A0A087YIA8_POEFO Loading...

Euchromatic histone-lysine N-methyltransferase 1b

AlphaFold DB , UniProt , Accession A0A087YIA8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,279 aa.

						>A0A087YIA8_POEFO|A0A087YIA8
FLLLLLQPAGLAVDNVAPPKKEGLDPPKHGEEKSGEDTDVASAAGRSSPAAAEAIMLNGTDSDDGSRHADLTVSGIKAALNENGTAETETPHGSVTGSNGFILAKEQQQDGGDAAAPASGVSSPLRTSRLPSGSPPGGQTAKPLGASAAAGCAQSSGALRTAPGTGSMSDTKNGFASSPVTIPPSVTVHRARKTMSRPAVSPAQKLINKELRQANSVKSESPVAPDVEKSSPPPPPNHLPQSPPETPASAHTASPAAPTEPAAPADSPADSAAAAKHRLGPYSTVFSSRKKKRRMGTYSLVPKKKTKVLKQRTMLEMFKELQQSAKTQQKREAATVNGEKVVNASEEDESEDMESEEEMRRQPAEQTLPAVQETSESADQKVKDEHESEDSEEDEGEEEEGTESDLSFESSLKKKLKKKSKADGAWLRPSRKRKRRMGAREPETDVLPQTSGQEYTEILPSECIDLSKSSHSNEPSGSAIEEAQELPLCSCRMETPKSREILILADRKCMATESVDGQLTRCQGAVLKHEMMRPSNSVQLLVLCEDHRSGMVKHQCCPGCGFFCRAGTFMECQPDVSISHRFHQACASMLKGQSFCPHCGEEAAKAKEVTIAKADTTSTVPPAQAKGPATPGAPEGRADTTTGSSSCLSPVAEVSGRADSSLSVHPALDPDDPAVPGSSRQATLQPGIGTIAPPMLPLGTTKETLESVLVALDTEKPKKLRFHPKQLFLSAKQGELKKVVLMLVDGTDPNFKMDSQNKRTPLHAAAEGGYADICHMLVQAGANLDMCDEDQRTPLMEACENNHMEVVLYLLRAGASAMHKDVEGFTCLHLAAKSGHYSVVEHLLTTGLVDVNCQDDGGWTAMIWATEYKHVDQVKLLLSKGADISIRDKEKNICLHWAAFSGSVEISEVLLNAQCDLQAVNVHGDSPLHIAARENRLDCVKLFLSRGANVFLKNREGETPPDCCSHNSKAWGALHAHKRERDAKNGRLRRTEEKLLHSDISLGQEQVSIPCVNSVDSEPIPDDYKYITENCVTSPMNIDRNITHLQYCVCKEDCSTSICMCGQLSLRRWYDKSGCLLPEFCREEPPLIFECNHACSCWRTCKNRVVQNGLRVRLQVFRTGNKGWGVRTLQDIPQGSFVCEYVGEIISEGEADTRQNDAYLFSLDDKPEDQYCIDARFYGNISRFLNHMCEPNLFACRVFTTHQDLRFPHIAFFASENVKAGEELGFNYGDHFWEVKAKLFSCECGSSKCKYSSVAMATTPEDQQQPSALPDTSSSSGAS
					

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Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	F	28.2	Very low	28.9	Very low	230 Å²	230	142.3 Å²	142.3	100%	1.009	79%	0.792	S	S	*	*				0	121	0	-81.5	-95.3	0	0	0	108.1
2	L	23	Very low	28.6	Very low	123 Å²	123	137.7 Å²	137.7	64%	0.644	79%	0.786	S	S	*	*				61.9	131.3	55	-70.8	81	0	0	0	110.8	R492	L2-R492 PolarHBondContact O-NH2 3.05Å
3	L	30.6	Very low	28.6	Very low	127 Å²	127	136.9 Å²	136.9	67%	0.665	79%	0.785	S	S	*	*			cis	-162.6	162	1.5	-130.9	-177	0	0	0	109.4
4	L	33.7	Very low	28.4	Very low	140 Å²	140	138.6 Å²	138.6	73%	0.733	79%	0.79	S	S	*	*			trans	68	150.4	168.6	-48.4	172.7	0	0	0	116
5	L	35.7	Very low	28.4	Very low	139 Å²	139	139.1 Å²	139.1	73%	0.728	79%	0.79	S	S	*	*			cis	-164.4	159.1	-19.3	-116.9	176.5	0	0	0	109.4
6	L	27.9	Very low	28.3	Very low	156 Å²	156	139.4 Å²	139.4	82%	0.817	80%	0.795	S	S	*	*			trans	144.3	140.1	133	-78.9	173.6	0	0	0	113.3
7	Q	28.4	Very low	28.3	Very low	183 Å²	183	136.2 Å²	136.2	86%	0.855	79%	0.789	S	S	*	*			trans	-84	157.5	160.1	-61.9	168.9	-79.5	0	0	109.8
8	P	30.5	Very low	29	Very low	123 Å²	123	135.8 Å²	135.8	80%	0.799	79%	0.792	S	S	*	*			trans	-106.1	165.7	138	35	-30.7	0	0	0	111.3
9	A	26.3	Very low	29.2	Very low	102 Å²	102	134.5 Å²	134.5	84%	0.843	79%	0.789	S	S	*	*			trans	-71.8	152.9	174	0	0	0	0	0	112.1
10	G	27.1	Very low	29.2	Very low	70 Å²	70	137.1 Å²	137.1	72%	0.722	79%	0.789	S	S	*	*			trans	-101	-171.9	167	0	0	0	0	0	112
11	L	26.8	Very low	29.2	Very low	172 Å²	172	139.5 Å²	139.5	90%	0.901	79%	0.791	S	S	*	*			trans	-167.8	175.3	161.9	-113.9	172.5	0	0	0	111.5
12	A	25.2	Very low	29.2	Very low	87 Å²	87	136.6 Å²	136.6	72%	0.719	78%	0.78	S	S	*	*			trans	68.1	98.1	169.9	0	0	0	0	0	117.7
13	V	28.4	Very low	29.4	Very low	128 Å²	128	134.2 Å²	134.2	78%	0.776	79%	0.785	S	S	*	*			trans	-88.2	138.4	145.7	173.1	0	0	0	0	107.2
14	D	26.2	Very low	29.4	Very low	160 Å²	160	136.7 Å²	136.7	86%	0.856	80%	0.799	S	S	*	*			trans	-114	139.4	164.5	-111.1	-42	0	0	0	110.1
15	N	28.7	Very low	29.2	Very low	146 Å²	146	137.2 Å²	137.2	78%	0.781	80%	0.802	S	S	*	*			trans	-96.4	133.4	-174.1	-74.2	-66	0	0	0	111.9
16	V	26.1	Very low	30	Very low	145 Å²	145	136 Å²	136	88%	0.879	80%	0.803	S	S	*	*			trans	-137.1	128.8	158.9	-176.1	0	0	0	0	109.7
17	A	28.6	Very low	31	Very low	84 Å²	84	133.8 Å²	133.8	69%	0.694	80%	0.798	S	S	*	*			trans	-82.4	157.2	178.5	0	0	0	0	0	112.2
18	P	40.1	Very low	31.1	Very low	129 Å²	129	134.5 Å²	134.5	84%	0.838	80%	0.798	S	S	*	*			trans	-85.4	152.2	-168.7	33.9	-36.6	0	0	0	114.3
19	P	33.8	Very low	31.3	Very low	112 Å²	112	138.3 Å²	138.3	73%	0.727	81%	0.805	S	S	*	*			trans	-129.6	131.2	153.7	35.5	-22.6	0	0	0	114.5
20	K	28.5	Very low	31.4	Very low	185 Å²	185	136.8 Å²	136.8	80%	0.804	80%	0.799	S	S	*	*			trans	48	124.2	141.6	-57.6	-177.2	178.5	-175.1	0	121.2
21	K	29.6	Very low	31.7	Very low	188 Å²	188	142.1 Å²	142.1	82%	0.817	81%	0.805	S	S	*	*				-160.3	128.6	126.4	-102.4	151.1	-174.9	179.9	0	107
22	E	28	Very low	31.9	Very low	169 Å²	169	140.8 Å²	140.8	79%	0.79	79%	0.794	S	S	*	*				59.1	99.8	60.9	-62.3	-178.3	160.3	0	0	110.8
23	G	27.3	Very low	32.2	Very low	73 Å²	73	144 Å²	144	75%	0.753	79%	0.792	S	S	*	*			trans	-94.2	-161	-177.4	0	0	0	0	0	113.1
24	L	30	Very low	32.3	Very low	180 Å²	180	143.8 Å²	143.8	94%	0.942	80%	0.796	S	S	*	*			trans	-167.2	130	159.8	-105.7	159	0	0	0	110.8
25	D	30.9	Very low	32.4	Very low	150 Å²	150	139.4 Å²	139.4	80%	0.802	79%	0.789	S	S	*	*			trans	-63.6	170.7	160.8	-87.9	-52.4	0	0	0	111.2
26	P	50.8	Low	32.5	Very low	115 Å²	115	141.6 Å²	141.6	75%	0.747	79%	0.794	S	S	*	*			cis	-153.2	-147.2	38.8	43.4	-19.6	0	0	0	114.6
27	P	48.9	Very low	32.8	Very low	109 Å²	109	141.5 Å²	141.5	71%	0.708	79%	0.789	S	S	*	*			cis	-113.7	150.4	-44.2	18.8	2.3	0	0	0	112
28	K	32.4	Very low	33.1	Very low	197 Å²	197	143.4 Å²	143.4	86%	0.857	79%	0.792	S	S	*	*				60.8	104.1	72.5	-77.5	-163.5	176.2	-172	0	118.6
29	H	32.9	Very low	32.6	Very low	204 Å²	204	144 Å²	144	94%	0.944	79%	0.788	S	S	*	*			trans	-167.4	142.3	133.8	-87.7	-76.2	0	0	0	105.5
30	G	29.6	Very low	32.4	Very low	70 Å²	70	144.1 Å²	144.1	72%	0.722	79%	0.787	S	S	*	*			cis	120.3	131.9	8.7	0	0	0	0	0	110
31	E	32	Very low	32.4	Very low	182 Å²	182	140.1 Å²	140.1	85%	0.85	79%	0.789	S	S	*	*			cis	-168.5	168.1	-2.8	-160.4	160.8	-149	0	0	109.6
32	E	31.4	Very low	32.4	Very low	143 Å²	143	136.5 Å²	136.5	67%	0.668	79%	0.787	S	S	*	*			trans	70.2	152.1	168.9	-52.9	-153.1	138.7	0	0	118.7
33	K	31.8	Very low	32.4	Very low	154 Å²	154	132.8 Å²	132.8	67%	0.67	79%	0.785	S	S	*	*			cis	-163.5	152.9	-5	-122.7	169.1	-168.5	146	0	112.5
34	S	30.7	Very low	32.5	Very low	124 Å²	124	134.6 Å²	134.6	87%	0.867	79%	0.793	S	S	*	*			trans	54.8	149.6	155.4	52.2	0	0	0	0	121
35	G	28.5	Very low	32.4	Very low	69 Å²	69	129.2 Å²	129.2	71%	0.711	78%	0.781	S	S	*	*			cis	169.9	174.7	-3.4	0	0	0	0	0	113.1
36	E	30.6	Very low	32.3	Very low	191 Å²	191	133.9 Å²	133.9	89%	0.893	79%	0.787	S	S	*	*			trans	67.6	102.1	162.1	-62.1	-179.3	130.6	0	0	121.6
37	D	32.7	Very low	31.2	Very low	144 Å²	144	133.8 Å²	133.8	77%	0.77	79%	0.789	S	S	*	*				17.7	135.8	128.1	-63.2	-34.5	0	0	0	123.9
38	T	34.3	Very low	30.3	Very low	123 Å²	123	134 Å²	134	76%	0.755	79%	0.793	S	S	*	*			trans	40.2	146.5	130.6	76.9	0	0	0	0	121.6
39	D	30.3	Very low	31.3	Very low	141 Å²	141	130.7 Å²	130.7	75%	0.754	79%	0.792	S	S	*	*			cis	-166.3	178.6	8.6	-140.4	-33	0	0	0	112.8
40	V	30.1	Very low	31.3	Very low	115 Å²	115	125.3 Å²	125.3	70%	0.697	78%	0.782	S	S	*	*			trans	50.9	121.2	152.4	175.8	0	0	0	0	120.5
41	A	28.1	Very low	31.4	Very low	102 Å²	102	126.7 Å²	126.7	84%	0.843	79%	0.787	S	S	*	*			trans	-165.6	96.8	134.9	0	0	0	0	0	115.7
42	S	28.5	Very low	31.4	Very low	111 Å²	111	122.7 Å²	122.7	78%	0.776	79%	0.785	S	S	*	*			trans	-31.4	150.8	159.9	-48.8	0	0	0	0	121.7
43	A	29.4	Very low	31.2	Very low	92 Å²	92	125.3 Å²	125.3	76%	0.76	80%	0.797	S	S	*	*			trans	76.5	104.2	131.3	0	0	0	0	0	123.5
44	A	29.1	Very low	31.2	Very low	111 Å²	111	122.3 Å²	122.3	92%	0.917	80%	0.802	S	S	*	*				44.4	134	117.5	0	0	0	0	0	123
45	G	27.7	Very low	31.2	Very low	66 Å²	66	124 Å²	124	68%	0.68	80%	0.799	S	S	*	*			trans	-179.8	109.6	155.9	0	0	0	0	0	119.5
46	R	28.9	Very low	31.3	Very low	249 Å²	249	127.9 Å²	127.9	94%	0.94	80%	0.801	S	S	*	*			trans	72.4	154	144.2	-60.1	175.7	-174.2	-144	-1.8	117.5
47	S	28	Very low	31.4	Very low	112 Å²	112	124.6 Å²	124.6	78%	0.783	79%	0.789	S	S	*	*			cis	-162.3	157.1	-4.9	33.4	0	0	0	0	112.9
48	S	29	Very low	31.2	Very low	113 Å²	113	124.6 Å²	124.6	79%	0.79	79%	0.789	S	S	*	*			trans	-68.8	165.9	166.8	-27.8	0	0	0	0	112.8
49	P	53.9	Low	31	Very low	128 Å²	128	121.7 Å²	121.7	83%	0.831	78%	0.783	S	S	*	*				-147.9	-163.5	69.7	36.6	-14.6	0	0	0	114.2
50	A	31.8	Very low	31.1	Very low	91 Å²	91	120.9 Å²	120.9	75%	0.752	78%	0.783	S	S	*	*				-168	162.2	-54.8	0	0	0	0	0	112.1
51	A	32.5	Very low	31.1	Very low	99 Å²	99	122.3 Å²	122.3	82%	0.818	79%	0.787	S	S	*	*			trans	81.6	138.5	151.1	0	0	0	0	0	124.1
52	A	32.2	Very low	31.3	Very low	99 Å²	99	121.3 Å²	121.3	82%	0.818	77%	0.774	S	S	*	*			trans	70.5	151.7	151.5	0	0	0	0	0	119.7
53	E	27	Very low	31.5	Very low	197 Å²	197	123.3 Å²	123.3	92%	0.921	78%	0.776	S	S	*	*			cis	-124.6	-177.2	4.8	-77.7	-170.4	121.2	0	0	113.4
54	A	32.8	Very low	31.5	Very low	92 Å²	92	126.7 Å²	126.7	76%	0.76	78%	0.781	S	S	*	*			trans	-146.6	163.5	-179.8	0	0	0	0	0	112.3
55	I	30.1	Very low	31.5	Very low	159 Å²	159	124.5 Å²	124.5	82%	0.815	77%	0.769	S	S	*	*			trans	-173.6	118.2	159.6	-102.1	147.9	0	0	0	108.1
56	M	30	Very low	31.6	Very low	150 Å²	150	126.2 Å²	126.2	74%	0.739	77%	0.771	S	S	*	*				81.3	132.7	69	-67.3	-83.6	-93.3	0	0	111.8
57	L	33.8	Very low	31.8	Very low	122 Å²	122	124.3 Å²	124.3	64%	0.639	76%	0.764	S	S	*	*			cis	-161.2	162	12.6	-102	157.4	0	0	0	113.7
58	N	28.1	Very low	32.2	Very low	145 Å²	145	126.7 Å²	126.7	78%	0.775	76%	0.762	S	S	*	*			trans	60.2	147.5	151.8	-64.5	-10.2	0	0	0	123
59	G	29.2	Very low	32.2	Very low	61 Å²	61	125.1 Å²	125.1	63%	0.629	76%	0.756	S	S	*	*			cis	132.4	162.5	-10.6	0	0	0	0	0	116.2
60	T	32	Very low	31.1	Very low	124 Å²	124	125.8 Å²	125.8	76%	0.761	75%	0.753	S	S	*	*			trans	74.6	143.8	174.6	71.6	0	0	0	0	118.7
61	D	31.4	Very low	31	Very low	146 Å²	146	128 Å²	128	78%	0.781	75%	0.751	S	S	*	*			cis	-168.3	164.6	-13.3	-95.4	-15.7	0	0	0	107.6
62	S	32.7	Very low	30.7	Very low	81 Å²	81	129.2 Å²	129.2	57%	0.566	75%	0.748	S	S	*	*			cis	-168.2	164.8	-21.9	-172.6	0	0	0	0	109.2
63	D	31.6	Very low	30.5	Very low	152 Å²	152	131.1 Å²	131.1	81%	0.813	75%	0.749	S	S	*	*			trans	64.8	147.7	161.9	-56.2	-55.6	0	0	0	119.9
64	D	30.6	Very low	30.5	Very low	164 Å²	164	127.7 Å²	127.7	88%	0.877	75%	0.747	S	S	*	*			cis	-134.4	172.4	27.8	-161.9	-4.4	0	0	0	113.5
65	G	28.8	Very low	30.2	Very low	65 Å²	65	126 Å²	126	67%	0.67	74%	0.739	S	S	*	*			trans	-102.3	-155.8	-170.6	0	0	0	0	0	116.5
66	S	30.1	Very low	30.1	Very low	102 Å²	102	126.7 Å²	126.7	71%	0.713	74%	0.743	S	S	*	*			cis	-163.8	128.8	-3.5	-170.3	0	0	0	0	112
67	R	32.8	Very low	29.9	Very low	209 Å²	209	129.6 Å²	129.6	79%	0.789	75%	0.751	S	S	*	*			trans	44.8	144.5	137.8	-57.2	-172.9	163.5	144.3	3.7	121.3
68	H	35.9	Very low	29.5	Very low	162 Å²	162	128.6 Å²	128.6	75%	0.75	76%	0.761	S	S	*	*			cis	-163.4	-165.9	-9.8	-92.1	-41.8	0	0	0	105.5
69	A	29.8	Very low	29.4	Very low	79 Å²	79	125.8 Å²	125.8	65%	0.653	76%	0.757	S	S	*	*			cis	-159.2	164.4	11	0	0	0	0	0	112.2
70	D	30.6	Very low	29.3	Very low	143 Å²	143	131.2 Å²	131.2	77%	0.765	77%	0.771	S	S	*	*				33.6	141.5	128.4	-63.9	12.1	0	0	0	121.9
71	L	30.1	Very low	29	Very low	138 Å²	138	132.5 Å²	132.5	72%	0.723	77%	0.773	S	S	*	*			cis	-161.2	-177.2	10.5	-124.6	169.9	0	0	0	112.7
72	T	25.8	Very low	28.6	Very low	123 Å²	123	134.6 Å²	134.6	76%	0.755	78%	0.779	S	S	*	*			trans	93.4	85.4	167.3	66.6	0	0	0	0	120.6
73	V	28	Very low	28.3	Very low	139 Å²	139	137.7 Å²	137.7	84%	0.842	79%	0.788	S	S	*	*				37	112.8	118	-175.7	0	0	0	0	118.9
74	S	27.1	Very low	28	Very low	125 Å²	125	134.4 Å²	134.4	87%	0.874	79%	0.791	S	S	*	*				-164.1	145.1	112.9	-170.3	0	0	0	0	111.4
75	G	25	Very low	27.7	Very low	58 Å²	58	132.2 Å²	132.2	60%	0.598	78%	0.783	S	S	*	*			trans	-164.1	147.3	171.2	0	0	0	0	0	111
76	I	28.5	Very low	27.7	Very low	172 Å²	172	132.9 Å²	132.9	88%	0.882	78%	0.783	S	S	*	*			trans	166.6	119.6	154.3	-89	151.5	0	0	0	107.1
77	K	25.4	Very low	27.5	Very low	211 Å²	211	133.5 Å²	133.5	92%	0.917	77%	0.774	S	S	*	*			trans	-158.8	102.5	149.3	-114.2	173.2	-176.4	178.3	0	107.7
78	A	25.6	Very low	27.5	Very low	102 Å²	102	127.9 Å²	127.9	84%	0.843	76%	0.763	S	S	*	*			trans	-74	148.7	175.8	0	0	0	0	0	110.2
79	A	27.7	Very low	26.9	Very low	85 Å²	85	126.6 Å²	126.6	70%	0.702	76%	0.758	S	S	*	*			trans	-84.2	146.3	-179.6	0	0	0	0	0	112
80	L	25.3	Very low	26.9	Very low	175 Å²	175	126.5 Å²	126.5	92%	0.916	75%	0.749	S	S	*	*			trans	-117.1	119.3	157.5	-78.9	168.6	0	0	0	107.1
81	N	25.6	Very low	28	Very low	152 Å²	152	123.4 Å²	123.4	81%	0.813	74%	0.737	S	S	*	*			trans	-90.5	116.1	174.6	-74.5	-10.3	0	0	0	109
82	E	24.7	Very low	28.3	Very low	190 Å²	190	125 Å²	125	89%	0.888	74%	0.74	S	S	*	*			trans	-82.7	133.7	153.3	-68.2	-168.8	124.2	0	0	108.8
83	N	25.9	Very low	28.4	Very low	145 Å²	145	122.3 Å²	122.3	78%	0.775	74%	0.737	S	S	*	*			trans	-150.4	68.2	170.1	-130.8	-3.5	0	0	0	110.1	T85	N83-T85 PolarHBondContact O-N 3.07Å; N83-T85 VanDerWaalsContact O-N 3.1Å
84	G	25.6	Very low	28.5	Very low	84 Å²	84	121.6 Å²	121.6	87%	0.866	74%	0.738	S	S	*	*			trans	-73.4	92.2	167.8	0	0	0	0	0	109.8
85	T	23.8	Very low	28.6	Very low	117 Å²	117	121.7 Å²	121.7	72%	0.718	73%	0.733	S	S	*	*			trans	-71.3	138.2	171	49.5	0	0	0	0	110.3	N83	N83-T85 PolarHBondContact O-N 3.07Å; N83-T85 VanDerWaalsContact O-N 3.1Å
86	A	29	Very low	28.7	Very low	79 Å²	79	125.4 Å²	125.4	65%	0.653	74%	0.744	S	S	*	*			trans	-62.8	-177.4	153.5	0	0	0	0	0	109.6
87	E	25.9	Very low	28.7	Very low	116 Å²	116	120.2 Å²	120.2	54%	0.542	73%	0.733	S	S	.	*				-146.3	142.5	80.7	-92.8	171.7	-170.6	0	0	111.6	K984	E87-K984 IonicContact OE1-NZ 3.15Å; E87-K984 PolarHBondContact OE1-NZ 3.41Å; E87-K984 IonicContact OE2-NZ 2.69Å
88	T	32.1	Very low	28.8	Very low	90 Å²	90	116.2 Å²	116.2	55%	0.552	73%	0.732	S	S	*	*			trans	-64.6	140.2	152.7	49	0	0	0	0	109.5
89	E	24.3	Very low	28.8	Very low	136 Å²	136	119.5 Å²	119.5	64%	0.636	74%	0.735	S	S	*	*			trans	-113.1	153	156.7	-95.8	-76.8	96.2	0	0	110.1
90	T	28.4	Very low	28.7	Very low	77 Å²	77	118.7 Å²	118.7	47%	0.472	74%	0.735	S	S	.	*			trans	-137	-143.6	-163.3	47.5	0	0	0	0	111.6
91	P	55.1	Low	28.7	Very low	77 Å²	77	119.7 Å²	119.7	50%	0.5	73%	0.732	S	S	.	*				-136.6	174.9	-96.4	42.4	-26.1	0	0	0	118.1
92	H	34.6	Very low	28.8	Very low	172 Å²	172	119.6 Å²	119.6	80%	0.796	73%	0.73	S	S	*	*			trans	71.9	152.3	158.4	-46.6	-44.1	0	0	0	118.8
93	G	29.2	Very low	28.8	Very low	67 Å²	67	118 Å²	118	69%	0.691	73%	0.727	S	S	*	*			cis	156.9	148	-14	0	0	0	0	0	116.3
94	S	29.3	Very low	28.7	Very low	124 Å²	124	115.5 Å²	115.5	87%	0.867	73%	0.727	S	S	*	*			trans	75	172.2	173	-140.9	0	0	0	0	114.9
95	V	28.8	Very low	28.7	Very low	127 Å²	127	120.2 Å²	120.2	77%	0.77	72%	0.723	S	S	*	*			cis	-143.6	167.6	20.9	-176.1	0	0	0	0	112.4
96	T	28.6	Very low	28.8	Very low	135 Å²	135	121.9 Å²	121.9	83%	0.828	72%	0.723	S	S	*	*			trans	-64.8	163.1	173	54.6	0	0	0	0	115.6
97	G	27.7	Very low	28.8	Very low	63 Å²	63	127 Å²	127	65%	0.649	73%	0.733	S	S	*	*			cis	151.7	175.8	-2.1	0	0	0	0	0	113.8
98	S	28.5	Very low	28.9	Very low	127 Å²	127	130 Å²	130	89%	0.888	75%	0.748	S	S	*	*			trans	68.2	143.8	173	74.2	0	0	0	0	119.6
99	N	25.3	Very low	28.8	Very low	172 Å²	172	134.5 Å²	134.5	92%	0.92	76%	0.762	S	S	*	*			trans	-157.4	141.1	163.1	-131.8	-23.3	0	0	0	111.2
100	G	25.8	Very low	29	Very low	67 Å²	67	135.5 Å²	135.5	69%	0.691	77%	0.772	S	S	*	*			trans	178.6	124.6	-178.1	0	0	0	0	0	112.3
101	F	25	Very low	28.9	Very low	197 Å²	197	135.6 Å²	135.6	86%	0.864	79%	0.788	S	S	*	*			trans	-78.2	156.3	-168.7	-80.6	-112.3	0	0	0	114.5
102	I	27.1	Very low	27.6	Very low	149 Å²	149	135.2 Å²	135.2	76%	0.764	80%	0.798	S	S	*	*				177.3	128.6	103.7	-94.4	-177.1	0	0	0	115.6
103	L	23.9	Very low	27.3	Very low	156 Å²	156	135.1 Å²	135.1	82%	0.817	80%	0.804	S	S	*	*			trans	54.6	136.1	149.6	-66.6	174.1	0	0	0	127
104	A	25.7	Very low	27.4	Very low	94 Å²	94	136.3 Å²	136.3	78%	0.777	81%	0.807	S	S	*	*			trans	69.7	147.8	146.3	0	0	0	0	0	119.4
105	K	25.2	Very low	27.4	Very low	182 Å²	182	135.6 Å²	135.6	79%	0.791	81%	0.808	S	S	*	*			cis	-152.8	-175.9	27.2	-165.6	168.5	173.7	-178.2	0	113.3
106	E	26	Very low	27.5	Very low	152 Å²	152	134 Å²	134	71%	0.71	81%	0.808	S	S	*	*			trans	-59.1	179.7	-172.9	-58	152.4	87.6	0	0	119.6
107	Q	28.6	Very low	28.5	Very low	186 Å²	186	133.6 Å²	133.6	87%	0.869	81%	0.808	S	S	*	*			trans	91.5	120.2	171	-55.9	-176.5	-45.6	0	0	115.2
108	Q	28.4	Very low	28.8	Very low	181 Å²	181	135 Å²	135	85%	0.846	81%	0.814	S	S	*	*			cis	89.4	88.1	24.1	-165.5	-172.6	6.7	0	0	115.4
109	Q	29.3	Very low	28.9	Very low	183 Å²	183	134.9 Å²	134.9	86%	0.855	81%	0.813	S	S	*	*			trans	-172	167	137.5	-110	168.4	-8	0	0	114.1
110	D	27.9	Very low	29.1	Very low	158 Å²	158	129.8 Å²	129.8	85%	0.845	80%	0.801	S	S	*	*			trans	-64.4	168.1	-177.1	-46	-91.6	0	0	0	114.3
111	G	27.5	Very low	29.4	Very low	78 Å²	78	133 Å²	133	80%	0.804	81%	0.807	S	S	*	*			cis	157.9	175.2	-2.3	0	0	0	0	0	111.8
112	G	27.4	Very low	29.6	Very low	70 Å²	70	128.7 Å²	128.7	72%	0.722	80%	0.801	S	S	*	*			trans	115.2	117.9	163.8	0	0	0	0	0	118.6
113	D	28.7	Very low	30	Very low	170 Å²	170	126.8 Å²	126.8	91%	0.909	80%	0.801	S	S	*	*				49.2	140.6	125.9	-65	-10.3	0	0	0	122.5
114	A	30	Very low	31.2	Very low	92 Å²	92	125.4 Å²	125.4	76%	0.76	80%	0.801	S	S	*	*			cis	-167.9	-174.9	-2.7	0	0	0	0	0	112.4
115	A	29.9	Very low	31.5	Very low	108 Å²	108	129 Å²	129	89%	0.893	81%	0.807	S	S	*	*			trans	101	130	160.5	0	0	0	0	0	119.1
116	A	31.7	Very low	31.8	Very low	93 Å²	93	131.4 Å²	131.4	77%	0.769	81%	0.811	S	S	*	*			trans	-134.2	168.4	168.8	0	0	0	0	0	108.3
117	P	49.5	Very low	31.9	Very low	127 Å²	127	129.5 Å²	129.5	83%	0.825	81%	0.81	S	S	*	*				-146	-178.6	89.3	29.7	-9	0	0	0	113.9
118	A	33.4	Very low	32	Very low	94 Å²	94	125.3 Å²	125.3	78%	0.777	80%	0.801	S	S	*	*			cis	-177.4	113.2	-39.2	0	0	0	0	0	109.9
119	S	30.5	Very low	31.9	Very low	123 Å²	123	128.1 Å²	128.1	86%	0.86	80%	0.804	S	S	*	*			trans	-175.2	159.9	165.3	54.6	0	0	0	0	109.6
120	G	29.4	Very low	32.1	Very low	65 Å²	65	127.1 Å²	127.1	67%	0.67	80%	0.803	S	S	*	*			cis	112.9	136.2	-15.9	0	0	0	0	0	115.3
121	V	32.2	Very low	33.1	Very low	135 Å²	135	125.1 Å²	125.1	82%	0.818	80%	0.799	S	S	*	*			cis	-154.3	133	-6.2	-175.4	0	0	0	0	106.9
122	S	28.6	Very low	33.2	Very low	107 Å²	107	127.6 Å²	127.6	75%	0.748	80%	0.804	S	S	*	*				178.3	125.9	94.5	38.1	0	0	0	0	114.8
123	S	36.6	Very low	33.2	Very low	109 Å²	109	127.4 Å²	127.4	76%	0.762	80%	0.802	S	S	*	*				36.6	153.2	129.6	-55.1	0	0	0	0	124
124	P	48.8	Very low	33.3	Very low	126 Å²	126	124.9 Å²	124.9	82%	0.818	80%	0.797	S	S	*	*			cis	-141.3	173.6	-29.4	39	-20.8	0	0	0	115.9
125	L	32.3	Very low	34.8	Very low	170 Å²	170	126.2 Å²	126.2	89%	0.89	80%	0.798	S	S	*	*			trans	-118.9	142.9	174.5	-92.1	165.5	0	0	0	112.8
126	R	30.5	Very low	36.2	Very low	233 Å²	233	126.8 Å²	126.8	88%	0.879	79%	0.793	S	S	*	*			trans	-168.9	149.5	160.6	-82.9	-142.3	172.1	168.4	-1	111.1
127	T	29.6	Very low	36.1	Very low	111 Å²	111	126.4 Å²	126.4	68%	0.681	80%	0.798	S	S	*	*			cis	-166.1	137.9	-14.5	19	0	0	0	0	112.4
128	S	29.9	Very low	35	Very low	98 Å²	98	123.9 Å²	123.9	69%	0.685	80%	0.795	S	S	*	*			trans	51.5	129.8	142.5	70.6	0	0	0	0	123.9
129	R	25.5	Very low	35.1	Very low	241 Å²	241	128 Å²	128	91%	0.909	80%	0.799	S	S	*	*				175.3	158.7	100.2	-94.1	-174.7	-174.5	-128.5	0.8	114.9
130	L	33.3	Very low	35.1	Very low	162 Å²	162	128.1 Å²	128.1	85%	0.848	79%	0.794	S	S	*	*			trans	-97.9	-176.6	166.3	-76.4	161.6	0	0	0	109.5
131	P	49.2	Very low	35.1	Very low	116 Å²	116	129.8 Å²	129.8	75%	0.753	80%	0.802	S	S	*	*			cis	-145.3	-171	10.6	42.2	-21	0	0	0	118.3
132	S	30.8	Very low	35.1	Very low	129 Å²	129	133 Å²	133	90%	0.902	80%	0.804	S	S	*	*			trans	105.8	139	139.6	-153.7	0	0	0	0	121.4
133	G	26.5	Very low	36.2	Very low	66 Å²	66	132.5 Å²	132.5	68%	0.68	80%	0.799	S	S	*	*			trans	157.1	121.6	167.5	0	0	0	0	0	115.8
134	S	31.4	Very low	35.7	Very low	117 Å²	117	135.6 Å²	135.6	82%	0.818	81%	0.806	S	S	*	*			trans	-168.5	-176.5	177.1	-51.8	0	0	0	0	110.7
135	P	61.1	Low	34.6	Very low	120 Å²	120	132.7 Å²	132.7	78%	0.779	80%	0.799	S	S	*	*			cis	-115.9	-96.4	-28.8	22.4	-0.9	0	0	0	113.1
136	P	59.7	Low	34.5	Very low	121 Å²	121	129.8 Å²	129.8	79%	0.786	80%	0.799	S	S	*	*				-125.8	157	-69.3	32.4	-14.1	0	0	0	117.4
137	G	28.4	Very low	34.4	Very low	85 Å²	85	124.1 Å²	124.1	88%	0.876	80%	0.795	S	S	*	*			trans	125.7	139.5	153.1	0	0	0	0	0	116.7
138	G	28.2	Very low	34.5	Very low	73 Å²	73	123.4 Å²	123.4	75%	0.753	80%	0.801	S	S	*	*			cis	-174.6	141.5	-8	0	0	0	0	0	115.2
139	Q	33.7	Very low	34.6	Very low	182 Å²	182	123.3 Å²	123.3	85%	0.85	81%	0.806	S	S	*	*			trans	11	152.8	140.5	-60.9	-169.7	78.4	0	0	121.5
140	T	31.7	Very low	35	Very low	124 Å²	124	116.7 Å²	116.7	76%	0.761	80%	0.803	S	S	*	*			cis	-172.9	173.3	-4.2	25.3	0	0	0	0	110.9
141	A	29.3	Very low	34.7	Very low	101 Å²	101	112.8 Å²	112.8	84%	0.835	80%	0.801	S	S	*	*			trans	120	169.6	139.3	0	0	0	0	0	120.8
142	K	32.5	Very low	33.6	Very low	201 Å²	201	113.2 Å²	113.2	87%	0.874	81%	0.806	S	S	*	*			trans	-155	-171.6	-163.3	-120.5	-179.1	-177.2	176.2	0	106.1
143	P	51	Low	33.6	Very low	97 Å²	97	111.3 Å²	111.3	63%	0.63	80%	0.798	S	S	*	*			cis	-137	-161.2	-27	33.7	-10.2	0	0	0	113.2
144	L	27.1	Very low	33.8	Very low	174 Å²	174	117 Å²	117	91%	0.911	81%	0.807	S	S	*	*			trans	72.8	153.4	160.7	-58.6	161.9	0	0	0	118
145	G	26	Very low	33.6	Very low	66 Å²	66	116.6 Å²	116.6	68%	0.68	80%	0.804	S	S	*	*			cis	163.7	167.4	-10	0	0	0	0	0	114.5
146	A	28.2	Very low	32.1	Very low	108 Å²	108	116.9 Å²	116.9	89%	0.893	81%	0.809	S	S	*	*			trans	69	162.7	168.1	0	0	0	0	0	119.3
147	S	29.9	Very low	30.6	Very low	114 Å²	114	114.4 Å²	114.4	80%	0.797	81%	0.805	S	S	*	*			cis	-173.9	167.1	-33.1	-169.7	0	0	0	0	111.5
148	A	30.5	Very low	30.7	Very low	96 Å²	96	115 Å²	115	79%	0.793	80%	0.802	S	S	*	*			trans	69.3	158	164.3	0	0	0	0	0	119.3
149	A	33.2	Very low	30.7	Very low	97 Å²	97	117.9 Å²	117.9	80%	0.802	80%	0.799	S	S	*	*			cis	-172.7	-175.7	-30.2	0	0	0	0	0	107.6
150	A	32.8	Very low	30.6	Very low	102 Å²	102	119.4 Å²	119.4	84%	0.843	80%	0.797	S	S	*	*			cis	-160.9	164.9	1.6	0	0	0	0	0	111.4
151	G	27.1	Very low	30.4	Very low	79 Å²	79	119.9 Å²	119.9	81%	0.814	80%	0.8	S	S	*	*			trans	101.4	148.4	157.7	0	0	0	0	0	117.4
152	C	26.8	Very low	30.4	Very low	126 Å²	126	119.3 Å²	119.3	85%	0.851	80%	0.795	S	S	*	*			cis	-157.6	137.8	-6.9	-167.8	0	0	0	0	112.5
153	A	31.2	Very low	31.4	Very low	88 Å²	88	116 Å²	116	73%	0.727	79%	0.794	S	S	*	*			trans	22.9	151.5	157.5	0	0	0	0	0	122.6
154	Q	29.5	Very low	30.3	Very low	186 Å²	186	114.5 Å²	114.5	87%	0.869	80%	0.797	S	S	*	*			cis	-129.2	-148.1	18.2	-58.3	-178.9	26.5	0	0	110.3
155	S	27.4	Very low	30.3	Very low	109 Å²	109	113.5 Å²	113.5	76%	0.762	80%	0.798	S	S	*	*			cis	-157.5	166.7	1	53.1	0	0	0	0	112.7
156	S	30.5	Very low	30.4	Very low	126 Å²	126	114 Å²	114	88%	0.881	80%	0.803	S	S	*	*			trans	-80.9	164.4	177.3	-46.3	0	0	0	0	114.3
157	G	26.7	Very low	30.3	Very low	69 Å²	69	114.2 Å²	114.2	71%	0.711	80%	0.798	S	S	*	*			cis	150.6	169.2	-8.9	0	0	0	0	0	114.6
158	A	30.6	Very low	30.1	Very low	96 Å²	96	116.9 Å²	116.9	79%	0.793	80%	0.8	S	S	*	*			trans	70.8	155.9	160	0	0	0	0	0	121
159	L	29.4	Very low	29.9	Very low	134 Å²	134	116.8 Å²	116.8	70%	0.702	79%	0.794	S	S	*	*			cis	-169.3	146.6	-20.3	-101.8	171.8	0	0	0	111
160	R	30.3	Very low	29.6	Very low	214 Å²	214	119.3 Å²	119.3	81%	0.808	79%	0.794	S	S	*	*			trans	64.7	161	149.3	-68.7	172.6	-178.4	-179.4	1	118.5
161	T	28.2	Very low	29.4	Very low	134 Å²	134	120 Å²	120	82%	0.822	79%	0.788	S	S	*	*			cis	-152.9	168.6	-4.3	-0.3	0	0	0	0	111.5
162	A	30.1	Very low	29.6	Very low	89 Å²	89	124.9 Å²	124.9	74%	0.736	79%	0.787	S	S	*	*			trans	-86.5	-171.8	166.9	0	0	0	0	0	111.5
163	P	52.1	Low	29.7	Very low	131 Å²	131	126.2 Å²	126.2	85%	0.851	79%	0.785	S	S	*	*			cis	-141	-167.8	3.2	44.8	-25.7	0	0	0	115.9
164	G	27.8	Very low	29.5	Very low	67 Å²	67	125.6 Å²	125.6	69%	0.691	79%	0.788	S	S	*	*			trans	123.3	110.2	143.7	0	0	0	0	0	120.8
165	T	28.7	Very low	29.4	Very low	152 Å²	152	127.2 Å²	127.2	93%	0.933	79%	0.792	S	S	*	*			trans	18.1	139	139.5	55.4	0	0	0	0	123.4
166	G	26.4	Very low	29.3	Very low	76 Å²	76	126.1 Å²	126.1	78%	0.784	79%	0.79	S	S	*	*			trans	139.6	109.4	132	0	0	0	0	0	121.1
167	S	27.4	Very low	29.3	Very low	113 Å²	113	126 Å²	126	79%	0.79	79%	0.789	S	S	*	*			trans	26	130.9	142.3	-73.5	0	0	0	0	125.9
168	M	25.5	Very low	29.3	Very low	170 Å²	170	127.7 Å²	127.7	84%	0.837	79%	0.79	S	S	*	*				82.5	136.9	126.9	-66.4	-65	-170.9	0	0	124.6
169	S	26.7	Very low	29.5	Very low	94 Å²	94	128.9 Å²	128.9	66%	0.657	79%	0.789	S	S	*	*			trans	63.2	107.9	139	65.2	0	0	0	0	123.8
170	D	26.4	Very low	29.4	Very low	151 Å²	151	129 Å²	129	81%	0.807	80%	0.795	S	S	*	*				86.6	147.8	116.1	-77.2	-61.6	0	0	0	126.3
171	T	28.5	Very low	29.2	Very low	117 Å²	117	124.8 Å²	124.8	72%	0.718	79%	0.794	S	S	*	*			trans	78.1	95.1	152.4	35.6	0	0	0	0	123.6
172	K	31.3	Very low	29.2	Very low	181 Å²	181	126.4 Å²	126.4	79%	0.787	80%	0.795	S	S	*	*				85.3	139.1	114.2	-95.1	-174.4	175	174.2	0	123.8
173	N	29	Very low	29.4	Very low	153 Å²	153	127.1 Å²	127.1	82%	0.818	79%	0.793	S	S	*	*			trans	81.6	110.1	149.1	-66.8	2.9	0	0	0	120.5
174	G	26.6	Very low	28.5	Very low	76 Å²	76	126.8 Å²	126.8	78%	0.784	79%	0.79	S	S	*	*			trans	-171.4	132.5	161.2	0	0	0	0	0	108.6
175	F	27.1	Very low	28.5	Very low	219 Å²	219	129.3 Å²	129.3	96%	0.961	80%	0.798	S	S	*	*			trans	-99.7	155.5	-163.6	-118.5	-98.7	0	0	0	115.5
176	A	26.3	Very low	28.5	Very low	87 Å²	87	127.9 Å²	127.9	72%	0.719	79%	0.789	S	S	*	*			trans	-57.4	158.3	-169.7	0	0	0	0	0	119
177	S	29.4	Very low	28.6	Very low	123 Å²	123	131 Å²	131	86%	0.86	79%	0.792	S	S	*	*			trans	-154.2	146.8	140.2	60.2	0	0	0	0	111.1
178	S	27.9	Very low	28.6	Very low	105 Å²	105	131.3 Å²	131.3	73%	0.734	79%	0.789	S	S	*	*			trans	-120.7	157	-173.1	-48.5	0	0	0	0	112.6
179	P	33.8	Very low	28.7	Very low	120 Å²	120	132.4 Å²	132.4	78%	0.779	79%	0.792	S	S	*	*			trans	-118.3	135.8	131	34.2	-28.4	0	0	0	109.9
180	V	26.9	Very low	28.8	Very low	137 Å²	137	137.6 Å²	137.6	83%	0.83	80%	0.797	S	S	*	*				77.9	125.4	50.1	179.8	0	0	0	0	112.2
181	T	26.1	Very low	28.9	Very low	125 Å²	125	135 Å²	135	77%	0.767	80%	0.797	S	S	*	*			trans	-134.8	144.4	-162.2	-46.1	0	0	0	0	110.6
182	I	28.7	Very low	29.1	Very low	168 Å²	168	140.3 Å²	140.3	86%	0.862	80%	0.803	S	S	*	*			trans	-163	152.8	156.3	-108.4	150.3	0	0	0	108.8
183	P	34.2	Very low	29.1	Very low	105 Å²	105	140.8 Å²	140.8	68%	0.682	81%	0.805	S	S	*	*				-115.9	172	-128.7	41.4	-36.3	0	0	0	116.7
184	P	32.5	Very low	29.2	Very low	123 Å²	123	138.6 Å²	138.6	80%	0.799	80%	0.798	S	S	*	*			trans	-74.3	167.5	164.6	33.2	-36.4	0	0	0	113.1
185	S	28	Very low	29.2	Very low	121 Å²	121	140.1 Å²	140.1	85%	0.846	79%	0.786	S	S	*	*			trans	-78.4	163.7	-172.4	47.4	0	0	0	0	115.2
186	V	28.9	Very low	29.3	Very low	122 Å²	122	135.2 Å²	135.2	74%	0.739	78%	0.779	S	S	*	*			trans	-110	135	175.8	-180	0	0	0	0	109.5	V188	V186-V188 HydrophobicContact CG1-CG2 3.75Å
187	T	28.5	Very low	29.7	Very low	141 Å²	141	142 Å²	142	87%	0.865	79%	0.786	S	S	*	*			trans	-111.2	141.7	156.4	38.2	0	0	0	0	108.9
188	V	27.8	Very low	29.9	Very low	119 Å²	119	142 Å²	142	72%	0.721	78%	0.783	S	S	*	*			trans	-117.8	116.2	-171.4	-179.9	0	0	0	0	109.8	V186	V186-V188 HydrophobicContact CG1-CG2 3.75Å
189	H	28.5	Very low	29.9	Very low	193 Å²	193	142 Å²	142	89%	0.894	79%	0.789	S	S	*	*			trans	-77.6	127.8	161	-68.7	-77	0	0	0	109.3
190	R	27.9	Very low	29.7	Very low	204 Å²	204	143 Å²	143	77%	0.77	79%	0.793	S	S	*	*			trans	-114.8	72	174.4	-166	-176.4	-175.6	155.6	1.9	111.6	R192	R190-R192 PolarHBondContact O-N 3.49Å
191	A	28.5	Very low	29.8	Very low	96 Å²	96	141.2 Å²	141.2	79%	0.793	79%	0.786	S	S	*	*			trans	-59.1	124.7	164.7	0	0	0	0	0	109.8
192	R	33.4	Very low	30	Very low	228 Å²	228	141.7 Å²	141.7	86%	0.86	79%	0.792	S	S	*	*			trans	-75.5	159.4	156.2	-71.4	-166.8	-174.5	-160.8	5.9	108.7	R190	R190-R192 PolarHBondContact O-N 3.49Å
193	K	30.8	Very low	29.8	Very low	191 Å²	191	138.1 Å²	138.1	83%	0.83	79%	0.787	S	S	*	*			trans	-132.9	96.6	-163.2	-177.4	-170	176.4	-172.3	0	110.3
194	T	30.4	Very low	29.5	Very low	108 Å²	108	142.1 Å²	142.1	66%	0.663	80%	0.797	S	S	*	*			trans	-126.6	68	177	41.6	0	0	0	0	109.9
195	M	27.7	Very low	29.3	Very low	107 Å²	107	146.1 Å²	146.1	53%	0.527	80%	0.802	S	S	.	*			trans	-153.9	126.4	146.9	-80.5	-41.3	-108.1	0	0	109.2	R933 E934	M195-R933 VanDerWaalsContact CE-CD 3.44Å; M195-R933 HydrophobicContact CE-CG 3.72Å; M195-E934 WeakPolarHBondContact CE-OE1 3.45Å
196	S	30.1	Very low	29.2	Very low	117 Å²	117	148.3 Å²	148.3	82%	0.818	80%	0.803	S	S	*	*			trans	-131.1	115.7	179.9	47.8	0	0	0	0	110.5
197	R	32.7	Very low	29	Very low	228 Å²	228	149.6 Å²	149.6	86%	0.86	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-77.1	144.4	178.6	-55.9	178.4	86.9	174.4	10.6	110.6
198	P	35.7	Very low	28.8	Very low	125 Å²	125	150.3 Å²	150.3	81%	0.812	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-62.4	156.2	169.9	-21.1	33.3	0	0	0	112.6
199	A	27	Very low	28.7	Very low	104 Å²	104	152.3 Å²	152.3	86%	0.86	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-91.8	145.6	175.2	0	0	0	0	0	111.8
200	V	30.1	Very low	28.7	Very low	142 Å²	142	150.5 Å²	150.5	86%	0.861	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-100.9	138.1	168.8	178.3	0	0	0	0	108.8
201	S	28.8	Very low	28.6	Very low	98 Å²	98	147.1 Å²	147.1	69%	0.685	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-80.5	141.2	-175.5	52.4	0	0	0	0	113.2	A203	S201-A203 PolarHBondContact O-N 2.73Å
202	P	29.7	Very low	28.5	Very low	135 Å²	135	152.6 Å²	152.6	88%	0.877	79%	0.79	S	S	*	*			trans	-92.9	81	-178.7	35.5	-34.3	0	0	0	112.5
203	A	25.2	Very low	28.3	Very low	93 Å²	93	150 Å²	150	77%	0.769	79%	0.788	S	S	*	*			trans	-108.9	50.4	-178.5	0	0	0	0	0	114.2	S201	S201-A203 PolarHBondContact O-N 2.73Å
204	Q	28.2	Very low	28.1	Very low	189 Å²	189	144.9 Å²	144.9	88%	0.883	78%	0.781	S	S	*	*			trans	-147.6	102.3	170.9	-103.6	-176.6	8.4	0	0	112.3
205	K	26.8	Very low	27.9	Very low	207 Å²	207	147.3 Å²	147.3	90%	0.9	79%	0.79	S	S	*	*			trans	-158.5	63.2	164.4	-129.5	-178.2	-171.4	-176.4	0	114.9
206	L	25.8	Very low	27.7	Very low	168 Å²	168	147.3 Å²	147.3	88%	0.88	80%	0.801	S	S	*	*			trans	-174.3	128.6	160.3	-96.9	152.2	0	0	0	102.8
207	I	24.8	Very low	27.6	Very low	149 Å²	149	148.4 Å²	148.4	76%	0.764	80%	0.802	S	S	*	*			cis	-137.8	144.9	33.2	-69.1	153	0	0	0	111.4
208	N	24.3	Very low	27.4	Very low	155 Å²	155	146.1 Å²	146.1	83%	0.829	80%	0.799	S	S	*	*			trans	-165.9	129.9	154.5	-108.8	-31.4	0	0	0	106.4
209	K	27.5	Very low	27	Very low	161 Å²	161	145.4 Å²	145.4	70%	0.7	80%	0.797	S	S	*	*			cis	-163.6	171.2	-8.6	-166.2	-172.5	173.1	-167.5	0	107.1
210	E	27.8	Very low	26.9	Very low	156 Å²	156	148.7 Å²	148.7	73%	0.729	79%	0.794	S	S	*	*			trans	75.8	159.5	166.1	-42.5	-166.2	146.6	0	0	115.7
211	L	26.1	Very low	26.8	Very low	133 Å²	133	147.4 Å²	147.4	70%	0.696	79%	0.791	S	S	*	*			cis	-151.3	135.3	8.2	-168.9	78	0	0	0	112.8
212	R	26.5	Very low	27.8	Very low	211 Å²	211	147.8 Å²	147.8	80%	0.796	79%	0.792	S	S	*	*			trans	156.8	122.5	145.8	-88.1	164.1	-167.8	-141.4	1.6	109.5
213	Q	27.8	Very low	27.7	Very low	172 Å²	172	148 Å²	148	80%	0.804	79%	0.79	S	S	*	*				60.8	131.2	89.8	-67.1	179.2	-8.8	0	0	114.3
214	A	26.5	Very low	27.8	Very low	84 Å²	84	147.8 Å²	147.8	69%	0.694	79%	0.788	S	S	*	*			cis	-166.5	163.6	-11.9	0	0	0	0	0	111.4
215	N	26.2	Very low	28.9	Very low	160 Å²	160	143.7 Å²	143.7	86%	0.856	78%	0.778	S	S	*	*			trans	65.9	140.8	155.5	-66.6	-6.3	0	0	0	122.8
216	S	25.4	Very low	29.1	Very low	106 Å²	106	140.6 Å²	140.6	74%	0.741	77%	0.771	S	S	*	*			trans	95	105.3	136	-161.3	0	0	0	0	122.2
217	V	27.8	Very low	29.4	Very low	141 Å²	141	138.4 Å²	138.4	86%	0.855	77%	0.765	S	S	*	*			trans	77.2	158.7	141	176.4	0	0	0	0	118.3
218	K	27.9	Very low	29.7	Very low	180 Å²	180	138.7 Å²	138.7	78%	0.783	76%	0.763	S	S	*	*			trans	-101.5	159.9	-169	-62	176.7	174.1	-180	0	112.6
219	S	27.1	Very low	29.8	Very low	110 Å²	110	139.1 Å²	139.1	77%	0.769	76%	0.757	S	S	*	*			trans	65.7	152	145.2	58.7	0	0	0	0	117.6
220	E	24.9	Very low	29.7	Very low	173 Å²	173	136.5 Å²	136.5	81%	0.808	76%	0.759	S	S	*	*			cis	-142.1	152.1	13.8	-63.5	172.6	106.9	0	0	113.3
221	S	27.6	Very low	29.6	Very low	114 Å²	114	134.2 Å²	134.2	80%	0.797	76%	0.76	S	S	*	*			trans	67.8	-173.9	144.3	86	0	0	0	0	117.6
222	P	49.5	Very low	30.9	Very low	107 Å²	107	133.4 Å²	133.4	70%	0.695	76%	0.763	S	S	*	*				-138.8	162.7	-123	37.7	-14.5	0	0	0	120
223	V	27.7	Very low	32.4	Very low	139 Å²	139	128.4 Å²	128.4	84%	0.842	76%	0.758	S	S	*	*			trans	73.1	144.9	142.1	161.7	0	0	0	0	121.4
224	A	28.2	Very low	33.6	Very low	88 Å²	88	125.8 Å²	125.8	73%	0.727	76%	0.756	S	S	*	*			trans	82.4	165.9	165.6	0	0	0	0	0	118
225	P	51.7	Low	35.2	Very low	104 Å²	104	127 Å²	127	68%	0.675	76%	0.756	S	S	*	*				-138.6	-174.4	-74	42.6	-26.7	0	0	0	115.6
226	D	29.2	Very low	36.5	Very low	142 Å²	142	124.9 Å²	124.9	76%	0.759	75%	0.752	S	S	*	*			trans	73.6	118.7	147.8	-66.9	-31.3	0	0	0	124.8
227	V	33.2	Very low	36.9	Very low	122 Å²	122	125.5 Å²	125.5	74%	0.739	75%	0.747	S	S	*	*				71.9	112.1	122.2	179.3	0	0	0	0	122.4
228	E	30.3	Very low	37.1	Very low	154 Å²	154	126.7 Å²	126.7	72%	0.72	74%	0.742	S	S	*	*			trans	87.9	152.1	143.9	-103.6	-166.8	-156.3	0	0	125.7
229	K	27.5	Very low	37.1	Very low	164 Å²	164	125.5 Å²	125.5	71%	0.713	74%	0.744	S	S	*	*			trans	79.7	104	154.2	-84	-175.8	178.3	78.8	0	123
230	S	25.1	Very low	38.3	Very low	107 Å²	107	125.2 Å²	125.2	75%	0.748	74%	0.74	S	S	*	*				55.3	133.6	123.2	61.9	0	0	0	0	123.6
231	S	24.9	Very low	38.5	Very low	107 Å²	107	124.9 Å²	124.9	75%	0.748	74%	0.738	S	S	*	*			trans	-59.6	-176.8	166	62.7	0	0	0	0	115.6
232	P	54.9	Low	38.6	Very low	116 Å²	116	124.1 Å²	124.1	75%	0.753	73%	0.732	S	S	*	*			cis	-131.6	-108.3	9.2	27.4	0.3	0	0	0	120
233	P	56.1	Low	38.4	Very low	106 Å²	106	124.7 Å²	124.7	69%	0.688	74%	0.736	S	S	*	*				-131.7	-142.5	-116.6	43.9	-22.8	0	0	0	116.2
234	P	54.1	Low	39.3	Very low	118 Å²	118	122.4 Å²	122.4	77%	0.766	72%	0.724	S	S	*	*				-119.2	-108.7	-57.8	24.4	-0	0	0	0	118
235	P	59.4	Low	39.2	Very low	108 Å²	108	125.7 Å²	125.7	70%	0.701	73%	0.725	S	S	*	*			trans	-127.8	-172.4	-133.6	44.3	-22.3	0	0	0	115.3
236	P	53.1	Low	38.1	Very low	116 Å²	116	126.8 Å²	126.8	75%	0.753	73%	0.729	S	S	*	*				-156.2	-155.4	88.4	44.2	-21.7	0	0	0	112.7
237	N	33.9	Very low	38.8	Very low	119 Å²	119	125.3 Å²	125.3	64%	0.636	73%	0.728	S	S	*	*			cis	-162.9	174.4	-5.5	-143.5	-23.4	0	0	0	113.7
238	H	33.2	Very low	38.5	Very low	166 Å²	166	124.3 Å²	124.3	77%	0.769	73%	0.732	S	S	*	*			trans	82.3	160.3	149.8	-67.7	-40	0	0	0	124.5
239	L	28.4	Very low	38.4	Very low	156 Å²	156	122.1 Å²	122.1	82%	0.817	73%	0.734	S	S	*	*			trans	-154.3	-176.6	-140.9	-105.7	168.3	0	0	0	109.8
240	P	51.4	Low	38.6	Very low	104 Å²	104	118.6 Å²	118.6	68%	0.675	74%	0.735	S	S	*	*			cis	-143.8	-177.3	39.5	33.3	-6.8	0	0	0	116
241	Q	29.8	Very low	38.6	Very low	166 Å²	166	121.8 Å²	121.8	78%	0.776	74%	0.738	S	S	*	*			cis	-157.5	131.7	-7.9	-121	157.2	4.2	0	0	111.9
242	S	29.2	Very low	38.8	Very low	97 Å²	97	122.6 Å²	122.6	68%	0.678	74%	0.739	S	S	*	*			trans	43.1	154.2	133.3	65.7	0	0	0	0	124.2
243	P	44.3	Very low	37.3	Very low	119 Å²	119	122 Å²	122	77%	0.773	74%	0.743	S	S	*	*			cis	-123.6	-138.4	-7.4	34.9	-10.7	0	0	0	112.2
244	P	47.4	Very low	36.7	Very low	92 Å²	92	122.3 Å²	122.3	60%	0.597	75%	0.748	S	S	*	*				-134	-153.9	-113.9	43.5	-20.4	0	0	0	114.4
245	E	25.5	Very low	36.2	Very low	157 Å²	157	122.5 Å²	122.5	73%	0.734	75%	0.749	S	S	*	*			cis	-161.3	131.6	5.8	-142.9	120.2	-118.8	0	0	113.9
246	T	29.1	Very low	34.8	Very low	126 Å²	126	121.7 Å²	121.7	77%	0.773	75%	0.752	S	S	*	*			trans	65.4	179.3	139.7	61.5	0	0	0	0	121.5
247	P	43.6	Very low	34.2	Very low	111 Å²	111	120.6 Å²	120.6	72%	0.721	75%	0.753	S	S	*	*				-143.6	-176.5	-65.1	45.1	-29.2	0	0	0	117.2
248	A	26.5	Very low	34.9	Very low	101 Å²	101	120.1 Å²	120.1	84%	0.835	76%	0.756	S	S	*	*			trans	77.1	161.2	138.2	0	0	0	0	0	122.2
249	S	29.1	Very low	35	Very low	109 Å²	109	117.6 Å²	117.6	76%	0.762	75%	0.753	S	S	*	*			trans	-124.8	136.7	173.2	56.1	0	0	0	0	110
250	A	32.1	Very low	35.3	Very low	89 Å²	89	118.7 Å²	118.7	74%	0.736	75%	0.754	S	S	*	*			trans	57.2	124.1	171.4	0	0	0	0	0	117.9
251	H	25.2	Very low	35.6	Very low	175 Å²	175	119 Å²	119	81%	0.81	76%	0.756	S	S	*	*				-179.4	127.5	118.5	-102.6	-74.1	0	0	0	112.9
252	T	27.9	Very low	35.7	Very low	124 Å²	124	116.1 Å²	116.1	76%	0.761	76%	0.76	S	S	*	*			trans	8.6	121.9	146.3	49	0	0	0	0	120.2
253	A	24.3	Very low	36	Very low	103 Å²	103	116 Å²	116	85%	0.851	77%	0.765	S	S	*	*			trans	-149.6	100.5	152.3	0	0	0	0	0	112.2
254	S	42.7	Very low	37	Very low	113 Å²	113	116.1 Å²	116.1	79%	0.79	77%	0.766	S	S	*	*			trans	-76.7	-176.2	164.4	-41.7	0	0	0	0	110.1
255	P	44.2	Very low	36.3	Very low	121 Å²	121	115.9 Å²	115.9	79%	0.786	77%	0.771	S	S	*	*			cis	-141.6	-160.4	7.7	44.1	-23.7	0	0	0	115.5
256	A	30.9	Very low	36.5	Very low	91 Å²	91	116.1 Å²	116.1	75%	0.752	78%	0.777	S	S	*	*			trans	70.2	117.7	166.3	0	0	0	0	0	116.3
257	A	40.1	Very low	36.6	Very low	94 Å²	94	115.2 Å²	115.2	78%	0.777	78%	0.777	S	S	*	*			cis	66.3	147.9	25.2	0	0	0	0	0	114.8
258	P	48.8	Very low	37	Very low	109 Å²	109	115.4 Å²	115.4	71%	0.708	78%	0.778	S	S	*	*			cis	-140.2	-169.8	2.7	37.5	-15.1	0	0	0	116.3
259	T	33.8	Very low	37	Very low	113 Å²	113	114.6 Å²	114.6	69%	0.693	77%	0.771	S	S	*	*			trans	64.5	113.4	148	44.1	0	0	0	0	123.8
260	E	35.7	Very low	36.8	Very low	179 Å²	179	116.4 Å²	116.4	84%	0.836	77%	0.772	S	S	*	*				54.7	162.6	113.5	-89.3	-178.1	-139.8	0	0	123.7
261	P	58.2	Low	36.4	Very low	111 Å²	111	117.1 Å²	117.1	72%	0.721	77%	0.772	S	S	*	*			cis	-135.7	-173.4	-3.8	38.7	-19.5	0	0	0	116.9
262	A	30.5	Very low	36.4	Very low	105 Å²	105	112.8 Å²	112.8	87%	0.868	77%	0.766	S	S	*	*			trans	93	157.5	148	0	0	0	0	0	122.4
263	A	36.6	Very low	36.3	Very low	94 Å²	94	111.7 Å²	111.7	78%	0.777	77%	0.77	S	S	*	*			trans	-132	-164	-172.5	0	0	0	0	0	109.9
264	P	64.1	Low	36.4	Very low	122 Å²	122	111.3 Å²	111.3	79%	0.792	77%	0.766	S	S	*	*			cis	-135.3	-170.8	-5.3	44.2	-26.4	0	0	0	114.8
265	A	32.4	Very low	35.7	Very low	86 Å²	86	109.9 Å²	109.9	71%	0.711	76%	0.762	S	S	*	*			trans	149.5	126.2	130.7	0	0	0	0	0	116.5
266	D	30.6	Very low	35	Very low	162 Å²	162	113 Å²	113	87%	0.866	76%	0.763	S	S	*	*			trans	43.7	135.4	142.2	-55.1	-20.9	0	0	0	125.4
267	S	31.8	Very low	34.8	Very low	108 Å²	108	116.7 Å²	116.7	76%	0.755	76%	0.764	S	S	*	*			trans	-74.9	168.4	156.9	76.6	0	0	0	0	111.8
268	P	51.1	Low	34	Very low	115 Å²	115	123 Å²	123	75%	0.747	77%	0.768	S	S	*	*				-161.4	176.6	77.9	44.4	-23.6	0	0	0	118.9
269	A	26.2	Very low	32.9	Very low	84 Å²	84	125.2 Å²	125.2	69%	0.694	77%	0.773	S	S	*	*			trans	69.3	138.5	137.1	0	0	0	0	0	125.2
270	D	25.6	Very low	32.7	Very low	146 Å²	146	122.7 Å²	122.7	78%	0.781	77%	0.77	S	S	*	*			trans	73.6	95	132.5	-75.3	-27.7	0	0	0	125.2
271	S	24.4	Very low	33.5	Very low	104 Å²	104	119.3 Å²	119.3	73%	0.727	76%	0.763	S	S	*	*				89.4	162.2	103.3	86	0	0	0	0	122.8
272	A	25	Very low	32.1	Very low	84 Å²	84	123.7 Å²	123.7	69%	0.694	77%	0.767	S	S	*	*			trans	63.3	82.7	142.2	0	0	0	0	0	121.9
273	A	25	Very low	32.2	Very low	101 Å²	101	123.1 Å²	123.1	84%	0.835	76%	0.756	S	S	*	*				64.3	166.2	107.9	0	0	0	0	0	123.5
274	A	26.2	Very low	31.9	Very low	95 Å²	95	124.4 Å²	124.4	79%	0.785	76%	0.755	S	S	*	*			trans	71.8	95.3	149.2	0	0	0	0	0	121.6
275	A	27.5	Very low	30.3	Very low	84 Å²	84	124.8 Å²	124.8	69%	0.694	75%	0.754	S	S	*	*				73.2	112.1	114.6	0	0	0	0	0	122.5
276	K	29.6	Very low	30.1	Very low	185 Å²	185	129.8 Å²	129.8	80%	0.804	76%	0.76	S	S	*	*				82	128.2	123.9	-72.4	178.9	179.2	174.4	0	122
277	H	26.9	Very low	30.1	Very low	170 Å²	170	126.3 Å²	126.3	79%	0.787	75%	0.749	S	S	*	*			trans	88.2	138.4	140.7	-75	-54.1	0	0	0	121.5
278	R	24.1	Very low	30	Very low	227 Å²	227	124.9 Å²	124.9	86%	0.857	74%	0.739	S	S	*	*			trans	71.9	152	167.9	-65	-175.6	169.6	-152.1	-0.8	116.5
279	L	25.1	Very low	29.1	Very low	154 Å²	154	129.6 Å²	129.6	81%	0.806	74%	0.742	S	S	*	*			cis	-161.7	171.9	-28.9	-112.6	171.4	0	0	0	107.7
280	G	30.9	Very low	29.3	Very low	61 Å²	61	133.9 Å²	133.9	63%	0.629	75%	0.745	S	S	*	*			trans	-70.5	176.8	167.7	0	0	0	0	0	113.2
281	P	52.2	Low	29.6	Very low	107 Å²	107	135.7 Å²	135.7	70%	0.695	75%	0.746	S	S	*	*				-134.6	-169.2	71	14.6	12.3	0	0	0	112.8
282	Y	27.5	Very low	29.9	Very low	204 Å²	204	140.1 Å²	140.1	80%	0.8	75%	0.752	S	S	*	*			cis	-145	145.5	29	-86.1	-91.9	0	0	0	110.3
283	S	32.7	Very low	30.1	Very low	92 Å²	92	148.3 Å²	148.3	64%	0.643	77%	0.765	S	S	*	*				81.9	135.6	71.1	-141.3	0	0	0	0	113.3
284	T	30.9	Very low	30.6	Very low	121 Å²	121	154.7 Å²	154.7	74%	0.742	77%	0.767	S	S	*	*			cis	-164.3	-176.7	3.3	-4.4	0	0	0	0	112.2
285	V	30.7	Very low	30.6	Very low	130 Å²	130	158.3 Å²	158.3	79%	0.788	77%	0.77	S	S	*	*			trans	88.7	128.8	167.3	-176.1	0	0	0	0	115.2
286	F	28	Very low	30.7	Very low	191 Å²	191	156.8 Å²	156.8	84%	0.838	76%	0.763	S	S	*	*			cis	-163.2	-174.4	-20.2	-134.9	-12.1	0	0	0	115.2
287	S	30.9	Very low	30.7	Very low	89 Å²	89	154.3 Å²	154.3	62%	0.622	76%	0.763	S	S	*	*			trans	-12.5	154.5	158	-83	0	0	0	0	123.6
288	S	29.4	Very low	30.7	Very low	78 Å²	78	155 Å²	155	55%	0.545	76%	0.76	S	S	.	*			cis	-170.3	144	-2.4	-112.4	0	0	0	0	116.4
289	R	32.2	Very low	31	Very low	215 Å²	215	149.6 Å²	149.6	81%	0.811	76%	0.757	S	S	*	*			trans	64.4	150.3	137	-64	169.3	-174.6	-162.1	0.8	120.5
290	K	31.5	Very low	31.2	Very low	174 Å²	174	149.1 Å²	149.1	76%	0.757	75%	0.754	S	S	*	*			cis	-169.8	157.8	-15.6	-118.9	176.3	180	173.7	0	113
291	K	31.6	Very low	31.1	Very low	184 Å²	184	152 Å²	152	80%	0.8	76%	0.76	S	S	*	*			trans	81.5	113.5	149.1	-78.6	-178.6	173.9	179.3	0	124.3
292	K	30.7	Very low	30.1	Very low	196 Å²	196	153 Å²	153	85%	0.852	77%	0.766	S	S	*	*				52.8	124.9	126.8	-70	-168.3	173.3	-170.9	0	123.5
293	R	28.6	Very low	30.4	Very low	256 Å²	256	152.7 Å²	152.7	97%	0.966	77%	0.769	S	S	*	*				-158.2	-169.7	114	-110.6	174.1	-177.5	-170.5	0.1	112.5
294	R	35.7	Very low	30.2	Very low	235 Å²	235	158.5 Å²	158.5	89%	0.887	78%	0.783	S	S	*	*			trans	-141.4	156.2	-157.3	-179.9	-170.3	-173.7	-151.8	6.8	111.6
295	M	26.5	Very low	30.2	Very low	172 Å²	172	162.6 Å²	162.6	85%	0.847	79%	0.79	S	S	*	*			trans	122	147.5	170.9	-70.9	-73.5	-78.6	0	0	111.4
296	G	29.2	Very low	30.1	Very low	52 Å²	52	162.7 Å²	162.7	54%	0.536	79%	0.791	S	S	.	*			cis	152	126.1	-14.1	0	0	0	0	0	114.6
297	T	28.8	Very low	30.2	Very low	132 Å²	132	163.5 Å²	163.5	81%	0.81	79%	0.794	S	S	*	*			trans	63.9	160.6	168.1	64.6	0	0	0	0	116.5
298	Y	27	Very low	30	Very low	184 Å²	184	165.4 Å²	165.4	72%	0.722	80%	0.802	S	S	*	*			cis	-151.3	156.3	-0.7	-149.4	-135.3	0	0	0	109.7	L300	Y298-L300 HydrophobicContact CD1-CD1 3.94Å; Y298-L300 HydrophobicContact CD1-CD2 4.26Å; Y298-L300 HydrophobicContact CD1-CG 3.73Å; Y298-L300 HydrophobicContact CE1-CD1 3.93Å; Y298-L300 HydrophobicContact CE1-CD2 3.77Å; Y298-L300 HydrophobicContact CE1-CG 3.74Å
299	S	30.5	Very low	30	Very low	115 Å²	115	169 Å²	169	80%	0.804	81%	0.814	S	S	*	*			trans	-124.8	133.5	168.6	-64.3	0	0	0	0	110.1
300	L	29.6	Very low	29.8	Very low	143 Å²	143	168.5 Å²	168.5	75%	0.749	82%	0.818	S	S	*	*			trans	-130.1	127.6	176.7	-78.7	173.8	0	0	0	111.6	Y298	Y298-L300 HydrophobicContact CD1-CD1 3.94Å; Y298-L300 HydrophobicContact CD1-CD2 4.26Å; Y298-L300 HydrophobicContact CD1-CG 3.73Å; Y298-L300 HydrophobicContact CE1-CD1 3.93Å; Y298-L300 HydrophobicContact CE1-CD2 3.77Å; Y298-L300 HydrophobicContact CE1-CG 3.74Å
301	V	29.4	Very low	30	Very low	122 Å²	122	169 Å²	169	74%	0.739	82%	0.823	S	S	*	*			trans	-117.6	125.2	174.8	177	0	0	0	0	108.2	K303	V301-K303 PolarHBondContact O-N 2.97Å
302	P	31.1	Very low	30.3	Very low	128 Å²	128	167 Å²	167	83%	0.831	81%	0.81	S	S	*	*			trans	-67.5	118.6	172.2	-18.8	32.3	0	0	0	110.9
303	K	32.6	Very low	31.4	Very low	198 Å²	198	161.3 Å²	161.3	86%	0.861	79%	0.792	S	S	*	*			trans	-85.3	126.7	173.6	-65	-179.8	-180	179.4	0	110.6	V301	V301-K303 PolarHBondContact O-N 2.97Å
304	K	30	Very low	32	Very low	213 Å²	213	153.4 Å²	153.4	93%	0.926	77%	0.767	S	S	*	*			trans	-122.6	152.5	149.4	-82.9	-170.2	174.4	-177.7	0	109.3
305	K	30.1	Very low	32.1	Very low	207 Å²	207	149 Å²	149	90%	0.9	76%	0.761	S	S	*	*			trans	-104.1	127.5	-162	-54.7	171.7	-176	174.8	0	110.8
306	T	29.2	Very low	32.8	Very low	132 Å²	132	145.7 Å²	145.7	81%	0.81	74%	0.743	S	S	*	*			trans	-92.7	146.1	153.1	42.4	0	0	0	0	109.1	V308	T306-V308 PolarHBondContact O-N 3.08Å
307	K	30.1	Very low	33.4	Very low	208 Å²	208	147 Å²	147	90%	0.904	74%	0.736	S	S	*	*			trans	-79	110.1	172.7	-72.6	-179.9	179.2	176.6	0	108.3	L309	K307-L309 PolarHBondContact O-N 2.92Å
308	V	26.6	Very low	34.1	Very low	129 Å²	129	146.9 Å²	146.9	78%	0.782	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-71.1	123.9	165	173.6	0	0	0	0	107.6	T306	T306-V308 PolarHBondContact O-N 3.08Å
309	L	29.8	Very low	34.6	Very low	154 Å²	154	145.1 Å²	145.1	81%	0.806	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-62.2	135.3	164.3	-85.2	79	0	0	0	107.7	K307 Q311	K307-L309 PolarHBondContact O-N 2.92Å; L309-Q311 PolarHBondContact O-N 3.39Å; L309-Q311 VanDerWaalsContact O-N 3.09Å
310	K	28.4	Very low	35.1	Very low	205 Å²	205	144.7 Å²	144.7	89%	0.891	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-58.6	118.1	167.7	-82	-173.1	171	-172	0	108.3	R312	K310-R312 PolarHBondContact O-N 3.04Å
311	Q	34.9	Very low	35.6	Very low	184 Å²	184	144.4 Å²	144.4	86%	0.86	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-59	124.4	157.1	-71.7	172.7	-65	0	0	107.3	L309	L309-Q311 PolarHBondContact O-N 3.39Å; L309-Q311 VanDerWaalsContact O-N 3.09Å
312	R	38.6	Very low	36.2	Very low	142 Å²	142	145.9 Å²	145.9	54%	0.536	70%	0.704	S	S	.	*	P	Polyproline II helix	trans	-64.9	142	160.8	-77.4	174.3	158.4	-154.4	-14.4	107.5	K310 M317 E320	K310-R312 PolarHBondContact O-N 3.04Å; R312-M317 HydrophobicContact CB-CG 4.27Å; R312-E320 IonicContact CZ-OE1 2.74Å; R312-E320 IonicContact CZ-OE2 2.65Å; R312-E320 IonicContact NH1-OE1 2.59Å; R312-E320 PolarHBondContact NH1-OE1 3.12Å; R312-E320 IonicContact NH1-OE2 3.97Å; R312-E320 PolarHBondContact NH1-OE2 3.41Å; R312-E320 IonicContact NH2-OE1 3.53Å; R312-E320 PolarHBondContact NH2-OE1 2.56Å; R312-E320 IonicContact NH2-OE2 2.77Å
313	T	53.6	Low	36.4	Very low	76 Å²	76	147.3 Å²	147.3	47%	0.466	70%	0.699	S	S	.	*	P	Polyproline II helix	trans	-75	152.2	172.2	61.8	0	0	0	0	110.2	L315 E316 M317	T313-L315 PolarHBondContact O-N 3.08Å; T313-L315 VanDerWaalsContact O-N 3.14Å; T313-E316 WeakPolarHBondContact CB-OE2 3.5Å; T313-E316 PolarHBondContact N-OE2 2.7Å; T313-E316 PolarHBondContact O-N 3.29Å; T313-E316 WeakPolarHBondContact OG1-CG 3.42Å; T313-E316 PolarHBondContact OG1-OE2 2.82Å; T313-M317 PolarHBondContact O-N 3.02Å
314	M	39.8	Very low	36.5	Very low	90 Å²	90	142.4 Å²	142.4	44%	0.443	69%	0.69	S	S	.	*	H	α-helix	trans	-54.1	-34.3	177.2	-68.9	-71.9	-81.6	0	0	112.3	E316 M317 F318 Q779	M314-E316 VanDerWaalsContact C-N 3.31Å; M314-E316 PolarHBondContact O-N 2.92Å; M314-M317 PolarHBondContact O-N 3.3Å; M314-M317 HydrophobicContact SD-CE 3.63Å; M314-F318 PolarHBondContact O-N 2.93Å; M314-Q779 HydrophobicContact CE-CB 4.46Å
315	L	37.4	Very low	36.7	Very low	143 Å²	143	136.4 Å²	136.4	75%	0.749	68%	0.679	S	S	*	*	H	α-helix	trans	-66	-24.1	175.9	-81.3	160.9	0	0	0	114.6	T313	T313-L315 PolarHBondContact O-N 3.08Å; T313-L315 VanDerWaalsContact O-N 3.14Å
316	E	42.6	Very low	36.8	Very low	102 Å²	102	135.4 Å²	135.4	48%	0.477	68%	0.675	S	S	.	*	H	α-helix	trans	-82.5	-36.7	177.3	-72.5	163.8	121.4	0	0	111.3	T313 M314 K319	T313-E316 WeakPolarHBondContact CB-OE2 3.5Å; T313-E316 PolarHBondContact N-OE2 2.7Å; T313-E316 PolarHBondContact O-N 3.29Å; T313-E316 WeakPolarHBondContact OG1-CG 3.42Å; T313-E316 PolarHBondContact OG1-OE2 2.82Å; M314-E316 VanDerWaalsContact C-N 3.31Å; M314-E316 PolarHBondContact O-N 2.92Å; E316-K319 PolarHBondContact O-N 3.19Å
317	M	41.6	Very low	37	Very low	81 Å²	81	135.1 Å²	135.1	40%	0.399	67%	0.673	S	S	.	*	H	α-helix	trans	-68.6	-35.3	179.8	-61.7	-168.9	-67.4	0	0	112.6	R312 T313 M314 K319	R312-M317 HydrophobicContact CB-CG 4.27Å; T313-M317 PolarHBondContact O-N 3.02Å; M314-M317 PolarHBondContact O-N 3.3Å; M314-M317 HydrophobicContact SD-CE 3.63Å; M317-K319 VanDerWaalsContact C-N 3.26Å; M317-K319 PolarHBondContact O-N 2.9Å
318	F	42.9	Very low	37	Very low	129 Å²	129	134.4 Å²	134.4	57%	0.566	67%	0.673	S	S	*	*	H	α-helix	trans	-68.5	-17.7	176.6	-95.7	-94	0	0	0	114.6	M314	M314-F318 PolarHBondContact O-N 2.93Å
319	K	38.8	Very low	37.2	Very low	146 Å²	146	137.8 Å²	137.8	64%	0.635	68%	0.681	S	S	*	*	H	α-helix	trans	-81	-33.3	-179.7	-86.3	-175.9	172.4	178.6	0	114.1	E316 M317 L321 Q322	E316-K319 PolarHBondContact O-N 3.19Å; M317-K319 VanDerWaalsContact C-N 3.26Å; M317-K319 PolarHBondContact O-N 2.9Å; K319-L321 VanDerWaalsContact C-N 3.31Å; K319-Q322 PolarHBondContact O-N 2.91Å
320	E	40.4	Very low	37.2	Very low	106 Å²	106	138.3 Å²	138.3	50%	0.495	68%	0.676	S	S	.	*	H	α-helix	trans	-69.3	-33.5	178.9	-69.2	175	162.4	0	0	110.7	R312 Q322 Q323	R312-E320 IonicContact CZ-OE1 2.74Å; R312-E320 IonicContact CZ-OE2 2.65Å; R312-E320 IonicContact NH1-OE1 2.59Å; R312-E320 PolarHBondContact NH1-OE1 3.12Å; R312-E320 IonicContact NH1-OE2 3.97Å; R312-E320 PolarHBondContact NH1-OE2 3.41Å; R312-E320 IonicContact NH2-OE1 3.53Å; R312-E320 PolarHBondContact NH2-OE1 2.56Å; R312-E320 IonicContact NH2-OE2 2.77Å; E320-Q322 VanDerWaalsContact C-N 3.3Å; E320-Q322 PolarHBondContact O-N 3.43Å; E320-Q323 PolarHBondContact O-N 2.94Å
321	L	39.9	Very low	37.2	Very low	137 Å²	137	134.1 Å²	134.1	72%	0.717	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	-22.2	179.3	-148.1	76.8	0	0	0	114.4	K319	K319-L321 VanDerWaalsContact C-N 3.31Å
322	Q	41	Very low	37	Very low	154 Å²	154	129 Å²	129	72%	0.72	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-7.9	177.5	-71	-171	-17.3	0	0	113.9	K319 E320	K319-Q322 PolarHBondContact O-N 2.91Å; E320-Q322 VanDerWaalsContact C-N 3.3Å; E320-Q322 PolarHBondContact O-N 3.43Å
323	Q	36.2	Very low	36.5	Very low	158 Å²	158	125.8 Å²	125.8	74%	0.738	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-18.6	-173	-68	-171.3	-14.6	0	0	114.5	E320	E320-Q323 PolarHBondContact O-N 2.94Å
324	S	33.7	Very low	35.4	Very low	95 Å²	95	124.8 Å²	124.8	66%	0.664	64%	0.635	S	S	*	*	S	Bend	trans	-75.5	-22.3	176.2	54.3	0	0	0	0	113.8	K326	S324-K326 VanDerWaalsContact C-N 3.26Å; S324-K326 PolarHBondContact O-N 2.77Å; S324-K326 VanDerWaalsContact O-N 3.1Å
325	A	34.6	Very low	34.8	Very low	86 Å²	86	127 Å²	127	71%	0.711	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	29.1	-171.8	0	0	0	0	0	115.1
326	K	32.2	Very low	34.2	Very low	186 Å²	186	125.9 Å²	125.9	81%	0.809	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.9	30.8	-173.8	-80.4	-162.4	173	-174.4	0	116.8	S324	S324-K326 VanDerWaalsContact C-N 3.26Å; S324-K326 PolarHBondContact O-N 2.77Å; S324-K326 VanDerWaalsContact O-N 3.1Å
327	T	33.2	Very low	33.6	Very low	126 Å²	126	128.7 Å²	128.7	77%	0.773	67%	0.67	S	S	*	*			trans	-148.3	90.1	165.7	30.3	0	0	0	0	112.5
328	Q	31.3	Very low	32.9	Very low	193 Å²	193	127.9 Å²	127.9	90%	0.902	68%	0.683	S	S	*	*			trans	173.2	108.5	142.3	-99.1	162.3	-10.2	0	0	111.1
329	Q	30.9	Very low	32.2	Very low	201 Å²	201	129.6 Å²	129.6	94%	0.939	69%	0.692	S	S	*	*				171.8	123.3	129.1	-96.5	-178.5	-4.2	0	0	113.2
330	K	28.7	Very low	31.6	Very low	164 Å²	164	129.8 Å²	129.8	71%	0.713	69%	0.693	S	S	*	*			trans	-154.9	148.6	142.8	-131.5	-170.4	167.9	-82.6	0	104.7	E332	K330-E332 IonicContact NZ-OE1 3.04Å; K330-E332 PolarHBondContact NZ-OE1 3.01Å; K330-E332 IonicContact NZ-OE2 3.06Å; K330-E332 PolarHBondContact NZ-OE2 3.01Å
331	R	29.7	Very low	31	Very low	118 Å²	118	130.8 Å²	130.8	45%	0.445	71%	0.706	S	S	.	*				110.9	102	59.7	4.1	175.8	170.9	167.6	-5.4	112.1	D669 D671	R331-D669 WeakPolarHBondContact CB-OD2 3.37Å; R331-D669 VanDerWaalsContact CG-OD2 3.26Å; R331-D669 WeakPolarHBondContact CG-OD2 3.43Å; R331-D671 IonicContact CZ-OD1 2.75Å; R331-D671 IonicContact CZ-OD2 3.77Å; R331-D671 IonicContact NH1-OD1 3.81Å; R331-D671 PolarHBondContact NH1-OD1 2.92Å; R331-D671 VanDerWaalsContact NH1-OD1 3.15Å; R331-D671 IonicContact NH1-OD2 3.87Å; R331-D671 PolarHBondContact NH1-OD2 2.75Å; R331-D671 VanDerWaalsContact NH2-CG 3.34Å; R331-D671 IonicContact NH2-OD1 2.64Å; R331-D671 PolarHBondContact NH2-OD1 3.12Å; R331-D671 IonicContact NH2-OD2 2.64Å
332	E	29.4	Very low	30.4	Very low	76 Å²	76	129.6 Å²	129.6	36%	0.355	70%	0.704	S	S	.	*			trans	137.2	61.2	148.5	-33.5	104.8	-176	0	0	129.3	K330 A667 L668 D669	K330-E332 IonicContact NZ-OE1 3.04Å; K330-E332 PolarHBondContact NZ-OE1 3.01Å; K330-E332 IonicContact NZ-OE2 3.06Å; K330-E332 PolarHBondContact NZ-OE2 3.01Å; E332-A667 CarbonylContact C-O 3.57Å; E332-A667 CarbonylContact O-C 3.58Å; E332-L668 VanDerWaalsContact C-CA 3.44Å; E332-L668 HydrophobicContact CB-CB 3.89Å; E332-L668 HydrophobicContact CB-CD2 3.44Å; E332-L668 VanDerWaalsContact CB-CD2 3.44Å; E332-L668 HydrophobicContact CB-CG 4.23Å; E332-L668 HydrophobicContact CG-CB 4.26Å; E332-L668 HydrophobicContact CG-CD2 4.36Å; E332-D669 WeakPolarHBondContact CA-OD1 3.5Å; E332-D669 HydrophobicContact CG-CB 3.92Å; E332-D669 VanDerWaalsContact CG-N 3.3Å; E332-D669 PolarHBondContact N-OD1 2.58Å; E332-D669 PolarHBondContact N-OD2 2.83Å
333	A	27.8	Very low	29.7	Very low	74 Å²	74	129.3 Å²	129.3	61%	0.612	71%	0.708	S	S	*	*			cis	152.4	-97.4	2.6	0	0	0	0	0	119.2	A667 L668 D669	A333-A667 CarbonylContact C-O 3.57Å; A333-A667 VanDerWaalsContact CA-O 3.24Å; A333-A667 WeakPolarHBondContact CA-O 3.37Å; A333-A667 PolarHBondContact N-O 3.4Å; A333-L668 VanDerWaalsContact C-N 3.33Å; A333-D669 WeakPolarHBondContact CA-OD1 3.31Å; A333-D669 WeakPolarHBondContact CB-OD1 3.23Å; A333-D669 PolarHBondContact N-OD1 3.34Å; A333-D669 VanDerWaalsContact N-OD1 3.08Å
334	A	30.3	Very low	29.5	Very low	56 Å²	56	125.5 Å²	125.5	46%	0.463	70%	0.704	S	S	.	*			trans	-114.3	-177.4	-154.4	0	0	0	0	0	123.6	A667 L668	A334-A667 PolarHBondContact N-O 2.98Å; A334-L668 WeakPolarHBondContact CB-O 3.2Å; A334-L668 PolarHBondContact N-O 3.27Å
335	T	28.1	Very low	29.3	Very low	135 Å²	135	125.8 Å²	125.8	83%	0.828	71%	0.705	S	S	*	*			trans	97.4	150.7	166.8	66.5	0	0	0	0	120.8
336	V	25.8	Very low	29.1	Very low	120 Å²	120	129.8 Å²	129.8	73%	0.727	71%	0.709	S	S	*	*			cis	-167.4	166.7	-38.9	98.5	0	0	0	0	112.3
337	N	28.5	Very low	28.9	Very low	161 Å²	161	129.2 Å²	129.2	86%	0.861	71%	0.71	S	S	*	*			trans	73.2	145	173.1	-70.5	-23.4	0	0	0	119.7
338	G	28.4	Very low	28.7	Very low	64 Å²	64	130.2 Å²	130.2	66%	0.66	71%	0.71	S	S	*	*			cis	170	166.4	-8.2	0	0	0	0	0	115.6
339	E	27.5	Very low	28.5	Very low	165 Å²	165	130 Å²	130	77%	0.771	71%	0.709	S	S	*	*			trans	70.3	146.7	175.2	-56.1	-140.1	104.6	0	0	117.4
340	K	25.7	Very low	28.2	Very low	150 Å²	150	125.2 Å²	125.2	65%	0.652	70%	0.698	S	S	*	*			cis	-158.5	140.2	7.6	-137.1	174.2	179.3	80.5	0	113.4
341	V	28.4	Very low	28.1	Very low	127 Å²	127	125.8 Å²	125.8	77%	0.77	70%	0.703	S	S	*	*			trans	64.3	138.1	139.4	148.6	0	0	0	0	120.5
342	V	26.4	Very low	27.9	Very low	112 Å²	112	126.9 Å²	126.9	68%	0.679	72%	0.718	S	S	*	*			cis	-170.5	152.8	-16.3	87.6	0	0	0	0	111.2
343	N	28	Very low	27.9	Very low	149 Å²	149	129.6 Å²	129.6	80%	0.797	73%	0.732	S	S	*	*			trans	34.7	158.4	150.9	-68.8	32	0	0	0	123
344	A	30.6	Very low	27.8	Very low	78 Å²	78	134.3 Å²	134.3	65%	0.645	74%	0.742	S	S	*	*			cis	-161.7	-176.4	-11.3	0	0	0	0	0	106.5
345	S	29.2	Very low	27.5	Very low	100 Å²	100	137.4 Å²	137.4	70%	0.699	76%	0.76	S	S	*	*			cis	-147.8	157.3	15.6	-41.2	0	0	0	0	107.3
346	E	31.1	Very low	27.4	Very low	171 Å²	171	139.9 Å²	139.9	80%	0.799	76%	0.762	S	S	*	*				53.9	130.2	64.1	-51.9	164	174.5	0	0	110.5
347	E	28.5	Very low	27.4	Very low	174 Å²	174	142.7 Å²	142.7	81%	0.813	77%	0.767	S	S	*	*			cis	-135.3	147.7	38.3	-74.6	148.7	-165.1	0	0	110.2
348	D	29.1	Very low	27.2	Very low	146 Å²	146	143.4 Å²	143.4	78%	0.781	77%	0.765	S	S	*	*				60.9	151.8	85	-59.9	-54.4	0	0	0	115
349	E	26.1	Very low	27	Very low	189 Å²	189	148.8 Å²	148.8	88%	0.883	78%	0.775	S	S	*	*			cis	-148	-175	16.1	-148.9	161.7	-154.7	0	0	111.4
350	S	26	Very low	26.7	Very low	101 Å²	101	149.9 Å²	149.9	71%	0.706	77%	0.772	S	S	*	*			trans	-117.6	-158.4	-169.6	60.7	0	0	0	0	115.1
351	E	25.6	Very low	26.7	Very low	176 Å²	176	152 Å²	152	82%	0.822	78%	0.776	S	S	*	*			trans	82.7	151.4	172.4	-56.2	-173.6	-173.3	0	0	118.7
352	D	25.8	Very low	26.4	Very low	140 Å²	140	154.7 Å²	154.7	75%	0.749	78%	0.78	S	S	*	*			cis	-168.6	-178.8	-46.2	-134.6	-41.8	0	0	0	110.8
353	M	28.6	Very low	26.9	Very low	134 Å²	134	155 Å²	155	66%	0.66	79%	0.785	S	S	*	*			trans	70.5	117.6	165.8	-63.2	-64.9	154.5	0	0	117.9
354	E	25.9	Very low	26.7	Very low	173 Å²	173	152.3 Å²	152.3	81%	0.808	78%	0.783	S	S	*	*				64.9	128	89.6	-66.7	-172.1	-178.6	0	0	114.3
355	S	25.3	Very low	26.5	Very low	120 Å²	120	157.1 Å²	157.1	84%	0.839	79%	0.792	S	S	*	*				-165.7	-176.8	65.4	49.2	0	0	0	0	114.4
356	E	26.1	Very low	26.5	Very low	187 Å²	187	160.2 Å²	160.2	87%	0.874	80%	0.796	S	S	*	*			trans	-101.8	-177.5	-169.7	-59.6	-167.7	115.8	0	0	116.2
357	E	25.1	Very low	26.3	Very low	180 Å²	180	157.3 Å²	157.3	84%	0.841	79%	0.79	S	S	*	*			trans	91.6	114.9	161.5	-60.9	-154.6	119.1	0	0	122.3
358	E	23.9	Very low	26.3	Very low	176 Å²	176	156.5 Å²	156.5	82%	0.822	79%	0.79	S	S	*	*			trans	63.4	94.4	135.5	-157.1	178.8	-163.8	0	0	122
359	M	24.3	Very low	27.6	Very low	176 Å²	176	154.9 Å²	154.9	87%	0.867	79%	0.788	S	S	*	*			trans	-153.4	161.8	136.2	-164.7	43.2	62.6	0	0	113.9
360	R	21.8	Very low	27.7	Very low	188 Å²	188	150.4 Å²	150.4	71%	0.709	78%	0.783	S	S	*	*			trans	-83.7	149.7	-174.4	-93.1	176	169.2	166.6	-1.6	115.9
361	R	24.2	Very low	27.8	Very low	194 Å²	194	151.4 Å²	151.4	73%	0.732	79%	0.785	S	S	*	*			trans	70.7	123.9	136.6	-72.7	173.2	177.7	-177.9	-3.8	122.3
362	Q	22.3	Very low	28	Very low	184 Å²	184	150.2 Å²	150.2	86%	0.86	78%	0.779	S	S	*	*			trans	72.3	160.6	132.4	-75.5	-172.2	-22.1	0	0	120.4
363	P	37.8	Very low	28.4	Very low	120 Å²	120	151 Å²	151	78%	0.779	78%	0.778	S	S	*	*			trans	-118.8	159.4	-152.4	41.8	-31.6	0	0	0	116.3
364	A	23.7	Very low	28.5	Very low	92 Å²	92	150.6 Å²	150.6	76%	0.76	78%	0.784	S	S	*	*			trans	170.7	144.6	139.9	0	0	0	0	0	113.3
365	E	26	Very low	29.1	Very low	179 Å²	179	147.3 Å²	147.3	84%	0.836	78%	0.78	S	S	*	*			trans	-134.2	124	158.1	-69.5	-169	121.3	0	0	107.2
366	Q	29.7	Very low	29.5	Very low	164 Å²	164	150 Å²	150	77%	0.766	78%	0.779	S	S	*	*				73.9	133.9	68.7	-64.7	-177.3	71.5	0	0	111.7
367	T	26.1	Very low	29.8	Very low	110 Å²	110	147 Å²	147	68%	0.675	78%	0.778	S	S	*	*			cis	-157.3	115.1	30.1	-48	0	0	0	0	115.4
368	L	28.3	Very low	30.3	Very low	158 Å²	158	142.9 Å²	142.9	83%	0.827	78%	0.775	S	S	*	*			trans	56.3	173.8	140	-57.3	178.8	0	0	0	122.7
369	P	55.9	Low	30.6	Very low	112 Å²	112	140.6 Å²	140.6	73%	0.727	77%	0.769	S	S	*	*			cis	-132.9	149.6	-8.5	18	7	0	0	0	119.3
370	A	28.2	Very low	30.9	Very low	94 Å²	94	138.6 Å²	138.6	78%	0.777	76%	0.757	S	S	*	*			trans	66.6	153.8	144.9	0	0	0	0	0	120.9
371	V	28.2	Very low	31.3	Very low	123 Å²	123	137.5 Å²	137.5	75%	0.745	76%	0.758	S	S	*	*			cis	-145.4	142.4	18.4	173.7	0	0	0	0	113.1
372	Q	31.4	Very low	31.5	Very low	150 Å²	150	134.1 Å²	134.1	70%	0.701	76%	0.759	S	S	*	*			trans	20.5	125.4	156.2	-59.7	-179.1	-84.1	0	0	123.8
373	E	33.8	Very low	31.8	Very low	156 Å²	156	132 Å²	132	73%	0.729	75%	0.746	S	S	*	*				93.4	154.8	90	-71.4	-179.8	-134	0	0	115.2
374	T	31.2	Very low	31.3	Very low	127 Å²	127	132.3 Å²	132.3	78%	0.779	74%	0.742	S	S	*	*			cis	-134.1	-165	14.3	49.6	0	0	0	0	114.6
375	S	37.2	Very low	31.4	Very low	104 Å²	104	134 Å²	134	73%	0.727	73%	0.733	S	S	*	*			trans	-77.6	-175.7	-168.4	53.1	0	0	0	0	117.1
376	E	34.6	Very low	31.4	Very low	176 Å²	176	132.6 Å²	132.6	82%	0.822	73%	0.727	S	S	*	*			cis	-167.7	170.3	27.8	-160.4	169.3	-141.2	0	0	115.5
377	S	31.8	Very low	31.1	Very low	123 Å²	123	132 Å²	132	86%	0.86	72%	0.724	S	S	*	*			trans	96.5	166.2	158.1	78.7	0	0	0	0	121.3
378	A	35.8	Very low	31	Very low	94 Å²	94	130.9 Å²	130.9	78%	0.777	72%	0.721	S	S	*	*			trans	-119.4	-171.7	-150.4	0	0	0	0	0	114.8
379	D	29.9	Very low	30.8	Very low	128 Å²	128	132.6 Å²	132.6	68%	0.684	72%	0.724	S	S	*	*			cis	-166.3	164.5	38.2	-153	-3.6	0	0	0	115.6
380	Q	31.3	Very low	29.2	Very low	135 Å²	135	134.4 Å²	134.4	63%	0.631	73%	0.728	S	S	*	*			trans	6.4	156.3	161.3	-76.4	169	86.2	0	0	123.6
381	K	29.3	Very low	29.1	Very low	164 Å²	164	134 Å²	134	71%	0.713	72%	0.72	S	S	*	*			cis	-171.3	150.9	12	-130.4	178.4	-179.4	163.6	0	115.6
382	V	28.6	Very low	29	Very low	124 Å²	124	136.3 Å²	136.3	75%	0.752	72%	0.722	S	S	*	*			trans	52.7	143.1	132.4	152.8	0	0	0	0	121.2
383	K	28	Very low	28.7	Very low	139 Å²	139	137.8 Å²	137.8	60%	0.604	73%	0.729	S	S	*	*			cis	-163.5	-171.8	-4.1	-112.4	-160.3	161.8	-85.3	0	107.9	E385	K383-E385 WeakPolarHBondContact CE-OE1 3.15Å; K383-E385 IonicContact NZ-OE1 2.63Å; K383-E385 PolarHBondContact NZ-OE1 3.39Å
384	D	27.4	Very low	28.3	Very low	127 Å²	127	137.5 Å²	137.5	68%	0.679	73%	0.733	S	S	*	*			cis	161.3	174.1	-40.3	-164.7	7.3	0	0	0	111.8
385	E	26.6	Very low	28.2	Very low	126 Å²	126	140.4 Å²	140.4	59%	0.589	74%	0.737	S	S	*	*			trans	84	125	161.6	-64.9	177.3	-140.5	0	0	124.6	K383	K383-E385 WeakPolarHBondContact CE-OE1 3.15Å; K383-E385 IonicContact NZ-OE1 2.63Å; K383-E385 PolarHBondContact NZ-OE1 3.39Å
386	H	25.9	Very low	27.7	Very low	151 Å²	151	138.9 Å²	138.9	70%	0.699	74%	0.738	S	S	*	*			trans	53.9	160.6	134.7	-70	-69.6	0	0	0	123.5
387	E	24.1	Very low	27.4	Very low	151 Å²	151	140.1 Å²	140.1	71%	0.706	74%	0.744	S	S	*	*			cis	-173.6	167	-20.5	-175.9	156.8	-96.3	0	0	111.9
388	S	23	Very low	27.2	Very low	86 Å²	86	143.2 Å²	143.2	60%	0.601	75%	0.745	S	S	*	*			trans	41.6	147.1	152.9	63.5	0	0	0	0	127.1
389	E	24.5	Very low	26.9	Very low	194 Å²	194	147.1 Å²	147.1	91%	0.907	75%	0.747	S	S	*	*			trans	87.8	-179.7	137.1	-84.1	172.9	-154.4	0	0	122.3
390	D	22.5	Very low	26.8	Very low	150 Å²	150	150 Å²	150	80%	0.802	76%	0.756	S	S	*	*			trans	-118.1	174.8	-131.6	-150.1	-9.8	0	0	0	114.8
391	S	25.6	Very low	26.6	Very low	87 Å²	87	147.2 Å²	147.2	61%	0.608	77%	0.765	S	S	*	*			trans	81.6	136.1	158.1	-62.9	0	0	0	0	124.4
392	E	25.9	Very low	26.5	Very low	170 Å²	170	145.1 Å²	145.1	79%	0.794	77%	0.766	S	S	*	*			trans	73	121.6	137.6	-71.2	171.3	-178.2	0	0	124.6
393	E	25.3	Very low	26.4	Very low	182 Å²	182	146.9 Å²	146.9	85%	0.85	77%	0.766	S	S	*	*			trans	62.4	159.2	147.5	-53.8	-175.4	166.5	0	0	118.7
394	D	26.3	Very low	26.4	Very low	149 Å²	149	145 Å²	145	80%	0.797	77%	0.77	S	S	*	*			cis	-147.8	-168.5	5.8	-165.6	11.4	0	0	0	111.4
395	E	29.6	Very low	26.3	Very low	188 Å²	188	146 Å²	146	88%	0.879	78%	0.775	S	S	*	*			trans	-67	161	-177.7	-58.6	-169	159.6	0	0	117.2
396	G	25.8	Very low	26.3	Very low	73 Å²	73	147 Å²	147	75%	0.753	78%	0.784	S	S	*	*			trans	169.1	78.6	165.5	0	0	0	0	0	121.2
397	E	28.5	Very low	26.3	Very low	202 Å²	202	144.7 Å²	144.7	94%	0.944	79%	0.785	S	S	*	*			trans	54.2	-178.3	145.4	-58	-167.5	153.8	0	0	122.9
398	E	27.3	Very low	26.3	Very low	187 Å²	187	146.2 Å²	146.2	87%	0.874	79%	0.789	S	S	*	*			trans	-83.1	163.3	-158.7	-52.6	179.2	150.4	0	0	113
399	E	29.3	Very low	26.2	Very low	177 Å²	177	150 Å²	150	83%	0.827	80%	0.798	S	S	*	*				-163.5	-142	54.4	-149.5	-173.8	-150.9	0	0	114.2
400	E	28.9	Very low	26.2	Very low	187 Å²	187	145.8 Å²	145.8	87%	0.874	79%	0.79	S	S	*	*			trans	-62.9	156	-163.1	-55.7	-166.7	135	0	0	118.4
401	G	26.7	Very low	26.4	Very low	78 Å²	78	143.9 Å²	143.9	80%	0.804	79%	0.788	S	S	*	*			trans	-172.9	150.1	168.6	0	0	0	0	0	114.7
402	T	26.1	Very low	26.3	Very low	120 Å²	120	148.3 Å²	148.3	74%	0.736	80%	0.804	S	S	*	*			trans	-100.1	168.9	-167	40.6	0	0	0	0	116.4
403	E	26.6	Very low	26.2	Very low	161 Å²	161	148.3 Å²	148.3	75%	0.752	80%	0.801	S	S	*	*			trans	67.7	133	144.2	72.4	-152.2	93.2	0	0	125.5
404	S	28.2	Very low	26.3	Very low	100 Å²	100	148 Å²	148	70%	0.699	80%	0.797	S	S	*	*			trans	75.4	128.3	150.5	41.8	0	0	0	0	124
405	D	25.8	Very low	26.1	Very low	146 Å²	146	149.9 Å²	149.9	78%	0.781	80%	0.798	S	S	*	*			trans	73	125.7	137	-72.4	9	0	0	0	125.8
406	L	26.1	Very low	25.8	Very low	149 Å²	149	147 Å²	147	78%	0.78	79%	0.788	S	S	*	*			trans	69.5	101.3	145.2	-61.1	175	0	0	0	122.7
407	S	25.7	Very low	25.6	Very low	102 Å²	102	152.1 Å²	152.1	71%	0.713	79%	0.789	S	S	*	*				91.2	150.1	125	-57.3	0	0	0	0	123
408	F	24.2	Very low	25.4	Very low	182 Å²	182	151.4 Å²	151.4	80%	0.798	78%	0.783	S	S	*	*			trans	70.4	98.4	164.6	-83.8	-82.1	0	0	0	123.2
409	E	22.1	Very low	25.2	Very low	167 Å²	167	151.8 Å²	151.8	78%	0.78	78%	0.782	S	S	*	*				67.1	160.1	126.8	-81.6	-146.7	100.5	0	0	126.4
410	S	23.7	Very low	24.9	Very low	105 Å²	105	148 Å²	148	73%	0.734	78%	0.775	S	S	*	*			trans	89.4	59.7	155.3	77.9	0	0	0	0	121.8
411	S	26.1	Very low	24.7	Very low	109 Å²	109	148.4 Å²	148.4	76%	0.762	77%	0.774	S	S	*	*			trans	16.4	117.6	133.1	-71	0	0	0	0	120.6
412	L	23.3	Very low	24.6	Very low	180 Å²	180	148.5 Å²	148.5	94%	0.942	77%	0.767	S	S	*	*			trans	-132.6	153.4	142	-86.5	-173.7	0	0	0	114
413	K	24.8	Very low	24.5	Very low	170 Å²	170	150.5 Å²	150.5	74%	0.739	77%	0.773	S	S	*	*			trans	-108.2	156.1	-175.1	-64.5	149.7	-178.6	159.7	0	107.5
414	K	26.4	Very low	24.4	Very low	176 Å²	176	146.5 Å²	146.5	77%	0.765	78%	0.775	S	S	*	*				165.7	172.6	67.7	-132.7	148.7	-172.6	171.5	0	109.8
415	K	23.8	Very low	24.2	Very low	189 Å²	189	145.5 Å²	145.5	82%	0.822	77%	0.773	S	S	*	*			trans	76.1	149.3	155.9	-72	166.9	-177.7	174.4	0	117.7
416	L	22	Very low	24.1	Very low	128 Å²	128	149.7 Å²	149.7	67%	0.67	78%	0.778	S	S	*	*			cis	-170.9	136.8	-13	176.3	67.6	0	0	0	114.4
417	K	22.5	Very low	24	Very low	179 Å²	179	148.3 Å²	148.3	78%	0.778	77%	0.771	S	S	*	*			trans	65.1	172.8	161	-76.7	166.3	-171.9	171.6	0	118.3
418	K	24	Very low	23.9	Very low	187 Å²	187	154.2 Å²	154.2	81%	0.813	78%	0.778	S	S	*	*			cis	163	138	-45.9	174.7	171.7	-177.4	171	0	111
419	K	22.5	Very low	24.5	Very low	195 Å²	195	150.7 Å²	150.7	85%	0.848	77%	0.773	S	S	*	*			trans	103.9	149	178.1	-76.7	-172.1	171.7	-177.9	0	113.4
420	S	23.6	Very low	24.6	Very low	98 Å²	98	147.3 Å²	147.3	69%	0.685	77%	0.768	S	S	*	*			cis	-167.3	155	-10.1	42.7	0	0	0	0	113.9
421	K	23.9	Very low	24.7	Very low	196 Å²	196	152.9 Å²	152.9	85%	0.852	77%	0.773	S	S	*	*			trans	31.1	123	146.6	-77.3	-166.9	169	-162.8	0	120.2
422	A	24.9	Very low	24.6	Very low	80 Å²	80	157.2 Å²	157.2	66%	0.661	78%	0.778	S	S	*	*				79	151.4	80.5	0	0	0	0	0	113.3
423	D	23.6	Very low	24.6	Very low	161 Å²	161	159.4 Å²	159.4	86%	0.861	77%	0.774	S	S	*	*			cis	-128.4	163.8	6.1	-82.2	-67.9	0	0	0	109.4
424	G	25.4	Very low	24.5	Very low	77 Å²	77	159.6 Å²	159.6	79%	0.794	78%	0.775	S	S	*	*				92.9	146.3	74.6	0	0	0	0	0	112.3
425	A	23.4	Very low	24.4	Very low	79 Å²	79	161.7 Å²	161.7	65%	0.653	78%	0.777	S	S	*	*			cis	-169.2	-172.8	-0.5	0	0	0	0	0	111.4
426	W	24.8	Very low	24.3	Very low	234 Å²	234	163.2 Å²	163.2	89%	0.886	78%	0.778	S	S	*	*			trans	78	147.7	163.4	-54.7	116.5	0	0	0	118
427	L	24.3	Very low	24.3	Very low	121 Å²	121	165 Å²	165	63%	0.634	79%	0.785	S	S	*	*			cis	-158.8	119.6	1.7	-119.8	170.4	0	0	0	113.8
428	R	23.4	Very low	24.2	Very low	226 Å²	226	160 Å²	160	85%	0.853	78%	0.784	S	S	*	*			trans	56.2	-179.4	138.6	-92.8	-173.3	177.9	178.5	1.8	121.9
429	P	36	Very low	24.1	Very low	107 Å²	107	155.9 Å²	155.9	70%	0.695	79%	0.785	S	S	*	*			cis	-132.3	179.9	-8.8	34.1	-14.4	0	0	0	117.7
