A0A5K4F7Q7_SCHMA Loading...

Oxidation resistance protein 1 AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F7Q7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,016 aa.

						>A0A5K4F7Q7_SCHMA|A0A5K4F7Q7
MSKSLYDGTKSTMRLSNITSKLRTVSATLANTNPFSSKSQGNSITEENADDVKQTEGIKKSKRRTRKRTTFTNESSTSASGKQEKPERKKKKKKQKHDHSDTTKLVKTNSVQQTTEYVVQEGDSFNSVAARFDLTPSELCRVNKFLSRTLFVGQVIKLPINEKVASMTAESSNKSVASDVKSDNDNLNAEDVQVTTEGVTKNPLDPKVCLTEGESKSKLLQSVDSLTSSVNETDTDDQDFDESSTYSEYTDYADEENDPMACQYLKFDCKFVVDLQCSVPGIILVTTNMFVFKPYDEEQYPLENHCKQIPLSQFRTIAVYRDPSVMYFTKRGTQPTSCPSNMNIECDVNELINSTEQTPCVIITKNDDSSTEKLSNSTESKGNTYEMNSGEKHDIGQKDIENVITTDSSSASNLKKCDLDDNPFYLCILAYTNSVENNNHRRHPYWFTVQSEEYWFLIPNEKSKILFDFLLTCQFHGYEDDVKQCTDMEVSQLSIKSNEIKDTNKANTIISKLHSKSLGNLNFFKSSIVSPVSSEHFCLDDDNNDDVSKFEKTIHRHHNHKHTHRHHNYCHFVIVPNTFDWVLPRIGSSDDHSRTLLILNNRQKYTNTLKEAPKISSDQNEHCQQSSQSNKLKELQNIEHSTDSSSFRNTTDISKTVEKHDSVPSMEEEKAALQLLKRETINWELVSSKELELKELEEEKRKQFMFDCIKSAEPELLPIPTATSNSEIFDVHKVRDLLQNLTPDAEGLDWILTYSTSVHGFSLRSLYRRCANSLTESSKDHSYGTIHTKMKHTLTSNSPYAANQPCILIIRTSTNEIFGAMLNTHPYPSNGRFYGNGSCFVFRWINTTDSKQDQLKENSNSINEQDSTSLSVTSNKLLNIPTDVNSASISSSSLLGTDNHNSDLVSSSSSFISSDVRTETVTKEFAHLCYNDKKEFPEQGKKQKFQKFTWSGENSYFINGDYDSLTIGCSQGHSAIQLDDILLHGHSDNCETFNSPQLTLSSPDFIITTLEIWSFI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	33.5	Very low	31.2	Very low	237 Å²	237	146.8 Å²	146.8	100%	1.167	80%	0.798	S	S	*	*				0	123.1	0	-65.4	178	177.2	0	0	108.4
2	S	27.4	Very low	30.9	Very low	98 Å²	98	145.8 Å²	145.8	69%	0.685	80%	0.8	S	S	*	*			trans	59.5	162.7	-168.3	77.1	0	0	0	0	114.3
3	K	33	Very low	30.9	Very low	180 Å²	180	148.6 Å²	148.6	78%	0.783	81%	0.808	S	S	*	*			cis	-114.5	163.7	-7	-87.7	95	-170	174.8	0	108.8
4	S	32.1	Very low	30.6	Very low	87 Å²	87	154.1 Å²	154.1	61%	0.608	81%	0.811	S	S	*	*			cis	82.3	111.1	20.1	85.7	0	0	0	0	118.3
5	L	29.6	Very low	30.7	Very low	153 Å²	153	153.5 Å²	153.5	80%	0.801	81%	0.808	S	S	*	*			trans	64.2	121.7	154.5	-58.9	159.6	0	0	0	118.5
6	Y	30.4	Very low	30.5	Very low	219 Å²	219	150 Å²	150	86%	0.859	80%	0.799	S	S	*	*				-165.9	157.7	87.8	-125.1	-92.3	0	0	0	113.3
7	D	32.8	Very low	30.4	Very low	142 Å²	142	148.1 Å²	148.1	76%	0.759	79%	0.79	S	S	*	*			trans	-88.8	158.6	168.7	-176.7	11.9	0	0	0	110.2
8	G	33.8	Very low	30.4	Very low	75 Å²	75	148.8 Å²	148.8	77%	0.773	79%	0.791	S	S	*	*			trans	-172.8	80.4	-170.7	0	0	0	0	0	115.9
9	T	29.4	Very low	30.4	Very low	113 Å²	113	148.7 Å²	148.7	69%	0.693	80%	0.797	S	S	*	*			trans	-81.1	160.9	170.7	56.3	0	0	0	0	113
10	K	30.1	Very low	30.4	Very low	199 Å²	199	146 Å²	146	87%	0.865	79%	0.79	S	S	*	*			trans	76.5	114.5	171.3	-48.6	166.2	-173.2	172.1	0	116.5
11	S	30.9	Very low	30.5	Very low	112 Å²	112	148.2 Å²	148.2	78%	0.783	79%	0.793	S	S	*	*				-162.7	149.8	92.3	-162.7	0	0	0	0	111.6
12	T	28.5	Very low	30.4	Very low	134 Å²	134	145.2 Å²	145.2	82%	0.822	78%	0.781	S	S	*	*			trans	-102.9	131.5	174.1	47	0	0	0	0	110.3
13	M	30	Very low	30.4	Very low	183 Å²	183	152.2 Å²	152.2	90%	0.901	79%	0.792	S	S	*	*			trans	-132.9	133	161.1	-79.9	-157.8	175.7	0	0	111
14	R	26.6	Very low	30.4	Very low	226 Å²	226	149.9 Å²	149.9	85%	0.853	79%	0.793	S	S	*	*			trans	-96.7	125	177.1	-64.8	172	169.3	128.6	-9.2	109.5
15	L	32.9	Very low	30.3	Very low	145 Å²	145	151.5 Å²	151.5	76%	0.759	80%	0.799	S	S	*	*			trans	-152.1	109.8	151	-80.2	111.7	0	0	0	105.5
16	S	27	Very low	30.2	Very low	97 Å²	97	149.9 Å²	149.9	68%	0.678	80%	0.801	S	S	*	*			cis	57.4	40.7	16.7	84.3	0	0	0	0	114.8
17	N	28.7	Very low	30.2	Very low	118 Å²	118	143.4 Å²	143.4	63%	0.631	79%	0.792	S	S	*	*			trans	-172.4	102.7	150.8	-95.7	-32.4	0	0	0	110.3
18	I	30.6	Very low	30.1	Very low	160 Å²	160	142.3 Å²	142.3	82%	0.821	79%	0.79	S	S	*	*			trans	176.2	64.2	152.2	-88.9	150.1	0	0	0	107.6
19	T	30.3	Very low	30	Very low	148 Å²	148	146.4 Å²	146.4	91%	0.908	79%	0.794	S	S	*	*	S	Bend	trans	-131.7	19.3	174.1	37.1	0	0	0	0	111.4
20	S	31.4	Very low	30.3	Very low	94 Å²	94	145.1 Å²	145.1	66%	0.657	80%	0.795	S	S	*	*	S	Bend	trans	-143.8	23.7	-160.1	50.9	0	0	0	0	114.4
21	K	31	Very low	30.3	Very low	192 Å²	192	143 Å²	143	84%	0.835	79%	0.793	S	S	*	*	S	Bend	trans	-130.4	-0.6	-177.4	-85.1	-161.7	171.8	-171.9	0	118.5
22	L	32.9	Very low	30.6	Very low	175 Å²	175	144.5 Å²	144.5	92%	0.916	80%	0.798	S	S	*	*	S	Bend	trans	-137.7	76.2	171.9	-73.8	175.9	0	0	0	111.5
23	R	27.6	Very low	30.8	Very low	244 Å²	244	145.4 Å²	145.4	92%	0.921	80%	0.798	S	S	*	*			trans	-151.7	52.5	164.3	-162.5	-172.8	-82	173.6	-7.7	112.2
24	T	31.8	Very low	31.3	Very low	132 Å²	132	140.9 Å²	140.9	81%	0.81	78%	0.781	S	S	*	*			trans	-153.1	130.6	162.8	-19.8	0	0	0	0	103.4
25	V	29.7	Very low	31.6	Very low	121 Å²	121	139.2 Å²	139.2	73%	0.733	78%	0.781	S	S	*	*			cis	-126.5	145.5	29.4	178.7	0	0	0	0	111.6	A27	V25-A27 WeakPolarHBondContact CG1-O 3.48Å
26	S	27.7	Very low	31.5	Very low	119 Å²	119	137 Å²	137	83%	0.832	78%	0.777	S	S	*	*			trans	-125.6	148.1	159.5	-65.7	0	0	0	0	108.5
27	A	29.7	Very low	31.9	Very low	82 Å²	82	137.6 Å²	137.6	68%	0.678	78%	0.782	S	S	*	*			trans	63.7	163.8	-171.9	0	0	0	0	0	113.3	V25	V25-A27 WeakPolarHBondContact CG1-O 3.48Å
28	T	30.8	Very low	32.1	Very low	119 Å²	119	141.5 Å²	141.5	73%	0.73	79%	0.793	S	S	*	*			cis	-154.1	170.5	16.3	-28.6	0	0	0	0	110
29	L	33.1	Very low	32.3	Very low	161 Å²	161	138.9 Å²	138.9	84%	0.843	79%	0.789	S	S	*	*			trans	66.5	160.5	169.6	-86.1	59	0	0	0	116
30	A	34.3	Very low	32.6	Very low	86 Å²	86	141.4 Å²	141.4	71%	0.711	79%	0.79	S	S	*	*			cis	-177.8	166.8	-34.3	0	0	0	0	0	108.1
31	N	30.6	Very low	32.9	Very low	155 Å²	155	140 Å²	140	83%	0.829	79%	0.791	S	S	*	*			trans	-59.6	137.7	171.2	-64.9	-35.1	0	0	0	112.2
32	T	37.3	Very low	33.2	Very low	144 Å²	144	138.6 Å²	138.6	88%	0.883	79%	0.792	S	S	*	*				-177.7	143.5	117.3	23.2	0	0	0	0	113.8
33	N	33	Very low	33.3	Very low	153 Å²	153	134.6 Å²	134.6	82%	0.818	78%	0.779	S	S	*	*			trans	-86.7	-175.1	160.4	-116	-28.3	0	0	0	108.6
34	P	40.4	Very low	33.8	Very low	87 Å²	87	129.9 Å²	129.9	57%	0.565	77%	0.771	S	S	*	*			cis	-135.8	-175.9	-5	27.4	-2.7	0	0	0	114.3
35	F	32.9	Very low	34	Very low	191 Å²	191	128 Å²	128	84%	0.838	76%	0.759	S	S	*	*				170.2	145.6	112.3	-98.5	-69.9	0	0	0	116.2
36	S	30.6	Very low	34.1	Very low	98 Å²	98	129.8 Å²	129.8	69%	0.685	76%	0.76	S	S	*	*			trans	-63.7	154.5	-172	56.7	0	0	0	0	120.3
37	S	35.3	Very low	34.2	Very low	110 Å²	110	131.4 Å²	131.4	77%	0.769	75%	0.754	S	S	*	*				167.3	160.5	121.7	49.7	0	0	0	0	111.9
38	K	33.8	Very low	34.2	Very low	200 Å²	200	133.6 Å²	133.6	87%	0.87	75%	0.754	S	S	*	*			cis	-171.9	126.3	-24.6	-104	-176.1	175.5	179.9	0	108.4
39	S	35.3	Very low	34.1	Very low	105 Å²	105	131.7 Å²	131.7	73%	0.734	75%	0.751	S	S	*	*			trans	173	109.2	151	50.8	0	0	0	0	109.6
40	Q	36.4	Very low	33.9	Very low	201 Å²	201	131.5 Å²	131.5	94%	0.939	75%	0.751	S	S	*	*				66.1	120.8	91.7	-71.8	-178.9	-62.3	0	0	114.8
41	G	36.7	Very low	33.8	Very low	65 Å²	65	133.7 Å²	133.7	67%	0.67	75%	0.751	S	S	*	*			cis	163.4	-176.6	-8	0	0	0	0	0	114.3
42	N	37.3	Very low	33.6	Very low	162 Å²	162	131.6 Å²	131.6	87%	0.866	74%	0.743	S	S	*	*			trans	68.1	144.8	164.5	-72.2	22	0	0	0	117.5
43	S	35.9	Very low	33.3	Very low	92 Å²	92	132 Å²	132	64%	0.643	73%	0.732	S	S	*	*			cis	-158.9	137.8	-3.8	53.1	0	0	0	0	110.7
44	I	37.7	Very low	33.1	Very low	144 Å²	144	132.6 Å²	132.6	74%	0.738	73%	0.73	S	S	*	*				68.4	132	106	-58.5	173.8	0	0	0	115.4
45	T	35.2	Very low	32.6	Very low	92 Å²	92	133.6 Å²	133.6	56%	0.564	74%	0.735	S	S	*	*			cis	-164.3	176	-27.2	44.4	0	0	0	0	107.6
46	E	31.9	Very low	32.4	Very low	159 Å²	159	132.7 Å²	132.7	74%	0.743	73%	0.733	S	S	*	*				34.6	152.3	129.7	-68.1	146.3	-156.6	0	0	122.2
47	E	30.9	Very low	32.5	Very low	153 Å²	153	131.6 Å²	131.6	72%	0.715	74%	0.738	S	S	*	*			cis	-175.7	-177.3	-20.7	-157.2	174.6	-135.1	0	0	106.8
48	N	28.7	Very low	32.3	Very low	128 Å²	128	131.8 Å²	131.8	68%	0.684	73%	0.729	S	S	*	*			trans	64.5	103.6	152	-63.2	-40.1	0	0	0	120.9
49	A	29.7	Very low	32.4	Very low	80 Å²	80	129.8 Å²	129.8	66%	0.661	72%	0.721	S	S	*	*				90.8	148.9	108.3	0	0	0	0	0	122
50	D	28.7	Very low	32.3	Very low	156 Å²	156	133.2 Å²	133.2	83%	0.834	72%	0.722	S	S	*	*			trans	70.8	158	153.5	-61.3	-22.3	0	0	0	122.4
51	D	30.9	Very low	32	Very low	133 Å²	133	127.6 Å²	127.6	71%	0.711	71%	0.705	S	S	*	*			trans	57.5	123.5	-177.9	-80.9	-10.9	0	0	0	118.3
52	V	27.9	Very low	31.7	Very low	111 Å²	111	133 Å²	133	67%	0.673	71%	0.71	S	S	*	*			cis	81.9	138.9	48.1	171.9	0	0	0	0	112.9
53	K	29.5	Very low	31.3	Very low	151 Å²	151	135.2 Å²	135.2	66%	0.657	71%	0.706	S	S	*	*			trans	81.1	129.8	-177.7	-66.5	144.2	-173	158.8	0	114.2
54	Q	30	Very low	30.8	Very low	166 Å²	166	141.3 Å²	141.3	78%	0.776	72%	0.715	S	S	*	*				76.4	145.9	102.7	-64.5	172.7	-16.7	0	0	113
55	T	29.6	Very low	30.4	Very low	109 Å²	109	139.9 Å²	139.9	67%	0.669	71%	0.713	S	S	*	*			cis	-159.3	167.4	-1.2	5.7	0	0	0	0	109
56	E	29.4	Very low	29.9	Very low	171 Å²	171	146.4 Å²	146.4	80%	0.799	73%	0.728	S	S	*	*			trans	39.7	113.1	152.5	-61.9	-179.2	-151.5	0	0	118.7
57	G	31.8	Very low	29.7	Very low	76 Å²	76	147.9 Å²	147.9	78%	0.784	73%	0.731	S	S	*	*				120.5	177.8	73.2	0	0	0	0	0	110.4
58	I	32	Very low	29.5	Very low	114 Å²	114	149.6 Å²	149.6	59%	0.585	73%	0.731	S	S	*	*			cis	-162	141.5	1.9	-141.9	169.3	0	0	0	110.8
59	K	34.6	Very low	29.5	Very low	158 Å²	158	148 Å²	148	69%	0.687	73%	0.726	S	S	*	*			trans	68.3	150.5	164	-60.8	157.9	-155.7	151.8	0	116.3
60	K	33.4	Very low	29.3	Very low	177 Å²	177	148.4 Å²	148.4	77%	0.77	72%	0.721	S	S	*	*			cis	-156.6	120.9	-7.3	-112.1	165	-175.6	-179.4	0	107.6
61	S	30	Very low	29.3	Very low	82 Å²	82	149.3 Å²	149.3	57%	0.573	72%	0.718	S	S	*	*				86.4	117.1	85.6	-82.4	0	0	0	0	118.4
62	K	30.6	Very low	29.2	Very low	178 Å²	178	148.2 Å²	148.2	77%	0.774	72%	0.716	S	S	*	*			trans	75.1	152.3	130.1	-64.8	166.7	-171.4	165.8	0	116.9
63	R	28	Very low	29.2	Very low	209 Å²	209	148.7 Å²	148.7	79%	0.789	72%	0.715	S	S	*	*			cis	-154.9	150.5	7	-129.2	169.9	172.8	169.7	-6.2	107.8
64	R	27.3	Very low	29.3	Very low	220 Å²	220	148.7 Å²	148.7	83%	0.83	72%	0.717	S	S	*	*				28.6	138	100.2	-38.4	171.7	89.9	158.4	2.2	113.9
65	T	28.3	Very low	29.3	Very low	114 Å²	114	145.5 Å²	145.5	70%	0.699	71%	0.713	S	S	*	*			cis	-163.4	142.5	30.4	1.4	0	0	0	0	107.4
66	R	25.1	Very low	29.5	Very low	230 Å²	230	144.6 Å²	144.6	87%	0.868	71%	0.711	S	S	*	*				57.1	129.8	80.4	-151.4	-172.9	-159	-173	8.7	114.3
67	K	28.3	Very low	29.6	Very low	189 Å²	189	142.6 Å²	142.6	82%	0.822	71%	0.711	S	S	*	*			trans	94.5	154.5	175.8	-70.3	-166.5	175	-178.9	0	116.2
68	R	26.2	Very low	29.5	Very low	190 Å²	190	143.9 Å²	143.9	72%	0.717	71%	0.708	S	S	*	*			cis	171.1	149.3	-23.1	-172.8	-172.4	127.6	140.8	-3.4	107.3
69	T	27.5	Very low	29.6	Very low	93 Å²	93	142.5 Å²	142.5	57%	0.571	71%	0.713	S	S	*	*			trans	63.9	146.1	155.5	33.3	0	0	0	0	117.4
70	T	27.4	Very low	29.3	Very low	89 Å²	89	140.8 Å²	140.8	55%	0.546	72%	0.721	S	S	.	*			cis	175.1	168.7	-21.1	25.4	0	0	0	0	105.8
71	F	28.3	Very low	29.2	Very low	176 Å²	176	135.9 Å²	135.9	77%	0.772	72%	0.72	S	S	*	*			trans	73	146.5	157.8	-54.1	-44.6	0	0	0	114.5
72	T	28.8	Very low	29.3	Very low	110 Å²	110	140.4 Å²	140.4	68%	0.675	73%	0.73	S	S	*	*			cis	-150.2	159.9	1.9	-5.7	0	0	0	0	110
73	N	27.5	Very low	29.4	Very low	121 Å²	121	138.4 Å²	138.4	65%	0.647	72%	0.723	S	S	*	*				15.8	143.5	124.8	-59.7	34.2	0	0	0	117.4
74	E	30.3	Very low	29.6	Very low	150 Å²	150	134.6 Å²	134.6	70%	0.701	72%	0.715	S	S	*	*			cis	-170.5	169.2	18.2	-128.4	163.9	-112.2	0	0	110.4
75	S	31.5	Very low	29.8	Very low	99 Å²	99	132.3 Å²	132.3	69%	0.692	71%	0.71	S	S	*	*			trans	52.9	153.2	142.5	-59.5	0	0	0	0	121.3
76	S	33.8	Very low	30.3	Very low	90 Å²	90	132.2 Å²	132.2	63%	0.629	71%	0.712	S	S	*	*			cis	-174.9	162.8	-20.8	55.6	0	0	0	0	107.3
77	T	30	Very low	30.6	Very low	130 Å²	130	128 Å²	128	80%	0.798	70%	0.702	S	S	*	*			trans	60.9	155.8	157.2	48.3	0	0	0	0	118.7
78	S	31.2	Very low	30.8	Very low	103 Å²	103	127.2 Å²	127.2	72%	0.72	69%	0.694	S	S	*	*			cis	-172.7	157	-25	53.6	0	0	0	0	110.9
79	A	33.3	Very low	31.1	Very low	84 Å²	84	124.8 Å²	124.8	69%	0.694	69%	0.689	S	S	*	*			trans	71.6	112.9	144.5	0	0	0	0	0	122.7
80	S	29.2	Very low	31.4	Very low	123 Å²	123	128.6 Å²	128.6	86%	0.86	70%	0.697	S	S	*	*				96.5	126.9	116	74.2	0	0	0	0	123.4
81	G	31.2	Very low	31.6	Very low	73 Å²	73	132.4 Å²	132.4	75%	0.753	71%	0.706	S	S	*	*			trans	93.4	156.7	140.7	0	0	0	0	0	119.2
82	K	31.9	Very low	31.9	Very low	177 Å²	177	132.5 Å²	132.5	77%	0.77	71%	0.706	S	S	*	*			cis	-176.1	151.3	-19	-132.8	179.2	160.6	-156.9	0	111.2
83	Q	33.2	Very low	32	Very low	137 Å²	137	136.3 Å²	136.3	64%	0.64	71%	0.713	S	S	*	*			trans	65.1	163.7	158.5	-67.6	167	-105.9	0	0	116.3
84	E	31.1	Very low	32.3	Very low	129 Å²	129	140.2 Å²	140.2	60%	0.603	73%	0.725	S	S	*	*			cis	-167.1	164.8	-18.1	-106.8	-177.9	-110.1	0	0	107
85	K	31.3	Very low	32.4	Very low	171 Å²	171	141.3 Å²	141.3	74%	0.743	73%	0.73	S	S	*	*			cis	-177.3	155.4	-5.6	179.8	160.7	177.4	179.7	0	111.3
86	P	39.3	Very low	32.5	Very low	113 Å²	113	146.1 Å²	146.1	73%	0.734	74%	0.738	S	S	*	*			trans	-109.1	160.5	-177.1	39.6	-33.6	0	0	0	115.4
87	E	31.8	Very low	32.5	Very low	141 Å²	141	149.2 Å²	149.2	66%	0.659	74%	0.743	S	S	*	*			trans	-157.7	119.2	157.9	-83.5	-136.9	140.4	0	0	116.1
88	R	31.9	Very low	32.7	Very low	172 Å²	172	150.3 Å²	150.3	65%	0.649	74%	0.743	S	S	*	*				76.5	135.4	122.1	-72.4	-179.1	171.9	157.5	2.9	127.3
89	K	32.9	Very low	33	Very low	139 Å²	139	153.4 Å²	153.4	60%	0.604	75%	0.746	S	S	*	*				90.9	110	125.7	-78.1	168	-174.8	159.4	0	123.1
90	K	32.6	Very low	33	Very low	173 Å²	173	153.5 Å²	153.5	75%	0.752	74%	0.742	S	S	*	*				88.3	132.5	116.2	-77.2	-178.7	180	-175.2	0	123.9
91	K	32.9	Very low	33.1	Very low	170 Å²	170	154.2 Å²	154.2	74%	0.739	74%	0.736	S	S	*	*			trans	103.1	121.5	131	-84.1	169.8	175.7	177.1	0	122.8
92	K	34.1	Very low	33.1	Very low	177 Å²	177	157.3 Å²	157.3	77%	0.77	74%	0.74	S	S	*	*				88.9	110.2	127	-79.9	-175.8	172.7	-169.6	0	123.6
93	K	30.8	Very low	33	Very low	190 Å²	190	155.4 Å²	155.4	83%	0.826	74%	0.744	S	S	*	*				52.9	122.5	116.4	-100.5	-170	175.1	-172.6	0	121
94	K	33.5	Very low	32.9	Very low	204 Å²	204	158.9 Å²	158.9	89%	0.887	76%	0.757	S	S	*	*				-169.2	165.7	108.1	-108.9	179.8	177.4	-175.4	0	114.4
95	Q	32.8	Very low	32.9	Very low	172 Å²	172	160.9 Å²	160.9	80%	0.804	77%	0.771	S	S	*	*			trans	-99	151.2	-169.8	-54	143.1	-75.9	0	0	113.5
96	K	33.1	Very low	32.9	Very low	200 Å²	200	158.5 Å²	158.5	87%	0.87	77%	0.771	S	S	*	*				175.1	134.5	108.7	-91.6	-171.2	174.3	-164.1	0	108.7
97	H	33.8	Very low	32.5	Very low	156 Å²	156	162.8 Å²	162.8	72%	0.722	78%	0.778	S	S	*	*			cis	101	107.2	47.1	-155.6	-68	0	0	0	110.8
98	D	35	Very low	32.4	Very low	152 Å²	152	161.6 Å²	161.6	81%	0.813	78%	0.78	S	S	*	*			trans	175.3	-176.1	136	-82	-11.9	0	0	0	111.1
99	H	37.6	Very low	32.2	Very low	168 Å²	168	161.1 Å²	161.1	78%	0.778	79%	0.79	S	S	*	*			trans	-112	173.4	-133.2	-137.7	-79.4	0	0	0	118.1
100	S	32.9	Very low	32.2	Very low	86 Å²	86	159.1 Å²	159.1	60%	0.601	79%	0.794	S	S	*	*			trans	75.6	106.3	155.4	47	0	0	0	0	121.4
101	D	31.8	Very low	32.4	Very low	138 Å²	138	157.7 Å²	157.7	74%	0.738	80%	0.799	S	S	*	*				64.9	103.7	118.9	-44.6	-29	0	0	0	121.2
102	T	30.9	Very low	33.3	Very low	138 Å²	138	155.8 Å²	155.8	85%	0.847	79%	0.793	S	S	*	*				169	95.2	96.5	-62.5	0	0	0	0	109.3
103	T	30.5	Very low	34.4	Very low	138 Å²	138	154.2 Å²	154.2	85%	0.847	79%	0.789	S	S	*	*			trans	-99.2	129.8	-178.8	44.1	0	0	0	0	113.7	L105	T103-L105 PolarHBondContact O-N 3.07Å
104	K	31.1	Very low	36.5	Very low	209 Å²	209	148 Å²	148	91%	0.909	77%	0.766	S	S	*	*			trans	-43.7	129.9	170.7	-56.8	169.4	-178.2	177.5	0	111.6
105	L	30.7	Very low	38.7	Very low	172 Å²	172	141.9 Å²	141.9	90%	0.901	75%	0.746	S	S	*	*			trans	-105.9	120.6	173	-115.6	161	0	0	0	110.2	T103	T103-L105 PolarHBondContact O-N 3.07Å
106	V	31.6	Very low	41.3	Very low	121 Å²	121	140 Å²	140	73%	0.733	74%	0.738	S	S	*	*			trans	-77	138.1	178.3	174.9	0	0	0	0	109.3	T108	V106-T108 PolarHBondContact O-N 2.83Å
107	K	30.3	Very low	44	Very low	203 Å²	203	132.1 Å²	132.1	88%	0.883	70%	0.702	S	S	*	*			trans	-77.1	91.9	-174.7	-161.6	176.1	-172.4	179.3	0	111.1
108	T	29.2	Very low	46.7	Very low	116 Å²	116	127.9 Å²	127.9	71%	0.712	69%	0.688	S	S	*	*			trans	-80.9	133.7	171.1	49.8	0	0	0	0	110.9	V106 S110	V106-T108 PolarHBondContact O-N 2.83Å; T108-S110 PolarHBondContact O-N 3.01Å; T108-S110 VanDerWaalsContact O-N 3.1Å
109	N	29	Very low	49.4	Very low	162 Å²	162	120.8 Å²	120.8	87%	0.866	65%	0.65	S	S	*	*			trans	-68.3	104.8	172.5	-73.5	-14.6	0	0	0	110.1
110	S	33.2	Very low	51.7	Low	97 Å²	97	117.5 Å²	117.5	68%	0.678	64%	0.635	S	S	*	*			trans	-76.2	132.9	167.8	46	0	0	0	0	110.2	T108 Q112	T108-S110 PolarHBondContact O-N 3.01Å; T108-S110 VanDerWaalsContact O-N 3.1Å; S110-Q112 PolarHBondContact O-N 3.47Å
111	V	36.3	Very low	54.2	Low	143 Å²	143	122.1 Å²	122.1	87%	0.867	65%	0.647	S	S	*	*			trans	-72.1	100.6	171	179.5	0	0	0	0	107.6	Q113	V111-Q113 PolarHBondContact O-N 3.17Å
112	Q	50.9	Low	56.6	Low	130 Å²	130	119.1 Å²	119.1	61%	0.607	65%	0.648	S	S	*	*			trans	-67.2	126.1	173.1	-67.9	-179.1	-43.3	0	0	109	S110	S110-Q112 PolarHBondContact O-N 3.47Å
113	Q	57.3	Low	59.3	Low	144 Å²	144	114.1 Å²	114.1	67%	0.673	62%	0.616	S	S	*	*			trans	-67.3	140.9	168.9	-67.3	-178.7	-19.4	0	0	109.2	V111 I160	V111-Q113 PolarHBondContact O-N 3.17Å; Q113-I160 HydrophobicContact CB-CB 4.49Å; Q113-I160 HydrophobicContact CB-CD1 3.79Å; Q113-I160 HydrophobicContact CB-CG1 4.24Å; Q113-I160 PolarHBondContact O-N 3.22Å
114	T	75.4	Confident	62.1	Low	59 Å²	59	110.2 Å²	110.2	36%	0.362	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.8	134.7	179.3	58.4	0	0	0	0	111.7	V142 K157 L158	T114-V142 HydrophobicContact CG2-CG1 4.17Å; T114-K157 HydrophobicContact CG2-CB 4.46Å; T114-L158 CarbonylContact C-O 3.53Å; T114-L158 WeakPolarHBondContact CA-O 3.41Å; T114-L158 WeakPolarHBondContact CB-O 3.47Å
115	T	78.7	Confident	64.9	Low	75 Å²	75	100.5 Å²	100.5	46%	0.46	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.5	158.7	164.2	40.1	0	0	0	0	110.9	K157 L158 I160	T115-K157 WeakPolarHBondContact O-CA 3.39Å; T115-L158 PolarHBondContact N-O 2.77Å; T115-L158 PolarHBondContact O-N 2.88Å; T115-I160 HydrophobicContact CG2-CD1 3.92Å; T115-I160 HydrophobicContact CG2-CG1 3.98Å
116	E	87.7	Confident	67.7	Low	134 Å²	134	97 Å²	97	63%	0.626	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	135.6	174.3	-62.3	-170.9	159.4	0	0	110	V155 I156	E116-V155 HydrophobicContact CB-CG1 3.93Å; E116-V155 HydrophobicContact CG-CG1 4.36Å; E116-I156 CarbonylContact C-O 3.53Å; E116-I156 WeakPolarHBondContact CA-O 3.36Å
117	Y	90.5	Very high	70.5	Confident	33 Å²	33	93.6 Å²	93.6	13%	0.129	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	140.1	178.1	176.3	-96.1	0	0	0	109.8	D123 V128 R131 F132 V155 I156 L158	Y117-D123 WeakPolarHBondContact CE1-OD2 3.49Å; Y117-D123 PolarHBondContact OH-OD2 3.25Å; Y117-V128 HydrophobicContact CE1-CG2 4.35Å; Y117-R131 PolarHBondContact OH-NH1 3.09Å; Y117-F132 HydrophobicContact CD1-CE2 4.47Å; Y117-F132 HydrophobicContact CD2-CE2 4.05Å; Y117-F132 AromaticContact CD2-CZ 3.73Å; Y117-F132 HydrophobicContact CD2-CZ 3.73Å; Y117-F132 HydrophobicContact CE2-CE2 4.14Å; Y117-F132 AromaticContact CE2-CZ 3.9Å; Y117-F132 HydrophobicContact CE2-CZ 3.9Å; Y117-F132 HydrophobicContact CG-CE2 4.23Å; Y117-F132 HydrophobicContact CG-CZ 4.29Å; Y117-V155 CarbonylContact O-C 3.47Å; Y117-V155 WeakPolarHBondContact O-CA 3.25Å; Y117-I156 HydrophobicContact CD1-CD1 3.81Å; Y117-I156 HydrophobicContact CD1-CG1 4.03Å; Y117-I156 HydrophobicContact CG-CG1 4.49Å; Y117-I156 PolarHBondContact N-O 2.78Å; Y117-I156 PolarHBondContact O-N 2.8Å; Y117-L158 HydrophobicContact CG-CD1 4.12Å
118	V	90.8	Very high	73.4	Confident	68 Å²	68	83.9 Å²	83.9	41%	0.412	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	119	176.9	-174.7	0	0	0	0	108.5	Q120 V155	V118-Q120 PolarHBondContact O-N 2.91Å; V118-Q120 PolarHBondContact O-NE2 3.41Å; V118-V155 HydrophobicContact CG2-CG2 4.45Å
119	V	91.2	Very high	76.4	Confident	2 Å²	2	78.4 Å²	78.4	1%	0.012	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-60.7	126.7	179.6	175.2	0	0	0	0	110.5	D123 L150 F151 G153 Q154 I156	V119-D123 HydrophobicContact CG1-CB 3.73Å; V119-L150 HydrophobicContact CG1-CB 4.09Å; V119-L150 HydrophobicContact CG2-CB 4.24Å; V119-L150 HydrophobicContact CG2-CD1 3.98Å; V119-F151 WeakPolarHBondContact CB-O 3.34Å; V119-F151 WeakPolarHBondContact CG1-O 3.26Å; V119-G153 PolarHBondContact O-N 2.72Å; V119-Q154 HydrophobicContact CB-CB 4.39Å; V119-Q154 HydrophobicContact CG2-CB 4.23Å; V119-Q154 WeakPolarHBondContact CG2-O 3.32Å; V119-Q154 PolarHBondContact N-O 3.15Å; V119-I156 HydrophobicContact CG2-CD1 4.32Å; V119-I156 HydrophobicContact CG2-CG2 3.95Å
120	Q	86.6	Confident	79.2	Confident	100 Å²	100	73.9 Å²	73.9	47%	0.467	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-96.1	169.3	-177.2	-59.6	-57.4	-55.8	0	0	112.4	V118 G122 D123	V118-Q120 PolarHBondContact O-N 2.91Å; V118-Q120 PolarHBondContact O-NE2 3.41Å; Q120-G122 PolarHBondContact O-N 3.14Å; Q120-D123 PolarHBondContact N-OD2 3.25Å; Q120-D123 WeakPolarHBondContact O-CB 3.42Å; Q120-D123 PolarHBondContact O-N 3Å; Q120-D123 VanDerWaalsContact O-N 3.13Å
121	E	84	Confident	81.8	Confident	182 Å²	182	76.4 Å²	76.4	85%	0.85	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	127.2	170.3	-170	175.1	179.2	0	0	110.2
122	G	82.6	Confident	84.3	Confident	75 Å²	75	72.5 Å²	72.5	77%	0.773	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	-8	-173.7	0	0	0	0	0	115.6	Q120	Q120-G122 PolarHBondContact O-N 3.14Å
123	D	88	Confident	86.1	Confident	33 Å²	33	72.6 Å²	72.6	18%	0.176	40%	0.397	C	S	.	.			trans	-70.1	132.6	171.6	-87.1	-31.6	0	0	0	111.3	Y117 V119 Q120 V128	Y117-D123 WeakPolarHBondContact CE1-OD2 3.49Å; Y117-D123 PolarHBondContact OH-OD2 3.25Å; V119-D123 HydrophobicContact CG1-CB 3.73Å; Q120-D123 PolarHBondContact N-OD2 3.25Å; Q120-D123 WeakPolarHBondContact O-CB 3.42Å; Q120-D123 PolarHBondContact O-N 3Å; Q120-D123 VanDerWaalsContact O-N 3.13Å; D123-V128 HydrophobicContact CB-CG2 3.71Å
124	S	89.3	Confident	87.5	Confident	56 Å²	56	66.6 Å²	66.6	39%	0.392	37%	0.369	S	S	.	.			trans	-116.9	157.7	170.9	72.9	0	0	0	0	109.9	N126 S127 V128	S124-N126 PolarHBondContact O-N 3.35Å; S124-S127 PolarHBondContact N-OG 2.86Å; S124-S127 PolarHBondContact O-N 3.03Å; S124-S127 VanDerWaalsContact O-N 3.15Å; S124-S127 PolarHBondContact O-OG 2.97Å; S124-S127 VanDerWaalsContact OG-CB 3.32Å; S124-S127 WeakPolarHBondContact OG-CB 3.09Å; S124-S127 PolarHBondContact OG-N 2.99Å; S124-S127 PolarHBondContact OG-OG 3.09Å; S124-V128 WeakPolarHBondContact O-CB 3.23Å; S124-V128 WeakPolarHBondContact O-CG2 3.41Å; S124-V128 PolarHBondContact O-N 2.81Å
125	F	89.6	Confident	88.1	Confident	6 Å²	6	67 Å²	67	3%	0.026	37%	0.371	C	S	.	.	H	α-helix	trans	-55.8	-36.8	178.5	-173.1	-105	0	0	0	113.3	A129 P136 L139 C140 F145 R148 L150	F125-A129 VanDerWaalsContact O-CB 3.3Å; F125-A129 WeakPolarHBondContact O-CB 3.25Å; F125-A129 PolarHBondContact O-N 2.88Å; F125-A129 VanDerWaalsContact O-N 3.09Å; F125-P136 HydrophobicContact CD1-CB 4.18Å; F125-P136 HydrophobicContact CE1-CB 3.71Å; F125-P136 WeakPolarHBondContact CE1-O 3.3Å; F125-P136 VanDerWaalsContact CZ-O 3.24Å; F125-P136 WeakPolarHBondContact CZ-O 3.42Å; F125-L139 HydrophobicContact CD2-CD2 3.86Å; F125-L139 HydrophobicContact CE2-CB 4.36Å; F125-L139 HydrophobicContact CE2-CD2 3.63Å; F125-L139 HydrophobicContact CE2-CG 3.84Å; F125-L139 HydrophobicContact CZ-CB 4.23Å; F125-L139 HydrophobicContact CZ-CD2 4.15Å; F125-L139 HydrophobicContact CZ-CG 4.22Å; F125-C140 HydrophobicContact CZ-CB 4.04Å; F125-F145 AromaticContact CE2-CD2 3.92Å; F125-F145 HydrophobicContact CE2-CD2 3.92Å; F125-F145 HydrophobicContact CE2-CE2 4.35Å; F125-R148 HydrophobicContact CB-CB 4.46Å; F125-R148 WeakPolarHBondContact CB-O 3.33Å; F125-R148 HydrophobicContact CD1-CB 3.74Å; F125-R148 HydrophobicContact CD1-CG 3.87Å; F125-R148 HydrophobicContact CE1-CB 4.19Å; F125-R148 HydrophobicContact CE1-CG 3.83Å; F125-R148 HydrophobicContact CG-CB 4.14Å; F125-L150 HydrophobicContact CB-CD1 4.27Å; F125-L150 HydrophobicContact CB-CG 4.22Å; F125-L150 HydrophobicContact CD2-CD1 4.1Å; F125-L150 HydrophobicContact CD2-CD2 4.1Å; F125-L150 HydrophobicContact CD2-CG 3.97Å
126	N	89.7	Confident	88.4	Confident	99 Å²	99	65.2 Å²	65.2	53%	0.529	36%	0.361	S	S	.	.	H	α-helix	trans	-76.6	-39.5	177.5	-72.4	11	0	0	0	112.6	S124 A129 A130	S124-N126 PolarHBondContact O-N 3.35Å; N126-A129 PolarHBondContact O-N 3.41Å; N126-A130 WeakPolarHBondContact O-CB 3.36Å; N126-A130 PolarHBondContact O-N 2.78Å
127	S	90.9	Very high	88.3	Confident	48 Å²	48	61.8 Å²	61.8	34%	0.336	35%	0.352	S	S	.	.	H	α-helix	trans	-70.3	-35.7	178.1	63.9	0	0	0	0	112	S124 R131	S124-S127 PolarHBondContact N-OG 2.86Å; S124-S127 PolarHBondContact O-N 3.03Å; S124-S127 VanDerWaalsContact O-N 3.15Å; S124-S127 PolarHBondContact O-OG 2.97Å; S124-S127 VanDerWaalsContact OG-CB 3.32Å; S124-S127 WeakPolarHBondContact OG-CB 3.09Å; S124-S127 PolarHBondContact OG-N 2.99Å; S124-S127 PolarHBondContact OG-OG 3.09Å; S127-R131 WeakPolarHBondContact O-CB 3.12Å; S127-R131 PolarHBondContact O-N 3.05Å
128	V	91.3	Very high	88.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-65.2	-46.6	171.8	171.7	0	0	0	0	110.8	Y117 D123 S124 A130 R131 F132 L139 L150 I156	Y117-V128 HydrophobicContact CE1-CG2 4.35Å; D123-V128 HydrophobicContact CB-CG2 3.71Å; S124-V128 WeakPolarHBondContact O-CB 3.23Å; S124-V128 WeakPolarHBondContact O-CG2 3.41Å; S124-V128 PolarHBondContact O-N 2.81Å; V128-A130 PolarHBondContact O-N 2.61Å; V128-R131 PolarHBondContact O-N 3.07Å; V128-F132 HydrophobicContact CG1-CD2 4.25Å; V128-F132 HydrophobicContact CG1-CE2 4.39Å; V128-F132 VanDerWaalsContact O-CD2 3.29Å; V128-F132 WeakPolarHBondContact O-CD2 3.37Å; V128-F132 PolarHBondContact O-N 2.62Å; V128-L139 HydrophobicContact CB-CD2 4.45Å; V128-L139 HydrophobicContact CG1-CD2 3.99Å; V128-L150 HydrophobicContact CB-CD1 4.35Å; V128-L150 HydrophobicContact CG2-CD1 4.14Å; V128-I156 HydrophobicContact CG1-CD1 3.5Å; V128-I156 VanDerWaalsContact CG1-CD1 3.5Å
129	A	91.6	Very high	88	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-58.2	-48.7	176.3	0	0	0	0	0	111.6	F125 N126 R131 F132 D133 L134 P136 L139	F125-A129 VanDerWaalsContact O-CB 3.3Å; F125-A129 WeakPolarHBondContact O-CB 3.25Å; F125-A129 PolarHBondContact O-N 2.88Å; F125-A129 VanDerWaalsContact O-N 3.09Å; N126-A129 PolarHBondContact O-N 3.41Å; A129-R131 PolarHBondContact O-N 2.82Å; A129-F132 PolarHBondContact O-N 2.84Å; A129-D133 PolarHBondContact O-N 3.39Å; A129-L134 CarbonylContact C-O 3.55Å; A129-L134 WeakPolarHBondContact CB-O 3.5Å; A129-L134 PolarHBondContact O-N 3.12Å; A129-P136 HydrophobicContact CB-CB 4.47Å; A129-P136 HydrophobicContact CB-CG 4.05Å; A129-L139 HydrophobicContact CB-CB 4.44Å; A129-L139 HydrophobicContact CB-CD2 3.94Å
130	A	87.5	Confident	87.8	Confident	68 Å²	68	62.3 Å²	62.3	56%	0.562	35%	0.354	S	S	*	.	H	α-helix	trans	-63.7	-37.1	177.6	0	0	0	0	0	113.5	N126 V128 F132 D133	N126-A130 WeakPolarHBondContact O-CB 3.36Å; N126-A130 PolarHBondContact O-N 2.78Å; V128-A130 PolarHBondContact O-N 2.61Å; A130-F132 PolarHBondContact O-N 2.65Å; A130-D133 PolarHBondContact O-N 2.93Å
131	R	88.2	Confident	87.8	Confident	149 Å²	149	65.9 Å²	65.9	56%	0.562	36%	0.364	S	S	*	.	H	α-helix	trans	-64.3	-20.8	179.5	-177.9	175.4	-176	-176	1	113.9	Y117 S127 V128 A129	Y117-R131 PolarHBondContact OH-NH1 3.09Å; S127-R131 WeakPolarHBondContact O-CB 3.12Å; S127-R131 PolarHBondContact O-N 3.05Å; V128-R131 PolarHBondContact O-N 3.07Å; A129-R131 PolarHBondContact O-N 2.82Å
132	F	88.3	Confident	87.9	Confident	61 Å²	61	59.2 Å²	59.2	27%	0.268	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118	18.3	-177.9	-65.6	-69.9	0	0	0	113.3	Y117 V128 A129 A130 L134 L158	Y117-F132 HydrophobicContact CD1-CE2 4.47Å; Y117-F132 HydrophobicContact CD2-CE2 4.05Å; Y117-F132 AromaticContact CD2-CZ 3.73Å; Y117-F132 HydrophobicContact CD2-CZ 3.73Å; Y117-F132 HydrophobicContact CE2-CE2 4.14Å; Y117-F132 AromaticContact CE2-CZ 3.9Å; Y117-F132 HydrophobicContact CE2-CZ 3.9Å; Y117-F132 HydrophobicContact CG-CE2 4.23Å; Y117-F132 HydrophobicContact CG-CZ 4.29Å; V128-F132 HydrophobicContact CG1-CD2 4.25Å; V128-F132 HydrophobicContact CG1-CE2 4.39Å; V128-F132 VanDerWaalsContact O-CD2 3.29Å; V128-F132 WeakPolarHBondContact O-CD2 3.37Å; V128-F132 PolarHBondContact O-N 2.62Å; A129-F132 PolarHBondContact O-N 2.84Å; A130-F132 PolarHBondContact O-N 2.65Å; F132-L134 HydrophobicContact CB-CD1 4.2Å; F132-L134 HydrophobicContact CB-CG 4.13Å; F132-L134 WeakPolarHBondContact O-CG 3.13Å; F132-L134 PolarHBondContact O-N 3.47Å; F132-L158 HydrophobicContact CD1-CD1 3.92Å; F132-L158 HydrophobicContact CD2-CD1 3.5Å; F132-L158 VanDerWaalsContact CD2-CD1 3.5Å; F132-L158 HydrophobicContact CD2-CD2 4.01Å; F132-L158 HydrophobicContact CD2-CG 4.41Å; F132-L158 HydrophobicContact CE1-CD1 3.83Å; F132-L158 HydrophobicContact CE2-CD1 3.42Å; F132-L158 VanDerWaalsContact CE2-CD1 3.42Å; F132-L158 HydrophobicContact CG-CD1 3.77Å; F132-L158 HydrophobicContact CG-CD2 4.37Å; F132-L158 HydrophobicContact CZ-CD1 3.59Å
133	D	88.1	Confident	88	Confident	133 Å²	133	57 Å²	57	71%	0.711	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	35.4	-177.6	-63.4	-42.3	0	0	0	114	A129 A130	A129-D133 PolarHBondContact O-N 3.39Å; A130-D133 PolarHBondContact O-N 2.93Å
134	L	87.7	Confident	87.9	Confident	17 Å²	17	64.1 Å²	64.1	9%	0.089	34%	0.335	C	S	.	.			trans	-105.2	142	178.3	-55	177.5	0	0	0	110.6	A129 F132 L139 L158 P159	A129-L134 CarbonylContact C-O 3.55Å; A129-L134 WeakPolarHBondContact CB-O 3.5Å; A129-L134 PolarHBondContact O-N 3.12Å; F132-L134 HydrophobicContact CB-CD1 4.2Å; F132-L134 HydrophobicContact CB-CG 4.13Å; F132-L134 WeakPolarHBondContact O-CG 3.13Å; F132-L134 PolarHBondContact O-N 3.47Å; L134-L139 HydrophobicContact CD1-CB 4.31Å; L134-L139 HydrophobicContact CD1-CD1 3.95Å; L134-L158 HydrophobicContact CD1-CD2 3.82Å; L134-P159 HydrophobicContact CD1-CG 4.49Å; L134-P159 HydrophobicContact CD2-CG 3.65Å
135	T	87.9	Confident	87.6	Confident	68 Å²	68	63.7 Å²	63.7	42%	0.417	33%	0.326	S	S	.	.			trans	-67.8	146.8	160.9	66.4	0	0	0	0	109.6	S137 E138 L139	T135-S137 PolarHBondContact O-N 2.99Å; T135-E138 VanDerWaalsContact CB-OE2 3.29Å; T135-E138 WeakPolarHBondContact CB-OE2 3.32Å; T135-E138 WeakPolarHBondContact CG2-OE2 3.13Å; T135-E138 PolarHBondContact N-OE2 2.86Å; T135-E138 PolarHBondContact O-N 3.14Å; T135-E138 VanDerWaalsContact OG1-CD 3.23Å; T135-E138 VanDerWaalsContact OG1-CG 3.3Å; T135-E138 WeakPolarHBondContact OG1-CG 3.27Å; T135-E138 PolarHBondContact OG1-N 3.03Å; T135-E138 PolarHBondContact OG1-OE2 2.91Å; T135-L139 PolarHBondContact O-N 2.81Å
136	P	86	Confident	86.8	Confident	37 Å²	37	72 Å²	72	24%	0.24	37%	0.37	C	S	.	.	H	α-helix	trans	-54.3	-27.1	172.6	-29.3	36.5	0	0	0	113.4	F125 A129 C140	F125-P136 HydrophobicContact CD1-CB 4.18Å; F125-P136 HydrophobicContact CE1-CB 3.71Å; F125-P136 WeakPolarHBondContact CE1-O 3.3Å; F125-P136 VanDerWaalsContact CZ-O 3.24Å; F125-P136 WeakPolarHBondContact CZ-O 3.42Å; A129-P136 HydrophobicContact CB-CB 4.47Å; A129-P136 HydrophobicContact CB-CG 4.05Å; P136-C140 VanDerWaalsContact O-CB 3.24Å; P136-C140 WeakPolarHBondContact O-CB 3.46Å; P136-C140 PolarHBondContact O-N 2.83Å; P136-C140 VanDerWaalsContact O-N 3.11Å
137	S	85.6	Confident	86.1	Confident	63 Å²	63	70.1 Å²	70.1	44%	0.441	37%	0.365	S	S	.	.	H	α-helix	trans	-74.5	-29.9	175.7	-58.4	0	0	0	0	113.4	T135 R141	T135-S137 PolarHBondContact O-N 2.99Å; S137-R141 WeakPolarHBondContact O-CB 3.36Å; S137-R141 PolarHBondContact O-N 2.83Å; S137-R141 VanDerWaalsContact O-N 3.1Å
138	E	85.9	Confident	85.7	Confident	77 Å²	77	75 Å²	75	36%	0.36	38%	0.376	S	S	.	.	H	α-helix	trans	-78.2	-42.8	173.6	-75.1	158.3	141.5	0	0	111.8	T135 C140 R141 V142	T135-E138 VanDerWaalsContact CB-OE2 3.29Å; T135-E138 WeakPolarHBondContact CB-OE2 3.32Å; T135-E138 WeakPolarHBondContact CG2-OE2 3.13Å; T135-E138 PolarHBondContact N-OE2 2.86Å; T135-E138 PolarHBondContact O-N 3.14Å; T135-E138 VanDerWaalsContact OG1-CD 3.23Å; T135-E138 VanDerWaalsContact OG1-CG 3.3Å; T135-E138 WeakPolarHBondContact OG1-CG 3.27Å; T135-E138 PolarHBondContact OG1-N 3.03Å; T135-E138 PolarHBondContact OG1-OE2 2.91Å; E138-C140 PolarHBondContact O-N 2.99Å; E138-R141 PolarHBondContact O-N 3.14Å; E138-V142 WeakPolarHBondContact O-CG2 3.38Å; E138-V142 PolarHBondContact O-N 3.24Å
139	L	87.2	Confident	85.3	Confident	0 Å²	0	79 Å²	79	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-56.9	-41.9	172.9	-177	63.8	0	0	0	110.9	F125 V128 A129 L134 T135 N143 I156 L158	F125-L139 HydrophobicContact CD2-CD2 3.86Å; F125-L139 HydrophobicContact CE2-CB 4.36Å; F125-L139 HydrophobicContact CE2-CD2 3.63Å; F125-L139 HydrophobicContact CE2-CG 3.84Å; F125-L139 HydrophobicContact CZ-CB 4.23Å; F125-L139 HydrophobicContact CZ-CD2 4.15Å; F125-L139 HydrophobicContact CZ-CG 4.22Å; V128-L139 HydrophobicContact CB-CD2 4.45Å; V128-L139 HydrophobicContact CG1-CD2 3.99Å; A129-L139 HydrophobicContact CB-CB 4.44Å; A129-L139 HydrophobicContact CB-CD2 3.94Å; L134-L139 HydrophobicContact CD1-CB 4.31Å; L134-L139 HydrophobicContact CD1-CD1 3.95Å; T135-L139 PolarHBondContact O-N 2.81Å; L139-N143 WeakPolarHBondContact O-CB 3.33Å; L139-N143 PolarHBondContact O-N 2.79Å; L139-N143 PolarHBondContact O-ND2 2.84Å; L139-I156 HydrophobicContact CD1-CD1 4.35Å; L139-L158 HydrophobicContact CD1-CD2 3.57Å
140	C	87.8	Confident	85	Confident	36 Å²	36	80.2 Å²	80.2	24%	0.243	41%	0.407	C	S	.	.	H	α-helix	trans	-58.3	-50.1	171.6	-170.3	0	0	0	0	112.2	F125 P136 E138 N143 K144 F145	F125-C140 HydrophobicContact CZ-CB 4.04Å; P136-C140 VanDerWaalsContact O-CB 3.24Å; P136-C140 WeakPolarHBondContact O-CB 3.46Å; P136-C140 PolarHBondContact O-N 2.83Å; P136-C140 VanDerWaalsContact O-N 3.11Å; E138-C140 PolarHBondContact O-N 2.99Å; C140-N143 PolarHBondContact O-N 2.79Å; C140-K144 WeakPolarHBondContact O-CA 3.18Å; C140-K144 PolarHBondContact O-N 2.88Å; C140-F145 PolarHBondContact O-N 3.04Å; C140-F145 PolarHBondContact SG-O 2.96Å
141	R	86.7	Confident	84.9	Confident	176 Å²	176	82.4 Å²	82.4	66%	0.664	40%	0.404	S	S	*	.	H	α-helix	trans	-64.7	-40.5	-177.6	-170.2	-173.9	-60.8	135.7	2.1	113.4	S137 E138 N143	S137-R141 WeakPolarHBondContact O-CB 3.36Å; S137-R141 PolarHBondContact O-N 2.83Å; S137-R141 VanDerWaalsContact O-N 3.1Å; E138-R141 PolarHBondContact O-N 3.14Å; R141-N143 VanDerWaalsContact C-N 3.34Å
142	V	85.4	Confident	84.7	Confident	42 Å²	42	80.1 Å²	80.1	26%	0.255	41%	0.406	S	S	.	.	H	α-helix	trans	-67.1	-36.3	178.3	171.7	0	0	0	0	111.2	T114 E138 K157 P159	T114-V142 HydrophobicContact CG2-CG1 4.17Å; E138-V142 WeakPolarHBondContact O-CG2 3.38Å; E138-V142 PolarHBondContact O-N 3.24Å; V142-K157 HydrophobicContact CG1-CB 4.07Å; V142-K157 WeakPolarHBondContact CG1-O 3.42Å; V142-P159 HydrophobicContact CG2-CG 4.34Å
143	N	86.4	Confident	84.2	Confident	29 Å²	29	79.5 Å²	79.5	16%	0.155	42%	0.417	C	S	.	.	H	α-helix	trans	-94.3	-9.6	-177.2	-72.6	-83.4	0	0	0	114.9	L139 C140 R141 F145 I156 K157	L139-N143 WeakPolarHBondContact O-CB 3.33Å; L139-N143 PolarHBondContact O-N 2.79Å; L139-N143 PolarHBondContact O-ND2 2.84Å; C140-N143 PolarHBondContact O-N 2.79Å; R141-N143 VanDerWaalsContact C-N 3.34Å; N143-F145 HydrophobicContact CB-CD1 3.96Å; N143-F145 HydrophobicContact CB-CD2 3.46Å; N143-F145 VanDerWaalsContact CB-CD2 3.46Å; N143-F145 HydrophobicContact CB-CE1 3.78Å; N143-F145 HydrophobicContact CB-CE2 3.27Å; N143-F145 HydrophobicContact CB-CG 3.8Å; N143-F145 HydrophobicContact CB-CZ 3.44Å; N143-F145 VanDerWaalsContact CB-CZ 3.44Å; N143-F145 PolarHBondContact O-N 3.39Å; N143-I156 WeakPolarHBondContact OD1-CA 3.47Å; N143-K157 PolarHBondContact ND2-O 3.1Å; N143-K157 PolarHBondContact OD1-N 3.14Å
144	K	84.9	Confident	84.2	Confident	181 Å²	181	75.5 Å²	75.5	79%	0.787	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	34.2	-170.7	-51.6	-179.9	-178.7	179.6	0	113.4	C140	C140-K144 WeakPolarHBondContact O-CA 3.18Å; C140-K144 PolarHBondContact O-N 2.88Å
145	F	83.5	Confident	84.2	Confident	47 Å²	47	78.5 Å²	78.5	21%	0.206	41%	0.413	C	S	.	.			trans	-70.5	147.5	176.6	-63.7	-41	0	0	0	111.5	F125 C140 N143 L150 I156	F125-F145 AromaticContact CE2-CD2 3.92Å; F125-F145 HydrophobicContact CE2-CD2 3.92Å; F125-F145 HydrophobicContact CE2-CE2 4.35Å; C140-F145 PolarHBondContact O-N 3.04Å; C140-F145 PolarHBondContact SG-O 2.96Å; N143-F145 HydrophobicContact CB-CD1 3.96Å; N143-F145 HydrophobicContact CB-CD2 3.46Å; N143-F145 VanDerWaalsContact CB-CD2 3.46Å; N143-F145 HydrophobicContact CB-CE1 3.78Å; N143-F145 HydrophobicContact CB-CE2 3.27Å; N143-F145 HydrophobicContact CB-CG 3.8Å; N143-F145 HydrophobicContact CB-CZ 3.44Å; N143-F145 VanDerWaalsContact CB-CZ 3.44Å; N143-F145 PolarHBondContact O-N 3.39Å; F145-L150 HydrophobicContact CE2-CD2 3.91Å; F145-L150 HydrophobicContact CZ-CD2 4.18Å; F145-I156 HydrophobicContact CE2-CG2 4.29Å; F145-I156 HydrophobicContact CZ-CB 4.38Å; F145-I156 HydrophobicContact CZ-CG2 3.83Å
146	L	71.3	Confident	84.3	Confident	180 Å²	180	75.3 Å²	75.3	94%	0.942	39%	0.393	S	S	*	.	S	Bend	trans	-103.4	-5.2	168.8	-70.2	86	0	0	0	112.3
147	S	75.3	Confident	84.4	Confident	61 Å²	61	78.1 Å²	78.1	43%	0.427	40%	0.402	S	S	.	.	S	Bend	trans	-131.6	158.8	-179.3	-178.5	0	0	0	0	111.2	T149	S147-T149 PolarHBondContact OG-N 3.4Å; S147-T149 PolarHBondContact OG-OG1 3.08Å
148	R	82.8	Confident	84.5	Confident	150 Å²	150	75.4 Å²	75.4	57%	0.566	38%	0.382	S	S	*	.	S	Bend	trans	-97.5	17.1	173.6	-60.7	177.7	178.7	-106.5	-1.9	112.5	F125	F125-R148 HydrophobicContact CB-CB 4.46Å; F125-R148 WeakPolarHBondContact CB-O 3.33Å; F125-R148 HydrophobicContact CD1-CB 3.74Å; F125-R148 HydrophobicContact CD1-CG 3.87Å; F125-R148 HydrophobicContact CE1-CB 4.19Å; F125-R148 HydrophobicContact CE1-CG 3.83Å; F125-R148 HydrophobicContact CG-CB 4.14Å
149	T	83.2	Confident	84.3	Confident	83 Å²	83	72.9 Å²	72.9	51%	0.509	37%	0.372	S	S	.	.			trans	-95.2	127.4	175.9	52.6	0	0	0	0	110.4	S147	S147-T149 PolarHBondContact OG-N 3.4Å; S147-T149 PolarHBondContact OG-OG1 3.08Å
150	L	85.5	Confident	83.3	Confident	26 Å²	26	76.6 Å²	76.6	14%	0.136	39%	0.392	C	S	.	.			trans	-112.8	151.8	169.3	-62.1	179.2	0	0	0	109.6	V119 F125 V128 F145 I156	V119-L150 HydrophobicContact CG1-CB 4.09Å; V119-L150 HydrophobicContact CG2-CB 4.24Å; V119-L150 HydrophobicContact CG2-CD1 3.98Å; F125-L150 HydrophobicContact CB-CD1 4.27Å; F125-L150 HydrophobicContact CB-CG 4.22Å; F125-L150 HydrophobicContact CD2-CD1 4.1Å; F125-L150 HydrophobicContact CD2-CD2 4.1Å; F125-L150 HydrophobicContact CD2-CG 3.97Å; V128-L150 HydrophobicContact CB-CD1 4.35Å; V128-L150 HydrophobicContact CG2-CD1 4.14Å; F145-L150 HydrophobicContact CE2-CD2 3.91Å; F145-L150 HydrophobicContact CZ-CD2 4.18Å; L150-I156 HydrophobicContact CD2-CG2 4.21Å
151	F	84.4	Confident	81.8	Confident	115 Å²	115	79.5 Å²	79.5	50%	0.504	41%	0.405	S	S	.	.			trans	-115.7	145.1	174.3	-60.9	-78	0	0	0	110.9	V119 G153 Q154	V119-F151 WeakPolarHBondContact CB-O 3.34Å; V119-F151 WeakPolarHBondContact CG1-O 3.26Å; F151-G153 PolarHBondContact O-N 3.48Å; F151-Q154 WeakPolarHBondContact O-CB 3.34Å; F151-Q154 PolarHBondContact O-N 3.24Å
152	V	85.4	Confident	79.9	Confident	101 Å²	101	80.3 Å²	80.3	61%	0.612	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	134.1	175.3	-174.6	0	0	0	0	109.7	Q154	V152-Q154 VanDerWaalsContact C-N 3.32Å
153	G	78.1	Confident	77.9	Confident	48 Å²	48	87.5 Å²	87.5	50%	0.495	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	-5.1	-173.3	0	0	0	0	0	115.1	V119 F151	V119-G153 PolarHBondContact O-N 2.72Å; F151-G153 PolarHBondContact O-N 3.48Å
154	Q	86.6	Confident	75.7	Confident	49 Å²	49	89.3 Å²	89.3	23%	0.229	46%	0.456	C	S	.	.			trans	-68.3	131.7	175.1	-175.7	177.7	-12.4	0	0	111	V119 F151 V152 I156	V119-Q154 HydrophobicContact CB-CB 4.39Å; V119-Q154 HydrophobicContact CG2-CB 4.23Å; V119-Q154 WeakPolarHBondContact CG2-O 3.32Å; V119-Q154 PolarHBondContact N-O 3.15Å; F151-Q154 WeakPolarHBondContact O-CB 3.34Å; F151-Q154 PolarHBondContact O-N 3.24Å; V152-Q154 VanDerWaalsContact C-N 3.32Å; Q154-I156 HydrophobicContact CG-CG2 4.23Å
155	V	88.5	Confident	73.4	Confident	79 Å²	79	85.6 Å²	85.6	48%	0.479	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	131.2	172.7	-171.6	0	0	0	0	109.6	E116 Y117 V118	E116-V155 HydrophobicContact CB-CG1 3.93Å; E116-V155 HydrophobicContact CG-CG1 4.36Å; Y117-V155 CarbonylContact O-C 3.47Å; Y117-V155 WeakPolarHBondContact O-CA 3.25Å; V118-V155 HydrophobicContact CG2-CG2 4.45Å
156	I	90.1	Very high	71	Confident	1 Å²	1	88.3 Å²	88.3	1%	0.005	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	153.7	178.2	74.8	-178.8	0	0	0	110.5	E116 Y117 V119 V128 L139 N143 F145 L150 Q154 L158	E116-I156 CarbonylContact C-O 3.53Å; E116-I156 WeakPolarHBondContact CA-O 3.36Å; Y117-I156 HydrophobicContact CD1-CD1 3.81Å; Y117-I156 HydrophobicContact CD1-CG1 4.03Å; Y117-I156 HydrophobicContact CG-CG1 4.49Å; Y117-I156 PolarHBondContact N-O 2.78Å; Y117-I156 PolarHBondContact O-N 2.8Å; V119-I156 HydrophobicContact CG2-CD1 4.32Å; V119-I156 HydrophobicContact CG2-CG2 3.95Å; V128-I156 HydrophobicContact CG1-CD1 3.5Å; V128-I156 VanDerWaalsContact CG1-CD1 3.5Å; L139-I156 HydrophobicContact CD1-CD1 4.35Å; N143-I156 WeakPolarHBondContact OD1-CA 3.47Å; F145-I156 HydrophobicContact CE2-CG2 4.29Å; F145-I156 HydrophobicContact CZ-CB 4.38Å; F145-I156 HydrophobicContact CZ-CG2 3.83Å; L150-I156 HydrophobicContact CD2-CG2 4.21Å; Q154-I156 HydrophobicContact CG-CG2 4.23Å; I156-L158 HydrophobicContact CD1-CD2 4.16Å; I156-L158 HydrophobicContact CG1-CD2 4.4Å; I156-L158 HydrophobicContact CG1-CG 4.48Å
157	K	87.9	Confident	69.5	Low	96 Å²	96	87.3 Å²	87.3	42%	0.417	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	134.6	177.6	-61.4	-170.8	177.9	-168.2	0	110.8	T114 T115 V142 N143	T114-K157 HydrophobicContact CG2-CB 4.46Å; T115-K157 WeakPolarHBondContact O-CA 3.39Å; V142-K157 HydrophobicContact CG1-CB 4.07Å; V142-K157 WeakPolarHBondContact CG1-O 3.42Å; N143-K157 PolarHBondContact ND2-O 3.1Å; N143-K157 PolarHBondContact OD1-N 3.14Å
158	L	87.6	Confident	67.5	Low	6 Å²	6	90.5 Å²	90.5	3%	0.031	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133.2	179.4	-58.7	172.7	0	0	0	108.9	T114 T115 Y117 F132 L134 L139 I156	T114-L158 CarbonylContact C-O 3.53Å; T114-L158 WeakPolarHBondContact CA-O 3.41Å; T114-L158 WeakPolarHBondContact CB-O 3.47Å; T115-L158 PolarHBondContact N-O 2.77Å; T115-L158 PolarHBondContact O-N 2.88Å; Y117-L158 HydrophobicContact CG-CD1 4.12Å; F132-L158 HydrophobicContact CD1-CD1 3.92Å; F132-L158 HydrophobicContact CD2-CD1 3.5Å; F132-L158 VanDerWaalsContact CD2-CD1 3.5Å; F132-L158 HydrophobicContact CD2-CD2 4.01Å; F132-L158 HydrophobicContact CD2-CG 4.41Å; F132-L158 HydrophobicContact CE1-CD1 3.83Å; F132-L158 HydrophobicContact CE2-CD1 3.42Å; F132-L158 VanDerWaalsContact CE2-CD1 3.42Å; F132-L158 HydrophobicContact CG-CD1 3.77Å; F132-L158 HydrophobicContact CG-CD2 4.37Å; F132-L158 HydrophobicContact CZ-CD1 3.59Å; L134-L158 HydrophobicContact CD1-CD2 3.82Å; L139-L158 HydrophobicContact CD1-CD2 3.57Å; I156-L158 HydrophobicContact CD1-CD2 4.16Å; I156-L158 HydrophobicContact CG1-CD2 4.4Å; I156-L158 HydrophobicContact CG1-CG 4.48Å
159	P	81	Confident	65.2	Low	24 Å²	24	88 Å²	88	16%	0.156	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	138.5	177.6	31.6	-33.2	0	0	0	110.6	L134 V142 N161	L134-P159 HydrophobicContact CD1-CG 4.49Å; L134-P159 HydrophobicContact CD2-CG 3.65Å; V142-P159 HydrophobicContact CG2-CG 4.34Å; P159-N161 PolarHBondContact O-N 2.99Å; P159-N161 VanDerWaalsContact O-N 3.12Å
160	I	67.1	Low	62.7	Low	79 Å²	79	93 Å²	93	41%	0.405	52%	0.522	S	S	.	.			trans	-77.2	101.4	179.8	-55.7	-179.8	0	0	0	109.8	Q113 T115	Q113-I160 HydrophobicContact CB-CB 4.49Å; Q113-I160 HydrophobicContact CB-CD1 3.79Å; Q113-I160 HydrophobicContact CB-CG1 4.24Å; Q113-I160 PolarHBondContact O-N 3.22Å; T115-I160 HydrophobicContact CG2-CD1 3.92Å; T115-I160 HydrophobicContact CG2-CG1 3.98Å
161	N	56.9	Low	60.2	Low	97 Å²	97	97.8 Å²	97.8	52%	0.519	56%	0.558	S	S	.	*			trans	-82.6	126.5	160.1	-83.2	-26.4	0	0	0	109.2	P159 K163	P159-N161 PolarHBondContact O-N 2.99Å; P159-N161 VanDerWaalsContact O-N 3.12Å; N161-K163 PolarHBondContact O-N 3.09Å
162	E	46.3	Very low	57.6	Low	193 Å²	193	97.5 Å²	97.5	90%	0.902	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	34.3	-176.2	-59.1	-177.1	129.7	0	0	114.4
163	K	42.7	Very low	55.1	Low	192 Å²	192	99.8 Å²	99.8	84%	0.835	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.3	-5.6	-175.9	-74	-170.1	173.7	-176.1	0	115.7	N161	N161-K163 PolarHBondContact O-N 3.09Å
164	V	40	Very low	53.2	Low	67 Å²	67	106 Å²	106	41%	0.406	59%	0.593	S	S	.	*			trans	-121.8	17.9	-173.8	-153.2	0	0	0	0	113.1	S166	V164-S166 PolarHBondContact O-N 3.26Å; V164-S166 VanDerWaalsContact O-N 3.12Å
165	A	36.6	Very low	50.5	Low	104 Å²	104	108.8 Å²	108.8	86%	0.86	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	9.5	-179.1	0	0	0	0	0	114.9
166	S	33.9	Very low	48	Very low	104 Å²	104	111.4 Å²	111.4	73%	0.727	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.2	14.2	-166.5	63.9	0	0	0	0	115.4	V164	V164-S166 PolarHBondContact O-N 3.26Å; V164-S166 VanDerWaalsContact O-N 3.12Å
167	M	39.6	Very low	45.2	Very low	159 Å²	159	115.4 Å²	115.4	78%	0.783	67%	0.667	S	S	*	*	S	Bend	trans	-130.6	11.3	-174	-56.3	-162.6	89.3	0	0	115.6
168	T	33.2	Very low	42.7	Very low	127 Å²	127	115.5 Å²	115.5	78%	0.779	68%	0.68	S	S	*	*	S	Bend	trans	-131.1	56.4	-178.9	56.5	0	0	0	0	112.4
169	A	35.4	Very low	40.1	Very low	99 Å²	99	122.4 Å²	122.4	82%	0.818	72%	0.716	S	S	*	*	S	Bend	trans	-135.2	-2.1	179.1	0	0	0	0	0	115.2
170	E	30.1	Very low	37.9	Very low	186 Å²	186	126.9 Å²	126.9	87%	0.869	74%	0.743	S	S	*	*			trans	-143.6	104.9	-178.1	-88.7	174.3	-165.1	0	0	111.9
