N604-N608 WeakPolarHBondContact O-CB 3.18Å; N604-N608 PolarHBondContact O-N 3.06Å; N604-N608 PolarHBondContact O-ND2 2.95Å; N604-N608 VanDerWaalsContact O-ND2 3.07Å
605	D	63.2	Low	65.3	Low	112 Å²	112	88.4 Å²	88.4	60%	0.599	47%	0.468	S	S	*	.	H	α-helix	trans	-64.7	-43.1	175	-74.1	-21.6	0	0	0	112.1	Q601 E603 N608 A609	Q601-D605 PolarHBondContact O-N 2.85Å; E603-D605 VanDerWaalsContact C-N 3.32Å; E603-D605 PolarHBondContact O-N 3Å; D605-N608 PolarHBondContact O-N 2.64Å; D605-A609 WeakPolarHBondContact O-CB 3.37Å; D605-A609 PolarHBondContact O-N 3.27Å
606	Q	64.1	Low	65.1	Low	123 Å²	123	87.8 Å²	87.8	58%	0.575	46%	0.464	S	S	*	.	H	α-helix	trans	-64.9	-42.7	174.2	-76.6	172.4	84.8	0	0	112.4	S602 E603 A609 V610	S602-Q606 WeakPolarHBondContact O-CB 2.92Å; S602-Q606 VanDerWaalsContact O-CG 3.29Å; S602-Q606 WeakPolarHBondContact O-CG 3.39Å; S602-Q606 PolarHBondContact O-N 2.84Å; S602-Q606 PolarHBondContact O-NE2 3.05Å; E603-Q606 PolarHBondContact O-N 2.92Å; Q606-A609 PolarHBondContact O-N 3.15Å; Q606-V610 WeakPolarHBondContact O-CG2 3.38Å; Q606-V610 PolarHBondContact O-N 2.68Å
607	Q	58.3	Low	65.2	Low	93 Å²	93	89.8 Å²	89.8	44%	0.435	47%	0.469	S	S	.	.	H	α-helix	trans	-64.5	-43.8	176.4	-73.2	176.4	11.5	0	0	111.2	E603 N604 A609 V610 I611	E603-Q607 WeakPolarHBondContact O-CB 3.3Å; E603-Q607 VanDerWaalsContact O-CG 3.3Å; E603-Q607 WeakPolarHBondContact O-CG 3.46Å; E603-Q607 PolarHBondContact O-N 3.45Å; N604-Q607 PolarHBondContact O-N 3.32Å; Q607-A609 PolarHBondContact O-N 2.93Å; Q607-V610 PolarHBondContact O-N 3.48Å; Q607-I611 WeakPolarHBondContact O-CB 3.19Å; Q607-I611 WeakPolarHBondContact O-CD1 3.39Å; Q607-I611 WeakPolarHBondContact O-CG1 3.31Å; Q607-I611 PolarHBondContact O-N 3.46Å
608	N	63.3	Low	65.6	Low	99 Å²	99	92.1 Å²	92.1	53%	0.529	48%	0.475	S	S	.	.	H	α-helix	trans	-62.4	-41.7	175	-77.3	-36.3	0	0	0	112	N604 D605 I611 S612	N604-N608 VanDerWaalsContact O-CB 3.24Å; N604-N608 WeakPolarHBondContact O-CB 3.18Å; N604-N608 PolarHBondContact O-N 3.06Å; N604-N608 PolarHBondContact O-ND2 2.95Å; N604-N608 VanDerWaalsContact O-ND2 3.07Å; D605-N608 PolarHBondContact O-N 2.64Å; N608-I611 PolarHBondContact O-N 3.2Å; N608-S612 VanDerWaalsContact O-CB 3.28Å; N608-S612 WeakPolarHBondContact O-CB 3.49Å; N608-S612 PolarHBondContact O-N 3.34Å; N608-S612 PolarHBondContact O-OG 2.93Å
609	A	67.4	Low	66.2	Low	50 Å²	50	94.6 Å²	94.6	41%	0.413	48%	0.482	S	S	.	.	H	α-helix	trans	-59.3	-50.9	173.5	0	0	0	0	0	111.3	D605 Q606 Q607 I611 S612 E613	D605-A609 WeakPolarHBondContact O-CB 3.37Å; D605-A609 PolarHBondContact O-N 3.27Å; Q606-A609 PolarHBondContact O-N 3.15Å; Q607-A609 PolarHBondContact O-N 2.93Å; A609-I611 PolarHBondContact O-N 3.24Å; A609-S612 PolarHBondContact O-N 3.3Å; A609-S612 PolarHBondContact O-OG 3.16Å; A609-E613 PolarHBondContact O-N 3.41Å
610	V	69.7	Low	66.9	Low	78 Å²	78	96.5 Å²	96.5	47%	0.473	48%	0.484	S	S	.	.	H	α-helix	trans	-62.1	-43.7	178.8	171.2	0	0	0	0	112.1	Q606 Q607 E613 Q614	Q606-V610 WeakPolarHBondContact O-CG2 3.38Å; Q606-V610 PolarHBondContact O-N 2.68Å; Q607-V610 PolarHBondContact O-N 3.48Å; V610-E613 PolarHBondContact O-N 3.06Å; V610-Q614 HydrophobicContact CG1-CG 4.43Å; V610-Q614 WeakPolarHBondContact O-CB 3.44Å; V610-Q614 VanDerWaalsContact O-CG 3.3Å; V610-Q614 WeakPolarHBondContact O-CG 3.24Å; V610-Q614 PolarHBondContact O-N 3.26Å
611	I	65.6	Low	67.8	Low	76 Å²	76	95.3 Å²	95.3	39%	0.39	49%	0.487	S	S	.	.	H	α-helix	trans	-64.9	-39.9	177.2	-69.3	164.4	0	0	0	110.7	Q607 N608 A609 Q614 K615	Q607-I611 WeakPolarHBondContact O-CB 3.19Å; Q607-I611 WeakPolarHBondContact O-CD1 3.39Å; Q607-I611 WeakPolarHBondContact O-CG1 3.31Å; Q607-I611 PolarHBondContact O-N 3.46Å; N608-I611 PolarHBondContact O-N 3.2Å; A609-I611 PolarHBondContact O-N 3.24Å; I611-Q614 PolarHBondContact O-N 3.18Å; I611-K615 HydrophobicContact CG2-CD 4.15Å; I611-K615 WeakPolarHBondContact O-CB 3.36Å; I611-K615 WeakPolarHBondContact O-CG 3.32Å; I611-K615 PolarHBondContact O-N 3.01Å
612	S	67.9	Low	68.8	Low	56 Å²	56	93.9 Å²	93.9	39%	0.392	48%	0.484	S	S	.	.	H	α-helix	trans	-64.3	-43.7	175.4	80.2	0	0	0	0	111.4	N608 A609 Q614 K615 I616	N608-S612 VanDerWaalsContact O-CB 3.28Å; N608-S612 WeakPolarHBondContact O-CB 3.49Å; N608-S612 PolarHBondContact O-N 3.34Å; N608-S612 PolarHBondContact O-OG 2.93Å; A609-S612 PolarHBondContact O-N 3.3Å; A609-S612 PolarHBondContact O-OG 3.16Å; S612-Q614 PolarHBondContact O-N 3.38Å; S612-K615 PolarHBondContact O-N 3.49Å; S612-I616 WeakPolarHBondContact O-CB 3.49Å; S612-I616 WeakPolarHBondContact O-CD1 3.14Å; S612-I616 WeakPolarHBondContact O-CG1 3.2Å; S612-I616 PolarHBondContact O-N 3.23Å
613	E	70.4	Confident	69.9	Low	108 Å²	108	99.3 Å²	99.3	51%	0.505	50%	0.495	S	S	.	.	H	α-helix	trans	-62.1	-42.6	174.6	-84.1	-155.8	-172.5	0	0	112.1	A609 V610 I616 K617	A609-E613 PolarHBondContact O-N 3.41Å; V610-E613 PolarHBondContact O-N 3.06Å; E613-I616 PolarHBondContact O-N 3.47Å; E613-K617 WeakPolarHBondContact O-CB 3.21Å; E613-K617 WeakPolarHBondContact O-CD 3.44Å; E613-K617 WeakPolarHBondContact O-CG 3.33Å; E613-K617 PolarHBondContact O-N 3.05Å; E613-K617 WeakPolarHBondContact OE2-CE 3.49Å; E613-K617 IonicContact OE2-NZ 3.57Å; E613-K617 PolarHBondContact OE2-NZ 2.91Å
614	Q	67.5	Low	71	Confident	106 Å²	106	97.3 Å²	97.3	50%	0.495	49%	0.489	S	S	.	.	H	α-helix	trans	-64.4	-46.6	177.5	-74.9	176.3	1	0	0	111.3	V610 I611 S612 I616 K617 N618	V610-Q614 HydrophobicContact CG1-CG 4.43Å; V610-Q614 WeakPolarHBondContact O-CB 3.44Å; V610-Q614 VanDerWaalsContact O-CG 3.3Å; V610-Q614 WeakPolarHBondContact O-CG 3.24Å; V610-Q614 PolarHBondContact O-N 3.26Å; I611-Q614 PolarHBondContact O-N 3.18Å; S612-Q614 PolarHBondContact O-N 3.38Å; Q614-I616 VanDerWaalsContact C-N 3.32Å; Q614-I616 PolarHBondContact O-N 3.49Å; Q614-K617 PolarHBondContact O-N 3.18Å; Q614-K617 VanDerWaalsContact O-N 3.16Å; Q614-N618 WeakPolarHBondContact O-CB 3.47Å; Q614-N618 PolarHBondContact O-N 2.98Å; Q614-N618 PolarHBondContact O-OD1 3.41Å
615	K	73.1	Confident	72	Confident	136 Å²	136	96.5 Å²	96.5	59%	0.591	49%	0.49	S	S	*	.	H	α-helix	trans	-57	-45	173.2	-74.4	176.5	178.5	179	0	111.4	I611 S612 K617 N618 I619	I611-K615 HydrophobicContact CG2-CD 4.15Å; I611-K615 WeakPolarHBondContact O-CB 3.36Å; I611-K615 WeakPolarHBondContact O-CG 3.32Å; I611-K615 PolarHBondContact O-N 3.01Å; S612-K615 PolarHBondContact O-N 3.49Å; K615-K617 PolarHBondContact O-N 3.16Å; K615-N618 PolarHBondContact O-N 3.02Å; K615-I619 WeakPolarHBondContact O-CB 3.4Å; K615-I619 WeakPolarHBondContact O-CD1 3.16Å; K615-I619 VanDerWaalsContact O-CG1 3.23Å; K615-I619 WeakPolarHBondContact O-CG1 3.3Å; K615-I619 PolarHBondContact O-N 3.12Å