430	S	24.7	Very low	24.1	Very low	97 Å²	97	158.1 Å²	158.1	68%	0.678	79%	0.788	S	S	*	*			trans	85	144.4	153.2	-64.2	0	0	0	0	119.4
431	R	26.1	Very low	24	Very low	222 Å²	222	161.3 Å²	161.3	84%	0.838	79%	0.792	S	S	*	*			cis	-156.4	135.3	-2.2	-115.7	165.5	-168.6	-167.2	2.9	112.2
432	K	23.9	Very low	24.3	Very low	200 Å²	200	157.6 Å²	157.6	87%	0.87	79%	0.788	S	S	*	*			trans	21.3	147	149.4	-57.2	175.6	-178.7	175.9	0	120.2
433	R	23.1	Very low	24.2	Very low	226 Å²	226	161.6 Å²	161.6	85%	0.853	79%	0.793	S	S	*	*			cis	-173.2	132.1	49.6	-156.1	-174.5	-171.2	-174.9	3	114.6
434	K	22.8	Very low	24.1	Very low	174 Å²	174	159.3 Å²	159.3	76%	0.757	79%	0.785	S	S	*	*			trans	38.2	136.4	137.5	-167.9	-179	179.8	-167.3	0	120.6
435	R	23	Very low	23.8	Very low	219 Å²	219	162.6 Å²	162.6	83%	0.826	78%	0.784	S	S	*	*			cis	-171.1	166.8	-5.5	-116.3	-176.9	-175.4	-178.1	0.5	110.9
436	R	21.7	Very low	23.7	Very low	222 Å²	222	165.1 Å²	165.1	84%	0.838	79%	0.791	S	S	*	*			trans	2	161.8	144.3	-78.9	-163.4	164	-161.5	-2.8	121.7
437	M	22.4	Very low	23.6	Very low	166 Å²	166	160.6 Å²	160.6	82%	0.818	78%	0.784	S	S	*	*			cis	174.6	140.1	-19.1	-99.8	-83.4	-90.6	0	0	109.2
438	G	21.6	Very low	23.9	Very low	73 Å²	73	160.1 Å²	160.1	75%	0.753	79%	0.788	S	S	*	*			trans	98	123.5	138.5	0	0	0	0	0	123.5
439	A	21.8	Very low	24.1	Very low	100 Å²	100	157 Å²	157	83%	0.826	78%	0.783	S	S	*	*			trans	70.4	125.6	134.3	0	0	0	0	0	125.5
440	R	21.7	Very low	23.6	Very low	243 Å²	243	157.7 Å²	157.7	92%	0.917	79%	0.786	S	S	*	*			trans	76.7	132.6	145.6	-72.2	-175.1	174.7	-170.1	-3.1	123.1
441	E	22.1	Very low	23.8	Very low	164 Å²	164	158.1 Å²	158.1	77%	0.766	79%	0.789	S	S	*	*			trans	-10.3	154.1	142.4	-62.9	-56.4	138.9	0	0	118.6
442	P	30.1	Very low	23.8	Very low	118 Å²	118	150.9 Å²	150.9	77%	0.766	78%	0.783	S	S	*	*			cis	-148.2	-153.7	45.1	45.6	-24.3	0	0	0	118.2
443	E	21.7	Very low	24	Very low	164 Å²	164	149.7 Å²	149.7	77%	0.766	78%	0.78	S	S	*	*			trans	-86.4	-175.7	-156	-49.6	169.8	106.6	0	0	118.4
444	T	21.8	Very low	24	Very low	114 Å²	114	147.1 Å²	147.1	70%	0.699	78%	0.778	S	S	*	*			trans	83.3	113	149.7	46	0	0	0	0	122.4
445	D	19.9	Very low	24	Very low	145 Å²	145	146.8 Å²	146.8	78%	0.775	77%	0.773	S	S	*	*				101.6	121	116.6	-75.2	-2.2	0	0	0	125.6
446	V	21.4	Very low	24	Very low	133 Å²	133	142.6 Å²	142.6	81%	0.806	77%	0.772	S	S	*	*				99.8	124.7	128.5	165.7	0	0	0	0	121.7
447	L	22.7	Very low	24.1	Very low	138 Å²	138	138.8 Å²	138.8	72%	0.723	76%	0.764	S	S	*	*			trans	-66.3	163.5	168.9	-78.7	151.5	0	0	0	113.2
448	P	29.6	Very low	24.2	Very low	111 Å²	111	138.9 Å²	138.9	72%	0.721	77%	0.766	S	S	*	*				-124.5	151.7	89	1.3	21.3	0	0	0	112.3
449	Q	27.2	Very low	24.1	Very low	160 Å²	160	143.2 Å²	143.2	75%	0.748	77%	0.771	S	S	*	*				67.1	148.7	56.1	-67.8	-175.2	-25.2	0	0	113.5
450	T	27.1	Very low	25.2	Very low	123 Å²	123	143.4 Å²	143.4	76%	0.755	76%	0.764	S	S	*	*			cis	-155	-176.8	14.4	-9.7	0	0	0	0	107.8
451	S	27.7	Very low	25.3	Very low	106 Å²	106	136.7 Å²	136.7	74%	0.741	75%	0.754	S	S	*	*			cis	-162.8	160	6.6	32.8	0	0	0	0	107
452	G	26	Very low	25.4	Very low	69 Å²	69	137.5 Å²	137.5	71%	0.711	76%	0.758	S	S	*	*			cis	116.2	152.8	26.1	0	0	0	0	0	108.6
453	Q	29.6	Very low	25.3	Very low	175 Å²	175	137.9 Å²	137.9	82%	0.818	76%	0.762	S	S	*	*			cis	-122	-144.3	8.4	-72.1	147.2	-145.8	0	0	108.7
454	E	22.3	Very low	25.4	Very low	173 Å²	173	138 Å²	138	81%	0.808	77%	0.766	S	S	*	*			cis	-151.1	-179.1	7.2	-72.9	-167	128	0	0	108.6
455	Y	22.9	Very low	25.4	Very low	167 Å²	167	140 Å²	140	66%	0.655	77%	0.773	S	S	*	*			cis	172.6	124.7	-49.8	176.6	-97	0	0	0	107.6	E457	Y455-E457 HydrophobicContact CE2-CG 3.98Å; Y455-E457 WeakPolarHBondContact CE2-OE2 3.31Å; Y455-E457 VanDerWaalsContact CZ-OE2 3.3Å; Y455-E457 PolarHBondContact OH-OE2 2.91Å
456	T	23.4	Very low	25.9	Very low	131 Å²	131	141.4 Å²	141.4	80%	0.804	78%	0.779	S	S	*	*			trans	-170.7	138.8	146.6	-66.3	0	0	0	0	108
457	E	23	Very low	26	Very low	141 Å²	141	140.5 Å²	140.5	66%	0.659	78%	0.779	S	S	*	*			trans	-118.9	152.6	-176.4	-59.3	173.1	95.8	0	0	112.2	Y455	Y455-E457 HydrophobicContact CE2-CG 3.98Å; Y455-E457 WeakPolarHBondContact CE2-OE2 3.31Å; Y455-E457 VanDerWaalsContact CZ-OE2 3.3Å; Y455-E457 PolarHBondContact OH-OE2 2.91Å
458	I	24	Very low	26.1	Very low	169 Å²	169	143.2 Å²	143.2	87%	0.867	79%	0.785	S	S	*	*			trans	-147.5	128.4	152.7	-56.2	-176.6	0	0	0	111.3
459	L	21	Very low	25.9	Very low	163 Å²	163	143.2 Å²	143.2	85%	0.853	79%	0.787	S	S	*	*			trans	-166.3	163.3	156.2	-94	176.6	0	0	0	107
460	P	44.2	Very low	26	Very low	105 Å²	105	139.7 Å²	139.7	68%	0.682	78%	0.78	S	S	*	*			cis	-132.4	-176.5	-17.9	36.4	-17.4	0	0	0	114.2
461	S	23.6	Very low	26.1	Very low	102 Å²	102	142.2 Å²	142.2	71%	0.713	78%	0.783	S	S	*	*			trans	135.1	127.4	133	-70.3	0	0	0	0	120
462	E	24.9	Very low	26	Very low	180 Å²	180	142.1 Å²	142.1	84%	0.841	78%	0.782	S	S	*	*			trans	59.2	102.4	138.8	-58.3	-172.4	150.2	0	0	124.6
463	C	26.7	Very low	26.1	Very low	127 Å²	127	145.1 Å²	145.1	86%	0.858	78%	0.782	S	S	*	*				45.5	115.2	119.3	-159.8	0	0	0	0	122.6
464	I	24.3	Very low	26.1	Very low	167 Å²	167	144.5 Å²	144.5	86%	0.856	78%	0.779	S	S	*	*			trans	-144.6	150	157.8	-64.9	-172.5	0	0	0	111.5
465	D	21.6	Very low	27.3	Very low	156 Å²	156	141 Å²	141	83%	0.834	77%	0.771	S	S	*	*			trans	-68.4	167.1	177.3	-92.4	-59	0	0	0	117.2
466	L	30.5	Very low	27.6	Very low	173 Å²	173	139 Å²	139	91%	0.906	78%	0.782	S	S	*	*			trans	-87.4	131.3	166.4	-77	85.7	0	0	0	112.8
467	S	24.4	Very low	27.9	Very low	114 Å²	114	136.5 Å²	136.5	80%	0.797	78%	0.782	S	S	*	*			trans	-150.9	111.6	160.9	65.5	0	0	0	0	116.2
468	K	25.5	Very low	28.4	Very low	196 Å²	196	135.6 Å²	135.6	85%	0.852	79%	0.792	S	S	*	*			trans	28.8	132.2	148.2	-64.5	-178.9	177.4	177.5	0	123
469	S	25.4	Very low	28.8	Very low	110 Å²	110	132.4 Å²	132.4	77%	0.769	79%	0.791	S	S	*	*			trans	76.6	152.2	136	71.2	0	0	0	0	118.8
470	S	28.1	Very low	29.4	Very low	86 Å²	86	132.3 Å²	132.3	60%	0.601	79%	0.789	S	S	*	*			cis	-159.4	149.4	11.7	-14.7	0	0	0	0	113.7
471	H	28.6	Very low	29	Very low	177 Å²	177	134.6 Å²	134.6	82%	0.819	79%	0.791	S	S	*	*			trans	62.6	148.5	152.8	-57.8	-49.9	0	0	0	118.8
472	S	26.9	Very low	29.7	Very low	103 Å²	103	137.2 Å²	137.2	72%	0.72	79%	0.792	S	S	*	*			cis	-174.6	161.2	0.1	38.3	0	0	0	0	109.1
473	N	27.1	Very low	30.4	Very low	132 Å²	132	133.4 Å²	133.4	71%	0.706	79%	0.791	S	S	*	*			cis	-167.6	163.1	-8.4	-106.6	26.7	0	0	0	109.8
474	E	29.3	Very low	31.5	Very low	162 Å²	162	133.3 Å²	133.3	76%	0.757	78%	0.778	S	S	*	*			trans	30.4	153.9	136.9	-61.9	-73.6	86.8	0	0	123.6
475	P	49.1	Very low	33	Very low	99 Å²	99	134.3 Å²	134.3	64%	0.643	78%	0.779	S	S	*	*			cis	-144.2	156.8	-33.2	38.1	-21.1	0	0	0	115.9
476	S	28.6	Very low	35	Very low	126 Å²	126	128.6 Å²	128.6	88%	0.881	75%	0.748	S	S	*	*				164.4	124	124.7	65.7	0	0	0	0	112.2
477	G	29.2	Very low	36.5	Very low	79 Å²	79	124.7 Å²	124.7	81%	0.814	73%	0.733	S	S	*	*			trans	173.8	127.5	171.9	0	0	0	0	0	111.9
478	S	33.2	Very low	38.9	Very low	122 Å²	122	123.1 Å²	123.1	85%	0.853	72%	0.715	S	S	*	*			trans	-78	142.8	179.9	49.4	0	0	0	0	112.1
479	A	32.3	Very low	41.5	Very low	102 Å²	102	115.2 Å²	115.2	84%	0.843	68%	0.684	S	S	*	*			trans	-69.1	151	-167.1	0	0	0	0	0	115.3
480	I	34.5	Very low	43.6	Very low	161 Å²	161	111.5 Å²	111.5	83%	0.826	66%	0.659	S	S	*	*			trans	-110.8	131.8	159.3	-64.4	174.4	0	0	0	106.3	E482	I480-E482 PolarHBondContact O-N 2.96Å
481	E	36	Very low	45.3	Very low	153 Å²	153	109 Å²	109	72%	0.715	64%	0.641	S	S	*	*			trans	-78.8	118.3	171.2	-80.1	-157	94.4	0	0	110.6	K591	E481-K591 IonicContact OE1-NZ 2.73Å; E481-K591 PolarHBondContact OE1-NZ 3Å
482	E	37.9	Very low	46.8	Very low	157 Å²	157	107.7 Å²	107.7	73%	0.734	63%	0.629	S	S	*	*			trans	-81.6	116.6	172.7	-169.5	176.9	-119.4	0	0	110	I480 Q484	I480-E482 PolarHBondContact O-N 2.96Å; E482-Q484 PolarHBondContact O-N 3.15Å
483	A	38.8	Very low	48.1	Very low	100 Å²	100	109 Å²	109	83%	0.826	63%	0.625	S	S	*	*			trans	-78.9	85	-174.8	0	0	0	0	0	111.9	E485	A483-E485 PolarHBondContact O-N 3.1Å
484	Q	49.8	Very low	49.5	Very low	125 Å²	125	105.6 Å²	105.6	58%	0.584	61%	0.605	S	S	*	*			trans	-70.9	110.5	175.6	-68.4	177.1	-6	0	0	111.4	E482 L590	E482-Q484 PolarHBondContact O-N 3.15Å; Q484-L590 HydrophobicContact CB-CD1 3.72Å; Q484-L590 WeakPolarHBondContact O-CD1 3.46Å
485	E	57	Low	50.7	Low	188 Å²	188	102.6 Å²	102.6	88%	0.879	60%	0.598	S	S	*	*			trans	-78.8	142.2	178.2	-168.6	172.6	-153.7	0	0	111.8	A483	A483-E485 PolarHBondContact O-N 3.1Å
486	L	63.7	Low	51.1	Low	36 Å²	36	101.1 Å²	101.1	19%	0.188	59%	0.588	C	S	.	*			trans	-75.1	132.9	178.4	-75.9	168.7	0	0	0	110.9	L488 L590 F595	L486-L488 HydrophobicContact CB-CD2 4.26Å; L486-L488 PolarHBondContact O-N 3.3Å; L486-L590 HydrophobicContact CD1-CD2 4.44Å; L486-L590 HydrophobicContact CD2-CB 3.77Å; L486-L590 HydrophobicContact CD2-CD2 4.31Å; L486-L590 HydrophobicContact CG-CB 4.42Å; L486-L590 HydrophobicContact CG-CD2 4.04Å; L486-F595 HydrophobicContact CD1-CB 4Å; L486-F595 HydrophobicContact CD1-CD1 4.32Å; L486-F595 HydrophobicContact CD1-CD2 4.13Å; L486-F595 HydrophobicContact CD1-CG 3.89Å; L486-F595 HydrophobicContact CD2-CB 4.25Å; L486-F595 HydrophobicContact CD2-CD2 4.02Å; L486-F595 HydrophobicContact CD2-CG 4.36Å
487	P	61.8	Low	52.4	Low	90 Å²	90	104.9 Å²	104.9	58%	0.584	59%	0.589	S	S	*	*			trans	-71.6	99.9	172.9	28.3	-32.7	0	0	0	110.1
488	L	75	Confident	53.9	Low	81 Å²	81	102.9 Å²	102.9	42%	0.424	56%	0.562	S	S	.	*			trans	-87.3	164.3	177.5	-60.7	-174	0	0	0	112.8	L486 S490 P597	L486-L488 HydrophobicContact CB-CD2 4.26Å; L486-L488 PolarHBondContact O-N 3.3Å; L488-S490 PolarHBondContact O-N 3.32Å; L488-S490 PolarHBondContact O-OG 2.87Å; L488-P597 CarbonylContact C-O 3.59Å; L488-P597 WeakPolarHBondContact CA-O 3.25Å
489	C	79.1	Confident	55.1	Low	30 Å²	30	107.1 Å²	107.1	20%	0.203	56%	0.559	C	S	.	*			trans	-64.6	128.4	-177	63.2	0	0	0	0	111.8	P534 P558 P597 H598	C489-P534 CarbonylContact C-O 3.55Å; C489-P534 VanDerWaalsContact CA-O 3.27Å; C489-P534 WeakPolarHBondContact CA-O 3.44Å; C489-P558 HydrophobicContact CB-CB 4.21Å; C489-P558 HydrophobicContact CB-CG 3.67Å; C489-P597 PolarHBondContact N-O 2.99Å; C489-H598 HydrophobicContact CB-CB 4.28Å; C489-H598 WeakPolarHBondContact CB-ND1 3.35Å; C489-H598 PolarHBondContact SG-O 3.06Å
490	S	68.8	Low	56.5	Low	33 Å²	33	109 Å²	109	23%	0.231	55%	0.551	C	S	.	*			trans	-103.6	40.5	-177.6	-37.3	0	0	0	0	111.2	L488 R492 R533 P534 S535 N536	L488-S490 PolarHBondContact O-N 3.32Å; L488-S490 PolarHBondContact O-OG 2.87Å; S490-R492 PolarHBondContact O-N 3.36Å; S490-R533 CarbonylContact C-O 3.58Å; S490-R533 VanDerWaalsContact O-O 3.06Å; S490-P534 PolarHBondContact N-O 2.62Å; S490-S535 WeakPolarHBondContact OG-CA 3.49Å; S490-N536 PolarHBondContact OG-N 2.81Å
491	C	65.3	Low	57.9	Low	34 Å²	34	104 Å²	104	23%	0.23	53%	0.525	C	S	.	.			trans	-66.2	47.4	-173.8	-64.6	0	0	0	0	114.6	R533	C491-R533 WeakPolarHBondContact CA-O 3.27Å
492	R	59.9	Low	58.9	Low	149 Å²	149	99 Å²	99	56%	0.562	50%	0.503	S	S	*	.			trans	-103	142.7	-173.4	-159.2	171.3	-172.1	169.5	2.8	109.6	L2 S490 E494	L2-R492 PolarHBondContact O-NH2 3.05Å; S490-R492 PolarHBondContact O-N 3.36Å; R492-E494 PolarHBondContact O-N 2.93Å
493	M	54.4	Low	60.1	Low	130 Å²	130	98 Å²	98	64%	0.64	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	116.4	173.2	-65.7	-169.7	-66.2	0	0	109.7	M532	M493-M532 HydrophobicContact CG-CG 4.26Å; M493-M532 HydrophobicContact CG-SD 3.86Å
494	E	56.1	Low	61.2	Low	61 Å²	61	100.4 Å²	100.4	29%	0.285	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	128	174.7	-70.6	179.8	161.6	0	0	109.1	R492 P496 M531 R533 L540	R492-E494 PolarHBondContact O-N 2.93Å; E494-P496 WeakPolarHBondContact O-CD 3.07Å; E494-M531 PolarHBondContact N-O 3.27Å; E494-M531 VanDerWaalsContact O-O 3.08Å; E494-R533 VanDerWaalsContact CD-NH2 3.35Å; E494-R533 IonicContact OE1-CZ 3.15Å; E494-R533 IonicContact OE1-NE 3.78Å; E494-R533 IonicContact OE1-NH2 2.8Å; E494-R533 PolarHBondContact OE1-NH2 2.85Å; E494-R533 IonicContact OE2-CZ 2.62Å; E494-R533 VanDerWaalsContact OE2-CZ 3.3Å; E494-R533 IonicContact OE2-NE 3.09Å; E494-R533 PolarHBondContact OE2-NE 3.27Å; E494-R533 IonicContact OE2-NH2 2.67Å; E494-R533 PolarHBondContact OE2-NH2 3.33Å; E494-R533 VanDerWaalsContact OE2-NH2 3.12Å; E494-L540 HydrophobicContact CB-CD2 4.14Å; E494-L540 WeakPolarHBondContact OE2-CD2 3.41Å
495	T	53.8	Low	61.7	Low	99 Å²	99	95.3 Å²	95.3	61%	0.607	48%	0.479	S	S	*	.			trans	-112.7	55.4	-168	45.9	0	0	0	0	116.1	K497 E530	T495-K497 PolarHBondContact O-N 3.47Å; T495-E530 HydrophobicContact CG2-CG 4.42Å
496	P	58.6	Low	62.5	Low	68 Å²	68	91.2 Å²	91.2	44%	0.442	46%	0.463	S	S	.	.			trans	-67.5	111.8	156.1	-5.9	22.2	0	0	0	109.2	E494 S498 M531 L540	E494-P496 WeakPolarHBondContact O-CD 3.07Å; P496-S498 PolarHBondContact O-N 2.84Å; P496-M531 HydrophobicContact CB-CE 3.83Å; P496-M531 HydrophobicContact CG-CE 3.78Å; P496-M531 WeakPolarHBondContact O-CE 3.46Å; P496-L540 HydrophobicContact CG-CD1 4.14Å
497	K	56	Low	63	Low	205 Å²	205	98 Å²	98	89%	0.891	49%	0.486	S	S	*	.			trans	-78.3	53.9	171.1	-70.3	-180	180	171.1	0	111.2	T495 R499	T495-K497 PolarHBondContact O-N 3.47Å; K497-R499 PolarHBondContact O-N 2.86Å
498	S	59.2	Low	64.1	Low	37 Å²	37	97.8 Å²	97.8	26%	0.259	48%	0.476	S	S	.	.			trans	-67.1	118.6	175.3	175.8	0	0	0	0	110.2	P496 E500 I501	P496-S498 PolarHBondContact O-N 2.84Å; S498-E500 VanDerWaalsContact C-N 3.26Å; S498-E500 PolarHBondContact OG-N 2.64Å; S498-I501 PolarHBondContact OG-N 3.46Å
499	R	60	Low	64.8	Low	210 Å²	210	94.3 Å²	94.3	79%	0.792	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-17.9	176.3	-164.1	173.5	-177.8	178.2	-1	112.3	K497 L502	K497-R499 PolarHBondContact O-N 2.86Å; R499-L502 WeakPolarHBondContact O-CB 3.46Å
500	E	61.9	Low	65.3	Low	142 Å²	142	95.6 Å²	95.6	66%	0.664	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-43.9	-174.1	-63	160.2	163.1	0	0	111.5	S498 L502 I503 L504	S498-E500 VanDerWaalsContact C-N 3.26Å; S498-E500 PolarHBondContact OG-N 2.64Å; E500-L502 PolarHBondContact O-N 2.7Å; E500-I503 WeakPolarHBondContact O-CB 3.39Å; E500-I503 PolarHBondContact O-N 3.11Å; E500-L504 PolarHBondContact O-N 3.38Å
501	I	63.3	Low	66.3	Low	56 Å²	56	94 Å²	94	29%	0.287	45%	0.451	S	S	.	.	H	α-helix	trans	-59	-32.8	174.5	-62.3	173.5	0	0	0	110.8	S498 I503 L504 A505 M531 V542	S498-I501 PolarHBondContact OG-N 3.46Å; I501-I503 VanDerWaalsContact C-N 3.3Å; I501-I503 PolarHBondContact O-N 2.97Å; I501-L504 PolarHBondContact O-N 3.43Å; I501-A505 VanDerWaalsContact O-CB 3.27Å; I501-A505 WeakPolarHBondContact O-CB 3.32Å; I501-A505 PolarHBondContact O-N 3.12Å; I501-M531 HydrophobicContact CD1-CE 3.84Å; I501-M531 HydrophobicContact CD1-SD 3.73Å; I501-M531 HydrophobicContact CG2-SD 4.08Å; I501-V542 HydrophobicContact CG2-CG2 3.98Å
502	L	57.7	Low	67.5	Low	49 Å²	49	93.7 Å²	93.7	26%	0.257	45%	0.448	S	S	.	.	H	α-helix	trans	-66.2	-28.3	175.7	-120.2	168.4	0	0	0	113.8	R499 E500 H529	R499-L502 WeakPolarHBondContact O-CB 3.46Å; E500-L502 PolarHBondContact O-N 2.7Å; L502-H529 HydrophobicContact CD1-CB 4.18Å
503	I	61.4	Low	68.9	Low	135 Å²	135	88.6 Å²	88.6	69%	0.692	43%	0.431	S	S	*	.	H	α-helix	trans	-81.1	-43.4	174.3	-63.2	166.3	0	0	0	109.3	E500 I501 A505 D506	E500-I503 WeakPolarHBondContact O-CB 3.39Å; E500-I503 PolarHBondContact O-N 3.11Å; I501-I503 VanDerWaalsContact C-N 3.3Å; I501-I503 PolarHBondContact O-N 2.97Å; I503-A505 VanDerWaalsContact C-N 3.27Å; I503-A505 PolarHBondContact O-N 3.08Å; I503-D506 PolarHBondContact O-N 2.92Å
504	L	61.6	Low	70.3	Confident	150 Å²	150	82.6 Å²	82.6	79%	0.785	40%	0.402	S	S	*	.	H	α-helix	trans	-62	-29.5	176.1	-68.2	168.7	0	0	0	113.6	E500 I501	E500-L504 PolarHBondContact O-N 3.38Å; I501-L504 PolarHBondContact O-N 3.43Å
505	A	60.8	Low	71.4	Confident	19 Å²	19	80.1 Å²	80.1	16%	0.157	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-3.7	-177	0	0	0	0	0	115.2	I501 I503 R507 K508 M510	I501-A505 VanDerWaalsContact O-CB 3.27Å; I501-A505 WeakPolarHBondContact O-CB 3.32Å; I501-A505 PolarHBondContact O-N 3.12Å; I503-A505 VanDerWaalsContact C-N 3.27Å; I503-A505 PolarHBondContact O-N 3.08Å; A505-R507 PolarHBondContact O-N 3.13Å; A505-K508 PolarHBondContact O-N 3.39Å; A505-M510 HydrophobicContact CB-CG 4.41Å; A505-M510 HydrophobicContact CB-SD 4.39Å
506	D	73.3	Confident	72.2	Confident	101 Å²	101	80.9 Å²	80.9	54%	0.54	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.2	39.5	-179.9	-172.6	31.8	0	0	0	113.9	I503 K508	I503-D506 PolarHBondContact O-N 2.92Å; D506-K508 HydrophobicContact CB-CD 4.42Å; D506-K508 WeakPolarHBondContact O-CG 3.22Å; D506-K508 PolarHBondContact O-N 2.78Å; D506-K508 WeakPolarHBondContact OD2-CE 3.46Å; D506-K508 IonicContact OD2-NZ 3.09Å; D506-K508 PolarHBondContact OD2-NZ 3.32Å
507	R	74.8	Confident	72.8	Confident	178 Å²	178	80.8 Å²	80.8	67%	0.672	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	17.1	-176.1	-56.6	173.9	176.3	-104.2	2.9	115.4	A505 V526	A505-R507 PolarHBondContact O-N 3.13Å; R507-V526 WeakPolarHBondContact O-CB 3.39Å; R507-V526 PolarHBondContact O-N 3.26Å
508	K	84.9	Confident	73.9	Confident	87 Å²	87	77.3 Å²	77.3	38%	0.378	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-102.1	153.9	-179.3	-72.6	154	-176.2	164.3	0	111.5	A505 D506 V526	A505-K508 PolarHBondContact O-N 3.39Å; D506-K508 HydrophobicContact CB-CD 4.42Å; D506-K508 WeakPolarHBondContact O-CG 3.22Å; D506-K508 PolarHBondContact O-N 2.78Å; D506-K508 WeakPolarHBondContact OD2-CE 3.46Å; D506-K508 IonicContact OD2-NZ 3.09Å; D506-K508 PolarHBondContact OD2-NZ 3.32Å; K508-V526 VanDerWaalsContact C-CG2 3.49Å; K508-V526 WeakPolarHBondContact O-CG2 3.27Å
509	C	89.8	Confident	75.1	Confident	7 Å²	7	79.7 Å²	79.7	5%	0.047	40%	0.398	C	S	.	.			trans	-67.9	128.8	178.6	-173.8	0	0	0	0	111.5	A511 C522 G524 C544 H547	C509-A511 PolarHBondContact O-N 3.36Å; C509-A511 WeakPolarHBondContact SG-CB 3.31Å; C509-A511 PolarHBondContact SG-N 2.73Å; C509-C522 HydrophobicContact CB-CB 3.9Å; C509-G524 WeakPolarHBondContact CB-O 3.45Å; C509-G524 PolarHBondContact N-O 3.35Å; C509-C544 HydrophobicContact CB-CB 4.04Å; C509-C544 PolarHBondContact SG-N 2.67Å; C509-C544 VanDerWaalsContact SG-N 3.36Å; C509-H547 PolarHBondContact SG-CE1 2.67Å
510	M	89.6	Confident	76.4	Confident	57 Å²	57	72.6 Å²	72.6	28%	0.281	38%	0.378	S	S	.	.			trans	-80	-0	177.1	-62.9	173.2	65.2	0	0	113.5	A505 T512 L541 V542	A505-M510 HydrophobicContact CB-CG 4.41Å; A505-M510 HydrophobicContact CB-SD 4.39Å; M510-T512 PolarHBondContact O-N 3.45Å; M510-L541 HydrophobicContact CB-CB 4.28Å; M510-L541 HydrophobicContact CB-CD2 4.03Å; M510-L541 HydrophobicContact CE-CD2 4.26Å; M510-V542 HydrophobicContact CG-CB 4.29Å; M510-V542 PolarHBondContact N-O 3.28Å; M510-V542 HydrophobicContact SD-CB 3.8Å; M510-V542 HydrophobicContact SD-CG2 3.79Å; M510-V542 PolarHBondContact SD-N 3.32Å
511	A	90.5	Very high	77.6	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	38%	0.383	C	S	.	.			trans	-62.2	134.6	178.7	0	0	0	0	0	112.2	C509 C522 L543 H547 F563	C509-A511 PolarHBondContact O-N 3.36Å; C509-A511 WeakPolarHBondContact SG-CB 3.31Å; C509-A511 PolarHBondContact SG-N 2.73Å; A511-C522 HydrophobicContact CB-CB 4.04Å; A511-C522 PolarHBondContact O-N 2.81Å; A511-L543 HydrophobicContact CB-CD2 3.91Å; A511-H547 HydrophobicContact CB-CB 4.15Å; A511-H547 WeakPolarHBondContact CB-CD2 3.38Å; A511-H547 VanDerWaalsContact CB-CG 3.48Å; A511-F563 HydrophobicContact CB-CD2 3.65Å; A511-F563 HydrophobicContact CB-CE2 3.5Å; A511-F563 VanDerWaalsContact CB-CE2 3.5Å; A511-F563 HydrophobicContact CB-CZ 4.42Å
512	T	90.2	Very high	78.8	Confident	28 Å²	28	73.4 Å²	73.4	17%	0.172	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119.3	162.8	-59.3	0	0	0	0	108	M510 L519 F562 F563	M510-T512 PolarHBondContact O-N 3.45Å; T512-L519 HydrophobicContact CG2-CB 3.89Å; T512-L519 HydrophobicContact CG2-CD2 4.28Å; T512-L519 HydrophobicContact CG2-CG 4.49Å; T512-F562 HydrophobicContact CG2-CD1 3.93Å; T512-F562 HydrophobicContact CG2-CE1 4.14Å; T512-F562 WeakPolarHBondContact O-CA 3.31Å; T512-F563 PolarHBondContact O-N 2.91Å
513	E	89.3	Confident	80.2	Confident	42 Å²	42	77.6 Å²	77.6	20%	0.196	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	140.6	172.3	-63	177.7	137.3	0	0	108.8	L519 T520 H547 F563 R565	E513-L519 WeakPolarHBondContact O-CA 3.46Å; E513-T520 PolarHBondContact N-O 2.86Å; E513-T520 PolarHBondContact O-N 2.87Å; E513-H547 IonicContact OE1-NE2 2.65Å; E513-H547 PolarHBondContact OE1-NE2 3.31Å; E513-H547 IonicContact OE2-NE2 2.68Å; E513-F563 HydrophobicContact CG-CB 4.34Å; E513-R565 WeakPolarHBondContact OE1-CD 3.42Å; E513-R565 IonicContact OE1-CZ 2.65Å; E513-R565 IonicContact OE1-NE 2.75Å; E513-R565 IonicContact OE1-NH1 4Å; E513-R565 PolarHBondContact OE1-NH1 3.01Å
514	S	83.9	Confident	81.4	Confident	4 Å²	4	72.4 Å²	72.4	3%	0.028	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	127.1	170.4	-179.3	0	0	0	0	108	F563 H583	S514-F563 PolarHBondContact N-O 2.99Å; S514-H583 WeakPolarHBondContact CB-NE2 3.5Å; S514-H583 PolarHBondContact OG-NE2 3.26Å
515	V	78.6	Confident	82.6	Confident	9 Å²	9	68.6 Å²	68.6	6%	0.055	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	117.6	171.9	-176.4	0	0	0	0	109.9	G517 Q518 A566 K613	V515-G517 PolarHBondContact O-N 3.46Å; V515-Q518 PolarHBondContact N-O 2.81Å; V515-Q518 WeakPolarHBondContact O-CA 3.17Å; V515-Q518 WeakPolarHBondContact O-CB 3.48Å; V515-Q518 PolarHBondContact O-N 2.73Å; V515-A566 VanDerWaalsContact CA-O 3.31Å; V515-A566 WeakPolarHBondContact CA-O 3.37Å; V515-A566 HydrophobicContact CG1-CB 3.88Å; V515-A566 WeakPolarHBondContact CG1-O 3.46Å; V515-A566 HydrophobicContact CG2-CB 3.97Å; V515-K613 HydrophobicContact CG1-CD 4.11Å; V515-K613 HydrophobicContact CG1-CG 4.22Å
516	D	71.1	Confident	83.8	Confident	115 Å²	115	68.3 Å²	68.3	62%	0.615	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	37.2	-179.7	-52.5	-50.2	0	0	0	113	Q518 G567	D516-Q518 PolarHBondContact O-N 2.61Å; D516-G567 WeakPolarHBondContact OD1-CA 3.43Å
517	G	70.6	Confident	84	Confident	65 Å²	65	69.8 Å²	69.8	67%	0.67	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	-12.4	-175.1	0	0	0	0	0	115.1	V515	V515-G517 PolarHBondContact O-N 3.46Å
518	Q	78.9	Confident	84	Confident	132 Å²	132	66 Å²	66	62%	0.617	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	129.8	174.2	-173	170.9	71.6	0	0	110.7	V515 D516	V515-Q518 PolarHBondContact N-O 2.81Å; V515-Q518 WeakPolarHBondContact O-CA 3.17Å; V515-Q518 WeakPolarHBondContact O-CB 3.48Å; V515-Q518 PolarHBondContact O-N 2.73Å; D516-Q518 PolarHBondContact O-N 2.61Å
519	L	85.4	Confident	83.5	Confident	88 Å²	88	66.7 Å²	66.7	46%	0.461	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	128.2	-178.9	-59.8	-178.7	0	0	0	111.4	T512 E513 F562	T512-L519 HydrophobicContact CG2-CB 3.89Å; T512-L519 HydrophobicContact CG2-CD2 4.28Å; T512-L519 HydrophobicContact CG2-CG 4.49Å; E513-L519 WeakPolarHBondContact O-CA 3.46Å; L519-F562 HydrophobicContact CD1-CE1 4.2Å; L519-F562 HydrophobicContact CD1-CE2 3.76Å; L519-F562 HydrophobicContact CD1-CZ 3.57Å; L519-F562 HydrophobicContact CD2-CD1 4.4Å; L519-F562 HydrophobicContact CD2-CD2 3.57Å; L519-F562 HydrophobicContact CD2-CE1 4.44Å; L519-F562 HydrophobicContact CD2-CE2 3.63Å; L519-F562 HydrophobicContact CD2-CG 4Å; L519-F562 HydrophobicContact CD2-CZ 4.08Å; L519-F562 HydrophobicContact CG-CE2 4.36Å; L519-F562 HydrophobicContact CG-CZ 4.5Å
520	T	86.7	Confident	83	Confident	60 Å²	60	70 Å²	70	37%	0.368	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	125.4	177.8	48.1	0	0	0	0	111.4	E513	E513-T520 PolarHBondContact N-O 2.86Å; E513-T520 PolarHBondContact O-N 2.87Å
521	R	88	Confident	82.7	Confident	201 Å²	201	67.7 Å²	67.7	76%	0.758	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	131.6	174.6	-70.4	-175.4	-179.8	177.1	0.7	110.9
522	C	88.3	Confident	82.4	Confident	15 Å²	15	68 Å²	68	10%	0.101	36%	0.363	C	S	.	.			trans	-63.3	140.9	174.4	-171.3	0	0	0	0	111	C509 A511 G524 H547	C509-C522 HydrophobicContact CB-CB 3.9Å; A511-C522 HydrophobicContact CB-CB 4.04Å; A511-C522 PolarHBondContact O-N 2.81Å; C522-G524 PolarHBondContact SG-N 2.82Å; C522-H547 WeakPolarHBondContact CB-NE2 3.45Å; C522-H547 PolarHBondContact SG-CE1 2.8Å; C522-H547 PolarHBondContact SG-ND1 2.89Å; C522-H547 PolarHBondContact SG-NE2 3.46Å
523	Q	86.3	Confident	82.3	Confident	136 Å²	136	69 Å²	69	64%	0.636	36%	0.364	S	S	*	.			trans	-109.6	10.2	173.2	-61	-61.1	-40.5	0	0	112.5
524	G	87.3	Confident	82	Confident	26 Å²	26	67 Å²	67	27%	0.268	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-65.4	138.1	179.7	0	0	0	0	0	112	C509 C522	C509-G524 WeakPolarHBondContact CB-O 3.45Å; C509-G524 PolarHBondContact N-O 3.35Å; C522-G524 PolarHBondContact SG-N 2.82Å
525	A	86.6	Confident	82	Confident	71 Å²	71	67.2 Å²	67.2	59%	0.587	36%	0.356	S	S	*	.	B	Isolated β-bridge	trans	-68.6	144.6	177.4	0	0	0	0	0	111.8	C544	A525-C544 VanDerWaalsContact O-CB 3.23Å; A525-C544 WeakPolarHBondContact O-CB 3.27Å
526	V	86.4	Confident	82	Confident	13 Å²	13	72 Å²	72	8%	0.079	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-92.2	127.2	176.7	174.9	0	0	0	0	109.6	R507 K508 K528 V542	R507-V526 WeakPolarHBondContact O-CB 3.39Å; R507-V526 PolarHBondContact O-N 3.26Å; K508-V526 VanDerWaalsContact C-CG2 3.49Å; K508-V526 WeakPolarHBondContact O-CG2 3.27Å; V526-K528 WeakPolarHBondContact CG1-O 2.95Å; V526-V542 HydrophobicContact CB-CG1 4.28Å; V526-V542 HydrophobicContact CG1-CG1 3.54Å; V526-V542 HydrophobicContact CG2-CG1 3.86Å
527	L	77.8	Confident	82.2	Confident	132 Å²	132	71.3 Å²	71.3	69%	0.691	39%	0.385	S	S	*	.			trans	-104.8	-38.6	175.4	-61	179.2	0	0	0	112.5	E545	L527-E545 HydrophobicContact CD1-CG 4.36Å
528	K	74.8	Confident	82.8	Confident	99 Å²	99	69.1 Å²	69.1	43%	0.43	36%	0.359	S	S	.	.			trans	-104.3	144.1	175.6	-65.9	173.2	-172.8	153.8	0	111.6	V526 E545 R548	V526-K528 WeakPolarHBondContact CG1-O 2.95Å; K528-E545 WeakPolarHBondContact CD-OE1 3.26Å; K528-E545 VanDerWaalsContact CE-OE2 3.28Å; K528-E545 WeakPolarHBondContact CE-OE2 3.32Å; K528-E545 WeakPolarHBondContact CG-OE1 3.31Å; K528-E545 IonicContact NZ-OE2 2.69Å; K528-E545 PolarHBondContact NZ-OE2 3.37Å; K528-R548 PolarHBondContact O-NH2 3.14Å
529	H	72.8	Confident	82.9	Confident	100 Å²	100	69.4 Å²	69.4	46%	0.463	36%	0.36	S	S	.	.			trans	-103.8	6.5	-170.6	-54.8	119	0	0	0	114.6	L502	L502-H529 HydrophobicContact CD1-CB 4.18Å
530	E	80.3	Confident	82.8	Confident	77 Å²	77	67.2 Å²	67.2	36%	0.36	35%	0.349	S	S	.	.			trans	-69.1	143.1	173.7	-54.8	109.2	-175.9	0	0	110.9	T495 R548	T495-E530 HydrophobicContact CG2-CG 4.42Å; E530-R548 VanDerWaalsContact O-CZ 3.26Å; E530-R548 PolarHBondContact O-NH1 2.84Å; E530-R548 PolarHBondContact O-NH2 3.4Å; E530-R548 IonicContact OE2-NH1 3.22Å
531	M	83.8	Confident	82.8	Confident	9 Å²	9	64.8 Å²	64.8	4%	0.044	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	149.6	174.2	-64.9	-168.9	-71.8	0	0	111.1	E494 P496 I501 L540 L541 V542	E494-M531 PolarHBondContact N-O 3.27Å; E494-M531 VanDerWaalsContact O-O 3.08Å; P496-M531 HydrophobicContact CB-CE 3.83Å; P496-M531 HydrophobicContact CG-CE 3.78Å; P496-M531 WeakPolarHBondContact O-CE 3.46Å; I501-M531 HydrophobicContact CD1-CE 3.84Å; I501-M531 HydrophobicContact CD1-SD 3.73Å; I501-M531 HydrophobicContact CG2-SD 4.08Å; M531-L540 HydrophobicContact CB-CB 4.05Å; M531-L540 HydrophobicContact CB-CD1 4.49Å; M531-L540 HydrophobicContact CB-CD2 3.89Å; M531-L540 HydrophobicContact CB-CG 4.37Å; M531-L540 HydrophobicContact CE-CD1 4.09Å; M531-L540 HydrophobicContact SD-CB 4.04Å; M531-L541 WeakPolarHBondContact CA-O 3.04Å; M531-V542 HydrophobicContact CG-CG2 3.93Å; M531-V542 HydrophobicContact SD-CG2 4.25Å
532	M	83.9	Confident	82.8	Confident	7 Å²	7	55.6 Å²	55.6	3%	0.034	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	150	176.7	-61	-167.5	-59.5	0	0	110.3	M493 L541 L543 R548 M551	M493-M532 HydrophobicContact CG-CG 4.26Å; M493-M532 HydrophobicContact CG-SD 3.86Å; M532-L541 PolarHBondContact N-O 3.25Å; M532-L541 WeakPolarHBondContact O-CB 3.44Å; M532-L541 PolarHBondContact O-N 3.02Å; M532-L543 HydrophobicContact CB-CD1 4.4Å; M532-L543 HydrophobicContact CE-CD1 3.83Å; M532-R548 HydrophobicContact CE-CB 3.87Å; M532-R548 HydrophobicContact CE-CG 3.8Å; M532-M551 HydrophobicContact CB-CE 4.29Å; M532-M551 HydrophobicContact CB-CG 4.33Å; M532-M551 HydrophobicContact CE-CB 3.84Å; M532-M551 HydrophobicContact CE-CG 3.9Å; M532-M551 HydrophobicContact SD-CG 4.38Å
533	R	87.3	Confident	82.8	Confident	49 Å²	49	54.9 Å²	54.9	19%	0.185	30%	0.295	C	S	.	.			trans	-135.4	148.2	172.5	53.5	-174.9	170.3	141.9	10.9	110	S490 C491 E494 S535 N536 V538 L540	S490-R533 CarbonylContact C-O 3.58Å; S490-R533 VanDerWaalsContact O-O 3.06Å; C491-R533 WeakPolarHBondContact CA-O 3.27Å; E494-R533 VanDerWaalsContact CD-NH2 3.35Å; E494-R533 IonicContact OE1-CZ 3.15Å; E494-R533 IonicContact OE1-NE 3.78Å; E494-R533 IonicContact OE1-NH2 2.8Å; E494-R533 PolarHBondContact OE1-NH2 2.85Å; E494-R533 IonicContact OE2-CZ 2.62Å; E494-R533 VanDerWaalsContact OE2-CZ 3.3Å; E494-R533 IonicContact OE2-NE 3.09Å; E494-R533 PolarHBondContact OE2-NE 3.27Å; E494-R533 IonicContact OE2-NH2 2.67Å; E494-R533 PolarHBondContact OE2-NH2 3.33Å; E494-R533 VanDerWaalsContact OE2-NH2 3.12Å; R533-S535 WeakPolarHBondContact CD-O 3.49Å; R533-N536 VanDerWaalsContact CZ-OD1 3.26Å; R533-N536 PolarHBondContact NH1-O 3.38Å; R533-N536 PolarHBondContact NH1-OD1 2.89Å; R533-N536 PolarHBondContact NH2-OD1 3.08Å; R533-V538 WeakPolarHBondContact CB-O 3.3Å; R533-V538 VanDerWaalsContact CD-O 3.24Å; R533-V538 WeakPolarHBondContact CD-O 3.27Å; R533-L540 HydrophobicContact CB-CD2 4.18Å; R533-L540 HydrophobicContact CG-CD2 3.82Å; R533-L540 HydrophobicContact CG-CG 4.44Å
534	P	82.6	Confident	83	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.266	C	S	.	.	S	Bend	trans	-83.5	-13.1	179.1	33.3	-34.3	0	0	0	113.4	C489 S490 V538 M551 C556	C489-P534 CarbonylContact C-O 3.55Å; C489-P534 VanDerWaalsContact CA-O 3.27Å; C489-P534 WeakPolarHBondContact CA-O 3.44Å; S490-P534 PolarHBondContact N-O 2.62Å; P534-V538 HydrophobicContact CG-CB 4.01Å; P534-V538 HydrophobicContact CG-CG1 3.93Å; P534-V538 HydrophobicContact CG-CG2 4.14Å; P534-M551 HydrophobicContact CB-CE 4.49Å; P534-M551 HydrophobicContact CB-SD 3.83Å; P534-C556 HydrophobicContact CB-CB 4.45Å
535	S	84.2	Confident	83.1	Confident	7 Å²	7	49.8 Å²	49.8	5%	0.049	26%	0.264	C	S	.	.	S	Bend	trans	-159.1	165.1	178	65.4	0	0	0	0	110.6	S490 R533 S537 V538 P558	S490-S535 WeakPolarHBondContact OG-CA 3.49Å; R533-S535 WeakPolarHBondContact CD-O 3.49Å; S535-S537 PolarHBondContact O-N 3.05Å; S535-S537 PolarHBondContact OG-N 3.49Å; S535-S537 PolarHBondContact OG-OG 2.83Å; S535-V538 PolarHBondContact O-N 3.03Å; S535-V538 WeakPolarHBondContact OG-CG2 3.38Å; S535-V538 PolarHBondContact OG-N 2.83Å; S535-P558 VanDerWaalsContact CB-O 3.25Å; S535-P558 WeakPolarHBondContact CB-O 3.45Å; S535-P558 PolarHBondContact OG-O 3.42Å
536	N	78.4	Confident	83.3	Confident	111 Å²	111	51.5 Å²	51.5	59%	0.594	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.2	171.9	-81	-31.7	0	0	0	114.1	S490 R533	S490-N536 PolarHBondContact OG-N 2.81Å; R533-N536 VanDerWaalsContact CZ-OD1 3.26Å; R533-N536 PolarHBondContact NH1-O 3.38Å; R533-N536 PolarHBondContact NH1-OD1 2.89Å; R533-N536 PolarHBondContact NH2-OD1 3.08Å
537	S	76.9	Confident	83.5	Confident	99 Å²	99	51 Å²	51	69%	0.692	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-10.3	178	56.7	0	0	0	0	114	S535	S535-S537 PolarHBondContact O-N 3.05Å; S535-S537 PolarHBondContact OG-N 3.49Å; S535-S537 PolarHBondContact OG-OG 2.83Å
538	V	81.6	Confident	84	Confident	19 Å²	19	45.5 Å²	45.5	12%	0.115	23%	0.23	C	C	.	.	S	Bend	trans	-104.3	133.6	177.2	175.3	0	0	0	0	109.9	R533 P534 S535	R533-V538 WeakPolarHBondContact CB-O 3.3Å; R533-V538 VanDerWaalsContact CD-O 3.24Å; R533-V538 WeakPolarHBondContact CD-O 3.27Å; P534-V538 HydrophobicContact CG-CB 4.01Å; P534-V538 HydrophobicContact CG-CG1 3.93Å; P534-V538 HydrophobicContact CG-CG2 4.14Å; S535-V538 PolarHBondContact O-N 3.03Å; S535-V538 WeakPolarHBondContact OG-CG2 3.38Å; S535-V538 PolarHBondContact OG-N 2.83Å
539	Q	81.1	Confident	84.6	Confident	138 Å²	138	43.8 Å²	43.8	65%	0.645	23%	0.231	S	C	*	.			trans	-60.2	155.2	177.9	70.1	-179.4	13.4	0	0	112.6	L541	Q539-L541 HydrophobicContact CG-CD2 4Å; Q539-L541 PolarHBondContact O-N 3.25Å
540	L	84.6	Confident	85.2	Confident	42 Å²	42	39.1 Å²	39.1	22%	0.22	21%	0.21	C	C	.	.			trans	-62.9	130.7	173.9	-80.9	170.3	0	0	0	111.7	E494 P496 M531 R533	E494-L540 HydrophobicContact CB-CD2 4.14Å; E494-L540 WeakPolarHBondContact OE2-CD2 3.41Å; P496-L540 HydrophobicContact CG-CD1 4.14Å; M531-L540 HydrophobicContact CB-CB 4.05Å; M531-L540 HydrophobicContact CB-CD1 4.49Å; M531-L540 HydrophobicContact CB-CD2 3.89Å; M531-L540 HydrophobicContact CB-CG 4.37Å; M531-L540 HydrophobicContact CE-CD1 4.09Å; M531-L540 HydrophobicContact SD-CB 4.04Å; R533-L540 HydrophobicContact CB-CD2 4.18Å; R533-L540 HydrophobicContact CG-CD2 3.82Å; R533-L540 HydrophobicContact CG-CG 4.44Å
541	L	85.9	Confident	85.5	Confident	10 Å²	10	35.5 Å²	35.5	5%	0.052	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.3	-178.1	-55.3	179.4	0	0	0	111.3	M510 M531 M532 Q539 L543 F563	M510-L541 HydrophobicContact CB-CB 4.28Å; M510-L541 HydrophobicContact CB-CD2 4.03Å; M510-L541 HydrophobicContact CE-CD2 4.26Å; M531-L541 WeakPolarHBondContact CA-O 3.04Å; M532-L541 PolarHBondContact N-O 3.25Å; M532-L541 WeakPolarHBondContact O-CB 3.44Å; M532-L541 PolarHBondContact O-N 3.02Å; Q539-L541 HydrophobicContact CG-CD2 4Å; Q539-L541 PolarHBondContact O-N 3.25Å; L541-L543 HydrophobicContact CB-CD1 4.49Å; L541-L543 HydrophobicContact CB-CD2 3.76Å; L541-L543 HydrophobicContact CB-CG 4.03Å; L541-L543 HydrophobicContact CD1-CD2 4.24Å; L541-F563 HydrophobicContact CD1-CE2 4.4Å
542	V	87	Confident	85.5	Confident	7 Å²	7	40.4 Å²	40.4	4%	0.042	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	125.9	165	-173.8	0	0	0	0	108.5	I501 M510 V526 M531	I501-V542 HydrophobicContact CG2-CG2 3.98Å; M510-V542 HydrophobicContact CG-CB 4.29Å; M510-V542 PolarHBondContact N-O 3.28Å; M510-V542 HydrophobicContact SD-CB 3.8Å; M510-V542 HydrophobicContact SD-CG2 3.79Å; M510-V542 PolarHBondContact SD-N 3.32Å; V526-V542 HydrophobicContact CB-CG1 4.28Å; V526-V542 HydrophobicContact CG1-CG1 3.54Å; V526-V542 HydrophobicContact CG2-CG1 3.86Å; M531-V542 HydrophobicContact CG-CG2 3.93Å; M531-V542 HydrophobicContact SD-CG2 4.25Å
543	L	88.9	Confident	85.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.248	C	C	.	.			trans	-126.7	145.5	-166	-59.6	174.4	0	0	0	113.2	A511 M532 L541 H547 R548 M551 F563	A511-L543 HydrophobicContact CB-CD2 3.91Å; M532-L543 HydrophobicContact CB-CD1 4.4Å; M532-L543 HydrophobicContact CE-CD1 3.83Å; L541-L543 HydrophobicContact CB-CD1 4.49Å; L541-L543 HydrophobicContact CB-CD2 3.76Å; L541-L543 HydrophobicContact CB-CG 4.03Å; L541-L543 HydrophobicContact CD1-CD2 4.24Å; L543-H547 HydrophobicContact CB-CB 4.13Å; L543-H547 HydrophobicContact CD2-CB 4.13Å; L543-R548 HydrophobicContact CB-CG 3.77Å; L543-R548 PolarHBondContact O-NE 3.49Å; L543-R548 PolarHBondContact O-NH2 2.81Å; L543-R548 VanDerWaalsContact O-NH2 3.17Å; L543-M551 HydrophobicContact CD1-CB 4.45Å; L543-M551 HydrophobicContact CD1-CE 3.72Å; L543-F563 HydrophobicContact CD1-CZ 4.05Å; L543-F563 HydrophobicContact CD2-CE2 4.11Å; L543-F563 HydrophobicContact CD2-CZ 4.08Å
544	C	90.8	Very high	85.3	Confident	4 Å²	4	45.7 Å²	45.7	3%	0.027	25%	0.248	C	C	.	.			trans	-73.7	160.1	165.1	68.5	0	0	0	0	111.1	C509 A525 D546 H547 R548	C509-C544 HydrophobicContact CB-CB 4.04Å; C509-C544 PolarHBondContact SG-N 2.67Å; C509-C544 VanDerWaalsContact SG-N 3.36Å; A525-C544 VanDerWaalsContact O-CB 3.23Å; A525-C544 WeakPolarHBondContact O-CB 3.27Å; C544-D546 VanDerWaalsContact C-N 3.26Å; C544-D546 PolarHBondContact O-N 3.24Å; C544-D546 VanDerWaalsContact O-N 3.15Å; C544-H547 CarbonylContact O-C 3.6Å; C544-H547 WeakPolarHBondContact O-CA 3.46Å; C544-H547 PolarHBondContact O-N 3.46Å; C544-H547 PolarHBondContact SG-CE1 2.95Å; C544-H547 PolarHBondContact SG-ND1 3.2Å; C544-R548 WeakPolarHBondContact O-CG 3.43Å; C544-R548 PolarHBondContact O-N 3.49Å
545	E	90.3	Very high	85.4	Confident	51 Å²	51	47.9 Å²	47.9	24%	0.238	26%	0.258	C	S	.	.	H	α-helix	trans	-55.5	-35.7	-173.1	-58.6	-55.8	118.6	0	0	113.9	L527 K528 H547 R548 S549	L527-E545 HydrophobicContact CD1-CG 4.36Å; K528-E545 WeakPolarHBondContact CD-OE1 3.26Å; K528-E545 VanDerWaalsContact CE-OE2 3.28Å; K528-E545 WeakPolarHBondContact CE-OE2 3.32Å; K528-E545 WeakPolarHBondContact CG-OE1 3.31Å; K528-E545 IonicContact NZ-OE2 2.69Å; K528-E545 PolarHBondContact NZ-OE2 3.37Å; E545-H547 VanDerWaalsContact C-N 3.35Å; E545-H547 PolarHBondContact O-N 2.79Å; E545-R548 PolarHBondContact O-N 2.86Å; E545-R548 IonicContact OE1-NE 2.69Å; E545-S549 WeakPolarHBondContact O-CB 3.41Å; E545-S549 PolarHBondContact O-N 2.94Å; E545-S549 PolarHBondContact O-OG 2.56Å
546	D	90.1	Very high	85.6	Confident	107 Å²	107	47.6 Å²	47.6	57%	0.572	26%	0.256	S	S	*	.	H	α-helix	trans	-64.8	-40.5	176.3	-46.9	-46	0	0	0	111.6	C544 S549 G550 R565	C544-D546 VanDerWaalsContact C-N 3.26Å; C544-D546 PolarHBondContact O-N 3.24Å; C544-D546 VanDerWaalsContact O-N 3.15Å; D546-S549 PolarHBondContact O-N 2.8Å; D546-G550 PolarHBondContact O-N 3.27Å; D546-R565 VanDerWaalsContact CB-NH2 3.32Å; D546-R565 PolarHBondContact O-NH2 2.84Å
547	H	90.1	Very high	86.1	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.019	23%	0.228	C	C	.	.	H	α-helix	trans	-77.5	-30.7	179.2	-81.1	104.2	0	0	0	112.1	C509 A511 E513 C522 L543 C544 E545 G550 M551 F563 R565	C509-H547 PolarHBondContact SG-CE1 2.67Å; A511-H547 HydrophobicContact CB-CB 4.15Å; A511-H547 WeakPolarHBondContact CB-CD2 3.38Å; A511-H547 VanDerWaalsContact CB-CG 3.48Å; E513-H547 IonicContact OE1-NE2 2.65Å; E513-H547 PolarHBondContact OE1-NE2 3.31Å; E513-H547 IonicContact OE2-NE2 2.68Å; C522-H547 WeakPolarHBondContact CB-NE2 3.45Å; C522-H547 PolarHBondContact SG-CE1 2.8Å; C522-H547 PolarHBondContact SG-ND1 2.89Å; C522-H547 PolarHBondContact SG-NE2 3.46Å; L543-H547 HydrophobicContact CB-CB 4.13Å; L543-H547 HydrophobicContact CD2-CB 4.13Å; C544-H547 CarbonylContact O-C 3.6Å; C544-H547 WeakPolarHBondContact O-CA 3.46Å; C544-H547 PolarHBondContact O-N 3.46Å; C544-H547 PolarHBondContact SG-CE1 2.95Å; C544-H547 PolarHBondContact SG-ND1 3.2Å; E545-H547 VanDerWaalsContact C-N 3.35Å; E545-H547 PolarHBondContact O-N 2.79Å; H547-G550 PolarHBondContact O-N 2.89Å; H547-M551 WeakPolarHBondContact O-CB 3.49Å; H547-M551 PolarHBondContact O-N 2.79Å; H547-F563 HydrophobicContact CB-CE1 4.35Å; H547-F563 HydrophobicContact CB-CZ 4.16Å; H547-F563 AromaticContact CD2-CD1 3.65Å; H547-F563 AromaticContact CD2-CD2 3.59Å; H547-F563 AromaticContact CD2-CE1 3.85Å; H547-F563 AromaticContact CD2-CE2 3.81Å; H547-F563 AromaticContact CD2-CG 3.48Å; H547-F563 VanDerWaalsContact CD2-CG 3.48Å; H547-F563 WeakPolarHBondContact CD2-CG 3.48Å; H547-F563 AromaticContact CD2-CZ 3.92Å; H547-F563 WeakPolarHBondContact O-CE1 3.14Å; H547-R565 PolarHBondContact NE2-NH1 2.86Å
548	R	88.4	Confident	86.5	Confident	15 Å²	15	37.7 Å²	37.7	6%	0.057	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-48.1	165.9	-63.4	-177.2	-179.8	-78.1	-12.8	110.8	K528 E530 M532 L543 C544 E545 G550 M551 V552	K528-R548 PolarHBondContact O-NH2 3.14Å; E530-R548 VanDerWaalsContact O-CZ 3.26Å; E530-R548 PolarHBondContact O-NH1 2.84Å; E530-R548 PolarHBondContact O-NH2 3.4Å; E530-R548 IonicContact OE2-NH1 3.22Å; M532-R548 HydrophobicContact CE-CB 3.87Å; M532-R548 HydrophobicContact CE-CG 3.8Å; L543-R548 HydrophobicContact CB-CG 3.77Å; L543-R548 PolarHBondContact O-NE 3.49Å; L543-R548 PolarHBondContact O-NH2 2.81Å; L543-R548 VanDerWaalsContact O-NH2 3.17Å; C544-R548 WeakPolarHBondContact O-CG 3.43Å; C544-R548 PolarHBondContact O-N 3.49Å; E545-R548 PolarHBondContact O-N 2.86Å; E545-R548 IonicContact OE1-NE 2.69Å; R548-G550 VanDerWaalsContact C-N 3.27Å; R548-G550 PolarHBondContact O-N 2.79Å; R548-M551 WeakPolarHBondContact O-CB 3.27Å; R548-M551 PolarHBondContact O-N 3.01Å; R548-M551 VanDerWaalsContact O-N 3.16Å; R548-V552 WeakPolarHBondContact O-CG2 3.46Å; R548-V552 PolarHBondContact O-N 2.95Å
549	S	86.6	Confident	86.6	Confident	64 Å²	64	38.9 Å²	38.9	45%	0.448	21%	0.212	S	C	.	.	H	α-helix	trans	-62.1	-33	176.9	-56.4	0	0	0	0	112.7	E545 D546 K553	E545-S549 WeakPolarHBondContact O-CB 3.41Å; E545-S549 PolarHBondContact O-N 2.94Å; E545-S549 PolarHBondContact O-OG 2.56Å; D546-S549 PolarHBondContact O-N 2.8Å; S549-K553 WeakPolarHBondContact O-CB 3.49Å; S549-K553 VanDerWaalsContact O-CG 3.27Å; S549-K553 WeakPolarHBondContact O-CG 3.18Å; S549-K553 PolarHBondContact O-N 3.04Å
550	G	86.6	Confident	86.7	Confident	2 Å²	2	34.1 Å²	34.1	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-70.4	-41.7	172.6	0	0	0	0	0	113.2	D546 H547 R548 K553 H554 Q555	D546-G550 PolarHBondContact O-N 3.27Å; H547-G550 PolarHBondContact O-N 2.89Å; R548-G550 VanDerWaalsContact C-N 3.27Å; R548-G550 PolarHBondContact O-N 2.79Å; G550-K553 CarbonylContact O-C 3.46Å; G550-K553 PolarHBondContact O-N 3.49Å; G550-H554 PolarHBondContact O-N 3.35Å; G550-Q555 PolarHBondContact O-N 3.47Å
551	M	86.5	Confident	86.8	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-61.6	-48.5	176.6	-174.4	76.6	73.6	0	0	111.1	M532 P534 L543 H547 R548 K553 H554 C556 F563	M532-M551 HydrophobicContact CB-CE 4.29Å; M532-M551 HydrophobicContact CB-CG 4.33Å; M532-M551 HydrophobicContact CE-CB 3.84Å; M532-M551 HydrophobicContact CE-CG 3.9Å; M532-M551 HydrophobicContact SD-CG 4.38Å; P534-M551 HydrophobicContact CB-CE 4.49Å; P534-M551 HydrophobicContact CB-SD 3.83Å; L543-M551 HydrophobicContact CD1-CB 4.45Å; L543-M551 HydrophobicContact CD1-CE 3.72Å; H547-M551 WeakPolarHBondContact O-CB 3.49Å; H547-M551 PolarHBondContact O-N 2.79Å; R548-M551 WeakPolarHBondContact O-CB 3.27Å; R548-M551 PolarHBondContact O-N 3.01Å; R548-M551 VanDerWaalsContact O-N 3.16Å; M551-K553 PolarHBondContact O-N 2.9Å; M551-H554 PolarHBondContact O-CD2 3.16Å; M551-H554 PolarHBondContact O-N 3.38Å; M551-C556 PolarHBondContact SD-SG 3.39Å; M551-F563 HydrophobicContact CB-CE1 4.32Å; M551-F563 HydrophobicContact CE-CZ 3.9Å
552	V	84.2	Confident	87	Confident	112 Å²	112	34.7 Å²	34.7	68%	0.679	20%	0.195	S	C	*	.	H	α-helix	trans	-63.9	-25.4	178.3	174.5	0	0	0	0	112.4	R548 H554	R548-V552 WeakPolarHBondContact O-CG2 3.46Å; R548-V552 PolarHBondContact O-N 2.95Å; V552-H554 VanDerWaalsContact C-N 3.34Å
553	K	84.1	Confident	87	Confident	126 Å²	126	34.3 Å²	34.3	55%	0.548	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	9.7	173.5	-68.2	178	-178.8	-175.6	0	113.7	S549 G550 M551 Q555	S549-K553 WeakPolarHBondContact O-CB 3.49Å; S549-K553 VanDerWaalsContact O-CG 3.27Å; S549-K553 WeakPolarHBondContact O-CG 3.18Å; S549-K553 PolarHBondContact O-N 3.04Å; G550-K553 CarbonylContact O-C 3.46Å; G550-K553 PolarHBondContact O-N 3.49Å; M551-K553 PolarHBondContact O-N 2.9Å; K553-Q555 HydrophobicContact CB-CG 3.93Å; K553-Q555 WeakPolarHBondContact O-CG 3.38Å; K553-Q555 PolarHBondContact O-N 2.85Å
554	H	83.4	Confident	86.5	Confident	41 Å²	41	34.3 Å²	34.3	19%	0.19	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	29.9	-178.5	-64.1	178.5	0	0	0	114.1	G550 M551 V552 C556 H580 H598	G550-H554 PolarHBondContact O-N 3.35Å; M551-H554 PolarHBondContact O-CD2 3.16Å; M551-H554 PolarHBondContact O-N 3.38Å; V552-H554 VanDerWaalsContact C-N 3.34Å; H554-C556 PolarHBondContact O-N 3.47Å; H554-C556 VanDerWaalsContact O-N 3.15Å; H554-H580 AromaticContact CE1-NE2 3.94Å; H554-H580 AromaticContact CG-CD2 3.89Å; H554-H580 AromaticContact CG-NE2 3.89Å; H554-H580 AromaticContact ND1-CD2 3.41Å; H554-H580 PolarHBondContact ND1-CD2 3.47Å; H554-H580 AromaticContact ND1-NE2 2.96Å; H554-H580 PolarHBondContact ND1-NE2 3.09Å; H554-H598 VanDerWaalsContact CA-CE1 3.47Å; H554-H598 WeakPolarHBondContact CA-CE1 3.36Å; H554-H598 PolarHBondContact O-CE1 3.43Å; H554-H598 PolarHBondContact O-NE2 3.31Å
555	Q	84.6	Confident	85.7	Confident	46 Å²	46	37.4 Å²	37.4	22%	0.215	20%	0.204	C	C	.	.			trans	-88.2	35.1	-179.7	-59.6	-177.5	-11.9	0	0	112.7	G550 K553 C564	G550-Q555 PolarHBondContact O-N 3.47Å; K553-Q555 HydrophobicContact CB-CG 3.93Å; K553-Q555 WeakPolarHBondContact O-CG 3.38Å; K553-Q555 PolarHBondContact O-N 2.85Å; Q555-C564 PolarHBondContact O-N 2.88Å
556	C	87.9	Confident	84.9	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-142.2	131.8	-175.6	48.8	0	0	0	0	109.2	P534 M551 H554 P558 F562 F563 H598	P534-C556 HydrophobicContact CB-CB 4.45Å; M551-C556 PolarHBondContact SD-SG 3.39Å; H554-C556 PolarHBondContact O-N 3.47Å; H554-C556 VanDerWaalsContact O-N 3.15Å; C556-P558 VanDerWaalsContact O-CD 3.32Å; C556-P558 WeakPolarHBondContact O-CD 3.5Å; C556-F562 CarbonylContact C-O 3.6Å; C556-F562 WeakPolarHBondContact CA-O 3.5Å; C556-F563 HydrophobicContact CB-CD1 3.79Å; C556-F563 HydrophobicContact CB-CE1 3.88Å; C556-F563 HydrophobicContact CB-CG 4.29Å; C556-F563 HydrophobicContact CB-CZ 4.42Å; C556-H598 PolarHBondContact O-CE1 2.86Å; C556-H598 PolarHBondContact O-NE2 3.47Å
557	C	87.9	Confident	84.3	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.17	C	C	.	.			trans	-76	118.7	-175.8	-174	0	0	0	0	110.9	G559 C560 G561 F562 C586	C557-G559 VanDerWaalsContact C-N 3.26Å; C557-G559 PolarHBondContact O-N 2.91Å; C557-C560 VanDerWaalsContact CB-SG 3.55Å; C557-C560 PolarHBondContact O-N 2.89Å; C557-G561 WeakPolarHBondContact O-CA 3.31Å; C557-G561 PolarHBondContact O-N 3.32Å; C557-F562 PolarHBondContact N-O 2.85Å; C557-C586 WeakPolarHBondContact SG-CB 3.49Å
558	P	86.1	Confident	83.9	Confident	3 Å²	3	32.9 Å²	32.9	2%	0.019	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-27	-178.2	-20.8	34.2	0	0	0	113.2	C489 S535 C556 P597	C489-P558 HydrophobicContact CB-CB 4.21Å; C489-P558 HydrophobicContact CB-CG 3.67Å; S535-P558 VanDerWaalsContact CB-O 3.25Å; S535-P558 WeakPolarHBondContact CB-O 3.45Å; S535-P558 PolarHBondContact OG-O 3.42Å; C556-P558 VanDerWaalsContact O-CD 3.32Å; C556-P558 WeakPolarHBondContact O-CD 3.5Å; P558-P597 HydrophobicContact CB-CB 4.22Å; P558-P597 HydrophobicContact CG-CB 4.23Å; P558-P597 HydrophobicContact CG-CG 4.29Å
559	G	82.6	Confident	83.9	Confident	44 Å²	44	32.5 Å²	32.5	45%	0.454	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-20.3	179.5	0	0	0	0	0	115.3	C557	C557-G559 VanDerWaalsContact C-N 3.26Å; C557-G559 PolarHBondContact O-N 2.91Å
560	C	85.3	Confident	84	Confident	37 Å²	37	30.6 Å²	30.6	25%	0.25	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-137.3	-6.7	-177	71.2	0	0	0	0	115.4	C557 F562 H583	C557-C560 VanDerWaalsContact CB-SG 3.55Å; C557-C560 PolarHBondContact O-N 2.89Å; C560-F562 VanDerWaalsContact C-N 3.27Å; C560-F562 HydrophobicContact CB-CD2 4.09Å; C560-F562 HydrophobicContact CB-CE2 4.13Å; C560-F562 PolarHBondContact O-N 2.95Å; C560-F562 WeakPolarHBondContact SG-CD2 3.47Å; C560-H583 PolarHBondContact SG-CE1 3.26Å; C560-H583 PolarHBondContact SG-ND1 2.93Å; C560-H583 VanDerWaalsContact SG-ND1 3.37Å
561	G	86	Confident	84.1	Confident	6 Å²	6	31.4 Å²	31.4	6%	0.062	17%	0.172	C	C	.	.			trans	78	-1.6	176.4	0	0	0	0	0	116.1	C557	C557-G561 WeakPolarHBondContact O-CA 3.31Å; C557-G561 PolarHBondContact O-N 3.32Å
562	F	89.4	Confident	84.3	Confident	58 Å²	58	31.7 Å²	31.7	25%	0.254	17%	0.174	S	C	.	.			trans	-83.5	148.4	-177.2	-51.7	-34.6	0	0	0	112.9	T512 L519 C556 C557 C560 H583	T512-F562 HydrophobicContact CG2-CD1 3.93Å; T512-F562 HydrophobicContact CG2-CE1 4.14Å; T512-F562 WeakPolarHBondContact O-CA 3.31Å; L519-F562 HydrophobicContact CD1-CE1 4.2Å; L519-F562 HydrophobicContact CD1-CE2 3.76Å; L519-F562 HydrophobicContact CD1-CZ 3.57Å; L519-F562 HydrophobicContact CD2-CD1 4.4Å; L519-F562 HydrophobicContact CD2-CD2 3.57Å; L519-F562 HydrophobicContact CD2-CE1 4.44Å; L519-F562 HydrophobicContact CD2-CE2 3.63Å; L519-F562 HydrophobicContact CD2-CG 4Å; L519-F562 HydrophobicContact CD2-CZ 4.08Å; L519-F562 HydrophobicContact CG-CE2 4.36Å; L519-F562 HydrophobicContact CG-CZ 4.5Å; C556-F562 CarbonylContact C-O 3.6Å; C556-F562 WeakPolarHBondContact CA-O 3.5Å; C557-F562 PolarHBondContact N-O 2.85Å; C560-F562 VanDerWaalsContact C-N 3.27Å; C560-F562 HydrophobicContact CB-CD2 4.09Å; C560-F562 HydrophobicContact CB-CE2 4.13Å; C560-F562 PolarHBondContact O-N 2.95Å; C560-F562 WeakPolarHBondContact SG-CD2 3.47Å; F562-H583 WeakPolarHBondContact CB-CE1 3.37Å; F562-H583 AromaticContact CD2-CE1 3.57Å; F562-H583 AromaticContact CG-CE1 3.85Å
563	F	88.1	Confident	84.3	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	121.9	176.3	-71.8	-92.8	0	0	0	111.4	A511 T512 E513 S514 L541 L543 H547 M551 C556 R565	A511-F563 HydrophobicContact CB-CD2 3.65Å; A511-F563 HydrophobicContact CB-CE2 3.5Å; A511-F563 VanDerWaalsContact CB-CE2 3.5Å; A511-F563 HydrophobicContact CB-CZ 4.42Å; T512-F563 PolarHBondContact O-N 2.91Å; E513-F563 HydrophobicContact CG-CB 4.34Å; S514-F563 PolarHBondContact N-O 2.99Å; L541-F563 HydrophobicContact CD1-CE2 4.4Å; L543-F563 HydrophobicContact CD1-CZ 4.05Å; L543-F563 HydrophobicContact CD2-CE2 4.11Å; L543-F563 HydrophobicContact CD2-CZ 4.08Å; H547-F563 HydrophobicContact CB-CE1 4.35Å; H547-F563 HydrophobicContact CB-CZ 4.16Å; H547-F563 AromaticContact CD2-CD1 3.65Å; H547-F563 AromaticContact CD2-CD2 3.59Å; H547-F563 AromaticContact CD2-CE1 3.85Å; H547-F563 AromaticContact CD2-CE2 3.81Å; H547-F563 AromaticContact CD2-CG 3.48Å; H547-F563 VanDerWaalsContact CD2-CG 3.48Å; H547-F563 WeakPolarHBondContact CD2-CG 3.48Å; H547-F563 AromaticContact CD2-CZ 3.92Å; H547-F563 WeakPolarHBondContact O-CE1 3.14Å; M551-F563 HydrophobicContact CB-CE1 4.32Å; M551-F563 HydrophobicContact CE-CZ 3.9Å; C556-F563 HydrophobicContact CB-CD1 3.79Å; C556-F563 HydrophobicContact CB-CE1 3.88Å; C556-F563 HydrophobicContact CB-CG 4.29Å; C556-F563 HydrophobicContact CB-CZ 4.42Å; F563-R565 HydrophobicContact CB-CG 4.41Å; F563-R565 PolarHBondContact O-N 2.99Å
564	C	76.9	Confident	83.9	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	73.2	-171.8	-61.7	0	0	0	0	110.3	Q555 F569 R581 H583	Q555-C564 PolarHBondContact O-N 2.88Å; C564-F569 VanDerWaalsContact CA-CZ 3.47Å; C564-F569 HydrophobicContact CB-CD1 3.63Å; C564-F569 HydrophobicContact CB-CD2 3.94Å; C564-F569 HydrophobicContact CB-CE1 3.52Å; C564-F569 HydrophobicContact CB-CE2 3.83Å; C564-F569 HydrophobicContact CB-CG 3.84Å; C564-F569 HydrophobicContact CB-CZ 3.62Å; C564-R581 HydrophobicContact CB-CB 4.09Å; C564-H583 PolarHBondContact SG-CE1 2.9Å
565	R	73.9	Confident	83.3	Confident	69 Å²	69	30.5 Å²	30.5	26%	0.26	17%	0.17	S	C	.	.			trans	-98.2	-31.3	-168.2	-78.8	174.1	157.7	-155.3	-7	115.1	E513 D546 H547 F563 I611	E513-R565 WeakPolarHBondContact OE1-CD 3.42Å; E513-R565 IonicContact OE1-CZ 2.65Å; E513-R565 IonicContact OE1-NE 2.75Å; E513-R565 IonicContact OE1-NH1 4Å; E513-R565 PolarHBondContact OE1-NH1 3.01Å; D546-R565 VanDerWaalsContact CB-NH2 3.32Å; D546-R565 PolarHBondContact O-NH2 2.84Å; H547-R565 PolarHBondContact NE2-NH1 2.86Å; F563-R565 HydrophobicContact CB-CG 4.41Å; F563-R565 PolarHBondContact O-N 2.99Å; R565-I611 WeakPolarHBondContact O-CG2 3.45Å
566	A	74.4	Confident	82.6	Confident	9 Å²	9	36 Å²	36	7%	0.074	21%	0.206	C	C	.	.	S	Bend	trans	-149.5	156.6	176	0	0	0	0	0	109.6	V515 F569 I611 K613	V515-A566 VanDerWaalsContact CA-O 3.31Å; V515-A566 WeakPolarHBondContact CA-O 3.37Å; V515-A566 HydrophobicContact CG1-CB 3.88Å; V515-A566 WeakPolarHBondContact CG1-O 3.46Å; V515-A566 HydrophobicContact CG2-CB 3.97Å; A566-F569 VanDerWaalsContact O-CE2 3.24Å; A566-F569 WeakPolarHBondContact O-CE2 3.39Å; A566-F569 WeakPolarHBondContact O-CZ 3.5Å; A566-I611 CarbonylContact C-O 3.42Å; A566-I611 VanDerWaalsContact CA-O 3.29Å; A566-I611 WeakPolarHBondContact CA-O 3.37Å; A566-I611 WeakPolarHBondContact CB-O 3.05Å; A566-K613 HydrophobicContact CB-CG 3.8Å
567	G	78.1	Confident	81.9	Confident	2 Å²	2	41 Å²	41	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	91.9	-167.7	-169.9	0	0	0	0	0	113.3	D516 F569 T610 I611	D516-G567 WeakPolarHBondContact OD1-CA 3.43Å; G567-F569 WeakPolarHBondContact O-CD2 3.44Å; G567-F569 WeakPolarHBondContact O-CE2 3.49Å; G567-T610 WeakPolarHBondContact O-CA 3.32Å; G567-I611 PolarHBondContact N-O 3.34Å; G567-I611 PolarHBondContact O-N 3.09Å
568	T	81.5	Confident	81.4	Confident	55 Å²	55	44.4 Å²	44.4	34%	0.337	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	129	-171.7	-51.4	0	0	0	0	113.2	E608 V609 T610	T568-E608 HydrophobicContact CG2-CG 3.47Å; T568-E608 VanDerWaalsContact CG2-CG 3.47Å; T568-E608 VanDerWaalsContact CG2-OE1 3.24Å; T568-E608 WeakPolarHBondContact CG2-OE1 3.19Å; T568-V609 WeakPolarHBondContact CA-O 3.34Å; T568-T610 WeakPolarHBondContact CG2-OG1 3.41Å; T568-T610 WeakPolarHBondContact OG1-CG2 3.47Å; T568-T610 PolarHBondContact OG1-OG1 3.27Å
569	F	87.8	Confident	81.4	Confident	7 Å²	7	45.6 Å²	45.6	3%	0.031	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	164	-178.6	-51.4	-71.7	0	0	0	111.8	C564 A566 G567 H583 E608 V609	C564-F569 VanDerWaalsContact CA-CZ 3.47Å; C564-F569 HydrophobicContact CB-CD1 3.63Å; C564-F569 HydrophobicContact CB-CD2 3.94Å; C564-F569 HydrophobicContact CB-CE1 3.52Å; C564-F569 HydrophobicContact CB-CE2 3.83Å; C564-F569 HydrophobicContact CB-CG 3.84Å; C564-F569 HydrophobicContact CB-CZ 3.62Å; A566-F569 VanDerWaalsContact O-CE2 3.24Å; A566-F569 WeakPolarHBondContact O-CE2 3.39Å; A566-F569 WeakPolarHBondContact O-CZ 3.5Å; G567-F569 WeakPolarHBondContact O-CD2 3.44Å; G567-F569 WeakPolarHBondContact O-CE2 3.49Å; F569-H583 AromaticContact CD1-CD2 3.82Å; F569-H583 AromaticContact CD1-NE2 3.93Å; F569-H583 AromaticContact CE1-CD2 3.89Å; F569-H583 AromaticContact CE1-NE2 3.23Å; F569-H583 WeakPolarHBondContact CE1-NE2 3.37Å; F569-E608 WeakPolarHBondContact O-CA 3.32Å; F569-V609 PolarHBondContact N-O 3.12Å; F569-V609 PolarHBondContact O-N 3.48Å
570	M	88.6	Confident	81.6	Confident	24 Å²	24	44.2 Å²	44.2	12%	0.118	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	129.8	162.4	-58.1	-54.1	-61.6	0	0	109.1	R581 F582 Q584 A606 E608	M570-R581 WeakPolarHBondContact O-CA 3.39Å; M570-F582 HydrophobicContact CB-CD1 4.03Å; M570-F582 HydrophobicContact CB-CD2 4.02Å; M570-F582 HydrophobicContact CB-CE1 3.7Å; M570-F582 HydrophobicContact CB-CE2 3.69Å; M570-F582 HydrophobicContact CB-CG 4.18Å; M570-F582 HydrophobicContact CB-CZ 3.51Å; M570-F582 HydrophobicContact CG-CD2 4.46Å; M570-F582 HydrophobicContact CG-CE2 4.04Å; M570-F582 HydrophobicContact CG-CZ 4.24Å; M570-F582 PolarHBondContact N-O 3.23Å; M570-F582 PolarHBondContact O-N 3.21Å; M570-Q584 HydrophobicContact CG-CB 3.98Å; M570-Q584 HydrophobicContact CG-CG 4.37Å; M570-Q584 HydrophobicContact SD-CB 4.4Å; M570-Q584 HydrophobicContact SD-CG 4.43Å; M570-A606 HydrophobicContact CB-CB 4.22Å; M570-A606 HydrophobicContact CE-CB 3.84Å; M570-A606 VanDerWaalsContact CE-O 3.3Å; M570-A606 WeakPolarHBondContact CE-O 3.41Å; M570-E608 HydrophobicContact SD-CB 4.38Å
571	E	88.9	Confident	81.7	Confident	19 Å²	19	44.2 Å²	44.2	9%	0.089	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	123.3	173.4	-168.5	178.6	107.6	0	0	110.3	Q573 S579 H580 R581 A606 K607 V609	E571-Q573 PolarHBondContact OE1-NE2 3.21Å; E571-S579 WeakPolarHBondContact OE1-CB 3.4Å; E571-H580 VanDerWaalsContact CA-O 3.31Å; E571-H580 WeakPolarHBondContact CA-O 3.46Å; E571-R581 HydrophobicContact CB-CG 4.42Å; E571-R581 HydrophobicContact CG-CG 4.13Å; E571-R581 IonicContact OE2-CZ 2.8Å; E571-R581 IonicContact OE2-NE 2.75Å; E571-R581 PolarHBondContact OE2-NE 3.06Å; E571-R581 IonicContact OE2-NH2 3.58Å; E571-R581 PolarHBondContact OE2-NH2 3.13Å; E571-A606 CarbonylContact O-C 3.51Å; E571-A606 WeakPolarHBondContact O-CA 3.06Å; E571-K607 PolarHBondContact N-O 3.31Å; E571-K607 PolarHBondContact O-N 3.36Å; E571-V609 HydrophobicContact CB-CB 4.23Å; E571-V609 HydrophobicContact CB-CG2 3.73Å
572	C	89.7	Confident	81.9	Confident	8 Å²	8	44 Å²	44	5%	0.054	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	159.9	164.3	73	0	0	0	0	110.8	S579 H580 C596 C599 E601 A606	C572-S579 WeakPolarHBondContact O-CA 3.18Å; C572-H580 PolarHBondContact N-O 3.36Å; C572-H580 VanDerWaalsContact N-O 3.09Å; C572-H580 PolarHBondContact O-N 2.85Å; C572-C596 PolarHBondContact SG-SG 2.99Å; C572-C599 PolarHBondContact SG-SG 2.7Å; C572-E601 PolarHBondContact SG-OE2 3.16Å; C572-A606 HydrophobicContact CB-CB 3.9Å
573	Q	84.4	Confident	81.8	Confident	110 Å²	110	42.9 Å²	42.9	51%	0.514	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	75.9	-172.8	-67.8	175.5	-1.7	0	0	107.8	E571 D575	E571-Q573 PolarHBondContact OE1-NE2 3.21Å; Q573-D575 PolarHBondContact O-N 3.39Å
574	P	76.2	Confident	81.7	Confident	49 Å²	49	50 Å²	50	32%	0.318	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	-35.8	177	23.9	-31.8	0	0	0	111.1	C599 E601	P574-C599 HydrophobicContact CB-CB 4.43Å; P574-C599 HydrophobicContact CG-CB 4.09Å; P574-E601 WeakPolarHBondContact CB-OE2 3.22Å; P574-E601 WeakPolarHBondContact CD-OE2 3.34Å
575	D	72	Confident	82	Confident	95 Å²	95	54.9 Å²	54.9	51%	0.508	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	144.7	172.2	-73.3	-62.4	0	0	0	110.3	Q573 S577 I578	Q573-D575 PolarHBondContact O-N 3.39Å; D575-S577 PolarHBondContact O-N 3.31Å; D575-I578 PolarHBondContact O-N 3.29Å
576	V	69.8	Low	82.6	Confident	160 Å²	160	53 Å²	53	97%	0.97	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-17.2	-179.9	-172	0	0	0	0	112.7
577	S	71.6	Confident	83.2	Confident	107 Å²	107	53.5 Å²	53.5	75%	0.748	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-12.9	-176.9	55.1	0	0	0	0	115.1	D575	D575-S577 PolarHBondContact O-N 3.31Å
578	I	78.6	Confident	83.6	Confident	71 Å²	71	54.3 Å²	54.3	36%	0.364	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	120.9	-172.4	-56.8	179.4	0	0	0	110.7	D575	D575-I578 PolarHBondContact O-N 3.29Å
579	S	85.1	Confident	83.7	Confident	28 Å²	28	59.2 Å²	59.2	20%	0.196	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	117.6	174.5	31.1	0	0	0	0	111.2	E571 C572	E571-S579 WeakPolarHBondContact OE1-CB 3.4Å; C572-S579 WeakPolarHBondContact O-CA 3.18Å
580	H	88.1	Confident	83.4	Confident	15 Å²	15	60.8 Å²	60.8	7%	0.069	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	125.7	176.4	-70.7	157.3	0	0	0	110.7	H554 E571 C572 H598 C599	H554-H580 AromaticContact CE1-NE2 3.94Å; H554-H580 AromaticContact CG-CD2 3.89Å; H554-H580 AromaticContact CG-NE2 3.89Å; H554-H580 AromaticContact ND1-CD2 3.41Å; H554-H580 PolarHBondContact ND1-CD2 3.47Å; H554-H580 AromaticContact ND1-NE2 2.96Å; H554-H580 PolarHBondContact ND1-NE2 3.09Å; E571-H580 VanDerWaalsContact CA-O 3.31Å; E571-H580 WeakPolarHBondContact CA-O 3.46Å; C572-H580 PolarHBondContact N-O 3.36Å; C572-H580 VanDerWaalsContact N-O 3.09Å; C572-H580 PolarHBondContact O-N 2.85Å; H580-H598 HydrophobicContact CB-CB 3.84Å; H580-H598 VanDerWaalsContact CG-CB 3.46Å; H580-H598 AromaticContact CG-CG 3.84Å; H580-H598 WeakPolarHBondContact ND1-CB 3.43Å; H580-C599 PolarHBondContact ND1-SG 3.47Å; H580-C599 VanDerWaalsContact ND1-SG 3.4Å
581	R	87.7	Confident	82.9	Confident	37 Å²	37	67.2 Å²	67.2	14%	0.14	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	131.8	-178.3	-67.6	-177.1	-178.5	149.3	7.2	112.9	C564 M570 E571 H598 I611	C564-R581 HydrophobicContact CB-CB 4.09Å; M570-R581 WeakPolarHBondContact O-CA 3.39Å; E571-R581 HydrophobicContact CB-CG 4.42Å; E571-R581 HydrophobicContact CG-CG 4.13Å; E571-R581 IonicContact OE2-CZ 2.8Å; E571-R581 IonicContact OE2-NE 2.75Å; E571-R581 PolarHBondContact OE2-NE 3.06Å; E571-R581 IonicContact OE2-NH2 3.58Å; E571-R581 PolarHBondContact OE2-NH2 3.13Å; R581-H598 PolarHBondContact N-NE2 3.14Å; R581-H598 PolarHBondContact O-NE2 2.89Å; R581-I611 VanDerWaalsContact NH1-CD1 3.34Å
582	F	88.4	Confident	82.4	Confident	0 Å²	0	70 Å²	70	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	156.3	178.8	61.4	-75.4	0	0	0	111.2	M570 A587 C596 P597 A603 A606	M570-F582 HydrophobicContact CB-CD1 4.03Å; M570-F582 HydrophobicContact CB-CD2 4.02Å; M570-F582 HydrophobicContact CB-CE1 3.7Å; M570-F582 HydrophobicContact CB-CE2 3.69Å; M570-F582 HydrophobicContact CB-CG 4.18Å; M570-F582 HydrophobicContact CB-CZ 3.51Å; M570-F582 HydrophobicContact CG-CD2 4.46Å; M570-F582 HydrophobicContact CG-CE2 4.04Å; M570-F582 HydrophobicContact CG-CZ 4.24Å; M570-F582 PolarHBondContact N-O 3.23Å; M570-F582 PolarHBondContact O-N 3.21Å; F582-A587 HydrophobicContact CD2-CB 4.4Å; F582-A587 HydrophobicContact CE2-CB 4Å; F582-C596 HydrophobicContact CD1-CB 4.37Å; F582-C596 HydrophobicContact CE1-CB 3.79Å; F582-C596 VanDerWaalsContact CE1-SG 3.53Å; F582-C596 HydrophobicContact CZ-CB 4.01Å; F582-P597 HydrophobicContact CB-CG 3.74Å; F582-P597 HydrophobicContact CD2-CG 4.33Å; F582-P597 HydrophobicContact CG-CG 4.09Å; F582-A603 HydrophobicContact CE2-CB 3.92Å; F582-A603 HydrophobicContact CZ-CB 3.86Å; F582-A606 HydrophobicContact CE1-CB 4.03Å; F582-A606 HydrophobicContact CZ-CB 3.85Å
583	H	87.2	Confident	82	Confident	36 Å²	36	75 Å²	75	17%	0.167	43%	0.43	C	S	.	.			trans	-76.8	144.6	168.8	-54.9	97	0	0	0	109.4	S514 C560 F562 C564 F569 A585 C586	S514-H583 WeakPolarHBondContact CB-NE2 3.5Å; S514-H583 PolarHBondContact OG-NE2 3.26Å; C560-H583 PolarHBondContact SG-CE1 3.26Å; C560-H583 PolarHBondContact SG-ND1 2.93Å; C560-H583 VanDerWaalsContact SG-ND1 3.37Å; F562-H583 WeakPolarHBondContact CB-CE1 3.37Å; F562-H583 AromaticContact CD2-CE1 3.57Å; F562-H583 AromaticContact CG-CE1 3.85Å; C564-H583 PolarHBondContact SG-CE1 2.9Å; F569-H583 AromaticContact CD1-CD2 3.82Å; F569-H583 AromaticContact CD1-NE2 3.93Å; F569-H583 AromaticContact CE1-CD2 3.89Å; F569-H583 AromaticContact CE1-NE2 3.23Å; F569-H583 WeakPolarHBondContact CE1-NE2 3.37Å; H583-A585 VanDerWaalsContact C-N 3.25Å; H583-A585 PolarHBondContact O-N 2.88Å; H583-C586 HydrophobicContact CB-CB 4.27Å; H583-C586 CarbonylContact O-C 3.6Å; H583-C586 WeakPolarHBondContact O-CA 3.11Å; H583-C586 WeakPolarHBondContact O-CB 3.34Å; H583-C586 PolarHBondContact O-N 2.89Å
584	Q	86	Confident	82.2	Confident	149 Å²	149	72.2 Å²	72.2	70%	0.696	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-55.8	-39.9	179.4	-168.3	-175.8	24.1	0	0	112.5	M570 C586 A587	M570-Q584 HydrophobicContact CG-CB 3.98Å; M570-Q584 HydrophobicContact CG-CG 4.37Å; M570-Q584 HydrophobicContact SD-CB 4.4Å; M570-Q584 HydrophobicContact SD-CG 4.43Å; Q584-C586 PolarHBondContact O-N 2.9Å; Q584-A587 WeakPolarHBondContact O-CB 3.44Å; Q584-A587 PolarHBondContact O-N 2.91Å
585	A	84.3	Confident	82.9	Confident	102 Å²	102	71 Å²	71	84%	0.843	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-71.9	-3.9	175.5	0	0	0	0	0	114.6	H583	H583-A585 VanDerWaalsContact C-N 3.25Å; H583-A585 PolarHBondContact O-N 2.88Å
586	C	87.3	Confident	83.7	Confident	29 Å²	29	66.6 Å²	66.6	20%	0.196	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-110.4	15.3	175.2	-59.3	0	0	0	0	112.4	C557 H583 Q584 P597	C557-C586 WeakPolarHBondContact SG-CB 3.49Å; H583-C586 HydrophobicContact CB-CB 4.27Å; H583-C586 CarbonylContact O-C 3.6Å; H583-C586 WeakPolarHBondContact O-CA 3.11Å; H583-C586 WeakPolarHBondContact O-CB 3.34Å; H583-C586 PolarHBondContact O-N 2.89Å; Q584-C586 PolarHBondContact O-N 2.9Å; C586-P597 WeakPolarHBondContact O-CG 3.24Å
587	A	86.9	Confident	84.5	Confident	20 Å²	20	59.1 Å²	59.1	17%	0.165	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-67.6	130.7	168.5	0	0	0	0	0	110.1	F582 Q584 F595 A603	F582-A587 HydrophobicContact CD2-CB 4.4Å; F582-A587 HydrophobicContact CE2-CB 4Å; Q584-A587 WeakPolarHBondContact O-CB 3.44Å; Q584-A587 PolarHBondContact O-N 2.91Å; A587-F595 CarbonylContact C-O 3.47Å; A587-F595 WeakPolarHBondContact CA-O 3.41Å; A587-A603 HydrophobicContact CB-CB 4.1Å
588	S	86.4	Confident	85.2	Confident	20 Å²	20	54.2 Å²	54.2	14%	0.14	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	130.6	176.6	-61.6	0	0	0	0	109.4	S594 F595	S588-S594 CarbonylContact O-C 3.57Å; S588-F595 PolarHBondContact N-O 3.39Å; S588-F595 PolarHBondContact O-N 3.47Å
589	M	83.7	Confident	85.5	Confident	158 Å²	158	52.7 Å²	52.7	78%	0.778	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	128.9	177.5	-66	-163.2	-60.2	0	0	111.4	Q593	M589-Q593 VanDerWaalsContact CA-O 3.32Å; M589-Q593 WeakPolarHBondContact CA-O 3.42Å
590	L	80.4	Confident	85.5	Confident	39 Å²	39	52.3 Å²	52.3	20%	0.204	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	131.8	173.3	177.2	66.1	0	0	0	109.2	Q484 L486 G592 Q593 F595	Q484-L590 HydrophobicContact CB-CD1 3.72Å; Q484-L590 WeakPolarHBondContact O-CD1 3.46Å; L486-L590 HydrophobicContact CD1-CD2 4.44Å; L486-L590 HydrophobicContact CD2-CB 3.77Å; L486-L590 HydrophobicContact CD2-CD2 4.31Å; L486-L590 HydrophobicContact CG-CB 4.42Å; L486-L590 HydrophobicContact CG-CD2 4.04Å; L590-G592 PolarHBondContact O-N 3.18Å; L590-Q593 PolarHBondContact N-O 3.34Å; L590-Q593 PolarHBondContact O-N 3.19Å; L590-F595 HydrophobicContact CB-CD2 4.09Å; L590-F595 HydrophobicContact CB-CE2 3.83Å
591	K	78.4	Confident	85.5	Confident	160 Å²	160	54.7 Å²	54.7	70%	0.696	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	33.9	-178.2	-65.8	-175.6	171.2	-175.3	0	114.4	E481 Q593	E481-K591 IonicContact OE1-NZ 2.73Å; E481-K591 PolarHBondContact OE1-NZ 3Å; K591-Q593 VanDerWaalsContact C-N 3.31Å; K591-Q593 PolarHBondContact O-N 2.85Å
592	G	78.8	Confident	85.4	Confident	78 Å²	78	56.5 Å²	56.5	80%	0.804	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	-0.7	-179.8	0	0	0	0	0	115.9	L590	L590-G592 PolarHBondContact O-N 3.18Å
593	Q	81.7	Confident	85.2	Confident	111 Å²	111	57 Å²	57	52%	0.519	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	151.7	173.5	-63.6	179.2	9.7	0	0	110.3	M589 L590 K591 F595	M589-Q593 VanDerWaalsContact CA-O 3.32Å; M589-Q593 WeakPolarHBondContact CA-O 3.42Å; L590-Q593 PolarHBondContact N-O 3.34Å; L590-Q593 PolarHBondContact O-N 3.19Å; K591-Q593 VanDerWaalsContact C-N 3.31Å; K591-Q593 PolarHBondContact O-N 2.85Å; Q593-F595 HydrophobicContact CB-CD2 4.5Å; Q593-F595 HydrophobicContact CB-CE2 3.55Å; Q593-F595 HydrophobicContact CB-CZ 3.62Å; Q593-F595 WeakPolarHBondContact O-CD2 3.4Å; Q593-F595 WeakPolarHBondContact O-CE2 3.42Å
594	S	88.2	Confident	84.9	Confident	52 Å²	52	59.4 Å²	59.4	36%	0.364	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	137.6	179.7	54.5	0	0	0	0	110.8	S588 E602 A603	S588-S594 CarbonylContact O-C 3.57Å; S594-E602 CarbonylContact O-C 3.57Å; S594-E602 WeakPolarHBondContact O-CA 3.19Å; S594-A603 PolarHBondContact O-N 3.24Å
595	F	89.6	Confident	84.8	Confident	25 Å²	25	58.7 Å²	58.7	11%	0.11	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	152.2	-171.8	-61	-82.6	0	0	0	111.9	L486 A587 S588 L590 Q593 G600 E601 E602	L486-F595 HydrophobicContact CD1-CB 4Å; L486-F595 HydrophobicContact CD1-CD1 4.32Å; L486-F595 HydrophobicContact CD1-CD2 4.13Å; L486-F595 HydrophobicContact CD1-CG 3.89Å; L486-F595 HydrophobicContact CD2-CB 4.25Å; L486-F595 HydrophobicContact CD2-CD2 4.02Å; L486-F595 HydrophobicContact CD2-CG 4.36Å; A587-F595 CarbonylContact C-O 3.47Å; A587-F595 WeakPolarHBondContact CA-O 3.41Å; S588-F595 PolarHBondContact N-O 3.39Å; S588-F595 PolarHBondContact O-N 3.47Å; L590-F595 HydrophobicContact CB-CD2 4.09Å; L590-F595 HydrophobicContact CB-CE2 3.83Å; Q593-F595 HydrophobicContact CB-CD2 4.5Å; Q593-F595 HydrophobicContact CB-CE2 3.55Å; Q593-F595 HydrophobicContact CB-CZ 3.62Å; Q593-F595 WeakPolarHBondContact O-CD2 3.4Å; Q593-F595 WeakPolarHBondContact O-CE2 3.42Å; F595-G600 WeakPolarHBondContact CD1-O 3.46Å; F595-E601 CarbonylContact C-O 3.57Å; F595-E601 VanDerWaalsContact CA-O 3.22Å; F595-E601 WeakPolarHBondContact CA-O 3.48Å; F595-E602 HydrophobicContact CD1-CG 4.28Å; F595-E602 HydrophobicContact CE1-CG 3.85Å