171	S	32.2	Very low	36.3	Very low	128 Å²	128	132.2 Å²	132.2	90%	0.895	76%	0.763	S	S	*	*			trans	175.4	76.3	150.5	-84.5	0	0	0	0	111.9
172	S	30.6	Very low	35.1	Very low	109 Å²	109	132 Å²	132	76%	0.762	77%	0.77	S	S	*	*			trans	-152.3	81.4	167.5	64.5	0	0	0	0	112.3
173	N	34.1	Very low	34.6	Very low	148 Å²	148	129.7 Å²	129.7	79%	0.791	76%	0.764	S	S	*	*			trans	-168.5	128.2	156.7	-103.9	-53.3	0	0	0	113.9
174	K	36.8	Very low	34.1	Very low	180 Å²	180	126.6 Å²	126.6	78%	0.783	76%	0.756	S	S	*	*			trans	61.8	96.2	147.4	-62.1	178.2	-176.4	178.2	0	120.5
175	S	30.8	Very low	33.8	Very low	107 Å²	107	129.4 Å²	129.4	75%	0.748	77%	0.769	S	S	*	*			trans	-22.4	143.5	135.5	55.4	0	0	0	0	118.2
176	V	34.9	Very low	33.7	Very low	134 Å²	134	132 Å²	132	81%	0.812	77%	0.768	S	S	*	*				170.6	130	111.3	154.2	0	0	0	0	112.4
177	A	32.9	Very low	33.7	Very low	85 Å²	85	134.1 Å²	134.1	70%	0.702	77%	0.77	S	S	*	*			trans	58.5	134.4	153.8	0	0	0	0	0	124.7
178	S	34.1	Very low	33.2	Very low	98 Å²	98	133.8 Å²	133.8	69%	0.685	77%	0.772	S	S	*	*			trans	63.8	110.1	137	62.2	0	0	0	0	122.9
179	D	33.4	Very low	33.1	Very low	150 Å²	150	131.3 Å²	131.3	80%	0.802	76%	0.764	S	S	*	*				82	118.6	120.5	-68.6	-39.3	0	0	0	124.1
180	V	35.2	Very low	32.9	Very low	119 Å²	119	135.4 Å²	135.4	72%	0.721	77%	0.767	S	S	*	*			trans	75.6	90.2	134.4	-175.9	0	0	0	0	119.5
181	K	33.6	Very low	32.8	Very low	190 Å²	190	132.8 Å²	132.8	83%	0.826	76%	0.759	S	S	*	*			trans	71.8	153.3	130.3	-72.2	-171.7	174.9	-174.4	0	122.4
182	S	32	Very low	32.7	Very low	94 Å²	94	131.5 Å²	131.5	66%	0.657	75%	0.745	S	S	*	*			trans	78.8	100.1	152.3	28.8	0	0	0	0	119.3
183	D	34.8	Very low	32.7	Very low	144 Å²	144	134 Å²	134	77%	0.77	75%	0.745	S	S	*	*				81.7	113	119.6	-49.7	-17	0	0	0	120.9
184	N	33	Very low	32.5	Very low	127 Å²	127	131.9 Å²	131.9	68%	0.679	74%	0.737	S	S	*	*			trans	81.3	133.1	134.8	-79.3	52.6	0	0	0	122.4
185	D	32.5	Very low	32.1	Very low	126 Å²	126	128.9 Å²	128.9	67%	0.674	73%	0.733	S	S	*	*			trans	53.7	126.8	139.4	-44.8	-24	0	0	0	118.6
186	N	35.2	Very low	32.2	Very low	158 Å²	158	128.7 Å²	128.7	85%	0.845	73%	0.728	S	S	*	*			cis	-161.5	174.5	33.4	-132.6	-41.4	0	0	0	112.7
187	L	33.5	Very low	32	Very low	148 Å²	148	131.1 Å²	131.1	78%	0.775	73%	0.73	S	S	*	*			trans	-97.5	167.7	175.4	-80.2	167.5	0	0	0	113.1
188	N	28.5	Very low	32	Very low	153 Å²	153	130.3 Å²	130.3	82%	0.818	73%	0.731	S	S	*	*			trans	75.7	148.6	163.7	-59	-19.6	0	0	0	118
189	A	30.8	Very low	31.9	Very low	74 Å²	74	131.6 Å²	131.6	61%	0.612	73%	0.734	S	S	*	*			cis	-170.2	167.9	-21.7	0	0	0	0	0	109.9
190	E	31.1	Very low	31.7	Very low	186 Å²	186	129.7 Å²	129.7	87%	0.869	73%	0.728	S	S	*	*			trans	64.4	159.2	163.3	-24.3	-166.2	136.4	0	0	116
191	D	29.1	Very low	31.7	Very low	131 Å²	131	133 Å²	133	70%	0.701	73%	0.733	S	S	*	*			cis	-157	176.8	-8.8	-149.7	2.5	0	0	0	112.2
192	V	30.9	Very low	31.5	Very low	101 Å²	101	131.5 Å²	131.5	61%	0.612	73%	0.734	S	S	*	*			trans	34.3	129.5	137.2	156.9	0	0	0	0	119.1
193	Q	29.2	Very low	31.8	Very low	162 Å²	162	132.2 Å²	132.2	76%	0.757	74%	0.736	S	S	*	*			cis	179.8	-175.2	10	-126.4	178.9	26.9	0	0	112.7
194	V	29.6	Very low	31.7	Very low	103 Å²	103	132.4 Å²	132.4	62%	0.624	74%	0.737	S	S	*	*			trans	90.4	109.9	136.3	146.4	0	0	0	0	122.7
195	T	29.2	Very low	31.4	Very low	116 Å²	116	133.4 Å²	133.4	71%	0.712	74%	0.742	S	S	*	*			trans	72.6	152.3	140.8	63.8	0	0	0	0	121.6
196	T	31.9	Very low	31.6	Very low	104 Å²	104	132.8 Å²	132.8	64%	0.638	75%	0.745	S	S	*	*			cis	-154.7	159.4	-4.1	1.6	0	0	0	0	112.2
197	E	32.1	Very low	31.2	Very low	184 Å²	184	134.4 Å²	134.4	86%	0.86	74%	0.744	S	S	*	*			trans	57	142.1	151.7	-69.4	162	-130.7	0	0	119.8
198	G	31.8	Very low	30.8	Very low	69 Å²	69	133.6 Å²	133.6	71%	0.711	75%	0.745	S	S	*	*			cis	-171.4	-171.8	-4.5	0	0	0	0	0	108
199	V	33.4	Very low	30.5	Very low	124 Å²	124	131.2 Å²	131.2	75%	0.752	74%	0.739	S	S	*	*			cis	-160.1	115.4	17.4	163.4	0	0	0	0	109.8
200	T	29.2	Very low	30.2	Very low	111 Å²	111	134.8 Å²	134.8	68%	0.681	75%	0.747	S	S	*	*			trans	57.4	153.1	154	66.1	0	0	0	0	121.7
201	K	35.4	Very low	30	Very low	187 Å²	187	131 Å²	131	81%	0.813	74%	0.737	S	S	*	*			cis	-160.1	126.4	-4.4	-114	158.1	-166.6	167	0	110.8
202	N	29	Very low	29.8	Very low	159 Å²	159	133.8 Å²	133.8	85%	0.85	75%	0.746	S	S	*	*			trans	10	161.7	141.6	-76.4	27.1	0	0	0	124.6
203	P	37.8	Very low	29.9	Very low	109 Å²	109	132.7 Å²	132.7	71%	0.708	76%	0.755	S	S	*	*			trans	-101.7	-174.3	-162.5	42.8	-38.3	0	0	0	114.6
204	L	32.2	Very low	29.8	Very low	149 Å²	149	132.6 Å²	132.6	78%	0.78	75%	0.754	S	S	*	*			trans	178.4	139	134	-95.5	157.5	0	0	0	114.3
205	D	27.4	Very low	30	Very low	147 Å²	147	133.7 Å²	133.7	79%	0.786	77%	0.767	S	S	*	*			trans	55.5	154.8	145	-68.5	-2.5	0	0	0	125.8
206	P	36.5	Very low	29.8	Very low	113 Å²	113	136.1 Å²	136.1	73%	0.734	77%	0.768	S	S	*	*			trans	-109.9	154.8	-176.2	40.8	-33	0	0	0	115.2
207	K	26	Very low	29.6	Very low	193 Å²	193	136 Å²	136	84%	0.839	77%	0.771	S	S	*	*			trans	158.3	141.7	144.9	-97.2	170.7	179.3	176.2	0	113
208	V	25	Very low	29.4	Very low	131 Å²	131	135.5 Å²	135.5	79%	0.794	77%	0.766	S	S	*	*			trans	68.3	153.1	141.9	173	0	0	0	0	114.6
209	C	22.5	Very low	29.1	Very low	103 Å²	103	138.8 Å²	138.8	70%	0.696	77%	0.766	S	S	*	*			cis	-142.5	-175.2	10.8	-148	0	0	0	0	113.1
210	L	24.8	Very low	28.8	Very low	148 Å²	148	139.1 Å²	139.1	78%	0.775	76%	0.763	S	S	*	*			trans	-36	161.9	149.1	-49	167.2	0	0	0	113.3
211	T	26.5	Very low	28.8	Very low	106 Å²	106	141.9 Å²	141.9	65%	0.65	77%	0.769	S	S	*	*			cis	-161.4	149.7	46.6	48.1	0	0	0	0	114.5
212	E	26.1	Very low	28.7	Very low	191 Å²	191	138.5 Å²	138.5	89%	0.893	77%	0.769	S	S	*	*			trans	53.2	142.1	134.9	-61.9	168.5	-160.1	0	0	122.6
213	G	32.7	Very low	28.9	Very low	78 Å²	78	137.6 Å²	137.6	80%	0.804	77%	0.768	S	S	*	*			trans	165.5	67.6	173.2	0	0	0	0	0	114.9
214	E	27.2	Very low	28.7	Very low	159 Å²	159	138.2 Å²	138.2	74%	0.743	77%	0.766	S	S	*	*			trans	-65.9	143.1	173.5	-68.1	-174.7	88.9	0	0	112.6	K216	E214-K216 IonicContact OE1-NZ 2.81Å; E214-K216 PolarHBondContact OE1-NZ 3.18Å
215	S	32.5	Very low	28.9	Very low	127 Å²	127	136.5 Å²	136.5	89%	0.888	77%	0.766	S	S	*	*				-167.5	148.2	126.5	-89.9	0	0	0	0	114.7
216	K	26.6	Very low	29.2	Very low	167 Å²	167	135.6 Å²	135.6	73%	0.726	76%	0.761	S	S	*	*			trans	-92	136.3	-164.3	-71.4	155.8	174.3	123.3	0	113.8	E214	E214-K216 IonicContact OE1-NZ 2.81Å; E214-K216 PolarHBondContact OE1-NZ 3.18Å
217	S	27	Very low	28.9	Very low	102 Å²	102	136.4 Å²	136.4	71%	0.713	76%	0.764	S	S	*	*			trans	81.9	155.6	130.7	78.7	0	0	0	0	122.5
218	K	28.7	Very low	29.3	Very low	173 Å²	173	131.8 Å²	131.8	75%	0.752	76%	0.755	S	S	*	*			trans	89.8	119.6	141.2	-88.5	-175.8	175.2	-174.6	0	121.3
219	L	25.1	Very low	29.8	Very low	137 Å²	137	130.5 Å²	130.5	72%	0.717	75%	0.753	S	S	*	*			trans	75	160.2	139.9	-50.7	165.7	0	0	0	116.6
220	L	26.2	Very low	30.5	Very low	131 Å²	131	131.2 Å²	131.2	69%	0.686	75%	0.754	S	S	*	*			cis	-150.1	-177.8	-1	-151.6	146.1	0	0	0	113.8
221	Q	29.8	Very low	31	Very low	170 Å²	170	130.4 Å²	130.4	79%	0.794	75%	0.75	S	S	*	*			trans	-69.6	164.4	175.3	-57.9	141.7	-53.5	0	0	114.5
222	S	32.2	Very low	31.3	Very low	116 Å²	116	133.2 Å²	133.2	81%	0.811	76%	0.756	S	S	*	*			trans	-162.7	-169.5	158.9	56.8	0	0	0	0	111.1
223	V	34	Very low	31.8	Very low	139 Å²	139	130.9 Å²	130.9	84%	0.842	75%	0.754	S	S	*	*				-134.4	163.9	-105.2	-74.8	0	0	0	0	109.8
224	D	32.7	Very low	31.8	Very low	122 Å²	122	134.1 Å²	134.1	65%	0.652	75%	0.753	S	S	*	*			cis	-167.5	157.2	-25.7	177.5	-97.3	0	0	0	106.4	L226	D224-L226 PolarHBondContact OD1-N 2.58Å
225	S	37.4	Very low	32.5	Very low	113 Å²	113	132.8 Å²	132.8	79%	0.79	76%	0.757	S	S	*	*			trans	-163.9	85	157	-82.5	0	0	0	0	115.6
226	L	34.1	Very low	32.7	Very low	129 Å²	129	133.2 Å²	133.2	68%	0.675	75%	0.749	S	S	*	*				47.4	114.1	126.4	-60	173.3	0	0	0	122.9	D224	D224-L226 PolarHBondContact OD1-N 2.58Å
227	T	29.6	Very low	33.4	Very low	130 Å²	130	131.7 Å²	131.7	80%	0.798	75%	0.748	S	S	*	*			trans	69.7	151.7	130.6	65.9	0	0	0	0	120.4
228	S	35	Very low	34.2	Very low	95 Å²	95	133.8 Å²	133.8	66%	0.664	75%	0.747	S	S	*	*			cis	-156.5	141.9	8.9	50.2	0	0	0	0	114.8
229	S	35.8	Very low	34.7	Very low	105 Å²	105	131.4 Å²	131.4	73%	0.734	74%	0.742	S	S	*	*			trans	72.3	149.9	130.6	78.7	0	0	0	0	121
230	V	35.6	Very low	35.4	Very low	118 Å²	118	133.6 Å²	133.6	72%	0.715	75%	0.746	S	S	*	*			cis	-168.9	152.9	-5.5	115.3	0	0	0	0	111.7
231	N	35.2	Very low	35.9	Very low	130 Å²	130	134 Å²	134	70%	0.695	75%	0.749	S	S	*	*			trans	62.2	138.6	169.9	-65.5	5.9	0	0	0	117.9
232	E	34.8	Very low	36.3	Very low	166 Å²	166	134 Å²	134	78%	0.776	75%	0.75	S	S	*	*			cis	78.2	115.6	30.3	-61.8	-174	178.3	0	0	116.3
233	T	36.4	Very low	36.6	Very low	141 Å²	141	133.6 Å²	133.6	87%	0.865	75%	0.746	S	S	*	*				-176.9	147.1	111.7	19.9	0	0	0	0	111.8
234	D	32.4	Very low	36.5	Very low	146 Å²	146	132.2 Å²	132.2	78%	0.781	74%	0.743	S	S	*	*			trans	-80.7	159.3	177.7	-46.6	-89.2	0	0	0	113.2
235	T	41.2	Very low	36.7	Very low	132 Å²	132	132.8 Å²	132.8	81%	0.81	75%	0.751	S	S	*	*			trans	-169.1	108	133.4	6.9	0	0	0	0	112.8
236	D	36	Very low	36.7	Very low	136 Å²	136	137.4 Å²	137.4	73%	0.727	75%	0.753	S	S	*	*				41	137.5	127.1	-51.2	-23.4	0	0	0	123.6
237	D	43	Very low	36.5	Very low	134 Å²	134	136.4 Å²	136.4	72%	0.717	76%	0.757	S	S	*	*			trans	102.7	121.2	131.2	-89.8	9.7	0	0	0	124.2
238	Q	42.6	Very low	36.6	Very low	147 Å²	147	137.4 Å²	137.4	69%	0.687	75%	0.752	S	S	*	*			trans	89.6	89.4	137.2	-67.9	172.9	43.7	0	0	122.4
239	D	39.2	Very low	36.7	Very low	122 Å²	122	140.8 Å²	140.8	65%	0.652	75%	0.752	S	S	*	*				73.3	154.1	110.6	-58.2	-11.5	0	0	0	124.3
240	F	40.4	Very low	36.4	Very low	183 Å²	183	142.1 Å²	142.1	80%	0.803	76%	0.756	S	S	*	*			trans	74.6	131.1	165.1	-58.8	-74.5	0	0	0	118.7
241	D	37.2	Very low	36.2	Very low	140 Å²	140	143.6 Å²	143.6	75%	0.749	76%	0.76	S	S	*	*			cis	-164.8	-172.8	-16.1	-149.2	-16.3	0	0	0	111.3
242	E	37.9	Very low	36.4	Very low	171 Å²	171	145 Å²	145	80%	0.799	76%	0.756	S	S	*	*			trans	86.5	101.9	164.4	-61.4	-154.5	113.1	0	0	121
243	S	38.9	Very low	36.6	Very low	106 Å²	106	141.4 Å²	141.4	74%	0.741	76%	0.755	S	S	*	*			trans	58.5	107.5	150	63.3	0	0	0	0	119.4
244	S	31.8	Very low	36.9	Very low	111 Å²	111	141.8 Å²	141.8	78%	0.776	75%	0.752	S	S	*	*			cis	84.1	119.5	46	85.8	0	0	0	0	116.9
245	T	36.1	Very low	37.6	Very low	134 Å²	134	140.1 Å²	140.1	82%	0.822	74%	0.739	S	S	*	*			trans	74.5	74.9	155.2	-44.2	0	0	0	0	119.1
246	Y	37.3	Very low	37.9	Very low	209 Å²	209	140.7 Å²	140.7	82%	0.82	73%	0.733	S	S	*	*				179.9	110.5	95.7	-169.1	-88.3	0	0	0	110
247	S	29.7	Very low	38.4	Very low	109 Å²	109	141.2 Å²	141.2	76%	0.762	74%	0.735	S	S	*	*			trans	-127.6	123.4	-170.8	54.4	0	0	0	0	111.8
248	E	32.3	Very low	38.8	Very low	150 Å²	150	138.4 Å²	138.4	70%	0.701	72%	0.72	S	S	*	*			trans	-164	160.8	157.8	-128.1	169.5	176.5	0	0	111.8
249	Y	36.5	Very low	39.1	Very low	166 Å²	166	133.6 Å²	133.6	65%	0.651	70%	0.702	S	S	*	*			trans	66.4	74.9	177.5	-68.2	-77.2	0	0	0	118.6	Y252	Y249-Y252 AromaticContact CD1-CE2 3.84Å; Y249-Y252 HydrophobicContact CD1-CE2 3.84Å; Y249-Y252 HydrophobicContact CG-CE2 4.46Å
250	T	30.6	Very low	39.4	Very low	134 Å²	134	134.8 Å²	134.8	82%	0.822	71%	0.706	S	S	*	*			trans	-122.9	83.5	149.5	53.2	0	0	0	0	109.7
251	D	30.6	Very low	40	Very low	149 Å²	149	128.4 Å²	128.4	80%	0.797	69%	0.686	S	S	*	*			trans	-164.2	86.6	169.2	-100.4	-27.3	0	0	0	109.5
252	Y	39.9	Very low	40.9	Very low	159 Å²	159	124 Å²	124	62%	0.624	67%	0.666	S	S	*	*			trans	-150.6	42.8	-178.9	-75.1	-66.4	0	0	0	112.3	Y249	Y249-Y252 AromaticContact CD1-CE2 3.84Å; Y249-Y252 HydrophobicContact CD1-CE2 3.84Å; Y249-Y252 HydrophobicContact CG-CE2 4.46Å
253	A	38.3	Very low	42.2	Very low	91 Å²	91	123.5 Å²	123.5	75%	0.752	66%	0.663	S	S	*	*	S	Bend	trans	-90.4	-24.2	-175.3	0	0	0	0	0	114.9
254	D	44	Very low	44.1	Very low	149 Å²	149	125 Å²	125	80%	0.797	65%	0.654	S	S	*	*	S	Bend	trans	-106.1	-8.2	-167.3	-67.4	-52.5	0	0	0	115.3	E256	D254-E256 PolarHBondContact O-N 3.08Å
255	E	46.7	Very low	46.6	Very low	111 Å²	111	120.6 Å²	120.6	52%	0.519	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-78	-10.7	-171.9	-66.9	-166.8	153.2	0	0	115.4	N257 D258	E255-N257 PolarHBondContact O-N 2.92Å; E255-D258 PolarHBondContact O-N 3.18Å
256	E	46.5	Very low	49	Very low	143 Å²	143	120.1 Å²	120.1	67%	0.668	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-66.3	-5.9	-173.6	-148.7	-162.9	137.2	0	0	114.5	D254 K462	D254-E256 PolarHBondContact O-N 3.08Å; E256-K462 IonicContact OE1-NZ 2.62Å; E256-K462 PolarHBondContact OE1-NZ 2.81Å; E256-K462 VanDerWaalsContact OE1-NZ 3.14Å
257	N	47.7	Very low	51.4	Low	147 Å²	147	110.7 Å²	110.7	79%	0.786	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-106.3	-2.9	-176.1	-69.9	-74.5	0	0	0	115.3	E255	E255-N257 PolarHBondContact O-N 2.92Å
258	D	51.8	Low	54.2	Low	75 Å²	75	109.1 Å²	109.1	40%	0.401	55%	0.554	S	S	.	*			trans	-106.3	107.5	172.8	-172	-8.4	0	0	0	111.7	E255 M260 A261 C262	E255-D258 PolarHBondContact O-N 3.18Å; D258-M260 PolarHBondContact O-N 3.25Å; D258-M260 VanDerWaalsContact O-N 3.13Å; D258-M260 WeakPolarHBondContact OD1-CB 3.18Å; D258-M260 PolarHBondContact OD1-N 2.85Å; D258-A261 HydrophobicContact CB-CB 4.07Å; D258-A261 PolarHBondContact O-N 3.41Å; D258-A261 VanDerWaalsContact O-N 3.08Å; D258-C262 PolarHBondContact O-N 3.49Å
259	P	48.7	Very low	56.9	Low	46 Å²	46	102.1 Å²	102.1	30%	0.299	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-8.7	178.6	30.1	-35.9	0	0	0	114.1
260	M	44.9	Very low	59.3	Low	148 Å²	148	97.3 Å²	97.3	73%	0.729	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-18.8	171.5	-59.7	-165.2	-40.2	0	0	113.5	D258 T472	D258-M260 PolarHBondContact O-N 3.25Å; D258-M260 VanDerWaalsContact O-N 3.13Å; D258-M260 WeakPolarHBondContact OD1-CB 3.18Å; D258-M260 PolarHBondContact OD1-N 2.85Å; M260-T472 HydrophobicContact CG-CG2 4.48Å
261	A	52.2	Low	62	Low	48 Å²	48	91.6 Å²	91.6	40%	0.397	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-44	174.6	0	0	0	0	0	111.4	D258 Q263	D258-A261 HydrophobicContact CB-CB 4.07Å; D258-A261 PolarHBondContact O-N 3.41Å; D258-A261 VanDerWaalsContact O-N 3.08Å; A261-Q263 PolarHBondContact O-N 2.86Å
262	C	56.2	Low	64.6	Low	47 Å²	47	85 Å²	85	32%	0.318	43%	0.434	S	S	.	.			trans	-70.8	112.4	179.6	-65.6	0	0	0	0	112.1	D258 Y264 F469	D258-C262 PolarHBondContact O-N 3.49Å; C262-Y264 WeakPolarHBondContact CB-O 3.38Å; C262-Y264 PolarHBondContact O-N 3.44Å; C262-Y264 VanDerWaalsContact O-N 3.14Å; C262-F469 WeakPolarHBondContact O-CE2 3.44Å
263	Q	64.8	Low	66.3	Low	161 Å²	161	79.7 Å²	79.7	75%	0.752	42%	0.418	S	S	*	.	S	Bend	trans	-68	-9.6	174.5	-62.1	-176.9	14	0	0	113.9	A261	A261-Q263 PolarHBondContact O-N 2.86Å
264	Y	79.5	Confident	67.7	Low	137 Å²	137	79.6 Å²	79.6	54%	0.537	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	151.6	177.1	64.5	-92.4	0	0	0	110.5	C262 K266 L284 V285	C262-Y264 WeakPolarHBondContact CB-O 3.38Å; C262-Y264 PolarHBondContact O-N 3.44Å; C262-Y264 VanDerWaalsContact O-N 3.14Å; Y264-K266 HydrophobicContact CD2-CB 4.33Å; Y264-K266 HydrophobicContact CE2-CB 4.43Å; Y264-L284 HydrophobicContact CD2-CD1 3.63Å; Y264-L284 HydrophobicContact CE2-CD1 4.49Å; Y264-L284 HydrophobicContact CG-CD1 4.07Å; Y264-V285 CarbonylContact C-O 3.59Å; Y264-V285 WeakPolarHBondContact CA-O 3.32Å; Y264-V285 WeakPolarHBondContact CB-O 3.2Å
265	L	84.2	Confident	68.7	Low	20 Å²	20	75.7 Å²	75.7	11%	0.105	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	131	171.5	178.5	63.9	0	0	0	109	F267 L284 V285 I465 L466 F469	L265-F267 HydrophobicContact CD1-CD1 4.44Å; L265-F267 HydrophobicContact CD2-CD1 4.19Å; L265-F267 HydrophobicContact CD2-CE1 3.88Å; L265-F267 HydrophobicContact CG-CD1 3.91Å; L265-F267 HydrophobicContact CG-CE1 4Å; L265-L284 CarbonylContact O-C 3.03Å; L265-L284 WeakPolarHBondContact O-CA 3.45Å; L265-V285 PolarHBondContact N-O 3.37Å; L265-V285 PolarHBondContact O-N 3.42Å; L265-I465 HydrophobicContact CD1-CG2 3.81Å; L265-I465 HydrophobicContact CD2-CG2 4.17Å; L265-L466 HydrophobicContact CD2-CB 4.04Å; L265-L466 HydrophobicContact CD2-CD1 4.1Å; L265-F469 HydrophobicContact CB-CD1 4.3Å; L265-F469 HydrophobicContact CB-CD2 4.33Å; L265-F469 HydrophobicContact CB-CE1 4.5Å; L265-F469 HydrophobicContact CB-CG 4.22Å; L265-F469 HydrophobicContact CD2-CB 4.23Å; L265-F469 HydrophobicContact CD2-CG 4.49Å
266	K	87	Confident	69.5	Low	124 Å²	124	79.6 Å²	79.6	54%	0.539	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	130	-179.3	-174.4	-166.9	172.6	-163.9	0	110.6	Y264 I282 I283 L284	Y264-K266 HydrophobicContact CD2-CB 4.33Å; Y264-K266 HydrophobicContact CE2-CB 4.43Å; K266-I282 HydrophobicContact CD-CG2 4.36Å; K266-I282 HydrophobicContact CG-CG2 3.7Å; K266-I283 WeakPolarHBondContact CA-O 3.4Å; K266-L284 HydrophobicContact CB-CD1 4.03Å; K266-L284 HydrophobicContact CG-CD1 4.38Å
267	F	87.6	Confident	70.6	Confident	11 Å²	11	75.7 Å²	75.7	5%	0.048	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	164.2	176.1	57.8	-87.8	0	0	0	112.6	L265 C269 I282 I283 I458 K462 L466	L265-F267 HydrophobicContact CD1-CD1 4.44Å; L265-F267 HydrophobicContact CD2-CD1 4.19Å; L265-F267 HydrophobicContact CD2-CE1 3.88Å; L265-F267 HydrophobicContact CG-CD1 3.91Å; L265-F267 HydrophobicContact CG-CE1 4Å; F267-C269 HydrophobicContact CE2-CB 4.38Å; F267-I282 WeakPolarHBondContact O-CA 3.38Å; F267-I283 HydrophobicContact CD2-CB 4.46Å; F267-I283 HydrophobicContact CE1-CB 4.22Å; F267-I283 HydrophobicContact CE1-CG2 3.71Å; F267-I283 HydrophobicContact CE2-CB 3.9Å; F267-I283 HydrophobicContact CE2-CD1 3.8Å; F267-I283 HydrophobicContact CE2-CG1 4.44Å; F267-I283 HydrophobicContact CE2-CG2 4.18Å; F267-I283 HydrophobicContact CZ-CB 3.76Å; F267-I283 HydrophobicContact CZ-CD1 3.91Å; F267-I283 HydrophobicContact CZ-CG1 4.45Å; F267-I283 HydrophobicContact CZ-CG2 3.5Å; F267-I283 VanDerWaalsContact CZ-CG2 3.5Å; F267-I283 PolarHBondContact N-O 3.14Å; F267-I283 PolarHBondContact O-N 3.23Å; F267-I458 HydrophobicContact CD2-CG2 4.42Å; F267-I458 HydrophobicContact CE2-CD1 3.96Å; F267-I458 HydrophobicContact CE2-CG1 4.19Å; F267-I458 HydrophobicContact CE2-CG2 3.82Å; F267-I458 HydrophobicContact CZ-CD1 4.18Å; F267-I458 HydrophobicContact CZ-CG2 4.46Å; F267-K462 HydrophobicContact CB-CB 4.34Å; F267-K462 HydrophobicContact CB-CD 4.44Å; F267-K462 HydrophobicContact CB-CG 4.03Å; F267-K462 HydrophobicContact CD2-CB 4.44Å; F267-K462 HydrophobicContact CG-CB 4.17Å; F267-K462 HydrophobicContact CG-CG 4.42Å; F267-L466 HydrophobicContact CE1-CB 4.46Å; F267-L466 HydrophobicContact CE1-CD1 4.04Å; F267-L466 HydrophobicContact CZ-CD1 4.08Å; F267-L466 HydrophobicContact CZ-CD2 3.91Å; F267-L466 HydrophobicContact CZ-CG 4.4Å
268	D	88.3	Confident	72.3	Confident	75 Å²	75	71.2 Å²	71.2	40%	0.401	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	141.8	-179.5	-63.9	-39.9	0	0	0	112.2	Y295 P459	D268-Y295 WeakPolarHBondContact CB-OH 3.28Å; D268-Y295 PolarHBondContact OD1-OH 3.1Å; D268-P459 VanDerWaalsContact O-CD 3.25Å; D268-P459 WeakPolarHBondContact O-CD 3.14Å; D268-P459 WeakPolarHBondContact O-CG 3.45Å
269	C	88.6	Confident	73.9	Confident	4 Å²	4	67.8 Å²	67.8	3%	0.027	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	-176.4	-175.8	73.7	0	0	0	0	112.4	F267 G281 I283 F292 L457 I458	F267-C269 HydrophobicContact CE2-CB 4.38Å; C269-G281 PolarHBondContact N-O 2.81Å; C269-G281 PolarHBondContact O-N 3.46Å; C269-G281 VanDerWaalsContact O-O 3.05Å; C269-I283 HydrophobicContact CB-CD1 3.99Å; C269-I283 VanDerWaalsContact SG-CD1 3.53Å; C269-I283 VanDerWaalsContact SG-CG1 3.56Å; C269-F292 VanDerWaalsContact SG-CD2 3.51Å; C269-F292 VanDerWaalsContact SG-CE2 3.54Å; C269-L457 CarbonylContact C-O 3.51Å; C269-L457 WeakPolarHBondContact CA-O 3.01Å; C269-L457 VanDerWaalsContact CB-O 3.26Å; C269-L457 WeakPolarHBondContact CB-O 3.2Å; C269-I458 HydrophobicContact CB-CG1 4.37Å
270	K	88	Confident	75.8	Confident	64 Å²	64	67.8 Å²	67.8	28%	0.278	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	124	167.5	-44.9	-176.8	-175.6	174.3	0	111.8	V279 P280 F456 L457	K270-V279 CarbonylContact C-O 3.44Å; K270-V279 VanDerWaalsContact CA-O 3.25Å; K270-V279 WeakPolarHBondContact CA-O 3.29Å; K270-P280 HydrophobicContact CG-CB 4.35Å; K270-F456 CarbonylContact O-C 3.56Å; K270-F456 WeakPolarHBondContact O-CA 3.42Å; K270-L457 HydrophobicContact CB-CB 4.08Å; K270-L457 HydrophobicContact CD-CD2 4.04Å; K270-L457 HydrophobicContact CG-CD2 4.38Å; K270-L457 PolarHBondContact N-O 2.9Å; K270-L457 PolarHBondContact O-N 3.2Å
271	F	87.4	Confident	77.8	Confident	14 Å²	14	60.8 Å²	60.8	6%	0.061	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	124.9	173.1	175.7	-123.4	0	0	0	110.5	V273 S278 V279 F292 K307 Y454 W455 F456	F271-V273 HydrophobicContact CD1-CG2 3.77Å; F271-V273 HydrophobicContact CE1-CG2 3.68Å; F271-V273 PolarHBondContact O-N 3.36Å; F271-S278 CarbonylContact O-C 3.55Å; F271-S278 WeakPolarHBondContact O-CA 3.47Å; F271-V279 PolarHBondContact N-O 3.3Å; F271-V279 PolarHBondContact O-N 3.02Å; F271-F292 HydrophobicContact CB-CD1 3.86Å; F271-F292 HydrophobicContact CB-CD2 4.46Å; F271-F292 HydrophobicContact CB-CE1 3.4Å; F271-F292 HydrophobicContact CB-CE2 4.04Å; F271-F292 HydrophobicContact CB-CG 4.37Å; F271-F292 HydrophobicContact CB-CZ 3.5Å; F271-F292 VanDerWaalsContact CB-CZ 3.5Å; F271-F292 HydrophobicContact CD1-CE1 4.28Å; F271-F292 HydrophobicContact CG-CD1 4.26Å; F271-F292 HydrophobicContact CG-CE1 4.08Å; F271-K307 HydrophobicContact CE1-CG 4.49Å; F271-K307 HydrophobicContact CE2-CG 4.41Å; F271-K307 HydrophobicContact CZ-CD 4.49Å; F271-K307 HydrophobicContact CZ-CG 4.24Å; F271-Y454 HydrophobicContact CE2-CD1 4.19Å; F271-Y454 HydrophobicContact CZ-CD1 4.3Å; F271-W455 WeakPolarHBondContact CD2-O 3.38Å; F271-F456 HydrophobicContact CB-CD1 3.96Å; F271-F456 HydrophobicContact CB-CE1 3.95Å; F271-F456 AromaticContact CD2-CD1 3.8Å; F271-F456 HydrophobicContact CD2-CD1 3.8Å; F271-F456 AromaticContact CD2-CE1 3.37Å; F271-F456 HydrophobicContact CD2-CE1 3.37Å; F271-F456 HydrophobicContact CD2-CE2 4.35Å; F271-F456 HydrophobicContact CD2-CG 4.43Å; F271-F456 AromaticContact CD2-CZ 3.69Å; F271-F456 HydrophobicContact CD2-CZ 3.69Å; F271-F456 HydrophobicContact CE2-CE1 4.22Å; F271-F456 HydrophobicContact CE2-CZ 4.09Å; F271-F456 HydrophobicContact CG-CD1 4.34Å; F271-F456 AromaticContact CG-CE1 3.98Å; F271-F456 HydrophobicContact CG-CE1 3.98Å
272	V	84.3	Confident	79.6	Confident	11 Å²	11	60.6 Å²	60.6	7%	0.067	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	92.8	-174.5	-173.1	0	0	0	0	109.3	D274 M326 K330 W455 L457	V272-D274 WeakPolarHBondContact CG1-O 3.47Å; V272-M326 HydrophobicContact CG1-CE 3.56Å; V272-M326 HydrophobicContact CG1-SD 4.18Å; V272-K330 PolarHBondContact O-NZ 2.87Å; V272-K330 VanDerWaalsContact O-NZ 3.15Å; V272-W455 HydrophobicContact CB-CB 3.93Å; V272-W455 PolarHBondContact N-O 3Å; V272-L457 HydrophobicContact CG2-CB 4.38Å
273	V	75	Confident	81.2	Confident	48 Å²	48	58.4 Å²	58.4	29%	0.291	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	-47.5	-178.8	177.9	0	0	0	0	109.7	F271 C277 V279 K330	F271-V273 HydrophobicContact CD1-CG2 3.77Å; F271-V273 HydrophobicContact CE1-CG2 3.68Å; F271-V273 PolarHBondContact O-N 3.36Å; V273-C277 PolarHBondContact N-O 3.08Å; V273-V279 HydrophobicContact CG2-CG2 3.98Å; V273-K330 PolarHBondContact O-NZ 3.13Å
274	D	67.5	Low	82.3	Confident	89 Å²	89	53.7 Å²	53.7	48%	0.476	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	171.8	173.7	-88.3	-47	0	0	0	110.8	V272 Q276 C277	V272-D274 WeakPolarHBondContact CG1-O 3.47Å; D274-Q276 PolarHBondContact O-N 2.86Å; D274-C277 PolarHBondContact O-N 2.89Å; D274-C277 VanDerWaalsContact O-N 3.1Å; D274-C277 VanDerWaalsContact O-O 3.14Å
275	L	66.8	Low	82.7	Confident	67 Å²	67	47.1 Å²	47.1	35%	0.351	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-9.7	174.5	-79.1	162.1	0	0	0	115.4	M326 Y327	L275-M326 HydrophobicContact CD2-CE 3.57Å; L275-M326 HydrophobicContact CG-CE 3.78Å; L275-Y327 HydrophobicContact CD1-CD1 3.55Å; L275-Y327 HydrophobicContact CD1-CD2 3.75Å; L275-Y327 HydrophobicContact CD1-CE1 3.61Å; L275-Y327 HydrophobicContact CD1-CE2 3.85Å; L275-Y327 HydrophobicContact CD1-CG 3.62Å; L275-Y327 HydrophobicContact CD2-CD2 3.59Å; L275-Y327 HydrophobicContact CD2-CE1 4.45Å; L275-Y327 HydrophobicContact CD2-CE2 3.25Å; L275-Y327 HydrophobicContact CD2-CG 4.35Å; L275-Y327 HydrophobicContact CG-CD2 4.33Å; L275-Y327 HydrophobicContact CG-CE2 4.17Å
276	Q	63.1	Low	82.6	Confident	193 Å²	193	47.8 Å²	47.8	90%	0.902	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	-8.5	-176.3	-60.1	179.8	4.8	0	0	113.3	D274	D274-Q276 PolarHBondContact O-N 2.86Å
277	C	69.9	Low	82.2	Confident	60 Å²	60	46 Å²	46	41%	0.405	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	131.7	-173.2	54.3	0	0	0	0	113.8	V273 D274	V273-C277 PolarHBondContact N-O 3.08Å; D274-C277 PolarHBondContact O-N 2.89Å; D274-C277 VanDerWaalsContact O-N 3.1Å; D274-C277 VanDerWaalsContact O-O 3.14Å
278	S	82.2	Confident	81.8	Confident	54 Å²	54	50.4 Å²	50.4	38%	0.378	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	123.6	177	71.1	0	0	0	0	111	F271	F271-S278 CarbonylContact O-C 3.55Å; F271-S278 WeakPolarHBondContact O-CA 3.47Å
279	V	85.3	Confident	81.6	Confident	3 Å²	3	48.4 Å²	48.4	2%	0.018	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	115.9	-179.2	-178.7	0	0	0	0	109.6	K270 F271 V273 F292 P294 Y300	K270-V279 CarbonylContact C-O 3.44Å; K270-V279 VanDerWaalsContact CA-O 3.25Å; K270-V279 WeakPolarHBondContact CA-O 3.29Å; F271-V279 PolarHBondContact N-O 3.3Å; F271-V279 PolarHBondContact O-N 3.02Å; V273-V279 HydrophobicContact CG2-CG2 3.98Å; V279-F292 HydrophobicContact CG1-CZ 4.45Å; V279-P294 HydrophobicContact CG1-CB 3.79Å; V279-Y300 HydrophobicContact CB-CD1 4.2Å; V279-Y300 HydrophobicContact CB-CE1 4.37Å; V279-Y300 HydrophobicContact CB-CG 4.46Å; V279-Y300 HydrophobicContact CG1-CD1 3.68Å; V279-Y300 HydrophobicContact CG1-CD2 3.74Å; V279-Y300 HydrophobicContact CG1-CE1 4.15Å; V279-Y300 HydrophobicContact CG1-CE2 4.2Å; V279-Y300 HydrophobicContact CG1-CG 3.47Å; V279-Y300 VanDerWaalsContact CG1-CG 3.47Å; V279-Y300 HydrophobicContact CG2-CD1 3.52Å; V279-Y300 HydrophobicContact CG2-CE1 3.65Å; V279-Y300 HydrophobicContact CG2-CG 4.22Å
280	P	88.1	Confident	81.6	Confident	46 Å²	46	48.2 Å²	48.2	30%	0.299	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	141.5	-179.3	33.2	-35.8	0	0	0	111.4	K270 P294 Y295	K270-P280 HydrophobicContact CG-CB 4.35Å; P280-P294 WeakPolarHBondContact O-CA 3.11Å; P280-Y295 VanDerWaalsContact C-CD2 3.42Å; P280-Y295 HydrophobicContact CB-CD2 3.81Å; P280-Y295 HydrophobicContact CB-CE2 3.89Å; P280-Y295 HydrophobicContact CG-CD2 4.24Å; P280-Y295 WeakPolarHBondContact O-CD2 3.48Å; P280-Y295 PolarHBondContact O-N 3.2Å; P280-Y295 VanDerWaalsContact O-N 3.09Å
281	G	88.5	Confident	81.7	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.8	-166.8	-177.8	0	0	0	0	0	114.3	C269 K293 Y295	C269-G281 PolarHBondContact N-O 2.81Å; C269-G281 PolarHBondContact O-N 3.46Å; C269-G281 VanDerWaalsContact O-O 3.05Å; G281-K293 CarbonylContact C-O 3.44Å; G281-K293 WeakPolarHBondContact CA-O 2.99Å; G281-Y295 VanDerWaalsContact N-CE2 3.29Å; G281-Y295 PolarHBondContact O-OH 2.81Å
282	I	89.1	Confident	81.8	Confident	45 Å²	45	45.5 Å²	45.5	23%	0.231	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	131.4	-175.2	-55.5	-178.9	0	0	0	109.7	K266 F267 F292 K293 Y295	K266-I282 HydrophobicContact CD-CG2 4.36Å; K266-I282 HydrophobicContact CG-CG2 3.7Å; F267-I282 WeakPolarHBondContact O-CA 3.38Å; I282-F292 WeakPolarHBondContact O-CA 3.45Å; I282-K293 PolarHBondContact N-O 2.88Å; I282-K293 PolarHBondContact O-N 3.01Å; I282-Y295 HydrophobicContact CD1-CD1 4.36Å; I282-Y295 HydrophobicContact CD1-CE1 3.9Å; I282-Y295 HydrophobicContact CG1-CD1 4.06Å; I282-Y295 HydrophobicContact CG1-CE1 3.42Å; I282-Y295 VanDerWaalsContact CG1-CE1 3.42Å
283	I	90	Very high	81.9	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	134.3	159.8	-79.8	159.9	0	0	0	109.4	K266 F267 C269 V285 F290 V291 F292 F456 I458	K266-I283 WeakPolarHBondContact CA-O 3.4Å; F267-I283 HydrophobicContact CD2-CB 4.46Å; F267-I283 HydrophobicContact CE1-CB 4.22Å; F267-I283 HydrophobicContact CE1-CG2 3.71Å; F267-I283 HydrophobicContact CE2-CB 3.9Å; F267-I283 HydrophobicContact CE2-CD1 3.8Å; F267-I283 HydrophobicContact CE2-CG1 4.44Å; F267-I283 HydrophobicContact CE2-CG2 4.18Å; F267-I283 HydrophobicContact CZ-CB 3.76Å; F267-I283 HydrophobicContact CZ-CD1 3.91Å; F267-I283 HydrophobicContact CZ-CG1 4.45Å; F267-I283 HydrophobicContact CZ-CG2 3.5Å; F267-I283 VanDerWaalsContact CZ-CG2 3.5Å; F267-I283 PolarHBondContact N-O 3.14Å; F267-I283 PolarHBondContact O-N 3.23Å; C269-I283 HydrophobicContact CB-CD1 3.99Å; C269-I283 VanDerWaalsContact SG-CD1 3.53Å; C269-I283 VanDerWaalsContact SG-CG1 3.56Å; I283-V285 HydrophobicContact CG2-CG2 3.48Å; I283-V285 VanDerWaalsContact CG2-CG2 3.48Å; I283-F290 HydrophobicContact CD1-CE2 4.25Å; I283-F290 HydrophobicContact CD1-CZ 3.64Å; I283-F290 HydrophobicContact CG1-CE1 4.26Å; I283-F290 HydrophobicContact CG1-CE2 4.38Å; I283-F290 HydrophobicContact CG1-CZ 3.73Å; I283-F290 HydrophobicContact CG2-CD2 4.47Å; I283-F290 HydrophobicContact CG2-CE2 3.87Å; I283-F290 HydrophobicContact CG2-CZ 4.06Å; I283-V291 CarbonylContact C-O 3.43Å; I283-V291 WeakPolarHBondContact CA-O 3.41Å; I283-F292 HydrophobicContact CG1-CB 4.32Å; I283-F292 HydrophobicContact CG1-CD2 4.25Å; I283-F456 HydrophobicContact CD1-CB 4.27Å; I283-F456 HydrophobicContact CD1-CD1 4.05Å; I283-F456 HydrophobicContact CD1-CG 4.17Å; I283-I458 HydrophobicContact CD1-CD1 3.95Å; I283-I458 HydrophobicContact CD1-CG1 4.45Å
284	L	88.9	Confident	82.5	Confident	62 Å²	62	48 Å²	48	33%	0.325	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	114.2	165.8	177.3	69.4	0	0	0	108	Y264 L265 K266 V291	Y264-L284 HydrophobicContact CD2-CD1 3.63Å; Y264-L284 HydrophobicContact CE2-CD1 4.49Å; Y264-L284 HydrophobicContact CG-CD1 4.07Å; L265-L284 CarbonylContact O-C 3.03Å; L265-L284 WeakPolarHBondContact O-CA 3.45Å; K266-L284 HydrophobicContact CB-CD1 4.03Å; K266-L284 HydrophobicContact CG-CD1 4.38Å; L284-V291 HydrophobicContact CB-CB 4.45Å; L284-V291 PolarHBondContact N-O 3.33Å; L284-V291 PolarHBondContact O-N 3.36Å
285	V	86.1	Confident	83.4	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	134.5	173.1	-159.7	0	0	0	0	108.4	Y264 L265 I283 F290 L311 L466 F469 L470	Y264-V285 CarbonylContact C-O 3.59Å; Y264-V285 WeakPolarHBondContact CA-O 3.32Å; Y264-V285 WeakPolarHBondContact CB-O 3.2Å; L265-V285 PolarHBondContact N-O 3.37Å; L265-V285 PolarHBondContact O-N 3.42Å; I283-V285 HydrophobicContact CG2-CG2 3.48Å; I283-V285 VanDerWaalsContact CG2-CG2 3.48Å; V285-F290 HydrophobicContact CG1-CD2 4.26Å; V285-F290 HydrophobicContact CG2-CD2 3.69Å; V285-F290 HydrophobicContact CG2-CE2 4Å; V285-L311 HydrophobicContact CG1-CD1 4.34Å; V285-L466 HydrophobicContact CG2-CD1 3.74Å; V285-F469 HydrophobicContact CB-CD1 4.26Å; V285-F469 HydrophobicContact CB-CE1 3.99Å; V285-F469 HydrophobicContact CG1-CD1 4.06Å; V285-F469 HydrophobicContact CG1-CE1 3.8Å; V285-L470 HydrophobicContact CG1-CD2 3.88Å
286	T	83.9	Confident	84	Confident	33 Å²	33	47.2 Å²	47.2	20%	0.202	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	176.5	173.7	61.4	0	0	0	0	108.7	N288 M289 L311	T286-N288 PolarHBondContact O-N 2.99Å; T286-N288 PolarHBondContact OG1-OD1 3.33Å; T286-M289 PolarHBondContact N-O 3.34Å; T286-M289 WeakPolarHBondContact OG1-CB 3.45Å; T286-M289 PolarHBondContact OG1-N 3.4Å; T286-M289 PolarHBondContact OG1-O 2.87Å; T286-L311 WeakPolarHBondContact O-CD1 3.39Å
287	T	78	Confident	84.3	Confident	87 Å²	87	42.9 Å²	42.9	53%	0.534	23%	0.23	S	C	.	.	S	Bend	trans	-61	-12	177.9	55.6	0	0	0	0	115.4
288	N	79.6	Confident	84.1	Confident	103 Å²	103	49 Å²	49	55%	0.551	25%	0.253	S	S	*	.	S	Bend	trans	-135.4	-13.7	179.4	67	-12.6	0	0	0	115.8	T286 L311	T286-N288 PolarHBondContact O-N 2.99Å; T286-N288 PolarHBondContact OG1-OD1 3.33Å; N288-L311 PolarHBondContact O-N 2.89Å
289	M	83.7	Confident	83.4	Confident	33 Å²	33	52.4 Å²	52.4	16%	0.163	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	135.4	-174	-66.6	-62.1	-41.8	0	0	112.3	T286 V291 Q308 P310	T286-M289 PolarHBondContact N-O 3.34Å; T286-M289 WeakPolarHBondContact OG1-CB 3.45Å; T286-M289 PolarHBondContact OG1-N 3.4Å; T286-M289 PolarHBondContact OG1-O 2.87Å; M289-V291 HydrophobicContact CB-CG2 4.39Å; M289-Q308 HydrophobicContact CE-CG 3.35Å; M289-P310 HydrophobicContact CE-CB 4.24Å; M289-P310 HydrophobicContact CE-CG 3.82Å; M289-P310 VanDerWaalsContact CE-N 3.32Å; M289-P310 VanDerWaalsContact SD-CA 3.58Å; M289-P310 HydrophobicContact SD-CB 3.84Å; M289-P310 HydrophobicContact SD-CG 3.8Å
290	F	88.9	Confident	82.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	130.3	162	-176.3	-82.7	0	0	0	109.3	I283 V285 I309 L311 F314 L426 I428 F456	I283-F290 HydrophobicContact CD1-CE2 4.25Å; I283-F290 HydrophobicContact CD1-CZ 3.64Å; I283-F290 HydrophobicContact CG1-CE1 4.26Å; I283-F290 HydrophobicContact CG1-CE2 4.38Å; I283-F290 HydrophobicContact CG1-CZ 3.73Å; I283-F290 HydrophobicContact CG2-CD2 4.47Å; I283-F290 HydrophobicContact CG2-CE2 3.87Å; I283-F290 HydrophobicContact CG2-CZ 4.06Å; V285-F290 HydrophobicContact CG1-CD2 4.26Å; V285-F290 HydrophobicContact CG2-CD2 3.69Å; V285-F290 HydrophobicContact CG2-CE2 4Å; F290-I309 HydrophobicContact CD1-CD1 4.34Å; F290-I309 PolarHBondContact N-O 2.91Å; F290-I309 PolarHBondContact O-N 2.85Å; F290-L311 HydrophobicContact CB-CD2 4.29Å; F290-F314 HydrophobicContact CB-CE1 3.81Å; F290-F314 HydrophobicContact CB-CZ 3.5Å; F290-F314 HydrophobicContact CD1-CZ 4.37Å; F290-F314 AromaticContact CD2-CZ 3.99Å; F290-F314 HydrophobicContact CD2-CZ 3.99Å; F290-F314 HydrophobicContact CG-CE1 4.45Å; F290-F314 AromaticContact CG-CZ 3.73Å; F290-F314 HydrophobicContact CG-CZ 3.73Å; F290-L426 HydrophobicContact CE2-CD2 4.5Å; F290-L426 HydrophobicContact CZ-CD2 4.48Å; F290-I428 HydrophobicContact CD1-CD1 4.29Å; F290-I428 HydrophobicContact CD2-CD1 4.18Å; F290-I428 HydrophobicContact CE1-CD1 3.87Å; F290-I428 HydrophobicContact CE2-CD1 3.75Å; F290-I428 HydrophobicContact CG-CD1 4.43Å; F290-I428 HydrophobicContact CZ-CD1 3.57Å; F290-F456 HydrophobicContact CE1-CE1 4.29Å; F290-F456 AromaticContact CE1-CE2 3.93Å; F290-F456 HydrophobicContact CE1-CE2 3.93Å; F290-F456 AromaticContact CE1-CZ 3.75Å; F290-F456 HydrophobicContact CE1-CZ 3.75Å; F290-F456 HydrophobicContact CZ-CD2 4.35Å; F290-F456 HydrophobicContact CZ-CE2 4.11Å; F290-F456 HydrophobicContact CZ-CZ 4.26Å
291	V	89	Confident	81.4	Confident	22 Å²	22	55.7 Å²	55.7	13%	0.133	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	128.4	-179.3	-171.7	0	0	0	0	109.9	I283 L284 M289 K293 K307 Q308	I283-V291 CarbonylContact C-O 3.43Å; I283-V291 WeakPolarHBondContact CA-O 3.41Å; L284-V291 HydrophobicContact CB-CB 4.45Å; L284-V291 PolarHBondContact N-O 3.33Å; L284-V291 PolarHBondContact O-N 3.36Å; M289-V291 HydrophobicContact CB-CG2 4.39Å; V291-K293 HydrophobicContact CG1-CG 4.3Å; V291-K307 CarbonylContact C-O 3.49Å; V291-K307 VanDerWaalsContact CA-O 3.27Å; V291-K307 WeakPolarHBondContact CA-O 3.05Å; V291-Q308 HydrophobicContact CG2-CG 4.31Å
292	F	90.1	Very high	80.1	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	135.7	164.7	168	-97.7	0	0	0	110.2	C269 F271 V279 I282 I283 H305 C306 K307 F456	C269-F292 VanDerWaalsContact SG-CD2 3.51Å; C269-F292 VanDerWaalsContact SG-CE2 3.54Å; F271-F292 HydrophobicContact CB-CD1 3.86Å; F271-F292 HydrophobicContact CB-CD2 4.46Å; F271-F292 HydrophobicContact CB-CE1 3.4Å; F271-F292 HydrophobicContact CB-CE2 4.04Å; F271-F292 HydrophobicContact CB-CG 4.37Å; F271-F292 HydrophobicContact CB-CZ 3.5Å; F271-F292 VanDerWaalsContact CB-CZ 3.5Å; F271-F292 HydrophobicContact CD1-CE1 4.28Å; F271-F292 HydrophobicContact CG-CD1 4.26Å; F271-F292 HydrophobicContact CG-CE1 4.08Å; V279-F292 HydrophobicContact CG1-CZ 4.45Å; I282-F292 WeakPolarHBondContact O-CA 3.45Å; I283-F292 HydrophobicContact CG1-CB 4.32Å; I283-F292 HydrophobicContact CG1-CD2 4.25Å; F292-H305 VanDerWaalsContact CD1-O 3.23Å; F292-H305 WeakPolarHBondContact CD1-O 3.31Å; F292-H305 WeakPolarHBondContact CE1-O 3.43Å; F292-C306 WeakPolarHBondContact O-CA 3.38Å; F292-C306 PolarHBondContact O-SG 3.31Å; F292-C306 VanDerWaalsContact O-SG 3.41Å; F292-K307 HydrophobicContact CB-CB 4.42Å; F292-K307 PolarHBondContact N-O 2.69Å; F292-K307 PolarHBondContact O-N 2.97Å; F292-F456 HydrophobicContact CB-CE1 3.64Å; F292-F456 HydrophobicContact CB-CZ 4.31Å; F292-F456 HydrophobicContact CD1-CE1 4.21Å; F292-F456 HydrophobicContact CD2-CD1 4.29Å; F292-F456 HydrophobicContact CD2-CE1 4.11Å; F292-F456 HydrophobicContact CG-CD1 4.34Å; F292-F456 AromaticContact CG-CE1 3.71Å; F292-F456 HydrophobicContact CG-CE1 3.71Å
293	K	86.7	Confident	78.7	Confident	104 Å²	104	65.8 Å²	65.8	45%	0.452	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	134.8	172.3	-68.3	-168.9	168.4	-155.2	0	111	G281 I282 V291	G281-K293 CarbonylContact C-O 3.44Å; G281-K293 WeakPolarHBondContact CA-O 2.99Å; I282-K293 PolarHBondContact N-O 2.88Å; I282-K293 PolarHBondContact O-N 3.01Å; V291-K293 HydrophobicContact CG1-CG 4.3Å
294	P	87.5	Confident	77.5	Confident	8 Å²	8	70.8 Å²	70.8	5%	0.052	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	157.6	169.4	30.5	-35.5	0	0	0	111.2	V279 P280 H305	V279-P294 HydrophobicContact CG1-CB 3.79Å; P280-P294 WeakPolarHBondContact O-CA 3.11Å; P294-H305 HydrophobicContact CG-CB 4.46Å
295	Y	86.1	Confident	76.6	Confident	86 Å²	86	69.4 Å²	69.4	34%	0.337	35%	0.345	S	S	.	.	S	Bend	trans	-74.2	-35.9	169.8	-61.7	-66.3	0	0	0	112.8	D268 P280 G281 I282	D268-Y295 WeakPolarHBondContact CB-OH 3.28Å; D268-Y295 PolarHBondContact OD1-OH 3.1Å; P280-Y295 VanDerWaalsContact C-CD2 3.42Å; P280-Y295 HydrophobicContact CB-CD2 3.81Å; P280-Y295 HydrophobicContact CB-CE2 3.89Å; P280-Y295 HydrophobicContact CG-CD2 4.24Å; P280-Y295 WeakPolarHBondContact O-CD2 3.48Å; P280-Y295 PolarHBondContact O-N 3.2Å; P280-Y295 VanDerWaalsContact O-N 3.09Å; G281-Y295 VanDerWaalsContact N-CE2 3.29Å; G281-Y295 PolarHBondContact O-OH 2.81Å; I282-Y295 HydrophobicContact CD1-CD1 4.36Å; I282-Y295 HydrophobicContact CD1-CE1 3.9Å; I282-Y295 HydrophobicContact CG1-CD1 4.06Å; I282-Y295 HydrophobicContact CG1-CE1 3.42Å; I282-Y295 VanDerWaalsContact CG1-CE1 3.42Å
296	D	79.4	Confident	76.3	Confident	53 Å²	53	71 Å²	71	28%	0.283	36%	0.355	S	S	.	.			trans	-109.2	95.9	-175	-170.8	-24.7	0	0	0	108.9	E298 Q299 Y300	D296-E298 PolarHBondContact O-N 2.89Å; D296-E298 WeakPolarHBondContact OD1-CA 3.35Å; D296-E298 WeakPolarHBondContact OD1-CB 3.21Å; D296-E298 PolarHBondContact OD1-N 3.39Å; D296-Q299 HydrophobicContact CB-CB 4.22Å; D296-Q299 PolarHBondContact OD1-N 3.28Å; D296-Y300 HydrophobicContact CB-CD2 4.32Å; D296-Y300 PolarHBondContact O-N 3.11Å
297	E	69.1	Low	76.3	Confident	101 Å²	101	71.3 Å²	71.3	47%	0.472	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-13.6	178.5	-61.5	-174.4	165.2	0	0	112.3	L302	E297-L302 HydrophobicContact CB-CD1 4.44Å; E297-L302 HydrophobicContact CB-CG 4.44Å; E297-L302 HydrophobicContact CG-CD1 4.38Å; E297-L302 HydrophobicContact CG-CD2 4.24Å; E297-L302 HydrophobicContact CG-CG 4.21Å
298	E	66.6	Low	76.6	Confident	189 Å²	189	73.5 Å²	73.5	88%	0.883	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-43.8	176	-61.2	-170.2	-178	0	0	111.4	D296	D296-E298 PolarHBondContact O-N 2.89Å; D296-E298 WeakPolarHBondContact OD1-CA 3.35Å; D296-E298 WeakPolarHBondContact OD1-CB 3.21Å; D296-E298 PolarHBondContact OD1-N 3.39Å
299	Q	67.7	Low	76.8	Confident	125 Å²	125	68.7 Å²	68.7	58%	0.584	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-31.8	175.5	-173.6	169.4	74.1	0	0	112.6	D296	D296-Q299 HydrophobicContact CB-CB 4.22Å; D296-Q299 PolarHBondContact OD1-N 3.28Å
300	Y	68.3	Low	76.8	Confident	55 Å²	55	68.9 Å²	68.9	22%	0.216	34%	0.336	C	S	.	.	S	Bend	trans	-125	91.8	-176.2	-57.4	-77.5	0	0	0	111.9	V279 D296 L302	V279-Y300 HydrophobicContact CB-CD1 4.2Å; V279-Y300 HydrophobicContact CB-CE1 4.37Å; V279-Y300 HydrophobicContact CB-CG 4.46Å; V279-Y300 HydrophobicContact CG1-CD1 3.68Å; V279-Y300 HydrophobicContact CG1-CD2 3.74Å; V279-Y300 HydrophobicContact CG1-CE1 4.15Å; V279-Y300 HydrophobicContact CG1-CE2 4.2Å; V279-Y300 HydrophobicContact CG1-CG 3.47Å; V279-Y300 VanDerWaalsContact CG1-CG 3.47Å; V279-Y300 HydrophobicContact CG2-CD1 3.52Å; V279-Y300 HydrophobicContact CG2-CE1 3.65Å; V279-Y300 HydrophobicContact CG2-CG 4.22Å; D296-Y300 HydrophobicContact CB-CD2 4.32Å; D296-Y300 PolarHBondContact O-N 3.11Å; Y300-L302 PolarHBondContact O-N 2.84Å
301	P	62.4	Low	76.3	Confident	64 Å²	64	69.1 Å²	69.1	42%	0.416	34%	0.337	S	S	.	.			trans	-51.3	127	-177.5	-31.1	35.9	0	0	0	113.4	E303 N304 H305	P301-E303 PolarHBondContact O-N 3.15Å; P301-N304 PolarHBondContact O-N 3.06Å; P301-N304 VanDerWaalsContact O-N 3.09Å; P301-H305 PolarHBondContact O-N 3.06Å; P301-H305 VanDerWaalsContact O-N 3.14Å; P301-H305 PolarHBondContact O-ND1 3.15Å
302	L	62.3	Low	75.6	Confident	73 Å²	73	73.2 Å²	73.2	38%	0.382	37%	0.366	S	S	.	.	H	α-helix	trans	-48	-42.8	-178.1	-79.8	153.4	0	0	0	113	E297 Y300 N304 H305 C306	E297-L302 HydrophobicContact CB-CD1 4.44Å; E297-L302 HydrophobicContact CB-CG 4.44Å; E297-L302 HydrophobicContact CG-CD1 4.38Å; E297-L302 HydrophobicContact CG-CD2 4.24Å; E297-L302 HydrophobicContact CG-CG 4.21Å; Y300-L302 PolarHBondContact O-N 2.84Å; L302-N304 PolarHBondContact O-N 3.41Å; L302-H305 PolarHBondContact O-N 3.48Å; L302-C306 HydrophobicContact CD2-CB 4.09Å; L302-C306 WeakPolarHBondContact O-CB 3.48Å; L302-C306 PolarHBondContact O-N 2.94Å
303	E	59	Low	75	Confident	184 Å²	184	74.7 Å²	74.7	86%	0.86	37%	0.373	S	S	*	.	H	α-helix	trans	-57.9	-33.7	-176.9	-59.7	-176.9	158	0	0	113.2	P301	P301-E303 PolarHBondContact O-N 3.15Å
304	N	64	Low	74.7	Confident	105 Å²	105	70.1 Å²	70.1	56%	0.561	35%	0.354	S	S	*	.	H	α-helix	trans	-96.4	-34.5	-178.3	-68.9	-24.4	0	0	0	112.7	P301 L302 K307	P301-N304 PolarHBondContact O-N 3.06Å; P301-N304 VanDerWaalsContact O-N 3.09Å; L302-N304 PolarHBondContact O-N 3.41Å; N304-K307 VanDerWaalsContact O-CE 3.3Å; N304-K307 WeakPolarHBondContact O-CE 3.37Å; N304-K307 PolarHBondContact O-NZ 2.91Å
305	H	70.8	Confident	73.7	Confident	33 Å²	33	70.2 Å²	70.2	15%	0.153	35%	0.353	C	S	.	.	H	α-helix	trans	-108.8	-24	-166.1	-56	99.5	0	0	0	114.6	F292 P294 P301 L302	F292-H305 VanDerWaalsContact CD1-O 3.23Å; F292-H305 WeakPolarHBondContact CD1-O 3.31Å; F292-H305 WeakPolarHBondContact CE1-O 3.43Å; P294-H305 HydrophobicContact CG-CB 4.46Å; P301-H305 PolarHBondContact O-N 3.06Å; P301-H305 VanDerWaalsContact O-N 3.14Å; P301-H305 PolarHBondContact O-ND1 3.15Å; L302-H305 PolarHBondContact O-N 3.48Å
306	C	79.9	Confident	73	Confident	33 Å²	33	66.8 Å²	66.8	22%	0.223	34%	0.341	C	S	.	.			trans	-70.7	130.9	169.4	-170.8	0	0	0	0	108.8	F292 L302	F292-C306 WeakPolarHBondContact O-CA 3.38Å; F292-C306 PolarHBondContact O-SG 3.31Å; F292-C306 VanDerWaalsContact O-SG 3.41Å; L302-C306 HydrophobicContact CD2-CB 4.09Å; L302-C306 WeakPolarHBondContact O-CB 3.48Å; L302-C306 PolarHBondContact O-N 2.94Å
307	K	82.4	Confident	72.8	Confident	39 Å²	39	64.4 Å²	64.4	17%	0.17	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	118.3	175.7	-59.1	-60.5	168.9	-162.4	0	109.2	F271 V291 F292 N304 I309 Y454	F271-K307 HydrophobicContact CE1-CG 4.49Å; F271-K307 HydrophobicContact CE2-CG 4.41Å; F271-K307 HydrophobicContact CZ-CD 4.49Å; F271-K307 HydrophobicContact CZ-CG 4.24Å; V291-K307 CarbonylContact C-O 3.49Å; V291-K307 VanDerWaalsContact CA-O 3.27Å; V291-K307 WeakPolarHBondContact CA-O 3.05Å; F292-K307 HydrophobicContact CB-CB 4.42Å; F292-K307 PolarHBondContact N-O 2.69Å; F292-K307 PolarHBondContact O-N 2.97Å; N304-K307 VanDerWaalsContact O-CE 3.3Å; N304-K307 WeakPolarHBondContact O-CE 3.37Å; N304-K307 PolarHBondContact O-NZ 2.91Å; K307-I309 HydrophobicContact CB-CD1 4.45Å; K307-Y454 HydrophobicContact CD-CD1 4.07Å; K307-Y454 HydrophobicContact CD-CE1 3.69Å; K307-Y454 HydrophobicContact CG-CD1 4.31Å; K307-Y454 HydrophobicContact CG-CE1 4.37Å
308	Q	84.5	Confident	73.1	Confident	134 Å²	134	59.9 Å²	59.9	63%	0.626	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	102.2	177	177.7	172.6	-11.7	0	0	108.2	M289 V291	M289-Q308 HydrophobicContact CE-CG 3.35Å; V291-Q308 HydrophobicContact CG2-CG 4.31Å
309	I	84.1	Confident	73.4	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	110	-170.8	-48.6	164.6	0	0	0	107.6	F290 K307 L311 Q313 F314 A430 Y454	F290-I309 HydrophobicContact CD1-CD1 4.34Å; F290-I309 PolarHBondContact N-O 2.91Å; F290-I309 PolarHBondContact O-N 2.85Å; K307-I309 HydrophobicContact CB-CD1 4.45Å; I309-L311 PolarHBondContact O-N 3.41Å; I309-Q313 HydrophobicContact CG2-CB 4.23Å; I309-F314 HydrophobicContact CB-CE1 3.8Å; I309-F314 HydrophobicContact CG2-CD1 3.75Å; I309-F314 HydrophobicContact CG2-CE1 3.43Å; I309-F314 VanDerWaalsContact CG2-CE1 3.43Å; I309-F314 HydrophobicContact CG2-CZ 4.48Å; I309-A430 HydrophobicContact CG2-CB 3.71Å; I309-Y454 HydrophobicContact CD1-CD2 3.4Å; I309-Y454 VanDerWaalsContact CD1-CD2 3.4Å; I309-Y454 HydrophobicContact CD1-CE2 3.43Å; I309-Y454 VanDerWaalsContact CD1-CE2 3.43Å; I309-Y454 HydrophobicContact CD1-CG 4.06Å; I309-Y454 HydrophobicContact CG1-CD2 4.49Å; I309-Y454 HydrophobicContact CG1-CE2 4.05Å
310	P	83.5	Confident	73.6	Confident	37 Å²	37	46.1 Å²	46.1	24%	0.24	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	136.7	169.5	-24	33	0	0	0	110.8	M289 S312 Q313 F314	M289-P310 HydrophobicContact CE-CB 4.24Å; M289-P310 HydrophobicContact CE-CG 3.82Å; M289-P310 VanDerWaalsContact CE-N 3.32Å; M289-P310 VanDerWaalsContact SD-CA 3.58Å; M289-P310 HydrophobicContact SD-CB 3.84Å; M289-P310 HydrophobicContact SD-CG 3.8Å; P310-S312 PolarHBondContact O-N 2.88Å; P310-S312 VanDerWaalsContact O-N 3.1Å; P310-Q313 HydrophobicContact CB-CG 4.45Å; P310-Q313 WeakPolarHBondContact O-CB 3.32Å; P310-Q313 PolarHBondContact O-N 3.49Å; P310-F314 WeakPolarHBondContact O-CD1 3.46Å