616	I	75.6	Confident	72.8	Confident	77 Å²	77	96.5 Å²	96.5	40%	0.395	49%	0.49	S	S	.	.	H	α-helix	trans	-64.1	-39.7	176.6	-70.5	165	0	0	0	111.9	S612 E613 Q614 R620	S612-I616 WeakPolarHBondContact O-CB 3.49Å; S612-I616 WeakPolarHBondContact O-CD1 3.14Å; S612-I616 WeakPolarHBondContact O-CG1 3.2Å; S612-I616 PolarHBondContact O-N 3.23Å; E613-I616 PolarHBondContact O-N 3.47Å; Q614-I616 VanDerWaalsContact C-N 3.32Å; Q614-I616 PolarHBondContact O-N 3.49Å; I616-R620 WeakPolarHBondContact O-CB 3.44Å; I616-R620 WeakPolarHBondContact O-CD 3.2Å; I616-R620 WeakPolarHBondContact O-CG 3.43Å; I616-R620 PolarHBondContact O-N 3.4Å; I616-R620 VanDerWaalsContact O-N 3.1Å
617	K	75.2	Confident	73.5	Confident	106 Å²	106	97.5 Å²	97.5	46%	0.461	49%	0.492	S	S	.	.	H	α-helix	trans	-65.9	-42.8	176.4	-73.4	160	-168.9	169.3	0	111.3	E613 Q614 K615 R620 A621	E613-K617 WeakPolarHBondContact O-CB 3.21Å; E613-K617 WeakPolarHBondContact O-CD 3.44Å; E613-K617 WeakPolarHBondContact O-CG 3.33Å; E613-K617 PolarHBondContact O-N 3.05Å; E613-K617 WeakPolarHBondContact OE2-CE 3.49Å; E613-K617 IonicContact OE2-NZ 3.57Å; E613-K617 PolarHBondContact OE2-NZ 2.91Å; Q614-K617 PolarHBondContact O-N 3.18Å; Q614-K617 VanDerWaalsContact O-N 3.16Å; K615-K617 PolarHBondContact O-N 3.16Å; K617-R620 PolarHBondContact O-N 3.02Å; K617-A621 PolarHBondContact O-N 2.89Å
618	N	76.2	Confident	74.5	Confident	99 Å²	99	100.8 Å²	100.8	53%	0.529	50%	0.5	S	S	.	.	H	α-helix	trans	-65.8	-51.6	178.3	-65.8	1.1	0	0	0	111.2	Q614 K615 R620 A621 D622	Q614-N618 WeakPolarHBondContact O-CB 3.47Å; Q614-N618 PolarHBondContact O-N 2.98Å; Q614-N618 PolarHBondContact O-OD1 3.41Å; K615-N618 PolarHBondContact O-N 3.02Å; N618-R620 PolarHBondContact O-N 3.39Å; N618-R620 VanDerWaalsContact O-N 3.16Å; N618-A621 CarbonylContact O-C 3.6Å; N618-A621 WeakPolarHBondContact O-CA 3.4Å; N618-A621 WeakPolarHBondContact O-CB 3.35Å; N618-A621 PolarHBondContact O-N 3.48Å; N618-D622 PolarHBondContact O-N 3.24Å
619	I	76	Confident	75.1	Confident	115 Å²	115	99.8 Å²	99.8	59%	0.59	50%	0.502	S	S	*	.	H	α-helix	trans	-56.3	-37.4	176.4	-67.2	163.7	0	0	0	111.5	K615 R623	K615-I619 WeakPolarHBondContact O-CB 3.4Å; K615-I619 WeakPolarHBondContact O-CD1 3.16Å; K615-I619 VanDerWaalsContact O-CG1 3.23Å; K615-I619 WeakPolarHBondContact O-CG1 3.3Å; K615-I619 PolarHBondContact O-N 3.12Å; I619-R623 VanDerWaalsContact O-CB 3.28Å; I619-R623 WeakPolarHBondContact O-CB 3.49Å; I619-R623 PolarHBondContact O-N 3Å; I619-R623 VanDerWaalsContact O-N 3.07Å
620	R	78.7	Confident	75.5	Confident	159 Å²	159	102.7 Å²	102.7	60%	0.6	51%	0.509	S	S	*	.	H	α-helix	trans	-67	-39.9	173	-73.9	168.4	-177.1	175.9	4.3	112.3	I616 K617 N618 N624	I616-R620 WeakPolarHBondContact O-CB 3.44Å; I616-R620 WeakPolarHBondContact O-CD 3.2Å; I616-R620 WeakPolarHBondContact O-CG 3.43Å; I616-R620 PolarHBondContact O-N 3.4Å; I616-R620 VanDerWaalsContact O-N 3.1Å; K617-R620 PolarHBondContact O-N 3.02Å; N618-R620 PolarHBondContact O-N 3.39Å; N618-R620 VanDerWaalsContact O-N 3.16Å; R620-N624 WeakPolarHBondContact O-CB 3.32Å; R620-N624 PolarHBondContact O-N 2.93Å; R620-N624 VanDerWaalsContact O-N 3.14Å; R620-N624 PolarHBondContact O-ND2 3.06Å; R620-N624 VanDerWaalsContact O-ND2 3.15Å
621	A	77.5	Confident	75.8	Confident	48 Å²	48	103.7 Å²	103.7	40%	0.397	51%	0.509	S	S	.	.	H	α-helix	trans	-65.5	-47.3	177	0	0	0	0	0	111.7	K617 N618 N624 A625	K617-A621 PolarHBondContact O-N 2.89Å; N618-A621 CarbonylContact O-C 3.6Å; N618-A621 WeakPolarHBondContact O-CA 3.4Å; N618-A621 WeakPolarHBondContact O-CB 3.35Å; N618-A621 PolarHBondContact O-N 3.48Å; A621-N624 CarbonylContact O-C 3.59Å; A621-N624 WeakPolarHBondContact O-CA 3.43Å; A621-N624 WeakPolarHBondContact O-CB 3.35Å; A621-N624 PolarHBondContact O-N 3.35Å; A621-N624 VanDerWaalsContact O-N 3.11Å; A621-A625 PolarHBondContact O-N 2.63Å
622	D	78.6	Confident	76	Confident	104 Å²	104	104.7 Å²	104.7	56%	0.556	52%	0.515	S	S	*	.	H	α-helix	trans	-62.6	-48.2	179.7	-61.9	-33	0	0	0	111.2	N618 N624 A625 L626	N618-D622 PolarHBondContact O-N 3.24Å; D622-N624 PolarHBondContact O-N 3Å; D622-A625 WeakPolarHBondContact O-CA 3.35Å; D622-A625 WeakPolarHBondContact O-CB 3.38Å; D622-A625 PolarHBondContact O-N 3.38Å; D622-L626 WeakPolarHBondContact O-CB 3.39Å; D622-L626 PolarHBondContact O-N 3.37Å
623	R	80.9	Confident	75.8	Confident	168 Å²	168	107.2 Å²	107.2	63%	0.634	52%	0.521	S	S	*	.	H	α-helix	trans	-58.1	-35	174.4	-164.1	-161.3	70.8	148.1	2.4	112	I619 K627	I619-R623 VanDerWaalsContact O-CB 3.28Å; I619-R623 WeakPolarHBondContact O-CB 3.49Å; I619-R623 PolarHBondContact O-N 3Å; I619-R623 VanDerWaalsContact O-N 3.07Å; R623-K627 VanDerWaalsContact O-CB 3.32Å; R623-K627 WeakPolarHBondContact O-CB 3.37Å; R623-K627 PolarHBondContact O-N 2.83Å
624	N	81.9	Confident	75.4	Confident	69 Å²	69	104.4 Å²	104.4	37%	0.369	52%	0.516	S	S	.	.	H	α-helix	trans	-78.3	-27	176.6	-69.2	-15.1	0	0	0	112.7	R620 A621 D622 R628	R620-N624 WeakPolarHBondContact O-CB 3.32Å; R620-N624 PolarHBondContact O-N 2.93Å; R620-N624 VanDerWaalsContact O-N 3.14Å; R620-N624 PolarHBondContact O-ND2 3.06Å; R620-N624 VanDerWaalsContact O-ND2 3.15Å; A621-N624 CarbonylContact O-C 3.59Å; A621-N624 WeakPolarHBondContact O-CA 3.43Å; A621-N624 WeakPolarHBondContact O-CB 3.35Å; A621-N624 PolarHBondContact O-N 3.35Å; A621-N624 VanDerWaalsContact O-N 3.11Å; D622-N624 PolarHBondContact O-N 3Å; N624-R628 WeakPolarHBondContact O-CG 3.48Å; N624-R628 PolarHBondContact O-N 3.33Å; N624-R628 PolarHBondContact O-NE 2.97Å
625	A	81.2	Confident	75.1	Confident	45 Å²	45	106.8 Å²	106.8	37%	0.372	52%	0.52	S	S	.	.	H	α-helix	trans	-69.8	-48.9	168.9	0	0	0	0	0	111	A621 D622 K627 R628 S629	A621-A625 PolarHBondContact O-N 2.63Å; D622-A625 WeakPolarHBondContact O-CA 3.35Å; D622-A625 WeakPolarHBondContact O-CB 3.38Å; D622-A625 PolarHBondContact O-N 3.38Å; A625-K627 VanDerWaalsContact C-N 3.35Å; A625-K627 PolarHBondContact O-N 3.47Å; A625-R628 WeakPolarHBondContact O-CA 3.36Å; A625-R628 WeakPolarHBondContact O-CB 3.46Å; A625-R628 PolarHBondContact O-N 2.94Å; A625-S629 PolarHBondContact O-N 3.16Å