596	C	89.6	Confident	84.9	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.007	32%	0.315	C	S	.	.			trans	-67.4	124.2	173.5	178.2	0	0	0	0	110	C572 F582 H598 C599 G600 E601	C572-C596 PolarHBondContact SG-SG 2.99Å; F582-C596 HydrophobicContact CD1-CB 4.37Å; F582-C596 HydrophobicContact CE1-CB 3.79Å; F582-C596 VanDerWaalsContact CE1-SG 3.53Å; F582-C596 HydrophobicContact CZ-CB 4.01Å; C596-H598 PolarHBondContact O-N 2.88Å; C596-H598 PolarHBondContact SG-N 2.98Å; C596-C599 VanDerWaalsContact SG-SG 3.63Å; C596-G600 WeakPolarHBondContact O-CA 3.43Å; C596-G600 PolarHBondContact O-N 3.36Å; C596-E601 PolarHBondContact N-O 3.31Å
597	P	86.1	Confident	85	Confident	3 Å²	3	60 Å²	60	2%	0.019	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	1.2	179.6	32.7	-40.3	0	0	0	114.2	L488 C489 P558 F582 C586	L488-P597 CarbonylContact C-O 3.59Å; L488-P597 WeakPolarHBondContact CA-O 3.25Å; C489-P597 PolarHBondContact N-O 2.99Å; P558-P597 HydrophobicContact CB-CB 4.22Å; P558-P597 HydrophobicContact CG-CB 4.23Å; P558-P597 HydrophobicContact CG-CG 4.29Å; F582-P597 HydrophobicContact CB-CG 3.74Å; F582-P597 HydrophobicContact CD2-CG 4.33Å; F582-P597 HydrophobicContact CG-CG 4.09Å; C586-P597 WeakPolarHBondContact O-CG 3.24Å
598	H	86	Confident	85.1	Confident	5 Å²	5	66 Å²	66	2%	0.023	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-57.2	171.8	-68.9	-86.4	0	0	0	112.2	C489 H554 C556 H580 R581 C596	C489-H598 HydrophobicContact CB-CB 4.28Å; C489-H598 WeakPolarHBondContact CB-ND1 3.35Å; C489-H598 PolarHBondContact SG-O 3.06Å; H554-H598 VanDerWaalsContact CA-CE1 3.47Å; H554-H598 WeakPolarHBondContact CA-CE1 3.36Å; H554-H598 PolarHBondContact O-CE1 3.43Å; H554-H598 PolarHBondContact O-NE2 3.31Å; C556-H598 PolarHBondContact O-CE1 2.86Å; C556-H598 PolarHBondContact O-NE2 3.47Å; H580-H598 HydrophobicContact CB-CB 3.84Å; H580-H598 VanDerWaalsContact CG-CB 3.46Å; H580-H598 AromaticContact CG-CG 3.84Å; H580-H598 WeakPolarHBondContact ND1-CB 3.43Å; R581-H598 PolarHBondContact N-NE2 3.14Å; R581-H598 PolarHBondContact O-NE2 2.89Å; C596-H598 PolarHBondContact O-N 2.88Å; C596-H598 PolarHBondContact SG-N 2.98Å
599	C	85.6	Confident	85.2	Confident	39 Å²	39	67 Å²	67	26%	0.264	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-8	-169.9	49.3	0	0	0	0	115.3	C572 P574 H580 C596 E601	C572-C599 PolarHBondContact SG-SG 2.7Å; P574-C599 HydrophobicContact CB-CB 4.43Å; P574-C599 HydrophobicContact CG-CB 4.09Å; H580-C599 PolarHBondContact ND1-SG 3.47Å; H580-C599 VanDerWaalsContact ND1-SG 3.4Å; C596-C599 VanDerWaalsContact SG-SG 3.63Å; C599-E601 VanDerWaalsContact C-N 3.26Å; C599-E601 HydrophobicContact CB-CG 4.37Å; C599-E601 PolarHBondContact O-N 3.29Å; C599-E601 PolarHBondContact SG-OE2 3.19Å
600	G	85.4	Confident	85.2	Confident	20 Å²	20	64.1 Å²	64.1	21%	0.206	36%	0.358	C	S	.	.			trans	74.2	7.1	-177.1	0	0	0	0	0	115.3	F595 C596	F595-G600 WeakPolarHBondContact CD1-O 3.46Å; C596-G600 WeakPolarHBondContact O-CA 3.43Å; C596-G600 PolarHBondContact O-N 3.36Å
601	E	87.4	Confident	85.3	Confident	65 Å²	65	64.2 Å²	64.2	30%	0.304	36%	0.358	S	S	.	.			trans	-66.3	150	170.2	-66.2	179	111.9	0	0	111.8	C572 P574 F595 C596 C599 A603	C572-E601 PolarHBondContact SG-OE2 3.16Å; P574-E601 WeakPolarHBondContact CB-OE2 3.22Å; P574-E601 WeakPolarHBondContact CD-OE2 3.34Å; F595-E601 CarbonylContact C-O 3.57Å; F595-E601 VanDerWaalsContact CA-O 3.22Å; F595-E601 WeakPolarHBondContact CA-O 3.48Å; C596-E601 PolarHBondContact N-O 3.31Å; C599-E601 VanDerWaalsContact C-N 3.26Å; C599-E601 HydrophobicContact CB-CG 4.37Å; C599-E601 PolarHBondContact O-N 3.29Å; C599-E601 PolarHBondContact SG-OE2 3.19Å; E601-A603 PolarHBondContact O-N 2.85Å
602	E	86	Confident	85	Confident	75 Å²	75	60.9 Å²	60.9	35%	0.35	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-55.5	123.1	173.6	-69.3	152.8	-119.8	0	0	111.8	S594 F595 A604 K605	S594-E602 CarbonylContact O-C 3.57Å; S594-E602 WeakPolarHBondContact O-CA 3.19Å; F595-E602 HydrophobicContact CD1-CG 4.28Å; F595-E602 HydrophobicContact CE1-CG 3.85Å; E602-A604 PolarHBondContact O-N 2.68Å; E602-A604 VanDerWaalsContact O-N 3.12Å; E602-K605 HydrophobicContact CB-CD 4.16Å; E602-K605 HydrophobicContact CB-CG 4.32Å; E602-K605 WeakPolarHBondContact O-CB 3.43Å; E602-K605 PolarHBondContact O-N 3.02Å; E602-K605 IonicContact OE1-NZ 3.27Å; E602-K605 PolarHBondContact OE1-NZ 3.24Å; E602-K605 WeakPolarHBondContact OE2-CE 3.35Å; E602-K605 IonicContact OE2-NZ 2.7Å; E602-K605 PolarHBondContact OE2-NZ 3.28Å; E602-K605 VanDerWaalsContact OE2-NZ 3.09Å
603	A	84.8	Confident	84.3	Confident	9 Å²	9	63 Å²	63	7%	0.074	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-64.5	-17.8	178.1	0	0	0	0	0	112.8	F582 A587 S594 E601 K605 A606	F582-A603 HydrophobicContact CE2-CB 3.92Å; F582-A603 HydrophobicContact CZ-CB 3.86Å; A587-A603 HydrophobicContact CB-CB 4.1Å; S594-A603 PolarHBondContact O-N 3.24Å; E601-A603 PolarHBondContact O-N 2.85Å; A603-K605 PolarHBondContact O-N 3.45Å; A603-A606 WeakPolarHBondContact O-CB 3.3Å; A603-A606 PolarHBondContact O-N 3.31Å
604	A	80.8	Confident	82.9	Confident	88 Å²	88	61.7 Å²	61.7	73%	0.727	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-65.9	-18	169.9	0	0	0	0	0	113.8	E602	E602-A604 PolarHBondContact O-N 2.68Å; E602-A604 VanDerWaalsContact O-N 3.12Å
605	K	82.8	Confident	80.5	Confident	134 Å²	134	66.9 Å²	66.9	58%	0.583	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-94.3	-13.3	174.5	-63.7	170.5	179.2	161.9	0	112.5	E602 A603	E602-K605 HydrophobicContact CB-CD 4.16Å; E602-K605 HydrophobicContact CB-CG 4.32Å; E602-K605 WeakPolarHBondContact O-CB 3.43Å; E602-K605 PolarHBondContact O-N 3.02Å; E602-K605 IonicContact OE1-NZ 3.27Å; E602-K605 PolarHBondContact OE1-NZ 3.24Å; E602-K605 WeakPolarHBondContact OE2-CE 3.35Å; E602-K605 IonicContact OE2-NZ 2.7Å; E602-K605 PolarHBondContact OE2-NZ 3.28Å; E602-K605 VanDerWaalsContact OE2-NZ 3.09Å; A603-K605 PolarHBondContact O-N 3.45Å
606	A	87.9	Confident	78	Confident	11 Å²	11	71.7 Å²	71.7	9%	0.091	41%	0.411	C	S	.	.	S	Bend	trans	-70.8	143.6	172.4	0	0	0	0	0	110.4	M570 E571 C572 F582 A603	M570-A606 HydrophobicContact CB-CB 4.22Å; M570-A606 HydrophobicContact CE-CB 3.84Å; M570-A606 VanDerWaalsContact CE-O 3.3Å; M570-A606 WeakPolarHBondContact CE-O 3.41Å; E571-A606 CarbonylContact O-C 3.51Å; E571-A606 WeakPolarHBondContact O-CA 3.06Å; C572-A606 HydrophobicContact CB-CB 3.9Å; F582-A606 HydrophobicContact CE1-CB 4.03Å; F582-A606 HydrophobicContact CZ-CB 3.85Å; A603-A606 WeakPolarHBondContact O-CB 3.3Å; A603-A606 PolarHBondContact O-N 3.31Å
607	K	88.8	Confident	75.2	Confident	147 Å²	147	78.5 Å²	78.5	64%	0.639	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	140	178	-66.6	169.3	-174.2	164	0	109.4	E571 V609	E571-K607 PolarHBondContact N-O 3.31Å; E571-K607 PolarHBondContact O-N 3.36Å; K607-V609 HydrophobicContact CB-CG2 4.34Å; K607-V609 PolarHBondContact O-N 3.19Å
608	E	89.2	Confident	72.6	Confident	145 Å²	145	83.7 Å²	83.7	68%	0.678	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.9	122.1	166.8	-172.8	173.1	-150	0	0	109	T568 F569 M570	T568-E608 HydrophobicContact CG2-CG 3.47Å; T568-E608 VanDerWaalsContact CG2-CG 3.47Å; T568-E608 VanDerWaalsContact CG2-OE1 3.24Å; T568-E608 WeakPolarHBondContact CG2-OE1 3.19Å; F569-E608 WeakPolarHBondContact O-CA 3.32Å; M570-E608 HydrophobicContact SD-CB 4.38Å
609	V	87.1	Confident	70	Confident	42 Å²	42	89.7 Å²	89.7	26%	0.255	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	123.9	-176.4	178.5	0	0	0	0	109.2	T568 F569 E571 K607 I611	T568-V609 WeakPolarHBondContact CA-O 3.34Å; F569-V609 PolarHBondContact N-O 3.12Å; F569-V609 PolarHBondContact O-N 3.48Å; E571-V609 HydrophobicContact CB-CB 4.23Å; E571-V609 HydrophobicContact CB-CG2 3.73Å; K607-V609 HydrophobicContact CB-CG2 4.34Å; K607-V609 PolarHBondContact O-N 3.19Å; V609-I611 HydrophobicContact CG1-CG1 4.01Å
610	T	84.8	Confident	67.3	Low	97 Å²	97	94 Å²	94	60%	0.595	55%	0.552	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104.9	121.9	175.8	-58.8	0	0	0	0	110.4	G567 T568	G567-T610 WeakPolarHBondContact O-CA 3.32Å; T568-T610 WeakPolarHBondContact CG2-OG1 3.41Å; T568-T610 WeakPolarHBondContact OG1-CG2 3.47Å; T568-T610 PolarHBondContact OG1-OG1 3.27Å
611	I	81.4	Confident	64.7	Low	41 Å²	41	98.5 Å²	98.5	21%	0.21	58%	0.577	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.1	111	-174.7	-55.9	174.4	0	0	0	109.2	R565 A566 G567 R581 V609	R565-I611 WeakPolarHBondContact O-CG2 3.45Å; A566-I611 CarbonylContact C-O 3.42Å; A566-I611 VanDerWaalsContact CA-O 3.29Å; A566-I611 WeakPolarHBondContact CA-O 3.37Å; A566-I611 WeakPolarHBondContact CB-O 3.05Å; G567-I611 PolarHBondContact N-O 3.34Å; G567-I611 PolarHBondContact O-N 3.09Å; R581-I611 VanDerWaalsContact NH1-CD1 3.34Å; V609-I611 HydrophobicContact CG1-CG1 4.01Å
612	A	74	Confident	62.2	Low	91 Å²	91	101.1 Å²	101.1	75%	0.752	60%	0.599	S	S	*	*			trans	-64.4	141.4	179.6	0	0	0	0	0	112.3	A614	A612-A614 PolarHBondContact O-N 3.04Å
613	K	63.3	Low	59.4	Low	122 Å²	122	101.9 Å²	101.9	53%	0.53	62%	0.619	S	S	.	*			trans	-58.7	130.6	167.5	-91.5	173.2	167.4	134.6	0	109.9	V515 A566 D615	V515-K613 HydrophobicContact CG1-CD 4.11Å; V515-K613 HydrophobicContact CG1-CG 4.22Å; A566-K613 HydrophobicContact CB-CG 3.8Å; K613-D615 PolarHBondContact O-N 2.77Å
614	A	51.2	Low	56.8	Low	84 Å²	84	110.8 Å²	110.8	69%	0.694	66%	0.659	S	S	*	*			trans	-85.7	96.1	174.3	0	0	0	0	0	110.4	A612 T616	A612-A614 PolarHBondContact O-N 3.04Å; A614-T616 WeakPolarHBondContact O-CG2 3.38Å; A614-T616 PolarHBondContact O-N 3.34Å; A614-T616 VanDerWaalsContact O-N 3.16Å; A614-T616 PolarHBondContact O-OG1 3.22Å
615	D	38	Very low	54.2	Low	161 Å²	161	110.9 Å²	110.9	86%	0.861	66%	0.66	S	S	*	*			trans	-58	116.7	179.8	-78.8	-28.8	0	0	0	112	K613	K613-D615 PolarHBondContact O-N 2.77Å
616	T	38.7	Very low	51.7	Low	125 Å²	125	114.7 Å²	114.7	77%	0.767	68%	0.676	S	S	*	*			trans	-133.5	59.6	-169	35.2	0	0	0	0	112.4	A614	A614-T616 WeakPolarHBondContact O-CG2 3.38Å; A614-T616 PolarHBondContact O-N 3.34Å; A614-T616 VanDerWaalsContact O-N 3.16Å; A614-T616 PolarHBondContact O-OG1 3.22Å
617	T	30.7	Very low	48.9	Very low	144 Å²	144	117.4 Å²	117.4	88%	0.883	71%	0.706	S	S	*	*			trans	-150.9	147.7	159.9	-21.9	0	0	0	0	113
618	S	31.1	Very low	46.9	Very low	113 Å²	113	116.7 Å²	116.7	79%	0.79	72%	0.716	S	S	*	*			trans	-114.8	124.7	-179.7	173	0	0	0	0	110.6
619	T	30.4	Very low	43.9	Very low	130 Å²	130	114.6 Å²	114.6	80%	0.798	72%	0.724	S	S	*	*			trans	-150.9	147.9	166.8	-34.6	0	0	0	0	110.6
620	V	29.1	Very low	41.2	Very low	131 Å²	131	119.2 Å²	119.2	79%	0.794	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-95.2	130.7	-176.6	179.9	0	0	0	0	110.5
621	P	31.9	Very low	39.2	Very low	113 Å²	113	120.8 Å²	120.8	73%	0.734	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-88.5	145.1	178.4	34	-34.4	0	0	0	113.2
622	P	33.5	Very low	36.6	Very low	120 Å²	120	122.7 Å²	122.7	78%	0.779	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-91.5	152.5	170.7	35.4	-33.5	0	0	0	114
623	A	28.5	Very low	34.6	Very low	92 Å²	92	122.9 Å²	122.9	76%	0.76	80%	0.795	S	S	*	*			trans	30.3	109.8	154.8	0	0	0	0	0	121.9
624	Q	29.2	Very low	34	Very low	196 Å²	196	123.2 Å²	123.2	92%	0.916	81%	0.809	S	S	*	*			trans	21.5	129.8	131.3	-62.5	178	-20.7	0	0	120.7
625	A	27.5	Very low	33.1	Very low	90 Å²	90	128.6 Å²	128.6	74%	0.744	82%	0.82	S	S	*	*				-173.8	157.3	105	0	0	0	0	0	113.6
626	K	28.9	Very low	32.7	Very low	213 Å²	213	124.9 Å²	124.9	93%	0.926	82%	0.82	S	S	*	*			trans	74.5	127.3	170.6	-55.6	-179.7	-179.6	178.3	0	118.6
627	G	29.5	Very low	32.3	Very low	69 Å²	69	131 Å²	131	71%	0.711	83%	0.829	S	S	*	*			trans	-129.7	-142.7	147.1	0	0	0	0	0	106.7
628	P	47	Very low	32.3	Very low	131 Å²	131	128.9 Å²	128.9	85%	0.851	83%	0.826	S	S	*	*			cis	-132.6	163.4	-20.9	39.9	-25.7	0	0	0	113.2
629	A	26.8	Very low	32.1	Very low	102 Å²	102	130.6 Å²	130.6	84%	0.843	83%	0.826	S	S	*	*			trans	-155.2	128.6	161.3	0	0	0	0	0	112.8
630	T	28.6	Very low	32	Very low	139 Å²	139	130.3 Å²	130.3	85%	0.853	83%	0.825	S	S	*	*			trans	-136.9	177.3	169.3	39.4	0	0	0	0	106.3
631	P	43	Very low	31.9	Very low	130 Å²	130	129.6 Å²	129.6	84%	0.844	82%	0.82	S	S	*	*			cis	-137.3	-173.2	13.1	43.8	-25.3	0	0	0	115.8
632	G	26.7	Very low	31.6	Very low	80 Å²	80	130.8 Å²	130.8	83%	0.825	83%	0.826	S	S	*	*			trans	169.9	99	165.7	0	0	0	0	0	113.7
633	A	34	Very low	31.3	Very low	96 Å²	96	128.3 Å²	128.3	79%	0.793	82%	0.822	S	S	*	*			trans	-137.5	163.3	170.9	0	0	0	0	0	108.5
634	P	49.1	Very low	31.3	Very low	128 Å²	128	129.8 Å²	129.8	83%	0.831	83%	0.827	S	S	*	*				-144.3	-160.3	80.2	40.1	-21.7	0	0	0	114.4
635	E	32.5	Very low	31.2	Very low	198 Å²	198	126 Å²	126	93%	0.925	82%	0.822	S	S	*	*			trans	-96.3	168.7	-163.9	-56.6	157	108.9	0	0	114.7
636	G	29.4	Very low	31.2	Very low	82 Å²	82	126.4 Å²	126.4	85%	0.845	82%	0.82	S	S	*	*			trans	-174.9	130.2	165.3	0	0	0	0	0	114.2
637	R	31.6	Very low	31.2	Very low	254 Å²	254	121.6 Å²	121.6	96%	0.958	81%	0.811	S	S	*	*			trans	-128.8	136.8	169.4	-79.7	-179.7	169.5	-176.5	-3.8	109.1
638	A	29.6	Very low	30.9	Very low	100 Å²	100	126 Å²	126	83%	0.826	82%	0.818	S	S	*	*			trans	-176.9	158.6	146.1	0	0	0	0	0	110.4
639	D	27.3	Very low	29.8	Very low	149 Å²	149	124.8 Å²	124.8	80%	0.797	81%	0.812	S	S	*	*			trans	-100.2	178.5	-180	-61.9	-81.6	0	0	0	112.7
640	T	28.5	Very low	30.7	Very low	124 Å²	124	125.3 Å²	125.3	76%	0.761	81%	0.807	S	S	*	*			trans	83.2	117.4	156.9	62	0	0	0	0	121.7
641	T	26.2	Very low	30.6	Very low	115 Å²	115	125.5 Å²	125.5	71%	0.706	81%	0.808	S	S	*	*			trans	70.4	128.2	133.9	53.8	0	0	0	0	123.5
642	T	26.6	Very low	29.8	Very low	139 Å²	139	123 Å²	123	85%	0.853	80%	0.799	S	S	*	*			trans	58.1	131.8	146.1	54.4	0	0	0	0	119.6
643	G	26.4	Very low	29.6	Very low	67 Å²	67	128 Å²	128	69%	0.691	80%	0.8	S	S	*	*			cis	142	173.8	2.7	0	0	0	0	0	112.6
644	S	29.7	Very low	29	Very low	123 Å²	123	130 Å²	130	86%	0.86	80%	0.802	S	S	*	*			trans	81	114.3	160.4	-51.5	0	0	0	0	120.8
645	S	26.2	Very low	27.9	Very low	118 Å²	118	129.8 Å²	129.8	83%	0.825	80%	0.804	S	S	*	*			trans	176.7	131.4	143.1	-79	0	0	0	0	108.6
646	S	28.4	Very low	27.6	Very low	98 Å²	98	123.3 Å²	123.3	69%	0.685	79%	0.791	S	S	*	*			cis	-159.7	143.7	-1.8	-79.2	0	0	0	0	112.2
647	C	27.3	Very low	27.6	Very low	112 Å²	112	131.2 Å²	131.2	76%	0.757	80%	0.795	S	S	*	*			trans	61.7	142.9	139.7	-61.5	0	0	0	0	121.2
648	L	24.3	Very low	27.5	Very low	161 Å²	161	123.7 Å²	123.7	84%	0.843	79%	0.787	S	S	*	*			cis	-154.9	158.8	0.3	-116.1	164.2	0	0	0	111.2
649	S	24.5	Very low	27.3	Very low	105 Å²	105	125.5 Å²	125.5	73%	0.734	78%	0.783	S	S	*	*			trans	-92.7	177.7	179.5	-34.8	0	0	0	0	111.8
650	P	44	Very low	27.7	Very low	114 Å²	114	122.4 Å²	122.4	74%	0.74	77%	0.773	S	S	*	*				-149	161.5	65.3	40.1	-20	0	0	0	118.4
651	V	27.2	Very low	27.6	Very low	142 Å²	142	121.5 Å²	121.5	86%	0.861	77%	0.771	S	S	*	*			trans	40.1	137.7	135	178.6	0	0	0	0	119.9
652	A	25.9	Very low	27.7	Very low	79 Å²	79	123.5 Å²	123.5	65%	0.653	78%	0.777	S	S	*	*			cis	-173.3	-172.2	-17.9	0	0	0	0	0	107.2
653	E	21.9	Very low	27.6	Very low	183 Å²	183	121.4 Å²	121.4	86%	0.855	77%	0.768	S	S	*	*			trans	69.3	120.2	177.7	-60.3	-158.3	135.5	0	0	113.6
654	V	23	Very low	27.4	Very low	138 Å²	138	125.1 Å²	125.1	84%	0.836	78%	0.777	S	S	*	*				74.8	135.8	79.9	170.4	0	0	0	0	113.7
655	S	24.7	Very low	27.4	Very low	124 Å²	124	127.3 Å²	127.3	87%	0.867	77%	0.773	S	S	*	*			trans	93.2	157.7	171.7	-154.2	0	0	0	0	118.2
656	G	26.4	Very low	27.9	Very low	63 Å²	63	127.1 Å²	127.1	65%	0.649	77%	0.77	S	S	*	*			trans	66.7	112.2	163.9	0	0	0	0	0	117.8
657	R	29.4	Very low	27.7	Very low	247 Å²	247	124.4 Å²	124.4	93%	0.932	75%	0.753	S	S	*	*			cis	56.1	98.9	7.8	-102.6	-165.5	-177.5	-149.5	2.7	116.6
658	A	29.1	Very low	27.7	Very low	96 Å²	96	124.5 Å²	124.5	79%	0.793	75%	0.745	S	S	*	*			trans	-162.1	148.5	152.2	0	0	0	0	0	108.9
659	D	27.1	Very low	27.5	Very low	138 Å²	138	119.6 Å²	119.6	74%	0.738	72%	0.72	S	S	*	*			cis	-168.9	159.3	-39	-119.1	-63.4	0	0	0	106.1
660	S	34.1	Very low	28.3	Very low	85 Å²	85	119.2 Å²	119.2	59%	0.594	72%	0.715	S	S	*	*			cis	-144.5	-152.1	2.1	-151.1	0	0	0	0	107.9
661	S	28.3	Very low	27.4	Very low	104 Å²	104	119.2 Å²	119.2	73%	0.727	71%	0.709	S	S	*	*			cis	-166.7	153.1	-1.5	35.2	0	0	0	0	106.6
662	L	26.4	Very low	27.2	Very low	157 Å²	157	119.2 Å²	119.2	82%	0.822	70%	0.704	S	S	*	*			cis	-155	174.7	-9.6	-114.3	171.2	0	0	0	107.6
663	S	25.9	Very low	28	Very low	95 Å²	95	121 Å²	121	66%	0.664	71%	0.709	S	S	*	*			trans	-158.6	143.1	-166.7	57.4	0	0	0	0	115.3
664	V	22.5	Very low	28.1	Very low	145 Å²	145	116.8 Å²	116.8	88%	0.879	71%	0.705	S	S	*	*			trans	-145.6	152.8	155.2	-177.5	0	0	0	0	109.6
665	H	27.9	Very low	28.1	Very low	169 Å²	169	116.8 Å²	116.8	78%	0.782	71%	0.705	S	S	*	*			trans	-99	-161	-177	-63.1	-89.2	0	0	0	111.4
666	P	36.7	Very low	28.7	Very low	115 Å²	115	116.9 Å²	116.9	75%	0.747	70%	0.703	S	S	*	*			cis	-149	-160.7	3.3	43.6	-20.5	0	0	0	117.6
667	A	25.7	Very low	28.6	Very low	41 Å²	41	117.4 Å²	117.4	34%	0.339	71%	0.708	S	S	.	*			trans	74.2	-177.3	141.8	0	0	0	0	0	121.4	E332 A333 A334	E332-A667 CarbonylContact C-O 3.57Å; E332-A667 CarbonylContact O-C 3.58Å; A333-A667 CarbonylContact C-O 3.57Å; A333-A667 VanDerWaalsContact CA-O 3.24Å; A333-A667 WeakPolarHBondContact CA-O 3.37Å; A333-A667 PolarHBondContact N-O 3.4Å; A334-A667 PolarHBondContact N-O 2.98Å
668	L	26.2	Very low	28.4	Very low	113 Å²	113	111.5 Å²	111.5	59%	0.592	71%	0.705	S	S	*	*				-132	142.3	-90.2	-57.2	180	0	0	0	119	E332 A333 A334	E332-L668 VanDerWaalsContact C-CA 3.44Å; E332-L668 HydrophobicContact CB-CB 3.89Å; E332-L668 HydrophobicContact CB-CD2 3.44Å; E332-L668 VanDerWaalsContact CB-CD2 3.44Å; E332-L668 HydrophobicContact CB-CG 4.23Å; E332-L668 HydrophobicContact CG-CB 4.26Å; E332-L668 HydrophobicContact CG-CD2 4.36Å; A333-L668 VanDerWaalsContact C-N 3.33Å; A334-L668 WeakPolarHBondContact CB-O 3.2Å; A334-L668 PolarHBondContact N-O 3.27Å
669	D	20.6	Very low	28.2	Very low	59 Å²	59	112 Å²	112	32%	0.316	70%	0.703	S	S	.	*			trans	-78.6	-171.1	-174.2	-35.4	2.5	0	0	0	116.5	R331 E332 A333	R331-D669 WeakPolarHBondContact CB-OD2 3.37Å; R331-D669 VanDerWaalsContact CG-OD2 3.26Å; R331-D669 WeakPolarHBondContact CG-OD2 3.43Å; E332-D669 WeakPolarHBondContact CA-OD1 3.5Å; E332-D669 HydrophobicContact CG-CB 3.92Å; E332-D669 VanDerWaalsContact CG-N 3.3Å; E332-D669 PolarHBondContact N-OD1 2.58Å; E332-D669 PolarHBondContact N-OD2 2.83Å; A333-D669 WeakPolarHBondContact CA-OD1 3.31Å; A333-D669 WeakPolarHBondContact CB-OD1 3.23Å; A333-D669 PolarHBondContact N-OD1 3.34Å; A333-D669 VanDerWaalsContact N-OD1 3.08Å
670	P	41.1	Very low	28.3	Very low	97 Å²	97	115.7 Å²	115.7	63%	0.63	71%	0.706	S	S	*	*			cis	-153	170.2	49.4	44.7	-21.8	0	0	0	122.8
671	D	25.8	Very low	28	Very low	113 Å²	113	119.6 Å²	119.6	60%	0.604	72%	0.715	S	S	*	*			trans	93.7	159.8	139.4	-90.2	-53.1	0	0	0	127	R331	R331-D671 IonicContact CZ-OD1 2.75Å; R331-D671 IonicContact CZ-OD2 3.77Å; R331-D671 IonicContact NH1-OD1 3.81Å; R331-D671 PolarHBondContact NH1-OD1 2.92Å; R331-D671 VanDerWaalsContact NH1-OD1 3.15Å; R331-D671 IonicContact NH1-OD2 3.87Å; R331-D671 PolarHBondContact NH1-OD2 2.75Å; R331-D671 VanDerWaalsContact NH2-CG 3.34Å; R331-D671 IonicContact NH2-OD1 2.64Å; R331-D671 PolarHBondContact NH2-OD1 3.12Å; R331-D671 IonicContact NH2-OD2 2.64Å
672	D	22.5	Very low	27.8	Very low	142 Å²	142	118.7 Å²	118.7	76%	0.759	71%	0.714	S	S	*	*			trans	-72.3	-179	170.6	-112.2	-54.2	0	0	0	112.2
673	P	42.1	Very low	27.8	Very low	118 Å²	118	118.4 Å²	118.4	77%	0.766	72%	0.719	S	S	*	*			cis	-145.5	-178.8	26.1	43	-22.1	0	0	0	119.6
674	A	23.8	Very low	27.7	Very low	93 Å²	93	121.7 Å²	121.7	77%	0.769	73%	0.728	S	S	*	*			trans	114.7	160	140.7	0	0	0	0	0	120.6
675	V	24.5	Very low	27.9	Very low	138 Å²	138	123.5 Å²	123.5	84%	0.836	73%	0.727	S	S	*	*			trans	-152.6	154.7	-158.6	155.7	0	0	0	0	106.5
676	P	35.8	Very low	27.9	Very low	126 Å²	126	121.4 Å²	121.4	82%	0.818	73%	0.728	S	S	*	*			cis	-136.1	-170.8	18.5	35.5	-13.7	0	0	0	116.5
677	G	24.7	Very low	27.4	Very low	74 Å²	74	119.4 Å²	119.4	76%	0.763	73%	0.729	S	S	*	*			trans	141.2	129.9	137.4	0	0	0	0	0	119.3
678	S	26.1	Very low	27.7	Very low	123 Å²	123	126.3 Å²	126.3	86%	0.86	76%	0.758	S	S	*	*			trans	-32.9	135.6	171.5	-71.5	0	0	0	0	117.2
679	S	25.4	Very low	27.8	Very low	107 Å²	107	124 Å²	124	75%	0.748	76%	0.761	S	S	*	*			cis	88.8	109.8	49	-177.3	0	0	0	0	115.1
680	R	29.2	Very low	28.1	Very low	215 Å²	215	127.8 Å²	127.8	81%	0.811	79%	0.787	S	S	*	*			trans	-175.9	135.9	133.3	-102.2	174	-168	-155.4	3.3	113.2
681	Q	27.3	Very low	27.4	Very low	168 Å²	168	130.8 Å²	130.8	79%	0.785	80%	0.796	S	S	*	*			trans	41.7	151.5	139.5	-63.3	172.2	-75.1	0	0	122.3
682	A	23.8	Very low	27.7	Very low	84 Å²	84	129 Å²	129	69%	0.694	80%	0.797	S	S	*	*			cis	-176.4	147.2	-22.1	0	0	0	0	0	109.6
683	T	26.3	Very low	28.3	Very low	151 Å²	151	127.1 Å²	127.1	93%	0.926	79%	0.792	S	S	*	*			trans	-155.9	155.9	153.2	-24.7	0	0	0	0	110.9
684	L	23.6	Very low	27.7	Very low	165 Å²	165	125.9 Å²	125.9	86%	0.864	79%	0.785	S	S	*	*			trans	-103.3	149.3	-173.6	-61.4	124.7	0	0	0	112.2
685	Q	27.6	Very low	28.1	Very low	182 Å²	182	129.4 Å²	129.4	85%	0.85	79%	0.787	S	S	*	*			trans	-173.8	128.4	143.7	-97.3	-70.5	-13.1	0	0	108.4
686	P	27.8	Very low	28.6	Very low	126 Å²	126	128.9 Å²	128.9	82%	0.818	78%	0.779	S	S	*	*			trans	-89.2	112.6	178.6	32.6	-31.1	0	0	0	112.5
687	G	26.6	Very low	28.4	Very low	73 Å²	73	127.7 Å²	127.7	75%	0.753	77%	0.771	S	S	*	*			trans	-102.7	151.3	170.6	0	0	0	0	0	112.7	G689	G687-G689 PolarHBondContact O-N 3.19Å
688	I	31.6	Very low	29.3	Very low	185 Å²	185	132 Å²	132	95%	0.949	78%	0.776	S	S	*	*			trans	-65.2	122.5	-176.1	-64.2	166.4	0	0	0	111
689	G	27.6	Very low	29.7	Very low	65 Å²	65	128.6 Å²	128.6	67%	0.67	76%	0.76	S	S	*	*			trans	-110.8	136.5	-177.8	0	0	0	0	0	113.7	G687	G687-G689 PolarHBondContact O-N 3.19Å
690	T	27.6	Very low	30.2	Very low	139 Å²	139	128.6 Å²	128.6	85%	0.853	76%	0.756	S	S	*	*			trans	-76	137.1	175.9	-57.5	0	0	0	0	110.8	A692	T690-A692 PolarHBondContact O-N 2.8Å; T690-A692 VanDerWaalsContact O-N 3.16Å
691	I	26.3	Very low	31.2	Very low	159 Å²	159	122.1 Å²	122.1	82%	0.815	74%	0.74	S	S	*	*			trans	-74.2	107.3	-178.4	-60.9	175.6	0	0	0	110.7
692	A	31.1	Very low	32.4	Very low	75 Å²	75	120.2 Å²	120.2	62%	0.62	73%	0.729	S	S	*	*			trans	-73.9	154.5	161.8	0	0	0	0	0	110.6	T690	T690-A692 PolarHBondContact O-N 2.8Å; T690-A692 VanDerWaalsContact O-N 3.16Å
693	P	34.8	Very low	33.4	Very low	103 Å²	103	123 Å²	123	67%	0.669	73%	0.728	S	S	*	*			trans	-63.6	135.7	178.9	26.4	-34.7	0	0	0	111.2	M695	P693-M695 PolarHBondContact O-N 3.22Å; P693-M695 VanDerWaalsContact O-N 3.08Å
694	P	31.4	Very low	34.7	Very low	93 Å²	93	119.5 Å²	119.5	60%	0.604	71%	0.707	S	S	*	*			trans	-66.7	113.4	-178.4	25.6	-33.4	0	0	0	110.9
695	M	31	Very low	36	Very low	166 Å²	166	114.4 Å²	114.4	82%	0.818	68%	0.68	S	S	*	*			trans	-56.2	146.2	167.7	-72.8	-75.5	99.4	0	0	110.4	P693	P693-M695 PolarHBondContact O-N 3.22Å; P693-M695 VanDerWaalsContact O-N 3.08Å
696	L	35.9	Very low	37.1	Very low	128 Å²	128	110.1 Å²	110.1	67%	0.67	66%	0.66	S	S	*	*			trans	-66.2	149	168.6	-68.5	165.4	0	0	0	109.6	L698	L696-L698 VanDerWaalsContact C-N 3.28Å; L696-L698 PolarHBondContact O-N 2.92Å
697	P	31.3	Very low	38.3	Very low	101 Å²	101	107.4 Å²	107.4	66%	0.656	64%	0.644	S	S	*	*			trans	-67.5	87.1	169.7	28.2	-33.9	0	0	0	110.4	G699	P697-G699 PolarHBondContact O-N 2.75Å
698	L	44	Very low	39.7	Very low	164 Å²	164	104.4 Å²	104.4	86%	0.859	61%	0.611	S	S	*	*			trans	-84.7	91.6	173.4	-169.7	76	0	0	0	108.5	L696	L696-L698 VanDerWaalsContact C-N 3.28Å; L696-L698 PolarHBondContact O-N 2.92Å
699	G	33.8	Very low	40.9	Very low	52 Å²	52	99.7 Å²	99.7	54%	0.536	59%	0.587	S	S	.	*	S	Bend	trans	-162.6	-53.2	-179.5	0	0	0	0	0	115.2	P697	P697-G699 PolarHBondContact O-N 2.75Å
700	T	36.7	Very low	42.5	Very low	106 Å²	106	101.2 Å²	101.2	65%	0.65	58%	0.583	S	S	*	*	S	Bend	trans	-110.5	-21.8	-167.5	51.2	0	0	0	0	115.1	T704	T700-T704 PolarHBondContact O-OG1 3.12Å
701	T	49.9	Very low	44	Very low	80 Å²	80	97.1 Å²	97.1	49%	0.491	56%	0.563	S	S	.	*	H	α-helix	trans	-78.9	-33.6	-172.5	50.4	0	0	0	0	113.6	T704 L705	T701-T704 WeakPolarHBondContact CA-OG1 3.3Å; T701-T704 PolarHBondContact O-OG1 3.09Å; T701-T704 VanDerWaalsContact O-OG1 3.13Å; T701-L705 VanDerWaalsContact O-CB 3.26Å; T701-L705 WeakPolarHBondContact O-CB 3.46Å; T701-L705 PolarHBondContact O-N 2.65Å
702	K	52.1	Low	45.4	Very low	127 Å²	127	92.2 Å²	92.2	55%	0.552	54%	0.539	S	S	*	.	H	α-helix	trans	-65.1	-52.6	-177.2	-175.8	-175.2	169.2	-167.2	0	111.6	T704 L705 E706	K702-T704 VanDerWaalsContact C-N 3.35Å; K702-T704 PolarHBondContact O-N 3.32Å; K702-L705 PolarHBondContact O-N 3.35Å; K702-E706 VanDerWaalsContact CE-CD 3.4Å; K702-E706 WeakPolarHBondContact CE-OE1 3.4Å; K702-E706 WeakPolarHBondContact CE-OE2 3.32Å; K702-E706 HydrophobicContact CG-CG 4.41Å; K702-E706 IonicContact NZ-OE1 2.64Å; K702-E706 WeakPolarHBondContact O-CB 3.46Å; K702-E706 WeakPolarHBondContact O-CG 3.01Å; K702-E706 PolarHBondContact O-N 3.27Å
703	E	44	Very low	46.6	Very low	142 Å²	142	96 Å²	96	66%	0.664	55%	0.548	S	S	*	.	H	α-helix	trans	-67.4	-36	-175.5	-60.9	177.7	172.9	0	0	112.1	S707	E703-S707 WeakPolarHBondContact O-CB 3.23Å; E703-S707 PolarHBondContact O-N 2.84Å
704	T	53.3	Low	47.5	Very low	78 Å²	78	96 Å²	96	48%	0.479	55%	0.547	S	S	.	.	H	α-helix	trans	-69.5	-38.2	173.9	46.6	0	0	0	0	112.3	T700 T701 K702 V708	T700-T704 PolarHBondContact O-OG1 3.12Å; T701-T704 WeakPolarHBondContact CA-OG1 3.3Å; T701-T704 PolarHBondContact O-OG1 3.09Å; T701-T704 VanDerWaalsContact O-OG1 3.13Å; K702-T704 VanDerWaalsContact C-N 3.35Å; K702-T704 PolarHBondContact O-N 3.32Å; T704-V708 WeakPolarHBondContact O-CB 3.4Å; T704-V708 VanDerWaalsContact O-CG2 3.23Å; T704-V708 WeakPolarHBondContact O-CG2 3.36Å; T704-V708 PolarHBondContact O-N 3.28Å
705	L	51	Low	48.4	Very low	58 Å²	58	98.4 Å²	98.4	30%	0.304	55%	0.55	S	S	.	.	H	α-helix	trans	-69.1	-43.7	174.7	-157.3	79.7	0	0	0	111.7	T701 K702 V708 L709 M776	T701-L705 VanDerWaalsContact O-CB 3.26Å; T701-L705 WeakPolarHBondContact O-CB 3.46Å; T701-L705 PolarHBondContact O-N 2.65Å; K702-L705 PolarHBondContact O-N 3.35Å; L705-V708 PolarHBondContact O-N 3.35Å; L705-L709 HydrophobicContact CG-CD1 4.39Å; L705-L709 VanDerWaalsContact O-CG 3.29Å; L705-L709 WeakPolarHBondContact O-CG 3.45Å; L705-L709 PolarHBondContact O-N 3.24Å; L705-M776 HydrophobicContact CD1-SD 4.26Å
706	E	51.7	Low	49.1	Very low	93 Å²	93	99.7 Å²	99.7	44%	0.435	55%	0.551	S	S	.	*	H	α-helix	trans	-63.9	-42.1	176.2	-73.6	175.8	165.1	0	0	111.3	K702 V708 L709 V710	K702-E706 VanDerWaalsContact CE-CD 3.4Å; K702-E706 WeakPolarHBondContact CE-OE1 3.4Å; K702-E706 WeakPolarHBondContact CE-OE2 3.32Å; K702-E706 HydrophobicContact CG-CG 4.41Å; K702-E706 IonicContact NZ-OE1 2.64Å; K702-E706 WeakPolarHBondContact O-CB 3.46Å; K702-E706 WeakPolarHBondContact O-CG 3.01Å; K702-E706 PolarHBondContact O-N 3.27Å; E706-V708 VanDerWaalsContact C-N 3.34Å; E706-V708 PolarHBondContact O-N 3.32Å; E706-L709 PolarHBondContact O-N 2.81Å; E706-V710 WeakPolarHBondContact O-CB 3.49Å; E706-V710 WeakPolarHBondContact O-CG2 3.39Å; E706-V710 PolarHBondContact O-N 2.98Å
707	S	52.4	Low	49.6	Very low	69 Å²	69	99.7 Å²	99.7	48%	0.483	56%	0.559	S	S	.	*	H	α-helix	trans	-59.6	-40.4	172.1	178.6	0	0	0	0	112.7	E703 A711	E703-S707 WeakPolarHBondContact O-CB 3.23Å; E703-S707 PolarHBondContact O-N 2.84Å; S707-A711 WeakPolarHBondContact O-CB 3.5Å; S707-A711 PolarHBondContact O-N 3.44Å
708	V	56.6	Low	50.4	Low	9 Å²	9	102.3 Å²	102.3	6%	0.055	56%	0.56	C	S	.	*	H	α-helix	trans	-69.1	-40.8	176.4	167.9	0	0	0	0	111.7	T704 L705 E706 A711 L712 K737 V740	T704-V708 WeakPolarHBondContact O-CB 3.4Å; T704-V708 VanDerWaalsContact O-CG2 3.23Å; T704-V708 WeakPolarHBondContact O-CG2 3.36Å; T704-V708 PolarHBondContact O-N 3.28Å; L705-V708 PolarHBondContact O-N 3.35Å; E706-V708 VanDerWaalsContact C-N 3.34Å; E706-V708 PolarHBondContact O-N 3.32Å; V708-A711 PolarHBondContact O-N 3.25Å; V708-L712 HydrophobicContact CG1-CD1 4.1Å; V708-L712 VanDerWaalsContact O-CG 3.27Å; V708-L712 WeakPolarHBondContact O-CG 3.36Å; V708-L712 PolarHBondContact O-N 2.86Å; V708-K737 HydrophobicContact CG2-CD 3.83Å; V708-K737 HydrophobicContact CG2-CG 3.72Å; V708-V740 HydrophobicContact CG1-CG1 4.28Å
709	L	55.6	Low	50.8	Low	87 Å²	87	104.3 Å²	104.3	46%	0.455	56%	0.561	S	S	.	*	H	α-helix	trans	-65.2	-43.3	176.4	-70.7	165.9	0	0	0	111.8	L705 E706 A711 L712 D713	L705-L709 HydrophobicContact CG-CD1 4.39Å; L705-L709 VanDerWaalsContact O-CG 3.29Å; L705-L709 WeakPolarHBondContact O-CG 3.45Å; L705-L709 PolarHBondContact O-N 3.24Å; E706-L709 PolarHBondContact O-N 2.81Å; L709-A711 VanDerWaalsContact C-N 3.33Å; L709-A711 PolarHBondContact O-N 2.95Å; L709-L712 WeakPolarHBondContact O-CB 3.41Å; L709-L712 PolarHBondContact O-N 3.03Å; L709-D713 PolarHBondContact O-N 3.04Å; L709-D713 VanDerWaalsContact O-N 3.13Å
710	V	62.1	Low	52	Low	96 Å²	96	106.2 Å²	106.2	58%	0.582	56%	0.559	S	S	*	*	H	α-helix	trans	-61.8	-40.7	174.2	169.7	0	0	0	0	111.3	E706 L712 D713 T714	E706-V710 WeakPolarHBondContact O-CB 3.49Å; E706-V710 WeakPolarHBondContact O-CG2 3.39Å; E706-V710 PolarHBondContact O-N 2.98Å; V710-L712 VanDerWaalsContact C-N 3.34Å; V710-L712 PolarHBondContact O-N 3.09Å; V710-D713 PolarHBondContact O-N 2.81Å; V710-T714 WeakPolarHBondContact O-CG2 3.47Å; V710-T714 PolarHBondContact O-N 3.12Å
711	A	58.2	Low	53.5	Low	53 Å²	53	112.2 Å²	112.2	44%	0.438	57%	0.57	S	S	.	*	H	α-helix	trans	-61.5	-41.8	174.7	0	0	0	0	0	112	S707 V708 L709 D713 T714	S707-A711 WeakPolarHBondContact O-CB 3.5Å; S707-A711 PolarHBondContact O-N 3.44Å; V708-A711 PolarHBondContact O-N 3.25Å; L709-A711 VanDerWaalsContact C-N 3.33Å; L709-A711 PolarHBondContact O-N 2.95Å; A711-D713 VanDerWaalsContact C-N 3.35Å; A711-D713 PolarHBondContact O-N 3.43Å; A711-T714 PolarHBondContact O-N 2.92Å; A711-T714 VanDerWaalsContact O-N 3.16Å; A711-T714 PolarHBondContact O-OG1 2.78Å
712	L	56.3	Low	54.8	Low	56 Å²	56	110.2 Å²	110.2	29%	0.293	55%	0.554	S	S	.	*	H	α-helix	trans	-63.2	-36.1	179	-71.7	166.6	0	0	0	113	V708 L709 V710 T714 V740 L741	V708-L712 HydrophobicContact CG1-CD1 4.1Å; V708-L712 VanDerWaalsContact O-CG 3.27Å; V708-L712 WeakPolarHBondContact O-CG 3.36Å; V708-L712 PolarHBondContact O-N 2.86Å; L709-L712 WeakPolarHBondContact O-CB 3.41Å; L709-L712 PolarHBondContact O-N 3.03Å; V710-L712 VanDerWaalsContact C-N 3.34Å; V710-L712 PolarHBondContact O-N 3.09Å; L712-T714 VanDerWaalsContact C-N 3.31Å; L712-T714 PolarHBondContact O-N 3.37Å; L712-V740 HydrophobicContact CD1-CG1 4.14Å; L712-L741 HydrophobicContact CD2-CD1 3.72Å
713	D	55.9	Low	56.2	Low	154 Å²	154	109.2 Å²	109.2	82%	0.824	55%	0.551	S	S	*	*	H	α-helix	trans	-70.3	-23.4	175.4	-88.3	-22.6	0	0	0	113.5	L709 V710 A711	L709-D713 PolarHBondContact O-N 3.04Å; L709-D713 VanDerWaalsContact O-N 3.13Å; V710-D713 PolarHBondContact O-N 2.81Å; A711-D713 VanDerWaalsContact C-N 3.35Å; A711-D713 PolarHBondContact O-N 3.43Å
714	T	55.4	Low	57.9	Low	105 Å²	105	104.8 Å²	104.8	64%	0.644	54%	0.535	S	S	*	.	H	α-helix	trans	-80.9	-24.1	179.5	64.3	0	0	0	0	114.4	V710 A711 L712	V710-T714 WeakPolarHBondContact O-CG2 3.47Å; V710-T714 PolarHBondContact O-N 3.12Å; A711-T714 PolarHBondContact O-N 2.92Å; A711-T714 VanDerWaalsContact O-N 3.16Å; A711-T714 PolarHBondContact O-OG1 2.78Å; L712-T714 VanDerWaalsContact C-N 3.31Å; L712-T714 PolarHBondContact O-N 3.37Å
715	E	48.9	Very low	59.6	Low	142 Å²	142	105.4 Å²	105.4	66%	0.664	53%	0.531	S	S	*	.	S	Bend	trans	-95.2	104.5	-178	-75.2	-151.3	-148.7	0	0	113.1
716	K	45.9	Very low	61.5	Low	194 Å²	194	106.7 Å²	106.7	84%	0.843	54%	0.536	S	S	*	.			trans	-53.5	125.1	172.4	-70.6	179.5	-179.8	173.3	0	110.4	K718	K716-K718 PolarHBondContact O-N 3.14Å
717	P	46.3	Very low	63.4	Low	127 Å²	127	102.3 Å²	102.3	83%	0.825	52%	0.515	S	S	*	.			trans	-68.9	95	-166.4	25.2	-35.2	0	0	0	112.8
718	K	49.4	Very low	65.4	Low	157 Å²	157	99 Å²	99	68%	0.683	49%	0.492	S	S	*	.			trans	-59.9	138.1	151.5	-64	165.2	-170.9	154.5	0	106.7	K716 L720	K716-K718 PolarHBondContact O-N 3.14Å; K718-L720 HydrophobicContact CB-CD1 3.67Å; K718-L720 PolarHBondContact O-N 2.76Å
719	K	51.3	Low	67.3	Low	205 Å²	205	102.5 Å²	102.5	89%	0.891	51%	0.51	S	S	*	.			trans	-72.2	73.5	175.7	-68.5	-175	176.3	-177.8	0	111	R721	K719-R721 PolarHBondContact O-N 3.38Å
720	L	59.3	Low	69.1	Low	93 Å²	93	98.8 Å²	98.8	49%	0.487	49%	0.491	S	S	.	.			trans	-68.7	83.7	167.1	-92.2	70.4	0	0	0	107.9	K718 F722	K718-L720 HydrophobicContact CB-CD1 3.67Å; K718-L720 PolarHBondContact O-N 2.76Å; L720-F722 HydrophobicContact CB-CE1 4.43Å; L720-F722 HydrophobicContact CB-CE2 3.87Å; L720-F722 HydrophobicContact CB-CZ 3.78Å; L720-F722 HydrophobicContact CD2-CE1 4.32Å; L720-F722 HydrophobicContact CD2-CZ 3.88Å; L720-F722 HydrophobicContact CG-CZ 4.45Å; L720-F722 WeakPolarHBondContact O-CD2 3.5Å; L720-F722 WeakPolarHBondContact O-CE2 3.31Å; L720-F722 PolarHBondContact O-N 2.82Å
721	R	67.1	Low	70.7	Confident	232 Å²	232	94.2 Å²	94.2	88%	0.875	46%	0.463	S	S	*	.			trans	-73	97.3	176.8	-174.1	-178	-170.7	169.8	5	109.2	K719	K719-R721 PolarHBondContact O-N 3.38Å
722	F	77.1	Confident	72.5	Confident	38 Å²	38	95.1 Å²	95.1	17%	0.167	46%	0.457	C	S	.	.			trans	-67.9	148.1	176.7	-60.2	-80.3	0	0	0	111.1	L720 L741 M742 D745	L720-F722 HydrophobicContact CB-CE1 4.43Å; L720-F722 HydrophobicContact CB-CE2 3.87Å; L720-F722 HydrophobicContact CB-CZ 3.78Å; L720-F722 HydrophobicContact CD2-CE1 4.32Å; L720-F722 HydrophobicContact CD2-CZ 3.88Å; L720-F722 HydrophobicContact CG-CZ 4.45Å; L720-F722 WeakPolarHBondContact O-CD2 3.5Å; L720-F722 WeakPolarHBondContact O-CE2 3.31Å; L720-F722 PolarHBondContact O-N 2.82Å; F722-L741 HydrophobicContact CE2-CD2 4.28Å; F722-L741 HydrophobicContact CE2-CG 3.86Å; F722-L741 HydrophobicContact CZ-CD2 3.65Å; F722-L741 HydrophobicContact CZ-CG 3.73Å; F722-M742 HydrophobicContact CB-CG 3.76Å; F722-M742 HydrophobicContact CB-SD 4.03Å; F722-M742 HydrophobicContact CD1-CG 3.64Å; F722-M742 HydrophobicContact CD1-SD 4Å; F722-M742 HydrophobicContact CD2-CG 3.73Å; F722-M742 HydrophobicContact CE1-CG 4.15Å; F722-M742 HydrophobicContact CE2-CG 4.24Å; F722-M742 HydrophobicContact CG-CG 3.41Å; F722-M742 VanDerWaalsContact CG-CG 3.41Å; F722-M742 HydrophobicContact CG-SD 4.09Å; F722-M742 HydrophobicContact CZ-CG 4.44Å; F722-D745 HydrophobicContact CD2-CB 4.05Å; F722-D745 HydrophobicContact CE2-CB 4.39Å
723	H	82.3	Confident	74.3	Confident	105 Å²	105	98.1 Å²	98.1	49%	0.486	47%	0.47	S	S	.	.			trans	-92.5	126.9	172.4	-176.1	-63	0	0	0	107.9	K725 Q726	H723-K725 PolarHBondContact ND1-N 3.24Å; H723-K725 PolarHBondContact O-N 2.9Å; H723-Q726 HydrophobicContact CB-CG 4.38Å; H723-Q726 VanDerWaalsContact O-CB 3.28Å; H723-Q726 WeakPolarHBondContact O-CB 3.15Å; H723-Q726 WeakPolarHBondContact O-CG 3.37Å; H723-Q726 PolarHBondContact O-N 3.49Å
724	P	78.9	Confident	76.2	Confident	50 Å²	50	92.1 Å²	92.1	33%	0.325	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-35.2	-170.4	-32.7	36.3	0	0	0	116.4	Q726 L727 T747 F751	P724-Q726 PolarHBondContact O-N 3.31Å; P724-Q726 VanDerWaalsContact O-N 3.11Å; P724-L727 WeakPolarHBondContact O-CB 3.29Å; P724-L727 PolarHBondContact O-N 3.38Å; P724-T747 HydrophobicContact CB-CG2 4.28Å; P724-F751 HydrophobicContact CB-CB 4.4Å; P724-F751 HydrophobicContact CB-CD1 4.13Å; P724-F751 HydrophobicContact CB-CD2 3.58Å; P724-F751 HydrophobicContact CB-CE1 4.37Å; P724-F751 HydrophobicContact CB-CE2 3.85Å; P724-F751 HydrophobicContact CB-CG 3.74Å; P724-F751 HydrophobicContact CB-CZ 4.25Å
725	K	89.9	Confident	78	Confident	91 Å²	91	89.6 Å²	89.6	40%	0.396	43%	0.425	S	S	.	.	H	α-helix	trans	-51.4	-28.1	169.9	-66.4	-179.5	-178.9	-177.6	0	115.2	H723 L729 F751 M753	H723-K725 PolarHBondContact ND1-N 3.24Å; H723-K725 PolarHBondContact O-N 2.9Å; K725-L729 WeakPolarHBondContact O-CG 3.38Å; K725-L729 PolarHBondContact O-N 2.75Å; K725-F751 HydrophobicContact CB-CE1 4.43Å; K725-F751 HydrophobicContact CG-CE1 3.87Å; K725-F751 HydrophobicContact CG-CZ 3.74Å; K725-M753 HydrophobicContact CB-CE 3.78Å; K725-M753 HydrophobicContact CG-CE 3.97Å; K725-M753 WeakPolarHBondContact O-CE 3.47Å
726	Q	91.5	Very high	80	Confident	85 Å²	85	84.3 Å²	84.3	40%	0.397	40%	0.402	S	S	.	.	H	α-helix	trans	-67.8	-35.4	177	-66.5	176.9	-65.6	0	0	111.6	H723 P724 F728 L729 S730 M742	H723-Q726 HydrophobicContact CB-CG 4.38Å; H723-Q726 VanDerWaalsContact O-CB 3.28Å; H723-Q726 WeakPolarHBondContact O-CB 3.15Å; H723-Q726 WeakPolarHBondContact O-CG 3.37Å; H723-Q726 PolarHBondContact O-N 3.49Å; P724-Q726 PolarHBondContact O-N 3.31Å; P724-Q726 VanDerWaalsContact O-N 3.11Å; Q726-F728 VanDerWaalsContact C-N 3.31Å; Q726-F728 PolarHBondContact O-N 2.94Å; Q726-L729 PolarHBondContact O-N 3.25Å; Q726-L729 VanDerWaalsContact O-N 3.14Å; Q726-S730 WeakPolarHBondContact O-CB 3.48Å; Q726-S730 PolarHBondContact O-N 2.84Å; Q726-M742 HydrophobicContact CB-CE 4.39Å; Q726-M742 HydrophobicContact CB-SD 3.64Å
727	L	92.1	Very high	82	Confident	0 Å²	0	81.9 Å²	81.9	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-60.8	-42.6	177	-178.8	61.9	0	0	0	111.2	P724 A731 V739 M742 L743 T747 P761 L777	P724-L727 WeakPolarHBondContact O-CB 3.29Å; P724-L727 PolarHBondContact O-N 3.38Å; L727-A731 WeakPolarHBondContact O-CB 2.78Å; L727-A731 PolarHBondContact O-N 2.72Å; L727-V739 HydrophobicContact CD1-CB 4.36Å; L727-V739 HydrophobicContact CD1-CG1 3.94Å; L727-V739 HydrophobicContact CD1-CG2 4.37Å; L727-M742 HydrophobicContact CB-CE 4.41Å; L727-M742 HydrophobicContact CB-SD 4.11Å; L727-M742 HydrophobicContact CD1-CB 4.06Å; L727-M742 HydrophobicContact CD1-CE 4.34Å; L727-M742 PolarHBondContact N-SD 2.8Å; L727-M742 VanDerWaalsContact N-SD 3.42Å; L727-L743 HydrophobicContact CD1-CD2 4.2Å; L727-L743 HydrophobicContact CD1-CG 4.24Å; L727-L743 HydrophobicContact CD2-CD2 3.88Å; L727-T747 HydrophobicContact CB-CG2 4.07Å; L727-T747 HydrophobicContact CD2-CG2 3.73Å; L727-P761 HydrophobicContact CB-CG 4.41Å; L727-P761 HydrophobicContact CD2-CG 4.05Å; L727-P761 HydrophobicContact CG-CB 4.17Å; L727-P761 HydrophobicContact CG-CG 3.86Å; L727-L777 HydrophobicContact CD1-CD2 4.35Å; L727-L777 HydrophobicContact CD2-CD2 4.42Å
728	F	94.5	Very high	84.1	Confident	1 Å²	1	80.5 Å²	80.5	0%	0.004	37%	0.372	C	S	.	.	H	α-helix	trans	-63.6	-43.6	173.3	-179.2	-79.6	0	0	0	112.3	Q726 A731 K732 M753 Q756 R759 P761 A764	Q726-F728 VanDerWaalsContact C-N 3.31Å; Q726-F728 PolarHBondContact O-N 2.94Å; F728-A731 PolarHBondContact O-N 3.48Å; F728-K732 HydrophobicContact CE1-CD 4.3Å; F728-K732 WeakPolarHBondContact O-CB 3.2Å; F728-K732 PolarHBondContact O-N 3.44Å; F728-M753 HydrophobicContact CB-CE 3.6Å; F728-M753 HydrophobicContact CD1-CE 3.42Å; F728-M753 VanDerWaalsContact CD1-CE 3.42Å; F728-M753 HydrophobicContact CD1-SD 3.64Å; F728-M753 HydrophobicContact CD2-CB 4.05Å; F728-M753 HydrophobicContact CD2-CE 4.48Å; F728-M753 HydrophobicContact CE1-CE 4.23Å; F728-M753 HydrophobicContact CE1-SD 3.83Å; F728-M753 HydrophobicContact CE2-CB 4.25Å; F728-M753 HydrophobicContact CG-CB 4.29Å; F728-M753 HydrophobicContact CG-CE 3.59Å; F728-M753 HydrophobicContact CG-SD 4.11Å; F728-M753 HydrophobicContact CZ-SD 4.43Å; F728-Q756 HydrophobicContact CE1-CB 4.29Å; F728-Q756 HydrophobicContact CE1-CG 4Å; F728-Q756 HydrophobicContact CZ-CB 3.91Å; F728-Q756 HydrophobicContact CZ-CG 4.12Å; F728-R759 HydrophobicContact CE2-CB 3.88Å; F728-R759 WeakPolarHBondContact CE2-O 3.28Å; F728-R759 HydrophobicContact CZ-CB 4.36Å; F728-P761 HydrophobicContact CB-CG 4.21Å; F728-A764 HydrophobicContact CD2-CB 4.19Å; F728-A764 HydrophobicContact CE1-CB 4.25Å; F728-A764 HydrophobicContact CE2-CB 3.89Å; F728-A764 HydrophobicContact CG-CB 4.49Å; F728-A764 HydrophobicContact CZ-CB 3.93Å
729	L	94.7	Very high	86	Confident	82 Å²	82	73 Å²	73	43%	0.429	34%	0.339	S	S	.	.	H	α-helix	trans	-67.9	-45.5	-178.1	-69.7	171.1	0	0	0	112	K725 Q726 A731 K732 Q733 M753	K725-L729 WeakPolarHBondContact O-CG 3.38Å; K725-L729 PolarHBondContact O-N 2.75Å; Q726-L729 PolarHBondContact O-N 3.25Å; Q726-L729 VanDerWaalsContact O-N 3.14Å; L729-A731 VanDerWaalsContact C-N 3.35Å; L729-K732 PolarHBondContact O-N 3.04Å; L729-Q733 WeakPolarHBondContact O-CB 3.3Å; L729-Q733 VanDerWaalsContact O-CG 3.23Å; L729-Q733 WeakPolarHBondContact O-CG 3.42Å; L729-Q733 PolarHBondContact O-N 3.01Å; L729-Q733 VanDerWaalsContact O-N 3.12Å; L729-M753 HydrophobicContact CG-CE 4.48Å
730	S	95	Very high	87.7	Confident	8 Å²	8	63.7 Å²	63.7	6%	0.056	30%	0.3	C	S	.	.	H	α-helix	trans	-65.7	-35.6	174.8	-72.8	0	0	0	0	112.3	Q726 Q733 G734 E735	Q726-S730 WeakPolarHBondContact O-CB 3.48Å; Q726-S730 PolarHBondContact O-N 2.84Å; S730-Q733 CarbonylContact O-C 3.6Å; S730-Q733 PolarHBondContact O-N 3.2Å; S730-G734 PolarHBondContact O-N 3.07Å; S730-E735 WeakPolarHBondContact CB-OE2 3.44Å; S730-E735 PolarHBondContact O-N 3.12Å; S730-E735 PolarHBondContact OG-OE2 3.5Å
731	A	95.1	Very high	89	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65	-37.4	171.5	0	0	0	0	0	112.4	L727 F728 L729 Q733 V739 P761 A765 Y770 I773 L777	L727-A731 WeakPolarHBondContact O-CB 2.78Å; L727-A731 PolarHBondContact O-N 2.72Å; F728-A731 PolarHBondContact O-N 3.48Å; L729-A731 VanDerWaalsContact C-N 3.35Å; A731-Q733 PolarHBondContact O-N 3.49Å; A731-V739 HydrophobicContact CB-CG2 4.39Å; A731-P761 HydrophobicContact CB-CB 4.05Å; A731-A765 HydrophobicContact CB-CB 4.44Å; A731-Y770 VanDerWaalsContact O-CD2 3.24Å; A731-Y770 WeakPolarHBondContact O-CD2 3.27Å; A731-I773 HydrophobicContact CB-CG2 4Å; A731-L777 HydrophobicContact CB-CD1 4.49Å
732	K	94.9	Very high	90	Very high	73 Å²	73	51.2 Å²	51.2	32%	0.317	25%	0.25	S	S	.	.	H	α-helix	trans	-69.9	-15.2	172.9	-157	175.7	172.1	49.2	0	113.7	F728 L729 A764 E767	F728-K732 HydrophobicContact CE1-CD 4.3Å; F728-K732 WeakPolarHBondContact O-CB 3.2Å; F728-K732 PolarHBondContact O-N 3.44Å; L729-K732 PolarHBondContact O-N 3.04Å; K732-A764 HydrophobicContact CB-CB 3.9Å; K732-A764 HydrophobicContact CG-CB 4.22Å; K732-E767 IonicContact NZ-OE1 2.59Å; K732-E767 PolarHBondContact NZ-OE1 3.16Å; K732-E767 IonicContact NZ-OE2 2.96Å; K732-E767 PolarHBondContact NZ-OE2 2.81Å
733	Q	95.4	Very high	90.4	Very high	118 Å²	118	50.6 Å²	50.6	55%	0.551	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.8	6.6	-172.8	-73.9	173.4	-6.7	0	0	113.4	L729 S730 A731 E735	L729-Q733 WeakPolarHBondContact O-CB 3.3Å; L729-Q733 VanDerWaalsContact O-CG 3.23Å; L729-Q733 WeakPolarHBondContact O-CG 3.42Å; L729-Q733 PolarHBondContact O-N 3.01Å; L729-Q733 VanDerWaalsContact O-N 3.12Å; S730-Q733 CarbonylContact O-C 3.6Å; S730-Q733 PolarHBondContact O-N 3.2Å; A731-Q733 PolarHBondContact O-N 3.49Å; Q733-E735 VanDerWaalsContact C-N 3.25Å; Q733-E735 HydrophobicContact CB-CG 3.72Å; Q733-E735 PolarHBondContact O-N 3.06Å
734	G	94.3	Very high	90.4	Very high	28 Å²	28	50.7 Å²	50.7	29%	0.289	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.4	16.3	-178.9	0	0	0	0	0	114.4	S730 L736 Y770 I773	S730-G734 PolarHBondContact O-N 3.07Å; G734-L736 VanDerWaalsContact C-N 3.3Å; G734-L736 PolarHBondContact O-N 3.45Å; G734-Y770 VanDerWaalsContact N-CE2 3.28Å; G734-I773 VanDerWaalsContact C-CD1 3.45Å
735	E	94.8	Very high	90.5	Very high	53 Å²	53	52.5 Å²	52.5	25%	0.248	26%	0.263	C	S	.	.			trans	-84.7	61.8	-169.7	-52.4	-168.3	114.8	0	0	113.3	S730 Q733 K737 K738 V739	S730-E735 WeakPolarHBondContact CB-OE2 3.44Å; S730-E735 PolarHBondContact O-N 3.12Å; S730-E735 PolarHBondContact OG-OE2 3.5Å; Q733-E735 VanDerWaalsContact C-N 3.25Å; Q733-E735 HydrophobicContact CB-CG 3.72Å; Q733-E735 PolarHBondContact O-N 3.06Å; E735-K737 VanDerWaalsContact C-N 3.27Å; E735-K737 PolarHBondContact O-N 3.44Å; E735-K737 VanDerWaalsContact O-N 3.08Å; E735-K738 HydrophobicContact CB-CB 4.17Å; E735-K738 HydrophobicContact CB-CD 4.01Å; E735-K738 VanDerWaalsContact CD-CD 3.46Å; E735-K738 HydrophobicContact CG-CD 4.37Å; E735-K738 PolarHBondContact O-N 2.8Å; E735-K738 IonicContact OE1-NZ 2.98Å; E735-K738 PolarHBondContact OE1-NZ 2.88Å; E735-K738 WeakPolarHBondContact OE2-CD 3.23Å; E735-K738 IonicContact OE2-NZ 3.75Å; E735-K738 PolarHBondContact OE2-NZ 3.2Å; E735-V739 PolarHBondContact O-N 2.24Å
736	L	90.5	Very high	89.9	Confident	31 Å²	31	51.2 Å²	51.2	16%	0.162	28%	0.275	C	S	.	.	H	α-helix	trans	-43.6	-48.8	-175.7	-179.9	68.8	0	0	0	113.2	G734 K738 V739 V740 D772 I773 M776	G734-L736 VanDerWaalsContact C-N 3.3Å; G734-L736 PolarHBondContact O-N 3.45Å; L736-K738 VanDerWaalsContact C-N 3.29Å; L736-K738 PolarHBondContact O-N 3.34Å; L736-V739 WeakPolarHBondContact O-CB 3.17Å; L736-V739 PolarHBondContact O-N 2.69Å; L736-V739 VanDerWaalsContact O-N 3.13Å; L736-V740 HydrophobicContact CD1-CG2 4.08Å; L736-V740 HydrophobicContact CG-CG2 4.26Å; L736-V740 WeakPolarHBondContact O-CG2 3.41Å; L736-V740 PolarHBondContact O-N 3.37Å; L736-D772 HydrophobicContact CD1-CB 4.36Å; L736-D772 WeakPolarHBondContact CD2-OD2 3.47Å; L736-I773 HydrophobicContact CB-CG1 4.22Å; L736-I773 HydrophobicContact CD1-CG1 3.93Å; L736-M776 HydrophobicContact CD1-CG 3.88Å
737	K	87.3	Confident	89.6	Confident	142 Å²	142	47.8 Å²	47.8	62%	0.617	26%	0.26	S	S	*	.	H	α-helix	trans	-58.1	-38.6	-178.1	-56.2	-162.3	176.7	-171.5	0	113	V708 E735 L741	V708-K737 HydrophobicContact CG2-CD 3.83Å; V708-K737 HydrophobicContact CG2-CG 3.72Å; E735-K737 VanDerWaalsContact C-N 3.27Å; E735-K737 PolarHBondContact O-N 3.44Å; E735-K737 VanDerWaalsContact O-N 3.08Å; K737-L741 WeakPolarHBondContact O-CB 3.5Å; K737-L741 PolarHBondContact O-N 3.3Å
738	K	90.4	Very high	89.2	Confident	99 Å²	99	52 Å²	52	43%	0.43	28%	0.283	S	S	.	.	H	α-helix	trans	-76.6	-37.6	177	-77	167.8	169.4	175.8	0	111.7	E735 L736 L741 M742	E735-K738 HydrophobicContact CB-CB 4.17Å; E735-K738 HydrophobicContact CB-CD 4.01Å; E735-K738 VanDerWaalsContact CD-CD 3.46Å; E735-K738 HydrophobicContact CG-CD 4.37Å; E735-K738 PolarHBondContact O-N 2.8Å; E735-K738 IonicContact OE1-NZ 2.98Å; E735-K738 PolarHBondContact OE1-NZ 2.88Å; E735-K738 WeakPolarHBondContact OE2-CD 3.23Å; E735-K738 IonicContact OE2-NZ 3.75Å; E735-K738 PolarHBondContact OE2-NZ 3.2Å; L736-K738 VanDerWaalsContact C-N 3.29Å; L736-K738 PolarHBondContact O-N 3.34Å; K738-L741 PolarHBondContact O-N 3.26Å; K738-M742 HydrophobicContact CB-CE 4.1Å; K738-M742 WeakPolarHBondContact O-CB 3.24Å; K738-M742 VanDerWaalsContact O-CE 3.26Å; K738-M742 WeakPolarHBondContact O-CE 3.44Å; K738-M742 WeakPolarHBondContact O-CG 3.47Å; K738-M742 PolarHBondContact O-N 2.81Å
739	V	90.4	Very high	88.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.7	-51.8	173.2	171.7	0	0	0	0	110.2	L727 A731 E735 L736 L741 M742 L743 I773 L777	L727-V739 HydrophobicContact CD1-CB 4.36Å; L727-V739 HydrophobicContact CD1-CG1 3.94Å; L727-V739 HydrophobicContact CD1-CG2 4.37Å; A731-V739 HydrophobicContact CB-CG2 4.39Å; E735-V739 PolarHBondContact O-N 2.24Å; L736-V739 WeakPolarHBondContact O-CB 3.17Å; L736-V739 PolarHBondContact O-N 2.69Å; L736-V739 VanDerWaalsContact O-N 3.13Å; V739-L741 PolarHBondContact O-N 3.42Å; V739-M742 PolarHBondContact O-N 3.23Å; V739-L743 HydrophobicContact CG1-CD1 3.76Å; V739-L743 HydrophobicContact CG1-CG 4.35Å; V739-L743 VanDerWaalsContact O-CG 3.3Å; V739-L743 WeakPolarHBondContact O-CG 3.32Å; V739-L743 PolarHBondContact O-N 2.9Å; V739-I773 HydrophobicContact CG1-CG2 4.27Å; V739-I773 HydrophobicContact CG2-CD1 4.25Å; V739-I773 HydrophobicContact CG2-CG2 4.22Å; V739-L777 HydrophobicContact CG1-CD2 4.45Å
740	V	86.1	Confident	88.6	Confident	9 Å²	9	50.3 Å²	50.3	6%	0.055	28%	0.275	C	S	.	.	H	α-helix	trans	-56.3	-49.9	177.7	174.5	0	0	0	0	111.1	V708 L712 L736 M742 L743 V744 M776	V708-V740 HydrophobicContact CG1-CG1 4.28Å; L712-V740 HydrophobicContact CD1-CG1 4.14Å; L736-V740 HydrophobicContact CD1-CG2 4.08Å; L736-V740 HydrophobicContact CG-CG2 4.26Å; L736-V740 WeakPolarHBondContact O-CG2 3.41Å; L736-V740 PolarHBondContact O-N 3.37Å; V740-M742 VanDerWaalsContact C-N 3.34Å; V740-M742 PolarHBondContact O-N 3.44Å; V740-L743 PolarHBondContact O-N 3.04Å; V740-V744 HydrophobicContact CG1-CG2 4.44Å; V740-V744 WeakPolarHBondContact O-CG2 3.4Å; V740-V744 PolarHBondContact O-N 2.02Å; V740-M776 HydrophobicContact CG2-CE 4.26Å; V740-M776 HydrophobicContact CG2-CG 4.13Å
741	L	86.9	Confident	88.4	Confident	60 Å²	60	52 Å²	52	31%	0.314	28%	0.281	S	S	.	.	H	α-helix	trans	-59.4	-40.1	178.4	179.3	58.1	0	0	0	113	L712 F722 K737 K738 V739 V744 D745	L712-L741 HydrophobicContact CD2-CD1 3.72Å; F722-L741 HydrophobicContact CE2-CD2 4.28Å; F722-L741 HydrophobicContact CE2-CG 3.86Å; F722-L741 HydrophobicContact CZ-CD2 3.65Å; F722-L741 HydrophobicContact CZ-CG 3.73Å; K737-L741 WeakPolarHBondContact O-CB 3.5Å; K737-L741 PolarHBondContact O-N 3.3Å; K738-L741 PolarHBondContact O-N 3.26Å; V739-L741 PolarHBondContact O-N 3.42Å; L741-V744 PolarHBondContact O-N 2.81Å; L741-D745 PolarHBondContact O-N 2.75Å; L741-D745 VanDerWaalsContact O-N 3.08Å
742	M	87.8	Confident	88.2	Confident	3 Å²	3	55.4 Å²	55.4	2%	0.015	30%	0.296	C	S	.	.	H	α-helix	trans	-69.7	-35.9	177	-79.7	-174.1	-77.4	0	0	113.5	F722 Q726 L727 K738 V739 V740 T747	F722-M742 HydrophobicContact CB-CG 3.76Å; F722-M742 HydrophobicContact CB-SD 4.03Å; F722-M742 HydrophobicContact CD1-CG 3.64Å; F722-M742 HydrophobicContact CD1-SD 4Å; F722-M742 HydrophobicContact CD2-CG 3.73Å; F722-M742 HydrophobicContact CE1-CG 4.15Å; F722-M742 HydrophobicContact CE2-CG 4.24Å; F722-M742 HydrophobicContact CG-CG 3.41Å; F722-M742 VanDerWaalsContact CG-CG 3.41Å; F722-M742 HydrophobicContact CG-SD 4.09Å; F722-M742 HydrophobicContact CZ-CG 4.44Å; Q726-M742 HydrophobicContact CB-CE 4.39Å; Q726-M742 HydrophobicContact CB-SD 3.64Å; L727-M742 HydrophobicContact CB-CE 4.41Å; L727-M742 HydrophobicContact CB-SD 4.11Å; L727-M742 HydrophobicContact CD1-CB 4.06Å; L727-M742 HydrophobicContact CD1-CE 4.34Å; L727-M742 PolarHBondContact N-SD 2.8Å; L727-M742 VanDerWaalsContact N-SD 3.42Å; K738-M742 HydrophobicContact CB-CE 4.1Å; K738-M742 WeakPolarHBondContact O-CB 3.24Å; K738-M742 VanDerWaalsContact O-CE 3.26Å; K738-M742 WeakPolarHBondContact O-CE 3.44Å; K738-M742 WeakPolarHBondContact O-CG 3.47Å; K738-M742 PolarHBondContact O-N 2.81Å; V739-M742 PolarHBondContact O-N 3.23Å; V740-M742 VanDerWaalsContact C-N 3.34Å; V740-M742 PolarHBondContact O-N 3.44Å; M742-T747 WeakPolarHBondContact O-CB 3.5Å; M742-T747 PolarHBondContact O-N 3.48Å; M742-T747 PolarHBondContact O-OG1 3.05Å
743	L	85	Confident	88	Confident	25 Å²	25	52.3 Å²	52.3	13%	0.131	28%	0.283	C	S	.	.	H	α-helix	trans	-70.4	-35.4	175.2	-65.3	172.1	0	0	0	111.2	L727 V739 V740 G746 P749 M776 L777 A780	L727-L743 HydrophobicContact CD1-CD2 4.2Å; L727-L743 HydrophobicContact CD1-CG 4.24Å; L727-L743 HydrophobicContact CD2-CD2 3.88Å; V739-L743 HydrophobicContact CG1-CD1 3.76Å; V739-L743 HydrophobicContact CG1-CG 4.35Å; V739-L743 VanDerWaalsContact O-CG 3.3Å; V739-L743 WeakPolarHBondContact O-CG 3.32Å; V739-L743 PolarHBondContact O-N 2.9Å; V740-L743 PolarHBondContact O-N 3.04Å; L743-G746 WeakPolarHBondContact O-CA 3.27Å; L743-G746 PolarHBondContact O-N 3.18Å; L743-P749 HydrophobicContact CD2-CB 3.97Å; L743-P749 HydrophobicContact CD2-CG 4.48Å; L743-M776 HydrophobicContact CD1-CB 4.33Å; L743-L777 HydrophobicContact CD1-CD2 4.24Å; L743-L777 HydrophobicContact CD2-CD2 4.22Å; L743-A780 HydrophobicContact CB-CB 4.45Å; L743-A780 HydrophobicContact CD1-CB 3.98Å; L743-A780 HydrophobicContact CD2-CB 3.85Å; L743-A780 HydrophobicContact CG-CB 4.3Å
744	V	82.6	Confident	87.7	Confident	107 Å²	107	52.4 Å²	52.4	65%	0.648	29%	0.287	S	S	*	.	H	α-helix	trans	-68.6	-33.3	174.2	172.2	0	0	0	0	112.6	V740 L741 G746	V740-V744 HydrophobicContact CG1-CG2 4.44Å; V740-V744 WeakPolarHBondContact O-CG2 3.4Å; V740-V744 PolarHBondContact O-N 2.02Å; L741-V744 PolarHBondContact O-N 2.81Å; V744-G746 PolarHBondContact O-N 3.26Å
745	D	81.1	Confident	87.5	Confident	88 Å²	88	54.6 Å²	54.6	47%	0.471	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-3.3	168.7	-166.4	52.6	0	0	0	112.9	F722 L741	F722-D745 HydrophobicContact CD2-CB 4.05Å; F722-D745 HydrophobicContact CE2-CB 4.39Å; L741-D745 PolarHBondContact O-N 2.75Å; L741-D745 VanDerWaalsContact O-N 3.08Å
746	G	76.7	Confident	87.2	Confident	63 Å²	63	56 Å²	56	65%	0.649	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	27.3	178	0	0	0	0	0	114.4	L743 V744 D748	L743-G746 WeakPolarHBondContact O-CA 3.27Å; L743-G746 PolarHBondContact O-N 3.18Å; V744-G746 PolarHBondContact O-N 3.26Å; G746-D748 PolarHBondContact O-N 3.07Å
747	T	85.8	Confident	87.2	Confident	13 Å²	13	58 Å²	58	8%	0.08	32%	0.316	C	S	.	.			trans	-68.7	127.2	172.6	-52.8	0	0	0	0	110.2	P724 L727 M742 P749	P724-T747 HydrophobicContact CB-CG2 4.28Å; L727-T747 HydrophobicContact CB-CG2 4.07Å; L727-T747 HydrophobicContact CD2-CG2 3.73Å; M742-T747 WeakPolarHBondContact O-CB 3.5Å; M742-T747 PolarHBondContact O-N 3.48Å; M742-T747 PolarHBondContact O-OG1 3.05Å; T747-P749 WeakPolarHBondContact O-CD 3.43Å
748	D	83.1	Confident	87.5	Confident	88 Å²	88	54.9 Å²	54.9	47%	0.471	30%	0.302	S	S	.	.			trans	-62.8	117.4	179.2	176	19.2	0	0	0	111.9	G746 N750 F751	G746-D748 PolarHBondContact O-N 3.07Å; D748-N750 PolarHBondContact O-N 3.16Å; D748-N750 VanDerWaalsContact OD1-CB 3.28Å; D748-N750 WeakPolarHBondContact OD1-CB 3.3Å; D748-N750 PolarHBondContact OD1-N 3.45Å; D748-N750 PolarHBondContact OD1-ND2 2.71Å; D748-N750 VanDerWaalsContact OD1-ND2 3.12Å; D748-F751 WeakPolarHBondContact O-CB 3.45Å; D748-F751 PolarHBondContact O-N 3.43Å
749	P	87.3	Confident	87.7	Confident	9 Å²	9	51.1 Å²	51.1	6%	0.058	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-14.5	177.8	30.8	-36.5	0	0	0	113.3	L743 T747 F751 L777 A780 A782	L743-P749 HydrophobicContact CD2-CB 3.97Å; L743-P749 HydrophobicContact CD2-CG 4.48Å; T747-P749 WeakPolarHBondContact O-CD 3.43Å; P749-F751 VanDerWaalsContact C-N 3.29Å; P749-L777 HydrophobicContact CB-CD2 3.8Å; P749-A780 HydrophobicContact CG-CB 4.12Å; P749-A782 HydrophobicContact CB-CB 4.09Å; P749-A782 HydrophobicContact CG-CB 4.42Å
750	N	90.2	Very high	88	Confident	39 Å²	39	51.2 Å²	51.2	21%	0.209	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	5.1	177.1	-56.8	-77.9	0	0	0	113	D748 K752 G781 A782 N783 M786	D748-N750 PolarHBondContact O-N 3.16Å; D748-N750 VanDerWaalsContact OD1-CB 3.28Å; D748-N750 WeakPolarHBondContact OD1-CB 3.3Å; D748-N750 PolarHBondContact OD1-N 3.45Å; D748-N750 PolarHBondContact OD1-ND2 2.71Å; D748-N750 VanDerWaalsContact OD1-ND2 3.12Å; N750-K752 PolarHBondContact O-N 2.83Å; N750-K752 VanDerWaalsContact O-N 3.14Å; N750-G781 PolarHBondContact ND2-O 2.78Å; N750-A782 WeakPolarHBondContact OD1-CA 3.49Å; N750-N783 PolarHBondContact OD1-N 3.23Å; N750-M786 HydrophobicContact CB-CE 4.1Å; N750-M786 HydrophobicContact CB-SD 3.74Å; N750-M786 WeakPolarHBondContact O-CE 3.28Å; N750-M786 PolarHBondContact OD1-SD 2.94Å; N750-M786 VanDerWaalsContact OD1-SD 3.33Å
751	F	89.9	Confident	88.4	Confident	44 Å²	44	50.8 Å²	50.8	19%	0.193	28%	0.283	C	S	.	.			trans	-53.6	117.9	177.5	173.3	-100.5	0	0	0	112	P724 K725 D748 P749 M753 T760 P761	P724-F751 HydrophobicContact CB-CB 4.4Å; P724-F751 HydrophobicContact CB-CD1 4.13Å; P724-F751 HydrophobicContact CB-CD2 3.58Å; P724-F751 HydrophobicContact CB-CE1 4.37Å; P724-F751 HydrophobicContact CB-CE2 3.85Å; P724-F751 HydrophobicContact CB-CG 3.74Å; P724-F751 HydrophobicContact CB-CZ 4.25Å; K725-F751 HydrophobicContact CB-CE1 4.43Å; K725-F751 HydrophobicContact CG-CE1 3.87Å; K725-F751 HydrophobicContact CG-CZ 3.74Å; D748-F751 WeakPolarHBondContact O-CB 3.45Å; D748-F751 PolarHBondContact O-N 3.43Å; P749-F751 VanDerWaalsContact C-N 3.29Å; F751-M753 HydrophobicContact CE1-CB 4.18Å; F751-T760 WeakPolarHBondContact O-CA 3.49Å; F751-P761 WeakPolarHBondContact O-CD 3.44Å
752	K	91.3	Very high	88.9	Confident	72 Å²	72	48 Å²	48	31%	0.313	27%	0.268	S	S	.	.			trans	-86.9	128.8	174.5	-70.3	-164.4	168.6	-153	0	111.1	N750 D754 K758 T760 M786 C787	N750-K752 PolarHBondContact O-N 2.83Å; N750-K752 VanDerWaalsContact O-N 3.14Å; K752-D754 PolarHBondContact O-N 3.16Å; K752-K758 HydrophobicContact CB-CB 4.22Å; K752-K758 VanDerWaalsContact CB-O 3.3Å; K752-K758 WeakPolarHBondContact CB-O 3.43Å; K752-K758 HydrophobicContact CD-CB 4.15Å; K752-K758 WeakPolarHBondContact CD-O 3.31Å; K752-K758 VanDerWaalsContact CG-O 3.27Å; K752-K758 WeakPolarHBondContact CG-O 3.19Å; K752-T760 HydrophobicContact CG-CG2 3.97Å; K752-M786 HydrophobicContact CD-CE 4.14Å; K752-M786 HydrophobicContact CG-CE 3.92Å; K752-C787 PolarHBondContact NZ-O 3.12Å
753	M	91.5	Very high	89.3	Confident	7 Å²	7	47.8 Å²	47.8	3%	0.034	27%	0.268	C	S	.	.			trans	-89.9	100.4	177.7	-176.4	172.2	-72.3	0	0	111.9	K725 F728 L729 F751 S755 Q756 K758 R759	K725-M753 HydrophobicContact CB-CE 3.78Å; K725-M753 HydrophobicContact CG-CE 3.97Å; K725-M753 WeakPolarHBondContact O-CE 3.47Å; F728-M753 HydrophobicContact CB-CE 3.6Å; F728-M753 HydrophobicContact CD1-CE 3.42Å; F728-M753 VanDerWaalsContact CD1-CE 3.42Å; F728-M753 HydrophobicContact CD1-SD 3.64Å; F728-M753 HydrophobicContact CD2-CB 4.05Å; F728-M753 HydrophobicContact CD2-CE 4.48Å; F728-M753 HydrophobicContact CE1-CE 4.23Å; F728-M753 HydrophobicContact CE1-SD 3.83Å; F728-M753 HydrophobicContact CE2-CB 4.25Å; F728-M753 HydrophobicContact CG-CB 4.29Å; F728-M753 HydrophobicContact CG-CE 3.59Å; F728-M753 HydrophobicContact CG-SD 4.11Å; F728-M753 HydrophobicContact CZ-SD 4.43Å; L729-M753 HydrophobicContact CG-CE 4.48Å; F751-M753 HydrophobicContact CE1-CB 4.18Å; M753-S755 VanDerWaalsContact CG-OG 3.26Å; M753-S755 WeakPolarHBondContact CG-OG 3.23Å; M753-S755 PolarHBondContact O-N 3.4Å; M753-Q756 HydrophobicContact CB-CB 4.3Å; M753-Q756 HydrophobicContact CG-CB 4.06Å; M753-Q756 HydrophobicContact CG-CG 4.15Å; M753-Q756 CarbonylContact O-C 3.42Å; M753-Q756 PolarHBondContact O-N 3.46Å; M753-Q756 HydrophobicContact SD-CB 3.98Å; M753-Q756 HydrophobicContact SD-CG 3.46Å; M753-Q756 WeakPolarHBondContact SD-CG 3.21Å; M753-K758 VanDerWaalsContact O-CA 3.26Å; M753-K758 WeakPolarHBondContact O-CA 3.46Å; M753-K758 PolarHBondContact O-N 3.26Å; M753-R759 PolarHBondContact N-O 2.74Å
754	D	88.6	Confident	89.9	Confident	121 Å²	121	46.6 Å²	46.6	65%	0.647	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-26.1	177.8	-57.2	-58.3	0	0	0	114.5	K752	K752-D754 PolarHBondContact O-N 3.16Å
755	S	89.5	Confident	90.6	Very high	74 Å²	74	41.5 Å²	41.5	52%	0.517	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-0.1	178.5	49.8	0	0	0	0	114.7	M753	M753-S755 VanDerWaalsContact CG-OG 3.26Å; M753-S755 WeakPolarHBondContact CG-OG 3.23Å; M753-S755 PolarHBondContact O-N 3.4Å
756	Q	88.7	Confident	91.4	Very high	82 Å²	82	37.3 Å²	37.3	38%	0.383	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.8	64.1	179.7	-66.5	-70.2	-95.3	0	0	109.1	F728 M753 K758 R759	F728-Q756 HydrophobicContact CE1-CB 4.29Å; F728-Q756 HydrophobicContact CE1-CG 4Å; F728-Q756 HydrophobicContact CZ-CB 3.91Å; F728-Q756 HydrophobicContact CZ-CG 4.12Å; M753-Q756 HydrophobicContact CB-CB 4.3Å; M753-Q756 HydrophobicContact CG-CB 4.06Å; M753-Q756 HydrophobicContact CG-CG 4.15Å; M753-Q756 CarbonylContact O-C 3.42Å; M753-Q756 PolarHBondContact O-N 3.46Å; M753-Q756 HydrophobicContact SD-CB 3.98Å; M753-Q756 HydrophobicContact SD-CG 3.46Å; M753-Q756 WeakPolarHBondContact SD-CG 3.21Å; Q756-K758 PolarHBondContact O-N 3.43Å; Q756-R759 VanDerWaalsContact O-CB 3.31Å; Q756-R759 WeakPolarHBondContact O-CB 3.44Å; Q756-R759 WeakPolarHBondContact O-CG 3.43Å; Q756-R759 PolarHBondContact O-N 3.43Å
757	N	91.1	Very high	92.3	Very high	73 Å²	73	36.7 Å²	36.7	39%	0.39	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	31.8	176.9	-61.1	25.8	0	0	0	114.1	R759 D788 E789 D790	N757-R759 HydrophobicContact CB-CG 4.48Å; N757-R759 PolarHBondContact O-N 2.82Å; N757-R759 VanDerWaalsContact O-N 3.12Å; N757-D788 WeakPolarHBondContact O-CB 3.37Å; N757-E789 WeakPolarHBondContact CA-OE2 3.25Å; N757-E789 HydrophobicContact CB-CB 4.21Å; N757-E789 WeakPolarHBondContact O-CB 3.43Å; N757-E789 WeakPolarHBondContact O-CG 3.34Å; N757-E789 PolarHBondContact O-N 2.77Å; N757-D790 PolarHBondContact ND2-OD2 2.83Å
758	K	92.9	Very high	92.8	Very high	76 Å²	76	37.1 Å²	37.1	33%	0.33	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	19.4	-172.1	-58.9	-170.4	-177.5	86.1	0	115.8	K752 M753 Q756 E789	K752-K758 HydrophobicContact CB-CB 4.22Å; K752-K758 VanDerWaalsContact CB-O 3.3Å; K752-K758 WeakPolarHBondContact CB-O 3.43Å; K752-K758 HydrophobicContact CD-CB 4.15Å; K752-K758 WeakPolarHBondContact CD-O 3.31Å; K752-K758 VanDerWaalsContact CG-O 3.27Å; K752-K758 WeakPolarHBondContact CG-O 3.19Å; M753-K758 VanDerWaalsContact O-CA 3.26Å; M753-K758 WeakPolarHBondContact O-CA 3.46Å; M753-K758 PolarHBondContact O-N 3.26Å; Q756-K758 PolarHBondContact O-N 3.43Å; K758-E789 HydrophobicContact CB-CG 3.96Å; K758-E789 HydrophobicContact CD-CG 3.94Å; K758-E789 HydrophobicContact CG-CG 3.69Å; K758-E789 IonicContact NZ-OE1 3.97Å; K758-E789 PolarHBondContact NZ-OE1 2.84Å
759	R	95.1	Very high	93.4	Very high	20 Å²	20	33.9 Å²	33.9	8%	0.075	18%	0.183	C	C	.	.			trans	-59.8	148.6	175.1	-67.8	172.3	74.1	-121.5	-9.4	111.2	F728 M753 Q756 N757 H763 E767 D788 E797	F728-R759 HydrophobicContact CE2-CB 3.88Å; F728-R759 WeakPolarHBondContact CE2-O 3.28Å; F728-R759 HydrophobicContact CZ-CB 4.36Å; M753-R759 PolarHBondContact N-O 2.74Å; Q756-R759 VanDerWaalsContact O-CB 3.31Å; Q756-R759 WeakPolarHBondContact O-CB 3.44Å; Q756-R759 WeakPolarHBondContact O-CG 3.43Å; Q756-R759 PolarHBondContact O-N 3.43Å; N757-R759 HydrophobicContact CB-CG 4.48Å; N757-R759 PolarHBondContact O-N 2.82Å; N757-R759 VanDerWaalsContact O-N 3.12Å; R759-H763 HydrophobicContact CB-CB 4.02Å; R759-H763 HydrophobicContact CG-CB 4.39Å; R759-H763 PolarHBondContact NH2-O 2.86Å; R759-E767 IonicContact CZ-OE2 3.67Å; R759-E767 IonicContact NH1-OE1 3.27Å; R759-E767 IonicContact NH1-OE2 2.69Å; R759-E767 PolarHBondContact NH1-OE2 2.69Å; R759-E767 IonicContact NH2-OE2 2.74Å; R759-E767 PolarHBondContact NH2-OE2 3.19Å; R759-D788 HydrophobicContact CB-CB 4.35Å; R759-D788 WeakPolarHBondContact CD-OD2 3.42Å; R759-D788 HydrophobicContact CG-CB 3.45Å; R759-D788 VanDerWaalsContact CG-CB 3.45Å; R759-D788 WeakPolarHBondContact CG-OD2 3.43Å; R759-E797 IonicContact CZ-OE2 3.56Å; R759-E797 IonicContact NE-OE2 3.55Å; R759-E797 PolarHBondContact NE-OE2 2.72Å; R759-E797 IonicContact NH2-OE2 2.74Å; R759-E797 PolarHBondContact NH2-OE2 2.72Å
760	T	96	Very high	93.9	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.018	20%	0.195	C	C	.	.			trans	-95.5	164.4	177.5	68.3	0	0	0	0	111.6	F751 K752 L762 H763 A764 M786	F751-T760 WeakPolarHBondContact O-CA 3.49Å; K752-T760 HydrophobicContact CG-CG2 3.97Å; T760-L762 PolarHBondContact O-N 2.78Å; T760-L762 VanDerWaalsContact O-N 3.11Å; T760-L762 PolarHBondContact OG1-N 3.27Å; T760-H763 PolarHBondContact N-ND1 3.32Å; T760-H763 VanDerWaalsContact N-ND1 3.16Å; T760-H763 WeakPolarHBondContact O-CB 3.42Å; T760-H763 PolarHBondContact O-N 2.77Å; T760-H763 PolarHBondContact OG1-ND1 3.36Å; T760-A764 PolarHBondContact O-N 2.75Å; T760-M786 HydrophobicContact CG2-CB 4.42Å; T760-M786 HydrophobicContact CG2-CE 3.77Å; T760-M786 HydrophobicContact CG2-SD 4.41Å
761	P	95.8	Very high	94	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-48.8	-33.5	169.6	-29.3	32.5	0	0	0	114.1	L727 F728 A731 F751 A764 A765 L777	L727-P761 HydrophobicContact CB-CG 4.41Å; L727-P761 HydrophobicContact CD2-CG 4.05Å; L727-P761 HydrophobicContact CG-CB 4.17Å; L727-P761 HydrophobicContact CG-CG 3.86Å; F728-P761 HydrophobicContact CB-CG 4.21Å; A731-P761 HydrophobicContact CB-CB 4.05Å; F751-P761 WeakPolarHBondContact O-CD 3.44Å; P761-A764 PolarHBondContact O-N 2.87Å; P761-A765 WeakPolarHBondContact O-CB 3.38Å; P761-A765 PolarHBondContact O-N 3.23Å; P761-L777 HydrophobicContact CB-CD1 3.91Å; P761-L777 HydrophobicContact CB-CD2 3.93Å
762	L	96.8	Very high	94.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-69.4	-33.4	178.7	-171	61.2	0	0	0	112.6	T760 A766 C774 L777 V778 A782 L784 P794 L810	T760-L762 PolarHBondContact O-N 2.78Å; T760-L762 VanDerWaalsContact O-N 3.11Å; T760-L762 PolarHBondContact OG1-N 3.27Å; L762-A766 WeakPolarHBondContact O-CB 3.5Å; L762-A766 PolarHBondContact O-N 2.93Å; L762-C774 HydrophobicContact CD1-CB 3.99Å; L762-L777 HydrophobicContact CB-CD1 4.31Å; L762-L777 HydrophobicContact CD1-CB 4.23Å; L762-L777 HydrophobicContact CD1-CD1 4.26Å; L762-V778 HydrophobicContact CD1-CG2 4.19Å; L762-V778 HydrophobicContact CD2-CG2 4.13Å; L762-A782 HydrophobicContact CB-CB 4.48Å; L762-A782 HydrophobicContact CD2-CB 4Å; L762-L784 HydrophobicContact CD2-CD2 4.23Å; L762-P794 HydrophobicContact CB-CG 4.15Å; L762-P794 HydrophobicContact CD2-CB 4.26Å; L762-P794 HydrophobicContact CD2-CG 3.99Å; L762-P794 HydrophobicContact CG-CB 3.87Å; L762-P794 HydrophobicContact CG-CG 3.86Å; L762-L810 HydrophobicContact CD1-CD2 4.41Å
763	H	97.4	Very high	94.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.5	-43	171	-63	70.6	0	0	0	110.8	R759 T760 A766 E767 M786 R792	R759-H763 HydrophobicContact CB-CB 4.02Å; R759-H763 HydrophobicContact CG-CB 4.39Å; R759-H763 PolarHBondContact NH2-O 2.86Å; T760-H763 PolarHBondContact N-ND1 3.32Å; T760-H763 VanDerWaalsContact N-ND1 3.16Å; T760-H763 WeakPolarHBondContact O-CB 3.42Å; T760-H763 PolarHBondContact O-N 2.77Å; T760-H763 PolarHBondContact OG1-ND1 3.36Å; H763-A766 PolarHBondContact O-N 2.73Å; H763-E767 VanDerWaalsContact O-CB 3.26Å; H763-E767 WeakPolarHBondContact O-CB 3.39Å; H763-E767 PolarHBondContact O-N 3.29Å; H763-M786 PolarHBondContact CE1-O 2.94Å; H763-M786 PolarHBondContact NE2-O 2.55Å; H763-R792 PolarHBondContact NE2-O 3.4Å
764	A	96.5	Very high	94.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67.8	-35.5	-179.2	0	0	0	0	0	112.6	F728 K732 T760 P761 G768	F728-A764 HydrophobicContact CD2-CB 4.19Å; F728-A764 HydrophobicContact CE1-CB 4.25Å; F728-A764 HydrophobicContact CE2-CB 3.89Å; F728-A764 HydrophobicContact CG-CB 4.49Å; F728-A764 HydrophobicContact CZ-CB 3.93Å; K732-A764 HydrophobicContact CB-CB 3.9Å; K732-A764 HydrophobicContact CG-CB 4.22Å; T760-A764 PolarHBondContact O-N 2.75Å; P761-A764 PolarHBondContact O-N 2.87Å; A764-G768 PolarHBondContact O-N 2.82Å
765	A	97.3	Very high	94.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-68.3	-39.3	172.2	0	0	0	0	0	112	A731 P761 G768 G769 Y770 I773 C774 L777	A731-A765 HydrophobicContact CB-CB 4.44Å; P761-A765 WeakPolarHBondContact O-CB 3.38Å; P761-A765 PolarHBondContact O-N 3.23Å; A765-G768 CarbonylContact O-C 3.57Å; A765-G768 PolarHBondContact O-N 3.28Å; A765-G769 PolarHBondContact O-N 2.94Å; A765-G769 VanDerWaalsContact O-N 3.08Å; A765-Y770 PolarHBondContact O-N 2.97Å; A765-I773 HydrophobicContact CB-CB 4.23Å; A765-I773 HydrophobicContact CB-CG2 3.57Å; A765-C774 VanDerWaalsContact CB-SG 3.58Å; A765-L777 HydrophobicContact CB-CD1 4.06Å