311	L	79.2	Confident	73.6	Confident	5 Å²	5	49.5 Å²	49.5	3%	0.026	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-64.5	-17.8	179.4	-68.9	165.7	0	0	0	112.3	V285 T286 N288 F290 I309 Q313 F314 L470 F475	V285-L311 HydrophobicContact CG1-CD1 4.34Å; T286-L311 WeakPolarHBondContact O-CD1 3.39Å; N288-L311 PolarHBondContact O-N 2.89Å; F290-L311 HydrophobicContact CB-CD2 4.29Å; I309-L311 PolarHBondContact O-N 3.41Å; L311-Q313 VanDerWaalsContact C-N 3.28Å; L311-Q313 PolarHBondContact O-N 3.08Å; L311-F314 HydrophobicContact CD2-CD1 3.97Å; L311-F314 HydrophobicContact CD2-CD2 4.14Å; L311-F314 HydrophobicContact CD2-CE1 3.72Å; L311-F314 HydrophobicContact CD2-CE2 3.92Å; L311-F314 HydrophobicContact CD2-CG 4.17Å; L311-F314 HydrophobicContact CD2-CZ 3.7Å; L311-F314 WeakPolarHBondContact O-CB 3.47Å; L311-F314 PolarHBondContact O-N 3.33Å; L311-L470 HydrophobicContact CD2-CD2 3.7Å; L311-F475 HydrophobicContact CB-CD1 4.02Å; L311-F475 HydrophobicContact CB-CE1 3.56Å; L311-F475 HydrophobicContact CD1-CE1 3.93Å; L311-F475 HydrophobicContact CG-CE1 4.22Å
312	S	73.3	Confident	73.8	Confident	107 Å²	107	48.5 Å²	48.5	75%	0.748	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-70.9	-14.2	168.8	54.4	0	0	0	0	115	P310	P310-S312 PolarHBondContact O-N 2.88Å; P310-S312 VanDerWaalsContact O-N 3.1Å
313	Q	79.2	Confident	74.1	Confident	31 Å²	31	47 Å²	47	15%	0.145	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-90.5	-10.7	170.7	-70.7	-176.1	-26.4	0	0	112.9	I309 P310 L311 R315 A430 Y431 N433	I309-Q313 HydrophobicContact CG2-CB 4.23Å; P310-Q313 HydrophobicContact CB-CG 4.45Å; P310-Q313 WeakPolarHBondContact O-CB 3.32Å; P310-Q313 PolarHBondContact O-N 3.49Å; L311-Q313 VanDerWaalsContact C-N 3.28Å; L311-Q313 PolarHBondContact O-N 3.08Å; Q313-R315 PolarHBondContact O-N 3.19Å; Q313-A430 HydrophobicContact CB-CB 4.33Å; Q313-A430 CarbonylContact O-C 3.59Å; Q313-A430 WeakPolarHBondContact O-CA 3.37Å; Q313-Y431 VanDerWaalsContact O-CD2 3.32Å; Q313-Y431 WeakPolarHBondContact O-CD2 3.26Å; Q313-Y431 PolarHBondContact O-N 3.44Å; Q313-N433 PolarHBondContact NE2-ND2 3.41Å; Q313-N433 VanDerWaalsContact NE2-ND2 3.12Å; Q313-N433 PolarHBondContact NE2-OD1 3.41Å
314	F	78.5	Confident	74.4	Confident	9 Å²	9	40.4 Å²	40.4	4%	0.039	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	130.6	-177.3	-83.2	51	0	0	0	110.2	F290 I309 P310 L311 I317 I428 F572	F290-F314 HydrophobicContact CB-CE1 3.81Å; F290-F314 HydrophobicContact CB-CZ 3.5Å; F290-F314 HydrophobicContact CD1-CZ 4.37Å; F290-F314 AromaticContact CD2-CZ 3.99Å; F290-F314 HydrophobicContact CD2-CZ 3.99Å; F290-F314 HydrophobicContact CG-CE1 4.45Å; F290-F314 AromaticContact CG-CZ 3.73Å; F290-F314 HydrophobicContact CG-CZ 3.73Å; I309-F314 HydrophobicContact CB-CE1 3.8Å; I309-F314 HydrophobicContact CG2-CD1 3.75Å; I309-F314 HydrophobicContact CG2-CE1 3.43Å; I309-F314 VanDerWaalsContact CG2-CE1 3.43Å; I309-F314 HydrophobicContact CG2-CZ 4.48Å; P310-F314 WeakPolarHBondContact O-CD1 3.46Å; L311-F314 HydrophobicContact CD2-CD1 3.97Å; L311-F314 HydrophobicContact CD2-CD2 4.14Å; L311-F314 HydrophobicContact CD2-CE1 3.72Å; L311-F314 HydrophobicContact CD2-CE2 3.92Å; L311-F314 HydrophobicContact CD2-CG 4.17Å; L311-F314 HydrophobicContact CD2-CZ 3.7Å; L311-F314 WeakPolarHBondContact O-CB 3.47Å; L311-F314 PolarHBondContact O-N 3.33Å; F314-I317 HydrophobicContact CD2-CD1 3.53Å; F314-I317 HydrophobicContact CD2-CG1 3.72Å; F314-I317 HydrophobicContact CE2-CD1 3.75Å; F314-I317 HydrophobicContact CE2-CG1 4.17Å; F314-I428 HydrophobicContact CD1-CG2 4.48Å; F314-I428 HydrophobicContact CD2-CG2 3.8Å; F314-I428 HydrophobicContact CE1-CG2 4.28Å; F314-I428 HydrophobicContact CE2-CB 4.38Å; F314-I428 HydrophobicContact CE2-CD1 3.7Å; F314-I428 HydrophobicContact CE2-CG1 3.88Å; F314-I428 HydrophobicContact CE2-CG2 3.56Å; F314-I428 HydrophobicContact CG-CG2 4.28Å; F314-I428 HydrophobicContact CZ-CD1 3.79Å; F314-I428 HydrophobicContact CZ-CG1 4.39Å; F314-I428 HydrophobicContact CZ-CG2 3.81Å; F314-F572 HydrophobicContact CB-CZ 4.31Å
315	R	68.3	Low	74.5	Confident	10 Å²	10	36.1 Å²	36.1	4%	0.038	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-63.3	-178.4	-169.2	178.5	176.6	-179.2	-0.8	110.1	Q313 L429 Y431 S451 E690	Q313-R315 PolarHBondContact O-N 3.19Å; R315-L429 HydrophobicContact CB-CB 4.29Å; R315-L429 WeakPolarHBondContact CB-O 3.31Å; R315-L429 PolarHBondContact N-O 3.25Å; R315-Y431 HydrophobicContact CB-CD2 4.36Å; R315-Y431 HydrophobicContact CB-CE2 3.95Å; R315-Y431 HydrophobicContact CG-CE2 3.96Å; R315-S451 VanDerWaalsContact CD-OG 3.28Å; R315-S451 WeakPolarHBondContact CD-OG 3.14Å; R315-S451 PolarHBondContact NH1-OG 3.35Å; R315-S451 VanDerWaalsContact NH1-OG 3.15Å; R315-E690 WeakPolarHBondContact CG-OE2 3.15Å; R315-E690 IonicContact CZ-OE1 2.61Å; R315-E690 IonicContact NE-OE1 3.26Å; R315-E690 PolarHBondContact NE-OE1 2.82Å; R315-E690 IonicContact NE-OE2 3.71Å; R315-E690 PolarHBondContact NE-OE2 3.32Å; R315-E690 IonicContact NH2-OE1 3.55Å; R315-E690 PolarHBondContact NH2-OE1 3.49Å
316	T	70	Confident	74.2	Confident	14 Å²	14	34.7 Å²	34.7	9%	0.086	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	157.7	169.9	65.7	0	0	0	0	111.2	L429 E684 L685 V686	T316-L429 PolarHBondContact N-O 3.07Å; T316-L429 PolarHBondContact O-N 2.99Å; T316-E684 WeakPolarHBondContact CB-OE1 3.43Å; T316-E684 WeakPolarHBondContact CG2-OE1 3.39Å; T316-L685 CarbonylContact C-O 3.52Å; T316-L685 VanDerWaalsContact CA-O 3.25Å; T316-L685 WeakPolarHBondContact CA-O 3.46Å; T316-V686 HydrophobicContact CG2-CB 4.32Å; T316-V686 HydrophobicContact CG2-CG1 4.12Å; T316-V686 HydrophobicContact CG2-CG2 3.96Å
317	I	76.4	Confident	73.3	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.015	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	132.8	173.6	-43.9	-179.4	0	0	0	108.3	F314 L426 C427 I428 L470 E684 L685	F314-I317 HydrophobicContact CD2-CD1 3.53Å; F314-I317 HydrophobicContact CD2-CG1 3.72Å; F314-I317 HydrophobicContact CE2-CD1 3.75Å; F314-I317 HydrophobicContact CE2-CG1 4.17Å; I317-L426 HydrophobicContact CG2-CD1 3.36Å; I317-L426 HydrophobicContact CG2-CG 4.29Å; I317-C427 CarbonylContact C-O 3.54Å; I317-C427 WeakPolarHBondContact CA-O 3.25Å; I317-I428 HydrophobicContact CG2-CG1 4.15Å; I317-L470 HydrophobicContact CD1-CD1 3.8Å; I317-E684 CarbonylContact O-C 3.54Å; I317-E684 WeakPolarHBondContact O-CA 3.4Å; I317-L685 HydrophobicContact CB-CB 4.13Å; I317-L685 HydrophobicContact CD1-CD2 3.86Å; I317-L685 HydrophobicContact CG1-CD2 4.4Å; I317-L685 PolarHBondContact N-O 2.8Å; I317-L685 PolarHBondContact O-N 3.22Å
318	A	74.2	Confident	72	Confident	6 Å²	6	43.3 Å²	43.3	5%	0.05	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	151.7	175.1	0	0	0	0	0	111	Y320 L426 C427 E684	A318-Y320 HydrophobicContact CB-CE1 4.39Å; A318-Y320 HydrophobicContact CB-CE2 3.7Å; A318-Y320 WeakPolarHBondContact CB-OH 3.46Å; A318-L426 CarbonylContact O-C 3.44Å; A318-L426 WeakPolarHBondContact O-CA 3.48Å; A318-C427 PolarHBondContact N-O 3.47Å; A318-C427 PolarHBondContact O-N 3.13Å; A318-E684 HydrophobicContact CB-CG 4.44Å
319	V	74.2	Confident	70.5	Confident	8 Å²	8	38.5 Å²	38.5	5%	0.048	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	128.4	171.4	160.2	0	0	0	0	111.3	F424 Y425 L426 F467 N682	V319-F424 HydrophobicContact CG1-CB 3.69Å; V319-F424 HydrophobicContact CG1-CD1 3.53Å; V319-F424 HydrophobicContact CG1-CE1 4.29Å; V319-F424 HydrophobicContact CG1-CG 3.69Å; V319-Y425 WeakPolarHBondContact CA-O 3.49Å; V319-L426 HydrophobicContact CG2-CB 4.14Å; V319-L426 HydrophobicContact CG2-CD1 3.52Å; V319-L426 HydrophobicContact CG2-CG 4.47Å; V319-F467 HydrophobicContact CB-CE2 3.85Å; V319-F467 HydrophobicContact CB-CZ 3.75Å; V319-F467 HydrophobicContact CG2-CE2 3.52Å; V319-F467 HydrophobicContact CG2-CZ 3.42Å; V319-F467 VanDerWaalsContact CG2-CZ 3.42Å; V319-N682 WeakPolarHBondContact O-CB 3.18Å
320	Y	70.7	Confident	68.9	Low	16 Å²	16	41 Å²	41	6%	0.063	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	148.4	179.5	-51.4	-78.8	0	0	0	110.8	A318 V325 Y425 C427 W455	A318-Y320 HydrophobicContact CB-CE1 4.39Å; A318-Y320 HydrophobicContact CB-CE2 3.7Å; A318-Y320 WeakPolarHBondContact CB-OH 3.46Å; Y320-V325 HydrophobicContact CD1-CB 4.14Å; Y320-V325 HydrophobicContact CD1-CG1 3.97Å; Y320-V325 HydrophobicContact CD1-CG2 3.76Å; Y320-V325 HydrophobicContact CD2-CG1 4.37Å; Y320-V325 HydrophobicContact CE1-CB 4.42Å; Y320-V325 HydrophobicContact CE1-CG1 3.74Å; Y320-V325 HydrophobicContact CE1-CG2 4.29Å; Y320-V325 HydrophobicContact CE2-CG1 4.15Å; Y320-V325 HydrophobicContact CG-CB 4.18Å; Y320-V325 HydrophobicContact CG-CG1 4.27Å; Y320-V325 HydrophobicContact CG-CG2 4.08Å; Y320-Y425 PolarHBondContact N-O 3.42Å; Y320-Y425 PolarHBondContact O-N 3.25Å; Y320-C427 HydrophobicContact CD2-CB 4.48Å; Y320-C427 HydrophobicContact CE2-CB 3.91Å; Y320-W455 AromaticContact CD2-CH2 3.48Å; Y320-W455 HydrophobicContact CD2-CH2 3.48Å; Y320-W455 VanDerWaalsContact CD2-CH2 3.48Å; Y320-W455 AromaticContact CD2-CZ3 3.57Å; Y320-W455 HydrophobicContact CD2-CZ3 3.57Å; Y320-W455 AromaticContact CE2-CH2 3.57Å; Y320-W455 HydrophobicContact CE2-CH2 3.57Å; Y320-W455 HydrophobicContact CE2-CZ2 4.35Å; Y320-W455 HydrophobicContact CE2-CZ3 4.08Å; Y320-W455 HydrophobicContact CG-CH2 4.44Å; Y320-W455 HydrophobicContact CG-CZ3 4.49Å
321	R	68.7	Low	66.9	Low	126 Å²	126	46.8 Å²	46.8	48%	0.475	23%	0.226	S	C	.	.	S	Bend	trans	-83	-31.3	167.8	-73.5	-173.4	-178.2	109.2	6.4	112.5	F424 E679 I681	R321-F424 HydrophobicContact CG-CD1 4.07Å; R321-F424 HydrophobicContact CG-CE1 3.65Å; R321-E679 PolarHBondContact NH1-O 2.87Å; R321-I681 PolarHBondContact NH1-O 2.66Å
322	D	66.2	Low	64.8	Low	43 Å²	43	49.7 Å²	49.7	23%	0.23	26%	0.257	C	S	.	.			trans	-108.7	122.3	-170.2	178.3	7.1	0	0	0	110.5	S324 V325 T680	D322-S324 VanDerWaalsContact CG-CB 3.46Å; D322-S324 VanDerWaalsContact CG-OG 3.26Å; D322-S324 PolarHBondContact O-N 2.88Å; D322-S324 WeakPolarHBondContact OD1-CB 3.38Å; D322-S324 PolarHBondContact OD1-N 2.72Å; D322-S324 PolarHBondContact OD1-OG 3.36Å; D322-S324 WeakPolarHBondContact OD2-CB 3.16Å; D322-S324 PolarHBondContact OD2-OG 3.47Å; D322-V325 PolarHBondContact O-N 3.03Å; D322-T680 HydrophobicContact CB-CG2 4.15Å
323	P	69.3	Low	62.9	Low	43 Å²	43	51.1 Å²	51.1	28%	0.279	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-14.3	174.8	26.8	-34	0	0	0	113.4	V325 M326 Y425	P323-V325 PolarHBondContact O-N 2.61Å; P323-V325 VanDerWaalsContact O-N 3.07Å; P323-M326 PolarHBondContact O-N 2.81Å; P323-Y425 HydrophobicContact CB-CD1 4.36Å; P323-Y425 HydrophobicContact CB-CE1 3.82Å; P323-Y425 HydrophobicContact CB-CE2 4.07Å; P323-Y425 HydrophobicContact CG-CE2 4.16Å
324	S	65	Low	60.4	Low	44 Å²	44	57.8 Å²	57.8	31%	0.308	29%	0.293	S	S	.	.	H	α-helix	trans	-54.9	-27.3	177.7	-54.9	0	0	0	0	112.7	D322 M326 Y327 F328	D322-S324 VanDerWaalsContact CG-CB 3.46Å; D322-S324 VanDerWaalsContact CG-OG 3.26Å; D322-S324 PolarHBondContact O-N 2.88Å; D322-S324 WeakPolarHBondContact OD1-CB 3.38Å; D322-S324 PolarHBondContact OD1-N 2.72Å; D322-S324 PolarHBondContact OD1-OG 3.36Å; D322-S324 WeakPolarHBondContact OD2-CB 3.16Å; D322-S324 PolarHBondContact OD2-OG 3.47Å; S324-M326 VanDerWaalsContact C-N 3.3Å; S324-M326 PolarHBondContact O-N 2.88Å; S324-Y327 WeakPolarHBondContact O-CB 3.17Å; S324-Y327 PolarHBondContact O-N 3.4Å; S324-F328 WeakPolarHBondContact O-CD2 3.43Å; S324-F328 WeakPolarHBondContact O-CE2 3.37Å
325	V	65.3	Low	58	Low	16 Å²	16	63.1 Å²	63.1	10%	0.097	33%	0.328	C	S	.	.	H	α-helix	trans	-60.6	-37.5	176.7	-175.6	0	0	0	0	112.2	Y320 D322 P323 Y327 F328 T329 W455	Y320-V325 HydrophobicContact CD1-CB 4.14Å; Y320-V325 HydrophobicContact CD1-CG1 3.97Å; Y320-V325 HydrophobicContact CD1-CG2 3.76Å; Y320-V325 HydrophobicContact CD2-CG1 4.37Å; Y320-V325 HydrophobicContact CE1-CB 4.42Å; Y320-V325 HydrophobicContact CE1-CG1 3.74Å; Y320-V325 HydrophobicContact CE1-CG2 4.29Å; Y320-V325 HydrophobicContact CE2-CG1 4.15Å; Y320-V325 HydrophobicContact CG-CB 4.18Å; Y320-V325 HydrophobicContact CG-CG1 4.27Å; Y320-V325 HydrophobicContact CG-CG2 4.08Å; D322-V325 PolarHBondContact O-N 3.03Å; P323-V325 PolarHBondContact O-N 2.61Å; P323-V325 VanDerWaalsContact O-N 3.07Å; V325-Y327 PolarHBondContact O-N 2.99Å; V325-F328 PolarHBondContact O-N 3.23Å; V325-T329 PolarHBondContact O-N 3.37Å; V325-W455 HydrophobicContact CB-CH2 4.23Å; V325-W455 HydrophobicContact CG1-CH2 4.21Å
326	M	66.2	Low	56	Low	2 Å²	2	68.8 Å²	68.8	1%	0.01	36%	0.364	C	S	.	.	H	α-helix	trans	-65.6	-23.2	-179.2	-174.9	171.8	45.5	0	0	112.8	V272 L275 P323 S324 F328 T329 K330 W455	V272-M326 HydrophobicContact CG1-CE 3.56Å; V272-M326 HydrophobicContact CG1-SD 4.18Å; L275-M326 HydrophobicContact CD2-CE 3.57Å; L275-M326 HydrophobicContact CG-CE 3.78Å; P323-M326 PolarHBondContact O-N 2.81Å; S324-M326 VanDerWaalsContact C-N 3.3Å; S324-M326 PolarHBondContact O-N 2.88Å; M326-F328 VanDerWaalsContact C-N 3.25Å; M326-F328 PolarHBondContact O-N 3.23Å; M326-T329 PolarHBondContact O-OG1 3.02Å; M326-K330 HydrophobicContact CG-CB 4.4Å; M326-K330 HydrophobicContact CG-CD 3.8Å; M326-K330 HydrophobicContact CG-CG 4.02Å; M326-K330 PolarHBondContact O-N 3.07Å; M326-K330 HydrophobicContact SD-CD 3.81Å; M326-K330 PolarHBondContact SD-NZ 3.48Å; M326-W455 HydrophobicContact CB-CD2 4.14Å; M326-W455 HydrophobicContact CB-CE3 4.26Å; M326-W455 HydrophobicContact CB-CH2 3.88Å; M326-W455 HydrophobicContact CB-CZ2 3.73Å; M326-W455 HydrophobicContact CB-CZ3 4.14Å; M326-W455 HydrophobicContact CG-CD2 4.01Å; M326-W455 HydrophobicContact CG-CG 4.35Å; M326-W455 HydrophobicContact CG-CZ2 4.06Å; M326-W455 HydrophobicContact SD-CB 4.09Å; M326-W455 HydrophobicContact SD-CD2 3.73Å; M326-W455 HydrophobicContact SD-CE3 4.35Å; M326-W455 HydrophobicContact SD-CG 3.58Å; M326-W455 VanDerWaalsContact SD-CG 3.58Å
327	Y	59.8	Low	53.9	Low	143 Å²	143	72.8 Å²	72.8	56%	0.561	39%	0.393	S	S	*	.	H	α-helix	trans	-65.8	-27.5	172	-69.7	-106	0	0	0	112.6	L275 S324 V325	L275-Y327 HydrophobicContact CD1-CD1 3.55Å; L275-Y327 HydrophobicContact CD1-CD2 3.75Å; L275-Y327 HydrophobicContact CD1-CE1 3.61Å; L275-Y327 HydrophobicContact CD1-CE2 3.85Å; L275-Y327 HydrophobicContact CD1-CG 3.62Å; L275-Y327 HydrophobicContact CD2-CD2 3.59Å; L275-Y327 HydrophobicContact CD2-CE1 4.45Å; L275-Y327 HydrophobicContact CD2-CE2 3.25Å; L275-Y327 HydrophobicContact CD2-CG 4.35Å; L275-Y327 HydrophobicContact CG-CD2 4.33Å; L275-Y327 HydrophobicContact CG-CE2 4.17Å; S324-Y327 WeakPolarHBondContact O-CB 3.17Å; S324-Y327 PolarHBondContact O-N 3.4Å; V325-Y327 PolarHBondContact O-N 2.99Å
328	F	55.5	Low	51.4	Low	110 Å²	110	78.4 Å²	78.4	48%	0.482	43%	0.431	S	S	.	.	H	α-helix	trans	-88.1	-23	-177.7	-61.5	-78.6	0	0	0	112.8	S324 V325 M326 R585	S324-F328 WeakPolarHBondContact O-CD2 3.43Å; S324-F328 WeakPolarHBondContact O-CE2 3.37Å; V325-F328 PolarHBondContact O-N 3.23Å; M326-F328 VanDerWaalsContact C-N 3.25Å; M326-F328 PolarHBondContact O-N 3.23Å; F328-R585 PolarHBondContact O-NH1 3.26Å
329	T	52.5	Low	48.9	Very low	34 Å²	34	84.5 Å²	84.5	21%	0.209	47%	0.47	C	S	.	.	H	α-helix	trans	-89.8	-58.3	176.5	62.7	0	0	0	0	111.7	V325 M326 R331 E453	V325-T329 PolarHBondContact O-N 3.37Å; M326-T329 PolarHBondContact O-OG1 3.02Å; T329-R331 VanDerWaalsContact C-N 3.32Å; T329-R331 PolarHBondContact O-N 3.18Å; T329-E453 WeakPolarHBondContact CB-OE1 3.22Å; T329-E453 PolarHBondContact OG1-OE1 2.93Å
330	K	52	Low	46.6	Very low	55 Å²	55	89.1 Å²	89.1	24%	0.239	50%	0.502	C	S	.	.			trans	-75.4	70.6	179.3	-68.9	-171.6	-179	171.8	0	113.2	V272 V273 M326 G332	V272-K330 PolarHBondContact O-NZ 2.87Å; V272-K330 VanDerWaalsContact O-NZ 3.15Å; V273-K330 PolarHBondContact O-NZ 3.13Å; M326-K330 HydrophobicContact CG-CB 4.4Å; M326-K330 HydrophobicContact CG-CD 3.8Å; M326-K330 HydrophobicContact CG-CG 4.02Å; M326-K330 PolarHBondContact O-N 3.07Å; M326-K330 HydrophobicContact SD-CD 3.81Å; M326-K330 PolarHBondContact SD-NZ 3.48Å; K330-G332 PolarHBondContact O-N 2.87Å
331	R	39.6	Very low	44.4	Very low	157 Å²	157	95.8 Å²	95.8	59%	0.592	54%	0.539	S	S	*	.			trans	-80	96.2	153	-77	-160.1	-177.2	-151.7	4	108.1	T329 D590	T329-R331 VanDerWaalsContact C-N 3.32Å; T329-R331 PolarHBondContact O-N 3.18Å; R331-D590 IonicContact CZ-OD2 3.79Å; R331-D590 IonicContact NH1-OD2 3.95Å; R331-D590 PolarHBondContact NH1-OD2 2.9Å; R331-D590 IonicContact NH2-OD2 2.67Å; R331-D590 PolarHBondContact NH2-OD2 2.98Å
332	G	36.3	Very low	42.5	Very low	66 Å²	66	98 Å²	98	68%	0.68	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-57.4	148.9	-171.7	0	0	0	0	0	114.8	K330	K330-G332 PolarHBondContact O-N 2.87Å
333	T	33.5	Very low	40.4	Very low	138 Å²	138	103.5 Å²	103.5	85%	0.847	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-49.3	139.8	154.6	41.1	0	0	0	0	109.2
334	Q	25.7	Very low	38.5	Very low	171 Å²	171	109 Å²	109	80%	0.799	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-58.3	135.5	172.2	-98.3	-159	18.7	0	0	109.3	T336	Q334-T336 PolarHBondContact O-N 2.64Å; Q334-T336 VanDerWaalsContact O-N 3.08Å
335	P	28.6	Very low	36.5	Very low	120 Å²	120	115.5 Å²	115.5	78%	0.779	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-60.8	116.2	165.7	26.4	-32.3	0	0	0	107.6	S337	P335-S337 PolarHBondContact O-N 3.17Å
336	T	27	Very low	34.6	Very low	129 Å²	129	120.3 Å²	120.3	79%	0.791	67%	0.67	S	S	*	*			trans	-68.1	94.7	-171.6	48.7	0	0	0	0	111.2	Q334	Q334-T336 PolarHBondContact O-N 2.64Å; Q334-T336 VanDerWaalsContact O-N 3.08Å
337	S	26.4	Very low	32.8	Very low	99 Å²	99	127 Å²	127	69%	0.692	71%	0.706	S	S	*	*			trans	26.4	94.4	160.8	61.7	0	0	0	0	116.3	P335 P339	P335-S337 PolarHBondContact O-N 3.17Å; S337-P339 WeakPolarHBondContact O-CD 3.4Å
338	C	21.9	Very low	31.1	Very low	121 Å²	121	125.4 Å²	125.4	82%	0.818	71%	0.711	S	S	*	*			trans	-58.1	121.8	158.7	-63.5	0	0	0	0	109.1	S340	C338-S340 PolarHBondContact O-N 2.98Å
339	P	23.2	Very low	29.7	Very low	133 Å²	133	127.3 Å²	127.3	86%	0.864	73%	0.726	S	S	*	*			trans	-85.3	98.8	-175.4	32.1	-32.9	0	0	0	111.1	S337	S337-P339 WeakPolarHBondContact O-CD 3.4Å
340	S	26.2	Very low	28.5	Very low	105 Å²	105	134.4 Å²	134.4	73%	0.734	76%	0.757	S	S	*	*			trans	-131.3	64.1	179.5	66.6	0	0	0	0	113.4	C338	C338-S340 PolarHBondContact O-N 2.98Å
341	N	24.3	Very low	27.4	Very low	156 Å²	156	138.5 Å²	138.5	83%	0.834	78%	0.781	S	S	*	*			trans	-94.7	86.9	162.8	-102	-12.8	0	0	0	109.4
342	M	27.3	Very low	26.8	Very low	173 Å²	173	138.3 Å²	138.3	85%	0.852	79%	0.79	S	S	*	*			trans	-145.3	92.2	161.1	-90.3	-61.6	173.8	0	0	108.8
343	N	22.6	Very low	26.2	Very low	159 Å²	159	141.7 Å²	141.7	85%	0.85	79%	0.793	S	S	*	*			trans	-76.7	120.6	170.2	-71.1	-23.6	0	0	0	109.2
344	I	29.8	Very low	26	Very low	158 Å²	158	140.7 Å²	140.7	81%	0.81	79%	0.791	S	S	*	*			trans	-134.6	133.3	158	-57.2	-175.6	0	0	0	106.6
345	E	23	Very low	26	Very low	180 Å²	180	138.8 Å²	138.8	84%	0.841	79%	0.791	S	S	*	*			trans	-79.3	-171.1	177.1	-64.3	173.9	104.2	0	0	111.2
346	C	26.1	Very low	25.8	Very low	117 Å²	117	141.6 Å²	141.6	79%	0.791	79%	0.794	S	S	*	*			trans	73.8	139.1	-179	-67.5	0	0	0	0	115.6
347	D	27	Very low	25.8	Very low	143 Å²	143	144.9 Å²	144.9	77%	0.765	80%	0.801	S	S	*	*			cis	-155.7	-175	-18.2	-138.3	-47.4	0	0	0	111.4
348	V	25.4	Very low	25.7	Very low	110 Å²	110	146.3 Å²	146.3	67%	0.667	81%	0.805	S	S	*	*	S	Bend	trans	-65.7	133.6	-176.9	171.4	0	0	0	0	114
349	N	25	Very low	25.7	Very low	149 Å²	149	146.7 Å²	146.7	80%	0.797	81%	0.806	S	S	*	*			trans	60.4	98.6	162.1	-62.8	-17.8	0	0	0	118.8
350	E	27.8	Very low	25.8	Very low	184 Å²	184	146 Å²	146	86%	0.86	80%	0.803	S	S	*	*			trans	-151.9	160.8	142.9	-123.7	174.9	-161.9	0	0	113.1
351	L	28.9	Very low	25.7	Very low	140 Å²	140	146.2 Å²	146.2	73%	0.733	80%	0.8	S	S	*	*			trans	50.4	75.3	178	-76.4	83.1	0	0	0	118
352	I	26.5	Very low	25.8	Very low	153 Å²	153	146.1 Å²	146.1	79%	0.785	80%	0.797	S	S	*	*			trans	-67.3	146.8	133	-64.6	170.2	0	0	0	107.9
353	N	25	Very low	25.8	Very low	138 Å²	138	144.7 Å²	144.7	74%	0.738	79%	0.792	S	S	*	*			trans	84.8	83.2	178.9	-54.7	-36.4	0	0	0	117.9
354	S	28.1	Very low	26	Very low	116 Å²	116	142.3 Å²	142.3	81%	0.811	78%	0.783	S	S	*	*			trans	-151.4	97.8	139.9	58.8	0	0	0	0	109.2
355	T	25.3	Very low	26	Very low	131 Å²	131	141.8 Å²	141.8	80%	0.804	78%	0.775	S	S	*	*			trans	-79.2	175.4	-177.6	-45.8	0	0	0	0	111.2
356	E	24.8	Very low	26.3	Very low	180 Å²	180	139.7 Å²	139.7	84%	0.841	77%	0.77	S	S	*	*			trans	83.8	80.4	168.6	-55.1	-175.5	-173.1	0	0	117.3
357	Q	27.5	Very low	26.7	Very low	198 Å²	198	140.3 Å²	140.3	93%	0.925	77%	0.765	S	S	*	*			trans	-139.8	134.7	132.9	-107	171.2	24.6	0	0	109.2
358	T	23.8	Very low	27	Very low	128 Å²	128	141.5 Å²	141.5	79%	0.785	77%	0.771	S	S	*	*			trans	-90.6	134.2	-163.9	45.3	0	0	0	0	113.4	C360	T358-C360 PolarHBondContact O-N 3.44Å
359	P	22.9	Very low	27.1	Very low	130 Å²	130	142 Å²	142	84%	0.844	78%	0.78	S	S	*	*			trans	-76	114.3	172	30.9	-32.3	0	0	0	110.3
360	C	24	Very low	27.6	Very low	118 Å²	118	140.6 Å²	140.6	80%	0.797	78%	0.782	S	S	*	*			trans	-95.5	106.8	-173.8	-147.5	0	0	0	0	112.7	T358	T358-C360 PolarHBondContact O-N 3.44Å
361	V	25	Very low	27.6	Very low	110 Å²	110	138.3 Å²	138.3	67%	0.667	78%	0.781	S	S	*	*			trans	49.8	98.9	157.4	-168.1	0	0	0	0	117.7	I363	V361-I363 HydrophobicContact CG1-CG1 3.78Å
362	I	25.1	Very low	27.7	Very low	153 Å²	153	141.1 Å²	141.1	79%	0.785	79%	0.79	S	S	*	*			trans	-72.4	119.8	150.9	-63.3	171.2	0	0	0	107.6	T364	I362-T364 HydrophobicContact CG2-CG2 3.97Å; I362-T364 PolarHBondContact O-N 3.03Å
363	I	27.5	Very low	27.8	Very low	143 Å²	143	142.5 Å²	142.5	73%	0.733	79%	0.79	S	S	*	*			trans	-86.5	91.5	174.5	-55.4	178.3	0	0	0	109.5	V361	V361-I363 HydrophobicContact CG1-CG1 3.78Å
364	T	26.6	Very low	28	Very low	109 Å²	109	143.2 Å²	143.2	67%	0.669	79%	0.793	S	S	*	*			trans	-112.3	100.6	162.8	46.5	0	0	0	0	109.1	I362 N366	I362-T364 HydrophobicContact CG2-CG2 3.97Å; I362-T364 PolarHBondContact O-N 3.03Å; T364-N366 PolarHBondContact O-N 3.15Å
365	K	30.9	Very low	28	Very low	147 Å²	147	141.7 Å²	141.7	64%	0.639	78%	0.783	S	S	*	*			trans	-79.5	103.7	167.8	-78.9	-163.4	174.3	-169.5	0	109.3
366	N	29.7	Very low	28.1	Very low	137 Å²	137	142.1 Å²	142.1	73%	0.733	78%	0.78	S	S	*	*			trans	-118.9	92.2	164	-83.5	30.8	0	0	0	107.1	T364	T364-N366 PolarHBondContact O-N 3.15Å
367	D	33.5	Very low	28.3	Very low	130 Å²	130	138.5 Å²	138.5	70%	0.695	77%	0.774	S	S	*	*			trans	-111.9	72.6	-174.1	-65.2	-56.2	0	0	0	111.1
368	D	33.8	Very low	28.3	Very low	167 Å²	167	134.1 Å²	134.1	89%	0.893	76%	0.762	S	S	*	*			trans	-86.6	104.4	170.6	-89.1	-45.9	0	0	0	110.5
369	S	28.2	Very low	28.5	Very low	120 Å²	120	136.1 Å²	136.1	84%	0.839	76%	0.762	S	S	*	*			trans	-88.7	114.3	-178.9	64.6	0	0	0	0	112.7
370	S	34.8	Very low	28.8	Very low	121 Å²	121	133.4 Å²	133.4	85%	0.846	75%	0.746	S	S	*	*			trans	-147	146.3	154.4	61.6	0	0	0	0	111.8
371	T	28	Very low	29.2	Very low	136 Å²	136	136.7 Å²	136.7	83%	0.834	75%	0.747	S	S	*	*			trans	-99.3	138.5	-174.1	53.3	0	0	0	0	111.5
372	E	31.3	Very low	29.5	Very low	198 Å²	198	134.7 Å²	134.7	93%	0.925	75%	0.749	S	S	*	*				-156.7	178.7	125.5	-119	174.9	-162.1	0	0	114.2
373	K	28.7	Very low	29.7	Very low	182 Å²	182	133.5 Å²	133.5	79%	0.791	74%	0.744	S	S	*	*			trans	-126	159.6	-140.8	-117.8	177.3	-176	172.4	0	112.4
374	L	28.1	Very low	29.8	Very low	153 Å²	153	130.8 Å²	130.8	80%	0.801	73%	0.734	S	S	*	*			trans	68.1	152.8	166.1	-83.3	78.2	0	0	0	116.2
375	S	29	Very low	29.9	Very low	84 Å²	84	134.9 Å²	134.9	59%	0.587	74%	0.739	S	S	*	*			cis	-165.2	159.5	-16.1	48.5	0	0	0	0	112.1
376	N	27.6	Very low	29.8	Very low	141 Å²	141	134.7 Å²	134.7	75%	0.754	74%	0.74	S	S	*	*			trans	50.3	105	147.7	-61.2	-0.8	0	0	0	118.3
377	S	28.9	Very low	29.8	Very low	103 Å²	103	134.4 Å²	134.4	72%	0.72	74%	0.736	S	S	*	*				79.3	160	90.1	87.7	0	0	0	0	113.4
378	T	27.5	Very low	29.7	Very low	107 Å²	107	134.4 Å²	134.4	66%	0.656	74%	0.736	S	S	*	*			cis	-154.3	152	16.3	-16.4	0	0	0	0	110.5
379	E	28.2	Very low	29.6	Very low	170 Å²	170	131.5 Å²	131.5	79%	0.794	73%	0.729	S	S	*	*			trans	62.3	155.3	145.2	-82.7	179.9	-139.8	0	0	121.9
380	S	28.7	Very low	29.8	Very low	73 Å²	73	129.2 Å²	129.2	51%	0.51	72%	0.724	S	S	.	*			cis	-165.3	171.5	-6.5	51.6	0	0	0	0	113.9
381	K	31.6	Very low	29.7	Very low	186 Å²	186	131 Å²	131	81%	0.809	72%	0.719	S	S	*	*			trans	80.4	134.5	148.9	-74.5	153.4	-168.3	136.3	0	121.5
382	G	30.8	Very low	30	Very low	69 Å²	69	130.8 Å²	130.8	71%	0.711	71%	0.707	S	S	*	*			trans	139.3	60.5	163.4	0	0	0	0	0	115.6
383	N	30.6	Very low	30.1	Very low	128 Å²	128	128.1 Å²	128.1	68%	0.684	69%	0.694	S	S	*	*				65.2	131	86.8	-84.2	66.1	0	0	0	116.1
384	T	28.6	Very low	30.4	Very low	86 Å²	86	124.9 Å²	124.9	53%	0.528	69%	0.685	S	S	.	*			cis	-174.7	177.9	-8.9	8.7	0	0	0	0	110.8
385	Y	28.5	Very low	30.6	Very low	194 Å²	194	124.8 Å²	124.8	76%	0.761	68%	0.684	S	S	*	*			trans	78.7	153.3	152.7	-57.3	-39.6	0	0	0	118.6
386	E	29.2	Very low	30.9	Very low	143 Å²	143	124.5 Å²	124.5	67%	0.668	69%	0.694	S	S	*	*			cis	-169.4	156.7	-10.4	-96	-98.9	131.6	0	0	106.4
387	M	30.8	Very low	31.2	Very low	131 Å²	131	126.3 Å²	126.3	65%	0.645	70%	0.698	S	S	*	*			cis	-173.3	174	-17.5	-125	-55.1	-165.4	0	0	110.7
388	N	31.3	Very low	31.3	Very low	130 Å²	130	130 Å²	130	70%	0.695	70%	0.701	S	S	*	*			trans	69.8	151.1	149.2	-72.3	-26.6	0	0	0	121.7
389	S	30.8	Very low	31.6	Very low	106 Å²	106	131 Å²	131	74%	0.741	70%	0.702	S	S	*	*			cis	-173.9	140.5	-17.6	52.2	0	0	0	0	114.6
390	G	33.3	Very low	31.6	Very low	72 Å²	72	130.3 Å²	130.3	74%	0.742	70%	0.702	S	S	*	*			trans	84.4	165.1	140.5	0	0	0	0	0	119.8
391	E	32.6	Very low	31.4	Very low	159 Å²	159	134.7 Å²	134.7	74%	0.743	72%	0.715	S	S	*	*			cis	-162.8	167	-6.7	-68.8	-143.8	120	0	0	107.5
392	K	33.7	Very low	31.2	Very low	131 Å²	131	133.8 Å²	133.8	57%	0.57	72%	0.719	S	S	*	*			cis	-171.3	160	-0.9	-122.3	168.7	175.6	132.2	0	111.5
393	H	33.7	Very low	31	Very low	142 Å²	142	136.8 Å²	136.8	66%	0.657	72%	0.723	S	S	*	*			trans	62.2	150.5	148.2	-63.5	-45.8	0	0	0	121.5
394	D	34.3	Very low	30.7	Very low	114 Å²	114	138.4 Å²	138.4	61%	0.61	73%	0.73	S	S	*	*			cis	-159.1	139.4	-10.2	-114.9	-1.1	0	0	0	116.6
395	I	32.8	Very low	30.5	Very low	152 Å²	152	139.7 Å²	139.7	78%	0.779	74%	0.738	S	S	*	*			trans	49.2	132.5	130.6	-63	171.5	0	0	0	122.9
396	G	35.7	Very low	30.4	Very low	77 Å²	77	136.4 Å²	136.4	79%	0.794	74%	0.738	S	S	*	*			trans	179.5	52.6	166.4	0	0	0	0	0	118.2
397	Q	33	Very low	30.2	Very low	179 Å²	179	136 Å²	136	84%	0.836	74%	0.74	S	S	*	*			trans	-55.6	139.7	-171.9	-60.3	168.7	-42.6	0	0	117.1
398	K	32	Very low	30.1	Very low	180 Å²	180	135 Å²	135	78%	0.783	75%	0.747	S	S	*	*				-176.7	158.8	104.8	-106.3	-173.1	176.4	-169.1	0	117.7
399	D	33.2	Very low	29.8	Very low	129 Å²	129	133.8 Å²	133.8	69%	0.69	75%	0.748	S	S	*	*			trans	73	102.7	155.3	-56.3	-14.5	0	0	0	122.1
400	I	28.7	Very low	29.5	Very low	155 Å²	155	134.3 Å²	134.3	80%	0.795	75%	0.752	S	S	*	*			trans	84	96.8	145.7	-52.9	174.5	0	0	0	119.5
401	E	25.2	Very low	29.2	Very low	166 Å²	166	136 Å²	136	78%	0.776	76%	0.759	S	S	*	*			trans	63.9	85.8	143.2	-59.8	-171.8	161.1	0	0	121.4
402	N	26.3	Very low	28.8	Very low	167 Å²	167	133.7 Å²	133.7	89%	0.893	76%	0.76	S	S	*	*			trans	65.4	44.3	134.6	-61.6	-6.8	0	0	0	119.6
403	V	26	Very low	28.3	Very low	131 Å²	131	135.5 Å²	135.5	79%	0.794	78%	0.776	S	S	*	*			trans	-124.9	94.2	160.5	-176.6	0	0	0	0	110.9
404	I	24.2	Very low	28	Very low	163 Å²	163	135.2 Å²	135.2	84%	0.836	78%	0.779	S	S	*	*			trans	-138.3	99.5	158.8	-58.9	-176.5	0	0	0	109.2
405	T	26.2	Very low	27.7	Very low	112 Å²	112	138.8 Å²	138.8	69%	0.687	79%	0.789	S	S	*	*			trans	-78.5	140.6	150.7	45.3	0	0	0	0	109.3
406	T	26.3	Very low	27.3	Very low	125 Å²	125	139.4 Å²	139.4	77%	0.767	79%	0.786	S	S	*	*			trans	175.9	150.4	137.1	29.6	0	0	0	0	108.3
407	D	25.1	Very low	27	Very low	134 Å²	134	139.6 Å²	139.6	72%	0.717	78%	0.775	S	S	*	*			cis	169.9	125.3	-36.8	-101.4	-43	0	0	0	104.8
408	S	27	Very low	27	Very low	112 Å²	112	135.4 Å²	135.4	78%	0.783	76%	0.758	S	S	*	*			trans	-146.5	81.1	152.5	50.1	0	0	0	0	106.3
409	S	26.2	Very low	27.8	Very low	103 Å²	103	129.5 Å²	129.5	72%	0.72	73%	0.734	S	S	*	*				53.7	110.5	96.1	72.6	0	0	0	0	112.3
410	S	24.4	Very low	28.2	Very low	118 Å²	118	128.8 Å²	128.8	83%	0.825	73%	0.731	S	S	*	*			cis	-164.1	107.4	5.9	48.4	0	0	0	0	111.1
411	A	26.6	Very low	29.5	Very low	108 Å²	108	127.7 Å²	127.7	89%	0.893	73%	0.726	S	S	*	*			trans	-158.2	49.1	-179.8	0	0	0	0	0	113.2
412	S	24	Very low	31.2	Very low	109 Å²	109	126.6 Å²	126.6	76%	0.762	73%	0.726	S	S	*	*			trans	-141.8	67.9	-173	60.6	0	0	0	0	113.1
413	N	23.5	Very low	33.3	Very low	170 Å²	170	120.5 Å²	120.5	91%	0.909	70%	0.696	S	S	*	*			trans	-157.1	60.2	171.9	-105.5	-30.2	0	0	0	113.3
414	L	26.4	Very low	35.8	Very low	135 Å²	135	115.3 Å²	115.3	71%	0.707	66%	0.662	S	S	*	*	S	Bend	trans	-138.2	121.3	158.7	-110.6	161.7	0	0	0	107.6
415	K	28.2	Very low	38.4	Very low	189 Å²	189	109.8 Å²	109.8	82%	0.822	63%	0.631	S	S	*	*			trans	-68	144	-171.4	-74.8	-177.4	176.2	-179.9	0	110.9	C417	K415-C417 VanDerWaalsContact C-N 3.25Å; K415-C417 PolarHBondContact O-N 2.65Å
416	K	25.3	Very low	41.3	Very low	165 Å²	165	104.6 Å²	104.6	72%	0.717	60%	0.599	S	S	*	*			trans	-68.2	82.6	168.7	-172.2	-177.2	-174.8	-66.1	0	109	D418	K416-D418 VanDerWaalsContact C-N 3.32Å; K416-D418 IonicContact NZ-OD1 2.7Å; K416-D418 PolarHBondContact NZ-OD1 3.19Å; K416-D418 IonicContact NZ-OD2 2.64Å; K416-D418 PolarHBondContact NZ-OD2 3.35Å; K416-D418 PolarHBondContact O-N 2.84Å
417	C	29.4	Very low	44	Very low	82 Å²	82	98.8 Å²	98.8	55%	0.554	56%	0.564	S	S	*	*			trans	-76.3	87.5	171.6	-68.9	0	0	0	0	108.8	K415 L419	K415-C417 VanDerWaalsContact C-N 3.25Å; K415-C417 PolarHBondContact O-N 2.65Å; C417-L419 PolarHBondContact O-N 2.85Å
418	D	32.8	Very low	46.8	Very low	90 Å²	90	92.4 Å²	92.4	48%	0.481	53%	0.53	S	S	.	.			trans	-67.2	100.1	172	-69.3	-44.9	0	0	0	109.5	K416 D420	K416-D418 VanDerWaalsContact C-N 3.32Å; K416-D418 IonicContact NZ-OD1 2.7Å; K416-D418 PolarHBondContact NZ-OD1 3.19Å; K416-D418 IonicContact NZ-OD2 2.64Å; K416-D418 PolarHBondContact NZ-OD2 3.35Å; K416-D418 PolarHBondContact O-N 2.84Å; D418-D420 PolarHBondContact O-N 3.03Å; D418-D420 VanDerWaalsContact O-N 3.09Å
419	L	49	Very low	49.4	Very low	56 Å²	56	89 Å²	89	29%	0.293	50%	0.502	S	S	.	.			trans	-79.4	76.4	166.4	-78.2	161.7	0	0	0	108.1	C417 P459	C417-L419 PolarHBondContact O-N 2.85Å; L419-P459 HydrophobicContact CD2-CB 4.18Å; L419-P459 HydrophobicContact CD2-CG 3.73Å
420	D	41.3	Very low	51.9	Low	114 Å²	114	84.2 Å²	84.2	61%	0.61	47%	0.469	S	S	*	.			trans	-70.7	157	172.9	-70.7	-38.4	0	0	0	111.4	D418	D418-D420 PolarHBondContact O-N 3.03Å; D418-D420 VanDerWaalsContact O-N 3.09Å
421	D	56.3	Low	54.2	Low	132 Å²	132	83.3 Å²	83.3	71%	0.706	45%	0.448	S	S	*	.	S	Bend	trans	48	92.7	178.6	-68.8	-5.8	0	0	0	118.9	N460	D421-N460 WeakPolarHBondContact O-CB 3.48Å
422	N	60.2	Low	56.1	Low	143 Å²	143	80.2 Å²	80.2	77%	0.765	42%	0.418	S	S	*	.			trans	43.8	83	159.9	-88	-14	0	0	0	115.8
423	P	70.3	Confident	57.5	Low	40 Å²	40	81.7 Å²	81.7	26%	0.26	42%	0.417	S	S	.	.			trans	-68.1	151	178.4	30.2	-36.6	0	0	0	112.8	L457	P423-L457 HydrophobicContact CB-CD1 3.73Å; P423-L457 HydrophobicContact CB-CD2 4.27Å; P423-L457 HydrophobicContact CB-CG 3.79Å; P423-L457 HydrophobicContact CG-CD1 3.82Å; P423-L457 HydrophobicContact CG-CD2 4.25Å; P423-L457 HydrophobicContact CG-CG 4.16Å
424	F	79.4	Confident	58.6	Low	21 Å²	21	78 Å²	78	9%	0.092	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	146.8	176.6	-76.9	-61.7	0	0	0	112.3	V319 R321 L457 I458 N460 S463 N682	V319-F424 HydrophobicContact CG1-CB 3.69Å; V319-F424 HydrophobicContact CG1-CD1 3.53Å; V319-F424 HydrophobicContact CG1-CE1 4.29Å; V319-F424 HydrophobicContact CG1-CG 3.69Å; R321-F424 HydrophobicContact CG-CD1 4.07Å; R321-F424 HydrophobicContact CG-CE1 3.65Å; F424-L457 CarbonylContact O-C 3.49Å; F424-L457 WeakPolarHBondContact O-CA 3.26Å; F424-I458 PolarHBondContact N-O 3.09Å; F424-I458 PolarHBondContact O-N 3.18Å; F424-N460 HydrophobicContact CE2-CB 4.41Å; F424-N460 WeakPolarHBondContact CE2-OD1 2.95Å; F424-S463 WeakPolarHBondContact CD2-OG 3.39Å; F424-S463 WeakPolarHBondContact CE2-OG 3.35Å; F424-N682 WeakPolarHBondContact CE1-ND2 3.49Å
425	Y	79.4	Confident	59.1	Low	48 Å²	48	78.3 Å²	78.3	19%	0.188	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	101	172.9	-66.2	-94.9	0	0	0	109.9	V319 Y320 P323 F456 L457	V319-Y425 WeakPolarHBondContact CA-O 3.49Å; Y320-Y425 PolarHBondContact N-O 3.42Å; Y320-Y425 PolarHBondContact O-N 3.25Å; P323-Y425 HydrophobicContact CB-CD1 4.36Å; P323-Y425 HydrophobicContact CB-CE1 3.82Å; P323-Y425 HydrophobicContact CB-CE2 4.07Å; P323-Y425 HydrophobicContact CG-CE2 4.16Å; Y425-F456 CarbonylContact C-O 3.58Å; Y425-F456 WeakPolarHBondContact CA-O 3.17Å; Y425-L457 HydrophobicContact CD1-CD1 3.97Å; Y425-L457 HydrophobicContact CD2-CD1 4.25Å; Y425-L457 HydrophobicContact CE1-CD1 3.57Å; Y425-L457 HydrophobicContact CE2-CD1 3.86Å; Y425-L457 HydrophobicContact CG-CD1 4.29Å
426	L	85.3	Confident	59.4	Low	2 Å²	2	76.9 Å²	76.9	1%	0.01	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	125.6	170.1	-178.6	76	0	0	0	109.7	F290 I317 A318 V319 I428 W455 F456 I458 L466	F290-L426 HydrophobicContact CE2-CD2 4.5Å; F290-L426 HydrophobicContact CZ-CD2 4.48Å; I317-L426 HydrophobicContact CG2-CD1 3.36Å; I317-L426 HydrophobicContact CG2-CG 4.29Å; A318-L426 CarbonylContact O-C 3.44Å; A318-L426 WeakPolarHBondContact O-CA 3.48Å; V319-L426 HydrophobicContact CG2-CB 4.14Å; V319-L426 HydrophobicContact CG2-CD1 3.52Å; V319-L426 HydrophobicContact CG2-CG 4.47Å; L426-I428 HydrophobicContact CD2-CD1 3.84Å; L426-I428 HydrophobicContact CD2-CG1 4.06Å; L426-I428 HydrophobicContact CG-CG1 4.21Å; L426-W455 CarbonylContact O-C 3.48Å; L426-W455 VanDerWaalsContact O-CA 3.29Å; L426-W455 WeakPolarHBondContact O-CA 3.46Å; L426-F456 HydrophobicContact CB-CB 4.32Å; L426-F456 HydrophobicContact CD2-CD2 4.26Å; L426-F456 PolarHBondContact N-O 3.47Å; L426-F456 PolarHBondContact O-N 3.49Å; L426-I458 HydrophobicContact CB-CD1 3.68Å; L426-I458 HydrophobicContact CB-CG1 4.29Å; L426-I458 HydrophobicContact CD2-CD1 3.49Å; L426-I458 VanDerWaalsContact CD2-CD1 3.49Å; L426-I458 HydrophobicContact CG-CD1 4.15Å; L426-L466 HydrophobicContact CD2-CD2 4Å
427	C	84.3	Confident	59.7	Low	3 Å²	3	75.1 Å²	75.1	2%	0.02	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130.4	165.3	-174.5	0	0	0	0	109.4	I317 A318 Y320 E453 Y454 W455	I317-C427 CarbonylContact C-O 3.54Å; I317-C427 WeakPolarHBondContact CA-O 3.25Å; A318-C427 PolarHBondContact N-O 3.47Å; A318-C427 PolarHBondContact O-N 3.13Å; Y320-C427 HydrophobicContact CD2-CB 4.48Å; Y320-C427 HydrophobicContact CE2-CB 3.91Å; C427-E453 VanDerWaalsContact SG-CG 3.57Å; C427-Y454 CarbonylContact C-O 3.46Å; C427-Y454 WeakPolarHBondContact CA-O 3.33Å; C427-W455 HydrophobicContact CB-CD2 4.04Å; C427-W455 HydrophobicContact CB-CE3 4.2Å; C427-W455 HydrophobicContact CB-CH2 4.08Å; C427-W455 HydrophobicContact CB-CZ2 3.9Å; C427-W455 HydrophobicContact CB-CZ3 4.23Å
428	I	84.1	Confident	59.9	Low	1 Å²	1	78 Å²	78	1%	0.005	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	123.3	171.9	-65.5	165.3	0	0	0	107.7	F290 F314 I317 L426 Y454 F456	F290-I428 HydrophobicContact CD1-CD1 4.29Å; F290-I428 HydrophobicContact CD2-CD1 4.18Å; F290-I428 HydrophobicContact CE1-CD1 3.87Å; F290-I428 HydrophobicContact CE2-CD1 3.75Å; F290-I428 HydrophobicContact CG-CD1 4.43Å; F290-I428 HydrophobicContact CZ-CD1 3.57Å; F314-I428 HydrophobicContact CD1-CG2 4.48Å; F314-I428 HydrophobicContact CD2-CG2 3.8Å; F314-I428 HydrophobicContact CE1-CG2 4.28Å; F314-I428 HydrophobicContact CE2-CB 4.38Å; F314-I428 HydrophobicContact CE2-CD1 3.7Å; F314-I428 HydrophobicContact CE2-CG1 3.88Å; F314-I428 HydrophobicContact CE2-CG2 3.56Å; F314-I428 HydrophobicContact CG-CG2 4.28Å; F314-I428 HydrophobicContact CZ-CD1 3.79Å; F314-I428 HydrophobicContact CZ-CG1 4.39Å; F314-I428 HydrophobicContact CZ-CG2 3.81Å; I317-I428 HydrophobicContact CG2-CG1 4.15Å; L426-I428 HydrophobicContact CD2-CD1 3.84Å; L426-I428 HydrophobicContact CD2-CG1 4.06Å; L426-I428 HydrophobicContact CG-CG1 4.21Å; I428-Y454 PolarHBondContact N-O 2.77Å; I428-Y454 PolarHBondContact O-N 3.35Å; I428-F456 HydrophobicContact CD1-CD2 4.29Å; I428-F456 HydrophobicContact CD1-CE2 3.97Å
429	L	80.7	Confident	59.7	Low	40 Å²	40	81.7 Å²	81.7	21%	0.209	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	129.3	163.8	-78.1	79.3	0	0	0	108.9	R315 T316 E452 E453	R315-L429 HydrophobicContact CB-CB 4.29Å; R315-L429 WeakPolarHBondContact CB-O 3.31Å; R315-L429 PolarHBondContact N-O 3.25Å; T316-L429 PolarHBondContact N-O 3.07Å; T316-L429 PolarHBondContact O-N 2.99Å; L429-E452 WeakPolarHBondContact CA-O 3.5Å; L429-E453 HydrophobicContact CD1-CG 4.41Å
430	A	79.8	Confident	59.1	Low	2 Å²	2	87.3 Å²	87.3	2%	0.017	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	148.3	177.5	0	0	0	0	0	112.3	I309 Q313 T432 S451 E452 Y454	I309-A430 HydrophobicContact CG2-CB 3.71Å; Q313-A430 HydrophobicContact CB-CB 4.33Å; Q313-A430 CarbonylContact O-C 3.59Å; Q313-A430 WeakPolarHBondContact O-CA 3.37Å; A430-T432 PolarHBondContact O-N 3.42Å; A430-S451 CarbonylContact O-C 3.6Å; A430-S451 WeakPolarHBondContact O-CA 3.36Å; A430-S451 WeakPolarHBondContact O-CB 3.38Å; A430-E452 PolarHBondContact N-O 3.41Å; A430-E452 PolarHBondContact O-N 3.33Å; A430-Y454 HydrophobicContact CB-CE2 4.13Å
431	Y	72.9	Confident	58.7	Low	99 Å²	99	93.6 Å²	93.6	39%	0.388	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	130.7	176.5	-69.6	-77.4	0	0	0	111.7	Q313 R315	Q313-Y431 VanDerWaalsContact O-CD2 3.32Å; Q313-Y431 WeakPolarHBondContact O-CD2 3.26Å; Q313-Y431 PolarHBondContact O-N 3.44Å; R315-Y431 HydrophobicContact CB-CD2 4.36Å; R315-Y431 HydrophobicContact CB-CE2 3.95Å; R315-Y431 HydrophobicContact CG-CE2 3.96Å
432	T	65.7	Low	57.3	Low	43 Å²	43	99.5 Å²	99.5	26%	0.264	49%	0.488	S	S	.	.			trans	-76.9	142.8	173.5	79.5	0	0	0	0	110.2	A430 S434 Q450 E452	A430-T432 PolarHBondContact O-N 3.42Å; T432-S434 PolarHBondContact O-N 3.49Å; T432-Q450 PolarHBondContact N-O 3.34Å; T432-E452 HydrophobicContact CG2-CB 4.13Å; T432-E452 HydrophobicContact CG2-CG 3.72Å; T432-E452 WeakPolarHBondContact CG2-OE1 3.39Å
433	N	53.9	Low	56	Low	140 Å²	140	99.2 Å²	99.2	75%	0.749	48%	0.482	S	S	*	.			trans	-78	6.7	173.1	-75.8	-21	0	0	0	113.1	Q313 V435	Q313-N433 PolarHBondContact NE2-ND2 3.41Å; Q313-N433 VanDerWaalsContact NE2-ND2 3.12Å; Q313-N433 PolarHBondContact NE2-OD1 3.41Å; N433-V435 VanDerWaalsContact C-N 3.28Å; N433-V435 PolarHBondContact O-N 3.2Å
434	S	46.6	Very low	54.3	Low	93 Å²	93	102.6 Å²	102.6	65%	0.65	50%	0.504	S	S	*	.			trans	-82	59.6	-168.8	-172	0	0	0	0	113.5	T432 E436	T432-S434 PolarHBondContact O-N 3.49Å; S434-E436 PolarHBondContact O-N 3.05Å; S434-E436 VanDerWaalsContact O-N 3.08Å
435	V	36.9	Very low	52.3	Low	141 Å²	141	108.5 Å²	108.5	86%	0.855	53%	0.527	S	S	*	.			trans	-85.3	58.2	174.7	-168.1	0	0	0	0	110.8	N433	N433-V435 VanDerWaalsContact C-N 3.28Å; N433-V435 PolarHBondContact O-N 3.2Å
436	E	33.2	Very low	50.1	Low	159 Å²	159	111.7 Å²	111.7	74%	0.743	54%	0.539	S	S	*	.			trans	-152.3	137.6	171.7	-116.8	172.7	-130.9	0	0	111.7	S434	S434-E436 PolarHBondContact O-N 3.05Å; S434-E436 VanDerWaalsContact O-N 3.08Å
437	N	31.5	Very low	47.8	Very low	129 Å²	129	115.6 Å²	115.6	69%	0.69	56%	0.556	S	S	*	*			trans	54.1	89.8	165.4	-56.4	-52	0	0	0	118.7
438	N	33.8	Very low	45.9	Very low	143 Å²	143	119.7 Å²	119.7	77%	0.765	58%	0.581	S	S	*	*				178.6	144.5	97.5	-94.9	-61.6	0	0	0	114.9	H440	N438-H440 PolarHBondContact O-N 2.97Å
439	N	29.7	Very low	44	Very low	167 Å²	167	125.1 Å²	125.1	89%	0.893	61%	0.614	S	S	*	*			trans	-82.9	85.6	177.4	-73.7	-58.7	0	0	0	111.8
440	H	36.1	Very low	42.6	Very low	173 Å²	173	129.2 Å²	129.2	80%	0.801	63%	0.632	S	S	*	*			trans	-116.7	152.9	171.7	-80.4	10.8	0	0	0	112.7	N438	N438-H440 PolarHBondContact O-N 2.97Å
441	R	32.4	Very low	41.8	Very low	247 Å²	247	129.8 Å²	129.8	93%	0.932	64%	0.636	S	S	*	*			trans	-63.5	139	-165.8	-73.9	178.4	168.6	-175.1	-4.8	112	H443	R441-H443 PolarHBondContact O-N 3.17Å
442	R	27.9	Very low	41.8	Very low	255 Å²	255	129.4 Å²	129.4	96%	0.962	64%	0.637	S	S	*	*			trans	-54.5	119.8	172.8	-65.3	-178.1	176.2	-159.9	-3	110.4
443	H	32.1	Very low	42.4	Very low	138 Å²	138	129.6 Å²	129.6	64%	0.639	64%	0.636	S	S	*	*			trans	-110	147.2	172.3	-149.1	-87.6	0	0	0	109.7	R441 Y445	R441-H443 PolarHBondContact O-N 3.17Å; H443-Y445 AromaticContact CE1-CD2 3.87Å; H443-Y445 AromaticContact CE1-CE2 3.61Å; H443-Y445 AromaticContact ND1-CD2 3.36Å; H443-Y445 WeakPolarHBondContact ND1-CD2 3.13Å; H443-Y445 AromaticContact ND1-CE2 3.58Å; H443-Y445 PolarHBondContact O-N 3.35Å
444	P	35.3	Very low	43.9	Very low	110 Å²	110	124.4 Å²	124.4	71%	0.714	61%	0.606	S	S	*	*	S	Bend	trans	-69.8	7	-171.1	-24.4	36.8	0	0	0	117.9
445	Y	37	Very low	45.9	Very low	146 Å²	146	120 Å²	120	57%	0.573	58%	0.575	S	S	*	*			trans	-105.2	93.1	-175.9	-57	-52.7	0	0	0	110.7	H443	H443-Y445 AromaticContact CE1-CD2 3.87Å; H443-Y445 AromaticContact CE1-CE2 3.61Å; H443-Y445 AromaticContact ND1-CD2 3.36Å; H443-Y445 WeakPolarHBondContact ND1-CD2 3.13Å; H443-Y445 AromaticContact ND1-CE2 3.58Å; H443-Y445 PolarHBondContact O-N 3.35Å
446	W	32.4	Very low	48.3	Very low	114 Å²	114	113.2 Å²	113.2	43%	0.432	53%	0.534	S	S	.	.			trans	-93.2	-14	-162.4	75.9	-80.7	0	0	0	116.7
447	F	36.8	Very low	50.9	Low	84 Å²	84	106.6 Å²	106.6	37%	0.368	50%	0.503	S	S	.	.	S	Bend	trans	-77.8	-37	-174.7	-82.3	-76	0	0	0	114.8
448	T	44.5	Very low	53.5	Low	89 Å²	89	100.6 Å²	100.6	55%	0.546	47%	0.471	S	S	.	.	S	Bend	trans	-97.9	14.4	-167.4	59.6	0	0	0	0	114.8
449	V	45.2	Very low	55.9	Low	115 Å²	115	94.9 Å²	94.9	70%	0.697	44%	0.442	S	S	*	.	S	Bend	trans	-108.7	-12.1	-172.3	-174.2	0	0	0	0	112.8
450	Q	50.6	Low	58.1	Low	126 Å²	126	90.3 Å²	90.3	59%	0.589	42%	0.418	S	S	*	.	S	Bend	trans	-127.1	4.9	-177.4	-65.6	-176.2	-39.3	0	0	113.5	T432	T432-Q450 PolarHBondContact N-O 3.34Å
451	S	63.6	Low	60.1	Low	15 Å²	15	89.8 Å²	89.8	11%	0.105	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	135.7	-174.6	-52.3	0	0	0	0	110.8	R315 A430	R315-S451 VanDerWaalsContact CD-OG 3.28Å; R315-S451 WeakPolarHBondContact CD-OG 3.14Å; R315-S451 PolarHBondContact NH1-OG 3.35Å; R315-S451 VanDerWaalsContact NH1-OG 3.15Å; A430-S451 CarbonylContact O-C 3.6Å; A430-S451 WeakPolarHBondContact O-CA 3.36Å; A430-S451 WeakPolarHBondContact O-CB 3.38Å
452	E	73.3	Confident	62.3	Low	90 Å²	90	80.4 Å²	80.4	42%	0.421	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	150.2	168	-91	168.8	-103.1	0	0	110.2	L429 A430 T432 Y454	L429-E452 WeakPolarHBondContact CA-O 3.5Å; A430-E452 PolarHBondContact N-O 3.41Å; A430-E452 PolarHBondContact O-N 3.33Å; T432-E452 HydrophobicContact CG2-CB 4.13Å; T432-E452 HydrophobicContact CG2-CG 3.72Å; T432-E452 WeakPolarHBondContact CG2-OE1 3.39Å; E452-Y454 HydrophobicContact CB-CE1 4.37Å; E452-Y454 HydrophobicContact CB-CE2 3.94Å; E452-Y454 PolarHBondContact OE2-OH 3.17Å
453	E	78.6	Confident	64.6	Low	48 Å²	48	69 Å²	69	22%	0.224	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	112.7	-171.8	-170.6	-169.7	171.7	0	0	110.2	T329 C427 L429 W455	T329-E453 WeakPolarHBondContact CB-OE1 3.22Å; T329-E453 PolarHBondContact OG1-OE1 2.93Å; C427-E453 VanDerWaalsContact SG-CG 3.57Å; L429-E453 HydrophobicContact CD1-CG 4.41Å; E453-W455 WeakPolarHBondContact OE1-CZ2 3.49Å; E453-W455 PolarHBondContact OE1-NE1 3.44Å
454	Y	85.2	Confident	66.5	Low	30 Å²	30	69.1 Å²	69.1	12%	0.118	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.6	-174.7	-53.4	-73.4	0	0	0	111.4	F271 K307 I309 C427 I428 A430 E452	F271-Y454 HydrophobicContact CE2-CD1 4.19Å; F271-Y454 HydrophobicContact CZ-CD1 4.3Å; K307-Y454 HydrophobicContact CD-CD1 4.07Å; K307-Y454 HydrophobicContact CD-CE1 3.69Å; K307-Y454 HydrophobicContact CG-CD1 4.31Å; K307-Y454 HydrophobicContact CG-CE1 4.37Å; I309-Y454 HydrophobicContact CD1-CD2 3.4Å; I309-Y454 VanDerWaalsContact CD1-CD2 3.4Å; I309-Y454 HydrophobicContact CD1-CE2 3.43Å; I309-Y454 VanDerWaalsContact CD1-CE2 3.43Å; I309-Y454 HydrophobicContact CD1-CG 4.06Å; I309-Y454 HydrophobicContact CG1-CD2 4.49Å; I309-Y454 HydrophobicContact CG1-CE2 4.05Å; C427-Y454 CarbonylContact C-O 3.46Å; C427-Y454 WeakPolarHBondContact CA-O 3.33Å; I428-Y454 PolarHBondContact N-O 2.77Å; I428-Y454 PolarHBondContact O-N 3.35Å; A430-Y454 HydrophobicContact CB-CE2 4.13Å; E452-Y454 HydrophobicContact CB-CE1 4.37Å; E452-Y454 HydrophobicContact CB-CE2 3.94Å; E452-Y454 PolarHBondContact OE2-OH 3.17Å
455	W	87.4	Confident	68.6	Low	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	133.7	-177.7	-73.7	76	0	0	0	111.7	F271 V272 Y320 V325 M326 L426 C427 E453	F271-W455 WeakPolarHBondContact CD2-O 3.38Å; V272-W455 HydrophobicContact CB-CB 3.93Å; V272-W455 PolarHBondContact N-O 3Å; Y320-W455 AromaticContact CD2-CH2 3.48Å; Y320-W455 HydrophobicContact CD2-CH2 3.48Å; Y320-W455 VanDerWaalsContact CD2-CH2 3.48Å; Y320-W455 AromaticContact CD2-CZ3 3.57Å; Y320-W455 HydrophobicContact CD2-CZ3 3.57Å; Y320-W455 AromaticContact CE2-CH2 3.57Å; Y320-W455 HydrophobicContact CE2-CH2 3.57Å; Y320-W455 HydrophobicContact CE2-CZ2 4.35Å; Y320-W455 HydrophobicContact CE2-CZ3 4.08Å; Y320-W455 HydrophobicContact CG-CH2 4.44Å; Y320-W455 HydrophobicContact CG-CZ3 4.49Å; V325-W455 HydrophobicContact CB-CH2 4.23Å; V325-W455 HydrophobicContact CG1-CH2 4.21Å; M326-W455 HydrophobicContact CB-CD2 4.14Å; M326-W455 HydrophobicContact CB-CE3 4.26Å; M326-W455 HydrophobicContact CB-CH2 3.88Å; M326-W455 HydrophobicContact CB-CZ2 3.73Å; M326-W455 HydrophobicContact CB-CZ3 4.14Å; M326-W455 HydrophobicContact CG-CD2 4.01Å; M326-W455 HydrophobicContact CG-CG 4.35Å; M326-W455 HydrophobicContact CG-CZ2 4.06Å; M326-W455 HydrophobicContact SD-CB 4.09Å; M326-W455 HydrophobicContact SD-CD2 3.73Å; M326-W455 HydrophobicContact SD-CE3 4.35Å; M326-W455 HydrophobicContact SD-CG 3.58Å; M326-W455 VanDerWaalsContact SD-CG 3.58Å; L426-W455 CarbonylContact O-C 3.48Å; L426-W455 VanDerWaalsContact O-CA 3.29Å; L426-W455 WeakPolarHBondContact O-CA 3.46Å; C427-W455 HydrophobicContact CB-CD2 4.04Å; C427-W455 HydrophobicContact CB-CE3 4.2Å; C427-W455 HydrophobicContact CB-CH2 4.08Å; C427-W455 HydrophobicContact CB-CZ2 3.9Å; C427-W455 HydrophobicContact CB-CZ3 4.23Å; E453-W455 WeakPolarHBondContact OE1-CZ2 3.49Å; E453-W455 PolarHBondContact OE1-NE1 3.44Å