626	L	78.6	Confident	74.3	Confident	111 Å²	111	104.4 Å²	104.4	58%	0.581	52%	0.517	S	S	*	.	H	α-helix	trans	-58.5	-44.7	177.2	-152.2	168.8	0	0	0	111	D622 R628 S629 L630	D622-L626 WeakPolarHBondContact O-CB 3.39Å; D622-L626 PolarHBondContact O-N 3.37Å; L626-R628 VanDerWaalsContact C-N 3.31Å; L626-R628 PolarHBondContact O-N 3.36Å; L626-S629 WeakPolarHBondContact O-CB 3.29Å; L626-S629 PolarHBondContact O-N 3.48Å; L626-L630 HydrophobicContact CD2-CD1 3.87Å; L626-L630 HydrophobicContact CD2-CG 4.45Å; L626-L630 PolarHBondContact O-N 3.37Å
627	K	80.5	Confident	73.2	Confident	144 Å²	144	105.1 Å²	105.1	63%	0.626	52%	0.521	S	S	*	.	H	α-helix	trans	-60.5	-34.9	174.1	-171.4	173.9	-177.6	178.8	0	113.4	R623 A625 Q631	R623-K627 VanDerWaalsContact O-CB 3.32Å; R623-K627 WeakPolarHBondContact O-CB 3.37Å; R623-K627 PolarHBondContact O-N 2.83Å; A625-K627 VanDerWaalsContact C-N 3.35Å; A625-K627 PolarHBondContact O-N 3.47Å; K627-Q631 WeakPolarHBondContact O-CB 3.39Å; K627-Q631 PolarHBondContact O-N 2.98Å; K627-Q631 VanDerWaalsContact O-N 3.13Å
628	R	77.9	Confident	72.1	Confident	162 Å²	162	110 Å²	110	61%	0.611	54%	0.538	S	S	*	.	H	α-helix	trans	-71.1	-40.4	174.4	-76.8	174.6	-72.6	179.4	3.3	111.7	N624 A625 L626 Q631 N632	N624-R628 WeakPolarHBondContact O-CG 3.48Å; N624-R628 PolarHBondContact O-N 3.33Å; N624-R628 PolarHBondContact O-NE 2.97Å; A625-R628 WeakPolarHBondContact O-CA 3.36Å; A625-R628 WeakPolarHBondContact O-CB 3.46Å; A625-R628 PolarHBondContact O-N 2.94Å; L626-R628 VanDerWaalsContact C-N 3.31Å; L626-R628 PolarHBondContact O-N 3.36Å; R628-Q631 PolarHBondContact O-N 3.29Å; R628-N632 PolarHBondContact O-N 3.49Å; R628-N632 VanDerWaalsContact O-N 3.12Å
629	S	77.4	Confident	70.9	Confident	79 Å²	79	111 Å²	111	55%	0.552	55%	0.548	S	S	*	.	H	α-helix	trans	-61.1	-50.7	174.9	-170.9	0	0	0	0	111.7	A625 L626 Q631 N632 H633	A625-S629 PolarHBondContact O-N 3.16Å; L626-S629 WeakPolarHBondContact O-CB 3.29Å; L626-S629 PolarHBondContact O-N 3.48Å; S629-Q631 VanDerWaalsContact C-N 3.31Å; S629-Q631 PolarHBondContact O-N 3.14Å; S629-N632 PolarHBondContact O-N 2.98Å; S629-H633 PolarHBondContact O-N 2.94Å
630	L	75.8	Confident	69.6	Low	110 Å²	110	109.4 Å²	109.4	58%	0.576	55%	0.547	S	S	*	.	H	α-helix	trans	-56.6	-42	175.3	-105	166.7	0	0	0	112.6	L626 N632 H633 A634	L626-L630 HydrophobicContact CD2-CD1 3.87Å; L626-L630 HydrophobicContact CD2-CG 4.45Å; L626-L630 PolarHBondContact O-N 3.37Å; L630-N632 VanDerWaalsContact C-N 3.28Å; L630-N632 PolarHBondContact O-N 3.49Å; L630-H633 PolarHBondContact O-N 3.1Å; L630-A634 WeakPolarHBondContact O-CB 3.31Å; L630-A634 PolarHBondContact O-N 3.43Å
631	Q	74.5	Confident	68.1	Low	100 Å²	100	109.9 Å²	109.9	47%	0.467	56%	0.556	S	S	.	*	H	α-helix	trans	-65.4	-30.3	178.1	-174.2	60.8	87.1	0	0	113.1	K627 R628 S629 R635	K627-Q631 WeakPolarHBondContact O-CB 3.39Å; K627-Q631 PolarHBondContact O-N 2.98Å; K627-Q631 VanDerWaalsContact O-N 3.13Å; R628-Q631 PolarHBondContact O-N 3.29Å; S629-Q631 VanDerWaalsContact C-N 3.31Å; S629-Q631 PolarHBondContact O-N 3.14Å; Q631-R635 WeakPolarHBondContact O-CG 3.29Å
632	N	69.7	Low	66.4	Low	97 Å²	97	116.7 Å²	116.7	52%	0.519	58%	0.577	S	S	.	*	H	α-helix	trans	-78.8	-41.9	174.6	-71.1	-12.5	0	0	0	111.5	R628 S629 L630 A634 R635 T636	R628-N632 PolarHBondContact O-N 3.49Å; R628-N632 VanDerWaalsContact O-N 3.12Å; S629-N632 PolarHBondContact O-N 2.98Å; L630-N632 VanDerWaalsContact C-N 3.28Å; L630-N632 PolarHBondContact O-N 3.49Å; N632-A634 PolarHBondContact O-N 3.15Å; N632-R635 WeakPolarHBondContact O-CB 3.44Å; N632-R635 PolarHBondContact O-N 3.41Å; N632-T636 PolarHBondContact O-N 2.93Å
633	H	64.2	Low	64.5	Low	109 Å²	109	121.5 Å²	121.5	51%	0.505	59%	0.592	S	S	.	*	H	α-helix	trans	-66.6	-36.8	178.2	-162.3	-10.4	0	0	0	112.3	S629 L630 R635 T636 L637	S629-H633 PolarHBondContact O-N 2.94Å; L630-H633 PolarHBondContact O-N 3.1Å; H633-R635 PolarHBondContact O-N 3.04Å; H633-T636 WeakPolarHBondContact CA-OG1 3.44Å; H633-T636 PolarHBondContact ND1-OG1 2.91Å; H633-T636 PolarHBondContact O-N 3.41Å; H633-T636 PolarHBondContact O-OG1 3.12Å; H633-L637 WeakPolarHBondContact O-CG 3.5Å; H633-L637 PolarHBondContact O-N 2.93Å; H633-L637 VanDerWaalsContact O-N 3.07Å
634	A	62.9	Low	62.2	Low	49 Å²	49	120.6 Å²	120.6	41%	0.405	60%	0.599	S	S	.	*	H	α-helix	trans	-62	-31.4	171.3	0	0	0	0	0	112.5	L630 N632 Y638	L630-A634 WeakPolarHBondContact O-CB 3.31Å; L630-A634 PolarHBondContact O-N 3.43Å; N632-A634 PolarHBondContact O-N 3.15Å; A634-Y638 PolarHBondContact O-N 3.21Å
635	R	59.9	Low	60.3	Low	155 Å²	155	125.9 Å²	125.9	59%	0.585	62%	0.621	S	S	*	*	H	α-helix	trans	-74.5	-41.2	174.8	-78	173.3	171.7	151.8	-4.2	112.5	Q631 N632 H633 Y638 V639	Q631-R635 WeakPolarHBondContact O-CG 3.29Å; N632-R635 WeakPolarHBondContact O-CB 3.44Å; N632-R635 PolarHBondContact O-N 3.41Å; H633-R635 PolarHBondContact O-N 3.04Å; R635-Y638 PolarHBondContact O-N 3.1Å; R635-V639 WeakPolarHBondContact O-CG2 3.44Å; R635-V639 PolarHBondContact O-N 3.44Å
636	T	57.3	Low	58.3	Low	86 Å²	86	130.7 Å²	130.7	53%	0.528	64%	0.639	S	S	.	*	H	α-helix	trans	-65.6	-40.7	177.9	51	0	0	0	0	111.7	N632 H633 Y638 V639 S640	N632-T636 PolarHBondContact O-N 2.93Å; H633-T636 WeakPolarHBondContact CA-OG1 3.44Å; H633-T636 PolarHBondContact ND1-OG1 2.91Å; H633-T636 PolarHBondContact O-N 3.41Å; H633-T636 PolarHBondContact O-OG1 3.12Å; T636-Y638 VanDerWaalsContact C-N 3.29Å; T636-Y638 PolarHBondContact O-N 3.42Å; T636-V639 PolarHBondContact O-N 3.2Å; T636-V639 VanDerWaalsContact O-N 3.14Å; T636-S640 PolarHBondContact O-N 2.98Å; T636-S640 PolarHBondContact O-OG 3.12Å
637	L	52.8	Low	56.7	Low	93 Å²	93	131 Å²	131	49%	0.487	64%	0.642	S	S	.	*	H	α-helix	trans	-63.9	-29.9	175.6	-69.7	171.9	0	0	0	113.5	H633 V639	H633-L637 WeakPolarHBondContact O-CG 3.5Å; H633-L637 PolarHBondContact O-N 2.93Å; H633-L637 VanDerWaalsContact O-N 3.07Å; L637-V639 VanDerWaalsContact C-N 3.33Å
638	Y	50.6	Low	55.4	Low	208 Å²	208	132.5 Å²	132.5	82%	0.816	65%	0.648	S	S	*	*	H	α-helix	trans	-80.1	-13.3	176.3	-130.5	-86.4	0	0	0	113.9	A634 R635 T636	A634-Y638 PolarHBondContact O-N 3.21Å; R635-Y638 PolarHBondContact O-N 3.1Å; T636-Y638 VanDerWaalsContact C-N 3.29Å; T636-Y638 PolarHBondContact O-N 3.42Å