766	A	97.6	Very high	94.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-73.1	-39.2	179.7	0	0	0	0	0	113.5	L762 H763 G768 G769 P794 A798 H803 V806 L810	L762-A766 WeakPolarHBondContact O-CB 3.5Å; L762-A766 PolarHBondContact O-N 2.93Å; H763-A766 PolarHBondContact O-N 2.73Å; A766-G768 PolarHBondContact O-N 2.97Å; A766-G769 PolarHBondContact O-N 3.25Å; A766-P794 HydrophobicContact CB-CB 4.1Å; A766-P794 WeakPolarHBondContact CB-O 3.31Å; A766-A798 HydrophobicContact CB-CB 4.22Å; A766-H803 PolarHBondContact O-CD2 3.29Å; A766-V806 HydrophobicContact CB-CG1 4.05Å; A766-L810 HydrophobicContact CB-CD1 4.41Å
767	E	96.9	Very high	94.5	Very high	49 Å²	49	25.8 Å²	25.8	23%	0.229	14%	0.136	C	C	.	.	H	α-helix	trans	-59.7	-32.1	169.3	-178.5	-166.8	174.7	0	0	112	K732 R759 H763 H803	K732-E767 IonicContact NZ-OE1 2.59Å; K732-E767 PolarHBondContact NZ-OE1 3.16Å; K732-E767 IonicContact NZ-OE2 2.96Å; K732-E767 PolarHBondContact NZ-OE2 2.81Å; R759-E767 IonicContact CZ-OE2 3.67Å; R759-E767 IonicContact NH1-OE1 3.27Å; R759-E767 IonicContact NH1-OE2 2.69Å; R759-E767 PolarHBondContact NH1-OE2 2.69Å; R759-E767 IonicContact NH2-OE2 2.74Å; R759-E767 PolarHBondContact NH2-OE2 3.19Å; H763-E767 VanDerWaalsContact O-CB 3.26Å; H763-E767 WeakPolarHBondContact O-CB 3.39Å; H763-E767 PolarHBondContact O-N 3.29Å; E767-H803 PolarHBondContact O-CD2 2.89Å; E767-H803 PolarHBondContact O-NE2 2.76Å
768	G	94.8	Very high	94.4	Very high	22 Å²	22	23.6 Å²	23.6	23%	0.227	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-1.2	179.6	0	0	0	0	0	115.8	A764 A765 A766 Y770	A764-G768 PolarHBondContact O-N 2.82Å; A765-G768 CarbonylContact O-C 3.57Å; A765-G768 PolarHBondContact O-N 3.28Å; A766-G768 PolarHBondContact O-N 2.97Å; G768-Y770 VanDerWaalsContact C-N 3.28Å; G768-Y770 WeakPolarHBondContact O-CE1 3.42Å; G768-Y770 PolarHBondContact O-N 2.66Å
769	G	96.3	Very high	93.9	Very high	21 Å²	21	24.1 Å²	24.1	22%	0.216	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.3	8.5	179.3	0	0	0	0	0	116	A765 A766 A771 H803 V806	A765-G769 PolarHBondContact O-N 2.94Å; A765-G769 VanDerWaalsContact O-N 3.08Å; A766-G769 PolarHBondContact O-N 3.25Å; G769-A771 PolarHBondContact O-N 3.47Å; G769-H803 WeakPolarHBondContact CA-ND1 3.33Å; G769-H803 PolarHBondContact N-CD2 3.41Å; G769-V806 VanDerWaalsContact C-CG2 3.49Å; G769-V806 WeakPolarHBondContact O-CG2 3.41Å
770	Y	97.4	Very high	93.2	Very high	77 Å²	77	25.5 Å²	25.5	30%	0.302	15%	0.145	S	C	.	.			trans	-79.4	81.3	-171.9	-52.8	-56.7	0	0	0	111.8	A731 G734 A765 G768 D772 I773 C774	A731-Y770 VanDerWaalsContact O-CD2 3.24Å; A731-Y770 WeakPolarHBondContact O-CD2 3.27Å; G734-Y770 VanDerWaalsContact N-CE2 3.28Å; A765-Y770 PolarHBondContact O-N 2.97Å; G768-Y770 VanDerWaalsContact C-N 3.28Å; G768-Y770 WeakPolarHBondContact O-CE1 3.42Å; G768-Y770 PolarHBondContact O-N 2.66Å; Y770-D772 VanDerWaalsContact C-N 3.28Å; Y770-D772 PolarHBondContact O-N 2.72Å; Y770-I773 HydrophobicContact CD2-CD1 4.41Å; Y770-I773 HydrophobicContact CG-CD1 4.21Å; Y770-I773 PolarHBondContact O-N 3.24Å; Y770-C774 PolarHBondContact O-N 3.45Å; Y770-C774 PolarHBondContact O-SG 3.43Å
771	A	93.4	Very high	92.3	Very high	24 Å²	24	27.3 Å²	27.3	20%	0.198	16%	0.164	C	C	.	.	H	α-helix	trans	-61.9	-32.4	-176.8	0	0	0	0	0	113.6	G769 H775 E805 V806	G769-A771 PolarHBondContact O-N 3.47Å; A771-H775 WeakPolarHBondContact O-CB 3.36Å; A771-H775 PolarHBondContact O-N 3.08Å; A771-E805 HydrophobicContact CB-CB 4.4Å; A771-V806 HydrophobicContact CB-CG2 4.01Å
772	D	90.9	Very high	92	Very high	63 Å²	63	27.7 Å²	27.7	34%	0.337	17%	0.167	S	C	.	.	H	α-helix	trans	-65.2	-45.3	173.1	64.6	-35.2	0	0	0	112.4	L736 Y770 H775 M776	L736-D772 HydrophobicContact CD1-CB 4.36Å; L736-D772 WeakPolarHBondContact CD2-OD2 3.47Å; Y770-D772 VanDerWaalsContact C-N 3.28Å; Y770-D772 PolarHBondContact O-N 2.72Å; D772-H775 WeakPolarHBondContact O-CB 3.29Å; D772-H775 PolarHBondContact O-N 2.92Å; D772-M776 WeakPolarHBondContact O-CG 3.38Å; D772-M776 PolarHBondContact O-N 2.88Å
773	I	95.4	Very high	91.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.1	-40.5	175.8	-67.9	179.8	0	0	0	110.4	A731 G734 L736 V739 A765 Y770 H775 M776 L777	A731-I773 HydrophobicContact CB-CG2 4Å; G734-I773 VanDerWaalsContact C-CD1 3.45Å; L736-I773 HydrophobicContact CB-CG1 4.22Å; L736-I773 HydrophobicContact CD1-CG1 3.93Å; V739-I773 HydrophobicContact CG1-CG2 4.27Å; V739-I773 HydrophobicContact CG2-CD1 4.25Å; V739-I773 HydrophobicContact CG2-CG2 4.22Å; A765-I773 HydrophobicContact CB-CB 4.23Å; A765-I773 HydrophobicContact CB-CG2 3.57Å; Y770-I773 HydrophobicContact CD2-CD1 4.41Å; Y770-I773 HydrophobicContact CG-CD1 4.21Å; Y770-I773 PolarHBondContact O-N 3.24Å; I773-H775 VanDerWaalsContact C-N 3.3Å; I773-H775 PolarHBondContact O-N 3.37Å; I773-M776 PolarHBondContact O-N 3.07Å; I773-L777 HydrophobicContact CG2-CD1 3.83Å; I773-L777 HydrophobicContact CG2-CG 4.32Å; I773-L777 WeakPolarHBondContact O-CB 3.42Å; I773-L777 VanDerWaalsContact O-CG 3.25Å; I773-L777 WeakPolarHBondContact O-CG 3.43Å; I773-L777 PolarHBondContact O-N 3.31Å
774	C	94.1	Very high	90.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-57.4	-45.7	171.9	-67.3	0	0	0	0	110.7	L762 A765 Y770 L777 V778 Y809	L762-C774 HydrophobicContact CD1-CB 3.99Å; A765-C774 VanDerWaalsContact CB-SG 3.58Å; Y770-C774 PolarHBondContact O-N 3.45Å; Y770-C774 PolarHBondContact O-SG 3.43Å; C774-L777 PolarHBondContact O-N 3.37Å; C774-V778 WeakPolarHBondContact O-CB 3.41Å; C774-V778 VanDerWaalsContact O-CG2 3.27Å; C774-V778 WeakPolarHBondContact O-CG2 3.45Å; C774-V778 PolarHBondContact O-N 3.01Å; C774-Y809 HydrophobicContact CB-CD1 4.07Å; C774-Y809 HydrophobicContact CB-CE1 4.23Å
775	H	89.9	Confident	90.5	Very high	80 Å²	80	35.7 Å²	35.7	37%	0.37	21%	0.21	S	C	.	.	H	α-helix	trans	-59.8	-50.7	176.2	-173.9	94.3	0	0	0	112.1	A771 D772 I773 L777 V778 Q779 Y809	A771-H775 WeakPolarHBondContact O-CB 3.36Å; A771-H775 PolarHBondContact O-N 3.08Å; D772-H775 WeakPolarHBondContact O-CB 3.29Å; D772-H775 PolarHBondContact O-N 2.92Å; I773-H775 VanDerWaalsContact C-N 3.3Å; I773-H775 PolarHBondContact O-N 3.37Å; H775-L777 VanDerWaalsContact C-N 3.34Å; H775-L777 PolarHBondContact O-N 2.94Å; H775-V778 PolarHBondContact O-N 3.2Å; H775-Q779 WeakPolarHBondContact NE2-CG 3.45Å; H775-Q779 WeakPolarHBondContact O-CG 3.3Å; H775-Q779 PolarHBondContact O-N 2.74Å; H775-Y809 HydrophobicContact CB-CE1 4.32Å; H775-Y809 HydrophobicContact CB-CE2 4.37Å; H775-Y809 AromaticContact ND1-CE2 3.46Å; H775-Y809 WeakPolarHBondContact ND1-CE2 3.48Å; H775-Y809 AromaticContact ND1-CZ 3.67Å
776	M	89	Confident	90.2	Very high	34 Å²	34	37.4 Å²	37.4	17%	0.167	22%	0.218	C	C	.	.	H	α-helix	trans	-62.4	-38.8	179.7	-72.1	-52.3	-49.7	0	0	113.1	L705 L736 V740 L743 D772 I773 A780	L705-M776 HydrophobicContact CD1-SD 4.26Å; L736-M776 HydrophobicContact CD1-CG 3.88Å; V740-M776 HydrophobicContact CG2-CE 4.26Å; V740-M776 HydrophobicContact CG2-CG 4.13Å; L743-M776 HydrophobicContact CD1-CB 4.33Å; D772-M776 WeakPolarHBondContact O-CG 3.38Å; D772-M776 PolarHBondContact O-N 2.88Å; I773-M776 PolarHBondContact O-N 3.07Å; M776-A780 WeakPolarHBondContact O-CB 3.44Å; M776-A780 PolarHBondContact O-N 3.22Å
777	L	90.1	Very high	90	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.2	-43.9	175.6	-73.3	169.8	0	0	0	111.7	L727 A731 V739 L743 P749 P761 L762 A765 I773 C774 H775 A780 G781 A782	L727-L777 HydrophobicContact CD1-CD2 4.35Å; L727-L777 HydrophobicContact CD2-CD2 4.42Å; A731-L777 HydrophobicContact CB-CD1 4.49Å; V739-L777 HydrophobicContact CG1-CD2 4.45Å; L743-L777 HydrophobicContact CD1-CD2 4.24Å; L743-L777 HydrophobicContact CD2-CD2 4.22Å; P749-L777 HydrophobicContact CB-CD2 3.8Å; P761-L777 HydrophobicContact CB-CD1 3.91Å; P761-L777 HydrophobicContact CB-CD2 3.93Å; L762-L777 HydrophobicContact CB-CD1 4.31Å; L762-L777 HydrophobicContact CD1-CB 4.23Å; L762-L777 HydrophobicContact CD1-CD1 4.26Å; A765-L777 HydrophobicContact CB-CD1 4.06Å; I773-L777 HydrophobicContact CG2-CD1 3.83Å; I773-L777 HydrophobicContact CG2-CG 4.32Å; I773-L777 WeakPolarHBondContact O-CB 3.42Å; I773-L777 VanDerWaalsContact O-CG 3.25Å; I773-L777 WeakPolarHBondContact O-CG 3.43Å; I773-L777 PolarHBondContact O-N 3.31Å; C774-L777 PolarHBondContact O-N 3.37Å; H775-L777 VanDerWaalsContact C-N 3.34Å; H775-L777 PolarHBondContact O-N 2.94Å; L777-A780 PolarHBondContact O-N 3.22Å; L777-G781 PolarHBondContact O-N 2.86Å; L777-A782 HydrophobicContact CB-CB 4.07Å; L777-A782 WeakPolarHBondContact O-CB 3.31Å; L777-A782 PolarHBondContact O-N 2.81Å
778	V	88.1	Confident	89.9	Confident	26 Å²	26	36.3 Å²	36.3	16%	0.158	22%	0.215	C	C	.	.	H	α-helix	trans	-67.2	-41.8	178.5	171.7	0	0	0	0	111.4	L762 C774 H775 A780 G781 L784 Y809	L762-V778 HydrophobicContact CD1-CG2 4.19Å; L762-V778 HydrophobicContact CD2-CG2 4.13Å; C774-V778 WeakPolarHBondContact O-CB 3.41Å; C774-V778 VanDerWaalsContact O-CG2 3.27Å; C774-V778 WeakPolarHBondContact O-CG2 3.45Å; C774-V778 PolarHBondContact O-N 3.01Å; H775-V778 PolarHBondContact O-N 3.2Å; V778-A780 VanDerWaalsContact C-N 3.26Å; V778-A780 PolarHBondContact O-N 2.91Å; V778-G781 PolarHBondContact O-N 2.78Å; V778-L784 HydrophobicContact CG1-CD2 4.29Å; V778-L784 HydrophobicContact CG2-CD2 3.51Å; V778-Y809 HydrophobicContact CB-CE1 4.37Å; V778-Y809 HydrophobicContact CG2-CE1 4.16Å
779	Q	83.4	Confident	89.9	Confident	87 Å²	87	39.9 Å²	39.9	41%	0.407	23%	0.226	S	C	.	.	H	α-helix	trans	-62.6	-31.5	172.9	-67.8	-53.6	-61	0	0	112.8	M314 H775 G781	M314-Q779 HydrophobicContact CE-CB 4.46Å; H775-Q779 WeakPolarHBondContact NE2-CG 3.45Å; H775-Q779 WeakPolarHBondContact O-CG 3.3Å; H775-Q779 PolarHBondContact O-N 2.74Å; Q779-G781 PolarHBondContact O-N 2.92Å
780	A	79.6	Confident	89.8	Confident	49 Å²	49	41.8 Å²	41.8	41%	0.405	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-1.7	172.5	0	0	0	0	0	114.2	L743 P749 M776 L777 V778	L743-A780 HydrophobicContact CB-CB 4.45Å; L743-A780 HydrophobicContact CD1-CB 3.98Å; L743-A780 HydrophobicContact CD2-CB 3.85Å; L743-A780 HydrophobicContact CG-CB 4.3Å; P749-A780 HydrophobicContact CG-CB 4.12Å; M776-A780 WeakPolarHBondContact O-CB 3.44Å; M776-A780 PolarHBondContact O-N 3.22Å; L777-A780 PolarHBondContact O-N 3.22Å; V778-A780 VanDerWaalsContact C-N 3.26Å; V778-A780 PolarHBondContact O-N 2.91Å
781	G	77.6	Confident	89.7	Confident	41 Å²	41	42.4 Å²	42.4	42%	0.423	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.3	29.7	178.5	0	0	0	0	0	115	N750 L777 V778 Q779	N750-G781 PolarHBondContact ND2-O 2.78Å; L777-G781 PolarHBondContact O-N 2.86Å; V778-G781 PolarHBondContact O-N 2.78Å; Q779-G781 PolarHBondContact O-N 2.92Å
782	A	88.7	Confident	89.8	Confident	9 Å²	9	43.1 Å²	43.1	7%	0.074	24%	0.235	C	C	.	.			trans	-63.8	131.4	164	0	0	0	0	0	110.8	P749 N750 L762 L777	P749-A782 HydrophobicContact CB-CB 4.09Å; P749-A782 HydrophobicContact CG-CB 4.42Å; N750-A782 WeakPolarHBondContact OD1-CA 3.49Å; L762-A782 HydrophobicContact CB-CB 4.48Å; L762-A782 HydrophobicContact CD2-CB 4Å; L777-A782 HydrophobicContact CB-CB 4.07Å; L777-A782 WeakPolarHBondContact O-CB 3.31Å; L777-A782 PolarHBondContact O-N 2.81Å
783	N	83.1	Confident	90.1	Very high	84 Å²	84	40.1 Å²	40.1	45%	0.449	22%	0.219	S	C	.	.			trans	-81.4	122.5	173.4	176.3	3.9	0	0	0	110.6	N750 D785 M786	N750-N783 PolarHBondContact OD1-N 3.23Å; N783-D785 PolarHBondContact O-N 2.84Å; N783-D785 PolarHBondContact OD1-N 2.81Å; N783-D785 VanDerWaalsContact OD1-N 3.11Å; N783-M786 HydrophobicContact CB-CG 3.76Å; N783-M786 HydrophobicContact CB-SD 3.86Å
784	L	88.1	Confident	90.1	Very high	21 Å²	21	40.1 Å²	40.1	11%	0.11	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-36.2	-176.4	-59.1	172.6	0	0	0	113.3	L762 V778 P794 L810 A813 A815	L762-L784 HydrophobicContact CD2-CD2 4.23Å; V778-L784 HydrophobicContact CG1-CD2 4.29Å; V778-L784 HydrophobicContact CG2-CD2 3.51Å; L784-P794 WeakPolarHBondContact O-CD 3.49Å; L784-L810 HydrophobicContact CD2-CD2 3.76Å; L784-A813 HydrophobicContact CD1-CB 3.77Å; L784-A813 VanDerWaalsContact CD1-O 3.23Å; L784-A813 WeakPolarHBondContact CD1-O 3.47Å; L784-A813 HydrophobicContact CD2-CB 4.14Å; L784-A815 HydrophobicContact CB-CB 3.93Å; L784-A815 HydrophobicContact CD1-CB 4.29Å
785	D	89	Confident	90.3	Very high	62 Å²	62	40.1 Å²	40.1	33%	0.332	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	21.5	-173.8	-59.6	-46.3	0	0	0	112.6	N783 C787 S816	N783-D785 PolarHBondContact O-N 2.84Å; N783-D785 PolarHBondContact OD1-N 2.81Å; N783-D785 VanDerWaalsContact OD1-N 3.11Å; D785-C787 PolarHBondContact O-N 3.49Å; D785-S816 WeakPolarHBondContact OD1-CB 3.47Å; D785-S816 PolarHBondContact OD1-N 2.72Å
786	M	90.4	Very high	90.6	Very high	36 Å²	36	36.3 Å²	36.3	18%	0.177	20%	0.201	C	C	.	.			trans	-71.6	116.7	170.5	-84.8	-179.7	71.6	0	0	110.4	N750 K752 T760 H763 N783	N750-M786 HydrophobicContact CB-CE 4.1Å; N750-M786 HydrophobicContact CB-SD 3.74Å; N750-M786 WeakPolarHBondContact O-CE 3.28Å; N750-M786 PolarHBondContact OD1-SD 2.94Å; N750-M786 VanDerWaalsContact OD1-SD 3.33Å; K752-M786 HydrophobicContact CD-CE 4.14Å; K752-M786 HydrophobicContact CG-CE 3.92Å; T760-M786 HydrophobicContact CG2-CB 4.42Å; T760-M786 HydrophobicContact CG2-CE 3.77Å; T760-M786 HydrophobicContact CG2-SD 4.41Å; H763-M786 PolarHBondContact CE1-O 2.94Å; H763-M786 PolarHBondContact NE2-O 2.55Å; N783-M786 HydrophobicContact CB-CG 3.76Å; N783-M786 HydrophobicContact CB-SD 3.86Å
787	C	93.7	Very high	91	Very high	19 Å²	19	35.3 Å²	35.3	13%	0.128	20%	0.196	C	C	.	.			trans	-82.4	159	176.8	-31.8	0	0	0	0	112.8	K752 D785 R792 H819	K752-C787 PolarHBondContact NZ-O 3.12Å; D785-C787 PolarHBondContact O-N 3.49Å; C787-R792 CarbonylContact C-O 3.56Å; C787-R792 WeakPolarHBondContact CA-O 3.28Å; C787-H819 PolarHBondContact SG-CE1 3.45Å; C787-H819 PolarHBondContact SG-NE2 2.76Å
788	D	94.3	Very high	91.3	Very high	8 Å²	8	35.3 Å²	35.3	4%	0.043	20%	0.196	C	C	.	.			trans	-89.9	-158	170.7	79.2	-9.2	0	0	0	113.1	N757 R759 D790 Q791 R792	N757-D788 WeakPolarHBondContact O-CB 3.37Å; R759-D788 HydrophobicContact CB-CB 4.35Å; R759-D788 WeakPolarHBondContact CD-OD2 3.42Å; R759-D788 HydrophobicContact CG-CB 3.45Å; R759-D788 VanDerWaalsContact CG-CB 3.45Å; R759-D788 WeakPolarHBondContact CG-OD2 3.43Å; D788-D790 WeakPolarHBondContact OD1-CA 3.43Å; D788-D790 PolarHBondContact OD1-N 3.1Å; D788-Q791 PolarHBondContact OD1-N 3.05Å; D788-Q791 VanDerWaalsContact OD1-N 3.1Å; D788-R792 PolarHBondContact N-O 3.28Å; D788-R792 PolarHBondContact OD1-N 3.08Å
789	E	94.9	Very high	91.7	Very high	96 Å²	96	34.1 Å²	34.1	45%	0.449	19%	0.188	S	C	.	.	S	Bend	trans	-75.2	-26.4	175.1	-77	-171.1	131.1	0	0	113.9	N757 K758	N757-E789 WeakPolarHBondContact CA-OE2 3.25Å; N757-E789 HydrophobicContact CB-CB 4.21Å; N757-E789 WeakPolarHBondContact O-CB 3.43Å; N757-E789 WeakPolarHBondContact O-CG 3.34Å; N757-E789 PolarHBondContact O-N 2.77Å; K758-E789 HydrophobicContact CB-CG 3.96Å; K758-E789 HydrophobicContact CD-CG 3.94Å; K758-E789 HydrophobicContact CG-CG 3.69Å; K758-E789 IonicContact NZ-OE1 3.97Å; K758-E789 PolarHBondContact NZ-OE1 2.84Å
790	D	94.4	Very high	92.3	Very high	62 Å²	62	32.2 Å²	32.2	33%	0.332	18%	0.18	S	C	.	.	S	Bend	trans	-91.5	13.2	176.1	-59.9	-66.6	0	0	0	110.9	N757 D788 R792 D821 V822	N757-D790 PolarHBondContact ND2-OD2 2.83Å; D788-D790 WeakPolarHBondContact OD1-CA 3.43Å; D788-D790 PolarHBondContact OD1-N 3.1Å; D790-R792 HydrophobicContact CB-CG 4.5Å; D790-R792 PolarHBondContact O-N 2.65Å; D790-D821 WeakPolarHBondContact O-CB 3.27Å; D790-V822 HydrophobicContact CB-CG2 4.07Å; D790-V822 WeakPolarHBondContact O-CG1 3.4Å; D790-V822 WeakPolarHBondContact O-CG2 3.44Å; D790-V822 PolarHBondContact O-N 2.98Å
791	Q	95.3	Very high	93.1	Very high	90 Å²	90	33 Å²	33	42%	0.421	18%	0.177	S	C	.	.			trans	61.3	19.5	-179.3	-66.1	-79	108	0	0	114.4	D788 H819 V822	D788-Q791 PolarHBondContact OD1-N 3.05Å; D788-Q791 VanDerWaalsContact OD1-N 3.1Å; Q791-H819 PolarHBondContact O-CD2 2.85Å; Q791-H819 VanDerWaalsContact O-CD2 3.29Å; Q791-V822 HydrophobicContact CB-CG1 4.02Å; Q791-V822 HydrophobicContact CG-CG1 3.81Å
792	R	95.9	Very high	94	Very high	39 Å²	39	34.3 Å²	34.3	15%	0.147	17%	0.174	C	C	.	.			trans	-81.7	148.6	177.6	-68.7	174.7	150.7	-141	-0.7	111.6	H763 C787 D788 D790 M796 E797 E800 D821	H763-R792 PolarHBondContact NE2-O 3.4Å; C787-R792 CarbonylContact C-O 3.56Å; C787-R792 WeakPolarHBondContact CA-O 3.28Å; D788-R792 PolarHBondContact N-O 3.28Å; D788-R792 PolarHBondContact OD1-N 3.08Å; D790-R792 HydrophobicContact CB-CG 4.5Å; D790-R792 PolarHBondContact O-N 2.65Å; R792-M796 HydrophobicContact CB-SD 4.29Å; R792-M796 HydrophobicContact CG-SD 4.41Å; R792-E797 IonicContact NH1-OE1 2.73Å; R792-E797 PolarHBondContact NH1-OE1 3.49Å; R792-E800 IonicContact CZ-OE1 3.54Å; R792-E800 IonicContact CZ-OE2 2.9Å; R792-E800 IonicContact NH1-OE1 3.18Å; R792-E800 PolarHBondContact NH1-OE1 3.34Å; R792-E800 IonicContact NH1-OE2 3.79Å; R792-E800 PolarHBondContact NH1-OE2 3.01Å; R792-E800 IonicContact NH2-OE1 3.65Å; R792-E800 PolarHBondContact NH2-OE1 3.32Å; R792-E800 IonicContact NH2-OE2 2.7Å; R792-D821 HydrophobicContact CG-CB 3.63Å; R792-D821 IonicContact CZ-OD2 3.21Å; R792-D821 IonicContact NE-OD2 2.75Å; R792-D821 PolarHBondContact NE-OD2 2.85Å; R792-D821 IonicContact NH2-OD2 3.07Å
793	T	96.8	Very high	94.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.187	C	C	.	.			trans	-105.3	161.6	176.5	68.2	0	0	0	0	111.4	L795 M796 E797 H819	T793-L795 PolarHBondContact O-N 2.96Å; T793-M796 HydrophobicContact CG2-SD 4.41Å; T793-M796 PolarHBondContact N-SD 2.99Å; T793-M796 WeakPolarHBondContact O-CB 2.99Å; T793-M796 PolarHBondContact O-N 2.91Å; T793-M796 PolarHBondContact OG1-N 3.37Å; T793-E797 WeakPolarHBondContact O-CG 3.48Å; T793-E797 PolarHBondContact O-N 2.84Å; T793-E797 VanDerWaalsContact O-N 3.15Å; T793-H819 HydrophobicContact CG2-CB 3.86Å
794	P	96.8	Very high	95	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-53.5	-33.8	171.5	-26.7	33.9	0	0	0	114.2	L762 A766 L784 E797 A798 L810	L762-P794 HydrophobicContact CB-CG 4.15Å; L762-P794 HydrophobicContact CD2-CB 4.26Å; L762-P794 HydrophobicContact CD2-CG 3.99Å; L762-P794 HydrophobicContact CG-CB 3.87Å; L762-P794 HydrophobicContact CG-CG 3.86Å; A766-P794 HydrophobicContact CB-CB 4.1Å; A766-P794 WeakPolarHBondContact CB-O 3.31Å; L784-P794 WeakPolarHBondContact O-CD 3.49Å; P794-E797 PolarHBondContact O-N 2.93Å; P794-A798 PolarHBondContact O-N 3.42Å; P794-L810 HydrophobicContact CB-CD1 4.21Å
795	L	97	Very high	95.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.6	-40.5	176	179.3	64.8	0	0	0	111.7	T793 E797 A798 C799 V807 L810 L811 A815 A817	T793-L795 PolarHBondContact O-N 2.96Å; L795-E797 VanDerWaalsContact C-N 3.32Å; L795-E797 PolarHBondContact O-N 2.94Å; L795-A798 PolarHBondContact O-N 2.84Å; L795-C799 WeakPolarHBondContact O-CB 3.33Å; L795-C799 PolarHBondContact O-N 3.2Å; L795-C799 PolarHBondContact O-SG 3.48Å; L795-V807 HydrophobicContact CD1-CB 4.49Å; L795-V807 HydrophobicContact CD1-CG1 4.18Å; L795-L810 HydrophobicContact CB-CD1 4.29Å; L795-L810 HydrophobicContact CD1-CB 4.05Å; L795-L810 HydrophobicContact CD1-CD1 4.48Å; L795-L811 HydrophobicContact CD1-CD2 4.3Å; L795-L811 HydrophobicContact CD1-CG 4.08Å; L795-L811 HydrophobicContact CD2-CD2 3.75Å; L795-L811 HydrophobicContact CD2-CG 4.42Å; L795-A815 HydrophobicContact CB-CB 4.28Å; L795-A815 HydrophobicContact CD2-CB 4.14Å; L795-A817 HydrophobicContact CD2-CB 4.17Å
796	M	97	Very high	95.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.7	-42.1	174.4	-73.2	169.7	155.8	0	0	111.8	R792 T793 C799 E800 H819 D821 F825 C827 L830	R792-M796 HydrophobicContact CB-SD 4.29Å; R792-M796 HydrophobicContact CG-SD 4.41Å; T793-M796 HydrophobicContact CG2-SD 4.41Å; T793-M796 PolarHBondContact N-SD 2.99Å; T793-M796 WeakPolarHBondContact O-CB 2.99Å; T793-M796 PolarHBondContact O-N 2.91Å; T793-M796 PolarHBondContact OG1-N 3.37Å; M796-C799 PolarHBondContact O-N 3.34Å; M796-E800 PolarHBondContact O-N 2.91Å; M796-H819 VanDerWaalsContact CE-C 3.46Å; M796-H819 HydrophobicContact CE-CB 3.99Å; M796-H819 WeakPolarHBondContact CE-O 3.4Å; M796-D821 HydrophobicContact SD-CB 4.37Å; M796-F825 WeakPolarHBondContact CE-O 3.42Å; M796-C827 VanDerWaalsContact CG-SG 3.52Å; M796-L830 HydrophobicContact CB-CD1 3.71Å; M796-L830 HydrophobicContact CG-CD1 4.06Å
797	E	96.7	Very high	96	Very high	13 Å²	13	36.5 Å²	36.5	6%	0.061	18%	0.178	C	C	.	.	H	α-helix	trans	-66	-40.3	178.9	-59.1	-78.5	103.4	0	0	111.6	R759 R792 T793 P794 L795 N801	R759-E797 IonicContact CZ-OE2 3.56Å; R759-E797 IonicContact NE-OE2 3.55Å; R759-E797 PolarHBondContact NE-OE2 2.72Å; R759-E797 IonicContact NH2-OE2 2.74Å; R759-E797 PolarHBondContact NH2-OE2 2.72Å; R792-E797 IonicContact NH1-OE1 2.73Å; R792-E797 PolarHBondContact NH1-OE1 3.49Å; T793-E797 WeakPolarHBondContact O-CG 3.48Å; T793-E797 PolarHBondContact O-N 2.84Å; T793-E797 VanDerWaalsContact O-N 3.15Å; P794-E797 PolarHBondContact O-N 2.93Å; L795-E797 VanDerWaalsContact C-N 3.32Å; L795-E797 PolarHBondContact O-N 2.94Å; E797-N801 PolarHBondContact O-N 3.49Å; E797-N801 PolarHBondContact O-ND2 2.92Å
798	A	97.3	Very high	96.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.1	-39.9	172.1	0	0	0	0	0	112.4	A766 P794 L795 N802 H803 V806 V807	A766-A798 HydrophobicContact CB-CB 4.22Å; P794-A798 PolarHBondContact O-N 3.42Å; L795-A798 PolarHBondContact O-N 2.84Å; A798-N802 PolarHBondContact O-N 3.32Å; A798-H803 HydrophobicContact CB-CB 4.34Å; A798-H803 PolarHBondContact O-N 3.25Å; A798-V806 HydrophobicContact CB-CB 4.04Å; A798-V806 HydrophobicContact CB-CG1 3.77Å; A798-V807 HydrophobicContact CB-CG2 3.79Å
799	C	96.7	Very high	96	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-68.3	-37.1	178	-74.7	0	0	0	0	113.3	L795 M796 N801 C827 H836 V839	L795-C799 WeakPolarHBondContact O-CB 3.33Å; L795-C799 PolarHBondContact O-N 3.2Å; L795-C799 PolarHBondContact O-SG 3.48Å; M796-C799 PolarHBondContact O-N 3.34Å; C799-N801 VanDerWaalsContact C-N 3.34Å; C799-C827 HydrophobicContact CB-CB 4.22Å; C799-H836 PolarHBondContact O-CD2 2.9Å; C799-H836 VanDerWaalsContact O-CD2 3.27Å; C799-V839 HydrophobicContact CB-CG1 4.11Å
800	E	96.2	Very high	96	Very high	48 Å²	48	35.5 Å²	35.5	22%	0.224	17%	0.171	C	C	.	.	H	α-helix	trans	-72.9	-27.2	178.5	-164.9	176.3	-121.5	0	0	112.6	R792 M796 L830 S834 H836	R792-E800 IonicContact CZ-OE1 3.54Å; R792-E800 IonicContact CZ-OE2 2.9Å; R792-E800 IonicContact NH1-OE1 3.18Å; R792-E800 PolarHBondContact NH1-OE1 3.34Å; R792-E800 IonicContact NH1-OE2 3.79Å; R792-E800 PolarHBondContact NH1-OE2 3.01Å; R792-E800 IonicContact NH2-OE1 3.65Å; R792-E800 PolarHBondContact NH2-OE1 3.32Å; R792-E800 IonicContact NH2-OE2 2.7Å; M796-E800 PolarHBondContact O-N 2.91Å; E800-L830 HydrophobicContact CB-CB 4.13Å; E800-L830 HydrophobicContact CG-CB 4.35Å; E800-S834 PolarHBondContact O-OG 3.11Å; E800-H836 PolarHBondContact O-CD2 2.67Å; E800-H836 PolarHBondContact O-NE2 2.78Å
801	N	96.1	Very high	95.9	Very high	64 Å²	64	33.9 Å²	33.9	34%	0.342	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	14.3	-177.5	-65.5	-84.2	0	0	0	114.2	E797 C799 H803	E797-N801 PolarHBondContact O-N 3.49Å; E797-N801 PolarHBondContact O-ND2 2.92Å; C799-N801 VanDerWaalsContact C-N 3.34Å; N801-H803 VanDerWaalsContact C-N 3.31Å; N801-H803 VanDerWaalsContact CB-CD2 3.49Å; N801-H803 WeakPolarHBondContact CB-CD2 3.36Å; N801-H803 WeakPolarHBondContact CB-NE2 3.48Å; N801-H803 PolarHBondContact O-N 2.8Å
802	N	96.7	Very high	95.6	Very high	70 Å²	70	36.8 Å²	36.8	37%	0.374	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	23.3	176.8	-154	14.2	0	0	0	116.5	A798 M804 H836	A798-N802 PolarHBondContact O-N 3.32Å; N802-M804 VanDerWaalsContact C-N 3.27Å; N802-M804 PolarHBondContact O-N 3.05Å; N802-H836 HydrophobicContact CB-CB 4.37Å
803	H	97.3	Very high	95.1	Very high	75 Å²	75	36.8 Å²	36.8	35%	0.347	18%	0.178	S	C	.	.			trans	-82.9	68.9	-174.4	-67.1	-52.2	0	0	0	112.1	A766 E767 G769 A798 N801 E805 V806 V807	A766-H803 PolarHBondContact O-CD2 3.29Å; E767-H803 PolarHBondContact O-CD2 2.89Å; E767-H803 PolarHBondContact O-NE2 2.76Å; G769-H803 WeakPolarHBondContact CA-ND1 3.33Å; G769-H803 PolarHBondContact N-CD2 3.41Å; A798-H803 HydrophobicContact CB-CB 4.34Å; A798-H803 PolarHBondContact O-N 3.25Å; N801-H803 VanDerWaalsContact C-N 3.31Å; N801-H803 VanDerWaalsContact CB-CD2 3.49Å; N801-H803 WeakPolarHBondContact CB-CD2 3.36Å; N801-H803 WeakPolarHBondContact CB-NE2 3.48Å; N801-H803 PolarHBondContact O-N 2.8Å; H803-E805 VanDerWaalsContact C-N 3.32Å; H803-E805 PolarHBondContact O-N 3.28Å; H803-V806 HydrophobicContact CB-CB 4.14Å; H803-V806 HydrophobicContact CB-CG2 4.18Å; H803-V806 WeakPolarHBondContact O-CA 3.43Å; H803-V806 WeakPolarHBondContact O-CB 3.09Å; H803-V806 PolarHBondContact O-N 2.89Å; H803-V807 PolarHBondContact O-N 3.21Å
804	M	95.4	Very high	94.5	Very high	45 Å²	45	39.3 Å²	39.3	22%	0.222	20%	0.204	C	C	.	.	H	α-helix	trans	-47.8	-46.4	-174.4	174.9	53.9	74.9	0	0	113.8	N802 V806 V807 L808 S838 V839 H842	N802-M804 VanDerWaalsContact C-N 3.27Å; N802-M804 PolarHBondContact O-N 3.05Å; M804-V806 VanDerWaalsContact C-N 3.29Å; M804-V806 PolarHBondContact O-N 3.06Å; M804-V807 PolarHBondContact O-N 2.95Å; M804-L808 HydrophobicContact CG-CD1 3.93Å; M804-L808 HydrophobicContact CG-CG 4.34Å; M804-L808 WeakPolarHBondContact O-CB 3.24Å; M804-L808 VanDerWaalsContact O-CG 3.3Å; M804-L808 WeakPolarHBondContact O-CG 3.44Å; M804-L808 PolarHBondContact O-N 3.47Å; M804-L808 HydrophobicContact SD-CD1 3.81Å; M804-L808 HydrophobicContact SD-CD2 4.17Å; M804-L808 HydrophobicContact SD-CG 3.66Å; M804-S838 WeakPolarHBondContact CE-O 3.4Å; M804-V839 HydrophobicContact CE-CB 4.45Å; M804-V839 HydrophobicContact CE-CG2 3.98Å; M804-H842 HydrophobicContact CE-CB 4.09Å
805	E	95.1	Very high	94.3	Very high	137 Å²	137	39.7 Å²	39.7	64%	0.64	21%	0.207	S	C	*	.	H	α-helix	trans	-61.6	-37.3	179.1	-63	-170.2	178.2	0	0	112.7	A771 H803 Y809	A771-E805 HydrophobicContact CB-CB 4.4Å; H803-E805 VanDerWaalsContact C-N 3.32Å; H803-E805 PolarHBondContact O-N 3.28Å; E805-Y809 VanDerWaalsContact O-CB 3.31Å; E805-Y809 WeakPolarHBondContact O-CB 3.46Å; E805-Y809 PolarHBondContact O-N 2.44Å
806	V	96.9	Very high	93.9	Very high	1 Å²	1	42 Å²	42	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-72.1	-40	175.1	-178.1	0	0	0	0	111	A766 G769 A771 A798 H803 M804 Y809 L810	A766-V806 HydrophobicContact CB-CG1 4.05Å; G769-V806 VanDerWaalsContact C-CG2 3.49Å; G769-V806 WeakPolarHBondContact O-CG2 3.41Å; A771-V806 HydrophobicContact CB-CG2 4.01Å; A798-V806 HydrophobicContact CB-CB 4.04Å; A798-V806 HydrophobicContact CB-CG1 3.77Å; H803-V806 HydrophobicContact CB-CB 4.14Å; H803-V806 HydrophobicContact CB-CG2 4.18Å; H803-V806 WeakPolarHBondContact O-CA 3.43Å; H803-V806 WeakPolarHBondContact O-CB 3.09Å; H803-V806 PolarHBondContact O-N 2.89Å; M804-V806 VanDerWaalsContact C-N 3.29Å; M804-V806 PolarHBondContact O-N 3.06Å; V806-Y809 PolarHBondContact O-N 2.89Å; V806-L810 HydrophobicContact CG1-CD1 3.66Å; V806-L810 HydrophobicContact CG1-CG 3.94Å; V806-L810 WeakPolarHBondContact O-CB 3.34Å; V806-L810 VanDerWaalsContact O-CG 3.3Å; V806-L810 WeakPolarHBondContact O-CG 3.35Å; V806-L810 PolarHBondContact O-N 2.83Å
807	V	96.1	Very high	93.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.7	-50.1	174.2	174.1	0	0	0	0	110.3	L795 A798 H803 M804 Y809 L810 L811 V839	L795-V807 HydrophobicContact CD1-CB 4.49Å; L795-V807 HydrophobicContact CD1-CG1 4.18Å; A798-V807 HydrophobicContact CB-CG2 3.79Å; H803-V807 PolarHBondContact O-N 3.21Å; M804-V807 PolarHBondContact O-N 2.95Å; V807-Y809 VanDerWaalsContact C-N 3.34Å; V807-Y809 PolarHBondContact O-N 2.84Å; V807-L810 PolarHBondContact O-N 3.15Å; V807-L811 HydrophobicContact CG1-CD1 3.73Å; V807-L811 HydrophobicContact CG1-CG 4.4Å; V807-L811 WeakPolarHBondContact O-CB 3.44Å; V807-L811 VanDerWaalsContact O-CG 3.23Å; V807-L811 WeakPolarHBondContact O-CG 3.48Å; V807-L811 PolarHBondContact O-N 2.92Å; V807-V839 HydrophobicContact CG1-CG1 4.46Å; V807-V839 HydrophobicContact CG2-CG1 4.41Å
808	L	94.4	Very high	93.2	Very high	56 Å²	56	45.5 Å²	45.5	29%	0.293	24%	0.242	S	C	.	.	H	α-helix	trans	-58.6	-43.5	175.4	-70	169.7	0	0	0	112	M804 R812 H842	M804-L808 HydrophobicContact CG-CD1 3.93Å; M804-L808 HydrophobicContact CG-CG 4.34Å; M804-L808 WeakPolarHBondContact O-CB 3.24Å; M804-L808 VanDerWaalsContact O-CG 3.3Å; M804-L808 WeakPolarHBondContact O-CG 3.44Å; M804-L808 PolarHBondContact O-N 3.47Å; M804-L808 HydrophobicContact SD-CD1 3.81Å; M804-L808 HydrophobicContact SD-CD2 4.17Å; M804-L808 HydrophobicContact SD-CG 3.66Å; L808-R812 WeakPolarHBondContact O-CB 3.41Å; L808-R812 PolarHBondContact O-N 3.31Å; L808-H842 WeakPolarHBondContact CD2-CE1 3.13Å; L808-H842 WeakPolarHBondContact CD2-NE2 3.23Å
809	Y	94.2	Very high	92.9	Very high	44 Å²	44	47.9 Å²	47.9	17%	0.173	25%	0.252	C	S	.	.	H	α-helix	trans	-65.9	-49.4	179	177	-106.5	0	0	0	112.5	C774 H775 V778 E805 V806 V807 R812 A813	C774-Y809 HydrophobicContact CB-CD1 4.07Å; C774-Y809 HydrophobicContact CB-CE1 4.23Å; H775-Y809 HydrophobicContact CB-CE1 4.32Å; H775-Y809 HydrophobicContact CB-CE2 4.37Å; H775-Y809 AromaticContact ND1-CE2 3.46Å; H775-Y809 WeakPolarHBondContact ND1-CE2 3.48Å; H775-Y809 AromaticContact ND1-CZ 3.67Å; V778-Y809 HydrophobicContact CB-CE1 4.37Å; V778-Y809 HydrophobicContact CG2-CE1 4.16Å; E805-Y809 VanDerWaalsContact O-CB 3.31Å; E805-Y809 WeakPolarHBondContact O-CB 3.46Å; E805-Y809 PolarHBondContact O-N 2.44Å; V806-Y809 PolarHBondContact O-N 2.89Å; V807-Y809 VanDerWaalsContact C-N 3.34Å; V807-Y809 PolarHBondContact O-N 2.84Å; Y809-R812 PolarHBondContact O-N 3.45Å; Y809-A813 WeakPolarHBondContact O-CB 3.18Å; Y809-A813 PolarHBondContact O-N 3.42Å
810	L	93.9	Very high	92.8	Very high	1 Å²	1	52 Å²	52	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-67.1	-40.9	-177.6	-69.1	177.4	0	0	0	111.8	L762 A766 L784 P794 L795 V806 V807 A813 G814 A815	L762-L810 HydrophobicContact CD1-CD2 4.41Å; A766-L810 HydrophobicContact CB-CD1 4.41Å; L784-L810 HydrophobicContact CD2-CD2 3.76Å; P794-L810 HydrophobicContact CB-CD1 4.21Å; L795-L810 HydrophobicContact CB-CD1 4.29Å; L795-L810 HydrophobicContact CD1-CB 4.05Å; L795-L810 HydrophobicContact CD1-CD1 4.48Å; V806-L810 HydrophobicContact CG1-CD1 3.66Å; V806-L810 HydrophobicContact CG1-CG 3.94Å; V806-L810 WeakPolarHBondContact O-CB 3.34Å; V806-L810 VanDerWaalsContact O-CG 3.3Å; V806-L810 WeakPolarHBondContact O-CG 3.35Å; V806-L810 PolarHBondContact O-N 2.83Å; V807-L810 PolarHBondContact O-N 3.15Å; L810-A813 PolarHBondContact O-N 2.83Å; L810-G814 PolarHBondContact O-N 3.09Å; L810-G814 VanDerWaalsContact O-N 3.12Å; L810-A815 HydrophobicContact CB-CB 4.01Å; L810-A815 VanDerWaalsContact O-CB 3.23Å; L810-A815 WeakPolarHBondContact O-CB 3.31Å; L810-A815 PolarHBondContact O-N 2.88Å
811	L	92.5	Very high	92.8	Very high	28 Å²	28	50.3 Å²	50.3	15%	0.147	26%	0.263	C	S	.	.	H	α-helix	trans	-61.3	-45.4	172.6	-70.9	171.4	0	0	0	111.2	L795 V807 A813 G814 A817 L843	L795-L811 HydrophobicContact CD1-CD2 4.3Å; L795-L811 HydrophobicContact CD1-CG 4.08Å; L795-L811 HydrophobicContact CD2-CD2 3.75Å; L795-L811 HydrophobicContact CD2-CG 4.42Å; V807-L811 HydrophobicContact CG1-CD1 3.73Å; V807-L811 HydrophobicContact CG1-CG 4.4Å; V807-L811 WeakPolarHBondContact O-CB 3.44Å; V807-L811 VanDerWaalsContact O-CG 3.23Å; V807-L811 WeakPolarHBondContact O-CG 3.48Å; V807-L811 PolarHBondContact O-N 2.92Å; L811-A813 VanDerWaalsContact C-N 3.26Å; L811-A813 PolarHBondContact O-N 3.17Å; L811-G814 PolarHBondContact O-N 2.87Å; L811-A817 HydrophobicContact CD2-CB 4.07Å; L811-L843 HydrophobicContact CD1-CD2 4.1Å
812	R	89.4	Confident	92.7	Very high	151 Å²	151	51.2 Å²	51.2	57%	0.57	27%	0.271	S	S	*	.	H	α-helix	trans	-65.4	-27.7	176.4	-170.9	-178.3	-64.4	-170	-1	112.8	L808 Y809 G814	L808-R812 WeakPolarHBondContact O-CB 3.41Å; L808-R812 PolarHBondContact O-N 3.31Å; Y809-R812 PolarHBondContact O-N 3.45Å; R812-G814 VanDerWaalsContact C-N 3.31Å
813	A	84.5	Confident	92.6	Very high	40 Å²	40	53 Å²	53	33%	0.331	28%	0.277	S	S	.	.	H	α-helix	trans	-77.9	-13.7	172.8	0	0	0	0	0	113.5	L784 Y809 L810 L811	L784-A813 HydrophobicContact CD1-CB 3.77Å; L784-A813 VanDerWaalsContact CD1-O 3.23Å; L784-A813 WeakPolarHBondContact CD1-O 3.47Å; L784-A813 HydrophobicContact CD2-CB 4.14Å; Y809-A813 WeakPolarHBondContact O-CB 3.18Å; Y809-A813 PolarHBondContact O-N 3.42Å; L810-A813 PolarHBondContact O-N 2.83Å; L811-A813 VanDerWaalsContact C-N 3.26Å; L811-A813 PolarHBondContact O-N 3.17Å
814	G	85.3	Confident	92.5	Very high	53 Å²	53	49.5 Å²	49.5	55%	0.546	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.1	18.7	176.7	0	0	0	0	0	115.9	L810 L811 R812	L810-G814 PolarHBondContact O-N 3.09Å; L810-G814 VanDerWaalsContact O-N 3.12Å; L811-G814 PolarHBondContact O-N 2.87Å; R812-G814 VanDerWaalsContact C-N 3.31Å
815	A	91.3	Very high	92.5	Very high	8 Å²	8	47.7 Å²	47.7	7%	0.066	25%	0.252	C	S	.	.			trans	-68	142.4	177.5	0	0	0	0	0	112.4	L784 L795 L810 A817	L784-A815 HydrophobicContact CB-CB 3.93Å; L784-A815 HydrophobicContact CD1-CB 4.29Å; L795-A815 HydrophobicContact CB-CB 4.28Å; L795-A815 HydrophobicContact CD2-CB 4.14Å; L810-A815 HydrophobicContact CB-CB 4.01Å; L810-A815 VanDerWaalsContact O-CB 3.23Å; L810-A815 WeakPolarHBondContact O-CB 3.31Å; L810-A815 PolarHBondContact O-N 2.88Å; A815-A817 PolarHBondContact O-N 2.96Å
816	S	89	Confident	92.5	Very high	47 Å²	47	41.3 Å²	41.3	33%	0.329	22%	0.222	S	C	.	.			trans	-83	110.3	-174.9	-174	0	0	0	0	113.5	D785 M818	D785-S816 WeakPolarHBondContact OD1-CB 3.47Å; D785-S816 PolarHBondContact OD1-N 2.72Å; S816-M818 PolarHBondContact O-N 3.01Å; S816-M818 PolarHBondContact OG-N 3.41Å
817	A	90.1	Very high	92.5	Very high	7 Å²	7	41.2 Å²	41.2	6%	0.058	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-10.7	171.7	0	0	0	0	0	114.3	L795 L811 A815 L843 V849	L795-A817 HydrophobicContact CD2-CB 4.17Å; L811-A817 HydrophobicContact CD2-CB 4.07Å; A815-A817 PolarHBondContact O-N 2.96Å; A817-L843 HydrophobicContact CB-CD2 4.23Å; A817-V849 HydrophobicContact CB-CG2 3.76Å
818	M	89	Confident	92.5	Very high	81 Å²	81	41.2 Å²	41.2	40%	0.399	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	10.4	-175.5	-68.5	-81.9	82.7	0	0	113.8	S816 T826 L848 V849	S816-M818 PolarHBondContact O-N 3.01Å; S816-M818 PolarHBondContact OG-N 3.41Å; M818-T826 HydrophobicContact CE-CG2 4.35Å; M818-L848 WeakPolarHBondContact CG-O 3.47Å; M818-V849 HydrophobicContact CE-CB 4.13Å; M818-V849 HydrophobicContact CE-CG1 3.78Å; M818-V849 HydrophobicContact CE-CG2 4.26Å
819	H	91.6	Very high	92.6	Very high	49 Å²	49	38.6 Å²	38.6	23%	0.227	21%	0.208	C	C	.	.			trans	-64	158.3	169	-149.4	83.8	0	0	0	111.2	C787 Q791 T793 M796	C787-H819 PolarHBondContact SG-CE1 3.45Å; C787-H819 PolarHBondContact SG-NE2 2.76Å; Q791-H819 PolarHBondContact O-CD2 2.85Å; Q791-H819 VanDerWaalsContact O-CD2 3.29Å; T793-H819 HydrophobicContact CG2-CB 3.86Å; M796-H819 VanDerWaalsContact CE-C 3.46Å; M796-H819 HydrophobicContact CE-CB 3.99Å; M796-H819 WeakPolarHBondContact CE-O 3.4Å
820	K	94.1	Very high	92.8	Very high	87 Å²	87	36.5 Å²	36.5	38%	0.378	20%	0.2	S	C	.	.			trans	-127.5	132.3	173.5	-77.4	-169	160.9	-154.7	0	111.7	G824 F825 T826 Q854	K820-G824 WeakPolarHBondContact CD-O 3.28Å; K820-G824 VanDerWaalsContact CE-O 3.26Å; K820-G824 WeakPolarHBondContact CE-O 3.32Å; K820-G824 WeakPolarHBondContact CG-O 3.45Å; K820-G824 PolarHBondContact NZ-O 3.35Å; K820-F825 VanDerWaalsContact CA-O 3.31Å; K820-F825 WeakPolarHBondContact CA-O 3.46Å; K820-T826 HydrophobicContact CG-CG2 3.96Å; K820-Q854 PolarHBondContact NZ-O 2.97Å
821	D	95.2	Very high	92.9	Very high	12 Å²	12	36.4 Å²	36.4	6%	0.064	20%	0.199	C	C	.	.			trans	-78.8	-178.5	174	85.2	-4	0	0	0	112.2	D790 R792 M796 E823 G824 F825	D790-D821 WeakPolarHBondContact O-CB 3.27Å; R792-D821 HydrophobicContact CG-CB 3.63Å; R792-D821 IonicContact CZ-OD2 3.21Å; R792-D821 IonicContact NE-OD2 2.75Å; R792-D821 PolarHBondContact NE-OD2 2.85Å; R792-D821 IonicContact NH2-OD2 3.07Å; M796-D821 HydrophobicContact SD-CB 4.37Å; D821-E823 PolarHBondContact O-N 3.24Å; D821-E823 PolarHBondContact OD1-N 3.31Å; D821-G824 WeakPolarHBondContact O-CA 3.44Å; D821-G824 PolarHBondContact O-N 2.98Å; D821-G824 PolarHBondContact OD1-N 3.01Å; D821-F825 PolarHBondContact N-O 3.46Å; D821-F825 WeakPolarHBondContact OD1-CB 3.43Å; D821-F825 PolarHBondContact OD1-N 3.03Å
822	V	95.4	Very high	93.1	Very high	84 Å²	84	35.1 Å²	35.1	51%	0.509	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-13	-177.8	-68.6	0	0	0	0	115.4	D790 Q791	D790-V822 HydrophobicContact CB-CG2 4.07Å; D790-V822 WeakPolarHBondContact O-CG1 3.4Å; D790-V822 WeakPolarHBondContact O-CG2 3.44Å; D790-V822 PolarHBondContact O-N 2.98Å; Q791-V822 HydrophobicContact CB-CG1 4.02Å; Q791-V822 HydrophobicContact CG-CG1 3.81Å
823	E	93.7	Very high	93.4	Very high	107 Å²	107	29.5 Å²	29.5	50%	0.5	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	6.9	170.7	-60.8	-168.2	158.8	0	0	111.4	D821 F825 D856	D821-E823 PolarHBondContact O-N 3.24Å; D821-E823 PolarHBondContact OD1-N 3.31Å; E823-F825 HydrophobicContact CB-CD2 3.94Å; E823-F825 HydrophobicContact CB-CE2 3.63Å; E823-F825 HydrophobicContact CB-CZ 4.15Å; E823-F825 HydrophobicContact CG-CE2 4.47Å; E823-F825 WeakPolarHBondContact OE2-CE2 3.28Å; E823-D856 WeakPolarHBondContact O-CB 3.49Å; E823-D856 PolarHBondContact O-N 2.99Å
824	G	95	Very high	93.9	Very high	2 Å²	2	29.9 Å²	29.9	2%	0.021	17%	0.173	C	C	.	.			trans	84.3	6	176.3	0	0	0	0	0	114.5	K820 D821	K820-G824 WeakPolarHBondContact CD-O 3.28Å; K820-G824 VanDerWaalsContact CE-O 3.26Å; K820-G824 WeakPolarHBondContact CE-O 3.32Å; K820-G824 WeakPolarHBondContact CG-O 3.45Å; K820-G824 PolarHBondContact NZ-O 3.35Å; D821-G824 WeakPolarHBondContact O-CA 3.44Å; D821-G824 PolarHBondContact O-N 2.98Å; D821-G824 PolarHBondContact OD1-N 3.01Å
825	F	96.5	Very high	94.4	Very high	6 Å²	6	28.3 Å²	28.3	3%	0.026	16%	0.156	C	C	.	.			trans	-70.6	139	-176.9	-62.2	-48.6	0	0	0	112	M796 K820 D821 E823 H829 L830 D855 W864	M796-F825 WeakPolarHBondContact CE-O 3.42Å; K820-F825 VanDerWaalsContact CA-O 3.31Å; K820-F825 WeakPolarHBondContact CA-O 3.46Å; D821-F825 PolarHBondContact N-O 3.46Å; D821-F825 WeakPolarHBondContact OD1-CB 3.43Å; D821-F825 PolarHBondContact OD1-N 3.03Å; E823-F825 HydrophobicContact CB-CD2 3.94Å; E823-F825 HydrophobicContact CB-CE2 3.63Å; E823-F825 HydrophobicContact CB-CZ 4.15Å; E823-F825 HydrophobicContact CG-CE2 4.47Å; E823-F825 WeakPolarHBondContact OE2-CE2 3.28Å; F825-H829 HydrophobicContact CB-CB 3.97Å; F825-H829 HydrophobicContact CD1-CB 3.72Å; F825-H829 HydrophobicContact CG-CB 4.21Å; F825-L830 HydrophobicContact CB-CD2 3.77Å; F825-L830 HydrophobicContact CB-CG 4.11Å; F825-L830 HydrophobicContact CD2-CD2 3.79Å; F825-L830 HydrophobicContact CG-CD2 3.9Å; F825-D855 HydrophobicContact CD1-CB 3.96Å; F825-D855 HydrophobicContact CE1-CB 4.17Å; F825-D855 WeakPolarHBondContact CE1-OD2 3.5Å; F825-W864 HydrophobicContact CE1-CD2 4.45Å; F825-W864 AromaticContact CE1-CE2 3.48Å; F825-W864 VanDerWaalsContact CE1-CE2 3.48Å; F825-W864 HydrophobicContact CE1-CH2 4.28Å; F825-W864 AromaticContact CE1-CZ2 3.37Å; F825-W864 HydrophobicContact CE1-CZ2 3.37Å; F825-W864 AromaticContact CE1-NE1 3.55Å; F825-W864 AromaticContact CZ-CH2 3.99Å; F825-W864 HydrophobicContact CZ-CH2 3.99Å; F825-W864 AromaticContact CZ-CZ2 3.49Å; F825-W864 HydrophobicContact CZ-CZ2 3.49Å; F825-W864 VanDerWaalsContact CZ-CZ2 3.49Å
826	T	95.4	Very high	94.7	Very high	3 Å²	3	29.5 Å²	29.5	2%	0.018	16%	0.16	C	C	.	.			trans	-97.1	171	165.6	65.6	0	0	0	0	110.4	M818 K820 L828 H829 L830	M818-T826 HydrophobicContact CE-CG2 4.35Å; K820-T826 HydrophobicContact CG-CG2 3.96Å; T826-L828 PolarHBondContact O-N 3.47Å; T826-L828 VanDerWaalsContact O-N 3.11Å; T826-H829 PolarHBondContact N-ND1 2.77Å; T826-H829 WeakPolarHBondContact O-CB 3.31Å; T826-H829 PolarHBondContact O-N 3.36Å; T826-H829 PolarHBondContact OG1-ND1 2.92Å; T826-L830 PolarHBondContact O-N 2.98Å
827	C	95.5	Very high	95	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-52.9	-33.7	174.5	-58.5	0	0	0	0	113.2	M796 C799 A831 L843	M796-C827 VanDerWaalsContact CG-SG 3.52Å; C799-C827 HydrophobicContact CB-CB 4.22Å; C827-A831 WeakPolarHBondContact O-CB 3.41Å; C827-A831 PolarHBondContact O-N 2.86Å; C827-A831 VanDerWaalsContact O-N 3.09Å; C827-L843 HydrophobicContact CB-CD1 4.14Å
828	L	96.7	Very high	95.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-67.2	-41.3	176.4	-172.2	71.2	0	0	0	112.4	T826 A832 V840 L843 L844 V849 A861	T826-L828 PolarHBondContact O-N 3.47Å; T826-L828 VanDerWaalsContact O-N 3.11Å; L828-A832 WeakPolarHBondContact O-CB 3.26Å; L828-A832 PolarHBondContact O-N 3.34Å; L828-V840 HydrophobicContact CD1-CG1 4Å; L828-L843 HydrophobicContact CD1-CB 4.32Å; L828-L843 HydrophobicContact CD1-CD1 4.43Å; L828-L844 HydrophobicContact CD1-CD1 4.5Å; L828-L844 HydrophobicContact CD1-CD2 3.95Å; L828-L844 HydrophobicContact CD1-CG 3.99Å; L828-L844 HydrophobicContact CD2-CD2 4.02Å; L828-V849 HydrophobicContact CB-CG1 3.85Å; L828-V849 HydrophobicContact CD1-CG1 4.47Å; L828-V849 HydrophobicContact CD2-CG1 3.81Å; L828-V849 HydrophobicContact CG-CG1 4.25Å; L828-A861 HydrophobicContact CD2-CB 3.76Å; L828-A861 HydrophobicContact CG-CB 3.75Å
829	H	97.3	Very high	95.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63	-46	177.6	-72.2	78.9	0	0	0	111.1	F825 T826 A832 K833 C853 D855 W859 W864	F825-H829 HydrophobicContact CB-CB 3.97Å; F825-H829 HydrophobicContact CD1-CB 3.72Å; F825-H829 HydrophobicContact CG-CB 4.21Å; T826-H829 PolarHBondContact N-ND1 2.77Å; T826-H829 WeakPolarHBondContact O-CB 3.31Å; T826-H829 PolarHBondContact O-N 3.36Å; T826-H829 PolarHBondContact OG1-ND1 2.92Å; H829-A832 PolarHBondContact O-N 2.8Å; H829-K833 WeakPolarHBondContact O-CB 3.39Å; H829-K833 PolarHBondContact O-N 2.93Å; H829-C853 PolarHBondContact CE1-O 2.95Å; H829-C853 PolarHBondContact CE1-SG 3.05Å; H829-C853 PolarHBondContact NE2-O 3.34Å; H829-D855 PolarHBondContact NE2-N 2.74Å; H829-W859 PolarHBondContact NE2-O 3.16Å; H829-W859 VanDerWaalsContact NE2-O 3.12Å; H829-W864 AromaticContact CD2-CD1 3.73Å; H829-W864 AromaticContact CD2-NE1 3.96Å
830	L	96.4	Very high	95.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.1	-43.9	-179.3	-58.9	180	0	0	0	111.6	M796 E800 F825 T826 S834	M796-L830 HydrophobicContact CB-CD1 3.71Å; M796-L830 HydrophobicContact CG-CD1 4.06Å; E800-L830 HydrophobicContact CB-CB 4.13Å; E800-L830 HydrophobicContact CG-CB 4.35Å; F825-L830 HydrophobicContact CB-CD2 3.77Å; F825-L830 HydrophobicContact CB-CG 4.11Å; F825-L830 HydrophobicContact CD2-CD2 3.79Å; F825-L830 HydrophobicContact CG-CD2 3.9Å; T826-L830 PolarHBondContact O-N 2.98Å; L830-S834 WeakPolarHBondContact O-CB 3.36Å; L830-S834 PolarHBondContact O-N 3.06Å; L830-S834 VanDerWaalsContact O-N 3.08Å; L830-S834 PolarHBondContact O-OG 3.14Å
831	A	96.6	Very high	96	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.1	-46.9	175.8	0	0	0	0	0	112.3	C827 K833 S834 G835 H836 V839 V840	C827-A831 WeakPolarHBondContact O-CB 3.41Å; C827-A831 PolarHBondContact O-N 2.86Å; C827-A831 VanDerWaalsContact O-N 3.09Å; A831-K833 PolarHBondContact O-N 2.85Å; A831-S834 PolarHBondContact O-N 3.05Å; A831-G835 PolarHBondContact O-N 2.8Å; A831-H836 HydrophobicContact CB-CB 4.45Å; A831-H836 PolarHBondContact O-N 2.88Å; A831-V839 HydrophobicContact CB-CB 4.11Å; A831-V839 HydrophobicContact CB-CG1 3.68Å; A831-V840 HydrophobicContact CB-CG2 3.74Å
832	A	97	Very high	96	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-70.2	-29	-178.5	0	0	0	0	0	113.8	L828 H829 V840 A861 H870	L828-A832 WeakPolarHBondContact O-CB 3.26Å; L828-A832 PolarHBondContact O-N 3.34Å; H829-A832 PolarHBondContact O-N 2.8Å; A832-V840 HydrophobicContact CB-CG2 4.04Å; A832-A861 HydrophobicContact CB-CB 3.87Å; A832-H870 PolarHBondContact O-CD2 2.89Å; A832-H870 VanDerWaalsContact O-CD2 3.23Å
833	K	96.4	Very high	95.9	Very high	33 Å²	33	25.2 Å²	25.2	14%	0.143	13%	0.131	C	C	.	.	H	α-helix	trans	-71	-46.6	173.2	179.6	175.4	-176.3	165	0	111.8	H829 A831 G835 W864 Y868 H870	H829-K833 WeakPolarHBondContact O-CB 3.39Å; H829-K833 PolarHBondContact O-N 2.93Å; A831-K833 PolarHBondContact O-N 2.85Å; K833-G835 VanDerWaalsContact C-N 3.28Å; K833-G835 PolarHBondContact O-N 2.79Å; K833-W864 HydrophobicContact CB-CB 4.1Å; K833-W864 HydrophobicContact CB-CE3 4.34Å; K833-W864 HydrophobicContact CB-CG 4.46Å; K833-W864 HydrophobicContact CD-CD2 4.08Å; K833-W864 HydrophobicContact CD-CE3 3.61Å; K833-W864 HydrophobicContact CD-CZ3 3.9Å; K833-W864 VanDerWaalsContact CE-CZ3 3.44Å; K833-W864 HydrophobicContact CG-CD2 4.35Å; K833-W864 HydrophobicContact CG-CE3 3.75Å; K833-W864 HydrophobicContact CG-CZ3 4.36Å; K833-Y868 HydrophobicContact CG-CD2 4.3Å; K833-Y868 HydrophobicContact CG-CE2 3.93Å; K833-H870 PolarHBondContact O-NE2 3.46Å
834	S	95.2	Very high	95.9	Very high	49 Å²	49	21 Å²	21	34%	0.343	11%	0.111	S	C	.	.	H	α-helix	trans	-75.9	-14	178.8	-63	0	0	0	0	113.8	E800 L830 A831 H836	E800-S834 PolarHBondContact O-OG 3.11Å; L830-S834 WeakPolarHBondContact O-CB 3.36Å; L830-S834 PolarHBondContact O-N 3.06Å; L830-S834 VanDerWaalsContact O-N 3.08Å; L830-S834 PolarHBondContact O-OG 3.14Å; A831-S834 PolarHBondContact O-N 3.05Å; S834-H836 WeakPolarHBondContact CB-NE2 3.38Å
835	G	95.1	Very high	95.7	Very high	19 Å²	19	25.1 Å²	25.1	20%	0.196	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.3	20.4	174.4	0	0	0	0	0	115	A831 K833 Y837 H870 Q873	A831-G835 PolarHBondContact O-N 2.8Å; K833-G835 VanDerWaalsContact C-N 3.28Å; K833-G835 PolarHBondContact O-N 2.79Å; G835-Y837 PolarHBondContact O-N 2.88Å; G835-H870 WeakPolarHBondContact CA-CE1 3.38Å; G835-H870 VanDerWaalsContact CA-NE2 3.31Å; G835-H870 WeakPolarHBondContact CA-NE2 3.45Å; G835-H870 PolarHBondContact N-NE2 3.13Å; G835-Q873 VanDerWaalsContact CA-OE1 3.31Å; G835-Q873 PolarHBondContact O-NE2 3.32Å
836	H	96.9	Very high	95.1	Very high	33 Å²	33	27.1 Å²	27.1	15%	0.153	15%	0.149	C	C	.	.			trans	-86	73.3	-171.1	-58.6	-31.6	0	0	0	112.1	C799 E800 N802 A831 S834 S838 V839 V840	C799-H836 PolarHBondContact O-CD2 2.9Å; C799-H836 VanDerWaalsContact O-CD2 3.27Å; E800-H836 PolarHBondContact O-CD2 2.67Å; E800-H836 PolarHBondContact O-NE2 2.78Å; N802-H836 HydrophobicContact CB-CB 4.37Å; A831-H836 HydrophobicContact CB-CB 4.45Å; A831-H836 PolarHBondContact O-N 2.88Å; S834-H836 WeakPolarHBondContact CB-NE2 3.38Å; H836-S838 VanDerWaalsContact C-N 3.3Å; H836-S838 PolarHBondContact O-N 2.93Å; H836-S838 VanDerWaalsContact O-N 3.16Å; H836-V839 HydrophobicContact CB-CB 4.09Å; H836-V839 HydrophobicContact CB-CG2 4.14Å; H836-V839 PolarHBondContact O-N 3.27Å; H836-V840 PolarHBondContact O-N 2.76Å
837	Y	96.6	Very high	94.2	Very high	88 Å²	88	30 Å²	30	35%	0.345	18%	0.179	S	C	.	.	H	α-helix	trans	-44.3	-49.7	-175.5	177.9	-78	0	0	0	113.3	G835 V839 V840 E841 D872 Q873 L876	G835-Y837 PolarHBondContact O-N 2.88Å; Y837-V839 PolarHBondContact O-N 2.8Å; Y837-V840 WeakPolarHBondContact O-CB 3.42Å; Y837-V840 PolarHBondContact O-N 2.83Å; Y837-E841 HydrophobicContact CD1-CB 4.47Å; Y837-E841 HydrophobicContact CE1-CB 4.07Å; Y837-E841 HydrophobicContact CE1-CG 4.39Å; Y837-E841 WeakPolarHBondContact CE1-OE1 3.31Å; Y837-E841 WeakPolarHBondContact O-CB 3.31Å; Y837-E841 PolarHBondContact O-N 2.81Å; Y837-E841 PolarHBondContact OH-OE1 3.47Å; Y837-D872 HydrophobicContact CD2-CB 4.28Å; Y837-D872 HydrophobicContact CE2-CB 4.33Å; Y837-Q873 HydrophobicContact CD2-CG 4Å; Y837-Q873 HydrophobicContact CG-CG 4.41Å; Y837-L876 HydrophobicContact CD2-CD2 4.08Å; Y837-L876 HydrophobicContact CE1-CD2 4.31Å; Y837-L876 HydrophobicContact CE2-CB 3.83Å; Y837-L876 HydrophobicContact CE2-CD2 3.71Å; Y837-L876 HydrophobicContact CE2-CG 4.3Å
838	S	96.3	Very high	93.3	Very high	49 Å²	49	35.5 Å²	35.5	34%	0.343	21%	0.208	S	C	.	.	H	α-helix	trans	-65.4	-38.1	-176.2	57.2	0	0	0	0	112.5	M804 H836 E841 H842	M804-S838 WeakPolarHBondContact CE-O 3.4Å; H836-S838 VanDerWaalsContact C-N 3.3Å; H836-S838 PolarHBondContact O-N 2.93Å; H836-S838 VanDerWaalsContact O-N 3.16Å; S838-E841 PolarHBondContact O-N 3.41Å; S838-H842 WeakPolarHBondContact O-CB 3.22Å; S838-H842 PolarHBondContact O-N 2.66Å
839	V	96.4	Very high	92.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.6	-43.2	175.2	178.1	0	0	0	0	110.4	C799 M804 V807 A831 H836 Y837 H842 L843	C799-V839 HydrophobicContact CB-CG1 4.11Å; M804-V839 HydrophobicContact CE-CB 4.45Å; M804-V839 HydrophobicContact CE-CG2 3.98Å; V807-V839 HydrophobicContact CG1-CG1 4.46Å; V807-V839 HydrophobicContact CG2-CG1 4.41Å; A831-V839 HydrophobicContact CB-CB 4.11Å; A831-V839 HydrophobicContact CB-CG1 3.68Å; H836-V839 HydrophobicContact CB-CB 4.09Å; H836-V839 HydrophobicContact CB-CG2 4.14Å; H836-V839 PolarHBondContact O-N 3.27Å; Y837-V839 PolarHBondContact O-N 2.8Å; V839-H842 PolarHBondContact O-N 3.34Å; V839-L843 HydrophobicContact CG1-CD1 3.95Å; V839-L843 HydrophobicContact CG1-CG 4.4Å; V839-L843 WeakPolarHBondContact O-CB 3.48Å; V839-L843 VanDerWaalsContact O-CG 3.23Å; V839-L843 WeakPolarHBondContact O-CG 3.47Å; V839-L843 PolarHBondContact O-N 3.25Å
840	V	96.6	Very high	92.6	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.6	-49	174.4	174.6	0	0	0	0	110.7	L828 A831 A832 H836 Y837 H842 L843 L844 Q873 L876 L877	L828-V840 HydrophobicContact CD1-CG1 4Å; A831-V840 HydrophobicContact CB-CG2 3.74Å; A832-V840 HydrophobicContact CB-CG2 4.04Å; H836-V840 PolarHBondContact O-N 2.76Å; Y837-V840 WeakPolarHBondContact O-CB 3.42Å; Y837-V840 PolarHBondContact O-N 2.83Å; V840-H842 PolarHBondContact O-N 3.08Å; V840-L843 PolarHBondContact O-N 2.84Å; V840-L844 HydrophobicContact CG1-CD1 3.69Å; V840-L844 HydrophobicContact CG1-CG 4.43Å; V840-L844 WeakPolarHBondContact O-CB 3.48Å; V840-L844 WeakPolarHBondContact O-CG 3.42Å; V840-L844 PolarHBondContact O-N 2.99Å; V840-Q873 HydrophobicContact CB-CG 4.45Å; V840-Q873 HydrophobicContact CG2-CG 4.4Å; V840-L876 HydrophobicContact CB-CD2 4.31Å; V840-L876 HydrophobicContact CG1-CD2 3.85Å; V840-L877 HydrophobicContact CG1-CD2 4.22Å; V840-L877 HydrophobicContact CG1-CG 4.42Å
841	E	96.1	Very high	92.6	Very high	76 Å²	76	40.9 Å²	40.9	36%	0.355	24%	0.238	S	C	.	.	H	α-helix	trans	-60.7	-43.3	179.6	-175.5	171.9	-109.7	0	0	112.4	Y837 S838 T845 L876	Y837-E841 HydrophobicContact CD1-CB 4.47Å; Y837-E841 HydrophobicContact CE1-CB 4.07Å; Y837-E841 HydrophobicContact CE1-CG 4.39Å; Y837-E841 WeakPolarHBondContact CE1-OE1 3.31Å; Y837-E841 WeakPolarHBondContact O-CB 3.31Å; Y837-E841 PolarHBondContact O-N 2.81Å; Y837-E841 PolarHBondContact OH-OE1 3.47Å; S838-E841 PolarHBondContact O-N 3.41Å; E841-T845 VanDerWaalsContact O-CB 3.22Å; E841-T845 WeakPolarHBondContact O-CB 3.42Å; E841-T845 PolarHBondContact O-N 2.91Å; E841-T845 PolarHBondContact O-OG1 2.9Å; E841-L876 HydrophobicContact CB-CD1 4.38Å; E841-L876 HydrophobicContact CB-CD2 3.75Å; E841-L876 HydrophobicContact CG-CD1 4.21Å; E841-L876 HydrophobicContact CG-CD2 4.45Å
842	H	94.6	Very high	92.5	Very high	65 Å²	65	42.8 Å²	42.8	30%	0.301	25%	0.248	S	C	.	.	H	α-helix	trans	-65.5	-51.1	176.9	-170.7	75	0	0	0	111.5	M804 L808 S838 V839 V840 L844 T845 T846	M804-H842 HydrophobicContact CE-CB 4.09Å; L808-H842 WeakPolarHBondContact CD2-CE1 3.13Å; L808-H842 WeakPolarHBondContact CD2-NE2 3.23Å; S838-H842 WeakPolarHBondContact O-CB 3.22Å; S838-H842 PolarHBondContact O-N 2.66Å; V839-H842 PolarHBondContact O-N 3.34Å; V840-H842 PolarHBondContact O-N 3.08Å; H842-L844 VanDerWaalsContact C-N 3.32Å; H842-L844 PolarHBondContact O-N 2.88Å; H842-T845 PolarHBondContact O-N 2.91Å; H842-T846 WeakPolarHBondContact O-CG2 3.48Å; H842-T846 PolarHBondContact O-N 2.9Å
843	L	93.8	Very high	92.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-54.3	-47.4	179.8	-75.8	172.1	0	0	0	111.7	L811 A817 C827 L828 V839 V840 T845 T846 V849	L811-L843 HydrophobicContact CD1-CD2 4.1Å; A817-L843 HydrophobicContact CB-CD2 4.23Å; C827-L843 HydrophobicContact CB-CD1 4.14Å; L828-L843 HydrophobicContact CD1-CB 4.32Å; L828-L843 HydrophobicContact CD1-CD1 4.43Å; V839-L843 HydrophobicContact CG1-CD1 3.95Å; V839-L843 HydrophobicContact CG1-CG 4.4Å; V839-L843 WeakPolarHBondContact O-CB 3.48Å; V839-L843 VanDerWaalsContact O-CG 3.23Å; V839-L843 WeakPolarHBondContact O-CG 3.47Å; V839-L843 PolarHBondContact O-N 3.25Å; V840-L843 PolarHBondContact O-N 2.84Å; L843-T845 VanDerWaalsContact C-N 3.34Å; L843-T845 PolarHBondContact O-N 2.98Å; L843-T846 PolarHBondContact O-N 2.64Å; L843-T846 PolarHBondContact O-OG1 2.7Å; L843-V849 HydrophobicContact CB-CG2 4.33Å; L843-V849 HydrophobicContact CD2-CG2 4.29Å
844	L	93.8	Very high	92.3	Very high	18 Å²	18	45.6 Å²	45.6	9%	0.094	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-36.3	177.6	-64.7	169.8	0	0	0	112.3	L828 V840 H842 T846 G847 V851 L876 L877 K880	L828-L844 HydrophobicContact CD1-CD1 4.5Å; L828-L844 HydrophobicContact CD1-CD2 3.95Å; L828-L844 HydrophobicContact CD1-CG 3.99Å; L828-L844 HydrophobicContact CD2-CD2 4.02Å; V840-L844 HydrophobicContact CG1-CD1 3.69Å; V840-L844 HydrophobicContact CG1-CG 4.43Å; V840-L844 WeakPolarHBondContact O-CB 3.48Å; V840-L844 WeakPolarHBondContact O-CG 3.42Å; V840-L844 PolarHBondContact O-N 2.99Å; H842-L844 VanDerWaalsContact C-N 3.32Å; H842-L844 PolarHBondContact O-N 2.88Å; L844-T846 VanDerWaalsContact C-N 3.3Å; L844-T846 PolarHBondContact O-N 3.23Å; L844-G847 PolarHBondContact O-N 3.42Å; L844-V851 HydrophobicContact CD2-CB 3.73Å; L844-V851 HydrophobicContact CD2-CG2 3.65Å; L844-L876 HydrophobicContact CD1-CG 4.37Å; L844-L877 HydrophobicContact CD1-CD2 3.75Å; L844-L877 HydrophobicContact CD2-CD2 4.45Å; L844-K880 HydrophobicContact CB-CD 4.35Å; L844-K880 HydrophobicContact CB-CG 4.24Å; L844-K880 HydrophobicContact CD1-CB 4.16Å; L844-K880 HydrophobicContact CD1-CG 4Å
845	T	91.3	Very high	92.4	Very high	89 Å²	89	43.8 Å²	43.8	55%	0.546	25%	0.25	S	C	.	.	H	α-helix	trans	-74.3	-18.1	-179.8	-57	0	0	0	0	112.9	E841 H842 L843 G847 K880	E841-T845 VanDerWaalsContact O-CB 3.22Å; E841-T845 WeakPolarHBondContact O-CB 3.42Å; E841-T845 PolarHBondContact O-N 2.91Å; E841-T845 PolarHBondContact O-OG1 2.9Å; H842-T845 PolarHBondContact O-N 2.91Å; L843-T845 VanDerWaalsContact C-N 3.34Å; L843-T845 PolarHBondContact O-N 2.98Å; T845-G847 VanDerWaalsContact C-N 3.27Å; T845-G847 PolarHBondContact O-N 2.36Å; T845-K880 PolarHBondContact OG1-NZ 3.04Å
846	T	83.4	Confident	92.4	Very high	47 Å²	47	47.8 Å²	47.8	29%	0.288	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-22.1	169.9	70.1	0	0	0	0	114	H842 L843 L844 L848	H842-T846 WeakPolarHBondContact O-CG2 3.48Å; H842-T846 PolarHBondContact O-N 2.9Å; L843-T846 PolarHBondContact O-N 2.64Å; L843-T846 PolarHBondContact O-OG1 2.7Å; L844-T846 VanDerWaalsContact C-N 3.3Å; L844-T846 PolarHBondContact O-N 3.23Å; T846-L848 PolarHBondContact O-N 2.9Å; T846-L848 VanDerWaalsContact O-N 3.16Å; T846-L848 WeakPolarHBondContact OG1-CB 3.46Å; T846-L848 PolarHBondContact OG1-N 3.04Å
847	G	76.1	Confident	92.3	Very high	64 Å²	64	47.7 Å²	47.7	66%	0.66	27%	0.274	S	S	*	.	S	Bend	trans	67.4	2.1	-171.2	0	0	0	0	0	115.1	L844 T845 V849	L844-G847 PolarHBondContact O-N 3.42Å; T845-G847 VanDerWaalsContact C-N 3.27Å; T845-G847 PolarHBondContact O-N 2.36Å; G847-V849 VanDerWaalsContact C-N 3.27Å; G847-V849 PolarHBondContact O-N 3.47Å
848	L	77.7	Confident	92.3	Very high	115 Å²	115	43.7 Å²	43.7	60%	0.602	26%	0.26	S	S	*	.			trans	-84.1	-0.2	-179.9	-59.3	175.5	0	0	0	113.5	M818 T846	M818-L848 WeakPolarHBondContact CG-O 3.47Å; T846-L848 PolarHBondContact O-N 2.9Å; T846-L848 VanDerWaalsContact O-N 3.16Å; T846-L848 WeakPolarHBondContact OG1-CB 3.46Å; T846-L848 PolarHBondContact OG1-N 3.04Å
849	V	87.9	Confident	92.3	Very high	14 Å²	14	43.5 Å²	43.5	9%	0.085	25%	0.252	C	S	.	.	S	Bend	trans	-132.3	121.7	-168.8	-179.9	0	0	0	0	109.1	A817 M818 L828 L843 G847 V851	A817-V849 HydrophobicContact CB-CG2 3.76Å; M818-V849 HydrophobicContact CE-CB 4.13Å; M818-V849 HydrophobicContact CE-CG1 3.78Å; M818-V849 HydrophobicContact CE-CG2 4.26Å; L828-V849 HydrophobicContact CB-CG1 3.85Å; L828-V849 HydrophobicContact CD1-CG1 4.47Å; L828-V849 HydrophobicContact CD2-CG1 3.81Å; L828-V849 HydrophobicContact CG-CG1 4.25Å; L843-V849 HydrophobicContact CB-CG2 4.33Å; L843-V849 HydrophobicContact CD2-CG2 4.29Å; G847-V849 VanDerWaalsContact C-N 3.27Å; G847-V849 PolarHBondContact O-N 3.47Å; V849-V851 PolarHBondContact O-N 2.92Å
850	D	91.3	Very high	92.4	Very high	82 Å²	82	43.7 Å²	43.7	44%	0.439	25%	0.253	S	S	.	.			trans	-68.2	117.1	169.9	172.5	22	0	0	0	110.3	N852 C853	D850-N852 PolarHBondContact O-N 3.31Å; D850-N852 WeakPolarHBondContact OD1-CA 3.24Å; D850-N852 WeakPolarHBondContact OD1-CB 3.04Å; D850-N852 PolarHBondContact OD1-N 3.17Å; D850-C853 HydrophobicContact CB-CB 4.11Å; D850-C853 WeakPolarHBondContact O-CB 3.29Å; D850-C853 PolarHBondContact O-N 2.87Å; D850-C853 PolarHBondContact O-SG 3.36Å; D850-C853 WeakPolarHBondContact OD2-CA 3.47Å; D850-C853 PolarHBondContact OD2-N 2.93Å
851	V	95.2	Very high	92.4	Very high	17 Å²	17	43.7 Å²	43.7	10%	0.103	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-27.6	177.1	69	0	0	0	0	112.6	L844 V849 L877 A882	L844-V851 HydrophobicContact CD2-CB 3.73Å; L844-V851 HydrophobicContact CD2-CG2 3.65Å; V849-V851 PolarHBondContact O-N 2.92Å; V851-L877 HydrophobicContact CG2-CD2 3.66Å; V851-A882 HydrophobicContact CG2-CB 3.78Å
852	N	95.3	Very high	92.4	Very high	41 Å²	41	40.2 Å²	40.2	22%	0.219	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	9	-177.7	-69.8	-47.1	0	0	0	113	D850 Q854 G881 A882 D883 I886	D850-N852 PolarHBondContact O-N 3.31Å; D850-N852 WeakPolarHBondContact OD1-CA 3.24Å; D850-N852 WeakPolarHBondContact OD1-CB 3.04Å; D850-N852 PolarHBondContact OD1-N 3.17Å; N852-Q854 PolarHBondContact O-N 2.73Å; N852-G881 PolarHBondContact ND2-O 2.79Å; N852-A882 WeakPolarHBondContact OD1-CA 3.03Å; N852-D883 PolarHBondContact OD1-N 3.4Å; N852-I886 HydrophobicContact CB-CD1 3.62Å; N852-I886 WeakPolarHBondContact OD1-CD1 3.47Å
853	C	94.1	Very high	92.5	Very high	13 Å²	13	37.1 Å²	37.1	9%	0.088	22%	0.223	C	C	.	.			trans	-59.7	135.4	178.7	65.7	0	0	0	0	110.6	H829 D850	H829-C853 PolarHBondContact CE1-O 2.95Å; H829-C853 PolarHBondContact CE1-SG 3.05Å; H829-C853 PolarHBondContact NE2-O 3.34Å; D850-C853 HydrophobicContact CB-CB 4.11Å; D850-C853 WeakPolarHBondContact O-CB 3.29Å; D850-C853 PolarHBondContact O-N 2.87Å; D850-C853 PolarHBondContact O-SG 3.36Å; D850-C853 WeakPolarHBondContact OD2-CA 3.47Å; D850-C853 PolarHBondContact OD2-N 2.93Å
854	Q	95.8	Very high	92.7	Very high	79 Å²	79	38.3 Å²	38.3	37%	0.369	23%	0.227	S	C	.	.	B	Isolated β-bridge	trans	-105.7	143.7	-179.2	-66.1	-179.1	-71.8	0	0	111.3	K820 N852 G858 W859 T860 I886 R887	K820-Q854 PolarHBondContact NZ-O 2.97Å; N852-Q854 PolarHBondContact O-N 2.73Å; Q854-G858 PolarHBondContact NE2-O 2.88Å; Q854-W859 CarbonylContact C-O 3.46Å; Q854-W859 VanDerWaalsContact CA-O 3.27Å; Q854-W859 WeakPolarHBondContact CA-O 3.44Å; Q854-T860 HydrophobicContact CG-CG2 3.91Å; Q854-I886 HydrophobicContact CG-CG2 4.26Å; Q854-R887 PolarHBondContact NE2-O 2.71Å
855	D	96.3	Very high	92.9	Very high	11 Å²	11	37.5 Å²	37.5	6%	0.059	22%	0.223	C	C	.	.			trans	-80.1	-169	170.6	66.8	19	0	0	0	113.6	F825 H829 G857 G858 W859 W864	F825-D855 HydrophobicContact CD1-CB 3.96Å; F825-D855 HydrophobicContact CE1-CB 4.17Å; F825-D855 WeakPolarHBondContact CE1-OD2 3.5Å; H829-D855 PolarHBondContact NE2-N 2.74Å; D855-G857 VanDerWaalsContact C-N 3.27Å; D855-G857 PolarHBondContact O-N 3.25Å; D855-G857 WeakPolarHBondContact OD1-CA 3.46Å; D855-G857 PolarHBondContact OD1-N 3.47Å; D855-G858 PolarHBondContact O-N 3.25Å; D855-G858 VanDerWaalsContact O-N 3.07Å; D855-G858 PolarHBondContact OD1-N 2.95Å; D855-W859 PolarHBondContact N-O 3.34Å; D855-W859 PolarHBondContact OD1-N 3.26Å; D855-W864 PolarHBondContact OD2-NE1 2.98Å
856	D	95	Very high	93.2	Very high	103 Å²	103	33.2 Å²	33.2	55%	0.551	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-4.9	177	-95.2	33.6	0	0	0	114.1	E823 K889	E823-D856 WeakPolarHBondContact O-CB 3.49Å; E823-D856 PolarHBondContact O-N 2.99Å; D856-K889 VanDerWaalsContact O-CE 3.29Å; D856-K889 WeakPolarHBondContact O-CE 3.42Å; D856-K889 PolarHBondContact O-NZ 3.19Å
857	G	94.6	Very high	93.8	Very high	30 Å²	30	33.6 Å²	33.6	31%	0.309	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-18.8	161.5	0	0	0	0	0	113.1	D855 W859 K889	D855-G857 VanDerWaalsContact C-N 3.27Å; D855-G857 PolarHBondContact O-N 3.25Å; D855-G857 WeakPolarHBondContact OD1-CA 3.46Å; D855-G857 PolarHBondContact OD1-N 3.47Å; G857-W859 VanDerWaalsContact C-N 3.35Å; G857-K889 WeakPolarHBondContact O-CB 3.39Å; G857-K889 VanDerWaalsContact O-CG 3.26Å; G857-K889 WeakPolarHBondContact O-CG 3.28Å; G857-K889 PolarHBondContact O-N 2.85Å; G857-K889 VanDerWaalsContact O-N 3.14Å
858	G	96.1	Very high	94.7	Very high	5 Å²	5	36.3 Å²	36.3	5%	0.052	19%	0.186	C	C	.	.	S	Bend	trans	83.5	12.9	-165.7	0	0	0	0	0	112.6	Q854 D855 D888	Q854-G858 PolarHBondContact NE2-O 2.88Å; D855-G858 PolarHBondContact O-N 3.25Å; D855-G858 VanDerWaalsContact O-N 3.07Å; D855-G858 PolarHBondContact OD1-N 2.95Å; G858-D888 WeakPolarHBondContact O-CA 3.23Å
859	W	97.4	Very high	95.6	Very high	44 Å²	44	35.4 Å²	35.4	17%	0.167	18%	0.178	C	C	.	.			trans	-86.3	145.2	179.6	-60.2	9.4	0	0	0	108.9	H829 Q854 D855 G857 I863 W864 D888 W897	H829-W859 PolarHBondContact NE2-O 3.16Å; H829-W859 VanDerWaalsContact NE2-O 3.12Å; Q854-W859 CarbonylContact C-O 3.46Å; Q854-W859 VanDerWaalsContact CA-O 3.27Å; Q854-W859 WeakPolarHBondContact CA-O 3.44Å; D855-W859 PolarHBondContact N-O 3.34Å; D855-W859 PolarHBondContact OD1-N 3.26Å; G857-W859 VanDerWaalsContact C-N 3.35Å; W859-I863 HydrophobicContact CB-CB 4.11Å; W859-I863 HydrophobicContact CB-CD1 4.43Å; W859-I863 HydrophobicContact CB-CG2 3.81Å; W859-I863 HydrophobicContact CD2-CG2 3.76Å; W859-I863 HydrophobicContact CE3-CG2 3.79Å; W859-I863 HydrophobicContact CG-CG2 3.76Å; W859-W864 HydrophobicContact CD2-CZ2 4.23Å; W859-W864 AromaticContact CE3-CD2 3.83Å; W859-W864 HydrophobicContact CE3-CD2 3.83Å; W859-W864 AromaticContact CE3-CE2 3.38Å; W859-W864 HydrophobicContact CE3-CE3 4.19Å; W859-W864 HydrophobicContact CE3-CG 4.43Å; W859-W864 AromaticContact CE3-CH2 3.79Å; W859-W864 HydrophobicContact CE3-CH2 3.79Å; W859-W864 AromaticContact CE3-CZ2 3.38Å; W859-W864 HydrophobicContact CE3-CZ2 3.38Å; W859-W864 HydrophobicContact CE3-CZ3 4.17Å; W859-W864 AromaticContact CE3-NE1 3.75Å; W859-W864 HydrophobicContact CH2-CH2 4.44Å; W859-W864 HydrophobicContact CZ3-CD2 4.24Å; W859-W864 AromaticContact CZ3-CE2 3.98Å; W859-W864 HydrophobicContact CZ3-CE3 4.12Å; W859-W864 AromaticContact CZ3-CH2 3.53Å; W859-W864 HydrophobicContact CZ3-CH2 3.53Å; W859-W864 AromaticContact CZ3-CZ2 3.65Å; W859-W864 HydrophobicContact CZ3-CZ2 3.65Å; W859-W864 AromaticContact CZ3-CZ3 3.77Å; W859-W864 HydrophobicContact CZ3-CZ3 3.77Å; W859-D888 VanDerWaalsContact CD1-CB 3.44Å; W859-D888 PolarHBondContact NE1-OD2 3.17Å; W859-W897 AromaticContact CE2-CZ2 3.59Å; W859-W897 HydrophobicContact CH2-CE3 4.44Å; W859-W897 AromaticContact CH2-CH2 3.53Å; W859-W897 HydrophobicContact CH2-CH2 3.53Å; W859-W897 AromaticContact CH2-CZ2 3.95Å; W859-W897 HydrophobicContact CH2-CZ2 3.95Å; W859-W897 AromaticContact CH2-CZ3 3.78Å; W859-W897 HydrophobicContact CH2-CZ3 3.78Å; W859-W897 AromaticContact CZ2-CH2 3.22Å; W859-W897 HydrophobicContact CZ2-CH2 3.22Å; W859-W897 AromaticContact CZ2-CZ2 3.26Å; W859-W897 HydrophobicContact CZ2-CZ2 3.26Å; W859-W897 AromaticContact CZ2-CZ3 3.96Å; W859-W897 HydrophobicContact CZ2-CZ3 3.96Å; W859-W897 AromaticContact NE1-CZ2 3.8Å
860	T	97.2	Very high	96	Very high	5 Å²	5	37 Å²	37	3%	0.031	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-97.4	168.5	173.4	61.6	0	0	0	0	110.5	Q854 M862 I863 W864 I886	Q854-T860 HydrophobicContact CG-CG2 3.91Å; T860-M862 PolarHBondContact O-N 2.74Å; T860-M862 VanDerWaalsContact O-N 3.14Å; T860-M862 PolarHBondContact OG1-N 3.22Å; T860-I863 PolarHBondContact O-N 2.89Å; T860-I863 PolarHBondContact OG1-N 3Å; T860-W864 PolarHBondContact O-N 2.79Å; T860-I886 HydrophobicContact CG2-CB 4.43Å; T860-I886 HydrophobicContact CG2-CD1 4.07Å; T860-I886 HydrophobicContact CG2-CG2 3.79Å
861	A	96.7	Very high	96.3	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-52.7	-32.3	170.3	0	0	0	0	0	113.3	L828 A832 A865 L877	L828-A861 HydrophobicContact CD2-CB 3.76Å; L828-A861 HydrophobicContact CG-CB 3.75Å; A832-A861 HydrophobicContact CB-CB 3.87Å; A861-A865 WeakPolarHBondContact O-CB 3.49Å; A861-A865 PolarHBondContact O-N 2.86Å; A861-L877 HydrophobicContact CB-CD1 4.35Å; A861-L877 HydrophobicContact CB-CD2 4.29Å
862	M	97.1	Very high	96.4	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-68.6	-37.7	176	-163.5	-153.1	-63.8	0	0	112.4	T860 A865 T866 V874 L877 L878 A882 I884 C894 L910	T860-M862 PolarHBondContact O-N 2.74Å; T860-M862 VanDerWaalsContact O-N 3.14Å; T860-M862 PolarHBondContact OG1-N 3.22Å; M862-A865 PolarHBondContact O-N 3.2Å; M862-T866 VanDerWaalsContact O-CB 3.23Å; M862-T866 WeakPolarHBondContact O-CB 3.44Å; M862-T866 PolarHBondContact O-N 2.85Å; M862-T866 PolarHBondContact O-OG1 3.23Å; M862-V874 HydrophobicContact CG-CG1 3.89Å; M862-V874 HydrophobicContact CG-CG2 4.33Å; M862-V874 HydrophobicContact SD-CG1 4.2Å; M862-L877 HydrophobicContact CB-CD1 4.12Å; M862-L877 HydrophobicContact CG-CD1 4.48Å; M862-L878 HydrophobicContact CE-CD2 3.48Å; M862-L878 VanDerWaalsContact CE-CD2 3.48Å; M862-L878 HydrophobicContact CE-CG 4.05Å; M862-L878 HydrophobicContact SD-CD2 4.27Å; M862-A882 HydrophobicContact CE-CB 3.36Å; M862-I884 HydrophobicContact CE-CG1 4.19Å; M862-C894 HydrophobicContact SD-CB 3.94Å; M862-C894 PolarHBondContact SD-SG 3.48Å; M862-L910 HydrophobicContact SD-CD2 3.87Å
863	I	97.3	Very high	96.4	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-65.9	-44	177.2	-72.8	168.9	0	0	0	110.1	W859 T860 T866 E867 C894 W897	W859-I863 HydrophobicContact CB-CB 4.11Å; W859-I863 HydrophobicContact CB-CD1 4.43Å; W859-I863 HydrophobicContact CB-CG2 3.81Å; W859-I863 HydrophobicContact CD2-CG2 3.76Å; W859-I863 HydrophobicContact CE3-CG2 3.79Å; W859-I863 HydrophobicContact CG-CG2 3.76Å; T860-I863 PolarHBondContact O-N 2.89Å; T860-I863 PolarHBondContact OG1-N 3Å; I863-T866 WeakPolarHBondContact O-CB 3.42Å; I863-T866 PolarHBondContact O-N 2.85Å; I863-T866 VanDerWaalsContact O-N 3.1Å; I863-E867 PolarHBondContact O-N 3.22Å; I863-C894 HydrophobicContact CG1-CB 4.35Å; I863-W897 HydrophobicContact CG2-CB 4.32Å; I863-W897 HydrophobicContact CG2-CD2 4.11Å; I863-W897 HydrophobicContact CG2-CG 3.72Å