456	F	88.5	Confident	70.7	Confident	0 Å²	0	60 Å²	60	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	135.5	179.2	-55.5	-92.3	0	0	0	111.3	K270 F271 I283 F290 F292 Y425 L426 I428 I458	K270-F456 CarbonylContact O-C 3.56Å; K270-F456 WeakPolarHBondContact O-CA 3.42Å; F271-F456 HydrophobicContact CB-CD1 3.96Å; F271-F456 HydrophobicContact CB-CE1 3.95Å; F271-F456 AromaticContact CD2-CD1 3.8Å; F271-F456 HydrophobicContact CD2-CD1 3.8Å; F271-F456 AromaticContact CD2-CE1 3.37Å; F271-F456 HydrophobicContact CD2-CE1 3.37Å; F271-F456 HydrophobicContact CD2-CE2 4.35Å; F271-F456 HydrophobicContact CD2-CG 4.43Å; F271-F456 AromaticContact CD2-CZ 3.69Å; F271-F456 HydrophobicContact CD2-CZ 3.69Å; F271-F456 HydrophobicContact CE2-CE1 4.22Å; F271-F456 HydrophobicContact CE2-CZ 4.09Å; F271-F456 HydrophobicContact CG-CD1 4.34Å; F271-F456 AromaticContact CG-CE1 3.98Å; F271-F456 HydrophobicContact CG-CE1 3.98Å; I283-F456 HydrophobicContact CD1-CB 4.27Å; I283-F456 HydrophobicContact CD1-CD1 4.05Å; I283-F456 HydrophobicContact CD1-CG 4.17Å; F290-F456 HydrophobicContact CE1-CE1 4.29Å; F290-F456 AromaticContact CE1-CE2 3.93Å; F290-F456 HydrophobicContact CE1-CE2 3.93Å; F290-F456 AromaticContact CE1-CZ 3.75Å; F290-F456 HydrophobicContact CE1-CZ 3.75Å; F290-F456 HydrophobicContact CZ-CD2 4.35Å; F290-F456 HydrophobicContact CZ-CE2 4.11Å; F290-F456 HydrophobicContact CZ-CZ 4.26Å; F292-F456 HydrophobicContact CB-CE1 3.64Å; F292-F456 HydrophobicContact CB-CZ 4.31Å; F292-F456 HydrophobicContact CD1-CE1 4.21Å; F292-F456 HydrophobicContact CD2-CD1 4.29Å; F292-F456 HydrophobicContact CD2-CE1 4.11Å; F292-F456 HydrophobicContact CG-CD1 4.34Å; F292-F456 AromaticContact CG-CE1 3.71Å; F292-F456 HydrophobicContact CG-CE1 3.71Å; Y425-F456 CarbonylContact C-O 3.58Å; Y425-F456 WeakPolarHBondContact CA-O 3.17Å; L426-F456 HydrophobicContact CB-CB 4.32Å; L426-F456 HydrophobicContact CD2-CD2 4.26Å; L426-F456 PolarHBondContact N-O 3.47Å; L426-F456 PolarHBondContact O-N 3.49Å; I428-F456 HydrophobicContact CD1-CD2 4.29Å; I428-F456 HydrophobicContact CD1-CE2 3.97Å; F456-I458 HydrophobicContact CB-CD1 4.26Å; F456-I458 HydrophobicContact CB-CG1 4.14Å
457	L	87	Confident	72.7	Confident	19 Å²	19	56.6 Å²	56.6	10%	0.099	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	119.2	171.2	-166.5	76.3	0	0	0	109.2	C269 K270 V272 P423 F424 Y425	C269-L457 CarbonylContact C-O 3.51Å; C269-L457 WeakPolarHBondContact CA-O 3.01Å; C269-L457 VanDerWaalsContact CB-O 3.26Å; C269-L457 WeakPolarHBondContact CB-O 3.2Å; K270-L457 HydrophobicContact CB-CB 4.08Å; K270-L457 HydrophobicContact CD-CD2 4.04Å; K270-L457 HydrophobicContact CG-CD2 4.38Å; K270-L457 PolarHBondContact N-O 2.9Å; K270-L457 PolarHBondContact O-N 3.2Å; V272-L457 HydrophobicContact CG2-CB 4.38Å; P423-L457 HydrophobicContact CB-CD1 3.73Å; P423-L457 HydrophobicContact CB-CD2 4.27Å; P423-L457 HydrophobicContact CB-CG 3.79Å; P423-L457 HydrophobicContact CG-CD1 3.82Å; P423-L457 HydrophobicContact CG-CD2 4.25Å; P423-L457 HydrophobicContact CG-CG 4.16Å; F424-L457 CarbonylContact O-C 3.49Å; F424-L457 WeakPolarHBondContact O-CA 3.26Å; Y425-L457 HydrophobicContact CD1-CD1 3.97Å; Y425-L457 HydrophobicContact CD2-CD1 4.25Å; Y425-L457 HydrophobicContact CE1-CD1 3.57Å; Y425-L457 HydrophobicContact CE2-CD1 3.86Å; Y425-L457 HydrophobicContact CG-CD1 4.29Å
458	I	86.4	Confident	74.3	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.021	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	140.8	-168.4	-62.7	-168.9	0	0	0	110.9	F267 C269 I283 F424 L426 F456 L466	F267-I458 HydrophobicContact CD2-CG2 4.42Å; F267-I458 HydrophobicContact CE2-CD1 3.96Å; F267-I458 HydrophobicContact CE2-CG1 4.19Å; F267-I458 HydrophobicContact CE2-CG2 3.82Å; F267-I458 HydrophobicContact CZ-CD1 4.18Å; F267-I458 HydrophobicContact CZ-CG2 4.46Å; C269-I458 HydrophobicContact CB-CG1 4.37Å; I283-I458 HydrophobicContact CD1-CD1 3.95Å; I283-I458 HydrophobicContact CD1-CG1 4.45Å; F424-I458 PolarHBondContact N-O 3.09Å; F424-I458 PolarHBondContact O-N 3.18Å; L426-I458 HydrophobicContact CB-CD1 3.68Å; L426-I458 HydrophobicContact CB-CG1 4.29Å; L426-I458 HydrophobicContact CD2-CD1 3.49Å; L426-I458 VanDerWaalsContact CD2-CD1 3.49Å; L426-I458 HydrophobicContact CG-CD1 4.15Å; F456-I458 HydrophobicContact CB-CD1 4.26Å; F456-I458 HydrophobicContact CB-CG1 4.14Å; I458-L466 HydrophobicContact CD1-CD2 3.63Å
459	P	83.3	Confident	75.9	Confident	22 Å²	22	51.7 Å²	51.7	14%	0.143	26%	0.256	C	S	.	.			trans	-56.4	139.3	173.5	-19.4	27.1	0	0	0	112.2	D268 L419 E461 K462 S463	D268-P459 VanDerWaalsContact O-CD 3.25Å; D268-P459 WeakPolarHBondContact O-CD 3.14Å; D268-P459 WeakPolarHBondContact O-CG 3.45Å; L419-P459 HydrophobicContact CD2-CB 4.18Å; L419-P459 HydrophobicContact CD2-CG 3.73Å; P459-E461 VanDerWaalsContact C-N 3.32Å; P459-E461 PolarHBondContact O-N 3.3Å; P459-K462 HydrophobicContact CB-CB 4.49Å; P459-K462 PolarHBondContact O-N 3.43Å; P459-S463 PolarHBondContact O-N 3.22Å; P459-S463 VanDerWaalsContact O-N 3.14Å
460	N	77	Confident	77.3	Confident	72 Å²	72	46.3 Å²	46.3	39%	0.385	22%	0.223	S	C	.	.	H	α-helix	trans	-52	-50	176.7	-177	3.9	0	0	0	111.6	D421 F424 K462 S463	D421-N460 WeakPolarHBondContact O-CB 3.48Å; F424-N460 HydrophobicContact CE2-CB 4.41Å; F424-N460 WeakPolarHBondContact CE2-OD1 2.95Å; N460-K462 PolarHBondContact O-N 3.21Å; N460-S463 WeakPolarHBondContact O-CB 3.45Å; N460-S463 PolarHBondContact O-N 2.85Å; N460-S463 PolarHBondContact O-OG 2.95Å
461	E	77.5	Confident	78.3	Confident	161 Å²	161	44.2 Å²	44.2	75%	0.752	22%	0.216	S	C	*	.	H	α-helix	trans	-55.6	-48	-179.9	-55.5	179.7	157.8	0	0	114.1	P459 S463	P459-E461 VanDerWaalsContact C-N 3.32Å; P459-E461 PolarHBondContact O-N 3.3Å; E461-S463 VanDerWaalsContact C-N 3.33Å
462	K	79.6	Confident	78.4	Confident	51 Å²	51	47 Å²	47	22%	0.222	23%	0.232	C	C	.	.	H	α-helix	trans	-80.8	-14.3	-175.8	-61.7	-68.3	-173.5	177.1	0	112.3	E256 F267 P459 N460 K464 I465 L466	E256-K462 IonicContact OE1-NZ 2.62Å; E256-K462 PolarHBondContact OE1-NZ 2.81Å; E256-K462 VanDerWaalsContact OE1-NZ 3.14Å; F267-K462 HydrophobicContact CB-CB 4.34Å; F267-K462 HydrophobicContact CB-CD 4.44Å; F267-K462 HydrophobicContact CB-CG 4.03Å; F267-K462 HydrophobicContact CD2-CB 4.44Å; F267-K462 HydrophobicContact CG-CB 4.17Å; F267-K462 HydrophobicContact CG-CG 4.42Å; P459-K462 HydrophobicContact CB-CB 4.49Å; P459-K462 PolarHBondContact O-N 3.43Å; N460-K462 PolarHBondContact O-N 3.21Å; K462-K464 PolarHBondContact O-N 2.72Å; K462-I465 HydrophobicContact CD-CD1 4.39Å; K462-I465 PolarHBondContact O-N 3.26Å; K462-L466 WeakPolarHBondContact O-CB 3.22Å; K462-L466 PolarHBondContact O-N 2.91Å
463	S	75	Confident	78	Confident	14 Å²	14	43.2 Å²	43.2	10%	0.098	22%	0.215	C	C	.	.	H	α-helix	trans	-60.2	-42	-178.3	72.7	0	0	0	0	113.6	F424 P459 N460 E461 L466 F467	F424-S463 WeakPolarHBondContact CD2-OG 3.39Å; F424-S463 WeakPolarHBondContact CE2-OG 3.35Å; P459-S463 PolarHBondContact O-N 3.22Å; P459-S463 VanDerWaalsContact O-N 3.14Å; N460-S463 WeakPolarHBondContact O-CB 3.45Å; N460-S463 PolarHBondContact O-N 2.85Å; N460-S463 PolarHBondContact O-OG 2.95Å; E461-S463 VanDerWaalsContact C-N 3.33Å; S463-L466 PolarHBondContact O-N 2.96Å; S463-F467 VanDerWaalsContact O-CD2 3.32Å; S463-F467 WeakPolarHBondContact O-CD2 3.34Å; S463-F467 PolarHBondContact O-N 2.92Å
464	K	72.5	Confident	76.7	Confident	142 Å²	142	48.1 Å²	48.1	62%	0.617	24%	0.238	S	C	*	.	H	α-helix	trans	-67.7	-46.6	178.4	-169.1	-164.9	171.2	-155.3	0	111.3	K462 L466 F467 D468	K462-K464 PolarHBondContact O-N 2.72Å; K464-L466 PolarHBondContact O-N 2.75Å; K464-F467 PolarHBondContact O-N 3.32Å; K464-F467 VanDerWaalsContact O-N 3.08Å; K464-D468 VanDerWaalsContact CE-OD2 3.26Å; K464-D468 WeakPolarHBondContact CE-OD2 3.45Å; K464-D468 IonicContact NZ-OD2 2.72Å; K464-D468 PolarHBondContact O-N 3.41Å
465	I	79.4	Confident	75	Confident	59 Å²	59	48.4 Å²	48.4	30%	0.303	24%	0.24	S	C	.	.	H	α-helix	trans	-60.1	-38.6	179.3	-55.6	176	0	0	0	110.4	L265 K462 D468 F469	L265-I465 HydrophobicContact CD1-CG2 3.81Å; L265-I465 HydrophobicContact CD2-CG2 4.17Å; K462-I465 HydrophobicContact CD-CD1 4.39Å; K462-I465 PolarHBondContact O-N 3.26Å; I465-D468 PolarHBondContact O-N 2.86Å; I465-F469 WeakPolarHBondContact O-CB 3.4Å; I465-F469 PolarHBondContact O-N 2.63Å
466	L	81.1	Confident	72.6	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-46.9	173.2	176.6	65.7	0	0	0	112.5	L265 F267 V285 L426 I458 K462 S463 K464 L470	L265-L466 HydrophobicContact CD2-CB 4.04Å; L265-L466 HydrophobicContact CD2-CD1 4.1Å; F267-L466 HydrophobicContact CE1-CB 4.46Å; F267-L466 HydrophobicContact CE1-CD1 4.04Å; F267-L466 HydrophobicContact CZ-CD1 4.08Å; F267-L466 HydrophobicContact CZ-CD2 3.91Å; F267-L466 HydrophobicContact CZ-CG 4.4Å; V285-L466 HydrophobicContact CG2-CD1 3.74Å; L426-L466 HydrophobicContact CD2-CD2 4Å; I458-L466 HydrophobicContact CD1-CD2 3.63Å; K462-L466 WeakPolarHBondContact O-CB 3.22Å; K462-L466 PolarHBondContact O-N 2.91Å; S463-L466 PolarHBondContact O-N 2.96Å; K464-L466 PolarHBondContact O-N 2.75Å; L466-L470 HydrophobicContact CD1-CD1 3.73Å; L466-L470 HydrophobicContact CD1-CG 4.14Å; L466-L470 HydrophobicContact CG-CD1 3.85Å; L466-L470 WeakPolarHBondContact O-CB 3.47Å; L466-L470 WeakPolarHBondContact O-CD1 3.22Å; L466-L470 WeakPolarHBondContact O-CG 3.46Å; L466-L470 PolarHBondContact O-N 2.67Å
467	F	74.6	Confident	69.9	Low	43 Å²	43	57.9 Å²	57.9	19%	0.189	30%	0.296	C	S	.	.	H	α-helix	trans	-64.7	-46.5	176.7	-84.1	-63.7	0	0	0	112.4	V319 S463 K464 F469 L470 L471	V319-F467 HydrophobicContact CB-CE2 3.85Å; V319-F467 HydrophobicContact CB-CZ 3.75Å; V319-F467 HydrophobicContact CG2-CE2 3.52Å; V319-F467 HydrophobicContact CG2-CZ 3.42Å; V319-F467 VanDerWaalsContact CG2-CZ 3.42Å; S463-F467 VanDerWaalsContact O-CD2 3.32Å; S463-F467 WeakPolarHBondContact O-CD2 3.34Å; S463-F467 PolarHBondContact O-N 2.92Å; K464-F467 PolarHBondContact O-N 3.32Å; K464-F467 VanDerWaalsContact O-N 3.08Å; F467-F469 VanDerWaalsContact C-N 3.31Å; F467-F469 PolarHBondContact O-N 3.14Å; F467-L470 PolarHBondContact O-N 3.06Å; F467-L471 VanDerWaalsContact O-CB 3.31Å; F467-L471 WeakPolarHBondContact O-CB 3.2Å; F467-L471 PolarHBondContact O-N 2.86Å
468	D	71	Confident	67.2	Low	61 Å²	61	68.5 Å²	68.5	33%	0.326	34%	0.337	S	S	.	.	H	α-helix	trans	-61.7	-39.5	179.3	-68	-22.1	0	0	0	110.8	K464 I465 T472	K464-D468 VanDerWaalsContact CE-OD2 3.26Å; K464-D468 WeakPolarHBondContact CE-OD2 3.45Å; K464-D468 IonicContact NZ-OD2 2.72Å; K464-D468 PolarHBondContact O-N 3.41Å; I465-D468 PolarHBondContact O-N 2.86Å; D468-T472 VanDerWaalsContact O-CB 3.31Å; D468-T472 WeakPolarHBondContact O-CB 3.17Å; D468-T472 PolarHBondContact O-N 3.41Å; D468-T472 PolarHBondContact O-OG1 2.64Å
469	F	77.5	Confident	64.7	Low	9 Å²	9	73 Å²	73	4%	0.039	36%	0.358	C	S	.	.	H	α-helix	trans	-65.8	-47.8	174.6	-174.8	-93.4	0	0	0	112.6	C262 L265 V285 I465 F467 L471 T472 C473	C262-F469 WeakPolarHBondContact O-CE2 3.44Å; L265-F469 HydrophobicContact CB-CD1 4.3Å; L265-F469 HydrophobicContact CB-CD2 4.33Å; L265-F469 HydrophobicContact CB-CE1 4.5Å; L265-F469 HydrophobicContact CB-CG 4.22Å; L265-F469 HydrophobicContact CD2-CB 4.23Å; L265-F469 HydrophobicContact CD2-CG 4.49Å; V285-F469 HydrophobicContact CB-CD1 4.26Å; V285-F469 HydrophobicContact CB-CE1 3.99Å; V285-F469 HydrophobicContact CG1-CD1 4.06Å; V285-F469 HydrophobicContact CG1-CE1 3.8Å; I465-F469 WeakPolarHBondContact O-CB 3.4Å; I465-F469 PolarHBondContact O-N 2.63Å; F467-F469 VanDerWaalsContact C-N 3.31Å; F467-F469 PolarHBondContact O-N 3.14Å; F469-L471 VanDerWaalsContact C-N 3.3Å; F469-L471 PolarHBondContact O-N 3.23Å; F469-T472 PolarHBondContact O-N 2.63Å; F469-T472 VanDerWaalsContact O-N 3.15Å; F469-C473 PolarHBondContact O-N 3Å; F469-C473 PolarHBondContact O-SG 3.26Å
470	L	75	Confident	62.3	Low	3 Å²	3	78.6 Å²	78.6	2%	0.016	39%	0.386	C	S	.	.	H	α-helix	trans	-65.1	-32.7	178.9	-72.5	168.5	0	0	0	112.6	V285 L311 I317 L466 F467 F475	V285-L470 HydrophobicContact CG1-CD2 3.88Å; L311-L470 HydrophobicContact CD2-CD2 3.7Å; I317-L470 HydrophobicContact CD1-CD1 3.8Å; L466-L470 HydrophobicContact CD1-CD1 3.73Å; L466-L470 HydrophobicContact CD1-CG 4.14Å; L466-L470 HydrophobicContact CG-CD1 3.85Å; L466-L470 WeakPolarHBondContact O-CB 3.47Å; L466-L470 WeakPolarHBondContact O-CD1 3.22Å; L466-L470 WeakPolarHBondContact O-CG 3.46Å; L466-L470 PolarHBondContact O-N 2.67Å; F467-L470 PolarHBondContact O-N 3.06Å; L470-F475 WeakPolarHBondContact O-CZ 3.42Å
471	L	70.5	Confident	60.1	Low	82 Å²	82	81.4 Å²	81.4	43%	0.429	40%	0.401	S	S	.	.	H	α-helix	trans	-72.7	-30.9	173.9	-169.5	70.6	0	0	0	112.4	F467 F469 I574 L685	F467-L471 VanDerWaalsContact O-CB 3.31Å; F467-L471 WeakPolarHBondContact O-CB 3.2Å; F467-L471 PolarHBondContact O-N 2.86Å; F469-L471 VanDerWaalsContact C-N 3.3Å; F469-L471 PolarHBondContact O-N 3.23Å; L471-I574 HydrophobicContact CD1-CD1 4.49Å; L471-I574 HydrophobicContact CD1-CG1 4.48Å; L471-I574 HydrophobicContact CD2-CD1 4.22Å; L471-L685 HydrophobicContact CD1-CD1 4.06Å
472	T	66.5	Low	57.9	Low	72 Å²	72	79.4 Å²	79.4	44%	0.442	40%	0.4	S	S	.	.	H	α-helix	trans	-80.2	-24.9	-179.5	-59.4	0	0	0	0	113	M260 D468 F469 Q474	M260-T472 HydrophobicContact CG-CG2 4.48Å; D468-T472 VanDerWaalsContact O-CB 3.31Å; D468-T472 WeakPolarHBondContact O-CB 3.17Å; D468-T472 PolarHBondContact O-N 3.41Å; D468-T472 PolarHBondContact O-OG1 2.64Å; F469-T472 PolarHBondContact O-N 2.63Å; F469-T472 VanDerWaalsContact O-N 3.15Å; T472-Q474 PolarHBondContact O-N 2.78Å; T472-Q474 VanDerWaalsContact O-N 3.11Å
473	C	64.7	Low	55.6	Low	11 Å²	11	84.5 Å²	84.5	7%	0.074	42%	0.422	C	S	.	.			trans	-59.8	111.9	176.4	-72.8	0	0	0	0	111.7	F469 F475	F469-C473 PolarHBondContact O-N 3Å; F469-C473 PolarHBondContact O-SG 3.26Å; C473-F475 HydrophobicContact CB-CD1 4.42Å; C473-F475 HydrophobicContact CB-CE1 3.58Å; C473-F475 HydrophobicContact CB-CE2 4.08Å; C473-F475 HydrophobicContact CB-CZ 3.4Å; C473-F475 VanDerWaalsContact CB-CZ 3.4Å; C473-F475 WeakPolarHBondContact O-CD2 3.4Å; C473-F475 WeakPolarHBondContact O-CE2 3.49Å; C473-F475 WeakPolarHBondContact O-CZ 3.39Å; C473-F475 PolarHBondContact O-N 3.22Å
474	Q	51.5	Low	53.4	Low	151 Å²	151	92.7 Å²	92.7	71%	0.706	46%	0.459	S	S	*	.			trans	-83.9	96.4	178.2	-67.4	-171	13.6	0	0	111.4	T472 H476	T472-Q474 PolarHBondContact O-N 2.78Å; T472-Q474 VanDerWaalsContact O-N 3.11Å; Q474-H476 PolarHBondContact O-N 2.93Å
475	F	49.6	Very low	51.2	Low	36 Å²	36	92.2 Å²	92.2	16%	0.158	47%	0.471	C	S	.	.	B	Isolated β-bridge	trans	-68.2	89	-173.9	-55.1	-69.2	0	0	0	113.5	L311 L470 C473 G477 C570 F572	L311-F475 HydrophobicContact CB-CD1 4.02Å; L311-F475 HydrophobicContact CB-CE1 3.56Å; L311-F475 HydrophobicContact CD1-CE1 3.93Å; L311-F475 HydrophobicContact CG-CE1 4.22Å; L470-F475 WeakPolarHBondContact O-CZ 3.42Å; C473-F475 HydrophobicContact CB-CD1 4.42Å; C473-F475 HydrophobicContact CB-CE1 3.58Å; C473-F475 HydrophobicContact CB-CE2 4.08Å; C473-F475 HydrophobicContact CB-CZ 3.4Å; C473-F475 VanDerWaalsContact CB-CZ 3.4Å; C473-F475 WeakPolarHBondContact O-CD2 3.4Å; C473-F475 WeakPolarHBondContact O-CE2 3.49Å; C473-F475 WeakPolarHBondContact O-CZ 3.39Å; C473-F475 PolarHBondContact O-N 3.22Å; F475-G477 PolarHBondContact O-N 3.45Å; F475-C570 HydrophobicContact CB-CB 4.2Å; F475-F572 AromaticContact CD2-CD2 3.56Å; F475-F572 HydrophobicContact CD2-CD2 3.56Å; F475-F572 AromaticContact CD2-CE2 3.44Å; F475-F572 HydrophobicContact CD2-CE2 3.44Å; F475-F572 VanDerWaalsContact CD2-CE2 3.44Å; F475-F572 AromaticContact CE2-CD2 3.31Å; F475-F572 HydrophobicContact CE2-CD2 3.31Å; F475-F572 AromaticContact CE2-CE2 3.32Å; F475-F572 HydrophobicContact CE2-CE2 3.32Å; F475-F572 HydrophobicContact CG-CE2 4.16Å; F475-F572 HydrophobicContact CZ-CD2 4.26Å; F475-F572 AromaticContact CZ-CE2 3.96Å; F475-F572 HydrophobicContact CZ-CE2 3.96Å
476	H	36	Very low	48.7	Very low	155 Å²	155	94.5 Å²	94.5	72%	0.718	49%	0.488	S	S	*	.			trans	-66.8	95.4	166.5	-94.5	70.9	0	0	0	110.5	Q474	Q474-H476 PolarHBondContact O-N 2.93Å
477	G	31.3	Very low	46.1	Very low	45 Å²	45	101.7 Å²	101.7	46%	0.464	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-65	136.4	161.6	0	0	0	0	0	110.5	F475 E479	F475-G477 PolarHBondContact O-N 3.45Å; G477-E479 PolarHBondContact O-N 2.95Å
478	Y	31.9	Very low	43.8	Very low	242 Å²	242	107.6 Å²	107.6	95%	0.949	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-64.6	121.1	166.9	-95.7	-106.6	0	0	0	109.1
479	E	34	Very low	41.8	Very low	99 Å²	99	112.4 Å²	112.4	46%	0.463	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-83.8	129.2	169	-70.9	-171.9	155.6	0	0	110.6	G477 N568	G477-E479 PolarHBondContact O-N 2.95Å; E479-N568 WeakPolarHBondContact OE1-CB 3.48Å; E479-N568 PolarHBondContact OE1-N 2.92Å; E479-N568 PolarHBondContact OE1-ND2 2.78Å
480	D	31.8	Very low	39.3	Very low	138 Å²	138	118 Å²	118	74%	0.738	61%	0.613	S	S	*	*			trans	30.4	101.5	155.4	-61.9	-16.2	0	0	0	119.3	V482	D480-V482 HydrophobicContact CB-CG2 4.14Å
481	D	31.5	Very low	37.1	Very low	132 Å²	132	123.2 Å²	123.2	71%	0.706	65%	0.649	S	S	*	*			trans	-107.7	56.9	143.4	-148.6	-15.2	0	0	0	110.9	K483	D481-K483 PolarHBondContact O-N 3.5Å; D481-K483 IonicContact OD1-NZ 3.14Å; D481-K483 PolarHBondContact OD1-NZ 2.77Å; D481-K483 IonicContact OD2-NZ 2.65Å
482	V	31.7	Very low	35.1	Very low	118 Å²	118	127 Å²	127	72%	0.715	67%	0.665	S	S	*	*			trans	-69.4	90.2	175.5	-179.4	0	0	0	0	109.6	D480	D480-V482 HydrophobicContact CB-CG2 4.14Å
483	K	30.8	Very low	33.1	Very low	159 Å²	159	130.3 Å²	130.3	69%	0.691	68%	0.679	S	S	*	*			trans	-119.2	122.8	164.7	-66.2	-167.1	-169.8	75.4	0	110.6	D481	D481-K483 PolarHBondContact O-N 3.5Å; D481-K483 IonicContact OD1-NZ 3.14Å; D481-K483 PolarHBondContact OD1-NZ 2.77Å; D481-K483 IonicContact OD2-NZ 2.65Å
484	Q	27.9	Very low	31.2	Very low	186 Å²	186	134.3 Å²	134.3	87%	0.869	71%	0.706	S	S	*	*			trans	-66.7	133.4	176	-63.8	166.4	-56.5	0	0	110.9
485	C	26.8	Very low	30.1	Very low	131 Å²	131	134 Å²	134	89%	0.885	71%	0.708	S	S	*	*			trans	-138.6	86.8	153.4	-163.6	0	0	0	0	108
486	T	26.8	Very low	28.9	Very low	107 Å²	107	141.6 Å²	141.6	66%	0.656	74%	0.741	S	S	*	*			trans	-76.9	169.1	163.3	48.5	0	0	0	0	109.8
487	D	25.7	Very low	28.6	Very low	156 Å²	156	139.5 Å²	139.5	83%	0.834	74%	0.744	S	S	*	*			trans	75.4	85.2	174.9	-53.6	-13.3	0	0	0	116.2
488	M	28.3	Very low	28.3	Very low	166 Å²	166	145.6 Å²	145.6	82%	0.818	77%	0.766	S	S	*	*			trans	-141.8	125.6	138.1	-130	177.4	76.4	0	0	111.3
489	E	28.7	Very low	28.1	Very low	162 Å²	162	142.4 Å²	142.4	76%	0.757	76%	0.76	S	S	*	*			trans	42.5	115.2	159.3	-62.9	175.3	151.9	0	0	118.7
490	V	25.2	Very low	27.8	Very low	128 Å²	128	144.4 Å²	144.4	78%	0.776	77%	0.772	S	S	*	*			cis	63.2	76.1	46.7	-165.5	0	0	0	0	113.9
491	S	29	Very low	27.8	Very low	111 Å²	111	146 Å²	146	78%	0.776	77%	0.773	S	S	*	*			trans	-165.8	122.5	140.3	-78.9	0	0	0	0	107
492	Q	27.1	Very low	27.7	Very low	163 Å²	163	145.4 Å²	145.4	76%	0.762	77%	0.769	S	S	*	*				59.6	130.8	55.8	-67.9	-154.2	4.4	0	0	114.8
493	L	25.6	Very low	27.7	Very low	141 Å²	141	145.3 Å²	145.3	74%	0.738	77%	0.769	S	S	*	*			trans	69	119.9	168.2	-53.4	150.6	0	0	0	113.2
494	S	24.3	Very low	27.7	Very low	94 Å²	94	143.5 Å²	143.5	66%	0.657	77%	0.767	S	S	*	*			cis	72.2	150.5	37.3	99	0	0	0	0	114.3
495	I	28	Very low	27.9	Very low	144 Å²	144	143.4 Å²	143.4	74%	0.738	76%	0.764	S	S	*	*			trans	77.7	98.9	-170.1	-50.2	161.9	0	0	0	110.4
496	K	25	Very low	28.2	Very low	196 Å²	196	140.8 Å²	140.8	85%	0.852	75%	0.751	S	S	*	*				79.2	153.4	67.3	-80	-168.5	172.1	-174.7	0	114.3
497	S	29.8	Very low	28.5	Very low	111 Å²	111	142.7 Å²	142.7	78%	0.776	76%	0.758	S	S	*	*			trans	57.5	100.2	168.8	46.5	0	0	0	0	116.2
498	N	25.4	Very low	28.7	Very low	174 Å²	174	141.1 Å²	141.1	93%	0.93	75%	0.754	S	S	*	*			trans	-116.7	78.6	153.6	-165.6	25.9	0	0	0	108.7
499	E	26.1	Very low	28.8	Very low	175 Å²	175	139.5 Å²	139.5	82%	0.818	75%	0.747	S	S	*	*			trans	-158.3	145.7	159.1	-143.2	175.9	-136.2	0	0	111.2
500	I	29.2	Very low	28.7	Very low	141 Å²	141	138.9 Å²	138.9	72%	0.723	75%	0.747	S	S	*	*			trans	102.4	90	172.7	-57.5	174.5	0	0	0	115.7
501	K	30.2	Very low	28.9	Very low	172 Å²	172	137.3 Å²	137.3	75%	0.748	74%	0.742	S	S	*	*			trans	81.3	117.5	134.1	-73.5	-173.9	173.8	-172.7	0	121.8
502	D	30.3	Very low	28.9	Very low	118 Å²	118	140.7 Å²	140.7	63%	0.631	74%	0.743	S	S	*	*				87.6	91.6	117.2	-61.1	-10	0	0	0	120.9
503	T	31	Very low	29	Very low	117 Å²	117	139.2 Å²	139.2	72%	0.718	74%	0.74	S	S	*	*				108.7	149.8	115.2	68.3	0	0	0	0	120
504	N	31.5	Very low	29	Very low	120 Å²	120	140.6 Å²	140.6	64%	0.642	74%	0.742	S	S	*	*			trans	84.5	101.8	150.2	-72.8	-58.5	0	0	0	119.8
505	K	32.8	Very low	29.2	Very low	184 Å²	184	140.2 Å²	140.2	80%	0.8	74%	0.74	S	S	*	*				86.4	98.6	125.3	-68.4	173.4	-177.3	174.1	0	119.1
506	A	32.7	Very low	29.2	Very low	76 Å²	76	142.5 Å²	142.5	63%	0.628	74%	0.744	S	S	*	*				102.1	115.8	100.1	0	0	0	0	0	118.6
507	N	32	Very low	29.3	Very low	147 Å²	147	137.8 Å²	137.8	79%	0.786	74%	0.736	S	S	*	*				80.4	130.2	127.7	-63.7	6.5	0	0	0	120.2
508	T	31.3	Very low	29.2	Very low	123 Å²	123	140.6 Å²	140.6	76%	0.755	74%	0.741	S	S	*	*			trans	83.5	142.5	134.2	-71.3	0	0	0	0	118.7
509	I	28.9	Very low	29.2	Very low	132 Å²	132	135.1 Å²	135.1	68%	0.677	73%	0.725	S	S	*	*			cis	178.3	144.5	-34.6	-115.4	164	0	0	0	106.8
510	I	28.2	Very low	29.3	Very low	149 Å²	149	134.3 Å²	134.3	76%	0.764	73%	0.727	S	S	*	*			trans	69.1	150	158.2	-80.4	170.1	0	0	0	120.5
511	S	29	Very low	29.3	Very low	96 Å²	96	134.9 Å²	134.9	67%	0.671	73%	0.73	S	S	*	*			trans	103.6	89.5	148.3	56.8	0	0	0	0	122.7
512	K	29.5	Very low	29.1	Very low	181 Å²	181	133 Å²	133	79%	0.787	73%	0.729	S	S	*	*				75.4	126	105.7	-77.5	177.8	175.5	-177.4	0	121.6
513	L	27.5	Very low	29	Very low	132 Å²	132	135.5 Å²	135.5	69%	0.691	73%	0.734	S	S	*	*				77.9	112.9	129.3	-67.2	171.1	0	0	0	121.3
514	H	25.7	Very low	28.8	Very low	170 Å²	170	136.8 Å²	136.8	79%	0.787	73%	0.73	S	S	*	*				47.9	119.7	119.6	-78.2	-123.3	0	0	0	117.4
515	S	28.8	Very low	28.7	Very low	87 Å²	87	139.6 Å²	139.6	61%	0.608	74%	0.737	S	S	*	*			cis	163.3	177.5	46.2	50.8	0	0	0	0	111
516	K	29.3	Very low	28.5	Very low	192 Å²	192	135.2 Å²	135.2	84%	0.835	73%	0.73	S	S	*	*			trans	70.2	106.4	148.6	-77.4	163.8	-175.9	176.4	0	119.6
517	S	26.5	Very low	28.3	Very low	97 Å²	97	136 Å²	136	68%	0.678	73%	0.731	S	S	*	*				102.3	125.6	102.4	-167.1	0	0	0	0	120
518	L	26.7	Very low	28.1	Very low	170 Å²	170	136.6 Å²	136.6	89%	0.89	73%	0.732	S	S	*	*			trans	58.2	113.8	149.2	-70	169	0	0	0	120.5
519	G	26.9	Very low	28	Very low	58 Å²	58	137.3 Å²	137.3	60%	0.598	74%	0.736	S	S	*	*				123.5	127.9	104.5	0	0	0	0	0	118.2
520	N	28	Very low	28	Very low	159 Å²	159	135.5 Å²	135.5	85%	0.85	74%	0.735	S	S	*	*			trans	64.2	134.1	155.1	-48.5	-35.6	0	0	0	116.3
521	L	27.9	Very low	28.3	Very low	152 Å²	152	132.6 Å²	132.6	80%	0.796	73%	0.726	S	S	*	*			cis	-156.3	173.9	45.6	-112.3	113.7	0	0	0	113.3
522	N	26.7	Very low	28.2	Very low	134 Å²	134	134 Å²	134	72%	0.717	73%	0.73	S	S	*	*			trans	-78.5	-172.9	178.2	-58.7	-73.6	0	0	0	114.1
523	F	27.4	Very low	28.3	Very low	169 Å²	169	130.4 Å²	130.4	74%	0.741	73%	0.727	S	S	*	*			trans	108.3	134.4	155.6	-69.6	-97	0	0	0	116.7
524	F	28.2	Very low	28.5	Very low	144 Å²	144	129 Å²	129	63%	0.632	73%	0.728	S	S	*	*			cis	176.3	136.9	-24	-128	-88.7	0	0	0	105.8
525	K	27.9	Very low	28.7	Very low	179 Å²	179	130 Å²	130	78%	0.778	73%	0.734	S	S	*	*			trans	38.1	154.9	151.3	-72.2	-175.3	-175.8	-177.9	0	122.4
526	S	28.5	Very low	28.7	Very low	93 Å²	93	133.2 Å²	133.2	65%	0.65	74%	0.739	S	S	*	*			cis	179.4	-175.6	-14.8	60	0	0	0	0	109.6
527	S	28.6	Very low	28.6	Very low	93 Å²	93	132.6 Å²	132.6	65%	0.65	74%	0.737	S	S	*	*			trans	87.5	114.3	157.7	-50.1	0	0	0	0	116.8
528	I	28.5	Very low	28.6	Very low	158 Å²	158	132.1 Å²	132.1	81%	0.81	73%	0.732	S	S	*	*				92	127	57.4	-71.4	157.5	0	0	0	112.6
529	V	28.9	Very low	28.7	Very low	139 Å²	139	131 Å²	131	84%	0.842	73%	0.726	S	S	*	*			trans	171.2	142.3	132.3	153.3	0	0	0	0	109.9
530	S	29.9	Very low	28.8	Very low	94 Å²	94	134.2 Å²	134.2	66%	0.657	73%	0.73	S	S	*	*			trans	-134.1	172.2	166.5	65.2	0	0	0	0	110.8
531	P	33	Very low	29	Very low	88 Å²	88	133.6 Å²	133.6	57%	0.571	73%	0.727	S	S	*	*			trans	-117.1	134.2	144.9	34.4	-25.7	0	0	0	109.9	I912	P531-I912 HydrophobicContact CG-CD1 4.26Å
532	V	28	Very low	29.1	Very low	125 Å²	125	132.2 Å²	132.2	76%	0.758	72%	0.72	S	S	*	*			cis	91	97.7	36.3	178.3	0	0	0	0	113.8
533	S	31.6	Very low	29.3	Very low	105 Å²	105	131.7 Å²	131.7	73%	0.734	72%	0.717	S	S	*	*			trans	-161.1	97.8	141.4	55.4	0	0	0	0	107.1
534	S	30.5	Very low	29.5	Very low	102 Å²	102	129.2 Å²	129.2	71%	0.713	71%	0.711	S	S	*	*				52.6	127.9	82.1	72.7	0	0	0	0	112.9
535	E	29.9	Very low	29.7	Very low	192 Å²	192	128.5 Å²	128.5	90%	0.897	71%	0.714	S	S	*	*			cis	-126.1	179.3	25.3	-63.3	-179.5	134.7	0	0	114.2
536	H	29.8	Very low	30.1	Very low	154 Å²	154	126.6 Å²	126.6	71%	0.713	71%	0.713	S	S	*	*			trans	-148.7	-170.8	-164.5	-156.7	-98.7	0	0	0	112
537	F	27	Very low	30.3	Very low	180 Å²	180	128 Å²	128	79%	0.789	72%	0.717	S	S	*	*			trans	80.4	118.3	178.3	-58.9	-82.5	0	0	0	114.1
538	C	26.2	Very low	30.4	Very low	87 Å²	87	127.3 Å²	127.3	59%	0.588	71%	0.712	S	S	*	*			cis	63.6	117.9	19	-63.6	0	0	0	0	116.6
539	L	28.6	Very low	30.7	Very low	147 Å²	147	128.3 Å²	128.3	77%	0.77	71%	0.711	S	S	*	*				62	147	126.2	-61.6	178.9	0	0	0	118.2
540	D	29.8	Very low	30.8	Very low	124 Å²	124	130.3 Å²	130.3	66%	0.663	71%	0.709	S	S	*	*			cis	-154.5	174.3	24.3	-89.7	-51.4	0	0	0	112.3
541	D	31.7	Very low	30.8	Very low	147 Å²	147	133.9 Å²	133.9	79%	0.786	72%	0.715	S	S	*	*			trans	60.4	162.3	150	-61.2	-21.8	0	0	0	120.8
542	D	31.3	Very low	30.8	Very low	122 Å²	122	137.8 Å²	137.8	65%	0.652	72%	0.723	S	S	*	*			cis	-155.2	164.1	11.7	-155.9	-4.9	0	0	0	113.2
543	N	30.9	Very low	30.9	Very low	124 Å²	124	136.8 Å²	136.8	66%	0.663	72%	0.717	S	S	*	*			trans	62.9	154.1	162.8	-64.4	-63.4	0	0	0	118.5
544	N	30.8	Very low	31	Very low	116 Å²	116	138.7 Å²	138.7	62%	0.62	72%	0.717	S	S	*	*			cis	-159.8	164.7	21.9	-145.5	39.7	0	0	0	111.7
545	D	33.2	Very low	31	Very low	130 Å²	130	141 Å²	141	70%	0.695	72%	0.717	S	S	*	*			trans	60.7	139.6	160.8	-46.8	-43.3	0	0	0	118.2
546	D	35.3	Very low	31	Very low	139 Å²	139	142.9 Å²	142.9	74%	0.743	72%	0.716	S	S	*	*			cis	-160.8	151.8	28.8	-146.1	-4.6	0	0	0	113.9
547	V	32.2	Very low	31	Very low	122 Å²	122	142.7 Å²	142.7	74%	0.739	71%	0.714	S	S	*	*			trans	28.5	138.8	143.4	160.9	0	0	0	0	122.4
548	S	32	Very low	31.3	Very low	79 Å²	79	142.4 Å²	142.4	55%	0.552	72%	0.715	S	S	*	*			cis	-176.4	164.8	-15.9	70.8	0	0	0	0	112.1
549	K	33.6	Very low	31.3	Very low	178 Å²	178	143.6 Å²	143.6	77%	0.774	72%	0.716	S	S	*	*			trans	66.9	151.4	156.5	-69.8	165	-179.1	165.7	0	117.7
550	F	32.3	Very low	31.3	Very low	182 Å²	182	143.7 Å²	143.7	80%	0.798	71%	0.712	S	S	*	*			cis	-134.3	140.1	9.9	-125.7	-70.8	0	0	0	111.8
551	E	28.1	Very low	31.2	Very low	169 Å²	169	146.5 Å²	146.5	79%	0.79	72%	0.718	S	S	*	*			trans	-125.7	143.1	174.6	174	-158	-147.1	0	0	108.2
552	K	34	Very low	31.1	Very low	170 Å²	170	148.9 Å²	148.9	74%	0.739	72%	0.724	S	S	*	*			trans	-177.8	117.9	144.8	-108.7	160.7	-175.1	177.3	0	117.8
553	T	30.5	Very low	31.1	Very low	103 Å²	103	148.6 Å²	148.6	63%	0.632	73%	0.727	S	S	*	*			trans	60.4	157.1	136.2	56.7	0	0	0	0	119.3
554	I	33.4	Very low	30.9	Very low	146 Å²	146	151.9 Å²	151.9	75%	0.749	74%	0.738	S	S	*	*			cis	-139.4	116.7	24.9	-61.2	167.5	0	0	0	108.2
555	H	29.5	Very low	30.8	Very low	150 Å²	150	156.3 Å²	156.3	69%	0.694	75%	0.746	S	S	*	*				44.4	134.5	109.1	-57.3	-16.4	0	0	0	116.7
556	R	31	Very low	30.6	Very low	232 Å²	232	157.8 Å²	157.8	88%	0.875	75%	0.748	S	S	*	*				-165.3	149.5	58.4	-129.5	156.7	-168.3	172.5	3.1	113.5
557	H	29.8	Very low	30.4	Very low	149 Å²	149	156.3 Å²	156.3	69%	0.69	74%	0.737	S	S	*	*			trans	-15.8	142.9	166.3	-55.8	-77.3	0	0	0	118.9
558	H	33	Very low	30.4	Very low	174 Å²	174	155.4 Å²	155.4	81%	0.806	73%	0.728	S	S	*	*				-149.2	156.4	71.2	-122.4	-81.4	0	0	0	117.9
559	N	27.2	Very low	30.6	Very low	113 Å²	113	158 Å²	158	60%	0.604	73%	0.727	S	S	*	*			trans	-48.3	158.4	176.7	-60.4	-23.5	0	0	0	115.4
560	H	28.8	Very low	30.8	Very low	148 Å²	148	151.1 Å²	151.1	69%	0.685	70%	0.7	S	S	*	*			cis	-153.9	145.4	34.3	-115	-27.9	0	0	0	115
561	K	26.8	Very low	31.4	Very low	183 Å²	183	148 Å²	148	80%	0.796	69%	0.688	S	S	*	*			trans	37.8	94.1	146.2	-64.5	177.3	177.8	178.2	0	118.7
562	H	29.8	Very low	32.2	Very low	197 Å²	197	141.1 Å²	141.1	91%	0.912	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-95.9	136.8	145.7	-97.9	-84.3	0	0	0	110.4
563	T	32	Very low	32.5	Very low	116 Å²	116	135.3 Å²	135.3	71%	0.712	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-93.9	143.4	172.4	49.2	0	0	0	0	110.3	R565	T563-R565 PolarHBondContact O-N 2.91Å
564	H	26.4	Very low	33	Very low	193 Å²	193	134.3 Å²	134.3	89%	0.894	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-54.2	131.2	170.9	-71.3	-94.1	0	0	0	111.3
565	R	28.2	Very low	33.2	Very low	210 Å²	210	129.2 Å²	129.2	79%	0.792	60%	0.6	S	S	*	*			trans	-131	140.5	157.4	-82.2	-175.7	167.9	169.3	-5.8	107.1	T563	T563-R565 PolarHBondContact O-N 2.91Å
566	H	29.6	Very low	33.6	Very low	160 Å²	160	125.8 Å²	125.8	74%	0.741	59%	0.591	S	S	*	*			trans	-75	158.7	161.7	-70.3	-102.8	0	0	0	108.3
567	H	30.1	Very low	34.3	Very low	109 Å²	109	116 Å²	116	51%	0.505	56%	0.556	S	S	.	*			trans	-133.5	107.5	178.8	-86.6	-14.2	0	0	0	110.2	Y569	H567-Y569 VanDerWaalsContact C-N 3.3Å; H567-Y569 HydrophobicContact CB-CD2 3.77Å; H567-Y569 HydrophobicContact CB-CE2 3.48Å; H567-Y569 VanDerWaalsContact CB-CE2 3.48Å; H567-Y569 AromaticContact CD2-CE2 3.99Å; H567-Y569 AromaticContact CD2-CZ 3.86Å; H567-Y569 PolarHBondContact O-N 3.36Å; H567-Y569 VanDerWaalsContact O-N 3.09Å
568	N	32.2	Very low	34.8	Very low	102 Å²	102	112.5 Å²	112.5	55%	0.545	55%	0.545	S	S	.	.			trans	-79.9	71.2	170.6	-84.4	-74.7	0	0	0	111.8	E479 C570	E479-N568 WeakPolarHBondContact OE1-CB 3.48Å; E479-N568 PolarHBondContact OE1-N 2.92Å; E479-N568 PolarHBondContact OE1-ND2 2.78Å; N568-C570 PolarHBondContact O-N 3.44Å
569	Y	36.6	Very low	35.2	Very low	134 Å²	134	105.9 Å²	105.9	53%	0.525	51%	0.514	S	S	.	.			trans	-59.1	122.6	176.6	-72	-85.3	0	0	0	112.2	H567 H571	H567-Y569 VanDerWaalsContact C-N 3.3Å; H567-Y569 HydrophobicContact CB-CD2 3.77Å; H567-Y569 HydrophobicContact CB-CE2 3.48Å; H567-Y569 VanDerWaalsContact CB-CE2 3.48Å; H567-Y569 AromaticContact CD2-CE2 3.99Å; H567-Y569 AromaticContact CD2-CZ 3.86Å; H567-Y569 PolarHBondContact O-N 3.36Å; H567-Y569 VanDerWaalsContact O-N 3.09Å; Y569-H571 PolarHBondContact O-N 2.98Å
570	C	38.3	Very low	35.7	Very low	33 Å²	33	105.5 Å²	105.5	22%	0.223	51%	0.512	C	S	.	.	B	Isolated β-bridge	trans	-88.7	88.5	159	-77.2	0	0	0	0	108.7	F475 N568 K689	F475-C570 HydrophobicContact CB-CB 4.2Å; N568-C570 PolarHBondContact O-N 3.44Å; C570-K689 PolarHBondContact SG-NZ 3.47Å
571	H	44.4	Very low	36.4	Very low	117 Å²	117	105 Å²	105	54%	0.542	50%	0.504	S	S	.	.			trans	-73.2	162.9	163.2	-82.9	-79.1	0	0	0	110.7	Y569 S688	Y569-H571 PolarHBondContact O-N 2.98Å; H571-S688 VanDerWaalsContact CB-OG 3.22Å; H571-S688 WeakPolarHBondContact CB-OG 3.01Å; H571-S688 PolarHBondContact O-N 2.92Å; H571-S688 PolarHBondContact O-OG 3.12Å
572	F	46	Very low	36.9	Very low	25 Å²	25	98 Å²	98	11%	0.11	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	142.7	168.2	-83	-93.3	0	0	0	109.3	F314 F475 L685 V686	F314-F572 HydrophobicContact CB-CZ 4.31Å; F475-F572 AromaticContact CD2-CD2 3.56Å; F475-F572 HydrophobicContact CD2-CD2 3.56Å; F475-F572 AromaticContact CD2-CE2 3.44Å; F475-F572 HydrophobicContact CD2-CE2 3.44Å; F475-F572 VanDerWaalsContact CD2-CE2 3.44Å; F475-F572 AromaticContact CE2-CD2 3.31Å; F475-F572 HydrophobicContact CE2-CD2 3.31Å; F475-F572 AromaticContact CE2-CE2 3.32Å; F475-F572 HydrophobicContact CE2-CE2 3.32Å; F475-F572 HydrophobicContact CG-CE2 4.16Å; F475-F572 HydrophobicContact CZ-CD2 4.26Å; F475-F572 AromaticContact CZ-CE2 3.96Å; F475-F572 HydrophobicContact CZ-CE2 3.96Å; F572-L685 HydrophobicContact CB-CD1 3.88Å; F572-L685 HydrophobicContact CB-CD2 4.09Å; F572-L685 HydrophobicContact CB-CG 3.8Å; F572-L685 HydrophobicContact CD1-CD2 3.91Å; F572-L685 HydrophobicContact CD1-CG 3.8Å; F572-L685 HydrophobicContact CG-CD2 4.1Å; F572-L685 HydrophobicContact CG-CG 4.12Å; F572-V686 CarbonylContact C-O 3.59Å; F572-V686 WeakPolarHBondContact CA-O 3.37Å
573	V	40.1	Very low	37.3	Very low	48 Å²	48	92.9 Å²	92.9	29%	0.291	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	134.2	-175.2	-174.4	0	0	0	0	109	V575 L685 V686 S688 L691	V573-V575 HydrophobicContact CG1-CG2 4.44Å; V573-L685 WeakPolarHBondContact O-CA 3.49Å; V573-V686 PolarHBondContact N-O 3.47Å; V573-V686 PolarHBondContact O-N 3.14Å; V573-S688 WeakPolarHBondContact CG2-OG 3.44Å; V573-L691 HydrophobicContact CB-CD2 4.33Å; V573-L691 HydrophobicContact CG1-CD2 4.19Å; V573-L691 HydrophobicContact CG2-CD2 4.04Å
574	I	40.2	Very low	37.5	Very low	82 Å²	82	92.9 Å²	92.9	42%	0.421	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	113.2	176.1	-55	179.4	0	0	0	108.5	L471 W683 E684 L685	L471-I574 HydrophobicContact CD1-CD1 4.49Å; L471-I574 HydrophobicContact CD1-CG1 4.48Å; L471-I574 HydrophobicContact CD2-CD1 4.22Å; I574-W683 HydrophobicContact CG2-CB 3.57Å; I574-W683 HydrophobicContact CG2-CD2 3.67Å; I574-W683 HydrophobicContact CG2-CE3 3.48Å; I574-W683 VanDerWaalsContact CG2-CE3 3.48Å; I574-W683 HydrophobicContact CG2-CG 3.75Å; I574-W683 HydrophobicContact CG2-CZ3 4.3Å; I574-E684 CarbonylContact C-O 3.52Å; I574-E684 WeakPolarHBondContact CA-O 3.23Å; I574-L685 HydrophobicContact CG1-CD1 3.88Å
575	V	38.2	Very low	37.9	Very low	38 Å²	38	88.8 Å²	88.8	23%	0.23	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	130.4	179.8	-174.4	0	0	0	0	109.1	V573 N577 E684 V686	V573-V575 HydrophobicContact CG1-CG2 4.44Å; V575-N577 PolarHBondContact O-N 3.48Å; V575-E684 HydrophobicContact CB-CB 4.46Å; V575-E684 PolarHBondContact N-O 2.76Å; V575-E684 PolarHBondContact O-N 2.8Å; V575-V686 HydrophobicContact CG2-CB 4.37Å; V575-V686 HydrophobicContact CG2-CG2 3.88Å
576	P	37.8	Very low	38.1	Very low	78 Å²	78	83.9 Å²	83.9	51%	0.506	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	128.5	170.9	28.9	-33.1	0	0	0	109.5	T578	P576-T578 PolarHBondContact O-N 3.15Å
577	N	44.9	Very low	38.3	Very low	28 Å²	28	79.8 Å²	79.8	15%	0.15	42%	0.424	C	S	.	.			trans	-65.6	93.4	-173.5	-177.6	15.3	0	0	0	112.3	V575 N682	V575-N577 PolarHBondContact O-N 3.48Å; N577-N682 VanDerWaalsContact CB-O 3.22Å; N577-N682 WeakPolarHBondContact CB-O 3.19Å
578	T	41.2	Very low	38.7	Very low	75 Å²	75	77.6 Å²	77.6	46%	0.46	42%	0.421	S	S	.	.			trans	-89.9	115.2	177.7	42.7	0	0	0	0	110.4	P576 D580 W581	P576-T578 PolarHBondContact O-N 3.15Å; T578-D580 PolarHBondContact O-N 2.66Å; T578-W581 PolarHBondContact O-NE1 3.08Å; T578-W581 VanDerWaalsContact O-NE1 3.12Å
579	F	40.4	Very low	39.1	Very low	35 Å²	35	76.7 Å²	76.7	15%	0.154	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-62	-3	-176.8	-86.4	-97.4	0	0	0	115.9	W581 V582 T680	F579-W581 PolarHBondContact O-N 3.47Å; F579-W581 VanDerWaalsContact O-N 3.09Å; F579-V582 HydrophobicContact CD1-CB 4.49Å; F579-V582 HydrophobicContact CD1-CG2 4.26Å; F579-V582 WeakPolarHBondContact O-CB 3.2Å; F579-V582 PolarHBondContact O-N 3.39Å; F579-T680 WeakPolarHBondContact CE2-OG1 3.47Å; F579-T680 WeakPolarHBondContact CZ-OG1 3.38Å
580	D	38.1	Very low	39.4	Very low	105 Å²	105	73.1 Å²	73.1	56%	0.561	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-61.5	-22.1	-172.2	-58.1	-36.2	0	0	0	113.4	T578	T578-D580 PolarHBondContact O-N 2.66Å
581	W	43	Very low	39.6	Very low	136 Å²	136	77 Å²	77	52%	0.515	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-83.1	-13.9	174	58.3	-88.5	0	0	0	114.8	T578 F579 P584	T578-W581 PolarHBondContact O-NE1 3.08Å; T578-W581 VanDerWaalsContact O-NE1 3.12Å; F579-W581 PolarHBondContact O-N 3.47Å; F579-W581 VanDerWaalsContact O-N 3.09Å; W581-P584 WeakPolarHBondContact O-CD 3.29Å
582	V	38.6	Very low	39.3	Very low	37 Å²	37	78 Å²	78	22%	0.224	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-23.8	176.4	-174.8	0	0	0	0	111.7	F579 P584 R585	F579-V582 HydrophobicContact CD1-CB 4.49Å; F579-V582 HydrophobicContact CD1-CG2 4.26Å; F579-V582 WeakPolarHBondContact O-CB 3.2Å; F579-V582 PolarHBondContact O-N 3.39Å; V582-P584 WeakPolarHBondContact O-CD 3.48Å; V582-P584 VanDerWaalsContact O-N 3.16Å; V582-R585 PolarHBondContact O-N 3.02Å
583	L	37.2	Very low	39.2	Very low	89 Å²	89	79.8 Å²	79.8	47%	0.466	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-55.4	-27.8	-173.5	-61.3	180	0	0	0	117.1	R585 I586	L583-R585 PolarHBondContact O-N 2.7Å; L583-I586 HydrophobicContact CD2-CD1 4.45Å
584	P	35.5	Very low	39.4	Very low	116 Å²	116	83.4 Å²	83.4	75%	0.753	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-64.9	-1.7	178.3	-24.3	35.4	0	0	0	116.5	W581 V582	W581-P584 WeakPolarHBondContact O-CD 3.29Å; V582-P584 WeakPolarHBondContact O-CD 3.48Å; V582-P584 VanDerWaalsContact O-N 3.16Å
585	R	35.1	Very low	39.7	Very low	107 Å²	107	82.9 Å²	82.9	40%	0.404	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-111.8	-6	-174.9	-70.3	-174.6	172.7	-179.3	-1.2	115.5	F328 V582 L583 G587	F328-R585 PolarHBondContact O-NH1 3.26Å; V582-R585 PolarHBondContact O-N 3.02Å; L583-R585 PolarHBondContact O-N 2.7Å; R585-G587 PolarHBondContact O-N 3.11Å; R585-G587 VanDerWaalsContact O-N 3.15Å
586	I	33.9	Very low	39.9	Very low	107 Å²	107	85.6 Å²	85.6	55%	0.549	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	88.3	176.6	-54.1	177.2	0	0	0	108.3	L583 L673	L583-I586 HydrophobicContact CD2-CD1 4.45Å; I586-L673 HydrophobicContact CD1-CD2 4.2Å
587	G	32.8	Very low	40.5	Very low	74 Å²	74	87 Å²	87	76%	0.763	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	159.5	-5.1	178.1	0	0	0	0	0	117.8	R585	R585-G587 PolarHBondContact O-N 3.11Å; R585-G587 VanDerWaalsContact O-N 3.15Å
588	S	37.8	Very low	40.7	Very low	63 Å²	63	89.4 Å²	89.4	44%	0.441	49%	0.488	S	S	.	.			trans	-74.1	134.8	176.5	78.5	0	0	0	0	111.1	D590	S588-D590 WeakPolarHBondContact CB-OD1 3.22Å; S588-D590 PolarHBondContact O-N 2.97Å; S588-D590 PolarHBondContact OG-OD1 2.94Å; S588-D590 PolarHBondContact OG-OD2 3.36Å
589	S	41.3	Very low	41	Very low	84 Å²	84	90.7 Å²	90.7	59%	0.587	49%	0.491	S	S	*	.			trans	-83.9	27.3	-166	57.4	0	0	0	0	114.6	D591 R594	S589-D591 PolarHBondContact O-N 3.47Å; S589-D591 VanDerWaalsContact O-N 3.14Å; S589-R594 PolarHBondContact O-NH1 3.45Å
590	D	43.7	Very low	41.2	Very low	58 Å²	58	93.2 Å²	93.2	31%	0.31	51%	0.507	S	S	.	.			trans	-61.9	105.7	-171.1	-46.8	11.9	0	0	0	111.3	R331 S588 H592 S593	R331-D590 IonicContact CZ-OD2 3.79Å; R331-D590 IonicContact NH1-OD2 3.95Å; R331-D590 PolarHBondContact NH1-OD2 2.9Å; R331-D590 IonicContact NH2-OD2 2.67Å; R331-D590 PolarHBondContact NH2-OD2 2.98Å; S588-D590 WeakPolarHBondContact CB-OD1 3.22Å; S588-D590 PolarHBondContact O-N 2.97Å; S588-D590 PolarHBondContact OG-OD1 2.94Å; S588-D590 PolarHBondContact OG-OD2 3.36Å; D590-H592 PolarHBondContact O-N 2.96Å; D590-S593 WeakPolarHBondContact O-CB 3.13Å; D590-S593 PolarHBondContact O-N 3.2Å; D590-S593 PolarHBondContact O-OG 3.34Å
591	D	42.1	Very low	41.7	Very low	114 Å²	114	92 Å²	92	61%	0.61	50%	0.5	S	S	*	.	H	α-helix	trans	-57.4	-26.4	-177.1	-81.4	-37.5	0	0	0	114	S589 S593 R594 T595	S589-D591 PolarHBondContact O-N 3.47Å; S589-D591 VanDerWaalsContact O-N 3.14Å; D591-S593 VanDerWaalsContact C-N 3.32Å; D591-S593 PolarHBondContact O-N 3.45Å; D591-R594 WeakPolarHBondContact O-CB 3.2Å; D591-R594 PolarHBondContact O-N 3.27Å; D591-R594 WeakPolarHBondContact OD1-CD 3.45Å; D591-R594 IonicContact OD1-CZ 3.26Å; D591-R594 IonicContact OD1-NE 3.6Å; D591-R594 IonicContact OD1-NH1 2.72Å; D591-R594 PolarHBondContact OD1-NH1 3.01Å; D591-T595 PolarHBondContact O-N 3.25Å; D591-T595 PolarHBondContact O-OG1 2.97Å
592	H	37.3	Very low	41.7	Very low	139 Å²	139	93.7 Å²	93.7	64%	0.644	51%	0.506	S	S	*	.	H	α-helix	trans	-63.7	-37.9	176.8	-159.4	63.1	0	0	0	112.5	D590 T595 L596	D590-H592 PolarHBondContact O-N 2.96Å; H592-T595 WeakPolarHBondContact CA-OG1 3.45Å; H592-T595 PolarHBondContact O-N 3.18Å; H592-T595 PolarHBondContact O-OG1 2.74Å; H592-L596 PolarHBondContact O-N 2.86Å
593	S	44.2	Very low	42	Very low	62 Å²	62	98.6 Å²	98.6	43%	0.434	53%	0.527	S	S	.	.	H	α-helix	trans	-67	-38.6	175.9	69.6	0	0	0	0	111.6	D590 D591 L596 L597	D590-S593 WeakPolarHBondContact O-CB 3.13Å; D590-S593 PolarHBondContact O-N 3.2Å; D590-S593 PolarHBondContact O-OG 3.34Å; D591-S593 VanDerWaalsContact C-N 3.32Å; D591-S593 PolarHBondContact O-N 3.45Å; S593-L596 PolarHBondContact O-N 3.48Å; S593-L597 PolarHBondContact O-N 3.37Å; S593-L597 VanDerWaalsContact O-N 3.13Å
594	R	44.8	Very low	42.5	Very low	124 Å²	124	101.2 Å²	101.2	47%	0.468	53%	0.534	S	S	.	.	H	α-helix	trans	-59	-47.6	172.5	-60.5	-178.1	174.2	120.2	5.5	111.3	S589 D591 L596 L597 I598	S589-R594 PolarHBondContact O-NH1 3.45Å; D591-R594 WeakPolarHBondContact O-CB 3.2Å; D591-R594 PolarHBondContact O-N 3.27Å; D591-R594 WeakPolarHBondContact OD1-CD 3.45Å; D591-R594 IonicContact OD1-CZ 3.26Å; D591-R594 IonicContact OD1-NE 3.6Å; D591-R594 IonicContact OD1-NH1 2.72Å; D591-R594 PolarHBondContact OD1-NH1 3.01Å; R594-L596 PolarHBondContact O-N 3Å; R594-L597 PolarHBondContact O-N 2.85Å; R594-I598 WeakPolarHBondContact O-CD1 3.33Å; R594-I598 WeakPolarHBondContact O-CG1 3.49Å; R594-I598 PolarHBondContact O-N 3.2Å
595	T	45.1	Very low	42.6	Very low	72 Å²	72	104.2 Å²	104.2	44%	0.442	53%	0.532	S	S	.	.	H	α-helix	trans	-64	-37.2	-179.8	36.1	0	0	0	0	114.1	D591 H592 I598 L599	D591-T595 PolarHBondContact O-N 3.25Å; D591-T595 PolarHBondContact O-OG1 2.97Å; H592-T595 WeakPolarHBondContact CA-OG1 3.45Å; H592-T595 PolarHBondContact O-N 3.18Å; H592-T595 PolarHBondContact O-OG1 2.74Å; T595-I598 PolarHBondContact O-N 3.42Å; T595-L599 PolarHBondContact O-N 3.09Å
596	L	44.2	Very low	42.7	Very low	95 Å²	95	104 Å²	104	50%	0.497	54%	0.542	S	S	.	.	H	α-helix	trans	-74	-34.2	179.6	-72.3	170	0	0	0	112.4	H592 S593 R594 I598 L599 N600	H592-L596 PolarHBondContact O-N 2.86Å; S593-L596 PolarHBondContact O-N 3.48Å; R594-L596 PolarHBondContact O-N 3Å; L596-I598 VanDerWaalsContact C-N 3.33Å; L596-I598 PolarHBondContact O-N 2.8Å; L596-L599 HydrophobicContact CD2-CD1 4.25Å; L596-L599 PolarHBondContact O-N 3.38Å; L596-N600 PolarHBondContact O-N 2.78Å; L596-N600 VanDerWaalsContact O-N 3.07Å
597	L	49.3	Very low	42.9	Very low	107 Å²	107	105 Å²	105	56%	0.56	55%	0.549	S	S	*	.	H	α-helix	trans	-60	-44	171.9	-130.7	77.6	0	0	0	111.7	S593 R594 L599 N600 N601	S593-L597 PolarHBondContact O-N 3.37Å; S593-L597 VanDerWaalsContact O-N 3.13Å; R594-L597 PolarHBondContact O-N 2.85Å; L597-L599 VanDerWaalsContact C-N 3.3Å; L597-L599 PolarHBondContact O-N 2.88Å; L597-N600 PolarHBondContact O-N 2.71Å; L597-N601 PolarHBondContact O-N 3.07Å
598	I	49.3	Very low	43	Very low	79 Å²	79	106.7 Å²	106.7	41%	0.405	55%	0.545	S	S	.	.	H	α-helix	trans	-63.6	-34.9	178	-66.9	164.9	0	0	0	111.6	R594 T595 L596 R602	R594-I598 WeakPolarHBondContact O-CD1 3.33Å; R594-I598 WeakPolarHBondContact O-CG1 3.49Å; R594-I598 PolarHBondContact O-N 3.2Å; T595-I598 PolarHBondContact O-N 3.42Å; L596-I598 VanDerWaalsContact C-N 3.33Å; L596-I598 PolarHBondContact O-N 2.8Å; I598-R602 PolarHBondContact O-N 3.22Å
599	L	47.3	Very low	42.8	Very low	102 Å²	102	111.2 Å²	111.2	53%	0.534	56%	0.563	S	S	.	*	H	α-helix	trans	-70.7	-41.5	176.3	-79.3	164.5	0	0	0	112.8	T595 L596 L597 R602	T595-L599 PolarHBondContact O-N 3.09Å; L596-L599 HydrophobicContact CD2-CD1 4.25Å; L596-L599 PolarHBondContact O-N 3.38Å; L597-L599 VanDerWaalsContact C-N 3.3Å; L597-L599 PolarHBondContact O-N 2.88Å; L599-R602 PolarHBondContact O-N 2.87Å
600	N	45	Very low	42.4	Very low	88 Å²	88	116.2 Å²	116.2	47%	0.471	57%	0.574	S	S	.	*	H	α-helix	trans	-67.3	-42.4	177.9	-165.2	-18.6	0	0	0	111.4	L596 L597 R602 Q603	L596-N600 PolarHBondContact O-N 2.78Å; L596-N600 VanDerWaalsContact O-N 3.07Å; L597-N600 PolarHBondContact O-N 2.71Å; N600-R602 PolarHBondContact O-N 2.97Å; N600-R602 VanDerWaalsContact O-N 3.17Å; N600-Q603 WeakPolarHBondContact O-CB 3.47Å; N600-Q603 PolarHBondContact O-N 2.99Å
601	N	47.7	Very low	41.8	Very low	80 Å²	80	123.1 Å²	123.1	43%	0.428	61%	0.605	S	S	.	*	H	α-helix	trans	-59.7	-30.3	176.6	-75.8	-8.9	0	0	0	113.1	L597 Q603 K604 Y605	L597-N601 PolarHBondContact O-N 3.07Å; N601-Q603 VanDerWaalsContact C-N 3.26Å; N601-Q603 PolarHBondContact O-N 2.91Å; N601-K604 PolarHBondContact O-N 3.04Å; N601-Y605 WeakPolarHBondContact O-CD2 3.26Å; N601-Y605 PolarHBondContact O-N 3.45Å
602	R	44.3	Very low	41.2	Very low	170 Å²	170	122.2 Å²	122.2	64%	0.642	61%	0.613	S	S	*	*	H	α-helix	trans	-64	-26	174.1	-81.3	-179.4	136.5	161.6	-3.6	114.2	I598 L599 N600	I598-R602 PolarHBondContact O-N 3.22Å; L599-R602 PolarHBondContact O-N 2.87Å; N600-R602 PolarHBondContact O-N 2.97Å; N600-R602 VanDerWaalsContact O-N 3.17Å