639	V	52.6	Low	53.9	Low	120 Å²	120	130.7 Å²	130.7	73%	0.727	66%	0.657	S	S	*	*	H	α-helix	trans	-102.1	-27.5	-178.8	172.6	0	0	0	0	111.9	R635 T636 L637	R635-V639 WeakPolarHBondContact O-CG2 3.44Å; R635-V639 PolarHBondContact O-N 3.44Å; T636-V639 PolarHBondContact O-N 3.2Å; T636-V639 VanDerWaalsContact O-N 3.14Å; L637-V639 VanDerWaalsContact C-N 3.33Å
640	S	48.9	Very low	51.8	Low	81 Å²	81	135 Å²	135	57%	0.566	67%	0.666	S	S	*	*	H	α-helix	trans	-79.4	-18.2	-177	57.7	0	0	0	0	115.3	T636 K642	T636-S640 PolarHBondContact O-N 2.98Å; T636-S640 PolarHBondContact O-OG 3.12Å; S640-K642 PolarHBondContact O-N 2.76Å
641	Q	45.3	Very low	50.5	Low	170 Å²	170	137.2 Å²	137.2	79%	0.794	67%	0.673	S	S	*	*	S	Bend	trans	-73.8	31.5	-176.8	-67.5	-175	-5	0	0	115
642	K	42	Very low	49.3	Very low	191 Å²	191	137.8 Å²	137.8	83%	0.83	68%	0.684	S	S	*	*	S	Bend	trans	-141.3	42.1	-175.5	-150.3	178.3	179.5	176.4	0	116.5	S640	S640-K642 PolarHBondContact O-N 2.76Å
643	K	39	Very low	48.3	Very low	204 Å²	204	142.4 Å²	142.4	89%	0.887	70%	0.702	S	S	*	*			trans	-164.9	145.1	145.8	-114.7	-179.1	176.9	-165.8	0	111.5
644	I	33	Very low	47.2	Very low	150 Å²	150	142.5 Å²	142.5	77%	0.769	71%	0.706	S	S	*	*			trans	-141.3	132.9	177.5	-59.9	172.8	0	0	0	107
645	E	41.8	Very low	46.6	Very low	179 Å²	179	147.5 Å²	147.5	84%	0.836	73%	0.726	S	S	*	*			trans	159.4	103.2	163.2	-92.6	155	-167.4	0	0	106.2
646	I	38.9	Very low	46	Very low	147 Å²	147	145.5 Å²	145.5	75%	0.754	73%	0.727	S	S	*	*				67.1	102.3	81.1	-60.1	163.2	0	0	0	112.5
647	D	45.6	Very low	45.7	Very low	118 Å²	118	147.9 Å²	147.9	63%	0.631	74%	0.737	S	S	*	*				-173.4	138.2	100	-143.1	0.2	0	0	0	114.8
648	K	52.3	Low	45.5	Very low	174 Å²	174	150 Å²	150	76%	0.757	75%	0.748	S	S	*	*			trans	49	150.4	157.9	-75.1	160.9	-164.2	101.8	0	126.3
649	P	48.1	Very low	45.5	Very low	124 Å²	124	146 Å²	146	81%	0.805	74%	0.741	S	S	*	*			trans	-119	178.1	179.7	44.9	-34.2	0	0	0	115.5
650	F	32.9	Very low	45.2	Very low	171 Å²	171	146 Å²	146	75%	0.75	74%	0.738	S	S	*	*			trans	-160.4	121.5	156.9	-169.1	-112.1	0	0	0	115.1
651	E	47.9	Very low	44.7	Very low	155 Å²	155	148.7 Å²	148.7	72%	0.724	75%	0.745	S	S	*	*			trans	50.9	171.2	151.8	-77.3	174.4	-152.7	0	0	124.9
652	V	48.8	Very low	44.7	Very low	113 Å²	113	148.1 Å²	148.1	69%	0.685	75%	0.748	S	S	*	*			trans	-156	150.5	-150.7	171.7	0	0	0	0	108.2	N654	V652-N654 WeakPolarHBondContact CG1-OD1 3.43Å
653	E	50.3	Low	44.5	Very low	194 Å²	194	145.6 Å²	145.6	91%	0.907	74%	0.743	S	S	*	*			trans	-129.1	146.9	155.1	-68.9	-173.6	152.3	0	0	109.1
654	N	40.2	Very low	44.5	Very low	110 Å²	110	139.7 Å²	139.7	59%	0.588	74%	0.741	S	S	*	*			trans	-102.2	-175.5	-172.5	-66.1	-9.7	0	0	0	111.5	V652	V652-N654 WeakPolarHBondContact CG1-OD1 3.43Å
655	D	50.1	Low	44.6	Very low	155 Å²	155	139.6 Å²	139.6	83%	0.829	74%	0.742	S	S	*	*				179.6	88.6	121.5	-85.7	-8.3	0	0	0	108.5
656	D	47.9	Very low	44.5	Very low	112 Å²	112	137.6 Å²	137.6	60%	0.599	74%	0.742	S	S	*	*				35.9	132.1	108	-50.7	-4.3	0	0	0	115.7
657	D	50.5	Low	44.3	Very low	137 Å²	137	137 Å²	137	73%	0.733	74%	0.74	S	S	*	*			cis	-166	173.7	43.3	-96	-40.6	0	0	0	113.3
658	D	48.7	Very low	43.7	Very low	136 Å²	136	136.2 Å²	136.2	73%	0.727	74%	0.739	S	S	*	*			trans	64.5	133.7	145	-72.9	1.9	0	0	0	122.4
659	D	50.8	Low	42.8	Very low	124 Å²	124	134.6 Å²	134.6	66%	0.663	74%	0.739	S	S	*	*			cis	-168.4	164.6	-5.1	-147.2	-7.3	0	0	0	115
660	N	45.6	Very low	42.2	Very low	122 Å²	122	135.4 Å²	135.4	65%	0.652	74%	0.736	S	S	*	*			trans	56.9	106.3	157.4	-64.4	-60.3	0	0	0	124.2
661	D	40.1	Very low	42.3	Very low	137 Å²	137	134.7 Å²	134.7	73%	0.733	74%	0.739	S	S	*	*				31.8	137.1	110.9	-71.2	-8.7	0	0	0	121
662	D	44.3	Very low	41.8	Very low	157 Å²	157	130.8 Å²	130.8	84%	0.84	74%	0.741	S	S	*	*				-150.8	165.5	66.4	-168.7	16.8	0	0	0	114.4
663	N	37.5	Very low	41.1	Very low	138 Å²	138	134.1 Å²	134.1	74%	0.738	75%	0.749	S	S	*	*			trans	-110.4	152.1	-174	-75	-92.8	0	0	0	113.5
664	G	39.1	Very low	40.5	Very low	81 Å²	81	134.8 Å²	134.8	84%	0.835	75%	0.748	S	S	*	*			trans	-158.7	62	-178.7	0	0	0	0	0	114.7
665	D	35.3	Very low	40.2	Very low	148 Å²	148	138 Å²	138	79%	0.791	76%	0.76	S	S	*	*			trans	-94.5	120.1	-176.3	-176.5	15	0	0	0	113.4
666	T	39.5	Very low	39.5	Very low	136 Å²	136	140.1 Å²	140.1	83%	0.834	77%	0.765	S	S	*	*			trans	-153.9	74.3	167	-7.2	0	0	0	0	115.2
667	N	34	Very low	38.8	Very low	136 Å²	136	139.9 Å²	139.9	73%	0.727	77%	0.768	S	S	*	*				19.7	151.9	125.3	-159.7	11	0	0	0	122.2
668	V	34.3	Very low	37.8	Very low	101 Å²	101	142.7 Å²	142.7	61%	0.612	78%	0.777	S	S	*	*			trans	94	103.2	157.2	-165.8	0	0	0	0	120.4
669	N	33.5	Very low	37.2	Very low	139 Å²	139	144.3 Å²	144.3	74%	0.743	78%	0.777	S	S	*	*			trans	62.3	163.2	146.9	-59.1	12.6	0	0	0	119.7
670	D	35.8	Very low	36.5	Very low	141 Å²	141	146.4 Å²	146.4	75%	0.754	79%	0.786	S	S	*	*			cis	-142.3	170.7	1	-143	-31.2	0	0	0	112.1
671	I	34.1	Very low	36	Very low	156 Å²	156	147.2 Å²	147.2	80%	0.8	79%	0.791	S	S	*	*			trans	-88	135.4	178.1	-67	168.7	0	0	0	111
672	G	37.3	Very low	35.5	Very low	74 Å²	74	149.1 Å²	149.1	76%	0.763	80%	0.797	S	S	*	*			trans	-142	109	175	0	0	0	0	0	112.5
673	E	33.5	Very low	35.3	Very low	182 Å²	182	147 Å²	147	85%	0.85	80%	0.795	S	S	*	*			trans	-75.2	144.2	-179.8	-59.6	174.6	140.9	0	0	112.2
674	K	39.3	Very low	35.1	Very low	208 Å²	208	147 Å²	147	90%	0.904	79%	0.793	S	S	*	*			trans	-141	123	151.8	-77.6	-164.2	175.7	179.8	0	110.6
675	E	32.8	Very low	35	Very low	177 Å²	177	151 Å²	151	83%	0.827	80%	0.796	S	S	*	*			trans	-74.9	151.3	168.5	-53.1	175.4	118.3	0	0	110.4
676	E	35	Very low	34.9	Very low	200 Å²	200	148.8 Å²	148.8	94%	0.935	79%	0.792	S	S	*	*			trans	-139	137.3	147.4	-152	160.4	-130.3	0	0	108.8
677	T	33.4	Very low	34.8	Very low	107 Å²	107	151.8 Å²	151.8	66%	0.656	80%	0.796	S	S	*	*			trans	-103.7	139.3	-151.2	49.6	0	0	0	0	114
678	Q	31	Very low	34.9	Very low	197 Å²	197	153.8 Å²	153.8	92%	0.921	80%	0.801	S	S	*	*			trans	-73.8	128	168	-68.5	-178	-6.9	0	0	110.4
679	K	35.7	Very low	35	Very low	169 Å²	169	156.8 Å²	156.8	74%	0.735	81%	0.814	S	S	*	*			trans	-135.8	123	159	-74.4	-169.8	175.6	-173.2	0	109.7
680	I	34.9	Very low	35	Very low	168 Å²	168	159.1 Å²	159.1	86%	0.862	82%	0.817	S	S	*	*			trans	-127.8	98.8	164.4	-61.1	177.9	0	0	0	104.6
681	D	35.5	Very low	35.1	Very low	140 Å²	140	160.2 Å²	160.2	75%	0.749	82%	0.822	S	S	*	*			trans	-75.6	142.7	-179.9	-74.3	-55.4	0	0	0	110.7