864	W	97.4	Very high	96.6	Very high	25 Å²	25	35.5 Å²	35.5	10%	0.095	18%	0.175	C	C	.	.	H	α-helix	trans	-63.4	-44.5	175.1	-74.9	100.7	0	0	0	112.9	F825 H829 K833 D855 W859 T860 T866 E867 Y868	F825-W864 HydrophobicContact CE1-CD2 4.45Å; F825-W864 AromaticContact CE1-CE2 3.48Å; F825-W864 VanDerWaalsContact CE1-CE2 3.48Å; F825-W864 HydrophobicContact CE1-CH2 4.28Å; F825-W864 AromaticContact CE1-CZ2 3.37Å; F825-W864 HydrophobicContact CE1-CZ2 3.37Å; F825-W864 AromaticContact CE1-NE1 3.55Å; F825-W864 AromaticContact CZ-CH2 3.99Å; F825-W864 HydrophobicContact CZ-CH2 3.99Å; F825-W864 AromaticContact CZ-CZ2 3.49Å; F825-W864 HydrophobicContact CZ-CZ2 3.49Å; F825-W864 VanDerWaalsContact CZ-CZ2 3.49Å; H829-W864 AromaticContact CD2-CD1 3.73Å; H829-W864 AromaticContact CD2-NE1 3.96Å; K833-W864 HydrophobicContact CB-CB 4.1Å; K833-W864 HydrophobicContact CB-CE3 4.34Å; K833-W864 HydrophobicContact CB-CG 4.46Å; K833-W864 HydrophobicContact CD-CD2 4.08Å; K833-W864 HydrophobicContact CD-CE3 3.61Å; K833-W864 HydrophobicContact CD-CZ3 3.9Å; K833-W864 VanDerWaalsContact CE-CZ3 3.44Å; K833-W864 HydrophobicContact CG-CD2 4.35Å; K833-W864 HydrophobicContact CG-CE3 3.75Å; K833-W864 HydrophobicContact CG-CZ3 4.36Å; D855-W864 PolarHBondContact OD2-NE1 2.98Å; W859-W864 HydrophobicContact CD2-CZ2 4.23Å; W859-W864 AromaticContact CE3-CD2 3.83Å; W859-W864 HydrophobicContact CE3-CD2 3.83Å; W859-W864 AromaticContact CE3-CE2 3.38Å; W859-W864 HydrophobicContact CE3-CE3 4.19Å; W859-W864 HydrophobicContact CE3-CG 4.43Å; W859-W864 AromaticContact CE3-CH2 3.79Å; W859-W864 HydrophobicContact CE3-CH2 3.79Å; W859-W864 AromaticContact CE3-CZ2 3.38Å; W859-W864 HydrophobicContact CE3-CZ2 3.38Å; W859-W864 HydrophobicContact CE3-CZ3 4.17Å; W859-W864 AromaticContact CE3-NE1 3.75Å; W859-W864 HydrophobicContact CH2-CH2 4.44Å; W859-W864 HydrophobicContact CZ3-CD2 4.24Å; W859-W864 AromaticContact CZ3-CE2 3.98Å; W859-W864 HydrophobicContact CZ3-CE3 4.12Å; W859-W864 AromaticContact CZ3-CH2 3.53Å; W859-W864 HydrophobicContact CZ3-CH2 3.53Å; W859-W864 AromaticContact CZ3-CZ2 3.65Å; W859-W864 HydrophobicContact CZ3-CZ2 3.65Å; W859-W864 AromaticContact CZ3-CZ3 3.77Å; W859-W864 HydrophobicContact CZ3-CZ3 3.77Å; T860-W864 PolarHBondContact O-N 2.79Å; W864-T866 PolarHBondContact O-N 2.8Å; W864-E867 WeakPolarHBondContact CZ3-OE2 3.39Å; W864-E867 PolarHBondContact O-N 2.69Å; W864-Y868 HydrophobicContact CE3-CD2 4.3Å; W864-Y868 AromaticContact CE3-CE2 3.79Å; W864-Y868 HydrophobicContact CE3-CE2 3.79Å; W864-Y868 AromaticContact CZ3-CE2 3.95Å; W864-Y868 HydrophobicContact CZ3-CE2 3.95Å; W864-Y868 WeakPolarHBondContact O-CD2 3.42Å; W864-Y868 PolarHBondContact O-N 3.27Å
865	A	97.6	Very high	96.7	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.8	-31.1	172.7	0	0	0	0	0	112.3	A861 M862 K869 H870 Q873 V874 L877	A861-A865 WeakPolarHBondContact O-CB 3.49Å; A861-A865 PolarHBondContact O-N 2.86Å; M862-A865 PolarHBondContact O-N 3.2Å; A865-K869 CarbonylContact O-C 3.5Å; A865-K869 PolarHBondContact O-N 2.77Å; A865-H870 HydrophobicContact CB-CB 4.26Å; A865-H870 PolarHBondContact O-N 2.83Å; A865-Q873 HydrophobicContact CB-CB 4.28Å; A865-V874 HydrophobicContact CB-CG2 3.79Å; A865-L877 HydrophobicContact CB-CD1 4.28Å
866	T	97.1	Very high	96.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-80.8	-37.3	-178.7	-63.5	0	0	0	0	113.8	M862 I863 W864 Y868 K869 V874 C894 W897 A898 S901 I906	M862-T866 VanDerWaalsContact O-CB 3.23Å; M862-T866 WeakPolarHBondContact O-CB 3.44Å; M862-T866 PolarHBondContact O-N 2.85Å; M862-T866 PolarHBondContact O-OG1 3.23Å; I863-T866 WeakPolarHBondContact O-CB 3.42Å; I863-T866 PolarHBondContact O-N 2.85Å; I863-T866 VanDerWaalsContact O-N 3.1Å; W864-T866 PolarHBondContact O-N 2.8Å; T866-Y868 VanDerWaalsContact C-N 3.33Å; T866-K869 PolarHBondContact O-N 3.24Å; T866-V874 WeakPolarHBondContact OG1-CG2 3.36Å; T866-C894 PolarHBondContact OG1-SG 3.4Å; T866-W897 HydrophobicContact CG2-CB 4.16Å; T866-A898 VanDerWaalsContact CG2-CA 3.45Å; T866-A898 HydrophobicContact CG2-CB 3.58Å; T866-A898 VanDerWaalsContact CG2-N 3.27Å; T866-S901 PolarHBondContact O-OG 3.26Å; T866-I906 HydrophobicContact CG2-CG2 3.78Å
867	E	95.8	Very high	96.7	Very high	55 Å²	55	31 Å²	31	26%	0.257	15%	0.149	S	C	.	.	H	α-helix	trans	-61.2	-45.5	171.8	-173.7	-172.7	-153.8	0	0	110.3	I863 W864 K869 S901	I863-E867 PolarHBondContact O-N 3.22Å; W864-E867 WeakPolarHBondContact CZ3-OE2 3.39Å; W864-E867 PolarHBondContact O-N 2.69Å; E867-K869 VanDerWaalsContact C-N 3.34Å; E867-K869 PolarHBondContact O-N 2.66Å; E867-S901 WeakPolarHBondContact O-CB 3.35Å
868	Y	95.5	Very high	96.8	Very high	120 Å²	120	31.3 Å²	31.3	47%	0.471	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	2	-178.2	-73.8	-102	0	0	0	114.6	K833 W864 T866 H870	K833-Y868 HydrophobicContact CG-CD2 4.3Å; K833-Y868 HydrophobicContact CG-CE2 3.93Å; W864-Y868 HydrophobicContact CE3-CD2 4.3Å; W864-Y868 AromaticContact CE3-CE2 3.79Å; W864-Y868 HydrophobicContact CE3-CE2 3.79Å; W864-Y868 AromaticContact CZ3-CE2 3.95Å; W864-Y868 HydrophobicContact CZ3-CE2 3.95Å; W864-Y868 WeakPolarHBondContact O-CD2 3.42Å; W864-Y868 PolarHBondContact O-N 3.27Å; T866-Y868 VanDerWaalsContact C-N 3.33Å; Y868-H870 WeakPolarHBondContact CB-NE2 3.38Å
869	K	96.7	Very high	96.7	Very high	97 Å²	97	35.5 Å²	35.5	42%	0.422	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	65	28.5	175	-46.4	-166.4	-179.8	-165.8	0	116.8	A865 T866 E867 V871 S901 G902	A865-K869 CarbonylContact O-C 3.5Å; A865-K869 PolarHBondContact O-N 2.77Å; T866-K869 PolarHBondContact O-N 3.24Å; E867-K869 VanDerWaalsContact C-N 3.34Å; E867-K869 PolarHBondContact O-N 2.66Å; K869-V871 VanDerWaalsContact C-N 3.27Å; K869-V871 WeakPolarHBondContact O-CG2 3.2Å; K869-V871 PolarHBondContact O-N 3.03Å; K869-S901 WeakPolarHBondContact CE-O 3.25Å; K869-S901 PolarHBondContact NZ-O 3.17Å; K869-G902 PolarHBondContact NZ-O 2.8Å
870	H	97.3	Very high	96.6	Very high	46 Å²	46	37.5 Å²	37.5	21%	0.213	18%	0.182	C	C	.	.			trans	-76	73.2	177.4	-58.8	-53.3	0	0	0	111.8	A832 K833 G835 A865 Y868 D872 Q873 V874	A832-H870 PolarHBondContact O-CD2 2.89Å; A832-H870 VanDerWaalsContact O-CD2 3.23Å; K833-H870 PolarHBondContact O-NE2 3.46Å; G835-H870 WeakPolarHBondContact CA-CE1 3.38Å; G835-H870 VanDerWaalsContact CA-NE2 3.31Å; G835-H870 WeakPolarHBondContact CA-NE2 3.45Å; G835-H870 PolarHBondContact N-NE2 3.13Å; A865-H870 HydrophobicContact CB-CB 4.26Å; A865-H870 PolarHBondContact O-N 2.83Å; Y868-H870 WeakPolarHBondContact CB-NE2 3.38Å; H870-D872 PolarHBondContact O-N 2.81Å; H870-Q873 HydrophobicContact CB-CB 4.05Å; H870-Q873 WeakPolarHBondContact O-CB 3.49Å; H870-Q873 PolarHBondContact O-N 2.74Å; H870-V874 PolarHBondContact O-N 3.34Å; H870-V874 VanDerWaalsContact O-N 3.14Å
871	V	96.6	Very high	96.4	Very high	21 Å²	21	39.7 Å²	39.7	13%	0.127	21%	0.205	C	C	.	.	H	α-helix	trans	-51.9	-49.1	-167.9	-165.9	0	0	0	0	113.1	K869 Q873 V874 K875 E905 I906	K869-V871 VanDerWaalsContact C-N 3.27Å; K869-V871 WeakPolarHBondContact O-CG2 3.2Å; K869-V871 PolarHBondContact O-N 3.03Å; V871-Q873 VanDerWaalsContact C-N 3.33Å; V871-Q873 PolarHBondContact O-N 2.8Å; V871-V874 PolarHBondContact O-N 3.02Å; V871-V874 VanDerWaalsContact O-N 3.11Å; V871-K875 PolarHBondContact O-N 3.41Å; V871-E905 HydrophobicContact CG1-CB 3.88Å; V871-E905 HydrophobicContact CG2-CB 4.35Å; V871-I906 HydrophobicContact CB-CG1 4.17Å; V871-I906 HydrophobicContact CG1-CG1 3.97Å; V871-I906 HydrophobicContact CG2-CD1 4.25Å; V871-I906 HydrophobicContact CG2-CG1 4.05Å
872	D	97.1	Very high	96.3	Very high	92 Å²	92	40.1 Å²	40.1	49%	0.492	21%	0.209	S	C	.	.	H	α-helix	trans	-73.2	-24.5	-176.7	-60.1	-50.4	0	0	0	113.3	Y837 H870 K875 L876	Y837-D872 HydrophobicContact CD2-CB 4.28Å; Y837-D872 HydrophobicContact CE2-CB 4.33Å; H870-D872 PolarHBondContact O-N 2.81Å; D872-K875 PolarHBondContact O-N 2.88Å; D872-K875 WeakPolarHBondContact OD1-CD 3.12Å; D872-K875 WeakPolarHBondContact OD1-CE 3.48Å; D872-K875 IonicContact OD1-NZ 2.66Å; D872-K875 PolarHBondContact OD1-NZ 3.48Å; D872-L876 VanDerWaalsContact O-CB 3.32Å; D872-L876 WeakPolarHBondContact O-CB 3.43Å; D872-L876 PolarHBondContact O-N 2.93Å
873	Q	96.6	Very high	96.2	Very high	10 Å²	10	43.4 Å²	43.4	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-69.6	-34.5	168.2	-92.2	149.7	96.1	0	0	111.9	G835 Y837 V840 A865 H870 V871 L876 L877	G835-Q873 VanDerWaalsContact CA-OE1 3.31Å; G835-Q873 PolarHBondContact O-NE2 3.32Å; Y837-Q873 HydrophobicContact CD2-CG 4Å; Y837-Q873 HydrophobicContact CG-CG 4.41Å; V840-Q873 HydrophobicContact CB-CG 4.45Å; V840-Q873 HydrophobicContact CG2-CG 4.4Å; A865-Q873 HydrophobicContact CB-CB 4.28Å; H870-Q873 HydrophobicContact CB-CB 4.05Å; H870-Q873 WeakPolarHBondContact O-CB 3.49Å; H870-Q873 PolarHBondContact O-N 2.74Å; V871-Q873 VanDerWaalsContact C-N 3.33Å; V871-Q873 PolarHBondContact O-N 2.8Å; Q873-L876 PolarHBondContact O-N 3.45Å; Q873-L877 WeakPolarHBondContact O-CB 3.35Å; Q873-L877 WeakPolarHBondContact O-CD1 3.38Å; Q873-L877 WeakPolarHBondContact O-CG 3.13Å; Q873-L877 PolarHBondContact O-N 2.79Å
874	V	97.1	Very high	96	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67.1	-43.2	172.4	178.9	0	0	0	0	110.7	M862 A865 T866 H870 V871 L876 L877 L878 I906	M862-V874 HydrophobicContact CG-CG1 3.89Å; M862-V874 HydrophobicContact CG-CG2 4.33Å; M862-V874 HydrophobicContact SD-CG1 4.2Å; A865-V874 HydrophobicContact CB-CG2 3.79Å; T866-V874 WeakPolarHBondContact OG1-CG2 3.36Å; H870-V874 PolarHBondContact O-N 3.34Å; H870-V874 VanDerWaalsContact O-N 3.14Å; V871-V874 PolarHBondContact O-N 3.02Å; V871-V874 VanDerWaalsContact O-N 3.11Å; V874-L876 VanDerWaalsContact C-N 3.34Å; V874-L876 PolarHBondContact O-N 2.95Å; V874-L877 PolarHBondContact O-N 2.88Å; V874-L878 HydrophobicContact CG1-CD1 3.92Å; V874-L878 HydrophobicContact CG1-CG 4.4Å; V874-L878 WeakPolarHBondContact O-CB 3.31Å; V874-L878 VanDerWaalsContact O-CG 3.23Å; V874-L878 WeakPolarHBondContact O-CG 3.2Å; V874-L878 PolarHBondContact O-N 2.7Å; V874-I906 HydrophobicContact CB-CG2 4.45Å; V874-I906 HydrophobicContact CG1-CG2 4.04Å; V874-I906 HydrophobicContact CG2-CD1 4.05Å; V874-I906 HydrophobicContact CG2-CG1 4.42Å; V874-I906 HydrophobicContact CG2-CG2 4.25Å
875	K	97.1	Very high	95.7	Very high	90 Å²	90	46.8 Å²	46.8	39%	0.391	25%	0.252	S	S	.	.	H	α-helix	trans	-57.5	-44.5	172.7	-63.8	173.2	-167.5	151.7	0	112	V871 D872 S879 V909	V871-K875 PolarHBondContact O-N 3.41Å; D872-K875 PolarHBondContact O-N 2.88Å; D872-K875 WeakPolarHBondContact OD1-CD 3.12Å; D872-K875 WeakPolarHBondContact OD1-CE 3.48Å; D872-K875 IonicContact OD1-NZ 2.66Å; D872-K875 PolarHBondContact OD1-NZ 3.48Å; K875-S879 PolarHBondContact O-N 3.16Å; K875-V909 HydrophobicContact CG-CG1 4.39Å; K875-V909 HydrophobicContact CG-CG2 4.35Å
876	L	96.7	Very high	95.5	Very high	7 Å²	7	48.2 Å²	48.2	4%	0.037	26%	0.259	C	S	.	.	H	α-helix	trans	-63	-48.3	175.7	169.8	65.8	0	0	0	112.4	Y837 V840 E841 L844 D872 Q873 V874 L878 S879 K880	Y837-L876 HydrophobicContact CD2-CD2 4.08Å; Y837-L876 HydrophobicContact CE1-CD2 4.31Å; Y837-L876 HydrophobicContact CE2-CB 3.83Å; Y837-L876 HydrophobicContact CE2-CD2 3.71Å; Y837-L876 HydrophobicContact CE2-CG 4.3Å; V840-L876 HydrophobicContact CB-CD2 4.31Å; V840-L876 HydrophobicContact CG1-CD2 3.85Å; E841-L876 HydrophobicContact CB-CD1 4.38Å; E841-L876 HydrophobicContact CB-CD2 3.75Å; E841-L876 HydrophobicContact CG-CD1 4.21Å; E841-L876 HydrophobicContact CG-CD2 4.45Å; L844-L876 HydrophobicContact CD1-CG 4.37Å; D872-L876 VanDerWaalsContact O-CB 3.32Å; D872-L876 WeakPolarHBondContact O-CB 3.43Å; D872-L876 PolarHBondContact O-N 2.93Å; Q873-L876 PolarHBondContact O-N 3.45Å; V874-L876 VanDerWaalsContact C-N 3.34Å; V874-L876 PolarHBondContact O-N 2.95Å; L876-L878 VanDerWaalsContact C-N 3.31Å; L876-L878 PolarHBondContact O-N 3.31Å; L876-S879 PolarHBondContact O-N 3.29Å; L876-S879 PolarHBondContact O-OG 3.15Å; L876-K880 HydrophobicContact CD1-CG 3.97Å; L876-K880 VanDerWaalsContact O-CG 3.23Å; L876-K880 WeakPolarHBondContact O-CG 3.43Å; L876-K880 PolarHBondContact O-N 2.95Å
877	L	96.4	Very high	95.4	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.8	-42.9	179.8	-74.9	162.8	0	0	0	110.8	V840 L844 V851 A861 M862 A865 Q873 V874 K880 G881 A882	V840-L877 HydrophobicContact CG1-CD2 4.22Å; V840-L877 HydrophobicContact CG1-CG 4.42Å; L844-L877 HydrophobicContact CD1-CD2 3.75Å; L844-L877 HydrophobicContact CD2-CD2 4.45Å; V851-L877 HydrophobicContact CG2-CD2 3.66Å; A861-L877 HydrophobicContact CB-CD1 4.35Å; A861-L877 HydrophobicContact CB-CD2 4.29Å; M862-L877 HydrophobicContact CB-CD1 4.12Å; M862-L877 HydrophobicContact CG-CD1 4.48Å; A865-L877 HydrophobicContact CB-CD1 4.28Å; Q873-L877 WeakPolarHBondContact O-CB 3.35Å; Q873-L877 WeakPolarHBondContact O-CD1 3.38Å; Q873-L877 WeakPolarHBondContact O-CG 3.13Å; Q873-L877 PolarHBondContact O-N 2.79Å; V874-L877 PolarHBondContact O-N 2.88Å; L877-K880 CarbonylContact O-C 3.49Å; L877-K880 PolarHBondContact O-N 2.83Å; L877-G881 PolarHBondContact O-N 3.42Å; L877-A882 HydrophobicContact CB-CB 3.99Å; L877-A882 WeakPolarHBondContact O-CB 3.46Å; L877-A882 PolarHBondContact O-N 3.44Å
878	L	95.7	Very high	95.4	Very high	38 Å²	38	50.9 Å²	50.9	20%	0.199	27%	0.268	C	S	.	.	H	α-helix	trans	-60.6	-46.1	173.5	-70.6	168.3	0	0	0	112.2	M862 V874 L876 K880 G881 I884 V909 L910	M862-L878 HydrophobicContact CE-CD2 3.48Å; M862-L878 VanDerWaalsContact CE-CD2 3.48Å; M862-L878 HydrophobicContact CE-CG 4.05Å; M862-L878 HydrophobicContact SD-CD2 4.27Å; V874-L878 HydrophobicContact CG1-CD1 3.92Å; V874-L878 HydrophobicContact CG1-CG 4.4Å; V874-L878 WeakPolarHBondContact O-CB 3.31Å; V874-L878 VanDerWaalsContact O-CG 3.23Å; V874-L878 WeakPolarHBondContact O-CG 3.2Å; V874-L878 PolarHBondContact O-N 2.7Å; L876-L878 VanDerWaalsContact C-N 3.31Å; L876-L878 PolarHBondContact O-N 3.31Å; L878-K880 PolarHBondContact O-N 3.3Å; L878-G881 PolarHBondContact O-N 2.9Å; L878-I884 HydrophobicContact CD2-CD1 3.68Å; L878-I884 HydrophobicContact CD2-CG1 3.49Å; L878-I884 VanDerWaalsContact CD2-CG1 3.49Å; L878-V909 HydrophobicContact CD1-CG1 3.48Å; L878-V909 VanDerWaalsContact CD1-CG1 3.48Å; L878-L910 HydrophobicContact CD1-CD2 4.44Å
879	S	95.2	Very high	95.4	Very high	92 Å²	92	52 Å²	52	64%	0.643	28%	0.275	S	S	*	.	H	α-helix	trans	-65.7	-20.1	177.8	78.4	0	0	0	0	113.7	K875 L876	K875-S879 PolarHBondContact O-N 3.16Å; L876-S879 PolarHBondContact O-N 3.29Å; L876-S879 PolarHBondContact O-OG 3.15Å
880	K	94.6	Very high	95.3	Very high	87 Å²	87	52.1 Å²	52.1	38%	0.378	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	11	174.9	-59.3	-77.1	178	166.3	0	113.3	L844 T845 L876 L877 L878	L844-K880 HydrophobicContact CB-CD 4.35Å; L844-K880 HydrophobicContact CB-CG 4.24Å; L844-K880 HydrophobicContact CD1-CB 4.16Å; L844-K880 HydrophobicContact CD1-CG 4Å; T845-K880 PolarHBondContact OG1-NZ 3.04Å; L876-K880 HydrophobicContact CD1-CG 3.97Å; L876-K880 VanDerWaalsContact O-CG 3.23Å; L876-K880 WeakPolarHBondContact O-CG 3.43Å; L876-K880 PolarHBondContact O-N 2.95Å; L877-K880 CarbonylContact O-C 3.49Å; L877-K880 PolarHBondContact O-N 2.83Å; L878-K880 PolarHBondContact O-N 3.3Å
881	G	92.2	Very high	95.3	Very high	50 Å²	50	55.4 Å²	55.4	52%	0.515	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	24.8	172	0	0	0	0	0	115.9	N852 L877 L878	N852-G881 PolarHBondContact ND2-O 2.79Å; L877-G881 PolarHBondContact O-N 3.42Å; L878-G881 PolarHBondContact O-N 2.9Å
882	A	95.4	Very high	95.3	Very high	10 Å²	10	54.6 Å²	54.6	8%	0.083	29%	0.286	C	S	.	.			trans	-68.9	129.4	173	0	0	0	0	0	112	V851 N852 M862 L877	V851-A882 HydrophobicContact CG2-CB 3.78Å; N852-A882 WeakPolarHBondContact OD1-CA 3.03Å; M862-A882 HydrophobicContact CE-CB 3.36Å; L877-A882 HydrophobicContact CB-CB 3.99Å; L877-A882 WeakPolarHBondContact O-CB 3.46Å; L877-A882 PolarHBondContact O-N 3.44Å
883	D	93.8	Very high	95.2	Very high	71 Å²	71	50.5 Å²	50.5	38%	0.38	26%	0.264	S	S	.	.			trans	-87.5	117.5	-175.9	175.2	11.5	0	0	0	111.5	N852 S885 I886	N852-D883 PolarHBondContact OD1-N 3.4Å; D883-S885 VanDerWaalsContact C-N 3.27Å; D883-S885 VanDerWaalsContact CG-OG 3.26Å; D883-S885 PolarHBondContact O-N 2.93Å; D883-S885 WeakPolarHBondContact OD1-CA 3.47Å; D883-S885 VanDerWaalsContact OD1-CB 3.27Å; D883-S885 WeakPolarHBondContact OD1-CB 3.34Å; D883-S885 PolarHBondContact OD1-N 2.86Å; D883-S885 PolarHBondContact OD1-OG 3.27Å; D883-S885 PolarHBondContact OD2-OG 3.42Å; D883-S885 VanDerWaalsContact OD2-OG 3.06Å; D883-I886 HydrophobicContact CB-CD1 3.85Å; D883-I886 HydrophobicContact CB-CG1 3.89Å
884	I	93.7	Very high	95.2	Very high	21 Å²	21	50.2 Å²	50.2	11%	0.108	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-26.6	179.8	-57.1	165.3	0	0	0	111.9	M862 L878 I886 L910 A913 C915	M862-I884 HydrophobicContact CE-CG1 4.19Å; L878-I884 HydrophobicContact CD2-CD1 3.68Å; L878-I884 HydrophobicContact CD2-CG1 3.49Å; L878-I884 VanDerWaalsContact CD2-CG1 3.49Å; I884-I886 VanDerWaalsContact C-N 3.26Å; I884-I886 PolarHBondContact O-N 3.06Å; I884-L910 HydrophobicContact CD1-CD2 4.21Å; I884-L910 HydrophobicContact CG1-CD2 3.96Å; I884-L910 HydrophobicContact CG2-CD2 3.96Å; I884-A913 HydrophobicContact CD1-CB 3.46Å; I884-A913 VanDerWaalsContact CD1-CB 3.46Å; I884-C915 HydrophobicContact CG2-CB 3.82Å; I884-C915 WeakPolarHBondContact CG2-SG 3.49Å
885	S	90.9	Very high	95.2	Very high	76 Å²	76	50.2 Å²	50.2	53%	0.531	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-9.8	-175.6	80.2	0	0	0	0	113.7	D883 R887	D883-S885 VanDerWaalsContact C-N 3.27Å; D883-S885 VanDerWaalsContact CG-OG 3.26Å; D883-S885 PolarHBondContact O-N 2.93Å; D883-S885 WeakPolarHBondContact OD1-CA 3.47Å; D883-S885 VanDerWaalsContact OD1-CB 3.27Å; D883-S885 WeakPolarHBondContact OD1-CB 3.34Å; D883-S885 PolarHBondContact OD1-N 2.86Å; D883-S885 PolarHBondContact OD1-OG 3.27Å; D883-S885 PolarHBondContact OD2-OG 3.42Å; D883-S885 VanDerWaalsContact OD2-OG 3.06Å; S885-R887 PolarHBondContact O-N 3.42Å
886	I	94.2	Very high	95.3	Very high	29 Å²	29	46 Å²	46	15%	0.149	24%	0.244	C	C	.	.			trans	-57.9	134	175.9	-67	176	0	0	0	110.2	N852 Q854 T860 D883 I884	N852-I886 HydrophobicContact CB-CD1 3.62Å; N852-I886 WeakPolarHBondContact OD1-CD1 3.47Å; Q854-I886 HydrophobicContact CG-CG2 4.26Å; T860-I886 HydrophobicContact CG2-CB 4.43Å; T860-I886 HydrophobicContact CG2-CD1 4.07Å; T860-I886 HydrophobicContact CG2-CG2 3.79Å; D883-I886 HydrophobicContact CB-CD1 3.85Å; D883-I886 HydrophobicContact CB-CG1 3.89Å; I884-I886 VanDerWaalsContact C-N 3.26Å; I884-I886 PolarHBondContact O-N 3.06Å
887	R	95.4	Very high	95.3	Very high	102 Å²	102	46.8 Å²	46.8	39%	0.385	25%	0.247	S	C	.	.			trans	-113.3	135.6	-177.3	-76.5	176.9	-173.8	-104.5	8.5	111.1	Q854 S885 K891 N892 I893 V920	Q854-R887 PolarHBondContact NE2-O 2.71Å; S885-R887 PolarHBondContact O-N 3.42Å; R887-K891 PolarHBondContact NH1-O 2.8Å; R887-N892 WeakPolarHBondContact CA-O 3.27Å; R887-I893 HydrophobicContact CG-CG2 3.54Å; R887-V920 PolarHBondContact NH1-O 3.44Å
888	D	95.8	Very high	95.3	Very high	10 Å²	10	46.8 Å²	46.8	5%	0.053	25%	0.247	C	C	.	.			trans	-73.8	-178.6	170.2	70	12.6	0	0	0	112.8	G858 W859 E890 K891 N892 W897	G858-D888 WeakPolarHBondContact O-CA 3.23Å; W859-D888 VanDerWaalsContact CD1-CB 3.44Å; W859-D888 PolarHBondContact NE1-OD2 3.17Å; D888-E890 PolarHBondContact O-N 3.25Å; D888-E890 VanDerWaalsContact OD1-CA 3.24Å; D888-E890 WeakPolarHBondContact OD1-CA 3.44Å; D888-E890 WeakPolarHBondContact OD1-CB 3.27Å; D888-E890 PolarHBondContact OD1-N 2.9Å; D888-K891 WeakPolarHBondContact O-CA 3.41Å; D888-K891 PolarHBondContact O-N 2.99Å; D888-K891 PolarHBondContact OD1-N 3.09Å; D888-N892 PolarHBondContact N-O 3.12Å; D888-N892 VanDerWaalsContact N-O 3.1Å; D888-N892 PolarHBondContact OD1-N 3.22Å; D888-N892 PolarHBondContact OD1-ND2 3.32Å; D888-N892 WeakPolarHBondContact OD2-CB 3.32Å; D888-N892 PolarHBondContact OD2-ND2 3.32Å; D888-W897 PolarHBondContact OD2-NE1 3.3Å
889	K	95.2	Very high	95.4	Very high	143 Å²	143	45 Å²	45	62%	0.622	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-18.7	177.4	-70.8	176.1	-177.1	-179.1	0	113.6	D856 G857	D856-K889 VanDerWaalsContact O-CE 3.29Å; D856-K889 WeakPolarHBondContact O-CE 3.42Å; D856-K889 PolarHBondContact O-NZ 3.19Å; G857-K889 WeakPolarHBondContact O-CB 3.39Å; G857-K889 VanDerWaalsContact O-CG 3.26Å; G857-K889 WeakPolarHBondContact O-CG 3.28Å; G857-K889 PolarHBondContact O-N 2.85Å; G857-K889 VanDerWaalsContact O-N 3.14Å
890	E	95	Very high	95.5	Very high	100 Å²	100	42.8 Å²	42.8	47%	0.467	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	8.7	172.1	-70.1	-175.4	175.8	0	0	112.5	D888 N892 N921 V922	D888-E890 PolarHBondContact O-N 3.25Å; D888-E890 VanDerWaalsContact OD1-CA 3.24Å; D888-E890 WeakPolarHBondContact OD1-CA 3.44Å; D888-E890 WeakPolarHBondContact OD1-CB 3.27Å; D888-E890 PolarHBondContact OD1-N 2.9Å; E890-N892 WeakPolarHBondContact CB-ND2 3.45Å; E890-N892 PolarHBondContact O-N 3.47Å; E890-N921 WeakPolarHBondContact O-CB 3.43Å; E890-V922 HydrophobicContact CB-CG2 3.92Å; E890-V922 HydrophobicContact CG-CG2 4.23Å; E890-V922 WeakPolarHBondContact O-CG1 3.47Å; E890-V922 WeakPolarHBondContact O-CG2 3.46Å; E890-V922 PolarHBondContact O-N 3.18Å
891	K	96.1	Very high	95.5	Very high	114 Å²	114	39.2 Å²	39.2	50%	0.496	20%	0.202	S	C	.	.			trans	60.7	14.1	-179.1	-58.7	-176.1	178	-166	0	115.6	R887 D888 V922	R887-K891 PolarHBondContact NH1-O 2.8Å; D888-K891 WeakPolarHBondContact O-CA 3.41Å; D888-K891 PolarHBondContact O-N 2.99Å; D888-K891 PolarHBondContact OD1-N 3.09Å; K891-V922 HydrophobicContact CB-CG1 4.11Å; K891-V922 HydrophobicContact CD-CG1 3.96Å; K891-V922 HydrophobicContact CG-CG1 3.8Å
892	N	96.5	Very high	95.6	Very high	5 Å²	5	37.5 Å²	37.5	3%	0.027	18%	0.184	C	C	.	.			trans	-64.9	140.3	168.4	-55.2	-58.2	0	0	0	108.8	R887 D888 E890 H896 N921	R887-N892 WeakPolarHBondContact CA-O 3.27Å; D888-N892 PolarHBondContact N-O 3.12Å; D888-N892 VanDerWaalsContact N-O 3.1Å; D888-N892 PolarHBondContact OD1-N 3.22Å; D888-N892 PolarHBondContact OD1-ND2 3.32Å; D888-N892 WeakPolarHBondContact OD2-CB 3.32Å; D888-N892 PolarHBondContact OD2-ND2 3.32Å; E890-N892 WeakPolarHBondContact CB-ND2 3.45Å; E890-N892 PolarHBondContact O-N 3.47Å; N892-H896 HydrophobicContact CB-CB 3.81Å; N892-N921 WeakPolarHBondContact OD1-CB 3.42Å; N892-N921 PolarHBondContact OD1-ND2 3.17Å
893	I	96.4	Very high	95.7	Very high	6 Å²	6	37.3 Å²	37.3	3%	0.031	18%	0.183	C	C	.	.			trans	-97.9	173.6	163	58.9	169.8	0	0	0	109.4	R887 L895 H896 C915 A919	R887-I893 HydrophobicContact CG-CG2 3.54Å; I893-L895 HydrophobicContact CD1-CB 4.41Å; I893-L895 HydrophobicContact CG1-CB 4.4Å; I893-L895 PolarHBondContact O-N 3.34Å; I893-L895 VanDerWaalsContact O-N 3.08Å; I893-H896 WeakPolarHBondContact CG1-ND1 3.21Å; I893-H896 PolarHBondContact N-ND1 3.27Å; I893-H896 WeakPolarHBondContact O-CB 3.47Å; I893-H896 PolarHBondContact O-N 2.82Å; I893-C915 WeakPolarHBondContact CD1-SG 3.39Å; I893-A919 HydrophobicContact CD1-CB 3.56Å; I893-A919 HydrophobicContact CG1-CB 4.12Å
894	C	96.6	Very high	95.8	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.02	18%	0.18	C	C	.	.	H	α-helix	trans	-55.8	-32.2	-175.6	-158.1	0	0	0	0	113.7	M862 I863 T866 H896 W897 A898 L910	M862-C894 HydrophobicContact SD-CB 3.94Å; M862-C894 PolarHBondContact SD-SG 3.48Å; I863-C894 HydrophobicContact CG1-CB 4.35Å; T866-C894 PolarHBondContact OG1-SG 3.4Å; C894-H896 VanDerWaalsContact C-N 3.35Å; C894-H896 PolarHBondContact O-N 3.35Å; C894-W897 WeakPolarHBondContact O-CB 3.4Å; C894-W897 PolarHBondContact O-N 3.35Å; C894-W897 VanDerWaalsContact O-N 3.09Å; C894-A898 PolarHBondContact O-N 2.8Å; C894-L910 HydrophobicContact CB-CD1 4.02Å; C894-L910 HydrophobicContact CB-CD2 4.27Å
895	L	97.2	Very high	96	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.7	-28.3	178.3	-171.8	62.2	0	0	0	113.9	I893 W897 A898 A899 L910 L911 C915 L917 P927 F943	I893-L895 HydrophobicContact CD1-CB 4.41Å; I893-L895 HydrophobicContact CG1-CB 4.4Å; I893-L895 PolarHBondContact O-N 3.34Å; I893-L895 VanDerWaalsContact O-N 3.08Å; L895-W897 VanDerWaalsContact C-N 3.32Å; L895-A898 HydrophobicContact CD1-CB 4.49Å; L895-A898 PolarHBondContact O-N 3.19Å; L895-A899 VanDerWaalsContact O-CB 3.3Å; L895-A899 WeakPolarHBondContact O-CB 3.24Å; L895-A899 PolarHBondContact O-N 3.05Å; L895-L910 HydrophobicContact CB-CD1 4.32Å; L895-L910 HydrophobicContact CD1-CB 4.25Å; L895-L910 HydrophobicContact CD1-CD1 4.31Å; L895-L911 HydrophobicContact CD1-CG 4.26Å; L895-L911 HydrophobicContact CD2-CD2 3.73Å; L895-L911 HydrophobicContact CD2-CG 4.15Å; L895-C915 VanDerWaalsContact CB-SG 3.55Å; L895-C915 HydrophobicContact CD2-CB 4.32Å; L895-L917 HydrophobicContact CD2-CD1 4.18Å; L895-P927 HydrophobicContact CB-CG 4.2Å; L895-P927 HydrophobicContact CD2-CB 4.32Å; L895-P927 HydrophobicContact CD2-CG 3.89Å; L895-P927 HydrophobicContact CG-CB 3.98Å; L895-P927 HydrophobicContact CG-CG 3.76Å; L895-F943 HydrophobicContact CD1-CE1 3.88Å; L895-F943 HydrophobicContact CD1-CZ 4.05Å; L895-F943 HydrophobicContact CG-CE1 4.45Å; L895-F943 HydrophobicContact CG-CZ 4.43Å
896	H	97.7	Very high	96.3	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-64.8	-38.4	169.7	-68.7	90	0	0	0	111.2	N892 I893 C894 A899 F900 A919 V920 N921 D925 S926 I930	N892-H896 HydrophobicContact CB-CB 3.81Å; I893-H896 WeakPolarHBondContact CG1-ND1 3.21Å; I893-H896 PolarHBondContact N-ND1 3.27Å; I893-H896 WeakPolarHBondContact O-CB 3.47Å; I893-H896 PolarHBondContact O-N 2.82Å; C894-H896 VanDerWaalsContact C-N 3.35Å; C894-H896 PolarHBondContact O-N 3.35Å; H896-A899 WeakPolarHBondContact O-CB 3.41Å; H896-A899 PolarHBondContact O-N 3.29Å; H896-F900 WeakPolarHBondContact O-CB 3.05Å; H896-F900 PolarHBondContact O-N 3.21Å; H896-A919 WeakPolarHBondContact CE1-CB 3.49Å; H896-A919 PolarHBondContact CE1-O 3.08Å; H896-A919 PolarHBondContact NE2-O 2.88Å; H896-V920 PolarHBondContact CE1-N 3.23Å; H896-V920 VanDerWaalsContact NE2-CA 3.26Å; H896-V920 WeakPolarHBondContact NE2-CA 3.33Å; H896-N921 PolarHBondContact NE2-N 3.07Å; H896-D925 PolarHBondContact NE2-O 3.47Å; H896-S926 WeakPolarHBondContact NE2-CA 3.11Å; H896-I930 HydrophobicContact CB-CD1 3.85Å
897	W	97.5	Very high	96.4	Very high	24 Å²	24	36.1 Å²	36.1	9%	0.091	17%	0.169	C	C	.	.	H	α-helix	trans	-73.2	-35.1	177.5	-70.7	106.2	0	0	0	112.3	W859 I863 T866 D888 C894 L895 F900 S901	W859-W897 AromaticContact CE2-CZ2 3.59Å; W859-W897 HydrophobicContact CH2-CE3 4.44Å; W859-W897 AromaticContact CH2-CH2 3.53Å; W859-W897 HydrophobicContact CH2-CH2 3.53Å; W859-W897 AromaticContact CH2-CZ2 3.95Å; W859-W897 HydrophobicContact CH2-CZ2 3.95Å; W859-W897 AromaticContact CH2-CZ3 3.78Å; W859-W897 HydrophobicContact CH2-CZ3 3.78Å; W859-W897 AromaticContact CZ2-CH2 3.22Å; W859-W897 HydrophobicContact CZ2-CH2 3.22Å; W859-W897 AromaticContact CZ2-CZ2 3.26Å; W859-W897 HydrophobicContact CZ2-CZ2 3.26Å; W859-W897 AromaticContact CZ2-CZ3 3.96Å; W859-W897 HydrophobicContact CZ2-CZ3 3.96Å; W859-W897 AromaticContact NE1-CZ2 3.8Å; I863-W897 HydrophobicContact CG2-CB 4.32Å; I863-W897 HydrophobicContact CG2-CD2 4.11Å; I863-W897 HydrophobicContact CG2-CG 3.72Å; T866-W897 HydrophobicContact CG2-CB 4.16Å; D888-W897 PolarHBondContact OD2-NE1 3.3Å; C894-W897 WeakPolarHBondContact O-CB 3.4Å; C894-W897 PolarHBondContact O-N 3.35Å; C894-W897 VanDerWaalsContact O-N 3.09Å; L895-W897 VanDerWaalsContact C-N 3.32Å; W897-F900 HydrophobicContact CE3-CB 4.42Å; W897-F900 AromaticContact CE3-CD1 3.96Å; W897-F900 HydrophobicContact CE3-CD1 3.96Å; W897-F900 HydrophobicContact CE3-CG 4.44Å; W897-F900 AromaticContact CZ3-CD1 3.86Å; W897-F900 HydrophobicContact CZ3-CD1 3.86Å; W897-F900 HydrophobicContact CZ3-CE1 4.23Å; W897-F900 HydrophobicContact CZ3-CG 4.41Å; W897-F900 PolarHBondContact O-N 3.04Å; W897-S901 PolarHBondContact O-N 2.74Å; W897-S901 PolarHBondContact O-OG 3.41Å
898	A	97.1	Very high	96.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.6	-38.9	171.5	0	0	0	0	0	111.8	T866 C894 L895 S901 G902 S903 I906 S907 L910	T866-A898 VanDerWaalsContact CG2-CA 3.45Å; T866-A898 HydrophobicContact CG2-CB 3.58Å; T866-A898 VanDerWaalsContact CG2-N 3.27Å; C894-A898 PolarHBondContact O-N 2.8Å; L895-A898 HydrophobicContact CD1-CB 4.49Å; L895-A898 PolarHBondContact O-N 3.19Å; A898-S901 PolarHBondContact O-OG 3.1Å; A898-G902 WeakPolarHBondContact O-CA 3.21Å; A898-G902 PolarHBondContact O-N 2.76Å; A898-S903 PolarHBondContact O-N 3.18Å; A898-I906 HydrophobicContact CB-CB 4.49Å; A898-I906 HydrophobicContact CB-CG2 4.12Å; A898-S907 WeakPolarHBondContact CB-OG 3.33Å; A898-L910 HydrophobicContact CB-CD1 4.1Å
899	A	96.7	Very high	96.5	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66.1	-36.4	172.4	0	0	0	0	0	113.1	L895 H896 P927 I930 A931 R936 F943	L895-A899 VanDerWaalsContact O-CB 3.3Å; L895-A899 WeakPolarHBondContact O-CB 3.24Å; L895-A899 PolarHBondContact O-N 3.05Å; H896-A899 WeakPolarHBondContact O-CB 3.41Å; H896-A899 PolarHBondContact O-N 3.29Å; A899-P927 HydrophobicContact CB-CB 4.03Å; A899-P927 WeakPolarHBondContact CB-O 3.34Å; A899-I930 HydrophobicContact CB-CB 4.25Å; A899-I930 HydrophobicContact CB-CG2 4.21Å; A899-A931 HydrophobicContact CB-CB 4.12Å; A899-R936 VanDerWaalsContact O-CG 3.32Å; A899-R936 WeakPolarHBondContact O-CG 3.42Å; A899-F943 HydrophobicContact CB-CE2 3.7Å; A899-F943 HydrophobicContact CB-CZ 3.95Å
900	F	96.9	Very high	96.5	Very high	47 Å²	47	29.2 Å²	29.2	21%	0.206	15%	0.146	C	C	.	.	H	α-helix	trans	-70.1	-52.3	176.7	178.5	-107	0	0	0	111.9	H896 W897 G902 I930 E934 R936	H896-F900 WeakPolarHBondContact O-CB 3.05Å; H896-F900 PolarHBondContact O-N 3.21Å; W897-F900 HydrophobicContact CE3-CB 4.42Å; W897-F900 AromaticContact CE3-CD1 3.96Å; W897-F900 HydrophobicContact CE3-CD1 3.96Å; W897-F900 HydrophobicContact CE3-CG 4.44Å; W897-F900 AromaticContact CZ3-CD1 3.86Å; W897-F900 HydrophobicContact CZ3-CD1 3.86Å; W897-F900 HydrophobicContact CZ3-CE1 4.23Å; W897-F900 HydrophobicContact CZ3-CG 4.41Å; W897-F900 PolarHBondContact O-N 3.04Å; F900-G902 PolarHBondContact O-N 2.76Å; F900-I930 HydrophobicContact CB-CG2 3.8Å; F900-I930 HydrophobicContact CD2-CG2 4.34Å; F900-E934 HydrophobicContact CD2-CG 3.68Å; F900-E934 HydrophobicContact CE2-CG 4.1Å; F900-R936 VanDerWaalsContact O-CZ 3.3Å; F900-R936 PolarHBondContact O-NE 3.14Å; F900-R936 PolarHBondContact O-NH2 3.01Å
901	S	95.4	Very high	96.5	Very high	11 Å²	11	25.6 Å²	25.6	8%	0.077	13%	0.129	C	C	.	.	H	α-helix	trans	-64.6	-28.4	176.8	73.6	0	0	0	0	111.5	T866 E867 K869 W897 A898	T866-S901 PolarHBondContact O-OG 3.26Å; E867-S901 WeakPolarHBondContact O-CB 3.35Å; K869-S901 WeakPolarHBondContact CE-O 3.25Å; K869-S901 PolarHBondContact NZ-O 3.17Å; W897-S901 PolarHBondContact O-N 2.74Å; W897-S901 PolarHBondContact O-OG 3.41Å; A898-S901 PolarHBondContact O-OG 3.1Å
902	G	94.9	Very high	96.4	Very high	14 Å²	14	25 Å²	25	14%	0.144	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	50.2	-173.8	0	0	0	0	0	110.6	K869 A898 F900	K869-G902 PolarHBondContact NZ-O 2.8Å; A898-G902 WeakPolarHBondContact O-CA 3.21Å; A898-G902 PolarHBondContact O-N 2.76Å; F900-G902 PolarHBondContact O-N 2.76Å
903	S	96.4	Very high	96.2	Very high	7 Å²	7	27 Å²	27	5%	0.049	15%	0.149	C	C	.	.			trans	-100.5	102.7	172.2	-172.8	0	0	0	0	109.2	A898 I906 S907	A898-S903 PolarHBondContact O-N 3.18Å; S903-I906 WeakPolarHBondContact OG-CD1 3.29Å; S903-I906 WeakPolarHBondContact OG-CG1 3.42Å; S903-S907 VanDerWaalsContact O-CB 3.29Å; S903-S907 WeakPolarHBondContact O-CB 3.43Å; S903-S907 PolarHBondContact O-N 2.82Å; S903-S907 PolarHBondContact O-OG 2.8Å
904	V	96.8	Very high	95.8	Very high	52 Å²	52	35.6 Å²	35.6	32%	0.315	19%	0.189	S	C	.	.	H	α-helix	trans	-66.4	-45.6	-178.3	-173.8	0	0	0	0	110.1	I906 S907 E908 D938 L942	V904-I906 PolarHBondContact O-N 3.48Å; V904-S907 WeakPolarHBondContact O-CB 3.48Å; V904-S907 PolarHBondContact O-N 3.22Å; V904-E908 WeakPolarHBondContact O-CB 3.25Å; V904-E908 PolarHBondContact O-N 3.29Å; V904-D938 HydrophobicContact CG2-CB 3.73Å; V904-L942 HydrophobicContact CG1-CB 4.44Å; V904-L942 HydrophobicContact CG1-CD2 3.94Å
905	E	97.1	Very high	95.5	Very high	119 Å²	119	36.1 Å²	36.1	56%	0.556	19%	0.193	S	C	*	.	H	α-helix	trans	-60.9	-43.5	179.5	-65.7	172.7	-131.7	0	0	112.4	V871 E908 V909	V871-E905 HydrophobicContact CG1-CB 3.88Å; V871-E905 HydrophobicContact CG2-CB 4.35Å; E905-E908 PolarHBondContact O-N 3.05Å; E905-V909 WeakPolarHBondContact O-CB 3.36Å; E905-V909 VanDerWaalsContact O-CG2 3.3Å; E905-V909 WeakPolarHBondContact O-CG2 3.45Å; E905-V909 PolarHBondContact O-N 3.04Å
906	I	97.4	Very high	95.2	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-69.6	-40	176.8	-62	172.8	0	0	0	110.4	T866 V871 V874 A898 S903 V904 E908 V909 L910	T866-I906 HydrophobicContact CG2-CG2 3.78Å; V871-I906 HydrophobicContact CB-CG1 4.17Å; V871-I906 HydrophobicContact CG1-CG1 3.97Å; V871-I906 HydrophobicContact CG2-CD1 4.25Å; V871-I906 HydrophobicContact CG2-CG1 4.05Å; V874-I906 HydrophobicContact CB-CG2 4.45Å; V874-I906 HydrophobicContact CG1-CG2 4.04Å; V874-I906 HydrophobicContact CG2-CD1 4.05Å; V874-I906 HydrophobicContact CG2-CG1 4.42Å; V874-I906 HydrophobicContact CG2-CG2 4.25Å; A898-I906 HydrophobicContact CB-CB 4.49Å; A898-I906 HydrophobicContact CB-CG2 4.12Å; S903-I906 WeakPolarHBondContact OG-CD1 3.29Å; S903-I906 WeakPolarHBondContact OG-CG1 3.42Å; V904-I906 PolarHBondContact O-N 3.48Å; I906-E908 VanDerWaalsContact C-N 3.27Å; I906-E908 PolarHBondContact O-N 2.92Å; I906-V909 PolarHBondContact O-N 3.37Å; I906-L910 HydrophobicContact CG2-CD1 3.85Å; I906-L910 HydrophobicContact CG2-CG 4.18Å; I906-L910 WeakPolarHBondContact O-CB 3.39Å; I906-L910 WeakPolarHBondContact O-CG 3.1Å; I906-L910 PolarHBondContact O-N 3.02Å
907	S	96.9	Very high	95	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.4	-40.8	174.1	-61.7	0	0	0	0	111.8	A898 S903 V904 L911	A898-S907 WeakPolarHBondContact CB-OG 3.33Å; S903-S907 VanDerWaalsContact O-CB 3.29Å; S903-S907 WeakPolarHBondContact O-CB 3.43Å; S903-S907 PolarHBondContact O-N 2.82Å; S903-S907 PolarHBondContact O-OG 2.8Å; V904-S907 WeakPolarHBondContact O-CB 3.48Å; V904-S907 PolarHBondContact O-N 3.22Å; S907-L911 WeakPolarHBondContact O-CB 3.36Å; S907-L911 WeakPolarHBondContact O-CD1 3.46Å; S907-L911 WeakPolarHBondContact O-CG 3.3Å; S907-L911 PolarHBondContact O-N 3.37Å
908	E	96.6	Very high	94.6	Very high	72 Å²	72	42.6 Å²	42.6	34%	0.336	23%	0.227	S	C	.	.	H	α-helix	trans	-69.4	-46.8	176	173.8	153.5	-133.5	0	0	112.4	V904 E905 I906 L910 L911 N912 L942 R946	V904-E908 WeakPolarHBondContact O-CB 3.25Å; V904-E908 PolarHBondContact O-N 3.29Å; E905-E908 PolarHBondContact O-N 3.05Å; I906-E908 VanDerWaalsContact C-N 3.27Å; I906-E908 PolarHBondContact O-N 2.92Å; E908-L910 VanDerWaalsContact C-N 3.28Å; E908-L910 PolarHBondContact O-N 2.88Å; E908-L911 PolarHBondContact O-N 3.2Å; E908-N912 WeakPolarHBondContact CG-ND2 3.26Å; E908-N912 VanDerWaalsContact O-CB 3.31Å; E908-N912 WeakPolarHBondContact O-CB 3.06Å; E908-N912 PolarHBondContact O-N 2.77Å; E908-N912 PolarHBondContact O-OD1 3.19Å; E908-L942 HydrophobicContact CB-CD2 3.98Å; E908-R946 IonicContact OE1-CZ 3.63Å; E908-R946 IonicContact OE1-NH1 2.72Å; E908-R946 IonicContact OE1-NH2 3.73Å; E908-R946 PolarHBondContact OE1-NH2 2.86Å
909	V	96.4	Very high	94.5	Very high	38 Å²	38	42.8 Å²	42.8	23%	0.23	23%	0.228	C	C	.	.	H	α-helix	trans	-56.6	-43.3	175.7	166.1	0	0	0	0	111.2	K875 L878 E905 I906 A913	K875-V909 HydrophobicContact CG-CG1 4.39Å; K875-V909 HydrophobicContact CG-CG2 4.35Å; L878-V909 HydrophobicContact CD1-CG1 3.48Å; L878-V909 VanDerWaalsContact CD1-CG1 3.48Å; E905-V909 WeakPolarHBondContact O-CB 3.36Å; E905-V909 VanDerWaalsContact O-CG2 3.3Å; E905-V909 WeakPolarHBondContact O-CG2 3.45Å; E905-V909 PolarHBondContact O-N 3.04Å; I906-V909 PolarHBondContact O-N 3.37Å; V909-A913 WeakPolarHBondContact O-CB 3.39Å; V909-A913 PolarHBondContact O-N 3.1Å; V909-A913 VanDerWaalsContact O-N 3.08Å
910	L	95.9	Very high	94.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66.9	-43.2	176.7	-68	171.9	0	0	0	112.3	M862 L878 I884 C894 L895 A898 I906 E908 A913 C915	M862-L910 HydrophobicContact SD-CD2 3.87Å; L878-L910 HydrophobicContact CD1-CD2 4.44Å; I884-L910 HydrophobicContact CD1-CD2 4.21Å; I884-L910 HydrophobicContact CG1-CD2 3.96Å; I884-L910 HydrophobicContact CG2-CD2 3.96Å; C894-L910 HydrophobicContact CB-CD1 4.02Å; C894-L910 HydrophobicContact CB-CD2 4.27Å; L895-L910 HydrophobicContact CB-CD1 4.32Å; L895-L910 HydrophobicContact CD1-CB 4.25Å; L895-L910 HydrophobicContact CD1-CD1 4.31Å; A898-L910 HydrophobicContact CB-CD1 4.1Å; I906-L910 HydrophobicContact CG2-CD1 3.85Å; I906-L910 HydrophobicContact CG2-CG 4.18Å; I906-L910 WeakPolarHBondContact O-CB 3.39Å; I906-L910 WeakPolarHBondContact O-CG 3.1Å; I906-L910 PolarHBondContact O-N 3.02Å; E908-L910 VanDerWaalsContact C-N 3.28Å; E908-L910 PolarHBondContact O-N 2.88Å; L910-A913 CarbonylContact O-C 2.87Å; L910-A913 PolarHBondContact O-N 3.11Å; L910-C915 HydrophobicContact CB-CB 4.21Å; L910-C915 WeakPolarHBondContact O-CB 3.49Å; L910-C915 PolarHBondContact O-N 3.25Å; L910-C915 VanDerWaalsContact O-N 3.12Å
911	L	94.8	Very high	94.4	Very high	23 Å²	23	43.7 Å²	43.7	12%	0.12	24%	0.237	C	C	.	.	H	α-helix	trans	-67.3	-38	177.9	-74.8	169	0	0	0	112.6	L895 S907 E908 A913 Q914 L917 L942 F943 R946	L895-L911 HydrophobicContact CD1-CG 4.26Å; L895-L911 HydrophobicContact CD2-CD2 3.73Å; L895-L911 HydrophobicContact CD2-CG 4.15Å; S907-L911 WeakPolarHBondContact O-CB 3.36Å; S907-L911 WeakPolarHBondContact O-CD1 3.46Å; S907-L911 WeakPolarHBondContact O-CG 3.3Å; S907-L911 PolarHBondContact O-N 3.37Å; E908-L911 PolarHBondContact O-N 3.2Å; L911-A913 PolarHBondContact O-N 3.31Å; L911-Q914 PolarHBondContact O-N 3.49Å; L911-L917 HydrophobicContact CD2-CB 3.82Å; L911-L917 HydrophobicContact CD2-CD1 4.14Å; L911-L917 HydrophobicContact CD2-CD2 4.26Å; L911-L917 HydrophobicContact CD2-CG 4.29Å; L911-L942 HydrophobicContact CD1-CD2 4.38Å; L911-L942 HydrophobicContact CD1-CG 4.33Å; L911-F943 HydrophobicContact CD1-CD1 3.9Å; L911-F943 HydrophobicContact CD1-CE1 3.94Å; L911-R946 HydrophobicContact CD1-CB 4.46Å; L911-R946 HydrophobicContact CD1-CG 4.23Å
912	N	94	Very high	94.4	Very high	102 Å²	102	45.1 Å²	45.1	55%	0.545	25%	0.245	S	C	.	.	H	α-helix	trans	-66.5	-29.1	174.7	-65.2	-4	0	0	0	111	E908 Q914 R946	E908-N912 WeakPolarHBondContact CG-ND2 3.26Å; E908-N912 VanDerWaalsContact O-CB 3.31Å; E908-N912 WeakPolarHBondContact O-CB 3.06Å; E908-N912 PolarHBondContact O-N 2.77Å; E908-N912 PolarHBondContact O-OD1 3.19Å; N912-Q914 PolarHBondContact O-N 2.62Å; N912-R946 PolarHBondContact OD1-NH1 3.08Å
913	A	90.7	Very high	94.4	Very high	48 Å²	48	48.1 Å²	48.1	40%	0.397	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	27	168.9	0	0	0	0	0	113.9	I884 V909 L910 L911 C915	I884-A913 HydrophobicContact CD1-CB 3.46Å; I884-A913 VanDerWaalsContact CD1-CB 3.46Å; V909-A913 WeakPolarHBondContact O-CB 3.39Å; V909-A913 PolarHBondContact O-N 3.1Å; V909-A913 VanDerWaalsContact O-N 3.08Å; L910-A913 CarbonylContact O-C 2.87Å; L910-A913 PolarHBondContact O-N 3.11Å; L911-A913 PolarHBondContact O-N 3.31Å; A913-C915 VanDerWaalsContact C-N 3.34Å; A913-C915 PolarHBondContact O-N 2.16Å
914	Q	87.8	Confident	94.4	Very high	185 Å²	185	48.2 Å²	48.2	86%	0.864	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	30.1	173.1	-57	-174.5	-10.4	0	0	115.7	L911 N912	L911-Q914 PolarHBondContact O-N 3.49Å; N912-Q914 PolarHBondContact O-N 2.62Å
915	C	91.4	Very high	94.4	Very high	15 Å²	15	45.9 Å²	45.9	10%	0.101	24%	0.243	C	C	.	.			trans	-64	137.6	173.2	-171.5	0	0	0	0	113	I884 I893 L895 L910 A913 L917	I884-C915 HydrophobicContact CG2-CB 3.82Å; I884-C915 WeakPolarHBondContact CG2-SG 3.49Å; I893-C915 WeakPolarHBondContact CD1-SG 3.39Å; L895-C915 VanDerWaalsContact CB-SG 3.55Å; L895-C915 HydrophobicContact CD2-CB 4.32Å; L910-C915 HydrophobicContact CB-CB 4.21Å; L910-C915 WeakPolarHBondContact O-CB 3.49Å; L910-C915 PolarHBondContact O-N 3.25Å; L910-C915 VanDerWaalsContact O-N 3.12Å; A913-C915 VanDerWaalsContact C-N 3.34Å; A913-C915 PolarHBondContact O-N 2.16Å; C915-L917 PolarHBondContact O-N 2.51Å; C915-L917 VanDerWaalsContact O-N 3.09Å
916	D	90.8	Very high	94.4	Very high	85 Å²	85	40.2 Å²	40.2	46%	0.455	22%	0.216	S	C	.	.			trans	-69	102.3	176.4	175.3	16.3	0	0	0	112.2	Q918 A919	D916-Q918 PolarHBondContact O-N 3.5Å; D916-Q918 WeakPolarHBondContact OD1-CA 3.43Å; D916-Q918 PolarHBondContact OD1-N 3.23Å; D916-A919 HydrophobicContact CB-CB 4.06Å; D916-A919 VanDerWaalsContact CG-N 3.29Å; D916-A919 VanDerWaalsContact O-CB 3.24Å; D916-A919 WeakPolarHBondContact O-CB 3.38Å; D916-A919 PolarHBondContact O-N 3.36Å; D916-A919 PolarHBondContact OD1-N 3.31Å; D916-A919 VanDerWaalsContact OD2-CA 3.32Å; D916-A919 WeakPolarHBondContact OD2-CA 3.47Å; D916-A919 WeakPolarHBondContact OD2-CB 3.46Å; D916-A919 PolarHBondContact OD2-N 3.34Å
917	L	92.7	Very high	94.3	Very high	14 Å²	14	40.1 Å²	40.1	7%	0.073	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-19.3	176.4	-176.4	53	0	0	0	114	L895 L911 C915 F943 R946 A948	L895-L917 HydrophobicContact CD2-CD1 4.18Å; L911-L917 HydrophobicContact CD2-CB 3.82Å; L911-L917 HydrophobicContact CD2-CD1 4.14Å; L911-L917 HydrophobicContact CD2-CD2 4.26Å; L911-L917 HydrophobicContact CD2-CG 4.29Å; C915-L917 PolarHBondContact O-N 2.51Å; C915-L917 VanDerWaalsContact O-N 3.09Å; L917-F943 HydrophobicContact CD1-CB 4.04Å; L917-F943 HydrophobicContact CD1-CD1 3.54Å; L917-F943 HydrophobicContact CD1-CE1 4.09Å; L917-F943 HydrophobicContact CD1-CG 3.78Å; L917-R946 HydrophobicContact CD2-CB 3.8Å; L917-R946 WeakPolarHBondContact CD2-O 3.4Å; L917-A948 HydrophobicContact CD1-CB 4.21Å; L917-A948 HydrophobicContact CD2-CB 3.89Å; L917-A948 HydrophobicContact CG-CB 3.93Å
918	Q	90.6	Very high	94.3	Very high	62 Å²	62	40.1 Å²	40.1	29%	0.29	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	2	178.4	-46.7	-66.7	-4.6	0	0	112.1	D916 V920 G947 N949	D916-Q918 PolarHBondContact O-N 3.5Å; D916-Q918 WeakPolarHBondContact OD1-CA 3.43Å; D916-Q918 PolarHBondContact OD1-N 3.23Å; Q918-V920 PolarHBondContact O-N 3.19Å; Q918-G947 PolarHBondContact NE2-O 3.23Å; Q918-N949 VanDerWaalsContact OE1-CB 3.3Å; Q918-N949 VanDerWaalsContact OE1-N 3.15Å
919	A	93.5	Very high	94.3	Very high	3 Å²	3	36.7 Å²	36.7	3%	0.025	20%	0.2	C	C	.	.			trans	-57	133.6	178.6	0	0	0	0	0	111.2	I893 H896 D916 S926 P927	I893-A919 HydrophobicContact CD1-CB 3.56Å; I893-A919 HydrophobicContact CG1-CB 4.12Å; H896-A919 WeakPolarHBondContact CE1-CB 3.49Å; H896-A919 PolarHBondContact CE1-O 3.08Å; H896-A919 PolarHBondContact NE2-O 2.88Å; D916-A919 HydrophobicContact CB-CB 4.06Å; D916-A919 VanDerWaalsContact CG-N 3.29Å; D916-A919 VanDerWaalsContact O-CB 3.24Å; D916-A919 WeakPolarHBondContact O-CB 3.38Å; D916-A919 PolarHBondContact O-N 3.36Å; D916-A919 PolarHBondContact OD1-N 3.31Å; D916-A919 VanDerWaalsContact OD2-CA 3.32Å; D916-A919 WeakPolarHBondContact OD2-CA 3.47Å; D916-A919 WeakPolarHBondContact OD2-CB 3.46Å; D916-A919 PolarHBondContact OD2-N 3.34Å; A919-S926 WeakPolarHBondContact O-CA 3.43Å; A919-P927 WeakPolarHBondContact O-CD 3.49Å
920	V	95.9	Very high	94.4	Very high	57 Å²	57	35.7 Å²	35.7	35%	0.345	19%	0.193	S	C	.	.			trans	-113.4	147	178.9	-64.9	0	0	0	0	113.5	R887 H896 Q918 G924 D925 L952	R887-V920 PolarHBondContact NH1-O 3.44Å; H896-V920 PolarHBondContact CE1-N 3.23Å; H896-V920 VanDerWaalsContact NE2-CA 3.26Å; H896-V920 WeakPolarHBondContact NE2-CA 3.33Å; Q918-V920 PolarHBondContact O-N 3.19Å; V920-G924 VanDerWaalsContact CG1-O 3.3Å; V920-G924 WeakPolarHBondContact CG1-O 3.41Å; V920-D925 WeakPolarHBondContact CA-O 3.47Å; V920-L952 HydrophobicContact CG1-CD2 4.06Å
921	N	95.8	Very high	94.4	Very high	10 Å²	10	35.7 Å²	35.7	5%	0.053	19%	0.193	C	C	.	.			trans	-91.1	-167	178	74.6	1.8	0	0	0	112.6	E890 N892 H896 H923 G924 D925	E890-N921 WeakPolarHBondContact O-CB 3.43Å; N892-N921 WeakPolarHBondContact OD1-CB 3.42Å; N892-N921 PolarHBondContact OD1-ND2 3.17Å; H896-N921 PolarHBondContact NE2-N 3.07Å; N921-H923 PolarHBondContact O-N 2.82Å; N921-H923 WeakPolarHBondContact OD1-CA 3.12Å; N921-H923 WeakPolarHBondContact OD1-CB 3.21Å; N921-H923 PolarHBondContact OD1-N 3.16Å; N921-G924 PolarHBondContact O-N 3.25Å; N921-G924 PolarHBondContact OD1-N 3.44Å; N921-D925 PolarHBondContact N-O 3.29Å; N921-D925 VanDerWaalsContact N-O 3.11Å; N921-D925 PolarHBondContact OD1-N 3.26Å; N921-D925 PolarHBondContact OD1-O 2.71Å
922	V	95.9	Very high	94.4	Very high	40 Å²	40	34.6 Å²	34.6	24%	0.242	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-15.8	177.5	-69.1	0	0	0	0	114.8	E890 K891 R955	E890-V922 HydrophobicContact CB-CG2 3.92Å; E890-V922 HydrophobicContact CG-CG2 4.23Å; E890-V922 WeakPolarHBondContact O-CG1 3.47Å; E890-V922 WeakPolarHBondContact O-CG2 3.46Å; E890-V922 PolarHBondContact O-N 3.18Å; K891-V922 HydrophobicContact CB-CG1 4.11Å; K891-V922 HydrophobicContact CD-CG1 3.96Å; K891-V922 HydrophobicContact CG-CG1 3.8Å; V922-R955 VanDerWaalsContact O-CD 3.25Å; V922-R955 WeakPolarHBondContact O-CD 3.44Å; V922-R955 PolarHBondContact O-NE 3.49Å; V922-R955 PolarHBondContact O-NH1 3.28Å
923	H	95.4	Very high	94.4	Very high	78 Å²	78	33.5 Å²	33.5	36%	0.361	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-10.9	171.6	-63.9	-76.7	0	0	0	112.1	N921 D925 R955	N921-H923 PolarHBondContact O-N 2.82Å; N921-H923 WeakPolarHBondContact OD1-CA 3.12Å; N921-H923 WeakPolarHBondContact OD1-CB 3.21Å; N921-H923 PolarHBondContact OD1-N 3.16Å; H923-D925 WeakPolarHBondContact CB-OD2 3.39Å; H923-R955 VanDerWaalsContact O-CB 3.25Å; H923-R955 WeakPolarHBondContact O-CB 3.38Å; H923-R955 WeakPolarHBondContact O-CG 3.4Å; H923-R955 PolarHBondContact O-N 3.04Å
924	G	95.6	Very high	94.6	Very high	8 Å²	8	33.1 Å²	33.1	8%	0.082	17%	0.166	C	C	.	.			trans	80	5.2	-168.5	0	0	0	0	0	112.8	V920 N921	V920-G924 VanDerWaalsContact CG1-O 3.3Å; V920-G924 WeakPolarHBondContact CG1-O 3.41Å; N921-G924 PolarHBondContact O-N 3.25Å; N921-G924 PolarHBondContact OD1-N 3.44Å
925	D	96.8	Very high	94.9	Very high	3 Å²	3	28 Å²	28	2%	0.016	14%	0.144	C	C	.	.			trans	-72.3	131.9	175.3	-65.4	-42.8	0	0	0	109.9	H896 V920 N921 H923 H929 I930 R933 N954	H896-D925 PolarHBondContact NE2-O 3.47Å; V920-D925 WeakPolarHBondContact CA-O 3.47Å; N921-D925 PolarHBondContact N-O 3.29Å; N921-D925 VanDerWaalsContact N-O 3.11Å; N921-D925 PolarHBondContact OD1-N 3.26Å; N921-D925 PolarHBondContact OD1-O 2.71Å; H923-D925 WeakPolarHBondContact CB-OD2 3.39Å; D925-H929 HydrophobicContact CB-CB 3.79Å; D925-H929 IonicContact OD1-CD2 3.19Å; D925-H929 IonicContact OD1-CG 2.78Å; D925-I930 HydrophobicContact CB-CG1 4.14Å; D925-R933 VanDerWaalsContact CG-NH2 3.33Å; D925-R933 IonicContact OD1-CZ 3.56Å; D925-R933 IonicContact OD1-NH1 3.55Å; D925-R933 IonicContact OD1-NH2 2.72Å; D925-R933 PolarHBondContact OD1-NH2 2.99Å; D925-R933 IonicContact OD2-CZ 3.2Å; D925-R933 IonicContact OD2-NH1 3.97Å; D925-R933 PolarHBondContact OD2-NH1 2.85Å; D925-R933 IonicContact OD2-NH2 3.83Å; D925-R933 PolarHBondContact OD2-NH2 3.2Å; D925-N954 WeakPolarHBondContact OD1-CB 3.39Å; D925-N954 PolarHBondContact OD1-ND2 2.88Å
926	S	96.8	Very high	95.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.155	C	C	.	.			trans	-89.1	168.7	164.7	70.4	0	0	0	0	111.1	H896 A919 L928 H929 I930	H896-S926 WeakPolarHBondContact NE2-CA 3.11Å; A919-S926 WeakPolarHBondContact O-CA 3.43Å; S926-L928 PolarHBondContact O-N 3.42Å; S926-L928 VanDerWaalsContact O-N 3.11Å; S926-H929 PolarHBondContact N-ND1 3.38Å; S926-H929 WeakPolarHBondContact O-CB 3.48Å; S926-H929 PolarHBondContact O-N 2.87Å; S926-H929 PolarHBondContact OG-ND1 2.8Å; S926-I930 PolarHBondContact O-N 3.44Å
927	P	97	Very high	95.2	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-51.1	-34.1	173.6	-29.4	36.7	0	0	0	113.5	L895 A899 A919 I930 A931 F943	L895-P927 HydrophobicContact CB-CG 4.2Å; L895-P927 HydrophobicContact CD2-CB 4.32Å; L895-P927 HydrophobicContact CD2-CG 3.89Å; L895-P927 HydrophobicContact CG-CB 3.98Å; L895-P927 HydrophobicContact CG-CG 3.76Å; A899-P927 HydrophobicContact CB-CB 4.03Å; A899-P927 WeakPolarHBondContact CB-O 3.34Å; A919-P927 WeakPolarHBondContact O-CD 3.49Å; P927-I930 PolarHBondContact O-N 3.03Å; P927-A931 WeakPolarHBondContact O-CB 3.2Å; P927-A931 PolarHBondContact O-N 3.33Å; P927-F943 HydrophobicContact CB-CD2 4.37Å; P927-F943 HydrophobicContact CB-CE2 3.75Å; P927-F943 HydrophobicContact CB-CZ 3.92Å; P927-F943 WeakPolarHBondContact O-CE2 3.22Å
928	L	96.8	Very high	95.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-67.3	-37.2	174.9	-172.9	66.2	0	0	0	113.1	S926 A932 V940 F943 L944 A948 V950 P960 L974	S926-L928 PolarHBondContact O-N 3.42Å; S926-L928 VanDerWaalsContact O-N 3.11Å; L928-A932 WeakPolarHBondContact O-CB 3.23Å; L928-A932 PolarHBondContact O-N 2.85Å; L928-V940 HydrophobicContact CD1-CB 4.48Å; L928-V940 HydrophobicContact CD1-CG1 4.19Å; L928-V940 HydrophobicContact CD1-CG2 4.37Å; L928-F943 HydrophobicContact CB-CD2 4.45Å; L928-F943 HydrophobicContact CD1-CB 3.88Å; L928-F943 HydrophobicContact CD1-CD2 4.28Å; L928-L944 HydrophobicContact CD1-CD2 4.47Å; L928-L944 HydrophobicContact CD1-CG 4.48Å; L928-L944 HydrophobicContact CD2-CD2 4.22Å; L928-A948 HydrophobicContact CB-CB 4.09Å; L928-A948 HydrophobicContact CD1-CB 4.46Å; L928-A948 HydrophobicContact CD2-CB 3.73Å; L928-A948 HydrophobicContact CG-CB 4.3Å; L928-V950 HydrophobicContact CD2-CG2 4.24Å; L928-P960 HydrophobicContact CB-CG 4.31Å; L928-P960 HydrophobicContact CD2-CB 4.04Å; L928-P960 HydrophobicContact CD2-CG 3.83Å; L928-P960 HydrophobicContact CG-CB 3.81Å; L928-P960 HydrophobicContact CG-CG 3.91Å; L928-L974 HydrophobicContact CD1-CD2 4.16Å; L928-L974 HydrophobicContact CD2-CD2 4.27Å; L928-L974 HydrophobicContact CG-CD2 4.39Å
929	H	96.8	Very high	95.7	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.1	-44.1	174.5	-69.6	76.5	0	0	0	110.8	D925 S926 A932 R933 L952 N954 E958	D925-H929 HydrophobicContact CB-CB 3.79Å; D925-H929 IonicContact OD1-CD2 3.19Å; D925-H929 IonicContact OD1-CG 2.78Å; S926-H929 PolarHBondContact N-ND1 3.38Å; S926-H929 WeakPolarHBondContact O-CB 3.48Å; S926-H929 PolarHBondContact O-N 2.87Å; S926-H929 PolarHBondContact OG-ND1 2.8Å; H929-A932 PolarHBondContact O-N 3.18Å; H929-R933 VanDerWaalsContact O-CB 3.32Å; H929-R933 WeakPolarHBondContact O-CB 3.38Å; H929-R933 PolarHBondContact O-N 3.48Å; H929-L952 PolarHBondContact CE1-O 3.41Å; H929-L952 PolarHBondContact NE2-O 2.76Å; H929-N954 PolarHBondContact NE2-N 3.07Å; H929-E958 PolarHBondContact NE2-O 3.3Å
930	I	96.6	Very high	95.8	Very high	17 Å²	17	28.9 Å²	28.9	9%	0.087	14%	0.143	C	C	.	.	H	α-helix	trans	-67.1	-49.7	179.1	-62.5	-174.3	0	0	0	110.9	H896 A899 F900 D925 S926 P927 A932 R933 E934	H896-I930 HydrophobicContact CB-CD1 3.85Å; A899-I930 HydrophobicContact CB-CB 4.25Å; A899-I930 HydrophobicContact CB-CG2 4.21Å; F900-I930 HydrophobicContact CB-CG2 3.8Å; F900-I930 HydrophobicContact CD2-CG2 4.34Å; D925-I930 HydrophobicContact CB-CG1 4.14Å; S926-I930 PolarHBondContact O-N 3.44Å; P927-I930 PolarHBondContact O-N 3.03Å; I930-A932 VanDerWaalsContact C-N 3.26Å; I930-A932 PolarHBondContact O-N 2.68Å; I930-R933 PolarHBondContact O-N 3Å; I930-R933 VanDerWaalsContact O-N 3.14Å; I930-E934 HydrophobicContact CG2-CG 4.26Å; I930-E934 WeakPolarHBondContact O-CB 3.23Å; I930-E934 PolarHBondContact O-N 3.04Å
931	A	96.3	Very high	95.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.9	-33	178.5	0	0	0	0	0	112.7	A899 P927 N935 R936 C939 V940 F943	A899-A931 HydrophobicContact CB-CB 4.12Å; P927-A931 WeakPolarHBondContact O-CB 3.2Å; P927-A931 PolarHBondContact O-N 3.33Å; A931-N935 PolarHBondContact O-N 3.04Å; A931-R936 HydrophobicContact CB-CB 4.24Å; A931-R936 PolarHBondContact O-N 3.22Å; A931-C939 HydrophobicContact CB-CB 4.02Å; A931-V940 HydrophobicContact CB-CG2 3.77Å; A931-F943 HydrophobicContact CB-CD2 4.02Å; A931-F943 HydrophobicContact CB-CE2 3.76Å
932	A	94.8	Very high	95.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-66.9	-48.9	172	0	0	0	0	0	111.8	L928 H929 I930 E934 N935 P960 C964 L974	L928-A932 WeakPolarHBondContact O-CB 3.23Å; L928-A932 PolarHBondContact O-N 2.85Å; H929-A932 PolarHBondContact O-N 3.18Å; I930-A932 VanDerWaalsContact C-N 3.26Å; I930-A932 PolarHBondContact O-N 2.68Å; A932-E934 PolarHBondContact O-N 3.02Å; A932-N935 WeakPolarHBondContact O-CA 3.46Å; A932-N935 PolarHBondContact O-N 3.2Å; A932-P960 HydrophobicContact CB-CB 4.16Å; A932-P960 VanDerWaalsContact CB-O 3.26Å; A932-P960 WeakPolarHBondContact CB-O 3.42Å; A932-C964 HydrophobicContact CB-CB 4.1Å; A932-C964 WeakPolarHBondContact O-CB 3.21Å; A932-L974 HydrophobicContact CB-CD1 3.64Å
933	R	94.4	Very high	95.8	Very high	79 Å²	79	29.4 Å²	29.4	30%	0.298	14%	0.138	S	C	.	.	H	α-helix	trans	-62.6	-42.2	-178.8	-167.5	179	-65.7	142.1	1.8	112.7	M195 D925 H929 I930 N935 N954 E958 C963	M195-R933 VanDerWaalsContact CE-CD 3.44Å; M195-R933 HydrophobicContact CE-CG 3.72Å; D925-R933 VanDerWaalsContact CG-NH2 3.33Å; D925-R933 IonicContact OD1-CZ 3.56Å; D925-R933 IonicContact OD1-NH1 3.55Å; D925-R933 IonicContact OD1-NH2 2.72Å; D925-R933 PolarHBondContact OD1-NH2 2.99Å; D925-R933 IonicContact OD2-CZ 3.2Å; D925-R933 IonicContact OD2-NH1 3.97Å; D925-R933 PolarHBondContact OD2-NH1 2.85Å; D925-R933 IonicContact OD2-NH2 3.83Å; D925-R933 PolarHBondContact OD2-NH2 3.2Å; H929-R933 VanDerWaalsContact O-CB 3.32Å; H929-R933 WeakPolarHBondContact O-CB 3.38Å; H929-R933 PolarHBondContact O-N 3.48Å; I930-R933 PolarHBondContact O-N 3Å; I930-R933 VanDerWaalsContact O-N 3.14Å; R933-N935 PolarHBondContact O-N 2.93Å; R933-N954 PolarHBondContact NH2-ND2 3.35Å; R933-E958 IonicContact NH2-OE2 2.71Å; R933-C963 WeakPolarHBondContact CA-O 3.38Å; R933-C963 HydrophobicContact CB-CB 4.35Å; R933-C963 PolarHBondContact NH2-SG 3.42Å
934	E	94.7	Very high	95.7	Very high	40 Å²	40	26.4 Å²	26.4	19%	0.187	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	4.8	174.7	-61	-48.5	120.5	0	0	113.6	M195 F900 I930 A932 R936	M195-E934 WeakPolarHBondContact CE-OE1 3.45Å; F900-E934 HydrophobicContact CD2-CG 3.68Å; F900-E934 HydrophobicContact CE2-CG 4.1Å; I930-E934 HydrophobicContact CG2-CG 4.26Å; I930-E934 WeakPolarHBondContact O-CB 3.23Å; I930-E934 PolarHBondContact O-N 3.04Å; A932-E934 PolarHBondContact O-N 3.02Å; E934-R936 HydrophobicContact CB-CG 3.85Å; E934-R936 WeakPolarHBondContact O-CD 3.31Å; E934-R936 PolarHBondContact O-N 2.97Å; E934-R936 PolarHBondContact O-NH1 2.94Å
935	N	94.2	Very high	95.6	Very high	77 Å²	77	30.5 Å²	30.5	41%	0.412	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	36.9	179.7	-175.2	38.8	0	0	0	113.7	A931 A932 R933 L937 S968 A970	A931-N935 PolarHBondContact O-N 3.04Å; A932-N935 WeakPolarHBondContact O-CA 3.46Å; A932-N935 PolarHBondContact O-N 3.2Å; R933-N935 PolarHBondContact O-N 2.93Å; N935-L937 VanDerWaalsContact C-N 3.26Å; N935-L937 PolarHBondContact O-N 2.88Å; N935-S968 WeakPolarHBondContact OD1-CB 3.13Å; N935-A970 WeakPolarHBondContact OD1-CB 3.42Å; N935-A970 PolarHBondContact OD1-N 3.35Å
936	R	95.1	Very high	95.4	Very high	86 Å²	86	35 Å²	35	33%	0.325	17%	0.168	S	C	.	.			trans	-80	71.5	177.3	-52.1	-51.2	-168.1	-147	-3.5	110.1	A899 F900 A931 E934 D938 C939 V940	A899-R936 VanDerWaalsContact O-CG 3.32Å; A899-R936 WeakPolarHBondContact O-CG 3.42Å; F900-R936 VanDerWaalsContact O-CZ 3.3Å; F900-R936 PolarHBondContact O-NE 3.14Å; F900-R936 PolarHBondContact O-NH2 3.01Å; A931-R936 HydrophobicContact CB-CB 4.24Å; A931-R936 PolarHBondContact O-N 3.22Å; E934-R936 HydrophobicContact CB-CG 3.85Å; E934-R936 WeakPolarHBondContact O-CD 3.31Å; E934-R936 PolarHBondContact O-N 2.97Å; E934-R936 PolarHBondContact O-NH1 2.94Å; R936-D938 PolarHBondContact O-N 2.82Å; R936-C939 HydrophobicContact CB-CB 3.96Å; R936-C939 PolarHBondContact O-N 3.2Å; R936-V940 PolarHBondContact O-N 3.27Å
937	L	94.4	Very high	95.1	Very high	32 Å²	32	36.8 Å²	36.8	17%	0.168	19%	0.187	C	C	.	.	H	α-helix	trans	-41.2	-47.5	-174.8	174.3	62.9	0	0	0	113.8	N935 V940 K941 K969 A973	N935-L937 VanDerWaalsContact C-N 3.26Å; N935-L937 PolarHBondContact O-N 2.88Å; L937-V940 CarbonylContact O-C 3.49Å; L937-V940 WeakPolarHBondContact O-CB 3.36Å; L937-V940 PolarHBondContact O-N 3Å; L937-K941 HydrophobicContact CD1-CG 4.46Å; L937-K941 HydrophobicContact CG-CD 4.5Å; L937-K941 WeakPolarHBondContact O-CG 2.88Å; L937-K941 PolarHBondContact O-N 2.92Å; L937-K969 HydrophobicContact CD1-CB 4.07Å; L937-K969 HydrophobicContact CD2-CB 3.86Å; L937-K969 HydrophobicContact CD2-CD 4.04Å; L937-K969 HydrophobicContact CG-CB 4.39Å; L937-A973 HydrophobicContact CD1-CB 3.97Å
938	D	95.9	Very high	94.9	Very high	77 Å²	77	37 Å²	37	41%	0.412	19%	0.189	S	C	.	.	H	α-helix	trans	-82.4	-25.6	-170.7	-52.4	-70.7	0	0	0	112.6	V904 R936 K941 L942	V904-D938 HydrophobicContact CG2-CB 3.73Å; R936-D938 PolarHBondContact O-N 2.82Å; D938-K941 WeakPolarHBondContact OD1-CE 3.15Å; D938-K941 IonicContact OD1-NZ 3.48Å; D938-K941 PolarHBondContact OD1-NZ 3.34Å; D938-L942 WeakPolarHBondContact O-CB 3.24Å; D938-L942 PolarHBondContact O-N 3.49Å
939	C	96.3	Very high	94.5	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.014	20%	0.2	C	C	.	.	H	α-helix	trans	-68.5	-40.5	163.6	-63.1	0	0	0	0	110.7	A931 R936 L942 F943	A931-C939 HydrophobicContact CB-CB 4.02Å; R936-C939 HydrophobicContact CB-CB 3.96Å; R936-C939 PolarHBondContact O-N 3.2Å; C939-L942 PolarHBondContact O-N 3.28Å; C939-F943 HydrophobicContact CB-CE2 4.17Å; C939-F943 HydrophobicContact CB-CZ 4.37Å; C939-F943 WeakPolarHBondContact O-CB 3.14Å; C939-F943 VanDerWaalsContact O-CD2 3.26Å; C939-F943 WeakPolarHBondContact O-CD2 3.44Å; C939-F943 WeakPolarHBondContact O-CG 3.29Å; C939-F943 PolarHBondContact O-N 3.02Å
940	V	96	Very high	94.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59	-47.1	172.7	169.5	0	0	0	0	110.8	L928 A931 R936 L937 L942 F943 L944 A970 L974	L928-V940 HydrophobicContact CD1-CB 4.48Å; L928-V940 HydrophobicContact CD1-CG1 4.19Å; L928-V940 HydrophobicContact CD1-CG2 4.37Å; A931-V940 HydrophobicContact CB-CG2 3.77Å; R936-V940 PolarHBondContact O-N 3.27Å; L937-V940 CarbonylContact O-C 3.49Å; L937-V940 WeakPolarHBondContact O-CB 3.36Å; L937-V940 PolarHBondContact O-N 3Å; V940-L942 PolarHBondContact O-N 3.1Å; V940-F943 PolarHBondContact O-N 3.34Å; V940-L944 HydrophobicContact CG1-CD1 3.82Å; V940-L944 HydrophobicContact CG1-CG 4.35Å; V940-L944 WeakPolarHBondContact O-CB 3.38Å; V940-L944 WeakPolarHBondContact O-CG 3.45Å; V940-L944 PolarHBondContact O-N 3.44Å; V940-A970 HydrophobicContact CG2-CB 4.32Å; V940-L974 HydrophobicContact CG1-CD1 4.27Å; V940-L974 HydrophobicContact CG1-CD2 4Å; V940-L974 HydrophobicContact CG1-CG 3.81Å
941	K	95.2	Very high	93.8	Very high	104 Å²	104	42.5 Å²	42.5	45%	0.452	21%	0.214	S	C	.	.	H	α-helix	trans	-57.3	-49.4	174.8	-71	172.7	-172.7	161.3	0	112.3	L937 D938 F943 L944 S945	L937-K941 HydrophobicContact CD1-CG 4.46Å; L937-K941 HydrophobicContact CG-CD 4.5Å; L937-K941 WeakPolarHBondContact O-CG 2.88Å; L937-K941 PolarHBondContact O-N 2.92Å; D938-K941 WeakPolarHBondContact OD1-CE 3.15Å; D938-K941 IonicContact OD1-NZ 3.48Å; D938-K941 PolarHBondContact OD1-NZ 3.34Å; K941-F943 PolarHBondContact O-N 2.78Å; K941-L944 PolarHBondContact O-N 3.35Å; K941-S945 PolarHBondContact O-N 3.34Å; K941-S945 PolarHBondContact O-OG 2.78Å
942	L	96.4	Very high	93.6	Very high	15 Å²	15	44 Å²	44	8%	0.079	22%	0.223	C	C	.	.	H	α-helix	trans	-59.5	-45	178.4	174.9	64.2	0	0	0	111.5	V904 E908 L911 D938 C939 V940 L944 S945 R946	V904-L942 HydrophobicContact CG1-CB 4.44Å; V904-L942 HydrophobicContact CG1-CD2 3.94Å; E908-L942 HydrophobicContact CB-CD2 3.98Å; L911-L942 HydrophobicContact CD1-CD2 4.38Å; L911-L942 HydrophobicContact CD1-CG 4.33Å; D938-L942 WeakPolarHBondContact O-CB 3.24Å; D938-L942 PolarHBondContact O-N 3.49Å; C939-L942 PolarHBondContact O-N 3.28Å; V940-L942 PolarHBondContact O-N 3.1Å; L942-L944 PolarHBondContact O-N 2.8Å; L942-S945 PolarHBondContact O-N 2.67Å; L942-S945 PolarHBondContact O-OG 3.26Å; L942-S945 VanDerWaalsContact O-OG 3.1Å; L942-R946 HydrophobicContact CD1-CG 4.02Å; L942-R946 WeakPolarHBondContact O-CB 3.47Å; L942-R946 WeakPolarHBondContact O-CG 3.38Å; L942-R946 PolarHBondContact O-N 2.73Å
943	F	96.6	Very high	93.5	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66	-38.2	178.5	-64.7	-19.2	0	0	0	112	L895 A899 L911 L917 P927 L928 A931 C939 V940 K941 R946 G947 A948	L895-F943 HydrophobicContact CD1-CE1 3.88Å; L895-F943 HydrophobicContact CD1-CZ 4.05Å; L895-F943 HydrophobicContact CG-CE1 4.45Å; L895-F943 HydrophobicContact CG-CZ 4.43Å; A899-F943 HydrophobicContact CB-CE2 3.7Å; A899-F943 HydrophobicContact CB-CZ 3.95Å; L911-F943 HydrophobicContact CD1-CD1 3.9Å; L911-F943 HydrophobicContact CD1-CE1 3.94Å; L917-F943 HydrophobicContact CD1-CB 4.04Å; L917-F943 HydrophobicContact CD1-CD1 3.54Å; L917-F943 HydrophobicContact CD1-CE1 4.09Å; L917-F943 HydrophobicContact CD1-CG 3.78Å; P927-F943 HydrophobicContact CB-CD2 4.37Å; P927-F943 HydrophobicContact CB-CE2 3.75Å; P927-F943 HydrophobicContact CB-CZ 3.92Å; P927-F943 WeakPolarHBondContact O-CE2 3.22Å; L928-F943 HydrophobicContact CB-CD2 4.45Å; L928-F943 HydrophobicContact CD1-CB 3.88Å; L928-F943 HydrophobicContact CD1-CD2 4.28Å; A931-F943 HydrophobicContact CB-CD2 4.02Å; A931-F943 HydrophobicContact CB-CE2 3.76Å; C939-F943 HydrophobicContact CB-CE2 4.17Å; C939-F943 HydrophobicContact CB-CZ 4.37Å; C939-F943 WeakPolarHBondContact O-CB 3.14Å; C939-F943 VanDerWaalsContact O-CD2 3.26Å; C939-F943 WeakPolarHBondContact O-CD2 3.44Å; C939-F943 WeakPolarHBondContact O-CG 3.29Å; C939-F943 PolarHBondContact O-N 3.02Å; V940-F943 PolarHBondContact O-N 3.34Å; K941-F943 PolarHBondContact O-N 2.78Å; F943-R946 CarbonylContact O-C 3.46Å; F943-R946 PolarHBondContact O-N 2.67Å; F943-G947 PolarHBondContact O-N 3.16Å; F943-A948 HydrophobicContact CB-CB 3.85Å; F943-A948 WeakPolarHBondContact O-CB 3.26Å; F943-A948 PolarHBondContact O-N 3.25Å
944	L	93.6	Very high	93.6	Very high	14 Å²	14	46.6 Å²	46.6	7%	0.073	24%	0.236	C	C	.	.	H	α-helix	trans	-65.8	-46	174.8	-67.5	172.4	0	0	0	112	L928 V940 K941 L942 R946 G947 V950 L974 H977	L928-L944 HydrophobicContact CD1-CD2 4.47Å; L928-L944 HydrophobicContact CD1-CG 4.48Å; L928-L944 HydrophobicContact CD2-CD2 4.22Å; V940-L944 HydrophobicContact CG1-CD1 3.82Å; V940-L944 HydrophobicContact CG1-CG 4.35Å; V940-L944 WeakPolarHBondContact O-CB 3.38Å; V940-L944 WeakPolarHBondContact O-CG 3.45Å; V940-L944 PolarHBondContact O-N 3.44Å; K941-L944 PolarHBondContact O-N 3.35Å; L942-L944 PolarHBondContact O-N 2.8Å; L944-R946 PolarHBondContact O-N 3.38Å; L944-G947 PolarHBondContact O-N 2.67Å; L944-V950 HydrophobicContact CD2-CG2 3.33Å; L944-L974 HydrophobicContact CD1-CD2 4.32Å; L944-L974 HydrophobicContact CD2-CD2 4.23Å; L944-H977 HydrophobicContact CD1-CB 3.99Å; L944-H977 HydrophobicContact CD2-CB 4.36Å
945	S	93.3	Very high	93.6	Very high	94 Å²	94	53.3 Å²	53.3	66%	0.657	26%	0.26	S	S	*	.	H	α-helix	trans	-67.3	-20.7	176.9	66.3	0	0	0	0	113.5	K941 L942	K941-S945 PolarHBondContact O-N 3.34Å; K941-S945 PolarHBondContact O-OG 2.78Å; L942-S945 PolarHBondContact O-N 2.67Å; L942-S945 PolarHBondContact O-OG 3.26Å; L942-S945 VanDerWaalsContact O-OG 3.1Å
946	R	93.1	Very high	93.6	Very high	98 Å²	98	55 Å²	55	37%	0.37	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	11.9	171.9	-58.3	-72.2	171	92.3	4.5	113.5	E908 L911 N912 L917 L942 F943 L944	E908-R946 IonicContact OE1-CZ 3.63Å; E908-R946 IonicContact OE1-NH1 2.72Å; E908-R946 IonicContact OE1-NH2 3.73Å; E908-R946 PolarHBondContact OE1-NH2 2.86Å; L911-R946 HydrophobicContact CD1-CB 4.46Å; L911-R946 HydrophobicContact CD1-CG 4.23Å; N912-R946 PolarHBondContact OD1-NH1 3.08Å; L917-R946 HydrophobicContact CD2-CB 3.8Å; L917-R946 WeakPolarHBondContact CD2-O 3.4Å; L942-R946 HydrophobicContact CD1-CG 4.02Å; L942-R946 WeakPolarHBondContact O-CB 3.47Å; L942-R946 WeakPolarHBondContact O-CG 3.38Å; L942-R946 PolarHBondContact O-N 2.73Å; F943-R946 CarbonylContact O-C 3.46Å; F943-R946 PolarHBondContact O-N 2.67Å; L944-R946 PolarHBondContact O-N 3.38Å
947	G	89.2	Confident	93.4	Very high	38 Å²	38	52.4 Å²	52.4	39%	0.392	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	21.7	169.7	0	0	0	0	0	116.6	Q918 F943 L944	Q918-G947 PolarHBondContact NE2-O 3.23Å; F943-G947 PolarHBondContact O-N 3.16Å; L944-G947 PolarHBondContact O-N 2.67Å
948	A	92.5	Very high	93.4	Very high	5 Å²	5	53.9 Å²	53.9	4%	0.041	27%	0.271	C	S	.	.			trans	-59.6	139.1	178.1	0	0	0	0	0	112.9	L917 L928 F943 V950	L917-A948 HydrophobicContact CD1-CB 4.21Å; L917-A948 HydrophobicContact CD2-CB 3.89Å; L917-A948 HydrophobicContact CG-CB 3.93Å; L928-A948 HydrophobicContact CB-CB 4.09Å; L928-A948 HydrophobicContact CD1-CB 4.46Å; L928-A948 HydrophobicContact CD2-CB 3.73Å; L928-A948 HydrophobicContact CG-CB 4.3Å; F943-A948 HydrophobicContact CB-CB 3.85Å; F943-A948 WeakPolarHBondContact O-CB 3.26Å; F943-A948 PolarHBondContact O-N 3.25Å; A948-V950 PolarHBondContact O-N 3.49Å; A948-V950 VanDerWaalsContact O-N 3.17Å
949	N	88.6	Confident	93.3	Very high	44 Å²	44	50.7 Å²	50.7	24%	0.235	25%	0.254	C	S	.	.			trans	-80	104.2	-173.4	-174.4	-3.2	0	0	0	112.4	Q918 F951 L952	Q918-N949 VanDerWaalsContact OE1-CB 3.3Å; Q918-N949 VanDerWaalsContact OE1-N 3.15Å; N949-F951 PolarHBondContact O-N 3.48Å; N949-F951 WeakPolarHBondContact OD1-CA 3.37Å; N949-F951 PolarHBondContact OD1-N 3.4Å; N949-L952 HydrophobicContact CB-CB 4.05Å; N949-L952 WeakPolarHBondContact O-CB 3.21Å; N949-L952 PolarHBondContact O-N 2.65Å; N949-L952 PolarHBondContact OD1-N 3.42Å
950	V	90.1	Very high	93.2	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.024	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-12.2	178	-164.6	0	0	0	0	113.4	L928 L944 A948 P961 L974	L928-V950 HydrophobicContact CD2-CG2 4.24Å; L944-V950 HydrophobicContact CD2-CG2 3.33Å; A948-V950 PolarHBondContact O-N 3.49Å; A948-V950 VanDerWaalsContact O-N 3.17Å; V950-P961 HydrophobicContact CG1-CG 3.56Å; V950-L974 HydrophobicContact CG1-CD2 4.1Å
951	F	89.3	Confident	92.9	Very high	83 Å²	83	50.6 Å²	50.6	36%	0.364	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-4.2	179.4	-54.3	-83	0	0	0	113.8	N949 K978	N949-F951 PolarHBondContact O-N 3.48Å; N949-F951 WeakPolarHBondContact OD1-CA 3.37Å; N949-F951 PolarHBondContact OD1-N 3.4Å; F951-K978 HydrophobicContact CE1-CD 4.31Å; F951-K978 HydrophobicContact CE1-CG 4.27Å; F951-K978 HydrophobicContact CZ-CG 4.28Å
952	L	91.4	Very high	92.8	Very high	33 Å²	33	49.9 Å²	49.9	17%	0.173	26%	0.255	C	S	.	.			trans	-58.4	144.5	170	-178.6	64	0	0	0	109.1	V920 H929 N949 T959 P960	V920-L952 HydrophobicContact CG1-CD2 4.06Å; H929-L952 PolarHBondContact CE1-O 3.41Å; H929-L952 PolarHBondContact NE2-O 2.76Å; N949-L952 HydrophobicContact CB-CB 4.05Å; N949-L952 WeakPolarHBondContact O-CB 3.21Å; N949-L952 PolarHBondContact O-N 2.65Å; N949-L952 PolarHBondContact OD1-N 3.42Å; L952-T959 WeakPolarHBondContact O-CA 3.49Å; L952-P960 WeakPolarHBondContact O-CD 3.38Å
953	K	94	Very high	92.5	Very high	124 Å²	124	50 Å²	50	54%	0.539	26%	0.256	S	S	.	.			trans	-118.5	138.4	179.3	-71.4	179.9	169.5	-121.9	0	111.5	G957 E958 T959	K953-G957 WeakPolarHBondContact CD-O 3.33Å; K953-G957 PolarHBondContact NZ-O 3.25Å; K953-E958 VanDerWaalsContact CA-O 3.29Å; K953-E958 WeakPolarHBondContact CA-O 3.24Å; K953-T959 HydrophobicContact CD-CG2 4.46Å; K953-T959 HydrophobicContact CG-CG2 3.63Å
954	N	95.1	Very high	92.1	Very high	9 Å²	9	50.4 Å²	50.4	5%	0.048	26%	0.259	C	S	.	.			trans	-73.6	-178.6	166.3	69.5	10.3	0	0	0	111.5	D925 H929 R933 E956 G957 E958	D925-N954 WeakPolarHBondContact OD1-CB 3.39Å; D925-N954 PolarHBondContact OD1-ND2 2.88Å; H929-N954 PolarHBondContact NE2-N 3.07Å; R933-N954 PolarHBondContact NH2-ND2 3.35Å; N954-E956 VanDerWaalsContact C-N 3.26Å; N954-E956 PolarHBondContact O-N 2.96Å; N954-E956 WeakPolarHBondContact OD1-CB 3.35Å; N954-E956 PolarHBondContact OD1-N 3.06Å; N954-G957 PolarHBondContact O-N 2.93Å; N954-G957 PolarHBondContact OD1-N 3.2Å; N954-E958 PolarHBondContact N-O 3.14Å; N954-E958 PolarHBondContact ND2-OE2 2.86Å; N954-E958 WeakPolarHBondContact OD1-CB 3.38Å; N954-E958 PolarHBondContact OD1-N 2.7Å; N954-E958 PolarHBondContact OD1-O 3.27Å