603	Q	45.1	Very low	41	Very low	141 Å²	141	120.4 Å²	120.4	66%	0.659	61%	0.614	S	S	*	*	H	α-helix	trans	-78.4	-21.6	176.1	-63.9	-178.3	-18.5	0	0	112.7	N600 N601 T606	N600-Q603 WeakPolarHBondContact O-CB 3.47Å; N600-Q603 PolarHBondContact O-N 2.99Å; N601-Q603 VanDerWaalsContact C-N 3.26Å; N601-Q603 PolarHBondContact O-N 2.91Å; Q603-T606 PolarHBondContact O-OG1 3.33Å
604	K	45.9	Very low	40.5	Very low	143 Å²	143	126 Å²	126	62%	0.622	63%	0.63	S	S	*	*	H	α-helix	trans	-82.2	-32.7	177.9	-65	-174.2	177.9	-178.3	0	112.8	N601 T606	N601-K604 PolarHBondContact O-N 3.04Å; K604-T606 VanDerWaalsContact C-N 3.31Å; K604-T606 PolarHBondContact O-N 2.92Å
605	Y	37.6	Very low	39.7	Very low	180 Å²	180	127.7 Å²	127.7	71%	0.706	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-6.1	176.8	-76.7	-74.5	0	0	0	115	N601	N601-Y605 WeakPolarHBondContact O-CD2 3.26Å; N601-Y605 PolarHBondContact O-N 3.45Å
606	T	37.4	Very low	39.1	Very low	101 Å²	101	129 Å²	129	62%	0.62	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-11.8	176.1	39.6	0	0	0	0	114.6	Q603 K604	Q603-T606 PolarHBondContact O-OG1 3.33Å; K604-T606 VanDerWaalsContact C-N 3.31Å; K604-T606 PolarHBondContact O-N 2.92Å
607	N	37.9	Very low	38.4	Very low	129 Å²	129	129.5 Å²	129.5	69%	0.69	67%	0.671	S	S	*	*	S	Bend	trans	-102.8	-1.1	-176.3	-73	5.2	0	0	0	114.7
608	T	36.1	Very low	37.8	Very low	110 Å²	110	130.7 Å²	130.7	68%	0.675	68%	0.678	S	S	*	*	S	Bend	trans	-102.9	18.9	-178.8	34.8	0	0	0	0	114.3
609	L	34.3	Very low	37.2	Very low	158 Å²	158	133 Å²	133	83%	0.827	69%	0.687	S	S	*	*	S	Bend	trans	-126.7	29.8	-176.8	-102.6	167.2	0	0	0	114.5
610	K	31.9	Very low	36.5	Very low	189 Å²	189	134 Å²	134	82%	0.822	69%	0.692	S	S	*	*			trans	-144.1	93.1	167.5	-73.5	-177.1	179.3	175.4	0	110.9
611	E	30.8	Very low	36	Very low	202 Å²	202	136.7 Å²	136.7	94%	0.944	70%	0.702	S	S	*	*				174.5	130.6	127.5	-98.3	172.6	-157.9	0	0	113.8
612	A	29.3	Very low	35.5	Very low	95 Å²	95	140.1 Å²	140.1	79%	0.785	72%	0.715	S	S	*	*			trans	-178.5	166.6	171.3	0	0	0	0	0	107.1
613	P	33.8	Very low	34.8	Very low	102 Å²	102	135.6 Å²	135.6	66%	0.662	71%	0.709	S	S	*	*			cis	-136.2	-161.6	-4.2	30.4	-5.7	0	0	0	113.6
614	K	33	Very low	34.3	Very low	178 Å²	178	136.2 Å²	136.2	77%	0.774	71%	0.712	S	S	*	*			trans	87.3	120.9	163.5	-54.3	164.9	-175	174.3	0	115.1
615	I	28.6	Very low	33.7	Very low	160 Å²	160	137 Å²	137	82%	0.821	72%	0.718	S	S	*	*			cis	84.7	104.5	42.7	-60.2	161.6	0	0	0	113.6
616	S	32.1	Very low	33.3	Very low	100 Å²	100	133 Å²	133	70%	0.699	72%	0.717	S	S	*	*				176.3	127.1	124.1	58.7	0	0	0	0	113.5
617	S	30.4	Very low	33.1	Very low	106 Å²	106	133.3 Å²	133.3	74%	0.741	72%	0.723	S	S	*	*			trans	47.2	146.8	136.5	70.2	0	0	0	0	121.6
618	D	35.3	Very low	33	Very low	132 Å²	132	135.7 Å²	135.7	71%	0.706	73%	0.73	S	S	*	*			cis	-169.2	171.2	19.6	-145.9	11.8	0	0	0	116.3
619	Q	38	Very low	32.9	Very low	128 Å²	128	134 Å²	134	60%	0.598	72%	0.723	S	S	*	*			trans	72.5	124.4	155.3	-58.7	-65	-62	0	0	123.5
620	N	33.1	Very low	32.9	Very low	121 Å²	121	132.8 Å²	132.8	65%	0.647	72%	0.717	S	S	*	*			trans	76.4	140.6	134.5	-60.1	-9.7	0	0	0	122.4
621	E	34.2	Very low	33.1	Very low	146 Å²	146	131.6 Å²	131.6	68%	0.682	71%	0.712	S	S	*	*			cis	-162.5	167.9	-11.3	-123.9	-162.6	124.2	0	0	113.8
622	H	35.5	Very low	33.2	Very low	151 Å²	151	129.1 Å²	129.1	70%	0.699	70%	0.704	S	S	*	*			trans	67.4	143.4	156.1	-94.1	53.9	0	0	0	119.9
623	C	30	Very low	33.4	Very low	76 Å²	76	131.6 Å²	131.6	51%	0.514	70%	0.697	S	S	.	*			cis	-164.5	149.9	-14.3	-138.6	0	0	0	0	113.9
624	Q	34.6	Very low	33.4	Very low	153 Å²	153	132.8 Å²	132.8	72%	0.715	69%	0.694	S	S	*	*			trans	65.3	142.6	151.4	-73.4	168.7	48.6	0	0	120.7
625	Q	33.6	Very low	33.5	Very low	159 Å²	159	130.5 Å²	130.5	74%	0.743	69%	0.689	S	S	*	*			cis	-158.5	144.2	-13.3	-133.2	168.7	25.3	0	0	113.8
626	S	28.8	Very low	33.6	Very low	98 Å²	98	130 Å²	130	69%	0.685	68%	0.683	S	S	*	*			trans	13.1	133.4	157	57.2	0	0	0	0	121.2
627	S	33.7	Very low	33.2	Very low	107 Å²	107	132.3 Å²	132.3	75%	0.748	69%	0.688	S	S	*	*				171.2	169.6	84.2	45.7	0	0	0	0	110.4
628	Q	35.4	Very low	33.3	Very low	179 Å²	179	134.6 Å²	134.6	84%	0.836	69%	0.69	S	S	*	*			cis	-171.2	162.1	-19.7	-101.3	-166	104.9	0	0	107.1
629	S	35	Very low	32.9	Very low	75 Å²	75	135.3 Å²	135.3	52%	0.524	69%	0.689	S	S	.	*			cis	-169.3	151.5	-25.4	82.5	0	0	0	0	110.9
630	N	33.5	Very low	32.4	Very low	131 Å²	131	137 Å²	137	70%	0.701	70%	0.697	S	S	*	*			trans	66.7	151.9	154.3	-66.7	-65.7	0	0	0	119.1
631	K	35.5	Very low	32.3	Very low	165 Å²	165	135.6 Å²	135.6	72%	0.717	70%	0.697	S	S	*	*			cis	-159.1	176.9	6	-121.6	159.7	-167.2	171.3	0	107.7
632	L	34.2	Very low	31.9	Very low	149 Å²	149	134.1 Å²	134.1	78%	0.78	70%	0.698	S	S	*	*			cis	-120.2	-168.3	8.9	-78	95	0	0	0	109.5
633	K	32.9	Very low	31.5	Very low	147 Å²	147	133.9 Å²	133.9	64%	0.639	70%	0.702	S	S	*	*			cis	71.3	141.9	22.2	-72.3	179.5	163.5	-78.1	0	115.2
634	E	33.1	Very low	31.5	Very low	127 Å²	127	135 Å²	135	59%	0.593	71%	0.71	S	S	*	*			cis	-165.7	-179.1	-11.2	-118.8	162.1	176.6	0	0	108.7
635	L	36.1	Very low	31.2	Very low	130 Å²	130	132.3 Å²	132.3	68%	0.681	71%	0.708	S	S	*	*			cis	-146.3	141.7	23.5	-75.5	171.1	0	0	0	113.8
636	Q	30.4	Very low	30.9	Very low	150 Å²	150	129.4 Å²	129.4	70%	0.701	71%	0.706	S	S	*	*				45.6	122.9	128.2	-57.4	175.9	-17.4	0	0	125.7
637	N	24.9	Very low	30.7	Very low	149 Å²	149	133.8 Å²	133.8	80%	0.797	71%	0.713	S	S	*	*				30.6	135.7	119.2	-52.5	9.4	0	0	0	123.4
638	I	32.5	Very low	30.4	Very low	154 Å²	154	139 Å²	139	79%	0.79	72%	0.716	S	S	*	*				174.6	122.9	124.5	-89.2	153.9	0	0	0	105.7
639	E	25.5	Very low	29.9	Very low	146 Å²	146	136.6 Å²	136.6	68%	0.682	71%	0.709	S	S	*	*			cis	95.3	131.5	40.5	-161.7	175	-144	0	0	112.8
640	H	28.9	Very low	29.5	Very low	164 Å²	164	138.7 Å²	138.7	76%	0.759	72%	0.719	S	S	*	*			trans	69.6	150.7	-179	-50.2	-52.9	0	0	0	117.7
641	S	29.1	Very low	29.2	Very low	92 Å²	92	138.4 Å²	138.4	64%	0.643	72%	0.722	S	S	*	*			cis	-167.7	157.2	-18.8	52.3	0	0	0	0	112.8
642	T	26.1	Very low	28.9	Very low	114 Å²	114	137.5 Å²	137.5	70%	0.699	73%	0.725	S	S	*	*			trans	62.9	139.8	147.1	46.8	0	0	0	0	122.9
643	D	28.2	Very low	28.7	Very low	147 Å²	147	138.7 Å²	138.7	79%	0.786	73%	0.73	S	S	*	*			trans	71.4	141.3	149.6	-60.8	-13.1	0	0	0	120.3
644	S	28.6	Very low	28.5	Very low	99 Å²	99	136.2 Å²	136.2	69%	0.692	73%	0.731	S	S	*	*			cis	-165.9	171.4	-11.6	49	0	0	0	0	111.4
645	S	30.2	Very low	28.4	Very low	96 Å²	96	139.5 Å²	139.5	67%	0.671	74%	0.744	S	S	*	*			trans	41.4	104.4	156.7	55.3	0	0	0	0	119.6
646	S	27.2	Very low	28.1	Very low	99 Å²	99	139.9 Å²	139.9	69%	0.692	75%	0.752	S	S	*	*				91.3	128.1	62.7	71	0	0	0	0	116.2
647	F	24.7	Very low	28.2	Very low	189 Å²	189	138.9 Å²	138.9	83%	0.829	76%	0.755	S	S	*	*			trans	48	103.2	143.6	-83.8	-80.2	0	0	0	120
648	R	25.8	Very low	28.4	Very low	216 Å²	216	140.1 Å²	140.1	82%	0.815	76%	0.756	S	S	*	*				173.1	148.9	92.7	-98.2	160.5	-176.4	-175	0.4	116.6
649	N	26.2	Very low	28.4	Very low	129 Å²	129	139.8 Å²	139.8	69%	0.69	75%	0.749	S	S	*	*			trans	70.4	115.8	142.6	-67.3	11.6	0	0	0	122.7
650	T	26.2	Very low	28.8	Very low	120 Å²	120	140.9 Å²	140.9	74%	0.736	75%	0.754	S	S	*	*				81.4	137.7	128.2	53.4	0	0	0	0	122.6
651	T	27.1	Very low	29	Very low	124 Å²	124	138.1 Å²	138.1	76%	0.761	75%	0.745	S	S	*	*			trans	75.3	142	156.9	38.1	0	0	0	0	120.1
652	D	28.6	Very low	29.4	Very low	147 Å²	147	138.4 Å²	138.4	79%	0.786	75%	0.747	S	S	*	*			trans	65.3	56	161.1	-57.5	-4.3	0	0	0	119.9	S654	D652-S654 PolarHBondContact O-N 3.28Å
653	I	29.9	Very low	30.2	Very low	174 Å²	174	139.2 Å²	139.2	89%	0.892	75%	0.751	S	S	*	*			trans	-78.3	94	155.3	-59.1	-179.3	0	0	0	109.2
654	S	28.6	Very low	31	Very low	95 Å²	95	135 Å²	135	66%	0.664	73%	0.732	S	S	*	*			trans	-118.2	131.7	167	-79.9	0	0	0	0	110.4	D652	D652-S654 PolarHBondContact O-N 3.28Å
655	K	31.3	Very low	32.2	Very low	195 Å²	195	132.8 Å²	132.8	85%	0.848	72%	0.717	S	S	*	*			trans	77.1	100.4	178.1	-46.4	155.9	-173.7	166.8	0	115.8
656	T	30.1	Very low	33.2	Very low	139 Å²	139	135.4 Å²	135.4	85%	0.853	72%	0.72	S	S	*	*				-167.8	105.5	118.8	26.1	0	0	0	0	109
657	V	32.2	Very low	34.7	Very low	128 Å²	128	136.2 Å²	136.2	78%	0.776	71%	0.713	S	S	*	*			trans	-138.4	109.1	163.7	178.8	0	0	0	0	106.4
658	E	30.2	Very low	36.2	Very low	175 Å²	175	132.8 Å²	132.8	82%	0.818	70%	0.699	S	S	*	*			trans	-74.4	127.5	173	-64.8	-179.3	134.5	0	0	108.4
659	K	32.8	Very low	37.4	Very low	147 Å²	147	127.1 Å²	127.1	64%	0.639	68%	0.682	S	S	*	*			trans	-106.2	91.5	-169.5	-162.7	177.2	-174.2	-71.2	0	109.6	D661	K659-D661 VanDerWaalsContact C-N 3.28Å; K659-D661 IonicContact NZ-OD1 2.58Å; K659-D661 PolarHBondContact NZ-OD1 2.85Å; K659-D661 IonicContact NZ-OD2 3.69Å; K659-D661 PolarHBondContact NZ-OD2 2.92Å; K659-D661 PolarHBondContact O-N 2.83Å
660	H	33.5	Very low	38.9	Very low	169 Å²	169	124.7 Å²	124.7	78%	0.782	67%	0.666	S	S	*	*			trans	-72.3	83	170.7	-80.1	-94.3	0	0	0	110.2	S662	H660-S662 PolarHBondContact O-N 2.89Å
661	D	31.7	Very low	40.6	Very low	106 Å²	106	121.3 Å²	121.3	57%	0.567	65%	0.65	S	S	*	*			trans	-83.6	83.2	167	-69.5	-36.2	0	0	0	109.4	K659	K659-D661 VanDerWaalsContact C-N 3.28Å; K659-D661 IonicContact NZ-OD1 2.58Å; K659-D661 PolarHBondContact NZ-OD1 2.85Å; K659-D661 IonicContact NZ-OD2 3.69Å; K659-D661 PolarHBondContact NZ-OD2 2.92Å; K659-D661 PolarHBondContact O-N 2.83Å
662	S	39	Very low	41.6	Very low	99 Å²	99	117.8 Å²	117.8	69%	0.692	63%	0.633	S	S	*	*			trans	-104.7	128.5	175.2	52.6	0	0	0	0	111.6	H660	H660-S662 PolarHBondContact O-N 2.89Å
663	V	42.6	Very low	42.8	Very low	130 Å²	130	114 Å²	114	79%	0.788	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-61.8	138.3	167.3	-177	0	0	0	0	108.6
664	P	44.1	Very low	44.1	Very low	60 Å²	60	111.7 Å²	111.7	39%	0.39	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-59.1	142.6	173.6	26.4	-35.2	0	0	0	110.5	E668 E669	P664-E668 HydrophobicContact CB-CB 4.49Å; P664-E669 HydrophobicContact CB-CG 4.45Å; P664-E669 HydrophobicContact CG-CG 4.43Å
665	S	54.2	Low	45.3	Very low	52 Å²	52	111.6 Å²	111.6	36%	0.364	59%	0.59	S	S	.	*	P	Polyproline II helix	trans	-74	156.4	176.5	65.2	0	0	0	0	111.6	E667 E668 E669	S665-E667 PolarHBondContact O-N 2.76Å; S665-E667 VanDerWaalsContact O-N 3.14Å; S665-E668 WeakPolarHBondContact CB-OE2 3.21Å; S665-E668 PolarHBondContact N-OE2 3.2Å; S665-E668 PolarHBondContact O-N 2.76Å; S665-E668 WeakPolarHBondContact OG-CG 3.27Å; S665-E668 PolarHBondContact OG-N 3.31Å; S665-E668 PolarHBondContact OG-OE2 2.96Å; S665-E669 PolarHBondContact O-N 3.14Å
666	M	51	Low	46	Very low	151 Å²	151	104.5 Å²	104.5	74%	0.744	56%	0.561	S	S	*	*	H	α-helix	trans	-53.9	-33.1	172.8	-175.2	-175.2	-67.4	0	0	111.9	K670	M666-K670 WeakPolarHBondContact O-CB 3.3Å; M666-K670 PolarHBondContact O-N 3.4Å
667	E	58.7	Low	47	Very low	115 Å²	115	103.8 Å²	103.8	54%	0.537	55%	0.546	S	S	.	.	H	α-helix	trans	-71.3	-31.6	177.5	-126.2	62.4	-134.3	0	0	112.7	S665 K670 A671	S665-E667 PolarHBondContact O-N 2.76Å; S665-E667 VanDerWaalsContact O-N 3.14Å; E667-K670 WeakPolarHBondContact OE1-CD 3.4Å; E667-K670 WeakPolarHBondContact OE1-CE 3.36Å; E667-K670 IonicContact OE1-NZ 3.61Å; E667-K670 PolarHBondContact OE1-NZ 2.92Å; E667-A671 VanDerWaalsContact O-CB 3.22Å; E667-A671 WeakPolarHBondContact O-CB 3.22Å; E667-A671 PolarHBondContact O-N 2.61Å
668	E	55.8	Low	48	Very low	117 Å²	117	107.3 Å²	107.3	55%	0.547	55%	0.545	S	S	.	.	H	α-helix	trans	-75.5	-42.2	174.7	-72.2	163.3	125.3	0	0	111.9	P664 S665 K670 A671 A672	P664-E668 HydrophobicContact CB-CB 4.49Å; S665-E668 WeakPolarHBondContact CB-OE2 3.21Å; S665-E668 PolarHBondContact N-OE2 3.2Å; S665-E668 PolarHBondContact O-N 2.76Å; S665-E668 WeakPolarHBondContact OG-CG 3.27Å; S665-E668 PolarHBondContact OG-N 3.31Å; S665-E668 PolarHBondContact OG-OE2 2.96Å; E668-K670 VanDerWaalsContact C-N 3.34Å; E668-A671 PolarHBondContact O-N 2.91Å; E668-A672 PolarHBondContact O-N 2.9Å
669	E	51	Low	48.6	Very low	98 Å²	98	104.2 Å²	104.2	46%	0.458	53%	0.531	S	S	.	.	H	α-helix	trans	-61.6	-43.9	172	-66.2	-171.5	151	0	0	111.1	P664 S665 A672 L673	P664-E669 HydrophobicContact CB-CG 4.45Å; P664-E669 HydrophobicContact CG-CG 4.43Å; S665-E669 PolarHBondContact O-N 3.14Å; E669-A672 PolarHBondContact O-N 3.16Å; E669-L673 WeakPolarHBondContact O-CB 3.5Å; E669-L673 WeakPolarHBondContact O-CG 3.45Å; E669-L673 PolarHBondContact O-N 2.99Å
670	K	57.9	Low	49.1	Very low	78 Å²	78	97.5 Å²	97.5	34%	0.339	50%	0.502	S	S	.	.	H	α-helix	trans	-63.8	-38.4	174.6	179.4	178	166.2	-164.2	0	112.1	M666 E667 E668 L673 Q674	M666-K670 WeakPolarHBondContact O-CB 3.3Å; M666-K670 PolarHBondContact O-N 3.4Å; E667-K670 WeakPolarHBondContact OE1-CD 3.4Å; E667-K670 WeakPolarHBondContact OE1-CE 3.36Å; E667-K670 IonicContact OE1-NZ 3.61Å; E667-K670 PolarHBondContact OE1-NZ 2.92Å; E668-K670 VanDerWaalsContact C-N 3.34Å; K670-L673 PolarHBondContact O-N 3.3Å; K670-Q674 VanDerWaalsContact O-CB 3.27Å; K670-Q674 WeakPolarHBondContact O-CB 3.48Å; K670-Q674 PolarHBondContact O-N 2.81Å
671	A	62.3	Low	49.3	Very low	49 Å²	49	95.2 Å²	95.2	41%	0.405	50%	0.495	S	S	.	.	H	α-helix	trans	-66	-42	174	0	0	0	0	0	112.1	E667 E668 Q674 L675	E667-A671 VanDerWaalsContact O-CB 3.22Å; E667-A671 WeakPolarHBondContact O-CB 3.22Å; E667-A671 PolarHBondContact O-N 2.61Å; E668-A671 PolarHBondContact O-N 2.91Å; A671-Q674 WeakPolarHBondContact O-CB 3.31Å; A671-Q674 PolarHBondContact O-N 3.34Å; A671-L675 WeakPolarHBondContact O-CG 3.35Å; A671-L675 PolarHBondContact O-N 2.73Å
672	A	49.3	Very low	50.3	Low	50 Å²	50	91.6 Å²	91.6	41%	0.413	48%	0.475	S	S	.	.	H	α-helix	trans	-62.3	-43.6	174	0	0	0	0	0	111.9	E668 E669 Q674 L675 L676	E668-A672 PolarHBondContact O-N 2.9Å; E669-A672 PolarHBondContact O-N 3.16Å; A672-Q674 VanDerWaalsContact C-N 3.32Å; A672-Q674 PolarHBondContact O-N 2.88Å; A672-L675 PolarHBondContact O-N 2.81Å; A672-L676 WeakPolarHBondContact O-CG 3.22Å; A672-L676 PolarHBondContact O-N 2.83Å
673	L	52.8	Low	50.6	Low	68 Å²	68	94 Å²	94	36%	0.356	47%	0.469	S	S	.	.	H	α-helix	trans	-63.5	-35.7	172.7	-72.4	168	0	0	0	112.5	I586 E669 K670 K677	I586-L673 HydrophobicContact CD1-CD2 4.2Å; E669-L673 WeakPolarHBondContact O-CB 3.5Å; E669-L673 WeakPolarHBondContact O-CG 3.45Å; E669-L673 PolarHBondContact O-N 2.99Å; K670-L673 PolarHBondContact O-N 3.3Å; L673-K677 VanDerWaalsContact O-CB 3.3Å; L673-K677 WeakPolarHBondContact O-CB 3.42Å; L673-K677 VanDerWaalsContact O-CG 3.26Å; L673-K677 WeakPolarHBondContact O-CG 3.33Å; L673-K677 PolarHBondContact O-N 2.92Å
674	Q	57	Low	50.9	Low	125 Å²	125	89.2 Å²	89.2	58%	0.584	44%	0.438	S	S	*	.	H	α-helix	trans	-69.3	-38.5	177	-163.2	76.6	22.9	0	0	111.7	K670 A671 A672 R678	K670-Q674 VanDerWaalsContact O-CB 3.27Å; K670-Q674 WeakPolarHBondContact O-CB 3.48Å; K670-Q674 PolarHBondContact O-N 2.81Å; A671-Q674 WeakPolarHBondContact O-CB 3.31Å; A671-Q674 PolarHBondContact O-N 3.34Å; A672-Q674 VanDerWaalsContact C-N 3.32Å; A672-Q674 PolarHBondContact O-N 2.88Å; Q674-R678 WeakPolarHBondContact O-CB 3.29Å; Q674-R678 PolarHBondContact O-N 2.77Å; Q674-R678 VanDerWaalsContact O-N 3.07Å
675	L	53.1	Low	51.2	Low	92 Å²	92	86.7 Å²	86.7	48%	0.482	42%	0.421	S	S	.	.	H	α-helix	trans	-65.4	-51.5	173.8	-73.8	168.4	0	0	0	111	A671 A672 K677 R678 E679	A671-L675 WeakPolarHBondContact O-CG 3.35Å; A671-L675 PolarHBondContact O-N 2.73Å; A672-L675 PolarHBondContact O-N 2.81Å; L675-K677 VanDerWaalsContact C-N 3.34Å; L675-K677 PolarHBondContact O-N 2.82Å; L675-R678 WeakPolarHBondContact O-CA 3.13Å; L675-R678 PolarHBondContact O-N 3.36Å; L675-E679 PolarHBondContact O-N 3.18Å
676	L	46.5	Very low	51.2	Low	47 Å²	47	84.4 Å²	84.4	25%	0.246	41%	0.405	C	S	.	.	H	α-helix	trans	-53.4	-49.8	175.7	-74.3	166.9	0	0	0	111.4	A672 R678 E679 T680	A672-L676 WeakPolarHBondContact O-CG 3.22Å; A672-L676 PolarHBondContact O-N 2.83Å; L676-R678 PolarHBondContact O-N 2.85Å; L676-E679 PolarHBondContact O-N 3.26Å; L676-T680 PolarHBondContact O-N 2.72Å; L676-T680 VanDerWaalsContact O-N 3.11Å; L676-T680 PolarHBondContact O-OG1 3.16Å
677	K	51.5	Low	51.3	Low	124 Å²	124	77.9 Å²	77.9	54%	0.539	38%	0.375	S	S	.	.	H	α-helix	trans	-62.1	-24.8	176.1	-77	-179.3	175.8	-171.9	0	114.4	L673 L675	L673-K677 VanDerWaalsContact O-CB 3.3Å; L673-K677 WeakPolarHBondContact O-CB 3.42Å; L673-K677 VanDerWaalsContact O-CG 3.26Å; L673-K677 WeakPolarHBondContact O-CG 3.33Å; L673-K677 PolarHBondContact O-N 2.92Å; L675-K677 VanDerWaalsContact C-N 3.34Å; L675-K677 PolarHBondContact O-N 2.82Å
678	R	52.9	Low	51.1	Low	201 Å²	201	73.6 Å²	73.6	76%	0.758	36%	0.357	S	S	*	.	H	α-helix	trans	-89.5	-34.1	-178.6	-178.1	174.1	177.2	134.9	0.2	112.9	Q674 L675 L676	Q674-R678 WeakPolarHBondContact O-CB 3.29Å; Q674-R678 PolarHBondContact O-N 2.77Å; Q674-R678 VanDerWaalsContact O-N 3.07Å; L675-R678 WeakPolarHBondContact O-CA 3.13Å; L675-R678 PolarHBondContact O-N 3.36Å; L676-R678 PolarHBondContact O-N 2.85Å
679	E	43.6	Very low	51.1	Low	110 Å²	110	71.8 Å²	71.8	51%	0.514	35%	0.347	S	S	.	.	H	α-helix	trans	-97.7	-28.9	-170.6	-66.2	178.6	176.5	0	0	113	R321 L675 L676 I681	R321-E679 PolarHBondContact NH1-O 2.87Å; L675-E679 PolarHBondContact O-N 3.18Å; L676-E679 PolarHBondContact O-N 3.26Å; E679-I681 PolarHBondContact O-N 3.37Å
680	T	43	Very low	51.4	Low	6 Å²	6	68.1 Å²	68.1	4%	0.037	33%	0.33	C	S	.	.			trans	-99.6	33.6	-174.8	64.4	0	0	0	0	114.9	D322 F579 L676 N682	D322-T680 HydrophobicContact CB-CG2 4.15Å; F579-T680 WeakPolarHBondContact CE2-OG1 3.47Å; F579-T680 WeakPolarHBondContact CZ-OG1 3.38Å; L676-T680 PolarHBondContact O-N 2.72Å; L676-T680 VanDerWaalsContact O-N 3.11Å; L676-T680 PolarHBondContact O-OG1 3.16Å; T680-N682 PolarHBondContact O-N 3.11Å; T680-N682 VanDerWaalsContact O-N 3.08Å
681	I	37.4	Very low	51.3	Low	122 Å²	122	66.8 Å²	66.8	63%	0.626	33%	0.326	S	S	*	.			trans	-72.4	99.9	165.2	-53.1	174	0	0	0	108.7	R321 E679	R321-I681 PolarHBondContact NH1-O 2.66Å; E679-I681 PolarHBondContact O-N 3.37Å
682	N	53.3	Low	51.2	Low	30 Å²	30	70.7 Å²	70.7	16%	0.16	34%	0.337	C	S	.	.			trans	-155.5	164.2	163.6	-97.5	-14.6	0	0	0	109	V319 F424 N577 T680	V319-N682 WeakPolarHBondContact O-CB 3.18Å; F424-N682 WeakPolarHBondContact CE1-ND2 3.49Å; N577-N682 VanDerWaalsContact CB-O 3.22Å; N577-N682 WeakPolarHBondContact CB-O 3.19Å; T680-N682 PolarHBondContact O-N 3.11Å; T680-N682 VanDerWaalsContact O-N 3.08Å
683	W	44.3	Very low	51.9	Low	150 Å²	150	73.3 Å²	73.3	57%	0.568	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	154.8	-162.9	-41.7	88.5	0	0	0	114.3	I574	I574-W683 HydrophobicContact CG2-CB 3.57Å; I574-W683 HydrophobicContact CG2-CD2 3.67Å; I574-W683 HydrophobicContact CG2-CE3 3.48Å; I574-W683 VanDerWaalsContact CG2-CE3 3.48Å; I574-W683 HydrophobicContact CG2-CG 3.75Å; I574-W683 HydrophobicContact CG2-CZ3 4.3Å
684	E	48.6	Very low	52.2	Low	28 Å²	28	73.4 Å²	73.4	13%	0.131	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	141.2	165.3	-173.6	-175.9	-171.4	0	0	109.7	T316 I317 A318 I574 V575 V686	T316-E684 WeakPolarHBondContact CB-OE1 3.43Å; T316-E684 WeakPolarHBondContact CG2-OE1 3.39Å; I317-E684 CarbonylContact O-C 3.54Å; I317-E684 WeakPolarHBondContact O-CA 3.4Å; A318-E684 HydrophobicContact CB-CG 4.44Å; I574-E684 CarbonylContact C-O 3.52Å; I574-E684 WeakPolarHBondContact CA-O 3.23Å; V575-E684 HydrophobicContact CB-CB 4.46Å; V575-E684 PolarHBondContact N-O 2.76Å; V575-E684 PolarHBondContact O-N 2.8Å; E684-V686 HydrophobicContact CG-CG2 3.77Å
685	L	51.6	Low	52.6	Low	7 Å²	7	73.1 Å²	73.1	4%	0.037	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	115.6	175.6	-167.2	78.7	0	0	0	108.9	T316 I317 L471 F572 V573 I574	T316-L685 CarbonylContact C-O 3.52Å; T316-L685 VanDerWaalsContact CA-O 3.25Å; T316-L685 WeakPolarHBondContact CA-O 3.46Å; I317-L685 HydrophobicContact CB-CB 4.13Å; I317-L685 HydrophobicContact CD1-CD2 3.86Å; I317-L685 HydrophobicContact CG1-CD2 4.4Å; I317-L685 PolarHBondContact N-O 2.8Å; I317-L685 PolarHBondContact O-N 3.22Å; L471-L685 HydrophobicContact CD1-CD1 4.06Å; F572-L685 HydrophobicContact CB-CD1 3.88Å; F572-L685 HydrophobicContact CB-CD2 4.09Å; F572-L685 HydrophobicContact CB-CG 3.8Å; F572-L685 HydrophobicContact CD1-CD2 3.91Å; F572-L685 HydrophobicContact CD1-CG 3.8Å; F572-L685 HydrophobicContact CG-CD2 4.1Å; F572-L685 HydrophobicContact CG-CG 4.12Å; V573-L685 WeakPolarHBondContact O-CA 3.49Å; I574-L685 HydrophobicContact CG1-CD1 3.88Å
686	V	53.4	Low	53.4	Low	5 Å²	5	73.1 Å²	73.1	3%	0.03	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	137.1	-172.2	-176.2	0	0	0	0	110.5	T316 F572 V573 V575 E684 S688	T316-V686 HydrophobicContact CG2-CB 4.32Å; T316-V686 HydrophobicContact CG2-CG1 4.12Å; T316-V686 HydrophobicContact CG2-CG2 3.96Å; F572-V686 CarbonylContact C-O 3.59Å; F572-V686 WeakPolarHBondContact CA-O 3.37Å; V573-V686 PolarHBondContact N-O 3.47Å; V573-V686 PolarHBondContact O-N 3.14Å; V575-V686 HydrophobicContact CG2-CB 4.37Å; V575-V686 HydrophobicContact CG2-CG2 3.88Å; E684-V686 HydrophobicContact CG-CG2 3.77Å; V686-S688 PolarHBondContact O-N 3.37Å
687	S	52.6	Low	54.3	Low	14 Å²	14	75.6 Å²	75.6	10%	0.098	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	135.2	176.6	-171.8	0	0	0	0	112	K689 E690 L691	S687-K689 VanDerWaalsContact C-N 3.27Å; S687-K689 PolarHBondContact O-N 2.8Å; S687-E690 CarbonylContact O-C 3.52Å; S687-E690 WeakPolarHBondContact O-CA 3.41Å; S687-E690 PolarHBondContact O-N 3.33Å; S687-L691 PolarHBondContact O-N 2.67Å
688	S	54.9	Low	54.8	Low	24 Å²	24	74.1 Å²	74.1	17%	0.168	35%	0.345	C	S	.	.	H	α-helix	trans	-59	-35.5	-179.5	-60.1	0	0	0	0	113.2	H571 V573 V686 E690 L691 E692	H571-S688 VanDerWaalsContact CB-OG 3.22Å; H571-S688 WeakPolarHBondContact CB-OG 3.01Å; H571-S688 PolarHBondContact O-N 2.92Å; H571-S688 PolarHBondContact O-OG 3.12Å; V573-S688 WeakPolarHBondContact CG2-OG 3.44Å; V686-S688 PolarHBondContact O-N 3.37Å; S688-E690 VanDerWaalsContact C-N 3.3Å; S688-E690 PolarHBondContact O-N 2.81Å; S688-L691 PolarHBondContact O-N 3.19Å; S688-E692 WeakPolarHBondContact O-CG 3.26Å; S688-E692 PolarHBondContact O-N 3.46Å
689	K	56.2	Low	55.6	Low	79 Å²	79	69.9 Å²	69.9	34%	0.343	33%	0.333	S	S	.	.	H	α-helix	trans	-65.1	-34.9	174.2	-70.8	-175.6	-175.7	166.3	0	112	C570 S687 L693	C570-K689 PolarHBondContact SG-NZ 3.47Å; S687-K689 VanDerWaalsContact C-N 3.27Å; S687-K689 PolarHBondContact O-N 2.8Å; K689-L693 VanDerWaalsContact O-CB 3.26Å; K689-L693 WeakPolarHBondContact O-CB 3.2Å; K689-L693 WeakPolarHBondContact O-CD1 3.36Å; K689-L693 WeakPolarHBondContact O-CG 3.28Å; K689-L693 PolarHBondContact O-N 2.79Å
690	E	56.5	Low	56.9	Low	21 Å²	21	71 Å²	71	10%	0.098	34%	0.337	C	S	.	.	H	α-helix	trans	-74.1	-34.1	173.7	-177.1	159.5	-168.9	0	0	111.6	R315 S687 S688 K694	R315-E690 WeakPolarHBondContact CG-OE2 3.15Å; R315-E690 IonicContact CZ-OE1 2.61Å; R315-E690 IonicContact NE-OE1 3.26Å; R315-E690 PolarHBondContact NE-OE1 2.82Å; R315-E690 IonicContact NE-OE2 3.71Å; R315-E690 PolarHBondContact NE-OE2 3.32Å; R315-E690 IonicContact NH2-OE1 3.55Å; R315-E690 PolarHBondContact NH2-OE1 3.49Å; S687-E690 CarbonylContact O-C 3.52Å; S687-E690 WeakPolarHBondContact O-CA 3.41Å; S687-E690 PolarHBondContact O-N 3.33Å; S688-E690 VanDerWaalsContact C-N 3.3Å; S688-E690 PolarHBondContact O-N 2.81Å; E690-K694 WeakPolarHBondContact O-CB 3.34Å; E690-K694 PolarHBondContact O-N 3.48Å
691	L	56.4	Low	58	Low	50 Å²	50	78.6 Å²	78.6	26%	0.262	36%	0.364	S	S	.	.	H	α-helix	trans	-62.8	-49.6	172.9	-173	64.3	0	0	0	111.5	V573 S687 S688 L693 K694 E695	V573-L691 HydrophobicContact CB-CD2 4.33Å; V573-L691 HydrophobicContact CG1-CD2 4.19Å; V573-L691 HydrophobicContact CG2-CD2 4.04Å; S687-L691 PolarHBondContact O-N 2.67Å; S688-L691 PolarHBondContact O-N 3.19Å; L691-L693 PolarHBondContact O-N 3.1Å; L691-K694 PolarHBondContact O-N 2.97Å; L691-E695 WeakPolarHBondContact O-CG 3.45Å; L691-E695 PolarHBondContact O-N 3.11Å
692	E	61	Low	59.5	Low	132 Å²	132	77.2 Å²	77.2	62%	0.617	35%	0.354	S	S	*	.	H	α-helix	trans	-61	-43.5	176.1	-72.1	177	-175	0	0	112.3	S688 L696	S688-E692 WeakPolarHBondContact O-CG 3.26Å; S688-E692 PolarHBondContact O-N 3.46Å; E692-L696 WeakPolarHBondContact O-CB 3.32Å; E692-L696 PolarHBondContact O-N 3.21Å
693	L	63.7	Low	60.4	Low	104 Å²	104	80.4 Å²	80.4	55%	0.545	37%	0.368	S	S	.	.	H	α-helix	trans	-64.1	-41.4	174.7	-75.9	169.5	0	0	0	111.6	K689 L691 L696 E697	K689-L693 VanDerWaalsContact O-CB 3.26Å; K689-L693 WeakPolarHBondContact O-CB 3.2Å; K689-L693 WeakPolarHBondContact O-CD1 3.36Å; K689-L693 WeakPolarHBondContact O-CG 3.28Å; K689-L693 PolarHBondContact O-N 2.79Å; L691-L693 PolarHBondContact O-N 3.1Å; L693-L696 PolarHBondContact O-N 2.68Å; L693-E697 WeakPolarHBondContact O-CB 3.22Å; L693-E697 VanDerWaalsContact O-CG 3.29Å; L693-E697 WeakPolarHBondContact O-CG 3.45Å; L693-E697 PolarHBondContact O-N 3.3Å
694	K	58.6	Low	61.7	Low	70 Å²	70	79.7 Å²	79.7	30%	0.304	37%	0.369	S	S	.	.	H	α-helix	trans	-68	-40.2	179.8	-177	177.9	179.5	-178.6	0	111.8	E690 L691 E698	E690-K694 WeakPolarHBondContact O-CB 3.34Å; E690-K694 PolarHBondContact O-N 3.48Å; L691-K694 PolarHBondContact O-N 2.97Å; K694-E698 WeakPolarHBondContact O-CB 3.4Å; K694-E698 WeakPolarHBondContact O-CG 3.18Å; K694-E698 PolarHBondContact O-N 3.49Å
695	E	66.8	Low	62.1	Low	120 Å²	120	83.2 Å²	83.2	56%	0.561	39%	0.387	S	S	*	.	H	α-helix	trans	-64	-44.6	172.1	-74.6	-177.2	-176.1	0	0	111.5	L691 E698 E699	L691-E695 WeakPolarHBondContact O-CG 3.45Å; L691-E695 PolarHBondContact O-N 3.11Å; E695-E698 PolarHBondContact O-N 2.89Å; E695-E699 WeakPolarHBondContact O-CB 3.31Å; E695-E699 PolarHBondContact O-N 2.83Å
696	L	69.3	Low	62.6	Low	91 Å²	91	89.6 Å²	89.6	48%	0.476	41%	0.414	S	S	.	.	H	α-helix	trans	-74.8	-29.5	-178.6	-172.1	141.8	0	0	0	112.9	E692 L693 K700	E692-L696 WeakPolarHBondContact O-CB 3.32Å; E692-L696 PolarHBondContact O-N 3.21Å; L693-L696 PolarHBondContact O-N 2.68Å; L696-K700 HydrophobicContact CD2-CD 3.93Å; L696-K700 WeakPolarHBondContact O-CB 3.41Å; L696-K700 WeakPolarHBondContact O-CD 3.37Å; L696-K700 VanDerWaalsContact O-CG 3.22Å; L696-K700 WeakPolarHBondContact O-CG 3.38Å; L696-K700 PolarHBondContact O-N 3.14Å
697	E	64.7	Low	63.2	Low	99 Å²	99	92.4 Å²	92.4	46%	0.463	43%	0.429	S	S	.	.	H	α-helix	trans	-75.2	-37.3	168.5	-76.6	-169.5	166.7	0	0	112	L693 E699 R701	L693-E697 WeakPolarHBondContact O-CB 3.22Å; L693-E697 VanDerWaalsContact O-CG 3.29Å; L693-E697 WeakPolarHBondContact O-CG 3.45Å; L693-E697 PolarHBondContact O-N 3.3Å; E697-E699 VanDerWaalsContact C-N 3.35Å; E697-R701 WeakPolarHBondContact O-CB 3.42Å; E697-R701 PolarHBondContact O-N 3.08Å
698	E	62.6	Low	63.5	Low	94 Å²	94	94.5 Å²	94.5	44%	0.439	44%	0.443	S	S	.	.	H	α-helix	trans	-60.8	-44.2	169.5	-93.7	-162.6	-152.2	0	0	111.2	K694 E695 R701 K702	K694-E698 WeakPolarHBondContact O-CB 3.4Å; K694-E698 WeakPolarHBondContact O-CG 3.18Å; K694-E698 PolarHBondContact O-N 3.49Å; E695-E698 PolarHBondContact O-N 2.89Å; E698-R701 CarbonylContact O-C 3.58Å; E698-R701 PolarHBondContact O-N 3.32Å; E698-K702 WeakPolarHBondContact O-CB 3.43Å; E698-K702 WeakPolarHBondContact O-CD 3.1Å; E698-K702 WeakPolarHBondContact O-CG 3.33Å; E698-K702 PolarHBondContact O-N 2.99Å; E698-K702 VanDerWaalsContact OE2-CE 3.23Å; E698-K702 WeakPolarHBondContact OE2-CE 3.41Å; E698-K702 IonicContact OE2-NZ 3.8Å; E698-K702 PolarHBondContact OE2-NZ 2.78Å
699	E	69.6	Low	63.7	Low	112 Å²	112	99.3 Å²	99.3	52%	0.523	47%	0.466	S	S	.	.	H	α-helix	trans	-70.2	-40.2	179.6	-160.6	58.6	-155.3	0	0	111.5	E695 E697 R701 K702 Q703	E695-E699 WeakPolarHBondContact O-CB 3.31Å; E695-E699 PolarHBondContact O-N 2.83Å; E697-E699 VanDerWaalsContact C-N 3.35Å; E699-R701 VanDerWaalsContact C-N 3.27Å; E699-R701 PolarHBondContact O-N 3.2Å; E699-K702 PolarHBondContact O-N 2.65Å; E699-K702 VanDerWaalsContact OE2-CD 3.22Å; E699-K702 WeakPolarHBondContact OE2-CD 3.48Å; E699-K702 IonicContact OE2-NZ 2.84Å; E699-Q703 VanDerWaalsContact O-CB 3.26Å; E699-Q703 WeakPolarHBondContact O-CB 3.18Å; E699-Q703 PolarHBondContact O-N 2.94Å
700	K	71.2	Confident	63.8	Low	134 Å²	134	102.4 Å²	102.4	58%	0.583	48%	0.479	S	S	*	.	H	α-helix	trans	-59	-36.5	167.3	-78.1	169.6	178.4	168.7	0	112.5	L696 F704	L696-K700 HydrophobicContact CD2-CD 3.93Å; L696-K700 WeakPolarHBondContact O-CB 3.41Å; L696-K700 WeakPolarHBondContact O-CD 3.37Å; L696-K700 VanDerWaalsContact O-CG 3.22Å; L696-K700 WeakPolarHBondContact O-CG 3.38Å; L696-K700 PolarHBondContact O-N 3.14Å; K700-F704 WeakPolarHBondContact O-CB 3.36Å; K700-F704 PolarHBondContact O-N 3.46Å
701	R	66	Low	63.6	Low	164 Å²	164	105 Å²	105	62%	0.619	50%	0.5	S	S	*	.	H	α-helix	trans	-75.2	-38	178.6	-175.3	-178.7	177.4	104	3.9	111.8	E697 E698 E699 M705	E697-R701 WeakPolarHBondContact O-CB 3.42Å; E697-R701 PolarHBondContact O-N 3.08Å; E698-R701 CarbonylContact O-C 3.58Å; E698-R701 PolarHBondContact O-N 3.32Å; E699-R701 VanDerWaalsContact C-N 3.27Å; E699-R701 PolarHBondContact O-N 3.2Å; R701-M705 WeakPolarHBondContact O-CB 3.46Å; R701-M705 WeakPolarHBondContact O-CG 3.42Å; R701-M705 PolarHBondContact O-N 3.3Å
702	K	69.5	Low	63.1	Low	94 Å²	94	105.6 Å²	105.6	41%	0.409	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-50.3	172	-72.2	156.6	-166.9	160.2	0	109.3	E698 E699 M705 F706	E698-K702 WeakPolarHBondContact O-CB 3.43Å; E698-K702 WeakPolarHBondContact O-CD 3.1Å; E698-K702 WeakPolarHBondContact O-CG 3.33Å; E698-K702 PolarHBondContact O-N 2.99Å; E698-K702 VanDerWaalsContact OE2-CE 3.23Å; E698-K702 WeakPolarHBondContact OE2-CE 3.41Å; E698-K702 IonicContact OE2-NZ 3.8Å; E698-K702 PolarHBondContact OE2-NZ 2.78Å; E699-K702 PolarHBondContact O-N 2.65Å; E699-K702 VanDerWaalsContact OE2-CD 3.22Å; E699-K702 WeakPolarHBondContact OE2-CD 3.48Å; E699-K702 IonicContact OE2-NZ 2.84Å; K702-M705 PolarHBondContact O-N 3.28Å; K702-F706 WeakPolarHBondContact O-CB 3.39Å; K702-F706 PolarHBondContact O-N 2.86Å
703	Q	71.6	Confident	62.8	Low	97 Å²	97	105.2 Å²	105.2	45%	0.453	51%	0.51	S	S	.	.	H	α-helix	trans	-59.5	-47.7	174.8	-174.6	59.7	46.7	0	0	111.7	E699 M705 F706 D707	E699-Q703 VanDerWaalsContact O-CB 3.26Å; E699-Q703 WeakPolarHBondContact O-CB 3.18Å; E699-Q703 PolarHBondContact O-N 2.94Å; Q703-M705 PolarHBondContact O-N 2.98Å; Q703-F706 PolarHBondContact O-N 3.45Å; Q703-F706 VanDerWaalsContact O-N 3.14Å; Q703-D707 PolarHBondContact NE2-OD1 3.07Å; Q703-D707 PolarHBondContact NE2-OD2 3.04Å; Q703-D707 WeakPolarHBondContact O-CB 3.48Å; Q703-D707 PolarHBondContact O-N 3.09Å
704	F	71.3	Confident	62.3	Low	135 Å²	135	102.6 Å²	102.6	59%	0.592	50%	0.499	S	S	*	.	H	α-helix	trans	-61.2	-43.3	176.3	178	-97.3	0	0	0	112.4	K700 F706 D707 C708	K700-F704 WeakPolarHBondContact O-CB 3.36Å; K700-F704 PolarHBondContact O-N 3.46Å; F704-F706 VanDerWaalsContact C-N 3.34Å; F704-D707 PolarHBondContact O-N 3.33Å; F704-C708 VanDerWaalsContact CZ-SG 3.57Å; F704-C708 VanDerWaalsContact O-CB 3.28Å; F704-C708 WeakPolarHBondContact O-CB 3.43Å; F704-C708 PolarHBondContact O-N 2.96Å; F704-C708 PolarHBondContact O-SG 3.02Å
705	M	57	Low	62.1	Low	101 Å²	101	105.4 Å²	105.4	50%	0.498	51%	0.514	S	S	.	.	H	α-helix	trans	-64.6	-39.3	173	-72.2	-151.3	-43	0	0	111.7	R701 K702 Q703 C708 I709	R701-M705 WeakPolarHBondContact O-CB 3.46Å; R701-M705 WeakPolarHBondContact O-CG 3.42Å; R701-M705 PolarHBondContact O-N 3.3Å; K702-M705 PolarHBondContact O-N 3.28Å; Q703-M705 PolarHBondContact O-N 2.98Å; M705-C708 PolarHBondContact O-N 3.41Å; M705-I709 WeakPolarHBondContact O-CB 3.1Å; M705-I709 WeakPolarHBondContact O-CD1 3.27Å; M705-I709 WeakPolarHBondContact O-CG1 3.36Å; M705-I709 PolarHBondContact O-N 2.91Å
706	F	62.8	Low	61.5	Low	141 Å²	141	103.7 Å²	103.7	62%	0.618	51%	0.508	S	S	*	.	H	α-helix	trans	-65.8	-41.6	178.9	-152.9	-82.6	0	0	0	111.3	K702 Q703 F704 I709 K710	K702-F706 WeakPolarHBondContact O-CB 3.39Å; K702-F706 PolarHBondContact O-N 2.86Å; Q703-F706 PolarHBondContact O-N 3.45Å; Q703-F706 VanDerWaalsContact O-N 3.14Å; F704-F706 VanDerWaalsContact C-N 3.34Å; F706-I709 PolarHBondContact O-N 2.98Å; F706-K710 WeakPolarHBondContact O-CB 3.13Å; F706-K710 PolarHBondContact O-N 3.02Å
707	D	65.2	Low	61.1	Low	64 Å²	64	103.7 Å²	103.7	34%	0.342	51%	0.508	S	S	.	.	H	α-helix	trans	-71.2	-33.3	174.3	-71.5	-34.4	0	0	0	112.1	Q703 F704 S711	Q703-D707 PolarHBondContact NE2-OD1 3.07Å; Q703-D707 PolarHBondContact NE2-OD2 3.04Å; Q703-D707 WeakPolarHBondContact O-CB 3.48Å; Q703-D707 PolarHBondContact O-N 3.09Å; F704-D707 PolarHBondContact O-N 3.33Å; D707-S711 WeakPolarHBondContact O-CB 3.42Å; D707-S711 PolarHBondContact O-N 3.22Å; D707-S711 PolarHBondContact O-OG 3.14Å
708	C	59.1	Low	61.3	Low	59 Å²	59	104.5 Å²	104.5	40%	0.399	52%	0.522	S	S	.	.	H	α-helix	trans	-66.1	-44.9	169.8	-78.7	0	0	0	0	112.1	F704 M705 K710 S711 A712	F704-C708 VanDerWaalsContact CZ-SG 3.57Å; F704-C708 VanDerWaalsContact O-CB 3.28Å; F704-C708 WeakPolarHBondContact O-CB 3.43Å; F704-C708 PolarHBondContact O-N 2.96Å; F704-C708 PolarHBondContact O-SG 3.02Å; M705-C708 PolarHBondContact O-N 3.41Å; C708-K710 VanDerWaalsContact C-N 3.31Å; C708-K710 PolarHBondContact O-N 2.67Å; C708-S711 CarbonylContact O-C 3.58Å; C708-S711 PolarHBondContact O-N 3.31Å; C708-A712 WeakPolarHBondContact O-CB 3.45Å; C708-A712 PolarHBondContact O-N 3.34Å
709	I	58.8	Low	61.9	Low	124 Å²	124	102.2 Å²	102.2	64%	0.636	51%	0.512	S	S	*	.	H	α-helix	trans	-63.5	-39.1	176	-71.1	162.1	0	0	0	110.5	M705 F706 A712	M705-I709 WeakPolarHBondContact O-CB 3.1Å; M705-I709 WeakPolarHBondContact O-CD1 3.27Å; M705-I709 WeakPolarHBondContact O-CG1 3.36Å; M705-I709 PolarHBondContact O-N 2.91Å; F706-I709 PolarHBondContact O-N 2.98Å; I709-A712 PolarHBondContact O-N 3.43Å
710	K	58.2	Low	62.2	Low	145 Å²	145	97.7 Å²	97.7	63%	0.63	49%	0.492	S	S	*	.	H	α-helix	trans	-76.1	-25.6	178	-174.8	-179.1	173.3	-166.5	0	113.5	F706 C708	F706-K710 WeakPolarHBondContact O-CB 3.13Å; F706-K710 PolarHBondContact O-N 3.02Å; C708-K710 VanDerWaalsContact C-N 3.31Å; C708-K710 PolarHBondContact O-N 2.67Å
711	S	51.2	Low	62.3	Low	76 Å²	76	97 Å²	97	53%	0.531	50%	0.5	S	S	.	.	H	α-helix	trans	-88.9	-15.4	172.3	-54	0	0	0	0	112.4	D707 C708 E713 L716	D707-S711 WeakPolarHBondContact O-CB 3.42Å; D707-S711 PolarHBondContact O-N 3.22Å; D707-S711 PolarHBondContact O-OG 3.14Å; C708-S711 CarbonylContact O-C 3.58Å; C708-S711 PolarHBondContact O-N 3.31Å; S711-E713 PolarHBondContact O-N 3.09Å; S711-L716 WeakPolarHBondContact O-CD1 3.44Å
712	A	47.6	Very low	62.9	Low	62 Å²	62	90.7 Å²	90.7	51%	0.512	48%	0.482	S	S	.	.			trans	-79.1	49.7	168	0	0	0	0	0	110.7	C708 I709	C708-A712 WeakPolarHBondContact O-CB 3.45Å; C708-A712 PolarHBondContact O-N 3.34Å; I709-A712 PolarHBondContact O-N 3.43Å
713	E	54.8	Low	63.3	Low	123 Å²	123	86.7 Å²	86.7	58%	0.575	47%	0.466	S	S	*	.			trans	-61.4	132.9	162.7	-71.3	-168.8	138.9	0	0	108.2	S711 E715 L716	S711-E713 PolarHBondContact O-N 3.09Å; E713-E715 PolarHBondContact O-N 2.99Å; E713-L716 HydrophobicContact CB-CD1 4.38Å; E713-L716 WeakPolarHBondContact O-CB 3.45Å; E713-L716 PolarHBondContact O-N 2.9Å
714	P	52.7	Low	63.4	Low	50 Å²	50	86.8 Å²	86.8	33%	0.325	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	0.7	-169.8	26	-35.5	0	0	0	114.7	L716 Q739	P714-L716 PolarHBondContact O-N 3.45Å; P714-Q739 HydrophobicContact CB-CG 3.56Å; P714-Q739 HydrophobicContact CG-CG 3.51Å
715	E	53.3	Low	63.7	Low	129 Å²	129	86 Å²	86	60%	0.603	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-20.2	166.6	-57.1	-161.5	163.1	0	0	112.8	E713 R735	E713-E715 PolarHBondContact O-N 2.99Å; E715-R735 PolarHBondContact O-NE 3.03Å; E715-R735 VanDerWaalsContact O-NE 3.14Å; E715-R735 PolarHBondContact O-NH2 3.5Å; E715-R735 VanDerWaalsContact O-NH2 3.09Å
716	L	54.8	Low	65.1	Low	83 Å²	83	82 Å²	82	44%	0.435	46%	0.462	S	S	.	.	S	Bend	trans	-104.9	-3.8	-168	-59.3	165.3	0	0	0	114.5	S711 E713 P714 Y930	S711-L716 WeakPolarHBondContact O-CD1 3.44Å; E713-L716 HydrophobicContact CB-CD1 4.38Å; E713-L716 WeakPolarHBondContact O-CB 3.45Å; E713-L716 PolarHBondContact O-N 2.9Å; P714-L716 PolarHBondContact O-N 3.45Å; L716-Y930 WeakPolarHBondContact CD1-OH 3.32Å; L716-Y930 HydrophobicContact CD2-CE1 3.65Å
717	L	62	Low	66.1	Low	92 Å²	92	80 Å²	80	48%	0.482	45%	0.454	S	S	.	.	S	Bend	trans	-68.3	140.2	170.1	-67.5	175.2	0	0	0	110	I719	L717-I719 PolarHBondContact O-N 2.88Å
718	P	67.4	Low	67.2	Low	116 Å²	116	77.3 Å²	77.3	75%	0.753	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-63.6	130.6	173.8	27.9	-33.7	0	0	0	109.5
719	I	75.1	Confident	68.5	Low	46 Å²	46	75.6 Å²	75.6	24%	0.236	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-74	129.1	179.2	-65.8	174.9	0	0	0	108.5	L717 T721 V731 V734 R735	L717-I719 PolarHBondContact O-N 2.88Å; I719-T721 PolarHBondContact O-N 3.21Å; I719-T721 VanDerWaalsContact O-N 3.1Å; I719-V731 HydrophobicContact CD1-CG1 3.36Å; I719-V734 HydrophobicContact CG2-CB 4.26Å; I719-V734 HydrophobicContact CG2-CG1 3.91Å; I719-R735 HydrophobicContact CD1-CG 4.24Å
720	P	77.2	Confident	69.8	Low	17 Å²	17	72.8 Å²	72.8	11%	0.11	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-56	117.1	-179.6	-26	34	0	0	0	111.1	A722 T723 L738 W750	P720-A722 PolarHBondContact O-N 3.16Å; P720-A722 VanDerWaalsContact O-N 3.11Å; P720-T723 HydrophobicContact CB-CG2 4.27Å; P720-T723 WeakPolarHBondContact O-CB 3.37Å; P720-T723 PolarHBondContact O-N 3.16Å; P720-T723 PolarHBondContact O-OG1 3.17Å; P720-L738 HydrophobicContact CG-CD2 4.44Å; P720-W750 HydrophobicContact CB-CB 4.06Å; P720-W750 HydrophobicContact CB-CG 3.94Å; P720-W750 HydrophobicContact CG-CD2 4.37Å; P720-W750 HydrophobicContact CG-CG 3.98Å
721	T	73.2	Confident	71.1	Confident	120 Å²	120	69.5 Å²	69.5	74%	0.736	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-58.7	-32.8	-166.5	55.8	0	0	0	0	113.1	I719 T723 S724	I719-T721 PolarHBondContact O-N 3.21Å; I719-T721 VanDerWaalsContact O-N 3.1Å; T721-T723 PolarHBondContact O-N 3.29Å; T721-S724 WeakPolarHBondContact O-CB 3.2Å; T721-S724 PolarHBondContact O-N 3.29Å; T721-S724 PolarHBondContact O-OG 2.84Å
722	A	78.2	Confident	72.7	Confident	31 Å²	31	71.7 Å²	71.7	26%	0.256	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-56.8	-30	176	0	0	0	0	0	114	P720 S724 N725 W750 W1013	P720-A722 PolarHBondContact O-N 3.16Å; P720-A722 VanDerWaalsContact O-N 3.11Å; A722-S724 PolarHBondContact O-N 3.01Å; A722-S724 VanDerWaalsContact O-N 3.16Å; A722-N725 WeakPolarHBondContact O-CB 3.35Å; A722-N725 PolarHBondContact O-N 2.81Å; A722-N725 VanDerWaalsContact O-N 3.08Å; A722-N725 PolarHBondContact O-ND2 3.1Å; A722-W750 WeakPolarHBondContact CB-O 3.5Å; A722-W1013 HydrophobicContact CB-CZ3 4.22Å; A722-W1013 WeakPolarHBondContact O-CH2 3.46Å
723	T	78.7	Confident	74.8	Confident	9 Å²	9	69.5 Å²	69.5	6%	0.055	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-64.3	-18.7	-179.8	60.6	0	0	0	0	113.7	P720 T721 N725 S726 V734 W750 W1013	P720-T723 HydrophobicContact CB-CG2 4.27Å; P720-T723 WeakPolarHBondContact O-CB 3.37Å; P720-T723 PolarHBondContact O-N 3.16Å; P720-T723 PolarHBondContact O-OG1 3.17Å; T721-T723 PolarHBondContact O-N 3.29Å; T723-N725 PolarHBondContact O-N 3.14Å; T723-S726 WeakPolarHBondContact O-CB 3.48Å; T723-S726 PolarHBondContact O-N 3.31Å; T723-S726 VanDerWaalsContact O-N 3.16Å; T723-V734 HydrophobicContact CG2-CG1 4Å; T723-V734 HydrophobicContact CG2-CG2 4.31Å; T723-W750 HydrophobicContact CG2-CB 4.18Å; T723-W750 HydrophobicContact CG2-CD2 3.91Å; T723-W750 HydrophobicContact CG2-CE3 3.46Å; T723-W750 VanDerWaalsContact CG2-CE3 3.46Å; T723-W750 HydrophobicContact CG2-CG 4.27Å; T723-W750 HydrophobicContact CG2-CZ3 4.07Å; T723-W1013 HydrophobicContact CG2-CZ3 4.28Å
724	S	73.6	Confident	76.4	Confident	100 Å²	100	63.8 Å²	63.8	70%	0.699	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-64.2	-13.4	172.4	64.3	0	0	0	0	114.3	T721 A722	T721-S724 WeakPolarHBondContact O-CB 3.2Å; T721-S724 PolarHBondContact O-N 3.29Å; T721-S724 PolarHBondContact O-OG 2.84Å; A722-S724 PolarHBondContact O-N 3.01Å; A722-S724 VanDerWaalsContact O-N 3.16Å
725	N	76.9	Confident	78.1	Confident	117 Å²	117	64.7 Å²	64.7	63%	0.626	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-89.8	1.7	175.8	-59.9	-49.4	0	0	0	114	A722 T723	A722-N725 WeakPolarHBondContact O-CB 3.35Å; A722-N725 PolarHBondContact O-N 2.81Å; A722-N725 VanDerWaalsContact O-N 3.08Å; A722-N725 PolarHBondContact O-ND2 3.1Å; T723-N725 PolarHBondContact O-N 3.14Å
726	S	86.5	Confident	79.8	Confident	19 Å²	19	60.5 Å²	60.5	13%	0.133	34%	0.336	C	S	.	.			trans	-75.9	146.4	178.2	-173.8	0	0	0	0	112.2	T723 I728 F729 E1011	T723-S726 WeakPolarHBondContact O-CB 3.48Å; T723-S726 PolarHBondContact O-N 3.31Å; T723-S726 VanDerWaalsContact O-N 3.16Å; S726-I728 PolarHBondContact OG-N 3.33Å; S726-F729 PolarHBondContact OG-N 3.25Å; S726-E1011 WeakPolarHBondContact CB-OE2 3.47Å; S726-E1011 VanDerWaalsContact OG-CD 3.26Å; S726-E1011 PolarHBondContact OG-OE1 2.88Å; S726-E1011 PolarHBondContact OG-OE2 3.12Å
727	E	84.3	Confident	81.6	Confident	97 Å²	97	56.6 Å²	56.6	45%	0.453	32%	0.316	S	S	.	.	S	Bend	trans	-90.2	-3.1	167.2	-68.2	-177.8	-176.1	0	0	112.9	S757 R811 T1009 E1011	E727-S757 VanDerWaalsContact CD-CB 3.49Å; E727-S757 WeakPolarHBondContact OE1-CB 3.12Å; E727-S757 PolarHBondContact OE1-OG 2.88Å; E727-S757 WeakPolarHBondContact OE2-CB 3.21Å; E727-S757 PolarHBondContact OE2-OG 2.88Å; E727-R811 PolarHBondContact O-NH1 3.38Å; E727-T1009 HydrophobicContact CB-CG2 4.22Å; E727-T1009 PolarHBondContact OE2-OG1 2.84Å; E727-E1011 PolarHBondContact N-OE1 3.21Å
728	I	88.7	Confident	82.9	Confident	8 Å²	8	53.7 Å²	53.7	4%	0.041	30%	0.301	C	S	.	.	S	Bend	trans	-120.7	-37.4	-173.7	-49.1	175.7	0	0	0	111.8	S726 I809 R811 I817 T1009 E1011	S726-I728 PolarHBondContact OG-N 3.33Å; I728-I809 HydrophobicContact CB-CD1 4.41Å; I728-I809 HydrophobicContact CD1-CG2 4.27Å; I728-I809 HydrophobicContact CG2-CD1 3.7Å; I728-I809 HydrophobicContact CG2-CG1 3.93Å; I728-R811 HydrophobicContact CD1-CB 4.08Å; I728-R811 HydrophobicContact CG1-CB 4.02Å; I728-R811 HydrophobicContact CG2-CB 4.07Å; I728-I817 HydrophobicContact CG2-CD1 3.94Å; I728-I817 HydrophobicContact CG2-CG1 4.11Å; I728-I817 HydrophobicContact CG2-CG2 3.64Å; I728-T1009 HydrophobicContact CD1-CG2 3.9Å; I728-T1009 HydrophobicContact CG1-CG2 4.02Å; I728-E1011 HydrophobicContact CD1-CB 4.46Å; I728-E1011 HydrophobicContact CD1-CG 3.92Å; I728-E1011 HydrophobicContact CG1-CG 4.46Å
729	F	86.5	Confident	83.7	Confident	23 Å²	23	52.7 Å²	52.7	10%	0.101	29%	0.286	C	S	.	.			trans	-73.5	137.7	179.8	-71.4	-47.8	0	0	0	112.7	S726 K733 V734 L737 W750 I807 I809 W1013	S726-F729 PolarHBondContact OG-N 3.25Å; F729-K733 HydrophobicContact CD1-CB 4.15Å; F729-V734 HydrophobicContact CB-CG2 3.72Å; F729-V734 HydrophobicContact CD1-CG2 4.24Å; F729-V734 HydrophobicContact CD2-CG2 4.41Å; F729-V734 HydrophobicContact CG-CG2 3.91Å; F729-L737 HydrophobicContact CE1-CD1 3.42Å; F729-L737 VanDerWaalsContact CE1-CD1 3.42Å; F729-L737 HydrophobicContact CZ-CD1 3.65Å; F729-W750 HydrophobicContact CE2-CE3 4.33Å; F729-W750 AromaticContact CE2-CZ3 3.83Å; F729-W750 HydrophobicContact CE2-CZ3 3.83Å; F729-W750 AromaticContact CZ-CZ3 3.9Å; F729-W750 HydrophobicContact CZ-CZ3 3.9Å; F729-I807 HydrophobicContact CZ-CG2 4.45Å; F729-I809 HydrophobicContact CD1-CD1 3.83Å; F729-I809 HydrophobicContact CE1-CD1 3.31Å; F729-I809 HydrophobicContact CE2-CG2 4.48Å; F729-I809 HydrophobicContact CZ-CD1 3.93Å; F729-I809 HydrophobicContact CZ-CG2 4.09Å; F729-W1013 AromaticContact CD2-CE2 3.98Å; F729-W1013 HydrophobicContact CD2-CZ2 4.21Å; F729-W1013 AromaticContact CD2-NE1 3.88Å; F729-W1013 AromaticContact CE2-CD1 3.61Å; F729-W1013 HydrophobicContact CE2-CD2 4.1Å; F729-W1013 AromaticContact CE2-CE2 3.74Å; F729-W1013 HydrophobicContact CE2-CG 4.04Å; F729-W1013 HydrophobicContact CE2-CZ2 4.42Å; F729-W1013 AromaticContact CE2-NE1 3.39Å
730	D	85	Confident	84.4	Confident	66 Å²	66	52.4 Å²	52.4	35%	0.353	29%	0.285	S	S	.	.			trans	-118.6	154.8	167	157.5	42.9	0	0	0	106.8	H732 K733 V734	D730-H732 PolarHBondContact O-N 2.8Å; D730-H732 IonicContact OD1-CD2 3.41Å; D730-H732 IonicContact OD2-CD2 2.86Å; D730-K733 HydrophobicContact CB-CD 4.35Å; D730-K733 HydrophobicContact CB-CG 4.33Å; D730-K733 WeakPolarHBondContact O-CA 3.11Å; D730-K733 WeakPolarHBondContact O-CB 3.23Å; D730-K733 PolarHBondContact O-N 2.88Å; D730-K733 IonicContact OD2-NZ 2.76Å; D730-V734 PolarHBondContact O-N 3.29Å
731	V	84.6	Confident	85	Confident	76 Å²	76	52.3 Å²	52.3	46%	0.461	28%	0.283	S	S	.	.	H	α-helix	trans	-49.3	-35.6	-176.7	-170.6	0	0	0	0	111.8	I719 R735	I719-V731 HydrophobicContact CD1-CG1 3.36Å; V731-R735 PolarHBondContact O-N 2.97Å
732	H	85.7	Confident	85.7	Confident	121 Å²	121	47 Å²	47	56%	0.56	25%	0.25	S	S	*	.	H	α-helix	trans	-72	-40.4	175.2	-64.6	-77.3	0	0	0	113.4	D730 R735 D736	D730-H732 PolarHBondContact O-N 2.8Å; D730-H732 IonicContact OD1-CD2 3.41Å; D730-H732 IonicContact OD2-CD2 2.86Å; H732-R735 PolarHBondContact O-N 3.33Å; H732-D736 PolarHBondContact O-N 3.02Å
733	K	90.7	Very high	86.1	Confident	17 Å²	17	50.1 Å²	50.1	7%	0.074	27%	0.268	C	S	.	.	H	α-helix	trans	-68.4	-36.6	-179.8	-61.5	-178.2	178	62.4	0	112.3	F729 D730 R735 D736 L737 I817 W844	F729-K733 HydrophobicContact CD1-CB 4.15Å; D730-K733 HydrophobicContact CB-CD 4.35Å; D730-K733 HydrophobicContact CB-CG 4.33Å; D730-K733 WeakPolarHBondContact O-CA 3.11Å; D730-K733 WeakPolarHBondContact O-CB 3.23Å; D730-K733 PolarHBondContact O-N 2.88Å; D730-K733 IonicContact OD2-NZ 2.76Å; K733-R735 VanDerWaalsContact C-N 3.34Å; K733-D736 PolarHBondContact O-N 3.47Å; K733-L737 PolarHBondContact O-N 2.9Å; K733-I817 HydrophobicContact CD-CD1 4.41Å; K733-W844 HydrophobicContact CB-CH2 4.08Å; K733-W844 HydrophobicContact CB-CZ2 3.59Å; K733-W844 HydrophobicContact CD-CD2 4.32Å; K733-W844 HydrophobicContact CD-CE3 4.49Å; K733-W844 HydrophobicContact CD-CZ2 4.5Å; K733-W844 HydrophobicContact CG-CD2 4.23Å; K733-W844 HydrophobicContact CG-CZ2 3.94Å