682	M	29.2	Very low	34.9	Very low	176 Å²	176	159.3 Å²	159.3	87%	0.867	82%	0.818	S	S	*	*			trans	-91	131.5	174.6	-58.4	-177.8	-61.8	0	0	110
683	S	41.3	Very low	34.8	Very low	113 Å²	113	162.2 Å²	162.2	79%	0.79	82%	0.821	S	S	*	*			trans	-122.5	113.1	162.9	56.5	0	0	0	0	109.4
684	I	32	Very low	34.7	Very low	137 Å²	137	157.7 Å²	157.7	70%	0.703	82%	0.815	S	S	*	*			trans	-91.6	125.5	174.1	-62.8	165.7	0	0	0	107.5
685	D	38	Very low	34.5	Very low	166 Å²	166	155 Å²	155	89%	0.888	81%	0.809	S	S	*	*			trans	-128.3	139.3	157.9	-87.1	-52.1	0	0	0	108.7
686	S	32.6	Very low	34.6	Very low	101 Å²	101	151.9 Å²	151.9	71%	0.706	81%	0.807	S	S	*	*			trans	-139.7	108.9	-169.7	-58.7	0	0	0	0	109.9
687	E	38.3	Very low	34.4	Very low	200 Å²	200	149.7 Å²	149.7	94%	0.935	80%	0.8	S	S	*	*			trans	-130.5	141.7	159.9	-73.7	-154.9	145.7	0	0	110.8
688	E	35.5	Very low	34.5	Very low	177 Å²	177	150.1 Å²	150.1	83%	0.827	81%	0.805	S	S	*	*			trans	-88.6	151.3	-173.8	-52.9	-178.7	119.9	0	0	111.2
689	N	36.6	Very low	34.6	Very low	165 Å²	165	148.3 Å²	148.3	88%	0.882	80%	0.796	S	S	*	*			trans	-158.8	112.9	143.9	-103.4	-61.2	0	0	0	110.8
690	K	33	Very low	34.6	Very low	187 Å²	187	151.1 Å²	151.1	81%	0.813	80%	0.804	S	S	*	*			trans	-89.1	132.9	170.2	-75.3	-179.5	175.5	178.4	0	110.3
691	I	37.9	Very low	34.3	Very low	165 Å²	165	151.4 Å²	151.4	85%	0.846	80%	0.799	S	S	*	*			trans	-138.1	112.3	152.9	-53.6	-179.6	0	0	0	108.1
692	D	30.7	Very low	34	Very low	136 Å²	136	152.8 Å²	152.8	73%	0.727	81%	0.805	S	S	*	*			trans	-78.8	146.3	174.2	-58.8	-76.9	0	0	0	111.6
693	T	34.6	Very low	34.2	Very low	135 Å²	135	150 Å²	150	83%	0.828	80%	0.803	S	S	*	*			trans	-168.7	137.8	144.1	-76.4	0	0	0	0	109.5	I695	T693-I695 HydrophobicContact CG2-CD1 4.42Å
694	A	32	Very low	33.5	Very low	87 Å²	87	154.2 Å²	154.2	72%	0.719	81%	0.807	S	S	*	*			trans	-132.5	137.4	-179.6	0	0	0	0	0	113.1
695	I	35.1	Very low	33.3	Very low	152 Å²	152	153.3 Å²	153.3	78%	0.779	81%	0.812	S	S	*	*			trans	-146.2	104.3	158.3	-74.3	103.9	0	0	0	104.4	T693	T693-I695 HydrophobicContact CG2-CD1 4.42Å
696	S	34.9	Very low	33.1	Very low	111 Å²	111	150.2 Å²	150.2	78%	0.776	80%	0.803	S	S	*	*				75.6	109.6	69.8	-66.8	0	0	0	0	114.1
697	I	31	Very low	32.8	Very low	155 Å²	155	153.1 Å²	153.1	80%	0.795	81%	0.811	S	S	*	*			trans	-104.7	137.6	-179.9	-57.8	163.1	0	0	0	109.6
698	P	35	Very low	32.7	Very low	116 Å²	116	149.6 Å²	149.6	75%	0.753	81%	0.808	S	S	*	*			trans	-96	122.7	160.2	13	5.5	0	0	0	111.1
699	Q	32.4	Very low	32.5	Very low	159 Å²	159	146.6 Å²	146.6	74%	0.743	81%	0.807	S	S	*	*			trans	-89.1	150	168	-65.8	-177	-0.2	0	0	110.8
700	Y	35	Very low	32.2	Very low	228 Å²	228	144.6 Å²	144.6	89%	0.894	80%	0.804	S	S	*	*			trans	-131.2	137.9	154.2	49.4	-90.4	0	0	0	110.7
701	K	28.6	Very low	32.2	Very low	174 Å²	174	144 Å²	144	76%	0.757	81%	0.805	S	S	*	*			trans	-138.1	168.8	179.3	-83.2	-174	176.5	177.9	0	108.7
702	L	30.2	Very low	32	Very low	168 Å²	168	140.7 Å²	140.7	88%	0.88	80%	0.796	S	S	*	*			trans	88.8	146.1	-174.8	-80.6	57.8	0	0	0	113.7
703	S	32.9	Very low	32.2	Very low	118 Å²	118	141.1 Å²	141.1	83%	0.825	80%	0.804	S	S	*	*			cis	-143.1	167.9	1.9	36.1	0	0	0	0	112.4
704	K	27.2	Very low	32.2	Very low	201 Å²	201	140.5 Å²	140.5	87%	0.874	81%	0.805	S	S	*	*			trans	-131	128	-174.2	-177.2	-174.7	-177.5	-176.3	0	111.2
705	C	28.4	Very low	32.2	Very low	118 Å²	118	140.6 Å²	140.6	80%	0.797	81%	0.806	S	S	*	*			trans	-140.7	129.6	167.9	-70	0	0	0	0	106.2
706	S	32.9	Very low	32.1	Very low	102 Å²	102	140.4 Å²	140.4	71%	0.713	81%	0.806	S	S	*	*			cis	105.2	120.8	30.6	68.8	0	0	0	0	111.6
707	D	27.4	Very low	31.8	Very low	161 Å²	161	141.6 Å²	141.6	86%	0.861	80%	0.803	S	S	*	*			trans	-81.3	158.1	-161.7	-42	-97.4	0	0	0	115.3
708	S	36.2	Very low	31.8	Very low	126 Å²	126	138.7 Å²	138.7	88%	0.881	80%	0.797	S	S	*	*			trans	-170.6	161.4	147	25.4	0	0	0	0	113.2
709	S	30.6	Very low	31.6	Very low	114 Å²	114	139.1 Å²	139.1	80%	0.797	80%	0.797	S	S	*	*			trans	-82.1	172.3	-177	60.3	0	0	0	0	112.2
710	C	30.2	Very low	31.4	Very low	123 Å²	123	137.2 Å²	137.2	83%	0.831	80%	0.797	S	S	*	*				-168.1	-167	53.1	61.1	0	0	0	0	116.1
711	Q	33.1	Very low	31.3	Very low	176 Å²	176	131.5 Å²	131.5	82%	0.822	79%	0.786	S	S	*	*			trans	-85.6	155.9	-158	-54.6	153.1	-10.4	0	0	115.7
712	S	34.2	Very low	31.4	Very low	95 Å²	95	129.9 Å²	129.9	66%	0.664	78%	0.782	S	S	*	*				151.1	120.1	111.5	-66.5	0	0	0	0	116.1
713	T	33.7	Very low	31.4	Very low	144 Å²	144	127.9 Å²	127.9	88%	0.883	77%	0.772	S	S	*	*			trans	54.8	154	146.5	60	0	0	0	0	120.6
714	S	35.4	Very low	31.3	Very low	122 Å²	122	128.2 Å²	128.2	85%	0.853	76%	0.764	S	S	*	*			cis	-143.6	-179.1	6.9	51.6	0	0	0	0	110.8
715	A	31.7	Very low	31.4	Very low	89 Å²	89	123.4 Å²	123.4	74%	0.736	75%	0.751	S	S	*	*			trans	-116.5	167.1	-172.2	0	0	0	0	0	114
716	L	32.4	Very low	31.6	Very low	149 Å²	149	124.7 Å²	124.7	78%	0.78	75%	0.75	S	S	*	*			trans	177.1	122.7	131	-94.2	165.6	0	0	0	112.6
717	N	30.3	Very low	31.4	Very low	136 Å²	136	125.5 Å²	125.5	73%	0.727	75%	0.746	S	S	*	*			trans	44.4	146.1	130.4	-62.4	15.5	0	0	0	121.8
718	S	30.2	Very low	31.6	Very low	94 Å²	94	125.3 Å²	125.3	66%	0.657	75%	0.745	S	S	*	*			cis	-174.1	-172.2	-4	-98	0	0	0	0	110.2
719	T	30.7	Very low	31.5	Very low	125 Å²	125	123.8 Å²	123.8	77%	0.767	74%	0.74	S	S	*	*			trans	93.3	98.3	156.3	-48.4	0	0	0	0	114.7
720	T	29.1	Very low	31.6	Very low	119 Å²	119	126.1 Å²	126.1	73%	0.73	74%	0.744	S	S	*	*				91	127.7	69.9	-76	0	0	0	0	112.2
721	T	32.1	Very low	31.7	Very low	108 Å²	108	125.2 Å²	125.2	66%	0.663	74%	0.737	S	S	*	*			cis	-149.2	-131.1	-11.3	29.1	0	0	0	0	108.1
722	M	31.5	Very low	31.8	Very low	139 Å²	139	124.7 Å²	124.7	69%	0.685	74%	0.737	S	S	*	*			cis	-165.4	132.8	-0.8	-146.3	12.8	166.3	0	0	116.1
723	N	29.2	Very low	31.8	Very low	126 Å²	126	127.2 Å²	127.2	67%	0.674	74%	0.743	S	S	*	*			trans	76.4	152.1	136.8	-106.6	-11.5	0	0	0	126
724	I	30.6	Very low	31.7	Very low	126 Å²	126	128.3 Å²	128.3	65%	0.646	74%	0.744	S	S	*	*			trans	95.1	98.4	149.7	-70	157.6	0	0	0	121.1
725	V	30	Very low	31.6	Very low	100 Å²	100	127.6 Å²	127.6	61%	0.606	74%	0.737	S	S	*	*				40.5	127.6	125.2	-174.5	0	0	0	0	120.7
726	N	31.2	Very low	31.8	Very low	145 Å²	145	128.3 Å²	128.3	78%	0.775	74%	0.736	S	S	*	*				-166.5	139.4	124.4	-105.7	-48.4	0	0	0	116.8