955	R	95.1	Very high	91.7	Very high	181 Å²	181	54.1 Å²	54.1	68%	0.683	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-25.5	-176.9	-71.1	172.1	175.5	-158.1	-9.4	113.1	V922 H923 G957	V922-R955 VanDerWaalsContact O-CD 3.25Å; V922-R955 WeakPolarHBondContact O-CD 3.44Å; V922-R955 PolarHBondContact O-NE 3.49Å; V922-R955 PolarHBondContact O-NH1 3.28Å; H923-R955 VanDerWaalsContact O-CB 3.25Å; H923-R955 WeakPolarHBondContact O-CB 3.38Å; H923-R955 WeakPolarHBondContact O-CG 3.4Å; H923-R955 PolarHBondContact O-N 3.04Å; R955-G957 PolarHBondContact O-N 2.88Å
956	E	93.4	Very high	91	Very high	113 Å²	113	55.9 Å²	55.9	53%	0.528	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-14.1	172.8	-66.4	68.5	-159.3	0	0	111.7	N954 E958	N954-E956 VanDerWaalsContact C-N 3.26Å; N954-E956 PolarHBondContact O-N 2.96Å; N954-E956 WeakPolarHBondContact OD1-CB 3.35Å; N954-E956 PolarHBondContact OD1-N 3.06Å; E956-E958 HydrophobicContact CB-CG 4.14Å
957	G	91.9	Very high	90.4	Very high	30 Å²	30	59.2 Å²	59.2	31%	0.309	31%	0.309	S	S	.	.	S	Bend	trans	89.4	4.9	177.3	0	0	0	0	0	114.4	K953 N954 R955	K953-G957 WeakPolarHBondContact CD-O 3.33Å; K953-G957 PolarHBondContact NZ-O 3.25Å; N954-G957 PolarHBondContact O-N 2.93Å; N954-G957 PolarHBondContact OD1-N 3.2Å; R955-G957 PolarHBondContact O-N 2.88Å
958	E	94.3	Very high	90.5	Very high	64 Å²	64	58.3 Å²	58.3	30%	0.299	30%	0.297	S	S	.	.			trans	-78.2	140	177.2	-53.4	174	159	0	0	109.8	H929 R933 K953 N954 E956 D962 C963	H929-E958 PolarHBondContact NE2-O 3.3Å; R933-E958 IonicContact NH2-OE2 2.71Å; K953-E958 VanDerWaalsContact CA-O 3.29Å; K953-E958 WeakPolarHBondContact CA-O 3.24Å; N954-E958 PolarHBondContact N-O 3.14Å; N954-E958 PolarHBondContact ND2-OE2 2.86Å; N954-E958 WeakPolarHBondContact OD1-CB 3.38Å; N954-E958 PolarHBondContact OD1-N 2.7Å; N954-E958 PolarHBondContact OD1-O 3.27Å; E956-E958 HydrophobicContact CB-CG 4.14Å; E958-D962 HydrophobicContact CB-CB 4.08Å; E958-C963 PolarHBondContact OE2-SG 3.38Å; E958-C963 VanDerWaalsContact OE2-SG 3.4Å
959	T	93.8	Very high	90.3	Very high	10 Å²	10	65.8 Å²	65.8	6%	0.061	33%	0.328	C	S	.	.			trans	-91.3	166	165.8	63.5	0	0	0	0	110.4	L952 K953 P961 D962 C963	L952-T959 WeakPolarHBondContact O-CA 3.49Å; K953-T959 HydrophobicContact CD-CG2 4.46Å; K953-T959 HydrophobicContact CG-CG2 3.63Å; T959-P961 VanDerWaalsContact C-CD 3.5Å; T959-P961 VanDerWaalsContact C-N 3.33Å; T959-P961 WeakPolarHBondContact OG1-CD 3.27Å; T959-D962 WeakPolarHBondContact CB-OD2 3.41Å; T959-D962 PolarHBondContact N-OD2 3.02Å; T959-D962 WeakPolarHBondContact O-CA 3.1Å; T959-D962 WeakPolarHBondContact O-CB 3.26Å; T959-D962 PolarHBondContact O-N 3.42Å; T959-D962 VanDerWaalsContact OG1-CG 3.26Å; T959-D962 PolarHBondContact OG1-OD2 3.1Å; T959-C963 PolarHBondContact O-N 3.47Å; T959-C963 PolarHBondContact O-SG 3.49Å
960	P	93.4	Very high	90.4	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-39.2	177	-22.2	30.1	0	0	0	115	L928 A932 L952 D962 C963 L974	L928-P960 HydrophobicContact CB-CG 4.31Å; L928-P960 HydrophobicContact CD2-CB 4.04Å; L928-P960 HydrophobicContact CD2-CG 3.83Å; L928-P960 HydrophobicContact CG-CB 3.81Å; L928-P960 HydrophobicContact CG-CG 3.91Å; A932-P960 HydrophobicContact CB-CB 4.16Å; A932-P960 VanDerWaalsContact CB-O 3.26Å; A932-P960 WeakPolarHBondContact CB-O 3.42Å; L952-P960 WeakPolarHBondContact O-CD 3.38Å; P960-D962 VanDerWaalsContact C-N 3.31Å; P960-D962 PolarHBondContact O-N 3.12Å; P960-C963 PolarHBondContact O-N 2.84Å; P960-L974 HydrophobicContact CB-CD2 4.33Å
961	P	91.3	Very high	90.4	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-37.7	168.4	-22.9	29	0	0	0	114.5	V950 T959 C964 L974	V950-P961 HydrophobicContact CG1-CG 3.56Å; T959-P961 VanDerWaalsContact C-CD 3.5Å; T959-P961 VanDerWaalsContact C-N 3.33Å; T959-P961 WeakPolarHBondContact OG1-CD 3.27Å; P961-C964 PolarHBondContact O-SG 2.95Å; P961-L974 HydrophobicContact CB-CB 4.44Å; P961-L974 HydrophobicContact CG-CB 4.19Å
962	D	91.7	Very high	90.4	Very high	89 Å²	89	64.5 Å²	64.5	48%	0.476	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-27.5	-179.7	-51.3	-48.3	0	0	0	111.8	E958 T959 P960 C964	E958-D962 HydrophobicContact CB-CB 4.08Å; T959-D962 WeakPolarHBondContact CB-OD2 3.41Å; T959-D962 PolarHBondContact N-OD2 3.02Å; T959-D962 WeakPolarHBondContact O-CA 3.1Å; T959-D962 WeakPolarHBondContact O-CB 3.26Å; T959-D962 PolarHBondContact O-N 3.42Å; T959-D962 VanDerWaalsContact OG1-CG 3.26Å; T959-D962 PolarHBondContact OG1-OD2 3.1Å; P960-D962 VanDerWaalsContact C-N 3.31Å; P960-D962 PolarHBondContact O-N 3.12Å; D962-C964 PolarHBondContact O-N 3.4Å
963	C	89.9	Confident	90.4	Very high	16 Å²	16	64.1 Å²	64.1	11%	0.108	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-7	177	-67.1	0	0	0	0	114.6	R933 E958 T959 P960	R933-C963 WeakPolarHBondContact CA-O 3.38Å; R933-C963 HydrophobicContact CB-CB 4.35Å; R933-C963 PolarHBondContact NH2-SG 3.42Å; E958-C963 PolarHBondContact OE2-SG 3.38Å; E958-C963 VanDerWaalsContact OE2-SG 3.4Å; T959-C963 PolarHBondContact O-N 3.47Å; T959-C963 PolarHBondContact O-SG 3.49Å; P960-C963 PolarHBondContact O-N 2.84Å
964	C	88.3	Confident	90.2	Very high	9 Å²	9	58.2 Å²	58.2	6%	0.061	30%	0.304	C	S	.	.	S	Bend	trans	-123.2	145.4	-173.2	67.5	0	0	0	0	113.5	A932 P961 D962 H966 W971	A932-C964 HydrophobicContact CB-CB 4.1Å; A932-C964 WeakPolarHBondContact O-CB 3.21Å; P961-C964 PolarHBondContact O-SG 2.95Å; D962-C964 PolarHBondContact O-N 3.4Å; C964-H966 PolarHBondContact O-N 3.26Å; C964-W971 VanDerWaalsContact SG-CA 3.51Å; C964-W971 VanDerWaalsContact SG-CB 3.55Å
965	S	86.6	Confident	89.8	Confident	93 Å²	93	60 Å²	60	65%	0.65	31%	0.312	S	S	*	.			trans	-60.2	131.6	-176.9	-59.1	0	0	0	0	111.9	N967 S968 W971	S965-N967 PolarHBondContact O-N 3.06Å; S965-S968 WeakPolarHBondContact O-CB 3.39Å; S965-S968 PolarHBondContact O-N 3.3Å; S965-S968 PolarHBondContact O-OG 2.91Å; S965-W971 VanDerWaalsContact O-CB 3.31Å; S965-W971 WeakPolarHBondContact O-CB 3.4Å
966	H	77.9	Confident	89.4	Confident	131 Å²	131	54 Å²	54	61%	0.606	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-22.9	-173.6	-65.6	-50.3	0	0	0	116.3	C964 W971	C964-H966 PolarHBondContact O-N 3.26Å; H966-W971 AromaticContact ND1-CD1 3.86Å; H966-W971 AromaticContact ND1-CE2 3.68Å; H966-W971 AromaticContact ND1-NE1 3.21Å; H966-W971 PolarHBondContact ND1-NE1 2.89Å; H966-W971 VanDerWaalsContact O-CD2 3.25Å
967	N	81.4	Confident	89.1	Confident	168 Å²	168	51 Å²	51	90%	0.898	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	10.6	179	-62.8	12.4	0	0	0	112.9	S965	S965-N967 PolarHBondContact O-N 3.06Å
968	S	90.8	Very high	88.8	Confident	18 Å²	18	52.3 Å²	52.3	13%	0.126	28%	0.284	C	S	.	.	S	Bend	trans	-83.4	152.4	-177.6	69.4	0	0	0	0	112.6	N935 S965 A970 W971 G972	N935-S968 WeakPolarHBondContact OD1-CB 3.13Å; S965-S968 WeakPolarHBondContact O-CB 3.39Å; S965-S968 PolarHBondContact O-N 3.3Å; S965-S968 PolarHBondContact O-OG 2.91Å; S968-A970 VanDerWaalsContact C-N 3.25Å; S968-A970 PolarHBondContact O-N 2.61Å; S968-W971 PolarHBondContact O-N 2.85Å; S968-W971 VanDerWaalsContact OG-CB 3.23Å; S968-W971 WeakPolarHBondContact OG-CB 3.42Å; S968-W971 PolarHBondContact OG-N 2.91Å; S968-G972 PolarHBondContact O-N 3.47Å
969	K	88.1	Confident	88.2	Confident	162 Å²	162	58.1 Å²	58.1	70%	0.704	30%	0.304	S	S	*	.	H	α-helix	trans	-62	-36.1	174.8	-62.4	-176.3	-179.5	179	0	111.2	L937 G972 A973	L937-K969 HydrophobicContact CD1-CB 4.07Å; L937-K969 HydrophobicContact CD2-CB 3.86Å; L937-K969 HydrophobicContact CD2-CD 4.04Å; L937-K969 HydrophobicContact CG-CB 4.39Å; K969-G972 PolarHBondContact O-N 2.83Å; K969-A973 PolarHBondContact O-N 3.38Å
970	A	89.6	Confident	87.5	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-62.1	-46.4	173.7	0	0	0	0	0	112.1	N935 V940 S968 G972 A973 L974	N935-A970 WeakPolarHBondContact OD1-CB 3.42Å; N935-A970 PolarHBondContact OD1-N 3.35Å; V940-A970 HydrophobicContact CG2-CB 4.32Å; S968-A970 VanDerWaalsContact C-N 3.25Å; S968-A970 PolarHBondContact O-N 2.61Å; A970-G972 VanDerWaalsContact C-N 3.31Å; A970-G972 PolarHBondContact O-N 3.03Å; A970-A973 PolarHBondContact O-N 3.26Å; A970-L974 WeakPolarHBondContact O-CB 3.48Å; A970-L974 WeakPolarHBondContact O-CD1 3.45Å; A970-L974 VanDerWaalsContact O-CG 3.3Å; A970-L974 WeakPolarHBondContact O-CG 3.4Å; A970-L974 PolarHBondContact O-N 3.48Å
971	W	91.3	Very high	86.4	Confident	70 Å²	70	68.6 Å²	68.6	27%	0.265	35%	0.347	S	S	.	.	H	α-helix	trans	-58	-43.9	174.7	-173.2	91.9	0	0	0	111.7	C964 S965 H966 S968 L974 H975	C964-W971 VanDerWaalsContact SG-CA 3.51Å; C964-W971 VanDerWaalsContact SG-CB 3.55Å; S965-W971 VanDerWaalsContact O-CB 3.31Å; S965-W971 WeakPolarHBondContact O-CB 3.4Å; H966-W971 AromaticContact ND1-CD1 3.86Å; H966-W971 AromaticContact ND1-CE2 3.68Å; H966-W971 AromaticContact ND1-NE1 3.21Å; H966-W971 PolarHBondContact ND1-NE1 2.89Å; H966-W971 VanDerWaalsContact O-CD2 3.25Å; S968-W971 PolarHBondContact O-N 2.85Å; S968-W971 VanDerWaalsContact OG-CB 3.23Å; S968-W971 WeakPolarHBondContact OG-CB 3.42Å; S968-W971 PolarHBondContact OG-N 2.91Å; W971-L974 PolarHBondContact O-N 2.99Å; W971-H975 AromaticContact CD1-CD2 3.8Å; W971-H975 AromaticContact CD2-CD2 3.62Å; W971-H975 AromaticContact CE2-CD2 3.2Å; W971-H975 AromaticContact CE2-CG 3.85Å; W971-H975 AromaticContact CE2-NE2 3.34Å; W971-H975 VanDerWaalsContact CE2-NE2 3.34Å; W971-H975 HydrophobicContact CE3-CB 4.47Å; W971-H975 AromaticContact CG-CD2 3.99Å; W971-H975 HydrophobicContact CH2-CB 4.46Å; W971-H975 AromaticContact CZ2-CD2 3.53Å; W971-H975 AromaticContact CZ2-CE1 3.67Å; W971-H975 AromaticContact CZ2-CG 3.75Å; W971-H975 AromaticContact CZ2-ND1 3.84Å; W971-H975 AromaticContact CZ2-NE2 3.49Å; W971-H975 WeakPolarHBondContact CZ2-NE2 3.37Å; W971-H975 HydrophobicContact CZ3-CB 4.38Å; W971-H975 AromaticContact NE1-CD2 3.27Å; W971-H975 PolarHBondContact NE1-CD2 3.14Å; W971-H975 VanDerWaalsContact NE1-CD2 3.27Å; W971-H975 AromaticContact NE1-NE2 3.15Å; W971-H975 PolarHBondContact NE1-NE2 3.08Å; W971-H975 VanDerWaalsContact NE1-NE2 3.15Å; W971-H975 WeakPolarHBondContact O-CB 3.47Å; W971-H975 PolarHBondContact O-N 3.45Å
972	G	89.4	Confident	85.3	Confident	34 Å²	34	72.2 Å²	72.2	35%	0.351	37%	0.367	S	S	.	.	H	α-helix	trans	-58.1	-47.5	175.1	0	0	0	0	0	113.1	S968 K969 A970 A976	S968-G972 PolarHBondContact O-N 3.47Å; K969-G972 PolarHBondContact O-N 2.83Å; A970-G972 VanDerWaalsContact C-N 3.31Å; A970-G972 PolarHBondContact O-N 3.03Å; G972-A976 VanDerWaalsContact O-CB 3.25Å; G972-A976 WeakPolarHBondContact O-CB 3.4Å; G972-A976 PolarHBondContact O-N 2.95Å
973	A	90.1	Very high	84.1	Confident	26 Å²	26	70 Å²	70	22%	0.215	36%	0.361	C	S	.	.	H	α-helix	trans	-64.5	-43.7	177.1	0	0	0	0	0	112.5	L937 K969 A970 A976 H977	L937-A973 HydrophobicContact CD1-CB 3.97Å; K969-A973 PolarHBondContact O-N 3.38Å; A970-A973 PolarHBondContact O-N 3.26Å; A973-A976 PolarHBondContact O-N 2.89Å; A973-H977 WeakPolarHBondContact O-CB 3.49Å; A973-H977 PolarHBondContact O-N 3.09Å
974	L	91.3	Very high	82.7	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-63.5	-42.8	177.9	-75.2	161.3	0	0	0	112.2	L928 A932 V940 L944 V950 P960 P961 A970 W971 K978	L928-L974 HydrophobicContact CD1-CD2 4.16Å; L928-L974 HydrophobicContact CD2-CD2 4.27Å; L928-L974 HydrophobicContact CG-CD2 4.39Å; A932-L974 HydrophobicContact CB-CD1 3.64Å; V940-L974 HydrophobicContact CG1-CD1 4.27Å; V940-L974 HydrophobicContact CG1-CD2 4Å; V940-L974 HydrophobicContact CG1-CG 3.81Å; L944-L974 HydrophobicContact CD1-CD2 4.32Å; L944-L974 HydrophobicContact CD2-CD2 4.23Å; V950-L974 HydrophobicContact CG1-CD2 4.1Å; P960-L974 HydrophobicContact CB-CD2 4.33Å; P961-L974 HydrophobicContact CB-CB 4.44Å; P961-L974 HydrophobicContact CG-CB 4.19Å; A970-L974 WeakPolarHBondContact O-CB 3.48Å; A970-L974 WeakPolarHBondContact O-CD1 3.45Å; A970-L974 VanDerWaalsContact O-CG 3.3Å; A970-L974 WeakPolarHBondContact O-CG 3.4Å; A970-L974 PolarHBondContact O-N 3.48Å; W971-L974 PolarHBondContact O-N 2.99Å; L974-K978 WeakPolarHBondContact O-CB 3.21Å; L974-K978 PolarHBondContact O-N 3.01Å
975	H	87.1	Confident	81	Confident	45 Å²	45	77.1 Å²	77.1	21%	0.208	39%	0.393	C	S	.	.	H	α-helix	trans	-74.7	-29.9	176.3	-88.3	-96.8	0	0	0	113.4	W971 R979	W971-H975 AromaticContact CD1-CD2 3.8Å; W971-H975 AromaticContact CD2-CD2 3.62Å; W971-H975 AromaticContact CE2-CD2 3.2Å; W971-H975 AromaticContact CE2-CG 3.85Å; W971-H975 AromaticContact CE2-NE2 3.34Å; W971-H975 VanDerWaalsContact CE2-NE2 3.34Å; W971-H975 HydrophobicContact CE3-CB 4.47Å; W971-H975 AromaticContact CG-CD2 3.99Å; W971-H975 HydrophobicContact CH2-CB 4.46Å; W971-H975 AromaticContact CZ2-CD2 3.53Å; W971-H975 AromaticContact CZ2-CE1 3.67Å; W971-H975 AromaticContact CZ2-CG 3.75Å; W971-H975 AromaticContact CZ2-ND1 3.84Å; W971-H975 AromaticContact CZ2-NE2 3.49Å; W971-H975 WeakPolarHBondContact CZ2-NE2 3.37Å; W971-H975 HydrophobicContact CZ3-CB 4.38Å; W971-H975 AromaticContact NE1-CD2 3.27Å; W971-H975 PolarHBondContact NE1-CD2 3.14Å; W971-H975 VanDerWaalsContact NE1-CD2 3.27Å; W971-H975 AromaticContact NE1-NE2 3.15Å; W971-H975 PolarHBondContact NE1-NE2 3.08Å; W971-H975 VanDerWaalsContact NE1-NE2 3.15Å; W971-H975 WeakPolarHBondContact O-CB 3.47Å; W971-H975 PolarHBondContact O-N 3.45Å; H975-R979 WeakPolarHBondContact O-CB 3.3Å; H975-R979 VanDerWaalsContact O-CG 3.3Å; H975-R979 WeakPolarHBondContact O-CG 3.33Å; H975-R979 PolarHBondContact O-N 3.19Å
976	A	86.9	Confident	79.2	Confident	55 Å²	55	75.1 Å²	75.1	46%	0.455	39%	0.386	S	S	.	.	H	α-helix	trans	-64.1	-53.6	170.3	0	0	0	0	0	110.6	G972 A973 K978 R979 E980	G972-A976 VanDerWaalsContact O-CB 3.25Å; G972-A976 WeakPolarHBondContact O-CB 3.4Å; G972-A976 PolarHBondContact O-N 2.95Å; A973-A976 PolarHBondContact O-N 2.89Å; A976-K978 VanDerWaalsContact C-N 3.31Å; A976-K978 PolarHBondContact O-N 2.91Å; A976-R979 CarbonylContact O-C 3.57Å; A976-R979 PolarHBondContact O-N 2.96Å; A976-R979 VanDerWaalsContact O-N 3.15Å; A976-E980 WeakPolarHBondContact O-CB 3.23Å; A976-E980 PolarHBondContact O-N 3.48Å
977	H	86.4	Confident	77.7	Confident	52 Å²	52	79 Å²	79	24%	0.241	40%	0.396	C	S	.	.	H	α-helix	trans	-62.1	-36.5	177.7	-175.3	-89.2	0	0	0	112.6	L944 A973 E980 R981	L944-H977 HydrophobicContact CD1-CB 3.99Å; L944-H977 HydrophobicContact CD2-CB 4.36Å; A973-H977 WeakPolarHBondContact O-CB 3.49Å; A973-H977 PolarHBondContact O-N 3.09Å; H977-E980 PolarHBondContact O-N 3.41Å; H977-R981 WeakPolarHBondContact O-CB 3.37Å; H977-R981 PolarHBondContact O-N 3.41Å
978	K	84.8	Confident	76	Confident	56 Å²	56	75.8 Å²	75.8	24%	0.243	38%	0.378	C	S	.	.	H	α-helix	trans	-61.9	-49.9	171.9	-179.3	168.5	177.1	168.9	0	111.5	F951 L974 A976 E980 R981 D982	F951-K978 HydrophobicContact CE1-CD 4.31Å; F951-K978 HydrophobicContact CE1-CG 4.27Å; F951-K978 HydrophobicContact CZ-CG 4.28Å; L974-K978 WeakPolarHBondContact O-CB 3.21Å; L974-K978 PolarHBondContact O-N 3.01Å; A976-K978 VanDerWaalsContact C-N 3.31Å; A976-K978 PolarHBondContact O-N 2.91Å; K978-E980 VanDerWaalsContact C-N 3.3Å; K978-E980 PolarHBondContact O-N 3.44Å; K978-R981 PolarHBondContact O-N 3.19Å; K978-D982 WeakPolarHBondContact O-CB 3.22Å; K978-D982 PolarHBondContact O-N 2.92Å
979	R	83.1	Confident	73.8	Confident	187 Å²	187	84.1 Å²	84.1	71%	0.706	41%	0.407	S	S	*	.	H	α-helix	trans	-62.1	-35.9	175.4	-77.4	176.5	174.1	-175.7	0.1	112.9	H975 A976 D982 A983	H975-R979 WeakPolarHBondContact O-CB 3.3Å; H975-R979 VanDerWaalsContact O-CG 3.3Å; H975-R979 WeakPolarHBondContact O-CG 3.33Å; H975-R979 PolarHBondContact O-N 3.19Å; A976-R979 CarbonylContact O-C 3.57Å; A976-R979 PolarHBondContact O-N 2.96Å; A976-R979 VanDerWaalsContact O-N 3.15Å; R979-D982 PolarHBondContact O-N 2.97Å; R979-A983 WeakPolarHBondContact O-CB 3.34Å; R979-A983 PolarHBondContact O-N 2.72Å
980	E	77.3	Confident	71.9	Confident	132 Å²	132	86.9 Å²	86.9	62%	0.617	41%	0.413	S	S	*	.	H	α-helix	trans	-67.9	-45.3	176.7	-178.1	168.1	-149.7	0	0	111.2	A976 H977 K978 A983 K984	A976-E980 WeakPolarHBondContact O-CB 3.23Å; A976-E980 PolarHBondContact O-N 3.48Å; H977-E980 PolarHBondContact O-N 3.41Å; K978-E980 VanDerWaalsContact C-N 3.3Å; K978-E980 PolarHBondContact O-N 3.44Å; E980-A983 CarbonylContact O-C 3.6Å; E980-A983 PolarHBondContact O-N 3.43Å; E980-K984 WeakPolarHBondContact O-CB 3.38Å; E980-K984 PolarHBondContact O-N 3.02Å
981	R	71.6	Confident	69.9	Low	97 Å²	97	91.4 Å²	91.4	37%	0.366	44%	0.44	S	S	.	.	H	α-helix	trans	-64.4	-40.6	172	-173.6	161.3	174	115.1	3.7	111.7	H977 K978 A983 K984 N985	H977-R981 WeakPolarHBondContact O-CB 3.37Å; H977-R981 PolarHBondContact O-N 3.41Å; K978-R981 PolarHBondContact O-N 3.19Å; R981-A983 VanDerWaalsContact C-N 3.25Å; R981-A983 PolarHBondContact O-N 3.11Å; R981-K984 PolarHBondContact O-N 2.89Å; R981-N985 WeakPolarHBondContact O-CB 3.18Å; R981-N985 PolarHBondContact O-N 3.36Å; R981-N985 PolarHBondContact O-OD1 2.98Å
982	D	68.6	Low	68.2	Low	76 Å²	76	94.5 Å²	94.5	41%	0.406	46%	0.458	S	S	.	.	H	α-helix	trans	-64.1	-28.9	174	-66.4	-23.6	0	0	0	111.9	K978 R979 G986	K978-D982 WeakPolarHBondContact O-CB 3.22Å; K978-D982 PolarHBondContact O-N 2.92Å; R979-D982 PolarHBondContact O-N 2.97Å; D982-G986 WeakPolarHBondContact O-CA 3.33Å; D982-G986 PolarHBondContact O-N 2.94Å
983	A	65.8	Low	66.9	Low	44 Å²	44	96.8 Å²	96.8	36%	0.364	46%	0.46	S	S	.	.	H	α-helix	trans	-88.2	-26.9	175.9	0	0	0	0	0	114.3	R979 E980 R981 R987	R979-A983 WeakPolarHBondContact O-CB 3.34Å; R979-A983 PolarHBondContact O-N 2.72Å; E980-A983 CarbonylContact O-C 3.6Å; E980-A983 PolarHBondContact O-N 3.43Å; R981-A983 VanDerWaalsContact C-N 3.25Å; R981-A983 PolarHBondContact O-N 3.11Å; A983-R987 PolarHBondContact O-N 2.72Å; A983-R987 VanDerWaalsContact O-N 3.17Å
984	K	59.8	Low	66.4	Low	103 Å²	103	102.2 Å²	102.2	45%	0.448	48%	0.478	S	S	.	.	H	α-helix	trans	-63.5	-51.8	164.4	-169.1	-176.9	179.1	-172.5	0	107.6	E87 E980 R981 G986 R987 L988	E87-K984 IonicContact OE1-NZ 3.15Å; E87-K984 PolarHBondContact OE1-NZ 3.41Å; E87-K984 IonicContact OE2-NZ 2.69Å; E980-K984 WeakPolarHBondContact O-CB 3.38Å; E980-K984 PolarHBondContact O-N 3.02Å; R981-K984 PolarHBondContact O-N 2.89Å; K984-G986 VanDerWaalsContact C-N 3.34Å; K984-G986 PolarHBondContact O-N 3.47Å; K984-R987 PolarHBondContact O-N 3.12Å; K984-R987 VanDerWaalsContact O-N 3.14Å; K984-L988 HydrophobicContact CG-CD1 4.14Å; K984-L988 WeakPolarHBondContact O-CG 3.41Å; K984-L988 PolarHBondContact O-N 3.21Å
985	N	52.7	Low	66.2	Low	71 Å²	71	105.1 Å²	105.1	38%	0.38	49%	0.494	S	S	.	.	H	α-helix	trans	-59.1	-40.2	172.6	-67.6	-0.3	0	0	0	112.3	R981 R987 L988 R989	R981-N985 WeakPolarHBondContact O-CB 3.18Å; R981-N985 PolarHBondContact O-N 3.36Å; R981-N985 PolarHBondContact O-OD1 2.98Å; N985-R987 VanDerWaalsContact C-N 3.28Å; N985-R987 PolarHBondContact O-N 3.33Å; N985-L988 CarbonylContact O-C 3.37Å; N985-L988 PolarHBondContact O-N 3.47Å; N985-R989 WeakPolarHBondContact O-CB 3.23Å; N985-R989 PolarHBondContact O-N 2.72Å
986	G	48.3	Very low	66.3	Low	50 Å²	50	105 Å²	105	52%	0.515	49%	0.494	S	S	.	.	H	α-helix	trans	-63.3	-29.2	176.7	0	0	0	0	0	114.2	D982 K984	D982-G986 WeakPolarHBondContact O-CA 3.33Å; D982-G986 PolarHBondContact O-N 2.94Å; K984-G986 VanDerWaalsContact C-N 3.34Å; K984-G986 PolarHBondContact O-N 3.47Å
987	R	48.3	Very low	66.5	Low	213 Å²	213	105.4 Å²	105.4	80%	0.804	49%	0.487	S	S	*	.	H	α-helix	trans	-84.7	-32.1	171	-81.4	-179.3	-88.2	-147.9	0.2	113	A983 K984 N985 R989	A983-R987 PolarHBondContact O-N 2.72Å; A983-R987 VanDerWaalsContact O-N 3.17Å; K984-R987 PolarHBondContact O-N 3.12Å; K984-R987 VanDerWaalsContact O-N 3.14Å; N985-R987 VanDerWaalsContact C-N 3.28Å; N985-R987 PolarHBondContact O-N 3.33Å; R987-R989 PolarHBondContact O-N 2.87Å
988	L	44.5	Very low	66.8	Low	101 Å²	101	107 Å²	107	53%	0.529	50%	0.503	S	S	.	.	H	α-helix	trans	-71.5	-12	169.8	-70.5	162.8	0	0	0	113.3	K984 N985 R990	K984-L988 HydrophobicContact CG-CD1 4.14Å; K984-L988 WeakPolarHBondContact O-CG 3.41Å; K984-L988 PolarHBondContact O-N 3.21Å; N985-L988 CarbonylContact O-C 3.37Å; N985-L988 PolarHBondContact O-N 3.47Å; L988-R990 CarbonylContact O-C 3.45Å; L988-R990 PolarHBondContact O-N 3.34Å
989	R	44.2	Very low	67.3	Low	192 Å²	192	105.2 Å²	105.2	73%	0.725	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	17.2	-179.6	-140.6	-179	-177.9	-155.6	-3.4	115.1	N985 R987 E992	N985-R989 WeakPolarHBondContact O-CB 3.23Å; N985-R989 PolarHBondContact O-N 2.72Å; R987-R989 PolarHBondContact O-N 2.87Å; R989-E992 IonicContact NE-OE1 3.36Å; R989-E992 PolarHBondContact NE-OE1 2.93Å; R989-E992 IonicContact NH2-OE1 2.68Å
990	R	48.2	Very low	67.9	Low	221 Å²	221	96.8 Å²	96.8	83%	0.834	47%	0.465	S	S	*	.	S	Bend	trans	-111.4	107.5	154.8	-173.8	179.8	-66.3	-166.5	-0.4	105.3	L988	L988-R990 CarbonylContact O-C 3.45Å; L988-R990 PolarHBondContact O-N 3.34Å
991	T	48.6	Very low	68.6	Low	94 Å²	94	90.5 Å²	90.5	58%	0.577	44%	0.436	S	S	*	.	S	Bend	trans	79.8	86.7	-171.8	-42.2	0	0	0	0	114	E993 S1014	T991-E993 PolarHBondContact O-N 3.35Å; T991-S1014 WeakPolarHBondContact CG2-O 3.32Å
992	E	54.5	Low	69.6	Low	135 Å²	135	91.6 Å²	91.6	63%	0.631	45%	0.448	S	S	*	.			trans	-75.2	106.3	170.2	-70.4	179.9	-179.3	0	0	109.5	R989 K994	R989-E992 IonicContact NE-OE1 3.36Å; R989-E992 PolarHBondContact NE-OE1 2.93Å; R989-E992 IonicContact NH2-OE1 2.68Å; E992-K994 PolarHBondContact O-N 3.5Å
993	E	63.6	Low	70.6	Confident	83 Å²	83	90.8 Å²	90.8	39%	0.388	46%	0.458	S	S	.	.			trans	-77	103.4	175.5	-170.8	157.7	-109.1	0	0	110.7	T991 L995 V1012 S1014 R1127	T991-E993 PolarHBondContact O-N 3.35Å; E993-L995 PolarHBondContact O-N 3.36Å; E993-V1012 HydrophobicContact CG-CB 3.82Å; E993-V1012 HydrophobicContact CG-CG1 4.49Å; E993-V1012 HydrophobicContact CG-CG2 3.94Å; E993-S1014 WeakPolarHBondContact OE1-CB 3.42Å; E993-S1014 PolarHBondContact OE1-OG 3.48Å; E993-R1127 VanDerWaalsContact CD-NH2 3.29Å; E993-R1127 IonicContact OE1-CZ 2.72Å; E993-R1127 IonicContact OE1-NH1 3.19Å; E993-R1127 PolarHBondContact OE1-NH1 3.47Å; E993-R1127 IonicContact OE1-NH2 2.69Å; E993-R1127 PolarHBondContact OE1-NH2 2.87Å; E993-R1127 IonicContact OE2-CZ 3.52Å; E993-R1127 IonicContact OE2-NH1 3.28Å; E993-R1127 IonicContact OE2-NH2 3.73Å; E993-R1127 PolarHBondContact OE2-NH2 3.25Å
994	K	79.4	Confident	71.8	Confident	139 Å²	139	92.8 Å²	92.8	60%	0.604	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	112.7	-173.6	-174.9	-171.5	171.1	-166.6	0	110.3	E992 L996 V1012 N1013	E992-K994 PolarHBondContact O-N 3.5Å; K994-L996 HydrophobicContact CB-CD2 4.46Å; K994-L996 HydrophobicContact CD-CD2 3.76Å; K994-L996 HydrophobicContact CG-CD2 3.94Å; K994-L996 PolarHBondContact O-N 2.93Å; K994-V1012 WeakPolarHBondContact O-CA 3.37Å; K994-N1013 WeakPolarHBondContact CB-O 3.41Å; K994-N1013 PolarHBondContact N-O 2.83Å; K994-N1013 PolarHBondContact O-N 2.91Å
995	L	87	Confident	73.5	Confident	62 Å²	62	89 Å²	89	33%	0.325	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	119.5	166.3	-174	67.2	0	0	0	109.6	E993 H997 P1010 V1012	E993-L995 PolarHBondContact O-N 3.36Å; L995-H997 WeakPolarHBondContact CD1-O 3.08Å; L995-P1010 HydrophobicContact CD1-CB 3.96Å; L995-V1012 HydrophobicContact CD1-CG1 3.76Å
996	L	88.6	Confident	75.2	Confident	42 Å²	42	92.4 Å²	92.4	22%	0.22	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-36.4	177.5	-57.5	-170.2	0	0	0	111.5	K994 C1011 N1013 E1018 I1020 W1124	K994-L996 HydrophobicContact CB-CD2 4.46Å; K994-L996 HydrophobicContact CD-CD2 3.76Å; K994-L996 HydrophobicContact CG-CD2 3.94Å; K994-L996 PolarHBondContact O-N 2.93Å; L996-C1011 PolarHBondContact N-O 3.44Å; L996-N1013 HydrophobicContact CD1-CB 3.8Å; L996-N1013 HydrophobicContact CD2-CB 4.43Å; L996-N1013 HydrophobicContact CG-CB 4.12Å; L996-E1018 WeakPolarHBondContact CD1-O 3.26Å; L996-I1020 HydrophobicContact CB-CB 4.42Å; L996-W1124 HydrophobicContact CD1-CH2 3.84Å
997	H	91.1	Very high	77.4	Confident	64 Å²	64	91.3 Å²	91.3	30%	0.296	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	141.5	179	-156.9	-106.1	0	0	0	111.2	L995 D999 P1010 C1011 I1020	L995-H997 WeakPolarHBondContact CD1-O 3.08Å; H997-D999 PolarHBondContact CE1-O 3.15Å; H997-D999 VanDerWaalsContact ND1-C 3.25Å; H997-D999 PolarHBondContact ND1-O 3.33Å; H997-P1010 WeakPolarHBondContact O-CA 3.35Å; H997-C1011 HydrophobicContact CB-CB 4.11Å; H997-C1011 PolarHBondContact N-O 2.96Å; H997-C1011 PolarHBondContact O-N 3.36Å; H997-I1020 HydrophobicContact CB-CD1 3.51Å
998	S	93	Very high	79.6	Confident	84 Å²	84	84.6 Å²	84.6	59%	0.587	43%	0.426	S	S	*	.	S	Bend	trans	-79.2	-29.7	-175.9	55.5	0	0	0	0	114	P1010	S998-P1010 WeakPolarHBondContact O-CA 3.46Å
999	D	95.8	Very high	82.1	Confident	19 Å²	19	79.8 Å²	79.8	10%	0.102	40%	0.401	C	S	.	.			trans	-158	105.7	178.4	174.9	25.8	0	0	0	111.2	H997 S1001 L1002 G1003 I1009	H997-D999 PolarHBondContact CE1-O 3.15Å; H997-D999 VanDerWaalsContact ND1-C 3.25Å; H997-D999 PolarHBondContact ND1-O 3.33Å; D999-S1001 VanDerWaalsContact CG-OG 3.25Å; D999-S1001 PolarHBondContact O-N 2.94Å; D999-S1001 WeakPolarHBondContact OD1-CB 3.3Å; D999-S1001 PolarHBondContact OD1-N 3.44Å; D999-S1001 PolarHBondContact OD1-OG 2.84Å; D999-S1001 PolarHBondContact OD2-OG 3.03Å; D999-L1002 PolarHBondContact O-N 3.33Å; D999-L1002 PolarHBondContact OD2-N 2.97Å; D999-G1003 WeakPolarHBondContact OD2-CA 3.22Å; D999-G1003 PolarHBondContact OD2-N 3.43Å; D999-I1009 CarbonylContact C-O 3.5Å; D999-I1009 VanDerWaalsContact CA-O 3.28Å; D999-I1009 WeakPolarHBondContact CA-O 3.19Å; D999-I1009 PolarHBondContact OD1-N 3.44Å
1000	I	94.2	Very high	84.6	Confident	10 Å²	10	71.5 Å²	71.5	5%	0.051	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-18.7	-179.8	70.3	176.7	0	0	0	113.2	L1002 I1009 C1011 I1020 Y1026 V1116 F1184	I1000-L1002 PolarHBondContact O-N 3.49Å; I1000-I1009 HydrophobicContact CD1-CG2 3.87Å; I1000-I1009 HydrophobicContact CG1-CB 4.01Å; I1000-I1009 HydrophobicContact CG1-CG2 3.79Å; I1000-I1009 PolarHBondContact N-O 3.39Å; I1000-C1011 HydrophobicContact CG2-CB 3.62Å; I1000-I1020 HydrophobicContact CB-CD1 4.47Å; I1000-I1020 HydrophobicContact CG2-CD1 3.59Å; I1000-Y1026 HydrophobicContact CD1-CD2 4.32Å; I1000-Y1026 HydrophobicContact CD1-CE2 4.09Å; I1000-Y1026 HydrophobicContact CG1-CD2 4.04Å; I1000-Y1026 HydrophobicContact CG1-CE2 3.9Å; I1000-V1116 HydrophobicContact CD1-CB 4.41Å; I1000-V1116 HydrophobicContact CD1-CG2 3.62Å; I1000-F1184 HydrophobicContact CD1-CE2 4.2Å
1001	S	93.8	Very high	86.9	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-14.8	176.4	81.7	0	0	0	0	113.1	D999 G1003 Q1004 E1005	D999-S1001 VanDerWaalsContact CG-OG 3.25Å; D999-S1001 PolarHBondContact O-N 2.94Å; D999-S1001 WeakPolarHBondContact OD1-CB 3.3Å; D999-S1001 PolarHBondContact OD1-N 3.44Å; D999-S1001 PolarHBondContact OD1-OG 2.84Å; D999-S1001 PolarHBondContact OD2-OG 3.03Å; S1001-G1003 VanDerWaalsContact C-N 3.27Å; S1001-G1003 PolarHBondContact O-N 2.82Å; S1001-G1003 PolarHBondContact OG-N 2.9Å; S1001-Q1004 VanDerWaalsContact O-CB 3.31Å; S1001-Q1004 WeakPolarHBondContact O-CB 3.44Å; S1001-Q1004 WeakPolarHBondContact O-CG 3.3Å; S1001-Q1004 PolarHBondContact O-N 3.49Å; S1001-Q1004 PolarHBondContact O-NE2 3.04Å; S1001-Q1004 PolarHBondContact OG-N 3.43Å; S1001-E1005 PolarHBondContact OG-N 3.46Å
1002	L	91.8	Very high	89.1	Confident	121 Å²	121	56.8 Å²	56.8	63%	0.634	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	35.2	-173.2	-55.6	171.2	0	0	0	113.4	D999 I1000 Q1004	D999-L1002 PolarHBondContact O-N 3.33Å; D999-L1002 PolarHBondContact OD2-N 2.97Å; I1000-L1002 PolarHBondContact O-N 3.49Å; L1002-Q1004 VanDerWaalsContact C-N 3.35Å
1003	G	90.4	Very high	90.9	Very high	58 Å²	58	50.6 Å²	50.6	60%	0.598	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	18.9	-178.1	0	0	0	0	0	114.5	D999 S1001	D999-G1003 WeakPolarHBondContact OD2-CA 3.22Å; D999-G1003 PolarHBondContact OD2-N 3.43Å; S1001-G1003 VanDerWaalsContact C-N 3.27Å; S1001-G1003 PolarHBondContact O-N 2.82Å; S1001-G1003 PolarHBondContact OG-N 2.9Å
1004	Q	90.7	Very high	91.9	Very high	86 Å²	86	48 Å²	48	40%	0.402	27%	0.269	S	S	.	.			trans	-81.3	-30.4	174.1	-64.7	174.9	107.5	0	0	111.8	S1001 L1002 Y1026 T1028	S1001-Q1004 VanDerWaalsContact O-CB 3.31Å; S1001-Q1004 WeakPolarHBondContact O-CB 3.44Å; S1001-Q1004 WeakPolarHBondContact O-CG 3.3Å; S1001-Q1004 PolarHBondContact O-N 3.49Å; S1001-Q1004 PolarHBondContact O-NE2 3.04Å; S1001-Q1004 PolarHBondContact OG-N 3.43Å; L1002-Q1004 VanDerWaalsContact C-N 3.35Å; Q1004-Y1026 PolarHBondContact NE2-O 3.29Å; Q1004-T1028 HydrophobicContact CB-CG2 3.6Å
1005	E	94.3	Very high	92.3	Very high	25 Å²	25	44.9 Å²	44.9	12%	0.117	26%	0.261	C	S	.	.	S	Bend	trans	-87.6	158.7	174.7	-62.1	-75.7	-174	0	0	111.5	S1001 V1007 I1009 Y1026 T1028 L1110	S1001-E1005 PolarHBondContact OG-N 3.46Å; E1005-V1007 PolarHBondContact O-N 3.14Å; E1005-I1009 HydrophobicContact CB-CD1 4.44Å; E1005-I1009 HydrophobicContact CG-CD1 3.9Å; E1005-Y1026 HydrophobicContact CG-CE1 4.03Å; E1005-Y1026 WeakPolarHBondContact CG-OH 3.37Å; E1005-Y1026 PolarHBondContact OE1-OH 3.11Å; E1005-T1028 HydrophobicContact CG-CG2 4.25Å; E1005-L1110 WeakPolarHBondContact OE2-CB 3.44Å
1006	Q	89.8	Confident	92.2	Very high	141 Å²	141	45.3 Å²	45.3	66%	0.659	26%	0.264	S	S	*	.	S	Bend	trans	-71	-16.7	175.6	-70.6	175.6	36.6	0	0	113.5	N1108	Q1006-N1108 PolarHBondContact NE2-O 3.27Å
1007	V	93.6	Very high	92.1	Very high	28 Å²	28	48.9 Å²	48.9	17%	0.17	29%	0.292	C	S	.	.	S	Bend	trans	-130.6	129.3	-178.4	-175.8	0	0	0	0	108.3	E1005 L1110 R1113	E1005-V1007 PolarHBondContact O-N 3.14Å; V1007-L1110 HydrophobicContact CB-CD2 3.92Å; V1007-L1110 HydrophobicContact CG2-CD2 4.41Å; V1007-R1113 HydrophobicContact CG1-CB 4.43Å; V1007-R1113 HydrophobicContact CG1-CG 3.81Å
1008	S	94.8	Very high	92	Very high	71 Å²	71	49.7 Å²	49.7	50%	0.497	30%	0.296	S	S	.	.			trans	-63.6	131.6	177.9	54	0	0	0	0	111.9	P1010	S1008-P1010 WeakPolarHBondContact O-CD 3.41Å
1009	I	97	Very high	91.9	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	30%	0.295	C	S	.	.			trans	-109.2	91.9	-178.9	-60.5	160.3	0	0	0	109.5	D999 I1000 E1005 Y1026 L1110 V1116 I1181	D999-I1009 CarbonylContact C-O 3.5Å; D999-I1009 VanDerWaalsContact CA-O 3.28Å; D999-I1009 WeakPolarHBondContact CA-O 3.19Å; D999-I1009 PolarHBondContact OD1-N 3.44Å; I1000-I1009 HydrophobicContact CD1-CG2 3.87Å; I1000-I1009 HydrophobicContact CG1-CB 4.01Å; I1000-I1009 HydrophobicContact CG1-CG2 3.79Å; I1000-I1009 PolarHBondContact N-O 3.39Å; E1005-I1009 HydrophobicContact CB-CD1 4.44Å; E1005-I1009 HydrophobicContact CG-CD1 3.9Å; I1009-Y1026 WeakPolarHBondContact CD1-OH 3.45Å; I1009-L1110 HydrophobicContact CD1-CD1 4.03Å; I1009-V1116 HydrophobicContact CG2-CG2 4.25Å; I1009-I1181 HydrophobicContact CD1-CB 4.16Å; I1009-I1181 HydrophobicContact CD1-CD1 4.08Å; I1009-I1181 HydrophobicContact CD1-CG1 4.46Å; I1009-I1181 HydrophobicContact CG1-CD1 4.25Å; I1009-I1181 HydrophobicContact CG2-CD1 3.49Å; I1009-I1181 VanDerWaalsContact CG2-CD1 3.49Å; I1009-I1181 HydrophobicContact CG2-CG1 4.01Å
1010	P	96.4	Very high	91.6	Very high	18 Å²	18	51 Å²	51	12%	0.117	30%	0.301	C	S	.	.			trans	-66.6	153.7	178.7	25.7	-33.9	0	0	0	112.6	L995 H997 S998 S1008 Q1115 V1116 L1129	L995-P1010 HydrophobicContact CD1-CB 3.96Å; H997-P1010 WeakPolarHBondContact O-CA 3.35Å; S998-P1010 WeakPolarHBondContact O-CA 3.46Å; S1008-P1010 WeakPolarHBondContact O-CD 3.41Å; P1010-Q1115 HydrophobicContact CG-CB 4.16Å; P1010-Q1115 HydrophobicContact CG-CG 4.06Å; P1010-V1116 PolarHBondContact O-N 3.38Å; P1010-L1129 HydrophobicContact CG-CD1 4.24Å
1011	C	95.8	Very high	91.5	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.007	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	121.7	174.4	-174.8	0	0	0	0	110.2	L996 H997 I1000 I1020 V1116	L996-C1011 PolarHBondContact N-O 3.44Å; H997-C1011 HydrophobicContact CB-CB 4.11Å; H997-C1011 PolarHBondContact N-O 2.96Å; H997-C1011 PolarHBondContact O-N 3.36Å; I1000-C1011 HydrophobicContact CG2-CB 3.62Å; C1011-I1020 HydrophobicContact CB-CD1 4.19Å; C1011-V1116 CarbonylContact C-O 3.41Å; C1011-V1116 VanDerWaalsContact CA-O 3.28Å; C1011-V1116 WeakPolarHBondContact CA-O 3.44Å
1012	V	94.5	Very high	91.2	Very high	6 Å²	6	58.3 Å²	58.3	4%	0.036	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	147	-176.7	-59.8	0	0	0	0	112.5	E993 K994 L995 Q1115 V1116 F1117 R1118 W1124	E993-V1012 HydrophobicContact CG-CB 3.82Å; E993-V1012 HydrophobicContact CG-CG1 4.49Å; E993-V1012 HydrophobicContact CG-CG2 3.94Å; K994-V1012 WeakPolarHBondContact O-CA 3.37Å; L995-V1012 HydrophobicContact CD1-CG1 3.76Å; V1012-Q1115 VanDerWaalsContact CG1-NE2 3.35Å; V1012-Q1115 HydrophobicContact CG2-CG 4.04Å; V1012-V1116 PolarHBondContact N-O 2.78Å; V1012-F1117 HydrophobicContact CG2-CB 3.59Å; V1012-F1117 CarbonylContact O-C 3.58Å; V1012-F1117 VanDerWaalsContact O-CA 3.32Å; V1012-F1117 WeakPolarHBondContact O-CA 3.36Å; V1012-R1118 PolarHBondContact O-N 3.37Å; V1012-W1124 WeakPolarHBondContact O-CZ3 3.44Å
1013	N	92.5	Very high	91.3	Very high	5 Å²	5	56 Å²	56	3%	0.027	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	117.8	172.4	-169.5	-14.1	0	0	0	110.7	K994 L996 V1015 D1016 E1018 R1118 W1124	K994-N1013 WeakPolarHBondContact CB-O 3.41Å; K994-N1013 PolarHBondContact N-O 2.83Å; K994-N1013 PolarHBondContact O-N 2.91Å; L996-N1013 HydrophobicContact CD1-CB 3.8Å; L996-N1013 HydrophobicContact CD2-CB 4.43Å; L996-N1013 HydrophobicContact CG-CB 4.12Å; N1013-V1015 PolarHBondContact OD1-N 2.98Å; N1013-D1016 PolarHBondContact ND2-OD1 3.21Å; N1013-D1016 PolarHBondContact OD1-N 3.28Å; N1013-E1018 PolarHBondContact ND2-O 2.85Å; N1013-R1118 HydrophobicContact CB-CB 4.09Å; N1013-R1118 VanDerWaalsContact OD1-CB 3.26Å; N1013-R1118 WeakPolarHBondContact OD1-CB 3.33Å; N1013-R1118 WeakPolarHBondContact OD1-CG 3.43Å; N1013-W1124 HydrophobicContact CB-CH2 4.08Å
1014	S	85.4	Confident	91.5	Very high	28 Å²	28	54.9 Å²	54.9	20%	0.196	31%	0.307	C	S	.	.	S	Bend	trans	-110.1	-5	177.9	30.2	0	0	0	0	113.1	T991 E993	T991-S1014 WeakPolarHBondContact CG2-O 3.32Å; E993-S1014 WeakPolarHBondContact OE1-CB 3.42Å; E993-S1014 PolarHBondContact OE1-OG 3.48Å
1015	V	87.2	Confident	91.8	Very high	73 Å²	73	55.2 Å²	55.2	44%	0.442	31%	0.308	S	S	.	.	S	Bend	trans	-109.7	-44.3	-164.5	177	0	0	0	0	112.1	N1013 R1118	N1013-V1015 PolarHBondContact OD1-N 2.98Å; V1015-R1118 HydrophobicContact CB-CB 4.38Å; V1015-R1118 HydrophobicContact CB-CG 3.83Å; V1015-R1118 HydrophobicContact CG2-CB 4.41Å; V1015-R1118 HydrophobicContact CG2-CG 4.25Å; V1015-R1118 WeakPolarHBondContact CG2-O 3.07Å
1016	D	86.2	Confident	92	Very high	71 Å²	71	54.5 Å²	54.5	38%	0.38	30%	0.304	S	S	.	.	S	Bend	trans	-142.9	-158.5	-173.8	63.4	42.6	0	0	0	112.2	N1013 E1018 R1118	N1013-D1016 PolarHBondContact ND2-OD1 3.21Å; N1013-D1016 PolarHBondContact OD1-N 3.28Å; D1016-E1018 WeakPolarHBondContact OD1-CB 3.39Å; D1016-E1018 PolarHBondContact OD1-N 3.02Å; D1016-R1118 IonicContact OD1-NE 2.67Å; D1016-R1118 IonicContact OD1-NH2 3.51Å; D1016-R1118 IonicContact OD2-CZ 3.3Å; D1016-R1118 IonicContact OD2-NE 3.6Å; D1016-R1118 PolarHBondContact OD2-NE 2.96Å; D1016-R1118 IonicContact OD2-NH2 3.12Å; D1016-R1118 PolarHBondContact OD2-NH2 3.29Å
1017	S	86.6	Confident	92.3	Very high	118 Å²	118	48.9 Å²	48.9	83%	0.825	28%	0.278	S	S	*	.			trans	-112.4	12.4	-178.6	60.9	0	0	0	0	113.9
1018	E	88.1	Confident	92.4	Very high	81 Å²	81	50.1 Å²	50.1	38%	0.379	29%	0.286	S	S	.	.			trans	-65	133.9	178.1	-159.7	172.5	108.8	0	0	110.7	L996 N1013 D1016 R1118 W1124	L996-E1018 WeakPolarHBondContact CD1-O 3.26Å; N1013-E1018 PolarHBondContact ND2-O 2.85Å; D1016-E1018 WeakPolarHBondContact OD1-CB 3.39Å; D1016-E1018 PolarHBondContact OD1-N 3.02Å; E1018-R1118 VanDerWaalsContact CD-NH2 3.35Å; E1018-R1118 IonicContact OE1-CZ 3.45Å; E1018-R1118 IonicContact OE1-NH1 3.82Å; E1018-R1118 PolarHBondContact OE1-NH1 2.78Å; E1018-R1118 IonicContact OE1-NH2 3.94Å; E1018-R1118 IonicContact OE2-CZ 3.64Å; E1018-R1118 VanDerWaalsContact OE2-CZ 3.28Å; E1018-R1118 IonicContact OE2-NH1 2.72Å; E1018-R1118 PolarHBondContact OE2-NH1 3.1Å; E1018-R1118 IonicContact OE2-NH2 3.62Å; E1018-R1118 PolarHBondContact OE2-NH2 3.08Å; E1018-W1124 HydrophobicContact CB-CZ2 4.4Å; E1018-W1124 PolarHBondContact OE1-NE1 2.67Å
1019	P	90.5	Very high	92.3	Very high	86 Å²	86	54.1 Å²	54.1	56%	0.558	30%	0.297	S	S	*	.			trans	-70.3	175.6	176	32	-37.2	0	0	0	111.7	W1124	P1019-W1124 VanDerWaalsContact O-CZ2 3.23Å; P1019-W1124 WeakPolarHBondContact O-CZ2 3.21Å
1020	I	90.4	Very high	92.2	Very high	45 Å²	45	55.9 Å²	55.9	23%	0.231	31%	0.306	C	S	.	.			trans	-56.1	136.4	167.4	174.4	165.9	0	0	0	109.6	L996 H997 I1000 C1011 D1022	L996-I1020 HydrophobicContact CB-CB 4.42Å; H997-I1020 HydrophobicContact CB-CD1 3.51Å; I1000-I1020 HydrophobicContact CB-CD1 4.47Å; I1000-I1020 HydrophobicContact CG2-CD1 3.59Å; C1011-I1020 HydrophobicContact CB-CD1 4.19Å; I1020-D1022 PolarHBondContact O-N 2.68Å; I1020-D1022 VanDerWaalsContact O-N 3.16Å
1021	P	90.6	Very high	92.1	Very high	20 Å²	20	56.6 Å²	56.6	13%	0.13	31%	0.311	C	S	.	.			trans	-57.9	116.7	170	-27	36.6	0	0	0	111.4	Y1024 W1124 F1184	P1021-Y1024 HydrophobicContact CB-CE1 4.25Å; P1021-Y1024 WeakPolarHBondContact O-CE1 3.29Å; P1021-W1124 HydrophobicContact CG-CD2 3.97Å; P1021-W1124 HydrophobicContact CG-CG 3.98Å; P1021-W1124 HydrophobicContact CG-CZ2 4.38Å; P1021-F1184 HydrophobicContact CB-CE1 4.1Å; P1021-F1184 HydrophobicContact CB-CZ 4.14Å; P1021-F1184 HydrophobicContact CG-CE1 3.93Å; P1021-F1184 HydrophobicContact CG-CZ 4.3Å
1022	D	89.4	Confident	91.9	Very high	142 Å²	142	59.9 Å²	59.9	76%	0.759	33%	0.331	S	S	*	.			trans	-116.2	5.3	179	64.1	-14.4	0	0	0	112.8	I1020 Y1024	I1020-D1022 PolarHBondContact O-N 2.68Å; I1020-D1022 VanDerWaalsContact O-N 3.16Å; D1022-Y1024 PolarHBondContact O-N 2.65Å
1023	D	92.3	Very high	91.6	Very high	74 Å²	74	63.2 Å²	63.2	40%	0.396	35%	0.351	S	S	.	.	S	Bend	trans	-86.2	17.8	-174.9	81	-43.3	0	0	0	114.3	R1176	D1023-R1176 PolarHBondContact O-NH1 3.08Å; D1023-R1176 IonicContact OD2-CZ 3.89Å; D1023-R1176 IonicContact OD2-NH1 2.81Å; D1023-R1176 PolarHBondContact OD2-NH1 3.06Å; D1023-R1176 IonicContact OD2-NH2 3.73Å; D1023-R1176 PolarHBondContact OD2-NH2 3.04Å
1024	Y	96	Very high	91.3	Very high	33 Å²	33	65.9 Å²	65.9	13%	0.129	37%	0.37	C	S	.	.	S	Bend	trans	-151.8	167	-179.9	81.5	-70.4	0	0	0	110.7	P1021 D1022 Y1026 F1177 R1183 F1184	P1021-Y1024 HydrophobicContact CB-CE1 4.25Å; P1021-Y1024 WeakPolarHBondContact O-CE1 3.29Å; D1022-Y1024 PolarHBondContact O-N 2.65Å; Y1024-Y1026 HydrophobicContact CE2-CD2 4.23Å; Y1024-F1177 CarbonylContact C-O 3.54Å; Y1024-F1177 WeakPolarHBondContact CA-O 3.49Å; Y1024-R1183 VanDerWaalsContact CD2-CD 3.46Å; Y1024-R1183 VanDerWaalsContact CG-CZ 3.47Å; Y1024-F1184 HydrophobicContact CD1-CZ 4.41Å; Y1024-F1184 HydrophobicContact CE1-CE2 4.24Å; Y1024-F1184 AromaticContact CE1-CZ 3.69Å; Y1024-F1184 HydrophobicContact CE1-CZ 3.69Å; Y1024-F1184 HydrophobicContact CE2-CE2 4.44Å; Y1024-F1184 AromaticContact CZ-CE2 3.85Å; Y1024-F1184 AromaticContact CZ-CZ 3.8Å
1025	K	96.6	Very high	91.1	Very high	94 Å²	94	71 Å²	71	41%	0.409	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	116.5	176.5	174	54.3	-173.5	144.5	0	111.1	I1027 F1177 Y1178 G1179	K1025-I1027 HydrophobicContact CG-CG2 4.36Å; K1025-I1027 PolarHBondContact O-N 3.21Å; K1025-F1177 PolarHBondContact N-O 2.71Å; K1025-Y1178 HydrophobicContact CB-CD1 3.86Å; K1025-Y1178 HydrophobicContact CB-CE1 4.2Å; K1025-Y1178 HydrophobicContact CG-CD1 3.99Å; K1025-Y1178 HydrophobicContact CG-CE1 4.27Å; K1025-Y1178 WeakPolarHBondContact O-CA 3.46Å; K1025-G1179 PolarHBondContact O-N 3.3Å; K1025-G1179 VanDerWaalsContact O-N 3.12Å
1026	Y	97.2	Very high	90.9	Very high	9 Å²	9	69.4 Å²	69.4	4%	0.035	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	125.2	170.9	-158.5	-72.9	0	0	0	111.5	I1000 Q1004 E1005 I1009 Y1024 T1028 G1179 N1180 I1181	I1000-Y1026 HydrophobicContact CD1-CD2 4.32Å; I1000-Y1026 HydrophobicContact CD1-CE2 4.09Å; I1000-Y1026 HydrophobicContact CG1-CD2 4.04Å; I1000-Y1026 HydrophobicContact CG1-CE2 3.9Å; Q1004-Y1026 PolarHBondContact NE2-O 3.29Å; E1005-Y1026 HydrophobicContact CG-CE1 4.03Å; E1005-Y1026 WeakPolarHBondContact CG-OH 3.37Å; E1005-Y1026 PolarHBondContact OE1-OH 3.11Å; I1009-Y1026 WeakPolarHBondContact CD1-OH 3.45Å; Y1024-Y1026 HydrophobicContact CE2-CD2 4.23Å; Y1026-T1028 HydrophobicContact CE1-CG2 4.05Å; Y1026-G1179 VanDerWaalsContact CA-O 3.3Å; Y1026-G1179 WeakPolarHBondContact CA-O 3.3Å; Y1026-N1180 HydrophobicContact CE1-CB 4.07Å; Y1026-N1180 HydrophobicContact CE2-CB 4.35Å; Y1026-I1181 HydrophobicContact CE2-CB 4.5Å; Y1026-I1181 PolarHBondContact OH-N 2.84Å
1027	I	96.9	Very high	90.9	Very high	24 Å²	24	71.4 Å²	71.4	12%	0.123	40%	0.402	C	S	.	.			trans	-133.3	156.6	173.8	50.3	160.4	0	0	0	109.8	K1025 E1029 C1031 V1142 G1179 N1180	K1025-I1027 HydrophobicContact CG-CG2 4.36Å; K1025-I1027 PolarHBondContact O-N 3.21Å; I1027-E1029 WeakPolarHBondContact CD1-O 3.39Å; I1027-C1031 HydrophobicContact CD1-CB 4.21Å; I1027-V1142 HydrophobicContact CD1-CG1 3.85Å; I1027-V1142 HydrophobicContact CG1-CG1 4.05Å; I1027-G1179 PolarHBondContact N-O 3.34Å; I1027-N1180 WeakPolarHBondContact O-CA 3.42Å; I1027-N1180 WeakPolarHBondContact O-CB 3.37Å
1028	T	95.4	Very high	91	Very high	53 Å²	53	66.8 Å²	66.8	33%	0.325	37%	0.368	S	S	.	.	S	Bend	trans	-109.7	-15.9	-178.1	52.5	0	0	0	0	114.6	Q1004 E1005 Y1026	Q1004-T1028 HydrophobicContact CB-CG2 3.6Å; E1005-T1028 HydrophobicContact CG-CG2 4.25Å; Y1026-T1028 HydrophobicContact CE1-CG2 4.05Å
1029	E	93.9	Very high	91	Very high	156 Å²	156	65.9 Å²	65.9	73%	0.729	37%	0.365	S	S	*	.	S	Bend	trans	-131.8	148.1	177.6	-65	-179	-176	0	0	108.6	I1027 C1031 V1142	I1027-E1029 WeakPolarHBondContact CD1-O 3.39Å; E1029-C1031 PolarHBondContact O-N 3.29Å; E1029-V1142 VanDerWaalsContact C-CG1 3.5Å
1030	N	95.2	Very high	91	Very high	36 Å²	36	70.2 Å²	70.2	19%	0.193	37%	0.371	C	S	.	.			trans	-58.8	133.8	-177.5	-75.8	-55	0	0	0	112.6	E1140 V1142 G1143 I1145	N1030-E1140 PolarHBondContact ND2-OE1 3.4Å; N1030-V1142 VanDerWaalsContact OD1-CA 3.31Å; N1030-V1142 WeakPolarHBondContact OD1-CA 3.48Å; N1030-G1143 WeakPolarHBondContact CA-O 2.93Å; N1030-G1143 PolarHBondContact OD1-N 3.18Å; N1030-G1143 PolarHBondContact OD1-O 2.93Å; N1030-I1145 HydrophobicContact CB-CD1 3.79Å; N1030-I1145 HydrophobicContact CB-CG1 4.09Å
1031	C	93.8	Very high	90.8	Very high	33 Å²	33	71 Å²	71	22%	0.223	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-104.7	163.9	178.7	69.8	0	0	0	0	112.3	I1027 E1029 G1143 I1145	I1027-C1031 HydrophobicContact CD1-CB 4.21Å; E1029-C1031 PolarHBondContact O-N 3.29Å; C1031-G1143 PolarHBondContact N-O 3.27Å; C1031-I1145 PolarHBondContact O-N 3.27Å
1032	V	92.1	Very high	90.5	Very high	71 Å²	71	74.2 Å²	74.2	43%	0.43	39%	0.391	S	S	.	.			trans	-131.3	133.8	173.4	-72.5	0	0	0	0	109.6	M1036 I1145	V1032-M1036 HydrophobicContact CB-CG 4.41Å; V1032-M1036 HydrophobicContact CG1-CB 4.05Å; V1032-M1036 HydrophobicContact CG1-CG 3.75Å; V1032-I1145 HydrophobicContact CG1-CB 4.03Å
1033	T	88.3	Confident	90.4	Very high	75 Å²	75	72.7 Å²	72.7	46%	0.46	39%	0.387	S	S	.	.	S	Bend	trans	-97.7	-44.5	176.2	47.9	0	0	0	0	110.9	E1144 Y1178	T1033-E1144 WeakPolarHBondContact CB-OE1 3.26Å; T1033-E1144 HydrophobicContact CG2-CG 3.88Å; T1033-E1144 WeakPolarHBondContact CG2-OE1 3.31Å; T1033-E1144 PolarHBondContact OG1-OE1 3.06Å; T1033-Y1178 HydrophobicContact CG2-CE2 4.27Å
1034	S	85.8	Confident	90.2	Very high	61 Å²	61	74.4 Å²	74.4	43%	0.427	39%	0.392	S	S	.	.	S	Bend	trans	-89.9	146.8	168.4	-71.6	0	0	0	0	111.3	M1036	S1034-M1036 PolarHBondContact O-N 3.21Å
1035	P	80.8	Confident	90.1	Very high	135 Å²	135	73.5 Å²	73.5	88%	0.877	39%	0.389	S	S	*	.			trans	-67.9	95.7	-177.6	-21.7	34.6	0	0	0	113.9
1036	M	83.4	Confident	90.1	Very high	40 Å²	40	74 Å²	74	20%	0.197	39%	0.393	C	S	.	.			trans	-81.9	133.4	173.9	-59.8	-54.7	179.8	0	0	111.7	V1032 S1034 I1038 I1145 Y1171 F1207	V1032-M1036 HydrophobicContact CB-CG 4.41Å; V1032-M1036 HydrophobicContact CG1-CB 4.05Å; V1032-M1036 HydrophobicContact CG1-CG 3.75Å; S1034-M1036 PolarHBondContact O-N 3.21Å; M1036-I1038 HydrophobicContact CB-CG1 4.04Å; M1036-I1038 PolarHBondContact O-N 2.94Å; M1036-I1145 HydrophobicContact CG-CG2 4.42Å; M1036-Y1171 HydrophobicContact CE-CD1 4.42Å; M1036-Y1171 HydrophobicContact CE-CE1 4.25Å; M1036-Y1171 HydrophobicContact SD-CD1 4.42Å; M1036-Y1171 HydrophobicContact SD-CE1 3.82Å; M1036-F1207 HydrophobicContact CB-CZ 4.33Å
1037	N	85.8	Confident	90	Very high	113 Å²	113	79.3 Å²	79.3	60%	0.604	41%	0.414	S	S	*	.			trans	-84.1	50.9	-179.3	68.6	-11.8	0	0	0	112.8	D1039 R1206	N1037-D1039 PolarHBondContact O-N 2.97Å; N1037-R1206 PolarHBondContact O-NH2 3.03Å; N1037-R1206 PolarHBondContact OD1-NH1 3Å; N1037-R1206 PolarHBondContact OD1-NH2 3.06Å
1038	I	88.3	Confident	90	Very high	22 Å²	22	78.2 Å²	78.2	11%	0.113	41%	0.409	C	S	.	.			trans	-60.4	122.8	177.5	-50.4	179.5	0	0	0	109.3	M1036 R1040 D1204 F1207	M1036-I1038 HydrophobicContact CB-CG1 4.04Å; M1036-I1038 PolarHBondContact O-N 2.94Å; I1038-R1040 HydrophobicContact CG2-CG 4.21Å; I1038-R1040 PolarHBondContact O-N 3.5Å; I1038-D1204 WeakPolarHBondContact CA-OD2 3.2Å; I1038-D1204 HydrophobicContact CG2-CB 4.37Å; I1038-F1207 HydrophobicContact CB-CD2 4.13Å; I1038-F1207 HydrophobicContact CB-CE2 4.31Å; I1038-F1207 HydrophobicContact CG1-CD2 3.72Å; I1038-F1207 HydrophobicContact CG1-CE2 3.77Å; I1038-F1207 HydrophobicContact CG1-CG 4.17Å; I1038-F1207 HydrophobicContact CG1-CZ 4.28Å; I1038-F1207 HydrophobicContact CG2-CD2 3.99Å
1039	D	89.1	Confident	90	Very high	61 Å²	61	80.8 Å²	80.8	33%	0.326	42%	0.424	S	S	.	.			trans	-70.5	105	177.5	-173.3	6.7	0	0	0	111.2	N1037 N1041 H1044 H1202 D1204	N1037-D1039 PolarHBondContact O-N 2.97Å; D1039-N1041 VanDerWaalsContact OD1-CB 3.27Å; D1039-N1041 WeakPolarHBondContact OD1-CB 2.9Å; D1039-N1041 PolarHBondContact OD1-N 2.75Å; D1039-H1044 IonicContact OD1-ND1 2.74Å; D1039-H1044 PolarHBondContact OD1-ND1 3.4Å; D1039-H1044 IonicContact OD2-CE1 3.73Å; D1039-H1044 IonicContact OD2-CG 2.64Å; D1039-H1044 IonicContact OD2-ND1 3.47Å; D1039-H1044 PolarHBondContact OD2-ND1 3.3Å; D1039-H1202 WeakPolarHBondContact O-CB 3.01Å; D1039-D1204 HydrophobicContact CB-CB 4.12Å; D1039-D1204 PolarHBondContact N-OD2 3.23Å
1040	R	89.4	Confident	90	Very high	177 Å²	177	74 Å²	74	67%	0.668	39%	0.393	S	S	*	.			trans	-109.3	18	177.5	-65.1	178.4	175.7	-164.2	-4.6	112	I1038 I1042	I1038-R1040 HydrophobicContact CG2-CG 4.21Å; I1038-R1040 PolarHBondContact O-N 3.5Å; R1040-I1042 PolarHBondContact O-N 3.46Å
1041	N	85.8	Confident	89.8	Confident	61 Å²	61	80.1 Å²	80.1	33%	0.326	42%	0.418	S	S	.	.			trans	-71.2	116	176.8	-176.5	10.2	0	0	0	111	D1039 T1043 H1044	D1039-N1041 VanDerWaalsContact OD1-CB 3.27Å; D1039-N1041 WeakPolarHBondContact OD1-CB 2.9Å; D1039-N1041 PolarHBondContact OD1-N 2.75Å; N1041-T1043 PolarHBondContact ND2-OG1 3.28Å; N1041-T1043 PolarHBondContact O-N 3.09Å; N1041-T1043 VanDerWaalsContact O-N 3.11Å; N1041-T1043 PolarHBondContact OD1-N 3.32Å; N1041-T1043 VanDerWaalsContact OD1-N 3.1Å; N1041-T1043 PolarHBondContact OD1-OG1 3.48Å; N1041-H1044 HydrophobicContact CB-CB 4.45Å; N1041-H1044 PolarHBondContact ND2-CD2 3.11Å; N1041-H1044 VanDerWaalsContact ND2-CD2 3.32Å; N1041-H1044 PolarHBondContact ND2-CE1 2.85Å; N1041-H1044 PolarHBondContact ND2-NE2 3.45Å; N1041-H1044 PolarHBondContact O-N 2.97Å
1042	I	84.3	Confident	89.5	Confident	89 Å²	89	84.7 Å²	84.7	46%	0.456	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-27.1	177.6	-167.5	170.9	0	0	0	113.2	R1040 H1044 L1045 A1094	R1040-I1042 PolarHBondContact O-N 3.46Å; I1042-H1044 VanDerWaalsContact C-N 3.3Å; I1042-H1044 PolarHBondContact O-N 3.49Å; I1042-L1045 HydrophobicContact CG1-CD1 4.44Å; I1042-L1045 PolarHBondContact O-N 2.75Å; I1042-A1094 HydrophobicContact CG1-CB 4.2Å
1043	T	88	Confident	89.6	Confident	110 Å²	110	84.3 Å²	84.3	68%	0.675	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-9.1	178.3	75	0	0	0	0	113.9	N1041	N1041-T1043 PolarHBondContact ND2-OG1 3.28Å; N1041-T1043 PolarHBondContact O-N 3.09Å; N1041-T1043 VanDerWaalsContact O-N 3.11Å; N1041-T1043 PolarHBondContact OD1-N 3.32Å; N1041-T1043 VanDerWaalsContact OD1-N 3.1Å; N1041-T1043 PolarHBondContact OD1-OG1 3.48Å
1044	H	89.3	Confident	89.9	Confident	110 Å²	110	80.8 Å²	80.8	51%	0.509	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-14.4	174.1	-60.1	170.4	0	0	0	112.3	D1039 N1041 I1042 Q1046	D1039-H1044 IonicContact OD1-ND1 2.74Å; D1039-H1044 PolarHBondContact OD1-ND1 3.4Å; D1039-H1044 IonicContact OD2-CE1 3.73Å; D1039-H1044 IonicContact OD2-CG 2.64Å; D1039-H1044 IonicContact OD2-ND1 3.47Å; D1039-H1044 PolarHBondContact OD2-ND1 3.3Å; N1041-H1044 HydrophobicContact CB-CB 4.45Å; N1041-H1044 PolarHBondContact ND2-CD2 3.11Å; N1041-H1044 VanDerWaalsContact ND2-CD2 3.32Å; N1041-H1044 PolarHBondContact ND2-CE1 2.85Å; N1041-H1044 PolarHBondContact ND2-NE2 3.45Å; N1041-H1044 PolarHBondContact O-N 2.97Å; I1042-H1044 VanDerWaalsContact C-N 3.3Å; I1042-H1044 PolarHBondContact O-N 3.49Å; H1044-Q1046 PolarHBondContact O-N 3.28Å
1045	L	92.9	Very high	90.2	Very high	13 Å²	13	80.1 Å²	80.1	7%	0.068	41%	0.405	C	S	.	.			trans	-63.9	121.1	172.6	-73.4	177.5	0	0	0	110.9	I1042 Y1047 N1092 H1093 A1094 Q1203	I1042-L1045 HydrophobicContact CG1-CD1 4.44Å; I1042-L1045 PolarHBondContact O-N 2.75Å; L1045-Y1047 WeakPolarHBondContact O-CD1 3.31Å; L1045-N1092 HydrophobicContact CD1-CB 4.24Å; L1045-N1092 HydrophobicContact CD2-CB 4.45Å; L1045-H1093 VanDerWaalsContact CD1-CE1 3.45Å; L1045-H1093 WeakPolarHBondContact CD1-CE1 3.37Å; L1045-A1094 HydrophobicContact CB-CB 4.22Å; L1045-A1094 HydrophobicContact CD1-CB 4.28Å; L1045-Q1203 HydrophobicContact CD2-CB 4.26Å; L1045-Q1203 HydrophobicContact CD2-CG 3.84Å
1046	Q	96	Very high	90.6	Very high	105 Å²	105	76.8 Å²	76.8	49%	0.491	38%	0.383	S	S	.	.			trans	-77.4	127	165.9	-56.5	-178	6.6	0	0	108.8	H1044 L1064 N1092 Q1203	H1044-Q1046 PolarHBondContact O-N 3.28Å; Q1046-L1064 HydrophobicContact CB-CD1 3.71Å; Q1046-L1064 VanDerWaalsContact OE1-CD1 3.3Å; Q1046-N1092 PolarHBondContact O-ND2 2.85Å; Q1046-Q1203 PolarHBondContact O-NE2 2.18Å
1047	Y	96.7	Very high	90.8	Very high	120 Å²	120	80.1 Å²	80.1	47%	0.471	41%	0.41	S	S	.	.			trans	-134.3	161.5	-168.4	66.9	-93.6	0	0	0	112.6	L1045 V1049 A1094	L1045-Y1047 WeakPolarHBondContact O-CD1 3.31Å; Y1047-V1049 HydrophobicContact CD2-CG1 4.42Å; Y1047-V1049 HydrophobicContact CE2-CG1 3.93Å; Y1047-A1094 HydrophobicContact CD1-CB 4.07Å; Y1047-A1094 WeakPolarHBondContact CD2-O 3.25Å; Y1047-A1094 HydrophobicContact CG-CB 4.11Å
1048	C	96.1	Very high	91	Very high	2 Å²	2	81 Å²	81	1%	0.014	41%	0.413	C	S	.	.			trans	-102	145.3	174	69.2	0	0	0	0	112.2	C1050 M1060 C1091 C1095 S1096	C1048-C1050 VanDerWaalsContact C-N 3.28Å; C1048-C1050 HydrophobicContact CB-CB 4.48Å; C1048-M1060 HydrophobicContact CB-CB 3.99Å; C1048-C1091 VanDerWaalsContact SG-SG 3.69Å; C1048-C1095 PolarHBondContact N-SG 3Å; C1048-C1095 VanDerWaalsContact N-SG 3.39Å; C1048-C1095 WeakPolarHBondContact O-CA 3.17Å; C1048-S1096 PolarHBondContact O-N 3.42Å
1049	V	96.3	Very high	91.4	Very high	106 Å²	106	80 Å²	80	64%	0.642	41%	0.408	S	S	*	.			trans	-94.2	24.5	172.9	-64.1	0	0	0	0	112.4	Y1047 K1051	Y1047-V1049 HydrophobicContact CD2-CG1 4.42Å; Y1047-V1049 HydrophobicContact CE2-CG1 3.93Å; V1049-K1051 PolarHBondContact O-N 3.17Å
1050	C	93.4	Very high	91.7	Very high	13 Å²	13	81 Å²	81	9%	0.088	41%	0.412	C	S	.	.			trans	-66.7	128.2	179.2	-66.4	0	0	0	0	110.9	C1048 C1054 S1096 C1097	C1048-C1050 VanDerWaalsContact C-N 3.28Å; C1048-C1050 HydrophobicContact CB-CB 4.48Å; C1050-C1054 VanDerWaalsContact CB-SG 3.58Å; C1050-S1096 CarbonylContact O-C 3.59Å; C1050-C1097 HydrophobicContact CB-CB 4.2Å; C1050-C1097 VanDerWaalsContact O-CA 3.29Å; C1050-C1097 WeakPolarHBondContact O-CA 3.3Å; C1050-C1097 WeakPolarHBondContact O-CB 3.47Å; C1050-C1097 PolarHBondContact O-N 3.06Å
1051	K	90.4	Very high	92.1	Very high	166 Å²	166	72.5 Å²	72.5	72%	0.722	38%	0.38	S	S	*	.	S	Bend	trans	-85.3	-31.7	172.2	-60.3	-177	-179.9	-178.4	0	112.2	V1049 W1098	V1049-K1051 PolarHBondContact O-N 3.17Å; K1051-W1098 PolarHBondContact O-NE1 3.26Å
1052	E	88.4	Confident	92.4	Very high	128 Å²	128	69.8 Å²	69.8	60%	0.598	37%	0.366	S	S	*	.	S	Bend	trans	-84.3	-173.3	179.6	-49.8	-45.6	130	0	0	112.8	C1054	E1052-C1054 PolarHBondContact O-N 3.09Å
1053	D	93.2	Very high	92.9	Very high	64 Å²	64	70 Å²	70	34%	0.342	37%	0.365	S	S	.	.			trans	-66.5	12.7	-178.2	81.3	-24.8	0	0	0	116.1	S1055 C1101 K1102	D1053-S1055 PolarHBondContact O-N 2.93Å; D1053-S1055 WeakPolarHBondContact OD1-CB 3.47Å; D1053-S1055 PolarHBondContact OD1-N 3.21Å; D1053-S1055 PolarHBondContact OD1-OG 3Å; D1053-S1055 VanDerWaalsContact OD1-OG 3.13Å; D1053-S1055 PolarHBondContact OD2-OG 3.11Å; D1053-C1101 CarbonylContact O-C 3.55Å; D1053-C1101 WeakPolarHBondContact O-CA 3.39Å; D1053-C1101 WeakPolarHBondContact O-CB 3.44Å; D1053-K1102 HydrophobicContact CB-CG 4.26Å; D1053-K1102 WeakPolarHBondContact O-CB 3.42Å; D1053-K1102 PolarHBondContact O-N 3.15Å; D1053-K1102 VanDerWaalsContact OD2-CG 3.23Å; D1053-K1102 WeakPolarHBondContact OD2-CG 3.37Å
1054	C	94.8	Very high	93.3	Very high	0 Å²	0	67 Å²	67	0%	0	35%	0.345	C	S	.	.	S	Bend	trans	60	13.8	-174	-65.8	0	0	0	0	116.3	C1050 E1052 T1056 C1059 R1068 C1091 C1097 C1101 N1103	C1050-C1054 VanDerWaalsContact CB-SG 3.58Å; E1052-C1054 PolarHBondContact O-N 3.09Å; C1054-T1056 PolarHBondContact O-N 2.93Å; C1054-C1059 HydrophobicContact CB-CB 4.44Å; C1054-R1068 VanDerWaalsContact O-CD 3.31Å; C1054-R1068 WeakPolarHBondContact O-CD 3.48Å; C1054-C1091 VanDerWaalsContact SG-SG 3.65Å; C1054-C1097 WeakPolarHBondContact SG-CB 3.17Å; C1054-C1097 PolarHBondContact SG-SG 2.87Å; C1054-C1101 HydrophobicContact CB-CB 4.05Å; C1054-N1103 HydrophobicContact CB-CB 4.28Å
1055	S	91.9	Very high	93.5	Very high	47 Å²	47	61.9 Å²	61.9	33%	0.329	32%	0.321	S	S	.	.			trans	-68.9	-11.4	177	-72.7	0	0	0	0	114.7	D1053	D1053-S1055 PolarHBondContact O-N 2.93Å; D1053-S1055 WeakPolarHBondContact OD1-CB 3.47Å; D1053-S1055 PolarHBondContact OD1-N 3.21Å; D1053-S1055 PolarHBondContact OD1-OG 3Å; D1053-S1055 VanDerWaalsContact OD1-OG 3.13Å; D1053-S1055 PolarHBondContact OD2-OG 3.11Å
1056	T	88.6	Confident	93.5	Very high	66 Å²	66	67.9 Å²	67.9	41%	0.405	35%	0.353	S	S	.	.	S	Bend	trans	-87	149.3	-174.6	55.3	0	0	0	0	113.8	C1054 I1058 C1059	C1054-T1056 PolarHBondContact O-N 2.93Å; T1056-I1058 PolarHBondContact O-N 3.46Å; T1056-I1058 VanDerWaalsContact O-N 3.12Å; T1056-I1058 WeakPolarHBondContact OG1-CG1 3.48Å; T1056-C1059 VanDerWaalsContact O-CB 3.29Å; T1056-C1059 WeakPolarHBondContact O-CB 3.11Å; T1056-C1059 PolarHBondContact O-N 3.1Å; T1056-C1059 VanDerWaalsContact O-N 3.07Å
1057	S	88.4	Confident	93.4	Very high	110 Å²	110	67 Å²	67	77%	0.769	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-10.9	178.8	51.7	0	0	0	0	114.9	C1059 Q1063	S1057-C1059 VanDerWaalsContact C-N 3.28Å; S1057-Q1063 PolarHBondContact O-NE2 3.49Å
1058	I	90.6	Very high	93.2	Very high	131 Å²	131	63.3 Å²	63.3	67%	0.672	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	0.8	172.7	62.8	168.6	0	0	0	113.4	T1056 M1060	T1056-I1058 PolarHBondContact O-N 3.46Å; T1056-I1058 VanDerWaalsContact O-N 3.12Å; T1056-I1058 WeakPolarHBondContact OG1-CG1 3.48Å; I1058-M1060 PolarHBondContact O-N 2.89Å
1059	C	95.6	Very high	93.2	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.007	33%	0.333	C	S	.	.			trans	-71.6	108.7	176.7	-177.3	0	0	0	0	111	C1054 T1056 S1057 C1061 G1062 Q1063	C1054-C1059 HydrophobicContact CB-CB 4.44Å; T1056-C1059 VanDerWaalsContact O-CB 3.29Å; T1056-C1059 WeakPolarHBondContact O-CB 3.11Å; T1056-C1059 PolarHBondContact O-N 3.1Å; T1056-C1059 VanDerWaalsContact O-N 3.07Å; S1057-C1059 VanDerWaalsContact C-N 3.28Å; C1059-C1061 VanDerWaalsContact C-N 3.33Å; C1059-C1061 PolarHBondContact O-N 3.37Å; C1059-G1062 WeakPolarHBondContact O-CA 3.33Å; C1059-G1062 PolarHBondContact O-N 3.14Å; C1059-Q1063 PolarHBondContact O-N 3.04Å
1060	M	95.9	Very high	93.2	Very high	81 Å²	81	59.2 Å²	59.2	40%	0.399	30%	0.303	S	S	.	.	H	α-helix	trans	-48.4	-49.5	179.5	-175.8	58.4	65.6	0	0	112.7	C1048 I1058 G1062 Q1063 L1064	C1048-M1060 HydrophobicContact CB-CB 3.99Å; I1058-M1060 PolarHBondContact O-N 2.89Å; M1060-G1062 PolarHBondContact O-N 3.29Å; M1060-Q1063 CarbonylContact O-C 3.59Å; M1060-Q1063 WeakPolarHBondContact O-CA 3.45Å; M1060-Q1063 WeakPolarHBondContact O-CB 3.32Å; M1060-Q1063 PolarHBondContact O-N 2.91Å; M1060-L1064 WeakPolarHBondContact O-CG 3.41Å; M1060-L1064 PolarHBondContact O-N 3.29Å; M1060-L1064 HydrophobicContact SD-CD2 4.37Å
1061	C	96.5	Very high	93.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.9	-34.5	179.1	-51.3	0	0	0	0	112.8	C1059 S1065 F1089 N1103	C1059-C1061 VanDerWaalsContact C-N 3.33Å; C1059-C1061 PolarHBondContact O-N 3.37Å; C1061-S1065 PolarHBondContact O-N 2.88Å; C1061-S1065 PolarHBondContact O-OG 3.33Å; C1061-F1089 WeakPolarHBondContact CB-O 3.23Å; C1061-N1103 WeakPolarHBondContact CB-ND2 3.23Å
1062	G	94.1	Very high	93.3	Very high	3 Å²	3	60.8 Å²	60.8	3%	0.031	31%	0.31	C	S	.	.	H	α-helix	trans	-67.4	-39.4	170.4	0	0	0	0	0	112.6	C1059 M1060 S1065 L1066 R1067	C1059-G1062 WeakPolarHBondContact O-CA 3.33Å; C1059-G1062 PolarHBondContact O-N 3.14Å; M1060-G1062 PolarHBondContact O-N 3.29Å; G1062-S1065 CarbonylContact O-C 3.57Å; G1062-S1065 WeakPolarHBondContact O-CA 3.11Å; G1062-S1065 WeakPolarHBondContact O-CB 3.47Å; G1062-S1065 PolarHBondContact O-N 2.81Å; G1062-S1065 VanDerWaalsContact O-N 3.14Å; G1062-L1066 CarbonylContact O-C 3.58Å; G1062-L1066 VanDerWaalsContact O-C 3.3Å; G1062-L1066 PolarHBondContact O-N 2.69Å; G1062-R1067 CarbonylContact O-C 3.5Å; G1062-R1067 WeakPolarHBondContact O-CA 3.46Å; G1062-R1067 PolarHBondContact O-N 2.86Å
1063	Q	94.3	Very high	93.4	Very high	93 Å²	93	58.5 Å²	58.5	44%	0.435	31%	0.308	S	S	.	.	H	α-helix	trans	-68.5	-35.8	178	-64.9	174	-9.4	0	0	112.9	S1057 C1059 M1060 S1065 L1066	S1057-Q1063 PolarHBondContact O-NE2 3.49Å; C1059-Q1063 PolarHBondContact O-N 3.04Å; M1060-Q1063 CarbonylContact O-C 3.59Å; M1060-Q1063 WeakPolarHBondContact O-CA 3.45Å; M1060-Q1063 WeakPolarHBondContact O-CB 3.32Å; M1060-Q1063 PolarHBondContact O-N 2.91Å; Q1063-S1065 PolarHBondContact O-N 3.15Å; Q1063-L1066 WeakPolarHBondContact O-CA 3.32Å; Q1063-L1066 PolarHBondContact O-N 3.24Å
1064	L	95.4	Very high	93.5	Very high	49 Å²	49	56.1 Å²	56.1	26%	0.257	30%	0.299	S	S	.	.	H	α-helix	trans	-60.7	-30	170.2	-59.9	-180	0	0	0	112	Q1046 M1060 L1066 F1089	Q1046-L1064 HydrophobicContact CB-CD1 3.71Å; Q1046-L1064 VanDerWaalsContact OE1-CD1 3.3Å; M1060-L1064 WeakPolarHBondContact O-CG 3.41Å; M1060-L1064 PolarHBondContact O-N 3.29Å; M1060-L1064 HydrophobicContact SD-CD2 4.37Å; L1064-L1066 VanDerWaalsContact C-N 3.26Å; L1064-L1066 PolarHBondContact O-N 3.19Å; L1064-F1089 HydrophobicContact CB-CB 3.99Å; L1064-F1089 HydrophobicContact CB-CD2 3.58Å; L1064-F1089 HydrophobicContact CB-CE2 4.22Å; L1064-F1089 HydrophobicContact CB-CG 3.79Å; L1064-F1089 HydrophobicContact CD1-CB 4.29Å; L1064-F1089 HydrophobicContact CD1-CD1 4.35Å; L1064-F1089 HydrophobicContact CD1-CG 4.21Å
1065	S	94.2	Very high	93.6	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.007	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	16.2	174.8	-43.5	0	0	0	0	112.4	C1061 G1062 Q1063 R1067 W1069 F1089	C1061-S1065 PolarHBondContact O-N 2.88Å; C1061-S1065 PolarHBondContact O-OG 3.33Å; G1062-S1065 CarbonylContact O-C 3.57Å; G1062-S1065 WeakPolarHBondContact O-CA 3.11Å; G1062-S1065 WeakPolarHBondContact O-CB 3.47Å; G1062-S1065 PolarHBondContact O-N 2.81Å; G1062-S1065 VanDerWaalsContact O-N 3.14Å; Q1063-S1065 PolarHBondContact O-N 3.15Å; S1065-R1067 WeakPolarHBondContact CB-O 3.47Å; S1065-R1067 PolarHBondContact O-N 3.3Å; S1065-W1069 PolarHBondContact O-NE1 3.27Å; S1065-F1089 PolarHBondContact OG-N 3.23Å
1066	L	93	Very high	93.8	Very high	139 Å²	139	55.5 Å²	55.5	73%	0.728	29%	0.294	S	S	*	.	S	Bend	trans	65.8	-53.1	-161.1	-49.5	172.4	0	0	0	113.6	G1062 Q1063 L1064	G1062-L1066 CarbonylContact O-C 3.58Å; G1062-L1066 VanDerWaalsContact O-C 3.3Å; G1062-L1066 PolarHBondContact O-N 2.69Å; Q1063-L1066 WeakPolarHBondContact O-CA 3.32Å; Q1063-L1066 PolarHBondContact O-N 3.24Å; L1064-L1066 VanDerWaalsContact C-N 3.26Å; L1064-L1066 PolarHBondContact O-N 3.19Å
1067	R	92.7	Very high	94.1	Very high	87 Å²	87	54.5 Å²	54.5	33%	0.328	29%	0.285	S	S	.	.	S	Bend	trans	-148.5	165.9	169.8	66	-178.4	-171.1	152.9	13.5	110.5	G1062 S1065 W1069 E1079	G1062-R1067 CarbonylContact O-C 3.5Å; G1062-R1067 WeakPolarHBondContact O-CA 3.46Å; G1062-R1067 PolarHBondContact O-N 2.86Å; S1065-R1067 WeakPolarHBondContact CB-O 3.47Å; S1065-R1067 PolarHBondContact O-N 3.3Å; R1067-W1069 HydrophobicContact CG-CD2 4.02Å; R1067-W1069 HydrophobicContact CG-CE3 4.35Å; R1067-W1069 HydrophobicContact CG-CH2 4.35Å; R1067-W1069 HydrophobicContact CG-CZ2 3.98Å; R1067-W1069 VanDerWaalsContact CZ-CZ3 3.48Å; R1067-W1069 VanDerWaalsContact NH2-CE3 3.34Å; R1067-W1069 PolarHBondContact O-N 2.94Å; R1067-W1069 PolarHBondContact O-NE1 3.06Å; R1067-E1079 IonicContact CZ-OE2 3.87Å; R1067-E1079 IonicContact NH1-OE2 3.56Å; R1067-E1079 PolarHBondContact NH1-OE2 2.97Å; R1067-E1079 IonicContact NH2-OE2 2.79Å; R1067-E1079 PolarHBondContact NH2-OE2 2.83Å
1068	R	93.3	Very high	94.3	Very high	42 Å²	42	54.6 Å²	54.6	16%	0.158	28%	0.284	C	S	.	.			trans	-66.2	107.3	168.6	-170.2	-174.5	75.3	79.5	14.3	109.1	C1054 Y1070 D1071 K1102 N1103	C1054-R1068 VanDerWaalsContact O-CD 3.31Å; C1054-R1068 WeakPolarHBondContact O-CD 3.48Å; R1068-Y1070 PolarHBondContact NH1-O 3.45Å; R1068-Y1070 PolarHBondContact NH2-O 3.48Å; R1068-D1071 PolarHBondContact NH1-O 3.43Å; R1068-D1071 PolarHBondContact NH2-O 3.23Å; R1068-K1102 WeakPolarHBondContact CD-O 3.32Å; R1068-K1102 PolarHBondContact NH1-O 2.72Å; R1068-N1103 HydrophobicContact CG-CB 4.39Å
1069	W	96.3	Very high	94.4	Very high	23 Å²	23	53.8 Å²	53.8	9%	0.087	28%	0.277	C	S	.	.			trans	-81.5	-16.8	-174.9	-72.2	106.5	0	0	0	115.3	S1065 R1067 L1076 L1077 E1079 F1080 P1086	S1065-W1069 PolarHBondContact O-NE1 3.27Å; R1067-W1069 HydrophobicContact CG-CD2 4.02Å; R1067-W1069 HydrophobicContact CG-CE3 4.35Å; R1067-W1069 HydrophobicContact CG-CH2 4.35Å; R1067-W1069 HydrophobicContact CG-CZ2 3.98Å; R1067-W1069 VanDerWaalsContact CZ-CZ3 3.48Å; R1067-W1069 VanDerWaalsContact NH2-CE3 3.34Å; R1067-W1069 PolarHBondContact O-N 2.94Å; R1067-W1069 PolarHBondContact O-NE1 3.06Å; W1069-L1076 HydrophobicContact CB-CD2 3.88Å; W1069-L1076 CarbonylContact O-C 3.06Å; W1069-L1076 WeakPolarHBondContact O-CA 3.49Å; W1069-L1077 WeakPolarHBondContact O-CG 3.37Å; W1069-L1077 PolarHBondContact O-N 2.92Å; W1069-E1079 WeakPolarHBondContact CZ3-O 3.49Å; W1069-F1080 HydrophobicContact CB-CD2 3.78Å; W1069-F1080 HydrophobicContact CB-CE2 4.01Å; W1069-F1080 AromaticContact CD2-CD2 3.48Å; W1069-F1080 HydrophobicContact CD2-CD2 3.48Å; W1069-F1080 VanDerWaalsContact CD2-CD2 3.48Å; W1069-F1080 AromaticContact CD2-CE2 3.99Å; W1069-F1080 HydrophobicContact CD2-CE2 3.99Å; W1069-F1080 HydrophobicContact CD2-CG 4.5Å; W1069-F1080 HydrophobicContact CE3-CB 3.91Å; W1069-F1080 AromaticContact CE3-CD2 3.5Å; W1069-F1080 HydrophobicContact CE3-CD2 3.5Å; W1069-F1080 VanDerWaalsContact CE3-CD2 3.5Å; W1069-F1080 HydrophobicContact CE3-CE2 4.44Å; W1069-F1080 HydrophobicContact CE3-CG 4.13Å; W1069-F1080 AromaticContact CG-CD2 3.59Å; W1069-F1080 HydrophobicContact CG-CD2 3.59Å; W1069-F1080 AromaticContact CG-CE2 3.75Å; W1069-F1080 HydrophobicContact CG-CE2 3.75Å; W1069-F1080 HydrophobicContact CZ3-CB 4.1Å; W1069-F1080 HydrophobicContact CZ3-CD2 4.22Å; W1069-P1086 HydrophobicContact CZ2-CG 4.14Å
1070	Y	96.9	Very high	94.4	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-75.1	153.6	174.8	-54.3	-60.7	0	0	0	111.6	R1068 C1075 L1076 I1088 E1090 V1105 F1213	R1068-Y1070 PolarHBondContact NH1-O 3.45Å; R1068-Y1070 PolarHBondContact NH2-O 3.48Å; Y1070-C1075 CarbonylContact C-O 3.4Å; Y1070-C1075 VanDerWaalsContact CA-O 3.28Å; Y1070-C1075 WeakPolarHBondContact CA-O 3.42Å; Y1070-L1076 HydrophobicContact CD1-CD2 3.8Å; Y1070-L1076 HydrophobicContact CE1-CD2 3.63Å; Y1070-L1076 HydrophobicContact CE1-CG 4.47Å; Y1070-I1088 HydrophobicContact CE2-CG2 4.02Å; Y1070-E1090 HydrophobicContact CE2-CG 4.45Å; Y1070-E1090 PolarHBondContact OH-OE1 3.4Å; Y1070-V1105 HydrophobicContact CD1-CB 4.18Å; Y1070-V1105 HydrophobicContact CD1-CG1 4.42Å; Y1070-V1105 HydrophobicContact CD1-CG2 3.7Å; Y1070-V1105 HydrophobicContact CD2-CB 4.46Å; Y1070-V1105 HydrophobicContact CD2-CG2 3.75Å; Y1070-V1105 HydrophobicContact CE1-CB 3.9Å; Y1070-V1105 HydrophobicContact CE1-CG1 4.15Å; Y1070-V1105 HydrophobicContact CE1-CG2 3.93Å; Y1070-V1105 HydrophobicContact CE2-CB 4.17Å; Y1070-V1105 HydrophobicContact CE2-CG2 3.96Å; Y1070-V1105 HydrophobicContact CG-CB 4.46Å; Y1070-V1105 HydrophobicContact CG-CG2 3.61Å; Y1070-F1213 AromaticContact CE1-CE1 3.86Å; Y1070-F1213 HydrophobicContact CE1-CE1 3.86Å; Y1070-F1213 AromaticContact CE1-CZ 3.94Å; Y1070-F1213 HydrophobicContact CE1-CZ 3.94Å
1071	D	93.9	Very high	94.2	Very high	45 Å²	45	53.1 Å²	53.1	24%	0.241	28%	0.278	C	S	.	.			trans	-87.2	-148.7	173.4	84.6	-44.9	0	0	0	111	R1068 S1073 G1074 C1075 L1077	R1068-D1071 PolarHBondContact NH1-O 3.43Å; R1068-D1071 PolarHBondContact NH2-O 3.23Å; D1071-S1073 WeakPolarHBondContact OD1-CA 3.18Å; D1071-S1073 PolarHBondContact OD1-N 3.26Å; D1071-S1073 PolarHBondContact OD1-OG 3.04Å; D1071-S1073 WeakPolarHBondContact OD2-CB 3.26Å; D1071-S1073 PolarHBondContact OD2-N 2.81Å; D1071-S1073 PolarHBondContact OD2-OG 3.21Å; D1071-G1074 PolarHBondContact OD1-N 3.42Å; D1071-C1075 PolarHBondContact N-O 3.03Å; D1071-C1075 PolarHBondContact OD1-N 2.93Å; D1071-L1077 HydrophobicContact CB-CD2 4.22Å
1072	K	91.6	Very high	93.8	Very high	166 Å²	166	57.3 Å²	57.3	72%	0.722	29%	0.294	S	S	*	.	S	Bend	trans	-86.4	-22.9	171.4	-68.6	179.7	179.7	175.7	0	113.6	K1102	K1072-K1102 PolarHBondContact O-NZ 3.25Å
1073	S	91.2	Very high	93.5	Very high	80 Å²	80	64.7 Å²	64.7	56%	0.559	33%	0.328	S	S	*	.	S	Bend	trans	-89.2	-25.7	-179	67.2	0	0	0	0	113.9	D1071 C1075	D1071-S1073 WeakPolarHBondContact OD1-CA 3.18Å; D1071-S1073 PolarHBondContact OD1-N 3.26Å; D1071-S1073 PolarHBondContact OD1-OG 3.04Å; D1071-S1073 WeakPolarHBondContact OD2-CB 3.26Å; D1071-S1073 PolarHBondContact OD2-N 2.81Å; D1071-S1073 PolarHBondContact OD2-OG 3.21Å; S1073-C1075 PolarHBondContact OG-SG 3.44Å; S1073-C1075 VanDerWaalsContact OG-SG 3.41Å
1074	G	93.8	Very high	93.2	Very high	15 Å²	15	68.1 Å²	68.1	16%	0.155	34%	0.344	C	S	.	.	S	Bend	trans	113.4	5.6	-176.1	0	0	0	0	0	114.2	D1071 V1105	D1071-G1074 PolarHBondContact OD1-N 3.42Å; G1074-V1105 WeakPolarHBondContact O-CG1 3.43Å
1075	C	96.6	Very high	93.1	Very high	21 Å²	21	67.6 Å²	67.6	14%	0.142	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-86.9	151.9	175.6	-53.8	0	0	0	0	110.7	Y1070 D1071 S1073 G1135 S1136	Y1070-C1075 CarbonylContact C-O 3.4Å; Y1070-C1075 VanDerWaalsContact CA-O 3.28Å; Y1070-C1075 WeakPolarHBondContact CA-O 3.42Å; D1071-C1075 PolarHBondContact N-O 3.03Å; D1071-C1075 PolarHBondContact OD1-N 2.93Å; S1073-C1075 PolarHBondContact OG-SG 3.44Å; S1073-C1075 VanDerWaalsContact OG-SG 3.41Å; C1075-G1135 CarbonylContact C-O 3.42Å; C1075-G1135 VanDerWaalsContact CA-O 3.28Å; C1075-G1135 WeakPolarHBondContact CA-O 3.38Å; C1075-S1136 PolarHBondContact SG-OG 3.4Å