734	V	89.9	Confident	86.3	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.012	29%	0.289	C	S	.	.	H	α-helix	trans	-65	-40.9	174.2	-170.7	0	0	0	0	110.2	I719 T723 F729 D730 L737 L738 W750	I719-V734 HydrophobicContact CG2-CB 4.26Å; I719-V734 HydrophobicContact CG2-CG1 3.91Å; T723-V734 HydrophobicContact CG2-CG1 4Å; T723-V734 HydrophobicContact CG2-CG2 4.31Å; F729-V734 HydrophobicContact CB-CG2 3.72Å; F729-V734 HydrophobicContact CD1-CG2 4.24Å; F729-V734 HydrophobicContact CD2-CG2 4.41Å; F729-V734 HydrophobicContact CG-CG2 3.91Å; D730-V734 PolarHBondContact O-N 3.29Å; V734-L737 PolarHBondContact O-N 2.87Å; V734-L738 HydrophobicContact CG1-CD1 3.97Å; V734-L738 HydrophobicContact CG1-CG 4.32Å; V734-L738 WeakPolarHBondContact O-CB 3.47Å; V734-L738 VanDerWaalsContact O-CG 3.27Å; V734-L738 WeakPolarHBondContact O-CG 3.43Å; V734-L738 PolarHBondContact O-N 2.89Å; V734-W750 HydrophobicContact CG1-CH2 4.08Å; V734-W750 HydrophobicContact CG1-CZ2 4.43Å; V734-W750 HydrophobicContact CG1-CZ3 4.28Å
735	R	87.1	Confident	86.9	Confident	69 Å²	69	49.4 Å²	49.4	26%	0.26	26%	0.256	S	S	.	.	H	α-helix	trans	-63	-44.4	172.9	-76.3	-173.7	174.7	111.4	-6.8	113	E715 I719 V731 H732 K733 L737 L738 Q739	E715-R735 PolarHBondContact O-NE 3.03Å; E715-R735 VanDerWaalsContact O-NE 3.14Å; E715-R735 PolarHBondContact O-NH2 3.5Å; E715-R735 VanDerWaalsContact O-NH2 3.09Å; I719-R735 HydrophobicContact CD1-CG 4.24Å; V731-R735 PolarHBondContact O-N 2.97Å; H732-R735 PolarHBondContact O-N 3.33Å; K733-R735 VanDerWaalsContact C-N 3.34Å; R735-L737 VanDerWaalsContact C-N 3.25Å; R735-L737 PolarHBondContact O-N 3.11Å; R735-L738 PolarHBondContact O-N 3.21Å; R735-Q739 VanDerWaalsContact O-CG 3.32Å; R735-Q739 WeakPolarHBondContact O-CG 3.25Å; R735-Q739 PolarHBondContact O-N 3.27Å
736	D	90.8	Very high	87.3	Confident	42 Å²	42	49.5 Å²	49.5	23%	0.225	25%	0.253	C	S	.	.	H	α-helix	trans	-57.3	-40	176.3	-72.4	-27.9	0	0	0	111.6	H732 K733 N740 W844 F945	H732-D736 PolarHBondContact O-N 3.02Å; K733-D736 PolarHBondContact O-N 3.47Å; D736-N740 WeakPolarHBondContact O-CB 3.42Å; D736-N740 PolarHBondContact O-ND2 3.17Å; D736-W844 HydrophobicContact CB-CZ2 4.13Å; D736-W844 PolarHBondContact OD2-NE1 3.22Å; D736-F945 HydrophobicContact CB-CB 4.16Å; D736-F945 HydrophobicContact CB-CD1 4.44Å; D736-F945 HydrophobicContact CB-CD2 4.15Å; D736-F945 HydrophobicContact CB-CG 4.02Å
737	L	91.7	Very high	87	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-75.8	-40.3	176.1	-72.4	-175.5	0	0	0	113.7	F729 K733 V734 R735 Q739 N740 L741 W750 I807 F842 W844 F945	F729-L737 HydrophobicContact CE1-CD1 3.42Å; F729-L737 VanDerWaalsContact CE1-CD1 3.42Å; F729-L737 HydrophobicContact CZ-CD1 3.65Å; K733-L737 PolarHBondContact O-N 2.9Å; V734-L737 PolarHBondContact O-N 2.87Å; R735-L737 VanDerWaalsContact C-N 3.25Å; R735-L737 PolarHBondContact O-N 3.11Å; L737-Q739 PolarHBondContact O-N 3.37Å; L737-N740 CarbonylContact O-C 3.52Å; L737-N740 WeakPolarHBondContact O-CA 3.04Å; L737-N740 PolarHBondContact O-N 2.8Å; L737-L741 WeakPolarHBondContact O-CG 3.29Å; L737-L741 PolarHBondContact O-N 3.01Å; L737-W750 HydrophobicContact CB-CH2 3.91Å; L737-W750 HydrophobicContact CD1-CH2 4.23Å; L737-I807 HydrophobicContact CD1-CD1 4Å; L737-I807 HydrophobicContact CD1-CG2 4.21Å; L737-F842 HydrophobicContact CD1-CZ 4.34Å; L737-F842 HydrophobicContact CD2-CD1 4.14Å; L737-F842 HydrophobicContact CD2-CD2 4.24Å; L737-F842 HydrophobicContact CD2-CE1 3.94Å; L737-F842 HydrophobicContact CD2-CE2 4.11Å; L737-F842 HydrophobicContact CD2-CG 4.27Å; L737-F842 HydrophobicContact CD2-CZ 3.95Å; L737-W844 HydrophobicContact CD1-CH2 4.08Å; L737-W844 HydrophobicContact CD2-CH2 4.17Å; L737-W844 HydrophobicContact CD2-CZ2 4.5Å; L737-W844 HydrophobicContact CG-CH2 3.92Å; L737-W844 HydrophobicContact CG-CZ2 4.14Å; L737-F945 HydrophobicContact CD2-CE2 3.84Å; L737-F945 HydrophobicContact CD2-CZ 3.86Å
738	L	88.4	Confident	87	Confident	31 Å²	31	51 Å²	51	16%	0.162	28%	0.283	C	S	.	.	H	α-helix	trans	-55.1	-39.7	174.2	-80.1	163.4	0	0	0	111.4	P720 V734 R735 N740 L741 W750	P720-L738 HydrophobicContact CG-CD2 4.44Å; V734-L738 HydrophobicContact CG1-CD1 3.97Å; V734-L738 HydrophobicContact CG1-CG 4.32Å; V734-L738 WeakPolarHBondContact O-CB 3.47Å; V734-L738 VanDerWaalsContact O-CG 3.27Å; V734-L738 WeakPolarHBondContact O-CG 3.43Å; V734-L738 PolarHBondContact O-N 2.89Å; R735-L738 PolarHBondContact O-N 3.21Å; L738-N740 PolarHBondContact O-N 3.47Å; L738-L741 HydrophobicContact CD2-CD1 4.23Å; L738-W750 HydrophobicContact CD2-CZ2 4.07Å; L738-W750 HydrophobicContact CG-CZ2 4.13Å
739	Q	85.9	Confident	86.7	Confident	94 Å²	94	56 Å²	56	44%	0.439	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-9	174.4	-71.3	178.7	27.5	0	0	114.6	P714 R735 L737	P714-Q739 HydrophobicContact CB-CG 3.56Å; P714-Q739 HydrophobicContact CG-CG 3.51Å; R735-Q739 VanDerWaalsContact O-CG 3.32Å; R735-Q739 WeakPolarHBondContact O-CG 3.25Å; R735-Q739 PolarHBondContact O-N 3.27Å; L737-Q739 PolarHBondContact O-N 3.37Å
740	N	89.7	Confident	86.9	Confident	40 Å²	40	55 Å²	55	21%	0.214	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.8	11.6	-167.1	-80.6	-80.7	0	0	0	113.7	D736 L737 L738 F840 F945 K947	D736-N740 WeakPolarHBondContact O-CB 3.42Å; D736-N740 PolarHBondContact O-ND2 3.17Å; L737-N740 CarbonylContact O-C 3.52Å; L737-N740 WeakPolarHBondContact O-CA 3.04Å; L737-N740 PolarHBondContact O-N 2.8Å; L738-N740 PolarHBondContact O-N 3.47Å; N740-F840 VanDerWaalsContact O-CE1 3.24Å; N740-F840 WeakPolarHBondContact O-CE1 3.45Å; N740-F840 WeakPolarHBondContact O-CZ 3.44Å; N740-F945 HydrophobicContact CB-CE1 4.03Å; N740-F945 HydrophobicContact CB-CZ 4.35Å; N740-F945 WeakPolarHBondContact ND2-CE1 3.3Å; N740-K947 HydrophobicContact CB-CD 4.02Å; N740-K947 PolarHBondContact O-NZ 3.24Å; N740-K947 WeakPolarHBondContact OD1-CD 3.37Å
741	L	89.7	Confident	87.1	Confident	15 Å²	15	55.3 Å²	55.3	8%	0.079	31%	0.306	C	S	.	.			trans	-58.8	165.8	176.2	-64.8	-177.7	0	0	0	112.2	L737 L738 A745 E746 W750 I807 M821 F1015	L737-L741 WeakPolarHBondContact O-CG 3.29Å; L737-L741 PolarHBondContact O-N 3.01Å; L738-L741 HydrophobicContact CD2-CD1 4.23Å; L741-A745 HydrophobicContact CB-CB 4.49Å; L741-E746 HydrophobicContact CB-CG 3.96Å; L741-E746 HydrophobicContact CD1-CG 4.49Å; L741-W750 HydrophobicContact CD1-CZ2 4.42Å; L741-W750 HydrophobicContact CD2-CZ2 4.03Å; L741-I807 HydrophobicContact CD2-CD1 4.41Å; L741-M821 HydrophobicContact CD2-CE 3.48Å; L741-M821 VanDerWaalsContact CD2-CE 3.48Å; L741-F1015 HydrophobicContact CD1-CE1 4.25Å; L741-F1015 HydrophobicContact CD2-CE1 3.98Å; L741-F1015 HydrophobicContact CD2-CZ 3.69Å
742	T	87.5	Confident	87.5	Confident	8 Å²	8	54 Å²	54	5%	0.049	30%	0.296	C	S	.	.			trans	-82.3	147.6	161.6	45.9	0	0	0	0	108.8	D744 A745 E746 M821 S838 F840	T742-D744 PolarHBondContact O-N 3.13Å; T742-D744 VanDerWaalsContact O-N 3.1Å; T742-A745 WeakPolarHBondContact O-CA 3.36Å; T742-A745 WeakPolarHBondContact O-CB 3.36Å; T742-A745 PolarHBondContact O-N 2.95Å; T742-E746 PolarHBondContact O-N 2.71Å; T742-M821 HydrophobicContact CG2-CG 3.98Å; T742-S838 VanDerWaalsContact CG2-O 3.28Å; T742-S838 WeakPolarHBondContact CG2-O 3.33Å; T742-F840 HydrophobicContact CG2-CE1 4.32Å
743	P	85.4	Confident	87.8	Confident	97 Å²	97	48.7 Å²	48.7	63%	0.63	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-52.6	-36.7	177.5	-28.9	36.3	0	0	0	113.2	A745 E746	P743-A745 PolarHBondContact O-N 3.34Å; P743-E746 PolarHBondContact O-N 3.42Å; P743-E746 VanDerWaalsContact O-N 3.14Å
744	D	84.4	Confident	88	Confident	94 Å²	94	47.9 Å²	47.9	50%	0.503	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-61	-9.1	175.9	-44.7	-21.6	0	0	0	114.3	T742 L748 P805	T742-D744 PolarHBondContact O-N 3.13Å; T742-D744 VanDerWaalsContact O-N 3.1Å; D744-L748 WeakPolarHBondContact O-CD1 3.46Å; D744-P805 HydrophobicContact CB-CG 4.44Å
745	A	86.6	Confident	88.3	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-122.7	-5	-179.2	0	0	0	0	0	113.3	L741 T742 P743 G747 P805 F1015	L741-A745 HydrophobicContact CB-CB 4.49Å; T742-A745 WeakPolarHBondContact O-CA 3.36Å; T742-A745 WeakPolarHBondContact O-CB 3.36Å; T742-A745 PolarHBondContact O-N 2.95Å; P743-A745 PolarHBondContact O-N 3.34Å; A745-G747 PolarHBondContact O-N 2.84Å; A745-P805 HydrophobicContact CB-CB 4.25Å; A745-P805 HydrophobicContact CB-CG 3.86Å; A745-F1015 HydrophobicContact CB-CD1 3.86Å; A745-F1015 HydrophobicContact CB-CD2 3.71Å; A745-F1015 HydrophobicContact CB-CE1 3.88Å; A745-F1015 HydrophobicContact CB-CE2 3.76Å; A745-F1015 HydrophobicContact CB-CG 3.77Å; A745-F1015 HydrophobicContact CB-CZ 3.84Å
746	E	85	Confident	88.7	Confident	120 Å²	120	44.7 Å²	44.7	56%	0.561	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	125.7	-179.7	-74.6	176.9	-143.8	0	0	110.8	L741 T742 P743 L748	L741-E746 HydrophobicContact CB-CG 3.96Å; L741-E746 HydrophobicContact CD1-CG 4.49Å; T742-E746 PolarHBondContact O-N 2.71Å; P743-E746 PolarHBondContact O-N 3.42Å; P743-E746 VanDerWaalsContact O-N 3.14Å; E746-L748 VanDerWaalsContact C-N 3.32Å; E746-L748 PolarHBondContact O-N 3.06Å
747	G	80.5	Confident	88.8	Confident	89 Å²	89	45.4 Å²	45.4	92%	0.918	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-0.3	178.6	0	0	0	0	0	116	A745	A745-G747 PolarHBondContact O-N 2.84Å
748	L	83.6	Confident	88.8	Confident	58 Å²	58	50.1 Å²	50.1	30%	0.304	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-84.8	155.6	171.8	-64.1	-175.7	0	0	0	112	D744 E746 F1015	D744-L748 WeakPolarHBondContact O-CD1 3.46Å; E746-L748 VanDerWaalsContact C-N 3.32Å; E746-L748 PolarHBondContact O-N 3.06Å; L748-F1015 HydrophobicContact CB-CB 3.79Å; L748-F1015 HydrophobicContact CB-CD1 4.37Å; L748-F1015 HydrophobicContact CD1-CB 3.77Å; L748-F1015 HydrophobicContact CG-CB 4.44Å
749	D	83.3	Confident	89.1	Confident	112 Å²	112	50.5 Å²	50.5	60%	0.599	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-82.8	139.3	-178.8	-100.1	-35.9	0	0	0	111.7	F1015 I1016	D749-F1015 WeakPolarHBondContact O-CA 3.4Å; D749-I1016 PolarHBondContact N-O 3.14Å; D749-I1016 PolarHBondContact O-N 3.02Å; D749-I1016 VanDerWaalsContact O-N 3.14Å
750	W	89.2	Confident	89.5	Confident	3 Å²	3	47.6 Å²	47.6	1%	0.011	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	123.7	-174.8	-69.9	42	0	0	0	110.9	P720 A722 T723 F729 V734 L737 L738 L741 I807 W1013 F1015	P720-W750 HydrophobicContact CB-CB 4.06Å; P720-W750 HydrophobicContact CB-CG 3.94Å; P720-W750 HydrophobicContact CG-CD2 4.37Å; P720-W750 HydrophobicContact CG-CG 3.98Å; A722-W750 WeakPolarHBondContact CB-O 3.5Å; T723-W750 HydrophobicContact CG2-CB 4.18Å; T723-W750 HydrophobicContact CG2-CD2 3.91Å; T723-W750 HydrophobicContact CG2-CE3 3.46Å; T723-W750 VanDerWaalsContact CG2-CE3 3.46Å; T723-W750 HydrophobicContact CG2-CG 4.27Å; T723-W750 HydrophobicContact CG2-CZ3 4.07Å; F729-W750 HydrophobicContact CE2-CE3 4.33Å; F729-W750 AromaticContact CE2-CZ3 3.83Å; F729-W750 HydrophobicContact CE2-CZ3 3.83Å; F729-W750 AromaticContact CZ-CZ3 3.9Å; F729-W750 HydrophobicContact CZ-CZ3 3.9Å; V734-W750 HydrophobicContact CG1-CH2 4.08Å; V734-W750 HydrophobicContact CG1-CZ2 4.43Å; V734-W750 HydrophobicContact CG1-CZ3 4.28Å; L737-W750 HydrophobicContact CB-CH2 3.91Å; L737-W750 HydrophobicContact CD1-CH2 4.23Å; L738-W750 HydrophobicContact CD2-CZ2 4.07Å; L738-W750 HydrophobicContact CG-CZ2 4.13Å; L741-W750 HydrophobicContact CD1-CZ2 4.42Å; L741-W750 HydrophobicContact CD2-CZ2 4.03Å; W750-I807 HydrophobicContact CE3-CD1 4.11Å; W750-I807 HydrophobicContact CH2-CD1 3.49Å; W750-I807 VanDerWaalsContact CH2-CD1 3.49Å; W750-I807 HydrophobicContact CZ2-CD1 4.1Å; W750-I807 HydrophobicContact CZ3-CD1 3.49Å; W750-I807 VanDerWaalsContact CZ3-CD1 3.49Å; W750-W1013 HydrophobicContact CB-CE3 4.09Å; W750-W1013 HydrophobicContact CE3-CE3 4.44Å; W750-F1015 AromaticContact CD1-CD1 3.95Å; W750-F1015 AromaticContact CD1-CE1 3.78Å; W750-F1015 HydrophobicContact CD2-CE1 4.14Å; W750-F1015 AromaticContact CE2-CE1 3.71Å; W750-F1015 HydrophobicContact CG-CD1 4.5Å; W750-F1015 HydrophobicContact CG-CE1 4.22Å; W750-F1015 HydrophobicContact CZ2-CE1 4.25Å; W750-F1015 AromaticContact NE1-CE1 3.46Å
751	I	89.8	Confident	89.7	Confident	72 Å²	72	50 Å²	50	37%	0.369	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127.6	-176.9	-66	176.6	0	0	0	111.1	T753 W1013 S1014 I1016	I751-T753 PolarHBondContact O-N 3.42Å; I751-W1013 CarbonylContact O-C 3.59Å; I751-W1013 VanDerWaalsContact O-CA 3.31Å; I751-W1013 WeakPolarHBondContact O-CA 3.45Å; I751-S1014 PolarHBondContact N-O 2.7Å; I751-S1014 PolarHBondContact O-N 2.81Å; I751-I1016 HydrophobicContact CD1-CB 3.96Å; I751-I1016 HydrophobicContact CD1-CD1 3.89Å; I751-I1016 HydrophobicContact CD1-CG1 4.03Å
752	L	92.3	Very high	90	Very high	48 Å²	48	50.8 Å²	50.8	25%	0.251	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	84.1	178.8	-177.9	61.1	0	0	0	111.4	Y754 E1011 W1013	L752-Y754 WeakPolarHBondContact CD1-O 3.45Å; L752-E1011 HydrophobicContact CD1-CB 3.96Å; L752-E1011 HydrophobicContact CD1-CG 4.15Å; L752-W1013 HydrophobicContact CB-CD2 4.36Å; L752-W1013 HydrophobicContact CB-CE3 4.14Å; L752-W1013 HydrophobicContact CB-CH2 3.8Å; L752-W1013 HydrophobicContact CB-CZ2 4.02Å; L752-W1013 HydrophobicContact CB-CZ3 3.88Å; L752-W1013 HydrophobicContact CD1-CD2 4.17Å; L752-W1013 HydrophobicContact CD1-CH2 4.37Å; L752-W1013 HydrophobicContact CD1-CZ2 3.7Å; L752-W1013 HydrophobicContact CD2-CZ2 4.31Å; L752-W1013 HydrophobicContact CG-CH2 4.45Å; L752-W1013 HydrophobicContact CG-CZ2 4.22Å
753	T	92.3	Very high	90.5	Very high	10 Å²	10	50.4 Å²	50.4	6%	0.061	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	-29	179.9	-67.5	0	0	0	0	112.5	I751 R769 S773 I1012 S1014	I751-T753 PolarHBondContact O-N 3.42Å; T753-R769 HydrophobicContact CG2-CB 4.38Å; T753-R769 WeakPolarHBondContact O-CB 3.08Å; T753-R769 WeakPolarHBondContact O-CD 3.38Å; T753-S773 PolarHBondContact OG1-OG 3.39Å; T753-I1012 PolarHBondContact N-O 3.07Å; T753-S1014 WeakPolarHBondContact CB-OG 3.32Å; T753-S1014 WeakPolarHBondContact OG1-CB 3.29Å; T753-S1014 PolarHBondContact OG1-OG 2.91Å
754	Y	95	Very high	90.9	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	141.3	172.4	-164.1	-98	0	0	0	113.4	L752 T756 H759 G760 S762 L766 R769 L982 L1010 E1011 I1012	L752-Y754 WeakPolarHBondContact CD1-O 3.45Å; Y754-T756 HydrophobicContact CE1-CG2 3.93Å; Y754-H759 WeakPolarHBondContact CA-ND1 3.16Å; Y754-H759 HydrophobicContact CD2-CB 4.03Å; Y754-H759 AromaticContact CD2-ND1 3.5Å; Y754-H759 WeakPolarHBondContact CD2-ND1 3.24Å; Y754-H759 HydrophobicContact CE2-CB 3.6Å; Y754-H759 AromaticContact CG-ND1 3.93Å; Y754-G760 PolarHBondContact OH-O 2.81Å; Y754-S762 PolarHBondContact OH-O 3.18Å; Y754-L766 HydrophobicContact CD1-CB 4.38Å; Y754-L766 HydrophobicContact CD1-CD1 4.29Å; Y754-L766 HydrophobicContact CD1-CG 4.25Å; Y754-L766 HydrophobicContact CD2-CB 4.13Å; Y754-L766 HydrophobicContact CD2-CG 4.49Å; Y754-L766 HydrophobicContact CE1-CB 4.17Å; Y754-L766 HydrophobicContact CE1-CD1 4.33Å; Y754-L766 HydrophobicContact CE1-CG 4.44Å; Y754-L766 VanDerWaalsContact CE2-CA 3.41Å; Y754-L766 HydrophobicContact CE2-CB 3.9Å; Y754-L766 VanDerWaalsContact CE2-N 3.35Å; Y754-L766 HydrophobicContact CG-CB 4.35Å; Y754-L766 HydrophobicContact CG-CG 4.27Å; Y754-R769 HydrophobicContact CD2-CB 4.38Å; Y754-L982 HydrophobicContact CE1-CD1 3.91Å; Y754-L1010 HydrophobicContact CD1-CD2 3.95Å; Y754-L1010 HydrophobicContact CE1-CD2 4.23Å; Y754-E1011 CarbonylContact O-C 3.6Å; Y754-E1011 WeakPolarHBondContact O-CA 3.28Å; Y754-I1012 PolarHBondContact N-O 3.31Å; Y754-I1012 PolarHBondContact O-N 2.92Å
755	S	95.7	Very high	91.4	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.014	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	134.7	162.9	167.7	0	0	0	0	108.7	S757 V758 H759 L1010	S755-S757 PolarHBondContact O-N 2.83Å; S755-S757 PolarHBondContact OG-N 3.26Å; S755-V758 PolarHBondContact O-N 3.06Å; S755-H759 PolarHBondContact N-ND1 3.34Å; S755-H759 WeakPolarHBondContact O-CB 3.45Å; S755-H759 PolarHBondContact O-N 3.05Å; S755-L1010 CarbonylContact C-O 3.59Å; S755-L1010 WeakPolarHBondContact CA-O 3.39Å
756	T	95.9	Very high	91.8	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.018	28%	0.279	C	S	.	.	H	α-helix	trans	-61.8	-32.1	175.3	49	0	0	0	0	112.6	Y754 V758 G760 F761 L982 T1009 L1010	Y754-T756 HydrophobicContact CE1-CG2 3.93Å; T756-V758 VanDerWaalsContact C-N 3.35Å; T756-G760 WeakPolarHBondContact CA-O 3.4Å; T756-G760 CarbonylContact O-C 3.57Å; T756-G760 VanDerWaalsContact O-CA 3.23Å; T756-G760 WeakPolarHBondContact O-CA 3.46Å; T756-G760 PolarHBondContact O-N 2.6Å; T756-F761 HydrophobicContact CG2-CD1 4.12Å; T756-F761 HydrophobicContact CG2-CE1 4.02Å; T756-F761 HydrophobicContact CG2-CG 4.47Å; T756-F761 HydrophobicContact CG2-CZ 4.28Å; T756-L982 HydrophobicContact CG2-CD1 4.35Å; T756-T1009 WeakPolarHBondContact OG1-CA 3.48Å; T756-L1010 HydrophobicContact CG2-CB 3.86Å; T756-L1010 PolarHBondContact N-O 2.85Å; T756-L1010 PolarHBondContact OG1-N 3.35Å
757	S	92.7	Very high	92.3	Very high	56 Å²	56	43 Å²	43	39%	0.392	25%	0.254	S	S	.	.	H	α-helix	trans	-70.5	-30.4	179.5	-52.9	0	0	0	0	112.7	E727 S755	E727-S757 VanDerWaalsContact CD-CB 3.49Å; E727-S757 WeakPolarHBondContact OE1-CB 3.12Å; E727-S757 PolarHBondContact OE1-OG 2.88Å; E727-S757 WeakPolarHBondContact OE2-CB 3.21Å; E727-S757 PolarHBondContact OE2-OG 2.88Å; S755-S757 PolarHBondContact O-N 2.83Å; S755-S757 PolarHBondContact OG-N 3.26Å
758	V	92.9	Very high	92.9	Very high	100 Å²	100	44.6 Å²	44.6	61%	0.606	23%	0.233	S	C	*	.	H	α-helix	trans	-94.2	-31.2	178.5	-168.3	0	0	0	0	112	S755 T756	S755-V758 PolarHBondContact O-N 3.06Å; T756-V758 VanDerWaalsContact C-N 3.35Å
759	H	94	Very high	93.3	Very high	40 Å²	40	46.1 Å²	46.1	19%	0.185	23%	0.234	C	C	.	.	H	α-helix	trans	-117.4	-5.1	-166.9	-55.2	155.2	0	0	0	115.2	Y754 S755 R769	Y754-H759 WeakPolarHBondContact CA-ND1 3.16Å; Y754-H759 HydrophobicContact CD2-CB 4.03Å; Y754-H759 AromaticContact CD2-ND1 3.5Å; Y754-H759 WeakPolarHBondContact CD2-ND1 3.24Å; Y754-H759 HydrophobicContact CE2-CB 3.6Å; Y754-H759 AromaticContact CG-ND1 3.93Å; S755-H759 PolarHBondContact N-ND1 3.34Å; S755-H759 WeakPolarHBondContact O-CB 3.45Å; S755-H759 PolarHBondContact O-N 3.05Å; H759-R769 PolarHBondContact CD2-NH1 3.3Å; H759-R769 VanDerWaalsContact CD2-NH1 3.29Å; H759-R769 PolarHBondContact CD2-NH2 3.35Å; H759-R769 WeakPolarHBondContact CE1-CD 3.35Å; H759-R769 PolarHBondContact CE1-NE 3.27Å; H759-R769 VanDerWaalsContact CE1-NE 3.33Å; H759-R769 VanDerWaalsContact CG-CZ 3.44Å; H759-R769 WeakPolarHBondContact ND1-CD 2.99Å; H759-R769 PolarHBondContact NE2-NE 3.37Å; H759-R769 PolarHBondContact NE2-NH2 2.89Å
760	G	93.5	Very high	93.6	Very high	33 Å²	33	41 Å²	41	34%	0.34	21%	0.207	S	C	.	.			trans	84.4	178.9	-178.3	0	0	0	0	0	114.2	Y754 T756	Y754-G760 PolarHBondContact OH-O 2.81Å; T756-G760 WeakPolarHBondContact CA-O 3.4Å; T756-G760 CarbonylContact O-C 3.57Å; T756-G760 VanDerWaalsContact O-CA 3.23Å; T756-G760 WeakPolarHBondContact O-CA 3.46Å; T756-G760 PolarHBondContact O-N 2.6Å
761	F	95.2	Very high	93.5	Very high	89 Å²	89	42.1 Å²	42.1	39%	0.39	22%	0.217	S	C	.	.	S	Bend	trans	-100.9	89.3	-173.2	-81.8	-93.3	0	0	0	109.1	T756 I981 L982 I1007	T756-F761 HydrophobicContact CG2-CD1 4.12Å; T756-F761 HydrophobicContact CG2-CE1 4.02Å; T756-F761 HydrophobicContact CG2-CG 4.47Å; T756-F761 HydrophobicContact CG2-CZ 4.28Å; F761-I981 CarbonylContact C-O 3.6Å; F761-I981 WeakPolarHBondContact CA-O 3.5Å; F761-I981 VanDerWaalsContact CB-O 3.23Å; F761-I981 WeakPolarHBondContact CB-O 3.23Å; F761-L982 VanDerWaalsContact CD1-O 3.29Å; F761-L982 WeakPolarHBondContact CD1-O 3.26Å; F761-L982 WeakPolarHBondContact CE1-O 3.28Å; F761-I1007 HydrophobicContact CE1-CG2 4.38Å
762	S	96	Very high	92.9	Very high	32 Å²	32	42.4 Å²	42.4	22%	0.224	22%	0.22	C	C	.	.			trans	-167.4	124.5	173.7	-177.8	0	0	0	0	113.1	Y754 R764 S765 L766 D980 I981	Y754-S762 PolarHBondContact OH-O 3.18Å; S762-R764 PolarHBondContact O-N 2.89Å; S762-R764 PolarHBondContact OG-N 2.61Å; S762-S765 WeakPolarHBondContact O-CA 3.24Å; S762-S765 WeakPolarHBondContact O-CB 3.33Å; S762-S765 PolarHBondContact O-N 3.04Å; S762-L766 PolarHBondContact O-N 2.89Å; S762-L766 VanDerWaalsContact O-N 3.11Å; S762-D980 WeakPolarHBondContact CA-O 3.17Å; S762-I981 PolarHBondContact N-O 2.88Å
763	L	96.8	Very high	91.5	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.1	-32.3	174.1	-179.9	58.6	0	0	0	112.4	S765 L766 Y767 S964 L965 D980 L982	L763-S765 VanDerWaalsContact C-N 3.28Å; L763-S765 PolarHBondContact O-N 3.3Å; L763-L766 HydrophobicContact CD1-CD1 4.34Å; L763-L766 HydrophobicContact CD1-CD2 4.33Å; L763-L766 WeakPolarHBondContact O-CB 3.36Å; L763-L766 PolarHBondContact O-N 2.93Å; L763-Y767 HydrophobicContact CD1-CD1 4.27Å; L763-Y767 HydrophobicContact CD1-CD2 4.5Å; L763-Y767 HydrophobicContact CD1-CE1 3.76Å; L763-Y767 HydrophobicContact CD1-CE2 4.01Å; L763-Y767 HydrophobicContact CD2-CE2 4.03Å; L763-Y767 HydrophobicContact CG-CD2 4.19Å; L763-Y767 HydrophobicContact CG-CE1 4.32Å; L763-Y767 HydrophobicContact CG-CE2 3.62Å; L763-Y767 WeakPolarHBondContact O-CD2 3.24Å; L763-Y767 PolarHBondContact O-N 3.1Å; L763-S964 VanDerWaalsContact CD2-C 3.44Å; L763-L965 HydrophobicContact CD1-CB 3.77Å; L763-L965 HydrophobicContact CD1-CD2 4Å; L763-L965 HydrophobicContact CD1-CG 4.49Å; L763-L965 HydrophobicContact CD2-CB 4.14Å; L763-D980 VanDerWaalsContact CB-O 3.32Å; L763-D980 WeakPolarHBondContact CB-O 3.16Å; L763-D980 PolarHBondContact N-O 3.03Å; L763-L982 HydrophobicContact CB-CD2 4.01Å; L763-L982 HydrophobicContact CB-CG 4.26Å; L763-L982 HydrophobicContact CD1-CD2 4.1Å
764	R	94.8	Very high	89.8	Confident	123 Å²	123	44.6 Å²	44.6	46%	0.464	23%	0.232	S	C	.	.	H	α-helix	trans	-72.1	-21.3	176.5	-58	177.6	-171.7	167.5	2.8	112.7	S762 R768 Y962 D963	S762-R764 PolarHBondContact O-N 2.89Å; S762-R764 PolarHBondContact OG-N 2.61Å; R764-R768 WeakPolarHBondContact O-CB 3.35Å; R764-R768 PolarHBondContact O-NH1 2.87Å; R764-R768 VanDerWaalsContact O-NH1 3.13Å; R764-Y962 PolarHBondContact NE-O 2.86Å; R764-D963 IonicContact NH2-OD1 3.43Å; R764-D963 PolarHBondContact NH2-OD1 2.94Å
765	S	94.7	Very high	87.6	Confident	21 Å²	21	47.7 Å²	47.7	15%	0.147	25%	0.251	C	S	.	.	H	α-helix	trans	-83.9	-30.8	169	-73.3	0	0	0	0	112.9	S762 L763 R768 R769	S762-S765 WeakPolarHBondContact O-CA 3.24Å; S762-S765 WeakPolarHBondContact O-CB 3.33Å; S762-S765 PolarHBondContact O-N 3.04Å; L763-S765 VanDerWaalsContact C-N 3.28Å; L763-S765 PolarHBondContact O-N 3.3Å; S765-R768 PolarHBondContact OG-NH1 3.36Å; S765-R768 PolarHBondContact OG-NH2 3.01Å; S765-R769 PolarHBondContact O-N 2.82Å
766	L	95.7	Very high	85.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.1	-59.3	171.3	-175.6	162.4	0	0	0	110.7	Y754 S762 L763 R768 R769 C770 P826 L982 L1010 I1012	Y754-L766 HydrophobicContact CD1-CB 4.38Å; Y754-L766 HydrophobicContact CD1-CD1 4.29Å; Y754-L766 HydrophobicContact CD1-CG 4.25Å; Y754-L766 HydrophobicContact CD2-CB 4.13Å; Y754-L766 HydrophobicContact CD2-CG 4.49Å; Y754-L766 HydrophobicContact CE1-CB 4.17Å; Y754-L766 HydrophobicContact CE1-CD1 4.33Å; Y754-L766 HydrophobicContact CE1-CG 4.44Å; Y754-L766 VanDerWaalsContact CE2-CA 3.41Å; Y754-L766 HydrophobicContact CE2-CB 3.9Å; Y754-L766 VanDerWaalsContact CE2-N 3.35Å; Y754-L766 HydrophobicContact CG-CB 4.35Å; Y754-L766 HydrophobicContact CG-CG 4.27Å; S762-L766 PolarHBondContact O-N 2.89Å; S762-L766 VanDerWaalsContact O-N 3.11Å; L763-L766 HydrophobicContact CD1-CD1 4.34Å; L763-L766 HydrophobicContact CD1-CD2 4.33Å; L763-L766 WeakPolarHBondContact O-CB 3.36Å; L763-L766 PolarHBondContact O-N 2.93Å; L766-R768 PolarHBondContact O-N 2.74Å; L766-R769 PolarHBondContact O-N 2.88Å; L766-C770 PolarHBondContact O-N 3.29Å; L766-C770 PolarHBondContact O-SG 3.05Å; L766-P826 HydrophobicContact CD2-CB 3.93Å; L766-P826 HydrophobicContact CD2-CG 4.38Å; L766-L982 HydrophobicContact CB-CD1 4.23Å; L766-L982 HydrophobicContact CD1-CD1 3.78Å; L766-L982 HydrophobicContact CD1-CD2 4.21Å; L766-L1010 HydrophobicContact CD1-CD2 3.95Å; L766-I1012 HydrophobicContact CD1-CD1 3.75Å; L766-I1012 HydrophobicContact CD2-CD1 3.61Å; L766-I1012 HydrophobicContact CG-CD1 3.62Å
767	Y	94.8	Very high	83	Confident	11 Å²	11	57.3 Å²	57.3	4%	0.043	31%	0.305	C	S	.	.	H	α-helix	trans	-54.4	-38.8	178.1	-64.7	-35.2	0	0	0	113.2	L763 R769 C770 A771 P826 P828 G960 D961 S964	L763-Y767 HydrophobicContact CD1-CD1 4.27Å; L763-Y767 HydrophobicContact CD1-CD2 4.5Å; L763-Y767 HydrophobicContact CD1-CE1 3.76Å; L763-Y767 HydrophobicContact CD1-CE2 4.01Å; L763-Y767 HydrophobicContact CD2-CE2 4.03Å; L763-Y767 HydrophobicContact CG-CD2 4.19Å; L763-Y767 HydrophobicContact CG-CE1 4.32Å; L763-Y767 HydrophobicContact CG-CE2 3.62Å; L763-Y767 WeakPolarHBondContact O-CD2 3.24Å; L763-Y767 PolarHBondContact O-N 3.1Å; Y767-R769 PolarHBondContact O-N 2.72Å; Y767-C770 PolarHBondContact O-N 3.11Å; Y767-A771 WeakPolarHBondContact O-CB 3.35Å; Y767-A771 PolarHBondContact O-N 2.76Å; Y767-P826 HydrophobicContact CD1-CB 4.23Å; Y767-P826 WeakPolarHBondContact CD1-O 3.38Å; Y767-P826 HydrophobicContact CE1-CB 4.06Å; Y767-P828 HydrophobicContact CD2-CB 4.36Å; Y767-P828 HydrophobicContact CD2-CG 4.17Å; Y767-P828 HydrophobicContact CE2-CB 4.02Å; Y767-P828 HydrophobicContact CE2-CG 4.34Å; Y767-G960 WeakPolarHBondContact OH-CA 3.39Å; Y767-D961 WeakPolarHBondContact CE2-O 3.49Å; Y767-D961 PolarHBondContact OH-N 3.35Å; Y767-D961 PolarHBondContact OH-O 3.27Å; Y767-S964 PolarHBondContact OH-O 3.27Å
768	R	93	Very high	80.4	Confident	123 Å²	123	58.8 Å²	58.8	46%	0.464	32%	0.316	S	S	.	.	H	α-helix	trans	-65.6	-34.6	179	-174.7	175	65.9	-99.7	-1.5	112.7	R764 S765 L766 N772	R764-R768 WeakPolarHBondContact O-CB 3.35Å; R764-R768 PolarHBondContact O-NH1 2.87Å; R764-R768 VanDerWaalsContact O-NH1 3.13Å; S765-R768 PolarHBondContact OG-NH1 3.36Å; S765-R768 PolarHBondContact OG-NH2 3.01Å; L766-R768 PolarHBondContact O-N 2.74Å; R768-N772 WeakPolarHBondContact O-CB 3.47Å; R768-N772 VanDerWaalsContact O-CG 3.23Å; R768-N772 PolarHBondContact O-N 2.87Å; R768-N772 PolarHBondContact O-OD1 3.24Å
769	R	91.3	Very high	78.1	Confident	91 Å²	91	59.9 Å²	59.9	34%	0.343	31%	0.312	S	S	.	.	H	α-helix	trans	-78.7	-40.9	175.5	-82.1	-155.8	168.5	79.1	-9.5	112.8	T753 Y754 H759 S765 L766 Y767 A771 N772 S773	T753-R769 HydrophobicContact CG2-CB 4.38Å; T753-R769 WeakPolarHBondContact O-CB 3.08Å; T753-R769 WeakPolarHBondContact O-CD 3.38Å; Y754-R769 HydrophobicContact CD2-CB 4.38Å; H759-R769 PolarHBondContact CD2-NH1 3.3Å; H759-R769 VanDerWaalsContact CD2-NH1 3.29Å; H759-R769 PolarHBondContact CD2-NH2 3.35Å; H759-R769 WeakPolarHBondContact CE1-CD 3.35Å; H759-R769 PolarHBondContact CE1-NE 3.27Å; H759-R769 VanDerWaalsContact CE1-NE 3.33Å; H759-R769 VanDerWaalsContact CG-CZ 3.44Å; H759-R769 WeakPolarHBondContact ND1-CD 2.99Å; H759-R769 PolarHBondContact NE2-NE 3.37Å; H759-R769 PolarHBondContact NE2-NH2 2.89Å; S765-R769 PolarHBondContact O-N 2.82Å; L766-R769 PolarHBondContact O-N 2.88Å; Y767-R769 PolarHBondContact O-N 2.72Å; R769-A771 PolarHBondContact O-N 2.91Å; R769-N772 PolarHBondContact O-N 2.84Å; R769-N772 VanDerWaalsContact O-N 3.07Å; R769-S773 PolarHBondContact O-N 2.95Å; R769-S773 VanDerWaalsContact O-N 3.09Å
770	C	90.5	Very high	75.5	Confident	4 Å²	4	65 Å²	65	3%	0.027	34%	0.341	C	S	.	.	H	α-helix	trans	-48.9	-46.7	169.5	-72.4	0	0	0	0	112	L766 Y767 H825 P826	L766-C770 PolarHBondContact O-N 3.29Å; L766-C770 PolarHBondContact O-SG 3.05Å; Y767-C770 PolarHBondContact O-N 3.11Å; C770-H825 HydrophobicContact CB-CB 3.93Å; C770-H825 PolarHBondContact SG-ND1 3.16Å; C770-H825 VanDerWaalsContact SG-ND1 3.37Å; C770-P826 WeakPolarHBondContact CB-O 3.49Å
771	A	86.7	Confident	72.7	Confident	27 Å²	27	72.2 Å²	72.2	22%	0.223	37%	0.366	C	S	.	.	H	α-helix	trans	-70.6	-34	177.8	0	0	0	0	0	114.2	Y767 R769 Y800	Y767-A771 WeakPolarHBondContact O-CB 3.35Å; Y767-A771 PolarHBondContact O-N 2.76Å; R769-A771 PolarHBondContact O-N 2.91Å; A771-Y800 HydrophobicContact CB-CD1 3.74Å; A771-Y800 HydrophobicContact CB-CE1 3.68Å
772	N	77.3	Confident	69.6	Low	78 Å²	78	72.3 Å²	72.3	42%	0.417	38%	0.377	S	S	.	.	H	α-helix	trans	-78	-25.7	-176.1	-80.8	10.7	0	0	0	113.9	R768 R769 L774 T775	R768-N772 WeakPolarHBondContact O-CB 3.47Å; R768-N772 VanDerWaalsContact O-CG 3.23Å; R768-N772 PolarHBondContact O-N 2.87Å; R768-N772 PolarHBondContact O-OD1 3.24Å; R769-N772 PolarHBondContact O-N 2.84Å; R769-N772 VanDerWaalsContact O-N 3.07Å; N772-L774 PolarHBondContact O-N 2.86Å; N772-L774 VanDerWaalsContact O-N 3.11Å; N772-T775 WeakPolarHBondContact O-CB 3.02Å; N772-T775 PolarHBondContact O-N 3.48Å; N772-T775 PolarHBondContact O-OG1 2.81Å
773	S	62.6	Low	66.6	Low	19 Å²	19	82.4 Å²	82.4	13%	0.133	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-55.2	-33.6	-170.4	-161.9	0	0	0	0	113.6	T753 R769 T775	T753-S773 PolarHBondContact OG1-OG 3.39Å; R769-S773 PolarHBondContact O-N 2.95Å; R769-S773 VanDerWaalsContact O-N 3.09Å; S773-T775 PolarHBondContact O-N 3.23Å; S773-T775 VanDerWaalsContact O-N 3.16Å
774	L	56.2	Low	63.3	Low	84 Å²	84	85 Å²	85	44%	0.44	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-69	-9.6	176.7	-80.5	76.8	0	0	0	114.5	N772 A802	N772-L774 PolarHBondContact O-N 2.86Å; N772-L774 VanDerWaalsContact O-N 3.11Å; L774-A802 HydrophobicContact CD1-CB 3.55Å; L774-A802 HydrophobicContact CD2-CB 3.58Å; L774-A802 HydrophobicContact CG-CB 4.21Å
775	T	49.9	Very low	60.4	Low	65 Å²	65	85.3 Å²	85.3	40%	0.399	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-107.6	-3.4	-170.5	74.1	0	0	0	0	114.2	N772 S773 K779	N772-T775 WeakPolarHBondContact O-CB 3.02Å; N772-T775 PolarHBondContact O-N 3.48Å; N772-T775 PolarHBondContact O-OG1 2.81Å; S773-T775 PolarHBondContact O-N 3.23Å; S773-T775 VanDerWaalsContact O-N 3.16Å; T775-K779 WeakPolarHBondContact O-CE 3.2Å; T775-K779 PolarHBondContact O-NZ 3.45Å
776	E	48.9	Very low	57.4	Low	120 Å²	120	90.5 Å²	90.5	56%	0.561	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-33.5	-175.5	-57.4	-163	147.4	0	0	112.2	S778 K779	E776-S778 PolarHBondContact O-N 3.18Å; E776-K779 PolarHBondContact O-N 3.42Å
777	S	45.8	Very low	54.4	Low	88 Å²	88	98.5 Å²	98.5	62%	0.615	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-13.1	171.9	55.5	0	0	0	0	115.4
778	S	38.6	Very low	51.7	Low	87 Å²	87	103.3 Å²	103.3	61%	0.608	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	1.9	177.7	47	0	0	0	0	114.7	E776	E776-S778 PolarHBondContact O-N 3.18Å
779	K	44	Very low	48.8	Very low	123 Å²	123	107.5 Å²	107.5	54%	0.535	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.6	-31.1	-175.6	-65	-166.2	-177	89.1	0	114.9	T775 E776 H781	T775-K779 WeakPolarHBondContact O-CE 3.2Å; T775-K779 PolarHBondContact O-NZ 3.45Å; E776-K779 PolarHBondContact O-N 3.42Å; K779-H781 PolarHBondContact O-N 2.9Å
780	D	39.2	Very low	46	Very low	147 Å²	147	112.1 Å²	112.1	79%	0.786	60%	0.597	S	S	*	*	S	Bend	trans	-89.8	0.1	-167.7	-68.5	-13.8	0	0	0	114.9
781	H	35.5	Very low	43.2	Very low	185 Å²	185	120.8 Å²	120.8	86%	0.856	63%	0.634	S	S	*	*	S	Bend	trans	-129.4	64.9	177.1	-88.6	27.3	0	0	0	112.9	K779	K779-H781 PolarHBondContact O-N 2.9Å
782	S	30.3	Very low	40.7	Very low	91 Å²	91	127.6 Å²	127.6	64%	0.636	66%	0.661	S	S	*	*			trans	-154.2	121.7	146.7	59.6	0	0	0	0	114.2	G784	S782-G784 VanDerWaalsContact C-N 3.29Å; S782-G784 PolarHBondContact O-N 3.5Å; S782-G784 VanDerWaalsContact O-N 3.17Å
783	Y	31.2	Very low	38.4	Very low	243 Å²	243	129.7 Å²	129.7	95%	0.953	68%	0.676	S	S	*	*			trans	-67	100.3	138.1	-89.6	-92.9	0	0	0	105.8
784	G	27.7	Very low	37.1	Very low	55 Å²	55	136.3 Å²	136.3	57%	0.567	71%	0.709	S	S	*	*			trans	-70.9	154.5	-166.5	0	0	0	0	0	113.8	S782	S782-G784 VanDerWaalsContact C-N 3.29Å; S782-G784 PolarHBondContact O-N 3.5Å; S782-G784 VanDerWaalsContact O-N 3.17Å
785	T	35	Very low	36	Very low	130 Å²	130	138.5 Å²	138.5	80%	0.798	73%	0.726	S	S	*	*			trans	-150.2	116.7	151.3	-80.1	0	0	0	0	109
786	I	32	Very low	35	Very low	129 Å²	129	141.2 Å²	141.2	66%	0.662	75%	0.748	S	S	*	*			trans	32.7	110	148.7	-50.1	170.4	0	0	0	116.3
787	H	32.5	Very low	34.4	Very low	169 Å²	169	142 Å²	142	78%	0.782	76%	0.756	S	S	*	*				-163.9	100.4	117.1	-103.8	-67.6	0	0	0	114.2
788	T	37.1	Very low	34.3	Very low	112 Å²	112	140.7 Å²	140.7	69%	0.687	75%	0.747	S	S	*	*				43.9	117.8	128.3	57.1	0	0	0	0	121.2	M790	T788-M790 PolarHBondContact O-N 2.98Å
789	K	32.4	Very low	34.7	Very low	211 Å²	211	141.9 Å²	141.9	92%	0.917	75%	0.752	S	S	*	*			trans	-35.4	122.1	165.1	-58	169.4	-178.7	175	0	114.9
790	M	32.4	Very low	34.9	Very low	188 Å²	188	141 Å²	141	93%	0.926	75%	0.747	S	S	*	*			trans	-121.6	127	139.3	-87.9	-175.2	157.4	0	0	109.4	T788	T788-M790 PolarHBondContact O-N 2.98Å
791	K	33.1	Very low	35.3	Very low	185 Å²	185	136 Å²	136	80%	0.804	73%	0.726	S	S	*	*			trans	-112.8	154.9	160.1	-88	-166.4	171.9	-168.3	0	106.6
792	H	32.9	Very low	36.3	Very low	171 Å²	171	127.7 Å²	127.7	79%	0.792	69%	0.689	S	S	*	*			trans	70.1	138.3	-170.5	-44.7	-88.3	0	0	0	111.1
793	T	29.3	Very low	38	Very low	121 Å²	121	129.6 Å²	129.6	74%	0.742	69%	0.692	S	S	*	*			cis	-147.9	169.2	15.1	-31.6	0	0	0	0	111.5
794	L	34.5	Very low	40.3	Very low	158 Å²	158	121.7 Å²	121.7	83%	0.827	66%	0.664	S	S	*	*	S	Bend	trans	86.8	144.7	169.9	-57.9	135.3	0	0	0	116.8
795	T	33.8	Very low	43.3	Very low	130 Å²	130	119.3 Å²	119.3	80%	0.798	64%	0.638	S	S	*	*			trans	51.2	128	-173	67.8	0	0	0	0	118.1	N797	T795-N797 PolarHBondContact O-N 3.02Å
796	S	28.3	Very low	46.1	Very low	123 Å²	123	113.1 Å²	113.1	86%	0.86	60%	0.6	S	S	*	*			trans	-99.5	60.5	-171.1	60.2	0	0	0	0	112.9
797	N	36.6	Very low	49.2	Very low	137 Å²	137	107 Å²	107	73%	0.733	57%	0.569	S	S	*	*			trans	-78.9	123.1	172.7	-73.4	3.4	0	0	0	110	T795	T795-N797 PolarHBondContact O-N 3.02Å
798	S	43.7	Very low	52.3	Low	59 Å²	59	98.9 Å²	98.9	41%	0.413	53%	0.532	S	S	.	.			trans	-60.7	143.5	176.3	177.9	0	0	0	0	110.6	Y800 A801	S798-Y800 PolarHBondContact O-N 3.36Å; S798-Y800 WeakPolarHBondContact OG-CD2 3.4Å; S798-Y800 PolarHBondContact OG-N 3.4Å; S798-A801 WeakPolarHBondContact O-CB 3.08Å; S798-A801 PolarHBondContact O-N 2.93Å
799	P	46.8	Very low	55.1	Low	112 Å²	112	93.6 Å²	93.6	73%	0.727	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-10.8	173.3	28.3	-36.3	0	0	0	113.4
800	Y	49.2	Very low	58.2	Low	105 Å²	105	83.5 Å²	83.5	41%	0.412	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-14.1	172.5	-58.5	-73.7	0	0	0	113.9	A771 S798 A802 Y827	A771-Y800 HydrophobicContact CB-CD1 3.74Å; A771-Y800 HydrophobicContact CB-CE1 3.68Å; S798-Y800 PolarHBondContact O-N 3.36Å; S798-Y800 WeakPolarHBondContact OG-CD2 3.4Å; S798-Y800 PolarHBondContact OG-N 3.4Å; Y800-A802 PolarHBondContact O-N 2.92Å; Y800-Y827 WeakPolarHBondContact O-CD1 3.09Å
801	A	47	Very low	61.3	Low	42 Å²	42	77.2 Å²	77.2	35%	0.347	42%	0.421	S	S	.	.			trans	-84.1	48.8	-173.5	0	0	0	0	0	112.8	S798 N803	S798-A801 WeakPolarHBondContact O-CB 3.08Å; S798-A801 PolarHBondContact O-N 2.93Å; A801-N803 PolarHBondContact O-N 2.85Å
802	A	55.9	Low	64.3	Low	11 Å²	11	68.4 Å²	68.4	9%	0.091	38%	0.383	C	S	.	.			trans	-80	109.6	173.1	0	0	0	0	0	109.9	L774 Y800 Q804 T824	L774-A802 HydrophobicContact CD1-CB 3.55Å; L774-A802 HydrophobicContact CD2-CB 3.58Å; L774-A802 HydrophobicContact CG-CB 4.21Å; Y800-A802 PolarHBondContact O-N 2.92Å; A802-Q804 PolarHBondContact O-N 3.24Å; A802-T824 PolarHBondContact O-OG1 3.04Å
803	N	66.1	Low	67.2	Low	130 Å²	130	63.3 Å²	63.3	70%	0.695	37%	0.366	S	S	*	.			trans	-76.2	51.8	172.2	-66.9	-7.1	0	0	0	111.1	A801	A801-N803 PolarHBondContact O-N 2.85Å
804	Q	79.9	Confident	70.3	Confident	77 Å²	77	61 Å²	61	36%	0.36	35%	0.352	S	S	.	.			trans	-100.3	127.1	171.3	-68	-63.6	-2.3	0	0	108.7	A802 T824	A802-Q804 PolarHBondContact O-N 3.24Å; Q804-T824 VanDerWaalsContact O-CA 3.25Å; Q804-T824 WeakPolarHBondContact O-CA 3.3Å
805	P	91.4	Very high	73	Confident	5 Å²	5	58.1 Å²	58.1	3%	0.032	34%	0.338	C	S	.	.			trans	-64.9	154.9	176.7	25.5	-30.1	0	0	0	111	D744 A745 L822 F1015	D744-P805 HydrophobicContact CB-CG 4.44Å; A745-P805 HydrophobicContact CB-CB 4.25Å; A745-P805 HydrophobicContact CB-CG 3.86Å; P805-L822 CarbonylContact C-O 3.5Å; P805-L822 VanDerWaalsContact CA-O 3.23Å; P805-L822 WeakPolarHBondContact CA-O 3.37Å; P805-F1015 HydrophobicContact CB-CD2 3.97Å; P805-F1015 HydrophobicContact CB-CE2 4.38Å; P805-F1015 HydrophobicContact CG-CB 4.31Å; P805-F1015 HydrophobicContact CG-CD2 3.84Å; P805-F1015 HydrophobicContact CG-CG 4.39Å; P805-F1015 WeakPolarHBondContact O-CD2 3.42Å
806	C	94.3	Very high	75.9	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	146.9	171.3	68.1	0	0	0	0	112.2	L822 I1012 W1013	C806-L822 PolarHBondContact N-O 3.35Å; C806-L822 PolarHBondContact O-N 2.86Å; C806-I1012 HydrophobicContact CB-CG2 3.89Å; C806-W1013 CarbonylContact C-O 3.51Å; C806-W1013 WeakPolarHBondContact CA-O 3.24Å; C806-W1013 WeakPolarHBondContact CB-O 3.42Å
807	I	96.2	Very high	79	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	123.4	169.5	-62.7	156.9	0	0	0	108.5	F729 L737 L741 W750 I809 M821 F842 I1012 W1013 F1015	F729-I807 HydrophobicContact CZ-CG2 4.45Å; L737-I807 HydrophobicContact CD1-CD1 4Å; L737-I807 HydrophobicContact CD1-CG2 4.21Å; L741-I807 HydrophobicContact CD2-CD1 4.41Å; W750-I807 HydrophobicContact CE3-CD1 4.11Å; W750-I807 HydrophobicContact CH2-CD1 3.49Å; W750-I807 VanDerWaalsContact CH2-CD1 3.49Å; W750-I807 HydrophobicContact CZ2-CD1 4.1Å; W750-I807 HydrophobicContact CZ3-CD1 3.49Å; W750-I807 VanDerWaalsContact CZ3-CD1 3.49Å; I807-I809 HydrophobicContact CG2-CB 4.37Å; I807-M821 HydrophobicContact CD1-CE 4.1Å; I807-M821 HydrophobicContact CG1-CE 3.5Å; I807-M821 VanDerWaalsContact CG1-CE 3.5Å; I807-M821 HydrophobicContact CG1-SD 3.9Å; I807-F842 HydrophobicContact CG2-CE1 4.27Å; I807-F842 HydrophobicContact CG2-CZ 3.86Å; I807-I1012 CarbonylContact O-C 3.5Å; I807-I1012 VanDerWaalsContact O-CA 3.26Å; I807-I1012 WeakPolarHBondContact O-CA 3.14Å; I807-W1013 HydrophobicContact CB-CB 4.39Å; I807-W1013 PolarHBondContact N-O 2.76Å; I807-W1013 PolarHBondContact O-N 2.83Å; I807-F1015 HydrophobicContact CD1-CE1 4.5Å; I807-F1015 HydrophobicContact CD1-CE2 4.24Å; I807-F1015 HydrophobicContact CD1-CZ 3.58Å; I807-F1015 HydrophobicContact CG1-CE2 4.08Å; I807-F1015 HydrophobicContact CG1-CZ 3.9Å
808	L	97.3	Very high	81.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	130.9	158	175.6	69.4	0	0	0	108.6	I810 G819 A820 L822 I967 L978 L1010 I1012	L808-I810 HydrophobicContact CD2-CD1 4.45Å; L808-G819 CarbonylContact O-C 3.55Å; L808-G819 WeakPolarHBondContact O-CA 3.46Å; L808-A820 PolarHBondContact N-O 3.13Å; L808-A820 PolarHBondContact O-N 2.88Å; L808-L822 HydrophobicContact CB-CD1 4.48Å; L808-I967 HydrophobicContact CD2-CD1 3.35Å; L808-L978 HydrophobicContact CD2-CD1 4.36Å; L808-L1010 HydrophobicContact CD1-CD1 4.05Å; L808-L1010 HydrophobicContact CD1-CD2 3.71Å; L808-L1010 HydrophobicContact CD1-CG 3.77Å; L808-I1012 HydrophobicContact CB-CG1 4.41Å; L808-I1012 HydrophobicContact CD1-CD1 4.13Å; L808-I1012 HydrophobicContact CD1-CG1 3.62Å
809	I	97	Very high	84.5	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	140.6	173.3	-174.7	168.6	0	0	0	111.5	I728 F729 I807 I817 W844 L1010 E1011	I728-I809 HydrophobicContact CB-CD1 4.41Å; I728-I809 HydrophobicContact CD1-CG2 4.27Å; I728-I809 HydrophobicContact CG2-CD1 3.7Å; I728-I809 HydrophobicContact CG2-CG1 3.93Å; F729-I809 HydrophobicContact CD1-CD1 3.83Å; F729-I809 HydrophobicContact CE1-CD1 3.31Å; F729-I809 HydrophobicContact CE2-CG2 4.48Å; F729-I809 HydrophobicContact CZ-CD1 3.93Å; F729-I809 HydrophobicContact CZ-CG2 4.09Å; I807-I809 HydrophobicContact CG2-CB 4.37Å; I809-I817 HydrophobicContact CD1-CG2 3.78Å; I809-I817 HydrophobicContact CG1-CG2 4Å; I809-W844 HydrophobicContact CD1-CH2 4.26Å; I809-W844 HydrophobicContact CD1-CZ3 3.89Å; I809-L1010 WeakPolarHBondContact O-CA 3.47Å; I809-E1011 HydrophobicContact CG2-CB 3.84Å; I809-E1011 PolarHBondContact N-O 3.27Å; I809-E1011 PolarHBondContact O-N 2.81Å
810	I	97.6	Very high	86.9	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	135.8	-173.6	-60.7	168.4	0	0	0	108.9	L808 I817 F818 I976 L978 F1005 I1007 L1010	L808-I810 HydrophobicContact CD2-CD1 4.45Å; I810-I817 WeakPolarHBondContact O-CA 3.21Å; I810-F818 HydrophobicContact CB-CE2 4.28Å; I810-F818 HydrophobicContact CD1-CD2 4.49Å; I810-F818 HydrophobicContact CD1-CE2 3.94Å; I810-F818 HydrophobicContact CG2-CE2 4.37Å; I810-F818 HydrophobicContact CG2-CZ 4.16Å; I810-F818 PolarHBondContact N-O 2.76Å; I810-F818 PolarHBondContact O-N 3.5Å; I810-I976 HydrophobicContact CD1-CG2 3.92Å; I810-L978 HydrophobicContact CD1-CD1 4.43Å; I810-L978 HydrophobicContact CD1-CD2 3.79Å; I810-F1005 HydrophobicContact CG2-CE2 4.16Å; I810-I1007 HydrophobicContact CG2-CG1 4.16Å; I810-I1007 HydrophobicContact CG2-CG2 4.45Å; I810-L1010 HydrophobicContact CG1-CD1 4.13Å; I810-L1010 HydrophobicContact CG1-CG 4.17Å
811	R	96.2	Very high	89.2	Confident	56 Å²	56	28.2 Å²	28.2	21%	0.211	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	122.4	164.9	-170.2	177.2	97.5	-138	-5	109.3	E727 I728 E816 I817 T1008 T1009	E727-R811 PolarHBondContact O-NH1 3.38Å; I728-R811 HydrophobicContact CD1-CB 4.08Å; I728-R811 HydrophobicContact CG1-CB 4.02Å; I728-R811 HydrophobicContact CG2-CB 4.07Å; R811-E816 WeakPolarHBondContact CA-O 3.35Å; R811-I817 HydrophobicContact CB-CG1 4.24Å; R811-I817 HydrophobicContact CG-CD1 4.35Å; R811-I817 HydrophobicContact CG-CG1 3.9Å; R811-T1008 PolarHBondContact O-N 3.47Å; R811-T1009 PolarHBondContact N-O 3.13Å; R811-T1009 PolarHBondContact O-N 2.96Å
812	T	96	Very high	91.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	169.4	179.5	63.2	0	0	0	0	112.8	T814 N815 E816 F818 T999 F1005 I1006 T1008	T812-T814 PolarHBondContact O-N 2.95Å; T812-T814 PolarHBondContact OG1-N 3.1Å; T812-T814 PolarHBondContact OG1-OG1 2.75Å; T812-N815 WeakPolarHBondContact O-CA 3.45Å; T812-N815 PolarHBondContact O-N 2.83Å; T812-N815 PolarHBondContact OG1-N 3.19Å; T812-E816 HydrophobicContact CG2-CB 4.48Å; T812-E816 PolarHBondContact N-O 2.9Å; T812-E816 WeakPolarHBondContact OG1-CB 3.38Å; T812-E816 PolarHBondContact OG1-N 2.88Å; T812-E816 PolarHBondContact OG1-O 2.91Å; T812-F818 HydrophobicContact CG2-CE1 3.52Å; T812-F818 HydrophobicContact CG2-CZ 4Å; T812-T999 HydrophobicContact CG2-CG2 4.38Å; T812-F1005 HydrophobicContact CG2-CB 3.87Å; T812-F1005 HydrophobicContact CG2-CD2 3.88Å; T812-F1005 HydrophobicContact CG2-CG 4.02Å; T812-I1006 CarbonylContact C-O 3.52Å; T812-I1006 VanDerWaalsContact CA-O 3.24Å; T812-I1006 WeakPolarHBondContact CA-O 3.39Å; T812-T1008 PolarHBondContact O-OG1 3.05Å
813	S	95.1	Very high	93.2	Very high	64 Å²	64	26.6 Å²	26.6	45%	0.448	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.9	167.6	58.5	0	0	0	0	113.6	N815 I1006 T1008	S813-N815 PolarHBondContact O-N 3.26Å; S813-I1006 PolarHBondContact N-O 3.42Å; S813-T1008 VanDerWaalsContact CA-OG1 3.29Å; S813-T1008 WeakPolarHBondContact CA-OG1 3.31Å; S813-T1008 PolarHBondContact N-OG1 2.59Å
814	T	93.5	Very high	94.4	Very high	71 Å²	71	20.6 Å²	20.6	44%	0.436	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-0.9	170.9	48.1	0	0	0	0	113.5	T812 E816	T812-T814 PolarHBondContact O-N 2.95Å; T812-T814 PolarHBondContact OG1-N 3.1Å; T812-T814 PolarHBondContact OG1-OG1 2.75Å; T814-E816 VanDerWaalsContact CB-OE2 3.29Å; T814-E816 WeakPolarHBondContact CB-OE2 3.46Å; T814-E816 PolarHBondContact O-N 2.94Å; T814-E816 WeakPolarHBondContact OG1-CG 3.21Å; T814-E816 PolarHBondContact OG1-OE2 3.06Å
815	N	91.5	Very high	95.1	Very high	99 Å²	99	17.2 Å²	17.2	53%	0.529	10%	0.095	S	C	.	.			trans	58.5	27.8	-171.9	-59.6	-79.8	0	0	0	113.9	T812 S813	T812-N815 WeakPolarHBondContact O-CA 3.45Å; T812-N815 PolarHBondContact O-N 2.83Å; T812-N815 PolarHBondContact OG1-N 3.19Å; S813-N815 PolarHBondContact O-N 3.26Å
816	E	93.7	Very high	95.2	Very high	19 Å²	19	17 Å²	17	9%	0.089	9%	0.094	C	C	.	.			trans	-81.2	142.7	167.3	-61.2	174.1	83.2	0	0	108.7	R811 T812 T814 L1000 S1001	R811-E816 WeakPolarHBondContact CA-O 3.35Å; T812-E816 HydrophobicContact CG2-CB 4.48Å; T812-E816 PolarHBondContact N-O 2.9Å; T812-E816 WeakPolarHBondContact OG1-CB 3.38Å; T812-E816 PolarHBondContact OG1-N 2.88Å; T812-E816 PolarHBondContact OG1-O 2.91Å; T814-E816 VanDerWaalsContact CB-OE2 3.29Å; T814-E816 WeakPolarHBondContact CB-OE2 3.46Å; T814-E816 PolarHBondContact O-N 2.94Å; T814-E816 WeakPolarHBondContact OG1-CG 3.21Å; T814-E816 PolarHBondContact OG1-OE2 3.06Å; E816-L1000 PolarHBondContact OE1-N 3.05Å; E816-S1001 PolarHBondContact OE1-N 3.33Å; E816-S1001 VanDerWaalsContact OE2-CB 3.25Å; E816-S1001 WeakPolarHBondContact OE2-CB 3.43Å; E816-S1001 PolarHBondContact OE2-OG 2.92Å
817	I	95.3	Very high	95.2	Very high	17 Å²	17	19.2 Å²	19.2	9%	0.087	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	123.7	-174.1	-59.7	169.8	0	0	0	109.3	I728 K733 I809 I810 R811 W844	I728-I817 HydrophobicContact CG2-CD1 3.94Å; I728-I817 HydrophobicContact CG2-CG1 4.11Å; I728-I817 HydrophobicContact CG2-CG2 3.64Å; K733-I817 HydrophobicContact CD-CD1 4.41Å; I809-I817 HydrophobicContact CD1-CG2 3.78Å; I809-I817 HydrophobicContact CG1-CG2 4Å; I810-I817 WeakPolarHBondContact O-CA 3.21Å; R811-I817 HydrophobicContact CB-CG1 4.24Å; R811-I817 HydrophobicContact CG-CD1 4.35Å; R811-I817 HydrophobicContact CG-CG1 3.9Å; I817-W844 HydrophobicContact CB-CE3 4.16Å; I817-W844 HydrophobicContact CG2-CE3 3.62Å; I817-W844 HydrophobicContact CG2-CZ3 3.75Å; I817-W844 PolarHBondContact O-N 2.84Å