727	N	30.2	Very low	31.8	Very low	119 Å²	119	128.6 Å²	128.6	64%	0.636	74%	0.737	S	S	*	*			trans	-62	159.4	-179.5	-46.8	-43	0	0	0	115.6
728	N	31.1	Very low	31.8	Very low	157 Å²	157	128 Å²	128	84%	0.84	73%	0.733	S	S	*	*				155.5	128.7	119.3	-80.3	-21.1	0	0	0	115.3
729	A	34.3	Very low	32	Very low	93 Å²	93	130.4 Å²	130.4	77%	0.769	74%	0.738	S	S	*	*			trans	162.9	114.7	142	0	0	0	0	0	107.5
730	N	32.5	Very low	32.3	Very low	163 Å²	163	130 Å²	130	87%	0.872	74%	0.74	S	S	*	*				72.8	144.4	54.4	-84.2	38	0	0	0	115.8
731	P	32	Very low	32.3	Very low	105 Å²	105	131.2 Å²	131.2	68%	0.682	74%	0.742	S	S	*	*			trans	-118	-175.8	-143	43.8	-33.8	0	0	0	115.1
732	I	35.4	Very low	32.5	Very low	164 Å²	164	134.8 Å²	134.8	84%	0.841	75%	0.751	S	S	*	*			trans	-135.2	144.5	167.1	-60.2	-179.5	0	0	0	108.6
733	D	33.2	Very low	32.6	Very low	148 Å²	148	136.6 Å²	136.6	79%	0.791	76%	0.758	S	S	*	*			trans	-109.7	144.9	176.3	-61.6	-70.5	0	0	0	111.2
734	D	31.6	Very low	32.9	Very low	167 Å²	167	136.4 Å²	136.4	89%	0.893	77%	0.766	S	S	*	*			trans	-103.6	140	172.5	-84	-43.3	0	0	0	112.6
735	P	35	Very low	33	Very low	108 Å²	108	138.1 Å²	138.1	70%	0.701	77%	0.774	S	S	*	*			trans	-131.1	140.6	169.8	37.6	-23.5	0	0	0	117.3
736	S	34.6	Very low	33.3	Very low	104 Å²	104	142.1 Å²	142.1	73%	0.727	79%	0.786	S	S	*	*			trans	84.8	133.1	144.8	79.1	0	0	0	0	122.5
737	I	32.7	Very low	33.3	Very low	154 Å²	154	143 Å²	143	79%	0.79	79%	0.785	S	S	*	*			trans	-177.6	132	148.4	-93.4	153	0	0	0	104.2
738	N	30.9	Very low	33.4	Very low	123 Å²	123	144.9 Å²	144.9	66%	0.658	80%	0.795	S	S	*	*			cis	92.9	133.8	32.9	-63.9	-24.4	0	0	0	113.5
739	I	33.6	Very low	33.5	Very low	145 Å²	145	142 Å²	142	74%	0.744	79%	0.788	S	S	*	*			cis	-158.3	139.3	-9.4	-107.2	160.5	0	0	0	107.4
740	S	37	Very low	33.5	Very low	116 Å²	116	144.7 Å²	144.7	81%	0.811	79%	0.794	S	S	*	*			trans	-169.8	157.3	148.3	54.9	0	0	0	0	115.4
741	N	30.3	Very low	33.3	Very low	146 Å²	146	145.1 Å²	145.1	78%	0.781	79%	0.791	S	S	*	*			trans	-83.6	-177.4	178.5	-53.1	-36.5	0	0	0	110.6
742	E	36.6	Very low	33.3	Very low	182 Å²	182	148 Å²	148	85%	0.85	80%	0.799	S	S	*	*			cis	-146.4	-159.9	33.6	-73.3	-164.1	144.1	0	0	114.8
743	Q	33.2	Very low	33	Very low	177 Å²	177	149 Å²	149	83%	0.827	80%	0.797	S	S	*	*			trans	-93.1	151.2	-157.4	-54.8	157.3	0.2	0	0	113.6
744	S	35.1	Very low	32.9	Very low	122 Å²	122	149.6 Å²	149.6	85%	0.853	80%	0.8	S	S	*	*				179	171.4	116	40.8	0	0	0	0	113
745	M	33.1	Very low	32.9	Very low	162 Å²	162	149.8 Å²	149.8	80%	0.798	80%	0.795	S	S	*	*			trans	-75.5	166.5	-171.1	-53	179.5	71.7	0	0	110.9
746	E	35	Very low	32.8	Very low	185 Å²	185	150.6 Å²	150.6	86%	0.864	80%	0.798	S	S	*	*				-161.6	-179.8	50.3	-146.8	166.1	-133.3	0	0	113.5
747	E	31.8	Very low	33	Very low	162 Å²	162	151.3 Å²	151.3	76%	0.757	79%	0.793	S	S	*	*			trans	-99.9	146.6	-164	-52.5	178.4	143.3	0	0	113.9
748	N	33.3	Very low	33	Very low	160 Å²	160	153.2 Å²	153.2	86%	0.856	80%	0.796	S	S	*	*				-167.4	164.8	113.3	-109.5	-76.7	0	0	0	113.8
749	S	32.9	Very low	33.3	Very low	97 Å²	97	157 Å²	157	68%	0.678	81%	0.806	S	S	*	*			trans	-110.3	155.4	-158.3	61	0	0	0	0	115.7
750	T	33.4	Very low	33.6	Very low	148 Å²	148	158.3 Å²	158.3	91%	0.908	81%	0.81	S	S	*	*			trans	-160.4	137	138.7	2	0	0	0	0	110.1
751	E	28.3	Very low	33.6	Very low	173 Å²	173	158.6 Å²	158.6	81%	0.808	81%	0.808	S	S	*	*			trans	-92.2	128	-168.5	-56.9	177.6	98	0	0	113.8
752	I	32.2	Very low	34.1	Very low	165 Å²	165	158.1 Å²	158.1	85%	0.846	81%	0.811	S	S	*	*			trans	-138.5	125.9	145.3	-58.6	-175.7	0	0	0	108.7
753	K	29	Very low	34.4	Very low	184 Å²	184	158.8 Å²	158.8	80%	0.8	81%	0.811	S	S	*	*			trans	-76.1	130.7	-178.1	-68.8	172.3	179.2	169.9	0	111.7
754	L	31	Very low	35	Very low	161 Å²	161	157.2 Å²	157.2	84%	0.843	81%	0.813	S	S	*	*			trans	-111.2	122.1	162.8	-74.3	173	0	0	0	109.7
755	H	31.9	Very low	35.2	Very low	172 Å²	172	159.4 Å²	159.4	80%	0.796	82%	0.815	S	S	*	*			trans	-83.5	122.7	173.8	-131.7	-93.3	0	0	0	108.9	D757	H755-D757 IonicContact CE1-OD1 2.63Å; H755-D757 IonicContact CG-OD1 3.91Å; H755-D757 IonicContact ND1-OD1 3.99Å; H755-D757 PolarHBondContact ND1-OD1 3.49Å
756	V	33.8	Very low	36.3	Very low	124 Å²	124	154.3 Å²	154.3	75%	0.752	80%	0.804	S	S	*	*			trans	-112.7	88.5	177.6	-177.5	0	0	0	0	109.1	K758	V756-K758 PolarHBondContact O-N 2.87Å; V756-K758 VanDerWaalsContact O-N 3.08Å
757	D	37.2	Very low	37.2	Very low	119 Å²	119	151.9 Å²	151.9	64%	0.636	80%	0.804	S	S	*	*			trans	-75	98.2	-176.2	-70.7	-10.4	0	0	0	111.5	H755 K759	H755-D757 IonicContact CE1-OD1 2.63Å; H755-D757 IonicContact CG-OD1 3.91Å; H755-D757 IonicContact ND1-OD1 3.99Å; H755-D757 PolarHBondContact ND1-OD1 3.49Å; D757-K759 PolarHBondContact O-N 3.4Å
758	K	34.6	Very low	37.8	Very low	195 Å²	195	150.8 Å²	150.8	85%	0.848	81%	0.808	S	S	*	*			trans	-65.8	95.2	171	-67.1	-173.9	178.8	-175.9	0	110.4	V756 Q760	V756-K758 PolarHBondContact O-N 2.87Å; V756-K758 VanDerWaalsContact O-N 3.08Å; K758-Q760 PolarHBondContact O-N 3.11Å; K758-Q760 VanDerWaalsContact O-N 3.08Å
759	K	36.4	Very low	39	Very low	202 Å²	202	150.8 Å²	150.8	88%	0.878	81%	0.807	S	S	*	*			trans	-65.1	104.6	175	-71.8	-179.8	179.8	172.4	0	111.1	D757	D757-K759 PolarHBondContact O-N 3.4Å
760	Q	39.2	Very low	39.7	Very low	173 Å²	173	151.4 Å²	151.4	81%	0.808	81%	0.809	S	S	*	*			trans	-74.7	148.4	165.6	-66.7	-172.8	-1.9	0	0	110.8	K758 T762	K758-Q760 PolarHBondContact O-N 3.11Å; K758-Q760 VanDerWaalsContact O-N 3.08Å; Q760-T762 PolarHBondContact O-N 2.91Å
761	P	37.9	Very low	40	Very low	121 Å²	121	150.4 Å²	150.4	79%	0.786	81%	0.805	S	S	*	*			trans	-66.8	129.4	171.5	28.3	-34	0	0	0	110.7	K763	P761-K763 PolarHBondContact O-N 3.43Å
762	T	39.6	Very low	40.8	Very low	137 Å²	137	148 Å²	148	84%	0.84	81%	0.807	S	S	*	*			trans	-68.7	112.2	-176.6	49.6	0	0	0	0	112	Q760	Q760-T762 PolarHBondContact O-N 2.91Å
763	K	44.1	Very low	41.4	Very low	196 Å²	196	149.3 Å²	149.3	85%	0.852	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-68.9	131.6	168.8	-65.2	-179.6	179.4	-180	0	109.8	P761	P761-K763 PolarHBondContact O-N 3.43Å
764	V	45.3	Very low	41.6	Very low	143 Å²	143	150.1 Å²	150.1	87%	0.867	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-74.1	127.1	176	-179.5	0	0	0	0	109.2	G766	V764-G766 PolarHBondContact O-N 2.91Å