1076	L	97.3	Very high	93.1	Very high	13 Å²	13	68.8 Å²	68.8	7%	0.068	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-66.2	143.2	171.1	-63.5	173.1	0	0	0	111.3	W1069 Y1070 F1080 I1088 G1135 F1194 F1213	W1069-L1076 HydrophobicContact CB-CD2 3.88Å; W1069-L1076 CarbonylContact O-C 3.06Å; W1069-L1076 WeakPolarHBondContact O-CA 3.49Å; Y1070-L1076 HydrophobicContact CD1-CD2 3.8Å; Y1070-L1076 HydrophobicContact CE1-CD2 3.63Å; Y1070-L1076 HydrophobicContact CE1-CG 4.47Å; L1076-F1080 HydrophobicContact CB-CB 4.37Å; L1076-F1080 HydrophobicContact CB-CD2 4.4Å; L1076-F1080 HydrophobicContact CB-CG 4.36Å; L1076-F1080 HydrophobicContact CD1-CD1 4.12Å; L1076-F1080 HydrophobicContact CD1-CD2 4.16Å; L1076-F1080 HydrophobicContact CD1-CE1 4.16Å; L1076-F1080 HydrophobicContact CD1-CE2 4.19Å; L1076-F1080 HydrophobicContact CD1-CG 4.15Å; L1076-F1080 HydrophobicContact CD1-CZ 4.19Å; L1076-F1080 HydrophobicContact CD2-CD2 3.91Å; L1076-F1080 HydrophobicContact CD2-CE2 3.94Å; L1076-F1080 HydrophobicContact CG-CD2 4.39Å; L1076-I1088 HydrophobicContact CD2-CD1 3.9Å; L1076-G1135 PolarHBondContact N-O 2.74Å; L1076-F1194 HydrophobicContact CD1-CE2 4.31Å; L1076-F1194 HydrophobicContact CD1-CZ 3.7Å; L1076-F1213 HydrophobicContact CD1-CB 3.82Å; L1076-F1213 HydrophobicContact CD1-CD1 3.54Å; L1076-F1213 HydrophobicContact CD1-CD2 3.9Å; L1076-F1213 HydrophobicContact CD1-CE1 4.04Å; L1076-F1213 HydrophobicContact CD1-CE2 4.36Å; L1076-F1213 HydrophobicContact CD1-CG 3.46Å; L1076-F1213 VanDerWaalsContact CD1-CG 3.46Å; L1076-F1213 HydrophobicContact CD1-CZ 4.43Å; L1076-F1213 HydrophobicContact CD2-CE1 4.28Å; L1076-F1213 HydrophobicContact CG-CD1 3.74Å; L1076-F1213 HydrophobicContact CG-CE1 3.94Å; L1076-F1213 HydrophobicContact CG-CG 4.21Å
1077	L	95.3	Very high	93.2	Very high	44 Å²	44	65 Å²	65	23%	0.23	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-64	146.4	176.4	-70.3	168.6	0	0	0	111.6	W1069 D1071 E1079 F1080	W1069-L1077 WeakPolarHBondContact O-CG 3.37Å; W1069-L1077 PolarHBondContact O-N 2.92Å; D1071-L1077 HydrophobicContact CB-CD2 4.22Å; L1077-E1079 PolarHBondContact O-N 3.46Å; L1077-E1079 VanDerWaalsContact O-N 3.1Å; L1077-F1080 WeakPolarHBondContact O-CB 3.37Å; L1077-F1080 PolarHBondContact O-N 2.91Å
1078	P	92.2	Very high	93.4	Very high	113 Å²	113	60.9 Å²	60.9	73%	0.734	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-27.7	-179.5	-27.2	35.5	0	0	0	115.1	F1080	P1078-F1080 PolarHBondContact O-N 3.26Å
1079	E	92.8	Very high	93.6	Very high	114 Å²	114	60 Å²	60	53%	0.533	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	11.4	177	-33.1	82.4	-113.2	0	0	114.2	R1067 W1069 L1077	R1067-E1079 IonicContact CZ-OE2 3.87Å; R1067-E1079 IonicContact NH1-OE2 3.56Å; R1067-E1079 PolarHBondContact NH1-OE2 2.97Å; R1067-E1079 IonicContact NH2-OE2 2.79Å; R1067-E1079 PolarHBondContact NH2-OE2 2.83Å; W1069-E1079 WeakPolarHBondContact CZ3-O 3.49Å; L1077-E1079 PolarHBondContact O-N 3.46Å; L1077-E1079 VanDerWaalsContact O-N 3.1Å
1080	F	95.1	Very high	93.7	Very high	11 Å²	11	58.9 Å²	58.9	5%	0.048	31%	0.309	C	S	.	.			trans	-72.5	121.4	174.3	-170.4	-80.6	0	0	0	110.4	W1069 L1076 L1077 P1078 R1082 P1085 P1086 I1088 F1194	W1069-F1080 HydrophobicContact CB-CD2 3.78Å; W1069-F1080 HydrophobicContact CB-CE2 4.01Å; W1069-F1080 AromaticContact CD2-CD2 3.48Å; W1069-F1080 HydrophobicContact CD2-CD2 3.48Å; W1069-F1080 VanDerWaalsContact CD2-CD2 3.48Å; W1069-F1080 AromaticContact CD2-CE2 3.99Å; W1069-F1080 HydrophobicContact CD2-CE2 3.99Å; W1069-F1080 HydrophobicContact CD2-CG 4.5Å; W1069-F1080 HydrophobicContact CE3-CB 3.91Å; W1069-F1080 AromaticContact CE3-CD2 3.5Å; W1069-F1080 HydrophobicContact CE3-CD2 3.5Å; W1069-F1080 VanDerWaalsContact CE3-CD2 3.5Å; W1069-F1080 HydrophobicContact CE3-CE2 4.44Å; W1069-F1080 HydrophobicContact CE3-CG 4.13Å; W1069-F1080 AromaticContact CG-CD2 3.59Å; W1069-F1080 HydrophobicContact CG-CD2 3.59Å; W1069-F1080 AromaticContact CG-CE2 3.75Å; W1069-F1080 HydrophobicContact CG-CE2 3.75Å; W1069-F1080 HydrophobicContact CZ3-CB 4.1Å; W1069-F1080 HydrophobicContact CZ3-CD2 4.22Å; L1076-F1080 HydrophobicContact CB-CB 4.37Å; L1076-F1080 HydrophobicContact CB-CD2 4.4Å; L1076-F1080 HydrophobicContact CB-CG 4.36Å; L1076-F1080 HydrophobicContact CD1-CD1 4.12Å; L1076-F1080 HydrophobicContact CD1-CD2 4.16Å; L1076-F1080 HydrophobicContact CD1-CE1 4.16Å; L1076-F1080 HydrophobicContact CD1-CE2 4.19Å; L1076-F1080 HydrophobicContact CD1-CG 4.15Å; L1076-F1080 HydrophobicContact CD1-CZ 4.19Å; L1076-F1080 HydrophobicContact CD2-CD2 3.91Å; L1076-F1080 HydrophobicContact CD2-CE2 3.94Å; L1076-F1080 HydrophobicContact CG-CD2 4.39Å; L1077-F1080 WeakPolarHBondContact O-CB 3.37Å; L1077-F1080 PolarHBondContact O-N 2.91Å; P1078-F1080 PolarHBondContact O-N 3.26Å; F1080-R1082 HydrophobicContact CD1-CG 4.24Å; F1080-R1082 PolarHBondContact O-N 3.05Å; F1080-P1085 HydrophobicContact CE1-CB 3.93Å; F1080-P1085 HydrophobicContact CZ-CB 4.16Å; F1080-P1086 HydrophobicContact CD2-CG 4.48Å; F1080-P1086 HydrophobicContact CE2-CG 3.8Å; F1080-P1086 HydrophobicContact CZ-CG 3.9Å; F1080-I1088 HydrophobicContact CE2-CD1 3.96Å; F1080-I1088 HydrophobicContact CE2-CG1 4.38Å; F1080-I1088 HydrophobicContact CZ-CD1 4.28Å; F1080-F1194 HydrophobicContact CD1-CE2 4.11Å; F1080-F1194 HydrophobicContact CD1-CZ 4.13Å; F1080-F1194 AromaticContact CE1-CE2 3.68Å; F1080-F1194 HydrophobicContact CE1-CE2 3.68Å; F1080-F1194 HydrophobicContact CE1-CZ 4.11Å
1081	C	91.4	Very high	93.7	Very high	57 Å²	57	58.9 Å²	58.9	39%	0.385	31%	0.309	S	S	.	.			trans	-70	127.7	173.5	-177.2	0	0	0	0	110	E1083 E1084 P1085	C1081-E1083 PolarHBondContact SG-OE2 3.06Å; C1081-E1084 PolarHBondContact SG-N 2.9Å; C1081-P1085 WeakPolarHBondContact O-CA 3.23Å
1082	R	88.9	Confident	93.8	Very high	88 Å²	88	56.8 Å²	56.8	33%	0.332	30%	0.298	S	S	.	.	S	Bend	trans	-106.5	-19	-173	-69.2	161.7	49.1	-154.2	-6.3	112.4	F1080 F1194 S1215	F1080-R1082 HydrophobicContact CD1-CG 4.24Å; F1080-R1082 PolarHBondContact O-N 3.05Å; R1082-F1194 HydrophobicContact CB-CD2 4.39Å; R1082-F1194 HydrophobicContact CB-CE2 4.45Å; R1082-F1194 HydrophobicContact CB-CG 4.45Å; R1082-F1194 HydrophobicContact CG-CD1 4.22Å; R1082-F1194 HydrophobicContact CG-CD2 4.42Å; R1082-F1194 HydrophobicContact CG-CE1 3.82Å; R1082-F1194 HydrophobicContact CG-CE2 4.05Å; R1082-F1194 HydrophobicContact CG-CG 4.5Å; R1082-F1194 HydrophobicContact CG-CZ 3.71Å; R1082-S1215 PolarHBondContact NH1-O 2.89Å; R1082-S1215 VanDerWaalsContact NH1-O 3.08Å; R1082-S1215 PolarHBondContact NH2-O 3.27Å; R1082-S1215 PolarHBondContact NH2-OG 2.73Å
1083	E	86.9	Confident	93.8	Very high	158 Å²	158	53.8 Å²	53.8	74%	0.738	29%	0.286	S	S	*	.	S	Bend	trans	-76	-40.4	177.3	-56.8	69.1	-154.1	0	0	110.2	C1081	C1081-E1083 PolarHBondContact SG-OE2 3.06Å
1084	E	88.9	Confident	93.9	Very high	165 Å²	165	51.3 Å²	51.3	77%	0.771	27%	0.271	S	S	*	.	S	Bend	trans	-131.5	81	171.8	-168.7	176.9	-174.6	0	0	109.8	C1081	C1081-E1084 PolarHBondContact SG-N 2.9Å
1085	P	92.8	Very high	93.9	Very high	37 Å²	37	51.3 Å²	51.3	24%	0.24	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-63.5	123.8	-176.2	-27.2	38	0	0	0	113.2	F1080 C1081 F1194 C1196	F1080-P1085 HydrophobicContact CE1-CB 3.93Å; F1080-P1085 HydrophobicContact CZ-CB 4.16Å; C1081-P1085 WeakPolarHBondContact O-CA 3.23Å; P1085-F1194 HydrophobicContact CG-CD2 4.09Å; P1085-F1194 HydrophobicContact CG-CE2 4.4Å; P1085-C1196 HydrophobicContact CB-CB 4.34Å
1086	P	93.8	Very high	93.8	Very high	27 Å²	27	53.9 Å²	53.9	18%	0.175	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-64.4	152.8	172.9	27.2	-35.4	0	0	0	111.7	W1069 F1080 I1088	W1069-P1086 HydrophobicContact CZ2-CG 4.14Å; F1080-P1086 HydrophobicContact CD2-CG 4.48Å; F1080-P1086 HydrophobicContact CE2-CG 3.8Å; F1080-P1086 HydrophobicContact CZ-CG 3.9Å; P1086-I1088 PolarHBondContact O-N 3.37Å
1087	L	94.8	Very high	93.6	Very high	59 Å²	59	53.7 Å²	53.7	31%	0.309	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-63.9	130.7	172.1	-55.1	-179	0	0	0	110	F1089 R1197 F1199	L1087-F1089 HydrophobicContact CB-CE2 3.84Å; L1087-F1089 HydrophobicContact CB-CZ 4.41Å; L1087-F1089 HydrophobicContact CD1-CE2 4.49Å; L1087-F1089 HydrophobicContact CD1-CZ 4.44Å; L1087-R1197 HydrophobicContact CD2-CB 3.62Å; L1087-R1197 HydrophobicContact CD2-CG 4.49Å; L1087-F1199 HydrophobicContact CB-CE2 4.29Å; L1087-F1199 HydrophobicContact CD1-CE2 4.18Å; L1087-F1199 HydrophobicContact CD2-CE2 4.28Å; L1087-F1199 HydrophobicContact CG-CE2 4.48Å
1088	I	97.4	Very high	93.3	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	123.8	175.6	-55.4	177.5	0	0	0	110.2	Y1070 L1076 F1080 P1086 C1196 R1197 V1198 F1199	Y1070-I1088 HydrophobicContact CE2-CG2 4.02Å; L1076-I1088 HydrophobicContact CD2-CD1 3.9Å; F1080-I1088 HydrophobicContact CE2-CD1 3.96Å; F1080-I1088 HydrophobicContact CE2-CG1 4.38Å; F1080-I1088 HydrophobicContact CZ-CD1 4.28Å; P1086-I1088 PolarHBondContact O-N 3.37Å; I1088-C1196 VanDerWaalsContact CD1-SG 3.57Å; I1088-R1197 PolarHBondContact N-O 3.36Å; I1088-V1198 HydrophobicContact CB-CG1 4.31Å; I1088-V1198 HydrophobicContact CB-CG2 4.22Å; I1088-V1198 HydrophobicContact CG2-CG1 4.49Å; I1088-V1198 CarbonylContact O-C 3.56Å; I1088-V1198 VanDerWaalsContact O-CA 3.32Å; I1088-V1198 WeakPolarHBondContact O-CA 3.13Å; I1088-F1199 PolarHBondContact O-N 3.08Å
1089	F	98.1	Very high	93.2	Very high	22 Å²	22	65 Å²	65	10%	0.096	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	100.8	172.5	-64.9	-92	0	0	0	109	C1061 L1064 S1065 L1087 N1103 F1199 Q1203 L1205	C1061-F1089 WeakPolarHBondContact CB-O 3.23Å; L1064-F1089 HydrophobicContact CB-CB 3.99Å; L1064-F1089 HydrophobicContact CB-CD2 3.58Å; L1064-F1089 HydrophobicContact CB-CE2 4.22Å; L1064-F1089 HydrophobicContact CB-CG 3.79Å; L1064-F1089 HydrophobicContact CD1-CB 4.29Å; L1064-F1089 HydrophobicContact CD1-CD1 4.35Å; L1064-F1089 HydrophobicContact CD1-CG 4.21Å; S1065-F1089 PolarHBondContact OG-N 3.23Å; L1087-F1089 HydrophobicContact CB-CE2 3.84Å; L1087-F1089 HydrophobicContact CB-CZ 4.41Å; L1087-F1089 HydrophobicContact CD1-CE2 4.49Å; L1087-F1089 HydrophobicContact CD1-CZ 4.44Å; F1089-N1103 PolarHBondContact O-ND2 3.01Å; F1089-F1199 HydrophobicContact CD1-CB 3.86Å; F1089-F1199 AromaticContact CD1-CD2 3.93Å; F1089-F1199 HydrophobicContact CD1-CD2 3.93Å; F1089-F1199 HydrophobicContact CD1-CG 4.19Å; F1089-F1199 HydrophobicContact CE1-CB 4.13Å; F1089-F1199 AromaticContact CE1-CD2 3.51Å; F1089-F1199 HydrophobicContact CE1-CD2 3.51Å; F1089-F1199 HydrophobicContact CE1-CE2 4.21Å; F1089-F1199 AromaticContact CE1-CG 3.95Å; F1089-F1199 HydrophobicContact CE1-CG 3.95Å; F1089-F1199 HydrophobicContact CE2-CD2 4.38Å; F1089-F1199 AromaticContact CZ-CD2 3.77Å; F1089-F1199 HydrophobicContact CZ-CD2 3.77Å; F1089-F1199 HydrophobicContact CZ-CE2 4.1Å; F1089-Q1203 HydrophobicContact CD1-CG 4.04Å; F1089-Q1203 HydrophobicContact CE1-CG 4.3Å; F1089-L1205 HydrophobicContact CE1-CD2 4.29Å; F1089-L1205 HydrophobicContact CZ-CD2 4.09Å
1090	E	98.1	Very high	93.1	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.321	C	S	.	.			trans	-68.8	160.6	172.3	-65	-154.5	146.3	0	0	110.9	Y1070 N1092 N1103 V1105 V1106 Q1107 V1198 F1199 T1200	Y1070-E1090 HydrophobicContact CE2-CG 4.45Å; Y1070-E1090 PolarHBondContact OH-OE1 3.4Å; E1090-N1092 PolarHBondContact O-N 3.23Å; E1090-N1103 WeakPolarHBondContact CA-ND2 3.21Å; E1090-N1103 WeakPolarHBondContact CA-O 3.46Å; E1090-N1103 WeakPolarHBondContact CB-O 3.42Å; E1090-V1105 WeakPolarHBondContact OE1-CA 3.21Å; E1090-V1105 PolarHBondContact OE1-N 2.88Å; E1090-V1106 PolarHBondContact OE1-N 2.86Å; E1090-Q1107 WeakPolarHBondContact OE2-CB 3.17Å; E1090-Q1107 VanDerWaalsContact OE2-CG 3.23Å; E1090-Q1107 WeakPolarHBondContact OE2-CG 3.43Å; E1090-Q1107 PolarHBondContact OE2-N 2.99Å; E1090-Q1107 VanDerWaalsContact OE2-N 3.14Å; E1090-Q1107 PolarHBondContact OE2-NE2 2.95Å; E1090-V1198 HydrophobicContact CG-CG1 3.82Å; E1090-F1199 PolarHBondContact N-O 3.38Å; E1090-T1200 HydrophobicContact CB-CG2 4.42Å; E1090-T1200 HydrophobicContact CG-CG2 4.38Å
1091	C	97.3	Very high	93.1	Very high	0 Å²	0	65 Å²	65	0%	0	32%	0.32	C	S	.	.			trans	-65.2	127.8	169.6	-74.6	0	0	0	0	109.1	C1048 C1054 C1095 C1097 N1103 R1104 Q1107	C1048-C1091 VanDerWaalsContact SG-SG 3.69Å; C1054-C1091 VanDerWaalsContact SG-SG 3.65Å; C1091-C1095 HydrophobicContact CB-CB 4.44Å; C1091-C1097 VanDerWaalsContact SG-SG 3.61Å; C1091-N1103 PolarHBondContact N-ND2 3.03Å; C1091-N1103 PolarHBondContact N-O 3.38Å; C1091-R1104 HydrophobicContact CB-CG 4.04Å; C1091-R1104 PolarHBondContact O-NH1 2.98Å; C1091-Q1107 PolarHBondContact O-NE2 3.3Å; C1091-Q1107 PolarHBondContact O-OE1 2.94Å
1092	N	95.3	Very high	93.3	Very high	2 Å²	2	66 Å²	66	1%	0.011	32%	0.318	C	S	.	.			trans	-96.2	-159.5	-177.5	59.8	45.3	0	0	0	111.1	L1045 Q1046 E1090 A1094 C1095 R1104 T1200 Q1203	L1045-N1092 HydrophobicContact CD1-CB 4.24Å; L1045-N1092 HydrophobicContact CD2-CB 4.45Å; Q1046-N1092 PolarHBondContact O-ND2 2.85Å; E1090-N1092 PolarHBondContact O-N 3.23Å; N1092-A1094 WeakPolarHBondContact OD1-CA 3.38Å; N1092-A1094 WeakPolarHBondContact OD1-CB 3.39Å; N1092-A1094 PolarHBondContact OD1-N 3.03Å; N1092-C1095 PolarHBondContact N-SG 2.84Å; N1092-C1095 VanDerWaalsContact N-SG 3.42Å; N1092-C1095 PolarHBondContact OD1-N 3.24Å; N1092-C1095 VanDerWaalsContact OD1-N 3.16Å; N1092-C1095 PolarHBondContact OD1-SG 3.04Å; N1092-C1095 VanDerWaalsContact OD1-SG 3.38Å; N1092-R1104 PolarHBondContact O-NH1 3.26Å; N1092-R1104 PolarHBondContact O-NH2 2.92Å; N1092-T1200 WeakPolarHBondContact CA-O 3.4Å; N1092-T1200 WeakPolarHBondContact CB-O 3.33Å; N1092-Q1203 PolarHBondContact ND2-NE2 3.48Å
1093	H	92.3	Very high	93.7	Very high	103 Å²	103	61.8 Å²	61.8	48%	0.477	30%	0.302	S	S	.	.	S	Bend	trans	-94.9	-5.6	-179.6	62.4	-96.5	0	0	0	114.5	L1045 T1201	L1045-H1093 VanDerWaalsContact CD1-CE1 3.45Å; L1045-H1093 WeakPolarHBondContact CD1-CE1 3.37Å; H1093-T1201 PolarHBondContact CE1-O 3.44Å
1094	A	92	Very high	94.1	Very high	28 Å²	28	55.2 Å²	55.2	23%	0.231	27%	0.27	C	S	.	.	S	Bend	trans	-88.7	-17.1	168.9	0	0	0	0	0	112.4	I1042 L1045 Y1047 N1092	I1042-A1094 HydrophobicContact CG1-CB 4.2Å; L1045-A1094 HydrophobicContact CB-CB 4.22Å; L1045-A1094 HydrophobicContact CD1-CB 4.28Å; Y1047-A1094 HydrophobicContact CD1-CB 4.07Å; Y1047-A1094 WeakPolarHBondContact CD2-O 3.25Å; Y1047-A1094 HydrophobicContact CG-CB 4.11Å; N1092-A1094 WeakPolarHBondContact OD1-CA 3.38Å; N1092-A1094 WeakPolarHBondContact OD1-CB 3.39Å; N1092-A1094 PolarHBondContact OD1-N 3.03Å
1095	C	95	Very high	94.5	Very high	14 Å²	14	48 Å²	48	10%	0.095	24%	0.237	C	C	.	.	S	Bend	trans	-61.4	140.7	174.5	-62.9	0	0	0	0	112.7	C1048 C1091 N1092 C1097	C1048-C1095 PolarHBondContact N-SG 3Å; C1048-C1095 VanDerWaalsContact N-SG 3.39Å; C1048-C1095 WeakPolarHBondContact O-CA 3.17Å; C1091-C1095 HydrophobicContact CB-CB 4.44Å; N1092-C1095 PolarHBondContact N-SG 2.84Å; N1092-C1095 VanDerWaalsContact N-SG 3.42Å; N1092-C1095 PolarHBondContact OD1-N 3.24Å; N1092-C1095 VanDerWaalsContact OD1-N 3.16Å; N1092-C1095 PolarHBondContact OD1-SG 3.04Å; N1092-C1095 VanDerWaalsContact OD1-SG 3.38Å; C1095-C1097 VanDerWaalsContact CB-SG 3.52Å; C1095-C1097 PolarHBondContact O-N 3.16Å
1096	S	94.7	Very high	94.7	Very high	76 Å²	76	46.5 Å²	46.5	53%	0.531	23%	0.227	S	C	.	.	S	Bend	trans	-72.9	-6.3	174.4	-46.8	0	0	0	0	113.9	C1048 C1050	C1048-S1096 PolarHBondContact O-N 3.42Å; C1050-S1096 CarbonylContact O-C 3.59Å
1097	C	92.5	Very high	94.7	Very high	9 Å²	9	48.5 Å²	48.5	6%	0.061	23%	0.234	C	C	.	.	S	Bend	trans	-87.5	150.5	-174.8	67.1	0	0	0	0	113.3	C1050 C1054 C1091 C1095 C1101 R1104	C1050-C1097 HydrophobicContact CB-CB 4.2Å; C1050-C1097 VanDerWaalsContact O-CA 3.29Å; C1050-C1097 WeakPolarHBondContact O-CA 3.3Å; C1050-C1097 WeakPolarHBondContact O-CB 3.47Å; C1050-C1097 PolarHBondContact O-N 3.06Å; C1054-C1097 WeakPolarHBondContact SG-CB 3.17Å; C1054-C1097 PolarHBondContact SG-SG 2.87Å; C1091-C1097 VanDerWaalsContact SG-SG 3.61Å; C1095-C1097 VanDerWaalsContact CB-SG 3.52Å; C1095-C1097 PolarHBondContact O-N 3.16Å; C1097-C1101 HydrophobicContact CB-CB 4.29Å; C1097-C1101 VanDerWaalsContact SG-SG 3.61Å; C1097-R1104 PolarHBondContact O-NH2 3.1Å
1098	W	89.7	Confident	94.6	Very high	186 Å²	186	48.6 Å²	48.6	71%	0.705	24%	0.235	S	C	*	.			trans	-59.6	153.4	-178.3	-59.3	85.1	0	0	0	113.2	K1051 T1100 C1101 R1104	K1051-W1098 PolarHBondContact O-NE1 3.26Å; W1098-T1100 PolarHBondContact O-N 3.32Å; W1098-C1101 WeakPolarHBondContact O-CB 3.5Å; W1098-C1101 PolarHBondContact O-N 3.26Å; W1098-C1101 VanDerWaalsContact O-N 3.08Å; W1098-C1101 PolarHBondContact O-SG 2.68Å; W1098-R1104 PolarHBondContact O-NE 3.33Å; W1098-R1104 VanDerWaalsContact O-NE 3.16Å
1099	R	89.4	Confident	94.4	Very high	207 Å²	207	49.8 Å²	49.8	78%	0.781	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-13.7	172.2	-90.5	-173.9	162.7	89.1	1.5	114.2	R1104	R1099-R1104 VanDerWaalsContact O-CD 3.27Å; R1099-R1104 WeakPolarHBondContact O-CD 3.48Å
1100	T	91	Very high	94.2	Very high	122 Å²	122	49 Å²	49	75%	0.748	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.4	6.9	178.1	47.3	0	0	0	0	113.9	W1098	W1098-T1100 PolarHBondContact O-N 3.32Å
1101	C	94.9	Very high	94	Very high	3 Å²	3	56.4 Å²	56.4	2%	0.02	27%	0.273	C	S	.	.	S	Bend	trans	-66.6	149.9	-179.7	78.1	0	0	0	0	112.7	D1053 C1054 C1097 W1098 N1103 R1104	D1053-C1101 CarbonylContact O-C 3.55Å; D1053-C1101 WeakPolarHBondContact O-CA 3.39Å; D1053-C1101 WeakPolarHBondContact O-CB 3.44Å; C1054-C1101 HydrophobicContact CB-CB 4.05Å; C1097-C1101 HydrophobicContact CB-CB 4.29Å; C1097-C1101 VanDerWaalsContact SG-SG 3.61Å; W1098-C1101 WeakPolarHBondContact O-CB 3.5Å; W1098-C1101 PolarHBondContact O-N 3.26Å; W1098-C1101 VanDerWaalsContact O-N 3.08Å; W1098-C1101 PolarHBondContact O-SG 2.68Å; C1101-N1103 PolarHBondContact O-N 3.48Å; C1101-R1104 PolarHBondContact O-N 2.69Å; C1101-R1104 PolarHBondContact SG-NE 2.6Å
1102	K	95.2	Very high	93.9	Very high	79 Å²	79	57 Å²	57	34%	0.343	28%	0.276	S	S	.	.	S	Bend	trans	-72	19.2	-175.2	-59.2	-64.7	-171.6	175.6	0	115.5	D1053 R1068 K1072	D1053-K1102 HydrophobicContact CB-CG 4.26Å; D1053-K1102 WeakPolarHBondContact O-CB 3.42Å; D1053-K1102 PolarHBondContact O-N 3.15Å; D1053-K1102 VanDerWaalsContact OD2-CG 3.23Å; D1053-K1102 WeakPolarHBondContact OD2-CG 3.37Å; R1068-K1102 WeakPolarHBondContact CD-O 3.32Å; R1068-K1102 PolarHBondContact NH1-O 2.72Å; K1072-K1102 PolarHBondContact O-NZ 3.25Å
1103	N	96.8	Very high	94	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	30%	0.302	C	S	.	.	S	Bend	trans	-129.3	40.1	173	-162.5	58.5	0	0	0	110.5	C1054 C1061 R1068 F1089 E1090 C1091 C1101	C1054-N1103 HydrophobicContact CB-CB 4.28Å; C1061-N1103 WeakPolarHBondContact CB-ND2 3.23Å; R1068-N1103 HydrophobicContact CG-CB 4.39Å; F1089-N1103 PolarHBondContact O-ND2 3.01Å; E1090-N1103 WeakPolarHBondContact CA-ND2 3.21Å; E1090-N1103 WeakPolarHBondContact CA-O 3.46Å; E1090-N1103 WeakPolarHBondContact CB-O 3.42Å; C1091-N1103 PolarHBondContact N-ND2 3.03Å; C1091-N1103 PolarHBondContact N-O 3.38Å; C1101-N1103 PolarHBondContact O-N 3.48Å
1104	R	96.3	Very high	94.3	Very high	20 Å²	20	59 Å²	59	8%	0.075	28%	0.279	C	S	.	.			trans	-143.7	104.6	174.7	-60.7	177.4	-170.4	-86.7	-2.5	106.1	C1091 N1092 C1097 W1098 R1099 C1101 Q1107 N1108	C1091-R1104 HydrophobicContact CB-CG 4.04Å; C1091-R1104 PolarHBondContact O-NH1 2.98Å; N1092-R1104 PolarHBondContact O-NH1 3.26Å; N1092-R1104 PolarHBondContact O-NH2 2.92Å; C1097-R1104 PolarHBondContact O-NH2 3.1Å; W1098-R1104 PolarHBondContact O-NE 3.33Å; W1098-R1104 VanDerWaalsContact O-NE 3.16Å; R1099-R1104 VanDerWaalsContact O-CD 3.27Å; R1099-R1104 WeakPolarHBondContact O-CD 3.48Å; C1101-R1104 PolarHBondContact O-N 2.69Å; C1101-R1104 PolarHBondContact SG-NE 2.6Å; R1104-Q1107 HydrophobicContact CB-CG 3.86Å; R1104-Q1107 HydrophobicContact CG-CG 4.31Å; R1104-N1108 PolarHBondContact O-ND2 2.97Å
1105	V	96.9	Very high	94.5	Very high	13 Å²	13	58.6 Å²	58.6	8%	0.079	27%	0.272	C	S	.	.	S	Bend	trans	-131.6	-57.4	-176.3	175	0	0	0	0	109.4	Y1070 G1074 E1090 N1108 F1137	Y1070-V1105 HydrophobicContact CD1-CB 4.18Å; Y1070-V1105 HydrophobicContact CD1-CG1 4.42Å; Y1070-V1105 HydrophobicContact CD1-CG2 3.7Å; Y1070-V1105 HydrophobicContact CD2-CB 4.46Å; Y1070-V1105 HydrophobicContact CD2-CG2 3.75Å; Y1070-V1105 HydrophobicContact CE1-CB 3.9Å; Y1070-V1105 HydrophobicContact CE1-CG1 4.15Å; Y1070-V1105 HydrophobicContact CE1-CG2 3.93Å; Y1070-V1105 HydrophobicContact CE2-CB 4.17Å; Y1070-V1105 HydrophobicContact CE2-CG2 3.96Å; Y1070-V1105 HydrophobicContact CG-CB 4.46Å; Y1070-V1105 HydrophobicContact CG-CG2 3.61Å; G1074-V1105 WeakPolarHBondContact O-CG1 3.43Å; E1090-V1105 WeakPolarHBondContact OE1-CA 3.21Å; E1090-V1105 PolarHBondContact OE1-N 2.88Å; V1105-N1108 WeakPolarHBondContact O-CB 3.46Å; V1105-N1108 PolarHBondContact O-N 2.86Å; V1105-F1137 HydrophobicContact CG1-CB 3.75Å; V1105-F1137 HydrophobicContact CG1-CG 4.4Å
1106	V	96.8	Very high	94.6	Very high	5 Å²	5	58 Å²	58	3%	0.03	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-66.8	-44.8	-179.8	-180	0	0	0	0	110.4	E1090 N1108 G1109 F1137 V1198 A1211 F1213	E1090-V1106 PolarHBondContact OE1-N 2.86Å; V1106-N1108 PolarHBondContact O-N 2.92Å; V1106-G1109 PolarHBondContact O-N 3.18Å; V1106-F1137 HydrophobicContact CB-CE2 4.38Å; V1106-F1137 HydrophobicContact CB-CZ 4.34Å; V1106-F1137 HydrophobicContact CG1-CE2 3.96Å; V1106-F1137 HydrophobicContact CG1-CZ 3.86Å; V1106-F1137 HydrophobicContact CG2-CD2 3.96Å; V1106-F1137 HydrophobicContact CG2-CE2 4.04Å; V1106-F1137 HydrophobicContact CG2-CG 4.33Å; V1106-F1137 HydrophobicContact CG2-CZ 4.46Å; V1106-V1198 HydrophobicContact CB-CG1 4.28Å; V1106-V1198 HydrophobicContact CG2-CG1 4.13Å; V1106-V1198 HydrophobicContact CG2-CG2 4.24Å; V1106-A1211 HydrophobicContact CG1-CB 3.97Å; V1106-A1211 HydrophobicContact CG2-CB 3.74Å; V1106-F1213 HydrophobicContact CG2-CE2 4.45Å; V1106-F1213 HydrophobicContact CG2-CZ 3.84Å
1107	Q	94.2	Very high	94.7	Very high	69 Å²	69	55.4 Å²	55.4	32%	0.322	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-64.6	-3.6	176.9	76.6	-170.9	-113.8	0	0	114.8	E1090 C1091 R1104 T1200	E1090-Q1107 WeakPolarHBondContact OE2-CB 3.17Å; E1090-Q1107 VanDerWaalsContact OE2-CG 3.23Å; E1090-Q1107 WeakPolarHBondContact OE2-CG 3.43Å; E1090-Q1107 PolarHBondContact OE2-N 2.99Å; E1090-Q1107 VanDerWaalsContact OE2-N 3.14Å; E1090-Q1107 PolarHBondContact OE2-NE2 2.95Å; C1091-Q1107 PolarHBondContact O-NE2 3.3Å; C1091-Q1107 PolarHBondContact O-OE1 2.94Å; R1104-Q1107 HydrophobicContact CB-CG 3.86Å; R1104-Q1107 HydrophobicContact CG-CG 4.31Å; Q1107-T1200 HydrophobicContact CB-CG2 4.23Å
1108	N	93.4	Very high	94.9	Very high	61 Å²	61	56.4 Å²	56.4	33%	0.326	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-89.9	-1.5	172.6	-58.1	-34.9	0	0	0	112.8	Q1006 R1104 V1105 V1106	Q1006-N1108 PolarHBondContact NE2-O 3.27Å; R1104-N1108 PolarHBondContact O-ND2 2.97Å; V1105-N1108 WeakPolarHBondContact O-CB 3.46Å; V1105-N1108 PolarHBondContact O-N 2.86Å; V1106-N1108 PolarHBondContact O-N 2.92Å
1109	G	92	Very high	95.1	Very high	26 Å²	26	47.9 Å²	47.9	27%	0.268	22%	0.218	S	C	.	.			trans	75.9	-177.6	176.7	0	0	0	0	0	115.2	V1106 R1111	V1106-G1109 PolarHBondContact O-N 3.18Å; G1109-R1111 PolarHBondContact O-N 3.2Å
1110	L	94.4	Very high	95	Very high	6 Å²	6	41.1 Å²	41.1	3%	0.031	21%	0.214	C	C	.	.			trans	-66	124.9	-177.6	-176.5	152.8	0	0	0	111.2	E1005 V1007 I1009 V1112 L1114 C1139 I1181	E1005-L1110 WeakPolarHBondContact OE2-CB 3.44Å; V1007-L1110 HydrophobicContact CB-CD2 3.92Å; V1007-L1110 HydrophobicContact CG2-CD2 4.41Å; I1009-L1110 HydrophobicContact CD1-CD1 4.03Å; L1110-V1112 VanDerWaalsContact CD2-O 3.31Å; L1110-V1112 WeakPolarHBondContact CD2-O 3.4Å; L1110-L1114 HydrophobicContact CD1-CD1 4.2Å; L1110-C1139 HydrophobicContact CD1-CB 4.1Å; L1110-I1181 HydrophobicContact CD1-CG2 3.85Å
1111	R	93.8	Very high	94.9	Very high	156 Å²	156	39.5 Å²	39.5	59%	0.589	20%	0.2	S	C	*	.			trans	-125.6	-10.6	-177.7	-70.7	175.6	62	-132.2	-4.5	114.5	G1109	G1109-R1111 PolarHBondContact O-N 3.2Å
1112	V	95.4	Very high	94.8	Very high	11 Å²	11	41.8 Å²	41.8	7%	0.067	21%	0.21	C	C	.	.	S	Bend	trans	-86.1	138.1	177.5	-176.4	0	0	0	0	109.1	L1110 L1114 Q1130 I1132	L1110-V1112 VanDerWaalsContact CD2-O 3.31Å; L1110-V1112 WeakPolarHBondContact CD2-O 3.4Å; V1112-L1114 HydrophobicContact CB-CD2 4.23Å; V1112-L1114 HydrophobicContact CB-CG 4.33Å; V1112-L1114 HydrophobicContact CG1-CD2 3.66Å; V1112-L1114 HydrophobicContact CG1-CG 4.24Å; V1112-L1114 PolarHBondContact O-N 3.41Å; V1112-L1114 VanDerWaalsContact O-N 3.14Å; V1112-Q1130 HydrophobicContact CG1-CG 3.88Å; V1112-I1132 HydrophobicContact CG1-CD1 3.72Å; V1112-I1132 HydrophobicContact CG1-CG1 3.8Å
1113	R	97.1	Very high	94.7	Very high	148 Å²	148	39.1 Å²	39.1	56%	0.558	20%	0.204	S	C	*	.			trans	-72.3	103.8	171.8	-67.9	179.2	169.5	-133.1	-5.8	110.4	V1007 L1129 Q1130	V1007-R1113 HydrophobicContact CG1-CB 4.43Å; V1007-R1113 HydrophobicContact CG1-CG 3.81Å; R1113-L1129 HydrophobicContact CB-CB 3.95Å; R1113-L1129 WeakPolarHBondContact O-CB 3.46Å; R1113-L1129 PolarHBondContact O-N 2.74Å; R1113-Q1130 HydrophobicContact CB-CG 4.25Å
1114	L	97.9	Very high	94.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	154.8	178.1	-58	-175.7	0	0	0	111.1	L1110 V1112 V1126 V1138 I1181 L1224	L1110-L1114 HydrophobicContact CD1-CD1 4.2Å; V1112-L1114 HydrophobicContact CB-CD2 4.23Å; V1112-L1114 HydrophobicContact CB-CG 4.33Å; V1112-L1114 HydrophobicContact CG1-CD2 3.66Å; V1112-L1114 HydrophobicContact CG1-CG 4.24Å; V1112-L1114 PolarHBondContact O-N 3.41Å; V1112-L1114 VanDerWaalsContact O-N 3.14Å; L1114-V1126 HydrophobicContact CB-CG1 3.96Å; L1114-V1126 HydrophobicContact CD1-CG1 4.23Å; L1114-V1126 HydrophobicContact CG-CG1 4.47Å; L1114-V1138 HydrophobicContact CD1-CG1 3.89Å; L1114-V1138 HydrophobicContact CD2-CG1 4.34Å; L1114-I1181 HydrophobicContact CB-CD1 3.55Å; L1114-I1181 HydrophobicContact CD1-CD1 3.88Å; L1114-I1181 HydrophobicContact CG-CD1 4.37Å; L1114-L1224 HydrophobicContact CD1-CD1 4.28Å; L1114-L1224 HydrophobicContact CD2-CD1 3.48Å; L1114-L1224 VanDerWaalsContact CD2-CD1 3.48Å
1115	Q	97.6	Very high	94.8	Very high	19 Å²	19	39.4 Å²	39.4	9%	0.089	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	131.4	178.1	174.6	171.2	66.9	0	0	110	P1010 V1012 V1126 R1127 L1129	P1010-Q1115 HydrophobicContact CG-CB 4.16Å; P1010-Q1115 HydrophobicContact CG-CG 4.06Å; V1012-Q1115 VanDerWaalsContact CG1-NE2 3.35Å; V1012-Q1115 HydrophobicContact CG2-CG 4.04Å; Q1115-V1126 CarbonylContact O-C 3.45Å; Q1115-V1126 WeakPolarHBondContact O-CA 3.44Å; Q1115-R1127 HydrophobicContact CB-CG 4.36Å; Q1115-R1127 PolarHBondContact N-O 3.21Å; Q1115-R1127 PolarHBondContact O-N 2.7Å; Q1115-L1129 HydrophobicContact CB-CD1 4.05Å; Q1115-L1129 HydrophobicContact CB-CD2 3.87Å; Q1115-L1129 HydrophobicContact CB-CG 3.89Å
1116	V	97.6	Very high	94.8	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	129.5	166.3	172.9	0	0	0	0	108.2	I1000 I1009 P1010 C1011 V1012 W1124 G1125 V1126 I1181 F1184	I1000-V1116 HydrophobicContact CD1-CB 4.41Å; I1000-V1116 HydrophobicContact CD1-CG2 3.62Å; I1009-V1116 HydrophobicContact CG2-CG2 4.25Å; P1010-V1116 PolarHBondContact O-N 3.38Å; C1011-V1116 CarbonylContact C-O 3.41Å; C1011-V1116 VanDerWaalsContact CA-O 3.28Å; C1011-V1116 WeakPolarHBondContact CA-O 3.44Å; V1012-V1116 PolarHBondContact N-O 2.78Å; V1116-W1124 HydrophobicContact CG1-CE3 3.74Å; V1116-W1124 HydrophobicContact CG1-CZ3 4.37Å; V1116-G1125 CarbonylContact C-O 3.36Å; V1116-G1125 WeakPolarHBondContact CA-O 3.38Å; V1116-V1126 HydrophobicContact CG2-CG2 4.37Å; V1116-I1181 HydrophobicContact CG2-CD1 4.4Å; V1116-I1181 HydrophobicContact CG2-CG1 3.94Å; V1116-F1184 HydrophobicContact CG1-CG 4.43Å; V1116-F1184 HydrophobicContact CG2-CB 4.41Å; V1116-F1184 HydrophobicContact CG2-CD2 3.94Å; V1116-F1184 HydrophobicContact CG2-CG 4.31Å
1117	F	96.3	Very high	94.9	Very high	23 Å²	23	40.4 Å²	40.4	10%	0.101	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	154	-179.5	79.4	-70.6	0	0	0	111.2	V1012 T1119 G1125 R1127 E1223	V1012-F1117 HydrophobicContact CG2-CB 3.59Å; V1012-F1117 CarbonylContact O-C 3.58Å; V1012-F1117 VanDerWaalsContact O-CA 3.32Å; V1012-F1117 WeakPolarHBondContact O-CA 3.36Å; F1117-T1119 HydrophobicContact CE1-CG2 4.33Å; F1117-T1119 HydrophobicContact CE2-CG2 4Å; F1117-T1119 HydrophobicContact CZ-CG2 3.82Å; F1117-T1119 PolarHBondContact O-N 3.37Å; F1117-G1125 WeakPolarHBondContact CD1-O 3.41Å; F1117-G1125 PolarHBondContact N-O 3.37Å; F1117-G1125 PolarHBondContact O-N 3.03Å; F1117-R1127 HydrophobicContact CD1-CB 3.84Å; F1117-R1127 HydrophobicContact CD1-CG 3.6Å; F1117-R1127 HydrophobicContact CE1-CB 3.64Å; F1117-R1127 HydrophobicContact CE1-CG 3.91Å; F1117-R1127 HydrophobicContact CG-CG 4.15Å; F1117-R1127 HydrophobicContact CZ-CB 4.39Å; F1117-E1223 HydrophobicContact CE1-CB 4.28Å; F1117-E1223 HydrophobicContact CE1-CG 3.95Å; F1117-E1223 HydrophobicContact CZ-CB 4.1Å; F1117-E1223 HydrophobicContact CZ-CG 3.98Å
1118	R	95.6	Very high	95.1	Very high	30 Å²	30	37.1 Å²	37.1	11%	0.113	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	118.9	170.5	-169.4	62.8	169.7	-163.3	-13.7	109.7	V1012 N1013 V1015 D1016 E1018 W1124	V1012-R1118 PolarHBondContact O-N 3.37Å; N1013-R1118 HydrophobicContact CB-CB 4.09Å; N1013-R1118 VanDerWaalsContact OD1-CB 3.26Å; N1013-R1118 WeakPolarHBondContact OD1-CB 3.33Å; N1013-R1118 WeakPolarHBondContact OD1-CG 3.43Å; V1015-R1118 HydrophobicContact CB-CB 4.38Å; V1015-R1118 HydrophobicContact CB-CG 3.83Å; V1015-R1118 HydrophobicContact CG2-CB 4.41Å; V1015-R1118 HydrophobicContact CG2-CG 4.25Å; V1015-R1118 WeakPolarHBondContact CG2-O 3.07Å; D1016-R1118 IonicContact OD1-NE 2.67Å; D1016-R1118 IonicContact OD1-NH2 3.51Å; D1016-R1118 IonicContact OD2-CZ 3.3Å; D1016-R1118 IonicContact OD2-NE 3.6Å; D1016-R1118 PolarHBondContact OD2-NE 2.96Å; D1016-R1118 IonicContact OD2-NH2 3.12Å; D1016-R1118 PolarHBondContact OD2-NH2 3.29Å; E1018-R1118 VanDerWaalsContact CD-NH2 3.35Å; E1018-R1118 IonicContact OE1-CZ 3.45Å; E1018-R1118 IonicContact OE1-NH1 3.82Å; E1018-R1118 PolarHBondContact OE1-NH1 2.78Å; E1018-R1118 IonicContact OE1-NH2 3.94Å; E1018-R1118 IonicContact OE2-CZ 3.64Å; E1018-R1118 VanDerWaalsContact OE2-CZ 3.28Å; E1018-R1118 IonicContact OE2-NH1 2.72Å; E1018-R1118 PolarHBondContact OE2-NH1 3.1Å; E1018-R1118 IonicContact OE2-NH2 3.62Å; E1018-R1118 PolarHBondContact OE2-NH2 3.08Å; R1118-W1124 HydrophobicContact CB-CE3 4.3Å; R1118-W1124 HydrophobicContact CB-CH2 4.19Å; R1118-W1124 HydrophobicContact CB-CZ3 3.99Å
1119	T	93.8	Very high	95.1	Very high	6 Å²	6	37.8 Å²	37.8	4%	0.037	20%	0.195	C	C	.	.			trans	-78.3	163.7	172.1	75.9	0	0	0	0	110.4	F1117 N1121 K1122 G1123	F1117-T1119 HydrophobicContact CE1-CG2 4.33Å; F1117-T1119 HydrophobicContact CE2-CG2 4Å; F1117-T1119 HydrophobicContact CZ-CG2 3.82Å; F1117-T1119 PolarHBondContact O-N 3.37Å; T1119-N1121 PolarHBondContact O-N 2.99Å; T1119-K1122 WeakPolarHBondContact OG1-CA 3.17Å; T1119-K1122 PolarHBondContact OG1-N 3.35Å; T1119-G1123 WeakPolarHBondContact CA-O 3.27Å; T1119-G1123 WeakPolarHBondContact CB-O 3.46Å; T1119-G1123 PolarHBondContact N-O 3.05Å; T1119-G1123 PolarHBondContact OG1-N 3.27Å; T1119-G1123 PolarHBondContact OG1-O 3.39Å
1120	G	88.4	Confident	95.3	Very high	66 Å²	66	39.8 Å²	39.8	68%	0.68	20%	0.197	S	C	*	.	S	Bend	trans	-69.3	-15.9	-179.8	0	0	0	0	0	115.3
1121	N	88.3	Confident	95.5	Very high	88 Å²	88	44.5 Å²	44.5	47%	0.471	22%	0.223	S	C	.	.	S	Bend	trans	-156.9	-36.5	-165.9	64.8	-36.7	0	0	0	115.1	T1119 G1123 E1243	T1119-N1121 PolarHBondContact O-N 2.99Å; N1121-G1123 PolarHBondContact O-N 3.18Å; N1121-E1243 WeakPolarHBondContact CB-OE2 3.39Å; N1121-E1243 WeakPolarHBondContact ND2-CB 3.43Å; N1121-E1243 PolarHBondContact ND2-O 3.24Å; N1121-E1243 PolarHBondContact ND2-OE2 3.38Å
1122	K	93	Very high	95.7	Very high	51 Å²	51	37.2 Å²	37.2	22%	0.222	20%	0.195	C	C	.	.	S	Bend	trans	-82.7	12.1	179.8	-65.3	172.1	-75.3	159.2	0	114	T1119 N1186 E1223 E1243	T1119-K1122 WeakPolarHBondContact OG1-CA 3.17Å; T1119-K1122 PolarHBondContact OG1-N 3.35Å; K1122-N1186 HydrophobicContact CD-CB 4.39Å; K1122-E1223 IonicContact NZ-OE1 3.43Å; K1122-E1223 PolarHBondContact NZ-OE1 3.45Å; K1122-E1223 IonicContact NZ-OE2 3.48Å; K1122-E1223 PolarHBondContact NZ-OE2 3.02Å; K1122-E1243 HydrophobicContact CG-CB 4.45Å
1123	G	93.8	Very high	95.8	Very high	22 Å²	22	39.9 Å²	39.9	23%	0.227	21%	0.213	C	C	.	.	S	Bend	trans	72.5	-130.2	-172.1	0	0	0	0	0	111.6	T1119 N1121	T1119-G1123 WeakPolarHBondContact CA-O 3.27Å; T1119-G1123 WeakPolarHBondContact CB-O 3.46Å; T1119-G1123 PolarHBondContact N-O 3.05Å; T1119-G1123 PolarHBondContact OG1-N 3.27Å; T1119-G1123 PolarHBondContact OG1-O 3.39Å; N1121-G1123 PolarHBondContact O-N 3.18Å
1124	W	96.9	Very high	95.8	Very high	26 Å²	26	37 Å²	37	10%	0.098	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	149.2	178.4	-66.8	96.3	0	0	0	112	L996 V1012 N1013 E1018 P1019 P1021 V1116 R1118 F1184 N1186	L996-W1124 HydrophobicContact CD1-CH2 3.84Å; V1012-W1124 WeakPolarHBondContact O-CZ3 3.44Å; N1013-W1124 HydrophobicContact CB-CH2 4.08Å; E1018-W1124 HydrophobicContact CB-CZ2 4.4Å; E1018-W1124 PolarHBondContact OE1-NE1 2.67Å; P1019-W1124 VanDerWaalsContact O-CZ2 3.23Å; P1019-W1124 WeakPolarHBondContact O-CZ2 3.21Å; P1021-W1124 HydrophobicContact CG-CD2 3.97Å; P1021-W1124 HydrophobicContact CG-CG 3.98Å; P1021-W1124 HydrophobicContact CG-CZ2 4.38Å; V1116-W1124 HydrophobicContact CG1-CE3 3.74Å; V1116-W1124 HydrophobicContact CG1-CZ3 4.37Å; R1118-W1124 HydrophobicContact CB-CE3 4.3Å; R1118-W1124 HydrophobicContact CB-CH2 4.19Å; R1118-W1124 HydrophobicContact CB-CZ3 3.99Å; W1124-F1184 HydrophobicContact CB-CD1 3.84Å; W1124-F1184 HydrophobicContact CB-CE1 4.41Å; W1124-N1186 PolarHBondContact O-ND2 3.15Å; W1124-N1186 PolarHBondContact O-OD1 3.33Å
1125	G	97.1	Very high	95.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	166.3	177.2	0	0	0	0	0	111.6	V1116 F1117 F1184 N1186	V1116-G1125 CarbonylContact C-O 3.36Å; V1116-G1125 WeakPolarHBondContact CA-O 3.38Å; F1117-G1125 WeakPolarHBondContact CD1-O 3.41Å; F1117-G1125 PolarHBondContact N-O 3.37Å; F1117-G1125 PolarHBondContact O-N 3.03Å; G1125-F1184 CarbonylContact C-O 3.58Å; G1125-F1184 VanDerWaalsContact CA-O 3.28Å; G1125-F1184 WeakPolarHBondContact CA-O 3.5Å; G1125-N1186 WeakPolarHBondContact CA-ND2 3.36Å
1126	V	98.4	Very high	95.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	138.5	168.1	-172.9	0	0	0	0	109.1	L1114 Q1115 V1116 I1181 F1184 L1185 E1223 L1224	L1114-V1126 HydrophobicContact CB-CG1 3.96Å; L1114-V1126 HydrophobicContact CD1-CG1 4.23Å; L1114-V1126 HydrophobicContact CG-CG1 4.47Å; Q1115-V1126 CarbonylContact O-C 3.45Å; Q1115-V1126 WeakPolarHBondContact O-CA 3.44Å; V1116-V1126 HydrophobicContact CG2-CG2 4.37Å; V1126-I1181 HydrophobicContact CG1-CD1 3.69Å; V1126-I1181 HydrophobicContact CG1-CG1 4.34Å; V1126-I1181 HydrophobicContact CG2-CD1 4.14Å; V1126-I1181 HydrophobicContact CG2-CG1 3.86Å; V1126-F1184 HydrophobicContact CG2-CB 3.76Å; V1126-F1184 PolarHBondContact N-O 3.44Å; V1126-L1185 HydrophobicContact CB-CD2 3.95Å; V1126-L1185 HydrophobicContact CG2-CD2 4.04Å; V1126-L1185 HydrophobicContact CG2-CG 4.32Å; V1126-E1223 CarbonylContact O-C 3.49Å; V1126-E1223 WeakPolarHBondContact O-CA 3.46Å; V1126-E1223 WeakPolarHBondContact O-CG 3.41Å; V1126-L1224 HydrophobicContact CG1-CD1 4.22Å; V1126-L1224 PolarHBondContact O-N 3.13Å
1127	R	97.6	Very high	95.8	Very high	39 Å²	39	38.1 Å²	38.1	15%	0.147	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	155.3	166.2	64.7	-172.8	-170.6	-157.4	7.5	110.8	E993 Q1115 F1117 E1222	E993-R1127 VanDerWaalsContact CD-NH2 3.29Å; E993-R1127 IonicContact OE1-CZ 2.72Å; E993-R1127 IonicContact OE1-NH1 3.19Å; E993-R1127 PolarHBondContact OE1-NH1 3.47Å; E993-R1127 IonicContact OE1-NH2 2.69Å; E993-R1127 PolarHBondContact OE1-NH2 2.87Å; E993-R1127 IonicContact OE2-CZ 3.52Å; E993-R1127 IonicContact OE2-NH1 3.28Å; E993-R1127 IonicContact OE2-NH2 3.73Å; E993-R1127 PolarHBondContact OE2-NH2 3.25Å; Q1115-R1127 HydrophobicContact CB-CG 4.36Å; Q1115-R1127 PolarHBondContact N-O 3.21Å; Q1115-R1127 PolarHBondContact O-N 2.7Å; F1117-R1127 HydrophobicContact CD1-CB 3.84Å; F1117-R1127 HydrophobicContact CD1-CG 3.6Å; F1117-R1127 HydrophobicContact CE1-CB 3.64Å; F1117-R1127 HydrophobicContact CE1-CG 3.91Å; F1117-R1127 HydrophobicContact CG-CG 4.15Å; F1117-R1127 HydrophobicContact CZ-CB 4.39Å; R1127-E1222 VanDerWaalsContact CA-O 3.31Å; R1127-E1222 WeakPolarHBondContact CA-O 3.42Å; R1127-E1222 VanDerWaalsContact CB-O 3.31Å; R1127-E1222 WeakPolarHBondContact CB-O 3.26Å
1128	T	97.7	Very high	95.8	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	145	173.8	-175.7	0	0	0	0	111.5	Q1130 I1132 V1218 K1219 G1221 E1222	T1128-Q1130 WeakPolarHBondContact CG2-O 3.31Å; T1128-Q1130 PolarHBondContact OG1-N 2.8Å; T1128-Q1130 PolarHBondContact OG1-O 3.31Å; T1128-I1132 HydrophobicContact CG2-CD1 4.13Å; T1128-I1132 HydrophobicContact CG2-CG1 4.28Å; T1128-V1218 HydrophobicContact CG2-CG1 3.96Å; T1128-K1219 WeakPolarHBondContact CG2-O 3.49Å; T1128-G1221 WeakPolarHBondContact O-CA 3.23Å; T1128-G1221 PolarHBondContact O-N 2.89Å; T1128-E1222 PolarHBondContact N-O 2.92Å; T1128-E1222 VanDerWaalsContact N-O 3.11Å
1129	L	95.4	Very high	95.9	Very high	76 Å²	76	35.7 Å²	35.7	40%	0.398	21%	0.205	S	C	.	.	S	Bend	trans	-98.5	4.7	173.5	-62.8	-179.4	0	0	0	112.8	P1010 R1113 Q1115	P1010-L1129 HydrophobicContact CG-CD1 4.24Å; R1113-L1129 HydrophobicContact CB-CB 3.95Å; R1113-L1129 WeakPolarHBondContact O-CB 3.46Å; R1113-L1129 PolarHBondContact O-N 2.74Å; Q1115-L1129 HydrophobicContact CB-CD1 4.05Å; Q1115-L1129 HydrophobicContact CB-CD2 3.87Å; Q1115-L1129 HydrophobicContact CB-CG 3.89Å
1130	Q	96.1	Very high	96.1	Very high	67 Å²	67	36.6 Å²	36.6	31%	0.313	21%	0.208	S	C	.	.	S	Bend	trans	-147.6	161.8	-178.1	57.4	170.4	93.1	0	0	109.9	V1112 R1113 T1128	V1112-Q1130 HydrophobicContact CG1-CG 3.88Å; R1113-Q1130 HydrophobicContact CB-CG 4.25Å; T1128-Q1130 WeakPolarHBondContact CG2-O 3.31Å; T1128-Q1130 PolarHBondContact OG1-N 2.8Å; T1128-Q1130 PolarHBondContact OG1-O 3.31Å
1131	D	97.6	Very high	96.5	Very high	105 Å²	105	33.9 Å²	33.9	56%	0.561	18%	0.178	S	C	*	.			trans	-66.3	140.6	167.4	-63	-13.5	0	0	0	109.9	V1218 K1219 A1220	D1131-V1218 CarbonylContact C-O 3.53Å; D1131-V1218 WeakPolarHBondContact CA-O 3.21Å; D1131-K1219 VanDerWaalsContact OD1-CA 3.31Å; D1131-K1219 WeakPolarHBondContact OD1-CA 3.33Å; D1131-A1220 PolarHBondContact OD1-N 3.42Å
1132	I	97.9	Very high	97	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.015	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-119	110.4	176.9	-49.9	177.6	0	0	0	107.9	V1112 T1128 V1138 A1214 N1217 V1218 L1224	V1112-I1132 HydrophobicContact CG1-CD1 3.72Å; V1112-I1132 HydrophobicContact CG1-CG1 3.8Å; T1128-I1132 HydrophobicContact CG2-CD1 4.13Å; T1128-I1132 HydrophobicContact CG2-CG1 4.28Å; I1132-V1138 HydrophobicContact CD1-CG1 4.5Å; I1132-V1138 HydrophobicContact CD1-CG2 4.25Å; I1132-V1138 HydrophobicContact CG2-CG2 4.12Å; I1132-A1214 HydrophobicContact CG2-CB 3.71Å; I1132-N1217 WeakPolarHBondContact O-CA 3.49Å; I1132-V1218 HydrophobicContact CB-CB 4.19Å; I1132-V1218 HydrophobicContact CD1-CB 4.47Å; I1132-V1218 PolarHBondContact N-O 3.28Å; I1132-V1218 PolarHBondContact O-N 2.94Å; I1132-L1224 HydrophobicContact CD1-CD1 4.39Å; I1132-L1224 HydrophobicContact CD1-CD2 4.15Å
1133	P	97.4	Very high	97.2	Very high	68 Å²	68	27.3 Å²	27.3	44%	0.442	15%	0.145	S	C	.	.			trans	-61.2	145.7	172.9	-23.9	34.2	0	0	0	112.4	G1135 S1136 A1214 N1217	P1133-G1135 PolarHBondContact O-N 3.38Å; P1133-S1136 VanDerWaalsContact O-CB 3.22Å; P1133-S1136 WeakPolarHBondContact O-CB 3.3Å; P1133-S1136 PolarHBondContact O-N 3.06Å; P1133-S1136 VanDerWaalsContact O-N 3.08Å; P1133-S1136 PolarHBondContact O-OG 2.93Å; P1133-A1214 WeakPolarHBondContact O-CB 3.29Å; P1133-N1217 WeakPolarHBondContact CA-OD1 3.5Å
1134	Q	96.6	Very high	97.4	Very high	88 Å²	88	26.5 Å²	26.5	41%	0.411	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	139.2	173.5	-175.3	173.6	40.3	0	0	111.5	S1136 S1215 E1216 N1217	Q1134-S1136 PolarHBondContact O-N 2.86Å; Q1134-S1215 PolarHBondContact NE2-O 3.18Å; Q1134-E1216 WeakPolarHBondContact CA-O 3.39Å; Q1134-N1217 PolarHBondContact N-OD1 3.41Å
1135	G	96.8	Very high	97.3	Very high	6 Å²	6	25.8 Å²	25.8	6%	0.062	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	77	-2.6	-177.6	0	0	0	0	0	115	C1075 L1076 P1133 F1213 A1214	C1075-G1135 CarbonylContact C-O 3.42Å; C1075-G1135 VanDerWaalsContact CA-O 3.28Å; C1075-G1135 WeakPolarHBondContact CA-O 3.38Å; L1076-G1135 PolarHBondContact N-O 2.74Å; P1133-G1135 PolarHBondContact O-N 3.38Å; G1135-F1213 WeakPolarHBondContact O-CD1 3.24Å; G1135-A1214 PolarHBondContact N-O 3.23Å
1136	S	97.9	Very high	97.1	Very high	16 Å²	16	25.9 Å²	25.9	11%	0.112	13%	0.134	C	C	.	.			trans	-63.6	139.5	174	-59.7	0	0	0	0	111.6	C1075 P1133 Q1134 F1213 A1214	C1075-S1136 PolarHBondContact SG-OG 3.4Å; P1133-S1136 VanDerWaalsContact O-CB 3.22Å; P1133-S1136 WeakPolarHBondContact O-CB 3.3Å; P1133-S1136 PolarHBondContact O-N 3.06Å; P1133-S1136 VanDerWaalsContact O-N 3.08Å; P1133-S1136 PolarHBondContact O-OG 2.93Å; Q1134-S1136 PolarHBondContact O-N 2.86Å; S1136-F1213 CarbonylContact O-C 3.3Å; S1136-F1213 VanDerWaalsContact O-CA 3.3Å; S1136-F1213 WeakPolarHBondContact O-CA 3.45Å; S1136-A1214 PolarHBondContact O-N 2.96Å
1137	F	98.3	Very high	96.7	Very high	21 Å²	21	28 Å²	28	9%	0.092	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	135.2	164.2	175	-121.8	0	0	0	110.2	V1105 V1106 C1139 E1140 A1211 F1212 F1213	V1105-F1137 HydrophobicContact CG1-CB 3.75Å; V1105-F1137 HydrophobicContact CG1-CG 4.4Å; V1106-F1137 HydrophobicContact CB-CE2 4.38Å; V1106-F1137 HydrophobicContact CB-CZ 4.34Å; V1106-F1137 HydrophobicContact CG1-CE2 3.96Å; V1106-F1137 HydrophobicContact CG1-CZ 3.86Å; V1106-F1137 HydrophobicContact CG2-CD2 3.96Å; V1106-F1137 HydrophobicContact CG2-CE2 4.04Å; V1106-F1137 HydrophobicContact CG2-CG 4.33Å; V1106-F1137 HydrophobicContact CG2-CZ 4.46Å; F1137-C1139 VanDerWaalsContact CE2-C 3.42Å; F1137-C1139 VanDerWaalsContact CE2-O 3.32Å; F1137-C1139 WeakPolarHBondContact CE2-O 3.46Å; F1137-E1140 HydrophobicContact CZ-CB 4.5Å; F1137-A1211 HydrophobicContact CD2-CB 4.11Å; F1137-A1211 HydrophobicContact CE2-CB 3.77Å; F1137-F1212 WeakPolarHBondContact CD2-O 3.18Å; F1137-F1213 HydrophobicContact CB-CD1 4.05Å; F1137-F1213 HydrophobicContact CB-CE1 3.63Å; F1137-F1213 HydrophobicContact CB-CZ 4.29Å; F1137-F1213 HydrophobicContact CD2-CE1 4.26Å; F1137-F1213 HydrophobicContact CD2-CZ 4.17Å; F1137-F1213 HydrophobicContact CG-CE1 4.39Å
1138	V	97.9	Very high	96.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	-58.8	-175.6	-179.5	0	0	0	0	111.7	L1114 I1132 L1193 F1212 A1214 L1224	L1114-V1138 HydrophobicContact CD1-CG1 3.89Å; L1114-V1138 HydrophobicContact CD2-CG1 4.34Å; I1132-V1138 HydrophobicContact CD1-CG1 4.5Å; I1132-V1138 HydrophobicContact CD1-CG2 4.25Å; I1132-V1138 HydrophobicContact CG2-CG2 4.12Å; V1138-L1193 HydrophobicContact CB-CD2 4.08Å; V1138-L1193 HydrophobicContact CG1-CD2 4.25Å; V1138-L1193 HydrophobicContact CG2-CD2 3.72Å; V1138-F1212 PolarHBondContact N-O 3.42Å; V1138-A1214 HydrophobicContact CG2-CB 4.34Å; V1138-L1224 HydrophobicContact CG1-CD1 3.9Å
1139	C	97.5	Very high	95.7	Very high	2 Å²	2	33 Å²	33	1%	0.014	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	164.5	174.9	60.9	0	0	0	0	110.9	L1110 F1137 I1181 F1212	L1110-C1139 HydrophobicContact CD1-CB 4.1Å; F1137-C1139 VanDerWaalsContact CE2-C 3.42Å; F1137-C1139 VanDerWaalsContact CE2-O 3.32Å; F1137-C1139 WeakPolarHBondContact CE2-O 3.46Å; C1139-I1181 HydrophobicContact CB-CG2 4.08Å; C1139-F1212 WeakPolarHBondContact O-CB 3.39Å; C1139-F1212 PolarHBondContact O-N 3.46Å
1140	E	97.7	Very high	95.4	Very high	24 Å²	24	32.5 Å²	32.5	11%	0.112	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	146.5	169.7	-175	179.9	146.9	0	0	110	N1030 F1137 V1142 N1180 H1209 I1210	N1030-E1140 PolarHBondContact ND2-OE1 3.4Å; F1137-E1140 HydrophobicContact CZ-CB 4.5Å; E1140-V1142 HydrophobicContact CB-CG2 3.91Å; E1140-V1142 HydrophobicContact CG-CG2 3.83Å; E1140-V1142 PolarHBondContact O-N 2.9Å; E1140-N1180 PolarHBondContact O-ND2 3.05Å; E1140-N1180 PolarHBondContact O-OD1 2.99Å; E1140-H1209 VanDerWaalsContact CD-ND1 3.26Å; E1140-H1209 HydrophobicContact CG-CB 4.41Å; E1140-H1209 IonicContact OE1-CE1 3.46Å; E1140-H1209 IonicContact OE1-CG 3.97Å; E1140-H1209 IonicContact OE1-ND1 2.67Å; E1140-H1209 PolarHBondContact OE1-ND1 3.14Å; E1140-H1209 IonicContact OE2-CG 2.61Å; E1140-H1209 IonicContact OE2-ND1 2.73Å; E1140-H1209 PolarHBondContact OE2-ND1 3.46Å; E1140-H1209 VanDerWaalsContact OE2-ND1 3.09Å; E1140-I1210 CarbonylContact C-O 3.49Å; E1140-I1210 VanDerWaalsContact CA-O 3.3Å; E1140-I1210 WeakPolarHBondContact CA-O 3.33Å; E1140-I1210 WeakPolarHBondContact CG-O 3.36Å
1141	Y	97.8	Very high	95.1	Very high	10 Å²	10	29.8 Å²	29.8	4%	0.039	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	107	165.5	-160.8	-80.3	0	0	0	109.3	Y1159 F1161 I1173 A1175 S1182 I1210 F1212 F1226	Y1141-Y1159 PolarHBondContact OH-O 2.59Å; Y1141-F1161 HydrophobicContact CD1-CB 3.75Å; Y1141-F1161 HydrophobicContact CD1-CD2 4.47Å; Y1141-F1161 HydrophobicContact CD1-CG 4.25Å; Y1141-F1161 AromaticContact CD2-CD2 4Å; Y1141-F1161 HydrophobicContact CD2-CD2 4Å; Y1141-F1161 HydrophobicContact CE1-CB 3.58Å; Y1141-F1161 HydrophobicContact CE1-CG 4.46Å; Y1141-F1161 HydrophobicContact CE2-CB 4.44Å; Y1141-F1161 HydrophobicContact CE2-CD2 4.23Å; Y1141-F1161 HydrophobicContact CG-CB 4.26Å; Y1141-F1161 HydrophobicContact CG-CD2 4.13Å; Y1141-F1161 HydrophobicContact CG-CG 4.32Å; Y1141-I1173 HydrophobicContact CD1-CB 4.19Å; Y1141-I1173 HydrophobicContact CD1-CG2 3.83Å; Y1141-I1173 HydrophobicContact CE1-CB 4.34Å; Y1141-I1173 HydrophobicContact CE1-CG2 3.95Å; Y1141-I1173 WeakPolarHBondContact O-CD1 3.2Å; Y1141-A1175 HydrophobicContact CE1-CB 3.79Å; Y1141-S1182 WeakPolarHBondContact CA-OG 3.37Å; Y1141-S1182 WeakPolarHBondContact CD2-OG 3.38Å; Y1141-I1210 PolarHBondContact N-O 2.95Å; Y1141-F1212 AromaticContact CD2-CE2 3.79Å; Y1141-F1212 HydrophobicContact CD2-CE2 3.79Å; Y1141-F1212 AromaticContact CD2-CZ 3.93Å; Y1141-F1212 HydrophobicContact CD2-CZ 3.93Å; Y1141-F1212 HydrophobicContact CG-CE2 4.29Å; Y1141-F1226 HydrophobicContact CE2-CZ 4.32Å
1142	V	98.1	Very high	94.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.18	C	C	.	.			trans	-117.7	136.2	-173.6	174	0	0	0	0	110.9	I1027 E1029 N1030 E1140 G1179 N1180 S1182	I1027-V1142 HydrophobicContact CD1-CG1 3.85Å; I1027-V1142 HydrophobicContact CG1-CG1 4.05Å; E1029-V1142 VanDerWaalsContact C-CG1 3.5Å; N1030-V1142 VanDerWaalsContact OD1-CA 3.31Å; N1030-V1142 WeakPolarHBondContact OD1-CA 3.48Å; E1140-V1142 HydrophobicContact CB-CG2 3.91Å; E1140-V1142 HydrophobicContact CG-CG2 3.83Å; E1140-V1142 PolarHBondContact O-N 2.9Å; V1142-G1179 WeakPolarHBondContact O-CA 3.38Å; V1142-N1180 HydrophobicContact CB-CB 3.96Å; V1142-N1180 HydrophobicContact CG1-CB 4.46Å; V1142-N1180 WeakPolarHBondContact CG2-ND2 3.31Å; V1142-N1180 PolarHBondContact O-N 3.48Å; V1142-S1182 PolarHBondContact N-OG 3.4Å
1143	G	97.4	Very high	94.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.2	-149.5	176.2	0	0	0	0	0	114	N1030 C1031 I1173 Y1178	N1030-G1143 WeakPolarHBondContact CA-O 2.93Å; N1030-G1143 PolarHBondContact OD1-N 3.18Å; N1030-G1143 PolarHBondContact OD1-O 2.93Å; C1031-G1143 PolarHBondContact N-O 3.27Å; G1143-I1173 VanDerWaalsContact CA-CG2 3.46Å; G1143-I1173 VanDerWaalsContact N-CG2 3.27Å; G1143-Y1178 WeakPolarHBondContact CA-O 3.37Å
1144	E	96.8	Very high	94	Very high	5 Å²	5	34.3 Å²	34.3	2%	0.023	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	117.8	177.1	-173	-170.2	164.1	0	0	110.7	T1033 I1146 R1154 I1173 D1174 Y1178	T1033-E1144 WeakPolarHBondContact CB-OE1 3.26Å; T1033-E1144 HydrophobicContact CG2-CG 3.88Å; T1033-E1144 WeakPolarHBondContact CG2-OE1 3.31Å; T1033-E1144 PolarHBondContact OG1-OE1 3.06Å; E1144-I1146 HydrophobicContact CG-CG2 3.89Å; E1144-I1146 PolarHBondContact O-N 3.39Å; E1144-R1154 IonicContact OE1-CZ 3.57Å; E1144-R1154 IonicContact OE1-NH1 3.73Å; E1144-R1154 PolarHBondContact OE1-NH1 2.98Å; E1144-R1154 IonicContact OE1-NH2 2.77Å; E1144-R1154 PolarHBondContact OE1-NH2 2.94Å; E1144-R1154 IonicContact OE2-CZ 3.66Å; E1144-R1154 IonicContact OE2-NH1 2.76Å; E1144-R1154 PolarHBondContact OE2-NH1 2.83Å; E1144-R1154 IonicContact OE2-NH2 3.59Å; E1144-I1173 CarbonylContact O-C 3.58Å; E1144-I1173 WeakPolarHBondContact O-CA 3.46Å; E1144-D1174 HydrophobicContact CB-CB 4.43Å; E1144-D1174 WeakPolarHBondContact CB-O 3.26Å; E1144-D1174 PolarHBondContact N-O 2.83Å; E1144-D1174 PolarHBondContact O-N 3.26Å; E1144-Y1178 HydrophobicContact CB-CD2 4.32Å
1145	I	94.9	Very high	93.6	Very high	12 Å²	12	39.9 Å²	39.9	6%	0.062	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	118.9	174.8	-63.9	170.1	0	0	0	109.4	N1030 C1031 V1032 M1036 C1172 I1173 F1207	N1030-I1145 HydrophobicContact CB-CD1 3.79Å; N1030-I1145 HydrophobicContact CB-CG1 4.09Å; C1031-I1145 PolarHBondContact O-N 3.27Å; V1032-I1145 HydrophobicContact CG1-CB 4.03Å; M1036-I1145 HydrophobicContact CG-CG2 4.42Å; I1145-C1172 WeakPolarHBondContact CA-O 3.46Å; I1145-I1173 HydrophobicContact CG1-CG1 4.15Å; I1145-F1207 HydrophobicContact CD1-CD1 4.43Å; I1145-F1207 HydrophobicContact CG2-CD1 3.77Å; I1145-F1207 HydrophobicContact CG2-CE1 3.68Å
1146	I	93.3	Very high	93.1	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	156.7	179.3	61.5	175.4	0	0	0	111.1	E1144 E1150 A1151 R1154 L1160 Y1171 C1172 D1174	E1144-I1146 HydrophobicContact CG-CG2 3.89Å; E1144-I1146 PolarHBondContact O-N 3.39Å; I1146-E1150 HydrophobicContact CB-CB 4.29Å; I1146-E1150 HydrophobicContact CB-CG 3.84Å; I1146-E1150 HydrophobicContact CD1-CG 4.24Å; I1146-E1150 HydrophobicContact CG2-CG 3.97Å; I1146-A1151 HydrophobicContact CD1-CB 3.69Å; I1146-A1151 HydrophobicContact CG1-CB 4.33Å; I1146-R1154 HydrophobicContact CD1-CG 4.2Å; I1146-L1160 HydrophobicContact CD1-CD2 4.04Å; I1146-Y1171 WeakPolarHBondContact O-CA 3.38Å; I1146-C1172 HydrophobicContact CG1-CB 4.22Å; I1146-C1172 PolarHBondContact N-O 3.28Å; I1146-C1172 PolarHBondContact O-N 2.92Å; I1146-D1174 HydrophobicContact CD1-CB 3.8Å; I1146-D1174 HydrophobicContact CG1-CB 4.34Å
1147	S	91	Very high	92.7	Very high	45 Å²	45	44.1 Å²	44.1	32%	0.315	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	153.6	169.6	47.6	0	0	0	0	111.2	G1149 E1150 A1151	S1147-G1149 VanDerWaalsContact C-N 3.33Å; S1147-G1149 PolarHBondContact O-N 3.08Å; S1147-E1150 WeakPolarHBondContact O-CA 3.46Å; S1147-E1150 WeakPolarHBondContact O-CB 3.47Å; S1147-E1150 PolarHBondContact O-N 3.45Å; S1147-A1151 PolarHBondContact O-N 3.44Å
1148	E	85.2	Confident	92.3	Very high	90 Å²	90	45 Å²	45	42%	0.421	25%	0.251	S	S	.	.	H	α-helix	trans	-48.4	-50.4	174.6	-175.9	-173	-159.6	0	0	112.5	E1150 A1151 D1152 Q1170	E1148-E1150 PolarHBondContact O-N 2.98Å; E1148-E1150 VanDerWaalsContact O-N 3.08Å; E1148-A1151 CarbonylContact O-C 3.41Å; E1148-A1151 WeakPolarHBondContact O-CA 3.28Å; E1148-A1151 VanDerWaalsContact O-CB 3.31Å; E1148-A1151 WeakPolarHBondContact O-CB 3.38Å; E1148-A1151 PolarHBondContact O-N 3.03Å; E1148-D1152 PolarHBondContact O-N 3.49Å; E1148-Q1170 HydrophobicContact CB-CB 4.24Å; E1148-Q1170 PolarHBondContact N-O 3.14Å; E1148-Q1170 PolarHBondContact OE1-OE1 3.12Å
1149	G	87.3	Confident	92.2	Very high	53 Å²	53	48 Å²	48	55%	0.546	26%	0.263	S	S	.	.	H	α-helix	trans	-68.3	-4.8	178	0	0	0	0	0	116.3	S1147	S1147-G1149 VanDerWaalsContact C-N 3.33Å; S1147-G1149 PolarHBondContact O-N 3.08Å
1150	E	90.7	Very high	92	Very high	65 Å²	65	50.3 Å²	50.3	30%	0.304	27%	0.274	S	S	.	.	H	α-helix	trans	-92.7	-41.3	164.2	163.4	67.9	-158.2	0	0	109.6	I1146 S1147 E1148 D1152 T1153 R1154	I1146-E1150 HydrophobicContact CB-CB 4.29Å; I1146-E1150 HydrophobicContact CB-CG 3.84Å; I1146-E1150 HydrophobicContact CD1-CG 4.24Å; I1146-E1150 HydrophobicContact CG2-CG 3.97Å; S1147-E1150 WeakPolarHBondContact O-CA 3.46Å; S1147-E1150 WeakPolarHBondContact O-CB 3.47Å; S1147-E1150 PolarHBondContact O-N 3.45Å; E1148-E1150 PolarHBondContact O-N 2.98Å; E1148-E1150 VanDerWaalsContact O-N 3.08Å; E1150-D1152 VanDerWaalsContact C-N 3.31Å; E1150-D1152 PolarHBondContact O-N 3.35Å; E1150-T1153 WeakPolarHBondContact O-CB 3.45Å; E1150-T1153 PolarHBondContact O-N 2.79Å; E1150-T1153 PolarHBondContact O-OG1 3.36Å; E1150-R1154 PolarHBondContact O-N 3.48Å; E1150-R1154 IonicContact OE1-CZ 3.23Å; E1150-R1154 VanDerWaalsContact OE1-CZ 3.23Å; E1150-R1154 IonicContact OE1-NE 2.83Å; E1150-R1154 PolarHBondContact OE1-NE 3.39Å; E1150-R1154 IonicContact OE1-NH2 2.75Å; E1150-R1154 PolarHBondContact OE1-NH2 3.2Å
1151	A	89.9	Confident	91.8	Very high	10 Å²	10	51 Å²	51	8%	0.083	28%	0.277	C	S	.	.	H	α-helix	trans	-57.5	-40.8	175.1	0	0	0	0	0	112.4	I1146 S1147 E1148 T1153 R1154 L1160	I1146-A1151 HydrophobicContact CD1-CB 3.69Å; I1146-A1151 HydrophobicContact CG1-CB 4.33Å; S1147-A1151 PolarHBondContact O-N 3.44Å; E1148-A1151 CarbonylContact O-C 3.41Å; E1148-A1151 WeakPolarHBondContact O-CA 3.28Å; E1148-A1151 VanDerWaalsContact O-CB 3.31Å; E1148-A1151 WeakPolarHBondContact O-CB 3.38Å; E1148-A1151 PolarHBondContact O-N 3.03Å; A1151-T1153 PolarHBondContact O-N 2.87Å; A1151-T1153 VanDerWaalsContact O-N 3.08Å; A1151-R1154 VanDerWaalsContact O-CB 3.32Å; A1151-R1154 WeakPolarHBondContact O-CB 3.27Å; A1151-R1154 PolarHBondContact O-N 2.93Å; A1151-L1160 HydrophobicContact CB-CD1 4.06Å; A1151-L1160 HydrophobicContact CB-CD2 4.23Å
1152	D	88.4	Confident	91.4	Very high	136 Å²	136	53.3 Å²	53.3	73%	0.727	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-24.2	172.2	-86.4	-19.6	0	0	0	114.1	E1148 E1150	E1148-D1152 PolarHBondContact O-N 3.49Å; E1150-D1152 VanDerWaalsContact C-N 3.31Å; E1150-D1152 PolarHBondContact O-N 3.35Å
1153	T	91.1	Very high	90.9	Very high	93 Å²	93	53.6 Å²	53.6	57%	0.571	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-11.9	179	76.8	0	0	0	0	113.1	E1150 A1151 Q1155	E1150-T1153 WeakPolarHBondContact O-CB 3.45Å; E1150-T1153 PolarHBondContact O-N 2.79Å; E1150-T1153 PolarHBondContact O-OG1 3.36Å; A1151-T1153 PolarHBondContact O-N 2.87Å; A1151-T1153 VanDerWaalsContact O-N 3.08Å; T1153-Q1155 PolarHBondContact O-N 2.96Å
1154	R	90.5	Very high	89.7	Confident	43 Å²	43	55.2 Å²	55.2	16%	0.162	31%	0.305	C	S	.	.			trans	-71.8	122.8	179.3	-63.8	-78.4	167.3	124	-10	109.4	E1144 I1146 E1150 A1151 N1156 D1174	E1144-R1154 IonicContact OE1-CZ 3.57Å; E1144-R1154 IonicContact OE1-NH1 3.73Å; E1144-R1154 PolarHBondContact OE1-NH1 2.98Å; E1144-R1154 IonicContact OE1-NH2 2.77Å; E1144-R1154 PolarHBondContact OE1-NH2 2.94Å; E1144-R1154 IonicContact OE2-CZ 3.66Å; E1144-R1154 IonicContact OE2-NH1 2.76Å; E1144-R1154 PolarHBondContact OE2-NH1 2.83Å; E1144-R1154 IonicContact OE2-NH2 3.59Å; I1146-R1154 HydrophobicContact CD1-CG 4.2Å; E1150-R1154 PolarHBondContact O-N 3.48Å; E1150-R1154 IonicContact OE1-CZ 3.23Å; E1150-R1154 VanDerWaalsContact OE1-CZ 3.23Å; E1150-R1154 IonicContact OE1-NE 2.83Å; E1150-R1154 PolarHBondContact OE1-NE 3.39Å; E1150-R1154 IonicContact OE1-NH2 2.75Å; E1150-R1154 PolarHBondContact OE1-NH2 3.2Å; A1151-R1154 VanDerWaalsContact O-CB 3.32Å; A1151-R1154 WeakPolarHBondContact O-CB 3.27Å; A1151-R1154 PolarHBondContact O-N 2.93Å; R1154-N1156 PolarHBondContact O-N 2.88Å; R1154-N1156 VanDerWaalsContact O-N 3.15Å; R1154-D1174 IonicContact CZ-OD2 3.7Å; R1154-D1174 IonicContact NH1-OD2 3.57Å; R1154-D1174 PolarHBondContact NH1-OD2 3.34Å
1155	Q	87.1	Confident	88	Confident	204 Å²	204	61.8 Å²	61.8	95%	0.953	34%	0.34	S	S	*	.	S	Bend	trans	-70.3	-7.1	178	-62.8	179.9	5.4	0	0	114	T1153	T1153-Q1155 PolarHBondContact O-N 2.96Å
1156	N	86.8	Confident	86.5	Confident	59 Å²	59	67.8 Å²	67.8	32%	0.316	37%	0.366	S	S	.	.			trans	-141.3	95.1	179.2	-171.4	-22.5	0	0	0	109.8	R1154 A1158	R1154-N1156 PolarHBondContact O-N 2.88Å; R1154-N1156 VanDerWaalsContact O-N 3.15Å; N1156-A1158 VanDerWaalsContact OD1-CB 3.27Å; N1156-A1158 WeakPolarHBondContact OD1-CB 3.3Å; N1156-A1158 PolarHBondContact OD1-N 3.31Å; N1156-A1158 VanDerWaalsContact OD1-N 3.14Å
1157	D	88.9	Confident	84.8	Confident	53 Å²	53	73.8 Å²	73.8	28%	0.283	41%	0.405	S	S	.	.			trans	-82.4	-2.1	178	57.8	-37.7	0	0	0	113.9	Y1159 L1160 K1236	D1157-Y1159 PolarHBondContact O-N 3.31Å; D1157-Y1159 VanDerWaalsContact O-N 3.08Å; D1157-L1160 HydrophobicContact CB-CD1 3.8Å; D1157-L1160 HydrophobicContact CB-CG 4.5Å; D1157-L1160 PolarHBondContact O-N 3.12Å; D1157-K1236 IonicContact OD1-NZ 3.88Å; D1157-K1236 PolarHBondContact OD1-NZ 3.2Å; D1157-K1236 VanDerWaalsContact OD2-CE 3.31Å; D1157-K1236 WeakPolarHBondContact OD2-CE 3.36Å; D1157-K1236 IonicContact OD2-NZ 2.7Å; D1157-K1236 PolarHBondContact OD2-NZ 2.82Å
1158	A	90.4	Very high	83.1	Confident	39 Å²	39	79.9 Å²	79.9	32%	0.322	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-5.6	-171.7	0	0	0	0	0	115	N1156	N1156-A1158 VanDerWaalsContact OD1-CB 3.27Å; N1156-A1158 WeakPolarHBondContact OD1-CB 3.3Å; N1156-A1158 PolarHBondContact OD1-N 3.31Å; N1156-A1158 VanDerWaalsContact OD1-N 3.14Å
1159	Y	95.1	Very high	81.9	Confident	64 Å²	64	81.2 Å²	81.2	25%	0.251	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.2	23.8	-179	-61.7	-83.1	0	0	0	112.5	Y1141 D1157 A1175 R1176 R1183	Y1141-Y1159 PolarHBondContact OH-O 2.59Å; D1157-Y1159 PolarHBondContact O-N 3.31Å; D1157-Y1159 VanDerWaalsContact O-N 3.08Å; Y1159-A1175 PolarHBondContact O-N 3.11Å; Y1159-R1176 HydrophobicContact CD2-CB 4.16Å; Y1159-R1176 HydrophobicContact CD2-CG 4.47Å; Y1159-R1176 HydrophobicContact CG-CB 4.48Å; Y1159-R1183 HydrophobicContact CD1-CB 4.09Å; Y1159-R1183 HydrophobicContact CE1-CB 4.4Å; Y1159-R1183 WeakPolarHBondContact CE1-O 3.46Å
1160	L	93.6	Very high	81.5	Confident	50 Å²	50	80.8 Å²	80.8	26%	0.262	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	141	176	-64.3	175.6	0	0	0	111.7	I1146 A1151 D1157 C1172 I1173 D1174	I1146-L1160 HydrophobicContact CD1-CD2 4.04Å; A1151-L1160 HydrophobicContact CB-CD1 4.06Å; A1151-L1160 HydrophobicContact CB-CD2 4.23Å; D1157-L1160 HydrophobicContact CB-CD1 3.8Å; D1157-L1160 HydrophobicContact CB-CG 4.5Å; D1157-L1160 PolarHBondContact O-N 3.12Å; L1160-C1172 HydrophobicContact CD2-CB 4.4Å; L1160-I1173 CarbonylContact C-O 3.59Å; L1160-I1173 WeakPolarHBondContact CA-O 3.37Å; L1160-D1174 HydrophobicContact CD2-CB 3.7Å
1161	F	93.3	Very high	81.5	Confident	38 Å²	38	79 Å²	79	17%	0.167	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	116.7	167.3	-165.8	-69.4	0	0	0	109.6	Y1141 C1172 I1173 A1195 I1210 F1212 F1226	Y1141-F1161 HydrophobicContact CD1-CB 3.75Å; Y1141-F1161 HydrophobicContact CD1-CD2 4.47Å; Y1141-F1161 HydrophobicContact CD1-CG 4.25Å; Y1141-F1161 AromaticContact CD2-CD2 4Å; Y1141-F1161 HydrophobicContact CD2-CD2 4Å; Y1141-F1161 HydrophobicContact CE1-CB 3.58Å; Y1141-F1161 HydrophobicContact CE1-CG 4.46Å; Y1141-F1161 HydrophobicContact CE2-CB 4.44Å; Y1141-F1161 HydrophobicContact CE2-CD2 4.23Å; Y1141-F1161 HydrophobicContact CG-CB 4.26Å; Y1141-F1161 HydrophobicContact CG-CD2 4.13Å; Y1141-F1161 HydrophobicContact CG-CG 4.32Å; F1161-C1172 CarbonylContact O-C 3.49Å; F1161-C1172 VanDerWaalsContact O-CA 3.31Å; F1161-C1172 WeakPolarHBondContact O-CA 3.25Å; F1161-I1173 PolarHBondContact N-O 3.41Å; F1161-I1173 PolarHBondContact O-N 3.27Å; F1161-A1195 HydrophobicContact CE2-CB 4.37Å; F1161-A1195 HydrophobicContact CZ-CB 3.87Å; F1161-I1210 HydrophobicContact CD1-CD1 4.41Å; F1161-I1210 HydrophobicContact CD1-CG1 4Å; F1161-I1210 HydrophobicContact CD1-CG2 4.06Å; F1161-I1210 HydrophobicContact CD2-CG2 4.42Å; F1161-I1210 HydrophobicContact CE1-CB 4.38Å; F1161-I1210 HydrophobicContact CE1-CD1 3.93Å; F1161-I1210 HydrophobicContact CE1-CG1 3.9Å; F1161-I1210 HydrophobicContact CE1-CG2 3.57Å; F1161-I1210 HydrophobicContact CE2-CG2 3.95Å; F1161-I1210 HydrophobicContact CG-CG2 4.49Å; F1161-I1210 HydrophobicContact CZ-CG2 3.52Å; F1161-F1212 HydrophobicContact CE2-CZ 4.31Å; F1161-F1226 HydrophobicContact CD2-CE2 4.09Å; F1161-F1226 HydrophobicContact CD2-CZ 4.38Å; F1161-F1226 HydrophobicContact CE2-CD2 4.41Å; F1161-F1226 AromaticContact CE2-CE2 3.79Å; F1161-F1226 HydrophobicContact CE2-CE2 3.79Å; F1161-F1226 HydrophobicContact CE2-CZ 4.44Å
1162	S	90.3	Very high	81.6	Confident	59 Å²	59	78.9 Å²	78.9	41%	0.413	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	139.1	179.9	-49.7	0	0	0	0	112.1
1163	L	87.3	Confident	82	Confident	5 Å²	5	72.5 Å²	72.5	3%	0.026	38%	0.377	C	S	.	.			trans	-93.2	-21.3	-173.6	-64.7	-179.1	0	0	0	115.1	Y1171 I1173 R1197 P1208 I1210	L1163-Y1171 WeakPolarHBondContact CB-O 3.46Å; L1163-Y1171 PolarHBondContact N-O 2.72Å; L1163-I1173 HydrophobicContact CD1-CG1 4.25Å; L1163-I1173 HydrophobicContact CD2-CD1 3.79Å; L1163-I1173 HydrophobicContact CD2-CG1 3.93Å; L1163-I1173 HydrophobicContact CG-CG1 4.37Å; L1163-R1197 PolarHBondContact O-NH1 3.34Å; L1163-P1208 HydrophobicContact CB-CG 4.31Å; L1163-P1208 HydrophobicContact CD2-CG 4.27Å; L1163-I1210 HydrophobicContact CD2-CD1 3.73Å; L1163-I1210 HydrophobicContact CD2-CG1 3.55Å
1164	D	72.4	Confident	82.2	Confident	34 Å²	34	68 Å²	68	18%	0.182	35%	0.35	C	S	.	.			trans	-149.5	156.7	-179.2	-128.8	-28.7	0	0	0	112	Q1170 R1197	D1164-Q1170 PolarHBondContact O-NE2 2.8Å; D1164-R1197 IonicContact OD1-CZ 3.29Å; D1164-R1197 IonicContact OD1-NH1 3.92Å; D1164-R1197 PolarHBondContact OD1-NH1 2.9Å
1165	D	61.3	Low	82.6	Confident	143 Å²	143	66 Å²	66	77%	0.765	34%	0.342	S	S	*	.	S	Bend	trans	-100.8	11.7	179	-49.8	-76.6	0	0	0	112.3	R1197	D1165-R1197 IonicContact OD2-NH2 3.74Å
1166	K	63.3	Low	83	Confident	139 Å²	139	58.2 Å²	58.2	60%	0.604	30%	0.304	S	S	*	.	S	Bend	trans	-105.3	135.7	-173.3	-69	173.9	-175.9	162.7	0	110.8	E1168	K1166-E1168 PolarHBondContact O-N 3.25Å
1167	P	56.8	Low	83.4	Confident	128 Å²	128	60.5 Å²	60.5	83%	0.831	31%	0.311	S	S	*	.	S	Bend	trans	-82.2	20.6	-169.2	35.8	-39.6	0	0	0	114.7
1168	E	54.6	Low	83.8	Confident	173 Å²	173	62.4 Å²	62.4	81%	0.808	32%	0.315	S	S	*	.	S	Bend	trans	-124.8	117.3	178.2	-67.5	-175.8	175.3	0	0	108.5	K1166	K1166-E1168 PolarHBondContact O-N 3.25Å
1169	D	60.3	Low	84.1	Confident	118 Å²	118	60.5 Å²	60.5	63%	0.631	30%	0.3	S	S	*	.	S	Bend	trans	52.2	58.8	-175.6	-69.8	-4.9	0	0	0	114.8	Y1171	D1169-Y1171 HydrophobicContact CB-CE2 4.02Å; D1169-Y1171 WeakPolarHBondContact O-CD2 3.21Å; D1169-Y1171 WeakPolarHBondContact O-CE2 3.39Å
1170	Q	80.1	Confident	84.2	Confident	44 Å²	44	57.7 Å²	57.7	21%	0.206	29%	0.289	C	S	.	.			trans	-74.9	135.7	176.4	-162	173.4	11.6	0	0	112.4	E1148 D1164	E1148-Q1170 HydrophobicContact CB-CB 4.24Å; E1148-Q1170 PolarHBondContact N-O 3.14Å; E1148-Q1170 PolarHBondContact OE1-OE1 3.12Å; D1164-Q1170 PolarHBondContact O-NE2 2.8Å
1171	Y	90.5	Very high	84.4	Confident	27 Å²	27	55.4 Å²	55.4	11%	0.106	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	154.9	178.4	-65.1	-89.8	0	0	0	111.3	M1036 I1146 L1163 D1169 R1206 F1207	M1036-Y1171 HydrophobicContact CE-CD1 4.42Å; M1036-Y1171 HydrophobicContact CE-CE1 4.25Å; M1036-Y1171 HydrophobicContact SD-CD1 4.42Å; M1036-Y1171 HydrophobicContact SD-CE1 3.82Å; I1146-Y1171 WeakPolarHBondContact O-CA 3.38Å; L1163-Y1171 WeakPolarHBondContact CB-O 3.46Å; L1163-Y1171 PolarHBondContact N-O 2.72Å; D1169-Y1171 HydrophobicContact CB-CE2 4.02Å; D1169-Y1171 WeakPolarHBondContact O-CD2 3.21Å; D1169-Y1171 WeakPolarHBondContact O-CE2 3.39Å; Y1171-R1206 HydrophobicContact CD2-CB 4.26Å; Y1171-R1206 HydrophobicContact CE2-CB 4.25Å; Y1171-F1207 AromaticContact CD1-CE1 3.63Å; Y1171-F1207 HydrophobicContact CD1-CE1 3.63Å; Y1171-F1207 HydrophobicContact CD1-CZ 4.14Å; Y1171-F1207 AromaticContact CD2-CE1 3.87Å; Y1171-F1207 HydrophobicContact CD2-CE1 3.87Å; Y1171-F1207 HydrophobicContact CD2-CZ 4.18Å; Y1171-F1207 AromaticContact CE1-CE1 3.86Å; Y1171-F1207 HydrophobicContact CE1-CE1 3.86Å; Y1171-F1207 AromaticContact CE1-CZ 3.88Å; Y1171-F1207 HydrophobicContact CE1-CZ 3.88Å; Y1171-F1207 HydrophobicContact CE2-CE1 4.11Å; Y1171-F1207 AromaticContact CE2-CZ 3.94Å; Y1171-F1207 HydrophobicContact CE2-CZ 3.94Å; Y1171-F1207 HydrophobicContact CG-CD1 4.45Å; Y1171-F1207 AromaticContact CG-CE1 3.65Å; Y1171-F1207 HydrophobicContact CG-CE1 3.65Å; Y1171-F1207 HydrophobicContact CG-CZ 4.3Å; Y1171-F1207 AromaticContact CZ-CZ 3.8Å
1172	C	92	Very high	84.6	Confident	8 Å²	8	53.6 Å²	53.6	5%	0.054	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	153	177.8	-60.6	0	0	0	0	110.6	I1145 I1146 L1160 F1161	I1145-C1172 WeakPolarHBondContact CA-O 3.46Å; I1146-C1172 HydrophobicContact CG1-CB 4.22Å; I1146-C1172 PolarHBondContact N-O 3.28Å; I1146-C1172 PolarHBondContact O-N 2.92Å; L1160-C1172 HydrophobicContact CD2-CB 4.4Å; F1161-C1172 CarbonylContact O-C 3.49Å; F1161-C1172 VanDerWaalsContact O-CA 3.31Å; F1161-C1172 WeakPolarHBondContact O-CA 3.25Å
1173	I	95.8	Very high	84.9	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	119.6	161.6	-63.7	172.5	0	0	0	107.8	Y1141 G1143 E1144 I1145 L1160 F1161 L1163 I1210	Y1141-I1173 HydrophobicContact CD1-CB 4.19Å; Y1141-I1173 HydrophobicContact CD1-CG2 3.83Å; Y1141-I1173 HydrophobicContact CE1-CB 4.34Å; Y1141-I1173 HydrophobicContact CE1-CG2 3.95Å; Y1141-I1173 WeakPolarHBondContact O-CD1 3.2Å; G1143-I1173 VanDerWaalsContact CA-CG2 3.46Å; G1143-I1173 VanDerWaalsContact N-CG2 3.27Å; E1144-I1173 CarbonylContact O-C 3.58Å; E1144-I1173 WeakPolarHBondContact O-CA 3.46Å; I1145-I1173 HydrophobicContact CG1-CG1 4.15Å; L1160-I1173 CarbonylContact C-O 3.59Å; L1160-I1173 WeakPolarHBondContact CA-O 3.37Å; F1161-I1173 PolarHBondContact N-O 3.41Å; F1161-I1173 PolarHBondContact O-N 3.27Å; L1163-I1173 HydrophobicContact CD1-CG1 4.25Å; L1163-I1173 HydrophobicContact CD2-CD1 3.79Å; L1163-I1173 HydrophobicContact CD2-CG1 3.93Å; L1163-I1173 HydrophobicContact CG-CG1 4.37Å; I1173-I1210 HydrophobicContact CD1-CG1 4.2Å
1174	D	96.4	Very high	85.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	108.5	171.2	-177.4	5.3	0	0	0	110.3	E1144 I1146 R1154 L1160 R1176	E1144-D1174 HydrophobicContact CB-CB 4.43Å; E1144-D1174 WeakPolarHBondContact CB-O 3.26Å; E1144-D1174 PolarHBondContact N-O 2.83Å; E1144-D1174 PolarHBondContact O-N 3.26Å; I1146-D1174 HydrophobicContact CD1-CB 3.8Å; I1146-D1174 HydrophobicContact CG1-CB 4.34Å; R1154-D1174 IonicContact CZ-OD2 3.7Å; R1154-D1174 IonicContact NH1-OD2 3.57Å; R1154-D1174 PolarHBondContact NH1-OD2 3.34Å; L1160-D1174 HydrophobicContact CD2-CB 3.7Å; D1174-R1176 VanDerWaalsContact C-N 3.29Å; D1174-R1176 WeakPolarHBondContact OD1-CA 3.48Å; D1174-R1176 WeakPolarHBondContact OD1-CB 3.42Å; D1174-R1176 PolarHBondContact OD1-N 3Å
1175	A	97.6	Very high	86.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	9.6	176.4	0	0	0	0	0	113.7	Y1141 Y1159 Y1178 R1183	Y1141-A1175 HydrophobicContact CE1-CB 3.79Å; Y1159-A1175 PolarHBondContact O-N 3.11Å; A1175-Y1178 CarbonylContact C-O 3.51Å; A1175-Y1178 VanDerWaalsContact CA-O 3.27Å; A1175-Y1178 WeakPolarHBondContact CA-O 3.4Å; A1175-R1183 HydrophobicContact CB-CB 3.77Å; A1175-R1183 PolarHBondContact O-NE 3.28Å; A1175-R1183 PolarHBondContact O-NH2 2.64Å