818	F	97	Very high	95	Very high	1 Å²	1	20 Å²	20	0%	0.004	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	174.1	-179.7	57.8	-91.5	0	0	0	110.1	I810 T812 F842 R843 I976 L998 T999 F1005	I810-F818 HydrophobicContact CB-CE2 4.28Å; I810-F818 HydrophobicContact CD1-CD2 4.49Å; I810-F818 HydrophobicContact CD1-CE2 3.94Å; I810-F818 HydrophobicContact CG2-CE2 4.37Å; I810-F818 HydrophobicContact CG2-CZ 4.16Å; I810-F818 PolarHBondContact N-O 2.76Å; I810-F818 PolarHBondContact O-N 3.5Å; T812-F818 HydrophobicContact CG2-CE1 3.52Å; T812-F818 HydrophobicContact CG2-CZ 4Å; F818-F842 CarbonylContact C-O 3.38Å; F818-F842 VanDerWaalsContact CA-O 3.24Å; F818-F842 WeakPolarHBondContact CA-O 3.35Å; F818-F842 WeakPolarHBondContact CB-O 3.49Å; F818-R843 HydrophobicContact CB-CB 3.75Å; F818-I976 HydrophobicContact CD2-CD1 4.13Å; F818-I976 HydrophobicContact CD2-CG1 4.4Å; F818-I976 HydrophobicContact CE2-CD1 4.44Å; F818-I976 HydrophobicContact CE2-CG1 4.41Å; F818-L998 HydrophobicContact CB-CB 4.22Å; F818-L998 HydrophobicContact CD2-CB 4.15Å; F818-L998 HydrophobicContact CD2-CD1 4Å; F818-L998 HydrophobicContact CG-CB 4.09Å; F818-T999 HydrophobicContact CD1-CG2 4.28Å; F818-T999 HydrophobicContact CE1-CG2 3.45Å; F818-T999 VanDerWaalsContact CE1-CG2 3.45Å; F818-T999 HydrophobicContact CZ-CG2 3.92Å; F818-F1005 HydrophobicContact CE2-CE1 4.01Å; F818-F1005 HydrophobicContact CE2-CE2 4.29Å; F818-F1005 AromaticContact CE2-CZ 3.78Å; F818-F1005 HydrophobicContact CE2-CZ 3.78Å; F818-F1005 AromaticContact CZ-CD1 3.89Å; F818-F1005 HydrophobicContact CZ-CD1 3.89Å; F818-F1005 HydrophobicContact CZ-CD2 4.04Å; F818-F1005 AromaticContact CZ-CE1 3.6Å; F818-F1005 HydrophobicContact CZ-CE1 3.6Å; F818-F1005 AromaticContact CZ-CE2 3.76Å; F818-F1005 HydrophobicContact CZ-CE2 3.76Å; F818-F1005 HydrophobicContact CZ-CG 4.11Å; F818-F1005 AromaticContact CZ-CZ 3.53Å; F818-F1005 HydrophobicContact CZ-CZ 3.53Å
819	G	97.4	Very high	94.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.9	-166.8	-176.1	0	0	0	0	0	113.7	L808 V841 F842	L808-G819 CarbonylContact O-C 3.55Å; L808-G819 WeakPolarHBondContact O-CA 3.46Å; G819-V841 WeakPolarHBondContact O-CA 3.18Å; G819-F842 PolarHBondContact N-O 3.18Å; G819-F842 PolarHBondContact O-N 2.89Å
820	A	97.8	Very high	94.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	140.6	179.5	0	0	0	0	0	111.3	L808 L822 F840 V841 I967 I976	L808-A820 PolarHBondContact N-O 3.13Å; L808-A820 PolarHBondContact O-N 2.88Å; A820-L822 HydrophobicContact CB-CD2 3.81Å; A820-L822 HydrophobicContact CB-CG 4.37Å; A820-F840 CarbonylContact C-O 3.53Å; A820-F840 VanDerWaalsContact CA-O 3.3Å; A820-F840 WeakPolarHBondContact CA-O 3.43Å; A820-V841 HydrophobicContact CB-CG1 4.05Å; A820-I967 HydrophobicContact CB-CD1 4.15Å; A820-I967 HydrophobicContact CB-CG2 3.89Å; A820-I976 HydrophobicContact CB-CD1 4.33Å
821	M	96.5	Very high	93.8	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	128.5	158.5	-179.2	63.4	78.4	0	0	108	L741 T742 I807 C839 F840 F1015	L741-M821 HydrophobicContact CD2-CE 3.48Å; L741-M821 VanDerWaalsContact CD2-CE 3.48Å; T742-M821 HydrophobicContact CG2-CG 3.98Å; I807-M821 HydrophobicContact CD1-CE 4.1Å; I807-M821 HydrophobicContact CG1-CE 3.5Å; I807-M821 VanDerWaalsContact CG1-CE 3.5Å; I807-M821 HydrophobicContact CG1-SD 3.9Å; M821-C839 VanDerWaalsContact O-CA 3.28Å; M821-C839 WeakPolarHBondContact O-CA 3.39Å; M821-F840 HydrophobicContact CB-CD1 3.62Å; M821-F840 HydrophobicContact CB-CD2 4.11Å; M821-F840 HydrophobicContact CB-CE1 3.32Å; M821-F840 HydrophobicContact CB-CE2 3.85Å; M821-F840 HydrophobicContact CB-CG 4Å; M821-F840 HydrophobicContact CB-CZ 3.43Å; M821-F840 VanDerWaalsContact CB-CZ 3.43Å; M821-F840 HydrophobicContact CE-CZ 4.38Å; M821-F840 HydrophobicContact CG-CD1 4.09Å; M821-F840 HydrophobicContact CG-CE1 3.6Å; M821-F840 HydrophobicContact CG-CZ 4.04Å; M821-F840 PolarHBondContact N-O 3.35Å; M821-F840 PolarHBondContact O-N 2.91Å; M821-F840 VanDerWaalsContact O-N 3.13Å; M821-F1015 HydrophobicContact CE-CE2 4.04Å; M821-F1015 HydrophobicContact CE-CZ 3.95Å; M821-F1015 HydrophobicContact SD-CE2 3.99Å; M821-F1015 HydrophobicContact SD-CZ 4.49Å
822	L	95.5	Very high	93.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	135.6	-179.9	-52	179.5	0	0	0	108.8	P805 C806 L808 A820 T824 P826 I958 I967	P805-L822 CarbonylContact C-O 3.5Å; P805-L822 VanDerWaalsContact CA-O 3.23Å; P805-L822 WeakPolarHBondContact CA-O 3.37Å; C806-L822 PolarHBondContact N-O 3.35Å; C806-L822 PolarHBondContact O-N 2.86Å; L808-L822 HydrophobicContact CB-CD1 4.48Å; A820-L822 HydrophobicContact CB-CD2 3.81Å; A820-L822 HydrophobicContact CB-CG 4.37Å; L822-T824 WeakPolarHBondContact CB-O 3.39Å; L822-T824 PolarHBondContact O-N 2.83Å; L822-P826 HydrophobicContact CD1-CG 3.74Å; L822-I958 HydrophobicContact CB-CD1 3.96Å; L822-I958 HydrophobicContact CD1-CD1 4.36Å; L822-I958 HydrophobicContact CD2-CD1 3.91Å; L822-I958 HydrophobicContact CD2-CG1 4.07Å; L822-I958 HydrophobicContact CG-CD1 4.29Å; L822-I967 HydrophobicContact CD1-CD1 4.14Å; L822-I967 HydrophobicContact CD2-CD1 4.04Å; L822-I967 HydrophobicContact CD2-CG1 4.11Å; L822-I967 HydrophobicContact CD2-CG2 3.95Å
823	N	92.5	Very high	93.5	Very high	18 Å²	18	38.3 Å²	38.3	10%	0.096	20%	0.202	C	C	.	.	S	Bend	trans	-79.3	-3.3	179.9	79.1	-76	0	0	0	113.9	G835 N836 C839	N823-G835 WeakPolarHBondContact OD1-CA 3.41Å; N823-N836 WeakPolarHBondContact CB-OD1 3.17Å; N823-N836 VanDerWaalsContact CG-CG 3.46Å; N823-N836 PolarHBondContact OD1-N 3.13Å; N823-N836 PolarHBondContact OD1-OD1 3.01Å; N823-C839 PolarHBondContact N-SG 3.38Å; N823-C839 VanDerWaalsContact N-SG 3.42Å; N823-C839 PolarHBondContact OD1-SG 2.9Å
824	T	92	Very high	93.5	Very high	5 Å²	5	36.3 Å²	36.3	3%	0.031	19%	0.185	C	C	.	.	S	Bend	trans	-156.7	153	179.5	-179	0	0	0	0	108.5	A802 Q804 L822 Y834 I958	A802-T824 PolarHBondContact O-OG1 3.04Å; Q804-T824 VanDerWaalsContact O-CA 3.25Å; Q804-T824 WeakPolarHBondContact O-CA 3.3Å; L822-T824 WeakPolarHBondContact CB-O 3.39Å; L822-T824 PolarHBondContact O-N 2.83Å; T824-Y834 HydrophobicContact CG2-CD2 3.73Å; T824-Y834 HydrophobicContact CG2-CE2 3.99Å; T824-I958 HydrophobicContact CG2-CD1 4.1Å
825	H	93.3	Very high	93.4	Very high	6 Å²	6	34.4 Å²	34.4	3%	0.028	18%	0.179	C	C	.	.			trans	-65.2	145.2	-179.4	-93.8	-69.7	0	0	0	113.3	C770 Y827 S1014	C770-H825 HydrophobicContact CB-CB 3.93Å; C770-H825 PolarHBondContact SG-ND1 3.16Å; C770-H825 VanDerWaalsContact SG-ND1 3.37Å; H825-Y827 VanDerWaalsContact O-CD1 3.29Å; H825-Y827 WeakPolarHBondContact O-CD1 3.44Å; H825-Y827 PolarHBondContact O-N 3.43Å; H825-S1014 PolarHBondContact CE1-OG 3.02Å; H825-S1014 PolarHBondContact NE2-OG 2.75Å
826	P	94.2	Very high	93.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.17	C	C	.	.			trans	-59	128.1	169	-26.5	35	0	0	0	112.9	L766 Y767 C770 L822 Y834 L965 I1012	L766-P826 HydrophobicContact CD2-CB 3.93Å; L766-P826 HydrophobicContact CD2-CG 4.38Å; Y767-P826 HydrophobicContact CD1-CB 4.23Å; Y767-P826 WeakPolarHBondContact CD1-O 3.38Å; Y767-P826 HydrophobicContact CE1-CB 4.06Å; C770-P826 WeakPolarHBondContact CB-O 3.49Å; L822-P826 HydrophobicContact CD1-CG 3.74Å; P826-Y834 WeakPolarHBondContact CA-OH 3.3Å; P826-L965 HydrophobicContact CB-CD1 4.1Å; P826-L965 HydrophobicContact CB-CD2 3.9Å; P826-L965 HydrophobicContact CG-CD2 4.16Å; P826-I1012 HydrophobicContact CG-CD1 4.18Å
827	Y	93.3	Very high	93.3	Very high	47 Å²	47	33.4 Å²	33.4	18%	0.184	18%	0.183	C	C	.	.			trans	-142.5	158.5	171.3	64.2	-101.3	0	0	0	111.1	Y800 H825 S829 Y834	Y800-Y827 WeakPolarHBondContact O-CD1 3.09Å; H825-Y827 VanDerWaalsContact O-CD1 3.29Å; H825-Y827 WeakPolarHBondContact O-CD1 3.44Å; H825-Y827 PolarHBondContact O-N 3.43Å; Y827-S829 PolarHBondContact O-N 2.8Å; Y827-Y834 AromaticContact CD1-CE2 3.9Å; Y827-Y834 HydrophobicContact CD1-CE2 3.9Å; Y827-Y834 HydrophobicContact CD2-CE1 4.49Å; Y827-Y834 AromaticContact CE1-CD2 3.68Å; Y827-Y834 HydrophobicContact CE1-CD2 3.68Å; Y827-Y834 AromaticContact CE1-CE2 3.52Å; Y827-Y834 HydrophobicContact CE1-CE2 3.52Å; Y827-Y834 HydrophobicContact CE1-CG 4.27Å; Y827-Y834 AromaticContact CE1-CZ 3.98Å; Y827-Y834 HydrophobicContact CE2-CD1 4.24Å; Y827-Y834 HydrophobicContact CE2-CE1 4.14Å; Y827-Y834 HydrophobicContact CE2-CG 4.47Å; Y827-Y834 AromaticContact CZ-CD2 3.73Å; Y827-Y834 AromaticContact CZ-CE2 3.86Å; Y827-Y834 AromaticContact CZ-CG 3.82Å; Y827-Y834 PolarHBondContact N-OH 3.09Å; Y827-Y834 PolarHBondContact O-OH 2.87Å
828	P	93.5	Very high	93.2	Very high	17 Å²	17	34.4 Å²	34.4	11%	0.11	19%	0.192	C	C	.	.			trans	-72.2	113.6	175	28.8	-32.7	0	0	0	110.3	Y767 G960 Y962	Y767-P828 HydrophobicContact CD2-CB 4.36Å; Y767-P828 HydrophobicContact CD2-CG 4.17Å; Y767-P828 HydrophobicContact CE2-CB 4.02Å; Y767-P828 HydrophobicContact CE2-CG 4.34Å; P828-G960 CarbonylContact C-O 3.52Å; P828-G960 WeakPolarHBondContact CA-O 3.5Å; P828-Y962 HydrophobicContact CB-CE1 4.41Å; P828-Y962 HydrophobicContact CB-CE2 4.18Å; P828-Y962 HydrophobicContact CG-CE1 4.41Å
829	S	91.8	Very high	93.1	Very high	14 Å²	14	34.4 Å²	34.4	10%	0.098	19%	0.192	C	C	.	.			trans	-101.3	6.3	-175.3	57.9	0	0	0	0	113.8	Y827 G831 R832 Y834 N959 G960	Y827-S829 PolarHBondContact O-N 2.8Å; S829-G831 PolarHBondContact O-N 2.86Å; S829-R832 WeakPolarHBondContact CB-O 3.29Å; S829-R832 WeakPolarHBondContact O-CB 3.23Å; S829-R832 PolarHBondContact O-N 3.44Å; S829-R832 PolarHBondContact OG-O 2.96Å; S829-Y834 VanDerWaalsContact CB-CE1 3.46Å; S829-Y834 WeakPolarHBondContact OG-CE1 3.45Å; S829-N959 PolarHBondContact OG-OD1 3.12Å; S829-G960 PolarHBondContact N-O 3.35Å; S829-G960 PolarHBondContact OG-N 2.93Å; S829-G960 PolarHBondContact OG-O 3.02Å
830	N	88.2	Confident	93.1	Very high	117 Å²	117	34.6 Å²	34.6	63%	0.626	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	51.4	-177	-68.5	110.1	0	0	0	112.3	R832	N830-R832 PolarHBondContact O-N 3.18Å
831	G	85.9	Confident	93.1	Very high	42 Å²	42	34.6 Å²	34.6	43%	0.433	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	-0.4	176.8	0	0	0	0	0	115.3	S829 N959	S829-G831 PolarHBondContact O-N 2.86Å; G831-N959 VanDerWaalsContact C-OD1 3.27Å; G831-N959 VanDerWaalsContact CA-OD1 3.3Å; G831-N959 WeakPolarHBondContact CA-OD1 3.4Å; G831-N959 PolarHBondContact O-ND2 3.02Å
832	R	92.2	Very high	93.1	Very high	194 Å²	194	34.6 Å²	34.6	73%	0.732	19%	0.192	S	C	*	.			trans	-83.1	136	174.2	-65.4	-177.6	175.2	-177.4	-1.9	111	S829 N830 N959	S829-R832 WeakPolarHBondContact CB-O 3.29Å; S829-R832 WeakPolarHBondContact O-CB 3.23Å; S829-R832 PolarHBondContact O-N 3.44Å; S829-R832 PolarHBondContact OG-O 2.96Å; N830-R832 PolarHBondContact O-N 3.18Å; R832-N959 PolarHBondContact O-OD1 2.83Å
833	F	94.3	Very high	93.1	Very high	72 Å²	72	35.9 Å²	35.9	32%	0.316	20%	0.197	S	C	.	.			trans	-73.8	144.8	167.5	-70.7	-89.1	0	0	0	111.4	Y956 I958 N959 C969	F833-Y956 HydrophobicContact CB-CD1 4.09Å; F833-Y956 VanDerWaalsContact CD1-C 3.46Å; F833-Y956 VanDerWaalsContact CD1-CA 3.49Å; F833-Y956 HydrophobicContact CD1-CD1 4.32Å; F833-Y956 HydrophobicContact CD1-CG 4.38Å; F833-Y956 AromaticContact CD2-CD1 3.64Å; F833-Y956 HydrophobicContact CD2-CD1 3.64Å; F833-Y956 HydrophobicContact CD2-CE1 4.34Å; F833-Y956 HydrophobicContact CD2-CG 4.25Å; F833-Y956 HydrophobicContact CE2-CD1 4.14Å; F833-Y956 HydrophobicContact CE2-CG 4.39Å; F833-Y956 AromaticContact CG-CD1 3.75Å; F833-Y956 HydrophobicContact CG-CD1 3.75Å; F833-Y956 HydrophobicContact CG-CG 4.24Å; F833-I958 CarbonylContact C-O 3.46Å; F833-I958 WeakPolarHBondContact CA-O 3.24Å; F833-N959 HydrophobicContact CD1-CB 3.66Å; F833-N959 WeakPolarHBondContact CD2-ND2 3.33Å; F833-N959 HydrophobicContact CE1-CB 3.54Å; F833-N959 HydrophobicContact CE2-CB 4.49Å; F833-N959 WeakPolarHBondContact CE2-ND2 3.29Å; F833-N959 HydrophobicContact CG-CB 4.21Å; F833-N959 HydrophobicContact CZ-CB 3.98Å; F833-N959 WeakPolarHBondContact CZ-ND2 3.42Å; F833-C969 HydrophobicContact CE1-CB 3.52Å; F833-C969 HydrophobicContact CZ-CB 3.5Å; F833-C969 VanDerWaalsContact CZ-CB 3.5Å
834	Y	94.4	Very high	93.2	Very high	23 Å²	23	35.4 Å²	35.4	9%	0.09	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-145.6	174.8	176.4	61.5	-84.3	0	0	0	110.4	T824 P826 Y827 S829 F957 I958	T824-Y834 HydrophobicContact CG2-CD2 3.73Å; T824-Y834 HydrophobicContact CG2-CE2 3.99Å; P826-Y834 WeakPolarHBondContact CA-OH 3.3Å; Y827-Y834 AromaticContact CD1-CE2 3.9Å; Y827-Y834 HydrophobicContact CD1-CE2 3.9Å; Y827-Y834 HydrophobicContact CD2-CE1 4.49Å; Y827-Y834 AromaticContact CE1-CD2 3.68Å; Y827-Y834 HydrophobicContact CE1-CD2 3.68Å; Y827-Y834 AromaticContact CE1-CE2 3.52Å; Y827-Y834 HydrophobicContact CE1-CE2 3.52Å; Y827-Y834 HydrophobicContact CE1-CG 4.27Å; Y827-Y834 AromaticContact CE1-CZ 3.98Å; Y827-Y834 HydrophobicContact CE2-CD1 4.24Å; Y827-Y834 HydrophobicContact CE2-CE1 4.14Å; Y827-Y834 HydrophobicContact CE2-CG 4.47Å; Y827-Y834 AromaticContact CZ-CD2 3.73Å; Y827-Y834 AromaticContact CZ-CE2 3.86Å; Y827-Y834 AromaticContact CZ-CG 3.82Å; Y827-Y834 PolarHBondContact N-OH 3.09Å; Y827-Y834 PolarHBondContact O-OH 2.87Å; S829-Y834 VanDerWaalsContact CB-CE1 3.46Å; S829-Y834 WeakPolarHBondContact OG-CE1 3.45Å; Y834-F957 WeakPolarHBondContact O-CB 3.47Å; Y834-I958 HydrophobicContact CD1-CB 4.47Å; Y834-I958 WeakPolarHBondContact CD1-O 3.35Å; Y834-I958 HydrophobicContact CD2-CB 4.06Å; Y834-I958 HydrophobicContact CD2-CD1 4.2Å; Y834-I958 HydrophobicContact CD2-CG2 4.47Å; Y834-I958 HydrophobicContact CE1-CB 4.25Å; Y834-I958 HydrophobicContact CE1-CG2 4.1Å; Y834-I958 HydrophobicContact CE2-CB 3.82Å; Y834-I958 HydrophobicContact CE2-CD1 3.98Å; Y834-I958 HydrophobicContact CE2-CG1 4.48Å; Y834-I958 HydrophobicContact CE2-CG2 3.73Å; Y834-I958 HydrophobicContact CG-CB 4.39Å; Y834-I958 PolarHBondContact N-O 2.82Å; Y834-I958 WeakPolarHBondContact O-CB 3.17Å; Y834-I958 PolarHBondContact O-N 2.87Å
835	G	91.5	Very high	93.1	Very high	30 Å²	30	36.8 Å²	36.8	31%	0.309	20%	0.201	S	C	.	.			trans	101.8	-175.8	-172.7	0	0	0	0	0	112.8	N823	N823-G835 WeakPolarHBondContact OD1-CA 3.41Å
836	N	91.4	Very high	92.6	Very high	63 Å²	63	39.8 Å²	39.8	34%	0.337	22%	0.217	S	C	.	.			trans	-143.1	178.2	-179.8	73.9	11.6	0	0	0	112.6	N823 S838 C839 F957	N823-N836 WeakPolarHBondContact CB-OD1 3.17Å; N823-N836 VanDerWaalsContact CG-CG 3.46Å; N823-N836 PolarHBondContact OD1-N 3.13Å; N823-N836 PolarHBondContact OD1-OD1 3.01Å; N836-S838 PolarHBondContact O-N 2.82Å; N836-S838 WeakPolarHBondContact OD1-CB 3.28Å; N836-S838 PolarHBondContact OD1-N 3.4Å; N836-S838 PolarHBondContact OD1-OG 3.23Å; N836-C839 WeakPolarHBondContact O-CB 3.43Å; N836-C839 PolarHBondContact O-N 3.05Å; N836-C839 PolarHBondContact O-SG 2.75Å; N836-F957 VanDerWaalsContact C-CE2 3.5Å; N836-F957 VanDerWaalsContact C-CZ 3.43Å; N836-F957 WeakPolarHBondContact O-CD1 3.34Å; N836-F957 WeakPolarHBondContact O-CE1 3.24Å
837	G	92.1	Very high	91.3	Very high	34 Å²	34	43.2 Å²	43.2	35%	0.351	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-2.4	-179.4	0	0	0	0	0	116.5	C839	G837-C839 VanDerWaalsContact C-N 3.28Å
838	S	91.9	Very high	89.4	Confident	39 Å²	39	44.2 Å²	44.2	27%	0.273	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-17.6	168.6	-52.9	0	0	0	0	112.1	T742 N836	T742-S838 VanDerWaalsContact CG2-O 3.28Å; T742-S838 WeakPolarHBondContact CG2-O 3.33Å; N836-S838 PolarHBondContact O-N 2.82Å; N836-S838 WeakPolarHBondContact OD1-CB 3.28Å; N836-S838 PolarHBondContact OD1-N 3.4Å; N836-S838 PolarHBondContact OD1-OG 3.23Å
839	C	95.2	Very high	86.9	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.007	28%	0.281	C	S	.	.			trans	-64.1	141.8	173.2	-68.2	0	0	0	0	112	M821 N823 N836 G837 F957 F993	M821-C839 VanDerWaalsContact O-CA 3.28Å; M821-C839 WeakPolarHBondContact O-CA 3.39Å; N823-C839 PolarHBondContact N-SG 3.38Å; N823-C839 VanDerWaalsContact N-SG 3.42Å; N823-C839 PolarHBondContact OD1-SG 2.9Å; N836-C839 WeakPolarHBondContact O-CB 3.43Å; N836-C839 PolarHBondContact O-N 3.05Å; N836-C839 PolarHBondContact O-SG 2.75Å; G837-C839 VanDerWaalsContact C-N 3.28Å; C839-F957 HydrophobicContact CB-CB 4.33Å; C839-F957 HydrophobicContact CB-CD1 3.97Å; C839-F957 HydrophobicContact CB-CG 4.42Å; C839-F993 HydrophobicContact CB-CE1 4.19Å; C839-F993 HydrophobicContact CB-CZ 4.33Å; C839-F993 WeakPolarHBondContact O-CE1 3.47Å
840	F	96.8	Very high	84.3	Confident	4 Å²	4	54.4 Å²	54.4	2%	0.018	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	152.2	174	66.3	-101	0	0	0	111.3	N740 T742 A820 M821 F842 K947 F948 T949	N740-F840 VanDerWaalsContact O-CE1 3.24Å; N740-F840 WeakPolarHBondContact O-CE1 3.45Å; N740-F840 WeakPolarHBondContact O-CZ 3.44Å; T742-F840 HydrophobicContact CG2-CE1 4.32Å; A820-F840 CarbonylContact C-O 3.53Å; A820-F840 VanDerWaalsContact CA-O 3.3Å; A820-F840 WeakPolarHBondContact CA-O 3.43Å; M821-F840 HydrophobicContact CB-CD1 3.62Å; M821-F840 HydrophobicContact CB-CD2 4.11Å; M821-F840 HydrophobicContact CB-CE1 3.32Å; M821-F840 HydrophobicContact CB-CE2 3.85Å; M821-F840 HydrophobicContact CB-CG 4Å; M821-F840 HydrophobicContact CB-CZ 3.43Å; M821-F840 VanDerWaalsContact CB-CZ 3.43Å; M821-F840 HydrophobicContact CE-CZ 4.38Å; M821-F840 HydrophobicContact CG-CD1 4.09Å; M821-F840 HydrophobicContact CG-CE1 3.6Å; M821-F840 HydrophobicContact CG-CZ 4.04Å; M821-F840 PolarHBondContact N-O 3.35Å; M821-F840 PolarHBondContact O-N 2.91Å; M821-F840 VanDerWaalsContact O-N 3.13Å; F840-F842 HydrophobicContact CD2-CD1 4.05Å; F840-F842 AromaticContact CE2-CD1 3.7Å; F840-F842 HydrophobicContact CE2-CD1 3.7Å; F840-F842 HydrophobicContact CE2-CE1 4.43Å; F840-K947 HydrophobicContact CD2-CD 3.85Å; F840-K947 HydrophobicContact CD2-CG 3.65Å; F840-K947 HydrophobicContact CE1-CD 4.49Å; F840-K947 HydrophobicContact CE2-CD 3.79Å; F840-K947 HydrophobicContact CE2-CG 4.01Å; F840-K947 HydrophobicContact CG-CD 4.25Å; F840-K947 HydrophobicContact CG-CG 4.17Å; F840-K947 HydrophobicContact CZ-CD 4.14Å; F840-F948 WeakPolarHBondContact CA-O 3.25Å; F840-F948 WeakPolarHBondContact CB-O 3.28Å; F840-T949 HydrophobicContact CB-CG2 4.3Å
841	V	97.7	Very high	82	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	155.2	173.5	-60.6	0	0	0	0	111.3	G819 A820 F948 I967 A975 F993 L998	G819-V841 WeakPolarHBondContact O-CA 3.18Å; A820-V841 HydrophobicContact CB-CG1 4.05Å; V841-F948 HydrophobicContact CG2-CB 3.84Å; V841-F948 HydrophobicContact CG2-CD2 4.23Å; V841-F948 HydrophobicContact CG2-CG 4.46Å; V841-F948 PolarHBondContact N-O 2.98Å; V841-F948 PolarHBondContact O-N 3Å; V841-I967 HydrophobicContact CG1-CG2 4.1Å; V841-A975 HydrophobicContact CG1-CB 4.19Å; V841-A975 HydrophobicContact CG2-CB 4.39Å; V841-F993 HydrophobicContact CB-CD2 4.43Å; V841-F993 HydrophobicContact CG1-CD2 3.7Å; V841-F993 HydrophobicContact CG1-CE2 3.65Å; V841-F993 HydrophobicContact CG1-CG 4.39Å; V841-F993 HydrophobicContact CG1-CZ 4.32Å; V841-F993 HydrophobicContact CG2-CB 3.97Å; V841-F993 HydrophobicContact CG2-CD2 3.9Å; V841-F993 HydrophobicContact CG2-CG 4.03Å; V841-L998 HydrophobicContact CB-CD1 4.16Å; V841-L998 HydrophobicContact CG2-CD1 4.39Å; V841-L998 HydrophobicContact CG2-CD2 4.16Å
842	F	97.1	Very high	79.7	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	159.5	-175.9	59.7	-100.5	0	0	0	113.3	L737 I807 F818 G819 F840 W844 F945 Q946	L737-F842 HydrophobicContact CD1-CZ 4.34Å; L737-F842 HydrophobicContact CD2-CD1 4.14Å; L737-F842 HydrophobicContact CD2-CD2 4.24Å; L737-F842 HydrophobicContact CD2-CE1 3.94Å; L737-F842 HydrophobicContact CD2-CE2 4.11Å; L737-F842 HydrophobicContact CD2-CG 4.27Å; L737-F842 HydrophobicContact CD2-CZ 3.95Å; I807-F842 HydrophobicContact CG2-CE1 4.27Å; I807-F842 HydrophobicContact CG2-CZ 3.86Å; F818-F842 CarbonylContact C-O 3.38Å; F818-F842 VanDerWaalsContact CA-O 3.24Å; F818-F842 WeakPolarHBondContact CA-O 3.35Å; F818-F842 WeakPolarHBondContact CB-O 3.49Å; G819-F842 PolarHBondContact N-O 3.18Å; G819-F842 PolarHBondContact O-N 2.89Å; F840-F842 HydrophobicContact CD2-CD1 4.05Å; F840-F842 AromaticContact CE2-CD1 3.7Å; F840-F842 HydrophobicContact CE2-CD1 3.7Å; F840-F842 HydrophobicContact CE2-CE1 4.43Å; F842-W844 HydrophobicContact CD2-CE3 4.46Å; F842-W844 HydrophobicContact CD2-CH2 4.05Å; F842-W844 AromaticContact CD2-CZ3 3.79Å; F842-W844 HydrophobicContact CD2-CZ3 3.79Å; F842-W844 AromaticContact CE2-CH2 3.84Å; F842-W844 HydrophobicContact CE2-CH2 3.84Å; F842-W844 AromaticContact CE2-CZ3 3.6Å; F842-W844 HydrophobicContact CE2-CZ3 3.6Å; F842-F945 HydrophobicContact CB-CE2 3.58Å; F842-F945 HydrophobicContact CB-CZ 3.67Å; F842-F945 AromaticContact CD2-CE2 3.86Å; F842-F945 HydrophobicContact CD2-CE2 3.86Å; F842-F945 AromaticContact CG-CE2 3.85Å; F842-F945 HydrophobicContact CG-CE2 3.85Å; F842-F945 HydrophobicContact CG-CZ 4.11Å; F842-Q946 CarbonylContact C-O 3.58Å; F842-Q946 WeakPolarHBondContact CA-O 3.26Å; F842-Q946 WeakPolarHBondContact CB-O 3.24Å
843	R	96.1	Very high	77	Confident	27 Å²	27	61.2 Å²	61.2	10%	0.102	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	159.2	174.5	66.7	178.1	176.7	-176.6	-7.2	113.5	F818 I845 F945 Q946 F948 Q997 L998	F818-R843 HydrophobicContact CB-CB 3.75Å; R843-I845 HydrophobicContact CG-CG1 4.37Å; R843-F945 CarbonylContact O-C 3.57Å; R843-F945 WeakPolarHBondContact O-CA 3.32Å; R843-Q946 HydrophobicContact CG-CB 4.08Å; R843-Q946 PolarHBondContact N-O 3.32Å; R843-Q946 VanDerWaalsContact NH2-OE1 3.17Å; R843-Q946 PolarHBondContact O-N 3.49Å; R843-F948 HydrophobicContact CG-CE2 4.29Å; R843-Q997 PolarHBondContact NH1-O 2.92Å; R843-L998 WeakPolarHBondContact CD-O 3.48Å; R843-L998 PolarHBondContact NH1-O 3.17Å
844	W	94.5	Very high	74.3	Confident	9 Å²	9	66.9 Å²	66.9	3%	0.034	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	124.1	166.6	-72.5	-89.1	0	0	0	111.3	K733 D736 L737 I809 I817 F842 Q943 F945	K733-W844 HydrophobicContact CB-CH2 4.08Å; K733-W844 HydrophobicContact CB-CZ2 3.59Å; K733-W844 HydrophobicContact CD-CD2 4.32Å; K733-W844 HydrophobicContact CD-CE3 4.49Å; K733-W844 HydrophobicContact CD-CZ2 4.5Å; K733-W844 HydrophobicContact CG-CD2 4.23Å; K733-W844 HydrophobicContact CG-CZ2 3.94Å; D736-W844 HydrophobicContact CB-CZ2 4.13Å; D736-W844 PolarHBondContact OD2-NE1 3.22Å; L737-W844 HydrophobicContact CD1-CH2 4.08Å; L737-W844 HydrophobicContact CD2-CH2 4.17Å; L737-W844 HydrophobicContact CD2-CZ2 4.5Å; L737-W844 HydrophobicContact CG-CH2 3.92Å; L737-W844 HydrophobicContact CG-CZ2 4.14Å; I809-W844 HydrophobicContact CD1-CH2 4.26Å; I809-W844 HydrophobicContact CD1-CZ3 3.89Å; I817-W844 HydrophobicContact CB-CE3 4.16Å; I817-W844 HydrophobicContact CG2-CE3 3.62Å; I817-W844 HydrophobicContact CG2-CZ3 3.75Å; I817-W844 PolarHBondContact O-N 2.84Å; F842-W844 HydrophobicContact CD2-CE3 4.46Å; F842-W844 HydrophobicContact CD2-CH2 4.05Å; F842-W844 AromaticContact CD2-CZ3 3.79Å; F842-W844 HydrophobicContact CD2-CZ3 3.79Å; F842-W844 AromaticContact CE2-CH2 3.84Å; F842-W844 HydrophobicContact CE2-CH2 3.84Å; F842-W844 AromaticContact CE2-CZ3 3.6Å; F842-W844 HydrophobicContact CE2-CZ3 3.6Å; W844-Q943 HydrophobicContact CB-CB 4.33Å; W844-F945 HydrophobicContact CD2-CD2 4.08Å; W844-F945 AromaticContact CE2-CD2 3.52Å; W844-F945 HydrophobicContact CG-CD2 4.49Å; W844-F945 HydrophobicContact CH2-CD2 4.39Å; W844-F945 HydrophobicContact CH2-CE2 4.19Å; W844-F945 AromaticContact CZ2-CD2 3.69Å; W844-F945 HydrophobicContact CZ2-CD2 3.69Å; W844-F945 AromaticContact CZ2-CE2 3.84Å; W844-F945 HydrophobicContact CZ2-CE2 3.84Å; W844-F945 AromaticContact NE1-CD2 3.62Å
845	I	90.6	Very high	71.5	Confident	33 Å²	33	73.3 Å²	73.3	17%	0.169	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	134.9	174.5	-51.2	-172.1	0	0	0	109.7	R843 T847 Q943 K944 Q946 L1000	R843-I845 HydrophobicContact CG-CG1 4.37Å; I845-T847 PolarHBondContact O-N 2.85Å; I845-Q943 CarbonylContact O-C 3.56Å; I845-Q943 VanDerWaalsContact O-CA 3.26Å; I845-Q943 WeakPolarHBondContact O-CA 3.46Å; I845-K944 PolarHBondContact N-O 2.88Å; I845-K944 PolarHBondContact O-N 3.33Å; I845-Q946 HydrophobicContact CD1-CG 4.48Å; I845-Q946 VanDerWaalsContact CD1-NE2 3.34Å; I845-L1000 HydrophobicContact CD1-CD2 4.44Å; I845-L1000 HydrophobicContact CG1-CD1 4.29Å; I845-L1000 HydrophobicContact CG2-CD1 4.21Å; I845-L1000 HydrophobicContact CG2-CD2 4.09Å
846	N	82.3	Confident	68.7	Low	69 Å²	69	80.5 Å²	80.5	37%	0.369	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	116.9	170	-68	-47.7	0	0	0	110.1	T848 Q943	N846-T848 PolarHBondContact O-N 2.98Å; N846-Q943 WeakPolarHBondContact OD1-CG 3.24Å; N846-Q943 PolarHBondContact OD1-NE2 3.39Å
847	T	67.5	Low	66	Low	73 Å²	73	86 Å²	86	45%	0.448	45%	0.445	S	S	.	.			trans	-81.9	30.7	-178.1	-30.6	0	0	0	0	113.4	I845 K942	I845-T847 PolarHBondContact O-N 2.85Å; T847-K942 VanDerWaalsContact CB-O 3.24Å; T847-K942 WeakPolarHBondContact CB-O 3.21Å; T847-K942 PolarHBondContact N-O 3.42Å; T847-K942 PolarHBondContact OG1-O 2.94Å
848	T	52.7	Low	63.1	Low	67 Å²	67	92.4 Å²	92.4	41%	0.411	47%	0.471	S	S	.	.			trans	-88.4	139.8	170	46.8	0	0	0	0	109.2	N846 K941	N846-T848 PolarHBondContact O-N 2.98Å; T848-K941 HydrophobicContact CG2-CD 4.31Å; T848-K941 HydrophobicContact CG2-CG 4.28Å
849	D	41.7	Very low	60.3	Low	144 Å²	144	95.4 Å²	95.4	77%	0.77	49%	0.492	S	S	*	.			trans	87.2	18.6	174.4	-48.2	-30.1	0	0	0	118.5	K851	D849-K851 PolarHBondContact O-N 3.06Å
850	S	36.8	Very low	57.4	Low	102 Å²	102	102.8 Å²	102.8	71%	0.713	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	59.4	165.8	-54.4	0	0	0	0	114.1
851	K	39.3	Very low	54.4	Low	201 Å²	201	107.8 Å²	107.8	87%	0.874	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141	3.6	169.8	-90.9	-163.5	175.9	-176.5	0	115.6	D849	D849-K851 PolarHBondContact O-N 3.06Å
852	Q	37.2	Very low	51.5	Low	162 Å²	162	114.9 Å²	114.9	76%	0.757	60%	0.604	S	S	*	*	S	Bend	trans	-118.1	-28.8	177.7	-70.2	-167.3	-29.4	0	0	115.7	Q854	Q852-Q854 VanDerWaalsContact C-N 3.32Å; Q852-Q854 PolarHBondContact O-N 3.03Å; Q852-Q854 VanDerWaalsContact O-N 3.14Å
853	D	35.9	Very low	48.4	Very low	132 Å²	132	120.8 Å²	120.8	71%	0.706	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	39.2	-174.3	-60.4	-51.1	0	0	0	115.5
854	Q	36.9	Very low	45.4	Very low	191 Å²	191	126.3 Å²	126.3	89%	0.893	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.1	27.5	162.7	-77.6	-162.1	78.4	0	0	112.5	Q852	Q852-Q854 VanDerWaalsContact C-N 3.32Å; Q852-Q854 PolarHBondContact O-N 3.03Å; Q852-Q854 VanDerWaalsContact O-N 3.14Å
855	L	36	Very low	42.7	Very low	159 Å²	159	133.2 Å²	133.2	83%	0.832	70%	0.695	S	S	*	*	S	Bend	trans	-135.6	44	175.4	-70.4	175	0	0	0	111.8
856	K	33.1	Very low	39.9	Very low	180 Å²	180	137.9 Å²	137.9	78%	0.783	72%	0.72	S	S	*	*	S	Bend	trans	-133.2	8.7	177.9	-83.3	-174.9	179.3	167	0	116
857	E	35.3	Very low	37.5	Very low	178 Å²	178	139.1 Å²	139.1	83%	0.832	73%	0.734	S	S	*	*	S	Bend	trans	-124.3	138.1	161.7	-64.9	-172.7	158.2	0	0	108
858	N	29.7	Very low	35.9	Very low	169 Å²	169	142 Å²	142	90%	0.904	75%	0.752	S	S	*	*	S	Bend	trans	86.9	54.8	-171	-51.9	-63.5	0	0	0	118.5
859	S	33.9	Very low	34.8	Very low	102 Å²	102	143.2 Å²	143.2	71%	0.713	76%	0.763	S	S	*	*			trans	-158.5	134.3	146.7	63.8	0	0	0	0	114.3
860	N	34.2	Very low	34.2	Very low	157 Å²	157	144 Å²	144	84%	0.84	77%	0.766	S	S	*	*			trans	66.9	92.8	152.2	-55	-7.7	0	0	0	118.7
861	S	33	Very low	33.8	Very low	109 Å²	109	144.4 Å²	144.4	76%	0.762	77%	0.769	S	S	*	*			trans	-68.2	175.7	142.5	50.7	0	0	0	0	111.7
862	I	36.9	Very low	33.4	Very low	149 Å²	149	140.5 Å²	140.5	76%	0.764	76%	0.762	S	S	*	*			trans	83.6	94.3	170.6	-51.2	179	0	0	0	116.1
863	N	33.5	Very low	32.9	Very low	124 Å²	124	138.6 Å²	138.6	66%	0.663	76%	0.761	S	S	*	*			trans	52.9	114.1	133.6	-69.7	45.2	0	0	0	122.9
864	E	32.7	Very low	32.7	Very low	142 Å²	142	138 Å²	138	66%	0.664	77%	0.768	S	S	*	*				90.6	128.8	113.9	-73.2	-171	106	0	0	123.3
865	Q	37.8	Very low	32.5	Very low	155 Å²	155	136.7 Å²	136.7	72%	0.724	77%	0.767	S	S	*	*			trans	82.6	121.9	139.9	-70.8	175.4	33.9	0	0	120.9
866	D	32.5	Very low	32.5	Very low	130 Å²	130	138 Å²	138	70%	0.695	77%	0.765	S	S	*	*			trans	65.8	98.6	148.6	-73.3	-43.7	0	0	0	124
867	S	30.7	Very low	32.6	Very low	96 Å²	96	136.1 Å²	136.1	67%	0.671	76%	0.764	S	S	*	*				48.2	91.6	99.6	-47.4	0	0	0	0	118.1
868	T	33.2	Very low	32.6	Very low	134 Å²	134	134 Å²	134	82%	0.822	76%	0.757	S	S	*	*				-167.1	115.7	129	11.6	0	0	0	0	115.1
869	S	30.6	Very low	32.8	Very low	91 Å²	91	132 Å²	132	64%	0.636	75%	0.747	S	S	*	*			trans	36.3	123.4	135.1	63.5	0	0	0	0	123.2
870	L	29.3	Very low	32.8	Very low	162 Å²	162	134.6 Å²	134.6	85%	0.848	75%	0.751	S	S	*	*				78.8	129.7	128.5	-68.2	170.6	0	0	0	122.1
871	S	27.5	Very low	32.8	Very low	110 Å²	110	131.8 Å²	131.8	77%	0.769	74%	0.741	S	S	*	*			trans	77.4	159.2	138.8	87.1	0	0	0	0	118.1
872	V	30.8	Very low	32.7	Very low	119 Å²	119	132 Å²	132	72%	0.721	74%	0.738	S	S	*	*			cis	-160.3	143.8	-20.7	122.4	0	0	0	0	108.6
873	T	26.4	Very low	32.3	Very low	122 Å²	122	131.6 Å²	131.6	75%	0.748	74%	0.738	S	S	*	*			trans	30.2	135.1	164.5	63.6	0	0	0	0	121.9
874	S	33.8	Very low	32.4	Very low	120 Å²	120	131.4 Å²	131.4	84%	0.839	74%	0.74	S	S	*	*				-164.9	114.2	128	-88	0	0	0	0	113.3
875	N	31.5	Very low	32.3	Very low	163 Å²	163	131.5 Å²	131.5	87%	0.872	75%	0.745	S	S	*	*			trans	-85.9	142.1	165.4	-60.8	-23.4	0	0	0	109.7
876	K	37	Very low	31.9	Very low	185 Å²	185	129.5 Å²	129.5	80%	0.804	75%	0.749	S	S	*	*			trans	-154.1	118.8	160.3	-97	-169.1	174.3	175.4	0	114.5
877	L	34.7	Very low	31.9	Very low	142 Å²	142	127.7 Å²	127.7	74%	0.743	75%	0.752	S	S	*	*			trans	70.8	157.2	134	-60.6	172.1	0	0	0	119
878	L	35.8	Very low	31.7	Very low	132 Å²	132	128.2 Å²	128.2	69%	0.691	76%	0.755	S	S	*	*			cis	-136.1	161.2	5.8	-89.9	98.8	0	0	0	111.9
879	N	33.3	Very low	31.7	Very low	129 Å²	129	129.1 Å²	129.1	69%	0.69	75%	0.754	S	S	*	*			trans	59.7	121.5	143.3	-64.7	12.1	0	0	0	119.5
880	I	32.9	Very low	31.5	Very low	155 Å²	155	130.2 Å²	130.2	80%	0.795	76%	0.761	S	S	*	*			cis	53.8	151.5	17.7	27.7	-178.2	0	0	0	116.1
881	P	34.7	Very low	31.7	Very low	99 Å²	99	127.2 Å²	127.2	64%	0.643	75%	0.754	S	S	*	*			cis	-144	176.7	3.4	37.7	-15.8	0	0	0	118.6
882	T	30.6	Very low	31.8	Very low	114 Å²	114	126.7 Å²	126.7	70%	0.699	75%	0.75	S	S	*	*			trans	55.5	162.3	140.6	53.5	0	0	0	0	121.6
883	D	28.4	Very low	31.6	Very low	140 Å²	140	126 Å²	126	75%	0.749	75%	0.75	S	S	*	*			cis	-160.3	-175	-8.3	-116	-27.4	0	0	0	110.2
884	V	36.6	Very low	31.9	Very low	119 Å²	119	127 Å²	127	72%	0.721	75%	0.751	S	S	*	*			trans	112.2	98.3	153.3	-46.2	0	0	0	0	121.2
885	N	30.3	Very low	31.4	Very low	144 Å²	144	129.3 Å²	129.3	77%	0.77	75%	0.753	S	S	*	*				58.6	115.3	118.7	-58.5	-18.4	0	0	0	123.4
886	S	28.8	Very low	31.4	Very low	113 Å²	113	124.5 Å²	124.5	79%	0.79	74%	0.742	S	S	*	*				61.3	105.7	126.6	69.4	0	0	0	0	122.3
887	A	33.3	Very low	30.9	Very low	93 Å²	93	121.4 Å²	121.4	77%	0.769	74%	0.738	S	S	*	*				171.6	129.9	117.4	0	0	0	0	0	109
888	S	26.3	Very low	30.6	Very low	106 Å²	106	121 Å²	121	74%	0.741	74%	0.737	S	S	*	*			cis	89.8	50.5	27.1	88.6	0	0	0	0	117.6
889	I	33.3	Very low	30.4	Very low	154 Å²	154	121 Å²	121	79%	0.79	74%	0.738	S	S	*	*			trans	-144.6	123.2	150.4	-50	179.1	0	0	0	106.3
890	S	26.1	Very low	30.5	Very low	114 Å²	114	121.8 Å²	121.8	80%	0.797	74%	0.737	S	S	*	*			cis	84	59.2	16.7	-51.1	0	0	0	0	118.1
891	S	34.1	Very low	30.4	Very low	98 Å²	98	121 Å²	121	69%	0.685	73%	0.734	S	S	*	*			trans	-165.4	125	152.1	51.6	0	0	0	0	109.1
892	S	28.4	Very low	30.3	Very low	99 Å²	99	120.7 Å²	120.7	69%	0.692	74%	0.735	S	S	*	*			cis	73	135.9	31.8	88.1	0	0	0	0	115.4
893	S	28.4	Very low	30.2	Very low	104 Å²	104	122.2 Å²	122.2	73%	0.727	74%	0.738	S	S	*	*			trans	66.8	154.8	157.8	78	0	0	0	0	116.1
894	L	31.1	Very low	30.3	Very low	145 Å²	145	123.5 Å²	123.5	76%	0.759	74%	0.744	S	S	*	*			cis	-134	156.1	-4	-89.5	109.2	0	0	0	107.5
895	L	25.1	Very low	30	Very low	168 Å²	168	123.5 Å²	123.5	88%	0.88	74%	0.744	S	S	*	*				38.7	120	86	-73.5	164.8	0	0	0	115.1
896	G	30.4	Very low	30	Very low	62 Å²	62	122.2 Å²	122.2	64%	0.639	75%	0.747	S	S	*	*			trans	147.2	70.7	179	0	0	0	0	0	112.5
897	T	26.7	Very low	30.1	Very low	119 Å²	119	121.6 Å²	121.6	73%	0.73	74%	0.742	S	S	*	*				68.4	121.1	88.2	64.1	0	0	0	0	115
898	D	28	Very low	30.2	Very low	133 Å²	133	123 Å²	123	71%	0.711	75%	0.747	S	S	*	*			trans	62.4	118.3	151.6	-38.6	-27.9	0	0	0	117.5
899	N	32.4	Very low	30.4	Very low	133 Å²	133	123.2 Å²	123.2	71%	0.711	75%	0.748	S	S	*	*				-173.3	150.5	68.1	-89.8	-77.6	0	0	0	114.7
900	H	35.3	Very low	30.3	Very low	146 Å²	146	121.4 Å²	121.4	68%	0.676	75%	0.749	S	S	*	*			trans	41.7	109.6	143.3	-65.3	-52.2	0	0	0	123.7
901	N	29.9	Very low	30.5	Very low	137 Å²	137	125.2 Å²	125.2	73%	0.733	75%	0.752	S	S	*	*				69.3	149.6	114	-61.1	-2.1	0	0	0	123.2
902	S	32.3	Very low	30.4	Very low	94 Å²	94	126.6 Å²	126.6	66%	0.657	75%	0.75	S	S	*	*			trans	65.7	108.5	155.1	49.5	0	0	0	0	119.4
903	D	29.5	Very low	30.6	Very low	145 Å²	145	127 Å²	127	78%	0.775	75%	0.753	S	S	*	*				37.6	122.3	113.6	-35.1	-38.8	0	0	0	118.6
904	L	30.8	Very low	30.7	Very low	168 Å²	168	126.4 Å²	126.4	88%	0.88	75%	0.748	S	S	*	*				-177.1	150.8	94.3	-96	168.9	0	0	0	114.1
905	V	29.8	Very low	30.9	Very low	118 Å²	118	125.6 Å²	125.6	72%	0.715	75%	0.745	S	S	*	*			trans	-70.4	142.9	171.6	-84.4	0	0	0	0	113.7
906	S	30.1	Very low	31.4	Very low	118 Å²	118	122.1 Å²	122.1	83%	0.825	73%	0.731	S	S	*	*			trans	-170.2	114.9	140.4	-76.7	0	0	0	0	107.7
907	S	31.3	Very low	31.4	Very low	99 Å²	99	129.2 Å²	129.2	69%	0.692	74%	0.738	S	S	*	*			cis	76.4	90.7	44.4	-52	0	0	0	0	114.1
908	S	34.1	Very low	31.8	Very low	124 Å²	124	129.7 Å²	129.7	87%	0.867	74%	0.741	S	S	*	*			trans	-174.1	107.4	160.4	-76.9	0	0	0	0	107.8
909	S	30.5	Very low	32.3	Very low	110 Å²	110	128.1 Å²	128.1	77%	0.769	73%	0.729	S	S	*	*			cis	90.9	76.7	15.3	91.8	0	0	0	0	117.7
910	S	32.4	Very low	32.5	Very low	115 Å²	115	124.8 Å²	124.8	80%	0.804	71%	0.714	S	S	*	*			trans	-164.1	113.6	159.2	52.1	0	0	0	0	107.2
911	F	30.9	Very low	32.6	Very low	195 Å²	195	123 Å²	123	86%	0.855	71%	0.713	S	S	*	*			cis	68.3	98.6	38.9	-83.9	-70.5	0	0	0	116.2
912	I	31	Very low	33.6	Very low	126 Å²	126	120.9 Å²	120.9	65%	0.646	71%	0.705	S	S	*	*			trans	-171.2	109.6	150.6	-89.4	144.6	0	0	0	102.5	P531	P531-I912 HydrophobicContact CG-CD1 4.26Å
913	S	31.7	Very low	34	Very low	109 Å²	109	121.9 Å²	121.9	76%	0.762	70%	0.698	S	S	*	*				63.5	137.5	83.9	-64.2	0	0	0	0	113.6
914	S	32	Very low	34.6	Very low	90 Å²	90	121.6 Å²	121.6	63%	0.629	69%	0.692	S	S	*	*			cis	-145.8	175.2	18.1	60.9	0	0	0	0	115.4
915	D	33.6	Very low	35	Very low	129 Å²	129	121 Å²	121	69%	0.69	68%	0.682	S	S	*	*			trans	70.7	167.9	157.5	-51	-45.9	0	0	0	121.4
916	V	37.6	Very low	35.5	Very low	95 Å²	95	117.4 Å²	117.4	58%	0.576	67%	0.665	S	S	*	*			trans	57.4	72.2	-174.7	-163.3	0	0	0	0	115.6	E919	V916-E919 HydrophobicContact CG1-CB 4.38Å; V916-E919 HydrophobicContact CG1-CG 4.02Å
917	R	29.6	Very low	36.2	Very low	211 Å²	211	117.3 Å²	117.3	80%	0.796	65%	0.651	S	S	*	*			trans	-110.7	56	175.3	-85.8	-166.6	167.4	90.5	-0.1	115.3
918	T	35.3	Very low	36.8	Very low	129 Å²	129	119.6 Å²	119.6	79%	0.791	66%	0.655	S	S	*	*	S	Bend	trans	-137.1	-18.7	159.2	35	0	0	0	0	113.6
919	E	38.3	Very low	37.3	Very low	99 Å²	99	118.3 Å²	118.3	46%	0.463	65%	0.645	S	S	.	*	S	Bend	trans	-85.1	-13.7	177.1	-60.1	-169.8	156.4	0	0	114.9	V916 T922 K923	V916-E919 HydrophobicContact CG1-CB 4.38Å; V916-E919 HydrophobicContact CG1-CG 4.02Å; E919-T922 PolarHBondContact O-OG1 3.15Å; E919-K923 HydrophobicContact CB-CD 4.33Å; E919-K923 WeakPolarHBondContact O-CG 3.34Å; E919-K923 PolarHBondContact O-N 2.85Å; E919-K923 IonicContact OE2-NZ 3.2Å; E919-K923 PolarHBondContact OE2-NZ 2.94Å
920	T	37.5	Very low	37.6	Very low	63 Å²	63	118.6 Å²	118.6	39%	0.387	63%	0.63	S	S	.	*	H	α-helix	trans	-73.2	-33.9	-170	52.2	0	0	0	0	113.1	T922 K923 E924	T920-T922 VanDerWaalsContact C-N 3.34Å; T920-T922 PolarHBondContact O-N 3.15Å; T920-K923 PolarHBondContact O-N 2.94Å; T920-E924 PolarHBondContact O-N 2.84Å
921	V	37.2	Very low	37.7	Very low	109 Å²	109	119 Å²	119	66%	0.661	62%	0.623	S	S	*	*	H	α-helix	trans	-68.3	-33.5	-178.4	-176.7	0	0	0	0	111.7	F925	V921-F925 WeakPolarHBondContact O-CB 3.3Å; V921-F925 PolarHBondContact O-N 3.37Å
922	T	50	Low	37.9	Very low	93 Å²	93	116.2 Å²	116.2	57%	0.571	62%	0.617	S	S	*	*	H	α-helix	trans	-75.9	-34.6	171.6	46.1	0	0	0	0	112.1	E919 T920 A926	E919-T922 PolarHBondContact O-OG1 3.15Å; T920-T922 VanDerWaalsContact C-N 3.34Å; T920-T922 PolarHBondContact O-N 3.15Å; T922-A926 VanDerWaalsContact O-CB 3.29Å; T922-A926 WeakPolarHBondContact O-CB 3.35Å; T922-A926 PolarHBondContact O-N 2.64Å
923	K	41.9	Very low	38.1	Very low	115 Å²	115	119.6 Å²	119.6	50%	0.5	63%	0.627	S	S	.	*	H	α-helix	trans	-70	-36.7	176.9	-75.2	170.2	175.9	170.9	0	113.5	E919 T920 H927	E919-K923 HydrophobicContact CB-CD 4.33Å; E919-K923 WeakPolarHBondContact O-CG 3.34Å; E919-K923 PolarHBondContact O-N 2.85Å; E919-K923 IonicContact OE2-NZ 3.2Å; E919-K923 PolarHBondContact OE2-NZ 2.94Å; T920-K923 PolarHBondContact O-N 2.94Å; K923-H927 PolarHBondContact O-N 2.59Å
924	E	41.1	Very low	38.4	Very low	139 Å²	139	121.7 Å²	121.7	65%	0.65	62%	0.623	S	S	*	*	H	α-helix	trans	-71.9	-40.8	172.7	-73.2	-174.7	155.7	0	0	112	T920 A926 H927 L928	T920-E924 PolarHBondContact O-N 2.84Å; E924-A926 VanDerWaalsContact C-N 3.29Å; E924-A926 PolarHBondContact O-N 3.34Å; E924-H927 PolarHBondContact O-N 3.19Å; E924-L928 WeakPolarHBondContact O-CG 3.41Å; E924-L928 PolarHBondContact O-N 3.28Å
925	F	38.2	Very low	38.4	Very low	154 Å²	154	126.6 Å²	126.6	68%	0.675	64%	0.635	S	S	*	*	H	α-helix	trans	-64.7	-34.6	174.5	-154.9	-91	0	0	0	111.8	V921	V921-F925 WeakPolarHBondContact O-CB 3.3Å; V921-F925 PolarHBondContact O-N 3.37Å
926	A	41.2	Very low	38.4	Very low	43 Å²	43	128.3 Å²	128.3	36%	0.355	64%	0.637	S	S	.	*	H	α-helix	trans	-64.6	-49.4	168.5	0	0	0	0	0	111.6	T922 E924 L928 C929 Y930	T922-A926 VanDerWaalsContact O-CB 3.29Å; T922-A926 WeakPolarHBondContact O-CB 3.35Å; T922-A926 PolarHBondContact O-N 2.64Å; E924-A926 VanDerWaalsContact C-N 3.29Å; E924-A926 PolarHBondContact O-N 3.34Å; A926-L928 PolarHBondContact O-N 3.28Å; A926-L928 VanDerWaalsContact O-N 3.16Å; A926-C929 CarbonylContact O-C 3.6Å; A926-C929 WeakPolarHBondContact O-CA 3.32Å; A926-C929 PolarHBondContact O-N 3.31Å; A926-Y930 VanDerWaalsContact O-CD2 3.31Å; A926-Y930 WeakPolarHBondContact O-CD2 3.33Å; A926-Y930 PolarHBondContact O-N 3.01Å
927	H	43.9	Very low	38	Very low	116 Å²	116	129.8 Å²	129.8	54%	0.537	65%	0.648	S	S	.	*	H	α-helix	trans	-63.8	-20.6	179.4	-98.2	-66.6	0	0	0	114.6	K923 E924 N931	K923-H927 PolarHBondContact O-N 2.59Å; E924-H927 PolarHBondContact O-N 3.19Å; H927-N931 PolarHBondContact ND1-ND2 2.99Å; H927-N931 WeakPolarHBondContact O-CB 3.18Å; H927-N931 PolarHBondContact O-ND2 3.06Å
928	L	44.9	Very low	38.3	Very low	148 Å²	148	127.7 Å²	127.7	78%	0.775	65%	0.648	S	S	*	*	H	α-helix	trans	-74.5	-24.9	169.7	-74.4	165.6	0	0	0	113.2	E924 A926	E924-L928 WeakPolarHBondContact O-CG 3.41Å; E924-L928 PolarHBondContact O-N 3.28Å; A926-L928 PolarHBondContact O-N 3.28Å; A926-L928 VanDerWaalsContact O-N 3.16Å
929	C	44.1	Very low	38.2	Very low	96 Å²	96	131.1 Å²	131.1	65%	0.649	66%	0.655	S	S	*	*	H	α-helix	trans	-91.2	-17.1	171.2	-62.9	0	0	0	0	113.4	A926	A926-C929 CarbonylContact O-C 3.6Å; A926-C929 WeakPolarHBondContact O-CA 3.32Å; A926-C929 PolarHBondContact O-N 3.31Å
930	Y	37.9	Very low	38.3	Very low	117 Å²	117	129.5 Å²	129.5	46%	0.459	67%	0.665	S	S	.	*	S	Bend	trans	-123	66.4	-173.7	-74.6	-94.7	0	0	0	112.3	L716 A926	L716-Y930 WeakPolarHBondContact CD1-OH 3.32Å; L716-Y930 HydrophobicContact CD2-CE1 3.65Å; A926-Y930 VanDerWaalsContact O-CD2 3.31Å; A926-Y930 WeakPolarHBondContact O-CD2 3.33Å; A926-Y930 PolarHBondContact O-N 3.01Å
931	N	33.3	Very low	39.2	Very low	123 Å²	123	133.8 Å²	133.8	66%	0.658	68%	0.678	S	S	*	*			trans	-147.6	48	175.6	-99.8	-46.8	0	0	0	114.5	H927	H927-N931 PolarHBondContact ND1-ND2 2.99Å; H927-N931 WeakPolarHBondContact O-CB 3.18Å; H927-N931 PolarHBondContact O-ND2 3.06Å
932	D	36.5	Very low	40.5	Very low	136 Å²	136	137 Å²	137	73%	0.727	68%	0.683	S	S	*	*			trans	-136.4	37.8	162.1	-128	-23.5	0	0	0	112.9	K934	D932-K934 PolarHBondContact O-N 2.69Å
933	K	35.1	Very low	42	Very low	197 Å²	197	135.3 Å²	135.3	86%	0.857	67%	0.669	S	S	*	*			trans	-77.9	69.1	167.1	-74.8	-166.9	174.7	-174.8	0	110.8
934	K	37.9	Very low	44.3	Very low	154 Å²	154	135.7 Å²	135.7	67%	0.67	67%	0.67	S	S	*	*			trans	-79.8	117.9	158.2	-81.8	173.7	-178.9	153	0	109	D932 F936	D932-K934 PolarHBondContact O-N 2.69Å; K934-F936 HydrophobicContact CB-CD2 4.46Å; K934-F936 HydrophobicContact CB-CE2 4.39Å; K934-F936 PolarHBondContact O-N 3.27Å
935	E	31.2	Very low	46.8	Very low	192 Å²	192	130.7 Å²	130.7	90%	0.897	65%	0.646	S	S	*	*			trans	-67.8	102	174.9	-62.4	179.9	129.9	0	0	109.8	P937	E935-P937 WeakPolarHBondContact O-CD 3.46Å
936	F	33.9	Very low	49.5	Very low	166 Å²	166	125.6 Å²	125.6	73%	0.728	63%	0.625	S	S	*	*			trans	-88.8	113.8	167.5	-89.1	-87.4	0	0	0	109.6	K934 E938	K934-F936 HydrophobicContact CB-CD2 4.46Å; K934-F936 HydrophobicContact CB-CE2 4.39Å; K934-F936 PolarHBondContact O-N 3.27Å; F936-E938 VanDerWaalsContact C-N 3.29Å; F936-E938 PolarHBondContact O-N 2.85Å
937	P	29.2	Very low	52	Low	125 Å²	125	126.7 Å²	126.7	81%	0.812	62%	0.621	S	S	*	*			trans	-86.3	61.8	-177	36.1	-36.4	0	0	0	111.7	E935	E935-P937 WeakPolarHBondContact O-CD 3.46Å
938	E	35.7	Very low	54.6	Low	167 Å²	167	122.8 Å²	122.8	78%	0.78	60%	0.603	S	S	*	*			trans	-99.5	127.1	-178.8	-64.5	-149.9	146.2	0	0	113.6	F936 G940	F936-E938 VanDerWaalsContact C-N 3.29Å; F936-E938 PolarHBondContact O-N 2.85Å; E938-G940 PolarHBondContact O-N 2.94Å
939	Q	33.2	Very low	57	Low	202 Å²	202	119.8 Å²	119.8	94%	0.944	59%	0.591	S	S	*	*			trans	-82.3	59.2	-178	-64.7	179.4	-14.9	0	0	111.7
940	G	41.6	Very low	59.5	Low	65 Å²	65	120 Å²	120	67%	0.67	58%	0.578	S	S	*	*			trans	-63.2	137.9	179.4	0	0	0	0	0	113.2	E938 K942	E938-G940 PolarHBondContact O-N 2.94Å; G940-K942 PolarHBondContact O-N 2.82Å
941	K	54.6	Low	62.2	Low	153 Å²	153	116.1 Å²	116.1	67%	0.665	57%	0.568	S	S	*	*			trans	-64.9	103.3	174.3	-68.6	-174.8	-178.9	-176	0	109.8	T848 Q943	T848-K941 HydrophobicContact CG2-CD 4.31Å; T848-K941 HydrophobicContact CG2-CG 4.28Å; K941-Q943 PolarHBondContact O-N 3.42Å
942	K	65.1	Low	65.1	Low	177 Å²	177	112.5 Å²	112.5	77%	0.77	56%	0.56	S	S	*	*			trans	-65.3	106.9	-178.7	-167.3	165.1	-172.2	168.6	0	111	T847 G940	T847-K942 VanDerWaalsContact CB-O 3.24Å; T847-K942 WeakPolarHBondContact CB-O 3.21Å; T847-K942 PolarHBondContact N-O 3.42Å; T847-K942 PolarHBondContact OG1-O 2.94Å; G940-K942 PolarHBondContact O-N 2.82Å
943	Q	80.9	Confident	67.8	Low	56 Å²	56	112.8 Å²	112.8	26%	0.262	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.9	147.9	170.8	-68.2	-176.1	-37.7	0	0	110.1	W844 I845 N846 K941	W844-Q943 HydrophobicContact CB-CB 4.33Å; I845-Q943 CarbonylContact O-C 3.56Å; I845-Q943 VanDerWaalsContact O-CA 3.26Å; I845-Q943 WeakPolarHBondContact O-CA 3.46Å; N846-Q943 WeakPolarHBondContact OD1-CG 3.24Å; N846-Q943 PolarHBondContact OD1-NE2 3.39Å; K941-Q943 PolarHBondContact O-N 3.42Å
944	K	90.1	Very high	70.6	Confident	124 Å²	124	104.3 Å²	104.3	54%	0.539	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	115.5	174.6	179.5	177.8	178.1	-178.8	0	109.4	I845	I845-K944 PolarHBondContact N-O 2.88Å; I845-K944 PolarHBondContact O-N 3.33Å
945	F	93.7	Very high	73.3	Confident	33 Å²	33	100.4 Å²	100.4	15%	0.145	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	142.5	169	-174.3	-112.4	0	0	0	111.2	D736 L737 N740 F842 R843 W844 K947	D736-F945 HydrophobicContact CB-CB 4.16Å; D736-F945 HydrophobicContact CB-CD1 4.44Å; D736-F945 HydrophobicContact CB-CD2 4.15Å; D736-F945 HydrophobicContact CB-CG 4.02Å; L737-F945 HydrophobicContact CD2-CE2 3.84Å; L737-F945 HydrophobicContact CD2-CZ 3.86Å; N740-F945 HydrophobicContact CB-CE1 4.03Å; N740-F945 HydrophobicContact CB-CZ 4.35Å; N740-F945 WeakPolarHBondContact ND2-CE1 3.3Å; F842-F945 HydrophobicContact CB-CE2 3.58Å; F842-F945 HydrophobicContact CB-CZ 3.67Å; F842-F945 AromaticContact CD2-CE2 3.86Å; F842-F945 HydrophobicContact CD2-CE2 3.86Å; F842-F945 AromaticContact CG-CE2 3.85Å; F842-F945 HydrophobicContact CG-CE2 3.85Å; F842-F945 HydrophobicContact CG-CZ 4.11Å; R843-F945 CarbonylContact O-C 3.57Å; R843-F945 WeakPolarHBondContact O-CA 3.32Å; W844-F945 HydrophobicContact CD2-CD2 4.08Å; W844-F945 AromaticContact CE2-CD2 3.52Å; W844-F945 HydrophobicContact CG-CD2 4.49Å; W844-F945 HydrophobicContact CH2-CD2 4.39Å; W844-F945 HydrophobicContact CH2-CE2 4.19Å; W844-F945 AromaticContact CZ2-CD2 3.69Å; W844-F945 HydrophobicContact CZ2-CD2 3.69Å; W844-F945 AromaticContact CZ2-CE2 3.84Å; W844-F945 HydrophobicContact CZ2-CE2 3.84Å; W844-F945 AromaticContact NE1-CD2 3.62Å; F945-K947 HydrophobicContact CE1-CB 3.82Å; F945-K947 HydrophobicContact CZ-CB 4.26Å
946	Q	94.8	Very high	76.4	Confident	47 Å²	47	97 Å²	97	22%	0.22	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	131.4	170.2	-64.8	-173.9	-13.1	0	0	108.8	F842 R843 I845 F948	F842-Q946 CarbonylContact C-O 3.58Å; F842-Q946 WeakPolarHBondContact CA-O 3.26Å; F842-Q946 WeakPolarHBondContact CB-O 3.24Å; R843-Q946 HydrophobicContact CG-CB 4.08Å; R843-Q946 PolarHBondContact N-O 3.32Å; R843-Q946 VanDerWaalsContact NH2-OE1 3.17Å; R843-Q946 PolarHBondContact O-N 3.49Å; I845-Q946 HydrophobicContact CD1-CG 4.48Å; I845-Q946 VanDerWaalsContact CD1-NE2 3.34Å; Q946-F948 HydrophobicContact CB-CE2 3.91Å; Q946-F948 HydrophobicContact CB-CZ 3.94Å
947	K	95.5	Very high	79.4	Confident	66 Å²	66	89.3 Å²	89.3	29%	0.287	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	135.5	177.6	171.1	171.5	177.6	173	0	109.5	N740 F840 F945 T949	N740-K947 HydrophobicContact CB-CD 4.02Å; N740-K947 PolarHBondContact O-NZ 3.24Å; N740-K947 WeakPolarHBondContact OD1-CD 3.37Å; F840-K947 HydrophobicContact CD2-CD 3.85Å; F840-K947 HydrophobicContact CD2-CG 3.65Å; F840-K947 HydrophobicContact CE1-CD 4.49Å; F840-K947 HydrophobicContact CE2-CD 3.79Å; F840-K947 HydrophobicContact CE2-CG 4.01Å; F840-K947 HydrophobicContact CG-CD 4.25Å; F840-K947 HydrophobicContact CG-CG 4.17Å; F840-K947 HydrophobicContact CZ-CD 4.14Å; F945-K947 HydrophobicContact CE1-CB 3.82Å; F945-K947 HydrophobicContact CZ-CB 4.26Å; K947-T949 HydrophobicContact CD-CG2 4.47Å; K947-T949 HydrophobicContact CG-CG2 4.3Å