765	L	39.1	Very low	42	Very low	169 Å²	169	150.9 Å²	150.9	89%	0.885	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-77.3	119.7	178.2	-75.8	82.9	0	0	0	111
766	G	57.4	Low	42.3	Very low	55 Å²	55	149.4 Å²	149.4	57%	0.567	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-93.8	163.2	154	0	0	0	0	0	110.9	V764	V764-G766 PolarHBondContact O-N 2.91Å
767	P	52.7	Low	42.2	Very low	133 Å²	133	151.4 Å²	151.4	86%	0.864	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-67.3	132.9	-178.7	27.6	-34.3	0	0	0	112.2
768	T	45.5	Very low	42.1	Very low	140 Å²	140	151.7 Å²	151.7	86%	0.859	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-84	135.4	-175.6	9	0	0	0	0	113.1
769	L	57	Low	42	Very low	159 Å²	159	148.3 Å²	148.3	83%	0.832	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-76	153.1	162	-100.7	69.4	0	0	0	111
770	P	49.2	Very low	41.7	Very low	110 Å²	110	147.4 Å²	147.4	71%	0.714	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-76.1	153.4	-179.3	31.8	-35.6	0	0	0	112.9
771	P	38	Very low	41.4	Very low	127 Å²	127	149 Å²	149	83%	0.825	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-83.5	126.5	-178.8	32.4	-33.6	0	0	0	112.7
772	S	46.1	Very low	41.1	Very low	122 Å²	122	149.3 Å²	149.3	85%	0.853	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-89.9	152.4	169	-70.5	0	0	0	0	112
773	Q	44.1	Very low	40.8	Very low	193 Å²	193	151.8 Å²	151.8	90%	0.902	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-79.4	161.2	-159.6	-66.5	160.6	-19.6	0	0	114.7
774	K	33.5	Very low	40.5	Very low	202 Å²	202	149.6 Å²	149.6	88%	0.878	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-61.1	143.6	175	-63.6	179.2	177.4	-178.1	0	112.1
775	L	39	Very low	39.9	Very low	176 Å²	176	152.6 Å²	152.6	92%	0.921	81%	0.807	S	S	*	*			trans	-137.8	158.8	145.6	-109.8	169.1	0	0	0	109.2
776	L	38.3	Very low	40	Very low	141 Å²	141	152 Å²	152	74%	0.738	80%	0.803	S	S	*	*			trans	-97.2	149.8	-163.1	-73.9	158.6	0	0	0	113.4
777	E	32.5	Very low	39.2	Very low	166 Å²	166	155.3 Å²	155.3	78%	0.776	80%	0.804	S	S	*	*			trans	29.9	131.7	143.3	-55.4	177.8	134.4	0	0	120.3
778	V	33.8	Very low	38.4	Very low	125 Å²	125	156.4 Å²	156.4	76%	0.758	80%	0.802	S	S	*	*				178.9	128.8	104	150.5	0	0	0	0	112
779	N	32.6	Very low	38.3	Very low	125 Å²	125	158.4 Å²	158.4	67%	0.668	80%	0.795	S	S	*	*			trans	53.4	120	157.5	-76.2	-40.7	0	0	0	123.3
780	K	30.4	Very low	38	Very low	183 Å²	183	155.1 Å²	155.1	80%	0.796	79%	0.786	S	S	*	*				58.6	101.7	129.2	-57.9	177.2	-176.4	-176.7	0	119.4
781	K	34.1	Very low	38.4	Very low	207 Å²	207	158.1 Å²	158.1	90%	0.9	80%	0.796	S	S	*	*				-167	164.9	99.6	-103.5	173.6	-178.6	-175.5	0	111.8
782	T	30.1	Very low	39.4	Very low	127 Å²	127	159.1 Å²	159.1	78%	0.779	79%	0.794	S	S	*	*			trans	-57	148.3	-179.1	40.7	0	0	0	0	112.9
783	K	33.9	Very low	39.7	Very low	189 Å²	189	163.6 Å²	163.6	82%	0.822	79%	0.794	S	S	*	*			trans	-140.1	133	161	-96.9	-168.8	171.1	-172.1	0	108.3
784	D	37.4	Very low	40.8	Very low	149 Å²	149	161.1 Å²	161.1	80%	0.797	79%	0.792	S	S	*	*			trans	-79.5	133.8	-170.4	-41.7	-75.8	0	0	0	110.2
785	Y	33.5	Very low	42.7	Very low	206 Å²	206	158.5 Å²	158.5	81%	0.808	78%	0.782	S	S	*	*			trans	-90.6	118.2	168.7	-78.5	-95.3	0	0	0	108	E787	Y785-E787 PolarHBondContact O-N 3.07Å
786	I	40.5	Very low	44.4	Very low	156 Å²	156	159.5 Å²	159.5	80%	0.8	77%	0.774	S	S	*	*			trans	-84.3	94.1	169.8	-60.3	174.5	0	0	0	106.8
787	E	41	Very low	46.1	Very low	126 Å²	126	159.9 Å²	159.9	59%	0.589	77%	0.77	S	S	*	*			trans	-89.5	109.5	176.5	-61.3	-167	124.6	0	0	109.9	Y785 Y789	Y785-E787 PolarHBondContact O-N 3.07Å; E787-Y789 HydrophobicContact CB-CD2 3.83Å; E787-Y789 HydrophobicContact CB-CE2 3.59Å; E787-Y789 HydrophobicContact CG-CE2 4.22Å; E787-Y789 PolarHBondContact O-N 3.34Å
788	N	35.9	Very low	47.9	Very low	155 Å²	155	155.2 Å²	155.2	83%	0.829	75%	0.754	S	S	*	*			trans	-78.8	92.6	170.1	-74.4	-37.2	0	0	0	108.9
789	Y	44.3	Very low	49.8	Very low	183 Å²	183	152.9 Å²	152.9	72%	0.718	74%	0.741	S	S	*	*			trans	-102.7	154	165.7	-67.9	-56.8	0	0	0	111.3	E787	E787-Y789 HydrophobicContact CB-CD2 3.83Å; E787-Y789 HydrophobicContact CB-CE2 3.59Å; E787-Y789 HydrophobicContact CG-CE2 4.22Å; E787-Y789 PolarHBondContact O-N 3.34Å
790	S	49.9	Very low	51.6	Low	90 Å²	90	153 Å²	153	63%	0.629	75%	0.752	S	S	*	*			trans	-76.6	156.8	-175.4	41.2	0	0	0	0	112.9	D792	S790-D792 PolarHBondContact O-N 2.84Å
791	D	57.4	Low	53.3	Low	173 Å²	173	149.9 Å²	149.9	93%	0.925	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	4.4	-173.4	-70.5	-54.8	0	0	0	116.8
792	D	59.6	Low	54.8	Low	148 Å²	148	144.4 Å²	144.4	79%	0.791	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	4.2	-175.3	-65.7	-55.3	0	0	0	114.4	S790	S790-D792 PolarHBondContact O-N 2.84Å
793	Y	52.8	Low	56.3	Low	216 Å²	216	141 Å²	141	85%	0.847	70%	0.703	S	S	*	*			trans	-118.9	115.3	178.9	-122	-98.4	0	0	0	112.5
794	V	66.3	Low	58	Low	141 Å²	141	136.7 Å²	136.7	86%	0.855	71%	0.712	S	S	*	*			trans	-103.4	98.3	174.1	-178.8	0	0	0	0	109.1
795	E	73.6	Confident	59.7	Low	147 Å²	147	135 Å²	135	69%	0.687	70%	0.703	S	S	*	*			trans	-75.2	127.9	170.9	-172.7	165.5	-146.2	0	0	110.2	F797	E795-F797 HydrophobicContact CB-CE2 3.99Å; E795-F797 HydrophobicContact CG-CE2 3.9Å; E795-F797 HydrophobicContact CG-CZ 4.13Å; E795-F797 WeakPolarHBondContact O-CD2 3.45Å; E795-F797 PolarHBondContact O-N 3.3Å
796	W	75.2	Confident	61.5	Low	197 Å²	197	127.6 Å²	127.6	75%	0.746	69%	0.69	S	S	*	*			trans	-81.9	119.1	-178.4	-178.8	87.8	0	0	0	110.8	P798	W796-P798 HydrophobicContact CH2-CB 3.77Å; W796-P798 HydrophobicContact CZ2-CB 4.44Å; W796-P798 HydrophobicContact CZ3-CB 4.07Å
797	F	73.6	Confident	63.1	Low	149 Å²	149	123.2 Å²	123.2	65%	0.654	67%	0.67	S	S	*	*			trans	-105.3	139.2	169	-68.6	-88.1	0	0	0	109.9	E795	E795-F797 HydrophobicContact CB-CE2 3.99Å; E795-F797 HydrophobicContact CG-CE2 3.9Å; E795-F797 HydrophobicContact CG-CZ 4.13Å; E795-F797 WeakPolarHBondContact O-CD2 3.45Å; E795-F797 PolarHBondContact O-N 3.3Å
798	P	70.9	Confident	64.7	Low	68 Å²	68	119.4 Å²	119.4	44%	0.442	66%	0.656	S	S	.	*			trans	-63.7	151.9	174.3	27.6	-34.5	0	0	0	110.9	W796	W796-P798 HydrophobicContact CH2-CB 3.77Å; W796-P798 HydrophobicContact CZ2-CB 4.44Å; W796-P798 HydrophobicContact CZ3-CB 4.07Å
799	P	73.3	Confident	66.5	Low	75 Å²	75	115.7 Å²	115.7	49%	0.487	64%	0.642	S	S	.	*			trans	-57.5	147.2	176.7	-24.2	34.5	0	0	0	112.7	D801 Q802	P799-D801 PolarHBondContact O-N 3.08Å; P799-Q802 PolarHBondContact O-N 3.12Å