1176	R	95.6	Very high	88.4	Confident	40 Å²	40	44.2 Å²	44.2	15%	0.151	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	-54.9	-175.4	175.9	61.7	-165.5	100.5	-17.5	112.6	D1023 Y1159 D1174 R1183	D1023-R1176 PolarHBondContact O-NH1 3.08Å; D1023-R1176 IonicContact OD2-CZ 3.89Å; D1023-R1176 IonicContact OD2-NH1 2.81Å; D1023-R1176 PolarHBondContact OD2-NH1 3.06Å; D1023-R1176 IonicContact OD2-NH2 3.73Å; D1023-R1176 PolarHBondContact OD2-NH2 3.04Å; Y1159-R1176 HydrophobicContact CD2-CB 4.16Å; Y1159-R1176 HydrophobicContact CD2-CG 4.47Å; Y1159-R1176 HydrophobicContact CG-CB 4.48Å; D1174-R1176 VanDerWaalsContact C-N 3.29Å; D1174-R1176 WeakPolarHBondContact OD1-CA 3.48Å; D1174-R1176 WeakPolarHBondContact OD1-CB 3.42Å; D1174-R1176 PolarHBondContact OD1-N 3Å; R1176-R1183 PolarHBondContact O-NH2 3.16Å
1177	F	95.4	Very high	89.9	Confident	107 Å²	107	38.1 Å²	38.1	47%	0.469	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-34.3	-173.7	-67	-68.5	0	0	0	113	Y1024 K1025	Y1024-F1177 CarbonylContact C-O 3.54Å; Y1024-F1177 WeakPolarHBondContact CA-O 3.49Å; K1025-F1177 PolarHBondContact N-O 2.71Å
1178	Y	97.2	Very high	91.8	Very high	93 Å²	93	33.2 Å²	33.2	37%	0.365	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	132.3	176.6	-57.4	-85	0	0	0	107.6	K1025 T1033 G1143 E1144 A1175	K1025-Y1178 HydrophobicContact CB-CD1 3.86Å; K1025-Y1178 HydrophobicContact CB-CE1 4.2Å; K1025-Y1178 HydrophobicContact CG-CD1 3.99Å; K1025-Y1178 HydrophobicContact CG-CE1 4.27Å; K1025-Y1178 WeakPolarHBondContact O-CA 3.46Å; T1033-Y1178 HydrophobicContact CG2-CE2 4.27Å; G1143-Y1178 WeakPolarHBondContact CA-O 3.37Å; E1144-Y1178 HydrophobicContact CB-CD2 4.32Å; A1175-Y1178 CarbonylContact C-O 3.51Å; A1175-Y1178 VanDerWaalsContact CA-O 3.27Å; A1175-Y1178 WeakPolarHBondContact CA-O 3.4Å
1179	G	97.3	Very high	93.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.9	169.3	171.8	0	0	0	0	0	114.1	K1025 Y1026 I1027 V1142	K1025-G1179 PolarHBondContact O-N 3.3Å; K1025-G1179 VanDerWaalsContact O-N 3.12Å; Y1026-G1179 VanDerWaalsContact CA-O 3.3Å; Y1026-G1179 WeakPolarHBondContact CA-O 3.3Å; I1027-G1179 PolarHBondContact N-O 3.34Å; V1142-G1179 WeakPolarHBondContact O-CA 3.38Å
1180	N	97.5	Very high	95.2	Very high	5 Å²	5	24.8 Å²	24.8	3%	0.027	11%	0.112	C	C	.	.			trans	-94.1	-158.1	177.1	77.9	-5	0	0	0	111.4	Y1026 I1027 E1140 V1142 S1182 R1183	Y1026-N1180 HydrophobicContact CE1-CB 4.07Å; Y1026-N1180 HydrophobicContact CE2-CB 4.35Å; I1027-N1180 WeakPolarHBondContact O-CA 3.42Å; I1027-N1180 WeakPolarHBondContact O-CB 3.37Å; E1140-N1180 PolarHBondContact O-ND2 3.05Å; E1140-N1180 PolarHBondContact O-OD1 2.99Å; V1142-N1180 HydrophobicContact CB-CB 3.96Å; V1142-N1180 HydrophobicContact CG1-CB 4.46Å; V1142-N1180 WeakPolarHBondContact CG2-ND2 3.31Å; V1142-N1180 PolarHBondContact O-N 3.48Å; N1180-S1182 PolarHBondContact O-N 3.25Å; N1180-S1182 WeakPolarHBondContact OD1-CB 2.86Å; N1180-S1182 PolarHBondContact OD1-N 3.29Å; N1180-S1182 PolarHBondContact OD1-OG 3.28Å; N1180-R1183 WeakPolarHBondContact O-CG 3.48Å
1181	I	97.5	Very high	96	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-58.6	-26	175.5	-160.5	-174.6	0	0	0	114.5	I1009 Y1026 L1110 L1114 V1116 V1126 C1139 R1183 F1184	I1009-I1181 HydrophobicContact CD1-CB 4.16Å; I1009-I1181 HydrophobicContact CD1-CD1 4.08Å; I1009-I1181 HydrophobicContact CD1-CG1 4.46Å; I1009-I1181 HydrophobicContact CG1-CD1 4.25Å; I1009-I1181 HydrophobicContact CG2-CD1 3.49Å; I1009-I1181 VanDerWaalsContact CG2-CD1 3.49Å; I1009-I1181 HydrophobicContact CG2-CG1 4.01Å; Y1026-I1181 HydrophobicContact CE2-CB 4.5Å; Y1026-I1181 PolarHBondContact OH-N 2.84Å; L1110-I1181 HydrophobicContact CD1-CG2 3.85Å; L1114-I1181 HydrophobicContact CB-CD1 3.55Å; L1114-I1181 HydrophobicContact CD1-CD1 3.88Å; L1114-I1181 HydrophobicContact CG-CD1 4.37Å; V1116-I1181 HydrophobicContact CG2-CD1 4.4Å; V1116-I1181 HydrophobicContact CG2-CG1 3.94Å; V1126-I1181 HydrophobicContact CG1-CD1 3.69Å; V1126-I1181 HydrophobicContact CG1-CG1 4.34Å; V1126-I1181 HydrophobicContact CG2-CD1 4.14Å; V1126-I1181 HydrophobicContact CG2-CG1 3.86Å; C1139-I1181 HydrophobicContact CB-CG2 4.08Å; I1181-R1183 PolarHBondContact O-N 2.75Å; I1181-R1183 VanDerWaalsContact O-N 3.12Å; I1181-F1184 PolarHBondContact O-N 2.81Å; I1181-F1184 VanDerWaalsContact O-N 3.09Å
1182	S	98	Very high	96.3	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.007	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-59.6	-29.3	-172.9	74.2	0	0	0	0	113.5	Y1141 V1142 N1180 F1184 L1185	Y1141-S1182 WeakPolarHBondContact CA-OG 3.37Å; Y1141-S1182 WeakPolarHBondContact CD2-OG 3.38Å; V1142-S1182 PolarHBondContact N-OG 3.4Å; N1180-S1182 PolarHBondContact O-N 3.25Å; N1180-S1182 WeakPolarHBondContact OD1-CB 2.86Å; N1180-S1182 PolarHBondContact OD1-N 3.29Å; N1180-S1182 PolarHBondContact OD1-OG 3.28Å; S1182-F1184 PolarHBondContact O-N 3.3Å; S1182-L1185 VanDerWaalsContact O-CB 3.31Å; S1182-L1185 WeakPolarHBondContact O-CB 3.35Å; S1182-L1185 PolarHBondContact O-N 3.34Å
1183	R	97.2	Very high	96.6	Very high	12 Å²	12	23.4 Å²	23.4	5%	0.045	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-61.6	-12.3	178.8	78.4	-170.8	-63.1	-84	6.6	113.9	Y1024 Y1159 A1175 R1176 N1180 I1181	Y1024-R1183 VanDerWaalsContact CD2-CD 3.46Å; Y1024-R1183 VanDerWaalsContact CG-CZ 3.47Å; Y1159-R1183 HydrophobicContact CD1-CB 4.09Å; Y1159-R1183 HydrophobicContact CE1-CB 4.4Å; Y1159-R1183 WeakPolarHBondContact CE1-O 3.46Å; A1175-R1183 HydrophobicContact CB-CB 3.77Å; A1175-R1183 PolarHBondContact O-NE 3.28Å; A1175-R1183 PolarHBondContact O-NH2 2.64Å; R1176-R1183 PolarHBondContact O-NH2 3.16Å; N1180-R1183 WeakPolarHBondContact O-CG 3.48Å; I1181-R1183 PolarHBondContact O-N 2.75Å; I1181-R1183 VanDerWaalsContact O-N 3.12Å
1184	F	97.8	Very high	96.6	Very high	12 Å²	12	24.4 Å²	24.4	5%	0.053	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-106	3.7	176.5	-54.8	-73	0	0	0	113	I1000 P1021 Y1024 V1116 W1124 G1125 V1126 I1181 S1182 N1186	I1000-F1184 HydrophobicContact CD1-CE2 4.2Å; P1021-F1184 HydrophobicContact CB-CE1 4.1Å; P1021-F1184 HydrophobicContact CB-CZ 4.14Å; P1021-F1184 HydrophobicContact CG-CE1 3.93Å; P1021-F1184 HydrophobicContact CG-CZ 4.3Å; Y1024-F1184 HydrophobicContact CD1-CZ 4.41Å; Y1024-F1184 HydrophobicContact CE1-CE2 4.24Å; Y1024-F1184 AromaticContact CE1-CZ 3.69Å; Y1024-F1184 HydrophobicContact CE1-CZ 3.69Å; Y1024-F1184 HydrophobicContact CE2-CE2 4.44Å; Y1024-F1184 AromaticContact CZ-CE2 3.85Å; Y1024-F1184 AromaticContact CZ-CZ 3.8Å; V1116-F1184 HydrophobicContact CG1-CG 4.43Å; V1116-F1184 HydrophobicContact CG2-CB 4.41Å; V1116-F1184 HydrophobicContact CG2-CD2 3.94Å; V1116-F1184 HydrophobicContact CG2-CG 4.31Å; W1124-F1184 HydrophobicContact CB-CD1 3.84Å; W1124-F1184 HydrophobicContact CB-CE1 4.41Å; G1125-F1184 CarbonylContact C-O 3.58Å; G1125-F1184 VanDerWaalsContact CA-O 3.28Å; G1125-F1184 WeakPolarHBondContact CA-O 3.5Å; V1126-F1184 HydrophobicContact CG2-CB 3.76Å; V1126-F1184 PolarHBondContact N-O 3.44Å; I1181-F1184 PolarHBondContact O-N 2.81Å; I1181-F1184 VanDerWaalsContact O-N 3.09Å; S1182-F1184 PolarHBondContact O-N 3.3Å; F1184-N1186 PolarHBondContact O-N 2.91Å
1185	L	97.9	Very high	96.6	Very high	2 Å²	2	26 Å²	26	1%	0.01	13%	0.127	C	C	.	.			trans	-74.3	114.1	173.4	-70.3	170.9	0	0	0	109.6	V1126 S1182 L1193 F1212 L1224 F1226 Y1228	V1126-L1185 HydrophobicContact CB-CD2 3.95Å; V1126-L1185 HydrophobicContact CG2-CD2 4.04Å; V1126-L1185 HydrophobicContact CG2-CG 4.32Å; S1182-L1185 VanDerWaalsContact O-CB 3.31Å; S1182-L1185 WeakPolarHBondContact O-CB 3.35Å; S1182-L1185 PolarHBondContact O-N 3.34Å; L1185-L1193 HydrophobicContact CD1-CD1 3.88Å; L1185-L1193 HydrophobicContact CD2-CD1 3.7Å; L1185-L1193 HydrophobicContact CG-CD1 4.43Å; L1185-F1212 HydrophobicContact CD1-CD2 3.72Å; L1185-F1212 HydrophobicContact CD1-CE2 3.61Å; L1185-F1212 HydrophobicContact CD1-CG 4.33Å; L1185-F1212 HydrophobicContact CD1-CZ 4.16Å; L1185-L1224 HydrophobicContact CD2-CB 3.55Å; L1185-F1226 HydrophobicContact CB-CD1 3.92Å; L1185-F1226 HydrophobicContact CB-CE1 3.89Å; L1185-F1226 HydrophobicContact CD1-CD1 4.48Å; L1185-Y1228 WeakPolarHBondContact O-CE1 3.49Å; L1185-Y1228 PolarHBondContact O-OH 3.11Å
1186	N	97.1	Very high	96.4	Very high	18 Å²	18	26.1 Å²	26.1	10%	0.096	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	161.5	-176.9	-81.4	-47.6	0	0	0	113.3	K1122 W1124 G1125 F1184 E1223 G1225 F1226 Y1228	K1122-N1186 HydrophobicContact CD-CB 4.39Å; W1124-N1186 PolarHBondContact O-ND2 3.15Å; W1124-N1186 PolarHBondContact O-OD1 3.33Å; G1125-N1186 WeakPolarHBondContact CA-ND2 3.36Å; F1184-N1186 PolarHBondContact O-N 2.91Å; N1186-E1223 WeakPolarHBondContact CB-OE1 3.13Å; N1186-E1223 PolarHBondContact ND2-OE1 3.45Å; N1186-G1225 WeakPolarHBondContact O-CA 3.49Å; N1186-F1226 PolarHBondContact O-N 2.95Å; N1186-Y1228 WeakPolarHBondContact CA-OH 3.39Å
1187	H	95.9	Very high	96.5	Very high	10 Å²	10	27.4 Å²	27.4	5%	0.046	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	136	170.6	177.6	53.2	0	0	0	112.1	C1189 F1226 N1227 Y1228 W1233 C1242 Y1251	H1187-C1189 PolarHBondContact NE2-SG 3.22Å; H1187-F1226 WeakPolarHBondContact CA-O 3.26Å; H1187-F1226 PolarHBondContact ND1-O 2.89Å; H1187-F1226 VanDerWaalsContact ND1-O 3.16Å; H1187-N1227 PolarHBondContact CE1-OD1 2.8Å; H1187-Y1228 VanDerWaalsContact CA-CE1 3.5Å; H1187-Y1228 HydrophobicContact CB-CD1 3.73Å; H1187-Y1228 HydrophobicContact CB-CD2 3.95Å; H1187-Y1228 HydrophobicContact CB-CE1 3.76Å; H1187-Y1228 HydrophobicContact CB-CE2 4Å; H1187-Y1228 HydrophobicContact CB-CG 3.82Å; H1187-Y1228 PolarHBondContact N-OH 2.76Å; H1187-Y1228 PolarHBondContact ND1-N 3.03Å; H1187-W1233 HydrophobicContact CB-CZ2 4.07Å; H1187-W1233 AromaticContact CD2-CE2 3.56Å; H1187-W1233 AromaticContact CD2-CZ2 3.34Å; H1187-W1233 WeakPolarHBondContact CD2-CZ2 3.42Å; H1187-W1233 AromaticContact CD2-NE1 3.31Å; H1187-W1233 PolarHBondContact CD2-NE1 2.97Å; H1187-W1233 VanDerWaalsContact CD2-NE1 3.31Å; H1187-W1233 AromaticContact CE1-NE1 3.71Å; H1187-W1233 AromaticContact CG-CZ2 3.8Å; H1187-W1233 AromaticContact CG-NE1 3.6Å; H1187-W1233 AromaticContact ND1-NE1 3.86Å; H1187-W1233 AromaticContact NE2-NE1 3.39Å; H1187-W1233 PolarHBondContact NE2-NE1 2.85Å; H1187-C1242 VanDerWaalsContact CD2-SG 3.51Å; H1187-Y1251 AromaticContact NE2-CD2 3.7Å; H1187-Y1251 AromaticContact NE2-CE2 3.77Å
1188	M	95.3	Very high	96.5	Very high	25 Å²	25	22.3 Å²	22.3	12%	0.123	11%	0.111	C	C	.	.			trans	-131.1	131.6	167.2	-66.3	-178.4	-176.3	0	0	111	E1190 P1191 E1223 F1226	M1188-E1190 VanDerWaalsContact C-N 3.3Å; M1188-P1191 HydrophobicContact CB-CB 4.26Å; M1188-E1223 HydrophobicContact CE-CB 3.8Å; M1188-E1223 HydrophobicContact CE-CG 3.62Å; M1188-F1226 PolarHBondContact N-O 3.38Å
1189	C	93.6	Very high	96.5	Very high	28 Å²	28	18 Å²	18	19%	0.189	9%	0.094	C	C	.	.	S	Bend	trans	-72.3	-24.8	174	-66.7	0	0	0	0	112.9	H1187 C1249	H1187-C1189 PolarHBondContact NE2-SG 3.22Å; C1189-C1249 VanDerWaalsContact SG-SG 3.62Å
1190	E	94.3	Very high	96.4	Very high	86 Å²	86	18.4 Å²	18.4	40%	0.402	10%	0.096	S	C	.	.	S	Bend	trans	-117.9	88.7	167.1	-68.7	-179.4	104.5	0	0	106.8	M1188 S1246 K1248	M1188-E1190 VanDerWaalsContact C-N 3.3Å; E1190-S1246 WeakPolarHBondContact OE2-CB 3.48Å; E1190-S1246 PolarHBondContact OE2-OG 3.46Å; E1190-K1248 HydrophobicContact CG-CB 4.46Å; E1190-K1248 HydrophobicContact CG-CD 4.49Å; E1190-K1248 VanDerWaalsContact OE1-CD 3.3Å; E1190-K1248 WeakPolarHBondContact OE1-CD 3.47Å; E1190-K1248 VanDerWaalsContact OE1-CE 3.25Å; E1190-K1248 WeakPolarHBondContact OE1-CE 3.23Å; E1190-K1248 IonicContact OE1-NZ 2.77Å; E1190-K1248 PolarHBondContact OE1-NZ 3.45Å
1191	P	95.8	Very high	96.1	Very high	39 Å²	39	21.8 Å²	21.8	25%	0.253	12%	0.117	S	C	.	.			trans	-88.1	133.5	-166.4	32.8	-35.5	0	0	0	113.7	M1188 L1193 S1215 G1225 N1227	M1188-P1191 HydrophobicContact CB-CB 4.26Å; P1191-L1193 VanDerWaalsContact C-N 3.33Å; P1191-L1193 WeakPolarHBondContact CB-O 3.4Å; P1191-S1215 WeakPolarHBondContact O-CB 3.42Å; P1191-S1215 PolarHBondContact O-OG 3.26Å; P1191-G1225 WeakPolarHBondContact CB-O 3.28Å; P1191-N1227 HydrophobicContact CG-CB 4.31Å
1192	N	97.2	Very high	95.9	Very high	10 Å²	10	22.4 Å²	22.4	5%	0.053	12%	0.12	C	C	.	.	S	Bend	trans	-86.1	-3	173.5	65.7	6.6	0	0	0	113.6	S1215 E1216 V1218 E1223 L1224 G1225	N1192-S1215 WeakPolarHBondContact O-CB 3.48Å; N1192-S1215 PolarHBondContact O-N 3.21Å; N1192-E1216 HydrophobicContact CB-CG 4.29Å; N1192-V1218 HydrophobicContact CB-CG2 3.88Å; N1192-E1223 PolarHBondContact ND2-O 3.24Å; N1192-L1224 WeakPolarHBondContact OD1-CA 3.47Å; N1192-G1225 PolarHBondContact N-O 2.79Å; N1192-G1225 PolarHBondContact OD1-N 3.18Å; N1192-G1225 PolarHBondContact OD1-O 3.05Å
1193	L	97.6	Very high	95.8	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	147.1	165.2	-62	-178	0	0	0	112	V1138 L1185 P1191 F1212 F1213 L1224 G1225 F1226	V1138-L1193 HydrophobicContact CB-CD2 4.08Å; V1138-L1193 HydrophobicContact CG1-CD2 4.25Å; V1138-L1193 HydrophobicContact CG2-CD2 3.72Å; L1185-L1193 HydrophobicContact CD1-CD1 3.88Å; L1185-L1193 HydrophobicContact CD2-CD1 3.7Å; L1185-L1193 HydrophobicContact CG-CD1 4.43Å; P1191-L1193 VanDerWaalsContact C-N 3.33Å; P1191-L1193 WeakPolarHBondContact CB-O 3.4Å; L1193-F1212 HydrophobicContact CB-CB 4.49Å; L1193-F1212 HydrophobicContact CB-CD1 4.16Å; L1193-F1212 HydrophobicContact CD1-CB 4.17Å; L1193-F1212 HydrophobicContact CD1-CD1 4.48Å; L1193-F1212 HydrophobicContact CD1-CG 4.29Å; L1193-F1213 WeakPolarHBondContact CA-O 3.31Å; L1193-L1224 HydrophobicContact CD1-CB 4.02Å; L1193-L1224 HydrophobicContact CD2-CD2 4.28Å; L1193-L1224 HydrophobicContact CG-CB 4.45Å; L1193-L1224 HydrophobicContact CG-CD2 4.38Å; L1193-G1225 PolarHBondContact N-O 3.31Å; L1193-G1225 VanDerWaalsContact N-O 3.07Å; L1193-F1226 HydrophobicContact CB-CB 4.29Å
1194	F	96.5	Very high	95.6	Very high	23 Å²	23	24 Å²	24	10%	0.101	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	150.2	164.9	70.6	-80.4	0	0	0	110.4	L1076 F1080 R1082 P1085 F1212 F1213	L1076-F1194 HydrophobicContact CD1-CE2 4.31Å; L1076-F1194 HydrophobicContact CD1-CZ 3.7Å; F1080-F1194 HydrophobicContact CD1-CE2 4.11Å; F1080-F1194 HydrophobicContact CD1-CZ 4.13Å; F1080-F1194 AromaticContact CE1-CE2 3.68Å; F1080-F1194 HydrophobicContact CE1-CE2 3.68Å; F1080-F1194 HydrophobicContact CE1-CZ 4.11Å; R1082-F1194 HydrophobicContact CB-CD2 4.39Å; R1082-F1194 HydrophobicContact CB-CE2 4.45Å; R1082-F1194 HydrophobicContact CB-CG 4.45Å; R1082-F1194 HydrophobicContact CG-CD1 4.22Å; R1082-F1194 HydrophobicContact CG-CD2 4.42Å; R1082-F1194 HydrophobicContact CG-CE1 3.82Å; R1082-F1194 HydrophobicContact CG-CE2 4.05Å; R1082-F1194 HydrophobicContact CG-CG 4.5Å; R1082-F1194 HydrophobicContact CG-CZ 3.71Å; P1085-F1194 HydrophobicContact CG-CD2 4.09Å; P1085-F1194 HydrophobicContact CG-CE2 4.4Å; F1194-F1212 WeakPolarHBondContact O-CA 3.5Å; F1194-F1213 HydrophobicContact CD1-CB 4.3Å; F1194-F1213 VanDerWaalsContact CD1-O 3.31Å; F1194-F1213 WeakPolarHBondContact CD1-O 3.46Å; F1194-F1213 HydrophobicContact CE1-CB 3.65Å; F1194-F1213 HydrophobicContact CE2-CB 4.22Å; F1194-F1213 HydrophobicContact CZ-CB 3.62Å; F1194-F1213 HydrophobicContact CZ-CG 4.46Å; F1194-F1213 PolarHBondContact N-O 2.86Å; F1194-F1213 PolarHBondContact O-N 2.96Å
1195	A	95.4	Very high	95.2	Very high	32 Å²	32	28 Å²	28	26%	0.264	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	145.9	179.4	0	0	0	0	0	111.3	F1161 I1210 A1211 F1212	F1161-A1195 HydrophobicContact CE2-CB 4.37Å; F1161-A1195 HydrophobicContact CZ-CB 3.87Å; A1195-I1210 HydrophobicContact CB-CG2 4.07Å; A1195-A1211 CarbonylContact C-O 3.52Å; A1195-F1212 HydrophobicContact CB-CD1 4.17Å; A1195-F1212 HydrophobicContact CB-CE1 3.94Å
1196	C	95.4	Very high	94.9	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.02	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	141.8	175.3	177.8	0	0	0	0	109.7	P1085 I1088 A1211 F1213	P1085-C1196 HydrophobicContact CB-CB 4.34Å; I1088-C1196 VanDerWaalsContact CD1-SG 3.57Å; C1196-A1211 PolarHBondContact N-O 3.35Å; C1196-A1211 PolarHBondContact O-N 2.99Å; C1196-F1213 HydrophobicContact CB-CD2 3.83Å; C1196-F1213 HydrophobicContact CB-CE2 3.9Å
1197	R	95.7	Very high	94.7	Very high	68 Å²	68	30.1 Å²	30.1	26%	0.257	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	120.7	-179.9	-73.4	-173.6	-84.1	-168.1	-8.2	110.5	L1087 I1088 L1163 D1164 D1165 P1208 I1210	L1087-R1197 HydrophobicContact CD2-CB 3.62Å; L1087-R1197 HydrophobicContact CD2-CG 4.49Å; I1088-R1197 PolarHBondContact N-O 3.36Å; L1163-R1197 PolarHBondContact O-NH1 3.34Å; D1164-R1197 IonicContact OD1-CZ 3.29Å; D1164-R1197 IonicContact OD1-NH1 3.92Å; D1164-R1197 PolarHBondContact OD1-NH1 2.9Å; D1165-R1197 IonicContact OD2-NH2 3.74Å; R1197-P1208 HydrophobicContact CB-CB 3.77Å; R1197-P1208 HydrophobicContact CB-CG 4.37Å; R1197-P1208 HydrophobicContact CG-CB 3.88Å; R1197-P1208 HydrophobicContact CG-CG 3.94Å; R1197-I1210 HydrophobicContact CG-CD1 3.9Å
1198	V	97.4	Very high	94.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.6	-170.5	-171.9	0	0	0	0	111.5	I1088 E1090 V1106 T1200 H1209 A1211	I1088-V1198 HydrophobicContact CB-CG1 4.31Å; I1088-V1198 HydrophobicContact CB-CG2 4.22Å; I1088-V1198 HydrophobicContact CG2-CG1 4.49Å; I1088-V1198 CarbonylContact O-C 3.56Å; I1088-V1198 VanDerWaalsContact O-CA 3.32Å; I1088-V1198 WeakPolarHBondContact O-CA 3.13Å; E1090-V1198 HydrophobicContact CG-CG1 3.82Å; V1106-V1198 HydrophobicContact CB-CG1 4.28Å; V1106-V1198 HydrophobicContact CG2-CG1 4.13Å; V1106-V1198 HydrophobicContact CG2-CG2 4.24Å; V1198-T1200 HydrophobicContact CG1-CG2 4.07Å; V1198-H1209 HydrophobicContact CB-CB 4.41Å; V1198-H1209 PolarHBondContact N-O 3.03Å; V1198-H1209 VanDerWaalsContact O-CB 3.32Å; V1198-H1209 WeakPolarHBondContact O-CB 3.16Å; V1198-H1209 PolarHBondContact O-CD2 2.75Å; V1198-H1209 PolarHBondContact O-N 3.21Å; V1198-A1211 HydrophobicContact CG2-CB 3.7Å
1199	F	97.1	Very high	94.6	Very high	3 Å²	3	30 Å²	30	1%	0.013	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	128.5	177.6	-61.8	-76	0	0	0	110.5	L1087 I1088 F1089 E1090 Q1203 D1204 L1205 P1208	L1087-F1199 HydrophobicContact CB-CE2 4.29Å; L1087-F1199 HydrophobicContact CD1-CE2 4.18Å; L1087-F1199 HydrophobicContact CD2-CE2 4.28Å; L1087-F1199 HydrophobicContact CG-CE2 4.48Å; I1088-F1199 PolarHBondContact O-N 3.08Å; F1089-F1199 HydrophobicContact CD1-CB 3.86Å; F1089-F1199 AromaticContact CD1-CD2 3.93Å; F1089-F1199 HydrophobicContact CD1-CD2 3.93Å; F1089-F1199 HydrophobicContact CD1-CG 4.19Å; F1089-F1199 HydrophobicContact CE1-CB 4.13Å; F1089-F1199 AromaticContact CE1-CD2 3.51Å; F1089-F1199 HydrophobicContact CE1-CD2 3.51Å; F1089-F1199 HydrophobicContact CE1-CE2 4.21Å; F1089-F1199 AromaticContact CE1-CG 3.95Å; F1089-F1199 HydrophobicContact CE1-CG 3.95Å; F1089-F1199 HydrophobicContact CE2-CD2 4.38Å; F1089-F1199 AromaticContact CZ-CD2 3.77Å; F1089-F1199 HydrophobicContact CZ-CD2 3.77Å; F1089-F1199 HydrophobicContact CZ-CE2 4.1Å; E1090-F1199 PolarHBondContact N-O 3.38Å; F1199-Q1203 HydrophobicContact CB-CG 4.1Å; F1199-D1204 WeakPolarHBondContact CE1-O 3.3Å; F1199-L1205 HydrophobicContact CD2-CD2 4.47Å; F1199-L1205 HydrophobicContact CE1-CD2 4.17Å; F1199-L1205 HydrophobicContact CE2-CD2 3.82Å; F1199-L1205 HydrophobicContact CZ-CB 4.45Å; F1199-L1205 HydrophobicContact CZ-CD2 3.64Å; F1199-P1208 HydrophobicContact CE1-CB 3.88Å; F1199-P1208 HydrophobicContact CE2-CB 4.48Å; F1199-P1208 HydrophobicContact CZ-CB 3.74Å
1200	T	94.9	Very high	94.8	Very high	8 Å²	8	28.8 Å²	28.8	5%	0.049	15%	0.147	C	C	.	.	S	Bend	trans	-128.1	-65.3	-169.1	70.6	0	0	0	0	113.2	E1090 N1092 Q1107 V1198 H1209	E1090-T1200 HydrophobicContact CB-CG2 4.42Å; E1090-T1200 HydrophobicContact CG-CG2 4.38Å; N1092-T1200 WeakPolarHBondContact CA-O 3.4Å; N1092-T1200 WeakPolarHBondContact CB-O 3.33Å; Q1107-T1200 HydrophobicContact CB-CG2 4.23Å; V1198-T1200 HydrophobicContact CG1-CG2 4.07Å; T1200-H1209 PolarHBondContact OG1-CD2 3.38Å; T1200-H1209 PolarHBondContact OG1-NE2 3.14Å
1201	T	91.4	Very high	94.9	Very high	76 Å²	76	24.7 Å²	24.7	47%	0.466	13%	0.128	S	C	.	.	S	Bend	trans	-101.4	-28.4	-175.2	61.1	0	0	0	0	113.1	H1093	H1093-T1201 PolarHBondContact CE1-O 3.44Å
1202	H	93	Very high	95.1	Very high	13 Å²	13	22.8 Å²	22.8	6%	0.06	12%	0.116	C	C	.	.			trans	-124.1	167.5	165.5	49.8	95.6	0	0	0	110	D1039 F1207	D1039-H1202 WeakPolarHBondContact O-CB 3.01Å; H1202-F1207 PolarHBondContact CE1-O 3.35Å; H1202-F1207 VanDerWaalsContact CE1-O 3.27Å
1203	Q	94.6	Very high	95.1	Very high	28 Å²	28	22.3 Å²	22.3	13%	0.131	11%	0.114	C	C	.	.			trans	-126.9	20.3	175.6	-71.2	171.2	-11.4	0	0	111.7	L1045 Q1046 F1089 N1092 F1199 L1205	L1045-Q1203 HydrophobicContact CD2-CB 4.26Å; L1045-Q1203 HydrophobicContact CD2-CG 3.84Å; Q1046-Q1203 PolarHBondContact O-NE2 2.18Å; F1089-Q1203 HydrophobicContact CD1-CG 4.04Å; F1089-Q1203 HydrophobicContact CE1-CG 4.3Å; N1092-Q1203 PolarHBondContact ND2-NE2 3.48Å; F1199-Q1203 HydrophobicContact CB-CG 4.1Å; Q1203-L1205 PolarHBondContact O-N 2.93Å; Q1203-L1205 VanDerWaalsContact O-N 3.13Å
1204	D	92.9	Very high	95.1	Very high	19 Å²	19	22.3 Å²	22.3	10%	0.102	11%	0.113	C	C	.	.			trans	-62.7	107.4	168.9	-169.7	-21.8	0	0	0	109.7	I1038 D1039 F1199 R1206 F1207	I1038-D1204 WeakPolarHBondContact CA-OD2 3.2Å; I1038-D1204 HydrophobicContact CG2-CB 4.37Å; D1039-D1204 HydrophobicContact CB-CB 4.12Å; D1039-D1204 PolarHBondContact N-OD2 3.23Å; F1199-D1204 WeakPolarHBondContact CE1-O 3.3Å; D1204-R1206 PolarHBondContact O-N 2.9Å; D1204-R1206 VanDerWaalsContact O-N 3.12Å; D1204-R1206 IonicContact OD1-CZ 3.65Å; D1204-R1206 PolarHBondContact OD1-N 3.44Å; D1204-R1206 IonicContact OD1-NE 2.91Å; D1204-R1206 PolarHBondContact OD1-NE 2.89Å; D1204-R1206 IonicContact OD1-NH2 3.53Å; D1204-R1206 IonicContact OD2-CZ 3.55Å; D1204-R1206 IonicContact OD2-NE 3.61Å; D1204-R1206 IonicContact OD2-NH2 2.7Å; D1204-R1206 PolarHBondContact OD2-NH2 2.92Å; D1204-F1207 HydrophobicContact CB-CD2 4.3Å; D1204-F1207 PolarHBondContact O-N 3Å; D1204-F1207 VanDerWaalsContact O-N 3.08Å
1205	L	91.3	Very high	95.1	Very high	95 Å²	95	21.5 Å²	21.5	50%	0.497	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-20	-168.4	-61.3	-179.7	0	0	0	113.8	F1089 F1199 Q1203 F1207	F1089-L1205 HydrophobicContact CE1-CD2 4.29Å; F1089-L1205 HydrophobicContact CZ-CD2 4.09Å; F1199-L1205 HydrophobicContact CD2-CD2 4.47Å; F1199-L1205 HydrophobicContact CE1-CD2 4.17Å; F1199-L1205 HydrophobicContact CE2-CD2 3.82Å; F1199-L1205 HydrophobicContact CZ-CB 4.45Å; F1199-L1205 HydrophobicContact CZ-CD2 3.64Å; Q1203-L1205 PolarHBondContact O-N 2.93Å; Q1203-L1205 VanDerWaalsContact O-N 3.13Å; L1205-F1207 PolarHBondContact O-N 3.47Å
1206	R	90.3	Very high	95.1	Very high	61 Å²	61	24.8 Å²	24.8	23%	0.23	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-19.3	177	-58.4	173.7	-64.7	155.9	3	113.1	N1037 Y1171 D1204 P1208	N1037-R1206 PolarHBondContact O-NH2 3.03Å; N1037-R1206 PolarHBondContact OD1-NH1 3Å; N1037-R1206 PolarHBondContact OD1-NH2 3.06Å; Y1171-R1206 HydrophobicContact CD2-CB 4.26Å; Y1171-R1206 HydrophobicContact CE2-CB 4.25Å; D1204-R1206 PolarHBondContact O-N 2.9Å; D1204-R1206 VanDerWaalsContact O-N 3.12Å; D1204-R1206 IonicContact OD1-CZ 3.65Å; D1204-R1206 PolarHBondContact OD1-N 3.44Å; D1204-R1206 IonicContact OD1-NE 2.91Å; D1204-R1206 PolarHBondContact OD1-NE 2.89Å; D1204-R1206 IonicContact OD1-NH2 3.53Å; D1204-R1206 IonicContact OD2-CZ 3.55Å; D1204-R1206 IonicContact OD2-NE 3.61Å; D1204-R1206 IonicContact OD2-NH2 2.7Å; D1204-R1206 PolarHBondContact OD2-NH2 2.92Å; R1206-P1208 VanDerWaalsContact C-CD 3.43Å; R1206-P1208 WeakPolarHBondContact O-CD 3.43Å
1207	F	92.6	Very high	95.2	Very high	4 Å²	4	30 Å²	30	2%	0.018	15%	0.148	C	C	.	.	S	Bend	trans	-128.5	63.3	-172.9	-54.4	-66.2	0	0	0	111.7	M1036 I1038 I1145 Y1171 H1202 D1204 L1205	M1036-F1207 HydrophobicContact CB-CZ 4.33Å; I1038-F1207 HydrophobicContact CB-CD2 4.13Å; I1038-F1207 HydrophobicContact CB-CE2 4.31Å; I1038-F1207 HydrophobicContact CG1-CD2 3.72Å; I1038-F1207 HydrophobicContact CG1-CE2 3.77Å; I1038-F1207 HydrophobicContact CG1-CG 4.17Å; I1038-F1207 HydrophobicContact CG1-CZ 4.28Å; I1038-F1207 HydrophobicContact CG2-CD2 3.99Å; I1145-F1207 HydrophobicContact CD1-CD1 4.43Å; I1145-F1207 HydrophobicContact CG2-CD1 3.77Å; I1145-F1207 HydrophobicContact CG2-CE1 3.68Å; Y1171-F1207 AromaticContact CD1-CE1 3.63Å; Y1171-F1207 HydrophobicContact CD1-CE1 3.63Å; Y1171-F1207 HydrophobicContact CD1-CZ 4.14Å; Y1171-F1207 AromaticContact CD2-CE1 3.87Å; Y1171-F1207 HydrophobicContact CD2-CE1 3.87Å; Y1171-F1207 HydrophobicContact CD2-CZ 4.18Å; Y1171-F1207 AromaticContact CE1-CE1 3.86Å; Y1171-F1207 HydrophobicContact CE1-CE1 3.86Å; Y1171-F1207 AromaticContact CE1-CZ 3.88Å; Y1171-F1207 HydrophobicContact CE1-CZ 3.88Å; Y1171-F1207 HydrophobicContact CE2-CE1 4.11Å; Y1171-F1207 AromaticContact CE2-CZ 3.94Å; Y1171-F1207 HydrophobicContact CE2-CZ 3.94Å; Y1171-F1207 HydrophobicContact CG-CD1 4.45Å; Y1171-F1207 AromaticContact CG-CE1 3.65Å; Y1171-F1207 HydrophobicContact CG-CE1 3.65Å; Y1171-F1207 HydrophobicContact CG-CZ 4.3Å; Y1171-F1207 AromaticContact CZ-CZ 3.8Å; H1202-F1207 PolarHBondContact CE1-O 3.35Å; H1202-F1207 VanDerWaalsContact CE1-O 3.27Å; D1204-F1207 HydrophobicContact CB-CD2 4.3Å; D1204-F1207 PolarHBondContact O-N 3Å; D1204-F1207 VanDerWaalsContact O-N 3.08Å; L1205-F1207 PolarHBondContact O-N 3.47Å
1208	P	94.3	Very high	95.3	Very high	4 Å²	4	26.9 Å²	26.9	3%	0.026	14%	0.137	C	C	.	.			trans	-69.4	144.6	173.1	30.3	-33.4	0	0	0	111.1	L1163 R1197 F1199 R1206 I1210	L1163-P1208 HydrophobicContact CB-CG 4.31Å; L1163-P1208 HydrophobicContact CD2-CG 4.27Å; R1197-P1208 HydrophobicContact CB-CB 3.77Å; R1197-P1208 HydrophobicContact CB-CG 4.37Å; R1197-P1208 HydrophobicContact CG-CB 3.88Å; R1197-P1208 HydrophobicContact CG-CG 3.94Å; F1199-P1208 HydrophobicContact CE1-CB 3.88Å; F1199-P1208 HydrophobicContact CE2-CB 4.48Å; F1199-P1208 HydrophobicContact CZ-CB 3.74Å; R1206-P1208 VanDerWaalsContact C-CD 3.43Å; R1206-P1208 WeakPolarHBondContact O-CD 3.43Å; P1208-I1210 HydrophobicContact CG-CD1 4.13Å
1209	H	95.3	Very high	95.2	Very high	28 Å²	28	32.7 Å²	32.7	13%	0.13	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	133	161.2	-65.3	-97	0	0	0	108.8	E1140 V1198 T1200 A1211	E1140-H1209 VanDerWaalsContact CD-ND1 3.26Å; E1140-H1209 HydrophobicContact CG-CB 4.41Å; E1140-H1209 IonicContact OE1-CE1 3.46Å; E1140-H1209 IonicContact OE1-CG 3.97Å; E1140-H1209 IonicContact OE1-ND1 2.67Å; E1140-H1209 PolarHBondContact OE1-ND1 3.14Å; E1140-H1209 IonicContact OE2-CG 2.61Å; E1140-H1209 IonicContact OE2-ND1 2.73Å; E1140-H1209 PolarHBondContact OE2-ND1 3.46Å; E1140-H1209 VanDerWaalsContact OE2-ND1 3.09Å; V1198-H1209 HydrophobicContact CB-CB 4.41Å; V1198-H1209 PolarHBondContact N-O 3.03Å; V1198-H1209 VanDerWaalsContact O-CB 3.32Å; V1198-H1209 WeakPolarHBondContact O-CB 3.16Å; V1198-H1209 PolarHBondContact O-CD2 2.75Å; V1198-H1209 PolarHBondContact O-N 3.21Å; T1200-H1209 PolarHBondContact OG1-CD2 3.38Å; T1200-H1209 PolarHBondContact OG1-NE2 3.14Å; H1209-A1211 PolarHBondContact O-N 3.01Å
1210	I	97.1	Very high	95.2	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.015	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	92.1	-178.8	-60.1	-54.4	0	0	0	109	E1140 Y1141 F1161 L1163 I1173 A1195 R1197 P1208	E1140-I1210 CarbonylContact C-O 3.49Å; E1140-I1210 VanDerWaalsContact CA-O 3.3Å; E1140-I1210 WeakPolarHBondContact CA-O 3.33Å; E1140-I1210 WeakPolarHBondContact CG-O 3.36Å; Y1141-I1210 PolarHBondContact N-O 2.95Å; F1161-I1210 HydrophobicContact CD1-CD1 4.41Å; F1161-I1210 HydrophobicContact CD1-CG1 4Å; F1161-I1210 HydrophobicContact CD1-CG2 4.06Å; F1161-I1210 HydrophobicContact CD2-CG2 4.42Å; F1161-I1210 HydrophobicContact CE1-CB 4.38Å; F1161-I1210 HydrophobicContact CE1-CD1 3.93Å; F1161-I1210 HydrophobicContact CE1-CG1 3.9Å; F1161-I1210 HydrophobicContact CE1-CG2 3.57Å; F1161-I1210 HydrophobicContact CE2-CG2 3.95Å; F1161-I1210 HydrophobicContact CG-CG2 4.49Å; F1161-I1210 HydrophobicContact CZ-CG2 3.52Å; L1163-I1210 HydrophobicContact CD2-CD1 3.73Å; L1163-I1210 HydrophobicContact CD2-CG1 3.55Å; I1173-I1210 HydrophobicContact CD1-CG1 4.2Å; A1195-I1210 HydrophobicContact CB-CG2 4.07Å; R1197-I1210 HydrophobicContact CG-CD1 3.9Å; P1208-I1210 HydrophobicContact CG-CD1 4.13Å
1211	A	97.9	Very high	95.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	126	-176.3	0	0	0	0	0	111.7	V1106 F1137 A1195 C1196 V1198 H1209 F1213	V1106-A1211 HydrophobicContact CG1-CB 3.97Å; V1106-A1211 HydrophobicContact CG2-CB 3.74Å; F1137-A1211 HydrophobicContact CD2-CB 4.11Å; F1137-A1211 HydrophobicContact CE2-CB 3.77Å; A1195-A1211 CarbonylContact C-O 3.52Å; C1196-A1211 PolarHBondContact N-O 3.35Å; C1196-A1211 PolarHBondContact O-N 2.99Å; V1198-A1211 HydrophobicContact CG2-CB 3.7Å; H1209-A1211 PolarHBondContact O-N 3.01Å; A1211-F1213 HydrophobicContact CB-CD2 4.33Å; A1211-F1213 HydrophobicContact CB-CE2 3.62Å; A1211-F1213 HydrophobicContact CB-CZ 4.26Å
1212	F	98.4	Very high	95.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	131.7	171.1	-68.2	-72.1	0	0	0	112	F1137 V1138 C1139 Y1141 F1161 L1185 L1193 F1194 A1195 F1226	F1137-F1212 WeakPolarHBondContact CD2-O 3.18Å; V1138-F1212 PolarHBondContact N-O 3.42Å; C1139-F1212 WeakPolarHBondContact O-CB 3.39Å; C1139-F1212 PolarHBondContact O-N 3.46Å; Y1141-F1212 AromaticContact CD2-CE2 3.79Å; Y1141-F1212 HydrophobicContact CD2-CE2 3.79Å; Y1141-F1212 AromaticContact CD2-CZ 3.93Å; Y1141-F1212 HydrophobicContact CD2-CZ 3.93Å; Y1141-F1212 HydrophobicContact CG-CE2 4.29Å; F1161-F1212 HydrophobicContact CE2-CZ 4.31Å; L1185-F1212 HydrophobicContact CD1-CD2 3.72Å; L1185-F1212 HydrophobicContact CD1-CE2 3.61Å; L1185-F1212 HydrophobicContact CD1-CG 4.33Å; L1185-F1212 HydrophobicContact CD1-CZ 4.16Å; L1193-F1212 HydrophobicContact CB-CB 4.49Å; L1193-F1212 HydrophobicContact CB-CD1 4.16Å; L1193-F1212 HydrophobicContact CD1-CB 4.17Å; L1193-F1212 HydrophobicContact CD1-CD1 4.48Å; L1193-F1212 HydrophobicContact CD1-CG 4.29Å; F1194-F1212 WeakPolarHBondContact O-CA 3.5Å; A1195-F1212 HydrophobicContact CB-CD1 4.17Å; A1195-F1212 HydrophobicContact CB-CE1 3.94Å; F1212-F1226 HydrophobicContact CD1-CB 4.38Å; F1212-F1226 HydrophobicContact CE1-CB 3.82Å; F1212-F1226 AromaticContact CE1-CD1 3.84Å; F1212-F1226 HydrophobicContact CE1-CD1 3.84Å; F1212-F1226 AromaticContact CE1-CD2 3.8Å; F1212-F1226 HydrophobicContact CE1-CD2 3.8Å; F1212-F1226 HydrophobicContact CE1-CE1 4.34Å; F1212-F1226 HydrophobicContact CE1-CE2 4.32Å; F1212-F1226 AromaticContact CE1-CG 3.55Å; F1212-F1226 HydrophobicContact CE1-CG 3.55Å; F1212-F1226 AromaticContact CZ-CD1 3.83Å; F1212-F1226 HydrophobicContact CZ-CD1 3.83Å; F1212-F1226 HydrophobicContact CZ-CD2 4.11Å; F1212-F1226 AromaticContact CZ-CE1 3.89Å; F1212-F1226 HydrophobicContact CZ-CE1 3.89Å; F1212-F1226 HydrophobicContact CZ-CE2 4.18Å; F1212-F1226 AromaticContact CZ-CG 3.96Å; F1212-F1226 HydrophobicContact CZ-CG 3.96Å; F1212-F1226 HydrophobicContact CZ-CZ 4.08Å
1213	F	98.2	Very high	95.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	146.1	174.1	-69.4	-88.3	0	0	0	111	Y1070 L1076 V1106 G1135 S1136 F1137 L1193 F1194 C1196 A1211 S1215	Y1070-F1213 AromaticContact CE1-CE1 3.86Å; Y1070-F1213 HydrophobicContact CE1-CE1 3.86Å; Y1070-F1213 AromaticContact CE1-CZ 3.94Å; Y1070-F1213 HydrophobicContact CE1-CZ 3.94Å; L1076-F1213 HydrophobicContact CD1-CB 3.82Å; L1076-F1213 HydrophobicContact CD1-CD1 3.54Å; L1076-F1213 HydrophobicContact CD1-CD2 3.9Å; L1076-F1213 HydrophobicContact CD1-CE1 4.04Å; L1076-F1213 HydrophobicContact CD1-CE2 4.36Å; L1076-F1213 HydrophobicContact CD1-CG 3.46Å; L1076-F1213 VanDerWaalsContact CD1-CG 3.46Å; L1076-F1213 HydrophobicContact CD1-CZ 4.43Å; L1076-F1213 HydrophobicContact CD2-CE1 4.28Å; L1076-F1213 HydrophobicContact CG-CD1 3.74Å; L1076-F1213 HydrophobicContact CG-CE1 3.94Å; L1076-F1213 HydrophobicContact CG-CG 4.21Å; V1106-F1213 HydrophobicContact CG2-CE2 4.45Å; V1106-F1213 HydrophobicContact CG2-CZ 3.84Å; G1135-F1213 WeakPolarHBondContact O-CD1 3.24Å; S1136-F1213 CarbonylContact O-C 3.3Å; S1136-F1213 VanDerWaalsContact O-CA 3.3Å; S1136-F1213 WeakPolarHBondContact O-CA 3.45Å; F1137-F1213 HydrophobicContact CB-CD1 4.05Å; F1137-F1213 HydrophobicContact CB-CE1 3.63Å; F1137-F1213 HydrophobicContact CB-CZ 4.29Å; F1137-F1213 HydrophobicContact CD2-CE1 4.26Å; F1137-F1213 HydrophobicContact CD2-CZ 4.17Å; F1137-F1213 HydrophobicContact CG-CE1 4.39Å; L1193-F1213 WeakPolarHBondContact CA-O 3.31Å; F1194-F1213 HydrophobicContact CD1-CB 4.3Å; F1194-F1213 VanDerWaalsContact CD1-O 3.31Å; F1194-F1213 WeakPolarHBondContact CD1-O 3.46Å; F1194-F1213 HydrophobicContact CE1-CB 3.65Å; F1194-F1213 HydrophobicContact CE2-CB 4.22Å; F1194-F1213 HydrophobicContact CZ-CB 3.62Å; F1194-F1213 HydrophobicContact CZ-CG 4.46Å; F1194-F1213 PolarHBondContact N-O 2.86Å; F1194-F1213 PolarHBondContact O-N 2.96Å; C1196-F1213 HydrophobicContact CB-CD2 3.83Å; C1196-F1213 HydrophobicContact CB-CE2 3.9Å; A1211-F1213 HydrophobicContact CB-CD2 4.33Å; A1211-F1213 HydrophobicContact CB-CE2 3.62Å; A1211-F1213 HydrophobicContact CB-CZ 4.26Å; F1213-S1215 PolarHBondContact O-N 3.43Å
1214	A	97.9	Very high	95.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	117.9	176.6	0	0	0	0	0	110.4	I1132 P1133 G1135 S1136 V1138 E1216	I1132-A1214 HydrophobicContact CG2-CB 3.71Å; P1133-A1214 WeakPolarHBondContact O-CB 3.29Å; G1135-A1214 PolarHBondContact N-O 3.23Å; S1136-A1214 PolarHBondContact O-N 2.96Å; V1138-A1214 HydrophobicContact CG2-CB 4.34Å; A1214-E1216 VanDerWaalsContact C-N 3.32Å
1215	S	96	Very high	95.9	Very high	7 Å²	7	35.6 Å²	35.6	5%	0.049	19%	0.191	C	C	.	.	S	Bend	trans	-73.8	-28.5	-178.9	119.1	0	0	0	0	111.3	R1082 Q1134 P1191 N1192 F1213	R1082-S1215 PolarHBondContact NH1-O 2.89Å; R1082-S1215 VanDerWaalsContact NH1-O 3.08Å; R1082-S1215 PolarHBondContact NH2-O 3.27Å; R1082-S1215 PolarHBondContact NH2-OG 2.73Å; Q1134-S1215 PolarHBondContact NE2-O 3.18Å; P1191-S1215 WeakPolarHBondContact O-CB 3.42Å; P1191-S1215 PolarHBondContact O-OG 3.26Å; N1192-S1215 WeakPolarHBondContact O-CB 3.48Å; N1192-S1215 PolarHBondContact O-N 3.21Å; F1213-S1215 PolarHBondContact O-N 3.43Å
1216	E	95.4	Very high	96.1	Very high	101 Å²	101	31.8 Å²	31.8	47%	0.472	17%	0.171	S	C	.	.	S	Bend	trans	-146.8	-173.9	177.3	64	-170.5	156.8	0	0	110.8	Q1134 N1192 A1214 V1218	Q1134-E1216 WeakPolarHBondContact CA-O 3.39Å; N1192-E1216 HydrophobicContact CB-CG 4.29Å; A1214-E1216 VanDerWaalsContact C-N 3.32Å; E1216-V1218 PolarHBondContact O-N 2.64Å
1217	N	96.9	Very high	96.3	Very high	112 Å²	112	32.1 Å²	32.1	60%	0.599	18%	0.177	S	C	*	.			trans	-78.5	100.1	173.3	-68	-37	0	0	0	109.8	I1132 P1133 Q1134	I1132-N1217 WeakPolarHBondContact O-CA 3.49Å; P1133-N1217 WeakPolarHBondContact CA-OD1 3.5Å; Q1134-N1217 PolarHBondContact N-OD1 3.41Å
1218	V	97.7	Very high	96.4	Very high	2 Å²	2	35 Å²	35	1%	0.012	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-85.6	135.8	179.7	-167.4	0	0	0	0	109.9	T1128 D1131 I1132 N1192 E1216 E1222 L1224	T1128-V1218 HydrophobicContact CG2-CG1 3.96Å; D1131-V1218 CarbonylContact C-O 3.53Å; D1131-V1218 WeakPolarHBondContact CA-O 3.21Å; I1132-V1218 HydrophobicContact CB-CB 4.19Å; I1132-V1218 HydrophobicContact CD1-CB 4.47Å; I1132-V1218 PolarHBondContact N-O 3.28Å; I1132-V1218 PolarHBondContact O-N 2.94Å; N1192-V1218 HydrophobicContact CB-CG2 3.88Å; E1216-V1218 PolarHBondContact O-N 2.64Å; V1218-E1222 HydrophobicContact CG1-CB 3.81Å; V1218-L1224 HydrophobicContact CG1-CD2 3.91Å; V1218-L1224 HydrophobicContact CG2-CD2 4.39Å
1219	K	97.1	Very high	96.1	Very high	122 Å²	122	36 Å²	36	53%	0.53	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-95	154.4	-177.9	-49.7	-174	-153.4	79.3	0	112.7	T1128 D1131 G1221 E1222	T1128-K1219 WeakPolarHBondContact CG2-O 3.49Å; D1131-K1219 VanDerWaalsContact OD1-CA 3.31Å; D1131-K1219 WeakPolarHBondContact OD1-CA 3.33Å; K1219-G1221 PolarHBondContact O-N 2.84Å; K1219-E1222 HydrophobicContact CB-CG 4.19Å; K1219-E1222 WeakPolarHBondContact CG-OE1 3.26Å; K1219-E1222 PolarHBondContact N-OE2 2.87Å; K1219-E1222 IonicContact NZ-OE1 3.53Å; K1219-E1222 PolarHBondContact NZ-OE1 3.24Å; K1219-E1222 WeakPolarHBondContact O-CB 3.41Å; K1219-E1222 PolarHBondContact O-N 3.35Å
1220	A	95.9	Very high	95.8	Very high	57 Å²	57	38.6 Å²	38.6	47%	0.471	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51	124.7	171.4	0	0	0	0	0	111.7	D1131	D1131-A1220 PolarHBondContact OD1-N 3.42Å
1221	G	92.6	Very high	95.3	Very high	47 Å²	47	44.7 Å²	44.7	49%	0.485	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.5	-15.1	-177.3	0	0	0	0	0	115.5	T1128 K1219	T1128-G1221 WeakPolarHBondContact O-CA 3.23Å; T1128-G1221 PolarHBondContact O-N 2.89Å; K1219-G1221 PolarHBondContact O-N 2.84Å
1222	E	96.4	Very high	94.9	Very high	65 Å²	65	46.4 Å²	46.4	30%	0.304	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-72.1	138.5	178.4	-67.4	173.6	175.1	0	0	111.3	R1127 T1128 V1218 K1219	R1127-E1222 VanDerWaalsContact CA-O 3.31Å; R1127-E1222 WeakPolarHBondContact CA-O 3.42Å; R1127-E1222 VanDerWaalsContact CB-O 3.31Å; R1127-E1222 WeakPolarHBondContact CB-O 3.26Å; T1128-E1222 PolarHBondContact N-O 2.92Å; T1128-E1222 VanDerWaalsContact N-O 3.11Å; V1218-E1222 HydrophobicContact CG1-CB 3.81Å; K1219-E1222 HydrophobicContact CB-CG 4.19Å; K1219-E1222 WeakPolarHBondContact CG-OE1 3.26Å; K1219-E1222 PolarHBondContact N-OE2 2.87Å; K1219-E1222 IonicContact NZ-OE1 3.53Å; K1219-E1222 PolarHBondContact NZ-OE1 3.24Å; K1219-E1222 WeakPolarHBondContact O-CB 3.41Å; K1219-E1222 PolarHBondContact O-N 3.35Å
1223	E	97.3	Very high	94.6	Very high	39 Å²	39	47 Å²	47	18%	0.182	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	145.1	174.1	-173.5	-179.4	173.6	0	0	110.2	F1117 K1122 V1126 N1186 M1188 N1192	F1117-E1223 HydrophobicContact CE1-CB 4.28Å; F1117-E1223 HydrophobicContact CE1-CG 3.95Å; F1117-E1223 HydrophobicContact CZ-CB 4.1Å; F1117-E1223 HydrophobicContact CZ-CG 3.98Å; K1122-E1223 IonicContact NZ-OE1 3.43Å; K1122-E1223 PolarHBondContact NZ-OE1 3.45Å; K1122-E1223 IonicContact NZ-OE2 3.48Å; K1122-E1223 PolarHBondContact NZ-OE2 3.02Å; V1126-E1223 CarbonylContact O-C 3.49Å; V1126-E1223 WeakPolarHBondContact O-CA 3.46Å; V1126-E1223 WeakPolarHBondContact O-CG 3.41Å; N1186-E1223 WeakPolarHBondContact CB-OE1 3.13Å; N1186-E1223 PolarHBondContact ND2-OE1 3.45Å; M1188-E1223 HydrophobicContact CE-CB 3.8Å; M1188-E1223 HydrophobicContact CE-CG 3.62Å; N1192-E1223 PolarHBondContact ND2-O 3.24Å
1224	L	98.3	Very high	94.1	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	135.3	177	-65.7	178.8	0	0	0	111	L1114 V1126 I1132 V1138 L1185 N1192 L1193 V1218	L1114-L1224 HydrophobicContact CD1-CD1 4.28Å; L1114-L1224 HydrophobicContact CD2-CD1 3.48Å; L1114-L1224 VanDerWaalsContact CD2-CD1 3.48Å; V1126-L1224 HydrophobicContact CG1-CD1 4.22Å; V1126-L1224 PolarHBondContact O-N 3.13Å; I1132-L1224 HydrophobicContact CD1-CD1 4.39Å; I1132-L1224 HydrophobicContact CD1-CD2 4.15Å; V1138-L1224 HydrophobicContact CG1-CD1 3.9Å; L1185-L1224 HydrophobicContact CD2-CB 3.55Å; N1192-L1224 WeakPolarHBondContact OD1-CA 3.47Å; L1193-L1224 HydrophobicContact CD1-CB 4.02Å; L1193-L1224 HydrophobicContact CD2-CD2 4.28Å; L1193-L1224 HydrophobicContact CG-CB 4.45Å; L1193-L1224 HydrophobicContact CG-CD2 4.38Å; V1218-L1224 HydrophobicContact CG1-CD2 3.91Å; V1218-L1224 HydrophobicContact CG2-CD2 4.39Å
1225	G	97.1	Very high	93.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	157	179.4	0	0	0	0	0	114.5	N1186 P1191 N1192 L1193	N1186-G1225 WeakPolarHBondContact O-CA 3.49Å; P1191-G1225 WeakPolarHBondContact CB-O 3.28Å; N1192-G1225 PolarHBondContact N-O 2.79Å; N1192-G1225 PolarHBondContact OD1-N 3.18Å; N1192-G1225 PolarHBondContact OD1-O 3.05Å; L1193-G1225 PolarHBondContact N-O 3.31Å; L1193-G1225 VanDerWaalsContact N-O 3.07Å
1226	F	96.4	Very high	93.3	Very high	15 Å²	15	56.1 Å²	56.1	7%	0.066	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	165.7	-177	70.4	-76.9	0	0	0	111.3	Y1141 F1161 L1185 N1186 H1187 M1188 L1193 F1212 Y1228	Y1141-F1226 HydrophobicContact CE2-CZ 4.32Å; F1161-F1226 HydrophobicContact CD2-CE2 4.09Å; F1161-F1226 HydrophobicContact CD2-CZ 4.38Å; F1161-F1226 HydrophobicContact CE2-CD2 4.41Å; F1161-F1226 AromaticContact CE2-CE2 3.79Å; F1161-F1226 HydrophobicContact CE2-CE2 3.79Å; F1161-F1226 HydrophobicContact CE2-CZ 4.44Å; L1185-F1226 HydrophobicContact CB-CD1 3.92Å; L1185-F1226 HydrophobicContact CB-CE1 3.89Å; L1185-F1226 HydrophobicContact CD1-CD1 4.48Å; N1186-F1226 PolarHBondContact O-N 2.95Å; H1187-F1226 WeakPolarHBondContact CA-O 3.26Å; H1187-F1226 PolarHBondContact ND1-O 2.89Å; H1187-F1226 VanDerWaalsContact ND1-O 3.16Å; M1188-F1226 PolarHBondContact N-O 3.38Å; L1193-F1226 HydrophobicContact CB-CB 4.29Å; F1212-F1226 HydrophobicContact CD1-CB 4.38Å; F1212-F1226 HydrophobicContact CE1-CB 3.82Å; F1212-F1226 AromaticContact CE1-CD1 3.84Å; F1212-F1226 HydrophobicContact CE1-CD1 3.84Å; F1212-F1226 AromaticContact CE1-CD2 3.8Å; F1212-F1226 HydrophobicContact CE1-CD2 3.8Å; F1212-F1226 HydrophobicContact CE1-CE1 4.34Å; F1212-F1226 HydrophobicContact CE1-CE2 4.32Å; F1212-F1226 AromaticContact CE1-CG 3.55Å; F1212-F1226 HydrophobicContact CE1-CG 3.55Å; F1212-F1226 AromaticContact CZ-CD1 3.83Å; F1212-F1226 HydrophobicContact CZ-CD1 3.83Å; F1212-F1226 HydrophobicContact CZ-CD2 4.11Å; F1212-F1226 AromaticContact CZ-CE1 3.89Å; F1212-F1226 HydrophobicContact CZ-CE1 3.89Å; F1212-F1226 HydrophobicContact CZ-CE2 4.18Å; F1212-F1226 AromaticContact CZ-CG 3.96Å; F1212-F1226 HydrophobicContact CZ-CG 3.96Å; F1212-F1226 HydrophobicContact CZ-CZ 4.08Å; F1226-Y1228 HydrophobicContact CD1-CD1 4.23Å; F1226-Y1228 HydrophobicContact CD1-CE1 4.02Å; F1226-Y1228 HydrophobicContact CD2-CD1 4.08Å; F1226-Y1228 AromaticContact CE1-CD1 3.83Å; F1226-Y1228 HydrophobicContact CE1-CD1 3.83Å; F1226-Y1228 AromaticContact CE1-CE1 3.47Å; F1226-Y1228 HydrophobicContact CE1-CE1 3.47Å; F1226-Y1228 VanDerWaalsContact CE1-CE1 3.47Å; F1226-Y1228 AromaticContact CE2-CD1 3.66Å; F1226-Y1228 HydrophobicContact CE2-CD1 3.66Å; F1226-Y1228 HydrophobicContact CE2-CE1 4.17Å; F1226-Y1228 HydrophobicContact CG-CD1 4.33Å; F1226-Y1228 AromaticContact CZ-CD1 3.52Å; F1226-Y1228 HydrophobicContact CZ-CD1 3.52Å; F1226-Y1228 AromaticContact CZ-CE1 3.55Å; F1226-Y1228 HydrophobicContact CZ-CE1 3.55Å; F1226-Y1228 PolarHBondContact O-N 3.42Å
1227	N	94	Very high	92.9	Very high	68 Å²	68	53.1 Å²	53.1	36%	0.364	29%	0.29	S	S	.	.			trans	-77.2	122.3	169.3	-174.8	12.7	0	0	0	109.2	H1187 P1191 G1229	H1187-N1227 PolarHBondContact CE1-OD1 2.8Å; P1191-N1227 HydrophobicContact CG-CB 4.31Å; N1227-G1229 PolarHBondContact O-N 2.95Å; N1227-G1229 PolarHBondContact OD1-N 3.4Å; N1227-G1229 VanDerWaalsContact OD1-N 3.09Å
1228	Y	93.9	Very high	92.5	Very high	65 Å²	65	56.1 Å²	56.1	26%	0.255	30%	0.298	S	S	.	.			trans	-75.6	-7.3	178	-74	14.2	0	0	0	112.6	L1185 N1186 H1187 F1226 F1232	L1185-Y1228 WeakPolarHBondContact O-CE1 3.49Å; L1185-Y1228 PolarHBondContact O-OH 3.11Å; N1186-Y1228 WeakPolarHBondContact CA-OH 3.39Å; H1187-Y1228 VanDerWaalsContact CA-CE1 3.5Å; H1187-Y1228 HydrophobicContact CB-CD1 3.73Å; H1187-Y1228 HydrophobicContact CB-CD2 3.95Å; H1187-Y1228 HydrophobicContact CB-CE1 3.76Å; H1187-Y1228 HydrophobicContact CB-CE2 4Å; H1187-Y1228 HydrophobicContact CB-CG 3.82Å; H1187-Y1228 PolarHBondContact N-OH 2.76Å; H1187-Y1228 PolarHBondContact ND1-N 3.03Å; F1226-Y1228 HydrophobicContact CD1-CD1 4.23Å; F1226-Y1228 HydrophobicContact CD1-CE1 4.02Å; F1226-Y1228 HydrophobicContact CD2-CD1 4.08Å; F1226-Y1228 AromaticContact CE1-CD1 3.83Å; F1226-Y1228 HydrophobicContact CE1-CD1 3.83Å; F1226-Y1228 AromaticContact CE1-CE1 3.47Å; F1226-Y1228 HydrophobicContact CE1-CE1 3.47Å; F1226-Y1228 VanDerWaalsContact CE1-CE1 3.47Å; F1226-Y1228 AromaticContact CE2-CD1 3.66Å; F1226-Y1228 HydrophobicContact CE2-CD1 3.66Å; F1226-Y1228 HydrophobicContact CE2-CE1 4.17Å; F1226-Y1228 HydrophobicContact CG-CD1 4.33Å; F1226-Y1228 AromaticContact CZ-CD1 3.52Å; F1226-Y1228 HydrophobicContact CZ-CD1 3.52Å; F1226-Y1228 AromaticContact CZ-CE1 3.55Å; F1226-Y1228 HydrophobicContact CZ-CE1 3.55Å; F1226-Y1228 PolarHBondContact O-N 3.42Å; Y1228-F1232 AromaticContact CD2-CD1 3.67Å; Y1228-F1232 HydrophobicContact CD2-CD1 3.67Å; Y1228-F1232 AromaticContact CD2-CD2 3.71Å; Y1228-F1232 HydrophobicContact CD2-CD2 3.71Å; Y1228-F1232 AromaticContact CD2-CE1 3.58Å; Y1228-F1232 HydrophobicContact CD2-CE1 3.58Å; Y1228-F1232 AromaticContact CD2-CE2 3.6Å; Y1228-F1232 HydrophobicContact CD2-CE2 3.6Å; Y1228-F1232 AromaticContact CD2-CG 3.75Å; Y1228-F1232 HydrophobicContact CD2-CG 3.75Å; Y1228-F1232 AromaticContact CD2-CZ 3.52Å; Y1228-F1232 HydrophobicContact CD2-CZ 3.52Å; Y1228-F1232 HydrophobicContact CE2-CD2 4.41Å; Y1228-F1232 HydrophobicContact CE2-CE1 4.06Å; Y1228-F1232 AromaticContact CE2-CE2 3.86Å; Y1228-F1232 HydrophobicContact CE2-CE2 3.86Å; Y1228-F1232 AromaticContact CE2-CZ 3.66Å; Y1228-F1232 HydrophobicContact CE2-CZ 3.66Å; Y1228-F1232 HydrophobicContact CG-CD1 4.46Å; Y1228-F1232 HydrophobicContact CG-CG 4.42Å
1229	G	89.5	Confident	92	Very high	25 Å²	25	62.2 Å²	62.2	26%	0.258	33%	0.33	S	S	.	.			trans	84.9	160.8	-175.9	0	0	0	0	0	112.8	N1227 H1231	N1227-G1229 PolarHBondContact O-N 2.95Å; N1227-G1229 PolarHBondContact OD1-N 3.4Å; N1227-G1229 VanDerWaalsContact OD1-N 3.09Å; G1229-H1231 PolarHBondContact O-N 3.08Å
1230	D	88.2	Confident	91.7	Very high	82 Å²	82	61.2 Å²	61.2	44%	0.439	33%	0.326	S	S	.	.	H	α-helix	trans	-67.7	-35	-176.1	-66.2	-71.3	0	0	0	112.2	F1232 W1233 E1234 Y1251	D1230-F1232 PolarHBondContact O-N 3.47Å; D1230-W1233 CarbonylContact O-C 3.54Å; D1230-W1233 WeakPolarHBondContact O-CA 3.41Å; D1230-W1233 PolarHBondContact O-N 2.64Å; D1230-E1234 WeakPolarHBondContact O-CG 3.26Å; D1230-E1234 PolarHBondContact O-N 3.14Å; D1230-Y1251 VanDerWaalsContact OD1-CE1 3.31Å; D1230-Y1251 WeakPolarHBondContact OD1-CE1 3.22Å; D1230-Y1251 PolarHBondContact OD1-OH 3.19Å
1231	H	86.2	Confident	91.5	Very high	132 Å²	132	60 Å²	60	61%	0.611	31%	0.314	S	S	*	.	H	α-helix	trans	-56.4	-43.3	179.2	-177.5	63.6	0	0	0	113.6	G1229 W1233 E1234 V1235	G1229-H1231 PolarHBondContact O-N 3.08Å; H1231-W1233 VanDerWaalsContact C-N 3.28Å; H1231-W1233 PolarHBondContact O-N 2.96Å; H1231-E1234 IonicContact ND1-OE2 2.7Å; H1231-E1234 PolarHBondContact O-N 3.37Å; H1231-V1235 PolarHBondContact O-N 3.21Å
1232	F	89.9	Confident	91.5	Very high	35 Å²	35	58.2 Å²	58.2	15%	0.154	29%	0.294	C	S	.	.	H	α-helix	trans	-57.5	-44	173.4	177	-84	0	0	0	111	Y1228 D1230 V1235 K1236 F1240	Y1228-F1232 AromaticContact CD2-CD1 3.67Å; Y1228-F1232 HydrophobicContact CD2-CD1 3.67Å; Y1228-F1232 AromaticContact CD2-CD2 3.71Å; Y1228-F1232 HydrophobicContact CD2-CD2 3.71Å; Y1228-F1232 AromaticContact CD2-CE1 3.58Å; Y1228-F1232 HydrophobicContact CD2-CE1 3.58Å; Y1228-F1232 AromaticContact CD2-CE2 3.6Å; Y1228-F1232 HydrophobicContact CD2-CE2 3.6Å; Y1228-F1232 AromaticContact CD2-CG 3.75Å; Y1228-F1232 HydrophobicContact CD2-CG 3.75Å; Y1228-F1232 AromaticContact CD2-CZ 3.52Å; Y1228-F1232 HydrophobicContact CD2-CZ 3.52Å; Y1228-F1232 HydrophobicContact CE2-CD2 4.41Å; Y1228-F1232 HydrophobicContact CE2-CE1 4.06Å; Y1228-F1232 AromaticContact CE2-CE2 3.86Å; Y1228-F1232 HydrophobicContact CE2-CE2 3.86Å; Y1228-F1232 AromaticContact CE2-CZ 3.66Å; Y1228-F1232 HydrophobicContact CE2-CZ 3.66Å; Y1228-F1232 HydrophobicContact CG-CD1 4.46Å; Y1228-F1232 HydrophobicContact CG-CG 4.42Å; D1230-F1232 PolarHBondContact O-N 3.47Å; F1232-V1235 PolarHBondContact O-N 2.93Å; F1232-K1236 HydrophobicContact CD1-CB 4.11Å; F1232-K1236 HydrophobicContact CD1-CG 3.94Å; F1232-K1236 HydrophobicContact CD2-CG 4.19Å; F1232-K1236 HydrophobicContact CE1-CB 3.8Å; F1232-K1236 HydrophobicContact CE1-CG 3.61Å; F1232-K1236 HydrophobicContact CE2-CG 3.9Å; F1232-K1236 HydrophobicContact CG-CG 4.22Å; F1232-K1236 HydrophobicContact CZ-CB 4.26Å; F1232-K1236 HydrophobicContact CZ-CG 3.6Å; F1232-K1236 VanDerWaalsContact O-CB 3.27Å; F1232-K1236 WeakPolarHBondContact O-CB 3.47Å; F1232-K1236 VanDerWaalsContact O-CG 3.3Å; F1232-K1236 WeakPolarHBondContact O-CG 3.41Å; F1232-K1236 PolarHBondContact O-N 3.12Å; F1232-F1240 HydrophobicContact CE1-CE2 4.41Å; F1232-F1240 HydrophobicContact CE1-CZ 4.22Å; F1232-F1240 HydrophobicContact CZ-CZ 4.12Å
1233	W	91.8	Very high	91.3	Very high	12 Å²	12	60 Å²	60	5%	0.045	30%	0.302	C	S	.	.	H	α-helix	trans	-75.3	-31.2	-178.6	-72.9	107.9	0	0	0	113.3	H1187 D1230 H1231 V1235 K1236 A1237 F1240 C1242 Y1251	H1187-W1233 HydrophobicContact CB-CZ2 4.07Å; H1187-W1233 AromaticContact CD2-CE2 3.56Å; H1187-W1233 AromaticContact CD2-CZ2 3.34Å; H1187-W1233 WeakPolarHBondContact CD2-CZ2 3.42Å; H1187-W1233 AromaticContact CD2-NE1 3.31Å; H1187-W1233 PolarHBondContact CD2-NE1 2.97Å; H1187-W1233 VanDerWaalsContact CD2-NE1 3.31Å; H1187-W1233 AromaticContact CE1-NE1 3.71Å; H1187-W1233 AromaticContact CG-CZ2 3.8Å; H1187-W1233 AromaticContact CG-NE1 3.6Å; H1187-W1233 AromaticContact ND1-NE1 3.86Å; H1187-W1233 AromaticContact NE2-NE1 3.39Å; H1187-W1233 PolarHBondContact NE2-NE1 2.85Å; D1230-W1233 CarbonylContact O-C 3.54Å; D1230-W1233 WeakPolarHBondContact O-CA 3.41Å; D1230-W1233 PolarHBondContact O-N 2.64Å; H1231-W1233 VanDerWaalsContact C-N 3.28Å; H1231-W1233 PolarHBondContact O-N 2.96Å; W1233-V1235 PolarHBondContact O-N 3.45Å; W1233-K1236 PolarHBondContact O-N 3.46Å; W1233-A1237 HydrophobicContact CE3-CB 4.5Å; W1233-A1237 WeakPolarHBondContact O-CB 3.37Å; W1233-A1237 PolarHBondContact O-N 3.26Å; W1233-F1240 HydrophobicContact CH2-CD2 4.05Å; W1233-F1240 AromaticContact CH2-CE2 3.66Å; W1233-F1240 HydrophobicContact CH2-CE2 3.66Å; W1233-F1240 AromaticContact CZ3-CD2 3.95Å; W1233-F1240 HydrophobicContact CZ3-CD2 3.95Å; W1233-F1240 AromaticContact CZ3-CE2 3.78Å; W1233-F1240 HydrophobicContact CZ3-CE2 3.78Å; W1233-C1242 HydrophobicContact CH2-CB 3.6Å; W1233-C1242 HydrophobicContact CZ2-CB 3.76Å; W1233-C1242 HydrophobicContact CZ3-CB 4.07Å; W1233-Y1251 HydrophobicContact CB-CD1 3.59Å; W1233-Y1251 HydrophobicContact CB-CD2 4.5Å; W1233-Y1251 HydrophobicContact CB-CE1 3.86Å; W1233-Y1251 HydrophobicContact CB-CG 3.94Å; W1233-Y1251 AromaticContact CD1-CD2 3.43Å; W1233-Y1251 VanDerWaalsContact CD1-CD2 3.43Å; W1233-Y1251 AromaticContact CD1-CE2 3.46Å; W1233-Y1251 VanDerWaalsContact CD1-CE2 3.46Å; W1233-Y1251 AromaticContact CD1-CG 3.75Å; W1233-Y1251 AromaticContact CD1-CZ 3.78Å; W1233-Y1251 HydrophobicContact CD2-CD1 4.35Å; W1233-Y1251 AromaticContact CD2-CD2 3.95Å; W1233-Y1251 HydrophobicContact CD2-CD2 3.95Å; W1233-Y1251 AromaticContact CD2-CG 3.76Å; W1233-Y1251 HydrophobicContact CD2-CG 3.76Å; W1233-Y1251 AromaticContact CE2-CD2 3.91Å; W1233-Y1251 HydrophobicContact CE3-CG 4.37Å; W1233-Y1251 AromaticContact CG-CD1 3.69Å; W1233-Y1251 HydrophobicContact CG-CD1 3.69Å; W1233-Y1251 AromaticContact CG-CD2 3.71Å; W1233-Y1251 HydrophobicContact CG-CD2 3.71Å; W1233-Y1251 HydrophobicContact CG-CE1 4.04Å; W1233-Y1251 HydrophobicContact CG-CE2 4.07Å; W1233-Y1251 AromaticContact CG-CG 3.51Å; W1233-Y1251 HydrophobicContact CG-CG 3.51Å; W1233-Y1251 AromaticContact NE1-CD2 3.52Å; W1233-Y1251 AromaticContact NE1-CE2 3.77Å
1234	E	88	Confident	91	Very high	127 Å²	127	59.4 Å²	59.4	59%	0.593	30%	0.302	S	S	*	.	H	α-helix	trans	-57.4	-38.4	170.2	-72	176.7	165.2	0	0	111.8	D1230 H1231 K1238	D1230-E1234 WeakPolarHBondContact O-CG 3.26Å; D1230-E1234 PolarHBondContact O-N 3.14Å; H1231-E1234 IonicContact ND1-OE2 2.7Å; H1231-E1234 PolarHBondContact O-N 3.37Å; E1234-K1238 PolarHBondContact O-NZ 3.13Å
1235	V	86.3	Confident	90.3	Very high	57 Å²	57	63 Å²	63	35%	0.345	34%	0.339	S	S	.	.	H	α-helix	trans	-78.7	-50.5	174.6	-177.4	0	0	0	0	111.2	H1231 F1232 W1233	H1231-V1235 PolarHBondContact O-N 3.21Å; F1232-V1235 PolarHBondContact O-N 2.93Å; W1233-V1235 PolarHBondContact O-N 3.45Å
1236	K	89.9	Confident	89.9	Confident	16 Å²	16	64.2 Å²	64.2	7%	0.07	35%	0.348	C	S	.	.	H	α-helix	trans	-86.1	-23	-167.7	-62.7	-47.4	-173.8	-156.4	0	116.5	D1157 F1232 W1233 K1238 L1239 F1240	D1157-K1236 IonicContact OD1-NZ 3.88Å; D1157-K1236 PolarHBondContact OD1-NZ 3.2Å; D1157-K1236 VanDerWaalsContact OD2-CE 3.31Å; D1157-K1236 WeakPolarHBondContact OD2-CE 3.36Å; D1157-K1236 IonicContact OD2-NZ 2.7Å; D1157-K1236 PolarHBondContact OD2-NZ 2.82Å; F1232-K1236 HydrophobicContact CD1-CB 4.11Å; F1232-K1236 HydrophobicContact CD1-CG 3.94Å; F1232-K1236 HydrophobicContact CD2-CG 4.19Å; F1232-K1236 HydrophobicContact CE1-CB 3.8Å; F1232-K1236 HydrophobicContact CE1-CG 3.61Å; F1232-K1236 HydrophobicContact CE2-CG 3.9Å; F1232-K1236 HydrophobicContact CG-CG 4.22Å; F1232-K1236 HydrophobicContact CZ-CB 4.26Å; F1232-K1236 HydrophobicContact CZ-CG 3.6Å; F1232-K1236 VanDerWaalsContact O-CB 3.27Å; F1232-K1236 WeakPolarHBondContact O-CB 3.47Å; F1232-K1236 VanDerWaalsContact O-CG 3.3Å; F1232-K1236 WeakPolarHBondContact O-CG 3.41Å; F1232-K1236 PolarHBondContact O-N 3.12Å; W1233-K1236 PolarHBondContact O-N 3.46Å; K1236-K1238 PolarHBondContact O-N 2.93Å; K1236-L1239 HydrophobicContact CD-CD1 4.06Å; K1236-L1239 WeakPolarHBondContact O-CA 3.46Å; K1236-L1239 WeakPolarHBondContact O-CB 3.27Å; K1236-L1239 PolarHBondContact O-N 3.04Å; K1236-F1240 HydrophobicContact CB-CE1 4.06Å; K1236-F1240 HydrophobicContact CB-CE2 4.37Å; K1236-F1240 HydrophobicContact CB-CZ 3.83Å; K1236-F1240 HydrophobicContact CD-CE1 4.28Å; K1236-F1240 HydrophobicContact CG-CE1 4.31Å; K1236-F1240 HydrophobicContact CG-CZ 4.08Å; K1236-F1240 PolarHBondContact O-N 2.93Å
1237	A	87.9	Confident	89.5	Confident	38 Å²	38	69.3 Å²	69.3	31%	0.314	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-19.6	178.1	0	0	0	0	0	113.3	W1233 L1239 F1240 M1256	W1233-A1237 HydrophobicContact CE3-CB 4.5Å; W1233-A1237 WeakPolarHBondContact O-CB 3.37Å; W1233-A1237 PolarHBondContact O-N 3.26Å; A1237-L1239 VanDerWaalsContact C-N 3.29Å; A1237-F1240 WeakPolarHBondContact CA-O 3.23Å; A1237-M1256 HydrophobicContact CB-SD 4.21Å
1238	K	87.6	Confident	89.3	Confident	175 Å²	175	72.9 Å²	72.9	76%	0.761	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-13.9	173.2	-55.1	-176.5	-177.4	88.2	0	113.7	E1234 K1236	E1234-K1238 PolarHBondContact O-NZ 3.13Å; K1236-K1238 PolarHBondContact O-N 2.93Å
1239	L	87.2	Confident	89.2	Confident	129 Å²	129	70.4 Å²	70.4	68%	0.675	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	-41.2	-176.5	-58.4	178.3	0	0	0	111.9	K1236 A1237	K1236-L1239 HydrophobicContact CD-CD1 4.06Å; K1236-L1239 WeakPolarHBondContact O-CA 3.46Å; K1236-L1239 WeakPolarHBondContact O-CB 3.27Å; K1236-L1239 PolarHBondContact O-N 3.04Å; A1237-L1239 VanDerWaalsContact C-N 3.29Å
1240	F	90.6	Very high	89.2	Confident	102 Å²	102	75 Å²	75	45%	0.447	40%	0.402	S	S	.	.			trans	-155.5	154	176.6	56.9	-91.2	0	0	0	111.1	F1232 W1233 K1236 A1237	F1232-F1240 HydrophobicContact CE1-CE2 4.41Å; F1232-F1240 HydrophobicContact CE1-CZ 4.22Å; F1232-F1240 HydrophobicContact CZ-CZ 4.12Å; W1233-F1240 HydrophobicContact CH2-CD2 4.05Å; W1233-F1240 AromaticContact CH2-CE2 3.66Å; W1233-F1240 HydrophobicContact CH2-CE2 3.66Å; W1233-F1240 AromaticContact CZ3-CD2 3.95Å; W1233-F1240 HydrophobicContact CZ3-CD2 3.95Å; W1233-F1240 AromaticContact CZ3-CE2 3.78Å; W1233-F1240 HydrophobicContact CZ3-CE2 3.78Å; K1236-F1240 HydrophobicContact CB-CE1 4.06Å; K1236-F1240 HydrophobicContact CB-CE2 4.37Å; K1236-F1240 HydrophobicContact CB-CZ 3.83Å; K1236-F1240 HydrophobicContact CD-CE1 4.28Å; K1236-F1240 HydrophobicContact CG-CE1 4.31Å; K1236-F1240 HydrophobicContact CG-CZ 4.08Å; K1236-F1240 PolarHBondContact O-N 2.93Å; A1237-F1240 WeakPolarHBondContact CA-O 3.23Å
1241	S	91.9	Very high	89.3	Confident	32 Å²	32	71.8 Å²	71.8	22%	0.224	38%	0.384	C	S	.	.			trans	-90.4	159.7	173.1	54.7	0	0	0	0	112.3	E1243	S1241-E1243 PolarHBondContact O-N 3.08Å
1242	C	93.3	Very high	89.2	Confident	9 Å²	9	66.7 Å²	66.7	6%	0.061	36%	0.363	C	S	.	.			trans	-67.9	129.5	173.2	175.9	0	0	0	0	112	H1187 W1233 C1244 C1249 Y1251	H1187-C1242 VanDerWaalsContact CD2-SG 3.51Å; W1233-C1242 HydrophobicContact CH2-CB 3.6Å; W1233-C1242 HydrophobicContact CZ2-CB 3.76Å; W1233-C1242 HydrophobicContact CZ3-CB 4.07Å; C1242-C1244 PolarHBondContact SG-N 3.34Å; C1242-C1244 PolarHBondContact SG-SG 3.43Å; C1242-C1249 PolarHBondContact SG-SG 2.97Å; C1242-Y1251 PolarHBondContact N-O 2.89Å
1243	E	92.4	Very high	88.5	Confident	101 Å²	101	68.8 Å²	68.8	47%	0.472	38%	0.382	S	S	.	.			trans	-115.7	32.8	179.7	-48.2	-163.6	162	0	0	112.8	N1121 K1122 S1241 G1245	N1121-E1243 WeakPolarHBondContact CB-OE2 3.39Å; N1121-E1243 WeakPolarHBondContact ND2-CB 3.43Å; N1121-E1243 PolarHBondContact ND2-O 3.24Å; N1121-E1243 PolarHBondContact ND2-OE2 3.38Å; K1122-E1243 HydrophobicContact CG-CB 4.45Å; S1241-E1243 PolarHBondContact O-N 3.08Å; E1243-G1245 PolarHBondContact O-N 3.18Å
1244	C	89.7	Confident	87.4	Confident	28 Å²	28	73.3 Å²	73.3	19%	0.189	41%	0.411	C	S	.	.			trans	-70.4	-8.8	-178.7	72.5	0	0	0	0	114.9	C1242 S1246 C1249	C1242-C1244 PolarHBondContact SG-N 3.34Å; C1242-C1244 PolarHBondContact SG-SG 3.43Å; C1244-S1246 PolarHBondContact O-N 3.13Å; C1244-C1249 VanDerWaalsContact SG-SG 3.7Å
1245	G	85	Confident	86.6	Confident	75 Å²	75	68.5 Å²	68.5	77%	0.773	39%	0.393	S	S	*	.			trans	76	-6.8	176.9	0	0	0	0	0	116.3	E1243	E1243-G1245 PolarHBondContact O-N 3.18Å
1246	S	89.2	Confident	85.6	Confident	26 Å²	26	69.7 Å²	69.7	18%	0.182	40%	0.395	C	S	.	.			trans	-62.2	139.4	175.8	162.6	0	0	0	0	112.1	E1190 C1244 K1248 C1249	E1190-S1246 WeakPolarHBondContact OE2-CB 3.48Å; E1190-S1246 PolarHBondContact OE2-OG 3.46Å; C1244-S1246 PolarHBondContact O-N 3.13Å; S1246-K1248 PolarHBondContact O-N 3.4Å; S1246-K1248 PolarHBondContact OG-N 3.18Å; S1246-C1249 WeakPolarHBondContact O-CB 3.47Å; S1246-C1249 PolarHBondContact O-N 3.03Å
1247	S	87.3	Confident	84.1	Confident	122 Å²	122	72.9 Å²	72.9	85%	0.853	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-11.4	171.5	56.4	0	0	0	0	113.7
1248	K	90.1	Very high	82.7	Confident	143 Å²	143	76.1 Å²	76.1	62%	0.622	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	19.6	174.2	-51.9	-177.9	-160.6	145.8	0	112.3	E1190 S1246 K1250	E1190-K1248 HydrophobicContact CG-CB 4.46Å; E1190-K1248 HydrophobicContact CG-CD 4.49Å; E1190-K1248 VanDerWaalsContact OE1-CD 3.3Å; E1190-K1248 WeakPolarHBondContact OE1-CD 3.47Å; E1190-K1248 VanDerWaalsContact OE1-CE 3.25Å; E1190-K1248 WeakPolarHBondContact OE1-CE 3.23Å; E1190-K1248 IonicContact OE1-NZ 2.77Å; E1190-K1248 PolarHBondContact OE1-NZ 3.45Å; S1246-K1248 PolarHBondContact O-N 3.4Å; S1246-K1248 PolarHBondContact OG-N 3.18Å; K1248-K1250 PolarHBondContact O-N 3.02Å
1249	C	90.9	Very high	80.6	Confident	13 Å²	13	72 Å²	72	9%	0.088	43%	0.43	C	S	.	.			trans	-64.6	101.5	-175.2	-179.7	0	0	0	0	113.3	C1189 C1242 C1244 S1246 Y1251 S1252	C1189-C1249 VanDerWaalsContact SG-SG 3.62Å; C1242-C1249 PolarHBondContact SG-SG 2.97Å; C1244-C1249 VanDerWaalsContact SG-SG 3.7Å; S1246-C1249 WeakPolarHBondContact O-CB 3.47Å; S1246-C1249 PolarHBondContact O-N 3.03Å; C1249-Y1251 VanDerWaalsContact C-N 3.34Å; C1249-Y1251 PolarHBondContact O-N 3.28Å; C1249-S1252 PolarHBondContact O-OG 3.35Å
1250	K	89.6	Confident	78.5	Confident	122 Å²	122	71.2 Å²	71.2	53%	0.53	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-38.6	-179.4	-68.5	-175.8	177.5	-176.5	0	114.3	K1248 A1255 M1256	K1248-K1250 PolarHBondContact O-N 3.02Å; K1250-A1255 WeakPolarHBondContact O-CB 3.15Å; K1250-M1256 VanDerWaalsContact O-CE 3.26Å; K1250-M1256 WeakPolarHBondContact O-CE 3.37Å
1251	Y	90.2	Very high	75.9	Confident	13 Å²	13	75.8 Å²	75.8	5%	0.051	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	21.2	-169.4	-36.2	-78.4	0	0	0	113.1	H1187 D1230 W1233 C1242 C1249	H1187-Y1251 AromaticContact NE2-CD2 3.7Å; H1187-Y1251 AromaticContact NE2-CE2 3.77Å; D1230-Y1251 VanDerWaalsContact OD1-CE1 3.31Å; D1230-Y1251 WeakPolarHBondContact OD1-CE1 3.22Å; D1230-Y1251 PolarHBondContact OD1-OH 3.19Å; W1233-Y1251 HydrophobicContact CB-CD1 3.59Å; W1233-Y1251 HydrophobicContact CB-CD2 4.5Å; W1233-Y1251 HydrophobicContact CB-CE1 3.86Å; W1233-Y1251 HydrophobicContact CB-CG 3.94Å; W1233-Y1251 AromaticContact CD1-CD2 3.43Å; W1233-Y1251 VanDerWaalsContact CD1-CD2 3.43Å; W1233-Y1251 AromaticContact CD1-CE2 3.46Å; W1233-Y1251 VanDerWaalsContact CD1-CE2 3.46Å; W1233-Y1251 AromaticContact CD1-CG 3.75Å; W1233-Y1251 AromaticContact CD1-CZ 3.78Å; W1233-Y1251 HydrophobicContact CD2-CD1 4.35Å; W1233-Y1251 AromaticContact CD2-CD2 3.95Å; W1233-Y1251 HydrophobicContact CD2-CD2 3.95Å; W1233-Y1251 AromaticContact CD2-CG 3.76Å; W1233-Y1251 HydrophobicContact CD2-CG 3.76Å; W1233-Y1251 AromaticContact CE2-CD2 3.91Å; W1233-Y1251 HydrophobicContact CE3-CG 4.37Å; W1233-Y1251 AromaticContact CG-CD1 3.69Å; W1233-Y1251 HydrophobicContact CG-CD1 3.69Å; W1233-Y1251 AromaticContact CG-CD2 3.71Å; W1233-Y1251 HydrophobicContact CG-CD2 3.71Å; W1233-Y1251 HydrophobicContact CG-CE1 4.04Å; W1233-Y1251 HydrophobicContact CG-CE2 4.07Å; W1233-Y1251 AromaticContact CG-CG 3.51Å; W1233-Y1251 HydrophobicContact CG-CG 3.51Å; W1233-Y1251 AromaticContact NE1-CD2 3.52Å; W1233-Y1251 AromaticContact NE1-CE2 3.77Å; C1242-Y1251 PolarHBondContact N-O 2.89Å; C1249-Y1251 VanDerWaalsContact C-N 3.34Å; C1249-Y1251 PolarHBondContact O-N 3.28Å
1252	S	84	Confident	73.5	Confident	26 Å²	26	82.3 Å²	82.3	18%	0.182	49%	0.489	C	S	.	.	S	Bend	trans	-70	156.2	175.1	61.1	0	0	0	0	111.1	C1249 V1254 A1255 M1256	C1249-S1252 PolarHBondContact O-OG 3.35Å; S1252-V1254 PolarHBondContact O-N 2.87Å; S1252-V1254 VanDerWaalsContact O-N 3.13Å; S1252-A1255 PolarHBondContact O-N 2.9Å; S1252-A1255 WeakPolarHBondContact OG-CB 3Å; S1252-A1255 PolarHBondContact OG-N 2.96Å; S1252-M1256 VanDerWaalsContact O-CG 3.27Å; S1252-M1256 WeakPolarHBondContact O-CG 3.45Å; S1252-M1256 PolarHBondContact O-N 3.01Å
1253	S	75.6	Confident	71	Confident	79 Å²	79	90.2 Å²	90.2	55%	0.552	53%	0.525	S	S	*	.	H	α-helix	trans	-57.2	-28.3	176.3	52.3	0	0	0	0	113.4	A1257	S1253-A1257 WeakPolarHBondContact O-CB 3.06Å; S1253-A1257 PolarHBondContact O-N 2.77Å
1254	V	68.9	Low	68.2	Low	107 Å²	107	94.1 Å²	94.1	65%	0.648	54%	0.543	S	S	*	.	H	α-helix	trans	-73.2	-47.2	173.7	-178.1	0	0	0	0	111.3	S1252 A1257	S1252-V1254 PolarHBondContact O-N 2.87Å; S1252-V1254 VanDerWaalsContact O-N 3.13Å; V1254-A1257 PolarHBondContact O-N 3.16Å
1255	A	70.9	Confident	65.5	Low	25 Å²	25	101.6 Å²	101.6	21%	0.207	58%	0.575	C	S	.	*	H	α-helix	trans	-67.3	-37.6	179.8	0	0	0	0	0	112.7	K1250 S1252 A1257 T1258	K1250-A1255 WeakPolarHBondContact O-CB 3.15Å; S1252-A1255 PolarHBondContact O-N 2.9Å; S1252-A1255 WeakPolarHBondContact OG-CB 3Å; S1252-A1255 PolarHBondContact OG-N 2.96Å; A1255-A1257 PolarHBondContact O-N 2.84Å; A1255-T1258 PolarHBondContact O-N 2.59Å; A1255-T1258 PolarHBondContact O-OG1 2.78Å
1256	M	64.6	Low	63.8	Low	82 Å²	82	104.1 Å²	104.1	40%	0.404	58%	0.578	S	S	.	*	H	α-helix	trans	-70.1	-19.5	175.6	-59.1	-71.5	78.3	0	0	113.1	A1237 K1250 S1252	A1237-M1256 HydrophobicContact CB-SD 4.21Å; K1250-M1256 VanDerWaalsContact O-CE 3.26Å; K1250-M1256 WeakPolarHBondContact O-CE 3.37Å; S1252-M1256 VanDerWaalsContact O-CG 3.27Å; S1252-M1256 WeakPolarHBondContact O-CG 3.45Å; S1252-M1256 PolarHBondContact O-N 3.01Å
1257	A	60.2	Low	61.1	Low	84 Å²	84	108.8 Å²	108.8	69%	0.694	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-8.9	175.2	0	0	0	0	0	113.8	S1253 V1254 A1255	S1253-A1257 WeakPolarHBondContact O-CB 3.06Å; S1253-A1257 PolarHBondContact O-N 2.77Å; V1254-A1257 PolarHBondContact O-N 3.16Å; A1255-A1257 PolarHBondContact O-N 2.84Å
1258	T	58.2	Low	58.7	Low	106 Å²	106	107.7 Å²	107.7	65%	0.65	61%	0.609	S	S	*	*	S	Bend	trans	-99.7	4.1	-172.9	44.1	0	0	0	0	115.8	A1255	A1255-T1258 PolarHBondContact O-N 2.59Å; A1255-T1258 PolarHBondContact O-OG1 2.78Å
1259	T	42.1	Very low	56.1	Low	87 Å²	87	108.6 Å²	108.6	53%	0.534	62%	0.62	S	S	.	*			trans	-149.6	148.2	175.5	47.2	0	0	0	0	111.6
1260	P	44.9	Very low	53.7	Low	114 Å²	114	113.5 Å²	113.5	74%	0.74	65%	0.651	S	S	*	*	S	Bend	cis	-133	121.6	2.5	34.8	-15	0	0	0	115.2
1261	E	35.1	Very low	50.9	Low	197 Å²	197	114.8 Å²	114.8	92%	0.921	66%	0.664	S	S	*	*	S	Bend	trans	-131.1	-28.9	152.2	-76.6	-163.7	132.1	0	0	112.3	Q1263	E1261-Q1263 VanDerWaalsContact C-N 3.31Å; E1261-Q1263 PolarHBondContact O-N 2.63Å; E1261-Q1263 VanDerWaalsContact O-N 3.12Å
1262	D	41.1	Very low	48.1	Very low	170 Å²	170	120.7 Å²	120.7	91%	0.909	70%	0.702	S	S	*	*	S	Bend	trans	-86.6	25.8	-167.1	-133	3.5	0	0	0	115.6
1263	Q	40.6	Very low	45.7	Very low	175 Å²	175	124.8 Å²	124.8	82%	0.818	73%	0.73	S	S	*	*			trans	-127.3	37.6	-178.4	-69.6	-163.9	-3.8	0	0	114.4	E1261	E1261-Q1263 VanDerWaalsContact C-N 3.31Å; E1261-Q1263 PolarHBondContact O-N 2.63Å; E1261-Q1263 VanDerWaalsContact O-N 3.12Å
1264	Q	34.9	Very low	43.8	Very low	183 Å²	183	126.7 Å²	126.7	86%	0.855	74%	0.744	S	S	*	*			trans	-131.6	78	168.9	-74.4	-166.5	-9.5	0	0	113.7
1265	Q	31.4	Very low	42.2	Very low	185 Å²	185	126.5 Å²	126.5	86%	0.864	75%	0.747	S	S	*	*				-171.8	146.6	124.3	-104.3	178.5	4.4	0	0	112.5
1266	P	50.3	Low	40.7	Very low	128 Å²	128	131 Å²	131	83%	0.831	78%	0.777	S	S	*	*			trans	-83	130.2	177.7	32.8	-32	0	0	0	111.7
1267	S	32.3	Very low	39.2	Very low	124 Å²	124	131 Å²	131	87%	0.867	80%	0.798	S	S	*	*			trans	-104.6	125.5	172	-65.6	0	0	0	0	110.6
1268	A	36.1	Very low	38.3	Very low	99 Å²	99	132 Å²	132	82%	0.818	81%	0.806	S	S	*	*			trans	-74.7	147.6	-179	0	0	0	0	0	112.5
1269	L	36.5	Very low	37.2	Very low	162 Å²	162	136.5 Å²	136.5	85%	0.848	84%	0.842	S	S	*	*			trans	-70.4	139.9	170.3	-68.4	167.1	0	0	0	110.8
1270	P	39.7	Very low	37	Very low	116 Å²	116	139 Å²	139	75%	0.753	86%	0.857	S	S	*	*			trans	-86.6	115.1	161.7	32.4	-28.7	0	0	0	110.3
1271	D	31.3	Very low	36.5	Very low	149 Å²	149	140.3 Å²	140.3	80%	0.797	86%	0.863	S	S	*	*			trans	-69.6	128.6	169.9	-85.3	-45.4	0	0	0	111.5
1272	T	32.5	Very low	36.6	Very low	137 Å²	137	137.1 Å²	137.1	84%	0.84	86%	0.86	S	S	*	*			trans	-138.6	87.5	159.7	59.8	0	0	0	0	111
1273	S	33.6	Very low	36.3	Very low	111 Å²	111	135.2 Å²	135.2	78%	0.776	86%	0.857	S	S	*	*			trans	-135.3	100.4	170.5	64.6	0	0	0	0	112.7
1274	S	35.4	Very low	36.1	Very low	120 Å²	120	132.7 Å²	132.7	84%	0.839	86%	0.86	S	S	*	*			trans	-155.3	135.6	163.7	61.1	0	0	0	0	108
1275	S	34.5	Very low	36.2	Very low	103 Å²	103	129.3 Å²	129.3	72%	0.72	86%	0.86	S	S	*	*			cis	-154.9	146.1	14.4	54.5	0	0	0	0	114.1
1276	S	39.2	Very low	36.5	Very low	119 Å²	119	125.4 Å²	125.4	83%	0.832	86%	0.86	S	S	*	*			trans	54.8	114.9	142.3	64.2	0	0	0	0	121
1277	G	33.1	Very low	35.4	Very low	83 Å²	83	125.2 Å²	125.2	86%	0.856	86%	0.862	S	S	*	*			trans	-161.5	125.4	153	0	0	0	0	0	108
1278	A	41	Very low	35.7	Very low	103 Å²	103	125.3 Å²	125.3	85%	0.851	86%	0.861	S	S	*	*			trans	-106.2	133.1	-161.7	0	0	0	0	0	114.3
1279	S	35.6	Very low	35.7	Very low	201 Å²	201	127.6 Å²	127.6	100%	1.406	87%	0.865	S	S	*	*			trans	-164.7	0	144.1	-74.1	0	0	0	0	108.2

Retrieved 1,279 of 1,279 residues in 286 ms (Link to these results)

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