948	F	96.8	Very high	82.6	Confident	35 Å²	35	83.4 Å²	83.4	15%	0.154	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	99.3	179.3	-54.2	-81.9	0	0	0	108	F840 V841 R843 Q946 F993 P996 L998	F840-F948 WeakPolarHBondContact CA-O 3.25Å; F840-F948 WeakPolarHBondContact CB-O 3.28Å; V841-F948 HydrophobicContact CG2-CB 3.84Å; V841-F948 HydrophobicContact CG2-CD2 4.23Å; V841-F948 HydrophobicContact CG2-CG 4.46Å; V841-F948 PolarHBondContact N-O 2.98Å; V841-F948 PolarHBondContact O-N 3Å; R843-F948 HydrophobicContact CG-CE2 4.29Å; Q946-F948 HydrophobicContact CB-CE2 3.91Å; Q946-F948 HydrophobicContact CB-CZ 3.94Å; F948-F993 HydrophobicContact CB-CB 4.17Å; F948-P996 VanDerWaalsContact CE1-CD 3.41Å; F948-P996 HydrophobicContact CE1-CG 4.18Å; F948-P996 HydrophobicContact CZ-CG 3.93Å; F948-L998 HydrophobicContact CD2-CD2 4.09Å; F948-L998 HydrophobicContact CE2-CD2 4.06Å
949	T	96.2	Very high	85.4	Confident	85 Å²	85	76.5 Å²	76.5	52%	0.521	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	166.4	177.9	49.3	0	0	0	0	111.5	F840 K947 S951 F993	F840-T949 HydrophobicContact CB-CG2 4.3Å; K947-T949 HydrophobicContact CD-CG2 4.47Å; K947-T949 HydrophobicContact CG-CG2 4.3Å; T949-S951 PolarHBondContact O-N 3.38Å; T949-F993 CarbonylContact O-C 3.33Å; T949-F993 WeakPolarHBondContact O-CA 3.25Å
950	W	96.6	Very high	88.4	Confident	99 Å²	99	66.9 Å²	66.9	38%	0.375	34%	0.344	S	S	.	.			trans	-46.6	131.5	169.3	-178.9	41.5	0	0	0	112.1	N954 F957 T992	W950-N954 PolarHBondContact NE1-O 2.99Å; W950-F957 HydrophobicContact CB-CE1 3.97Å; W950-F957 AromaticContact CD1-CE1 3.32Å; W950-F957 AromaticContact CD1-CZ 3.69Å; W950-F957 HydrophobicContact CD2-CE1 4.02Å; W950-F957 AromaticContact CD2-CZ 3.83Å; W950-F957 HydrophobicContact CD2-CZ 3.83Å; W950-F957 AromaticContact CE2-CZ 3.66Å; W950-F957 AromaticContact CG-CE1 3.52Å; W950-F957 HydrophobicContact CG-CE1 3.52Å; W950-F957 AromaticContact CG-CZ 3.86Å; W950-F957 HydrophobicContact CG-CZ 3.86Å; W950-F957 HydrophobicContact CZ2-CZ 4.24Å; W950-F957 AromaticContact NE1-CE1 3.72Å; W950-F957 AromaticContact NE1-CZ 3.58Å; W950-T992 VanDerWaalsContact CD1-O 3.31Å
951	S	94.8	Very high	90.9	Very high	37 Å²	37	66.8 Å²	66.8	26%	0.259	33%	0.328	S	S	.	.			trans	-79.1	-29.4	-179.5	59	0	0	0	0	113.9	T949 E953 E991 T992 N994	T949-S951 PolarHBondContact O-N 3.38Å; S951-E953 PolarHBondContact OG-N 2.86Å; S951-E953 VanDerWaalsContact OG-N 3.13Å; S951-E991 VanDerWaalsContact CB-O 3.24Å; S951-E991 WeakPolarHBondContact CB-O 3.46Å; S951-E991 PolarHBondContact OG-O 3.01Å; S951-T992 PolarHBondContact N-O 2.6Å; S951-T992 PolarHBondContact OG-O 3.33Å; S951-N994 WeakPolarHBondContact CB-ND2 3Å
952	G	93.7	Very high	92.7	Very high	46 Å²	46	64.7 Å²	64.7	47%	0.474	32%	0.317	S	S	.	.	S	Bend	trans	98.3	-21	-166.4	0	0	0	0	0	114.4	N954	G952-N954 PolarHBondContact O-N 2.95Å
953	E	93.1	Very high	94.1	Very high	143 Å²	143	61 Å²	61	67%	0.668	31%	0.306	S	S	*	.	S	Bend	trans	-65.5	-39.6	-170	-60.7	-63.1	166.2	0	0	113.6	S951	S951-E953 PolarHBondContact OG-N 2.86Å; S951-E953 VanDerWaalsContact OG-N 3.13Å
954	N	94.2	Very high	94.8	Very high	19 Å²	19	60 Å²	60	10%	0.102	31%	0.305	C	S	.	.			trans	-149.8	163.8	178.1	71.2	66.2	0	0	0	111.4	W950 G952 Y956 T992	W950-N954 PolarHBondContact NE1-O 2.99Å; G952-N954 PolarHBondContact O-N 2.95Å; N954-Y956 HydrophobicContact CB-CD2 3.65Å; N954-Y956 HydrophobicContact CB-CE2 3.86Å; N954-Y956 HydrophobicContact CB-CG 4.38Å; N954-Y956 WeakPolarHBondContact OD1-CB 3.4Å; N954-Y956 WeakPolarHBondContact OD1-CD2 3.43Å; N954-Y956 PolarHBondContact OD1-N 2.94Å; N954-T992 PolarHBondContact ND2-N 3.38Å; N954-T992 PolarHBondContact ND2-OG1 2.59Å; N954-T992 WeakPolarHBondContact OD1-CB 3.48Å; N954-T992 WeakPolarHBondContact OD1-CG2 3.29Å; N954-T992 PolarHBondContact OD1-OG1 3.47Å
955	S	94.3	Very high	95.2	Very high	72 Å²	72	54.1 Å²	54.1	50%	0.503	28%	0.279	S	S	.	.			trans	-106.9	29.9	-179.6	-62.9	0	0	0	0	113.4	F957	S955-F957 VanDerWaalsContact C-N 3.25Å; S955-F957 VanDerWaalsContact O-CD2 3.24Å; S955-F957 WeakPolarHBondContact O-CD2 3.29Å; S955-F957 PolarHBondContact O-N 3.19Å
956	Y	96	Very high	95.3	Very high	119 Å²	119	53.2 Å²	53.2	47%	0.467	28%	0.276	S	S	.	.			trans	-88	55.5	-174.3	-57.1	-44.5	0	0	0	112.1	F833 N954 G968 C969	F833-Y956 HydrophobicContact CB-CD1 4.09Å; F833-Y956 VanDerWaalsContact CD1-C 3.46Å; F833-Y956 VanDerWaalsContact CD1-CA 3.49Å; F833-Y956 HydrophobicContact CD1-CD1 4.32Å; F833-Y956 HydrophobicContact CD1-CG 4.38Å; F833-Y956 AromaticContact CD2-CD1 3.64Å; F833-Y956 HydrophobicContact CD2-CD1 3.64Å; F833-Y956 HydrophobicContact CD2-CE1 4.34Å; F833-Y956 HydrophobicContact CD2-CG 4.25Å; F833-Y956 HydrophobicContact CE2-CD1 4.14Å; F833-Y956 HydrophobicContact CE2-CG 4.39Å; F833-Y956 AromaticContact CG-CD1 3.75Å; F833-Y956 HydrophobicContact CG-CD1 3.75Å; F833-Y956 HydrophobicContact CG-CG 4.24Å; N954-Y956 HydrophobicContact CB-CD2 3.65Å; N954-Y956 HydrophobicContact CB-CE2 3.86Å; N954-Y956 HydrophobicContact CB-CG 4.38Å; N954-Y956 WeakPolarHBondContact OD1-CB 3.4Å; N954-Y956 WeakPolarHBondContact OD1-CD2 3.43Å; N954-Y956 PolarHBondContact OD1-N 2.94Å; Y956-G968 WeakPolarHBondContact O-CA 3.48Å; Y956-C969 WeakPolarHBondContact CB-O 3.46Å; Y956-C969 WeakPolarHBondContact CD2-O 3.39Å; Y956-C969 PolarHBondContact O-N 3.02Å
957	F	96.5	Very high	95.5	Very high	6 Å²	6	51 Å²	51	3%	0.026	27%	0.266	C	S	.	.			trans	-68.8	-53	-168.8	-55.8	-75.9	0	0	0	114.5	Y834 N836 C839 W950 S955 I967 G968 T992 F993	Y834-F957 WeakPolarHBondContact O-CB 3.47Å; N836-F957 VanDerWaalsContact C-CE2 3.5Å; N836-F957 VanDerWaalsContact C-CZ 3.43Å; N836-F957 WeakPolarHBondContact O-CD1 3.34Å; N836-F957 WeakPolarHBondContact O-CE1 3.24Å; C839-F957 HydrophobicContact CB-CB 4.33Å; C839-F957 HydrophobicContact CB-CD1 3.97Å; C839-F957 HydrophobicContact CB-CG 4.42Å; W950-F957 HydrophobicContact CB-CE1 3.97Å; W950-F957 AromaticContact CD1-CE1 3.32Å; W950-F957 AromaticContact CD1-CZ 3.69Å; W950-F957 HydrophobicContact CD2-CE1 4.02Å; W950-F957 AromaticContact CD2-CZ 3.83Å; W950-F957 HydrophobicContact CD2-CZ 3.83Å; W950-F957 AromaticContact CE2-CZ 3.66Å; W950-F957 AromaticContact CG-CE1 3.52Å; W950-F957 HydrophobicContact CG-CE1 3.52Å; W950-F957 AromaticContact CG-CZ 3.86Å; W950-F957 HydrophobicContact CG-CZ 3.86Å; W950-F957 HydrophobicContact CZ2-CZ 4.24Å; W950-F957 AromaticContact NE1-CE1 3.72Å; W950-F957 AromaticContact NE1-CZ 3.58Å; S955-F957 VanDerWaalsContact C-N 3.25Å; S955-F957 VanDerWaalsContact O-CD2 3.24Å; S955-F957 WeakPolarHBondContact O-CD2 3.29Å; S955-F957 PolarHBondContact O-N 3.19Å; F957-I967 CarbonylContact O-C 3.56Å; F957-I967 VanDerWaalsContact O-CA 3.28Å; F957-I967 WeakPolarHBondContact O-CA 3.14Å; F957-G968 PolarHBondContact O-N 2.84Å; F957-T992 HydrophobicContact CD1-CG2 4.18Å; F957-T992 HydrophobicContact CE1-CG2 4.49Å; F957-F993 HydrophobicContact CD1-CE1 4.07Å; F957-F993 HydrophobicContact CD1-CZ 4.25Å
958	I	96.6	Very high	95.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	135.2	-175.3	-40.5	175.7	0	0	0	108.8	L822 T824 F833 Y834 L965 T966 I967	L822-I958 HydrophobicContact CB-CD1 3.96Å; L822-I958 HydrophobicContact CD1-CD1 4.36Å; L822-I958 HydrophobicContact CD2-CD1 3.91Å; L822-I958 HydrophobicContact CD2-CG1 4.07Å; L822-I958 HydrophobicContact CG-CD1 4.29Å; T824-I958 HydrophobicContact CG2-CD1 4.1Å; F833-I958 CarbonylContact C-O 3.46Å; F833-I958 WeakPolarHBondContact CA-O 3.24Å; Y834-I958 HydrophobicContact CD1-CB 4.47Å; Y834-I958 WeakPolarHBondContact CD1-O 3.35Å; Y834-I958 HydrophobicContact CD2-CB 4.06Å; Y834-I958 HydrophobicContact CD2-CD1 4.2Å; Y834-I958 HydrophobicContact CD2-CG2 4.47Å; Y834-I958 HydrophobicContact CE1-CB 4.25Å; Y834-I958 HydrophobicContact CE1-CG2 4.1Å; Y834-I958 HydrophobicContact CE2-CB 3.82Å; Y834-I958 HydrophobicContact CE2-CD1 3.98Å; Y834-I958 HydrophobicContact CE2-CG1 4.48Å; Y834-I958 HydrophobicContact CE2-CG2 3.73Å; Y834-I958 HydrophobicContact CG-CB 4.39Å; Y834-I958 PolarHBondContact N-O 2.82Å; Y834-I958 WeakPolarHBondContact O-CB 3.17Å; Y834-I958 PolarHBondContact O-N 2.87Å; I958-L965 HydrophobicContact CG2-CD1 4.25Å; I958-T966 CarbonylContact C-O 3.45Å; I958-T966 WeakPolarHBondContact CA-O 3.34Å; I958-I967 HydrophobicContact CG2-CG1 4.41Å
959	N	95.7	Very high	95.4	Very high	22 Å²	22	47.4 Å²	47.4	12%	0.118	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	126.4	170.1	-159.1	-25.5	0	0	0	109	S829 G831 R832 F833 T966	S829-N959 PolarHBondContact OG-OD1 3.12Å; G831-N959 VanDerWaalsContact C-OD1 3.27Å; G831-N959 VanDerWaalsContact CA-OD1 3.3Å; G831-N959 WeakPolarHBondContact CA-OD1 3.4Å; G831-N959 PolarHBondContact O-ND2 3.02Å; R832-N959 PolarHBondContact O-OD1 2.83Å; F833-N959 HydrophobicContact CD1-CB 3.66Å; F833-N959 WeakPolarHBondContact CD2-ND2 3.33Å; F833-N959 HydrophobicContact CE1-CB 3.54Å; F833-N959 HydrophobicContact CE2-CB 4.49Å; F833-N959 WeakPolarHBondContact CE2-ND2 3.29Å; F833-N959 HydrophobicContact CG-CB 4.21Å; F833-N959 HydrophobicContact CZ-CB 3.98Å; F833-N959 WeakPolarHBondContact CZ-ND2 3.42Å; N959-T966 PolarHBondContact N-O 3.46Å; N959-T966 PolarHBondContact O-N 2.61Å
960	G	94.8	Very high	95.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	125.4	178.5	0	0	0	0	0	110.1	Y767 P828 S829	Y767-G960 WeakPolarHBondContact OH-CA 3.39Å; P828-G960 CarbonylContact C-O 3.52Å; P828-G960 WeakPolarHBondContact CA-O 3.5Å; S829-G960 PolarHBondContact N-O 3.35Å; S829-G960 PolarHBondContact OG-N 2.93Å; S829-G960 PolarHBondContact OG-O 3.02Å
961	D	94.2	Very high	94.7	Very high	63 Å²	63	46.6 Å²	46.6	34%	0.337	25%	0.248	S	C	.	.			trans	-117.1	176.9	164.1	-146.5	-23.5	0	0	0	110.1	Y767 D963 S964	Y767-D961 WeakPolarHBondContact CE2-O 3.49Å; Y767-D961 PolarHBondContact OH-N 3.35Å; Y767-D961 PolarHBondContact OH-O 3.27Å; D961-D963 PolarHBondContact O-N 3.33Å; D961-S964 CarbonylContact C-O 3.52Å; D961-S964 PolarHBondContact N-O 3.42Å; D961-S964 VanDerWaalsContact O-O 3.07Å
962	Y	93.5	Very high	94.4	Very high	109 Å²	109	47.9 Å²	47.9	43%	0.427	27%	0.268	S	S	.	.	S	Bend	trans	-68.1	-20.6	178.4	-71	-84.7	0	0	0	113.8	R764 P828	R764-Y962 PolarHBondContact NE-O 2.86Å; P828-Y962 HydrophobicContact CB-CE1 4.41Å; P828-Y962 HydrophobicContact CB-CE2 4.18Å; P828-Y962 HydrophobicContact CG-CE1 4.41Å
963	D	94.9	Very high	94.3	Very high	100 Å²	100	50 Å²	50	54%	0.535	27%	0.265	S	S	.	.	S	Bend	trans	-120	-5.8	-169.9	-58	-19.7	0	0	0	113	R764 D961 D980	R764-D963 IonicContact NH2-OD1 3.43Å; R764-D963 PolarHBondContact NH2-OD1 2.94Å; D961-D963 PolarHBondContact O-N 3.33Å; D963-D980 PolarHBondContact O-N 3.17Å
964	S	95.2	Very high	94.5	Very high	36 Å²	36	43.2 Å²	43.2	25%	0.252	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	159.1	172.3	64.7	0	0	0	0	113.5	L763 Y767 D961 L978	L763-S964 VanDerWaalsContact CD2-C 3.44Å; Y767-S964 PolarHBondContact OH-O 3.27Å; D961-S964 CarbonylContact C-O 3.52Å; D961-S964 PolarHBondContact N-O 3.42Å; D961-S964 VanDerWaalsContact O-O 3.07Å; S964-L978 WeakPolarHBondContact CA-O 3.34Å; S964-L978 VanDerWaalsContact CB-O 3.31Å; S964-L978 WeakPolarHBondContact CB-O 3.37Å
965	L	97.3	Very high	94.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	123.5	170.1	175	60.5	0	0	0	109.6	L763 P826 I958 Q977 L978	L763-L965 HydrophobicContact CD1-CB 3.77Å; L763-L965 HydrophobicContact CD1-CD2 4Å; L763-L965 HydrophobicContact CD1-CG 4.49Å; L763-L965 HydrophobicContact CD2-CB 4.14Å; P826-L965 HydrophobicContact CB-CD1 4.1Å; P826-L965 HydrophobicContact CB-CD2 3.9Å; P826-L965 HydrophobicContact CG-CD2 4.16Å; I958-L965 HydrophobicContact CG2-CD1 4.25Å; L965-Q977 CarbonylContact O-C 3.46Å; L965-Q977 WeakPolarHBondContact O-CA 3.37Å; L965-L978 HydrophobicContact CD2-CD1 4.4Å; L965-L978 PolarHBondContact N-O 3.33Å; L965-L978 PolarHBondContact O-N 3.21Å
966	T	97.2	Very high	94.8	Very high	13 Å²	13	38.9 Å²	38.9	8%	0.08	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	135.5	-176.5	-64.6	0	0	0	0	110.8	I958 N959 C969 S974 I976	I958-T966 CarbonylContact C-O 3.45Å; I958-T966 WeakPolarHBondContact CA-O 3.34Å; N959-T966 PolarHBondContact N-O 3.46Å; N959-T966 PolarHBondContact O-N 2.61Å; T966-C969 HydrophobicContact CG2-CB 4.07Å; T966-S974 WeakPolarHBondContact CG2-OG 3.47Å; T966-I976 CarbonylContact C-O 3.55Å; T966-I976 WeakPolarHBondContact CA-O 3.2Å
967	I	97.8	Very high	94.8	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	117.8	177.1	-63.4	157.7	0	0	0	108.3	L808 A820 L822 V841 F957 I958 A975 I976 F993	L808-I967 HydrophobicContact CD2-CD1 3.35Å; A820-I967 HydrophobicContact CB-CD1 4.15Å; A820-I967 HydrophobicContact CB-CG2 3.89Å; L822-I967 HydrophobicContact CD1-CD1 4.14Å; L822-I967 HydrophobicContact CD2-CD1 4.04Å; L822-I967 HydrophobicContact CD2-CG1 4.11Å; L822-I967 HydrophobicContact CD2-CG2 3.95Å; V841-I967 HydrophobicContact CG1-CG2 4.1Å; F957-I967 CarbonylContact O-C 3.56Å; F957-I967 VanDerWaalsContact O-CA 3.28Å; F957-I967 WeakPolarHBondContact O-CA 3.14Å; I958-I967 HydrophobicContact CG2-CG1 4.41Å; I967-A975 WeakPolarHBondContact O-CB 3.43Å; I967-A975 PolarHBondContact O-N 2.76Å; I967-I976 HydrophobicContact CB-CB 4.37Å; I967-I976 PolarHBondContact N-O 2.82Å; I967-I976 PolarHBondContact O-N 2.83Å; I967-F993 HydrophobicContact CG2-CE2 4.15Å; I967-F993 HydrophobicContact CG2-CZ 4.4Å
968	G	96.1	Very high	94.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	68.5	126.8	-166.5	0	0	0	0	0	111.4	Y956 F957 S974 A975 F993	Y956-G968 WeakPolarHBondContact O-CA 3.48Å; F957-G968 PolarHBondContact O-N 2.84Å; G968-S974 WeakPolarHBondContact O-CA 3.24Å; G968-S974 WeakPolarHBondContact O-CB 3.38Å; G968-A975 PolarHBondContact O-N 3.12Å; G968-F993 VanDerWaalsContact CA-CE2 3.5Å
969	C	94.3	Very high	94.9	Very high	26 Å²	26	38 Å²	38	18%	0.176	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	131.5	177.5	-165.6	0	0	0	0	110.9	F833 Y956 T966 H973 T992	F833-C969 HydrophobicContact CE1-CB 3.52Å; F833-C969 HydrophobicContact CZ-CB 3.5Å; F833-C969 VanDerWaalsContact CZ-CB 3.5Å; Y956-C969 WeakPolarHBondContact CB-O 3.46Å; Y956-C969 WeakPolarHBondContact CD2-O 3.39Å; Y956-C969 PolarHBondContact O-N 3.02Å; T966-C969 HydrophobicContact CG2-CB 4.07Å; C969-H973 CarbonylContact C-O 3.59Å; C969-H973 WeakPolarHBondContact CA-O 3.41Å; C969-T992 PolarHBondContact N-OG1 2.71Å; C969-T992 PolarHBondContact O-OG1 2.65Å
970	S	91.7	Very high	94.9	Very high	6 Å²	6	39.8 Å²	39.8	4%	0.042	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	121.8	-176.4	51.2	0	0	0	0	110.4	G972 H973 C990 E991	S970-G972 PolarHBondContact O-N 3.29Å; S970-H973 PolarHBondContact N-O 2.85Å; S970-H973 WeakPolarHBondContact O-CB 3.07Å; S970-H973 PolarHBondContact O-N 2.8Å; S970-C990 WeakPolarHBondContact OG-CA 3.24Å; S970-C990 PolarHBondContact OG-SG 2.92Å; S970-C990 VanDerWaalsContact OG-SG 3.4Å; S970-E991 WeakPolarHBondContact CB-OE2 3.36Å; S970-E991 PolarHBondContact OG-N 3.46Å
971	Q	87.8	Confident	95	Very high	160 Å²	160	42.9 Å²	42.9	75%	0.748	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	54	21.6	-179.6	-45	-57	-15.8	0	0	115.4
972	G	87.2	Confident	95.1	Very high	64 Å²	64	39.9 Å²	39.9	66%	0.66	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.7	-17.6	-175	0	0	0	0	0	114.6	S970	S970-G972 PolarHBondContact O-N 3.29Å
973	H	92.4	Very high	95.2	Very high	90 Å²	90	37.8 Å²	37.8	42%	0.417	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	147.6	171.2	-56.9	-77.9	0	0	0	110.5	C969 S970 D988 N989	C969-H973 CarbonylContact C-O 3.59Å; C969-H973 WeakPolarHBondContact CA-O 3.41Å; S970-H973 PolarHBondContact N-O 2.85Å; S970-H973 WeakPolarHBondContact O-CB 3.07Å; S970-H973 PolarHBondContact O-N 2.8Å; H973-D988 HydrophobicContact CB-CB 4.21Å; H973-D988 IonicContact CE1-OD2 3.62Å; H973-D988 IonicContact CG-OD2 3.69Å; H973-D988 IonicContact ND1-OD2 2.7Å; H973-D988 PolarHBondContact ND1-OD2 3.06Å; H973-N989 VanDerWaalsContact CB-O 3.29Å; H973-N989 WeakPolarHBondContact CB-O 3.42Å
974	S	95.9	Very high	95.3	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.014	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	139.2	-176.6	-59.2	0	0	0	0	111.9	T966 G968 D988	T966-S974 WeakPolarHBondContact CG2-OG 3.47Å; G968-S974 WeakPolarHBondContact O-CA 3.24Å; G968-S974 WeakPolarHBondContact O-CB 3.38Å; S974-D988 PolarHBondContact O-N 2.89Å
975	A	97.2	Very high	95.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	-41.2	-179.1	0	0	0	0	0	111.4	V841 I967 G968 S987 C990 F993	V841-A975 HydrophobicContact CG1-CB 4.19Å; V841-A975 HydrophobicContact CG2-CB 4.39Å; I967-A975 WeakPolarHBondContact O-CB 3.43Å; I967-A975 PolarHBondContact O-N 2.76Å; G968-A975 PolarHBondContact O-N 3.12Å; A975-S987 WeakPolarHBondContact O-CA 3.38Å; A975-S987 WeakPolarHBondContact O-CB 3.38Å; A975-S987 PolarHBondContact O-OG 3.3Å; A975-C990 HydrophobicContact CB-CB 3.72Å; A975-F993 HydrophobicContact CB-CD2 4Å; A975-F993 HydrophobicContact CB-CE2 4.43Å
976	I	97.8	Very high	95.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	128.7	166.4	-55.7	175	0	0	0	108.1	I810 F818 A820 T966 I967 L978 L998	I810-I976 HydrophobicContact CD1-CG2 3.92Å; F818-I976 HydrophobicContact CD2-CD1 4.13Å; F818-I976 HydrophobicContact CD2-CG1 4.4Å; F818-I976 HydrophobicContact CE2-CD1 4.44Å; F818-I976 HydrophobicContact CE2-CG1 4.41Å; A820-I976 HydrophobicContact CB-CD1 4.33Å; T966-I976 CarbonylContact C-O 3.55Å; T966-I976 WeakPolarHBondContact CA-O 3.2Å; I967-I976 HydrophobicContact CB-CB 4.37Å; I967-I976 PolarHBondContact N-O 2.82Å; I967-I976 PolarHBondContact O-N 2.83Å; I976-L978 HydrophobicContact CG2-CD2 3.67Å; I976-L978 HydrophobicContact CG2-CG 4.04Å; I976-L998 HydrophobicContact CD1-CD1 3.95Å; I976-L998 HydrophobicContact CG1-CD1 3.61Å
977	Q	97.3	Very high	95.4	Very high	71 Å²	71	38 Å²	38	33%	0.332	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	135.9	168.2	176.8	171.6	-14.3	0	0	109.4	L965 G985 H986	L965-Q977 CarbonylContact O-C 3.46Å; L965-Q977 WeakPolarHBondContact O-CA 3.37Å; Q977-G985 CarbonylContact O-C 3.57Å; Q977-G985 WeakPolarHBondContact O-CA 3.34Å; Q977-H986 PolarHBondContact N-O 2.8Å; Q977-H986 PolarHBondContact O-N 3.03Å
978	L	97.8	Very high	95.3	Very high	3 Å²	3	39.7 Å²	39.7	2%	0.016	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	148.7	-175.3	-48.3	178	0	0	0	110.8	L808 I810 S964 L965 I976 L982 F1005 I1007 L1010	L808-L978 HydrophobicContact CD2-CD1 4.36Å; I810-L978 HydrophobicContact CD1-CD1 4.43Å; I810-L978 HydrophobicContact CD1-CD2 3.79Å; S964-L978 WeakPolarHBondContact CA-O 3.34Å; S964-L978 VanDerWaalsContact CB-O 3.31Å; S964-L978 WeakPolarHBondContact CB-O 3.37Å; L965-L978 HydrophobicContact CD2-CD1 4.4Å; L965-L978 PolarHBondContact N-O 3.33Å; L965-L978 PolarHBondContact O-N 3.21Å; I976-L978 HydrophobicContact CG2-CD2 3.67Å; I976-L978 HydrophobicContact CG2-CG 4.04Å; L978-L982 HydrophobicContact CB-CD2 4.31Å; L978-L982 HydrophobicContact CD1-CD2 4.26Å; L978-F1005 HydrophobicContact CD2-CE2 4.28Å; L978-F1005 HydrophobicContact CD2-CZ 4.09Å; L978-I1007 HydrophobicContact CD2-CD1 3.9Å; L978-L1010 HydrophobicContact CD1-CD1 3.68Å
979	D	97.1	Very high	95.3	Very high	33 Å²	33	44.4 Å²	44.4	18%	0.176	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	172.3	175.5	69.5	4.5	0	0	0	114.2	I981 L982 L983 H984	D979-I981 VanDerWaalsContact C-N 3.27Å; D979-I981 VanDerWaalsContact CG-CG1 3.45Å; D979-I981 PolarHBondContact O-N 3.38Å; D979-I981 WeakPolarHBondContact OD1-CG1 3.29Å; D979-I981 VanDerWaalsContact OD2-CG1 3.24Å; D979-I981 WeakPolarHBondContact OD2-CG1 3.31Å; D979-L982 PolarHBondContact O-N 2.71Å; D979-L982 VanDerWaalsContact O-N 3.16Å; D979-L982 VanDerWaalsContact OD1-CA 3.25Å; D979-L982 WeakPolarHBondContact OD1-CA 3.19Å; D979-L982 PolarHBondContact OD1-N 3.21Å; D979-L983 PolarHBondContact OD1-N 3.18Å; D979-H984 PolarHBondContact N-O 3.46Å; D979-H984 VanDerWaalsContact N-O 3.12Å; D979-H984 PolarHBondContact OD1-N 3.06Å; D979-H984 WeakPolarHBondContact OD2-CB 3.4Å; D979-H984 IonicContact OD2-CE1 3.74Å; D979-H984 IonicContact OD2-CG 3.92Å; D979-H984 PolarHBondContact OD2-N 2.75Å; D979-H984 IonicContact OD2-ND1 4Å; D979-H984 PolarHBondContact OD2-ND1 3.43Å
980	D	96.5	Very high	95.4	Very high	58 Å²	58	43.4 Å²	43.4	31%	0.31	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-26.9	-176.1	84.9	-58.2	0	0	0	113.8	S762 L763 D963	S762-D980 WeakPolarHBondContact CA-O 3.17Å; L763-D980 VanDerWaalsContact CB-O 3.32Å; L763-D980 WeakPolarHBondContact CB-O 3.16Å; L763-D980 PolarHBondContact N-O 3.03Å; D963-D980 PolarHBondContact O-N 3.17Å
981	I	96	Very high	95.5	Very high	66 Å²	66	47.2 Å²	47.2	34%	0.338	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-9.5	176	54.2	174.7	0	0	0	113.1	F761 S762 D979 L983	F761-I981 CarbonylContact C-O 3.6Å; F761-I981 WeakPolarHBondContact CA-O 3.5Å; F761-I981 VanDerWaalsContact CB-O 3.23Å; F761-I981 WeakPolarHBondContact CB-O 3.23Å; S762-I981 PolarHBondContact N-O 2.88Å; D979-I981 VanDerWaalsContact C-N 3.27Å; D979-I981 VanDerWaalsContact CG-CG1 3.45Å; D979-I981 PolarHBondContact O-N 3.38Å; D979-I981 WeakPolarHBondContact OD1-CG1 3.29Å; D979-I981 VanDerWaalsContact OD2-CG1 3.24Å; D979-I981 WeakPolarHBondContact OD2-CG1 3.31Å; I981-L983 VanDerWaalsContact C-N 3.25Å; I981-L983 HydrophobicContact CD1-CB 3.68Å; I981-L983 HydrophobicContact CD1-CD2 3.99Å; I981-L983 HydrophobicContact CD1-CG 4.46Å; I981-L983 HydrophobicContact CG1-CB 3.79Å; I981-L983 PolarHBondContact O-N 3.22Å
982	L	96.5	Very high	95.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.215	C	C	.	.	S	Bend	trans	57	34.4	-173.1	-51.9	173.7	0	0	0	113.4	Y754 T756 F761 L763 L766 L978 D979 I1007 L1010	Y754-L982 HydrophobicContact CE1-CD1 3.91Å; T756-L982 HydrophobicContact CG2-CD1 4.35Å; F761-L982 VanDerWaalsContact CD1-O 3.29Å; F761-L982 WeakPolarHBondContact CD1-O 3.26Å; F761-L982 WeakPolarHBondContact CE1-O 3.28Å; L763-L982 HydrophobicContact CB-CD2 4.01Å; L763-L982 HydrophobicContact CB-CG 4.26Å; L763-L982 HydrophobicContact CD1-CD2 4.1Å; L766-L982 HydrophobicContact CB-CD1 4.23Å; L766-L982 HydrophobicContact CD1-CD1 3.78Å; L766-L982 HydrophobicContact CD1-CD2 4.21Å; L978-L982 HydrophobicContact CB-CD2 4.31Å; L978-L982 HydrophobicContact CD1-CD2 4.26Å; D979-L982 PolarHBondContact O-N 2.71Å; D979-L982 VanDerWaalsContact O-N 3.16Å; D979-L982 VanDerWaalsContact OD1-CA 3.25Å; D979-L982 WeakPolarHBondContact OD1-CA 3.19Å; D979-L982 PolarHBondContact OD1-N 3.21Å; L982-I1007 WeakPolarHBondContact O-CB 3.38Å; L982-I1007 WeakPolarHBondContact O-CD1 3.4Å; L982-L1010 HydrophobicContact CD2-CD1 4.27Å
983	L	96.3	Very high	96.4	Very high	64 Å²	64	36.8 Å²	36.8	34%	0.335	18%	0.184	S	C	.	.	S	Bend	trans	-104.4	-45.9	179.2	-179.7	60.6	0	0	0	111.8	D979 I981 I1006 I1007	D979-L983 PolarHBondContact OD1-N 3.18Å; I981-L983 VanDerWaalsContact C-N 3.25Å; I981-L983 HydrophobicContact CD1-CB 3.68Å; I981-L983 HydrophobicContact CD1-CD2 3.99Å; I981-L983 HydrophobicContact CD1-CG 4.46Å; I981-L983 HydrophobicContact CG1-CB 3.79Å; I981-L983 PolarHBondContact O-N 3.22Å; L983-I1006 HydrophobicContact CD1-CG2 3.86Å; L983-I1006 HydrophobicContact CG-CG2 4.5Å; L983-I1006 CarbonylContact O-C 3.58Å; L983-I1006 WeakPolarHBondContact O-CA 3.37Å; L983-I1007 PolarHBondContact O-N 3.33Å
984	H	97	Very high	96.5	Very high	97 Å²	97	37.3 Å²	37.3	45%	0.449	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	143.6	175.7	-45.6	87.9	0	0	0	109.7	D979	D979-H984 PolarHBondContact N-O 3.46Å; D979-H984 VanDerWaalsContact N-O 3.12Å; D979-H984 PolarHBondContact OD1-N 3.06Å; D979-H984 WeakPolarHBondContact OD2-CB 3.4Å; D979-H984 IonicContact OD2-CE1 3.74Å; D979-H984 IonicContact OD2-CG 3.92Å; D979-H984 PolarHBondContact OD2-N 2.75Å; D979-H984 IonicContact OD2-ND1 4Å; D979-H984 PolarHBondContact OD2-ND1 3.43Å
985	G	97	Very high	96.4	Very high	7 Å²	7	37.3 Å²	37.3	7%	0.072	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	164.5	165.7	0	0	0	0	0	111.4	Q977 F1005	Q977-G985 CarbonylContact O-C 3.57Å; Q977-G985 WeakPolarHBondContact O-CA 3.34Å; G985-F1005 VanDerWaalsContact CA-CZ 3.5Å; G985-F1005 PolarHBondContact N-O 3.22Å; G985-F1005 WeakPolarHBondContact O-CD1 3.24Å; G985-F1005 PolarHBondContact O-N 3.2Å
986	H	96.8	Very high	96.2	Very high	51 Å²	51	39.3 Å²	39.3	24%	0.236	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	136.7	179.4	-176.8	86.1	0	0	0	108.1	Q977 D988 P1003 D1004	Q977-H986 PolarHBondContact N-O 2.8Å; Q977-H986 PolarHBondContact O-N 3.03Å; H986-D988 IonicContact NE2-OD2 3.46Å; H986-D988 PolarHBondContact NE2-OD2 3.43Å; H986-P1003 CarbonylContact C-O 3.58Å; H986-P1003 WeakPolarHBondContact CA-O 3.4Å; H986-D1004 IonicContact CE1-OD1 3.71Å; H986-D1004 IonicContact CG-OD1 2.63Å; H986-D1004 IonicContact ND1-OD1 2.76Å; H986-D1004 PolarHBondContact ND1-OD1 3.4Å
987	S	97.4	Very high	96.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.214	C	C	.	.			trans	-131.4	135.4	174	-176.7	0	0	0	0	107.6	A975 Q997 L998 P1003	A975-S987 WeakPolarHBondContact O-CA 3.38Å; A975-S987 WeakPolarHBondContact O-CB 3.38Å; A975-S987 PolarHBondContact O-OG 3.3Å; S987-Q997 WeakPolarHBondContact O-CG 3.4Å; S987-L998 WeakPolarHBondContact OG-CB 3.41Å; S987-L998 PolarHBondContact OG-N 3.39Å; S987-P1003 PolarHBondContact N-O 3.27Å; S987-P1003 VanDerWaalsContact O-CA 3.24Å; S987-P1003 WeakPolarHBondContact O-CA 3.33Å; S987-P1003 WeakPolarHBondContact O-CB 3.43Å
988	D	96.2	Very high	95.9	Very high	36 Å²	36	38.3 Å²	38.3	19%	0.193	20%	0.199	C	C	.	.			trans	-145.1	171.5	-175	-142.4	-7	0	0	0	110.2	H973 S974 H986 C990	H973-D988 HydrophobicContact CB-CB 4.21Å; H973-D988 IonicContact CE1-OD2 3.62Å; H973-D988 IonicContact CG-OD2 3.69Å; H973-D988 IonicContact ND1-OD2 2.7Å; H973-D988 PolarHBondContact ND1-OD2 3.06Å; S974-D988 PolarHBondContact O-N 2.89Å; H986-D988 IonicContact NE2-OD2 3.46Å; H986-D988 PolarHBondContact NE2-OD2 3.43Å; D988-C990 PolarHBondContact O-N 3.29Å
989	N	95.4	Very high	95.7	Very high	99 Å²	99	38.2 Å²	38.2	53%	0.529	20%	0.199	S	C	.	.			trans	-65	129.7	175.8	-75.6	18.8	0	0	0	110.5	H973 S995 P996 Q997	H973-N989 VanDerWaalsContact CB-O 3.29Å; H973-N989 WeakPolarHBondContact CB-O 3.42Å; N989-S995 WeakPolarHBondContact CA-O 3.2Å; N989-P996 VanDerWaalsContact OD1-CA 3.28Å; N989-P996 WeakPolarHBondContact OD1-CA 3.37Å; N989-Q997 PolarHBondContact OD1-N 2.68Å
990	C	95.6	Very high	95.3	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.034	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-135.5	122.5	-172	-172.5	0	0	0	0	113.9	S970 A975 D988 T992 F993 N994 S995	S970-C990 WeakPolarHBondContact OG-CA 3.24Å; S970-C990 PolarHBondContact OG-SG 2.92Å; S970-C990 VanDerWaalsContact OG-SG 3.4Å; A975-C990 HydrophobicContact CB-CB 3.72Å; D988-C990 PolarHBondContact O-N 3.29Å; C990-T992 VanDerWaalsContact C-N 3.27Å; C990-T992 PolarHBondContact O-N 2.67Å; C990-F993 PolarHBondContact O-N 2.92Å; C990-N994 WeakPolarHBondContact O-CA 3.46Å; C990-N994 PolarHBondContact O-N 3.14Å; C990-S995 PolarHBondContact N-O 2.93Å; C990-S995 PolarHBondContact O-N 2.86Å
991	E	95	Very high	94.9	Very high	85 Å²	85	42.5 Å²	42.5	40%	0.397	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-26.5	-179.2	-56.5	172	154.6	0	0	112.2	S951 S970 F993 N994	S951-E991 VanDerWaalsContact CB-O 3.24Å; S951-E991 WeakPolarHBondContact CB-O 3.46Å; S951-E991 PolarHBondContact OG-O 3.01Å; S970-E991 WeakPolarHBondContact CB-OE2 3.36Å; S970-E991 PolarHBondContact OG-N 3.46Å; E991-F993 PolarHBondContact O-N 2.95Å; E991-N994 PolarHBondContact O-N 2.74Å; E991-N994 PolarHBondContact O-OD1 2.78Å
992	T	95.8	Very high	94.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-32	-179.6	-49.6	0	0	0	0	112.6	W950 S951 N954 F957 C969 C990	W950-T992 VanDerWaalsContact CD1-O 3.31Å; S951-T992 PolarHBondContact N-O 2.6Å; S951-T992 PolarHBondContact OG-O 3.33Å; N954-T992 PolarHBondContact ND2-N 3.38Å; N954-T992 PolarHBondContact ND2-OG1 2.59Å; N954-T992 WeakPolarHBondContact OD1-CB 3.48Å; N954-T992 WeakPolarHBondContact OD1-CG2 3.29Å; N954-T992 PolarHBondContact OD1-OG1 3.47Å; F957-T992 HydrophobicContact CD1-CG2 4.18Å; F957-T992 HydrophobicContact CE1-CG2 4.49Å; C969-T992 PolarHBondContact N-OG1 2.71Å; C969-T992 PolarHBondContact O-OG1 2.65Å; C990-T992 VanDerWaalsContact C-N 3.27Å; C990-T992 PolarHBondContact O-N 2.67Å
993	F	96.5	Very high	94.6	Very high	5 Å²	5	43.7 Å²	43.7	2%	0.022	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.7	1.2	-180	-56.7	-64.7	0	0	0	113.2	C839 V841 F948 T949 F957 I967 G968 A975 C990 E991 S995	C839-F993 HydrophobicContact CB-CE1 4.19Å; C839-F993 HydrophobicContact CB-CZ 4.33Å; C839-F993 WeakPolarHBondContact O-CE1 3.47Å; V841-F993 HydrophobicContact CB-CD2 4.43Å; V841-F993 HydrophobicContact CG1-CD2 3.7Å; V841-F993 HydrophobicContact CG1-CE2 3.65Å; V841-F993 HydrophobicContact CG1-CG 4.39Å; V841-F993 HydrophobicContact CG1-CZ 4.32Å; V841-F993 HydrophobicContact CG2-CB 3.97Å; V841-F993 HydrophobicContact CG2-CD2 3.9Å; V841-F993 HydrophobicContact CG2-CG 4.03Å; F948-F993 HydrophobicContact CB-CB 4.17Å; T949-F993 CarbonylContact O-C 3.33Å; T949-F993 WeakPolarHBondContact O-CA 3.25Å; F957-F993 HydrophobicContact CD1-CE1 4.07Å; F957-F993 HydrophobicContact CD1-CZ 4.25Å; I967-F993 HydrophobicContact CG2-CE2 4.15Å; I967-F993 HydrophobicContact CG2-CZ 4.4Å; G968-F993 VanDerWaalsContact CA-CE2 3.5Å; A975-F993 HydrophobicContact CB-CD2 4Å; A975-F993 HydrophobicContact CB-CE2 4.43Å; C990-F993 PolarHBondContact O-N 2.92Å; E991-F993 PolarHBondContact O-N 2.95Å; F993-S995 PolarHBondContact O-N 2.87Å; F993-S995 VanDerWaalsContact O-N 3.14Å
994	N	94.4	Very high	94.6	Very high	101 Å²	101	45.6 Å²	45.6	54%	0.54	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.8	37.4	-162.6	-71	-20.8	0	0	0	112.5	S951 C990 E991	S951-N994 WeakPolarHBondContact CB-ND2 3Å; C990-N994 WeakPolarHBondContact O-CA 3.46Å; C990-N994 PolarHBondContact O-N 3.14Å; E991-N994 PolarHBondContact O-N 2.74Å; E991-N994 PolarHBondContact O-OD1 2.78Å
995	S	94.3	Very high	94.6	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.021	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-86.2	133.3	179.5	57.4	0	0	0	0	110.1	N989 C990 F993	N989-S995 WeakPolarHBondContact CA-O 3.2Å; C990-S995 PolarHBondContact N-O 2.93Å; C990-S995 PolarHBondContact O-N 2.86Å; F993-S995 PolarHBondContact O-N 2.87Å; F993-S995 VanDerWaalsContact O-N 3.14Å
996	P	94	Very high	94.7	Very high	42 Å²	42	45.3 Å²	45.3	27%	0.273	25%	0.249	S	C	.	.			trans	-68.7	167.3	161.3	34.3	-35.5	0	0	0	110.1	F948 N989 L998	F948-P996 VanDerWaalsContact CE1-CD 3.41Å; F948-P996 HydrophobicContact CE1-CG 4.18Å; F948-P996 HydrophobicContact CZ-CG 3.93Å; N989-P996 VanDerWaalsContact OD1-CA 3.28Å; N989-P996 WeakPolarHBondContact OD1-CA 3.37Å; P996-L998 PolarHBondContact O-N 3.14Å; P996-L998 VanDerWaalsContact O-N 3.14Å
997	Q	94.6	Very high	94.7	Very high	47 Å²	47	43 Å²	43	22%	0.22	24%	0.239	C	C	.	.			trans	-36.5	119.8	160.8	-171	-167.5	-68.5	0	0	109.9	R843 S987 N989 T999 P1003	R843-Q997 PolarHBondContact NH1-O 2.92Å; S987-Q997 WeakPolarHBondContact O-CG 3.4Å; N989-Q997 PolarHBondContact OD1-N 2.68Å; Q997-T999 WeakPolarHBondContact CG-O 3.49Å; Q997-T999 PolarHBondContact NE2-O 3.44Å; Q997-P1003 HydrophobicContact CG-CB 4.25Å
998	L	94.4	Very high	94.6	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	26%	0.255	C	S	.	.	S	Bend	trans	-76.1	-40.8	-169.5	-64	176.9	0	0	0	111.5	F818 V841 R843 F948 I976 S987 P996	F818-L998 HydrophobicContact CB-CB 4.22Å; F818-L998 HydrophobicContact CD2-CB 4.15Å; F818-L998 HydrophobicContact CD2-CD1 4Å; F818-L998 HydrophobicContact CG-CB 4.09Å; V841-L998 HydrophobicContact CB-CD1 4.16Å; V841-L998 HydrophobicContact CG2-CD1 4.39Å; V841-L998 HydrophobicContact CG2-CD2 4.16Å; R843-L998 WeakPolarHBondContact CD-O 3.48Å; R843-L998 PolarHBondContact NH1-O 3.17Å; F948-L998 HydrophobicContact CD2-CD2 4.09Å; F948-L998 HydrophobicContact CE2-CD2 4.06Å; I976-L998 HydrophobicContact CD1-CD1 3.95Å; I976-L998 HydrophobicContact CG1-CD1 3.61Å; S987-L998 WeakPolarHBondContact OG-CB 3.41Å; S987-L998 PolarHBondContact OG-N 3.39Å; P996-L998 PolarHBondContact O-N 3.14Å; P996-L998 VanDerWaalsContact O-N 3.14Å
999	T	93	Very high	94.6	Very high	2 Å²	2	44 Å²	44	1%	0.012	25%	0.246	C	C	.	.			trans	-64.6	146.6	164.5	42	0	0	0	0	111.3	T812 F818 Q997 S1002 F1005	T812-T999 HydrophobicContact CG2-CG2 4.38Å; F818-T999 HydrophobicContact CD1-CG2 4.28Å; F818-T999 HydrophobicContact CE1-CG2 3.45Å; F818-T999 VanDerWaalsContact CE1-CG2 3.45Å; F818-T999 HydrophobicContact CZ-CG2 3.92Å; Q997-T999 WeakPolarHBondContact CG-O 3.49Å; Q997-T999 PolarHBondContact NE2-O 3.44Å; T999-S1002 WeakPolarHBondContact CB-O 3.34Å; T999-S1002 PolarHBondContact OG1-O 3.02Å; T999-F1005 HydrophobicContact CG2-CB 4.1Å; T999-F1005 HydrophobicContact CG2-CD1 3.91Å; T999-F1005 HydrophobicContact CG2-CG 4.21Å
1000	L	88.9	Confident	94.7	Very high	101 Å²	101	39.3 Å²	39.3	53%	0.529	22%	0.221	S	C	.	.	S	Bend	trans	-95.3	-29	170.4	-62.1	109	0	0	0	112.1	E816 I845	E816-L1000 PolarHBondContact OE1-N 3.05Å; I845-L1000 HydrophobicContact CD1-CD2 4.44Å; I845-L1000 HydrophobicContact CG1-CD1 4.29Å; I845-L1000 HydrophobicContact CG2-CD1 4.21Å; I845-L1000 HydrophobicContact CG2-CD2 4.09Å
1001	S	87.3	Confident	94.8	Very high	80 Å²	80	39.1 Å²	39.1	56%	0.559	22%	0.219	S	C	*	.	S	Bend	trans	-75.4	-40.5	-172.9	-53.6	0	0	0	0	114.4	E816	E816-S1001 PolarHBondContact OE1-N 3.33Å; E816-S1001 VanDerWaalsContact OE2-CB 3.25Å; E816-S1001 WeakPolarHBondContact OE2-CB 3.43Å; E816-S1001 PolarHBondContact OE2-OG 2.92Å
1002	S	92.4	Very high	94.8	Very high	49 Å²	49	35 Å²	35	34%	0.343	20%	0.201	S	C	.	.			trans	-171	146.3	-171.3	168.4	0	0	0	0	109	T999 D1004	T999-S1002 WeakPolarHBondContact CB-O 3.34Å; T999-S1002 PolarHBondContact OG1-O 3.02Å; S1002-D1004 VanDerWaalsContact C-N 3.33Å; S1002-D1004 VanDerWaalsContact CB-O 3.31Å; S1002-D1004 WeakPolarHBondContact CB-O 3.4Å; S1002-D1004 PolarHBondContact OG-N 3.36Å; S1002-D1004 PolarHBondContact OG-O 3.12Å
1003	P	94.9	Very high	94.7	Very high	41 Å²	41	35.1 Å²	35.1	27%	0.266	20%	0.201	S	C	.	.	S	Bend	trans	-64.3	-39.2	173.7	26.5	-33.8	0	0	0	111.6	H986 S987 Q997	H986-P1003 CarbonylContact C-O 3.58Å; H986-P1003 WeakPolarHBondContact CA-O 3.4Å; S987-P1003 PolarHBondContact N-O 3.27Å; S987-P1003 VanDerWaalsContact O-CA 3.24Å; S987-P1003 WeakPolarHBondContact O-CA 3.33Å; S987-P1003 WeakPolarHBondContact O-CB 3.43Å; Q997-P1003 HydrophobicContact CG-CB 4.25Å
1004	D	96.7	Very high	94.5	Very high	104 Å²	104	34.9 Å²	34.9	56%	0.556	20%	0.2	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	133.6	170.5	-61.8	-35.6	0	0	0	110.7	H986 S1002	H986-D1004 IonicContact CE1-OD1 3.71Å; H986-D1004 IonicContact CG-OD1 2.63Å; H986-D1004 IonicContact ND1-OD1 2.76Å; H986-D1004 PolarHBondContact ND1-OD1 3.4Å; S1002-D1004 VanDerWaalsContact C-N 3.33Å; S1002-D1004 VanDerWaalsContact CB-O 3.31Å; S1002-D1004 WeakPolarHBondContact CB-O 3.4Å; S1002-D1004 PolarHBondContact OG-N 3.36Å; S1002-D1004 PolarHBondContact OG-O 3.12Å
1005	F	96.8	Very high	94.2	Very high	15 Å²	15	30.1 Å²	30.1	7%	0.066	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	154.6	179.1	61.3	-95.2	0	0	0	113.1	I810 T812 F818 L978 G985 T999 I1007	I810-F1005 HydrophobicContact CG2-CE2 4.16Å; T812-F1005 HydrophobicContact CG2-CB 3.87Å; T812-F1005 HydrophobicContact CG2-CD2 3.88Å; T812-F1005 HydrophobicContact CG2-CG 4.02Å; F818-F1005 HydrophobicContact CE2-CE1 4.01Å; F818-F1005 HydrophobicContact CE2-CE2 4.29Å; F818-F1005 AromaticContact CE2-CZ 3.78Å; F818-F1005 HydrophobicContact CE2-CZ 3.78Å; F818-F1005 AromaticContact CZ-CD1 3.89Å; F818-F1005 HydrophobicContact CZ-CD1 3.89Å; F818-F1005 HydrophobicContact CZ-CD2 4.04Å; F818-F1005 AromaticContact CZ-CE1 3.6Å; F818-F1005 HydrophobicContact CZ-CE1 3.6Å; F818-F1005 AromaticContact CZ-CE2 3.76Å; F818-F1005 HydrophobicContact CZ-CE2 3.76Å; F818-F1005 HydrophobicContact CZ-CG 4.11Å; F818-F1005 AromaticContact CZ-CZ 3.53Å; F818-F1005 HydrophobicContact CZ-CZ 3.53Å; L978-F1005 HydrophobicContact CD2-CE2 4.28Å; L978-F1005 HydrophobicContact CD2-CZ 4.09Å; G985-F1005 VanDerWaalsContact CA-CZ 3.5Å; G985-F1005 PolarHBondContact N-O 3.22Å; G985-F1005 WeakPolarHBondContact O-CD1 3.24Å; G985-F1005 PolarHBondContact O-N 3.2Å; T999-F1005 HydrophobicContact CG2-CB 4.1Å; T999-F1005 HydrophobicContact CG2-CD1 3.91Å; T999-F1005 HydrophobicContact CG2-CG 4.21Å; F1005-I1007 HydrophobicContact CD2-CG1 4.01Å; F1005-I1007 HydrophobicContact CE2-CD1 4.22Å; F1005-I1007 HydrophobicContact CE2-CG1 3.73Å
1006	I	97.2	Very high	93.4	Very high	83 Å²	83	34.6 Å²	34.6	43%	0.426	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	128.4	172.8	-58.6	174.2	0	0	0	108.6	T812 S813 L983	T812-I1006 CarbonylContact C-O 3.52Å; T812-I1006 VanDerWaalsContact CA-O 3.24Å; T812-I1006 WeakPolarHBondContact CA-O 3.39Å; S813-I1006 PolarHBondContact N-O 3.42Å; L983-I1006 HydrophobicContact CD1-CG2 3.86Å; L983-I1006 HydrophobicContact CG-CG2 4.5Å; L983-I1006 CarbonylContact O-C 3.58Å; L983-I1006 WeakPolarHBondContact O-CA 3.37Å
1007	I	97.1	Very high	93.3	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.021	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	128.1	-179.7	-61.7	161.7	0	0	0	108.7	F761 I810 L978 L982 L983 F1005 L1010	F761-I1007 HydrophobicContact CE1-CG2 4.38Å; I810-I1007 HydrophobicContact CG2-CG1 4.16Å; I810-I1007 HydrophobicContact CG2-CG2 4.45Å; L978-I1007 HydrophobicContact CD2-CD1 3.9Å; L982-I1007 WeakPolarHBondContact O-CB 3.38Å; L982-I1007 WeakPolarHBondContact O-CD1 3.4Å; L983-I1007 PolarHBondContact O-N 3.33Å; F1005-I1007 HydrophobicContact CD2-CG1 4.01Å; F1005-I1007 HydrophobicContact CE2-CD1 4.22Å; F1005-I1007 HydrophobicContact CE2-CG1 3.73Å; I1007-L1010 HydrophobicContact CG2-CB 3.88Å
1008	T	95.9	Very high	93.3	Very high	54 Å²	54	33.5 Å²	33.5	33%	0.331	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-43.4	172.4	-62	0	0	0	0	111.1	R811 T812 S813	R811-T1008 PolarHBondContact O-N 3.47Å; T812-T1008 PolarHBondContact O-OG1 3.05Å; S813-T1008 VanDerWaalsContact CA-OG1 3.29Å; S813-T1008 WeakPolarHBondContact CA-OG1 3.31Å; S813-T1008 PolarHBondContact N-OG1 2.59Å
1009	T	96	Very high	93.2	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	139.1	171	-45.3	0	0	0	0	109.2	E727 I728 T756 R811 E1011	E727-T1009 HydrophobicContact CB-CG2 4.22Å; E727-T1009 PolarHBondContact OE2-OG1 2.84Å; I728-T1009 HydrophobicContact CD1-CG2 3.9Å; I728-T1009 HydrophobicContact CG1-CG2 4.02Å; T756-T1009 WeakPolarHBondContact OG1-CA 3.48Å; R811-T1009 PolarHBondContact N-O 3.13Å; R811-T1009 PolarHBondContact O-N 2.96Å; T1009-E1011 HydrophobicContact CG2-CG 4.28Å
1010	L	97.5	Very high	93.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	131	170	173.8	165	0	0	0	108.9	Y754 S755 T756 L766 L808 I809 I810 L978 L982 I1007	Y754-L1010 HydrophobicContact CD1-CD2 3.95Å; Y754-L1010 HydrophobicContact CE1-CD2 4.23Å; S755-L1010 CarbonylContact C-O 3.59Å; S755-L1010 WeakPolarHBondContact CA-O 3.39Å; T756-L1010 HydrophobicContact CG2-CB 3.86Å; T756-L1010 PolarHBondContact N-O 2.85Å; T756-L1010 PolarHBondContact OG1-N 3.35Å; L766-L1010 HydrophobicContact CD1-CD2 3.95Å; L808-L1010 HydrophobicContact CD1-CD1 4.05Å; L808-L1010 HydrophobicContact CD1-CD2 3.71Å; L808-L1010 HydrophobicContact CD1-CG 3.77Å; I809-L1010 WeakPolarHBondContact O-CA 3.47Å; I810-L1010 HydrophobicContact CG1-CD1 4.13Å; I810-L1010 HydrophobicContact CG1-CG 4.17Å; L978-L1010 HydrophobicContact CD1-CD1 3.68Å; L982-L1010 HydrophobicContact CD2-CD1 4.27Å; I1007-L1010 HydrophobicContact CG2-CB 3.88Å
1011	E	97.1	Very high	93.5	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	147.7	178.4	-59.2	178.3	176.5	0	0	111.4	S726 E727 I728 L752 Y754 I809 T1009 W1013	S726-E1011 WeakPolarHBondContact CB-OE2 3.47Å; S726-E1011 VanDerWaalsContact OG-CD 3.26Å; S726-E1011 PolarHBondContact OG-OE1 2.88Å; S726-E1011 PolarHBondContact OG-OE2 3.12Å; E727-E1011 PolarHBondContact N-OE1 3.21Å; I728-E1011 HydrophobicContact CD1-CB 4.46Å; I728-E1011 HydrophobicContact CD1-CG 3.92Å; I728-E1011 HydrophobicContact CG1-CG 4.46Å; L752-E1011 HydrophobicContact CD1-CB 3.96Å; L752-E1011 HydrophobicContact CD1-CG 4.15Å; Y754-E1011 CarbonylContact O-C 3.6Å; Y754-E1011 WeakPolarHBondContact O-CA 3.28Å; I809-E1011 HydrophobicContact CG2-CB 3.84Å; I809-E1011 PolarHBondContact N-O 3.27Å; I809-E1011 PolarHBondContact O-N 2.81Å; T1009-E1011 HydrophobicContact CG2-CG 4.28Å; E1011-W1013 PolarHBondContact OE2-NE1 3.46Å
1012	I	95.7	Very high	93.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	126.2	164.4	-67.5	168.3	0	0	0	109.2	T753 Y754 L766 C806 I807 L808 P826	T753-I1012 PolarHBondContact N-O 3.07Å; Y754-I1012 PolarHBondContact N-O 3.31Å; Y754-I1012 PolarHBondContact O-N 2.92Å; L766-I1012 HydrophobicContact CD1-CD1 3.75Å; L766-I1012 HydrophobicContact CD2-CD1 3.61Å; L766-I1012 HydrophobicContact CG-CD1 3.62Å; C806-I1012 HydrophobicContact CB-CG2 3.89Å; I807-I1012 CarbonylContact O-C 3.5Å; I807-I1012 VanDerWaalsContact O-CA 3.26Å; I807-I1012 WeakPolarHBondContact O-CA 3.14Å; L808-I1012 HydrophobicContact CB-CG1 4.41Å; L808-I1012 HydrophobicContact CD1-CD1 4.13Å; L808-I1012 HydrophobicContact CD1-CG1 3.62Å; P826-I1012 HydrophobicContact CG-CD1 4.18Å
1013	W	94.4	Very high	94	Very high	1 Å²	1	28.8 Å²	28.8	0%	0.004	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	121.2	176.2	-66.5	78.4	0	0	0	109.7	A722 T723 F729 W750 I751 L752 C806 I807 E1011	A722-W1013 HydrophobicContact CB-CZ3 4.22Å; A722-W1013 WeakPolarHBondContact O-CH2 3.46Å; T723-W1013 HydrophobicContact CG2-CZ3 4.28Å; F729-W1013 AromaticContact CD2-CE2 3.98Å; F729-W1013 HydrophobicContact CD2-CZ2 4.21Å; F729-W1013 AromaticContact CD2-NE1 3.88Å; F729-W1013 AromaticContact CE2-CD1 3.61Å; F729-W1013 HydrophobicContact CE2-CD2 4.1Å; F729-W1013 AromaticContact CE2-CE2 3.74Å; F729-W1013 HydrophobicContact CE2-CG 4.04Å; F729-W1013 HydrophobicContact CE2-CZ2 4.42Å; F729-W1013 AromaticContact CE2-NE1 3.39Å; W750-W1013 HydrophobicContact CB-CE3 4.09Å; W750-W1013 HydrophobicContact CE3-CE3 4.44Å; I751-W1013 CarbonylContact O-C 3.59Å; I751-W1013 VanDerWaalsContact O-CA 3.31Å; I751-W1013 WeakPolarHBondContact O-CA 3.45Å; L752-W1013 HydrophobicContact CB-CD2 4.36Å; L752-W1013 HydrophobicContact CB-CE3 4.14Å; L752-W1013 HydrophobicContact CB-CH2 3.8Å; L752-W1013 HydrophobicContact CB-CZ2 4.02Å; L752-W1013 HydrophobicContact CB-CZ3 3.88Å; L752-W1013 HydrophobicContact CD1-CD2 4.17Å; L752-W1013 HydrophobicContact CD1-CH2 4.37Å; L752-W1013 HydrophobicContact CD1-CZ2 3.7Å; L752-W1013 HydrophobicContact CD2-CZ2 4.31Å; L752-W1013 HydrophobicContact CG-CH2 4.45Å; L752-W1013 HydrophobicContact CG-CZ2 4.22Å; C806-W1013 CarbonylContact C-O 3.51Å; C806-W1013 WeakPolarHBondContact CA-O 3.24Å; C806-W1013 WeakPolarHBondContact CB-O 3.42Å; I807-W1013 HydrophobicContact CB-CB 4.39Å; I807-W1013 PolarHBondContact N-O 2.76Å; I807-W1013 PolarHBondContact O-N 2.83Å; E1011-W1013 PolarHBondContact OE2-NE1 3.46Å
1014	S	91.9	Very high	93.9	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.007	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	160.1	169.7	-61.9	0	0	0	0	110.7	I751 T753 H825	I751-S1014 PolarHBondContact N-O 2.7Å; I751-S1014 PolarHBondContact O-N 2.81Å; T753-S1014 WeakPolarHBondContact CB-OG 3.32Å; T753-S1014 WeakPolarHBondContact OG1-CB 3.29Å; T753-S1014 PolarHBondContact OG1-OG 2.91Å; H825-S1014 PolarHBondContact CE1-OG 3.02Å; H825-S1014 PolarHBondContact NE2-OG 2.75Å
1015	F	88.9	Confident	93.7	Very high	1 Å²	1	21.5 Å²	21.5	0%	0.004	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136.6	163.7	-57.3	-88.2	0	0	0	108.8	L741 A745 L748 D749 W750 P805 I807 M821	L741-F1015 HydrophobicContact CD1-CE1 4.25Å; L741-F1015 HydrophobicContact CD2-CE1 3.98Å; L741-F1015 HydrophobicContact CD2-CZ 3.69Å; A745-F1015 HydrophobicContact CB-CD1 3.86Å; A745-F1015 HydrophobicContact CB-CD2 3.71Å; A745-F1015 HydrophobicContact CB-CE1 3.88Å; A745-F1015 HydrophobicContact CB-CE2 3.76Å; A745-F1015 HydrophobicContact CB-CG 3.77Å; A745-F1015 HydrophobicContact CB-CZ 3.84Å; L748-F1015 HydrophobicContact CB-CB 3.79Å; L748-F1015 HydrophobicContact CB-CD1 4.37Å; L748-F1015 HydrophobicContact CD1-CB 3.77Å; L748-F1015 HydrophobicContact CG-CB 4.44Å; D749-F1015 WeakPolarHBondContact O-CA 3.4Å; W750-F1015 AromaticContact CD1-CD1 3.95Å; W750-F1015 AromaticContact CD1-CE1 3.78Å; W750-F1015 HydrophobicContact CD2-CE1 4.14Å; W750-F1015 AromaticContact CE2-CE1 3.71Å; W750-F1015 HydrophobicContact CG-CD1 4.5Å; W750-F1015 HydrophobicContact CG-CE1 4.22Å; W750-F1015 HydrophobicContact CZ2-CE1 4.25Å; W750-F1015 AromaticContact NE1-CE1 3.46Å; P805-F1015 HydrophobicContact CB-CD2 3.97Å; P805-F1015 HydrophobicContact CB-CE2 4.38Å; P805-F1015 HydrophobicContact CG-CB 4.31Å; P805-F1015 HydrophobicContact CG-CD2 3.84Å; P805-F1015 HydrophobicContact CG-CG 4.39Å; P805-F1015 WeakPolarHBondContact O-CD2 3.42Å; I807-F1015 HydrophobicContact CD1-CE1 4.5Å; I807-F1015 HydrophobicContact CD1-CE2 4.24Å; I807-F1015 HydrophobicContact CD1-CZ 3.58Å; I807-F1015 HydrophobicContact CG1-CE2 4.08Å; I807-F1015 HydrophobicContact CG1-CZ 3.9Å; M821-F1015 HydrophobicContact CE-CE2 4.04Å; M821-F1015 HydrophobicContact CE-CZ 3.95Å; M821-F1015 HydrophobicContact SD-CE2 3.99Å; M821-F1015 HydrophobicContact SD-CZ 4.49Å
1016	I	75.8	Confident	93.4	Very high	96 Å²	96	22.1 Å²	22.1	49%	0.492	12%	0.118	S	C	.	.			trans	-137.6	0	176.8	-59.4	-165.9	0	0	0	109.6	D749 I751	D749-I1016 PolarHBondContact N-O 3.14Å; D749-I1016 PolarHBondContact O-N 3.02Å; D749-I1016 VanDerWaalsContact O-N 3.14Å; I751-I1016 HydrophobicContact CD1-CB 3.96Å; I751-I1016 HydrophobicContact CD1-CD1 3.89Å; I751-I1016 HydrophobicContact CD1-CG1 4.03Å

Retrieved 1,016 of 1,016 residues in 975.9 ms (Link to these results)

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