800	S	70.3	Confident	67.8	Low	129 Å²	129	112.3 Å²	112.3	90%	0.902	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	-22.6	-179.4	-48.2	0	0	0	0	114.9
801	D	66.9	Low	69.1	Low	116 Å²	116	110.2 Å²	110.2	62%	0.62	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	9.1	-177.5	-54.5	-47.9	0	0	0	113.8	P799	P799-D801 PolarHBondContact O-N 3.08Å
802	Q	65.6	Low	69.9	Low	93 Å²	93	106.2 Å²	106.2	44%	0.435	61%	0.609	S	S	.	*	B	Isolated β-bridge	trans	-120	98.7	-179	-172.2	176.4	14.2	0	0	111.1	P799	P799-Q802 PolarHBondContact O-N 3.12Å
803	S	61.3	Low	70.9	Confident	54 Å²	54	106.7 Å²	106.7	38%	0.378	60%	0.604	S	S	.	*			trans	-71.9	150.3	169.4	39.7	0	0	0	0	111.3	D805 G806 T807	S803-D805 WeakPolarHBondContact CB-OD1 3.42Å; S803-D805 PolarHBondContact O-N 3.03Å; S803-D805 PolarHBondContact OG-OD1 3.42Å; S803-D805 PolarHBondContact OG-OD2 3.44Å; S803-G806 PolarHBondContact O-N 3.02Å; S803-G806 VanDerWaalsContact O-N 3.13Å; S803-T807 PolarHBondContact OG-OG1 3.43Å; S803-T807 VanDerWaalsContact OG-OG1 3.09Å
804	G	67.8	Low	72.2	Confident	99 Å²	99	103.5 Å²	103.5	100%	1.021	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	11.1	-178.1	0	0	0	0	0	115.8
805	D	74.9	Confident	72.5	Confident	114 Å²	114	100.1 Å²	100.1	61%	0.61	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-5.3	172.2	52.7	25.5	0	0	0	113.1	S803 T807	S803-D805 WeakPolarHBondContact CB-OD1 3.42Å; S803-D805 PolarHBondContact O-N 3.03Å; S803-D805 PolarHBondContact OG-OD1 3.42Å; S803-D805 PolarHBondContact OG-OD2 3.44Å; D805-T807 VanDerWaalsContact C-N 3.31Å; D805-T807 WeakPolarHBondContact OD1-CB 3.34Å; D805-T807 PolarHBondContact OD1-N 3.25Å; D805-T807 PolarHBondContact OD1-OG1 3Å
806	G	71.2	Confident	71.9	Confident	51 Å²	51	104.5 Å²	104.5	53%	0.526	60%	0.597	S	S	.	*	S	Bend	trans	82	6.6	-178.5	0	0	0	0	0	114.2	S803	S803-G806 PolarHBondContact O-N 3.02Å; S803-G806 VanDerWaalsContact O-N 3.13Å
807	T	74.5	Confident	71.8	Confident	63 Å²	63	99.9 Å²	99.9	39%	0.387	59%	0.59	S	S	.	*			trans	-83.5	153.7	168.5	70.3	0	0	0	0	110.6	S803 D805	S803-T807 PolarHBondContact OG-OG1 3.43Å; S803-T807 VanDerWaalsContact OG-OG1 3.09Å; D805-T807 VanDerWaalsContact C-N 3.31Å; D805-T807 WeakPolarHBondContact OD1-CB 3.34Å; D805-T807 PolarHBondContact OD1-N 3.25Å; D805-T807 PolarHBondContact OD1-OG1 3Å
808	T	74.6	Confident	71.7	Confident	46 Å²	46	97.3 Å²	97.3	28%	0.282	59%	0.586	S	S	.	*	B	Isolated β-bridge	trans	-137.5	165	176.1	72	0	0	0	0	109.9	L810 N811 A812	T808-L810 PolarHBondContact O-N 3.35Å; T808-L810 VanDerWaalsContact O-N 3.08Å; T808-L810 VanDerWaalsContact OG1-CB 3.27Å; T808-L810 WeakPolarHBondContact OG1-CB 3.31Å; T808-L810 PolarHBondContact OG1-N 3.07Å; T808-L810 VanDerWaalsContact OG1-N 3.12Å; T808-N811 PolarHBondContact N-OD1 2.88Å; T808-N811 WeakPolarHBondContact O-CB 3.49Å; T808-N811 PolarHBondContact O-N 2.96Å; T808-N811 PolarHBondContact OG1-N 2.96Å; T808-N811 PolarHBondContact OG1-OD1 3.49Å; T808-A812 PolarHBondContact O-N 2.83Å
809	S	72.7	Confident	71.7	Confident	78 Å²	78	98.9 Å²	98.9	55%	0.545	59%	0.594	S	S	.	*	H	α-helix	trans	-55.8	-21.9	168.3	58.7	0	0	0	0	113.3	K813	S809-K813 PolarHBondContact O-N 3.13Å
810	L	71.1	Confident	71.6	Confident	111 Å²	111	100.3 Å²	100.3	58%	0.581	60%	0.6	S	S	*	*	H	α-helix	trans	-76.5	-41	174.9	-133.8	144.9	0	0	0	111.5	T808 A812 K813 Y814	T808-L810 PolarHBondContact O-N 3.35Å; T808-L810 VanDerWaalsContact O-N 3.08Å; T808-L810 VanDerWaalsContact OG1-CB 3.27Å; T808-L810 WeakPolarHBondContact OG1-CB 3.31Å; T808-L810 PolarHBondContact OG1-N 3.07Å; T808-L810 VanDerWaalsContact OG1-N 3.12Å; L810-A812 VanDerWaalsContact C-N 3.32Å; L810-A812 PolarHBondContact O-N 2.89Å; L810-K813 PolarHBondContact O-N 2.67Å; L810-K813 VanDerWaalsContact O-N 3.12Å; L810-Y814 HydrophobicContact CD2-CD2 3.68Å; L810-Y814 HydrophobicContact CD2-CE2 3.68Å; L810-Y814 HydrophobicContact CG-CD2 4.5Å; L810-Y814 HydrophobicContact CG-CE2 4.41Å; L810-Y814 WeakPolarHBondContact O-CD2 3.48Å; L810-Y814 PolarHBondContact O-N 3.43Å; L810-Y814 VanDerWaalsContact O-N 3.14Å
811	N	78.3	Confident	71.7	Confident	46 Å²	46	98.5 Å²	98.5	25%	0.246	58%	0.582	C	S	.	*	H	α-helix	trans	-56.9	-47.7	172.2	-60.9	48.6	0	0	0	110.5	T808 K813 Y814 G815 Y816	T808-N811 PolarHBondContact N-OD1 2.88Å; T808-N811 WeakPolarHBondContact O-CB 3.49Å; T808-N811 PolarHBondContact O-N 2.96Å; T808-N811 PolarHBondContact OG1-N 2.96Å; T808-N811 PolarHBondContact OG1-OD1 3.49Å; N811-K813 PolarHBondContact O-N 3.46Å; N811-Y814 PolarHBondContact O-N 3.17Å; N811-Y814 VanDerWaalsContact O-N 3.16Å; N811-G815 PolarHBondContact O-N 2.99Å; N811-Y816 PolarHBondContact O-N 3.32Å
812	A	73.7	Confident	72	Confident	90 Å²	90	97.3 Å²	97.3	74%	0.744	58%	0.579	S	S	*	*	H	α-helix	trans	-62.3	-27.3	178.2	0	0	0	0	0	113.6	T808 L810	T808-A812 PolarHBondContact O-N 2.83Å; L810-A812 VanDerWaalsContact C-N 3.32Å; L810-A812 PolarHBondContact O-N 2.89Å
813	K	79.8	Confident	72.5	Confident	157 Å²	157	97.6 Å²	97.6	68%	0.683	59%	0.589	S	S	*	*	H	α-helix	trans	-79.1	-30.1	176.4	-174	-179.9	176.8	-170.5	0	113.3	S809 L810 N811	S809-K813 PolarHBondContact O-N 3.13Å; L810-K813 PolarHBondContact O-N 2.67Å; L810-K813 VanDerWaalsContact O-N 3.12Å; N811-K813 PolarHBondContact O-N 3.46Å
814	Y	80.2	Confident	73.4	Confident	149 Å²	149	101 Å²	101	58%	0.584	61%	0.606	S	S	*	*	H	α-helix	trans	-108.7	-2.7	-175.7	-70.6	-86.6	0	0	0	114.5	L810 N811	L810-Y814 HydrophobicContact CD2-CD2 3.68Å; L810-Y814 HydrophobicContact CD2-CE2 3.68Å; L810-Y814 HydrophobicContact CG-CD2 4.5Å; L810-Y814 HydrophobicContact CG-CE2 4.41Å; L810-Y814 WeakPolarHBondContact O-CD2 3.48Å; L810-Y814 PolarHBondContact O-N 3.43Å; L810-Y814 VanDerWaalsContact O-N 3.14Å; N811-Y814 PolarHBondContact O-N 3.17Å; N811-Y814 VanDerWaalsContact O-N 3.16Å
815	G	74.3	Confident	73.8	Confident	71 Å²	71	101.2 Å²	101.2	73%	0.732	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	83.8	35.2	170.7	0	0	0	0	0	115.1	N811	N811-G815 PolarHBondContact O-N 2.99Å
816	Y	60.9	Low	73.7	Confident	238 Å²	238	100 Å²	100	93%	0.933	57%	0.568	S	S	*	*			trans	-100.4	0	176.8	-73.2	-78.2	0	0	0	112.7	N811	N811-Y816 PolarHBondContact O-N 3.32Å

Retrieved 816 of 816 residues in 477.5 ms (Link to these results)

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